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 133 GLN : amide:sc= 0.698 K(o=2.6,f=-8.3!) USER MOD Set 1.2: A 135 LYS NZ :NH3+ -142:sc= 1.89 (180deg=0.215) USER MOD Set 2.1: A 66 ASN : amide:sc= 0.982 K(o=1.5,f=-5.3!) USER MOD Set 2.2: A 78 LYS NZ :NH3+ 136:sc= 0.525 (180deg=0) USER MOD Set 3.1: A 53 THR OG1 : rot -61:sc= 0.416 USER MOD Set 3.2: A 107 HIS : no HD1:sc= 0.23 K(o=0.65,f=-0.033) USER MOD Set 4.1: A 51 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 109 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 36 THR OG1 : rot -28:sc= 0.172 USER MOD Set 5.2: A 55 SER OG : 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= -0.839 K(o=-0.84,f=0) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl 175:sc= 0 (180deg=-0.0102) USER MOD Single : A 71 SER OG : rot -103:sc= 0.63 USER MOD Single : A 73 SER OG : rot -43:sc= 0.145 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=-0.42) 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= 0.778 K(o=0.78,f=0) USER MOD Single : A 102 ASN : amide:sc= 0.617 K(o=0.62,f=-0.66) USER MOD Single : A 108 MET CE :methyl 141:sc= -0.424 (180deg=-3.28!) USER MOD Single : A 116 ASN : amide:sc=-0.000498 X(o=-0.0005,f=-0.0005) USER MOD Single : A 118 SER OG : rot 84:sc= 1.19 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot 10:sc= 1.27 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 145 THR OG1 : rot -66:sc= 0.62 USER MOD ----------------------------------------------------------------- ATOM 48 N THR A 36 0.149 -6.215 9.695 1.00 0.00 N ATOM 49 CA THR A 36 -1.255 -6.033 9.288 1.00 0.00 C ATOM 50 C THR A 36 -1.431 -4.759 8.474 1.00 0.00 C ATOM 51 O THR A 36 -0.848 -3.717 8.799 1.00 0.00 O ATOM 52 CB THR A 36 -2.219 -6.035 10.487 1.00 0.00 C ATOM 53 OG1 THR A 36 -1.747 -5.205 11.528 1.00 0.00 O ATOM 54 CG2 THR A 36 -2.412 -7.445 11.053 1.00 0.00 C ATOM 0 HA THR A 36 -1.508 -6.889 8.662 1.00 0.00 H new ATOM 0 HB THR A 36 -3.171 -5.657 10.114 1.00 0.00 H new ATOM 0 HG1 THR A 36 -0.768 -5.167 11.498 1.00 0.00 H new ATOM 0 HG21 THR A 36 -3.099 -7.407 11.898 1.00 0.00 H new ATOM 0 HG22 THR A 36 -2.823 -8.094 10.280 1.00 0.00 H new ATOM 0 HG23 THR A 36 -1.451 -7.839 11.384 1.00 0.00 H new ATOM 62 N PHE A 37 -2.229 -4.868 7.405 1.00 0.00 N ATOM 63 CA PHE A 37 -2.454 -3.811 6.412 1.00 0.00 C ATOM 64 C PHE A 37 -3.938 -3.446 6.344 1.00 0.00 C ATOM 65 O PHE A 37 -4.804 -4.325 6.368 1.00 0.00 O ATOM 66 CB PHE A 37 -1.976 -4.237 5.005 1.00 0.00 C ATOM 67 CG PHE A 37 -0.675 -5.015 4.924 1.00 0.00 C ATOM 68 CD1 PHE A 37 0.361 -4.783 5.846 1.00 0.00 C ATOM 69 CD2 PHE A 37 -0.522 -6.014 3.946 1.00 0.00 C ATOM 70 CE1 PHE A 37 1.490 -5.616 5.873 1.00 0.00 C ATOM 71 CE2 PHE A 37 0.642 -6.801 3.925 1.00 0.00 C ATOM 72 CZ PHE A 37 1.633 -6.623 4.906 1.00 0.00 C ATOM 0 H PHE A 37 -2.752 -5.720 7.201 1.00 0.00 H new ATOM 0 HA PHE A 37 -1.873 -2.945 6.730 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -2.761 -4.841 4.549 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.872 -3.339 4.397 1.00 0.00 H new ATOM 0 HD1 PHE A 37 0.287 -3.958 6.539 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -1.298 -6.176 3.212 1.00 0.00 H new ATOM 0 HE1 PHE A 37 2.245 -5.483 6.634 1.00 0.00 H new ATOM 0 HE2 PHE A 37 0.776 -7.545 3.153 1.00 0.00 H new ATOM 0 HZ PHE A 37 2.504 -7.261 4.916 1.00 0.00 H new ATOM 82 N SER A 38 -4.228 -2.154 6.213 1.00 0.00 N ATOM 83 CA SER A 38 -5.606 -1.640 6.103 1.00 0.00 C ATOM 84 C SER A 38 -5.766 -0.478 5.094 1.00 0.00 C ATOM 85 O SER A 38 -4.799 0.248 4.838 1.00 0.00 O ATOM 86 CB SER A 38 -6.151 -1.196 7.474 1.00 0.00 C ATOM 87 OG SER A 38 -6.031 -2.202 8.474 1.00 0.00 O ATOM 0 H SER A 38 -3.516 -1.424 6.179 1.00 0.00 H new ATOM 0 HA SER A 38 -6.187 -2.481 5.723 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.617 -0.303 7.799 1.00 0.00 H new ATOM 0 HB3 SER A 38 -7.200 -0.919 7.369 1.00 0.00 H new ATOM 0 HG SER A 38 -6.390 -1.865 9.321 1.00 0.00 H new ATOM 93 N PRO A 39 -6.984 -0.248 4.558 1.00 0.00 N ATOM 94 CA PRO A 39 -8.135 -1.146 4.623 1.00 0.00 C ATOM 95 C PRO A 39 -7.906 -2.370 3.735 1.00 0.00 C ATOM 96 O PRO A 39 -7.164 -2.314 2.757 1.00 0.00 O ATOM 97 CB PRO A 39 -9.330 -0.331 4.129 1.00 0.00 C ATOM 98 CG PRO A 39 -8.689 0.635 3.137 1.00 0.00 C ATOM 99 CD PRO A 39 -7.313 0.917 3.743 1.00 0.00 C ATOM 0 HA PRO A 39 -8.301 -1.517 5.635 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.081 -0.961 3.653 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -9.826 0.196 4.944 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -8.606 0.193 2.144 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -9.275 1.548 3.032 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -6.567 1.070 2.963 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -7.332 1.823 4.348 1.00 0.00 H new ATOM 107 N ALA A 40 -8.580 -3.474 4.066 1.00 0.00 N ATOM 108 CA ALA A 40 -8.576 -4.683 3.229 1.00 0.00 C ATOM 109 C ALA A 40 -9.103 -4.425 1.799 1.00 0.00 C ATOM 110 O ALA A 40 -8.637 -5.058 0.851 1.00 0.00 O ATOM 111 CB ALA A 40 -9.391 -5.774 3.934 1.00 0.00 C ATOM 0 H ALA A 40 -9.141 -3.558 4.914 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.544 -5.011 3.107 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.396 -6.677 3.323 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -8.943 -5.994 4.903 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -10.415 -5.428 4.078 1.00 0.00 H new ATOM 117 N LEU A 41 -10.020 -3.460 1.642 1.00 0.00 N ATOM 118 CA LEU A 41 -10.495 -2.935 0.361 1.00 0.00 C ATOM 119 C LEU A 41 -10.625 -1.408 0.461 1.00 0.00 C ATOM 120 O LEU A 41 -11.415 -0.898 1.258 1.00 0.00 O ATOM 121 CB LEU A 41 -11.833 -3.611 -0.010 1.00 0.00 C ATOM 122 CG LEU A 41 -12.556 -3.004 -1.235 1.00 0.00 C ATOM 123 CD1 LEU A 41 -11.728 -3.080 -2.527 1.00 0.00 C ATOM 124 CD2 LEU A 41 -13.893 -3.726 -1.450 1.00 0.00 C ATOM 0 H LEU A 41 -10.467 -3.007 2.439 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.784 -3.160 -0.434 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.647 -4.667 -0.204 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.500 -3.557 0.850 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.712 -1.948 -1.016 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -12.293 -2.637 -3.348 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -10.794 -2.534 -2.393 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -11.509 -4.122 -2.758 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -14.403 -3.298 -2.313 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -13.710 -4.786 -1.625 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -14.517 -3.607 -0.564 1.00 0.00 H new ATOM 136 N LEU A 42 -9.870 -0.688 -0.368 1.00 0.00 N ATOM 137 CA LEU A 42 -9.955 0.762 -0.543 1.00 0.00 C ATOM 138 C LEU A 42 -10.738 1.071 -1.825 1.00 0.00 C ATOM 139 O LEU A 42 -10.368 0.583 -2.892 1.00 0.00 O ATOM 140 CB LEU A 42 -8.520 1.318 -0.614 1.00 0.00 C ATOM 141 CG LEU A 42 -8.411 2.846 -0.749 1.00 0.00 C ATOM 142 CD1 LEU A 42 -9.077 3.605 0.409 1.00 0.00 C ATOM 143 CD2 LEU A 42 -6.931 3.234 -0.813 1.00 0.00 C ATOM 0 H LEU A 42 -9.156 -1.114 -0.958 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.479 1.231 0.290 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -7.984 1.010 0.284 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -8.012 0.858 -1.461 1.00 0.00 H new ATOM 0 HG LEU A 42 -8.938 3.127 -1.661 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -8.965 4.678 0.253 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.137 3.353 0.447 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -8.603 3.323 1.349 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -6.842 4.316 -0.909 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -6.430 2.908 0.098 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -6.466 2.754 -1.674 1.00 0.00 H new ATOM 155 N VAL A 43 -11.779 1.903 -1.739 1.00 0.00 N ATOM 156 CA VAL A 43 -12.509 2.425 -2.910 1.00 0.00 C ATOM 157 C VAL A 43 -12.203 3.918 -3.057 1.00 0.00 C ATOM 158 O VAL A 43 -12.412 4.687 -2.120 1.00 0.00 O ATOM 159 CB VAL A 43 -14.039 2.191 -2.832 1.00 0.00 C ATOM 160 CG1 VAL A 43 -14.712 2.559 -4.166 1.00 0.00 C ATOM 161 CG2 VAL A 43 -14.374 0.726 -2.496 1.00 0.00 C ATOM 0 H VAL A 43 -12.147 2.240 -0.849 1.00 0.00 H new ATOM 0 HA VAL A 43 -12.166 1.874 -3.786 1.00 0.00 H new ATOM 0 HB VAL A 43 -14.418 2.831 -2.035 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -15.786 2.388 -4.091 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -14.527 3.610 -4.389 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -14.301 1.941 -4.964 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -15.456 0.601 -2.450 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -13.966 0.073 -3.268 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -13.937 0.465 -1.532 1.00 0.00 H new ATOM 171 N VAL A 44 -11.715 4.314 -4.234 1.00 0.00 N ATOM 172 CA VAL A 44 -11.497 5.724 -4.627 1.00 0.00 C ATOM 173 C VAL A 44 -12.156 6.034 -5.977 1.00 0.00 C ATOM 174 O VAL A 44 -12.661 5.128 -6.641 1.00 0.00 O ATOM 175 CB VAL A 44 -9.996 6.099 -4.672 1.00 0.00 C ATOM 176 CG1 VAL A 44 -9.333 5.948 -3.296 1.00 0.00 C ATOM 177 CG2 VAL A 44 -9.221 5.295 -5.726 1.00 0.00 C ATOM 0 H VAL A 44 -11.451 3.653 -4.965 1.00 0.00 H new ATOM 0 HA VAL A 44 -11.968 6.333 -3.856 1.00 0.00 H new ATOM 0 HB VAL A 44 -9.956 7.149 -4.963 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.280 6.220 -3.368 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -9.829 6.603 -2.579 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.419 4.914 -2.962 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.174 5.597 -5.716 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -9.294 4.231 -5.499 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.644 5.485 -6.712 1.00 0.00 H new ATOM 187 N THR A 45 -12.134 7.306 -6.392 1.00 0.00 N ATOM 188 CA THR A 45 -12.609 7.791 -7.699 1.00 0.00 C ATOM 189 C THR A 45 -11.423 8.101 -8.612 1.00 0.00 C ATOM 190 O THR A 45 -10.343 8.460 -8.144 1.00 0.00 O ATOM 191 CB THR A 45 -13.495 9.033 -7.506 1.00 0.00 C ATOM 192 OG1 THR A 45 -14.519 8.727 -6.582 1.00 0.00 O ATOM 193 CG2 THR A 45 -14.174 9.514 -8.792 1.00 0.00 C ATOM 0 H THR A 45 -11.771 8.057 -5.806 1.00 0.00 H new ATOM 0 HA THR A 45 -13.206 7.012 -8.174 1.00 0.00 H new ATOM 0 HB THR A 45 -12.834 9.827 -7.158 1.00 0.00 H new ATOM 0 HG1 THR A 45 -15.088 9.514 -6.452 1.00 0.00 H new ATOM 0 HG21 THR A 45 -14.781 10.393 -8.576 1.00 0.00 H new ATOM 0 HG22 THR A 45 -13.414 9.770 -9.531 1.00 0.00 H new ATOM 0 HG23 THR A 45 -14.810 8.721 -9.186 1.00 0.00 H new ATOM 201 N GLU A 46 -11.633 7.984 -9.919 1.00 0.00 N ATOM 202 CA GLU A 46 -10.712 8.387 -10.977 1.00 0.00 C ATOM 203 C GLU A 46 -10.104 9.777 -10.730 1.00 0.00 C ATOM 204 O GLU A 46 -10.818 10.772 -10.572 1.00 0.00 O ATOM 205 CB GLU A 46 -11.471 8.347 -12.315 1.00 0.00 C ATOM 206 CG GLU A 46 -11.059 7.146 -13.173 1.00 0.00 C ATOM 207 CD GLU A 46 -9.741 7.340 -13.935 1.00 0.00 C ATOM 208 OE1 GLU A 46 -9.028 8.345 -13.713 1.00 0.00 O ATOM 209 OE2 GLU A 46 -9.403 6.444 -14.741 1.00 0.00 O1- ATOM 0 H GLU A 46 -12.496 7.584 -10.289 1.00 0.00 H new ATOM 0 HA GLU A 46 -9.872 7.693 -10.996 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -12.543 8.304 -12.123 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -11.283 9.268 -12.866 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -10.969 6.269 -12.532 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -11.853 6.937 -13.890 1.00 0.00 H new ATOM 216 N GLY A 47 -8.771 9.827 -10.688 1.00 0.00 N ATOM 217 CA GLY A 47 -7.963 11.026 -10.447 1.00 0.00 C ATOM 218 C GLY A 47 -7.753 11.384 -8.970 1.00 0.00 C ATOM 219 O GLY A 47 -7.087 12.379 -8.697 1.00 0.00 O ATOM 0 H GLY A 47 -8.198 8.995 -10.827 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.988 10.887 -10.913 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.438 11.871 -10.946 1.00 0.00 H new ATOM 223 N ASP A 48 -8.287 10.613 -8.018 1.00 0.00 N ATOM 224 CA ASP A 48 -8.097 10.840 -6.576 1.00 0.00 C ATOM 225 C ASP A 48 -6.836 10.141 -6.026 1.00 0.00 C ATOM 226 O ASP A 48 -6.357 9.145 -6.572 1.00 0.00 O ATOM 227 CB ASP A 48 -9.362 10.392 -5.820 1.00 0.00 C ATOM 228 CG ASP A 48 -9.411 10.843 -4.348 1.00 0.00 C ATOM 229 OD1 ASP A 48 -8.900 11.943 -4.027 1.00 0.00 O1- ATOM 230 OD2 ASP A 48 -9.999 10.104 -3.525 1.00 0.00 O ATOM 0 H ASP A 48 -8.871 9.803 -8.226 1.00 0.00 H new ATOM 0 HA ASP A 48 -7.939 11.907 -6.419 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -10.238 10.783 -6.337 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.428 9.305 -5.858 1.00 0.00 H new ATOM 235 N ASN A 49 -6.300 10.657 -4.917 1.00 0.00 N ATOM 236 CA ASN A 49 -5.199 10.059 -4.166 1.00 0.00 C ATOM 237 C ASN A 49 -5.693 8.859 -3.334 1.00 0.00 C ATOM 238 O ASN A 49 -6.564 9.007 -2.473 1.00 0.00 O ATOM 239 CB ASN A 49 -4.568 11.126 -3.253 1.00 0.00 C ATOM 240 CG ASN A 49 -4.113 12.358 -4.027 1.00 0.00 C ATOM 241 OD1 ASN A 49 -4.791 13.377 -4.072 1.00 0.00 O ATOM 242 ND2 ASN A 49 -2.966 12.295 -4.677 1.00 0.00 N ATOM 0 H ASN A 49 -6.632 11.530 -4.506 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.448 9.693 -4.866 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -5.291 11.424 -2.494 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -3.715 10.694 -2.729 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -2.642 13.096 -5.219 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -2.404 11.445 -4.638 1.00 0.00 H new ATOM 249 N ALA A 50 -5.115 7.677 -3.562 1.00 0.00 N ATOM 250 CA ALA A 50 -5.394 6.460 -2.787 1.00 0.00 C ATOM 251 C ALA A 50 -4.275 6.199 -1.763 1.00 0.00 C ATOM 252 O ALA A 50 -3.102 6.229 -2.143 1.00 0.00 O ATOM 253 CB ALA A 50 -5.552 5.289 -3.766 1.00 0.00 C ATOM 0 H ALA A 50 -4.428 7.534 -4.302 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.317 6.579 -2.220 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -5.760 4.375 -3.210 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -6.377 5.494 -4.448 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.632 5.165 -4.337 1.00 0.00 H new ATOM 259 N THR A 51 -4.620 5.931 -0.494 1.00 0.00 N ATOM 260 CA THR A 51 -3.646 5.690 0.589 1.00 0.00 C ATOM 261 C THR A 51 -4.011 4.452 1.406 1.00 0.00 C ATOM 262 O THR A 51 -5.108 4.374 1.959 1.00 0.00 O ATOM 263 CB THR A 51 -3.506 6.911 1.512 1.00 0.00 C ATOM 264 OG1 THR A 51 -3.293 8.074 0.739 1.00 0.00 O ATOM 265 CG2 THR A 51 -2.305 6.770 2.454 1.00 0.00 C ATOM 0 H THR A 51 -5.590 5.874 -0.185 1.00 0.00 H new ATOM 0 HA THR A 51 -2.683 5.514 0.110 1.00 0.00 H new ATOM 0 HB THR A 51 -4.425 6.980 2.093 1.00 0.00 H new ATOM 0 HG1 THR A 51 -3.206 8.849 1.332 1.00 0.00 H new ATOM 0 HG21 THR A 51 -2.237 7.651 3.092 1.00 0.00 H new ATOM 0 HG22 THR A 51 -2.431 5.882 3.074 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.391 6.676 1.867 1.00 0.00 H new ATOM 273 N PHE A 52 -3.065 3.518 1.511 1.00 0.00 N ATOM 274 CA PHE A 52 -3.102 2.347 2.395 1.00 0.00 C ATOM 275 C PHE A 52 -2.170 2.535 3.601 1.00 0.00 C ATOM 276 O PHE A 52 -1.218 3.315 3.537 1.00 0.00 O ATOM 277 CB PHE A 52 -2.667 1.100 1.611 1.00 0.00 C ATOM 278 CG PHE A 52 -3.642 0.663 0.540 1.00 0.00 C ATOM 279 CD1 PHE A 52 -4.723 -0.175 0.878 1.00 0.00 C ATOM 280 CD2 PHE A 52 -3.461 1.075 -0.795 1.00 0.00 C ATOM 281 CE1 PHE A 52 -5.615 -0.604 -0.118 1.00 0.00 C ATOM 282 CE2 PHE A 52 -4.351 0.639 -1.791 1.00 0.00 C ATOM 283 CZ PHE A 52 -5.424 -0.203 -1.450 1.00 0.00 C ATOM 0 H PHE A 52 -2.210 3.557 0.956 1.00 0.00 H new ATOM 0 HA PHE A 52 -4.122 2.226 2.760 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -1.701 1.296 1.147 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.523 0.277 2.311 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -4.865 -0.487 1.902 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.638 1.726 -1.053 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -6.447 -1.242 0.140 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -4.211 0.950 -2.816 1.00 0.00 H new ATOM 0 HZ PHE A 52 -6.105 -0.543 -2.216 1.00 0.00 H new ATOM 293 N THR A 53 -2.408 1.775 4.674 1.00 0.00 N ATOM 294 CA THR A 53 -1.601 1.753 5.905 1.00 0.00 C ATOM 295 C THR A 53 -1.055 0.348 6.148 1.00 0.00 C ATOM 296 O THR A 53 -1.793 -0.624 5.999 1.00 0.00 O ATOM 297 CB THR A 53 -2.458 2.194 7.099 1.00 0.00 C ATOM 298 OG1 THR A 53 -3.063 3.438 6.816 1.00 0.00 O ATOM 299 CG2 THR A 53 -1.647 2.353 8.387 1.00 0.00 C ATOM 0 H THR A 53 -3.199 1.132 4.714 1.00 0.00 H new ATOM 0 HA THR A 53 -0.765 2.443 5.792 1.00 0.00 H new ATOM 0 HB THR A 53 -3.200 1.410 7.253 1.00 0.00 H new ATOM 0 HG1 THR A 53 -2.368 4.112 6.660 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.307 2.666 9.196 1.00 0.00 H new ATOM 0 HG22 THR A 53 -1.183 1.401 8.645 1.00 0.00 H new ATOM 0 HG23 THR A 53 -0.872 3.105 8.239 1.00 0.00 H new ATOM 307 N CYS A 54 0.207 0.238 6.569 1.00 0.00 N ATOM 308 CA CYS A 54 0.832 -1.006 7.052 1.00 0.00 C ATOM 309 C CYS A 54 1.504 -0.789 8.415 1.00 0.00 C ATOM 310 O CYS A 54 2.229 0.192 8.594 1.00 0.00 O ATOM 311 CB CYS A 54 1.905 -1.496 6.065 1.00 0.00 C ATOM 312 SG CYS A 54 1.331 -1.960 4.411 1.00 0.00 S ATOM 0 H CYS A 54 0.846 1.033 6.586 1.00 0.00 H new ATOM 0 HA CYS A 54 0.040 -1.749 7.143 1.00 0.00 H new ATOM 0 HB2 CYS A 54 2.654 -0.711 5.958 1.00 0.00 H new ATOM 0 HB3 CYS A 54 2.406 -2.357 6.506 1.00 0.00 H new ATOM 317 N SER A 55 1.348 -1.732 9.346 1.00 0.00 N ATOM 318 CA SER A 55 2.099 -1.753 10.611 1.00 0.00 C ATOM 319 C SER A 55 2.817 -3.100 10.763 1.00 0.00 C ATOM 320 O SER A 55 2.283 -4.140 10.366 1.00 0.00 O ATOM 321 CB SER A 55 1.183 -1.448 11.809 1.00 0.00 C ATOM 322 OG SER A 55 0.046 -2.300 11.882 1.00 0.00 O ATOM 0 H SER A 55 0.694 -2.509 9.247 1.00 0.00 H new ATOM 0 HA SER A 55 2.853 -0.966 10.590 1.00 0.00 H new ATOM 0 HB2 SER A 55 1.758 -1.542 12.730 1.00 0.00 H new ATOM 0 HB3 SER A 55 0.848 -0.412 11.747 1.00 0.00 H new ATOM 0 HG SER A 55 -0.494 -2.058 12.663 1.00 0.00 H new ATOM 328 N PHE A 56 4.051 -3.077 11.283 1.00 0.00 N ATOM 329 CA PHE A 56 4.966 -4.223 11.289 1.00 0.00 C ATOM 330 C PHE A 56 5.526 -4.565 12.672 1.00 0.00 C ATOM 331 O PHE A 56 5.920 -3.696 13.450 1.00 0.00 O ATOM 332 CB PHE A 56 6.148 -3.940 10.339 1.00 0.00 C ATOM 333 CG PHE A 56 5.955 -4.491 8.946 1.00 0.00 C ATOM 334 CD1 PHE A 56 4.992 -3.912 8.104 1.00 0.00 C ATOM 335 CD2 PHE A 56 6.699 -5.604 8.506 1.00 0.00 C ATOM 336 CE1 PHE A 56 4.745 -4.463 6.840 1.00 0.00 C ATOM 337 CE2 PHE A 56 6.443 -6.158 7.237 1.00 0.00 C ATOM 338 CZ PHE A 56 5.463 -5.589 6.404 1.00 0.00 C ATOM 0 H PHE A 56 4.448 -2.245 11.719 1.00 0.00 H new ATOM 0 HA PHE A 56 4.378 -5.080 10.961 1.00 0.00 H new ATOM 0 HB2 PHE A 56 6.301 -2.863 10.276 1.00 0.00 H new ATOM 0 HB3 PHE A 56 7.056 -4.367 10.766 1.00 0.00 H new ATOM 0 HD1 PHE A 56 4.442 -3.042 8.431 1.00 0.00 H new ATOM 0 HD2 PHE A 56 7.463 -6.030 9.140 1.00 0.00 H new ATOM 0 HE1 PHE A 56 3.999 -4.020 6.197 1.00 0.00 H new ATOM 0 HE2 PHE A 56 7.000 -7.021 6.903 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.263 -6.016 5.432 1.00 0.00 H new ATOM 424 N PHE A 63 14.026 -1.129 9.892 1.00 0.00 N ATOM 425 CA PHE A 63 13.886 -1.849 8.629 1.00 0.00 C ATOM 426 C PHE A 63 13.517 -0.904 7.472 1.00 0.00 C ATOM 427 O PHE A 63 13.045 0.214 7.688 1.00 0.00 O ATOM 428 CB PHE A 63 12.842 -2.975 8.812 1.00 0.00 C ATOM 429 CG PHE A 63 11.486 -2.539 9.332 1.00 0.00 C ATOM 430 CD1 PHE A 63 10.490 -2.106 8.436 1.00 0.00 C ATOM 431 CD2 PHE A 63 11.212 -2.594 10.714 1.00 0.00 C ATOM 432 CE1 PHE A 63 9.228 -1.725 8.921 1.00 0.00 C ATOM 433 CE2 PHE A 63 9.953 -2.200 11.199 1.00 0.00 C ATOM 434 CZ PHE A 63 8.965 -1.758 10.301 1.00 0.00 C ATOM 0 HA PHE A 63 14.844 -2.292 8.359 1.00 0.00 H new ATOM 0 HB2 PHE A 63 12.700 -3.472 7.852 1.00 0.00 H new ATOM 0 HB3 PHE A 63 13.252 -3.717 9.498 1.00 0.00 H new ATOM 0 HD1 PHE A 63 10.696 -2.067 7.377 1.00 0.00 H new ATOM 0 HD2 PHE A 63 11.971 -2.939 11.401 1.00 0.00 H new ATOM 0 HE1 PHE A 63 8.459 -1.406 8.233 1.00 0.00 H new ATOM 0 HE2 PHE A 63 9.745 -2.237 12.258 1.00 0.00 H new ATOM 0 HZ PHE A 63 8.001 -1.443 10.673 1.00 0.00 H new ATOM 444 N VAL A 64 13.685 -1.389 6.240 1.00 0.00 N ATOM 445 CA VAL A 64 13.196 -0.749 5.010 1.00 0.00 C ATOM 446 C VAL A 64 11.856 -1.404 4.684 1.00 0.00 C ATOM 447 O VAL A 64 11.789 -2.630 4.587 1.00 0.00 O ATOM 448 CB VAL A 64 14.158 -0.937 3.807 1.00 0.00 C ATOM 449 CG1 VAL A 64 13.673 -0.157 2.571 1.00 0.00 C ATOM 450 CG2 VAL A 64 15.594 -0.503 4.150 1.00 0.00 C ATOM 0 H VAL A 64 14.179 -2.263 6.062 1.00 0.00 H new ATOM 0 HA VAL A 64 13.114 0.325 5.176 1.00 0.00 H new ATOM 0 HB VAL A 64 14.160 -2.003 3.578 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.370 -0.311 1.747 1.00 0.00 H new ATOM 0 HG12 VAL A 64 12.684 -0.513 2.281 1.00 0.00 H new ATOM 0 HG13 VAL A 64 13.621 0.906 2.809 1.00 0.00 H new ATOM 0 HG21 VAL A 64 16.236 -0.650 3.281 1.00 0.00 H new ATOM 0 HG22 VAL A 64 15.599 0.550 4.430 1.00 0.00 H new ATOM 0 HG23 VAL A 64 15.966 -1.101 4.982 1.00 0.00 H new ATOM 460 N LEU A 65 10.799 -0.603 4.523 1.00 0.00 N ATOM 461 CA LEU A 65 9.485 -1.090 4.094 1.00 0.00 C ATOM 462 C LEU A 65 9.305 -0.833 2.599 1.00 0.00 C ATOM 463 O LEU A 65 9.671 0.230 2.104 1.00 0.00 O ATOM 464 CB LEU A 65 8.364 -0.417 4.911 1.00 0.00 C ATOM 465 CG LEU A 65 6.968 -1.010 4.610 1.00 0.00 C ATOM 466 CD1 LEU A 65 6.860 -2.470 5.066 1.00 0.00 C ATOM 467 CD2 LEU A 65 5.874 -0.203 5.303 1.00 0.00 C ATOM 0 H LEU A 65 10.830 0.403 4.687 1.00 0.00 H new ATOM 0 HA LEU A 65 9.426 -2.164 4.273 1.00 0.00 H new ATOM 0 HB2 LEU A 65 8.579 -0.526 5.974 1.00 0.00 H new ATOM 0 HB3 LEU A 65 8.354 0.651 4.696 1.00 0.00 H new ATOM 0 HG LEU A 65 6.836 -0.965 3.529 1.00 0.00 H new ATOM 0 HD11 LEU A 65 5.864 -2.850 4.837 1.00 0.00 H new ATOM 0 HD12 LEU A 65 7.606 -3.070 4.545 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.032 -2.529 6.141 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.901 -0.639 5.076 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.037 -0.220 6.381 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.901 0.827 4.948 1.00 0.00 H new ATOM 479 N ASN A 66 8.721 -1.802 1.896 1.00 0.00 N ATOM 480 CA ASN A 66 8.519 -1.798 0.449 1.00 0.00 C ATOM 481 C ASN A 66 7.041 -2.093 0.122 1.00 0.00 C ATOM 482 O ASN A 66 6.443 -2.993 0.720 1.00 0.00 O ATOM 483 CB ASN A 66 9.427 -2.866 -0.190 1.00 0.00 C ATOM 484 CG ASN A 66 10.874 -2.845 0.300 1.00 0.00 C ATOM 485 OD1 ASN A 66 11.739 -2.193 -0.269 1.00 0.00 O ATOM 486 ND2 ASN A 66 11.185 -3.568 1.362 1.00 0.00 N ATOM 0 H ASN A 66 8.360 -2.647 2.339 1.00 0.00 H new ATOM 0 HA ASN A 66 8.774 -0.817 0.047 1.00 0.00 H new ATOM 0 HB2 ASN A 66 9.004 -3.851 0.009 1.00 0.00 H new ATOM 0 HB3 ASN A 66 9.421 -2.729 -1.271 1.00 0.00 H new ATOM 0 HD21 ASN A 66 12.145 -3.582 1.706 1.00 0.00 H new ATOM 0 HD22 ASN A 66 10.465 -4.112 1.837 1.00 0.00 H new ATOM 493 N TRP A 67 6.459 -1.359 -0.833 1.00 0.00 N ATOM 494 CA TRP A 67 5.112 -1.598 -1.366 1.00 0.00 C ATOM 495 C TRP A 67 5.181 -2.386 -2.682 1.00 0.00 C ATOM 496 O TRP A 67 5.971 -2.052 -3.572 1.00 0.00 O ATOM 497 CB TRP A 67 4.399 -0.264 -1.605 1.00 0.00 C ATOM 498 CG TRP A 67 2.941 -0.386 -1.960 1.00 0.00 C ATOM 499 CD1 TRP A 67 2.396 -0.100 -3.164 1.00 0.00 C ATOM 500 CD2 TRP A 67 1.820 -0.835 -1.130 1.00 0.00 C ATOM 501 NE1 TRP A 67 1.032 -0.329 -3.132 1.00 0.00 N ATOM 502 CE2 TRP A 67 0.612 -0.692 -1.873 1.00 0.00 C ATOM 503 CE3 TRP A 67 1.695 -1.337 0.181 1.00 0.00 C ATOM 504 CZ2 TRP A 67 -0.651 -0.954 -1.321 1.00 0.00 C ATOM 505 CZ3 TRP A 67 0.436 -1.646 0.734 1.00 0.00 C ATOM 506 CH2 TRP A 67 -0.738 -1.442 -0.009 1.00 0.00 C ATOM 0 H TRP A 67 6.923 -0.562 -1.268 1.00 0.00 H new ATOM 0 HA TRP A 67 4.554 -2.183 -0.635 1.00 0.00 H new ATOM 0 HB2 TRP A 67 4.491 0.348 -0.707 1.00 0.00 H new ATOM 0 HB3 TRP A 67 4.911 0.268 -2.407 1.00 0.00 H new ATOM 0 HD1 TRP A 67 2.945 0.255 -4.024 1.00 0.00 H new ATOM 0 HE1 TRP A 67 0.416 -0.240 -3.940 1.00 0.00 H new ATOM 0 HE3 TRP A 67 2.584 -1.488 0.775 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -1.546 -0.782 -1.900 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 0.374 -2.043 1.737 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -1.702 -1.660 0.427 1.00 0.00 H new ATOM 517 N TYR A 68 4.330 -3.402 -2.827 1.00 0.00 N ATOM 518 CA TYR A 68 4.265 -4.278 -3.994 1.00 0.00 C ATOM 519 C TYR A 68 2.869 -4.320 -4.629 1.00 0.00 C ATOM 520 O TYR A 68 1.853 -4.335 -3.934 1.00 0.00 O ATOM 521 CB TYR A 68 4.666 -5.704 -3.592 1.00 0.00 C ATOM 522 CG TYR A 68 6.067 -5.833 -3.033 1.00 0.00 C ATOM 523 CD1 TYR A 68 7.154 -6.070 -3.896 1.00 0.00 C ATOM 524 CD2 TYR A 68 6.280 -5.717 -1.646 1.00 0.00 C ATOM 525 CE1 TYR A 68 8.458 -6.174 -3.377 1.00 0.00 C ATOM 526 CE2 TYR A 68 7.581 -5.821 -1.124 1.00 0.00 C ATOM 527 CZ TYR A 68 8.677 -6.039 -1.988 1.00 0.00 C ATOM 528 OH TYR A 68 9.937 -6.106 -1.477 1.00 0.00 O ATOM 0 H TYR A 68 3.645 -3.645 -2.111 1.00 0.00 H new ATOM 0 HA TYR A 68 4.955 -3.871 -4.733 1.00 0.00 H new ATOM 0 HB2 TYR A 68 3.958 -6.070 -2.849 1.00 0.00 H new ATOM 0 HB3 TYR A 68 4.576 -6.352 -4.464 1.00 0.00 H new ATOM 0 HD1 TYR A 68 6.987 -6.172 -4.958 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.444 -5.548 -0.983 1.00 0.00 H new ATOM 0 HE1 TYR A 68 9.291 -6.357 -4.040 1.00 0.00 H new ATOM 0 HE2 TYR A 68 7.743 -5.734 -0.060 1.00 0.00 H new ATOM 0 HH TYR A 68 9.902 -5.992 -0.504 1.00 0.00 H new ATOM 538 N ARG A 69 2.845 -4.402 -5.960 1.00 0.00 N ATOM 539 CA ARG A 69 1.682 -4.718 -6.794 1.00 0.00 C ATOM 540 C ARG A 69 1.718 -6.218 -7.102 1.00 0.00 C ATOM 541 O ARG A 69 2.803 -6.758 -7.321 1.00 0.00 O ATOM 542 CB ARG A 69 1.791 -3.905 -8.093 1.00 0.00 C ATOM 543 CG ARG A 69 0.625 -4.129 -9.071 1.00 0.00 C ATOM 544 CD ARG A 69 0.848 -3.435 -10.425 1.00 0.00 C ATOM 545 NE ARG A 69 2.081 -3.890 -11.106 1.00 0.00 N ATOM 546 CZ ARG A 69 2.334 -5.096 -11.605 1.00 0.00 C ATOM 547 NH1 ARG A 69 1.460 -6.080 -11.571 1.00 0.00 N ATOM 548 NH2 ARG A 69 3.504 -5.342 -12.146 1.00 0.00 N1+ ATOM 0 H ARG A 69 3.684 -4.241 -6.518 1.00 0.00 H new ATOM 0 HA ARG A 69 0.747 -4.471 -6.291 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.844 -2.845 -7.843 1.00 0.00 H new ATOM 0 HB3 ARG A 69 2.725 -4.161 -8.593 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.492 -5.199 -9.233 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -0.297 -3.757 -8.623 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -0.009 -3.624 -11.071 1.00 0.00 H new ATOM 0 HD3 ARG A 69 0.900 -2.357 -10.272 1.00 0.00 H new ATOM 0 HE ARG A 69 2.823 -3.197 -11.204 1.00 0.00 H new ATOM 0 HH11 ARG A 69 0.543 -5.933 -11.149 1.00 0.00 H new ATOM 0 HH12 ARG A 69 1.700 -6.989 -11.967 1.00 0.00 H new ATOM 0 HH21 ARG A 69 4.213 -4.610 -12.182 1.00 0.00 H new ATOM 0 HH22 ARG A 69 3.704 -6.265 -12.531 1.00 0.00 H new ATOM 562 N MET A 70 0.569 -6.892 -7.150 1.00 0.00 N ATOM 563 CA MET A 70 0.492 -8.296 -7.587 1.00 0.00 C ATOM 564 C MET A 70 0.227 -8.421 -9.095 1.00 0.00 C ATOM 565 O MET A 70 -0.515 -7.633 -9.683 1.00 0.00 O ATOM 566 CB MET A 70 -0.566 -9.062 -6.785 1.00 0.00 C ATOM 567 CG MET A 70 -0.300 -8.968 -5.276 1.00 0.00 C ATOM 568 SD MET A 70 -1.016 -10.301 -4.284 1.00 0.00 S ATOM 569 CE MET A 70 0.203 -11.594 -4.647 1.00 0.00 C ATOM 0 H MET A 70 -0.331 -6.489 -6.890 1.00 0.00 H new ATOM 0 HA MET A 70 1.467 -8.744 -7.393 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.555 -8.661 -7.008 1.00 0.00 H new ATOM 0 HB3 MET A 70 -0.570 -10.108 -7.091 1.00 0.00 H new ATOM 0 HG2 MET A 70 0.778 -8.954 -5.113 1.00 0.00 H new ATOM 0 HG3 MET A 70 -0.690 -8.017 -4.913 1.00 0.00 H new ATOM 0 HE1 MET A 70 -0.017 -12.480 -4.051 1.00 0.00 H new ATOM 0 HE2 MET A 70 0.159 -11.849 -5.706 1.00 0.00 H new ATOM 0 HE3 MET A 70 1.202 -11.232 -4.403 1.00 0.00 H new ATOM 579 N SER A 71 0.812 -9.439 -9.717 1.00 0.00 N ATOM 580 CA SER A 71 0.556 -9.855 -11.106 1.00 0.00 C ATOM 581 C SER A 71 -0.219 -11.192 -11.146 1.00 0.00 C ATOM 582 O SER A 71 -0.024 -12.030 -10.254 1.00 0.00 O ATOM 583 CB SER A 71 1.888 -10.005 -11.857 1.00 0.00 C ATOM 584 OG SER A 71 2.511 -8.744 -12.073 1.00 0.00 O ATOM 0 H SER A 71 1.507 -10.026 -9.255 1.00 0.00 H new ATOM 0 HA SER A 71 -0.051 -9.089 -11.589 1.00 0.00 H new ATOM 0 HB2 SER A 71 2.557 -10.650 -11.287 1.00 0.00 H new ATOM 0 HB3 SER A 71 1.713 -10.494 -12.815 1.00 0.00 H new ATOM 0 HG SER A 71 2.380 -8.470 -13.005 1.00 0.00 H new ATOM 590 N PRO A 72 -1.064 -11.436 -12.174 1.00 0.00 N ATOM 591 CA PRO A 72 -1.988 -12.576 -12.221 1.00 0.00 C ATOM 592 C PRO A 72 -1.304 -13.945 -12.378 1.00 0.00 C ATOM 593 O PRO A 72 -1.932 -14.966 -12.109 1.00 0.00 O ATOM 594 CB PRO A 72 -2.938 -12.281 -13.388 1.00 0.00 C ATOM 595 CG PRO A 72 -2.100 -11.409 -14.318 1.00 0.00 C ATOM 596 CD PRO A 72 -1.275 -10.581 -13.336 1.00 0.00 C ATOM 0 HA PRO A 72 -2.509 -12.667 -11.268 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -3.264 -13.197 -13.882 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -3.836 -11.763 -13.053 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.469 -12.006 -14.976 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -2.722 -10.781 -14.956 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -0.325 -10.282 -13.779 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -1.800 -9.667 -13.059 1.00 0.00 H new ATOM 604 N SER A 73 -0.021 -13.992 -12.756 1.00 0.00 N ATOM 605 CA SER A 73 0.795 -15.222 -12.738 1.00 0.00 C ATOM 606 C SER A 73 1.273 -15.616 -11.316 1.00 0.00 C ATOM 607 O SER A 73 2.102 -16.516 -11.164 1.00 0.00 O ATOM 608 CB SER A 73 1.982 -15.050 -13.705 1.00 0.00 C ATOM 609 OG SER A 73 2.571 -16.297 -14.057 1.00 0.00 O ATOM 0 H SER A 73 0.489 -13.173 -13.087 1.00 0.00 H new ATOM 0 HA SER A 73 0.166 -16.048 -13.069 1.00 0.00 H new ATOM 0 HB2 SER A 73 1.643 -14.542 -14.608 1.00 0.00 H new ATOM 0 HB3 SER A 73 2.735 -14.411 -13.244 1.00 0.00 H new ATOM 0 HG SER A 73 2.652 -16.858 -13.257 1.00 0.00 H new ATOM 615 N ASN A 74 0.781 -14.929 -10.272 1.00 0.00 N ATOM 616 CA ASN A 74 1.087 -15.113 -8.842 1.00 0.00 C ATOM 617 C ASN A 74 2.472 -14.543 -8.468 1.00 0.00 C ATOM 618 O ASN A 74 3.207 -15.115 -7.659 1.00 0.00 O ATOM 619 CB ASN A 74 0.874 -16.568 -8.367 1.00 0.00 C ATOM 620 CG ASN A 74 -0.504 -17.114 -8.729 1.00 0.00 C ATOM 621 OD1 ASN A 74 -1.504 -16.809 -8.087 1.00 0.00 O ATOM 622 ND2 ASN A 74 -0.601 -17.933 -9.763 1.00 0.00 N ATOM 0 H ASN A 74 0.109 -14.175 -10.415 1.00 0.00 H new ATOM 0 HA ASN A 74 0.359 -14.522 -8.287 1.00 0.00 H new ATOM 0 HB2 ASN A 74 1.640 -17.205 -8.809 1.00 0.00 H new ATOM 0 HB3 ASN A 74 1.006 -16.615 -7.286 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -1.509 -18.313 -10.029 1.00 0.00 H new ATOM 0 HD22 ASN A 74 0.233 -18.184 -10.294 1.00 0.00 H new ATOM 629 N GLN A 75 2.840 -13.416 -9.087 1.00 0.00 N ATOM 630 CA GLN A 75 4.109 -12.709 -8.873 1.00 0.00 C ATOM 631 C GLN A 75 3.868 -11.312 -8.268 1.00 0.00 C ATOM 632 O GLN A 75 2.722 -10.862 -8.165 1.00 0.00 O ATOM 633 CB GLN A 75 4.882 -12.615 -10.204 1.00 0.00 C ATOM 634 CG GLN A 75 5.206 -13.988 -10.819 1.00 0.00 C ATOM 635 CD GLN A 75 6.067 -13.852 -12.077 1.00 0.00 C ATOM 636 OE1 GLN A 75 5.576 -13.751 -13.195 1.00 0.00 O ATOM 637 NE2 GLN A 75 7.381 -13.818 -11.953 1.00 0.00 N ATOM 0 H GLN A 75 2.243 -12.955 -9.774 1.00 0.00 H new ATOM 0 HA GLN A 75 4.711 -13.272 -8.159 1.00 0.00 H new ATOM 0 HB2 GLN A 75 4.295 -12.035 -10.916 1.00 0.00 H new ATOM 0 HB3 GLN A 75 5.812 -12.070 -10.038 1.00 0.00 H new ATOM 0 HG2 GLN A 75 5.727 -14.602 -10.085 1.00 0.00 H new ATOM 0 HG3 GLN A 75 4.279 -14.505 -11.066 1.00 0.00 H new ATOM 0 HE21 GLN A 75 7.809 -13.901 -11.031 1.00 0.00 H new ATOM 0 HE22 GLN A 75 7.969 -13.709 -12.780 1.00 0.00 H new ATOM 646 N THR A 76 4.948 -10.620 -7.881 1.00 0.00 N ATOM 647 CA THR A 76 4.939 -9.291 -7.249 1.00 0.00 C ATOM 648 C THR A 76 5.945 -8.353 -7.906 1.00 0.00 C ATOM 649 O THR A 76 6.962 -8.786 -8.451 1.00 0.00 O ATOM 650 CB THR A 76 5.227 -9.364 -5.741 1.00 0.00 C ATOM 651 OG1 THR A 76 6.269 -10.281 -5.474 1.00 0.00 O ATOM 652 CG2 THR A 76 3.981 -9.779 -4.964 1.00 0.00 C ATOM 0 H THR A 76 5.892 -10.985 -8.004 1.00 0.00 H new ATOM 0 HA THR A 76 3.933 -8.896 -7.391 1.00 0.00 H new ATOM 0 HB THR A 76 5.531 -8.368 -5.418 1.00 0.00 H new ATOM 0 HG1 THR A 76 6.438 -10.312 -4.509 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.213 -9.823 -3.900 1.00 0.00 H new ATOM 0 HG22 THR A 76 3.188 -9.051 -5.133 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.651 -10.761 -5.304 1.00 0.00 H new ATOM 660 N ASP A 77 5.651 -7.057 -7.839 1.00 0.00 N ATOM 661 CA ASP A 77 6.439 -5.973 -8.432 1.00 0.00 C ATOM 662 C ASP A 77 6.533 -4.778 -7.476 1.00 0.00 C ATOM 663 O ASP A 77 5.521 -4.257 -7.008 1.00 0.00 O ATOM 664 CB ASP A 77 5.749 -5.543 -9.728 1.00 0.00 C ATOM 665 CG ASP A 77 6.545 -4.576 -10.615 1.00 0.00 C ATOM 666 OD1 ASP A 77 7.794 -4.529 -10.524 1.00 0.00 O1- ATOM 667 OD2 ASP A 77 5.891 -3.891 -11.439 1.00 0.00 O ATOM 0 H ASP A 77 4.823 -6.716 -7.350 1.00 0.00 H new ATOM 0 HA ASP A 77 7.452 -6.323 -8.630 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.520 -6.436 -10.310 1.00 0.00 H new ATOM 0 HB3 ASP A 77 4.798 -5.075 -9.474 1.00 0.00 H new ATOM 672 N LYS A 78 7.754 -4.338 -7.185 1.00 0.00 N ATOM 673 CA LYS A 78 8.035 -3.254 -6.233 1.00 0.00 C ATOM 674 C LYS A 78 7.751 -1.876 -6.858 1.00 0.00 C ATOM 675 O LYS A 78 8.306 -1.535 -7.906 1.00 0.00 O ATOM 676 CB LYS A 78 9.488 -3.376 -5.735 1.00 0.00 C ATOM 677 CG LYS A 78 9.837 -2.318 -4.672 1.00 0.00 C ATOM 678 CD LYS A 78 11.263 -2.520 -4.143 1.00 0.00 C ATOM 679 CE LYS A 78 11.683 -1.333 -3.267 1.00 0.00 C ATOM 680 NZ LYS A 78 13.060 -1.493 -2.744 1.00 0.00 N1+ ATOM 0 H LYS A 78 8.595 -4.729 -7.609 1.00 0.00 H new ATOM 0 HA LYS A 78 7.369 -3.346 -5.375 1.00 0.00 H new ATOM 0 HB2 LYS A 78 9.643 -4.371 -5.318 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.168 -3.275 -6.581 1.00 0.00 H new ATOM 0 HG2 LYS A 78 9.742 -1.321 -5.102 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.127 -2.378 -3.847 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.316 -3.443 -3.565 1.00 0.00 H new ATOM 0 HD3 LYS A 78 11.955 -2.627 -4.978 1.00 0.00 H new ATOM 0 HE2 LYS A 78 11.620 -0.413 -3.848 1.00 0.00 H new ATOM 0 HE3 LYS A 78 10.987 -1.233 -2.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 13.573 -0.593 -2.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.021 -1.767 -1.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.554 -2.231 -3.286 1.00 0.00 H new ATOM 694 N LEU A 79 6.912 -1.071 -6.195 1.00 0.00 N ATOM 695 CA LEU A 79 6.518 0.266 -6.662 1.00 0.00 C ATOM 696 C LEU A 79 7.256 1.397 -5.931 1.00 0.00 C ATOM 697 O LEU A 79 7.701 2.355 -6.566 1.00 0.00 O ATOM 698 CB LEU A 79 4.998 0.430 -6.488 1.00 0.00 C ATOM 699 CG LEU A 79 4.100 -0.602 -7.207 1.00 0.00 C ATOM 700 CD1 LEU A 79 2.654 -0.088 -7.148 1.00 0.00 C ATOM 701 CD2 LEU A 79 4.469 -0.851 -8.673 1.00 0.00 C ATOM 0 H LEU A 79 6.482 -1.332 -5.308 1.00 0.00 H new ATOM 0 HA LEU A 79 6.795 0.343 -7.713 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.772 0.393 -5.422 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.721 1.424 -6.839 1.00 0.00 H new ATOM 0 HG LEU A 79 4.236 -1.554 -6.693 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.995 -0.797 -7.649 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.348 0.019 -6.107 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.591 0.880 -7.646 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.788 -1.588 -9.099 1.00 0.00 H new ATOM 0 HD22 LEU A 79 4.390 0.082 -9.232 1.00 0.00 H new ATOM 0 HD23 LEU A 79 5.491 -1.224 -8.733 1.00 0.00 H new ATOM 713 N ALA A 80 7.391 1.294 -4.606 1.00 0.00 N ATOM 714 CA ALA A 80 7.920 2.338 -3.723 1.00 0.00 C ATOM 715 C ALA A 80 8.455 1.745 -2.408 1.00 0.00 C ATOM 716 O ALA A 80 8.205 0.577 -2.104 1.00 0.00 O ATOM 717 CB ALA A 80 6.813 3.378 -3.475 1.00 0.00 C ATOM 0 H ALA A 80 7.125 0.450 -4.100 1.00 0.00 H new ATOM 0 HA ALA A 80 8.768 2.827 -4.202 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.191 4.162 -2.819 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.506 3.816 -4.425 1.00 0.00 H new ATOM 0 HB3 ALA A 80 5.957 2.893 -3.005 1.00 0.00 H new ATOM 723 N ALA A 81 9.180 2.553 -1.628 1.00 0.00 N ATOM 724 CA ALA A 81 9.789 2.151 -0.358 1.00 0.00 C ATOM 725 C ALA A 81 10.124 3.348 0.550 1.00 0.00 C ATOM 726 O ALA A 81 10.122 4.495 0.099 1.00 0.00 O ATOM 727 CB ALA A 81 11.047 1.321 -0.659 1.00 0.00 C ATOM 0 H ALA A 81 9.363 3.527 -1.869 1.00 0.00 H new ATOM 0 HA ALA A 81 9.064 1.553 0.195 1.00 0.00 H new ATOM 0 HB1 ALA A 81 11.513 1.014 0.277 1.00 0.00 H new ATOM 0 HB2 ALA A 81 10.771 0.437 -1.234 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.751 1.923 -1.234 1.00 0.00 H new ATOM 733 N PHE A 82 10.446 3.067 1.816 1.00 0.00 N ATOM 734 CA PHE A 82 11.011 4.029 2.765 1.00 0.00 C ATOM 735 C PHE A 82 12.065 3.344 3.659 1.00 0.00 C ATOM 736 O PHE A 82 11.726 2.352 4.314 1.00 0.00 O ATOM 737 CB PHE A 82 9.904 4.664 3.615 1.00 0.00 C ATOM 738 CG PHE A 82 10.364 5.834 4.468 1.00 0.00 C ATOM 739 CD1 PHE A 82 11.046 5.619 5.682 1.00 0.00 C ATOM 740 CD2 PHE A 82 10.116 7.152 4.036 1.00 0.00 C ATOM 741 CE1 PHE A 82 11.472 6.711 6.458 1.00 0.00 C ATOM 742 CE2 PHE A 82 10.534 8.244 4.818 1.00 0.00 C ATOM 743 CZ PHE A 82 11.211 8.024 6.029 1.00 0.00 C ATOM 0 H PHE A 82 10.317 2.139 2.219 1.00 0.00 H new ATOM 0 HA PHE A 82 11.502 4.823 2.203 1.00 0.00 H new ATOM 0 HB2 PHE A 82 9.105 5.002 2.956 1.00 0.00 H new ATOM 0 HB3 PHE A 82 9.478 3.900 4.266 1.00 0.00 H new ATOM 0 HD1 PHE A 82 11.242 4.611 6.018 1.00 0.00 H new ATOM 0 HD2 PHE A 82 9.603 7.324 3.101 1.00 0.00 H new ATOM 0 HE1 PHE A 82 12.000 6.541 7.385 1.00 0.00 H new ATOM 0 HE2 PHE A 82 10.334 9.252 4.487 1.00 0.00 H new ATOM 0 HZ PHE A 82 11.531 8.863 6.630 1.00 0.00 H new ATOM 753 N PRO A 83 13.305 3.873 3.745 1.00 0.00 N ATOM 754 CA PRO A 83 13.873 4.937 2.911 1.00 0.00 C ATOM 755 C PRO A 83 13.836 4.600 1.412 1.00 0.00 C ATOM 756 O PRO A 83 13.815 3.428 1.036 1.00 0.00 O ATOM 757 CB PRO A 83 15.316 5.124 3.397 1.00 0.00 C ATOM 758 CG PRO A 83 15.277 4.610 4.834 1.00 0.00 C ATOM 759 CD PRO A 83 14.278 3.460 4.742 1.00 0.00 C ATOM 0 HA PRO A 83 13.286 5.850 3.011 1.00 0.00 H new ATOM 0 HB2 PRO A 83 16.021 4.559 2.788 1.00 0.00 H new ATOM 0 HB3 PRO A 83 15.622 6.169 3.353 1.00 0.00 H new ATOM 0 HG2 PRO A 83 16.257 4.271 5.171 1.00 0.00 H new ATOM 0 HG3 PRO A 83 14.948 5.380 5.532 1.00 0.00 H new ATOM 0 HD2 PRO A 83 14.772 2.533 4.449 1.00 0.00 H new ATOM 0 HD3 PRO A 83 13.801 3.276 5.705 1.00 0.00 H new ATOM 907 N ARG A 94 4.674 8.727 -8.937 1.00 0.00 N ATOM 908 CA ARG A 94 3.286 8.714 -8.454 1.00 0.00 C ATOM 909 C ARG A 94 3.041 7.724 -7.304 1.00 0.00 C ATOM 910 O ARG A 94 2.026 7.843 -6.617 1.00 0.00 O ATOM 911 CB ARG A 94 2.330 8.450 -9.632 1.00 0.00 C ATOM 912 CG ARG A 94 2.447 7.035 -10.231 1.00 0.00 C ATOM 913 CD ARG A 94 1.589 6.873 -11.491 1.00 0.00 C ATOM 914 NE ARG A 94 0.143 6.979 -11.205 1.00 0.00 N ATOM 915 CZ ARG A 94 -0.742 5.989 -11.185 1.00 0.00 C ATOM 916 NH1 ARG A 94 -0.402 4.725 -11.317 1.00 0.00 N1+ ATOM 917 NH2 ARG A 94 -2.016 6.256 -11.041 1.00 0.00 N ATOM 0 HA ARG A 94 3.086 9.699 -8.032 1.00 0.00 H new ATOM 0 HB2 ARG A 94 1.305 8.608 -9.297 1.00 0.00 H new ATOM 0 HB3 ARG A 94 2.525 9.182 -10.416 1.00 0.00 H new ATOM 0 HG2 ARG A 94 3.490 6.829 -10.473 1.00 0.00 H new ATOM 0 HG3 ARG A 94 2.141 6.300 -9.487 1.00 0.00 H new ATOM 0 HD2 ARG A 94 1.869 7.634 -12.219 1.00 0.00 H new ATOM 0 HD3 ARG A 94 1.797 5.905 -11.947 1.00 0.00 H new ATOM 0 HE ARG A 94 -0.214 7.913 -11.001 1.00 0.00 H new ATOM 0 HH11 ARG A 94 0.578 4.471 -11.441 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -1.118 3.999 -11.295 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -2.327 7.223 -10.945 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -2.698 5.497 -11.025 1.00 0.00 H new ATOM 931 N PHE A 95 3.943 6.760 -7.086 1.00 0.00 N ATOM 932 CA PHE A 95 3.928 5.840 -5.945 1.00 0.00 C ATOM 933 C PHE A 95 4.889 6.356 -4.863 1.00 0.00 C ATOM 934 O PHE A 95 6.062 6.608 -5.161 1.00 0.00 O ATOM 935 CB PHE A 95 4.323 4.434 -6.426 1.00 0.00 C ATOM 936 CG PHE A 95 3.536 3.901 -7.613 1.00 0.00 C ATOM 937 CD1 PHE A 95 2.129 3.853 -7.573 1.00 0.00 C ATOM 938 CD2 PHE A 95 4.213 3.421 -8.750 1.00 0.00 C ATOM 939 CE1 PHE A 95 1.408 3.314 -8.654 1.00 0.00 C ATOM 940 CE2 PHE A 95 3.492 2.884 -9.832 1.00 0.00 C ATOM 941 CZ PHE A 95 2.089 2.824 -9.782 1.00 0.00 C ATOM 0 H PHE A 95 4.726 6.594 -7.718 1.00 0.00 H new ATOM 0 HA PHE A 95 2.929 5.785 -5.512 1.00 0.00 H new ATOM 0 HB2 PHE A 95 5.381 4.443 -6.689 1.00 0.00 H new ATOM 0 HB3 PHE A 95 4.207 3.739 -5.594 1.00 0.00 H new ATOM 0 HD1 PHE A 95 1.602 4.231 -6.710 1.00 0.00 H new ATOM 0 HD2 PHE A 95 5.291 3.465 -8.792 1.00 0.00 H new ATOM 0 HE1 PHE A 95 0.329 3.277 -8.617 1.00 0.00 H new ATOM 0 HE2 PHE A 95 4.017 2.518 -10.702 1.00 0.00 H new ATOM 0 HZ PHE A 95 1.535 2.403 -10.608 1.00 0.00 H new ATOM 951 N ARG A 96 4.410 6.534 -3.626 1.00 0.00 N ATOM 952 CA ARG A 96 5.138 7.218 -2.538 1.00 0.00 C ATOM 953 C ARG A 96 4.886 6.556 -1.173 1.00 0.00 C ATOM 954 O ARG A 96 3.828 5.963 -0.964 1.00 0.00 O ATOM 955 CB ARG A 96 4.721 8.706 -2.488 1.00 0.00 C ATOM 956 CG ARG A 96 4.968 9.443 -3.815 1.00 0.00 C ATOM 957 CD ARG A 96 4.626 10.933 -3.745 1.00 0.00 C ATOM 958 NE ARG A 96 4.790 11.534 -5.077 1.00 0.00 N ATOM 959 CZ ARG A 96 4.530 12.782 -5.439 1.00 0.00 C ATOM 960 NH1 ARG A 96 4.089 13.684 -4.587 1.00 0.00 N1+ ATOM 961 NH2 ARG A 96 4.715 13.132 -6.693 1.00 0.00 N ATOM 0 H ARG A 96 3.488 6.202 -3.343 1.00 0.00 H new ATOM 0 HA ARG A 96 6.204 7.139 -2.749 1.00 0.00 H new ATOM 0 HB2 ARG A 96 3.663 8.773 -2.233 1.00 0.00 H new ATOM 0 HB3 ARG A 96 5.273 9.206 -1.692 1.00 0.00 H new ATOM 0 HG2 ARG A 96 6.014 9.329 -4.098 1.00 0.00 H new ATOM 0 HG3 ARG A 96 4.373 8.976 -4.600 1.00 0.00 H new ATOM 0 HD2 ARG A 96 3.602 11.066 -3.397 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.275 11.433 -3.026 1.00 0.00 H new ATOM 0 HE ARG A 96 5.146 10.918 -5.808 1.00 0.00 H new ATOM 0 HH11 ARG A 96 3.936 13.432 -3.611 1.00 0.00 H new ATOM 0 HH12 ARG A 96 3.900 14.635 -4.903 1.00 0.00 H new ATOM 0 HH21 ARG A 96 5.053 12.447 -7.369 1.00 0.00 H new ATOM 0 HH22 ARG A 96 4.520 14.088 -6.990 1.00 0.00 H new ATOM 975 N VAL A 97 5.839 6.666 -0.244 1.00 0.00 N ATOM 976 CA VAL A 97 5.732 6.157 1.143 1.00 0.00 C ATOM 977 C VAL A 97 6.035 7.265 2.161 1.00 0.00 C ATOM 978 O VAL A 97 6.980 8.032 1.969 1.00 0.00 O ATOM 979 CB VAL A 97 6.674 4.954 1.393 1.00 0.00 C ATOM 980 CG1 VAL A 97 6.511 4.391 2.819 1.00 0.00 C ATOM 981 CG2 VAL A 97 6.441 3.829 0.374 1.00 0.00 C ATOM 0 H VAL A 97 6.732 7.121 -0.431 1.00 0.00 H new ATOM 0 HA VAL A 97 4.704 5.819 1.274 1.00 0.00 H new ATOM 0 HB VAL A 97 7.690 5.330 1.276 1.00 0.00 H new ATOM 0 HG11 VAL A 97 7.188 3.548 2.957 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.746 5.168 3.546 1.00 0.00 H new ATOM 0 HG13 VAL A 97 5.483 4.058 2.963 1.00 0.00 H new ATOM 0 HG21 VAL A 97 7.121 3.003 0.582 1.00 0.00 H new ATOM 0 HG22 VAL A 97 5.411 3.479 0.447 1.00 0.00 H new ATOM 0 HG23 VAL A 97 6.625 4.205 -0.632 1.00 0.00 H new ATOM 991 N THR A 98 5.268 7.305 3.260 1.00 0.00 N ATOM 992 CA THR A 98 5.515 8.143 4.447 1.00 0.00 C ATOM 993 C THR A 98 5.602 7.256 5.689 1.00 0.00 C ATOM 994 O THR A 98 4.700 6.461 5.941 1.00 0.00 O ATOM 995 CB THR A 98 4.390 9.174 4.610 1.00 0.00 C ATOM 996 OG1 THR A 98 4.375 10.014 3.476 1.00 0.00 O ATOM 997 CG2 THR A 98 4.579 10.076 5.833 1.00 0.00 C ATOM 0 H THR A 98 4.427 6.735 3.352 1.00 0.00 H new ATOM 0 HA THR A 98 6.457 8.676 4.320 1.00 0.00 H new ATOM 0 HB THR A 98 3.464 8.613 4.732 1.00 0.00 H new ATOM 0 HG1 THR A 98 3.658 10.676 3.569 1.00 0.00 H new ATOM 0 HG21 THR A 98 3.752 10.784 5.894 1.00 0.00 H new ATOM 0 HG22 THR A 98 4.602 9.465 6.736 1.00 0.00 H new ATOM 0 HG23 THR A 98 5.518 10.622 5.741 1.00 0.00 H new ATOM 1005 N GLN A 99 6.662 7.410 6.485 1.00 0.00 N ATOM 1006 CA GLN A 99 6.790 6.786 7.807 1.00 0.00 C ATOM 1007 C GLN A 99 6.123 7.668 8.876 1.00 0.00 C ATOM 1008 O GLN A 99 6.285 8.892 8.872 1.00 0.00 O ATOM 1009 CB GLN A 99 8.281 6.557 8.114 1.00 0.00 C ATOM 1010 CG GLN A 99 8.520 5.855 9.460 1.00 0.00 C ATOM 1011 CD GLN A 99 10.010 5.625 9.723 1.00 0.00 C ATOM 1012 OE1 GLN A 99 10.713 6.466 10.271 1.00 0.00 O ATOM 1013 NE2 GLN A 99 10.554 4.490 9.335 1.00 0.00 N ATOM 0 H GLN A 99 7.468 7.979 6.227 1.00 0.00 H new ATOM 0 HA GLN A 99 6.282 5.822 7.814 1.00 0.00 H new ATOM 0 HB2 GLN A 99 8.722 5.959 7.316 1.00 0.00 H new ATOM 0 HB3 GLN A 99 8.797 7.517 8.115 1.00 0.00 H new ATOM 0 HG2 GLN A 99 8.097 6.457 10.264 1.00 0.00 H new ATOM 0 HG3 GLN A 99 7.997 4.899 9.469 1.00 0.00 H new ATOM 0 HE21 GLN A 99 9.982 3.780 8.878 1.00 0.00 H new ATOM 0 HE22 GLN A 99 11.548 4.321 9.492 1.00 0.00 H new ATOM 1022 N LEU A 100 5.387 7.051 9.808 1.00 0.00 N ATOM 1023 CA LEU A 100 4.668 7.740 10.885 1.00 0.00 C ATOM 1024 C LEU A 100 5.532 7.878 12.158 1.00 0.00 C ATOM 1025 O LEU A 100 6.424 7.049 12.380 1.00 0.00 O ATOM 1026 CB LEU A 100 3.362 6.973 11.193 1.00 0.00 C ATOM 1027 CG LEU A 100 2.458 6.675 9.978 1.00 0.00 C ATOM 1028 CD1 LEU A 100 1.141 6.050 10.454 1.00 0.00 C ATOM 1029 CD2 LEU A 100 2.150 7.922 9.141 1.00 0.00 C ATOM 0 H LEU A 100 5.273 6.038 9.835 1.00 0.00 H new ATOM 0 HA LEU A 100 4.432 8.751 10.552 1.00 0.00 H new ATOM 0 HB2 LEU A 100 3.621 6.028 11.670 1.00 0.00 H new ATOM 0 HB3 LEU A 100 2.787 7.549 11.918 1.00 0.00 H new ATOM 0 HG LEU A 100 3.006 5.982 9.340 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.505 5.841 9.593 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.350 5.121 10.985 1.00 0.00 H new ATOM 0 HD13 LEU A 100 0.630 6.743 11.123 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.511 7.648 8.302 1.00 0.00 H new ATOM 0 HD22 LEU A 100 1.639 8.659 9.761 1.00 0.00 H new ATOM 0 HD23 LEU A 100 3.081 8.347 8.765 1.00 0.00 H new ATOM 1041 N PRO A 101 5.234 8.851 13.049 1.00 0.00 N ATOM 1042 CA PRO A 101 5.911 9.006 14.339 1.00 0.00 C ATOM 1043 C PRO A 101 5.643 7.856 15.331 1.00 0.00 C ATOM 1044 O PRO A 101 6.254 7.830 16.399 1.00 0.00 O ATOM 1045 CB PRO A 101 5.440 10.359 14.887 1.00 0.00 C ATOM 1046 CG PRO A 101 4.060 10.535 14.259 1.00 0.00 C ATOM 1047 CD PRO A 101 4.247 9.914 12.877 1.00 0.00 C ATOM 0 HA PRO A 101 6.992 8.971 14.201 1.00 0.00 H new ATOM 0 HB2 PRO A 101 5.388 10.355 15.976 1.00 0.00 H new ATOM 0 HB3 PRO A 101 6.116 11.165 14.603 1.00 0.00 H new ATOM 0 HG2 PRO A 101 3.285 10.026 14.832 1.00 0.00 H new ATOM 0 HG3 PRO A 101 3.773 11.585 14.197 1.00 0.00 H new ATOM 0 HD2 PRO A 101 3.306 9.516 12.496 1.00 0.00 H new ATOM 0 HD3 PRO A 101 4.593 10.657 12.158 1.00 0.00 H new ATOM 1055 N ASN A 102 4.785 6.880 14.992 1.00 0.00 N ATOM 1056 CA ASN A 102 4.603 5.642 15.767 1.00 0.00 C ATOM 1057 C ASN A 102 5.860 4.727 15.752 1.00 0.00 C ATOM 1058 O ASN A 102 5.967 3.790 16.547 1.00 0.00 O ATOM 1059 CB ASN A 102 3.348 4.930 15.225 1.00 0.00 C ATOM 1060 CG ASN A 102 2.794 3.833 16.138 1.00 0.00 C ATOM 1061 OD1 ASN A 102 3.033 3.795 17.340 1.00 0.00 O ATOM 1062 ND2 ASN A 102 2.003 2.920 15.602 1.00 0.00 N ATOM 0 H ASN A 102 4.192 6.929 14.163 1.00 0.00 H new ATOM 0 HA ASN A 102 4.463 5.890 16.819 1.00 0.00 H new ATOM 0 HB2 ASN A 102 2.568 5.673 15.057 1.00 0.00 H new ATOM 0 HB3 ASN A 102 3.585 4.492 14.255 1.00 0.00 H new ATOM 0 HD21 ASN A 102 1.596 2.191 16.187 1.00 0.00 H new ATOM 0 HD22 ASN A 102 1.799 2.945 14.603 1.00 0.00 H new ATOM 1069 N GLY A 103 6.827 4.987 14.855 1.00 0.00 N ATOM 1070 CA GLY A 103 8.175 4.387 14.837 1.00 0.00 C ATOM 1071 C GLY A 103 8.329 3.123 13.984 1.00 0.00 C ATOM 1072 O GLY A 103 9.433 2.841 13.516 1.00 0.00 O ATOM 0 H GLY A 103 6.686 5.648 14.091 1.00 0.00 H new ATOM 0 HA2 GLY A 103 8.881 5.135 14.476 1.00 0.00 H new ATOM 0 HA3 GLY A 103 8.460 4.148 15.862 1.00 0.00 H new ATOM 1076 N ARG A 104 7.236 2.387 13.750 1.00 0.00 N ATOM 1077 CA ARG A 104 7.156 1.244 12.826 1.00 0.00 C ATOM 1078 C ARG A 104 5.710 1.069 12.344 1.00 0.00 C ATOM 1079 O ARG A 104 4.976 0.159 12.728 1.00 0.00 O ATOM 1080 CB ARG A 104 7.796 -0.026 13.432 1.00 0.00 C ATOM 1081 CG ARG A 104 7.471 -0.309 14.912 1.00 0.00 C ATOM 1082 CD ARG A 104 8.137 -1.601 15.409 1.00 0.00 C ATOM 1083 NE ARG A 104 9.613 -1.521 15.388 1.00 0.00 N ATOM 1084 CZ ARG A 104 10.456 -2.527 15.599 1.00 0.00 C ATOM 1085 NH1 ARG A 104 10.032 -3.726 15.941 1.00 0.00 N1+ ATOM 1086 NH2 ARG A 104 11.749 -2.346 15.467 1.00 0.00 N ATOM 0 H ARG A 104 6.348 2.576 14.215 1.00 0.00 H new ATOM 0 HA ARG A 104 7.754 1.444 11.937 1.00 0.00 H new ATOM 0 HB2 ARG A 104 7.479 -0.885 12.841 1.00 0.00 H new ATOM 0 HB3 ARG A 104 8.878 0.052 13.327 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.804 0.529 15.523 1.00 0.00 H new ATOM 0 HG3 ARG A 104 6.391 -0.386 15.038 1.00 0.00 H new ATOM 0 HD2 ARG A 104 7.802 -1.811 16.425 1.00 0.00 H new ATOM 0 HD3 ARG A 104 7.813 -2.436 14.787 1.00 0.00 H new ATOM 0 HE ARG A 104 10.023 -0.608 15.193 1.00 0.00 H new ATOM 0 HH11 ARG A 104 9.033 -3.902 16.050 1.00 0.00 H new ATOM 0 HH12 ARG A 104 10.702 -4.479 16.096 1.00 0.00 H new ATOM 0 HH21 ARG A 104 12.111 -1.430 15.201 1.00 0.00 H new ATOM 0 HH22 ARG A 104 12.392 -3.121 15.630 1.00 0.00 H new ATOM 1100 N ASP A 105 5.329 1.992 11.466 1.00 0.00 N ATOM 1101 CA ASP A 105 3.985 2.233 10.934 1.00 0.00 C ATOM 1102 C ASP A 105 4.128 3.209 9.762 1.00 0.00 C ATOM 1103 O ASP A 105 4.915 4.160 9.834 1.00 0.00 O ATOM 1104 CB ASP A 105 3.083 2.817 12.030 1.00 0.00 C ATOM 1105 CG ASP A 105 1.575 2.587 11.858 1.00 0.00 C ATOM 1106 OD1 ASP A 105 1.106 2.303 10.734 1.00 0.00 O1- ATOM 1107 OD2 ASP A 105 0.869 2.707 12.887 1.00 0.00 O ATOM 0 H ASP A 105 6.006 2.646 11.074 1.00 0.00 H new ATOM 0 HA ASP A 105 3.525 1.305 10.595 1.00 0.00 H new ATOM 0 HB2 ASP A 105 3.388 2.393 12.987 1.00 0.00 H new ATOM 0 HB3 ASP A 105 3.262 3.891 12.086 1.00 0.00 H new ATOM 1112 N PHE A 106 3.414 2.944 8.672 1.00 0.00 N ATOM 1113 CA PHE A 106 3.637 3.620 7.389 1.00 0.00 C ATOM 1114 C PHE A 106 2.361 3.771 6.553 1.00 0.00 C ATOM 1115 O PHE A 106 1.515 2.877 6.521 1.00 0.00 O ATOM 1116 CB PHE A 106 4.657 2.821 6.559 1.00 0.00 C ATOM 1117 CG PHE A 106 6.052 2.620 7.139 1.00 0.00 C ATOM 1118 CD1 PHE A 106 6.274 1.655 8.141 1.00 0.00 C ATOM 1119 CD2 PHE A 106 7.153 3.308 6.593 1.00 0.00 C ATOM 1120 CE1 PHE A 106 7.573 1.393 8.608 1.00 0.00 C ATOM 1121 CE2 PHE A 106 8.458 3.019 7.036 1.00 0.00 C ATOM 1122 CZ PHE A 106 8.669 2.059 8.039 1.00 0.00 C ATOM 0 H PHE A 106 2.663 2.255 8.649 1.00 0.00 H new ATOM 0 HA PHE A 106 4.001 4.619 7.627 1.00 0.00 H new ATOM 0 HB2 PHE A 106 4.231 1.837 6.365 1.00 0.00 H new ATOM 0 HB3 PHE A 106 4.765 3.318 5.595 1.00 0.00 H new ATOM 0 HD1 PHE A 106 5.437 1.111 8.554 1.00 0.00 H new ATOM 0 HD2 PHE A 106 6.996 4.059 5.833 1.00 0.00 H new ATOM 0 HE1 PHE A 106 7.728 0.680 9.404 1.00 0.00 H new ATOM 0 HE2 PHE A 106 9.300 3.538 6.603 1.00 0.00 H new ATOM 0 HZ PHE A 106 9.672 1.834 8.371 1.00 0.00 H new ATOM 1132 N HIS A 107 2.285 4.874 5.804 1.00 0.00 N ATOM 1133 CA HIS A 107 1.284 5.123 4.763 1.00 0.00 C ATOM 1134 C HIS A 107 1.902 4.991 3.354 1.00 0.00 C ATOM 1135 O HIS A 107 2.948 5.583 3.075 1.00 0.00 O ATOM 1136 CB HIS A 107 0.681 6.526 4.943 1.00 0.00 C ATOM 1137 CG HIS A 107 -0.257 6.687 6.113 1.00 0.00 C ATOM 1138 ND1 HIS A 107 -0.889 5.659 6.820 1.00 0.00 N ATOM 1139 CD2 HIS A 107 -0.670 7.885 6.617 1.00 0.00 C ATOM 1140 CE1 HIS A 107 -1.646 6.269 7.746 1.00 0.00 C ATOM 1141 NE2 HIS A 107 -1.537 7.605 7.649 1.00 0.00 N ATOM 0 H HIS A 107 2.943 5.646 5.910 1.00 0.00 H new ATOM 0 HA HIS A 107 0.497 4.375 4.860 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.496 7.241 5.053 1.00 0.00 H new ATOM 0 HB3 HIS A 107 0.145 6.791 4.032 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -0.374 8.865 6.273 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -2.260 5.755 8.471 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -2.013 8.290 8.236 1.00 0.00 H new ATOM 1149 N MET A 108 1.231 4.259 2.460 1.00 0.00 N ATOM 1150 CA MET A 108 1.601 4.047 1.054 1.00 0.00 C ATOM 1151 C MET A 108 0.582 4.738 0.153 1.00 0.00 C ATOM 1152 O MET A 108 -0.602 4.411 0.193 1.00 0.00 O ATOM 1153 CB MET A 108 1.626 2.543 0.734 1.00 0.00 C ATOM 1154 CG MET A 108 3.003 1.922 0.973 1.00 0.00 C ATOM 1155 SD MET A 108 3.748 2.078 2.613 1.00 0.00 S ATOM 1156 CE MET A 108 2.489 1.196 3.544 1.00 0.00 C ATOM 0 H MET A 108 0.370 3.772 2.709 1.00 0.00 H new ATOM 0 HA MET A 108 2.593 4.465 0.880 1.00 0.00 H new ATOM 0 HB2 MET A 108 0.887 2.030 1.350 1.00 0.00 H new ATOM 0 HB3 MET A 108 1.336 2.390 -0.306 1.00 0.00 H new ATOM 0 HG2 MET A 108 2.932 0.859 0.741 1.00 0.00 H new ATOM 0 HG3 MET A 108 3.694 2.360 0.252 1.00 0.00 H new ATOM 0 HE1 MET A 108 2.965 0.588 4.313 1.00 0.00 H new ATOM 0 HE2 MET A 108 1.815 1.912 4.013 1.00 0.00 H new ATOM 0 HE3 MET A 108 1.923 0.552 2.871 1.00 0.00 H new ATOM 1166 N SER A 109 1.036 5.678 -0.667 1.00 0.00 N ATOM 1167 CA SER A 109 0.181 6.584 -1.440 1.00 0.00 C ATOM 1168 C SER A 109 0.340 6.381 -2.957 1.00 0.00 C ATOM 1169 O SER A 109 1.459 6.390 -3.475 1.00 0.00 O ATOM 1170 CB SER A 109 0.523 8.043 -1.097 1.00 0.00 C ATOM 1171 OG SER A 109 0.405 8.300 0.298 1.00 0.00 O ATOM 0 H SER A 109 2.032 5.839 -0.820 1.00 0.00 H new ATOM 0 HA SER A 109 -0.851 6.358 -1.173 1.00 0.00 H new ATOM 0 HB2 SER A 109 1.539 8.264 -1.423 1.00 0.00 H new ATOM 0 HB3 SER A 109 -0.140 8.711 -1.647 1.00 0.00 H new ATOM 0 HG SER A 109 0.632 9.236 0.478 1.00 0.00 H new ATOM 1177 N VAL A 110 -0.779 6.251 -3.675 1.00 0.00 N ATOM 1178 CA VAL A 110 -0.867 6.280 -5.143 1.00 0.00 C ATOM 1179 C VAL A 110 -1.472 7.632 -5.532 1.00 0.00 C ATOM 1180 O VAL A 110 -2.647 7.895 -5.268 1.00 0.00 O ATOM 1181 CB VAL A 110 -1.726 5.125 -5.716 1.00 0.00 C ATOM 1182 CG1 VAL A 110 -1.750 5.173 -7.256 1.00 0.00 C ATOM 1183 CG2 VAL A 110 -1.234 3.744 -5.247 1.00 0.00 C ATOM 0 H VAL A 110 -1.689 6.117 -3.233 1.00 0.00 H new ATOM 0 HA VAL A 110 0.130 6.148 -5.562 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.737 5.267 -5.334 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.359 4.353 -7.636 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.174 6.122 -7.584 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.734 5.078 -7.639 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -1.868 2.967 -5.675 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.205 3.594 -5.574 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.280 3.691 -4.159 1.00 0.00 H new ATOM 1193 N VAL A 111 -0.655 8.488 -6.144 1.00 0.00 N ATOM 1194 CA VAL A 111 -1.052 9.821 -6.623 1.00 0.00 C ATOM 1195 C VAL A 111 -1.861 9.681 -7.917 1.00 0.00 C ATOM 1196 O VAL A 111 -1.379 9.100 -8.890 1.00 0.00 O ATOM 1197 CB VAL A 111 0.178 10.741 -6.828 1.00 0.00 C ATOM 1198 CG1 VAL A 111 -0.202 12.109 -7.419 1.00 0.00 C ATOM 1199 CG2 VAL A 111 0.915 10.972 -5.495 1.00 0.00 C ATOM 0 H VAL A 111 0.325 8.274 -6.327 1.00 0.00 H new ATOM 0 HA VAL A 111 -1.677 10.292 -5.864 1.00 0.00 H new ATOM 0 HB VAL A 111 0.827 10.226 -7.536 1.00 0.00 H new ATOM 0 HG11 VAL A 111 0.696 12.714 -7.542 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -0.680 11.967 -8.388 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -0.892 12.617 -6.746 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.775 11.620 -5.662 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.238 11.443 -4.782 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.254 10.016 -5.096 1.00 0.00 H new ATOM 1209 N ARG A 112 -3.088 10.227 -7.912 1.00 0.00 N ATOM 1210 CA ARG A 112 -4.022 10.273 -9.052 1.00 0.00 C ATOM 1211 C ARG A 112 -4.260 8.879 -9.642 1.00 0.00 C ATOM 1212 O ARG A 112 -3.740 8.529 -10.703 1.00 0.00 O ATOM 1213 CB ARG A 112 -3.552 11.292 -10.108 1.00 0.00 C ATOM 1214 CG ARG A 112 -3.583 12.717 -9.540 1.00 0.00 C ATOM 1215 CD ARG A 112 -3.140 13.746 -10.583 1.00 0.00 C ATOM 1216 NE ARG A 112 -3.195 15.113 -10.034 1.00 0.00 N ATOM 1217 CZ ARG A 112 -2.829 16.228 -10.658 1.00 0.00 C ATOM 1218 NH1 ARG A 112 -2.353 16.219 -11.887 1.00 0.00 N1+ ATOM 1219 NH2 ARG A 112 -2.937 17.385 -10.042 1.00 0.00 N ATOM 0 H ARG A 112 -3.474 10.668 -7.077 1.00 0.00 H new ATOM 0 HA ARG A 112 -4.989 10.618 -8.685 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -2.541 11.047 -10.432 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -4.192 11.232 -10.988 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -4.592 12.953 -9.200 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -2.931 12.777 -8.669 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -2.125 13.523 -10.911 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -3.781 13.677 -11.462 1.00 0.00 H new ATOM 0 HE ARG A 112 -3.548 15.213 -9.082 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -2.256 15.337 -12.390 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -2.082 17.094 -12.335 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -3.300 17.424 -9.090 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -2.657 18.243 -10.517 1.00 0.00 H new ATOM 1233 N ALA A 113 -5.020 8.058 -8.923 1.00 0.00 N ATOM 1234 CA ALA A 113 -5.343 6.688 -9.311 1.00 0.00 C ATOM 1235 C ALA A 113 -6.334 6.660 -10.493 1.00 0.00 C ATOM 1236 O ALA A 113 -7.337 7.374 -10.479 1.00 0.00 O ATOM 1237 CB ALA A 113 -5.881 5.979 -8.067 1.00 0.00 C ATOM 0 H ALA A 113 -5.438 8.333 -8.034 1.00 0.00 H new ATOM 0 HA ALA A 113 -4.457 6.164 -9.670 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -6.135 4.949 -8.317 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -5.120 5.986 -7.286 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -6.772 6.496 -7.710 1.00 0.00 H new ATOM 1243 N ARG A 114 -6.044 5.852 -11.516 1.00 0.00 N ATOM 1244 CA ARG A 114 -6.871 5.637 -12.717 1.00 0.00 C ATOM 1245 C ARG A 114 -7.533 4.253 -12.661 1.00 0.00 C ATOM 1246 O ARG A 114 -7.061 3.385 -11.928 1.00 0.00 O ATOM 1247 CB ARG A 114 -5.999 5.777 -13.986 1.00 0.00 C ATOM 1248 CG ARG A 114 -5.859 7.210 -14.535 1.00 0.00 C ATOM 1249 CD ARG A 114 -5.487 8.260 -13.483 1.00 0.00 C ATOM 1250 NE ARG A 114 -5.155 9.561 -14.088 1.00 0.00 N ATOM 1251 CZ ARG A 114 -5.998 10.545 -14.384 1.00 0.00 C ATOM 1252 NH1 ARG A 114 -7.302 10.441 -14.234 1.00 0.00 N1+ ATOM 1253 NH2 ARG A 114 -5.523 11.681 -14.849 1.00 0.00 N ATOM 0 H ARG A 114 -5.186 5.301 -11.535 1.00 0.00 H new ATOM 0 HA ARG A 114 -7.657 6.391 -12.752 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -5.004 5.391 -13.767 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -6.421 5.146 -14.768 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -5.100 7.213 -15.317 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -6.800 7.500 -15.002 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -6.317 8.386 -12.788 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -4.636 7.904 -12.902 1.00 0.00 H new ATOM 0 HE ARG A 114 -4.171 9.725 -14.303 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -7.707 9.576 -13.876 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -7.907 11.226 -14.476 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -4.518 11.799 -14.979 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -6.160 12.444 -15.080 1.00 0.00 H new ATOM 1267 N ARG A 115 -8.595 4.001 -13.442 1.00 0.00 N ATOM 1268 CA ARG A 115 -9.327 2.713 -13.428 1.00 0.00 C ATOM 1269 C ARG A 115 -8.406 1.484 -13.572 1.00 0.00 C ATOM 1270 O ARG A 115 -8.614 0.472 -12.900 1.00 0.00 O ATOM 1271 CB ARG A 115 -10.442 2.692 -14.490 1.00 0.00 C ATOM 1272 CG ARG A 115 -11.557 3.724 -14.216 1.00 0.00 C ATOM 1273 CD ARG A 115 -12.961 3.147 -14.418 1.00 0.00 C ATOM 1274 NE ARG A 115 -13.330 2.259 -13.301 1.00 0.00 N ATOM 1275 CZ ARG A 115 -14.431 1.527 -13.196 1.00 0.00 C ATOM 1276 NH1 ARG A 115 -15.351 1.504 -14.136 1.00 0.00 N1+ ATOM 1277 NH2 ARG A 115 -14.610 0.796 -12.118 1.00 0.00 N ATOM 0 H ARG A 115 -8.974 4.680 -14.102 1.00 0.00 H new ATOM 0 HA ARG A 115 -9.784 2.640 -12.441 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -10.006 2.888 -15.470 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -10.880 1.695 -14.529 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -11.463 4.091 -13.194 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -11.423 4.581 -14.876 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -13.684 3.959 -14.497 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -13.000 2.593 -15.356 1.00 0.00 H new ATOM 0 HE ARG A 115 -12.669 2.201 -12.527 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -15.230 2.062 -14.981 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -16.185 0.928 -14.019 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -13.908 0.798 -11.378 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -15.451 0.227 -12.021 1.00 0.00 H new ATOM 1291 N ASN A 116 -7.340 1.608 -14.369 1.00 0.00 N ATOM 1292 CA ASN A 116 -6.309 0.584 -14.582 1.00 0.00 C ATOM 1293 C ASN A 116 -5.495 0.200 -13.318 1.00 0.00 C ATOM 1294 O ASN A 116 -4.920 -0.888 -13.281 1.00 0.00 O ATOM 1295 CB ASN A 116 -5.383 1.092 -15.701 1.00 0.00 C ATOM 1296 CG ASN A 116 -4.367 0.043 -16.151 1.00 0.00 C ATOM 1297 OD1 ASN A 116 -4.716 -0.968 -16.749 1.00 0.00 O ATOM 1298 ND2 ASN A 116 -3.090 0.248 -15.878 1.00 0.00 N ATOM 0 H ASN A 116 -7.164 2.458 -14.905 1.00 0.00 H new ATOM 0 HA ASN A 116 -6.813 -0.342 -14.858 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -5.987 1.396 -16.556 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -4.853 1.979 -15.353 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -2.391 -0.437 -16.165 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -2.804 1.091 -15.380 1.00 0.00 H new ATOM 1305 N ASP A 117 -5.443 1.047 -12.278 1.00 0.00 N ATOM 1306 CA ASP A 117 -4.738 0.749 -11.020 1.00 0.00 C ATOM 1307 C ASP A 117 -5.509 -0.230 -10.111 1.00 0.00 C ATOM 1308 O ASP A 117 -4.940 -0.732 -9.147 1.00 0.00 O ATOM 1309 CB ASP A 117 -4.440 2.044 -10.244 1.00 0.00 C ATOM 1310 CG ASP A 117 -3.453 2.978 -10.953 1.00 0.00 C ATOM 1311 OD1 ASP A 117 -2.292 2.581 -11.204 1.00 0.00 O1- ATOM 1312 OD2 ASP A 117 -3.814 4.149 -11.203 1.00 0.00 O ATOM 0 H ASP A 117 -5.891 1.963 -12.286 1.00 0.00 H new ATOM 0 HA ASP A 117 -3.805 0.263 -11.304 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -5.375 2.579 -10.076 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -4.040 1.785 -9.264 1.00 0.00 H new ATOM 1317 N SER A 118 -6.784 -0.528 -10.380 1.00 0.00 N ATOM 1318 CA SER A 118 -7.564 -1.454 -9.541 1.00 0.00 C ATOM 1319 C SER A 118 -6.979 -2.882 -9.543 1.00 0.00 C ATOM 1320 O SER A 118 -6.694 -3.450 -10.605 1.00 0.00 O ATOM 1321 CB SER A 118 -9.038 -1.493 -9.976 1.00 0.00 C ATOM 1322 OG SER A 118 -9.611 -0.193 -10.058 1.00 0.00 O ATOM 0 H SER A 118 -7.301 -0.144 -11.171 1.00 0.00 H new ATOM 0 HA SER A 118 -7.504 -1.070 -8.523 1.00 0.00 H new ATOM 0 HB2 SER A 118 -9.115 -1.984 -10.946 1.00 0.00 H new ATOM 0 HB3 SER A 118 -9.608 -2.095 -9.268 1.00 0.00 H new ATOM 0 HG SER A 118 -9.395 0.205 -10.927 1.00 0.00 H new ATOM 1328 N GLY A 119 -6.804 -3.475 -8.355 1.00 0.00 N ATOM 1329 CA GLY A 119 -6.135 -4.772 -8.164 1.00 0.00 C ATOM 1330 C GLY A 119 -5.572 -4.972 -6.756 1.00 0.00 C ATOM 1331 O GLY A 119 -5.892 -4.206 -5.845 1.00 0.00 O ATOM 0 H GLY A 119 -7.129 -3.060 -7.482 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.844 -5.572 -8.379 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -5.324 -4.862 -8.886 1.00 0.00 H new ATOM 1335 N THR A 120 -4.755 -6.017 -6.572 1.00 0.00 N ATOM 1336 CA THR A 120 -4.191 -6.421 -5.270 1.00 0.00 C ATOM 1337 C THR A 120 -2.792 -5.846 -5.072 1.00 0.00 C ATOM 1338 O THR A 120 -1.982 -5.801 -6.001 1.00 0.00 O ATOM 1339 CB THR A 120 -4.146 -7.946 -5.123 1.00 0.00 C ATOM 1340 OG1 THR A 120 -5.326 -8.517 -5.654 1.00 0.00 O ATOM 1341 CG2 THR A 120 -4.042 -8.384 -3.662 1.00 0.00 C ATOM 0 H THR A 120 -4.459 -6.621 -7.339 1.00 0.00 H new ATOM 0 HA THR A 120 -4.851 -6.018 -4.502 1.00 0.00 H new ATOM 0 HB THR A 120 -3.261 -8.285 -5.662 1.00 0.00 H new ATOM 0 HG1 THR A 120 -5.290 -9.492 -5.558 1.00 0.00 H new ATOM 0 HG21 THR A 120 -4.013 -9.472 -3.610 1.00 0.00 H new ATOM 0 HG22 THR A 120 -3.132 -7.975 -3.224 1.00 0.00 H new ATOM 0 HG23 THR A 120 -4.907 -8.017 -3.110 1.00 0.00 H new ATOM 1349 N TYR A 121 -2.503 -5.453 -3.835 1.00 0.00 N ATOM 1350 CA TYR A 121 -1.255 -4.822 -3.398 1.00 0.00 C ATOM 1351 C TYR A 121 -0.893 -5.246 -1.956 1.00 0.00 C ATOM 1352 O TYR A 121 -1.764 -5.701 -1.210 1.00 0.00 O ATOM 1353 CB TYR A 121 -1.392 -3.294 -3.471 1.00 0.00 C ATOM 1354 CG TYR A 121 -1.635 -2.688 -4.842 1.00 0.00 C ATOM 1355 CD1 TYR A 121 -2.950 -2.552 -5.339 1.00 0.00 C ATOM 1356 CD2 TYR A 121 -0.548 -2.217 -5.609 1.00 0.00 C ATOM 1357 CE1 TYR A 121 -3.175 -1.988 -6.607 1.00 0.00 C ATOM 1358 CE2 TYR A 121 -0.778 -1.629 -6.865 1.00 0.00 C ATOM 1359 CZ TYR A 121 -2.086 -1.521 -7.373 1.00 0.00 C ATOM 1360 OH TYR A 121 -2.279 -0.969 -8.601 1.00 0.00 O ATOM 0 H TYR A 121 -3.165 -5.571 -3.068 1.00 0.00 H new ATOM 0 HA TYR A 121 -0.455 -5.150 -4.062 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -2.213 -2.996 -2.819 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.483 -2.853 -3.062 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -3.787 -2.883 -4.742 1.00 0.00 H new ATOM 0 HD2 TYR A 121 0.460 -2.308 -5.231 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -4.180 -1.912 -6.994 1.00 0.00 H new ATOM 0 HE2 TYR A 121 0.055 -1.258 -7.444 1.00 0.00 H new ATOM 0 HH TYR A 121 -3.237 -0.822 -8.747 1.00 0.00 H new ATOM 1370 N LEU A 122 0.367 -5.095 -1.529 1.00 0.00 N ATOM 1371 CA LEU A 122 0.849 -5.551 -0.212 1.00 0.00 C ATOM 1372 C LEU A 122 2.164 -4.898 0.231 1.00 0.00 C ATOM 1373 O LEU A 122 2.863 -4.273 -0.564 1.00 0.00 O ATOM 1374 CB LEU A 122 0.945 -7.095 -0.153 1.00 0.00 C ATOM 1375 CG LEU A 122 2.058 -7.763 -0.991 1.00 0.00 C ATOM 1376 CD1 LEU A 122 2.311 -9.188 -0.473 1.00 0.00 C ATOM 1377 CD2 LEU A 122 1.691 -7.846 -2.480 1.00 0.00 C ATOM 0 H LEU A 122 1.091 -4.648 -2.092 1.00 0.00 H new ATOM 0 HA LEU A 122 0.098 -5.219 0.505 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.085 -7.386 0.888 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.012 -7.506 -0.473 1.00 0.00 H new ATOM 0 HG LEU A 122 2.951 -7.146 -0.890 1.00 0.00 H new ATOM 0 HD11 LEU A 122 3.096 -9.657 -1.066 1.00 0.00 H new ATOM 0 HD12 LEU A 122 2.621 -9.146 0.571 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.395 -9.773 -0.556 1.00 0.00 H new ATOM 0 HD21 LEU A 122 2.503 -8.323 -3.029 1.00 0.00 H new ATOM 0 HD22 LEU A 122 0.780 -8.433 -2.598 1.00 0.00 H new ATOM 0 HD23 LEU A 122 1.529 -6.842 -2.871 1.00 0.00 H new ATOM 1389 N CYS A 123 2.524 -5.101 1.499 1.00 0.00 N ATOM 1390 CA CYS A 123 3.783 -4.652 2.102 1.00 0.00 C ATOM 1391 C CYS A 123 4.759 -5.814 2.352 1.00 0.00 C ATOM 1392 O CYS A 123 4.348 -6.928 2.686 1.00 0.00 O ATOM 1393 CB CYS A 123 3.470 -3.962 3.433 1.00 0.00 C ATOM 1394 SG CYS A 123 3.043 -2.213 3.320 1.00 0.00 S ATOM 0 H CYS A 123 1.927 -5.600 2.159 1.00 0.00 H new ATOM 0 HA CYS A 123 4.264 -3.966 1.405 1.00 0.00 H new ATOM 0 HB2 CYS A 123 2.644 -4.490 3.910 1.00 0.00 H new ATOM 0 HB3 CYS A 123 4.335 -4.065 4.088 1.00 0.00 H new ATOM 1399 N GLY A 124 6.061 -5.526 2.259 1.00 0.00 N ATOM 1400 CA GLY A 124 7.153 -6.416 2.675 1.00 0.00 C ATOM 1401 C GLY A 124 8.334 -5.629 3.235 1.00 0.00 C ATOM 1402 O GLY A 124 8.725 -4.616 2.656 1.00 0.00 O ATOM 0 H GLY A 124 6.396 -4.640 1.881 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.788 -7.113 3.430 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.482 -7.012 1.824 1.00 0.00 H new ATOM 1406 N ALA A 125 8.905 -6.081 4.353 1.00 0.00 N ATOM 1407 CA ALA A 125 9.990 -5.391 5.056 1.00 0.00 C ATOM 1408 C ALA A 125 11.310 -6.176 5.031 1.00 0.00 C ATOM 1409 O ALA A 125 11.317 -7.399 4.906 1.00 0.00 O ATOM 1410 CB ALA A 125 9.551 -5.116 6.498 1.00 0.00 C ATOM 0 H ALA A 125 8.622 -6.951 4.803 1.00 0.00 H new ATOM 0 HA ALA A 125 10.186 -4.453 4.536 1.00 0.00 H new ATOM 0 HB1 ALA A 125 10.352 -4.603 7.030 1.00 0.00 H new ATOM 0 HB2 ALA A 125 8.659 -4.490 6.494 1.00 0.00 H new ATOM 0 HB3 ALA A 125 9.330 -6.059 6.997 1.00 0.00 H new ATOM 1416 N ILE A 126 12.430 -5.472 5.210 1.00 0.00 N ATOM 1417 CA ILE A 126 13.774 -6.047 5.379 1.00 0.00 C ATOM 1418 C ILE A 126 14.584 -5.217 6.387 1.00 0.00 C ATOM 1419 O ILE A 126 14.601 -3.988 6.324 1.00 0.00 O ATOM 1420 CB ILE A 126 14.474 -6.198 4.005 1.00 0.00 C ATOM 1421 CG1 ILE A 126 15.787 -6.992 4.156 1.00 0.00 C ATOM 1422 CG2 ILE A 126 14.726 -4.845 3.321 1.00 0.00 C ATOM 1423 CD1 ILE A 126 16.454 -7.354 2.825 1.00 0.00 C ATOM 0 H ILE A 126 12.430 -4.453 5.243 1.00 0.00 H new ATOM 0 HA ILE A 126 13.695 -7.051 5.795 1.00 0.00 H new ATOM 0 HB ILE A 126 13.797 -6.754 3.357 1.00 0.00 H new ATOM 0 HG12 ILE A 126 16.486 -6.407 4.754 1.00 0.00 H new ATOM 0 HG13 ILE A 126 15.583 -7.909 4.710 1.00 0.00 H new ATOM 0 HG21 ILE A 126 15.218 -5.008 2.362 1.00 0.00 H new ATOM 0 HG22 ILE A 126 13.776 -4.337 3.159 1.00 0.00 H new ATOM 0 HG23 ILE A 126 15.363 -4.229 3.956 1.00 0.00 H new ATOM 0 HD11 ILE A 126 17.371 -7.911 3.017 1.00 0.00 H new ATOM 0 HD12 ILE A 126 15.775 -7.967 2.232 1.00 0.00 H new ATOM 0 HD13 ILE A 126 16.692 -6.442 2.277 1.00 0.00 H new ATOM 1435 N SER A 127 15.213 -5.881 7.351 1.00 0.00 N ATOM 1436 CA SER A 127 15.894 -5.263 8.503 1.00 0.00 C ATOM 1437 C SER A 127 17.165 -4.470 8.134 1.00 0.00 C ATOM 1438 O SER A 127 17.749 -4.663 7.065 1.00 0.00 O ATOM 1439 CB SER A 127 16.221 -6.348 9.540 1.00 0.00 C ATOM 1440 OG SER A 127 15.061 -7.114 9.846 1.00 0.00 O ATOM 0 H SER A 127 15.270 -6.899 7.360 1.00 0.00 H new ATOM 0 HA SER A 127 15.204 -4.528 8.918 1.00 0.00 H new ATOM 0 HB2 SER A 127 17.004 -7.002 9.156 1.00 0.00 H new ATOM 0 HB3 SER A 127 16.608 -5.886 10.448 1.00 0.00 H new ATOM 0 HG SER A 127 15.288 -7.801 10.507 1.00 0.00 H new ATOM 1446 N LEU A 128 17.620 -3.583 9.034 1.00 0.00 N ATOM 1447 CA LEU A 128 18.777 -2.696 8.805 1.00 0.00 C ATOM 1448 C LEU A 128 20.148 -3.394 8.638 1.00 0.00 C ATOM 1449 O LEU A 128 21.118 -2.741 8.247 1.00 0.00 O ATOM 1450 CB LEU A 128 18.795 -1.582 9.870 1.00 0.00 C ATOM 1451 CG LEU A 128 18.839 -1.974 11.364 1.00 0.00 C ATOM 1452 CD1 LEU A 128 20.036 -2.844 11.774 1.00 0.00 C ATOM 1453 CD2 LEU A 128 18.876 -0.675 12.175 1.00 0.00 C ATOM 0 H LEU A 128 17.192 -3.459 9.951 1.00 0.00 H new ATOM 0 HA LEU A 128 18.625 -2.256 7.819 1.00 0.00 H new ATOM 0 HB2 LEU A 128 19.660 -0.950 9.670 1.00 0.00 H new ATOM 0 HB3 LEU A 128 17.908 -0.967 9.717 1.00 0.00 H new ATOM 0 HG LEU A 128 17.956 -2.583 11.558 1.00 0.00 H new ATOM 0 HD11 LEU A 128 19.977 -3.065 12.840 1.00 0.00 H new ATOM 0 HD12 LEU A 128 20.019 -3.776 11.208 1.00 0.00 H new ATOM 0 HD13 LEU A 128 20.963 -2.309 11.565 1.00 0.00 H new ATOM 0 HD21 LEU A 128 18.908 -0.911 13.239 1.00 0.00 H new ATOM 0 HD22 LEU A 128 19.763 -0.102 11.904 1.00 0.00 H new ATOM 0 HD23 LEU A 128 17.984 -0.087 11.960 1.00 0.00 H new ATOM 1465 N ALA A 129 20.253 -4.696 8.924 1.00 0.00 N ATOM 1466 CA ALA A 129 21.494 -5.473 8.841 1.00 0.00 C ATOM 1467 C ALA A 129 21.808 -5.932 7.396 1.00 0.00 C ATOM 1468 O ALA A 129 20.876 -6.223 6.639 1.00 0.00 O ATOM 1469 CB ALA A 129 21.364 -6.670 9.798 1.00 0.00 C ATOM 0 H ALA A 129 19.455 -5.254 9.228 1.00 0.00 H new ATOM 0 HA ALA A 129 22.334 -4.844 9.135 1.00 0.00 H new ATOM 0 HB1 ALA A 129 22.274 -7.268 9.758 1.00 0.00 H new ATOM 0 HB2 ALA A 129 21.212 -6.308 10.815 1.00 0.00 H new ATOM 0 HB3 ALA A 129 20.513 -7.283 9.500 1.00 0.00 H new ATOM 1475 N PRO A 130 23.094 -6.090 7.013 1.00 0.00 N ATOM 1476 CA PRO A 130 23.478 -6.610 5.697 1.00 0.00 C ATOM 1477 C PRO A 130 23.115 -8.096 5.516 1.00 0.00 C ATOM 1478 O PRO A 130 22.972 -8.557 4.385 1.00 0.00 O ATOM 1479 CB PRO A 130 24.990 -6.378 5.601 1.00 0.00 C ATOM 1480 CG PRO A 130 25.452 -6.431 7.056 1.00 0.00 C ATOM 1481 CD PRO A 130 24.282 -5.799 7.808 1.00 0.00 C ATOM 0 HA PRO A 130 22.935 -6.101 4.901 1.00 0.00 H new ATOM 0 HB2 PRO A 130 25.476 -7.144 4.997 1.00 0.00 H new ATOM 0 HB3 PRO A 130 25.220 -5.417 5.142 1.00 0.00 H new ATOM 0 HG2 PRO A 130 25.638 -7.454 7.384 1.00 0.00 H new ATOM 0 HG3 PRO A 130 26.377 -5.875 7.207 1.00 0.00 H new ATOM 0 HD2 PRO A 130 24.192 -6.215 8.812 1.00 0.00 H new ATOM 0 HD3 PRO A 130 24.424 -4.724 7.920 1.00 0.00 H new ATOM 1489 N LYS A 131 22.932 -8.842 6.614 1.00 0.00 N ATOM 1490 CA LYS A 131 22.526 -10.256 6.621 1.00 0.00 C ATOM 1491 C LYS A 131 20.997 -10.466 6.453 1.00 0.00 C ATOM 1492 O LYS A 131 20.531 -11.607 6.385 1.00 0.00 O ATOM 1493 CB LYS A 131 23.083 -10.860 7.932 1.00 0.00 C ATOM 1494 CG LYS A 131 23.035 -12.394 8.073 1.00 0.00 C ATOM 1495 CD LYS A 131 23.695 -13.186 6.929 1.00 0.00 C ATOM 1496 CE LYS A 131 25.166 -12.820 6.665 1.00 0.00 C ATOM 1497 NZ LYS A 131 26.060 -13.204 7.791 1.00 0.00 N1+ ATOM 0 H LYS A 131 23.067 -8.467 7.553 1.00 0.00 H new ATOM 0 HA LYS A 131 22.938 -10.771 5.753 1.00 0.00 H new ATOM 0 HB2 LYS A 131 24.121 -10.543 8.037 1.00 0.00 H new ATOM 0 HB3 LYS A 131 22.531 -10.426 8.766 1.00 0.00 H new ATOM 0 HG2 LYS A 131 23.519 -12.671 9.010 1.00 0.00 H new ATOM 0 HG3 LYS A 131 21.992 -12.702 8.150 1.00 0.00 H new ATOM 0 HD2 LYS A 131 23.634 -14.250 7.158 1.00 0.00 H new ATOM 0 HD3 LYS A 131 23.124 -13.024 6.015 1.00 0.00 H new ATOM 0 HE2 LYS A 131 25.502 -13.315 5.754 1.00 0.00 H new ATOM 0 HE3 LYS A 131 25.245 -11.747 6.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 27.039 -12.936 7.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 25.759 -12.713 8.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 26.008 -14.232 7.940 1.00 0.00 H new ATOM 1511 N ALA A 132 20.205 -9.386 6.405 1.00 0.00 N ATOM 1512 CA ALA A 132 18.738 -9.424 6.345 1.00 0.00 C ATOM 1513 C ALA A 132 18.178 -10.044 5.044 1.00 0.00 C ATOM 1514 O ALA A 132 18.875 -10.180 4.035 1.00 0.00 O ATOM 1515 CB ALA A 132 18.211 -8.001 6.573 1.00 0.00 C ATOM 0 H ALA A 132 20.577 -8.436 6.407 1.00 0.00 H new ATOM 0 HA ALA A 132 18.384 -10.090 7.132 1.00 0.00 H new ATOM 0 HB1 ALA A 132 17.122 -8.006 6.533 1.00 0.00 H new ATOM 0 HB2 ALA A 132 18.536 -7.645 7.550 1.00 0.00 H new ATOM 0 HB3 ALA A 132 18.600 -7.340 5.798 1.00 0.00 H new ATOM 1521 N GLN A 133 16.888 -10.390 5.073 1.00 0.00 N ATOM 1522 CA GLN A 133 16.138 -11.029 3.988 1.00 0.00 C ATOM 1523 C GLN A 133 14.655 -10.635 4.123 1.00 0.00 C ATOM 1524 O GLN A 133 14.140 -10.571 5.242 1.00 0.00 O ATOM 1525 CB GLN A 133 16.331 -12.552 4.110 1.00 0.00 C ATOM 1526 CG GLN A 133 15.625 -13.381 3.023 1.00 0.00 C ATOM 1527 CD GLN A 133 15.551 -14.854 3.426 1.00 0.00 C ATOM 1528 OE1 GLN A 133 14.789 -15.229 4.311 1.00 0.00 O ATOM 1529 NE2 GLN A 133 16.335 -15.732 2.833 1.00 0.00 N ATOM 0 H GLN A 133 16.309 -10.223 5.896 1.00 0.00 H new ATOM 0 HA GLN A 133 16.490 -10.708 3.008 1.00 0.00 H new ATOM 0 HB2 GLN A 133 17.398 -12.772 4.080 1.00 0.00 H new ATOM 0 HB3 GLN A 133 15.967 -12.873 5.086 1.00 0.00 H new ATOM 0 HG2 GLN A 133 14.620 -12.993 2.859 1.00 0.00 H new ATOM 0 HG3 GLN A 133 16.162 -13.284 2.079 1.00 0.00 H new ATOM 0 HE21 GLN A 133 16.972 -15.431 2.096 1.00 0.00 H new ATOM 0 HE22 GLN A 133 16.304 -16.713 3.111 1.00 0.00 H new ATOM 1538 N ILE A 134 13.960 -10.384 3.005 1.00 0.00 N ATOM 1539 CA ILE A 134 12.578 -9.852 2.986 1.00 0.00 C ATOM 1540 C ILE A 134 11.588 -10.777 3.716 1.00 0.00 C ATOM 1541 O ILE A 134 11.654 -12.004 3.595 1.00 0.00 O ATOM 1542 CB ILE A 134 12.094 -9.559 1.536 1.00 0.00 C ATOM 1543 CG1 ILE A 134 13.076 -8.626 0.783 1.00 0.00 C ATOM 1544 CG2 ILE A 134 10.676 -8.940 1.534 1.00 0.00 C ATOM 1545 CD1 ILE A 134 12.773 -8.471 -0.714 1.00 0.00 C ATOM 0 H ILE A 134 14.341 -10.545 2.073 1.00 0.00 H new ATOM 0 HA ILE A 134 12.604 -8.908 3.530 1.00 0.00 H new ATOM 0 HB ILE A 134 12.061 -10.515 1.014 1.00 0.00 H new ATOM 0 HG12 ILE A 134 13.055 -7.642 1.250 1.00 0.00 H new ATOM 0 HG13 ILE A 134 14.088 -9.013 0.899 1.00 0.00 H new ATOM 0 HG21 ILE A 134 10.365 -8.746 0.507 1.00 0.00 H new ATOM 0 HG22 ILE A 134 9.976 -9.633 2.001 1.00 0.00 H new ATOM 0 HG23 ILE A 134 10.687 -8.004 2.093 1.00 0.00 H new ATOM 0 HD11 ILE A 134 13.506 -7.803 -1.166 1.00 0.00 H new ATOM 0 HD12 ILE A 134 12.824 -9.446 -1.198 1.00 0.00 H new ATOM 0 HD13 ILE A 134 11.774 -8.054 -0.842 1.00 0.00 H new ATOM 1557 N LYS A 135 10.652 -10.176 4.457 1.00 0.00 N ATOM 1558 CA LYS A 135 9.484 -10.829 5.056 1.00 0.00 C ATOM 1559 C LYS A 135 8.193 -10.105 4.635 1.00 0.00 C ATOM 1560 O LYS A 135 8.052 -8.893 4.834 1.00 0.00 O ATOM 1561 CB LYS A 135 9.632 -10.863 6.594 1.00 0.00 C ATOM 1562 CG LYS A 135 10.876 -11.618 7.099 1.00 0.00 C ATOM 1563 CD LYS A 135 10.819 -13.133 6.823 1.00 0.00 C ATOM 1564 CE LYS A 135 12.202 -13.797 6.843 1.00 0.00 C ATOM 1565 NZ LYS A 135 13.042 -13.346 5.703 1.00 0.00 N1+ ATOM 0 H LYS A 135 10.689 -9.178 4.665 1.00 0.00 H new ATOM 0 HA LYS A 135 9.423 -11.856 4.696 1.00 0.00 H new ATOM 0 HB2 LYS A 135 9.668 -9.839 6.966 1.00 0.00 H new ATOM 0 HB3 LYS A 135 8.743 -11.326 7.022 1.00 0.00 H new ATOM 0 HG2 LYS A 135 11.764 -11.202 6.623 1.00 0.00 H new ATOM 0 HG3 LYS A 135 10.982 -11.454 8.171 1.00 0.00 H new ATOM 0 HD2 LYS A 135 10.182 -13.609 7.569 1.00 0.00 H new ATOM 0 HD3 LYS A 135 10.354 -13.303 5.852 1.00 0.00 H new ATOM 0 HE2 LYS A 135 12.705 -13.563 7.781 1.00 0.00 H new ATOM 0 HE3 LYS A 135 12.087 -14.880 6.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 13.601 -14.147 5.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 12.431 -12.984 4.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 13.683 -12.591 6.021 1.00 0.00 H new ATOM 1579 N GLU A 136 7.256 -10.849 4.047 1.00 0.00 N ATOM 1580 CA GLU A 136 6.007 -10.360 3.464 1.00 0.00 C ATOM 1581 C GLU A 136 4.883 -11.407 3.611 1.00 0.00 C ATOM 1582 O GLU A 136 5.118 -12.610 3.491 1.00 0.00 O ATOM 1583 CB GLU A 136 6.237 -9.948 1.992 1.00 0.00 C ATOM 1584 CG GLU A 136 6.515 -11.059 0.960 1.00 0.00 C ATOM 1585 CD GLU A 136 7.893 -11.739 1.077 1.00 0.00 C ATOM 1586 OE1 GLU A 136 8.105 -12.559 2.003 1.00 0.00 O ATOM 1587 OE2 GLU A 136 8.757 -11.494 0.204 1.00 0.00 O1- ATOM 0 H GLU A 136 7.353 -11.861 3.960 1.00 0.00 H new ATOM 0 HA GLU A 136 5.681 -9.474 4.008 1.00 0.00 H new ATOM 0 HB2 GLU A 136 5.358 -9.397 1.659 1.00 0.00 H new ATOM 0 HB3 GLU A 136 7.077 -9.253 1.968 1.00 0.00 H new ATOM 0 HG2 GLU A 136 5.743 -11.822 1.056 1.00 0.00 H new ATOM 0 HG3 GLU A 136 6.422 -10.635 -0.040 1.00 0.00 H new ATOM 1594 N SER A 137 3.657 -10.959 3.881 1.00 0.00 N ATOM 1595 CA SER A 137 2.448 -11.785 4.074 1.00 0.00 C ATOM 1596 C SER A 137 1.208 -10.881 4.202 1.00 0.00 C ATOM 1597 O SER A 137 1.364 -9.711 4.555 1.00 0.00 O ATOM 1598 CB SER A 137 2.567 -12.699 5.308 1.00 0.00 C ATOM 1599 OG SER A 137 1.559 -13.702 5.285 1.00 0.00 O ATOM 0 H SER A 137 3.462 -9.962 3.977 1.00 0.00 H new ATOM 0 HA SER A 137 2.343 -12.427 3.199 1.00 0.00 H new ATOM 0 HB2 SER A 137 3.552 -13.166 5.328 1.00 0.00 H new ATOM 0 HB3 SER A 137 2.477 -12.105 6.218 1.00 0.00 H new ATOM 0 HG SER A 137 1.650 -14.275 6.075 1.00 0.00 H new ATOM 1605 N LEU A 138 0.005 -11.406 3.908 1.00 0.00 N ATOM 1606 CA LEU A 138 -1.278 -10.682 3.761 1.00 0.00 C ATOM 1607 C LEU A 138 -1.276 -9.789 2.494 1.00 0.00 C ATOM 1608 O LEU A 138 -0.256 -9.651 1.814 1.00 0.00 O ATOM 1609 CB LEU A 138 -1.682 -9.877 5.030 1.00 0.00 C ATOM 1610 CG LEU A 138 -2.029 -10.682 6.304 1.00 0.00 C ATOM 1611 CD1 LEU A 138 -0.819 -11.341 6.986 1.00 0.00 C ATOM 1612 CD2 LEU A 138 -2.699 -9.738 7.316 1.00 0.00 C ATOM 0 H LEU A 138 -0.108 -12.408 3.757 1.00 0.00 H new ATOM 0 HA LEU A 138 -2.046 -11.445 3.638 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -0.864 -9.199 5.273 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -2.544 -9.260 4.777 1.00 0.00 H new ATOM 0 HG LEU A 138 -2.688 -11.490 5.986 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -1.151 -11.885 7.870 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -0.343 -12.033 6.292 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -0.104 -10.573 7.280 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -2.950 -10.293 8.220 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -2.015 -8.927 7.565 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -3.609 -9.324 6.881 1.00 0.00 H new ATOM 1624 N ARG A 139 -2.425 -9.173 2.171 1.00 0.00 N ATOM 1625 CA ARG A 139 -2.594 -8.188 1.095 1.00 0.00 C ATOM 1626 C ARG A 139 -3.848 -7.317 1.286 1.00 0.00 C ATOM 1627 O ARG A 139 -4.721 -7.636 2.096 1.00 0.00 O ATOM 1628 CB ARG A 139 -2.545 -8.876 -0.290 1.00 0.00 C ATOM 1629 CG ARG A 139 -3.510 -10.044 -0.561 1.00 0.00 C ATOM 1630 CD ARG A 139 -4.994 -9.701 -0.386 1.00 0.00 C ATOM 1631 NE ARG A 139 -5.867 -10.634 -1.117 1.00 0.00 N ATOM 1632 CZ ARG A 139 -7.167 -10.456 -1.324 1.00 0.00 C ATOM 1633 NH1 ARG A 139 -7.838 -9.499 -0.723 1.00 0.00 N ATOM 1634 NH2 ARG A 139 -7.821 -11.234 -2.157 1.00 0.00 N1+ ATOM 0 H ARG A 139 -3.294 -9.356 2.673 1.00 0.00 H new ATOM 0 HA ARG A 139 -1.753 -7.496 1.143 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -2.727 -8.113 -1.047 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -1.530 -9.242 -0.443 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -3.351 -10.401 -1.579 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -3.260 -10.867 0.108 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -5.248 -9.722 0.674 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -5.175 -8.685 -0.737 1.00 0.00 H new ATOM 0 HE ARG A 139 -5.441 -11.481 -1.493 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -7.361 -8.869 -0.078 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -8.836 -9.386 -0.901 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -7.330 -11.980 -2.650 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -8.819 -11.091 -2.311 1.00 0.00 H new ATOM 1648 N ALA A 140 -3.955 -6.246 0.503 1.00 0.00 N ATOM 1649 CA ALA A 140 -5.100 -5.338 0.405 1.00 0.00 C ATOM 1650 C ALA A 140 -5.525 -5.145 -1.066 1.00 0.00 C ATOM 1651 O ALA A 140 -4.754 -5.434 -1.982 1.00 0.00 O ATOM 1652 CB ALA A 140 -4.695 -4.007 1.051 1.00 0.00 C ATOM 0 H ALA A 140 -3.197 -5.970 -0.121 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.962 -5.755 0.925 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -5.528 -3.307 0.994 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.432 -4.175 2.095 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -3.836 -3.593 0.523 1.00 0.00 H new ATOM 1658 N GLU A 141 -6.748 -4.667 -1.297 1.00 0.00 N ATOM 1659 CA GLU A 141 -7.323 -4.443 -2.631 1.00 0.00 C ATOM 1660 C GLU A 141 -7.613 -2.955 -2.864 1.00 0.00 C ATOM 1661 O GLU A 141 -8.126 -2.267 -1.982 1.00 0.00 O ATOM 1662 CB GLU A 141 -8.622 -5.250 -2.792 1.00 0.00 C ATOM 1663 CG GLU A 141 -8.392 -6.763 -2.669 1.00 0.00 C ATOM 1664 CD GLU A 141 -9.678 -7.574 -2.905 1.00 0.00 C ATOM 1665 OE1 GLU A 141 -10.305 -7.440 -3.982 1.00 0.00 O1- ATOM 1666 OE2 GLU A 141 -10.044 -8.390 -2.024 1.00 0.00 O ATOM 0 H GLU A 141 -7.387 -4.417 -0.542 1.00 0.00 H new ATOM 0 HA GLU A 141 -6.594 -4.775 -3.370 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -9.340 -4.932 -2.036 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -9.064 -5.031 -3.764 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -7.634 -7.072 -3.389 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -8.001 -6.989 -1.677 1.00 0.00 H new ATOM 1673 N LEU A 142 -7.324 -2.472 -4.074 1.00 0.00 N ATOM 1674 CA LEU A 142 -7.681 -1.142 -4.570 1.00 0.00 C ATOM 1675 C LEU A 142 -8.780 -1.258 -5.631 1.00 0.00 C ATOM 1676 O LEU A 142 -8.650 -2.038 -6.577 1.00 0.00 O ATOM 1677 CB LEU A 142 -6.420 -0.482 -5.168 1.00 0.00 C ATOM 1678 CG LEU A 142 -6.619 0.941 -5.734 1.00 0.00 C ATOM 1679 CD1 LEU A 142 -7.143 1.931 -4.684 1.00 0.00 C ATOM 1680 CD2 LEU A 142 -5.284 1.454 -6.288 1.00 0.00 C ATOM 0 H LEU A 142 -6.813 -3.021 -4.765 1.00 0.00 H new ATOM 0 HA LEU A 142 -8.060 -0.528 -3.753 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -5.651 -0.443 -4.396 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -6.040 -1.121 -5.965 1.00 0.00 H new ATOM 0 HG LEU A 142 -7.370 0.875 -6.521 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -7.263 2.914 -5.139 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -8.105 1.586 -4.307 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -6.433 1.997 -3.860 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -5.418 2.459 -6.689 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -4.544 1.479 -5.488 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -4.940 0.790 -7.081 1.00 0.00 H new ATOM 1692 N ARG A 143 -9.815 -0.427 -5.505 1.00 0.00 N ATOM 1693 CA ARG A 143 -10.866 -0.208 -6.500 1.00 0.00 C ATOM 1694 C ARG A 143 -10.908 1.279 -6.868 1.00 0.00 C ATOM 1695 O ARG A 143 -11.172 2.131 -6.018 1.00 0.00 O ATOM 1696 CB ARG A 143 -12.205 -0.689 -5.915 1.00 0.00 C ATOM 1697 CG ARG A 143 -13.383 -0.521 -6.888 1.00 0.00 C ATOM 1698 CD ARG A 143 -14.691 -0.995 -6.245 1.00 0.00 C ATOM 1699 NE ARG A 143 -15.836 -0.788 -7.152 1.00 0.00 N ATOM 1700 CZ ARG A 143 -17.113 -0.678 -6.801 1.00 0.00 C ATOM 1701 NH1 ARG A 143 -17.508 -0.765 -5.547 1.00 0.00 N1+ ATOM 1702 NH2 ARG A 143 -18.028 -0.476 -7.726 1.00 0.00 N ATOM 0 H ARG A 143 -9.950 0.139 -4.667 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.666 -0.772 -7.411 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -12.117 -1.740 -5.638 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -12.415 -0.135 -5.000 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -13.474 0.525 -7.179 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -13.193 -1.090 -7.798 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -14.612 -2.052 -5.990 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -14.859 -0.454 -5.314 1.00 0.00 H new ATOM 0 HE ARG A 143 -15.627 -0.723 -8.148 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -16.824 -0.922 -4.807 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -18.498 -0.675 -5.317 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -17.755 -0.405 -8.706 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -19.010 -0.391 -7.462 1.00 0.00 H new ATOM 1716 N VAL A 144 -10.679 1.589 -8.139 1.00 0.00 N ATOM 1717 CA VAL A 144 -10.861 2.930 -8.707 1.00 0.00 C ATOM 1718 C VAL A 144 -12.145 2.936 -9.540 1.00 0.00 C ATOM 1719 O VAL A 144 -12.252 2.234 -10.548 1.00 0.00 O ATOM 1720 CB VAL A 144 -9.652 3.380 -9.552 1.00 0.00 C ATOM 1721 CG1 VAL A 144 -9.846 4.836 -10.004 1.00 0.00 C ATOM 1722 CG2 VAL A 144 -8.326 3.253 -8.788 1.00 0.00 C ATOM 0 H VAL A 144 -10.355 0.904 -8.822 1.00 0.00 H new ATOM 0 HA VAL A 144 -10.941 3.646 -7.889 1.00 0.00 H new ATOM 0 HB VAL A 144 -9.598 2.720 -10.418 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -8.989 5.149 -10.601 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -10.753 4.913 -10.603 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -9.934 5.480 -9.129 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -7.506 3.582 -9.426 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -8.361 3.874 -7.893 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -8.169 2.213 -8.502 1.00 0.00 H new ATOM 1732 N THR A 145 -13.121 3.727 -9.092 1.00 0.00 N ATOM 1733 CA THR A 145 -14.423 3.944 -9.739 1.00 0.00 C ATOM 1734 C THR A 145 -14.323 5.081 -10.754 1.00 0.00 C ATOM 1735 O THR A 145 -13.460 5.952 -10.643 1.00 0.00 O ATOM 1736 CB THR A 145 -15.525 4.200 -8.696 1.00 0.00 C ATOM 1737 OG1 THR A 145 -15.255 5.357 -7.937 1.00 0.00 O ATOM 1738 CG2 THR A 145 -15.692 3.015 -7.741 1.00 0.00 C ATOM 0 H THR A 145 -13.024 4.260 -8.228 1.00 0.00 H new ATOM 0 HA THR A 145 -14.702 3.038 -10.277 1.00 0.00 H new ATOM 0 HB THR A 145 -16.449 4.339 -9.257 1.00 0.00 H new ATOM 0 HG1 THR A 145 -14.453 5.211 -7.393 1.00 0.00 H new ATOM 0 HG21 THR A 145 -16.480 3.236 -7.021 1.00 0.00 H new ATOM 0 HG22 THR A 145 -15.960 2.125 -8.310 1.00 0.00 H new ATOM 0 HG23 THR A 145 -14.755 2.839 -7.212 1.00 0.00 H new ATOM 1746 N GLU A 146 -15.175 5.061 -11.773 1.00 0.00 N ATOM 1747 CA GLU A 146 -15.185 6.060 -12.843 1.00 0.00 C ATOM 1748 C GLU A 146 -15.592 7.462 -12.350 1.00 0.00 C ATOM 1749 O GLU A 146 -16.293 7.613 -11.344 1.00 0.00 O ATOM 1750 CB GLU A 146 -16.039 5.573 -14.029 1.00 0.00 C ATOM 1751 CG GLU A 146 -17.562 5.577 -13.842 1.00 0.00 C ATOM 1752 CD GLU A 146 -18.104 4.650 -12.736 1.00 0.00 C ATOM 1753 OE1 GLU A 146 -17.475 3.610 -12.430 1.00 0.00 O ATOM 1754 OE2 GLU A 146 -19.190 4.949 -12.185 1.00 0.00 O1- ATOM 0 H GLU A 146 -15.889 4.341 -11.883 1.00 0.00 H new ATOM 0 HA GLU A 146 -14.160 6.172 -13.198 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.803 6.194 -14.893 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -15.731 4.556 -14.273 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -17.880 6.597 -13.624 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -18.026 5.294 -14.787 1.00 0.00 H new ATOM 1761 N ARG A 147 -15.145 8.503 -13.065 1.00 0.00 N ATOM 1762 CA ARG A 147 -15.311 9.904 -12.665 1.00 0.00 C ATOM 1763 C ARG A 147 -16.793 10.292 -12.748 1.00 0.00 C ATOM 1764 O ARG A 147 -17.401 10.219 -13.821 1.00 0.00 O ATOM 1765 CB ARG A 147 -14.429 10.811 -13.546 1.00 0.00 C ATOM 1766 CG ARG A 147 -14.299 12.245 -13.002 1.00 0.00 C ATOM 1767 CD ARG A 147 -13.303 12.344 -11.838 1.00 0.00 C ATOM 1768 NE ARG A 147 -13.279 13.704 -11.271 1.00 0.00 N ATOM 1769 CZ ARG A 147 -12.477 14.139 -10.305 1.00 0.00 C ATOM 1770 NH1 ARG A 147 -11.556 13.374 -9.758 1.00 0.00 N ATOM 1771 NH2 ARG A 147 -12.595 15.374 -9.869 1.00 0.00 N1+ ATOM 0 H ARG A 147 -14.651 8.392 -13.950 1.00 0.00 H new ATOM 0 HA ARG A 147 -14.988 10.035 -11.632 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -13.436 10.370 -13.630 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -14.848 10.848 -14.552 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -13.980 12.908 -13.806 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -15.277 12.594 -12.670 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -13.574 11.628 -11.062 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -12.306 12.074 -12.185 1.00 0.00 H new ATOM 0 HE ARG A 147 -13.942 14.376 -11.657 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -11.439 12.411 -10.074 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -10.959 13.744 -9.018 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -13.299 15.992 -10.272 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -11.982 15.714 -9.128 1.00 0.00 H new