USER MOD reduce.3.24.130724 H: found=0, std=0, add=1138, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1136 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 80 LYS NZ :NH3+ -102:sc= 1.04 (180deg=-0.624) USER MOD Set 1.2: A 84 THR OG1 : rot 82:sc= 0 USER MOD Set 2.1: A 73 MET CE :methyl 152:sc= -1.57 (180deg=-4.4!) USER MOD Set 2.2: A 78 CYS SG : rot -60:sc= -1.26 USER MOD Set 3.1: A 68 ASN : amide:sc= -0.588 X(o=-0.42,f=-0.58) USER MOD Set 3.2: A 81 ASN : amide:sc= 0.163 K(o=-0.42,f=-4.9!) USER MOD Set 4.1: A 26 THR OG1 : rot 79:sc= 0.111 USER MOD Set 4.2: A 27 ASN : amide:sc= 0.105 X(o=0.22,f=0.19) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 27:sc= 0.344 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 170:sc= -1.28 (180deg=-1.47) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 14 CYS SG : rot -170:sc= -0.238 USER MOD Single : A 16 GLN : amide:sc= -0.255 X(o=-0.25,f=-0.045) USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 21 CYS SG : rot 76:sc= -3.94! USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 HIS :FLIP no HD1:sc= -7.67! C(o=-11!,f=-7.7!) USER MOD Single : A 31 THR OG1 : rot -59:sc= 1.17 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc=-0.00283 X(o=-0.0028,f=-0.17) USER MOD Single : A 42 GLN : amide:sc= -0.108 K(o=-0.11,f=-1.3!) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 120:sc= -3.23 USER MOD Single : A 52 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : A 55 ASN : amide:sc= -2.08 K(o=-2.1,f=-15!) USER MOD Single : A 56 ASN : amide:sc= -0.571 X(o=-0.57,f=-0.51) USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 61 SER OG : rot 98:sc= -0.19 USER MOD Single : A 63 ASN : amide:sc= -1.97 K(o=-2,f=-4.9!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 SER OG : rot 87:sc= 0.492 USER MOD Single : A 75 GLN : amide:sc=-0.00922 K(o=-0.0092,f=-1.4!) USER MOD Single : A 87 THR OG1 : rot 70:sc= 0.909 USER MOD Single : A 89 CYS SG : rot 66:sc= -0.27 USER MOD Single : A 90 CYS SG : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot -70:sc= -0.779 USER MOD Single : A 95 MET CE :methyl -178:sc= -1.87! (180deg=-1.9!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 80:sc= -0.0313 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot -82:sc= 0.402 USER MOD Single : A 125 THR OG1 : rot -81:sc= 1.1 USER MOD Single : A 131 THR OG1 : rot -66:sc= 0.644 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 4.277 11.991 16.445 1.00 0.00 N ATOM 2 CA GLY A 1 5.307 11.159 15.850 1.00 0.00 C ATOM 3 C GLY A 1 6.597 11.176 16.644 1.00 0.00 C ATOM 4 O GLY A 1 7.056 12.234 17.073 1.00 0.00 O ATOM 0 H1 GLY A 1 3.415 11.945 15.864 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.067 11.650 17.405 1.00 0.00 H new ATOM 0 H3 GLY A 1 4.610 12.975 16.493 1.00 0.00 H new ATOM 0 HA2 GLY A 1 4.944 10.134 15.775 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.505 11.502 14.834 1.00 0.00 H new ATOM 8 N SER A 2 7.184 10.000 16.842 1.00 0.00 N ATOM 9 CA SER A 2 8.427 9.882 17.595 1.00 0.00 C ATOM 10 C SER A 2 9.496 10.811 17.027 1.00 0.00 C ATOM 11 O SER A 2 9.562 11.034 15.819 1.00 0.00 O ATOM 12 CB SER A 2 8.927 8.437 17.573 1.00 0.00 C ATOM 13 OG SER A 2 10.122 8.299 18.323 1.00 0.00 O ATOM 0 H SER A 2 6.818 9.115 16.491 1.00 0.00 H new ATOM 0 HA SER A 2 8.227 10.173 18.626 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.160 7.777 17.980 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.102 8.125 16.543 1.00 0.00 H new ATOM 0 HG SER A 2 10.420 7.366 18.295 1.00 0.00 H new ATOM 19 N SER A 3 10.332 11.351 17.909 1.00 0.00 N ATOM 20 CA SER A 3 11.396 12.259 17.498 1.00 0.00 C ATOM 21 C SER A 3 12.700 11.500 17.271 1.00 0.00 C ATOM 22 O SER A 3 13.248 10.896 18.191 1.00 0.00 O ATOM 23 CB SER A 3 11.603 13.347 18.553 1.00 0.00 C ATOM 24 OG SER A 3 11.886 12.780 19.821 1.00 0.00 O ATOM 0 H SER A 3 10.293 11.175 18.913 1.00 0.00 H new ATOM 0 HA SER A 3 11.099 12.726 16.559 1.00 0.00 H new ATOM 0 HB2 SER A 3 12.423 13.999 18.252 1.00 0.00 H new ATOM 0 HB3 SER A 3 10.710 13.968 18.620 1.00 0.00 H new ATOM 0 HG SER A 3 12.300 11.900 19.701 1.00 0.00 H new ATOM 30 N GLY A 4 13.191 11.537 16.036 1.00 0.00 N ATOM 31 CA GLY A 4 14.426 10.849 15.708 1.00 0.00 C ATOM 32 C GLY A 4 14.279 9.932 14.511 1.00 0.00 C ATOM 33 O GLY A 4 13.192 9.420 14.242 1.00 0.00 O ATOM 0 H GLY A 4 12.756 12.031 15.257 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.205 11.584 15.505 1.00 0.00 H new ATOM 0 HA3 GLY A 4 14.754 10.267 16.569 1.00 0.00 H new ATOM 37 N SER A 5 15.375 9.724 13.788 1.00 0.00 N ATOM 38 CA SER A 5 15.362 8.866 12.609 1.00 0.00 C ATOM 39 C SER A 5 16.509 7.861 12.656 1.00 0.00 C ATOM 40 O SER A 5 17.177 7.617 11.651 1.00 0.00 O ATOM 41 CB SER A 5 15.460 9.710 11.337 1.00 0.00 C ATOM 42 OG SER A 5 14.193 10.228 10.970 1.00 0.00 O ATOM 0 H SER A 5 16.283 10.138 13.998 1.00 0.00 H new ATOM 0 HA SER A 5 14.421 8.317 12.600 1.00 0.00 H new ATOM 0 HB2 SER A 5 16.160 10.530 11.494 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.858 9.103 10.524 1.00 0.00 H new ATOM 0 HG SER A 5 14.283 10.765 10.155 1.00 0.00 H new ATOM 48 N SER A 6 16.732 7.280 13.831 1.00 0.00 N ATOM 49 CA SER A 6 17.800 6.304 14.011 1.00 0.00 C ATOM 50 C SER A 6 17.597 5.101 13.096 1.00 0.00 C ATOM 51 O SER A 6 16.707 4.280 13.319 1.00 0.00 O ATOM 52 CB SER A 6 17.860 5.846 15.469 1.00 0.00 C ATOM 53 OG SER A 6 19.043 5.108 15.724 1.00 0.00 O ATOM 0 H SER A 6 16.187 7.469 14.672 1.00 0.00 H new ATOM 0 HA SER A 6 18.744 6.782 13.749 1.00 0.00 H new ATOM 0 HB2 SER A 6 17.820 6.713 16.128 1.00 0.00 H new ATOM 0 HB3 SER A 6 16.989 5.232 15.697 1.00 0.00 H new ATOM 0 HG SER A 6 19.058 4.828 16.663 1.00 0.00 H new ATOM 59 N GLY A 7 18.429 5.003 12.063 1.00 0.00 N ATOM 60 CA GLY A 7 18.325 3.897 11.129 1.00 0.00 C ATOM 61 C GLY A 7 17.449 4.226 9.937 1.00 0.00 C ATOM 62 O GLY A 7 16.812 5.279 9.898 1.00 0.00 O ATOM 0 H GLY A 7 19.173 5.670 11.857 1.00 0.00 H new ATOM 0 HA2 GLY A 7 19.321 3.625 10.780 1.00 0.00 H new ATOM 0 HA3 GLY A 7 17.920 3.027 11.645 1.00 0.00 H new ATOM 66 N MET A 8 17.418 3.325 8.960 1.00 0.00 N ATOM 67 CA MET A 8 16.613 3.526 7.761 1.00 0.00 C ATOM 68 C MET A 8 15.334 2.696 7.818 1.00 0.00 C ATOM 69 O MET A 8 15.341 1.507 7.503 1.00 0.00 O ATOM 70 CB MET A 8 17.418 3.157 6.513 1.00 0.00 C ATOM 71 CG MET A 8 16.583 3.102 5.245 1.00 0.00 C ATOM 72 SD MET A 8 17.562 3.373 3.755 1.00 0.00 S ATOM 73 CE MET A 8 16.734 2.281 2.602 1.00 0.00 C ATOM 0 H MET A 8 17.941 2.449 8.975 1.00 0.00 H new ATOM 0 HA MET A 8 16.339 4.580 7.711 1.00 0.00 H new ATOM 0 HB2 MET A 8 18.219 3.884 6.379 1.00 0.00 H new ATOM 0 HB3 MET A 8 17.891 2.187 6.669 1.00 0.00 H new ATOM 0 HG2 MET A 8 16.091 2.131 5.180 1.00 0.00 H new ATOM 0 HG3 MET A 8 15.796 3.855 5.300 1.00 0.00 H new ATOM 0 HE1 MET A 8 17.106 2.466 1.594 1.00 0.00 H new ATOM 0 HE2 MET A 8 16.931 1.245 2.877 1.00 0.00 H new ATOM 0 HE3 MET A 8 15.660 2.467 2.632 1.00 0.00 H new ATOM 83 N GLU A 9 14.239 3.332 8.223 1.00 0.00 N ATOM 84 CA GLU A 9 12.954 2.651 8.323 1.00 0.00 C ATOM 85 C GLU A 9 12.658 1.858 7.053 1.00 0.00 C ATOM 86 O GLU A 9 13.187 2.141 5.977 1.00 0.00 O ATOM 87 CB GLU A 9 11.834 3.662 8.578 1.00 0.00 C ATOM 88 CG GLU A 9 11.776 4.156 10.014 1.00 0.00 C ATOM 89 CD GLU A 9 11.390 3.063 10.992 1.00 0.00 C ATOM 90 OE1 GLU A 9 10.177 2.843 11.188 1.00 0.00 O ATOM 91 OE2 GLU A 9 12.303 2.428 11.561 1.00 0.00 O ATOM 0 H GLU A 9 14.216 4.317 8.487 1.00 0.00 H new ATOM 0 HA GLU A 9 13.005 1.956 9.161 1.00 0.00 H new ATOM 0 HB2 GLU A 9 11.968 4.516 7.914 1.00 0.00 H new ATOM 0 HB3 GLU A 9 10.878 3.206 8.321 1.00 0.00 H new ATOM 0 HG2 GLU A 9 12.748 4.562 10.294 1.00 0.00 H new ATOM 0 HG3 GLU A 9 11.057 4.972 10.085 1.00 0.00 H new ATOM 98 N PRO A 10 11.794 0.841 7.179 1.00 0.00 N ATOM 99 CA PRO A 10 11.408 -0.014 6.052 1.00 0.00 C ATOM 100 C PRO A 10 10.544 0.722 5.035 1.00 0.00 C ATOM 101 O PRO A 10 10.447 0.314 3.878 1.00 0.00 O ATOM 102 CB PRO A 10 10.610 -1.139 6.717 1.00 0.00 C ATOM 103 CG PRO A 10 10.084 -0.537 7.975 1.00 0.00 C ATOM 104 CD PRO A 10 11.126 0.446 8.431 1.00 0.00 C ATOM 0 HA PRO A 10 12.274 -0.362 5.490 1.00 0.00 H new ATOM 0 HB2 PRO A 10 9.800 -1.484 6.074 1.00 0.00 H new ATOM 0 HB3 PRO A 10 11.241 -2.003 6.925 1.00 0.00 H new ATOM 0 HG2 PRO A 10 9.129 -0.041 7.801 1.00 0.00 H new ATOM 0 HG3 PRO A 10 9.912 -1.302 8.732 1.00 0.00 H new ATOM 0 HD2 PRO A 10 10.677 1.302 8.935 1.00 0.00 H new ATOM 0 HD3 PRO A 10 11.825 -0.007 9.134 1.00 0.00 H new ATOM 112 N TRP A 11 9.919 1.809 5.473 1.00 0.00 N ATOM 113 CA TRP A 11 9.063 2.603 4.599 1.00 0.00 C ATOM 114 C TRP A 11 9.875 3.248 3.481 1.00 0.00 C ATOM 115 O TRP A 11 9.401 3.381 2.353 1.00 0.00 O ATOM 116 CB TRP A 11 8.336 3.681 5.405 1.00 0.00 C ATOM 117 CG TRP A 11 9.115 4.955 5.532 1.00 0.00 C ATOM 118 CD1 TRP A 11 9.868 5.352 6.600 1.00 0.00 C ATOM 119 CD2 TRP A 11 9.216 5.998 4.557 1.00 0.00 C ATOM 120 NE1 TRP A 11 10.431 6.580 6.347 1.00 0.00 N ATOM 121 CE2 TRP A 11 10.047 6.998 5.101 1.00 0.00 C ATOM 122 CE3 TRP A 11 8.687 6.185 3.277 1.00 0.00 C ATOM 123 CZ2 TRP A 11 10.358 8.165 4.408 1.00 0.00 C ATOM 124 CZ3 TRP A 11 8.996 7.344 2.591 1.00 0.00 C ATOM 125 CH2 TRP A 11 9.826 8.321 3.157 1.00 0.00 C ATOM 0 H TRP A 11 9.989 2.161 6.428 1.00 0.00 H new ATOM 0 HA TRP A 11 8.327 1.936 4.150 1.00 0.00 H new ATOM 0 HB2 TRP A 11 7.378 3.895 4.931 1.00 0.00 H new ATOM 0 HB3 TRP A 11 8.119 3.295 6.401 1.00 0.00 H new ATOM 0 HD1 TRP A 11 10.001 4.785 7.509 1.00 0.00 H new ATOM 0 HE1 TRP A 11 11.037 7.097 6.984 1.00 0.00 H new ATOM 0 HE3 TRP A 11 8.048 5.437 2.832 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 10.996 8.920 4.842 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 8.591 7.500 1.602 1.00 0.00 H new ATOM 0 HH2 TRP A 11 10.050 9.215 2.594 1.00 0.00 H new ATOM 136 N LYS A 12 11.101 3.648 3.801 1.00 0.00 N ATOM 137 CA LYS A 12 11.980 4.278 2.824 1.00 0.00 C ATOM 138 C LYS A 12 12.241 3.345 1.646 1.00 0.00 C ATOM 139 O LYS A 12 12.251 3.775 0.493 1.00 0.00 O ATOM 140 CB LYS A 12 13.305 4.673 3.479 1.00 0.00 C ATOM 141 CG LYS A 12 13.302 6.076 4.061 1.00 0.00 C ATOM 142 CD LYS A 12 13.031 7.122 2.993 1.00 0.00 C ATOM 143 CE LYS A 12 13.725 8.438 3.312 1.00 0.00 C ATOM 144 NZ LYS A 12 13.715 9.367 2.149 1.00 0.00 N ATOM 0 H LYS A 12 11.508 3.547 4.731 1.00 0.00 H new ATOM 0 HA LYS A 12 11.485 5.175 2.452 1.00 0.00 H new ATOM 0 HB2 LYS A 12 13.535 3.961 4.271 1.00 0.00 H new ATOM 0 HB3 LYS A 12 14.103 4.597 2.740 1.00 0.00 H new ATOM 0 HG2 LYS A 12 12.544 6.146 4.841 1.00 0.00 H new ATOM 0 HG3 LYS A 12 14.264 6.277 4.533 1.00 0.00 H new ATOM 0 HD2 LYS A 12 13.374 6.754 2.026 1.00 0.00 H new ATOM 0 HD3 LYS A 12 11.957 7.287 2.908 1.00 0.00 H new ATOM 0 HE2 LYS A 12 13.231 8.913 4.160 1.00 0.00 H new ATOM 0 HE3 LYS A 12 14.755 8.242 3.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 14.197 10.252 2.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 14.208 8.925 1.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 12.732 9.575 1.879 1.00 0.00 H new ATOM 158 N GLN A 13 12.450 2.067 1.944 1.00 0.00 N ATOM 159 CA GLN A 13 12.711 1.074 0.909 1.00 0.00 C ATOM 160 C GLN A 13 11.468 0.839 0.056 1.00 0.00 C ATOM 161 O GLN A 13 11.533 0.870 -1.174 1.00 0.00 O ATOM 162 CB GLN A 13 13.168 -0.243 1.539 1.00 0.00 C ATOM 163 CG GLN A 13 14.209 -0.065 2.632 1.00 0.00 C ATOM 164 CD GLN A 13 14.599 -1.376 3.286 1.00 0.00 C ATOM 165 OE1 GLN A 13 13.741 -2.181 3.649 1.00 0.00 O ATOM 166 NE2 GLN A 13 15.899 -1.597 3.439 1.00 0.00 N ATOM 0 H GLN A 13 12.444 1.695 2.894 1.00 0.00 H new ATOM 0 HA GLN A 13 13.505 1.455 0.266 1.00 0.00 H new ATOM 0 HB2 GLN A 13 12.301 -0.758 1.954 1.00 0.00 H new ATOM 0 HB3 GLN A 13 13.577 -0.886 0.760 1.00 0.00 H new ATOM 0 HG2 GLN A 13 15.097 0.404 2.209 1.00 0.00 H new ATOM 0 HG3 GLN A 13 13.821 0.614 3.391 1.00 0.00 H new ATOM 0 HE21 GLN A 13 16.575 -0.902 3.123 1.00 0.00 H new ATOM 0 HE22 GLN A 13 16.222 -2.462 3.872 1.00 0.00 H new ATOM 175 N CYS A 14 10.340 0.603 0.715 1.00 0.00 N ATOM 176 CA CYS A 14 9.082 0.361 0.017 1.00 0.00 C ATOM 177 C CYS A 14 8.837 1.427 -1.046 1.00 0.00 C ATOM 178 O CYS A 14 8.569 1.111 -2.205 1.00 0.00 O ATOM 179 CB CYS A 14 7.920 0.338 1.010 1.00 0.00 C ATOM 180 SG CYS A 14 6.300 0.090 0.246 1.00 0.00 S ATOM 0 H CYS A 14 10.270 0.574 1.732 1.00 0.00 H new ATOM 0 HA CYS A 14 9.149 -0.609 -0.475 1.00 0.00 H new ATOM 0 HB2 CYS A 14 8.093 -0.456 1.736 1.00 0.00 H new ATOM 0 HB3 CYS A 14 7.909 1.278 1.562 1.00 0.00 H new ATOM 0 HG CYS A 14 5.368 0.293 1.129 1.00 0.00 H new ATOM 186 N ALA A 15 8.929 2.690 -0.643 1.00 0.00 N ATOM 187 CA ALA A 15 8.718 3.802 -1.561 1.00 0.00 C ATOM 188 C ALA A 15 9.239 3.470 -2.955 1.00 0.00 C ATOM 189 O ALA A 15 8.583 3.754 -3.957 1.00 0.00 O ATOM 190 CB ALA A 15 9.389 5.060 -1.030 1.00 0.00 C ATOM 0 H ALA A 15 9.148 2.968 0.313 1.00 0.00 H new ATOM 0 HA ALA A 15 7.645 3.980 -1.636 1.00 0.00 H new ATOM 0 HB1 ALA A 15 9.223 5.882 -1.726 1.00 0.00 H new ATOM 0 HB2 ALA A 15 8.966 5.316 -0.059 1.00 0.00 H new ATOM 0 HB3 ALA A 15 10.460 4.884 -0.924 1.00 0.00 H new ATOM 196 N GLN A 16 10.423 2.868 -3.011 1.00 0.00 N ATOM 197 CA GLN A 16 11.032 2.499 -4.284 1.00 0.00 C ATOM 198 C GLN A 16 10.166 1.490 -5.030 1.00 0.00 C ATOM 199 O GLN A 16 9.740 1.737 -6.158 1.00 0.00 O ATOM 200 CB GLN A 16 12.429 1.920 -4.055 1.00 0.00 C ATOM 201 CG GLN A 16 13.374 2.873 -3.340 1.00 0.00 C ATOM 202 CD GLN A 16 13.685 4.110 -4.158 1.00 0.00 C ATOM 203 OE1 GLN A 16 14.682 4.157 -4.879 1.00 0.00 O ATOM 204 NE2 GLN A 16 12.830 5.121 -4.051 1.00 0.00 N ATOM 0 H GLN A 16 10.979 2.626 -2.191 1.00 0.00 H new ATOM 0 HA GLN A 16 11.114 3.399 -4.893 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.342 1.003 -3.472 1.00 0.00 H new ATOM 0 HB3 GLN A 16 12.862 1.646 -5.017 1.00 0.00 H new ATOM 0 HG2 GLN A 16 12.932 3.172 -2.390 1.00 0.00 H new ATOM 0 HG3 GLN A 16 14.303 2.352 -3.109 1.00 0.00 H new ATOM 0 HE21 GLN A 16 12.016 5.039 -3.441 1.00 0.00 H new ATOM 0 HE22 GLN A 16 12.987 5.980 -4.579 1.00 0.00 H new ATOM 213 N TRP A 17 9.910 0.353 -4.393 1.00 0.00 N ATOM 214 CA TRP A 17 9.095 -0.694 -4.997 1.00 0.00 C ATOM 215 C TRP A 17 7.828 -0.111 -5.614 1.00 0.00 C ATOM 216 O TRP A 17 7.424 -0.499 -6.711 1.00 0.00 O ATOM 217 CB TRP A 17 8.728 -1.750 -3.953 1.00 0.00 C ATOM 218 CG TRP A 17 8.010 -2.933 -4.530 1.00 0.00 C ATOM 219 CD1 TRP A 17 8.519 -3.857 -5.398 1.00 0.00 C ATOM 220 CD2 TRP A 17 6.653 -3.316 -4.282 1.00 0.00 C ATOM 221 NE1 TRP A 17 7.559 -4.791 -5.704 1.00 0.00 N ATOM 222 CE2 TRP A 17 6.407 -4.483 -5.032 1.00 0.00 C ATOM 223 CE3 TRP A 17 5.624 -2.789 -3.498 1.00 0.00 C ATOM 224 CZ2 TRP A 17 5.173 -5.128 -5.020 1.00 0.00 C ATOM 225 CZ3 TRP A 17 4.399 -3.430 -3.488 1.00 0.00 C ATOM 226 CH2 TRP A 17 4.182 -4.590 -4.244 1.00 0.00 C ATOM 0 H TRP A 17 10.255 0.133 -3.459 1.00 0.00 H new ATOM 0 HA TRP A 17 9.680 -1.163 -5.788 1.00 0.00 H new ATOM 0 HB2 TRP A 17 9.637 -2.092 -3.458 1.00 0.00 H new ATOM 0 HB3 TRP A 17 8.101 -1.292 -3.188 1.00 0.00 H new ATOM 0 HD1 TRP A 17 9.527 -3.854 -5.786 1.00 0.00 H new ATOM 0 HE1 TRP A 17 7.685 -5.586 -6.331 1.00 0.00 H new ATOM 0 HE3 TRP A 17 5.782 -1.897 -2.910 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 5.004 -6.022 -5.603 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 3.596 -3.030 -2.887 1.00 0.00 H new ATOM 0 HH2 TRP A 17 3.214 -5.069 -4.214 1.00 0.00 H new ATOM 237 N LEU A 18 7.206 0.824 -4.904 1.00 0.00 N ATOM 238 CA LEU A 18 5.984 1.462 -5.382 1.00 0.00 C ATOM 239 C LEU A 18 6.227 2.176 -6.708 1.00 0.00 C ATOM 240 O LEU A 18 5.517 1.944 -7.687 1.00 0.00 O ATOM 241 CB LEU A 18 5.464 2.455 -4.342 1.00 0.00 C ATOM 242 CG LEU A 18 4.931 1.850 -3.043 1.00 0.00 C ATOM 243 CD1 LEU A 18 5.025 2.857 -1.907 1.00 0.00 C ATOM 244 CD2 LEU A 18 3.496 1.378 -3.223 1.00 0.00 C ATOM 0 H LEU A 18 7.528 1.157 -3.995 1.00 0.00 H new ATOM 0 HA LEU A 18 5.235 0.686 -5.540 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.270 3.145 -4.094 1.00 0.00 H new ATOM 0 HB3 LEU A 18 4.668 3.044 -4.798 1.00 0.00 H new ATOM 0 HG LEU A 18 5.546 0.987 -2.788 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.641 2.409 -0.991 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.066 3.145 -1.761 1.00 0.00 H new ATOM 0 HD13 LEU A 18 4.435 3.740 -2.154 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.134 0.950 -2.288 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.867 2.223 -3.503 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.457 0.622 -4.007 1.00 0.00 H new ATOM 256 N ILE A 19 7.233 3.043 -6.732 1.00 0.00 N ATOM 257 CA ILE A 19 7.571 3.788 -7.938 1.00 0.00 C ATOM 258 C ILE A 19 7.817 2.848 -9.114 1.00 0.00 C ATOM 259 O ILE A 19 7.440 3.143 -10.248 1.00 0.00 O ATOM 260 CB ILE A 19 8.818 4.666 -7.728 1.00 0.00 C ATOM 261 CG1 ILE A 19 8.607 5.614 -6.545 1.00 0.00 C ATOM 262 CG2 ILE A 19 9.134 5.450 -8.992 1.00 0.00 C ATOM 263 CD1 ILE A 19 9.874 6.306 -6.092 1.00 0.00 C ATOM 0 H ILE A 19 7.829 3.247 -5.929 1.00 0.00 H new ATOM 0 HA ILE A 19 6.719 4.430 -8.161 1.00 0.00 H new ATOM 0 HB ILE A 19 9.666 4.019 -7.505 1.00 0.00 H new ATOM 0 HG12 ILE A 19 7.870 6.368 -6.821 1.00 0.00 H new ATOM 0 HG13 ILE A 19 8.191 5.052 -5.709 1.00 0.00 H new ATOM 0 HG21 ILE A 19 10.018 6.066 -8.827 1.00 0.00 H new ATOM 0 HG22 ILE A 19 9.322 4.757 -9.812 1.00 0.00 H new ATOM 0 HG23 ILE A 19 8.288 6.090 -9.244 1.00 0.00 H new ATOM 0 HD11 ILE A 19 9.650 6.962 -5.251 1.00 0.00 H new ATOM 0 HD12 ILE A 19 10.606 5.559 -5.785 1.00 0.00 H new ATOM 0 HD13 ILE A 19 10.280 6.896 -6.914 1.00 0.00 H new ATOM 275 N HIS A 20 8.451 1.713 -8.835 1.00 0.00 N ATOM 276 CA HIS A 20 8.746 0.728 -9.869 1.00 0.00 C ATOM 277 C HIS A 20 7.493 -0.058 -10.243 1.00 0.00 C ATOM 278 O HIS A 20 7.333 -0.480 -11.389 1.00 0.00 O ATOM 279 CB HIS A 20 9.840 -0.229 -9.394 1.00 0.00 C ATOM 280 CG HIS A 20 11.225 0.318 -9.553 1.00 0.00 C ATOM 281 ND1 HIS A 20 12.035 0.016 -10.627 1.00 0.00 N ATOM 282 CD2 HIS A 20 11.942 1.154 -8.766 1.00 0.00 C ATOM 283 CE1 HIS A 20 13.191 0.641 -10.494 1.00 0.00 C ATOM 284 NE2 HIS A 20 13.160 1.339 -9.373 1.00 0.00 N ATOM 0 H HIS A 20 8.770 1.453 -7.902 1.00 0.00 H new ATOM 0 HA HIS A 20 9.098 1.259 -10.753 1.00 0.00 H new ATOM 0 HB2 HIS A 20 9.671 -0.468 -8.344 1.00 0.00 H new ATOM 0 HB3 HIS A 20 9.761 -1.163 -9.950 1.00 0.00 H new ATOM 0 HD2 HIS A 20 11.617 1.594 -7.835 1.00 0.00 H new ATOM 0 HE1 HIS A 20 14.020 0.590 -11.184 1.00 0.00 H new ATOM 0 HE2 HIS A 20 13.918 1.921 -9.016 1.00 0.00 H new ATOM 293 N CYS A 21 6.609 -0.251 -9.271 1.00 0.00 N ATOM 294 CA CYS A 21 5.371 -0.988 -9.498 1.00 0.00 C ATOM 295 C CYS A 21 4.408 -0.179 -10.361 1.00 0.00 C ATOM 296 O CYS A 21 3.299 -0.625 -10.658 1.00 0.00 O ATOM 297 CB CYS A 21 4.710 -1.338 -8.165 1.00 0.00 C ATOM 298 SG CYS A 21 5.555 -2.644 -7.242 1.00 0.00 S ATOM 0 H CYS A 21 6.726 0.093 -8.318 1.00 0.00 H new ATOM 0 HA CYS A 21 5.617 -1.910 -10.026 1.00 0.00 H new ATOM 0 HB2 CYS A 21 4.666 -0.441 -7.547 1.00 0.00 H new ATOM 0 HB3 CYS A 21 3.682 -1.647 -8.352 1.00 0.00 H new ATOM 0 HG CYS A 21 6.628 -2.160 -6.689 1.00 0.00 H new ATOM 304 N LYS A 22 4.837 1.014 -10.758 1.00 0.00 N ATOM 305 CA LYS A 22 4.013 1.887 -11.587 1.00 0.00 C ATOM 306 C LYS A 22 2.815 2.410 -10.801 1.00 0.00 C ATOM 307 O LYS A 22 1.686 2.401 -11.292 1.00 0.00 O ATOM 308 CB LYS A 22 3.533 1.138 -12.832 1.00 0.00 C ATOM 309 CG LYS A 22 4.644 0.417 -13.575 1.00 0.00 C ATOM 310 CD LYS A 22 5.566 1.395 -14.284 1.00 0.00 C ATOM 311 CE LYS A 22 6.169 0.782 -15.539 1.00 0.00 C ATOM 312 NZ LYS A 22 5.302 0.994 -16.731 1.00 0.00 N ATOM 0 H LYS A 22 5.751 1.399 -10.519 1.00 0.00 H new ATOM 0 HA LYS A 22 4.622 2.737 -11.895 1.00 0.00 H new ATOM 0 HB2 LYS A 22 2.773 0.413 -12.539 1.00 0.00 H new ATOM 0 HB3 LYS A 22 3.054 1.845 -13.509 1.00 0.00 H new ATOM 0 HG2 LYS A 22 5.221 -0.185 -12.873 1.00 0.00 H new ATOM 0 HG3 LYS A 22 4.211 -0.269 -14.303 1.00 0.00 H new ATOM 0 HD2 LYS A 22 5.010 2.295 -14.548 1.00 0.00 H new ATOM 0 HD3 LYS A 22 6.364 1.700 -13.607 1.00 0.00 H new ATOM 0 HE2 LYS A 22 7.151 1.219 -15.721 1.00 0.00 H new ATOM 0 HE3 LYS A 22 6.320 -0.286 -15.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 5.747 0.562 -17.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 4.374 0.555 -16.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 5.179 2.014 -16.894 1.00 0.00 H new ATOM 326 N VAL A 23 3.068 2.868 -9.579 1.00 0.00 N ATOM 327 CA VAL A 23 2.011 3.398 -8.727 1.00 0.00 C ATOM 328 C VAL A 23 2.317 4.828 -8.296 1.00 0.00 C ATOM 329 O VAL A 23 1.408 5.622 -8.050 1.00 0.00 O ATOM 330 CB VAL A 23 1.812 2.527 -7.472 1.00 0.00 C ATOM 331 CG1 VAL A 23 1.314 1.142 -7.856 1.00 0.00 C ATOM 332 CG2 VAL A 23 3.106 2.436 -6.677 1.00 0.00 C ATOM 0 H VAL A 23 3.997 2.882 -9.157 1.00 0.00 H new ATOM 0 HA VAL A 23 1.094 3.388 -9.317 1.00 0.00 H new ATOM 0 HB VAL A 23 1.057 2.996 -6.841 1.00 0.00 H new ATOM 0 HG11 VAL A 23 1.179 0.541 -6.956 1.00 0.00 H new ATOM 0 HG12 VAL A 23 0.362 1.230 -8.379 1.00 0.00 H new ATOM 0 HG13 VAL A 23 2.043 0.661 -8.508 1.00 0.00 H new ATOM 0 HG21 VAL A 23 2.948 1.817 -5.794 1.00 0.00 H new ATOM 0 HG22 VAL A 23 3.884 1.991 -7.297 1.00 0.00 H new ATOM 0 HG23 VAL A 23 3.415 3.435 -6.369 1.00 0.00 H new ATOM 342 N LEU A 24 3.602 5.151 -8.209 1.00 0.00 N ATOM 343 CA LEU A 24 4.030 6.487 -7.808 1.00 0.00 C ATOM 344 C LEU A 24 5.126 7.008 -8.732 1.00 0.00 C ATOM 345 O LEU A 24 5.931 6.247 -9.271 1.00 0.00 O ATOM 346 CB LEU A 24 4.530 6.473 -6.363 1.00 0.00 C ATOM 347 CG LEU A 24 3.502 6.079 -5.301 1.00 0.00 C ATOM 348 CD1 LEU A 24 4.175 5.890 -3.950 1.00 0.00 C ATOM 349 CD2 LEU A 24 2.401 7.126 -5.210 1.00 0.00 C ATOM 0 H LEU A 24 4.366 4.506 -8.411 1.00 0.00 H new ATOM 0 HA LEU A 24 3.171 7.153 -7.882 1.00 0.00 H new ATOM 0 HB2 LEU A 24 5.372 5.784 -6.298 1.00 0.00 H new ATOM 0 HB3 LEU A 24 4.910 7.466 -6.121 1.00 0.00 H new ATOM 0 HG LEU A 24 3.051 5.131 -5.594 1.00 0.00 H new ATOM 0 HD11 LEU A 24 3.428 5.610 -3.207 1.00 0.00 H new ATOM 0 HD12 LEU A 24 4.925 5.103 -4.024 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.655 6.821 -3.649 1.00 0.00 H new ATOM 0 HD21 LEU A 24 1.679 6.829 -4.450 1.00 0.00 H new ATOM 0 HD22 LEU A 24 2.836 8.089 -4.941 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.899 7.211 -6.174 1.00 0.00 H new ATOM 361 N PRO A 25 5.163 8.335 -8.919 1.00 0.00 N ATOM 362 CA PRO A 25 6.158 8.988 -9.775 1.00 0.00 C ATOM 363 C PRO A 25 7.560 8.935 -9.178 1.00 0.00 C ATOM 364 O PRO A 25 7.736 8.598 -8.006 1.00 0.00 O ATOM 365 CB PRO A 25 5.664 10.434 -9.854 1.00 0.00 C ATOM 366 CG PRO A 25 4.869 10.632 -8.609 1.00 0.00 C ATOM 367 CD PRO A 25 4.235 9.302 -8.308 1.00 0.00 C ATOM 0 HA PRO A 25 6.244 8.500 -10.746 1.00 0.00 H new ATOM 0 HB2 PRO A 25 6.497 11.135 -9.907 1.00 0.00 H new ATOM 0 HB3 PRO A 25 5.054 10.596 -10.743 1.00 0.00 H new ATOM 0 HG2 PRO A 25 5.506 10.956 -7.786 1.00 0.00 H new ATOM 0 HG3 PRO A 25 4.111 11.403 -8.748 1.00 0.00 H new ATOM 0 HD2 PRO A 25 4.134 9.139 -7.235 1.00 0.00 H new ATOM 0 HD3 PRO A 25 3.236 9.227 -8.738 1.00 0.00 H new ATOM 375 N THR A 26 8.557 9.270 -9.991 1.00 0.00 N ATOM 376 CA THR A 26 9.944 9.260 -9.543 1.00 0.00 C ATOM 377 C THR A 26 10.233 10.440 -8.622 1.00 0.00 C ATOM 378 O THR A 26 11.020 10.328 -7.683 1.00 0.00 O ATOM 379 CB THR A 26 10.919 9.303 -10.734 1.00 0.00 C ATOM 380 OG1 THR A 26 10.749 10.523 -11.464 1.00 0.00 O ATOM 381 CG2 THR A 26 10.694 8.117 -11.661 1.00 0.00 C ATOM 0 H THR A 26 8.430 9.552 -10.963 1.00 0.00 H new ATOM 0 HA THR A 26 10.092 8.330 -8.995 1.00 0.00 H new ATOM 0 HB THR A 26 11.935 9.252 -10.344 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.204 11.252 -10.993 1.00 0.00 H new ATOM 0 HG21 THR A 26 11.394 8.169 -12.495 1.00 0.00 H new ATOM 0 HG22 THR A 26 10.853 7.190 -11.111 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.673 8.142 -12.042 1.00 0.00 H new ATOM 389 N ASN A 27 9.591 11.570 -8.897 1.00 0.00 N ATOM 390 CA ASN A 27 9.779 12.772 -8.092 1.00 0.00 C ATOM 391 C ASN A 27 8.594 12.991 -7.156 1.00 0.00 C ATOM 392 O ASN A 27 8.299 14.121 -6.765 1.00 0.00 O ATOM 393 CB ASN A 27 9.963 13.993 -8.995 1.00 0.00 C ATOM 394 CG ASN A 27 11.369 14.090 -9.557 1.00 0.00 C ATOM 395 OD1 ASN A 27 11.743 13.337 -10.457 1.00 0.00 O ATOM 396 ND2 ASN A 27 12.155 15.019 -9.026 1.00 0.00 N ATOM 0 H ASN A 27 8.936 11.679 -9.671 1.00 0.00 H new ATOM 0 HA ASN A 27 10.676 12.637 -7.488 1.00 0.00 H new ATOM 0 HB2 ASN A 27 9.249 13.945 -9.817 1.00 0.00 H new ATOM 0 HB3 ASN A 27 9.737 14.897 -8.429 1.00 0.00 H new ATOM 0 HD21 ASN A 27 13.111 15.131 -9.362 1.00 0.00 H new ATOM 0 HD22 ASN A 27 11.802 15.621 -8.282 1.00 0.00 H new ATOM 403 N HIS A 28 7.918 11.903 -6.801 1.00 0.00 N ATOM 404 CA HIS A 28 6.765 11.977 -5.910 1.00 0.00 C ATOM 405 C HIS A 28 7.105 12.759 -4.645 1.00 0.00 C ATOM 406 O HIS A 28 8.222 13.252 -4.490 1.00 0.00 O ATOM 407 CB HIS A 28 6.288 10.571 -5.543 1.00 0.00 C ATOM 408 CG HIS A 28 4.830 10.502 -5.211 1.00 0.00 C ATOM 409 ND1 HIS A 28 3.754 11.041 -5.830 1.00 0.00 N flip ATOM 410 CD2 HIS A 28 4.338 9.813 -4.122 1.00 0.00 C flip ATOM 411 CE1 HIS A 28 2.643 10.671 -5.112 1.00 0.00 C flip ATOM 412 NE2 HIS A 28 3.022 9.930 -4.087 1.00 0.00 N flip ATOM 0 H HIS A 28 8.148 10.961 -7.116 1.00 0.00 H new ATOM 0 HA HIS A 28 5.964 12.499 -6.434 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.495 9.897 -6.374 1.00 0.00 H new ATOM 0 HB3 HIS A 28 6.864 10.212 -4.690 1.00 0.00 H new ATOM 0 HD2 HIS A 28 4.935 9.264 -3.409 1.00 0.00 H new ATOM 0 HE1 HIS A 28 1.625 10.942 -5.348 1.00 0.00 H new ATOM 0 HE2 HIS A 28 2.404 9.518 -3.387 1.00 0.00 H new ATOM 421 N ARG A 29 6.134 12.868 -3.744 1.00 0.00 N ATOM 422 CA ARG A 29 6.330 13.591 -2.494 1.00 0.00 C ATOM 423 C ARG A 29 7.071 12.728 -1.477 1.00 0.00 C ATOM 424 O ARG A 29 7.819 13.238 -0.642 1.00 0.00 O ATOM 425 CB ARG A 29 4.983 14.033 -1.919 1.00 0.00 C ATOM 426 CG ARG A 29 4.025 12.882 -1.657 1.00 0.00 C ATOM 427 CD ARG A 29 2.628 13.383 -1.328 1.00 0.00 C ATOM 428 NE ARG A 29 2.513 13.808 0.064 1.00 0.00 N ATOM 429 CZ ARG A 29 1.580 14.646 0.502 1.00 0.00 C ATOM 430 NH1 ARG A 29 0.686 15.146 -0.340 1.00 0.00 N ATOM 431 NH2 ARG A 29 1.540 14.986 1.784 1.00 0.00 N ATOM 0 H ARG A 29 5.204 12.465 -3.857 1.00 0.00 H new ATOM 0 HA ARG A 29 6.934 14.473 -2.705 1.00 0.00 H new ATOM 0 HB2 ARG A 29 5.155 14.571 -0.987 1.00 0.00 H new ATOM 0 HB3 ARG A 29 4.515 14.734 -2.610 1.00 0.00 H new ATOM 0 HG2 ARG A 29 3.984 12.235 -2.533 1.00 0.00 H new ATOM 0 HG3 ARG A 29 4.399 12.277 -0.831 1.00 0.00 H new ATOM 0 HD2 ARG A 29 2.378 14.217 -1.984 1.00 0.00 H new ATOM 0 HD3 ARG A 29 1.903 12.593 -1.527 1.00 0.00 H new ATOM 0 HE ARG A 29 3.186 13.441 0.737 1.00 0.00 H new ATOM 0 HH11 ARG A 29 0.714 14.887 -1.326 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -0.030 15.789 -0.001 1.00 0.00 H new ATOM 0 HH21 ARG A 29 2.226 14.604 2.435 1.00 0.00 H new ATOM 0 HH22 ARG A 29 0.823 15.630 2.119 1.00 0.00 H new ATOM 445 N VAL A 30 6.857 11.418 -1.552 1.00 0.00 N ATOM 446 CA VAL A 30 7.505 10.484 -0.639 1.00 0.00 C ATOM 447 C VAL A 30 9.004 10.407 -0.903 1.00 0.00 C ATOM 448 O VAL A 30 9.773 9.950 -0.057 1.00 0.00 O ATOM 449 CB VAL A 30 6.900 9.073 -0.758 1.00 0.00 C ATOM 450 CG1 VAL A 30 5.391 9.121 -0.576 1.00 0.00 C ATOM 451 CG2 VAL A 30 7.265 8.449 -2.096 1.00 0.00 C ATOM 0 H VAL A 30 6.240 10.980 -2.236 1.00 0.00 H new ATOM 0 HA VAL A 30 7.337 10.860 0.370 1.00 0.00 H new ATOM 0 HB VAL A 30 7.317 8.450 0.033 1.00 0.00 H new ATOM 0 HG11 VAL A 30 4.982 8.115 -0.664 1.00 0.00 H new ATOM 0 HG12 VAL A 30 5.156 9.524 0.409 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.952 9.759 -1.343 1.00 0.00 H new ATOM 0 HG21 VAL A 30 6.829 7.452 -2.163 1.00 0.00 H new ATOM 0 HG22 VAL A 30 6.878 9.069 -2.904 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.349 8.378 -2.180 1.00 0.00 H new ATOM 461 N THR A 31 9.415 10.858 -2.085 1.00 0.00 N ATOM 462 CA THR A 31 10.823 10.840 -2.462 1.00 0.00 C ATOM 463 C THR A 31 11.543 12.084 -1.958 1.00 0.00 C ATOM 464 O THR A 31 12.762 12.079 -1.781 1.00 0.00 O ATOM 465 CB THR A 31 10.993 10.746 -3.990 1.00 0.00 C ATOM 466 OG1 THR A 31 10.490 11.933 -4.613 1.00 0.00 O ATOM 467 CG2 THR A 31 10.265 9.529 -4.542 1.00 0.00 C ATOM 0 H THR A 31 8.793 11.240 -2.797 1.00 0.00 H new ATOM 0 HA THR A 31 11.263 9.957 -1.999 1.00 0.00 H new ATOM 0 HB THR A 31 12.056 10.644 -4.210 1.00 0.00 H new ATOM 0 HG1 THR A 31 9.542 12.042 -4.391 1.00 0.00 H new ATOM 0 HG21 THR A 31 10.399 9.484 -5.623 1.00 0.00 H new ATOM 0 HG22 THR A 31 10.671 8.625 -4.088 1.00 0.00 H new ATOM 0 HG23 THR A 31 9.202 9.605 -4.311 1.00 0.00 H new ATOM 475 N TRP A 32 10.784 13.149 -1.726 1.00 0.00 N ATOM 476 CA TRP A 32 11.351 14.402 -1.241 1.00 0.00 C ATOM 477 C TRP A 32 12.216 14.165 -0.007 1.00 0.00 C ATOM 478 O TRP A 32 12.023 13.191 0.720 1.00 0.00 O ATOM 479 CB TRP A 32 10.237 15.398 -0.915 1.00 0.00 C ATOM 480 CG TRP A 32 9.709 16.114 -2.121 1.00 0.00 C ATOM 481 CD1 TRP A 32 9.559 15.602 -3.378 1.00 0.00 C ATOM 482 CD2 TRP A 32 9.264 17.473 -2.183 1.00 0.00 C ATOM 483 NE1 TRP A 32 9.047 16.561 -4.218 1.00 0.00 N ATOM 484 CE2 TRP A 32 8.857 17.718 -3.509 1.00 0.00 C ATOM 485 CE3 TRP A 32 9.169 18.507 -1.248 1.00 0.00 C ATOM 486 CZ2 TRP A 32 8.363 18.953 -3.921 1.00 0.00 C ATOM 487 CZ3 TRP A 32 8.679 19.733 -1.658 1.00 0.00 C ATOM 488 CH2 TRP A 32 8.281 19.947 -2.984 1.00 0.00 C ATOM 0 H TRP A 32 9.774 13.170 -1.866 1.00 0.00 H new ATOM 0 HA TRP A 32 11.980 14.817 -2.029 1.00 0.00 H new ATOM 0 HB2 TRP A 32 9.418 14.869 -0.428 1.00 0.00 H new ATOM 0 HB3 TRP A 32 10.612 16.131 -0.201 1.00 0.00 H new ATOM 0 HD1 TRP A 32 9.806 14.592 -3.669 1.00 0.00 H new ATOM 0 HE1 TRP A 32 8.842 16.433 -5.209 1.00 0.00 H new ATOM 0 HE3 TRP A 32 9.473 18.351 -0.223 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 8.056 19.120 -4.943 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 8.602 20.539 -0.944 1.00 0.00 H new ATOM 0 HH2 TRP A 32 7.902 20.916 -3.273 1.00 0.00 H new ATOM 499 N ASP A 33 13.169 15.062 0.222 1.00 0.00 N ATOM 500 CA ASP A 33 14.063 14.951 1.369 1.00 0.00 C ATOM 501 C ASP A 33 13.301 15.162 2.674 1.00 0.00 C ATOM 502 O ASP A 33 13.624 14.558 3.697 1.00 0.00 O ATOM 503 CB ASP A 33 15.199 15.969 1.258 1.00 0.00 C ATOM 504 CG ASP A 33 16.168 15.636 0.140 1.00 0.00 C ATOM 505 OD1 ASP A 33 16.458 14.437 -0.054 1.00 0.00 O ATOM 506 OD2 ASP A 33 16.636 16.573 -0.539 1.00 0.00 O ATOM 0 H ASP A 33 13.342 15.874 -0.371 1.00 0.00 H new ATOM 0 HA ASP A 33 14.485 13.946 1.373 1.00 0.00 H new ATOM 0 HB2 ASP A 33 14.779 16.960 1.088 1.00 0.00 H new ATOM 0 HB3 ASP A 33 15.740 16.010 2.203 1.00 0.00 H new ATOM 511 N SER A 34 12.289 16.022 2.631 1.00 0.00 N ATOM 512 CA SER A 34 11.484 16.316 3.810 1.00 0.00 C ATOM 513 C SER A 34 10.259 15.409 3.872 1.00 0.00 C ATOM 514 O SER A 34 9.204 15.806 4.365 1.00 0.00 O ATOM 515 CB SER A 34 11.047 17.783 3.804 1.00 0.00 C ATOM 516 OG SER A 34 12.022 18.608 4.418 1.00 0.00 O ATOM 0 H SER A 34 12.007 16.528 1.791 1.00 0.00 H new ATOM 0 HA SER A 34 12.097 16.131 4.692 1.00 0.00 H new ATOM 0 HB2 SER A 34 10.881 18.112 2.778 1.00 0.00 H new ATOM 0 HB3 SER A 34 10.097 17.885 4.329 1.00 0.00 H new ATOM 0 HG SER A 34 11.720 19.540 4.400 1.00 0.00 H new ATOM 522 N ALA A 35 10.408 14.189 3.366 1.00 0.00 N ATOM 523 CA ALA A 35 9.315 13.224 3.365 1.00 0.00 C ATOM 524 C ALA A 35 9.417 12.278 4.557 1.00 0.00 C ATOM 525 O ALA A 35 10.513 11.965 5.020 1.00 0.00 O ATOM 526 CB ALA A 35 9.308 12.437 2.063 1.00 0.00 C ATOM 0 H ALA A 35 11.275 13.846 2.952 1.00 0.00 H new ATOM 0 HA ALA A 35 8.377 13.773 3.450 1.00 0.00 H new ATOM 0 HB1 ALA A 35 8.487 11.720 2.076 1.00 0.00 H new ATOM 0 HB2 ALA A 35 9.179 13.122 1.225 1.00 0.00 H new ATOM 0 HB3 ALA A 35 10.253 11.905 1.955 1.00 0.00 H new ATOM 532 N GLN A 36 8.267 11.827 5.048 1.00 0.00 N ATOM 533 CA GLN A 36 8.228 10.918 6.187 1.00 0.00 C ATOM 534 C GLN A 36 7.128 9.876 6.014 1.00 0.00 C ATOM 535 O GLN A 36 6.198 10.064 5.230 1.00 0.00 O ATOM 536 CB GLN A 36 8.008 11.699 7.483 1.00 0.00 C ATOM 537 CG GLN A 36 9.066 12.761 7.740 1.00 0.00 C ATOM 538 CD GLN A 36 8.592 13.837 8.698 1.00 0.00 C ATOM 539 OE1 GLN A 36 7.538 14.442 8.497 1.00 0.00 O ATOM 540 NE2 GLN A 36 9.369 14.081 9.746 1.00 0.00 N ATOM 0 H GLN A 36 7.351 12.076 4.675 1.00 0.00 H new ATOM 0 HA GLN A 36 9.187 10.402 6.241 1.00 0.00 H new ATOM 0 HB2 GLN A 36 7.028 12.175 7.449 1.00 0.00 H new ATOM 0 HB3 GLN A 36 7.994 11.001 8.320 1.00 0.00 H new ATOM 0 HG2 GLN A 36 9.960 12.287 8.145 1.00 0.00 H new ATOM 0 HG3 GLN A 36 9.350 13.222 6.794 1.00 0.00 H new ATOM 0 HE21 GLN A 36 10.234 13.555 9.873 1.00 0.00 H new ATOM 0 HE22 GLN A 36 9.101 14.794 10.424 1.00 0.00 H new ATOM 549 N VAL A 37 7.240 8.776 6.752 1.00 0.00 N ATOM 550 CA VAL A 37 6.254 7.704 6.681 1.00 0.00 C ATOM 551 C VAL A 37 4.856 8.259 6.436 1.00 0.00 C ATOM 552 O VAL A 37 4.100 7.730 5.620 1.00 0.00 O ATOM 553 CB VAL A 37 6.243 6.866 7.974 1.00 0.00 C ATOM 554 CG1 VAL A 37 7.472 5.972 8.041 1.00 0.00 C ATOM 555 CG2 VAL A 37 6.163 7.770 9.194 1.00 0.00 C ATOM 0 H VAL A 37 8.004 8.604 7.406 1.00 0.00 H new ATOM 0 HA VAL A 37 6.539 7.065 5.845 1.00 0.00 H new ATOM 0 HB VAL A 37 5.359 6.228 7.966 1.00 0.00 H new ATOM 0 HG11 VAL A 37 7.447 5.388 8.961 1.00 0.00 H new ATOM 0 HG12 VAL A 37 7.480 5.299 7.184 1.00 0.00 H new ATOM 0 HG13 VAL A 37 8.371 6.588 8.027 1.00 0.00 H new ATOM 0 HG21 VAL A 37 6.156 7.161 10.098 1.00 0.00 H new ATOM 0 HG22 VAL A 37 7.026 8.435 9.211 1.00 0.00 H new ATOM 0 HG23 VAL A 37 5.249 8.362 9.149 1.00 0.00 H new ATOM 565 N PHE A 38 4.517 9.329 7.148 1.00 0.00 N ATOM 566 CA PHE A 38 3.208 9.956 7.008 1.00 0.00 C ATOM 567 C PHE A 38 2.885 10.221 5.541 1.00 0.00 C ATOM 568 O PHE A 38 1.879 9.741 5.019 1.00 0.00 O ATOM 569 CB PHE A 38 3.160 11.267 7.797 1.00 0.00 C ATOM 570 CG PHE A 38 1.790 11.609 8.310 1.00 0.00 C ATOM 571 CD1 PHE A 38 0.658 11.225 7.609 1.00 0.00 C ATOM 572 CD2 PHE A 38 1.635 12.312 9.493 1.00 0.00 C ATOM 573 CE1 PHE A 38 -0.603 11.539 8.078 1.00 0.00 C ATOM 574 CE2 PHE A 38 0.376 12.628 9.968 1.00 0.00 C ATOM 575 CZ PHE A 38 -0.745 12.241 9.260 1.00 0.00 C ATOM 0 H PHE A 38 5.130 9.780 7.827 1.00 0.00 H new ATOM 0 HA PHE A 38 2.461 9.271 7.408 1.00 0.00 H new ATOM 0 HB2 PHE A 38 3.848 11.200 8.640 1.00 0.00 H new ATOM 0 HB3 PHE A 38 3.514 12.078 7.160 1.00 0.00 H new ATOM 0 HD1 PHE A 38 0.763 10.674 6.686 1.00 0.00 H new ATOM 0 HD2 PHE A 38 2.508 12.617 10.051 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -1.477 11.236 7.521 1.00 0.00 H new ATOM 0 HE2 PHE A 38 0.269 13.177 10.892 1.00 0.00 H new ATOM 0 HZ PHE A 38 -1.730 12.486 9.629 1.00 0.00 H new ATOM 585 N ASP A 39 3.746 10.989 4.881 1.00 0.00 N ATOM 586 CA ASP A 39 3.554 11.317 3.473 1.00 0.00 C ATOM 587 C ASP A 39 3.043 10.108 2.697 1.00 0.00 C ATOM 588 O ASP A 39 1.989 10.165 2.062 1.00 0.00 O ATOM 589 CB ASP A 39 4.864 11.815 2.861 1.00 0.00 C ATOM 590 CG ASP A 39 5.234 13.207 3.336 1.00 0.00 C ATOM 591 OD1 ASP A 39 5.828 13.322 4.428 1.00 0.00 O ATOM 592 OD2 ASP A 39 4.928 14.180 2.616 1.00 0.00 O ATOM 0 H ASP A 39 4.583 11.396 5.298 1.00 0.00 H new ATOM 0 HA ASP A 39 2.807 12.108 3.409 1.00 0.00 H new ATOM 0 HB2 ASP A 39 5.666 11.123 3.115 1.00 0.00 H new ATOM 0 HB3 ASP A 39 4.776 11.817 1.775 1.00 0.00 H new ATOM 597 N LEU A 40 3.795 9.015 2.752 1.00 0.00 N ATOM 598 CA LEU A 40 3.419 7.791 2.054 1.00 0.00 C ATOM 599 C LEU A 40 2.161 7.180 2.664 1.00 0.00 C ATOM 600 O LEU A 40 1.371 6.541 1.971 1.00 0.00 O ATOM 601 CB LEU A 40 4.566 6.779 2.102 1.00 0.00 C ATOM 602 CG LEU A 40 4.240 5.371 1.602 1.00 0.00 C ATOM 603 CD1 LEU A 40 3.853 5.404 0.131 1.00 0.00 C ATOM 604 CD2 LEU A 40 5.423 4.440 1.823 1.00 0.00 C ATOM 0 H LEU A 40 4.669 8.951 3.273 1.00 0.00 H new ATOM 0 HA LEU A 40 3.210 8.045 1.015 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.394 7.170 1.511 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.916 6.705 3.132 1.00 0.00 H new ATOM 0 HG LEU A 40 3.392 4.990 2.172 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.624 4.394 -0.208 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.976 6.038 -0.000 1.00 0.00 H new ATOM 0 HD13 LEU A 40 4.681 5.804 -0.454 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.173 3.442 1.461 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.289 4.817 1.279 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.655 4.393 2.887 1.00 0.00 H new ATOM 616 N ALA A 41 1.983 7.384 3.965 1.00 0.00 N ATOM 617 CA ALA A 41 0.819 6.857 4.668 1.00 0.00 C ATOM 618 C ALA A 41 -0.448 7.605 4.269 1.00 0.00 C ATOM 619 O ALA A 41 -1.551 7.065 4.355 1.00 0.00 O ATOM 620 CB ALA A 41 1.031 6.938 6.172 1.00 0.00 C ATOM 0 H ALA A 41 2.629 7.910 4.553 1.00 0.00 H new ATOM 0 HA ALA A 41 0.696 5.812 4.385 1.00 0.00 H new ATOM 0 HB1 ALA A 41 0.155 6.541 6.685 1.00 0.00 H new ATOM 0 HB2 ALA A 41 1.908 6.353 6.448 1.00 0.00 H new ATOM 0 HB3 ALA A 41 1.182 7.978 6.463 1.00 0.00 H new ATOM 626 N GLN A 42 -0.283 8.850 3.833 1.00 0.00 N ATOM 627 CA GLN A 42 -1.415 9.671 3.422 1.00 0.00 C ATOM 628 C GLN A 42 -1.908 9.266 2.037 1.00 0.00 C ATOM 629 O GLN A 42 -3.038 8.803 1.879 1.00 0.00 O ATOM 630 CB GLN A 42 -1.026 11.151 3.425 1.00 0.00 C ATOM 631 CG GLN A 42 -0.537 11.649 4.775 1.00 0.00 C ATOM 632 CD GLN A 42 -0.836 13.118 4.999 1.00 0.00 C ATOM 633 OE1 GLN A 42 -1.854 13.634 4.536 1.00 0.00 O ATOM 634 NE2 GLN A 42 0.053 13.801 5.711 1.00 0.00 N ATOM 0 H GLN A 42 0.623 9.312 3.755 1.00 0.00 H new ATOM 0 HA GLN A 42 -2.224 9.513 4.136 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -0.245 11.314 2.682 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -1.887 11.745 3.118 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -1.005 11.062 5.566 1.00 0.00 H new ATOM 0 HG3 GLN A 42 0.538 11.485 4.851 1.00 0.00 H new ATOM 0 HE21 GLN A 42 0.883 13.333 6.075 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -0.094 14.794 5.893 1.00 0.00 H new ATOM 643 N THR A 43 -1.053 9.442 1.034 1.00 0.00 N ATOM 644 CA THR A 43 -1.402 9.096 -0.338 1.00 0.00 C ATOM 645 C THR A 43 -2.135 7.761 -0.399 1.00 0.00 C ATOM 646 O THR A 43 -2.876 7.491 -1.345 1.00 0.00 O ATOM 647 CB THR A 43 -0.151 9.024 -1.234 1.00 0.00 C ATOM 648 OG1 THR A 43 -0.511 9.268 -2.598 1.00 0.00 O ATOM 649 CG2 THR A 43 0.520 7.664 -1.117 1.00 0.00 C ATOM 0 H THR A 43 -0.113 9.822 1.147 1.00 0.00 H new ATOM 0 HA THR A 43 -2.059 9.884 -0.706 1.00 0.00 H new ATOM 0 HB THR A 43 0.552 9.788 -0.902 1.00 0.00 H new ATOM 0 HG1 THR A 43 0.290 9.222 -3.161 1.00 0.00 H new ATOM 0 HG21 THR A 43 1.401 7.636 -1.758 1.00 0.00 H new ATOM 0 HG22 THR A 43 0.819 7.493 -0.083 1.00 0.00 H new ATOM 0 HG23 THR A 43 -0.178 6.886 -1.426 1.00 0.00 H new ATOM 657 N LEU A 44 -1.925 6.930 0.615 1.00 0.00 N ATOM 658 CA LEU A 44 -2.567 5.621 0.678 1.00 0.00 C ATOM 659 C LEU A 44 -3.739 5.636 1.654 1.00 0.00 C ATOM 660 O LEU A 44 -4.721 4.916 1.471 1.00 0.00 O ATOM 661 CB LEU A 44 -1.554 4.553 1.094 1.00 0.00 C ATOM 662 CG LEU A 44 -0.264 4.496 0.276 1.00 0.00 C ATOM 663 CD1 LEU A 44 0.752 3.582 0.944 1.00 0.00 C ATOM 664 CD2 LEU A 44 -0.553 4.028 -1.143 1.00 0.00 C ATOM 0 H LEU A 44 -1.315 7.139 1.405 1.00 0.00 H new ATOM 0 HA LEU A 44 -2.948 5.383 -0.315 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -1.291 4.718 2.139 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -2.040 3.579 1.038 1.00 0.00 H new ATOM 0 HG LEU A 44 0.158 5.500 0.228 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.664 3.554 0.347 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.982 3.960 1.940 1.00 0.00 H new ATOM 0 HD13 LEU A 44 0.340 2.576 1.024 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.377 3.993 -1.711 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.998 3.033 -1.115 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -1.245 4.722 -1.621 1.00 0.00 H new ATOM 676 N ARG A 45 -3.629 6.461 2.690 1.00 0.00 N ATOM 677 CA ARG A 45 -4.680 6.570 3.694 1.00 0.00 C ATOM 678 C ARG A 45 -6.060 6.534 3.044 1.00 0.00 C ATOM 679 O ARG A 45 -6.987 5.916 3.567 1.00 0.00 O ATOM 680 CB ARG A 45 -4.516 7.863 4.496 1.00 0.00 C ATOM 681 CG ARG A 45 -5.591 8.065 5.552 1.00 0.00 C ATOM 682 CD ARG A 45 -5.836 9.541 5.822 1.00 0.00 C ATOM 683 NE ARG A 45 -7.187 9.789 6.319 1.00 0.00 N ATOM 684 CZ ARG A 45 -7.642 10.995 6.640 1.00 0.00 C ATOM 685 NH1 ARG A 45 -6.858 12.057 6.517 1.00 0.00 N ATOM 686 NH2 ARG A 45 -8.884 11.140 7.086 1.00 0.00 N ATOM 0 H ARG A 45 -2.823 7.063 2.856 1.00 0.00 H new ATOM 0 HA ARG A 45 -4.593 5.718 4.368 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -3.539 7.859 4.980 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -4.528 8.710 3.810 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -6.518 7.595 5.223 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -5.293 7.570 6.476 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -5.110 9.902 6.550 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -5.677 10.109 4.905 1.00 0.00 H new ATOM 0 HE ARG A 45 -7.815 8.993 6.425 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -5.903 11.949 6.175 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -7.210 12.982 6.764 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -9.490 10.325 7.182 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -9.233 12.066 7.332 1.00 0.00 H new ATOM 700 N ASP A 46 -6.187 7.199 1.901 1.00 0.00 N ATOM 701 CA ASP A 46 -7.453 7.243 1.179 1.00 0.00 C ATOM 702 C ASP A 46 -7.926 5.836 0.825 1.00 0.00 C ATOM 703 O ASP A 46 -9.074 5.474 1.079 1.00 0.00 O ATOM 704 CB ASP A 46 -7.311 8.081 -0.093 1.00 0.00 C ATOM 705 CG ASP A 46 -6.304 7.494 -1.063 1.00 0.00 C ATOM 706 OD1 ASP A 46 -5.309 6.902 -0.598 1.00 0.00 O ATOM 707 OD2 ASP A 46 -6.513 7.628 -2.287 1.00 0.00 O ATOM 0 H ASP A 46 -5.429 7.715 1.455 1.00 0.00 H new ATOM 0 HA ASP A 46 -8.197 7.705 1.828 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -8.281 8.159 -0.584 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -7.007 9.093 0.174 1.00 0.00 H new ATOM 712 N GLY A 47 -7.032 5.047 0.237 1.00 0.00 N ATOM 713 CA GLY A 47 -7.377 3.690 -0.143 1.00 0.00 C ATOM 714 C GLY A 47 -7.743 3.573 -1.610 1.00 0.00 C ATOM 715 O GLY A 47 -8.520 2.700 -1.996 1.00 0.00 O ATOM 0 H GLY A 47 -6.075 5.324 0.017 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.536 3.031 0.072 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.214 3.347 0.465 1.00 0.00 H new ATOM 719 N VAL A 48 -7.183 4.457 -2.430 1.00 0.00 N ATOM 720 CA VAL A 48 -7.455 4.450 -3.862 1.00 0.00 C ATOM 721 C VAL A 48 -6.275 3.882 -4.643 1.00 0.00 C ATOM 722 O VAL A 48 -6.455 3.153 -5.619 1.00 0.00 O ATOM 723 CB VAL A 48 -7.766 5.866 -4.381 1.00 0.00 C ATOM 724 CG1 VAL A 48 -8.020 5.842 -5.881 1.00 0.00 C ATOM 725 CG2 VAL A 48 -8.956 6.455 -3.640 1.00 0.00 C ATOM 0 H VAL A 48 -6.538 5.187 -2.127 1.00 0.00 H new ATOM 0 HA VAL A 48 -8.328 3.815 -4.015 1.00 0.00 H new ATOM 0 HB VAL A 48 -6.900 6.501 -4.194 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -8.238 6.852 -6.229 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -7.135 5.464 -6.394 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.869 5.193 -6.096 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -9.162 7.456 -4.019 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -9.830 5.822 -3.794 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -8.731 6.510 -2.575 1.00 0.00 H new ATOM 735 N LEU A 49 -5.066 4.221 -4.207 1.00 0.00 N ATOM 736 CA LEU A 49 -3.855 3.744 -4.865 1.00 0.00 C ATOM 737 C LEU A 49 -3.607 2.272 -4.550 1.00 0.00 C ATOM 738 O LEU A 49 -3.392 1.461 -5.452 1.00 0.00 O ATOM 739 CB LEU A 49 -2.651 4.580 -4.427 1.00 0.00 C ATOM 740 CG LEU A 49 -1.320 4.245 -5.101 1.00 0.00 C ATOM 741 CD1 LEU A 49 -1.402 4.496 -6.599 1.00 0.00 C ATOM 742 CD2 LEU A 49 -0.190 5.055 -4.484 1.00 0.00 C ATOM 0 H LEU A 49 -4.899 4.824 -3.401 1.00 0.00 H new ATOM 0 HA LEU A 49 -3.991 3.848 -5.941 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -2.876 5.630 -4.614 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.528 4.467 -3.350 1.00 0.00 H new ATOM 0 HG LEU A 49 -1.111 3.187 -4.941 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.446 4.252 -7.062 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -2.184 3.871 -7.030 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.635 5.545 -6.780 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.749 4.803 -4.976 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.393 6.118 -4.612 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.116 4.825 -3.421 1.00 0.00 H new ATOM 754 N LEU A 50 -3.641 1.933 -3.267 1.00 0.00 N ATOM 755 CA LEU A 50 -3.423 0.557 -2.832 1.00 0.00 C ATOM 756 C LEU A 50 -4.033 -0.429 -3.823 1.00 0.00 C ATOM 757 O LEU A 50 -3.351 -1.324 -4.323 1.00 0.00 O ATOM 758 CB LEU A 50 -4.023 0.339 -1.442 1.00 0.00 C ATOM 759 CG LEU A 50 -3.114 0.672 -0.259 1.00 0.00 C ATOM 760 CD1 LEU A 50 -3.905 0.671 1.039 1.00 0.00 C ATOM 761 CD2 LEU A 50 -1.957 -0.315 -0.182 1.00 0.00 C ATOM 0 H LEU A 50 -3.817 2.592 -2.508 1.00 0.00 H new ATOM 0 HA LEU A 50 -2.348 0.381 -2.787 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.928 0.942 -1.360 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.326 -0.705 -1.359 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.705 1.671 -0.410 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.241 0.910 1.870 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.698 1.416 0.982 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.344 -0.314 1.197 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -1.320 -0.063 0.666 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.348 -1.325 -0.055 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.374 -0.265 -1.102 1.00 0.00 H new ATOM 773 N CYS A 51 -5.321 -0.259 -4.103 1.00 0.00 N ATOM 774 CA CYS A 51 -6.023 -1.134 -5.035 1.00 0.00 C ATOM 775 C CYS A 51 -5.309 -1.178 -6.382 1.00 0.00 C ATOM 776 O CYS A 51 -5.171 -2.240 -6.986 1.00 0.00 O ATOM 777 CB CYS A 51 -7.465 -0.660 -5.223 1.00 0.00 C ATOM 778 SG CYS A 51 -8.559 -1.057 -3.839 1.00 0.00 S ATOM 0 H CYS A 51 -5.900 0.477 -3.698 1.00 0.00 H new ATOM 0 HA CYS A 51 -6.031 -2.140 -4.616 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -7.465 0.420 -5.374 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -7.868 -1.108 -6.131 1.00 0.00 H new ATOM 0 HG CYS A 51 -9.042 0.041 -3.339 1.00 0.00 H new ATOM 784 N GLN A 52 -4.861 -0.016 -6.846 1.00 0.00 N ATOM 785 CA GLN A 52 -4.163 0.078 -8.123 1.00 0.00 C ATOM 786 C GLN A 52 -2.947 -0.842 -8.148 1.00 0.00 C ATOM 787 O GLN A 52 -2.735 -1.582 -9.109 1.00 0.00 O ATOM 788 CB GLN A 52 -3.732 1.521 -8.388 1.00 0.00 C ATOM 789 CG GLN A 52 -4.889 2.506 -8.417 1.00 0.00 C ATOM 790 CD GLN A 52 -4.615 3.703 -9.307 1.00 0.00 C ATOM 791 OE1 GLN A 52 -3.541 4.300 -9.250 1.00 0.00 O ATOM 792 NE2 GLN A 52 -5.589 4.059 -10.137 1.00 0.00 N ATOM 0 H GLN A 52 -4.969 0.873 -6.357 1.00 0.00 H new ATOM 0 HA GLN A 52 -4.850 -0.238 -8.908 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -3.024 1.827 -7.618 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -3.205 1.565 -9.341 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -5.787 1.996 -8.767 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -5.093 2.851 -7.403 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -6.464 3.535 -10.151 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -5.462 4.856 -10.760 1.00 0.00 H new ATOM 801 N LEU A 53 -2.150 -0.789 -7.086 1.00 0.00 N ATOM 802 CA LEU A 53 -0.954 -1.617 -6.986 1.00 0.00 C ATOM 803 C LEU A 53 -1.198 -3.001 -7.580 1.00 0.00 C ATOM 804 O LEU A 53 -0.521 -3.412 -8.523 1.00 0.00 O ATOM 805 CB LEU A 53 -0.520 -1.746 -5.525 1.00 0.00 C ATOM 806 CG LEU A 53 0.682 -2.654 -5.259 1.00 0.00 C ATOM 807 CD1 LEU A 53 1.923 -2.115 -5.953 1.00 0.00 C ATOM 808 CD2 LEU A 53 0.923 -2.795 -3.763 1.00 0.00 C ATOM 0 H LEU A 53 -2.311 -0.181 -6.283 1.00 0.00 H new ATOM 0 HA LEU A 53 -0.159 -1.133 -7.554 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -0.289 -0.750 -5.146 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.366 -2.118 -4.947 1.00 0.00 H new ATOM 0 HG LEU A 53 0.464 -3.641 -5.666 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.767 -2.774 -5.752 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.747 -2.068 -7.028 1.00 0.00 H new ATOM 0 HD13 LEU A 53 2.145 -1.116 -5.577 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.782 -3.444 -3.592 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.119 -1.813 -3.332 1.00 0.00 H new ATOM 0 HD23 LEU A 53 0.041 -3.229 -3.292 1.00 0.00 H new ATOM 820 N LEU A 54 -2.170 -3.715 -7.023 1.00 0.00 N ATOM 821 CA LEU A 54 -2.505 -5.053 -7.499 1.00 0.00 C ATOM 822 C LEU A 54 -2.891 -5.025 -8.974 1.00 0.00 C ATOM 823 O LEU A 54 -2.415 -5.837 -9.766 1.00 0.00 O ATOM 824 CB LEU A 54 -3.652 -5.637 -6.671 1.00 0.00 C ATOM 825 CG LEU A 54 -3.403 -5.751 -5.167 1.00 0.00 C ATOM 826 CD1 LEU A 54 -4.594 -6.396 -4.476 1.00 0.00 C ATOM 827 CD2 LEU A 54 -2.133 -6.544 -4.895 1.00 0.00 C ATOM 0 H LEU A 54 -2.740 -3.390 -6.242 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.624 -5.684 -7.385 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.537 -5.020 -6.827 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.884 -6.630 -7.057 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.274 -4.747 -4.763 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.398 -6.469 -3.406 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.484 -5.788 -4.642 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.755 -7.394 -4.884 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -1.972 -6.615 -3.819 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.233 -7.545 -5.314 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.284 -6.040 -5.357 1.00 0.00 H new ATOM 839 N ASN A 55 -3.756 -4.083 -9.337 1.00 0.00 N ATOM 840 CA ASN A 55 -4.205 -3.948 -10.718 1.00 0.00 C ATOM 841 C ASN A 55 -3.016 -3.810 -11.665 1.00 0.00 C ATOM 842 O ASN A 55 -3.102 -4.167 -12.839 1.00 0.00 O ATOM 843 CB ASN A 55 -5.127 -2.736 -10.860 1.00 0.00 C ATOM 844 CG ASN A 55 -6.364 -2.845 -9.989 1.00 0.00 C ATOM 845 OD1 ASN A 55 -6.653 -3.904 -9.432 1.00 0.00 O ATOM 846 ND2 ASN A 55 -7.102 -1.747 -9.869 1.00 0.00 N ATOM 0 H ASN A 55 -4.160 -3.402 -8.694 1.00 0.00 H new ATOM 0 HA ASN A 55 -4.757 -4.849 -10.984 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -4.578 -1.832 -10.595 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -5.428 -2.632 -11.902 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -7.946 -1.760 -9.297 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -6.824 -0.891 -10.349 1.00 0.00 H new ATOM 853 N ASN A 56 -1.909 -3.292 -11.144 1.00 0.00 N ATOM 854 CA ASN A 56 -0.703 -3.107 -11.943 1.00 0.00 C ATOM 855 C ASN A 56 0.045 -4.426 -12.111 1.00 0.00 C ATOM 856 O ASN A 56 0.467 -4.778 -13.214 1.00 0.00 O ATOM 857 CB ASN A 56 0.212 -2.069 -11.291 1.00 0.00 C ATOM 858 CG ASN A 56 -0.078 -0.660 -11.772 1.00 0.00 C ATOM 859 OD1 ASN A 56 -0.233 -0.420 -12.970 1.00 0.00 O ATOM 860 ND2 ASN A 56 -0.152 0.281 -10.837 1.00 0.00 N ATOM 0 H ASN A 56 -1.822 -2.993 -10.173 1.00 0.00 H new ATOM 0 HA ASN A 56 -1.001 -2.750 -12.929 1.00 0.00 H new ATOM 0 HB2 ASN A 56 0.093 -2.112 -10.208 1.00 0.00 H new ATOM 0 HB3 ASN A 56 1.251 -2.317 -11.507 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -0.344 1.248 -11.100 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -0.017 0.037 -9.856 1.00 0.00 H new ATOM 867 N LEU A 57 0.206 -5.153 -11.011 1.00 0.00 N ATOM 868 CA LEU A 57 0.903 -6.435 -11.036 1.00 0.00 C ATOM 869 C LEU A 57 0.098 -7.478 -11.804 1.00 0.00 C ATOM 870 O LEU A 57 0.596 -8.088 -12.750 1.00 0.00 O ATOM 871 CB LEU A 57 1.163 -6.923 -9.610 1.00 0.00 C ATOM 872 CG LEU A 57 1.751 -5.894 -8.644 1.00 0.00 C ATOM 873 CD1 LEU A 57 1.896 -6.489 -7.252 1.00 0.00 C ATOM 874 CD2 LEU A 57 3.095 -5.392 -9.153 1.00 0.00 C ATOM 0 H LEU A 57 -0.136 -4.877 -10.091 1.00 0.00 H new ATOM 0 HA LEU A 57 1.856 -6.293 -11.545 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.223 -7.286 -9.195 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.840 -7.776 -9.657 1.00 0.00 H new ATOM 0 HG LEU A 57 1.067 -5.047 -8.585 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.316 -5.742 -6.579 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.918 -6.799 -6.885 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.559 -7.354 -7.293 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.499 -4.660 -8.453 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.787 -6.230 -9.241 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.963 -4.926 -10.129 1.00 0.00 H new ATOM 886 N ARG A 58 -1.150 -7.676 -11.392 1.00 0.00 N ATOM 887 CA ARG A 58 -2.025 -8.644 -12.042 1.00 0.00 C ATOM 888 C ARG A 58 -3.207 -7.947 -12.710 1.00 0.00 C ATOM 889 O ARG A 58 -3.555 -6.820 -12.357 1.00 0.00 O ATOM 890 CB ARG A 58 -2.531 -9.669 -11.026 1.00 0.00 C ATOM 891 CG ARG A 58 -2.811 -11.036 -11.627 1.00 0.00 C ATOM 892 CD ARG A 58 -3.915 -11.761 -10.874 1.00 0.00 C ATOM 893 NE ARG A 58 -4.231 -13.053 -11.476 1.00 0.00 N ATOM 894 CZ ARG A 58 -5.376 -13.698 -11.275 1.00 0.00 C ATOM 895 NH1 ARG A 58 -6.308 -13.172 -10.492 1.00 0.00 N ATOM 896 NH2 ARG A 58 -5.590 -14.870 -11.858 1.00 0.00 N ATOM 0 H ARG A 58 -1.578 -7.179 -10.611 1.00 0.00 H new ATOM 0 HA ARG A 58 -1.448 -9.159 -12.810 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -1.792 -9.775 -10.231 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -3.443 -9.291 -10.565 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -3.096 -10.923 -12.673 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -1.901 -11.636 -11.608 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -3.610 -11.909 -9.838 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -4.811 -11.140 -10.858 1.00 0.00 H new ATOM 0 HE ARG A 58 -3.535 -13.484 -12.084 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -6.147 -12.271 -10.042 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -7.186 -13.669 -10.339 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -4.876 -15.277 -12.461 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -6.469 -15.364 -11.703 1.00 0.00 H new ATOM 910 N ALA A 59 -3.818 -8.624 -13.675 1.00 0.00 N ATOM 911 CA ALA A 59 -4.961 -8.071 -14.391 1.00 0.00 C ATOM 912 C ALA A 59 -6.274 -8.514 -13.754 1.00 0.00 C ATOM 913 O ALA A 59 -6.367 -9.607 -13.196 1.00 0.00 O ATOM 914 CB ALA A 59 -4.917 -8.483 -15.855 1.00 0.00 C ATOM 0 H ALA A 59 -3.541 -9.557 -13.980 1.00 0.00 H new ATOM 0 HA ALA A 59 -4.906 -6.984 -14.329 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -5.777 -8.063 -16.377 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -3.999 -8.112 -16.310 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -4.944 -9.570 -15.928 1.00 0.00 H new ATOM 920 N HIS A 60 -7.287 -7.658 -13.842 1.00 0.00 N ATOM 921 CA HIS A 60 -8.596 -7.961 -13.273 1.00 0.00 C ATOM 922 C HIS A 60 -8.490 -8.224 -11.774 1.00 0.00 C ATOM 923 O HIS A 60 -9.216 -9.053 -11.227 1.00 0.00 O ATOM 924 CB HIS A 60 -9.210 -9.174 -13.973 1.00 0.00 C ATOM 925 CG HIS A 60 -9.945 -8.830 -15.232 1.00 0.00 C ATOM 926 ND1 HIS A 60 -11.211 -9.298 -15.516 1.00 0.00 N ATOM 927 CD2 HIS A 60 -9.586 -8.058 -16.284 1.00 0.00 C ATOM 928 CE1 HIS A 60 -11.598 -8.829 -16.689 1.00 0.00 C ATOM 929 NE2 HIS A 60 -10.630 -8.074 -17.176 1.00 0.00 N ATOM 0 H HIS A 60 -7.227 -6.749 -14.302 1.00 0.00 H new ATOM 0 HA HIS A 60 -9.241 -7.096 -13.427 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -8.419 -9.887 -14.207 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -9.895 -9.671 -13.286 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -8.652 -7.528 -16.400 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -12.545 -9.029 -17.168 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -10.654 -7.583 -18.070 1.00 0.00 H new ATOM 938 N SER A 61 -7.579 -7.514 -11.117 1.00 0.00 N ATOM 939 CA SER A 61 -7.374 -7.674 -9.682 1.00 0.00 C ATOM 940 C SER A 61 -8.423 -6.896 -8.893 1.00 0.00 C ATOM 941 O SER A 61 -8.988 -7.402 -7.924 1.00 0.00 O ATOM 942 CB SER A 61 -5.972 -7.203 -9.290 1.00 0.00 C ATOM 943 OG SER A 61 -4.998 -7.694 -10.194 1.00 0.00 O ATOM 0 H SER A 61 -6.971 -6.822 -11.555 1.00 0.00 H new ATOM 0 HA SER A 61 -7.475 -8.732 -9.442 1.00 0.00 H new ATOM 0 HB2 SER A 61 -5.942 -6.114 -9.275 1.00 0.00 H new ATOM 0 HB3 SER A 61 -5.740 -7.543 -8.281 1.00 0.00 H new ATOM 0 HG SER A 61 -4.787 -7.002 -10.856 1.00 0.00 H new ATOM 949 N ILE A 62 -8.678 -5.662 -9.317 1.00 0.00 N ATOM 950 CA ILE A 62 -9.659 -4.814 -8.652 1.00 0.00 C ATOM 951 C ILE A 62 -10.341 -3.879 -9.645 1.00 0.00 C ATOM 952 O ILE A 62 -9.678 -3.158 -10.389 1.00 0.00 O ATOM 953 CB ILE A 62 -9.013 -3.975 -7.535 1.00 0.00 C ATOM 954 CG1 ILE A 62 -8.302 -4.884 -6.530 1.00 0.00 C ATOM 955 CG2 ILE A 62 -10.063 -3.124 -6.836 1.00 0.00 C ATOM 956 CD1 ILE A 62 -7.567 -4.128 -5.446 1.00 0.00 C ATOM 0 H ILE A 62 -8.219 -5.228 -10.118 1.00 0.00 H new ATOM 0 HA ILE A 62 -10.403 -5.478 -8.212 1.00 0.00 H new ATOM 0 HB ILE A 62 -8.274 -3.311 -7.982 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -9.036 -5.544 -6.068 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -7.594 -5.518 -7.064 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -9.590 -2.537 -6.049 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -10.528 -2.454 -7.559 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -10.824 -3.771 -6.399 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -7.087 -4.836 -4.770 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -6.810 -3.488 -5.898 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -8.274 -3.515 -4.887 1.00 0.00 H new ATOM 968 N ASN A 63 -11.670 -3.896 -9.650 1.00 0.00 N ATOM 969 CA ASN A 63 -12.442 -3.049 -10.551 1.00 0.00 C ATOM 970 C ASN A 63 -12.492 -1.613 -10.038 1.00 0.00 C ATOM 971 O ASN A 63 -13.199 -1.310 -9.075 1.00 0.00 O ATOM 972 CB ASN A 63 -13.862 -3.596 -10.708 1.00 0.00 C ATOM 973 CG ASN A 63 -14.716 -2.736 -11.620 1.00 0.00 C ATOM 974 OD1 ASN A 63 -14.203 -1.889 -12.352 1.00 0.00 O ATOM 975 ND2 ASN A 63 -16.025 -2.951 -11.580 1.00 0.00 N ATOM 0 H ASN A 63 -12.234 -4.487 -9.040 1.00 0.00 H new ATOM 0 HA ASN A 63 -11.949 -3.052 -11.523 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -13.816 -4.609 -11.107 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -14.334 -3.661 -9.728 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -16.650 -2.403 -12.172 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -16.406 -3.664 -10.958 1.00 0.00 H new ATOM 982 N LEU A 64 -11.739 -0.732 -10.687 1.00 0.00 N ATOM 983 CA LEU A 64 -11.697 0.673 -10.297 1.00 0.00 C ATOM 984 C LEU A 64 -13.099 1.199 -10.006 1.00 0.00 C ATOM 985 O LEU A 64 -13.288 2.043 -9.130 1.00 0.00 O ATOM 986 CB LEU A 64 -11.045 1.510 -11.399 1.00 0.00 C ATOM 987 CG LEU A 64 -9.601 1.149 -11.751 1.00 0.00 C ATOM 988 CD1 LEU A 64 -9.155 1.889 -13.002 1.00 0.00 C ATOM 989 CD2 LEU A 64 -8.675 1.462 -10.585 1.00 0.00 C ATOM 0 H LEU A 64 -11.149 -0.966 -11.486 1.00 0.00 H new ATOM 0 HA LEU A 64 -11.102 0.754 -9.388 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.651 1.422 -12.301 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -11.073 2.557 -11.097 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.552 0.079 -11.951 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -8.125 1.619 -13.237 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.801 1.615 -13.836 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -9.219 2.964 -12.831 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -7.652 1.199 -10.852 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -8.728 2.526 -10.354 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -8.981 0.886 -9.712 1.00 0.00 H new ATOM 1001 N LYS A 65 -14.081 0.693 -10.745 1.00 0.00 N ATOM 1002 CA LYS A 65 -15.467 1.108 -10.565 1.00 0.00 C ATOM 1003 C LYS A 65 -15.978 0.714 -9.183 1.00 0.00 C ATOM 1004 O LYS A 65 -16.709 1.469 -8.544 1.00 0.00 O ATOM 1005 CB LYS A 65 -16.352 0.483 -11.645 1.00 0.00 C ATOM 1006 CG LYS A 65 -15.938 0.850 -13.059 1.00 0.00 C ATOM 1007 CD LYS A 65 -16.232 2.309 -13.365 1.00 0.00 C ATOM 1008 CE LYS A 65 -16.021 2.624 -14.839 1.00 0.00 C ATOM 1009 NZ LYS A 65 -16.021 4.090 -15.099 1.00 0.00 N ATOM 0 H LYS A 65 -13.942 -0.006 -11.475 1.00 0.00 H new ATOM 0 HA LYS A 65 -15.509 2.194 -10.652 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -16.329 -0.602 -11.539 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -17.383 0.797 -11.484 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -14.873 0.657 -13.189 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -16.466 0.215 -13.770 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -17.260 2.540 -13.086 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -15.587 2.946 -12.760 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -15.074 2.197 -15.170 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -16.807 2.151 -15.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -15.875 4.263 -16.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -16.934 4.494 -14.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -15.255 4.539 -14.558 1.00 0.00 H new ATOM 1023 N GLU A 66 -15.586 -0.472 -8.728 1.00 0.00 N ATOM 1024 CA GLU A 66 -16.005 -0.965 -7.421 1.00 0.00 C ATOM 1025 C GLU A 66 -15.508 -0.046 -6.309 1.00 0.00 C ATOM 1026 O GLU A 66 -16.142 0.075 -5.260 1.00 0.00 O ATOM 1027 CB GLU A 66 -15.483 -2.385 -7.196 1.00 0.00 C ATOM 1028 CG GLU A 66 -16.153 -3.427 -8.076 1.00 0.00 C ATOM 1029 CD GLU A 66 -17.567 -3.745 -7.631 1.00 0.00 C ATOM 1030 OE1 GLU A 66 -18.384 -2.805 -7.539 1.00 0.00 O ATOM 1031 OE2 GLU A 66 -17.857 -4.932 -7.374 1.00 0.00 O ATOM 0 H GLU A 66 -14.979 -1.109 -9.245 1.00 0.00 H new ATOM 0 HA GLU A 66 -17.095 -0.979 -7.398 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -14.409 -2.402 -7.381 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -15.630 -2.656 -6.150 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -16.172 -3.070 -9.106 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.559 -4.341 -8.067 1.00 0.00 H new ATOM 1038 N ILE A 67 -14.371 0.599 -6.546 1.00 0.00 N ATOM 1039 CA ILE A 67 -13.789 1.507 -5.565 1.00 0.00 C ATOM 1040 C ILE A 67 -14.091 2.960 -5.915 1.00 0.00 C ATOM 1041 O ILE A 67 -14.055 3.348 -7.081 1.00 0.00 O ATOM 1042 CB ILE A 67 -12.264 1.321 -5.461 1.00 0.00 C ATOM 1043 CG1 ILE A 67 -11.625 1.381 -6.850 1.00 0.00 C ATOM 1044 CG2 ILE A 67 -11.937 0.002 -4.777 1.00 0.00 C ATOM 1045 CD1 ILE A 67 -10.113 1.348 -6.821 1.00 0.00 C ATOM 0 H ILE A 67 -13.834 0.510 -7.409 1.00 0.00 H new ATOM 0 HA ILE A 67 -14.242 1.266 -4.603 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.854 2.131 -4.858 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -11.987 0.542 -7.444 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -11.951 2.292 -7.352 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -10.855 -0.115 -4.711 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -12.365 -0.004 -3.774 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -12.356 -0.821 -5.355 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -9.728 1.394 -7.840 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -9.741 2.202 -6.254 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -9.778 0.425 -6.348 1.00 0.00 H new ATOM 1057 N ASN A 68 -14.386 3.760 -4.895 1.00 0.00 N ATOM 1058 CA ASN A 68 -14.692 5.172 -5.094 1.00 0.00 C ATOM 1059 C ASN A 68 -13.420 5.972 -5.356 1.00 0.00 C ATOM 1060 O ASN A 68 -12.635 6.228 -4.442 1.00 0.00 O ATOM 1061 CB ASN A 68 -15.420 5.734 -3.872 1.00 0.00 C ATOM 1062 CG ASN A 68 -16.685 4.964 -3.546 1.00 0.00 C ATOM 1063 OD1 ASN A 68 -17.674 5.036 -4.275 1.00 0.00 O ATOM 1064 ND2 ASN A 68 -16.657 4.220 -2.446 1.00 0.00 N ATOM 0 H ASN A 68 -14.420 3.454 -3.922 1.00 0.00 H new ATOM 0 HA ASN A 68 -15.340 5.259 -5.966 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -14.751 5.709 -3.011 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -15.671 6.780 -4.051 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -17.478 3.678 -2.176 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -15.815 4.191 -1.872 1.00 0.00 H new ATOM 1071 N LEU A 69 -13.223 6.367 -6.609 1.00 0.00 N ATOM 1072 CA LEU A 69 -12.047 7.140 -6.992 1.00 0.00 C ATOM 1073 C LEU A 69 -12.218 8.610 -6.624 1.00 0.00 C ATOM 1074 O LEU A 69 -13.270 9.202 -6.866 1.00 0.00 O ATOM 1075 CB LEU A 69 -11.790 7.005 -8.494 1.00 0.00 C ATOM 1076 CG LEU A 69 -11.254 5.652 -8.965 1.00 0.00 C ATOM 1077 CD1 LEU A 69 -11.634 5.403 -10.416 1.00 0.00 C ATOM 1078 CD2 LEU A 69 -9.744 5.587 -8.788 1.00 0.00 C ATOM 0 H LEU A 69 -13.863 6.165 -7.377 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.190 6.745 -6.446 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -12.722 7.207 -9.021 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -11.081 7.778 -8.792 1.00 0.00 H new ATOM 0 HG LEU A 69 -11.706 4.870 -8.354 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.244 4.436 -10.733 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -12.720 5.406 -10.514 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.211 6.188 -11.043 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.379 4.618 -9.128 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -9.275 6.377 -9.374 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.495 5.719 -7.735 1.00 0.00 H new ATOM 1090 N ARG A 70 -11.176 9.193 -6.040 1.00 0.00 N ATOM 1091 CA ARG A 70 -11.211 10.595 -5.640 1.00 0.00 C ATOM 1092 C ARG A 70 -12.182 10.806 -4.482 1.00 0.00 C ATOM 1093 O ARG A 70 -13.097 11.627 -4.548 1.00 0.00 O ATOM 1094 CB ARG A 70 -11.613 11.476 -6.824 1.00 0.00 C ATOM 1095 CG ARG A 70 -11.200 12.930 -6.669 1.00 0.00 C ATOM 1096 CD ARG A 70 -11.528 13.738 -7.915 1.00 0.00 C ATOM 1097 NE ARG A 70 -10.892 13.186 -9.108 1.00 0.00 N ATOM 1098 CZ ARG A 70 -11.421 12.211 -9.839 1.00 0.00 C ATOM 1099 NH1 ARG A 70 -12.589 11.683 -9.499 1.00 0.00 N ATOM 1100 NH2 ARG A 70 -10.781 11.762 -10.911 1.00 0.00 N ATOM 0 H ARG A 70 -10.298 8.717 -5.833 1.00 0.00 H new ATOM 0 HA ARG A 70 -10.211 10.877 -5.309 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -11.165 11.075 -7.733 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -12.694 11.426 -6.953 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -11.709 13.364 -5.808 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -10.130 12.986 -6.469 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -12.608 13.761 -8.058 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -11.203 14.769 -7.775 1.00 0.00 H new ATOM 0 HE ARG A 70 -9.992 13.570 -9.396 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -13.083 12.025 -8.675 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -12.993 10.934 -10.062 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -9.882 12.165 -11.174 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -11.188 11.013 -11.472 1.00 0.00 H new ATOM 1114 N PRO A 71 -11.981 10.047 -3.394 1.00 0.00 N ATOM 1115 CA PRO A 71 -12.828 10.132 -2.201 1.00 0.00 C ATOM 1116 C PRO A 71 -12.633 11.441 -1.444 1.00 0.00 C ATOM 1117 O PRO A 71 -13.327 11.710 -0.464 1.00 0.00 O ATOM 1118 CB PRO A 71 -12.363 8.948 -1.350 1.00 0.00 C ATOM 1119 CG PRO A 71 -10.960 8.698 -1.784 1.00 0.00 C ATOM 1120 CD PRO A 71 -10.910 9.047 -3.246 1.00 0.00 C ATOM 0 HA PRO A 71 -13.888 10.104 -2.452 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -12.413 9.181 -0.286 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -12.990 8.072 -1.514 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -10.260 9.308 -1.213 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -10.681 7.657 -1.622 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -9.939 9.453 -3.529 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -11.086 8.174 -3.874 1.00 0.00 H new ATOM 1128 N GLN A 72 -11.686 12.251 -1.906 1.00 0.00 N ATOM 1129 CA GLN A 72 -11.401 13.532 -1.271 1.00 0.00 C ATOM 1130 C GLN A 72 -11.308 13.381 0.244 1.00 0.00 C ATOM 1131 O GLN A 72 -11.786 14.232 0.993 1.00 0.00 O ATOM 1132 CB GLN A 72 -12.482 14.554 -1.628 1.00 0.00 C ATOM 1133 CG GLN A 72 -12.551 14.873 -3.113 1.00 0.00 C ATOM 1134 CD GLN A 72 -13.577 15.942 -3.433 1.00 0.00 C ATOM 1135 OE1 GLN A 72 -14.783 15.697 -3.379 1.00 0.00 O ATOM 1136 NE2 GLN A 72 -13.103 17.136 -3.769 1.00 0.00 N ATOM 0 H GLN A 72 -11.104 12.043 -2.717 1.00 0.00 H new ATOM 0 HA GLN A 72 -10.439 13.886 -1.642 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -13.450 14.175 -1.301 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -12.296 15.475 -1.075 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -11.570 15.202 -3.456 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -12.794 13.965 -3.665 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -12.096 17.294 -3.801 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -13.746 17.895 -3.995 1.00 0.00 H new ATOM 1145 N MET A 73 -10.691 12.290 0.687 1.00 0.00 N ATOM 1146 CA MET A 73 -10.535 12.028 2.113 1.00 0.00 C ATOM 1147 C MET A 73 -11.894 11.850 2.785 1.00 0.00 C ATOM 1148 O MET A 73 -12.146 12.407 3.853 1.00 0.00 O ATOM 1149 CB MET A 73 -9.768 13.170 2.783 1.00 0.00 C ATOM 1150 CG MET A 73 -8.348 13.332 2.268 1.00 0.00 C ATOM 1151 SD MET A 73 -7.155 12.350 3.198 1.00 0.00 S ATOM 1152 CE MET A 73 -7.572 10.698 2.647 1.00 0.00 C ATOM 0 H MET A 73 -10.292 11.574 0.080 1.00 0.00 H new ATOM 0 HA MET A 73 -9.969 11.104 2.227 1.00 0.00 H new ATOM 0 HB2 MET A 73 -10.311 14.102 2.627 1.00 0.00 H new ATOM 0 HB3 MET A 73 -9.738 12.995 3.858 1.00 0.00 H new ATOM 0 HG2 MET A 73 -8.311 13.042 1.218 1.00 0.00 H new ATOM 0 HG3 MET A 73 -8.065 14.383 2.318 1.00 0.00 H new ATOM 0 HE1 MET A 73 -6.689 10.062 2.703 1.00 0.00 H new ATOM 0 HE2 MET A 73 -8.355 10.289 3.285 1.00 0.00 H new ATOM 0 HE3 MET A 73 -7.926 10.737 1.617 1.00 0.00 H new ATOM 1162 N SER A 74 -12.764 11.070 2.152 1.00 0.00 N ATOM 1163 CA SER A 74 -14.098 10.821 2.686 1.00 0.00 C ATOM 1164 C SER A 74 -14.110 9.567 3.555 1.00 0.00 C ATOM 1165 O SER A 74 -14.157 8.448 3.046 1.00 0.00 O ATOM 1166 CB SER A 74 -15.108 10.676 1.546 1.00 0.00 C ATOM 1167 OG SER A 74 -15.601 11.940 1.138 1.00 0.00 O ATOM 0 H SER A 74 -12.569 10.599 1.268 1.00 0.00 H new ATOM 0 HA SER A 74 -14.380 11.673 3.305 1.00 0.00 H new ATOM 0 HB2 SER A 74 -14.637 10.176 0.700 1.00 0.00 H new ATOM 0 HB3 SER A 74 -15.937 10.046 1.868 1.00 0.00 H new ATOM 0 HG SER A 74 -15.001 12.323 0.464 1.00 0.00 H new ATOM 1173 N GLN A 75 -14.068 9.765 4.869 1.00 0.00 N ATOM 1174 CA GLN A 75 -14.074 8.650 5.809 1.00 0.00 C ATOM 1175 C GLN A 75 -14.928 7.501 5.285 1.00 0.00 C ATOM 1176 O GLN A 75 -14.450 6.376 5.135 1.00 0.00 O ATOM 1177 CB GLN A 75 -14.594 9.109 7.172 1.00 0.00 C ATOM 1178 CG GLN A 75 -14.710 7.984 8.188 1.00 0.00 C ATOM 1179 CD GLN A 75 -15.491 8.390 9.422 1.00 0.00 C ATOM 1180 OE1 GLN A 75 -16.246 9.363 9.401 1.00 0.00 O ATOM 1181 NE2 GLN A 75 -15.314 7.646 10.507 1.00 0.00 N ATOM 0 H GLN A 75 -14.030 10.686 5.306 1.00 0.00 H new ATOM 0 HA GLN A 75 -13.050 8.294 5.920 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -13.928 9.876 7.566 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -15.572 9.572 7.042 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -15.195 7.127 7.721 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -13.711 7.663 8.484 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -14.679 6.848 10.480 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -15.813 7.872 11.367 1.00 0.00 H new ATOM 1190 N PHE A 76 -16.196 7.791 5.009 1.00 0.00 N ATOM 1191 CA PHE A 76 -17.118 6.781 4.503 1.00 0.00 C ATOM 1192 C PHE A 76 -16.505 6.024 3.328 1.00 0.00 C ATOM 1193 O PHE A 76 -16.405 4.796 3.350 1.00 0.00 O ATOM 1194 CB PHE A 76 -18.435 7.431 4.074 1.00 0.00 C ATOM 1195 CG PHE A 76 -19.626 6.528 4.222 1.00 0.00 C ATOM 1196 CD1 PHE A 76 -19.924 5.947 5.444 1.00 0.00 C ATOM 1197 CD2 PHE A 76 -20.447 6.260 3.139 1.00 0.00 C ATOM 1198 CE1 PHE A 76 -21.018 5.115 5.582 1.00 0.00 C ATOM 1199 CE2 PHE A 76 -21.544 5.429 3.271 1.00 0.00 C ATOM 1200 CZ PHE A 76 -21.830 4.857 4.495 1.00 0.00 C ATOM 0 H PHE A 76 -16.608 8.717 5.127 1.00 0.00 H new ATOM 0 HA PHE A 76 -17.316 6.071 5.306 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -18.596 8.332 4.666 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -18.354 7.744 3.033 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -19.294 6.147 6.298 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -20.228 6.706 2.180 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -21.238 4.666 6.539 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -22.176 5.228 2.419 1.00 0.00 H new ATOM 0 HZ PHE A 76 -22.687 4.209 4.602 1.00 0.00 H new ATOM 1210 N LEU A 77 -16.097 6.765 2.304 1.00 0.00 N ATOM 1211 CA LEU A 77 -15.494 6.165 1.118 1.00 0.00 C ATOM 1212 C LEU A 77 -14.144 5.537 1.452 1.00 0.00 C ATOM 1213 O LEU A 77 -13.979 4.319 1.375 1.00 0.00 O ATOM 1214 CB LEU A 77 -15.322 7.217 0.022 1.00 0.00 C ATOM 1215 CG LEU A 77 -16.565 8.040 -0.320 1.00 0.00 C ATOM 1216 CD1 LEU A 77 -16.264 9.022 -1.441 1.00 0.00 C ATOM 1217 CD2 LEU A 77 -17.720 7.126 -0.705 1.00 0.00 C ATOM 0 H LEU A 77 -16.172 7.782 2.270 1.00 0.00 H new ATOM 0 HA LEU A 77 -16.160 5.381 0.759 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -14.530 7.902 0.325 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -14.982 6.716 -0.884 1.00 0.00 H new ATOM 0 HG LEU A 77 -16.856 8.608 0.564 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -17.160 9.598 -1.670 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -15.468 9.698 -1.129 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -15.948 8.475 -2.329 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -18.596 7.728 -0.945 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -17.439 6.531 -1.574 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -17.953 6.463 0.128 1.00 0.00 H new ATOM 1229 N CYS A 78 -13.184 6.375 1.826 1.00 0.00 N ATOM 1230 CA CYS A 78 -11.849 5.902 2.173 1.00 0.00 C ATOM 1231 C CYS A 78 -11.915 4.540 2.857 1.00 0.00 C ATOM 1232 O CYS A 78 -11.308 3.573 2.397 1.00 0.00 O ATOM 1233 CB CYS A 78 -11.150 6.911 3.086 1.00 0.00 C ATOM 1234 SG CYS A 78 -10.954 8.554 2.358 1.00 0.00 S ATOM 0 H CYS A 78 -13.305 7.385 1.897 1.00 0.00 H new ATOM 0 HA CYS A 78 -11.276 5.798 1.252 1.00 0.00 H new ATOM 0 HB2 CYS A 78 -11.718 7.001 4.012 1.00 0.00 H new ATOM 0 HB3 CYS A 78 -10.166 6.524 3.352 1.00 0.00 H new ATOM 0 HG CYS A 78 -10.242 8.466 1.274 1.00 0.00 H new ATOM 1240 N LEU A 79 -12.655 4.472 3.958 1.00 0.00 N ATOM 1241 CA LEU A 79 -12.800 3.229 4.707 1.00 0.00 C ATOM 1242 C LEU A 79 -13.202 2.082 3.785 1.00 0.00 C ATOM 1243 O LEU A 79 -12.518 1.061 3.712 1.00 0.00 O ATOM 1244 CB LEU A 79 -13.841 3.396 5.815 1.00 0.00 C ATOM 1245 CG LEU A 79 -13.313 3.884 7.165 1.00 0.00 C ATOM 1246 CD1 LEU A 79 -14.463 4.158 8.121 1.00 0.00 C ATOM 1247 CD2 LEU A 79 -12.353 2.865 7.761 1.00 0.00 C ATOM 0 H LEU A 79 -13.164 5.263 4.352 1.00 0.00 H new ATOM 0 HA LEU A 79 -11.836 2.990 5.156 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -14.600 4.097 5.470 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -14.338 2.438 5.967 1.00 0.00 H new ATOM 0 HG LEU A 79 -12.770 4.816 7.006 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -14.068 4.504 9.076 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -15.113 4.924 7.698 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -15.034 3.242 8.275 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -11.987 3.228 8.721 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -12.872 1.917 7.905 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -11.512 2.718 7.084 1.00 0.00 H new ATOM 1259 N LYS A 80 -14.315 2.258 3.081 1.00 0.00 N ATOM 1260 CA LYS A 80 -14.807 1.240 2.160 1.00 0.00 C ATOM 1261 C LYS A 80 -13.727 0.844 1.158 1.00 0.00 C ATOM 1262 O LYS A 80 -13.389 -0.331 1.027 1.00 0.00 O ATOM 1263 CB LYS A 80 -16.044 1.749 1.418 1.00 0.00 C ATOM 1264 CG LYS A 80 -16.969 0.641 0.945 1.00 0.00 C ATOM 1265 CD LYS A 80 -16.468 0.007 -0.341 1.00 0.00 C ATOM 1266 CE LYS A 80 -16.864 0.828 -1.559 1.00 0.00 C ATOM 1267 NZ LYS A 80 -15.876 0.693 -2.664 1.00 0.00 N ATOM 0 H LYS A 80 -14.894 3.096 3.131 1.00 0.00 H new ATOM 0 HA LYS A 80 -15.077 0.359 2.743 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -16.600 2.420 2.073 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -15.725 2.336 0.557 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -17.051 -0.121 1.720 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -17.970 1.044 0.787 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -15.383 -0.088 -0.302 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -16.873 -1.001 -0.433 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -17.846 0.509 -1.909 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -16.952 1.877 -1.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -15.268 1.536 -2.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -15.290 -0.151 -2.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -16.379 0.600 -3.570 1.00 0.00 H new ATOM 1281 N ASN A 81 -13.188 1.835 0.455 1.00 0.00 N ATOM 1282 CA ASN A 81 -12.145 1.589 -0.535 1.00 0.00 C ATOM 1283 C ASN A 81 -11.047 0.700 0.040 1.00 0.00 C ATOM 1284 O ASN A 81 -10.860 -0.435 -0.399 1.00 0.00 O ATOM 1285 CB ASN A 81 -11.546 2.913 -1.014 1.00 0.00 C ATOM 1286 CG ASN A 81 -12.578 3.813 -1.665 1.00 0.00 C ATOM 1287 OD1 ASN A 81 -13.778 3.547 -1.602 1.00 0.00 O ATOM 1288 ND2 ASN A 81 -12.114 4.887 -2.295 1.00 0.00 N ATOM 0 H ASN A 81 -13.456 2.814 0.552 1.00 0.00 H new ATOM 0 HA ASN A 81 -12.597 1.074 -1.383 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -11.097 3.433 -0.168 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -10.745 2.710 -1.725 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -12.761 5.530 -2.751 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -11.111 5.069 -2.322 1.00 0.00 H new ATOM 1295 N ILE A 82 -10.325 1.223 1.026 1.00 0.00 N ATOM 1296 CA ILE A 82 -9.247 0.476 1.662 1.00 0.00 C ATOM 1297 C ILE A 82 -9.576 -1.011 1.732 1.00 0.00 C ATOM 1298 O ILE A 82 -8.783 -1.853 1.310 1.00 0.00 O ATOM 1299 CB ILE A 82 -8.966 0.996 3.084 1.00 0.00 C ATOM 1300 CG1 ILE A 82 -8.503 2.453 3.037 1.00 0.00 C ATOM 1301 CG2 ILE A 82 -7.923 0.125 3.770 1.00 0.00 C ATOM 1302 CD1 ILE A 82 -8.542 3.144 4.382 1.00 0.00 C ATOM 0 H ILE A 82 -10.467 2.161 1.401 1.00 0.00 H new ATOM 0 HA ILE A 82 -8.358 0.620 1.049 1.00 0.00 H new ATOM 0 HB ILE A 82 -9.889 0.947 3.661 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -7.485 2.490 2.648 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -9.132 3.003 2.337 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -7.735 0.505 4.774 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -8.289 -0.900 3.833 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.997 0.145 3.195 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -8.200 4.173 4.272 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -9.563 3.139 4.764 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -7.891 2.618 5.080 1.00 0.00 H new ATOM 1314 N ARG A 83 -10.751 -1.327 2.265 1.00 0.00 N ATOM 1315 CA ARG A 83 -11.186 -2.714 2.390 1.00 0.00 C ATOM 1316 C ARG A 83 -11.088 -3.436 1.049 1.00 0.00 C ATOM 1317 O ARG A 83 -10.464 -4.493 0.945 1.00 0.00 O ATOM 1318 CB ARG A 83 -12.623 -2.775 2.910 1.00 0.00 C ATOM 1319 CG ARG A 83 -12.722 -2.773 4.427 1.00 0.00 C ATOM 1320 CD ARG A 83 -14.035 -2.167 4.899 1.00 0.00 C ATOM 1321 NE ARG A 83 -14.267 -2.404 6.321 1.00 0.00 N ATOM 1322 CZ ARG A 83 -15.418 -2.144 6.931 1.00 0.00 C ATOM 1323 NH1 ARG A 83 -16.437 -1.642 6.246 1.00 0.00 N ATOM 1324 NH2 ARG A 83 -15.553 -2.387 8.228 1.00 0.00 N ATOM 0 H ARG A 83 -11.419 -0.642 2.617 1.00 0.00 H new ATOM 0 HA ARG A 83 -10.528 -3.213 3.102 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -13.179 -1.924 2.517 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -13.102 -3.675 2.524 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -12.636 -3.794 4.800 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -11.888 -2.210 4.846 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -14.029 -1.094 4.707 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -14.858 -2.590 4.322 1.00 0.00 H new ATOM 0 HE ARG A 83 -13.504 -2.790 6.876 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -16.338 -1.455 5.248 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -17.320 -1.443 6.717 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -14.772 -2.774 8.758 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -16.437 -2.187 8.695 1.00 0.00 H new ATOM 1338 N THR A 84 -11.709 -2.860 0.025 1.00 0.00 N ATOM 1339 CA THR A 84 -11.693 -3.449 -1.308 1.00 0.00 C ATOM 1340 C THR A 84 -10.322 -4.027 -1.638 1.00 0.00 C ATOM 1341 O THR A 84 -10.215 -5.118 -2.200 1.00 0.00 O ATOM 1342 CB THR A 84 -12.073 -2.414 -2.384 1.00 0.00 C ATOM 1343 OG1 THR A 84 -13.364 -1.864 -2.100 1.00 0.00 O ATOM 1344 CG2 THR A 84 -12.080 -3.049 -3.767 1.00 0.00 C ATOM 0 H THR A 84 -12.230 -1.986 0.093 1.00 0.00 H new ATOM 0 HA THR A 84 -12.432 -4.251 -1.308 1.00 0.00 H new ATOM 0 HB THR A 84 -11.328 -1.618 -2.370 1.00 0.00 H new ATOM 0 HG1 THR A 84 -13.276 -1.148 -1.437 1.00 0.00 H new ATOM 0 HG21 THR A 84 -12.351 -2.299 -4.510 1.00 0.00 H new ATOM 0 HG22 THR A 84 -11.088 -3.441 -3.992 1.00 0.00 H new ATOM 0 HG23 THR A 84 -12.806 -3.862 -3.790 1.00 0.00 H new ATOM 1352 N PHE A 85 -9.273 -3.291 -1.284 1.00 0.00 N ATOM 1353 CA PHE A 85 -7.907 -3.731 -1.542 1.00 0.00 C ATOM 1354 C PHE A 85 -7.588 -5.001 -0.758 1.00 0.00 C ATOM 1355 O PHE A 85 -7.391 -6.069 -1.338 1.00 0.00 O ATOM 1356 CB PHE A 85 -6.915 -2.627 -1.174 1.00 0.00 C ATOM 1357 CG PHE A 85 -5.505 -3.118 -1.010 1.00 0.00 C ATOM 1358 CD1 PHE A 85 -4.733 -3.430 -2.117 1.00 0.00 C ATOM 1359 CD2 PHE A 85 -4.952 -3.268 0.252 1.00 0.00 C ATOM 1360 CE1 PHE A 85 -3.436 -3.883 -1.969 1.00 0.00 C ATOM 1361 CE2 PHE A 85 -3.655 -3.720 0.406 1.00 0.00 C ATOM 1362 CZ PHE A 85 -2.895 -4.027 -0.706 1.00 0.00 C ATOM 0 H PHE A 85 -9.343 -2.387 -0.817 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.817 -3.950 -2.606 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -6.936 -1.858 -1.947 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.237 -2.155 -0.246 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -5.150 -3.318 -3.107 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -5.541 -3.029 1.125 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -2.845 -4.124 -2.840 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -3.236 -3.833 1.395 1.00 0.00 H new ATOM 0 HZ PHE A 85 -1.881 -4.379 -0.588 1.00 0.00 H new ATOM 1372 N LEU A 86 -7.537 -4.875 0.563 1.00 0.00 N ATOM 1373 CA LEU A 86 -7.240 -6.012 1.428 1.00 0.00 C ATOM 1374 C LEU A 86 -7.992 -7.257 0.969 1.00 0.00 C ATOM 1375 O LEU A 86 -7.533 -8.382 1.169 1.00 0.00 O ATOM 1376 CB LEU A 86 -7.609 -5.685 2.877 1.00 0.00 C ATOM 1377 CG LEU A 86 -6.979 -4.420 3.461 1.00 0.00 C ATOM 1378 CD1 LEU A 86 -7.883 -3.815 4.523 1.00 0.00 C ATOM 1379 CD2 LEU A 86 -5.605 -4.727 4.039 1.00 0.00 C ATOM 0 H LEU A 86 -7.697 -3.998 1.059 1.00 0.00 H new ATOM 0 HA LEU A 86 -6.170 -6.213 1.368 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -8.693 -5.590 2.942 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -7.325 -6.531 3.503 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.859 -3.693 2.658 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -7.418 -2.916 4.927 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -8.845 -3.558 4.079 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.035 -4.537 5.325 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -5.171 -3.815 4.450 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.701 -5.472 4.829 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -4.957 -5.114 3.252 1.00 0.00 H new ATOM 1391 N THR A 87 -9.149 -7.048 0.349 1.00 0.00 N ATOM 1392 CA THR A 87 -9.964 -8.153 -0.141 1.00 0.00 C ATOM 1393 C THR A 87 -9.246 -8.918 -1.247 1.00 0.00 C ATOM 1394 O THR A 87 -9.043 -10.127 -1.147 1.00 0.00 O ATOM 1395 CB THR A 87 -11.321 -7.657 -0.673 1.00 0.00 C ATOM 1396 OG1 THR A 87 -11.935 -6.787 0.284 1.00 0.00 O ATOM 1397 CG2 THR A 87 -12.247 -8.827 -0.969 1.00 0.00 C ATOM 0 H THR A 87 -9.543 -6.124 0.174 1.00 0.00 H new ATOM 0 HA THR A 87 -10.135 -8.819 0.705 1.00 0.00 H new ATOM 0 HB THR A 87 -11.144 -7.110 -1.599 1.00 0.00 H new ATOM 0 HG1 THR A 87 -11.432 -5.947 0.333 1.00 0.00 H new ATOM 0 HG21 THR A 87 -13.199 -8.452 -1.344 1.00 0.00 H new ATOM 0 HG22 THR A 87 -11.790 -9.471 -1.720 1.00 0.00 H new ATOM 0 HG23 THR A 87 -12.416 -9.397 -0.056 1.00 0.00 H new ATOM 1405 N ALA A 88 -8.863 -8.205 -2.301 1.00 0.00 N ATOM 1406 CA ALA A 88 -8.165 -8.816 -3.424 1.00 0.00 C ATOM 1407 C ALA A 88 -6.932 -9.582 -2.954 1.00 0.00 C ATOM 1408 O ALA A 88 -6.612 -10.647 -3.484 1.00 0.00 O ATOM 1409 CB ALA A 88 -7.773 -7.756 -4.443 1.00 0.00 C ATOM 0 H ALA A 88 -9.025 -7.203 -2.400 1.00 0.00 H new ATOM 0 HA ALA A 88 -8.843 -9.526 -3.897 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -7.252 -8.227 -5.276 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -8.669 -7.256 -4.811 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.117 -7.024 -3.972 1.00 0.00 H new ATOM 1415 N CYS A 89 -6.245 -9.033 -1.959 1.00 0.00 N ATOM 1416 CA CYS A 89 -5.046 -9.664 -1.418 1.00 0.00 C ATOM 1417 C CYS A 89 -5.301 -11.134 -1.102 1.00 0.00 C ATOM 1418 O CYS A 89 -4.383 -11.954 -1.134 1.00 0.00 O ATOM 1419 CB CYS A 89 -4.583 -8.931 -0.158 1.00 0.00 C ATOM 1420 SG CYS A 89 -4.126 -7.204 -0.434 1.00 0.00 S ATOM 0 H CYS A 89 -6.497 -8.152 -1.510 1.00 0.00 H new ATOM 0 HA CYS A 89 -4.262 -9.604 -2.173 1.00 0.00 H new ATOM 0 HB2 CYS A 89 -5.379 -8.971 0.585 1.00 0.00 H new ATOM 0 HB3 CYS A 89 -3.727 -9.459 0.263 1.00 0.00 H new ATOM 0 HG CYS A 89 -5.181 -6.525 -0.772 1.00 0.00 H new ATOM 1426 N CYS A 90 -6.552 -11.459 -0.795 1.00 0.00 N ATOM 1427 CA CYS A 90 -6.927 -12.831 -0.470 1.00 0.00 C ATOM 1428 C CYS A 90 -7.699 -13.470 -1.619 1.00 0.00 C ATOM 1429 O CYS A 90 -7.716 -14.692 -1.763 1.00 0.00 O ATOM 1430 CB CYS A 90 -7.770 -12.862 0.806 1.00 0.00 C ATOM 1431 SG CYS A 90 -7.972 -14.512 1.518 1.00 0.00 S ATOM 0 H CYS A 90 -7.323 -10.792 -0.764 1.00 0.00 H new ATOM 0 HA CYS A 90 -6.013 -13.403 -0.308 1.00 0.00 H new ATOM 0 HB2 CYS A 90 -7.309 -12.211 1.549 1.00 0.00 H new ATOM 0 HB3 CYS A 90 -8.755 -12.449 0.588 1.00 0.00 H new ATOM 0 HG CYS A 90 -8.697 -14.434 2.594 1.00 0.00 H new ATOM 1437 N GLU A 91 -8.337 -12.635 -2.434 1.00 0.00 N ATOM 1438 CA GLU A 91 -9.113 -13.121 -3.569 1.00 0.00 C ATOM 1439 C GLU A 91 -8.248 -13.201 -4.824 1.00 0.00 C ATOM 1440 O GLU A 91 -8.085 -14.270 -5.413 1.00 0.00 O ATOM 1441 CB GLU A 91 -10.314 -12.208 -3.822 1.00 0.00 C ATOM 1442 CG GLU A 91 -11.294 -12.155 -2.661 1.00 0.00 C ATOM 1443 CD GLU A 91 -12.367 -13.222 -2.755 1.00 0.00 C ATOM 1444 OE1 GLU A 91 -12.010 -14.418 -2.813 1.00 0.00 O ATOM 1445 OE2 GLU A 91 -13.562 -12.863 -2.771 1.00 0.00 O ATOM 0 H GLU A 91 -8.332 -11.620 -2.329 1.00 0.00 H new ATOM 0 HA GLU A 91 -9.471 -14.122 -3.330 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -9.956 -11.200 -4.030 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -10.839 -12.551 -4.714 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -10.749 -12.274 -1.725 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -11.765 -11.173 -2.633 1.00 0.00 H new ATOM 1452 N THR A 92 -7.696 -12.061 -5.229 1.00 0.00 N ATOM 1453 CA THR A 92 -6.850 -12.001 -6.415 1.00 0.00 C ATOM 1454 C THR A 92 -5.588 -12.836 -6.233 1.00 0.00 C ATOM 1455 O THR A 92 -5.287 -13.709 -7.047 1.00 0.00 O ATOM 1456 CB THR A 92 -6.449 -10.551 -6.745 1.00 0.00 C ATOM 1457 OG1 THR A 92 -7.620 -9.748 -6.927 1.00 0.00 O ATOM 1458 CG2 THR A 92 -5.592 -10.499 -8.001 1.00 0.00 C ATOM 0 H THR A 92 -7.820 -11.167 -4.753 1.00 0.00 H new ATOM 0 HA THR A 92 -7.434 -12.406 -7.241 1.00 0.00 H new ATOM 0 HB THR A 92 -5.867 -10.160 -5.911 1.00 0.00 H new ATOM 0 HG1 THR A 92 -8.069 -10.008 -7.758 1.00 0.00 H new ATOM 0 HG21 THR A 92 -5.321 -9.465 -8.214 1.00 0.00 H new ATOM 0 HG22 THR A 92 -4.687 -11.087 -7.849 1.00 0.00 H new ATOM 0 HG23 THR A 92 -6.153 -10.908 -8.841 1.00 0.00 H new ATOM 1466 N PHE A 93 -4.854 -12.564 -5.159 1.00 0.00 N ATOM 1467 CA PHE A 93 -3.623 -13.291 -4.870 1.00 0.00 C ATOM 1468 C PHE A 93 -3.897 -14.483 -3.957 1.00 0.00 C ATOM 1469 O PHE A 93 -3.717 -15.634 -4.350 1.00 0.00 O ATOM 1470 CB PHE A 93 -2.597 -12.361 -4.220 1.00 0.00 C ATOM 1471 CG PHE A 93 -2.086 -11.293 -5.144 1.00 0.00 C ATOM 1472 CD1 PHE A 93 -2.890 -10.220 -5.495 1.00 0.00 C ATOM 1473 CD2 PHE A 93 -0.803 -11.361 -5.661 1.00 0.00 C ATOM 1474 CE1 PHE A 93 -2.423 -9.235 -6.345 1.00 0.00 C ATOM 1475 CE2 PHE A 93 -0.330 -10.379 -6.511 1.00 0.00 C ATOM 1476 CZ PHE A 93 -1.141 -9.315 -6.854 1.00 0.00 C ATOM 0 H PHE A 93 -5.090 -11.846 -4.474 1.00 0.00 H new ATOM 0 HA PHE A 93 -3.220 -13.663 -5.812 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.048 -11.890 -3.347 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -1.755 -12.955 -3.863 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -3.893 -10.153 -5.100 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -0.165 -12.191 -5.397 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -3.059 -8.404 -6.611 1.00 0.00 H new ATOM 0 HE2 PHE A 93 0.673 -10.444 -6.907 1.00 0.00 H new ATOM 0 HZ PHE A 93 -0.774 -8.547 -7.519 1.00 0.00 H new ATOM 1486 N GLY A 94 -4.333 -14.196 -2.734 1.00 0.00 N ATOM 1487 CA GLY A 94 -4.625 -15.253 -1.783 1.00 0.00 C ATOM 1488 C GLY A 94 -3.592 -15.337 -0.676 1.00 0.00 C ATOM 1489 O GLY A 94 -2.947 -16.370 -0.498 1.00 0.00 O ATOM 0 H GLY A 94 -4.489 -13.250 -2.385 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -5.609 -15.083 -1.346 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -4.670 -16.208 -2.307 1.00 0.00 H new ATOM 1493 N MET A 95 -3.435 -14.248 0.068 1.00 0.00 N ATOM 1494 CA MET A 95 -2.473 -14.203 1.163 1.00 0.00 C ATOM 1495 C MET A 95 -3.163 -14.438 2.503 1.00 0.00 C ATOM 1496 O MET A 95 -4.388 -14.546 2.571 1.00 0.00 O ATOM 1497 CB MET A 95 -1.747 -12.857 1.179 1.00 0.00 C ATOM 1498 CG MET A 95 -0.607 -12.769 0.178 1.00 0.00 C ATOM 1499 SD MET A 95 0.463 -11.347 0.466 1.00 0.00 S ATOM 1500 CE MET A 95 -0.741 -10.022 0.514 1.00 0.00 C ATOM 0 H MET A 95 -3.961 -13.385 -0.067 1.00 0.00 H new ATOM 0 HA MET A 95 -1.744 -14.998 1.005 1.00 0.00 H new ATOM 0 HB2 MET A 95 -2.465 -12.064 0.970 1.00 0.00 H new ATOM 0 HB3 MET A 95 -1.355 -12.677 2.180 1.00 0.00 H new ATOM 0 HG2 MET A 95 -0.013 -13.682 0.229 1.00 0.00 H new ATOM 0 HG3 MET A 95 -1.018 -12.711 -0.830 1.00 0.00 H new ATOM 0 HE1 MET A 95 -0.229 -9.070 0.650 1.00 0.00 H new ATOM 0 HE2 MET A 95 -1.299 -10.003 -0.422 1.00 0.00 H new ATOM 0 HE3 MET A 95 -1.429 -10.185 1.343 1.00 0.00 H new ATOM 1510 N ARG A 96 -2.370 -14.516 3.567 1.00 0.00 N ATOM 1511 CA ARG A 96 -2.906 -14.739 4.904 1.00 0.00 C ATOM 1512 C ARG A 96 -3.502 -13.455 5.473 1.00 0.00 C ATOM 1513 O ARG A 96 -2.776 -12.542 5.868 1.00 0.00 O ATOM 1514 CB ARG A 96 -1.809 -15.260 5.835 1.00 0.00 C ATOM 1515 CG ARG A 96 -1.516 -16.741 5.661 1.00 0.00 C ATOM 1516 CD ARG A 96 -2.657 -17.601 6.182 1.00 0.00 C ATOM 1517 NE ARG A 96 -2.452 -17.999 7.572 1.00 0.00 N ATOM 1518 CZ ARG A 96 -3.006 -19.076 8.117 1.00 0.00 C ATOM 1519 NH1 ARG A 96 -3.793 -19.860 7.393 1.00 0.00 N ATOM 1520 NH2 ARG A 96 -2.772 -19.373 9.389 1.00 0.00 N ATOM 0 H ARG A 96 -1.355 -14.428 3.529 1.00 0.00 H new ATOM 0 HA ARG A 96 -3.697 -15.485 4.831 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -0.895 -14.694 5.658 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -2.103 -15.075 6.868 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -1.348 -16.958 4.606 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -0.597 -16.995 6.189 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -3.594 -17.050 6.097 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -2.753 -18.491 5.560 1.00 0.00 H new ATOM 0 HE ARG A 96 -1.851 -17.418 8.156 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -3.974 -19.637 6.414 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -4.217 -20.686 7.815 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -2.166 -18.774 9.949 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -3.198 -20.200 9.806 1.00 0.00 H new ATOM 1534 N LYS A 97 -4.829 -13.390 5.510 1.00 0.00 N ATOM 1535 CA LYS A 97 -5.524 -12.219 6.030 1.00 0.00 C ATOM 1536 C LYS A 97 -4.916 -11.769 7.355 1.00 0.00 C ATOM 1537 O LYS A 97 -4.867 -10.576 7.652 1.00 0.00 O ATOM 1538 CB LYS A 97 -7.012 -12.525 6.217 1.00 0.00 C ATOM 1539 CG LYS A 97 -7.910 -11.314 6.031 1.00 0.00 C ATOM 1540 CD LYS A 97 -7.994 -10.483 7.300 1.00 0.00 C ATOM 1541 CE LYS A 97 -9.115 -10.965 8.209 1.00 0.00 C ATOM 1542 NZ LYS A 97 -9.453 -9.960 9.254 1.00 0.00 N ATOM 0 H LYS A 97 -5.445 -14.136 5.186 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.414 -11.411 5.307 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.307 -13.298 5.508 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -7.168 -12.932 7.216 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -7.528 -10.698 5.216 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -8.909 -11.641 5.742 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -7.045 -10.534 7.833 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -8.158 -9.437 7.041 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -10.001 -11.179 7.611 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -8.819 -11.899 8.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -10.221 -10.326 9.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -8.615 -9.774 9.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -9.760 -9.076 8.799 1.00 0.00 H new ATOM 1556 N SER A 98 -4.454 -12.732 8.146 1.00 0.00 N ATOM 1557 CA SER A 98 -3.851 -12.434 9.440 1.00 0.00 C ATOM 1558 C SER A 98 -2.642 -11.518 9.279 1.00 0.00 C ATOM 1559 O SER A 98 -2.383 -10.661 10.122 1.00 0.00 O ATOM 1560 CB SER A 98 -3.435 -13.728 10.142 1.00 0.00 C ATOM 1561 OG SER A 98 -2.992 -13.472 11.463 1.00 0.00 O ATOM 0 H SER A 98 -4.486 -13.725 7.914 1.00 0.00 H new ATOM 0 HA SER A 98 -4.594 -11.921 10.050 1.00 0.00 H new ATOM 0 HB2 SER A 98 -4.277 -14.420 10.165 1.00 0.00 H new ATOM 0 HB3 SER A 98 -2.640 -14.213 9.576 1.00 0.00 H new ATOM 0 HG SER A 98 -2.733 -14.315 11.890 1.00 0.00 H new ATOM 1567 N GLU A 99 -1.906 -11.707 8.188 1.00 0.00 N ATOM 1568 CA GLU A 99 -0.723 -10.899 7.916 1.00 0.00 C ATOM 1569 C GLU A 99 -1.116 -9.493 7.471 1.00 0.00 C ATOM 1570 O GLU A 99 -0.459 -8.512 7.822 1.00 0.00 O ATOM 1571 CB GLU A 99 0.141 -11.563 6.842 1.00 0.00 C ATOM 1572 CG GLU A 99 -0.167 -11.087 5.432 1.00 0.00 C ATOM 1573 CD GLU A 99 0.453 -11.972 4.369 1.00 0.00 C ATOM 1574 OE1 GLU A 99 0.701 -13.161 4.658 1.00 0.00 O ATOM 1575 OE2 GLU A 99 0.691 -11.475 3.248 1.00 0.00 O ATOM 0 H GLU A 99 -2.108 -12.412 7.479 1.00 0.00 H new ATOM 0 HA GLU A 99 -0.147 -10.823 8.838 1.00 0.00 H new ATOM 0 HB2 GLU A 99 1.191 -11.368 7.061 1.00 0.00 H new ATOM 0 HB3 GLU A 99 0.000 -12.643 6.891 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -1.247 -11.058 5.290 1.00 0.00 H new ATOM 0 HG3 GLU A 99 0.198 -10.067 5.309 1.00 0.00 H new ATOM 1582 N LEU A 100 -2.190 -9.404 6.695 1.00 0.00 N ATOM 1583 CA LEU A 100 -2.672 -8.118 6.200 1.00 0.00 C ATOM 1584 C LEU A 100 -2.865 -7.131 7.347 1.00 0.00 C ATOM 1585 O LEU A 100 -3.007 -7.527 8.504 1.00 0.00 O ATOM 1586 CB LEU A 100 -3.988 -8.302 5.443 1.00 0.00 C ATOM 1587 CG LEU A 100 -3.954 -9.277 4.265 1.00 0.00 C ATOM 1588 CD1 LEU A 100 -5.314 -9.341 3.586 1.00 0.00 C ATOM 1589 CD2 LEU A 100 -2.877 -8.873 3.269 1.00 0.00 C ATOM 0 H LEU A 100 -2.744 -10.206 6.395 1.00 0.00 H new ATOM 0 HA LEU A 100 -1.922 -7.714 5.520 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -4.746 -8.643 6.149 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.311 -7.329 5.074 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.714 -10.270 4.646 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -5.271 -10.039 2.750 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.063 -9.678 4.303 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.584 -8.351 3.218 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -2.867 -9.578 2.438 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -3.086 -7.871 2.893 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -1.905 -8.880 3.762 1.00 0.00 H new ATOM 1601 N PHE A 101 -2.871 -5.844 7.017 1.00 0.00 N ATOM 1602 CA PHE A 101 -3.048 -4.799 8.019 1.00 0.00 C ATOM 1603 C PHE A 101 -4.529 -4.495 8.231 1.00 0.00 C ATOM 1604 O PHE A 101 -5.383 -4.968 7.483 1.00 0.00 O ATOM 1605 CB PHE A 101 -2.310 -3.527 7.597 1.00 0.00 C ATOM 1606 CG PHE A 101 -2.724 -3.014 6.247 1.00 0.00 C ATOM 1607 CD1 PHE A 101 -3.830 -2.190 6.114 1.00 0.00 C ATOM 1608 CD2 PHE A 101 -2.008 -3.355 5.112 1.00 0.00 C ATOM 1609 CE1 PHE A 101 -4.214 -1.715 4.874 1.00 0.00 C ATOM 1610 CE2 PHE A 101 -2.386 -2.884 3.869 1.00 0.00 C ATOM 1611 CZ PHE A 101 -3.491 -2.064 3.750 1.00 0.00 C ATOM 0 H PHE A 101 -2.755 -5.499 6.064 1.00 0.00 H new ATOM 0 HA PHE A 101 -2.630 -5.158 8.960 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.486 -2.751 8.342 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -1.238 -3.724 7.589 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -4.399 -1.915 6.990 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -1.144 -3.997 5.199 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -5.077 -1.072 4.784 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -1.818 -3.157 2.992 1.00 0.00 H new ATOM 0 HZ PHE A 101 -3.789 -1.696 2.779 1.00 0.00 H new ATOM 1621 N GLU A 102 -4.822 -3.702 9.257 1.00 0.00 N ATOM 1622 CA GLU A 102 -6.199 -3.336 9.569 1.00 0.00 C ATOM 1623 C GLU A 102 -6.593 -2.044 8.858 1.00 0.00 C ATOM 1624 O GLU A 102 -5.916 -1.024 8.981 1.00 0.00 O ATOM 1625 CB GLU A 102 -6.377 -3.174 11.080 1.00 0.00 C ATOM 1626 CG GLU A 102 -7.778 -3.504 11.566 1.00 0.00 C ATOM 1627 CD GLU A 102 -8.138 -2.776 12.847 1.00 0.00 C ATOM 1628 OE1 GLU A 102 -7.341 -2.837 13.807 1.00 0.00 O ATOM 1629 OE2 GLU A 102 -9.216 -2.147 12.890 1.00 0.00 O ATOM 0 H GLU A 102 -4.126 -3.301 9.885 1.00 0.00 H new ATOM 0 HA GLU A 102 -6.849 -4.137 9.217 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -5.662 -3.818 11.593 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -6.137 -2.148 11.358 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -8.498 -3.244 10.790 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -7.858 -4.579 11.728 1.00 0.00 H new ATOM 1636 N ALA A 103 -7.692 -2.097 8.113 1.00 0.00 N ATOM 1637 CA ALA A 103 -8.177 -0.932 7.383 1.00 0.00 C ATOM 1638 C ALA A 103 -8.063 0.332 8.228 1.00 0.00 C ATOM 1639 O ALA A 103 -7.674 1.389 7.732 1.00 0.00 O ATOM 1640 CB ALA A 103 -9.618 -1.148 6.944 1.00 0.00 C ATOM 0 H ALA A 103 -8.263 -2.934 7.999 1.00 0.00 H new ATOM 0 HA ALA A 103 -7.554 -0.803 6.498 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -9.968 -0.271 6.400 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -9.674 -2.023 6.296 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.246 -1.305 7.821 1.00 0.00 H new ATOM 1646 N PHE A 104 -8.405 0.216 9.507 1.00 0.00 N ATOM 1647 CA PHE A 104 -8.343 1.350 10.421 1.00 0.00 C ATOM 1648 C PHE A 104 -6.912 1.864 10.553 1.00 0.00 C ATOM 1649 O PHE A 104 -6.629 3.027 10.263 1.00 0.00 O ATOM 1650 CB PHE A 104 -8.883 0.954 11.797 1.00 0.00 C ATOM 1651 CG PHE A 104 -9.304 2.127 12.636 1.00 0.00 C ATOM 1652 CD1 PHE A 104 -10.303 2.984 12.201 1.00 0.00 C ATOM 1653 CD2 PHE A 104 -8.701 2.373 13.859 1.00 0.00 C ATOM 1654 CE1 PHE A 104 -10.693 4.064 12.971 1.00 0.00 C ATOM 1655 CE2 PHE A 104 -9.087 3.451 14.633 1.00 0.00 C ATOM 1656 CZ PHE A 104 -10.083 4.298 14.188 1.00 0.00 C ATOM 0 H PHE A 104 -8.728 -0.652 9.934 1.00 0.00 H new ATOM 0 HA PHE A 104 -8.962 2.149 10.012 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -9.735 0.287 11.666 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -8.117 0.392 12.331 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -10.782 2.806 11.250 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -7.921 1.715 14.211 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -11.473 4.724 12.621 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -8.610 3.631 15.585 1.00 0.00 H new ATOM 0 HZ PHE A 104 -10.384 5.142 14.791 1.00 0.00 H new ATOM 1666 N ASP A 105 -6.014 0.990 10.993 1.00 0.00 N ATOM 1667 CA ASP A 105 -4.612 1.354 11.164 1.00 0.00 C ATOM 1668 C ASP A 105 -4.161 2.310 10.064 1.00 0.00 C ATOM 1669 O ASP A 105 -3.425 3.264 10.319 1.00 0.00 O ATOM 1670 CB ASP A 105 -3.734 0.101 11.159 1.00 0.00 C ATOM 1671 CG ASP A 105 -3.911 -0.734 12.412 1.00 0.00 C ATOM 1672 OD1 ASP A 105 -4.201 -0.152 13.478 1.00 0.00 O ATOM 1673 OD2 ASP A 105 -3.759 -1.970 12.326 1.00 0.00 O ATOM 0 H ASP A 105 -6.232 0.024 11.238 1.00 0.00 H new ATOM 0 HA ASP A 105 -4.507 1.858 12.125 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -3.975 -0.504 10.285 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -2.688 0.394 11.066 1.00 0.00 H new ATOM 1678 N LEU A 106 -4.608 2.049 8.841 1.00 0.00 N ATOM 1679 CA LEU A 106 -4.250 2.886 7.701 1.00 0.00 C ATOM 1680 C LEU A 106 -4.989 4.219 7.750 1.00 0.00 C ATOM 1681 O LEU A 106 -4.376 5.284 7.672 1.00 0.00 O ATOM 1682 CB LEU A 106 -4.568 2.162 6.391 1.00 0.00 C ATOM 1683 CG LEU A 106 -4.074 2.839 5.112 1.00 0.00 C ATOM 1684 CD1 LEU A 106 -2.582 2.608 4.928 1.00 0.00 C ATOM 1685 CD2 LEU A 106 -4.847 2.329 3.906 1.00 0.00 C ATOM 0 H LEU A 106 -5.219 1.265 8.613 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.179 3.083 7.750 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.137 1.162 6.438 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -5.649 2.041 6.320 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.246 3.912 5.202 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.248 3.097 4.013 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.042 3.023 5.779 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.385 1.538 4.860 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.482 2.822 3.005 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -4.707 1.252 3.813 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -5.907 2.547 4.035 1.00 0.00 H new ATOM 1697 N PHE A 107 -6.310 4.152 7.884 1.00 0.00 N ATOM 1698 CA PHE A 107 -7.133 5.354 7.945 1.00 0.00 C ATOM 1699 C PHE A 107 -6.687 6.261 9.088 1.00 0.00 C ATOM 1700 O PHE A 107 -6.346 7.425 8.875 1.00 0.00 O ATOM 1701 CB PHE A 107 -8.606 4.980 8.121 1.00 0.00 C ATOM 1702 CG PHE A 107 -9.537 6.156 8.041 1.00 0.00 C ATOM 1703 CD1 PHE A 107 -9.458 7.048 6.984 1.00 0.00 C ATOM 1704 CD2 PHE A 107 -10.492 6.369 9.022 1.00 0.00 C ATOM 1705 CE1 PHE A 107 -10.313 8.132 6.908 1.00 0.00 C ATOM 1706 CE2 PHE A 107 -11.350 7.451 8.951 1.00 0.00 C ATOM 1707 CZ PHE A 107 -11.261 8.332 7.892 1.00 0.00 C ATOM 0 H PHE A 107 -6.833 3.279 7.952 1.00 0.00 H new ATOM 0 HA PHE A 107 -7.012 5.895 7.007 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -8.882 4.255 7.355 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -8.735 4.489 9.086 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -8.720 6.895 6.210 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -10.567 5.682 9.852 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -10.239 8.822 6.080 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -12.089 7.607 9.723 1.00 0.00 H new ATOM 0 HZ PHE A 107 -11.932 9.176 7.833 1.00 0.00 H new ATOM 1717 N ASP A 108 -6.693 5.720 10.302 1.00 0.00 N ATOM 1718 CA ASP A 108 -6.289 6.479 11.479 1.00 0.00 C ATOM 1719 C ASP A 108 -4.769 6.561 11.577 1.00 0.00 C ATOM 1720 O ASP A 108 -4.224 6.996 12.592 1.00 0.00 O ATOM 1721 CB ASP A 108 -6.860 5.839 12.746 1.00 0.00 C ATOM 1722 CG ASP A 108 -7.118 6.854 13.842 1.00 0.00 C ATOM 1723 OD1 ASP A 108 -8.077 7.641 13.707 1.00 0.00 O ATOM 1724 OD2 ASP A 108 -6.359 6.862 14.834 1.00 0.00 O ATOM 0 H ASP A 108 -6.973 4.759 10.496 1.00 0.00 H new ATOM 0 HA ASP A 108 -6.684 7.490 11.382 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -7.791 5.327 12.503 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -6.166 5.082 13.112 1.00 0.00 H new ATOM 1729 N VAL A 109 -4.089 6.141 10.515 1.00 0.00 N ATOM 1730 CA VAL A 109 -2.631 6.167 10.481 1.00 0.00 C ATOM 1731 C VAL A 109 -2.043 5.809 11.842 1.00 0.00 C ATOM 1732 O VAL A 109 -1.165 6.505 12.352 1.00 0.00 O ATOM 1733 CB VAL A 109 -2.105 7.550 10.054 1.00 0.00 C ATOM 1734 CG1 VAL A 109 -0.647 7.459 9.630 1.00 0.00 C ATOM 1735 CG2 VAL A 109 -2.960 8.123 8.934 1.00 0.00 C ATOM 0 H VAL A 109 -4.524 5.779 9.667 1.00 0.00 H new ATOM 0 HA VAL A 109 -2.318 5.425 9.747 1.00 0.00 H new ATOM 0 HB VAL A 109 -2.169 8.223 10.909 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -0.293 8.446 9.332 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -0.047 7.095 10.464 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -0.555 6.771 8.790 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -2.574 9.100 8.645 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -2.931 7.453 8.075 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -3.989 8.227 9.278 1.00 0.00 H new ATOM 1745 N ARG A 110 -2.532 4.719 12.423 1.00 0.00 N ATOM 1746 CA ARG A 110 -2.056 4.269 13.725 1.00 0.00 C ATOM 1747 C ARG A 110 -0.675 3.631 13.608 1.00 0.00 C ATOM 1748 O ARG A 110 0.309 4.155 14.131 1.00 0.00 O ATOM 1749 CB ARG A 110 -3.041 3.269 14.335 1.00 0.00 C ATOM 1750 CG ARG A 110 -4.469 3.786 14.403 1.00 0.00 C ATOM 1751 CD ARG A 110 -5.225 3.181 15.576 1.00 0.00 C ATOM 1752 NE ARG A 110 -4.673 3.605 16.860 1.00 0.00 N ATOM 1753 CZ ARG A 110 -4.950 3.005 18.013 1.00 0.00 C ATOM 1754 NH1 ARG A 110 -5.767 1.961 18.041 1.00 0.00 N ATOM 1755 NH2 ARG A 110 -4.409 3.450 19.140 1.00 0.00 N ATOM 0 H ARG A 110 -3.258 4.131 12.013 1.00 0.00 H new ATOM 0 HA ARG A 110 -1.982 5.139 14.377 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -3.023 2.351 13.748 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -2.708 3.011 15.341 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -4.460 4.872 14.496 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -4.987 3.550 13.474 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -6.274 3.471 15.519 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -5.190 2.094 15.508 1.00 0.00 H new ATOM 0 HE ARG A 110 -4.041 4.405 16.872 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -6.184 1.617 17.176 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -5.978 1.502 18.927 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -3.780 4.253 19.122 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -4.622 2.989 20.025 1.00 0.00 H new ATOM 1769 N ASP A 111 -0.609 2.497 12.919 1.00 0.00 N ATOM 1770 CA ASP A 111 0.651 1.787 12.732 1.00 0.00 C ATOM 1771 C ASP A 111 0.898 1.498 11.255 1.00 0.00 C ATOM 1772 O ASP A 111 0.417 0.500 10.718 1.00 0.00 O ATOM 1773 CB ASP A 111 0.648 0.481 13.527 1.00 0.00 C ATOM 1774 CG ASP A 111 0.527 0.712 15.021 1.00 0.00 C ATOM 1775 OD1 ASP A 111 -0.151 1.683 15.417 1.00 0.00 O ATOM 1776 OD2 ASP A 111 1.110 -0.078 15.793 1.00 0.00 O ATOM 0 H ASP A 111 -1.414 2.049 12.480 1.00 0.00 H new ATOM 0 HA ASP A 111 1.456 2.424 13.098 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -0.180 -0.144 13.191 1.00 0.00 H new ATOM 0 HB3 ASP A 111 1.566 -0.069 13.321 1.00 0.00 H new ATOM 1781 N PHE A 112 1.650 2.378 10.602 1.00 0.00 N ATOM 1782 CA PHE A 112 1.959 2.218 9.186 1.00 0.00 C ATOM 1783 C PHE A 112 2.829 0.987 8.955 1.00 0.00 C ATOM 1784 O PHE A 112 2.616 0.231 8.008 1.00 0.00 O ATOM 1785 CB PHE A 112 2.668 3.465 8.654 1.00 0.00 C ATOM 1786 CG PHE A 112 2.887 3.441 7.168 1.00 0.00 C ATOM 1787 CD1 PHE A 112 1.819 3.288 6.299 1.00 0.00 C ATOM 1788 CD2 PHE A 112 4.162 3.572 6.640 1.00 0.00 C ATOM 1789 CE1 PHE A 112 2.019 3.265 4.931 1.00 0.00 C ATOM 1790 CE2 PHE A 112 4.368 3.550 5.274 1.00 0.00 C ATOM 1791 CZ PHE A 112 3.294 3.397 4.418 1.00 0.00 C ATOM 0 H PHE A 112 2.057 3.209 11.031 1.00 0.00 H new ATOM 0 HA PHE A 112 1.021 2.084 8.647 1.00 0.00 H new ATOM 0 HB2 PHE A 112 2.080 4.346 8.913 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.631 3.567 9.154 1.00 0.00 H new ATOM 0 HD1 PHE A 112 0.819 3.186 6.694 1.00 0.00 H new ATOM 0 HD2 PHE A 112 5.005 3.693 7.305 1.00 0.00 H new ATOM 0 HE1 PHE A 112 1.178 3.144 4.264 1.00 0.00 H new ATOM 0 HE2 PHE A 112 5.367 3.652 4.876 1.00 0.00 H new ATOM 0 HZ PHE A 112 3.452 3.381 3.350 1.00 0.00 H new ATOM 1801 N GLY A 113 3.813 0.792 9.829 1.00 0.00 N ATOM 1802 CA GLY A 113 4.702 -0.348 9.703 1.00 0.00 C ATOM 1803 C GLY A 113 3.958 -1.632 9.390 1.00 0.00 C ATOM 1804 O GLY A 113 4.464 -2.492 8.670 1.00 0.00 O ATOM 0 H GLY A 113 4.010 1.403 10.621 1.00 0.00 H new ATOM 0 HA2 GLY A 113 5.430 -0.152 8.915 1.00 0.00 H new ATOM 0 HA3 GLY A 113 5.262 -0.473 10.630 1.00 0.00 H new ATOM 1808 N LYS A 114 2.753 -1.763 9.935 1.00 0.00 N ATOM 1809 CA LYS A 114 1.937 -2.950 9.711 1.00 0.00 C ATOM 1810 C LYS A 114 1.565 -3.086 8.238 1.00 0.00 C ATOM 1811 O LYS A 114 1.511 -4.192 7.700 1.00 0.00 O ATOM 1812 CB LYS A 114 0.669 -2.891 10.566 1.00 0.00 C ATOM 1813 CG LYS A 114 0.869 -3.388 11.987 1.00 0.00 C ATOM 1814 CD LYS A 114 -0.459 -3.608 12.693 1.00 0.00 C ATOM 1815 CE LYS A 114 -1.182 -4.831 12.151 1.00 0.00 C ATOM 1816 NZ LYS A 114 -2.365 -5.188 12.982 1.00 0.00 N ATOM 0 H LYS A 114 2.320 -1.061 10.535 1.00 0.00 H new ATOM 0 HA LYS A 114 2.523 -3.823 10.000 1.00 0.00 H new ATOM 0 HB2 LYS A 114 0.310 -1.862 10.597 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -0.109 -3.486 10.088 1.00 0.00 H new ATOM 0 HG2 LYS A 114 1.433 -4.321 11.971 1.00 0.00 H new ATOM 0 HG3 LYS A 114 1.464 -2.666 12.546 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -0.288 -3.729 13.763 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -1.089 -2.727 12.569 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -1.502 -4.640 11.127 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -0.493 -5.675 12.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -2.831 -6.026 12.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -2.057 -5.395 13.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -3.034 -4.392 12.993 1.00 0.00 H new ATOM 1830 N VAL A 115 1.310 -1.953 7.591 1.00 0.00 N ATOM 1831 CA VAL A 115 0.945 -1.945 6.179 1.00 0.00 C ATOM 1832 C VAL A 115 2.144 -2.284 5.300 1.00 0.00 C ATOM 1833 O VAL A 115 2.018 -3.015 4.317 1.00 0.00 O ATOM 1834 CB VAL A 115 0.380 -0.577 5.753 1.00 0.00 C ATOM 1835 CG1 VAL A 115 -0.027 -0.600 4.288 1.00 0.00 C ATOM 1836 CG2 VAL A 115 -0.796 -0.188 6.636 1.00 0.00 C ATOM 0 H VAL A 115 1.349 -1.029 8.022 1.00 0.00 H new ATOM 0 HA VAL A 115 0.175 -2.705 6.047 1.00 0.00 H new ATOM 0 HB VAL A 115 1.161 0.173 5.876 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -0.424 0.375 4.005 1.00 0.00 H new ATOM 0 HG12 VAL A 115 0.843 -0.830 3.672 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -0.792 -1.361 4.135 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -1.183 0.781 6.321 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -1.582 -0.938 6.547 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -0.468 -0.128 7.674 1.00 0.00 H new ATOM 1846 N ILE A 116 3.305 -1.749 5.661 1.00 0.00 N ATOM 1847 CA ILE A 116 4.527 -1.996 4.906 1.00 0.00 C ATOM 1848 C ILE A 116 4.837 -3.487 4.833 1.00 0.00 C ATOM 1849 O ILE A 116 5.142 -4.016 3.765 1.00 0.00 O ATOM 1850 CB ILE A 116 5.731 -1.263 5.527 1.00 0.00 C ATOM 1851 CG1 ILE A 116 5.431 0.232 5.662 1.00 0.00 C ATOM 1852 CG2 ILE A 116 6.978 -1.484 4.684 1.00 0.00 C ATOM 1853 CD1 ILE A 116 6.553 1.017 6.305 1.00 0.00 C ATOM 0 H ILE A 116 3.425 -1.142 6.472 1.00 0.00 H new ATOM 0 HA ILE A 116 4.358 -1.613 3.900 1.00 0.00 H new ATOM 0 HB ILE A 116 5.912 -1.670 6.522 1.00 0.00 H new ATOM 0 HG12 ILE A 116 5.230 0.645 4.673 1.00 0.00 H new ATOM 0 HG13 ILE A 116 4.524 0.361 6.252 1.00 0.00 H new ATOM 0 HG21 ILE A 116 7.820 -0.960 5.136 1.00 0.00 H new ATOM 0 HG22 ILE A 116 7.199 -2.550 4.634 1.00 0.00 H new ATOM 0 HG23 ILE A 116 6.810 -1.101 3.678 1.00 0.00 H new ATOM 0 HD11 ILE A 116 6.272 2.068 6.368 1.00 0.00 H new ATOM 0 HD12 ILE A 116 6.740 0.630 7.307 1.00 0.00 H new ATOM 0 HD13 ILE A 116 7.457 0.919 5.704 1.00 0.00 H new ATOM 1865 N GLU A 117 4.754 -4.159 5.977 1.00 0.00 N ATOM 1866 CA GLU A 117 5.024 -5.591 6.043 1.00 0.00 C ATOM 1867 C GLU A 117 4.198 -6.348 5.007 1.00 0.00 C ATOM 1868 O GLU A 117 4.726 -7.162 4.248 1.00 0.00 O ATOM 1869 CB GLU A 117 4.722 -6.126 7.444 1.00 0.00 C ATOM 1870 CG GLU A 117 5.182 -7.558 7.661 1.00 0.00 C ATOM 1871 CD GLU A 117 6.680 -7.721 7.490 1.00 0.00 C ATOM 1872 OE1 GLU A 117 7.436 -6.913 8.069 1.00 0.00 O ATOM 1873 OE2 GLU A 117 7.096 -8.658 6.776 1.00 0.00 O ATOM 0 H GLU A 117 4.502 -3.735 6.870 1.00 0.00 H new ATOM 0 HA GLU A 117 6.080 -5.746 5.824 1.00 0.00 H new ATOM 0 HB2 GLU A 117 5.203 -5.483 8.181 1.00 0.00 H new ATOM 0 HB3 GLU A 117 3.648 -6.067 7.623 1.00 0.00 H new ATOM 0 HG2 GLU A 117 4.897 -7.879 8.663 1.00 0.00 H new ATOM 0 HG3 GLU A 117 4.666 -8.212 6.958 1.00 0.00 H new ATOM 1880 N THR A 118 2.897 -6.076 4.983 1.00 0.00 N ATOM 1881 CA THR A 118 1.996 -6.732 4.043 1.00 0.00 C ATOM 1882 C THR A 118 2.602 -6.783 2.645 1.00 0.00 C ATOM 1883 O THR A 118 2.658 -7.844 2.020 1.00 0.00 O ATOM 1884 CB THR A 118 0.636 -6.013 3.974 1.00 0.00 C ATOM 1885 OG1 THR A 118 0.004 -6.034 5.259 1.00 0.00 O ATOM 1886 CG2 THR A 118 -0.273 -6.671 2.946 1.00 0.00 C ATOM 0 H THR A 118 2.444 -5.406 5.604 1.00 0.00 H new ATOM 0 HA THR A 118 1.844 -7.748 4.408 1.00 0.00 H new ATOM 0 HB THR A 118 0.812 -4.980 3.673 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.391 -5.334 5.825 1.00 0.00 H new ATOM 0 HG21 THR A 118 -1.228 -6.146 2.915 1.00 0.00 H new ATOM 0 HG22 THR A 118 0.197 -6.627 1.964 1.00 0.00 H new ATOM 0 HG23 THR A 118 -0.440 -7.712 3.222 1.00 0.00 H new ATOM 1894 N LEU A 119 3.056 -5.633 2.159 1.00 0.00 N ATOM 1895 CA LEU A 119 3.660 -5.548 0.834 1.00 0.00 C ATOM 1896 C LEU A 119 4.919 -6.404 0.753 1.00 0.00 C ATOM 1897 O LEU A 119 5.161 -7.077 -0.249 1.00 0.00 O ATOM 1898 CB LEU A 119 3.996 -4.094 0.498 1.00 0.00 C ATOM 1899 CG LEU A 119 2.875 -3.077 0.719 1.00 0.00 C ATOM 1900 CD1 LEU A 119 3.410 -1.659 0.600 1.00 0.00 C ATOM 1901 CD2 LEU A 119 1.744 -3.308 -0.273 1.00 0.00 C ATOM 0 H LEU A 119 3.017 -4.747 2.662 1.00 0.00 H new ATOM 0 HA LEU A 119 2.939 -5.926 0.109 1.00 0.00 H new ATOM 0 HB2 LEU A 119 4.856 -3.793 1.097 1.00 0.00 H new ATOM 0 HB3 LEU A 119 4.303 -4.045 -0.547 1.00 0.00 H new ATOM 0 HG LEU A 119 2.481 -3.211 1.727 1.00 0.00 H new ATOM 0 HD11 LEU A 119 2.598 -0.949 0.760 1.00 0.00 H new ATOM 0 HD12 LEU A 119 4.185 -1.499 1.349 1.00 0.00 H new ATOM 0 HD13 LEU A 119 3.830 -1.511 -0.395 1.00 0.00 H new ATOM 0 HD21 LEU A 119 0.955 -2.576 -0.102 1.00 0.00 H new ATOM 0 HD22 LEU A 119 2.124 -3.201 -1.289 1.00 0.00 H new ATOM 0 HD23 LEU A 119 1.342 -4.312 -0.139 1.00 0.00 H new ATOM 1913 N SER A 120 5.717 -6.377 1.816 1.00 0.00 N ATOM 1914 CA SER A 120 6.953 -7.150 1.864 1.00 0.00 C ATOM 1915 C SER A 120 6.701 -8.602 1.470 1.00 0.00 C ATOM 1916 O SER A 120 7.517 -9.222 0.788 1.00 0.00 O ATOM 1917 CB SER A 120 7.562 -7.089 3.266 1.00 0.00 C ATOM 1918 OG SER A 120 8.789 -7.797 3.320 1.00 0.00 O ATOM 0 H SER A 120 5.530 -5.828 2.655 1.00 0.00 H new ATOM 0 HA SER A 120 7.653 -6.715 1.151 1.00 0.00 H new ATOM 0 HB2 SER A 120 7.725 -6.049 3.550 1.00 0.00 H new ATOM 0 HB3 SER A 120 6.863 -7.511 3.988 1.00 0.00 H new ATOM 0 HG SER A 120 9.159 -7.742 4.226 1.00 0.00 H new ATOM 1924 N ARG A 121 5.565 -9.138 1.904 1.00 0.00 N ATOM 1925 CA ARG A 121 5.205 -10.517 1.598 1.00 0.00 C ATOM 1926 C ARG A 121 4.596 -10.623 0.203 1.00 0.00 C ATOM 1927 O ARG A 121 5.043 -11.420 -0.623 1.00 0.00 O ATOM 1928 CB ARG A 121 4.220 -11.053 2.638 1.00 0.00 C ATOM 1929 CG ARG A 121 4.764 -11.037 4.057 1.00 0.00 C ATOM 1930 CD ARG A 121 3.743 -11.567 5.052 1.00 0.00 C ATOM 1931 NE ARG A 121 3.608 -13.019 4.976 1.00 0.00 N ATOM 1932 CZ ARG A 121 3.161 -13.769 5.977 1.00 0.00 C ATOM 1933 NH1 ARG A 121 2.807 -13.206 7.124 1.00 0.00 N ATOM 1934 NH2 ARG A 121 3.066 -15.085 5.832 1.00 0.00 N ATOM 0 H ARG A 121 4.878 -8.638 2.469 1.00 0.00 H new ATOM 0 HA ARG A 121 6.114 -11.118 1.626 1.00 0.00 H new ATOM 0 HB2 ARG A 121 3.307 -10.459 2.601 1.00 0.00 H new ATOM 0 HB3 ARG A 121 3.946 -12.075 2.374 1.00 0.00 H new ATOM 0 HG2 ARG A 121 5.670 -11.641 4.107 1.00 0.00 H new ATOM 0 HG3 ARG A 121 5.044 -10.019 4.329 1.00 0.00 H new ATOM 0 HD2 ARG A 121 4.039 -11.283 6.062 1.00 0.00 H new ATOM 0 HD3 ARG A 121 2.776 -11.102 4.861 1.00 0.00 H new ATOM 0 HE ARG A 121 3.871 -13.483 4.107 1.00 0.00 H new ATOM 0 HH11 ARG A 121 2.878 -12.195 7.239 1.00 0.00 H new ATOM 0 HH12 ARG A 121 2.464 -13.784 7.891 1.00 0.00 H new ATOM 0 HH21 ARG A 121 3.336 -15.522 4.951 1.00 0.00 H new ATOM 0 HH22 ARG A 121 2.723 -15.659 6.602 1.00 0.00 H new ATOM 1948 N LEU A 122 3.573 -9.815 -0.053 1.00 0.00 N ATOM 1949 CA LEU A 122 2.901 -9.818 -1.348 1.00 0.00 C ATOM 1950 C LEU A 122 3.902 -10.031 -2.480 1.00 0.00 C ATOM 1951 O LEU A 122 3.717 -10.903 -3.329 1.00 0.00 O ATOM 1952 CB LEU A 122 2.149 -8.503 -1.558 1.00 0.00 C ATOM 1953 CG LEU A 122 1.640 -8.239 -2.975 1.00 0.00 C ATOM 1954 CD1 LEU A 122 0.627 -9.297 -3.384 1.00 0.00 C ATOM 1955 CD2 LEU A 122 1.031 -6.848 -3.073 1.00 0.00 C ATOM 0 H LEU A 122 3.191 -9.149 0.619 1.00 0.00 H new ATOM 0 HA LEU A 122 2.188 -10.642 -1.358 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.297 -8.482 -0.878 1.00 0.00 H new ATOM 0 HB3 LEU A 122 2.806 -7.682 -1.271 1.00 0.00 H new ATOM 0 HG LEU A 122 2.486 -8.292 -3.660 1.00 0.00 H new ATOM 0 HD11 LEU A 122 0.276 -9.093 -4.395 1.00 0.00 H new ATOM 0 HD12 LEU A 122 1.096 -10.280 -3.354 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -0.218 -9.277 -2.696 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.674 -6.678 -4.089 1.00 0.00 H new ATOM 0 HD22 LEU A 122 0.196 -6.766 -2.377 1.00 0.00 H new ATOM 0 HD23 LEU A 122 1.786 -6.102 -2.824 1.00 0.00 H new ATOM 1967 N SER A 123 4.963 -9.230 -2.484 1.00 0.00 N ATOM 1968 CA SER A 123 5.992 -9.330 -3.512 1.00 0.00 C ATOM 1969 C SER A 123 6.328 -10.789 -3.804 1.00 0.00 C ATOM 1970 O SER A 123 6.396 -11.202 -4.962 1.00 0.00 O ATOM 1971 CB SER A 123 7.253 -8.582 -3.075 1.00 0.00 C ATOM 1972 OG SER A 123 7.848 -9.201 -1.947 1.00 0.00 O ATOM 0 H SER A 123 5.132 -8.505 -1.787 1.00 0.00 H new ATOM 0 HA SER A 123 5.606 -8.875 -4.424 1.00 0.00 H new ATOM 0 HB2 SER A 123 7.967 -8.555 -3.898 1.00 0.00 H new ATOM 0 HB3 SER A 123 7.002 -7.548 -2.837 1.00 0.00 H new ATOM 0 HG SER A 123 7.390 -8.906 -1.132 1.00 0.00 H new ATOM 1978 N ARG A 124 6.537 -11.565 -2.746 1.00 0.00 N ATOM 1979 CA ARG A 124 6.868 -12.978 -2.888 1.00 0.00 C ATOM 1980 C ARG A 124 6.006 -13.633 -3.963 1.00 0.00 C ATOM 1981 O ARG A 124 6.484 -14.459 -4.741 1.00 0.00 O ATOM 1982 CB ARG A 124 6.678 -13.704 -1.555 1.00 0.00 C ATOM 1983 CG ARG A 124 7.715 -13.334 -0.507 1.00 0.00 C ATOM 1984 CD ARG A 124 9.018 -14.088 -0.721 1.00 0.00 C ATOM 1985 NE ARG A 124 8.851 -15.529 -0.549 1.00 0.00 N ATOM 1986 CZ ARG A 124 8.824 -16.129 0.636 1.00 0.00 C ATOM 1987 NH1 ARG A 124 8.952 -15.417 1.747 1.00 0.00 N ATOM 1988 NH2 ARG A 124 8.669 -17.445 0.711 1.00 0.00 N ATOM 0 H ARG A 124 6.483 -11.239 -1.781 1.00 0.00 H new ATOM 0 HA ARG A 124 7.913 -13.052 -3.189 1.00 0.00 H new ATOM 0 HB2 ARG A 124 5.685 -13.479 -1.167 1.00 0.00 H new ATOM 0 HB3 ARG A 124 6.716 -14.780 -1.728 1.00 0.00 H new ATOM 0 HG2 ARG A 124 7.904 -12.261 -0.544 1.00 0.00 H new ATOM 0 HG3 ARG A 124 7.325 -13.555 0.486 1.00 0.00 H new ATOM 0 HD2 ARG A 124 9.395 -13.884 -1.723 1.00 0.00 H new ATOM 0 HD3 ARG A 124 9.767 -13.723 -0.018 1.00 0.00 H new ATOM 0 HE ARG A 124 8.750 -16.106 -1.384 1.00 0.00 H new ATOM 0 HH11 ARG A 124 9.072 -14.405 1.694 1.00 0.00 H new ATOM 0 HH12 ARG A 124 8.931 -15.881 2.655 1.00 0.00 H new ATOM 0 HH21 ARG A 124 8.571 -17.996 -0.141 1.00 0.00 H new ATOM 0 HH22 ARG A 124 8.648 -17.905 1.621 1.00 0.00 H new ATOM 2002 N THR A 125 4.730 -13.259 -4.001 1.00 0.00 N ATOM 2003 CA THR A 125 3.801 -13.810 -4.979 1.00 0.00 C ATOM 2004 C THR A 125 4.462 -13.955 -6.345 1.00 0.00 C ATOM 2005 O THR A 125 5.347 -13.185 -6.717 1.00 0.00 O ATOM 2006 CB THR A 125 2.545 -12.929 -5.119 1.00 0.00 C ATOM 2007 OG1 THR A 125 2.912 -11.624 -5.582 1.00 0.00 O ATOM 2008 CG2 THR A 125 1.813 -12.814 -3.791 1.00 0.00 C ATOM 0 H THR A 125 4.317 -12.577 -3.365 1.00 0.00 H new ATOM 0 HA THR A 125 3.506 -14.794 -4.615 1.00 0.00 H new ATOM 0 HB THR A 125 1.878 -13.397 -5.843 1.00 0.00 H new ATOM 0 HG1 THR A 125 3.235 -11.088 -4.828 1.00 0.00 H new ATOM 0 HG21 THR A 125 0.930 -12.187 -3.915 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.510 -13.806 -3.456 1.00 0.00 H new ATOM 0 HG23 THR A 125 2.474 -12.366 -3.049 1.00 0.00 H new ATOM 2016 N PRO A 126 4.022 -14.964 -7.112 1.00 0.00 N ATOM 2017 CA PRO A 126 4.557 -15.232 -8.450 1.00 0.00 C ATOM 2018 C PRO A 126 4.158 -14.161 -9.459 1.00 0.00 C ATOM 2019 O PRO A 126 4.570 -14.204 -10.619 1.00 0.00 O ATOM 2020 CB PRO A 126 3.928 -16.578 -8.820 1.00 0.00 C ATOM 2021 CG PRO A 126 2.676 -16.644 -8.016 1.00 0.00 C ATOM 2022 CD PRO A 126 2.969 -15.920 -6.731 1.00 0.00 C ATOM 0 HA PRO A 126 5.647 -15.239 -8.460 1.00 0.00 H new ATOM 0 HB2 PRO A 126 3.716 -16.636 -9.888 1.00 0.00 H new ATOM 0 HB3 PRO A 126 4.596 -17.406 -8.582 1.00 0.00 H new ATOM 0 HG2 PRO A 126 1.847 -16.176 -8.547 1.00 0.00 H new ATOM 0 HG3 PRO A 126 2.390 -17.678 -7.824 1.00 0.00 H new ATOM 0 HD2 PRO A 126 2.085 -15.412 -6.345 1.00 0.00 H new ATOM 0 HD3 PRO A 126 3.309 -16.603 -5.953 1.00 0.00 H new ATOM 2030 N ILE A 127 3.354 -13.203 -9.011 1.00 0.00 N ATOM 2031 CA ILE A 127 2.901 -12.121 -9.876 1.00 0.00 C ATOM 2032 C ILE A 127 3.818 -10.908 -9.765 1.00 0.00 C ATOM 2033 O ILE A 127 4.202 -10.313 -10.772 1.00 0.00 O ATOM 2034 CB ILE A 127 1.461 -11.694 -9.535 1.00 0.00 C ATOM 2035 CG1 ILE A 127 0.500 -12.871 -9.717 1.00 0.00 C ATOM 2036 CG2 ILE A 127 1.037 -10.519 -10.404 1.00 0.00 C ATOM 2037 CD1 ILE A 127 0.325 -13.706 -8.468 1.00 0.00 C ATOM 0 H ILE A 127 3.003 -13.154 -8.055 1.00 0.00 H new ATOM 0 HA ILE A 127 2.927 -12.501 -10.897 1.00 0.00 H new ATOM 0 HB ILE A 127 1.429 -11.380 -8.492 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -0.473 -12.491 -10.029 1.00 0.00 H new ATOM 0 HG13 ILE A 127 0.867 -13.508 -10.522 1.00 0.00 H new ATOM 0 HG21 ILE A 127 0.017 -10.229 -10.151 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.707 -9.677 -10.230 1.00 0.00 H new ATOM 0 HG23 ILE A 127 1.082 -10.808 -11.454 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -0.369 -14.522 -8.670 1.00 0.00 H new ATOM 0 HD12 ILE A 127 1.289 -14.116 -8.166 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -0.071 -13.083 -7.666 1.00 0.00 H new ATOM 2049 N ALA A 128 4.167 -10.547 -8.534 1.00 0.00 N ATOM 2050 CA ALA A 128 5.043 -9.408 -8.292 1.00 0.00 C ATOM 2051 C ALA A 128 6.439 -9.659 -8.851 1.00 0.00 C ATOM 2052 O ALA A 128 7.058 -8.766 -9.430 1.00 0.00 O ATOM 2053 CB ALA A 128 5.115 -9.105 -6.802 1.00 0.00 C ATOM 0 H ALA A 128 3.856 -11.027 -7.689 1.00 0.00 H new ATOM 0 HA ALA A 128 4.625 -8.544 -8.808 1.00 0.00 H new ATOM 0 HB1 ALA A 128 5.773 -8.252 -6.636 1.00 0.00 H new ATOM 0 HB2 ALA A 128 4.117 -8.872 -6.429 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.506 -9.974 -6.273 1.00 0.00 H new ATOM 2059 N LEU A 129 6.931 -10.880 -8.673 1.00 0.00 N ATOM 2060 CA LEU A 129 8.256 -11.250 -9.159 1.00 0.00 C ATOM 2061 C LEU A 129 8.256 -11.402 -10.677 1.00 0.00 C ATOM 2062 O LEU A 129 9.212 -11.017 -11.349 1.00 0.00 O ATOM 2063 CB LEU A 129 8.716 -12.554 -8.504 1.00 0.00 C ATOM 2064 CG LEU A 129 8.705 -12.577 -6.975 1.00 0.00 C ATOM 2065 CD1 LEU A 129 9.034 -13.970 -6.460 1.00 0.00 C ATOM 2066 CD2 LEU A 129 9.687 -11.555 -6.420 1.00 0.00 C ATOM 0 H LEU A 129 6.432 -11.631 -8.196 1.00 0.00 H new ATOM 0 HA LEU A 129 8.950 -10.453 -8.892 1.00 0.00 H new ATOM 0 HB2 LEU A 129 8.080 -13.362 -8.864 1.00 0.00 H new ATOM 0 HB3 LEU A 129 9.729 -12.770 -8.843 1.00 0.00 H new ATOM 0 HG LEU A 129 7.704 -12.313 -6.633 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.022 -13.967 -5.370 1.00 0.00 H new ATOM 0 HD12 LEU A 129 8.293 -14.679 -6.830 1.00 0.00 H new ATOM 0 HD13 LEU A 129 10.023 -14.263 -6.811 1.00 0.00 H new ATOM 0 HD21 LEU A 129 9.666 -11.585 -5.331 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.692 -11.789 -6.770 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.407 -10.558 -6.761 1.00 0.00 H new ATOM 2078 N ALA A 130 7.176 -11.965 -11.210 1.00 0.00 N ATOM 2079 CA ALA A 130 7.050 -12.165 -12.648 1.00 0.00 C ATOM 2080 C ALA A 130 7.499 -10.926 -13.416 1.00 0.00 C ATOM 2081 O ALA A 130 8.210 -11.026 -14.417 1.00 0.00 O ATOM 2082 CB ALA A 130 5.614 -12.519 -13.008 1.00 0.00 C ATOM 0 H ALA A 130 6.376 -12.290 -10.667 1.00 0.00 H new ATOM 0 HA ALA A 130 7.699 -12.993 -12.933 1.00 0.00 H new ATOM 0 HB1 ALA A 130 5.534 -12.666 -14.085 1.00 0.00 H new ATOM 0 HB2 ALA A 130 5.326 -13.436 -12.495 1.00 0.00 H new ATOM 0 HB3 ALA A 130 4.952 -11.709 -12.702 1.00 0.00 H new ATOM 2088 N THR A 131 7.081 -9.757 -12.941 1.00 0.00 N ATOM 2089 CA THR A 131 7.438 -8.499 -13.583 1.00 0.00 C ATOM 2090 C THR A 131 8.947 -8.279 -13.561 1.00 0.00 C ATOM 2091 O THR A 131 9.527 -7.789 -14.529 1.00 0.00 O ATOM 2092 CB THR A 131 6.747 -7.303 -12.902 1.00 0.00 C ATOM 2093 OG1 THR A 131 7.268 -7.124 -11.580 1.00 0.00 O ATOM 2094 CG2 THR A 131 5.242 -7.515 -12.834 1.00 0.00 C ATOM 0 H THR A 131 6.494 -9.656 -12.113 1.00 0.00 H new ATOM 0 HA THR A 131 7.098 -8.565 -14.616 1.00 0.00 H new ATOM 0 HB THR A 131 6.946 -6.410 -13.495 1.00 0.00 H new ATOM 0 HG1 THR A 131 7.023 -7.893 -11.025 1.00 0.00 H new ATOM 0 HG21 THR A 131 4.775 -6.658 -12.349 1.00 0.00 H new ATOM 0 HG22 THR A 131 4.844 -7.622 -13.843 1.00 0.00 H new ATOM 0 HG23 THR A 131 5.027 -8.417 -12.261 1.00 0.00 H new ATOM 2102 N GLY A 132 9.577 -8.646 -12.449 1.00 0.00 N ATOM 2103 CA GLY A 132 11.013 -8.482 -12.322 1.00 0.00 C ATOM 2104 C GLY A 132 11.390 -7.193 -11.618 1.00 0.00 C ATOM 2105 O GLY A 132 12.483 -6.664 -11.820 1.00 0.00 O ATOM 0 H GLY A 132 9.118 -9.054 -11.634 1.00 0.00 H new ATOM 0 HA2 GLY A 132 11.425 -9.327 -11.770 1.00 0.00 H new ATOM 0 HA3 GLY A 132 11.466 -8.497 -13.313 1.00 0.00 H new ATOM 2109 N ILE A 133 10.482 -6.686 -10.791 1.00 0.00 N ATOM 2110 CA ILE A 133 10.724 -5.451 -10.055 1.00 0.00 C ATOM 2111 C ILE A 133 11.526 -5.716 -8.786 1.00 0.00 C ATOM 2112 O ILE A 133 11.278 -6.689 -8.074 1.00 0.00 O ATOM 2113 CB ILE A 133 9.405 -4.752 -9.679 1.00 0.00 C ATOM 2114 CG1 ILE A 133 8.616 -4.391 -10.940 1.00 0.00 C ATOM 2115 CG2 ILE A 133 9.682 -3.508 -8.848 1.00 0.00 C ATOM 2116 CD1 ILE A 133 7.169 -4.044 -10.668 1.00 0.00 C ATOM 0 H ILE A 133 9.572 -7.111 -10.614 1.00 0.00 H new ATOM 0 HA ILE A 133 11.296 -4.798 -10.714 1.00 0.00 H new ATOM 0 HB ILE A 133 8.805 -5.439 -9.081 1.00 0.00 H new ATOM 0 HG12 ILE A 133 9.098 -3.546 -11.431 1.00 0.00 H new ATOM 0 HG13 ILE A 133 8.656 -5.229 -11.636 1.00 0.00 H new ATOM 0 HG21 ILE A 133 8.739 -3.025 -8.590 1.00 0.00 H new ATOM 0 HG22 ILE A 133 10.207 -3.790 -7.935 1.00 0.00 H new ATOM 0 HG23 ILE A 133 10.299 -2.817 -9.422 1.00 0.00 H new ATOM 0 HD11 ILE A 133 6.671 -3.799 -11.606 1.00 0.00 H new ATOM 0 HD12 ILE A 133 6.671 -4.896 -10.205 1.00 0.00 H new ATOM 0 HD13 ILE A 133 7.120 -3.187 -9.997 1.00 0.00 H new ATOM 2128 N ARG A 134 12.487 -4.842 -8.507 1.00 0.00 N ATOM 2129 CA ARG A 134 13.326 -4.981 -7.322 1.00 0.00 C ATOM 2130 C ARG A 134 12.543 -5.607 -6.172 1.00 0.00 C ATOM 2131 O ARG A 134 11.835 -4.928 -5.428 1.00 0.00 O ATOM 2132 CB ARG A 134 13.875 -3.617 -6.897 1.00 0.00 C ATOM 2133 CG ARG A 134 14.822 -2.999 -7.912 1.00 0.00 C ATOM 2134 CD ARG A 134 16.185 -3.673 -7.885 1.00 0.00 C ATOM 2135 NE ARG A 134 17.077 -3.146 -8.914 1.00 0.00 N ATOM 2136 CZ ARG A 134 18.402 -3.202 -8.837 1.00 0.00 C ATOM 2137 NH1 ARG A 134 18.985 -3.760 -7.785 1.00 0.00 N ATOM 2138 NH2 ARG A 134 19.146 -2.701 -9.815 1.00 0.00 N ATOM 0 H ARG A 134 12.704 -4.030 -9.085 1.00 0.00 H new ATOM 0 HA ARG A 134 14.159 -5.638 -7.572 1.00 0.00 H new ATOM 0 HB2 ARG A 134 13.041 -2.936 -6.729 1.00 0.00 H new ATOM 0 HB3 ARG A 134 14.396 -3.725 -5.945 1.00 0.00 H new ATOM 0 HG2 ARG A 134 14.393 -3.084 -8.910 1.00 0.00 H new ATOM 0 HG3 ARG A 134 14.937 -1.935 -7.704 1.00 0.00 H new ATOM 0 HD2 ARG A 134 16.640 -3.532 -6.904 1.00 0.00 H new ATOM 0 HD3 ARG A 134 16.061 -4.747 -8.028 1.00 0.00 H new ATOM 0 HE ARG A 134 16.660 -2.711 -9.737 1.00 0.00 H new ATOM 0 HH11 ARG A 134 18.416 -4.148 -7.032 1.00 0.00 H new ATOM 0 HH12 ARG A 134 20.003 -3.802 -7.728 1.00 0.00 H new ATOM 0 HH21 ARG A 134 18.701 -2.273 -10.626 1.00 0.00 H new ATOM 0 HH22 ARG A 134 20.163 -2.744 -9.755 1.00 0.00 H new ATOM 2152 N PRO A 135 12.671 -6.934 -6.022 1.00 0.00 N ATOM 2153 CA PRO A 135 11.983 -7.681 -4.965 1.00 0.00 C ATOM 2154 C PRO A 135 12.540 -7.371 -3.580 1.00 0.00 C ATOM 2155 O PRO A 135 13.745 -7.180 -3.413 1.00 0.00 O ATOM 2156 CB PRO A 135 12.248 -9.142 -5.334 1.00 0.00 C ATOM 2157 CG PRO A 135 13.510 -9.111 -6.124 1.00 0.00 C ATOM 2158 CD PRO A 135 13.498 -7.806 -6.872 1.00 0.00 C ATOM 0 HA PRO A 135 10.925 -7.427 -4.908 1.00 0.00 H new ATOM 0 HB2 PRO A 135 12.354 -9.762 -4.444 1.00 0.00 H new ATOM 0 HB3 PRO A 135 11.426 -9.558 -5.917 1.00 0.00 H new ATOM 0 HG2 PRO A 135 14.381 -9.179 -5.472 1.00 0.00 H new ATOM 0 HG3 PRO A 135 13.561 -9.955 -6.812 1.00 0.00 H new ATOM 0 HD2 PRO A 135 14.504 -7.406 -6.999 1.00 0.00 H new ATOM 0 HD3 PRO A 135 13.071 -7.918 -7.869 1.00 0.00 H new ATOM 2166 N PHE A 136 11.656 -7.324 -2.588 1.00 0.00 N ATOM 2167 CA PHE A 136 12.060 -7.038 -1.217 1.00 0.00 C ATOM 2168 C PHE A 136 13.299 -7.843 -0.835 1.00 0.00 C ATOM 2169 O PHE A 136 13.596 -8.886 -1.418 1.00 0.00 O ATOM 2170 CB PHE A 136 10.917 -7.350 -0.250 1.00 0.00 C ATOM 2171 CG PHE A 136 9.892 -6.256 -0.160 1.00 0.00 C ATOM 2172 CD1 PHE A 136 10.063 -5.200 0.721 1.00 0.00 C ATOM 2173 CD2 PHE A 136 8.758 -6.283 -0.956 1.00 0.00 C ATOM 2174 CE1 PHE A 136 9.121 -4.192 0.806 1.00 0.00 C ATOM 2175 CE2 PHE A 136 7.813 -5.278 -0.875 1.00 0.00 C ATOM 2176 CZ PHE A 136 7.995 -4.230 0.007 1.00 0.00 C ATOM 0 H PHE A 136 10.655 -7.480 -2.709 1.00 0.00 H new ATOM 0 HA PHE A 136 12.303 -5.978 -1.151 1.00 0.00 H new ATOM 0 HB2 PHE A 136 10.427 -8.271 -0.565 1.00 0.00 H new ATOM 0 HB3 PHE A 136 11.330 -7.532 0.742 1.00 0.00 H new ATOM 0 HD1 PHE A 136 10.942 -5.164 1.348 1.00 0.00 H new ATOM 0 HD2 PHE A 136 8.611 -7.099 -1.648 1.00 0.00 H new ATOM 0 HE1 PHE A 136 9.265 -3.375 1.497 1.00 0.00 H new ATOM 0 HE2 PHE A 136 6.933 -5.312 -1.500 1.00 0.00 H new ATOM 0 HZ PHE A 136 7.259 -3.443 0.071 1.00 0.00 H new ATOM 2186 N PRO A 137 14.039 -7.349 0.168 1.00 0.00 N ATOM 2187 CA PRO A 137 15.258 -8.006 0.651 1.00 0.00 C ATOM 2188 C PRO A 137 14.961 -9.311 1.382 1.00 0.00 C ATOM 2189 O PRO A 137 15.869 -9.968 1.892 1.00 0.00 O ATOM 2190 CB PRO A 137 15.858 -6.978 1.613 1.00 0.00 C ATOM 2191 CG PRO A 137 14.696 -6.165 2.071 1.00 0.00 C ATOM 2192 CD PRO A 137 13.745 -6.111 0.908 1.00 0.00 C ATOM 0 HA PRO A 137 15.924 -8.283 -0.167 1.00 0.00 H new ATOM 0 HB2 PRO A 137 16.356 -7.464 2.452 1.00 0.00 H new ATOM 0 HB3 PRO A 137 16.604 -6.358 1.115 1.00 0.00 H new ATOM 0 HG2 PRO A 137 14.222 -6.618 2.942 1.00 0.00 H new ATOM 0 HG3 PRO A 137 15.011 -5.164 2.364 1.00 0.00 H new ATOM 0 HD2 PRO A 137 12.707 -6.078 1.239 1.00 0.00 H new ATOM 0 HD3 PRO A 137 13.912 -5.226 0.293 1.00 0.00 H new ATOM 2200 N SER A 138 13.686 -9.681 1.429 1.00 0.00 N ATOM 2201 CA SER A 138 13.270 -10.906 2.102 1.00 0.00 C ATOM 2202 C SER A 138 13.859 -12.132 1.410 1.00 0.00 C ATOM 2203 O SER A 138 13.932 -12.192 0.183 1.00 0.00 O ATOM 2204 CB SER A 138 11.743 -11.006 2.128 1.00 0.00 C ATOM 2205 OG SER A 138 11.202 -10.888 0.823 1.00 0.00 O ATOM 0 H SER A 138 12.923 -9.150 1.009 1.00 0.00 H new ATOM 0 HA SER A 138 13.642 -10.873 3.126 1.00 0.00 H new ATOM 0 HB2 SER A 138 11.445 -11.960 2.564 1.00 0.00 H new ATOM 0 HB3 SER A 138 11.335 -10.223 2.767 1.00 0.00 H new ATOM 0 HG SER A 138 10.225 -10.957 0.866 1.00 0.00 H new ATOM 2211 N GLY A 139 14.278 -13.110 2.208 1.00 0.00 N ATOM 2212 CA GLY A 139 14.856 -14.321 1.656 1.00 0.00 C ATOM 2213 C GLY A 139 13.816 -15.394 1.398 1.00 0.00 C ATOM 2214 O GLY A 139 12.654 -15.267 1.782 1.00 0.00 O ATOM 0 H GLY A 139 14.227 -13.085 3.226 1.00 0.00 H new ATOM 0 HA2 GLY A 139 15.368 -14.083 0.723 1.00 0.00 H new ATOM 0 HA3 GLY A 139 15.609 -14.707 2.343 1.00 0.00 H new ATOM 2218 N PRO A 140 14.234 -16.480 0.731 1.00 0.00 N ATOM 2219 CA PRO A 140 13.346 -17.600 0.406 1.00 0.00 C ATOM 2220 C PRO A 140 12.939 -18.395 1.642 1.00 0.00 C ATOM 2221 O PRO A 140 12.163 -19.346 1.553 1.00 0.00 O ATOM 2222 CB PRO A 140 14.192 -18.464 -0.531 1.00 0.00 C ATOM 2223 CG PRO A 140 15.602 -18.144 -0.171 1.00 0.00 C ATOM 2224 CD PRO A 140 15.606 -16.699 0.243 1.00 0.00 C ATOM 0 HA PRO A 140 12.409 -17.262 -0.035 1.00 0.00 H new ATOM 0 HB2 PRO A 140 13.979 -19.524 -0.393 1.00 0.00 H new ATOM 0 HB3 PRO A 140 13.988 -18.232 -1.576 1.00 0.00 H new ATOM 0 HG2 PRO A 140 15.952 -18.783 0.639 1.00 0.00 H new ATOM 0 HG3 PRO A 140 16.268 -18.309 -1.018 1.00 0.00 H new ATOM 0 HD2 PRO A 140 16.345 -16.506 1.021 1.00 0.00 H new ATOM 0 HD3 PRO A 140 15.845 -16.042 -0.593 1.00 0.00 H new ATOM 2232 N SER A 141 13.468 -17.999 2.796 1.00 0.00 N ATOM 2233 CA SER A 141 13.163 -18.677 4.050 1.00 0.00 C ATOM 2234 C SER A 141 11.821 -18.211 4.607 1.00 0.00 C ATOM 2235 O SER A 141 11.000 -19.021 5.038 1.00 0.00 O ATOM 2236 CB SER A 141 14.269 -18.421 5.075 1.00 0.00 C ATOM 2237 OG SER A 141 15.345 -19.327 4.901 1.00 0.00 O ATOM 0 H SER A 141 14.110 -17.212 2.888 1.00 0.00 H new ATOM 0 HA SER A 141 13.103 -19.747 3.850 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.631 -17.398 4.976 1.00 0.00 H new ATOM 0 HB3 SER A 141 13.865 -18.520 6.083 1.00 0.00 H new ATOM 0 HG SER A 141 16.040 -19.142 5.567 1.00 0.00 H new ATOM 2243 N SER A 142 11.605 -16.899 4.594 1.00 0.00 N ATOM 2244 CA SER A 142 10.365 -16.324 5.101 1.00 0.00 C ATOM 2245 C SER A 142 9.163 -17.162 4.675 1.00 0.00 C ATOM 2246 O SER A 142 9.109 -17.664 3.553 1.00 0.00 O ATOM 2247 CB SER A 142 10.203 -14.887 4.600 1.00 0.00 C ATOM 2248 OG SER A 142 11.185 -14.036 5.165 1.00 0.00 O ATOM 0 H SER A 142 12.273 -16.215 4.238 1.00 0.00 H new ATOM 0 HA SER A 142 10.414 -16.319 6.190 1.00 0.00 H new ATOM 0 HB2 SER A 142 10.282 -14.867 3.513 1.00 0.00 H new ATOM 0 HB3 SER A 142 9.209 -14.520 4.855 1.00 0.00 H new ATOM 0 HG SER A 142 11.061 -13.124 4.828 1.00 0.00 H new ATOM 2254 N GLY A 143 8.201 -17.308 5.580 1.00 0.00 N ATOM 2255 CA GLY A 143 7.013 -18.086 5.281 1.00 0.00 C ATOM 2256 C GLY A 143 7.041 -19.458 5.923 1.00 0.00 C ATOM 2257 O GLY A 143 6.155 -19.803 6.705 1.00 0.00 O ATOM 0 H GLY A 143 8.223 -16.901 6.515 1.00 0.00 H new ATOM 0 HA2 GLY A 143 6.132 -17.545 5.626 1.00 0.00 H new ATOM 0 HA3 GLY A 143 6.917 -18.196 4.201 1.00 0.00 H new TER 2261 GLY A 143