USER MOD reduce.3.24.130724 H: found=0, std=0, add=731, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 732 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 90 TYR OH : rot 25:sc= 1.25 USER MOD Set 1.2: A 105 SER OG : rot -155:sc= 0.825 USER MOD Set 1.3: A 111 SER OG : rot -102:sc= 0.869 USER MOD Set 1.4: A 115 HIS : no HE2:sc= 0.85 K(o=3.8,f=-5.6!) USER MOD Set 2.1: A 93 TYR OH : rot -161:sc= -0.336 USER MOD Set 2.2: A 150 HIS : no HD1:sc= -0.35 K(o=0.69,f=-10!) USER MOD Set 2.3: A 154 THR OG1 : rot -101:sc= 1.37 USER MOD Single : A 67 LYS NZ :NH3+ 141:sc= 1.2 (180deg=-0.0931) USER MOD Single : A 68 SER OG : rot -45:sc= 0.698 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0316 USER MOD Single : A 72 THR OG1 : rot -125:sc= 0.373 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc=-0.00849 USER MOD Single : A 85 SER OG : rot 53:sc= 0.0398 USER MOD Single : A 87 SER OG : rot -60:sc= -0.128 USER MOD Single : A 95 LYS NZ :NH3+ -150:sc= 0.0446 (180deg=0) USER MOD Single : A 96 SER OG : rot -44:sc= 0.122 USER MOD Single : A 100 GLN : amide:sc= 0.533 K(o=0.53,f=-0.14) USER MOD Single : A 107 ASN : amide:sc= -1.23 K(o=-1.2,f=-7.4!) USER MOD Single : A 113 SER OG : rot 87:sc= 0.34 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 84:sc= 1.3 USER MOD Single : A 123 CYS SG : rot -160:sc= -7.03! USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 137:sc= -0.0909 (180deg=-0.341) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 THR OG1 : rot 91:sc= 1.22 USER MOD Single : A 141 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 LYS NZ :NH3+ 170:sc= 1.1 (180deg=0.979) USER MOD Single : A 156 LYS NZ :NH3+ -143:sc= 1.37 (180deg=0.673) USER MOD Single : A 161 ASN : amide:sc= -1.99! C(o=-2!,f=-8.4!) USER MOD ----------------------------------------------------------------- ATOM 67 N LYS A 67 -6.153 3.597 -13.157 1.00 0.00 N ATOM 68 CA LYS A 67 -5.165 2.662 -13.627 1.00 0.00 C ATOM 69 C LYS A 67 -3.797 3.270 -13.407 1.00 0.00 C ATOM 70 O LYS A 67 -2.932 2.687 -12.765 1.00 0.00 O ATOM 71 CB LYS A 67 -5.340 2.309 -15.133 1.00 0.00 C ATOM 72 CG LYS A 67 -6.647 1.576 -15.545 1.00 0.00 C ATOM 73 CD LYS A 67 -7.920 2.421 -15.394 1.00 0.00 C ATOM 74 CE LYS A 67 -7.844 3.718 -16.188 1.00 0.00 C ATOM 75 NZ LYS A 67 -9.009 4.584 -15.954 1.00 0.00 N ATOM 0 HA LYS A 67 -5.283 1.733 -13.069 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -5.277 3.234 -15.706 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -4.496 1.689 -15.435 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -6.558 1.256 -16.583 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -6.750 0.674 -14.941 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -8.781 1.842 -15.728 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -8.080 2.650 -14.340 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -6.935 4.255 -15.917 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -7.773 3.487 -17.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -8.700 5.576 -15.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -9.689 4.469 -16.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -9.462 4.321 -15.056 1.00 0.00 H new ATOM 89 N SER A 68 -3.633 4.477 -13.884 1.00 0.00 N ATOM 90 CA SER A 68 -2.362 5.126 -13.826 1.00 0.00 C ATOM 91 C SER A 68 -2.338 6.245 -12.785 1.00 0.00 C ATOM 92 O SER A 68 -3.379 6.816 -12.441 1.00 0.00 O ATOM 93 CB SER A 68 -1.984 5.641 -15.215 1.00 0.00 C ATOM 94 OG SER A 68 -2.967 6.534 -15.740 1.00 0.00 O ATOM 0 H SER A 68 -4.373 5.028 -14.318 1.00 0.00 H new ATOM 0 HA SER A 68 -1.618 4.396 -13.508 1.00 0.00 H new ATOM 0 HB2 SER A 68 -1.022 6.151 -15.163 1.00 0.00 H new ATOM 0 HB3 SER A 68 -1.862 4.797 -15.894 1.00 0.00 H new ATOM 0 HG SER A 68 -3.861 6.163 -15.587 1.00 0.00 H new ATOM 100 N LEU A 69 -1.142 6.566 -12.324 1.00 0.00 N ATOM 101 CA LEU A 69 -0.894 7.599 -11.307 1.00 0.00 C ATOM 102 C LEU A 69 -1.255 8.981 -11.868 1.00 0.00 C ATOM 103 O LEU A 69 -1.599 9.912 -11.128 1.00 0.00 O ATOM 104 CB LEU A 69 0.598 7.488 -10.886 1.00 0.00 C ATOM 105 CG LEU A 69 1.182 8.373 -9.746 1.00 0.00 C ATOM 106 CD1 LEU A 69 1.393 9.822 -10.165 1.00 0.00 C ATOM 107 CD2 LEU A 69 0.325 8.290 -8.494 1.00 0.00 C ATOM 0 H LEU A 69 -0.289 6.110 -12.648 1.00 0.00 H new ATOM 0 HA LEU A 69 -1.518 7.457 -10.425 1.00 0.00 H new ATOM 0 HB2 LEU A 69 0.773 6.450 -10.604 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.195 7.681 -11.777 1.00 0.00 H new ATOM 0 HG LEU A 69 2.169 7.968 -9.520 1.00 0.00 H new ATOM 0 HD11 LEU A 69 1.802 10.387 -9.327 1.00 0.00 H new ATOM 0 HD12 LEU A 69 2.089 9.861 -11.003 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.439 10.257 -10.465 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.757 8.918 -7.715 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.684 8.635 -8.720 1.00 0.00 H new ATOM 0 HD23 LEU A 69 0.286 7.257 -8.147 1.00 0.00 H new ATOM 119 N THR A 70 -1.219 9.083 -13.174 1.00 0.00 N ATOM 120 CA THR A 70 -1.550 10.282 -13.903 1.00 0.00 C ATOM 121 C THR A 70 -3.017 10.712 -13.616 1.00 0.00 C ATOM 122 O THR A 70 -3.350 11.900 -13.650 1.00 0.00 O ATOM 123 CB THR A 70 -1.397 9.977 -15.404 1.00 0.00 C ATOM 124 OG1 THR A 70 -0.181 9.220 -15.604 1.00 0.00 O ATOM 125 CG2 THR A 70 -1.325 11.258 -16.220 1.00 0.00 C ATOM 0 H THR A 70 -0.949 8.307 -13.779 1.00 0.00 H new ATOM 0 HA THR A 70 -0.889 11.093 -13.596 1.00 0.00 H new ATOM 0 HB THR A 70 -2.266 9.407 -15.735 1.00 0.00 H new ATOM 0 HG1 THR A 70 -0.074 9.018 -16.557 1.00 0.00 H new ATOM 0 HG21 THR A 70 -1.217 11.011 -17.276 1.00 0.00 H new ATOM 0 HG22 THR A 70 -2.238 11.834 -16.074 1.00 0.00 H new ATOM 0 HG23 THR A 70 -0.468 11.848 -15.896 1.00 0.00 H new ATOM 133 N GLU A 71 -3.850 9.741 -13.276 1.00 0.00 N ATOM 134 CA GLU A 71 -5.271 9.960 -13.067 1.00 0.00 C ATOM 135 C GLU A 71 -5.584 10.232 -11.589 1.00 0.00 C ATOM 136 O GLU A 71 -6.694 10.635 -11.245 1.00 0.00 O ATOM 137 CB GLU A 71 -6.016 8.702 -13.508 1.00 0.00 C ATOM 138 CG GLU A 71 -5.737 8.289 -14.940 1.00 0.00 C ATOM 139 CD GLU A 71 -6.304 6.936 -15.274 1.00 0.00 C ATOM 140 OE1 GLU A 71 -5.591 5.911 -15.089 1.00 0.00 O ATOM 141 OE2 GLU A 71 -7.456 6.861 -15.757 1.00 0.00 O ATOM 0 H GLU A 71 -3.557 8.774 -13.137 1.00 0.00 H new ATOM 0 HA GLU A 71 -5.583 10.830 -13.645 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -5.745 7.881 -12.845 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -7.087 8.867 -13.390 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -6.158 9.032 -15.617 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -4.660 8.279 -15.108 1.00 0.00 H new ATOM 148 N THR A 72 -4.613 10.022 -10.734 1.00 0.00 N ATOM 149 CA THR A 72 -4.822 10.095 -9.309 1.00 0.00 C ATOM 150 C THR A 72 -4.806 11.547 -8.754 1.00 0.00 C ATOM 151 O THR A 72 -3.821 12.288 -8.943 1.00 0.00 O ATOM 152 CB THR A 72 -3.734 9.293 -8.641 1.00 0.00 C ATOM 153 OG1 THR A 72 -3.518 8.103 -9.414 1.00 0.00 O ATOM 154 CG2 THR A 72 -4.175 8.898 -7.269 1.00 0.00 C ATOM 0 H THR A 72 -3.656 9.796 -11.006 1.00 0.00 H new ATOM 0 HA THR A 72 -5.814 9.697 -9.096 1.00 0.00 H new ATOM 0 HB THR A 72 -2.821 9.885 -8.574 1.00 0.00 H new ATOM 0 HG1 THR A 72 -3.609 7.317 -8.836 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.388 8.318 -6.787 1.00 0.00 H new ATOM 0 HG22 THR A 72 -4.379 9.793 -6.681 1.00 0.00 H new ATOM 0 HG23 THR A 72 -5.080 8.295 -7.337 1.00 0.00 H new ATOM 162 N GLU A 73 -5.871 11.923 -8.031 1.00 0.00 N ATOM 163 CA GLU A 73 -5.980 13.263 -7.460 1.00 0.00 C ATOM 164 C GLU A 73 -5.168 13.403 -6.172 1.00 0.00 C ATOM 165 O GLU A 73 -4.896 12.414 -5.482 1.00 0.00 O ATOM 166 CB GLU A 73 -7.441 13.691 -7.259 1.00 0.00 C ATOM 167 CG GLU A 73 -8.279 12.811 -6.349 1.00 0.00 C ATOM 168 CD GLU A 73 -9.701 13.335 -6.230 1.00 0.00 C ATOM 169 OE1 GLU A 73 -10.559 13.009 -7.100 1.00 0.00 O ATOM 170 OE2 GLU A 73 -9.983 14.118 -5.314 1.00 0.00 O ATOM 0 H GLU A 73 -6.665 11.315 -7.831 1.00 0.00 H new ATOM 0 HA GLU A 73 -5.547 13.948 -8.189 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -7.449 14.704 -6.858 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -7.923 13.731 -8.236 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -8.296 11.793 -6.739 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -7.822 12.767 -5.361 1.00 0.00 H new ATOM 177 N LEU A 74 -4.791 14.633 -5.867 1.00 0.00 N ATOM 178 CA LEU A 74 -3.923 14.954 -4.748 1.00 0.00 C ATOM 179 C LEU A 74 -4.754 15.526 -3.590 1.00 0.00 C ATOM 180 O LEU A 74 -5.555 16.445 -3.782 1.00 0.00 O ATOM 181 CB LEU A 74 -2.851 15.977 -5.253 1.00 0.00 C ATOM 182 CG LEU A 74 -1.638 16.345 -4.348 1.00 0.00 C ATOM 183 CD1 LEU A 74 -2.032 17.162 -3.127 1.00 0.00 C ATOM 184 CD2 LEU A 74 -0.874 15.100 -3.940 1.00 0.00 C ATOM 0 H LEU A 74 -5.085 15.451 -6.400 1.00 0.00 H new ATOM 0 HA LEU A 74 -3.420 14.063 -4.372 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -2.451 15.591 -6.190 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.373 16.904 -5.488 1.00 0.00 H new ATOM 0 HG LEU A 74 -0.986 16.980 -4.947 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -1.143 17.386 -2.537 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -2.499 18.093 -3.448 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -2.736 16.593 -2.520 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -0.031 15.381 -3.308 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -1.535 14.432 -3.387 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.506 14.591 -4.831 1.00 0.00 H new ATOM 196 N LEU A 75 -4.569 14.967 -2.423 1.00 0.00 N ATOM 197 CA LEU A 75 -5.224 15.404 -1.209 1.00 0.00 C ATOM 198 C LEU A 75 -4.162 15.768 -0.166 1.00 0.00 C ATOM 199 O LEU A 75 -3.148 15.071 -0.047 1.00 0.00 O ATOM 200 CB LEU A 75 -6.114 14.282 -0.606 1.00 0.00 C ATOM 201 CG LEU A 75 -7.394 13.841 -1.350 1.00 0.00 C ATOM 202 CD1 LEU A 75 -8.315 15.012 -1.602 1.00 0.00 C ATOM 203 CD2 LEU A 75 -7.096 13.078 -2.634 1.00 0.00 C ATOM 0 H LEU A 75 -3.943 14.174 -2.282 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.849 16.261 -1.459 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -5.487 13.399 -0.484 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -6.411 14.603 0.392 1.00 0.00 H new ATOM 0 HG LEU A 75 -7.911 13.143 -0.691 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -9.206 14.668 -2.127 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -8.604 15.459 -0.651 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -7.800 15.756 -2.210 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -8.032 12.794 -3.114 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -6.520 13.712 -3.309 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.522 12.182 -2.400 1.00 0.00 H new ATOM 215 N PRO A 76 -4.322 16.888 0.550 1.00 0.00 N ATOM 216 CA PRO A 76 -3.449 17.230 1.678 1.00 0.00 C ATOM 217 C PRO A 76 -3.778 16.330 2.886 1.00 0.00 C ATOM 218 O PRO A 76 -4.944 16.084 3.177 1.00 0.00 O ATOM 219 CB PRO A 76 -3.811 18.695 1.990 1.00 0.00 C ATOM 220 CG PRO A 76 -4.615 19.155 0.820 1.00 0.00 C ATOM 221 CD PRO A 76 -5.315 17.939 0.303 1.00 0.00 C ATOM 0 HA PRO A 76 -2.390 17.094 1.458 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -4.382 18.771 2.915 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -2.916 19.304 2.117 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -5.331 19.922 1.115 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -3.975 19.593 0.054 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -6.249 17.750 0.832 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -5.560 18.028 -0.755 1.00 0.00 H new ATOM 229 N ILE A 77 -2.762 15.877 3.612 1.00 0.00 N ATOM 230 CA ILE A 77 -2.973 14.904 4.712 1.00 0.00 C ATOM 231 C ILE A 77 -3.644 15.530 5.948 1.00 0.00 C ATOM 232 O ILE A 77 -4.075 14.825 6.865 1.00 0.00 O ATOM 233 CB ILE A 77 -1.665 14.155 5.143 1.00 0.00 C ATOM 234 CG1 ILE A 77 -0.690 15.042 5.970 1.00 0.00 C ATOM 235 CG2 ILE A 77 -0.957 13.566 3.929 1.00 0.00 C ATOM 236 CD1 ILE A 77 -0.133 16.261 5.265 1.00 0.00 C ATOM 0 H ILE A 77 -1.791 16.155 3.473 1.00 0.00 H new ATOM 0 HA ILE A 77 -3.655 14.167 4.288 1.00 0.00 H new ATOM 0 HB ILE A 77 -1.979 13.347 5.803 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.208 15.374 6.870 1.00 0.00 H new ATOM 0 HG13 ILE A 77 0.146 14.422 6.294 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.052 13.051 4.250 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.619 12.859 3.429 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.693 14.367 3.238 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.532 16.799 5.940 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.423 15.948 4.381 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -0.953 16.914 4.966 1.00 0.00 H new ATOM 248 N THR A 78 -3.728 16.843 5.967 1.00 0.00 N ATOM 249 CA THR A 78 -4.363 17.544 7.059 1.00 0.00 C ATOM 250 C THR A 78 -5.889 17.334 7.014 1.00 0.00 C ATOM 251 O THR A 78 -6.568 17.399 8.037 1.00 0.00 O ATOM 252 CB THR A 78 -3.999 19.059 7.048 1.00 0.00 C ATOM 253 OG1 THR A 78 -4.620 19.742 8.142 1.00 0.00 O ATOM 254 CG2 THR A 78 -4.412 19.717 5.739 1.00 0.00 C ATOM 0 H THR A 78 -3.361 17.449 5.233 1.00 0.00 H new ATOM 0 HA THR A 78 -3.988 17.130 7.995 1.00 0.00 H new ATOM 0 HB THR A 78 -2.916 19.132 7.150 1.00 0.00 H new ATOM 0 HG1 THR A 78 -4.376 20.691 8.116 1.00 0.00 H new ATOM 0 HG21 THR A 78 -4.145 20.773 5.763 1.00 0.00 H new ATOM 0 HG22 THR A 78 -3.898 19.231 4.910 1.00 0.00 H new ATOM 0 HG23 THR A 78 -5.489 19.618 5.606 1.00 0.00 H new ATOM 262 N GLU A 79 -6.405 17.029 5.838 1.00 0.00 N ATOM 263 CA GLU A 79 -7.804 16.778 5.673 1.00 0.00 C ATOM 264 C GLU A 79 -8.047 15.303 5.435 1.00 0.00 C ATOM 265 O GLU A 79 -8.683 14.891 4.465 1.00 0.00 O ATOM 266 CB GLU A 79 -8.444 17.689 4.616 1.00 0.00 C ATOM 267 CG GLU A 79 -7.765 17.714 3.258 1.00 0.00 C ATOM 268 CD GLU A 79 -8.395 18.729 2.344 1.00 0.00 C ATOM 269 OE1 GLU A 79 -8.307 19.948 2.648 1.00 0.00 O ATOM 270 OE2 GLU A 79 -9.002 18.351 1.325 1.00 0.00 O ATOM 0 H GLU A 79 -5.859 16.951 4.980 1.00 0.00 H new ATOM 0 HA GLU A 79 -8.313 17.039 6.601 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -9.479 17.378 4.476 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -8.466 18.706 5.007 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -6.707 17.943 3.384 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -7.825 16.726 2.802 1.00 0.00 H new ATOM 277 N ALA A 80 -7.522 14.508 6.355 1.00 0.00 N ATOM 278 CA ALA A 80 -7.621 13.055 6.317 1.00 0.00 C ATOM 279 C ALA A 80 -9.085 12.596 6.401 1.00 0.00 C ATOM 280 O ALA A 80 -9.439 11.506 5.969 1.00 0.00 O ATOM 281 CB ALA A 80 -6.803 12.447 7.444 1.00 0.00 C ATOM 0 H ALA A 80 -7.007 14.859 7.162 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.220 12.709 5.364 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -6.884 11.361 7.407 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -5.758 12.737 7.333 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -7.180 12.806 8.402 1.00 0.00 H new ATOM 287 N ASP A 81 -9.924 13.457 6.930 1.00 0.00 N ATOM 288 CA ASP A 81 -11.352 13.194 7.041 1.00 0.00 C ATOM 289 C ASP A 81 -12.038 13.330 5.674 1.00 0.00 C ATOM 290 O ASP A 81 -13.151 12.854 5.466 1.00 0.00 O ATOM 291 CB ASP A 81 -11.987 14.157 8.054 1.00 0.00 C ATOM 292 CG ASP A 81 -13.483 14.000 8.175 1.00 0.00 C ATOM 293 OD1 ASP A 81 -13.950 12.993 8.756 1.00 0.00 O ATOM 294 OD2 ASP A 81 -14.217 14.894 7.702 1.00 0.00 O ATOM 0 H ASP A 81 -9.640 14.365 7.299 1.00 0.00 H new ATOM 0 HA ASP A 81 -11.489 12.171 7.391 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -11.532 13.996 9.031 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -11.759 15.182 7.761 1.00 0.00 H new ATOM 299 N SER A 82 -11.359 13.963 4.745 1.00 0.00 N ATOM 300 CA SER A 82 -11.890 14.174 3.417 1.00 0.00 C ATOM 301 C SER A 82 -11.426 13.061 2.473 1.00 0.00 C ATOM 302 O SER A 82 -11.801 13.025 1.294 1.00 0.00 O ATOM 303 CB SER A 82 -11.447 15.546 2.911 1.00 0.00 C ATOM 304 OG SER A 82 -11.801 16.559 3.857 1.00 0.00 O ATOM 0 H SER A 82 -10.424 14.346 4.888 1.00 0.00 H new ATOM 0 HA SER A 82 -12.979 14.145 3.450 1.00 0.00 H new ATOM 0 HB2 SER A 82 -10.369 15.551 2.748 1.00 0.00 H new ATOM 0 HB3 SER A 82 -11.916 15.756 1.950 1.00 0.00 H new ATOM 0 HG SER A 82 -11.511 17.434 3.524 1.00 0.00 H new ATOM 310 N ILE A 83 -10.618 12.154 3.000 1.00 0.00 N ATOM 311 CA ILE A 83 -10.119 11.039 2.234 1.00 0.00 C ATOM 312 C ILE A 83 -11.235 10.006 2.111 1.00 0.00 C ATOM 313 O ILE A 83 -11.888 9.691 3.104 1.00 0.00 O ATOM 314 CB ILE A 83 -8.883 10.380 2.919 1.00 0.00 C ATOM 315 CG1 ILE A 83 -7.803 11.426 3.228 1.00 0.00 C ATOM 316 CG2 ILE A 83 -8.305 9.256 2.063 1.00 0.00 C ATOM 317 CD1 ILE A 83 -7.280 12.183 2.038 1.00 0.00 C ATOM 0 H ILE A 83 -10.295 12.176 3.967 1.00 0.00 H new ATOM 0 HA ILE A 83 -9.805 11.398 1.254 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.224 9.947 3.859 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -8.208 12.142 3.943 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -6.966 10.926 3.716 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -7.445 8.818 2.570 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -9.064 8.489 1.908 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -7.993 9.657 1.099 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -6.523 12.896 2.364 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -6.838 11.484 1.328 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.100 12.718 1.558 1.00 0.00 H new ATOM 329 N PRO A 84 -11.518 9.534 0.890 1.00 0.00 N ATOM 330 CA PRO A 84 -12.539 8.509 0.648 1.00 0.00 C ATOM 331 C PRO A 84 -12.338 7.243 1.492 1.00 0.00 C ATOM 332 O PRO A 84 -11.245 6.638 1.514 1.00 0.00 O ATOM 333 CB PRO A 84 -12.327 8.163 -0.824 1.00 0.00 C ATOM 334 CG PRO A 84 -11.778 9.411 -1.415 1.00 0.00 C ATOM 335 CD PRO A 84 -10.899 9.999 -0.365 1.00 0.00 C ATOM 0 HA PRO A 84 -13.534 8.872 0.905 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -11.636 7.329 -0.942 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -13.262 7.872 -1.304 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -11.215 9.200 -2.324 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -12.577 10.100 -1.688 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -9.870 9.651 -0.460 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -10.874 11.087 -0.423 1.00 0.00 H new ATOM 343 N SER A 85 -13.384 6.827 2.142 1.00 0.00 N ATOM 344 CA SER A 85 -13.371 5.636 2.927 1.00 0.00 C ATOM 345 C SER A 85 -13.797 4.449 2.065 1.00 0.00 C ATOM 346 O SER A 85 -14.857 3.857 2.261 1.00 0.00 O ATOM 347 CB SER A 85 -14.291 5.832 4.127 1.00 0.00 C ATOM 348 OG SER A 85 -15.545 6.376 3.706 1.00 0.00 O ATOM 0 H SER A 85 -14.280 7.314 2.140 1.00 0.00 H new ATOM 0 HA SER A 85 -12.367 5.426 3.296 1.00 0.00 H new ATOM 0 HB2 SER A 85 -14.451 4.879 4.631 1.00 0.00 H new ATOM 0 HB3 SER A 85 -13.821 6.500 4.849 1.00 0.00 H new ATOM 0 HG SER A 85 -15.919 5.820 2.991 1.00 0.00 H new ATOM 354 N ALA A 86 -12.978 4.142 1.096 1.00 0.00 N ATOM 355 CA ALA A 86 -13.260 3.103 0.138 1.00 0.00 C ATOM 356 C ALA A 86 -12.024 2.260 -0.050 1.00 0.00 C ATOM 357 O ALA A 86 -11.005 2.516 0.594 1.00 0.00 O ATOM 358 CB ALA A 86 -13.713 3.715 -1.184 1.00 0.00 C ATOM 0 H ALA A 86 -12.085 4.611 0.946 1.00 0.00 H new ATOM 0 HA ALA A 86 -14.068 2.470 0.505 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -13.923 2.920 -1.900 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -14.615 4.305 -1.022 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -12.925 4.358 -1.576 1.00 0.00 H new ATOM 364 N SER A 87 -12.094 1.298 -0.918 1.00 0.00 N ATOM 365 CA SER A 87 -11.006 0.394 -1.123 1.00 0.00 C ATOM 366 C SER A 87 -10.215 0.826 -2.347 1.00 0.00 C ATOM 367 O SER A 87 -10.788 1.328 -3.326 1.00 0.00 O ATOM 368 CB SER A 87 -11.571 -1.017 -1.312 1.00 0.00 C ATOM 369 OG SER A 87 -10.576 -2.037 -1.191 1.00 0.00 O ATOM 0 H SER A 87 -12.909 1.118 -1.505 1.00 0.00 H new ATOM 0 HA SER A 87 -10.338 0.399 -0.262 1.00 0.00 H new ATOM 0 HB2 SER A 87 -12.354 -1.191 -0.574 1.00 0.00 H new ATOM 0 HB3 SER A 87 -12.038 -1.087 -2.294 1.00 0.00 H new ATOM 0 HG SER A 87 -9.884 -1.901 -1.871 1.00 0.00 H new ATOM 375 N GLY A 88 -8.919 0.668 -2.291 1.00 0.00 N ATOM 376 CA GLY A 88 -8.128 1.003 -3.415 1.00 0.00 C ATOM 377 C GLY A 88 -6.684 1.147 -3.080 1.00 0.00 C ATOM 378 O GLY A 88 -6.175 0.497 -2.147 1.00 0.00 O ATOM 0 H GLY A 88 -8.406 0.313 -1.484 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -8.245 0.234 -4.178 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -8.492 1.936 -3.845 1.00 0.00 H new ATOM 382 N VAL A 89 -6.049 2.021 -3.787 1.00 0.00 N ATOM 383 CA VAL A 89 -4.638 2.234 -3.699 1.00 0.00 C ATOM 384 C VAL A 89 -4.368 3.713 -3.461 1.00 0.00 C ATOM 385 O VAL A 89 -5.157 4.567 -3.865 1.00 0.00 O ATOM 386 CB VAL A 89 -3.951 1.718 -5.012 1.00 0.00 C ATOM 387 CG1 VAL A 89 -4.568 2.336 -6.252 1.00 0.00 C ATOM 388 CG2 VAL A 89 -2.431 1.894 -4.999 1.00 0.00 C ATOM 0 H VAL A 89 -6.510 2.628 -4.465 1.00 0.00 H new ATOM 0 HA VAL A 89 -4.218 1.677 -2.862 1.00 0.00 H new ATOM 0 HB VAL A 89 -4.138 0.645 -5.047 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -4.064 1.952 -7.139 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -5.627 2.081 -6.297 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -4.457 3.420 -6.212 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -2.013 1.519 -5.933 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -2.188 2.951 -4.891 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -2.007 1.338 -4.163 1.00 0.00 H new ATOM 398 N TYR A 90 -3.308 4.010 -2.768 1.00 0.00 N ATOM 399 CA TYR A 90 -2.954 5.367 -2.484 1.00 0.00 C ATOM 400 C TYR A 90 -1.447 5.544 -2.565 1.00 0.00 C ATOM 401 O TYR A 90 -0.681 4.577 -2.397 1.00 0.00 O ATOM 402 CB TYR A 90 -3.488 5.798 -1.105 1.00 0.00 C ATOM 403 CG TYR A 90 -3.004 4.940 0.035 1.00 0.00 C ATOM 404 CD1 TYR A 90 -1.796 5.205 0.654 1.00 0.00 C ATOM 405 CD2 TYR A 90 -3.751 3.861 0.486 1.00 0.00 C ATOM 406 CE1 TYR A 90 -1.341 4.428 1.677 1.00 0.00 C ATOM 407 CE2 TYR A 90 -3.299 3.073 1.517 1.00 0.00 C ATOM 408 CZ TYR A 90 -2.093 3.364 2.108 1.00 0.00 C ATOM 409 OH TYR A 90 -1.628 2.584 3.138 1.00 0.00 O ATOM 0 H TYR A 90 -2.665 3.317 -2.384 1.00 0.00 H new ATOM 0 HA TYR A 90 -3.417 6.010 -3.233 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -3.193 6.831 -0.919 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -4.578 5.776 -1.126 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.202 6.043 0.321 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -4.700 3.638 0.021 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -0.394 4.648 2.146 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -3.886 2.233 1.859 1.00 0.00 H new ATOM 0 HH TYR A 90 -1.007 3.105 3.688 1.00 0.00 H new ATOM 419 N ALA A 91 -1.040 6.751 -2.810 1.00 0.00 N ATOM 420 CA ALA A 91 0.342 7.113 -2.929 1.00 0.00 C ATOM 421 C ALA A 91 0.655 8.234 -1.947 1.00 0.00 C ATOM 422 O ALA A 91 0.037 9.299 -2.002 1.00 0.00 O ATOM 423 CB ALA A 91 0.617 7.558 -4.355 1.00 0.00 C ATOM 0 H ALA A 91 -1.678 7.536 -2.937 1.00 0.00 H new ATOM 0 HA ALA A 91 0.977 6.258 -2.697 1.00 0.00 H new ATOM 0 HB1 ALA A 91 1.667 7.835 -4.454 1.00 0.00 H new ATOM 0 HB2 ALA A 91 0.391 6.741 -5.041 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -0.009 8.417 -4.595 1.00 0.00 H new ATOM 429 N VAL A 92 1.589 7.991 -1.059 1.00 0.00 N ATOM 430 CA VAL A 92 1.964 8.943 -0.033 1.00 0.00 C ATOM 431 C VAL A 92 3.200 9.746 -0.467 1.00 0.00 C ATOM 432 O VAL A 92 4.296 9.177 -0.710 1.00 0.00 O ATOM 433 CB VAL A 92 2.252 8.232 1.319 1.00 0.00 C ATOM 434 CG1 VAL A 92 2.587 9.241 2.406 1.00 0.00 C ATOM 435 CG2 VAL A 92 1.063 7.387 1.742 1.00 0.00 C ATOM 0 H VAL A 92 2.117 7.119 -1.025 1.00 0.00 H new ATOM 0 HA VAL A 92 1.124 9.623 0.106 1.00 0.00 H new ATOM 0 HB VAL A 92 3.114 7.581 1.176 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.784 8.717 3.341 1.00 0.00 H new ATOM 0 HG12 VAL A 92 3.471 9.809 2.115 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.747 9.922 2.542 1.00 0.00 H new ATOM 0 HG21 VAL A 92 1.284 6.897 2.690 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.186 8.024 1.858 1.00 0.00 H new ATOM 0 HG23 VAL A 92 0.864 6.632 0.981 1.00 0.00 H new ATOM 445 N TYR A 93 3.015 11.042 -0.563 1.00 0.00 N ATOM 446 CA TYR A 93 4.039 11.978 -0.970 1.00 0.00 C ATOM 447 C TYR A 93 4.436 12.826 0.210 1.00 0.00 C ATOM 448 O TYR A 93 3.571 13.276 0.968 1.00 0.00 O ATOM 449 CB TYR A 93 3.496 12.913 -2.065 1.00 0.00 C ATOM 450 CG TYR A 93 3.220 12.256 -3.390 1.00 0.00 C ATOM 451 CD1 TYR A 93 2.116 11.445 -3.583 1.00 0.00 C ATOM 452 CD2 TYR A 93 4.072 12.452 -4.452 1.00 0.00 C ATOM 453 CE1 TYR A 93 1.887 10.844 -4.798 1.00 0.00 C ATOM 454 CE2 TYR A 93 3.850 11.864 -5.666 1.00 0.00 C ATOM 455 CZ TYR A 93 2.760 11.059 -5.837 1.00 0.00 C ATOM 456 OH TYR A 93 2.548 10.454 -7.049 1.00 0.00 O ATOM 0 H TYR A 93 2.122 11.488 -0.354 1.00 0.00 H new ATOM 0 HA TYR A 93 4.894 11.417 -1.349 1.00 0.00 H new ATOM 0 HB2 TYR A 93 2.574 13.370 -1.705 1.00 0.00 H new ATOM 0 HB3 TYR A 93 4.213 13.720 -2.220 1.00 0.00 H new ATOM 0 HD1 TYR A 93 1.425 11.282 -2.769 1.00 0.00 H new ATOM 0 HD2 TYR A 93 4.937 13.086 -4.324 1.00 0.00 H new ATOM 0 HE1 TYR A 93 1.026 10.207 -4.935 1.00 0.00 H new ATOM 0 HE2 TYR A 93 4.533 12.035 -6.485 1.00 0.00 H new ATOM 0 HH TYR A 93 3.380 10.458 -7.566 1.00 0.00 H new ATOM 466 N ASP A 94 5.712 13.057 0.385 1.00 0.00 N ATOM 467 CA ASP A 94 6.145 13.926 1.464 1.00 0.00 C ATOM 468 C ASP A 94 5.999 15.402 1.063 1.00 0.00 C ATOM 469 O ASP A 94 5.398 15.725 0.025 1.00 0.00 O ATOM 470 CB ASP A 94 7.587 13.619 1.948 1.00 0.00 C ATOM 471 CG ASP A 94 8.686 13.883 0.931 1.00 0.00 C ATOM 472 OD1 ASP A 94 8.859 15.041 0.497 1.00 0.00 O ATOM 473 OD2 ASP A 94 9.449 12.959 0.631 1.00 0.00 O ATOM 0 H ASP A 94 6.460 12.668 -0.189 1.00 0.00 H new ATOM 0 HA ASP A 94 5.489 13.725 2.311 1.00 0.00 H new ATOM 0 HB2 ASP A 94 7.788 14.215 2.838 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.636 12.572 2.248 1.00 0.00 H new ATOM 478 N LYS A 95 6.564 16.279 1.881 1.00 0.00 N ATOM 479 CA LYS A 95 6.480 17.738 1.720 1.00 0.00 C ATOM 480 C LYS A 95 7.024 18.220 0.354 1.00 0.00 C ATOM 481 O LYS A 95 6.642 19.289 -0.134 1.00 0.00 O ATOM 482 CB LYS A 95 7.304 18.421 2.821 1.00 0.00 C ATOM 483 CG LYS A 95 6.953 18.048 4.264 1.00 0.00 C ATOM 484 CD LYS A 95 5.554 18.479 4.657 1.00 0.00 C ATOM 485 CE LYS A 95 5.290 18.191 6.132 1.00 0.00 C ATOM 486 NZ LYS A 95 3.921 18.574 6.548 1.00 0.00 N ATOM 0 H LYS A 95 7.108 15.997 2.696 1.00 0.00 H new ATOM 0 HA LYS A 95 5.424 18.002 1.783 1.00 0.00 H new ATOM 0 HB2 LYS A 95 8.356 18.189 2.654 1.00 0.00 H new ATOM 0 HB3 LYS A 95 7.194 19.500 2.711 1.00 0.00 H new ATOM 0 HG2 LYS A 95 7.044 16.969 4.388 1.00 0.00 H new ATOM 0 HG3 LYS A 95 7.674 18.509 4.939 1.00 0.00 H new ATOM 0 HD2 LYS A 95 5.429 19.544 4.462 1.00 0.00 H new ATOM 0 HD3 LYS A 95 4.822 17.955 4.043 1.00 0.00 H new ATOM 0 HE2 LYS A 95 5.441 17.129 6.324 1.00 0.00 H new ATOM 0 HE3 LYS A 95 6.016 18.731 6.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 3.927 18.848 7.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 3.595 19.376 5.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 3.279 17.767 6.413 1.00 0.00 H new ATOM 500 N SER A 96 7.888 17.440 -0.254 1.00 0.00 N ATOM 501 CA SER A 96 8.542 17.838 -1.474 1.00 0.00 C ATOM 502 C SER A 96 8.011 17.026 -2.684 1.00 0.00 C ATOM 503 O SER A 96 8.646 16.982 -3.741 1.00 0.00 O ATOM 504 CB SER A 96 10.058 17.646 -1.285 1.00 0.00 C ATOM 505 OG SER A 96 10.827 18.312 -2.280 1.00 0.00 O ATOM 0 H SER A 96 8.155 16.515 0.084 1.00 0.00 H new ATOM 0 HA SER A 96 8.329 18.885 -1.689 1.00 0.00 H new ATOM 0 HB2 SER A 96 10.347 18.016 -0.301 1.00 0.00 H new ATOM 0 HB3 SER A 96 10.290 16.581 -1.305 1.00 0.00 H new ATOM 0 HG SER A 96 10.423 18.163 -3.160 1.00 0.00 H new ATOM 511 N ASP A 97 6.833 16.386 -2.513 1.00 0.00 N ATOM 512 CA ASP A 97 6.155 15.600 -3.599 1.00 0.00 C ATOM 513 C ASP A 97 6.981 14.354 -3.966 1.00 0.00 C ATOM 514 O ASP A 97 6.834 13.737 -5.026 1.00 0.00 O ATOM 515 CB ASP A 97 5.839 16.508 -4.835 1.00 0.00 C ATOM 516 CG ASP A 97 5.105 15.827 -5.998 1.00 0.00 C ATOM 517 OD1 ASP A 97 3.885 15.578 -5.900 1.00 0.00 O ATOM 518 OD2 ASP A 97 5.729 15.611 -7.071 1.00 0.00 O ATOM 0 H ASP A 97 6.320 16.392 -1.632 1.00 0.00 H new ATOM 0 HA ASP A 97 5.195 15.242 -3.227 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.238 17.352 -4.497 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.777 16.915 -5.212 1.00 0.00 H new ATOM 523 N GLU A 98 7.830 13.959 -3.059 1.00 0.00 N ATOM 524 CA GLU A 98 8.575 12.762 -3.238 1.00 0.00 C ATOM 525 C GLU A 98 7.732 11.593 -2.797 1.00 0.00 C ATOM 526 O GLU A 98 7.465 11.410 -1.599 1.00 0.00 O ATOM 527 CB GLU A 98 9.890 12.782 -2.474 1.00 0.00 C ATOM 528 CG GLU A 98 10.885 13.825 -2.945 1.00 0.00 C ATOM 529 CD GLU A 98 11.323 13.620 -4.374 1.00 0.00 C ATOM 530 OE1 GLU A 98 11.553 12.459 -4.789 1.00 0.00 O ATOM 531 OE2 GLU A 98 11.485 14.615 -5.101 1.00 0.00 O ATOM 0 H GLU A 98 8.018 14.456 -2.188 1.00 0.00 H new ATOM 0 HA GLU A 98 8.826 12.670 -4.295 1.00 0.00 H new ATOM 0 HB2 GLU A 98 9.678 12.953 -1.419 1.00 0.00 H new ATOM 0 HB3 GLU A 98 10.353 11.798 -2.550 1.00 0.00 H new ATOM 0 HG2 GLU A 98 10.439 14.815 -2.846 1.00 0.00 H new ATOM 0 HG3 GLU A 98 11.760 13.803 -2.296 1.00 0.00 H new ATOM 538 N LEU A 99 7.221 10.879 -3.766 1.00 0.00 N ATOM 539 CA LEU A 99 6.487 9.668 -3.520 1.00 0.00 C ATOM 540 C LEU A 99 7.443 8.666 -2.954 1.00 0.00 C ATOM 541 O LEU A 99 8.408 8.286 -3.612 1.00 0.00 O ATOM 542 CB LEU A 99 5.833 9.175 -4.834 1.00 0.00 C ATOM 543 CG LEU A 99 4.990 7.872 -4.828 1.00 0.00 C ATOM 544 CD1 LEU A 99 5.858 6.615 -4.833 1.00 0.00 C ATOM 545 CD2 LEU A 99 4.061 7.863 -3.638 1.00 0.00 C ATOM 0 H LEU A 99 7.304 11.124 -4.753 1.00 0.00 H new ATOM 0 HA LEU A 99 5.679 9.830 -2.807 1.00 0.00 H new ATOM 0 HB2 LEU A 99 5.192 9.977 -5.200 1.00 0.00 H new ATOM 0 HB3 LEU A 99 6.630 9.045 -5.566 1.00 0.00 H new ATOM 0 HG LEU A 99 4.406 7.859 -5.748 1.00 0.00 H new ATOM 0 HD11 LEU A 99 5.219 5.732 -4.828 1.00 0.00 H new ATOM 0 HD12 LEU A 99 6.482 6.607 -5.727 1.00 0.00 H new ATOM 0 HD13 LEU A 99 6.493 6.608 -3.947 1.00 0.00 H new ATOM 0 HD21 LEU A 99 3.473 6.945 -3.642 1.00 0.00 H new ATOM 0 HD22 LEU A 99 4.646 7.916 -2.720 1.00 0.00 H new ATOM 0 HD23 LEU A 99 3.392 8.722 -3.692 1.00 0.00 H new ATOM 557 N GLN A 100 7.206 8.287 -1.738 1.00 0.00 N ATOM 558 CA GLN A 100 8.064 7.361 -1.070 1.00 0.00 C ATOM 559 C GLN A 100 7.338 6.124 -0.585 1.00 0.00 C ATOM 560 O GLN A 100 7.972 5.150 -0.165 1.00 0.00 O ATOM 561 CB GLN A 100 8.868 8.034 0.034 1.00 0.00 C ATOM 562 CG GLN A 100 9.962 8.949 -0.490 1.00 0.00 C ATOM 563 CD GLN A 100 10.877 9.419 0.599 1.00 0.00 C ATOM 564 OE1 GLN A 100 11.872 8.772 0.911 1.00 0.00 O ATOM 565 NE2 GLN A 100 10.596 10.550 1.150 1.00 0.00 N ATOM 0 H GLN A 100 6.414 8.610 -1.182 1.00 0.00 H new ATOM 0 HA GLN A 100 8.777 7.008 -1.816 1.00 0.00 H new ATOM 0 HB2 GLN A 100 8.193 8.612 0.665 1.00 0.00 H new ATOM 0 HB3 GLN A 100 9.317 7.267 0.666 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.542 8.422 -1.247 1.00 0.00 H new ATOM 0 HG3 GLN A 100 9.509 9.811 -0.979 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.760 11.062 0.867 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.209 10.933 1.869 1.00 0.00 H new ATOM 574 N PHE A 101 6.027 6.161 -0.577 1.00 0.00 N ATOM 575 CA PHE A 101 5.285 4.992 -0.183 1.00 0.00 C ATOM 576 C PHE A 101 3.956 4.886 -0.908 1.00 0.00 C ATOM 577 O PHE A 101 3.160 5.812 -0.896 1.00 0.00 O ATOM 578 CB PHE A 101 5.070 4.956 1.345 1.00 0.00 C ATOM 579 CG PHE A 101 4.171 3.842 1.808 1.00 0.00 C ATOM 580 CD1 PHE A 101 4.595 2.531 1.769 1.00 0.00 C ATOM 581 CD2 PHE A 101 2.893 4.116 2.270 1.00 0.00 C ATOM 582 CE1 PHE A 101 3.765 1.510 2.177 1.00 0.00 C ATOM 583 CE2 PHE A 101 2.059 3.103 2.683 1.00 0.00 C ATOM 584 CZ PHE A 101 2.495 1.797 2.636 1.00 0.00 C ATOM 0 H PHE A 101 5.463 6.971 -0.834 1.00 0.00 H new ATOM 0 HA PHE A 101 5.885 4.128 -0.470 1.00 0.00 H new ATOM 0 HB2 PHE A 101 6.038 4.856 1.836 1.00 0.00 H new ATOM 0 HB3 PHE A 101 4.647 5.908 1.665 1.00 0.00 H new ATOM 0 HD1 PHE A 101 5.589 2.302 1.415 1.00 0.00 H new ATOM 0 HD2 PHE A 101 2.547 5.139 2.306 1.00 0.00 H new ATOM 0 HE1 PHE A 101 4.107 0.486 2.138 1.00 0.00 H new ATOM 0 HE2 PHE A 101 1.066 3.331 3.043 1.00 0.00 H new ATOM 0 HZ PHE A 101 1.844 0.998 2.958 1.00 0.00 H new ATOM 594 N VAL A 102 3.739 3.773 -1.543 1.00 0.00 N ATOM 595 CA VAL A 102 2.447 3.460 -2.127 1.00 0.00 C ATOM 596 C VAL A 102 1.894 2.234 -1.441 1.00 0.00 C ATOM 597 O VAL A 102 2.655 1.326 -1.068 1.00 0.00 O ATOM 598 CB VAL A 102 2.456 3.247 -3.680 1.00 0.00 C ATOM 599 CG1 VAL A 102 2.770 4.525 -4.402 1.00 0.00 C ATOM 600 CG2 VAL A 102 3.433 2.174 -4.102 1.00 0.00 C ATOM 0 H VAL A 102 4.445 3.049 -1.677 1.00 0.00 H new ATOM 0 HA VAL A 102 1.815 4.334 -1.967 1.00 0.00 H new ATOM 0 HB VAL A 102 1.453 2.920 -3.952 1.00 0.00 H new ATOM 0 HG11 VAL A 102 2.769 4.345 -5.477 1.00 0.00 H new ATOM 0 HG12 VAL A 102 2.017 5.275 -4.159 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.752 4.884 -4.095 1.00 0.00 H new ATOM 0 HG21 VAL A 102 3.404 2.062 -5.186 1.00 0.00 H new ATOM 0 HG22 VAL A 102 4.439 2.456 -3.793 1.00 0.00 H new ATOM 0 HG23 VAL A 102 3.161 1.229 -3.632 1.00 0.00 H new ATOM 610 N GLY A 103 0.611 2.201 -1.250 1.00 0.00 N ATOM 611 CA GLY A 103 0.026 1.094 -0.560 1.00 0.00 C ATOM 612 C GLY A 103 -1.374 0.828 -1.003 1.00 0.00 C ATOM 613 O GLY A 103 -2.044 1.716 -1.535 1.00 0.00 O ATOM 0 H GLY A 103 -0.044 2.919 -1.558 1.00 0.00 H new ATOM 0 HA2 GLY A 103 0.633 0.204 -0.725 1.00 0.00 H new ATOM 0 HA3 GLY A 103 0.035 1.291 0.512 1.00 0.00 H new ATOM 617 N ILE A 104 -1.811 -0.382 -0.787 1.00 0.00 N ATOM 618 CA ILE A 104 -3.148 -0.814 -1.121 1.00 0.00 C ATOM 619 C ILE A 104 -3.865 -1.210 0.151 1.00 0.00 C ATOM 620 O ILE A 104 -3.290 -1.879 1.013 1.00 0.00 O ATOM 621 CB ILE A 104 -3.141 -1.987 -2.143 1.00 0.00 C ATOM 622 CG1 ILE A 104 -2.199 -3.128 -1.682 1.00 0.00 C ATOM 623 CG2 ILE A 104 -2.750 -1.472 -3.514 1.00 0.00 C ATOM 624 CD1 ILE A 104 -2.131 -4.312 -2.629 1.00 0.00 C ATOM 0 H ILE A 104 -1.239 -1.114 -0.365 1.00 0.00 H new ATOM 0 HA ILE A 104 -3.674 0.012 -1.600 1.00 0.00 H new ATOM 0 HB ILE A 104 -4.146 -2.404 -2.201 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -1.195 -2.723 -1.554 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -2.527 -3.480 -0.704 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -2.747 -2.298 -4.226 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -3.467 -0.717 -3.837 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.755 -1.030 -3.466 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -1.449 -5.061 -2.227 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.124 -4.747 -2.739 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -1.771 -3.979 -3.602 1.00 0.00 H new ATOM 636 N SER A 105 -5.079 -0.777 0.307 1.00 0.00 N ATOM 637 CA SER A 105 -5.803 -1.035 1.534 1.00 0.00 C ATOM 638 C SER A 105 -7.294 -1.218 1.277 1.00 0.00 C ATOM 639 O SER A 105 -7.816 -0.831 0.208 1.00 0.00 O ATOM 640 CB SER A 105 -5.555 0.105 2.533 1.00 0.00 C ATOM 641 OG SER A 105 -4.158 0.220 2.850 1.00 0.00 O ATOM 0 H SER A 105 -5.596 -0.244 -0.392 1.00 0.00 H new ATOM 0 HA SER A 105 -5.434 -1.968 1.960 1.00 0.00 H new ATOM 0 HB2 SER A 105 -5.915 1.045 2.114 1.00 0.00 H new ATOM 0 HB3 SER A 105 -6.124 -0.076 3.445 1.00 0.00 H new ATOM 0 HG SER A 105 -4.056 0.637 3.731 1.00 0.00 H new ATOM 647 N ARG A 106 -7.980 -1.813 2.241 1.00 0.00 N ATOM 648 CA ARG A 106 -9.399 -2.043 2.128 1.00 0.00 C ATOM 649 C ARG A 106 -10.165 -0.750 2.382 1.00 0.00 C ATOM 650 O ARG A 106 -11.208 -0.518 1.795 1.00 0.00 O ATOM 651 CB ARG A 106 -9.863 -3.173 3.063 1.00 0.00 C ATOM 652 CG ARG A 106 -11.351 -3.494 2.953 1.00 0.00 C ATOM 653 CD ARG A 106 -11.740 -3.872 1.525 1.00 0.00 C ATOM 654 NE ARG A 106 -13.173 -4.079 1.394 1.00 0.00 N ATOM 655 CZ ARG A 106 -13.876 -3.977 0.261 1.00 0.00 C ATOM 656 NH1 ARG A 106 -13.295 -3.606 -0.873 1.00 0.00 N ATOM 657 NH2 ARG A 106 -15.159 -4.226 0.272 1.00 0.00 N ATOM 0 H ARG A 106 -7.567 -2.145 3.113 1.00 0.00 H new ATOM 0 HA ARG A 106 -9.614 -2.369 1.110 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -9.290 -4.073 2.841 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -9.636 -2.896 4.092 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -11.598 -4.314 3.627 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -11.935 -2.631 3.274 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -11.422 -3.085 0.841 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -11.213 -4.780 1.233 1.00 0.00 H new ATOM 0 HE ARG A 106 -13.687 -4.323 2.240 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -12.297 -3.394 -0.889 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -13.846 -3.533 -1.728 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -15.619 -4.496 1.142 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -15.701 -4.150 -0.589 1.00 0.00 H new ATOM 671 N ASN A 107 -9.660 0.072 3.257 1.00 0.00 N ATOM 672 CA ASN A 107 -10.240 1.376 3.462 1.00 0.00 C ATOM 673 C ASN A 107 -9.131 2.386 3.466 1.00 0.00 C ATOM 674 O ASN A 107 -8.301 2.411 4.377 1.00 0.00 O ATOM 675 CB ASN A 107 -11.088 1.435 4.746 1.00 0.00 C ATOM 676 CG ASN A 107 -11.813 2.775 4.964 1.00 0.00 C ATOM 677 OD1 ASN A 107 -11.321 3.855 4.629 1.00 0.00 O ATOM 678 ND2 ASN A 107 -13.002 2.701 5.483 1.00 0.00 N ATOM 0 H ASN A 107 -8.849 -0.133 3.841 1.00 0.00 H new ATOM 0 HA ASN A 107 -10.931 1.601 2.650 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -11.828 0.635 4.716 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -10.443 1.240 5.603 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -13.552 3.549 5.622 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -13.386 1.795 5.752 1.00 0.00 H new ATOM 685 N ILE A 108 -9.095 3.172 2.414 1.00 0.00 N ATOM 686 CA ILE A 108 -8.085 4.178 2.201 1.00 0.00 C ATOM 687 C ILE A 108 -8.021 5.171 3.360 1.00 0.00 C ATOM 688 O ILE A 108 -6.990 5.279 4.002 1.00 0.00 O ATOM 689 CB ILE A 108 -8.287 4.919 0.846 1.00 0.00 C ATOM 690 CG1 ILE A 108 -8.238 3.915 -0.320 1.00 0.00 C ATOM 691 CG2 ILE A 108 -7.216 5.986 0.661 1.00 0.00 C ATOM 692 CD1 ILE A 108 -8.471 4.532 -1.688 1.00 0.00 C ATOM 0 H ILE A 108 -9.786 3.126 1.665 1.00 0.00 H new ATOM 0 HA ILE A 108 -7.128 3.659 2.157 1.00 0.00 H new ATOM 0 HB ILE A 108 -9.264 5.402 0.856 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -7.266 3.421 -0.318 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -8.988 3.143 -0.150 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -7.370 6.495 -0.290 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -7.279 6.709 1.474 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -6.232 5.518 0.667 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -8.420 3.755 -2.451 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -9.455 5.001 -1.713 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -7.706 5.284 -1.883 1.00 0.00 H new ATOM 704 N ALA A 109 -9.135 5.841 3.648 1.00 0.00 N ATOM 705 CA ALA A 109 -9.202 6.860 4.713 1.00 0.00 C ATOM 706 C ALA A 109 -8.695 6.336 6.038 1.00 0.00 C ATOM 707 O ALA A 109 -7.827 6.957 6.663 1.00 0.00 O ATOM 708 CB ALA A 109 -10.619 7.374 4.873 1.00 0.00 C ATOM 0 H ALA A 109 -10.017 5.699 3.156 1.00 0.00 H new ATOM 0 HA ALA A 109 -8.551 7.680 4.408 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -10.647 8.124 5.663 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -10.952 7.821 3.936 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -11.279 6.547 5.135 1.00 0.00 H new ATOM 714 N ALA A 110 -9.201 5.185 6.440 1.00 0.00 N ATOM 715 CA ALA A 110 -8.822 4.581 7.702 1.00 0.00 C ATOM 716 C ALA A 110 -7.332 4.250 7.730 1.00 0.00 C ATOM 717 O ALA A 110 -6.619 4.655 8.656 1.00 0.00 O ATOM 718 CB ALA A 110 -9.653 3.339 7.975 1.00 0.00 C ATOM 0 H ALA A 110 -9.882 4.646 5.905 1.00 0.00 H new ATOM 0 HA ALA A 110 -9.019 5.306 8.492 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -9.352 2.902 8.927 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -10.708 3.609 8.017 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -9.496 2.614 7.177 1.00 0.00 H new ATOM 724 N SER A 111 -6.866 3.570 6.692 1.00 0.00 N ATOM 725 CA SER A 111 -5.488 3.138 6.589 1.00 0.00 C ATOM 726 C SER A 111 -4.533 4.337 6.536 1.00 0.00 C ATOM 727 O SER A 111 -3.590 4.424 7.348 1.00 0.00 O ATOM 728 CB SER A 111 -5.323 2.242 5.353 1.00 0.00 C ATOM 729 OG SER A 111 -4.012 1.711 5.229 1.00 0.00 O ATOM 0 H SER A 111 -7.442 3.303 5.894 1.00 0.00 H new ATOM 0 HA SER A 111 -5.231 2.563 7.479 1.00 0.00 H new ATOM 0 HB2 SER A 111 -6.039 1.422 5.407 1.00 0.00 H new ATOM 0 HB3 SER A 111 -5.563 2.817 4.459 1.00 0.00 H new ATOM 0 HG SER A 111 -3.515 2.221 4.556 1.00 0.00 H new ATOM 735 N VAL A 112 -4.803 5.273 5.617 1.00 0.00 N ATOM 736 CA VAL A 112 -3.970 6.457 5.418 1.00 0.00 C ATOM 737 C VAL A 112 -3.820 7.223 6.712 1.00 0.00 C ATOM 738 O VAL A 112 -2.691 7.443 7.172 1.00 0.00 O ATOM 739 CB VAL A 112 -4.526 7.390 4.289 1.00 0.00 C ATOM 740 CG1 VAL A 112 -3.758 8.701 4.213 1.00 0.00 C ATOM 741 CG2 VAL A 112 -4.438 6.692 2.949 1.00 0.00 C ATOM 0 H VAL A 112 -5.607 5.227 4.992 1.00 0.00 H new ATOM 0 HA VAL A 112 -2.989 6.110 5.095 1.00 0.00 H new ATOM 0 HB VAL A 112 -5.565 7.611 4.532 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -4.173 9.321 3.418 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -3.841 9.227 5.164 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -2.708 8.496 4.002 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -4.827 7.348 2.171 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -3.398 6.449 2.733 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -5.026 5.775 2.977 1.00 0.00 H new ATOM 751 N SER A 113 -4.942 7.561 7.324 1.00 0.00 N ATOM 752 CA SER A 113 -4.946 8.296 8.567 1.00 0.00 C ATOM 753 C SER A 113 -4.178 7.550 9.658 1.00 0.00 C ATOM 754 O SER A 113 -3.306 8.131 10.306 1.00 0.00 O ATOM 755 CB SER A 113 -6.371 8.538 9.018 1.00 0.00 C ATOM 756 OG SER A 113 -7.118 9.207 8.013 1.00 0.00 O ATOM 0 H SER A 113 -5.871 7.332 6.971 1.00 0.00 H new ATOM 0 HA SER A 113 -4.449 9.251 8.395 1.00 0.00 H new ATOM 0 HB2 SER A 113 -6.847 7.587 9.257 1.00 0.00 H new ATOM 0 HB3 SER A 113 -6.371 9.132 9.932 1.00 0.00 H new ATOM 0 HG SER A 113 -7.496 8.548 7.393 1.00 0.00 H new ATOM 762 N ALA A 114 -4.461 6.251 9.801 1.00 0.00 N ATOM 763 CA ALA A 114 -3.847 5.434 10.835 1.00 0.00 C ATOM 764 C ALA A 114 -2.332 5.484 10.761 1.00 0.00 C ATOM 765 O ALA A 114 -1.676 5.933 11.705 1.00 0.00 O ATOM 766 CB ALA A 114 -4.336 3.993 10.760 1.00 0.00 C ATOM 0 H ALA A 114 -5.117 5.746 9.205 1.00 0.00 H new ATOM 0 HA ALA A 114 -4.150 5.851 11.796 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -3.860 3.406 11.545 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -5.417 3.968 10.894 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -4.081 3.572 9.787 1.00 0.00 H new ATOM 772 N HIS A 115 -1.765 5.101 9.625 1.00 0.00 N ATOM 773 CA HIS A 115 -0.310 5.056 9.534 1.00 0.00 C ATOM 774 C HIS A 115 0.340 6.427 9.483 1.00 0.00 C ATOM 775 O HIS A 115 1.465 6.568 9.902 1.00 0.00 O ATOM 776 CB HIS A 115 0.256 4.113 8.449 1.00 0.00 C ATOM 777 CG HIS A 115 -0.109 4.412 7.033 1.00 0.00 C ATOM 778 ND1 HIS A 115 0.434 5.452 6.298 1.00 0.00 N ATOM 779 CD2 HIS A 115 -0.945 3.774 6.208 1.00 0.00 C ATOM 780 CE1 HIS A 115 -0.071 5.422 5.082 1.00 0.00 C ATOM 781 NE2 HIS A 115 -0.908 4.410 5.009 1.00 0.00 N ATOM 0 H HIS A 115 -2.267 4.826 8.781 1.00 0.00 H new ATOM 0 HA HIS A 115 -0.024 4.601 10.482 1.00 0.00 H new ATOM 0 HB2 HIS A 115 1.343 4.121 8.527 1.00 0.00 H new ATOM 0 HB3 HIS A 115 -0.073 3.099 8.677 1.00 0.00 H new ATOM 0 HD1 HIS A 115 1.114 6.130 6.642 1.00 0.00 H new ATOM 0 HD2 HIS A 115 -1.543 2.908 6.451 1.00 0.00 H new ATOM 0 HE1 HIS A 115 0.162 6.110 4.283 1.00 0.00 H new ATOM 790 N LEU A 116 -0.356 7.442 9.003 1.00 0.00 N ATOM 791 CA LEU A 116 0.241 8.781 8.987 1.00 0.00 C ATOM 792 C LEU A 116 0.267 9.386 10.379 1.00 0.00 C ATOM 793 O LEU A 116 1.135 10.182 10.700 1.00 0.00 O ATOM 794 CB LEU A 116 -0.435 9.714 7.986 1.00 0.00 C ATOM 795 CG LEU A 116 -0.259 9.357 6.504 1.00 0.00 C ATOM 796 CD1 LEU A 116 -0.953 10.378 5.634 1.00 0.00 C ATOM 797 CD2 LEU A 116 1.219 9.264 6.132 1.00 0.00 C ATOM 0 H LEU A 116 -1.303 7.379 8.629 1.00 0.00 H new ATOM 0 HA LEU A 116 1.271 8.662 8.651 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -1.502 9.740 8.208 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -0.052 10.722 8.144 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.713 8.380 6.336 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -0.820 10.113 4.585 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -2.017 10.396 5.872 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -0.524 11.363 5.816 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.313 9.010 5.076 1.00 0.00 H new ATOM 0 HD22 LEU A 116 1.702 10.223 6.319 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.698 8.493 6.735 1.00 0.00 H new ATOM 809 N LYS A 117 -0.673 8.981 11.212 1.00 0.00 N ATOM 810 CA LYS A 117 -0.688 9.426 12.595 1.00 0.00 C ATOM 811 C LYS A 117 0.173 8.513 13.458 1.00 0.00 C ATOM 812 O LYS A 117 0.339 8.733 14.661 1.00 0.00 O ATOM 813 CB LYS A 117 -2.118 9.532 13.134 1.00 0.00 C ATOM 814 CG LYS A 117 -2.968 10.567 12.404 1.00 0.00 C ATOM 815 CD LYS A 117 -2.364 11.960 12.516 1.00 0.00 C ATOM 816 CE LYS A 117 -3.159 12.975 11.725 1.00 0.00 C ATOM 817 NZ LYS A 117 -2.573 14.326 11.822 1.00 0.00 N ATOM 0 H LYS A 117 -1.432 8.349 10.959 1.00 0.00 H new ATOM 0 HA LYS A 117 -0.260 10.427 12.635 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -2.600 8.558 13.057 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -2.081 9.786 14.193 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -3.058 10.291 11.353 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -3.976 10.571 12.820 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -2.330 12.260 13.563 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -1.335 11.942 12.156 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -3.199 12.670 10.679 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -4.186 12.997 12.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -3.146 14.993 11.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -2.558 14.627 12.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -1.602 14.311 11.450 1.00 0.00 H new ATOM 831 N SER A 118 0.693 7.480 12.844 1.00 0.00 N ATOM 832 CA SER A 118 1.622 6.606 13.499 1.00 0.00 C ATOM 833 C SER A 118 3.040 7.052 13.159 1.00 0.00 C ATOM 834 O SER A 118 3.865 7.291 14.047 1.00 0.00 O ATOM 835 CB SER A 118 1.393 5.161 13.066 1.00 0.00 C ATOM 836 OG SER A 118 0.049 4.772 13.321 1.00 0.00 O ATOM 0 H SER A 118 0.483 7.225 11.879 1.00 0.00 H new ATOM 0 HA SER A 118 1.474 6.656 14.578 1.00 0.00 H new ATOM 0 HB2 SER A 118 1.614 5.054 12.004 1.00 0.00 H new ATOM 0 HB3 SER A 118 2.076 4.502 13.601 1.00 0.00 H new ATOM 0 HG SER A 118 -0.522 5.061 12.579 1.00 0.00 H new ATOM 842 N VAL A 119 3.294 7.218 11.879 1.00 0.00 N ATOM 843 CA VAL A 119 4.581 7.608 11.398 1.00 0.00 C ATOM 844 C VAL A 119 4.476 8.837 10.450 1.00 0.00 C ATOM 845 O VAL A 119 4.159 8.713 9.261 1.00 0.00 O ATOM 846 CB VAL A 119 5.339 6.397 10.738 1.00 0.00 C ATOM 847 CG1 VAL A 119 4.530 5.733 9.627 1.00 0.00 C ATOM 848 CG2 VAL A 119 6.696 6.815 10.230 1.00 0.00 C ATOM 0 H VAL A 119 2.600 7.082 11.144 1.00 0.00 H new ATOM 0 HA VAL A 119 5.182 7.920 12.252 1.00 0.00 H new ATOM 0 HB VAL A 119 5.475 5.653 11.523 1.00 0.00 H new ATOM 0 HG11 VAL A 119 5.100 4.904 9.207 1.00 0.00 H new ATOM 0 HG12 VAL A 119 3.591 5.358 10.035 1.00 0.00 H new ATOM 0 HG13 VAL A 119 4.320 6.462 8.845 1.00 0.00 H new ATOM 0 HG21 VAL A 119 7.196 5.958 9.779 1.00 0.00 H new ATOM 0 HG22 VAL A 119 6.579 7.600 9.483 1.00 0.00 H new ATOM 0 HG23 VAL A 119 7.295 7.190 11.060 1.00 0.00 H new ATOM 858 N PRO A 120 4.726 10.056 10.982 1.00 0.00 N ATOM 859 CA PRO A 120 4.647 11.319 10.213 1.00 0.00 C ATOM 860 C PRO A 120 5.871 11.554 9.306 1.00 0.00 C ATOM 861 O PRO A 120 6.165 12.688 8.914 1.00 0.00 O ATOM 862 CB PRO A 120 4.581 12.407 11.309 1.00 0.00 C ATOM 863 CG PRO A 120 4.432 11.667 12.600 1.00 0.00 C ATOM 864 CD PRO A 120 5.060 10.328 12.381 1.00 0.00 C ATOM 0 HA PRO A 120 3.794 11.315 9.535 1.00 0.00 H new ATOM 0 HB2 PRO A 120 5.483 13.019 11.309 1.00 0.00 H new ATOM 0 HB3 PRO A 120 3.740 13.080 11.143 1.00 0.00 H new ATOM 0 HG2 PRO A 120 4.923 12.200 13.414 1.00 0.00 H new ATOM 0 HG3 PRO A 120 3.382 11.566 12.873 1.00 0.00 H new ATOM 0 HD2 PRO A 120 6.137 10.352 12.545 1.00 0.00 H new ATOM 0 HD3 PRO A 120 4.652 9.572 13.052 1.00 0.00 H new ATOM 872 N GLU A 121 6.523 10.473 8.941 1.00 0.00 N ATOM 873 CA GLU A 121 7.725 10.478 8.120 1.00 0.00 C ATOM 874 C GLU A 121 7.434 11.071 6.735 1.00 0.00 C ATOM 875 O GLU A 121 8.207 11.857 6.202 1.00 0.00 O ATOM 876 CB GLU A 121 8.192 9.022 7.954 1.00 0.00 C ATOM 877 CG GLU A 121 9.514 8.823 7.235 1.00 0.00 C ATOM 878 CD GLU A 121 10.685 9.336 8.025 1.00 0.00 C ATOM 879 OE1 GLU A 121 11.142 8.628 8.955 1.00 0.00 O ATOM 880 OE2 GLU A 121 11.178 10.447 7.732 1.00 0.00 O ATOM 0 H GLU A 121 6.227 9.535 9.213 1.00 0.00 H new ATOM 0 HA GLU A 121 8.492 11.085 8.601 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.268 8.571 8.943 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.421 8.474 7.413 1.00 0.00 H new ATOM 0 HG2 GLU A 121 9.656 7.762 7.030 1.00 0.00 H new ATOM 0 HG3 GLU A 121 9.480 9.332 6.272 1.00 0.00 H new ATOM 887 N LEU A 122 6.299 10.708 6.180 1.00 0.00 N ATOM 888 CA LEU A 122 5.971 11.069 4.809 1.00 0.00 C ATOM 889 C LEU A 122 4.701 11.907 4.725 1.00 0.00 C ATOM 890 O LEU A 122 4.079 11.990 3.675 1.00 0.00 O ATOM 891 CB LEU A 122 5.824 9.796 3.973 1.00 0.00 C ATOM 892 CG LEU A 122 7.039 8.863 3.944 1.00 0.00 C ATOM 893 CD1 LEU A 122 6.744 7.632 3.116 1.00 0.00 C ATOM 894 CD2 LEU A 122 8.267 9.584 3.409 1.00 0.00 C ATOM 0 H LEU A 122 5.582 10.161 6.655 1.00 0.00 H new ATOM 0 HA LEU A 122 6.783 11.681 4.416 1.00 0.00 H new ATOM 0 HB2 LEU A 122 4.970 9.235 4.351 1.00 0.00 H new ATOM 0 HB3 LEU A 122 5.588 10.084 2.948 1.00 0.00 H new ATOM 0 HG LEU A 122 7.249 8.550 4.967 1.00 0.00 H new ATOM 0 HD11 LEU A 122 7.618 6.981 3.107 1.00 0.00 H new ATOM 0 HD12 LEU A 122 5.898 7.097 3.548 1.00 0.00 H new ATOM 0 HD13 LEU A 122 6.502 7.929 2.095 1.00 0.00 H new ATOM 0 HD21 LEU A 122 9.115 8.899 3.399 1.00 0.00 H new ATOM 0 HD22 LEU A 122 8.071 9.934 2.395 1.00 0.00 H new ATOM 0 HD23 LEU A 122 8.496 10.436 4.049 1.00 0.00 H new ATOM 906 N CYS A 123 4.334 12.535 5.810 1.00 0.00 N ATOM 907 CA CYS A 123 3.116 13.325 5.848 1.00 0.00 C ATOM 908 C CYS A 123 3.261 14.654 5.095 1.00 0.00 C ATOM 909 O CYS A 123 3.694 15.650 5.650 1.00 0.00 O ATOM 910 CB CYS A 123 2.675 13.554 7.291 1.00 0.00 C ATOM 911 SG CYS A 123 2.288 12.033 8.171 1.00 0.00 S ATOM 0 H CYS A 123 4.857 12.519 6.685 1.00 0.00 H new ATOM 0 HA CYS A 123 2.341 12.757 5.333 1.00 0.00 H new ATOM 0 HB2 CYS A 123 3.465 14.083 7.825 1.00 0.00 H new ATOM 0 HB3 CYS A 123 1.798 14.201 7.297 1.00 0.00 H new ATOM 0 HG CYS A 123 1.543 12.305 9.201 1.00 0.00 H new ATOM 917 N GLY A 124 2.967 14.632 3.815 1.00 0.00 N ATOM 918 CA GLY A 124 2.998 15.838 3.025 1.00 0.00 C ATOM 919 C GLY A 124 1.741 15.980 2.209 1.00 0.00 C ATOM 920 O GLY A 124 1.036 16.992 2.290 1.00 0.00 O ATOM 0 H GLY A 124 2.704 13.792 3.300 1.00 0.00 H new ATOM 0 HA2 GLY A 124 3.111 16.703 3.679 1.00 0.00 H new ATOM 0 HA3 GLY A 124 3.865 15.822 2.364 1.00 0.00 H new ATOM 924 N SER A 125 1.457 14.969 1.434 1.00 0.00 N ATOM 925 CA SER A 125 0.274 14.910 0.621 1.00 0.00 C ATOM 926 C SER A 125 0.018 13.465 0.205 1.00 0.00 C ATOM 927 O SER A 125 0.908 12.627 0.309 1.00 0.00 O ATOM 928 CB SER A 125 0.413 15.852 -0.584 1.00 0.00 C ATOM 929 OG SER A 125 1.691 15.718 -1.202 1.00 0.00 O ATOM 0 H SER A 125 2.054 14.146 1.349 1.00 0.00 H new ATOM 0 HA SER A 125 -0.591 15.250 1.191 1.00 0.00 H new ATOM 0 HB2 SER A 125 -0.369 15.634 -1.311 1.00 0.00 H new ATOM 0 HB3 SER A 125 0.269 16.883 -0.261 1.00 0.00 H new ATOM 0 HG SER A 125 1.750 16.328 -1.967 1.00 0.00 H new ATOM 935 N VAL A 126 -1.170 13.160 -0.211 1.00 0.00 N ATOM 936 CA VAL A 126 -1.497 11.814 -0.591 1.00 0.00 C ATOM 937 C VAL A 126 -2.381 11.813 -1.838 1.00 0.00 C ATOM 938 O VAL A 126 -3.224 12.678 -2.011 1.00 0.00 O ATOM 939 CB VAL A 126 -2.179 11.037 0.598 1.00 0.00 C ATOM 940 CG1 VAL A 126 -3.481 11.695 1.044 1.00 0.00 C ATOM 941 CG2 VAL A 126 -2.399 9.563 0.266 1.00 0.00 C ATOM 0 H VAL A 126 -1.937 13.826 -0.298 1.00 0.00 H new ATOM 0 HA VAL A 126 -0.572 11.290 -0.831 1.00 0.00 H new ATOM 0 HB VAL A 126 -1.483 11.087 1.435 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -3.914 11.124 1.865 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -3.279 12.713 1.377 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -4.181 11.719 0.209 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -2.871 9.066 1.113 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -3.043 9.479 -0.609 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -1.440 9.090 0.057 1.00 0.00 H new ATOM 951 N LYS A 127 -2.118 10.908 -2.721 1.00 0.00 N ATOM 952 CA LYS A 127 -2.933 10.713 -3.893 1.00 0.00 C ATOM 953 C LYS A 127 -3.701 9.426 -3.715 1.00 0.00 C ATOM 954 O LYS A 127 -3.110 8.414 -3.367 1.00 0.00 O ATOM 955 CB LYS A 127 -2.079 10.671 -5.175 1.00 0.00 C ATOM 956 CG LYS A 127 -1.604 12.026 -5.681 1.00 0.00 C ATOM 957 CD LYS A 127 -0.776 11.877 -6.951 1.00 0.00 C ATOM 958 CE LYS A 127 -0.390 13.223 -7.560 1.00 0.00 C ATOM 959 NZ LYS A 127 -1.554 13.945 -8.134 1.00 0.00 N ATOM 0 H LYS A 127 -1.324 10.271 -2.656 1.00 0.00 H new ATOM 0 HA LYS A 127 -3.621 11.551 -4.005 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -1.207 10.043 -4.991 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -2.658 10.189 -5.963 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -2.464 12.667 -5.877 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -1.009 12.517 -4.911 1.00 0.00 H new ATOM 0 HD2 LYS A 127 0.128 11.311 -6.727 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -1.341 11.299 -7.683 1.00 0.00 H new ATOM 0 HE2 LYS A 127 0.076 13.843 -6.795 1.00 0.00 H new ATOM 0 HE3 LYS A 127 0.355 13.065 -8.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -1.502 14.950 -7.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -1.542 13.855 -9.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -2.435 13.536 -7.761 1.00 0.00 H new ATOM 973 N VAL A 128 -4.999 9.452 -3.917 1.00 0.00 N ATOM 974 CA VAL A 128 -5.803 8.252 -3.688 1.00 0.00 C ATOM 975 C VAL A 128 -6.526 7.803 -4.952 1.00 0.00 C ATOM 976 O VAL A 128 -7.008 8.634 -5.735 1.00 0.00 O ATOM 977 CB VAL A 128 -6.827 8.423 -2.519 1.00 0.00 C ATOM 978 CG1 VAL A 128 -6.122 8.781 -1.219 1.00 0.00 C ATOM 979 CG2 VAL A 128 -7.903 9.453 -2.845 1.00 0.00 C ATOM 0 H VAL A 128 -5.521 10.269 -4.233 1.00 0.00 H new ATOM 0 HA VAL A 128 -5.095 7.476 -3.397 1.00 0.00 H new ATOM 0 HB VAL A 128 -7.322 7.461 -2.390 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -6.859 8.894 -0.424 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -5.422 7.989 -0.955 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -5.579 9.718 -1.345 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -8.592 9.538 -2.004 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -7.436 10.420 -3.031 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -8.451 9.138 -3.733 1.00 0.00 H new ATOM 989 N GLY A 129 -6.559 6.507 -5.172 1.00 0.00 N ATOM 990 CA GLY A 129 -7.245 5.973 -6.298 1.00 0.00 C ATOM 991 C GLY A 129 -8.163 4.860 -5.891 1.00 0.00 C ATOM 992 O GLY A 129 -7.716 3.802 -5.425 1.00 0.00 O ATOM 0 H GLY A 129 -6.112 5.811 -4.575 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -7.818 6.761 -6.786 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -6.523 5.605 -7.027 1.00 0.00 H new ATOM 996 N ILE A 130 -9.430 5.086 -6.052 1.00 0.00 N ATOM 997 CA ILE A 130 -10.430 4.134 -5.677 1.00 0.00 C ATOM 998 C ILE A 130 -10.717 3.242 -6.863 1.00 0.00 C ATOM 999 O ILE A 130 -11.218 3.690 -7.895 1.00 0.00 O ATOM 1000 CB ILE A 130 -11.772 4.805 -5.184 1.00 0.00 C ATOM 1001 CG1 ILE A 130 -11.582 5.645 -3.896 1.00 0.00 C ATOM 1002 CG2 ILE A 130 -12.852 3.753 -4.954 1.00 0.00 C ATOM 1003 CD1 ILE A 130 -10.794 6.933 -4.064 1.00 0.00 C ATOM 0 H ILE A 130 -9.804 5.947 -6.452 1.00 0.00 H new ATOM 0 HA ILE A 130 -10.040 3.561 -4.836 1.00 0.00 H new ATOM 0 HB ILE A 130 -12.085 5.483 -5.978 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -12.565 5.891 -3.496 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -11.080 5.027 -3.151 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -13.767 4.239 -4.615 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -13.047 3.222 -5.886 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -12.515 3.045 -4.197 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -10.720 7.442 -3.103 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -9.794 6.702 -4.430 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -11.302 7.580 -4.780 1.00 0.00 H new ATOM 1015 N VAL A 131 -10.378 2.013 -6.739 1.00 0.00 N ATOM 1016 CA VAL A 131 -10.621 1.081 -7.787 1.00 0.00 C ATOM 1017 C VAL A 131 -11.861 0.272 -7.418 1.00 0.00 C ATOM 1018 O VAL A 131 -12.092 -0.025 -6.236 1.00 0.00 O ATOM 1019 CB VAL A 131 -9.362 0.211 -8.083 1.00 0.00 C ATOM 1020 CG1 VAL A 131 -8.935 -0.614 -6.882 1.00 0.00 C ATOM 1021 CG2 VAL A 131 -9.545 -0.663 -9.315 1.00 0.00 C ATOM 0 H VAL A 131 -9.926 1.621 -5.913 1.00 0.00 H new ATOM 0 HA VAL A 131 -10.819 1.598 -8.726 1.00 0.00 H new ATOM 0 HB VAL A 131 -8.554 0.910 -8.297 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -8.054 -1.202 -7.139 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -8.698 0.050 -6.050 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -9.746 -1.282 -6.593 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -8.642 -1.251 -9.481 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -10.391 -1.333 -9.163 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -9.733 -0.032 -10.184 1.00 0.00 H new ATOM 1031 N GLU A 132 -12.670 -0.039 -8.393 1.00 0.00 N ATOM 1032 CA GLU A 132 -13.963 -0.641 -8.135 1.00 0.00 C ATOM 1033 C GLU A 132 -13.880 -2.156 -8.071 1.00 0.00 C ATOM 1034 O GLU A 132 -14.855 -2.835 -7.750 1.00 0.00 O ATOM 1035 CB GLU A 132 -14.957 -0.141 -9.168 1.00 0.00 C ATOM 1036 CG GLU A 132 -15.062 1.379 -9.148 1.00 0.00 C ATOM 1037 CD GLU A 132 -15.920 1.939 -10.233 1.00 0.00 C ATOM 1038 OE1 GLU A 132 -17.143 2.028 -10.048 1.00 0.00 O ATOM 1039 OE2 GLU A 132 -15.392 2.331 -11.271 1.00 0.00 O ATOM 0 H GLU A 132 -12.462 0.113 -9.380 1.00 0.00 H new ATOM 0 HA GLU A 132 -14.315 -0.336 -7.150 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -14.651 -0.473 -10.160 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -15.937 -0.578 -8.974 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -15.461 1.693 -8.184 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -14.062 1.804 -9.233 1.00 0.00 H new ATOM 1046 N GLU A 133 -12.717 -2.675 -8.365 1.00 0.00 N ATOM 1047 CA GLU A 133 -12.455 -4.074 -8.226 1.00 0.00 C ATOM 1048 C GLU A 133 -11.212 -4.270 -7.352 1.00 0.00 C ATOM 1049 O GLU A 133 -10.075 -4.217 -7.823 1.00 0.00 O ATOM 1050 CB GLU A 133 -12.355 -4.778 -9.598 1.00 0.00 C ATOM 1051 CG GLU A 133 -11.329 -4.191 -10.551 1.00 0.00 C ATOM 1052 CD GLU A 133 -11.436 -4.756 -11.934 1.00 0.00 C ATOM 1053 OE1 GLU A 133 -12.192 -4.198 -12.740 1.00 0.00 O ATOM 1054 OE2 GLU A 133 -10.762 -5.751 -12.253 1.00 0.00 O ATOM 0 H GLU A 133 -11.925 -2.133 -8.709 1.00 0.00 H new ATOM 0 HA GLU A 133 -13.295 -4.553 -7.723 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -12.115 -5.828 -9.433 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -13.333 -4.746 -10.077 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -11.456 -3.109 -10.594 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -10.328 -4.379 -10.162 1.00 0.00 H new ATOM 1061 N PRO A 134 -11.408 -4.428 -6.032 1.00 0.00 N ATOM 1062 CA PRO A 134 -10.315 -4.596 -5.060 1.00 0.00 C ATOM 1063 C PRO A 134 -9.726 -6.005 -5.103 1.00 0.00 C ATOM 1064 O PRO A 134 -9.510 -6.653 -4.063 1.00 0.00 O ATOM 1065 CB PRO A 134 -10.999 -4.354 -3.706 1.00 0.00 C ATOM 1066 CG PRO A 134 -12.371 -3.877 -4.027 1.00 0.00 C ATOM 1067 CD PRO A 134 -12.707 -4.440 -5.360 1.00 0.00 C ATOM 0 HA PRO A 134 -9.483 -3.921 -5.260 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -11.031 -5.269 -3.115 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -10.455 -3.614 -3.119 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -13.085 -4.210 -3.273 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -12.410 -2.788 -4.044 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -13.119 -5.447 -5.286 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -13.444 -3.832 -5.885 1.00 0.00 H new ATOM 1075 N ASP A 135 -9.467 -6.463 -6.283 1.00 0.00 N ATOM 1076 CA ASP A 135 -8.869 -7.751 -6.501 1.00 0.00 C ATOM 1077 C ASP A 135 -7.382 -7.627 -6.287 1.00 0.00 C ATOM 1078 O ASP A 135 -6.794 -6.618 -6.673 1.00 0.00 O ATOM 1079 CB ASP A 135 -9.152 -8.245 -7.916 1.00 0.00 C ATOM 1080 CG ASP A 135 -8.508 -9.580 -8.197 1.00 0.00 C ATOM 1081 OD1 ASP A 135 -9.113 -10.620 -7.876 1.00 0.00 O ATOM 1082 OD2 ASP A 135 -7.383 -9.617 -8.731 1.00 0.00 O ATOM 0 H ASP A 135 -9.666 -5.949 -7.141 1.00 0.00 H new ATOM 0 HA ASP A 135 -9.293 -8.473 -5.802 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -10.229 -8.326 -8.061 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -8.788 -7.510 -8.634 1.00 0.00 H new ATOM 1087 N LYS A 136 -6.782 -8.634 -5.685 1.00 0.00 N ATOM 1088 CA LYS A 136 -5.357 -8.624 -5.347 1.00 0.00 C ATOM 1089 C LYS A 136 -4.453 -8.306 -6.542 1.00 0.00 C ATOM 1090 O LYS A 136 -3.493 -7.547 -6.399 1.00 0.00 O ATOM 1091 CB LYS A 136 -4.940 -9.948 -4.699 1.00 0.00 C ATOM 1092 CG LYS A 136 -5.609 -10.234 -3.353 1.00 0.00 C ATOM 1093 CD LYS A 136 -5.179 -9.256 -2.251 1.00 0.00 C ATOM 1094 CE LYS A 136 -3.700 -9.403 -1.909 1.00 0.00 C ATOM 1095 NZ LYS A 136 -3.273 -8.480 -0.835 1.00 0.00 N ATOM 0 H LYS A 136 -7.264 -9.490 -5.412 1.00 0.00 H new ATOM 0 HA LYS A 136 -5.222 -7.814 -4.630 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -5.171 -10.763 -5.386 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -3.859 -9.945 -4.560 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -6.691 -10.184 -3.473 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -5.369 -11.251 -3.043 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -5.378 -8.234 -2.574 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -5.778 -9.430 -1.357 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -3.502 -10.430 -1.601 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -3.104 -9.217 -2.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -2.261 -8.619 -0.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -3.436 -7.498 -1.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -3.822 -8.673 0.027 1.00 0.00 H new ATOM 1109 N ALA A 137 -4.781 -8.831 -7.714 1.00 0.00 N ATOM 1110 CA ALA A 137 -3.951 -8.605 -8.888 1.00 0.00 C ATOM 1111 C ALA A 137 -4.122 -7.188 -9.393 1.00 0.00 C ATOM 1112 O ALA A 137 -3.157 -6.545 -9.774 1.00 0.00 O ATOM 1113 CB ALA A 137 -4.258 -9.606 -9.988 1.00 0.00 C ATOM 0 H ALA A 137 -5.605 -9.409 -7.877 1.00 0.00 H new ATOM 0 HA ALA A 137 -2.911 -8.748 -8.593 1.00 0.00 H new ATOM 0 HB1 ALA A 137 -3.620 -9.407 -10.849 1.00 0.00 H new ATOM 0 HB2 ALA A 137 -4.071 -10.616 -9.623 1.00 0.00 H new ATOM 0 HB3 ALA A 137 -5.303 -9.514 -10.282 1.00 0.00 H new ATOM 1119 N VAL A 138 -5.345 -6.689 -9.341 1.00 0.00 N ATOM 1120 CA VAL A 138 -5.642 -5.341 -9.807 1.00 0.00 C ATOM 1121 C VAL A 138 -5.038 -4.307 -8.851 1.00 0.00 C ATOM 1122 O VAL A 138 -4.467 -3.298 -9.283 1.00 0.00 O ATOM 1123 CB VAL A 138 -7.168 -5.108 -9.964 1.00 0.00 C ATOM 1124 CG1 VAL A 138 -7.455 -3.713 -10.513 1.00 0.00 C ATOM 1125 CG2 VAL A 138 -7.772 -6.167 -10.875 1.00 0.00 C ATOM 0 H VAL A 138 -6.152 -7.197 -8.980 1.00 0.00 H new ATOM 0 HA VAL A 138 -5.191 -5.224 -10.792 1.00 0.00 H new ATOM 0 HB VAL A 138 -7.626 -5.186 -8.978 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -8.532 -3.576 -10.613 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -7.056 -2.964 -9.829 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -6.983 -3.602 -11.489 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -8.843 -5.992 -10.976 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -7.301 -6.114 -11.857 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -7.605 -7.155 -10.445 1.00 0.00 H new ATOM 1135 N LEU A 139 -5.134 -4.588 -7.555 1.00 0.00 N ATOM 1136 CA LEU A 139 -4.551 -3.732 -6.533 1.00 0.00 C ATOM 1137 C LEU A 139 -3.044 -3.645 -6.713 1.00 0.00 C ATOM 1138 O LEU A 139 -2.476 -2.555 -6.731 1.00 0.00 O ATOM 1139 CB LEU A 139 -4.878 -4.247 -5.122 1.00 0.00 C ATOM 1140 CG LEU A 139 -6.341 -4.177 -4.673 1.00 0.00 C ATOM 1141 CD1 LEU A 139 -6.496 -4.814 -3.300 1.00 0.00 C ATOM 1142 CD2 LEU A 139 -6.823 -2.733 -4.637 1.00 0.00 C ATOM 0 H LEU A 139 -5.615 -5.409 -7.188 1.00 0.00 H new ATOM 0 HA LEU A 139 -4.985 -2.738 -6.644 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -4.554 -5.286 -5.058 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -4.278 -3.682 -4.409 1.00 0.00 H new ATOM 0 HG LEU A 139 -6.950 -4.726 -5.391 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -7.539 -4.759 -2.989 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -6.185 -5.858 -3.346 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -5.875 -4.282 -2.580 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -7.864 -2.705 -4.316 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -6.212 -2.163 -3.937 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -6.738 -2.296 -5.632 1.00 0.00 H new ATOM 1154 N THR A 140 -2.413 -4.794 -6.884 1.00 0.00 N ATOM 1155 CA THR A 140 -0.979 -4.857 -7.059 1.00 0.00 C ATOM 1156 C THR A 140 -0.561 -4.242 -8.414 1.00 0.00 C ATOM 1157 O THR A 140 0.518 -3.670 -8.535 1.00 0.00 O ATOM 1158 CB THR A 140 -0.481 -6.315 -6.943 1.00 0.00 C ATOM 1159 OG1 THR A 140 -0.948 -6.872 -5.695 1.00 0.00 O ATOM 1160 CG2 THR A 140 1.041 -6.381 -6.978 1.00 0.00 C ATOM 0 H THR A 140 -2.879 -5.701 -6.905 1.00 0.00 H new ATOM 0 HA THR A 140 -0.514 -4.272 -6.266 1.00 0.00 H new ATOM 0 HB THR A 140 -0.871 -6.883 -7.788 1.00 0.00 H new ATOM 0 HG1 THR A 140 -1.814 -7.308 -5.835 1.00 0.00 H new ATOM 0 HG21 THR A 140 1.362 -7.419 -6.894 1.00 0.00 H new ATOM 0 HG22 THR A 140 1.402 -5.964 -7.918 1.00 0.00 H new ATOM 0 HG23 THR A 140 1.449 -5.807 -6.146 1.00 0.00 H new ATOM 1168 N GLN A 141 -1.436 -4.344 -9.409 1.00 0.00 N ATOM 1169 CA GLN A 141 -1.192 -3.778 -10.732 1.00 0.00 C ATOM 1170 C GLN A 141 -1.072 -2.272 -10.633 1.00 0.00 C ATOM 1171 O GLN A 141 -0.068 -1.695 -11.068 1.00 0.00 O ATOM 1172 CB GLN A 141 -2.331 -4.131 -11.682 1.00 0.00 C ATOM 1173 CG GLN A 141 -2.133 -3.645 -13.106 1.00 0.00 C ATOM 1174 CD GLN A 141 -3.340 -3.895 -13.976 1.00 0.00 C ATOM 1175 OE1 GLN A 141 -4.480 -3.887 -13.506 1.00 0.00 O ATOM 1176 NE2 GLN A 141 -3.112 -4.178 -15.226 1.00 0.00 N ATOM 0 H GLN A 141 -2.334 -4.821 -9.322 1.00 0.00 H new ATOM 0 HA GLN A 141 -0.263 -4.196 -11.120 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -2.455 -5.214 -11.695 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -3.257 -3.709 -11.292 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -1.912 -2.578 -13.095 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -1.267 -4.145 -13.540 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -2.157 -4.176 -15.583 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -3.889 -4.402 -15.848 1.00 0.00 H new ATOM 1185 N ALA A 142 -2.088 -1.650 -10.042 1.00 0.00 N ATOM 1186 CA ALA A 142 -2.114 -0.211 -9.859 1.00 0.00 C ATOM 1187 C ALA A 142 -0.944 0.220 -8.996 1.00 0.00 C ATOM 1188 O ALA A 142 -0.232 1.155 -9.338 1.00 0.00 O ATOM 1189 CB ALA A 142 -3.432 0.225 -9.241 1.00 0.00 C ATOM 0 H ALA A 142 -2.911 -2.131 -9.679 1.00 0.00 H new ATOM 0 HA ALA A 142 -2.025 0.271 -10.833 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -3.433 1.307 -9.111 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -4.254 -0.063 -9.897 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -3.556 -0.257 -8.271 1.00 0.00 H new ATOM 1195 N TRP A 143 -0.723 -0.527 -7.912 1.00 0.00 N ATOM 1196 CA TRP A 143 0.389 -0.299 -6.990 1.00 0.00 C ATOM 1197 C TRP A 143 1.703 -0.238 -7.770 1.00 0.00 C ATOM 1198 O TRP A 143 2.486 0.706 -7.627 1.00 0.00 O ATOM 1199 CB TRP A 143 0.433 -1.456 -5.963 1.00 0.00 C ATOM 1200 CG TRP A 143 1.486 -1.337 -4.899 1.00 0.00 C ATOM 1201 CD1 TRP A 143 1.349 -0.733 -3.691 1.00 0.00 C ATOM 1202 CD2 TRP A 143 2.834 -1.846 -4.942 1.00 0.00 C ATOM 1203 NE1 TRP A 143 2.521 -0.820 -2.982 1.00 0.00 N ATOM 1204 CE2 TRP A 143 3.446 -1.497 -3.729 1.00 0.00 C ATOM 1205 CE3 TRP A 143 3.577 -2.557 -5.892 1.00 0.00 C ATOM 1206 CZ2 TRP A 143 4.765 -1.830 -3.437 1.00 0.00 C ATOM 1207 CZ3 TRP A 143 4.888 -2.884 -5.601 1.00 0.00 C ATOM 1208 CH2 TRP A 143 5.469 -2.520 -4.381 1.00 0.00 C ATOM 0 H TRP A 143 -1.317 -1.313 -7.648 1.00 0.00 H new ATOM 0 HA TRP A 143 0.250 0.647 -6.467 1.00 0.00 H new ATOM 0 HB2 TRP A 143 -0.541 -1.526 -5.479 1.00 0.00 H new ATOM 0 HB3 TRP A 143 0.590 -2.391 -6.501 1.00 0.00 H new ATOM 0 HD1 TRP A 143 0.448 -0.253 -3.339 1.00 0.00 H new ATOM 0 HE1 TRP A 143 2.677 -0.441 -2.048 1.00 0.00 H new ATOM 0 HE3 TRP A 143 3.134 -2.844 -6.834 1.00 0.00 H new ATOM 0 HZ2 TRP A 143 5.216 -1.552 -2.496 1.00 0.00 H new ATOM 0 HZ3 TRP A 143 5.473 -3.429 -6.327 1.00 0.00 H new ATOM 0 HH2 TRP A 143 6.496 -2.791 -4.182 1.00 0.00 H new ATOM 1219 N LYS A 144 1.894 -1.235 -8.624 1.00 0.00 N ATOM 1220 CA LYS A 144 3.083 -1.375 -9.436 1.00 0.00 C ATOM 1221 C LYS A 144 3.234 -0.212 -10.405 1.00 0.00 C ATOM 1222 O LYS A 144 4.310 0.372 -10.517 1.00 0.00 O ATOM 1223 CB LYS A 144 3.035 -2.695 -10.205 1.00 0.00 C ATOM 1224 CG LYS A 144 4.291 -2.989 -11.004 1.00 0.00 C ATOM 1225 CD LYS A 144 4.203 -4.304 -11.764 1.00 0.00 C ATOM 1226 CE LYS A 144 3.998 -5.485 -10.830 1.00 0.00 C ATOM 1227 NZ LYS A 144 3.990 -6.763 -11.562 1.00 0.00 N ATOM 0 H LYS A 144 1.212 -1.979 -8.770 1.00 0.00 H new ATOM 0 HA LYS A 144 3.948 -1.372 -8.772 1.00 0.00 H new ATOM 0 HB2 LYS A 144 2.866 -3.509 -9.500 1.00 0.00 H new ATOM 0 HB3 LYS A 144 2.181 -2.678 -10.882 1.00 0.00 H new ATOM 0 HG2 LYS A 144 4.468 -2.177 -11.709 1.00 0.00 H new ATOM 0 HG3 LYS A 144 5.148 -3.019 -10.331 1.00 0.00 H new ATOM 0 HD2 LYS A 144 3.379 -4.257 -12.476 1.00 0.00 H new ATOM 0 HD3 LYS A 144 5.116 -4.452 -12.341 1.00 0.00 H new ATOM 0 HE2 LYS A 144 4.790 -5.499 -10.082 1.00 0.00 H new ATOM 0 HE3 LYS A 144 3.056 -5.366 -10.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 3.848 -7.546 -10.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 3.218 -6.759 -12.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 4.899 -6.888 -12.053 1.00 0.00 H new ATOM 1241 N LEU A 145 2.154 0.127 -11.089 1.00 0.00 N ATOM 1242 CA LEU A 145 2.172 1.209 -12.053 1.00 0.00 C ATOM 1243 C LEU A 145 2.572 2.518 -11.397 1.00 0.00 C ATOM 1244 O LEU A 145 3.479 3.194 -11.875 1.00 0.00 O ATOM 1245 CB LEU A 145 0.814 1.356 -12.753 1.00 0.00 C ATOM 1246 CG LEU A 145 0.325 0.133 -13.532 1.00 0.00 C ATOM 1247 CD1 LEU A 145 -0.997 0.417 -14.214 1.00 0.00 C ATOM 1248 CD2 LEU A 145 1.364 -0.316 -14.540 1.00 0.00 C ATOM 0 H LEU A 145 1.250 -0.336 -10.992 1.00 0.00 H new ATOM 0 HA LEU A 145 2.918 0.960 -12.808 1.00 0.00 H new ATOM 0 HB2 LEU A 145 0.065 1.606 -12.001 1.00 0.00 H new ATOM 0 HB3 LEU A 145 0.871 2.201 -13.440 1.00 0.00 H new ATOM 0 HG LEU A 145 0.170 -0.678 -12.820 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -1.322 -0.468 -14.761 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -1.745 0.676 -13.464 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -0.877 1.248 -14.909 1.00 0.00 H new ATOM 0 HD21 LEU A 145 0.993 -1.187 -15.081 1.00 0.00 H new ATOM 0 HD22 LEU A 145 1.561 0.492 -15.244 1.00 0.00 H new ATOM 0 HD23 LEU A 145 2.286 -0.577 -14.020 1.00 0.00 H new ATOM 1260 N TRP A 146 1.925 2.829 -10.292 1.00 0.00 N ATOM 1261 CA TRP A 146 2.163 4.060 -9.550 1.00 0.00 C ATOM 1262 C TRP A 146 3.591 4.140 -9.014 1.00 0.00 C ATOM 1263 O TRP A 146 4.279 5.175 -9.193 1.00 0.00 O ATOM 1264 CB TRP A 146 1.175 4.187 -8.391 1.00 0.00 C ATOM 1265 CG TRP A 146 -0.275 4.332 -8.786 1.00 0.00 C ATOM 1266 CD1 TRP A 146 -0.864 4.026 -9.987 1.00 0.00 C ATOM 1267 CD2 TRP A 146 -1.314 4.803 -7.950 1.00 0.00 C ATOM 1268 NE1 TRP A 146 -2.206 4.276 -9.930 1.00 0.00 N ATOM 1269 CE2 TRP A 146 -2.507 4.761 -8.689 1.00 0.00 C ATOM 1270 CE3 TRP A 146 -1.348 5.260 -6.640 1.00 0.00 C ATOM 1271 CZ2 TRP A 146 -3.719 5.160 -8.152 1.00 0.00 C ATOM 1272 CZ3 TRP A 146 -2.545 5.655 -6.110 1.00 0.00 C ATOM 1273 CH2 TRP A 146 -3.715 5.603 -6.861 1.00 0.00 C ATOM 0 H TRP A 146 1.211 2.231 -9.876 1.00 0.00 H new ATOM 0 HA TRP A 146 2.018 4.885 -10.248 1.00 0.00 H new ATOM 0 HB2 TRP A 146 1.274 3.308 -7.754 1.00 0.00 H new ATOM 0 HB3 TRP A 146 1.457 5.050 -7.789 1.00 0.00 H new ATOM 0 HD1 TRP A 146 -0.342 3.643 -10.852 1.00 0.00 H new ATOM 0 HE1 TRP A 146 -2.872 4.126 -10.688 1.00 0.00 H new ATOM 0 HE3 TRP A 146 -0.445 5.303 -6.049 1.00 0.00 H new ATOM 0 HZ2 TRP A 146 -4.630 5.122 -8.731 1.00 0.00 H new ATOM 0 HZ3 TRP A 146 -2.583 6.013 -5.092 1.00 0.00 H new ATOM 0 HH2 TRP A 146 -4.644 5.921 -6.411 1.00 0.00 H new ATOM 1284 N ILE A 147 4.058 3.060 -8.374 1.00 0.00 N ATOM 1285 CA ILE A 147 5.401 3.067 -7.828 1.00 0.00 C ATOM 1286 C ILE A 147 6.425 3.217 -8.943 1.00 0.00 C ATOM 1287 O ILE A 147 7.332 4.044 -8.838 1.00 0.00 O ATOM 1288 CB ILE A 147 5.748 1.841 -6.897 1.00 0.00 C ATOM 1289 CG1 ILE A 147 7.163 1.999 -6.317 1.00 0.00 C ATOM 1290 CG2 ILE A 147 5.602 0.504 -7.610 1.00 0.00 C ATOM 1291 CD1 ILE A 147 7.622 0.853 -5.440 1.00 0.00 C ATOM 0 H ILE A 147 3.534 2.197 -8.229 1.00 0.00 H new ATOM 0 HA ILE A 147 5.443 3.934 -7.169 1.00 0.00 H new ATOM 0 HB ILE A 147 5.024 1.839 -6.082 1.00 0.00 H new ATOM 0 HG12 ILE A 147 7.868 2.112 -7.141 1.00 0.00 H new ATOM 0 HG13 ILE A 147 7.201 2.920 -5.736 1.00 0.00 H new ATOM 0 HG21 ILE A 147 5.853 -0.304 -6.923 1.00 0.00 H new ATOM 0 HG22 ILE A 147 4.574 0.384 -7.951 1.00 0.00 H new ATOM 0 HG23 ILE A 147 6.275 0.473 -8.467 1.00 0.00 H new ATOM 0 HD11 ILE A 147 8.630 1.054 -5.077 1.00 0.00 H new ATOM 0 HD12 ILE A 147 6.945 0.750 -4.592 1.00 0.00 H new ATOM 0 HD13 ILE A 147 7.622 -0.071 -6.019 1.00 0.00 H new ATOM 1303 N GLU A 148 6.226 2.488 -10.054 1.00 0.00 N ATOM 1304 CA GLU A 148 7.146 2.554 -11.171 1.00 0.00 C ATOM 1305 C GLU A 148 7.266 3.933 -11.767 1.00 0.00 C ATOM 1306 O GLU A 148 8.327 4.280 -12.260 1.00 0.00 O ATOM 1307 CB GLU A 148 6.893 1.508 -12.250 1.00 0.00 C ATOM 1308 CG GLU A 148 7.353 0.118 -11.868 1.00 0.00 C ATOM 1309 CD GLU A 148 7.401 -0.806 -13.054 1.00 0.00 C ATOM 1310 OE1 GLU A 148 8.151 -0.506 -14.026 1.00 0.00 O ATOM 1311 OE2 GLU A 148 6.718 -1.853 -13.051 1.00 0.00 O ATOM 0 H GLU A 148 5.438 1.854 -10.190 1.00 0.00 H new ATOM 0 HA GLU A 148 8.111 2.309 -10.727 1.00 0.00 H new ATOM 0 HB2 GLU A 148 5.827 1.480 -12.474 1.00 0.00 H new ATOM 0 HB3 GLU A 148 7.402 1.811 -13.165 1.00 0.00 H new ATOM 0 HG2 GLU A 148 8.342 0.176 -11.413 1.00 0.00 H new ATOM 0 HG3 GLU A 148 6.680 -0.293 -11.116 1.00 0.00 H new ATOM 1318 N GLU A 149 6.207 4.728 -11.698 1.00 0.00 N ATOM 1319 CA GLU A 149 6.267 6.099 -12.186 1.00 0.00 C ATOM 1320 C GLU A 149 7.338 6.842 -11.419 1.00 0.00 C ATOM 1321 O GLU A 149 8.250 7.442 -11.995 1.00 0.00 O ATOM 1322 CB GLU A 149 4.931 6.812 -11.993 1.00 0.00 C ATOM 1323 CG GLU A 149 3.767 6.141 -12.675 1.00 0.00 C ATOM 1324 CD GLU A 149 3.918 6.043 -14.171 1.00 0.00 C ATOM 1325 OE1 GLU A 149 4.638 5.165 -14.658 1.00 0.00 O ATOM 1326 OE2 GLU A 149 3.271 6.831 -14.900 1.00 0.00 O ATOM 0 H GLU A 149 5.304 4.451 -11.313 1.00 0.00 H new ATOM 0 HA GLU A 149 6.496 6.080 -13.252 1.00 0.00 H new ATOM 0 HB2 GLU A 149 4.721 6.882 -10.926 1.00 0.00 H new ATOM 0 HB3 GLU A 149 5.019 7.832 -12.368 1.00 0.00 H new ATOM 0 HG2 GLU A 149 3.645 5.139 -12.264 1.00 0.00 H new ATOM 0 HG3 GLU A 149 2.855 6.693 -12.446 1.00 0.00 H new ATOM 1333 N HIS A 150 7.283 6.727 -10.114 1.00 0.00 N ATOM 1334 CA HIS A 150 8.231 7.414 -9.284 1.00 0.00 C ATOM 1335 C HIS A 150 9.580 6.763 -9.201 1.00 0.00 C ATOM 1336 O HIS A 150 10.559 7.440 -8.891 1.00 0.00 O ATOM 1337 CB HIS A 150 7.675 7.812 -7.952 1.00 0.00 C ATOM 1338 CG HIS A 150 6.982 9.129 -8.025 1.00 0.00 C ATOM 1339 ND1 HIS A 150 7.604 10.304 -7.689 1.00 0.00 N ATOM 1340 CD2 HIS A 150 5.730 9.468 -8.415 1.00 0.00 C ATOM 1341 CE1 HIS A 150 6.774 11.304 -7.860 1.00 0.00 C ATOM 1342 NE2 HIS A 150 5.635 10.829 -8.302 1.00 0.00 N ATOM 0 H HIS A 150 6.595 6.167 -9.610 1.00 0.00 H new ATOM 0 HA HIS A 150 8.422 8.348 -9.813 1.00 0.00 H new ATOM 0 HB2 HIS A 150 6.977 7.050 -7.605 1.00 0.00 H new ATOM 0 HB3 HIS A 150 8.481 7.863 -7.220 1.00 0.00 H new ATOM 0 HD2 HIS A 150 4.956 8.794 -8.751 1.00 0.00 H new ATOM 0 HE1 HIS A 150 6.992 12.344 -7.669 1.00 0.00 H new ATOM 0 HE2 HIS A 150 4.810 11.385 -8.526 1.00 0.00 H new ATOM 1351 N ILE A 151 9.643 5.475 -9.485 1.00 0.00 N ATOM 1352 CA ILE A 151 10.929 4.771 -9.593 1.00 0.00 C ATOM 1353 C ILE A 151 11.744 5.418 -10.710 1.00 0.00 C ATOM 1354 O ILE A 151 12.932 5.682 -10.564 1.00 0.00 O ATOM 1355 CB ILE A 151 10.760 3.245 -9.938 1.00 0.00 C ATOM 1356 CG1 ILE A 151 9.952 2.496 -8.872 1.00 0.00 C ATOM 1357 CG2 ILE A 151 12.117 2.563 -10.147 1.00 0.00 C ATOM 1358 CD1 ILE A 151 10.572 2.482 -7.499 1.00 0.00 C ATOM 0 H ILE A 151 8.826 4.887 -9.647 1.00 0.00 H new ATOM 0 HA ILE A 151 11.424 4.845 -8.625 1.00 0.00 H new ATOM 0 HB ILE A 151 10.201 3.201 -10.873 1.00 0.00 H new ATOM 0 HG12 ILE A 151 8.962 2.948 -8.803 1.00 0.00 H new ATOM 0 HG13 ILE A 151 9.810 1.467 -9.201 1.00 0.00 H new ATOM 0 HG21 ILE A 151 11.963 1.510 -10.384 1.00 0.00 H new ATOM 0 HG22 ILE A 151 12.644 3.046 -10.970 1.00 0.00 H new ATOM 0 HG23 ILE A 151 12.710 2.647 -9.237 1.00 0.00 H new ATOM 0 HD11 ILE A 151 9.928 1.930 -6.815 1.00 0.00 H new ATOM 0 HD12 ILE A 151 11.549 2.001 -7.546 1.00 0.00 H new ATOM 0 HD13 ILE A 151 10.688 3.505 -7.142 1.00 0.00 H new ATOM 1370 N LYS A 152 11.074 5.713 -11.798 1.00 0.00 N ATOM 1371 CA LYS A 152 11.729 6.263 -12.959 1.00 0.00 C ATOM 1372 C LYS A 152 11.941 7.786 -12.811 1.00 0.00 C ATOM 1373 O LYS A 152 13.041 8.296 -13.054 1.00 0.00 O ATOM 1374 CB LYS A 152 10.904 5.942 -14.213 1.00 0.00 C ATOM 1375 CG LYS A 152 10.509 4.469 -14.315 1.00 0.00 C ATOM 1376 CD LYS A 152 9.604 4.196 -15.505 1.00 0.00 C ATOM 1377 CE LYS A 152 8.770 2.922 -15.301 1.00 0.00 C ATOM 1378 NZ LYS A 152 9.580 1.694 -15.086 1.00 0.00 N ATOM 0 H LYS A 152 10.068 5.580 -11.903 1.00 0.00 H new ATOM 0 HA LYS A 152 12.714 5.807 -13.056 1.00 0.00 H new ATOM 0 HB2 LYS A 152 10.002 6.554 -14.213 1.00 0.00 H new ATOM 0 HB3 LYS A 152 11.477 6.220 -15.098 1.00 0.00 H new ATOM 0 HG2 LYS A 152 11.408 3.859 -14.398 1.00 0.00 H new ATOM 0 HG3 LYS A 152 10.002 4.167 -13.399 1.00 0.00 H new ATOM 0 HD2 LYS A 152 8.939 5.046 -15.660 1.00 0.00 H new ATOM 0 HD3 LYS A 152 10.208 4.096 -16.407 1.00 0.00 H new ATOM 0 HE2 LYS A 152 8.112 3.065 -14.444 1.00 0.00 H new ATOM 0 HE3 LYS A 152 8.132 2.775 -16.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 8.958 0.915 -14.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 10.061 1.436 -15.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 10.289 1.871 -14.346 1.00 0.00 H new ATOM 1392 N VAL A 153 10.911 8.513 -12.380 1.00 0.00 N ATOM 1393 CA VAL A 153 11.026 9.970 -12.312 1.00 0.00 C ATOM 1394 C VAL A 153 11.801 10.513 -11.094 1.00 0.00 C ATOM 1395 O VAL A 153 12.658 11.364 -11.262 1.00 0.00 O ATOM 1396 CB VAL A 153 9.686 10.742 -12.512 1.00 0.00 C ATOM 1397 CG1 VAL A 153 9.068 10.418 -13.864 1.00 0.00 C ATOM 1398 CG2 VAL A 153 8.695 10.476 -11.397 1.00 0.00 C ATOM 0 H VAL A 153 10.013 8.133 -12.081 1.00 0.00 H new ATOM 0 HA VAL A 153 11.644 10.181 -13.185 1.00 0.00 H new ATOM 0 HB VAL A 153 9.928 11.804 -12.483 1.00 0.00 H new ATOM 0 HG11 VAL A 153 8.135 10.969 -13.979 1.00 0.00 H new ATOM 0 HG12 VAL A 153 9.758 10.704 -14.658 1.00 0.00 H new ATOM 0 HG13 VAL A 153 8.868 9.348 -13.926 1.00 0.00 H new ATOM 0 HG21 VAL A 153 7.779 11.037 -11.583 1.00 0.00 H new ATOM 0 HG22 VAL A 153 8.467 9.411 -11.359 1.00 0.00 H new ATOM 0 HG23 VAL A 153 9.125 10.789 -10.446 1.00 0.00 H new ATOM 1408 N THR A 154 11.533 10.032 -9.880 1.00 0.00 N ATOM 1409 CA THR A 154 12.223 10.591 -8.733 1.00 0.00 C ATOM 1410 C THR A 154 13.212 9.613 -8.107 1.00 0.00 C ATOM 1411 O THR A 154 13.934 9.973 -7.178 1.00 0.00 O ATOM 1412 CB THR A 154 11.250 11.163 -7.664 1.00 0.00 C ATOM 1413 OG1 THR A 154 10.288 10.166 -7.241 1.00 0.00 O ATOM 1414 CG2 THR A 154 10.524 12.397 -8.183 1.00 0.00 C ATOM 0 H THR A 154 10.869 9.286 -9.675 1.00 0.00 H new ATOM 0 HA THR A 154 12.800 11.429 -9.124 1.00 0.00 H new ATOM 0 HB THR A 154 11.852 11.451 -6.802 1.00 0.00 H new ATOM 0 HG1 THR A 154 9.431 10.328 -7.688 1.00 0.00 H new ATOM 0 HG21 THR A 154 9.851 12.774 -7.413 1.00 0.00 H new ATOM 0 HG22 THR A 154 11.252 13.167 -8.437 1.00 0.00 H new ATOM 0 HG23 THR A 154 9.949 12.134 -9.071 1.00 0.00 H new ATOM 1422 N GLY A 155 13.202 8.372 -8.601 1.00 0.00 N ATOM 1423 CA GLY A 155 14.131 7.343 -8.156 1.00 0.00 C ATOM 1424 C GLY A 155 13.962 6.955 -6.707 1.00 0.00 C ATOM 1425 O GLY A 155 14.903 6.463 -6.075 1.00 0.00 O ATOM 0 H GLY A 155 12.549 8.058 -9.319 1.00 0.00 H new ATOM 0 HA2 GLY A 155 14.002 6.457 -8.777 1.00 0.00 H new ATOM 0 HA3 GLY A 155 15.151 7.695 -8.312 1.00 0.00 H new ATOM 1429 N LYS A 156 12.775 7.133 -6.189 1.00 0.00 N ATOM 1430 CA LYS A 156 12.529 6.862 -4.796 1.00 0.00 C ATOM 1431 C LYS A 156 12.068 5.455 -4.570 1.00 0.00 C ATOM 1432 O LYS A 156 10.963 5.078 -4.954 1.00 0.00 O ATOM 1433 CB LYS A 156 11.546 7.858 -4.177 1.00 0.00 C ATOM 1434 CG LYS A 156 12.060 9.285 -4.099 1.00 0.00 C ATOM 1435 CD LYS A 156 13.362 9.363 -3.309 1.00 0.00 C ATOM 1436 CE LYS A 156 13.853 10.790 -3.173 1.00 0.00 C ATOM 1437 NZ LYS A 156 13.986 11.454 -4.481 1.00 0.00 N ATOM 0 H LYS A 156 11.963 7.464 -6.710 1.00 0.00 H new ATOM 0 HA LYS A 156 13.487 6.985 -4.290 1.00 0.00 H new ATOM 0 HB2 LYS A 156 10.624 7.849 -4.759 1.00 0.00 H new ATOM 0 HB3 LYS A 156 11.292 7.521 -3.172 1.00 0.00 H new ATOM 0 HG2 LYS A 156 12.219 9.672 -5.106 1.00 0.00 H new ATOM 0 HG3 LYS A 156 11.308 9.919 -3.629 1.00 0.00 H new ATOM 0 HD2 LYS A 156 13.212 8.934 -2.318 1.00 0.00 H new ATOM 0 HD3 LYS A 156 14.124 8.762 -3.805 1.00 0.00 H new ATOM 0 HE2 LYS A 156 13.160 11.354 -2.549 1.00 0.00 H new ATOM 0 HE3 LYS A 156 14.817 10.795 -2.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 14.820 12.075 -4.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 14.097 10.736 -5.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 13.135 12.021 -4.671 1.00 0.00 H new ATOM 1451 N VAL A 157 12.936 4.674 -3.984 1.00 0.00 N ATOM 1452 CA VAL A 157 12.617 3.322 -3.600 1.00 0.00 C ATOM 1453 C VAL A 157 13.081 3.168 -2.148 1.00 0.00 C ATOM 1454 O VAL A 157 14.187 2.695 -1.886 1.00 0.00 O ATOM 1455 CB VAL A 157 13.351 2.244 -4.463 1.00 0.00 C ATOM 1456 CG1 VAL A 157 12.580 0.935 -4.478 1.00 0.00 C ATOM 1457 CG2 VAL A 157 13.663 2.730 -5.874 1.00 0.00 C ATOM 0 H VAL A 157 13.889 4.958 -3.758 1.00 0.00 H new ATOM 0 HA VAL A 157 11.548 3.162 -3.739 1.00 0.00 H new ATOM 0 HB VAL A 157 14.313 2.061 -3.985 1.00 0.00 H new ATOM 0 HG11 VAL A 157 13.114 0.205 -5.086 1.00 0.00 H new ATOM 0 HG12 VAL A 157 12.483 0.558 -3.460 1.00 0.00 H new ATOM 0 HG13 VAL A 157 11.589 1.101 -4.899 1.00 0.00 H new ATOM 0 HG21 VAL A 157 14.172 1.940 -6.427 1.00 0.00 H new ATOM 0 HG22 VAL A 157 12.735 2.989 -6.383 1.00 0.00 H new ATOM 0 HG23 VAL A 157 14.305 3.609 -5.822 1.00 0.00 H new ATOM 1467 N PRO A 158 12.305 3.668 -1.195 1.00 0.00 N ATOM 1468 CA PRO A 158 12.661 3.648 0.209 1.00 0.00 C ATOM 1469 C PRO A 158 12.159 2.381 0.924 1.00 0.00 C ATOM 1470 O PRO A 158 11.240 1.706 0.436 1.00 0.00 O ATOM 1471 CB PRO A 158 11.968 4.906 0.757 1.00 0.00 C ATOM 1472 CG PRO A 158 11.121 5.424 -0.369 1.00 0.00 C ATOM 1473 CD PRO A 158 11.034 4.335 -1.384 1.00 0.00 C ATOM 0 HA PRO A 158 13.740 3.639 0.365 1.00 0.00 H new ATOM 0 HB2 PRO A 158 11.358 4.669 1.629 1.00 0.00 H new ATOM 0 HB3 PRO A 158 12.699 5.650 1.072 1.00 0.00 H new ATOM 0 HG2 PRO A 158 10.129 5.698 -0.011 1.00 0.00 H new ATOM 0 HG3 PRO A 158 11.562 6.321 -0.803 1.00 0.00 H new ATOM 0 HD2 PRO A 158 10.190 3.670 -1.202 1.00 0.00 H new ATOM 0 HD3 PRO A 158 10.921 4.724 -2.396 1.00 0.00 H new ATOM 1481 N PRO A 159 12.755 2.047 2.101 1.00 0.00 N ATOM 1482 CA PRO A 159 12.425 0.838 2.892 1.00 0.00 C ATOM 1483 C PRO A 159 10.924 0.593 3.110 1.00 0.00 C ATOM 1484 O PRO A 159 10.485 -0.554 3.119 1.00 0.00 O ATOM 1485 CB PRO A 159 13.111 1.098 4.230 1.00 0.00 C ATOM 1486 CG PRO A 159 14.284 1.937 3.882 1.00 0.00 C ATOM 1487 CD PRO A 159 13.844 2.821 2.751 1.00 0.00 C ATOM 0 HA PRO A 159 12.755 -0.058 2.366 1.00 0.00 H new ATOM 0 HB2 PRO A 159 12.446 1.611 4.925 1.00 0.00 H new ATOM 0 HB3 PRO A 159 13.415 0.167 4.709 1.00 0.00 H new ATOM 0 HG2 PRO A 159 14.606 2.530 4.738 1.00 0.00 H new ATOM 0 HG3 PRO A 159 15.131 1.318 3.586 1.00 0.00 H new ATOM 0 HD2 PRO A 159 13.489 3.786 3.112 1.00 0.00 H new ATOM 0 HD3 PRO A 159 14.661 3.021 2.058 1.00 0.00 H new ATOM 1495 N GLY A 160 10.147 1.663 3.245 1.00 0.00 N ATOM 1496 CA GLY A 160 8.721 1.536 3.489 1.00 0.00 C ATOM 1497 C GLY A 160 7.978 1.001 2.300 1.00 0.00 C ATOM 1498 O GLY A 160 6.939 0.370 2.445 1.00 0.00 O ATOM 0 H GLY A 160 10.483 2.624 3.189 1.00 0.00 H new ATOM 0 HA2 GLY A 160 8.559 0.876 4.341 1.00 0.00 H new ATOM 0 HA3 GLY A 160 8.314 2.510 3.759 1.00 0.00 H new ATOM 1502 N ASN A 161 8.511 1.243 1.126 1.00 0.00 N ATOM 1503 CA ASN A 161 7.849 0.829 -0.092 1.00 0.00 C ATOM 1504 C ASN A 161 8.537 -0.423 -0.657 1.00 0.00 C ATOM 1505 O ASN A 161 7.966 -1.155 -1.479 1.00 0.00 O ATOM 1506 CB ASN A 161 7.880 1.971 -1.110 1.00 0.00 C ATOM 1507 CG ASN A 161 6.723 1.941 -2.107 1.00 0.00 C ATOM 1508 OD1 ASN A 161 6.291 2.974 -2.582 1.00 0.00 O ATOM 1509 ND2 ASN A 161 6.206 0.786 -2.418 1.00 0.00 N ATOM 0 H ASN A 161 9.400 1.724 0.986 1.00 0.00 H new ATOM 0 HA ASN A 161 6.809 0.585 0.123 1.00 0.00 H new ATOM 0 HB2 ASN A 161 7.863 2.921 -0.576 1.00 0.00 H new ATOM 0 HB3 ASN A 161 8.821 1.931 -1.659 1.00 0.00 H new ATOM 0 HD21 ASN A 161 5.424 0.736 -3.071 1.00 0.00 H new ATOM 0 HD22 ASN A 161 6.583 -0.069 -2.008 1.00 0.00 H new