USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 967 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 94 LYS NZ :NH3+ 156:sc= -0.246 (180deg=-0.939) USER MOD Set 1.2: A 107 HIS : no HD1:sc= -1.65 K(o=-1.9,f=-0.64) USER MOD Set 2.1: A 97 ASN : amide:sc= 0.157 K(o=0.16,f=-1.7) USER MOD Set 2.2: A 135 GLN : amide:sc= 0 X(o=0.16,f=0.14) USER MOD Set 3.1: A 5 THR OG1 : rot 180:sc= 0.118 USER MOD Set 3.2: A 8 GLN : amide:sc= 0.121 X(o=0.24,f=0.36) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 77:sc= 0.00335 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -24:sc= 0.111 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0357 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 80:sc= 0.989 USER MOD Single : A 36 MET CE :methyl -111:sc= 0 (180deg=-0.0663) USER MOD Single : A 38 SER OG : rot 83:sc= 1.24 USER MOD Single : A 41 GLN : amide:sc=-0.00966 K(o=-0.0097,f=-0.91) USER MOD Single : A 42 ASN : amide:sc= -0.0315 X(o=-0.032,f=-0.032) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.0585 USER MOD Single : A 49 GLN : amide:sc= -0.142 K(o=-0.14,f=-2) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=-0.0077) USER MOD Single : A 60 ASN : amide:sc= -0.013 X(o=-0.013,f=-0.34) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl -151:sc= -0.482 (180deg=-2.9!) USER MOD Single : A 72 MET CE :methyl 156:sc= 0 (180deg=-0.171) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -71:sc= 0.175 USER MOD Single : A 109 MET CE :methyl 149:sc= -0.64 (180deg=-2.7!) USER MOD Single : A 110 THR OG1 : rot -65:sc= 0.53 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot -64:sc= 0.978 USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 137 ASN : amide:sc= 0.194 K(o=0.19,f=-1.7) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 144 MET CE :methyl -178:sc= 0 (180deg=-0.00867) USER MOD Single : A 145 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 58 N THR A 5 -14.027 18.993 1.225 1.00 0.00 N ATOM 59 CA THR A 5 -14.514 19.749 0.113 1.00 0.00 C ATOM 60 C THR A 5 -15.582 19.086 -0.687 1.00 0.00 C ATOM 61 O THR A 5 -15.813 17.892 -0.502 1.00 0.00 O ATOM 62 CB THR A 5 -13.458 20.107 -0.889 1.00 0.00 C ATOM 63 OG1 THR A 5 -12.689 19.005 -1.350 1.00 0.00 O ATOM 64 CG2 THR A 5 -12.385 20.971 -0.205 1.00 0.00 C ATOM 0 HA THR A 5 -14.907 20.628 0.625 1.00 0.00 H new ATOM 0 HB THR A 5 -14.010 20.575 -1.704 1.00 0.00 H new ATOM 0 HG1 THR A 5 -12.025 19.318 -1.999 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.614 21.235 -0.929 1.00 0.00 H new ATOM 0 HG22 THR A 5 -12.843 21.880 0.184 1.00 0.00 H new ATOM 0 HG23 THR A 5 -11.936 20.411 0.616 1.00 0.00 H new ATOM 72 N GLU A 6 -16.293 19.849 -1.536 1.00 0.00 N ATOM 73 CA GLU A 6 -17.485 19.267 -2.068 1.00 0.00 C ATOM 74 C GLU A 6 -17.203 18.229 -3.099 1.00 0.00 C ATOM 75 O GLU A 6 -17.904 17.237 -3.295 1.00 0.00 O ATOM 76 CB GLU A 6 -18.249 20.393 -2.785 1.00 0.00 C ATOM 77 CG GLU A 6 -18.903 21.418 -1.857 1.00 0.00 C ATOM 78 CD GLU A 6 -19.989 20.871 -0.942 1.00 0.00 C ATOM 79 OE1 GLU A 6 -21.014 20.347 -1.454 1.00 0.00 O ATOM 80 OE2 GLU A 6 -19.857 21.012 0.303 1.00 0.00 O ATOM 0 H GLU A 6 -16.068 20.797 -1.837 1.00 0.00 H new ATOM 0 HA GLU A 6 -18.035 18.805 -1.248 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -17.560 20.914 -3.450 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -19.021 19.947 -3.412 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -18.127 21.872 -1.241 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -19.332 22.213 -2.467 1.00 0.00 H new ATOM 87 N GLU A 7 -16.088 18.404 -3.831 1.00 0.00 N ATOM 88 CA GLU A 7 -15.658 17.470 -4.825 1.00 0.00 C ATOM 89 C GLU A 7 -15.013 16.229 -4.308 1.00 0.00 C ATOM 90 O GLU A 7 -14.840 15.262 -5.048 1.00 0.00 O ATOM 91 CB GLU A 7 -14.642 18.256 -5.670 1.00 0.00 C ATOM 92 CG GLU A 7 -13.552 18.975 -4.873 1.00 0.00 C ATOM 93 CD GLU A 7 -12.928 20.054 -5.746 1.00 0.00 C ATOM 94 OE1 GLU A 7 -13.484 21.176 -5.885 1.00 0.00 O ATOM 95 OE2 GLU A 7 -11.762 19.861 -6.183 1.00 0.00 O ATOM 0 H GLU A 7 -15.472 19.211 -3.730 1.00 0.00 H new ATOM 0 HA GLU A 7 -16.530 17.105 -5.367 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -14.165 17.569 -6.369 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -15.181 18.993 -6.265 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -13.975 19.418 -3.972 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -12.791 18.264 -4.551 1.00 0.00 H new ATOM 102 N GLN A 8 -14.638 16.239 -3.017 1.00 0.00 N ATOM 103 CA GLN A 8 -14.114 15.059 -2.403 1.00 0.00 C ATOM 104 C GLN A 8 -15.226 14.086 -2.212 1.00 0.00 C ATOM 105 O GLN A 8 -15.078 12.877 -2.384 1.00 0.00 O ATOM 106 CB GLN A 8 -13.478 15.274 -1.019 1.00 0.00 C ATOM 107 CG GLN A 8 -11.975 15.530 -1.152 1.00 0.00 C ATOM 108 CD GLN A 8 -11.407 15.824 0.229 1.00 0.00 C ATOM 109 OE1 GLN A 8 -11.196 15.067 1.175 1.00 0.00 O ATOM 110 NE2 GLN A 8 -10.986 17.108 0.384 1.00 0.00 N ATOM 0 H GLN A 8 -14.696 17.053 -2.405 1.00 0.00 H new ATOM 0 HA GLN A 8 -13.330 14.709 -3.074 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -13.954 16.119 -0.521 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -13.649 14.398 -0.394 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -11.481 14.661 -1.587 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -11.792 16.370 -1.823 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -11.131 17.786 -0.364 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -10.525 17.393 1.248 1.00 0.00 H new ATOM 119 N ILE A 9 -16.398 14.565 -1.759 1.00 0.00 N ATOM 120 CA ILE A 9 -17.635 13.901 -1.483 1.00 0.00 C ATOM 121 C ILE A 9 -18.362 13.424 -2.693 1.00 0.00 C ATOM 122 O ILE A 9 -18.863 12.301 -2.738 1.00 0.00 O ATOM 123 CB ILE A 9 -18.488 14.858 -0.705 1.00 0.00 C ATOM 124 CG1 ILE A 9 -17.830 15.190 0.645 1.00 0.00 C ATOM 125 CG2 ILE A 9 -19.906 14.289 -0.528 1.00 0.00 C ATOM 126 CD1 ILE A 9 -18.534 16.366 1.322 1.00 0.00 C ATOM 0 H ILE A 9 -16.484 15.562 -1.559 1.00 0.00 H new ATOM 0 HA ILE A 9 -17.412 12.995 -0.920 1.00 0.00 H new ATOM 0 HB ILE A 9 -18.576 15.790 -1.263 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -17.866 14.316 1.296 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -16.778 15.430 0.492 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -20.513 14.995 0.039 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -20.357 14.126 -1.507 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -19.854 13.342 0.010 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -18.050 16.581 2.275 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -18.475 17.244 0.679 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -19.580 16.113 1.496 1.00 0.00 H new ATOM 138 N ALA A 10 -18.341 14.229 -3.770 1.00 0.00 N ATOM 139 CA ALA A 10 -18.773 13.933 -5.100 1.00 0.00 C ATOM 140 C ALA A 10 -18.085 12.710 -5.602 1.00 0.00 C ATOM 141 O ALA A 10 -18.707 11.774 -6.103 1.00 0.00 O ATOM 142 CB ALA A 10 -18.461 15.102 -6.049 1.00 0.00 C ATOM 0 H ALA A 10 -17.985 15.182 -3.699 1.00 0.00 H new ATOM 0 HA ALA A 10 -19.850 13.770 -5.074 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -18.799 14.854 -7.055 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -18.976 15.998 -5.704 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -17.386 15.284 -6.061 1.00 0.00 H new ATOM 148 N GLU A 11 -16.742 12.638 -5.594 1.00 0.00 N ATOM 149 CA GLU A 11 -16.080 11.512 -6.176 1.00 0.00 C ATOM 150 C GLU A 11 -16.382 10.258 -5.429 1.00 0.00 C ATOM 151 O GLU A 11 -16.691 9.239 -6.045 1.00 0.00 O ATOM 152 CB GLU A 11 -14.573 11.762 -6.356 1.00 0.00 C ATOM 153 CG GLU A 11 -14.218 12.739 -7.478 1.00 0.00 C ATOM 154 CD GLU A 11 -12.734 12.700 -7.814 1.00 0.00 C ATOM 155 OE1 GLU A 11 -11.848 13.027 -6.979 1.00 0.00 O ATOM 156 OE2 GLU A 11 -12.349 12.192 -8.900 1.00 0.00 O ATOM 0 H GLU A 11 -16.125 13.344 -5.193 1.00 0.00 H new ATOM 0 HA GLU A 11 -16.479 11.374 -7.181 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -14.167 12.143 -5.419 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -14.081 10.809 -6.553 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -14.799 12.497 -8.368 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -14.497 13.750 -7.181 1.00 0.00 H new ATOM 163 N PHE A 12 -16.515 10.396 -4.098 1.00 0.00 N ATOM 164 CA PHE A 12 -16.704 9.293 -3.208 1.00 0.00 C ATOM 165 C PHE A 12 -18.055 8.695 -3.401 1.00 0.00 C ATOM 166 O PHE A 12 -18.243 7.485 -3.521 1.00 0.00 O ATOM 167 CB PHE A 12 -16.510 9.610 -1.716 1.00 0.00 C ATOM 168 CG PHE A 12 -15.096 9.697 -1.255 1.00 0.00 C ATOM 169 CD1 PHE A 12 -14.076 8.853 -1.628 1.00 0.00 C ATOM 170 CD2 PHE A 12 -14.856 10.692 -0.337 1.00 0.00 C ATOM 171 CE1 PHE A 12 -12.826 9.021 -1.079 1.00 0.00 C ATOM 172 CE2 PHE A 12 -13.592 10.965 0.130 1.00 0.00 C ATOM 173 CZ PHE A 12 -12.588 10.133 -0.306 1.00 0.00 C ATOM 0 H PHE A 12 -16.490 11.301 -3.627 1.00 0.00 H new ATOM 0 HA PHE A 12 -15.914 8.591 -3.474 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -17.004 10.557 -1.497 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -17.018 8.843 -1.131 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -14.255 8.066 -2.345 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -15.687 11.278 0.029 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -12.047 8.294 -1.252 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -13.398 11.788 0.802 1.00 0.00 H new ATOM 0 HZ PHE A 12 -11.569 10.363 -0.030 1.00 0.00 H new ATOM 183 N LYS A 13 -19.052 9.582 -3.567 1.00 0.00 N ATOM 184 CA LYS A 13 -20.415 9.192 -3.750 1.00 0.00 C ATOM 185 C LYS A 13 -20.566 8.668 -5.136 1.00 0.00 C ATOM 186 O LYS A 13 -21.366 7.789 -5.455 1.00 0.00 O ATOM 187 CB LYS A 13 -21.462 10.282 -3.465 1.00 0.00 C ATOM 188 CG LYS A 13 -22.923 9.851 -3.323 1.00 0.00 C ATOM 189 CD LYS A 13 -23.879 11.044 -3.258 1.00 0.00 C ATOM 190 CE LYS A 13 -23.900 11.754 -1.902 1.00 0.00 C ATOM 191 NZ LYS A 13 -24.735 12.975 -1.866 1.00 0.00 N ATOM 0 H LYS A 13 -18.908 10.592 -3.574 1.00 0.00 H new ATOM 0 HA LYS A 13 -20.623 8.428 -3.001 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -21.173 10.791 -2.546 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -21.407 11.017 -4.268 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -23.195 9.216 -4.166 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -23.035 9.249 -2.421 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -23.599 11.763 -4.028 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -24.887 10.702 -3.493 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -24.263 11.058 -1.146 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -22.879 12.018 -1.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -24.695 13.395 -0.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -24.378 13.660 -2.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -25.719 12.729 -2.095 1.00 0.00 H new ATOM 205 N GLU A 14 -19.812 9.136 -6.147 1.00 0.00 N ATOM 206 CA GLU A 14 -19.738 8.467 -7.408 1.00 0.00 C ATOM 207 C GLU A 14 -19.227 7.070 -7.314 1.00 0.00 C ATOM 208 O GLU A 14 -19.803 6.107 -7.817 1.00 0.00 O ATOM 209 CB GLU A 14 -19.022 9.419 -8.380 1.00 0.00 C ATOM 210 CG GLU A 14 -18.755 8.811 -9.758 1.00 0.00 C ATOM 211 CD GLU A 14 -18.527 9.816 -10.878 1.00 0.00 C ATOM 212 OE1 GLU A 14 -19.490 10.566 -11.191 1.00 0.00 O ATOM 213 OE2 GLU A 14 -17.448 9.790 -11.529 1.00 0.00 O ATOM 0 H GLU A 14 -19.249 9.985 -6.089 1.00 0.00 H new ATOM 0 HA GLU A 14 -20.729 8.271 -7.818 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -19.624 10.319 -8.501 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -18.074 9.727 -7.939 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -17.880 8.164 -9.689 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -19.600 8.177 -10.027 1.00 0.00 H new ATOM 220 N ALA A 15 -18.094 6.891 -6.613 1.00 0.00 N ATOM 221 CA ALA A 15 -17.508 5.612 -6.357 1.00 0.00 C ATOM 222 C ALA A 15 -18.425 4.677 -5.646 1.00 0.00 C ATOM 223 O ALA A 15 -18.397 3.461 -5.826 1.00 0.00 O ATOM 224 CB ALA A 15 -16.137 5.767 -5.678 1.00 0.00 C ATOM 0 H ALA A 15 -17.566 7.665 -6.209 1.00 0.00 H new ATOM 0 HA ALA A 15 -17.334 5.133 -7.320 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -15.709 4.782 -5.492 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -15.471 6.335 -6.328 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -16.257 6.294 -4.732 1.00 0.00 H new ATOM 230 N PHE A 16 -19.234 5.209 -4.712 1.00 0.00 N ATOM 231 CA PHE A 16 -20.129 4.391 -3.952 1.00 0.00 C ATOM 232 C PHE A 16 -21.139 3.681 -4.785 1.00 0.00 C ATOM 233 O PHE A 16 -21.328 2.472 -4.652 1.00 0.00 O ATOM 234 CB PHE A 16 -20.815 5.347 -2.962 1.00 0.00 C ATOM 235 CG PHE A 16 -21.704 4.682 -1.968 1.00 0.00 C ATOM 236 CD1 PHE A 16 -22.995 4.371 -2.326 1.00 0.00 C ATOM 237 CD2 PHE A 16 -21.216 4.335 -0.730 1.00 0.00 C ATOM 238 CE1 PHE A 16 -23.770 3.657 -1.443 1.00 0.00 C ATOM 239 CE2 PHE A 16 -22.040 3.733 0.192 1.00 0.00 C ATOM 240 CZ PHE A 16 -23.249 3.241 -0.240 1.00 0.00 C ATOM 0 H PHE A 16 -19.269 6.202 -4.483 1.00 0.00 H new ATOM 0 HA PHE A 16 -19.575 3.595 -3.456 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -20.047 5.905 -2.426 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -21.402 6.072 -3.526 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -23.392 4.681 -3.281 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -20.184 4.535 -0.481 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -24.793 3.422 -1.695 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -21.745 3.649 1.228 1.00 0.00 H new ATOM 0 HZ PHE A 16 -23.789 2.528 0.365 1.00 0.00 H new ATOM 250 N SER A 17 -21.721 4.479 -5.698 1.00 0.00 N ATOM 251 CA SER A 17 -22.724 3.985 -6.589 1.00 0.00 C ATOM 252 C SER A 17 -22.164 2.998 -7.554 1.00 0.00 C ATOM 253 O SER A 17 -22.874 2.182 -8.141 1.00 0.00 O ATOM 254 CB SER A 17 -23.487 5.053 -7.390 1.00 0.00 C ATOM 255 OG SER A 17 -23.989 5.937 -6.398 1.00 0.00 O ATOM 0 H SER A 17 -21.497 5.467 -5.819 1.00 0.00 H new ATOM 0 HA SER A 17 -23.442 3.518 -5.915 1.00 0.00 H new ATOM 0 HB2 SER A 17 -22.831 5.571 -8.090 1.00 0.00 H new ATOM 0 HB3 SER A 17 -24.293 4.612 -7.976 1.00 0.00 H new ATOM 0 HG SER A 17 -23.264 6.512 -6.075 1.00 0.00 H new ATOM 261 N LEU A 18 -20.857 2.990 -7.875 1.00 0.00 N ATOM 262 CA LEU A 18 -20.335 1.911 -8.655 1.00 0.00 C ATOM 263 C LEU A 18 -20.219 0.615 -7.929 1.00 0.00 C ATOM 264 O LEU A 18 -20.132 -0.445 -8.547 1.00 0.00 O ATOM 265 CB LEU A 18 -18.932 2.320 -9.133 1.00 0.00 C ATOM 266 CG LEU A 18 -19.034 3.447 -10.175 1.00 0.00 C ATOM 267 CD1 LEU A 18 -17.716 4.221 -10.346 1.00 0.00 C ATOM 268 CD2 LEU A 18 -19.434 2.816 -11.519 1.00 0.00 C ATOM 0 H LEU A 18 -20.181 3.705 -7.605 1.00 0.00 H new ATOM 0 HA LEU A 18 -21.040 1.741 -9.469 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -18.333 2.652 -8.285 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -18.422 1.459 -9.566 1.00 0.00 H new ATOM 0 HG LEU A 18 -19.778 4.165 -9.830 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -17.848 5.003 -11.093 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -17.433 4.672 -9.395 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -16.932 3.537 -10.671 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -19.514 3.595 -12.277 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -18.677 2.092 -11.821 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -20.395 2.313 -11.413 1.00 0.00 H new ATOM 280 N PHE A 19 -20.393 0.622 -6.596 1.00 0.00 N ATOM 281 CA PHE A 19 -20.543 -0.614 -5.893 1.00 0.00 C ATOM 282 C PHE A 19 -21.947 -1.017 -5.595 1.00 0.00 C ATOM 283 O PHE A 19 -22.259 -2.207 -5.604 1.00 0.00 O ATOM 284 CB PHE A 19 -19.840 -0.643 -4.525 1.00 0.00 C ATOM 285 CG PHE A 19 -18.357 -0.720 -4.636 1.00 0.00 C ATOM 286 CD1 PHE A 19 -17.744 -1.893 -5.007 1.00 0.00 C ATOM 287 CD2 PHE A 19 -17.612 0.316 -4.123 1.00 0.00 C ATOM 288 CE1 PHE A 19 -16.370 -1.907 -5.043 1.00 0.00 C ATOM 289 CE2 PHE A 19 -16.237 0.300 -4.141 1.00 0.00 C ATOM 290 CZ PHE A 19 -15.623 -0.831 -4.625 1.00 0.00 C ATOM 0 H PHE A 19 -20.429 1.460 -6.016 1.00 0.00 H new ATOM 0 HA PHE A 19 -20.089 -1.301 -6.607 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -20.111 0.251 -3.964 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -20.201 -1.499 -3.955 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -18.320 -2.771 -5.261 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -18.121 1.166 -3.694 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -15.863 -2.787 -5.410 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -15.662 1.143 -3.789 1.00 0.00 H new ATOM 0 HZ PHE A 19 -14.545 -0.875 -4.677 1.00 0.00 H new ATOM 300 N ASP A 20 -22.837 -0.060 -5.278 1.00 0.00 N ATOM 301 CA ASP A 20 -24.222 -0.342 -5.061 1.00 0.00 C ATOM 302 C ASP A 20 -24.974 -0.705 -6.295 1.00 0.00 C ATOM 303 O ASP A 20 -25.213 0.098 -7.195 1.00 0.00 O ATOM 304 CB ASP A 20 -24.967 0.814 -4.372 1.00 0.00 C ATOM 305 CG ASP A 20 -26.211 0.398 -3.601 1.00 0.00 C ATOM 306 OD1 ASP A 20 -26.669 -0.767 -3.455 1.00 0.00 O ATOM 307 OD2 ASP A 20 -26.844 1.375 -3.119 1.00 0.00 O ATOM 0 H ASP A 20 -22.592 0.924 -5.171 1.00 0.00 H new ATOM 0 HA ASP A 20 -24.197 -1.212 -4.405 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -24.282 1.313 -3.687 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -25.252 1.546 -5.128 1.00 0.00 H new ATOM 312 N LYS A 21 -25.304 -2.006 -6.371 1.00 0.00 N ATOM 313 CA LYS A 21 -25.818 -2.610 -7.560 1.00 0.00 C ATOM 314 C LYS A 21 -27.284 -2.397 -7.717 1.00 0.00 C ATOM 315 O LYS A 21 -27.669 -1.821 -8.734 1.00 0.00 O ATOM 316 CB LYS A 21 -25.648 -4.134 -7.432 1.00 0.00 C ATOM 317 CG LYS A 21 -25.864 -4.891 -8.744 1.00 0.00 C ATOM 318 CD LYS A 21 -24.561 -5.039 -9.532 1.00 0.00 C ATOM 319 CE LYS A 21 -24.735 -5.426 -11.003 1.00 0.00 C ATOM 320 NZ LYS A 21 -23.551 -5.061 -11.812 1.00 0.00 N ATOM 0 H LYS A 21 -25.211 -2.653 -5.588 1.00 0.00 H new ATOM 0 HA LYS A 21 -25.284 -2.169 -8.401 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -24.646 -4.349 -7.060 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -26.351 -4.508 -6.688 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -26.275 -5.878 -8.531 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -26.599 -4.364 -9.352 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -24.015 -4.097 -9.482 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -23.943 -5.793 -9.044 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -24.909 -6.499 -11.078 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -25.618 -4.931 -11.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -23.708 -5.339 -12.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -23.399 -4.033 -11.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -22.713 -5.553 -11.442 1.00 0.00 H new ATOM 334 N ASP A 22 -28.028 -2.804 -6.673 1.00 0.00 N ATOM 335 CA ASP A 22 -29.451 -2.664 -6.638 1.00 0.00 C ATOM 336 C ASP A 22 -29.954 -1.268 -6.505 1.00 0.00 C ATOM 337 O ASP A 22 -31.016 -0.868 -6.981 1.00 0.00 O ATOM 338 CB ASP A 22 -30.067 -3.513 -5.513 1.00 0.00 C ATOM 339 CG ASP A 22 -29.160 -4.047 -4.413 1.00 0.00 C ATOM 340 OD1 ASP A 22 -28.552 -3.121 -3.813 1.00 0.00 O ATOM 341 OD2 ASP A 22 -29.147 -5.257 -4.060 1.00 0.00 O ATOM 0 H ASP A 22 -27.634 -3.238 -5.838 1.00 0.00 H new ATOM 0 HA ASP A 22 -29.767 -3.018 -7.619 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -30.845 -2.916 -5.038 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -30.560 -4.367 -5.977 1.00 0.00 H new ATOM 346 N GLY A 23 -29.170 -0.452 -5.778 1.00 0.00 N ATOM 347 CA GLY A 23 -29.494 0.916 -5.514 1.00 0.00 C ATOM 348 C GLY A 23 -30.264 1.048 -4.246 1.00 0.00 C ATOM 349 O GLY A 23 -31.179 1.868 -4.194 1.00 0.00 O ATOM 0 H GLY A 23 -28.288 -0.751 -5.363 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -28.579 1.504 -5.450 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -30.077 1.321 -6.341 1.00 0.00 H new ATOM 353 N ASP A 24 -29.844 0.392 -3.149 1.00 0.00 N ATOM 354 CA ASP A 24 -30.503 0.462 -1.882 1.00 0.00 C ATOM 355 C ASP A 24 -29.973 1.577 -1.047 1.00 0.00 C ATOM 356 O ASP A 24 -30.683 2.107 -0.194 1.00 0.00 O ATOM 357 CB ASP A 24 -30.609 -0.895 -1.167 1.00 0.00 C ATOM 358 CG ASP A 24 -29.315 -1.597 -0.780 1.00 0.00 C ATOM 359 OD1 ASP A 24 -28.215 -1.007 -0.952 1.00 0.00 O ATOM 360 OD2 ASP A 24 -29.358 -2.773 -0.331 1.00 0.00 O ATOM 0 H ASP A 24 -29.018 -0.207 -3.144 1.00 0.00 H new ATOM 0 HA ASP A 24 -31.545 0.718 -2.076 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -31.196 -0.750 -0.260 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -31.176 -1.569 -1.809 1.00 0.00 H new ATOM 365 N GLY A 25 -28.714 1.982 -1.293 1.00 0.00 N ATOM 366 CA GLY A 25 -27.981 2.868 -0.442 1.00 0.00 C ATOM 367 C GLY A 25 -26.894 2.209 0.335 1.00 0.00 C ATOM 368 O GLY A 25 -26.192 2.944 1.028 1.00 0.00 O ATOM 0 H GLY A 25 -28.188 1.682 -2.114 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -27.548 3.662 -1.050 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -28.674 3.341 0.254 1.00 0.00 H new ATOM 372 N THR A 26 -26.749 0.873 0.286 1.00 0.00 N ATOM 373 CA THR A 26 -25.771 0.166 1.053 1.00 0.00 C ATOM 374 C THR A 26 -24.945 -0.763 0.231 1.00 0.00 C ATOM 375 O THR A 26 -25.240 -1.149 -0.899 1.00 0.00 O ATOM 376 CB THR A 26 -26.268 -0.688 2.181 1.00 0.00 C ATOM 377 OG1 THR A 26 -26.932 -1.876 1.774 1.00 0.00 O ATOM 378 CG2 THR A 26 -27.245 0.048 3.113 1.00 0.00 C ATOM 0 H THR A 26 -27.325 0.270 -0.301 1.00 0.00 H new ATOM 0 HA THR A 26 -25.214 1.010 1.459 1.00 0.00 H new ATOM 0 HB THR A 26 -25.343 -0.942 2.700 1.00 0.00 H new ATOM 0 HG1 THR A 26 -27.285 -1.759 0.867 1.00 0.00 H new ATOM 0 HG21 THR A 26 -27.567 -0.625 3.908 1.00 0.00 H new ATOM 0 HG22 THR A 26 -26.748 0.914 3.550 1.00 0.00 H new ATOM 0 HG23 THR A 26 -28.113 0.378 2.543 1.00 0.00 H new ATOM 386 N ILE A 27 -23.701 -1.038 0.662 1.00 0.00 N ATOM 387 CA ILE A 27 -22.808 -1.943 0.008 1.00 0.00 C ATOM 388 C ILE A 27 -22.748 -3.106 0.937 1.00 0.00 C ATOM 389 O ILE A 27 -22.417 -3.029 2.118 1.00 0.00 O ATOM 390 CB ILE A 27 -21.414 -1.483 -0.302 1.00 0.00 C ATOM 391 CG1 ILE A 27 -21.273 -0.063 -0.876 1.00 0.00 C ATOM 392 CG2 ILE A 27 -21.068 -2.386 -1.497 1.00 0.00 C ATOM 393 CD1 ILE A 27 -19.851 0.495 -0.878 1.00 0.00 C ATOM 0 H ILE A 27 -23.302 -0.613 1.499 1.00 0.00 H new ATOM 0 HA ILE A 27 -23.202 -2.125 -0.992 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.821 -1.511 0.612 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -21.649 -0.062 -1.899 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -21.910 0.610 -0.302 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -20.058 -2.162 -1.842 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -21.124 -3.431 -1.192 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -21.776 -2.206 -2.306 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -19.855 1.500 -1.301 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -19.474 0.533 0.144 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -19.208 -0.149 -1.478 1.00 0.00 H new ATOM 405 N THR A 28 -23.080 -4.289 0.389 1.00 0.00 N ATOM 406 CA THR A 28 -22.910 -5.557 1.028 1.00 0.00 C ATOM 407 C THR A 28 -21.585 -6.147 0.689 1.00 0.00 C ATOM 408 O THR A 28 -20.823 -5.738 -0.185 1.00 0.00 O ATOM 409 CB THR A 28 -24.061 -6.471 0.730 1.00 0.00 C ATOM 410 OG1 THR A 28 -23.959 -6.785 -0.652 1.00 0.00 O ATOM 411 CG2 THR A 28 -25.460 -5.875 0.961 1.00 0.00 C ATOM 0 H THR A 28 -23.486 -4.364 -0.544 1.00 0.00 H new ATOM 0 HA THR A 28 -22.914 -5.410 2.108 1.00 0.00 H new ATOM 0 HB THR A 28 -23.984 -7.318 1.411 1.00 0.00 H new ATOM 0 HG1 THR A 28 -24.690 -7.386 -0.906 1.00 0.00 H new ATOM 0 HG21 THR A 28 -26.218 -6.619 0.715 1.00 0.00 H new ATOM 0 HG22 THR A 28 -25.563 -5.583 2.006 1.00 0.00 H new ATOM 0 HG23 THR A 28 -25.592 -4.999 0.325 1.00 0.00 H new ATOM 419 N THR A 29 -21.246 -7.222 1.424 1.00 0.00 N ATOM 420 CA THR A 29 -20.003 -7.905 1.238 1.00 0.00 C ATOM 421 C THR A 29 -20.027 -8.682 -0.033 1.00 0.00 C ATOM 422 O THR A 29 -18.993 -8.859 -0.675 1.00 0.00 O ATOM 423 CB THR A 29 -19.759 -8.951 2.285 1.00 0.00 C ATOM 424 OG1 THR A 29 -20.875 -9.796 2.521 1.00 0.00 O ATOM 425 CG2 THR A 29 -19.281 -8.203 3.541 1.00 0.00 C ATOM 0 H THR A 29 -21.838 -7.621 2.153 1.00 0.00 H new ATOM 0 HA THR A 29 -19.243 -7.125 1.264 1.00 0.00 H new ATOM 0 HB THR A 29 -18.998 -9.653 1.945 1.00 0.00 H new ATOM 0 HG1 THR A 29 -20.647 -10.453 3.211 1.00 0.00 H new ATOM 0 HG21 THR A 29 -19.087 -8.919 4.339 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.365 -7.657 3.313 1.00 0.00 H new ATOM 0 HG23 THR A 29 -20.051 -7.501 3.862 1.00 0.00 H new ATOM 433 N LYS A 30 -21.224 -9.076 -0.503 1.00 0.00 N ATOM 434 CA LYS A 30 -21.370 -9.666 -1.798 1.00 0.00 C ATOM 435 C LYS A 30 -21.006 -8.696 -2.869 1.00 0.00 C ATOM 436 O LYS A 30 -20.349 -9.035 -3.852 1.00 0.00 O ATOM 437 CB LYS A 30 -22.761 -10.321 -1.839 1.00 0.00 C ATOM 438 CG LYS A 30 -22.942 -11.216 -3.066 1.00 0.00 C ATOM 439 CD LYS A 30 -24.403 -11.667 -3.122 1.00 0.00 C ATOM 440 CE LYS A 30 -24.726 -12.656 -4.243 1.00 0.00 C ATOM 441 NZ LYS A 30 -26.174 -12.960 -4.198 1.00 0.00 N ATOM 0 H LYS A 30 -22.096 -8.985 0.018 1.00 0.00 H new ATOM 0 HA LYS A 30 -20.665 -10.472 -2.000 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -22.909 -10.912 -0.935 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -23.526 -9.545 -1.841 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -22.677 -10.674 -3.974 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -22.280 -12.080 -3.006 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -24.665 -12.123 -2.167 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -25.036 -10.787 -3.239 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -24.458 -12.232 -5.211 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -24.143 -13.569 -4.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -26.411 -13.632 -4.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -26.412 -13.378 -3.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -26.717 -12.083 -4.331 1.00 0.00 H new ATOM 455 N GLU A 31 -21.533 -7.463 -2.767 1.00 0.00 N ATOM 456 CA GLU A 31 -21.298 -6.432 -3.730 1.00 0.00 C ATOM 457 C GLU A 31 -19.845 -6.113 -3.817 1.00 0.00 C ATOM 458 O GLU A 31 -19.266 -6.011 -4.898 1.00 0.00 O ATOM 459 CB GLU A 31 -22.200 -5.251 -3.334 1.00 0.00 C ATOM 460 CG GLU A 31 -23.694 -5.354 -3.648 1.00 0.00 C ATOM 461 CD GLU A 31 -24.649 -4.275 -3.157 1.00 0.00 C ATOM 462 OE1 GLU A 31 -24.650 -3.927 -1.946 1.00 0.00 O ATOM 463 OE2 GLU A 31 -25.439 -3.745 -3.984 1.00 0.00 O ATOM 0 H GLU A 31 -22.137 -7.175 -1.997 1.00 0.00 H new ATOM 0 HA GLU A 31 -21.559 -6.735 -4.744 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -22.094 -5.095 -2.260 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -21.816 -4.357 -3.826 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -23.795 -5.408 -4.732 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -24.045 -6.305 -3.247 1.00 0.00 H new ATOM 470 N LEU A 32 -19.146 -6.037 -2.671 1.00 0.00 N ATOM 471 CA LEU A 32 -17.735 -5.833 -2.557 1.00 0.00 C ATOM 472 C LEU A 32 -16.971 -6.928 -3.219 1.00 0.00 C ATOM 473 O LEU A 32 -16.239 -6.717 -4.185 1.00 0.00 O ATOM 474 CB LEU A 32 -17.151 -5.796 -1.135 1.00 0.00 C ATOM 475 CG LEU A 32 -17.403 -4.586 -0.221 1.00 0.00 C ATOM 476 CD1 LEU A 32 -16.583 -4.715 1.074 1.00 0.00 C ATOM 477 CD2 LEU A 32 -17.115 -3.229 -0.886 1.00 0.00 C ATOM 0 H LEU A 32 -19.599 -6.124 -1.761 1.00 0.00 H new ATOM 0 HA LEU A 32 -17.627 -4.851 -3.018 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -17.521 -6.678 -0.612 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -16.071 -5.910 -1.227 1.00 0.00 H new ATOM 0 HG LEU A 32 -18.470 -4.599 0.002 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -16.771 -3.851 1.712 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.874 -5.624 1.600 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -15.522 -4.761 0.830 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -17.317 -2.426 -0.177 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.070 -3.188 -1.192 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -17.754 -3.110 -1.761 1.00 0.00 H new ATOM 489 N GLY A 33 -17.254 -8.174 -2.801 1.00 0.00 N ATOM 490 CA GLY A 33 -16.541 -9.326 -3.261 1.00 0.00 C ATOM 491 C GLY A 33 -16.653 -9.493 -4.737 1.00 0.00 C ATOM 492 O GLY A 33 -15.646 -9.894 -5.318 1.00 0.00 O ATOM 0 H GLY A 33 -17.993 -8.386 -2.130 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -15.491 -9.238 -2.984 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -16.928 -10.216 -2.764 1.00 0.00 H new ATOM 496 N THR A 34 -17.792 -9.131 -5.354 1.00 0.00 N ATOM 497 CA THR A 34 -18.177 -9.324 -6.718 1.00 0.00 C ATOM 498 C THR A 34 -17.526 -8.300 -7.582 1.00 0.00 C ATOM 499 O THR A 34 -17.009 -8.601 -8.656 1.00 0.00 O ATOM 500 CB THR A 34 -19.656 -9.315 -6.971 1.00 0.00 C ATOM 501 OG1 THR A 34 -20.314 -10.370 -6.285 1.00 0.00 O ATOM 502 CG2 THR A 34 -19.992 -9.472 -8.463 1.00 0.00 C ATOM 0 H THR A 34 -18.525 -8.648 -4.834 1.00 0.00 H new ATOM 0 HA THR A 34 -17.838 -10.330 -6.967 1.00 0.00 H new ATOM 0 HB THR A 34 -20.002 -8.347 -6.608 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.445 -10.119 -5.347 1.00 0.00 H new ATOM 0 HG21 THR A 34 -21.074 -9.460 -8.596 1.00 0.00 H new ATOM 0 HG22 THR A 34 -19.548 -8.650 -9.024 1.00 0.00 H new ATOM 0 HG23 THR A 34 -19.593 -10.418 -8.828 1.00 0.00 H new ATOM 510 N VAL A 35 -17.362 -7.075 -7.052 1.00 0.00 N ATOM 511 CA VAL A 35 -16.644 -6.057 -7.755 1.00 0.00 C ATOM 512 C VAL A 35 -15.169 -6.232 -7.634 1.00 0.00 C ATOM 513 O VAL A 35 -14.417 -6.067 -8.593 1.00 0.00 O ATOM 514 CB VAL A 35 -17.160 -4.656 -7.606 1.00 0.00 C ATOM 515 CG1 VAL A 35 -16.231 -3.717 -8.395 1.00 0.00 C ATOM 516 CG2 VAL A 35 -18.595 -4.793 -8.142 1.00 0.00 C ATOM 0 H VAL A 35 -17.724 -6.790 -6.142 1.00 0.00 H new ATOM 0 HA VAL A 35 -16.870 -6.221 -8.809 1.00 0.00 H new ATOM 0 HB VAL A 35 -17.175 -4.226 -6.605 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -16.586 -2.691 -8.302 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -15.219 -3.788 -7.997 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -16.229 -4.006 -9.446 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -19.097 -3.827 -8.090 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -18.566 -5.132 -9.178 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -19.141 -5.518 -7.538 1.00 0.00 H new ATOM 526 N MET A 36 -14.652 -6.597 -6.448 1.00 0.00 N ATOM 527 CA MET A 36 -13.256 -6.793 -6.208 1.00 0.00 C ATOM 528 C MET A 36 -12.731 -7.903 -7.053 1.00 0.00 C ATOM 529 O MET A 36 -11.740 -7.817 -7.777 1.00 0.00 O ATOM 530 CB MET A 36 -12.859 -7.197 -4.778 1.00 0.00 C ATOM 531 CG MET A 36 -12.764 -5.984 -3.852 1.00 0.00 C ATOM 532 SD MET A 36 -13.165 -6.363 -2.120 1.00 0.00 S ATOM 533 CE MET A 36 -11.781 -7.474 -1.735 1.00 0.00 C ATOM 0 H MET A 36 -15.229 -6.762 -5.623 1.00 0.00 H new ATOM 0 HA MET A 36 -12.842 -5.809 -6.428 1.00 0.00 H new ATOM 0 HB2 MET A 36 -13.592 -7.900 -4.382 1.00 0.00 H new ATOM 0 HB3 MET A 36 -11.900 -7.714 -4.799 1.00 0.00 H new ATOM 0 HG2 MET A 36 -11.754 -5.576 -3.902 1.00 0.00 H new ATOM 0 HG3 MET A 36 -13.439 -5.208 -4.212 1.00 0.00 H new ATOM 0 HE1 MET A 36 -12.156 -8.489 -1.601 1.00 0.00 H new ATOM 0 HE2 MET A 36 -11.063 -7.458 -2.555 1.00 0.00 H new ATOM 0 HE3 MET A 36 -11.293 -7.143 -0.818 1.00 0.00 H new ATOM 543 N ARG A 37 -13.390 -9.074 -7.027 1.00 0.00 N ATOM 544 CA ARG A 37 -13.135 -10.164 -7.916 1.00 0.00 C ATOM 545 C ARG A 37 -13.146 -9.807 -9.363 1.00 0.00 C ATOM 546 O ARG A 37 -12.363 -10.347 -10.143 1.00 0.00 O ATOM 547 CB ARG A 37 -14.136 -11.326 -7.797 1.00 0.00 C ATOM 548 CG ARG A 37 -13.762 -12.629 -8.506 1.00 0.00 C ATOM 549 CD ARG A 37 -14.827 -13.726 -8.467 1.00 0.00 C ATOM 550 NE ARG A 37 -14.848 -14.218 -7.061 1.00 0.00 N ATOM 551 CZ ARG A 37 -15.780 -13.897 -6.117 1.00 0.00 C ATOM 552 NH1 ARG A 37 -17.003 -13.412 -6.479 1.00 0.00 N ATOM 553 NH2 ARG A 37 -15.595 -14.184 -4.795 1.00 0.00 N ATOM 0 H ARG A 37 -14.134 -9.270 -6.357 1.00 0.00 H new ATOM 0 HA ARG A 37 -12.137 -10.458 -7.592 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -14.281 -11.544 -6.739 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -15.096 -10.989 -8.188 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -13.535 -12.404 -9.548 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -12.848 -13.018 -8.057 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -15.802 -13.336 -8.760 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -14.585 -14.532 -9.160 1.00 0.00 H new ATOM 0 HE ARG A 37 -14.100 -14.851 -6.779 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -17.230 -13.285 -7.465 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -17.690 -13.176 -5.763 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -14.741 -14.651 -4.489 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -16.310 -13.931 -4.113 1.00 0.00 H new ATOM 567 N SER A 38 -14.088 -8.938 -9.770 1.00 0.00 N ATOM 568 CA SER A 38 -14.122 -8.462 -11.118 1.00 0.00 C ATOM 569 C SER A 38 -13.033 -7.498 -11.443 1.00 0.00 C ATOM 570 O SER A 38 -12.681 -7.407 -12.618 1.00 0.00 O ATOM 571 CB SER A 38 -15.481 -7.844 -11.488 1.00 0.00 C ATOM 572 OG SER A 38 -16.494 -8.824 -11.318 1.00 0.00 O ATOM 0 H SER A 38 -14.823 -8.566 -9.169 1.00 0.00 H new ATOM 0 HA SER A 38 -13.961 -9.355 -11.722 1.00 0.00 H new ATOM 0 HB2 SER A 38 -15.685 -6.978 -10.858 1.00 0.00 H new ATOM 0 HB3 SER A 38 -15.467 -7.492 -12.519 1.00 0.00 H new ATOM 0 HG SER A 38 -16.762 -8.858 -10.376 1.00 0.00 H new ATOM 578 N LEU A 39 -12.346 -6.794 -10.525 1.00 0.00 N ATOM 579 CA LEU A 39 -11.213 -5.947 -10.738 1.00 0.00 C ATOM 580 C LEU A 39 -9.997 -6.790 -10.569 1.00 0.00 C ATOM 581 O LEU A 39 -8.845 -6.362 -10.524 1.00 0.00 O ATOM 582 CB LEU A 39 -11.163 -4.661 -9.896 1.00 0.00 C ATOM 583 CG LEU A 39 -12.350 -3.730 -10.198 1.00 0.00 C ATOM 584 CD1 LEU A 39 -12.797 -2.888 -8.991 1.00 0.00 C ATOM 585 CD2 LEU A 39 -12.132 -2.887 -11.466 1.00 0.00 C ATOM 0 H LEU A 39 -12.611 -6.822 -9.540 1.00 0.00 H new ATOM 0 HA LEU A 39 -11.284 -5.545 -11.749 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -11.165 -4.920 -8.837 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -10.229 -4.134 -10.093 1.00 0.00 H new ATOM 0 HG LEU A 39 -13.190 -4.392 -10.409 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -13.637 -2.256 -9.279 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -13.101 -3.549 -8.179 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -11.970 -2.261 -8.658 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -13.000 -2.248 -11.632 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -11.244 -2.267 -11.343 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -11.998 -3.547 -12.323 1.00 0.00 H new ATOM 597 N GLY A 40 -10.136 -8.128 -10.586 1.00 0.00 N ATOM 598 CA GLY A 40 -9.118 -9.125 -10.698 1.00 0.00 C ATOM 599 C GLY A 40 -8.781 -9.938 -9.495 1.00 0.00 C ATOM 600 O GLY A 40 -8.087 -10.938 -9.672 1.00 0.00 O ATOM 0 H GLY A 40 -11.061 -8.552 -10.513 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -9.414 -9.813 -11.490 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.205 -8.630 -11.030 1.00 0.00 H new ATOM 604 N GLN A 41 -9.222 -9.613 -8.267 1.00 0.00 N ATOM 605 CA GLN A 41 -8.769 -10.361 -7.135 1.00 0.00 C ATOM 606 C GLN A 41 -9.485 -11.664 -7.043 1.00 0.00 C ATOM 607 O GLN A 41 -10.328 -12.065 -7.844 1.00 0.00 O ATOM 608 CB GLN A 41 -8.859 -9.494 -5.868 1.00 0.00 C ATOM 609 CG GLN A 41 -8.051 -8.196 -5.873 1.00 0.00 C ATOM 610 CD GLN A 41 -6.546 -8.397 -5.981 1.00 0.00 C ATOM 611 OE1 GLN A 41 -6.067 -9.391 -5.437 1.00 0.00 O ATOM 612 NE2 GLN A 41 -5.798 -7.427 -6.573 1.00 0.00 N ATOM 0 H GLN A 41 -9.873 -8.856 -8.060 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.717 -10.622 -7.251 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.906 -9.244 -5.699 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -8.534 -10.095 -5.019 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.384 -7.577 -6.706 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.268 -7.643 -4.959 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -6.254 -6.625 -7.008 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -4.781 -7.501 -6.582 1.00 0.00 H new ATOM 621 N ASN A 42 -9.196 -12.436 -5.980 1.00 0.00 N ATOM 622 CA ASN A 42 -9.797 -13.724 -5.828 1.00 0.00 C ATOM 623 C ASN A 42 -10.320 -13.981 -4.457 1.00 0.00 C ATOM 624 O ASN A 42 -10.078 -15.082 -3.965 1.00 0.00 O ATOM 625 CB ASN A 42 -8.782 -14.839 -6.132 1.00 0.00 C ATOM 626 CG ASN A 42 -8.225 -14.713 -7.543 1.00 0.00 C ATOM 627 OD1 ASN A 42 -8.708 -15.219 -8.555 1.00 0.00 O ATOM 628 ND2 ASN A 42 -7.050 -14.042 -7.682 1.00 0.00 N ATOM 0 H ASN A 42 -8.553 -12.172 -5.233 1.00 0.00 H new ATOM 0 HA ASN A 42 -10.629 -13.728 -6.532 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -7.965 -14.796 -5.412 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -9.261 -15.811 -6.014 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -6.606 -13.975 -8.598 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -6.612 -13.606 -6.870 1.00 0.00 H new ATOM 635 N PRO A 43 -11.086 -13.195 -3.760 1.00 0.00 N ATOM 636 CA PRO A 43 -11.607 -13.636 -2.499 1.00 0.00 C ATOM 637 C PRO A 43 -12.542 -14.793 -2.406 1.00 0.00 C ATOM 638 O PRO A 43 -13.298 -15.014 -3.350 1.00 0.00 O ATOM 639 CB PRO A 43 -12.424 -12.439 -2.018 1.00 0.00 C ATOM 640 CG PRO A 43 -12.584 -11.465 -3.195 1.00 0.00 C ATOM 641 CD PRO A 43 -11.410 -11.823 -4.120 1.00 0.00 C ATOM 0 HA PRO A 43 -10.732 -13.981 -1.949 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -13.400 -12.765 -1.658 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -11.924 -11.948 -1.183 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -13.543 -11.595 -3.696 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -12.534 -10.427 -2.866 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -11.690 -11.741 -5.170 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -10.561 -11.158 -3.963 1.00 0.00 H new ATOM 649 N THR A 44 -12.652 -15.524 -1.282 1.00 0.00 N ATOM 650 CA THR A 44 -13.779 -16.360 -1.010 1.00 0.00 C ATOM 651 C THR A 44 -14.680 -15.590 -0.107 1.00 0.00 C ATOM 652 O THR A 44 -14.336 -14.615 0.559 1.00 0.00 O ATOM 653 CB THR A 44 -13.419 -17.711 -0.465 1.00 0.00 C ATOM 654 OG1 THR A 44 -12.781 -17.572 0.796 1.00 0.00 O ATOM 655 CG2 THR A 44 -12.476 -18.558 -1.337 1.00 0.00 C ATOM 0 H THR A 44 -11.944 -15.534 -0.548 1.00 0.00 H new ATOM 0 HA THR A 44 -14.287 -16.601 -1.944 1.00 0.00 H new ATOM 0 HB THR A 44 -14.375 -18.232 -0.416 1.00 0.00 H new ATOM 0 HG1 THR A 44 -12.551 -18.458 1.146 1.00 0.00 H new ATOM 0 HG21 THR A 44 -12.285 -19.512 -0.846 1.00 0.00 H new ATOM 0 HG22 THR A 44 -12.940 -18.736 -2.307 1.00 0.00 H new ATOM 0 HG23 THR A 44 -11.535 -18.027 -1.477 1.00 0.00 H new ATOM 663 N GLU A 45 -15.798 -16.283 0.176 1.00 0.00 N ATOM 664 CA GLU A 45 -16.765 -15.726 1.070 1.00 0.00 C ATOM 665 C GLU A 45 -16.385 -15.764 2.510 1.00 0.00 C ATOM 666 O GLU A 45 -16.851 -14.978 3.333 1.00 0.00 O ATOM 667 CB GLU A 45 -18.120 -16.409 0.821 1.00 0.00 C ATOM 668 CG GLU A 45 -18.736 -16.004 -0.520 1.00 0.00 C ATOM 669 CD GLU A 45 -20.241 -16.014 -0.747 1.00 0.00 C ATOM 670 OE1 GLU A 45 -21.066 -15.364 -0.051 1.00 0.00 O ATOM 671 OE2 GLU A 45 -20.625 -16.717 -1.720 1.00 0.00 O ATOM 0 H GLU A 45 -16.029 -17.202 -0.201 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.827 -14.661 0.848 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -17.989 -17.491 0.846 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.808 -16.152 1.627 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -18.392 -14.992 -0.732 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -18.299 -16.655 -1.277 1.00 0.00 H new ATOM 678 N ALA A 46 -15.554 -16.760 2.865 1.00 0.00 N ATOM 679 CA ALA A 46 -15.029 -16.884 4.189 1.00 0.00 C ATOM 680 C ALA A 46 -13.953 -15.878 4.412 1.00 0.00 C ATOM 681 O ALA A 46 -13.823 -15.253 5.463 1.00 0.00 O ATOM 682 CB ALA A 46 -14.340 -18.247 4.364 1.00 0.00 C ATOM 0 H ALA A 46 -15.242 -17.490 2.224 1.00 0.00 H new ATOM 0 HA ALA A 46 -15.864 -16.754 4.878 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -13.945 -18.328 5.377 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -15.063 -19.045 4.192 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -13.523 -18.336 3.648 1.00 0.00 H new ATOM 688 N GLU A 47 -13.114 -15.593 3.400 1.00 0.00 N ATOM 689 CA GLU A 47 -12.332 -14.396 3.404 1.00 0.00 C ATOM 690 C GLU A 47 -13.067 -13.118 3.620 1.00 0.00 C ATOM 691 O GLU A 47 -12.731 -12.411 4.569 1.00 0.00 O ATOM 692 CB GLU A 47 -11.421 -14.325 2.167 1.00 0.00 C ATOM 693 CG GLU A 47 -10.304 -15.369 2.230 1.00 0.00 C ATOM 694 CD GLU A 47 -9.439 -15.369 0.978 1.00 0.00 C ATOM 695 OE1 GLU A 47 -9.918 -15.828 -0.093 1.00 0.00 O ATOM 696 OE2 GLU A 47 -8.258 -14.945 1.086 1.00 0.00 O ATOM 0 H GLU A 47 -12.977 -16.188 2.583 1.00 0.00 H new ATOM 0 HA GLU A 47 -11.723 -14.487 4.304 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -12.016 -14.481 1.267 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.985 -13.329 2.092 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.678 -15.175 3.101 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.742 -16.358 2.366 1.00 0.00 H new ATOM 703 N LEU A 48 -14.108 -12.903 2.795 1.00 0.00 N ATOM 704 CA LEU A 48 -14.996 -11.808 3.036 1.00 0.00 C ATOM 705 C LEU A 48 -15.565 -11.737 4.411 1.00 0.00 C ATOM 706 O LEU A 48 -15.573 -10.667 5.018 1.00 0.00 O ATOM 707 CB LEU A 48 -16.128 -11.880 1.997 1.00 0.00 C ATOM 708 CG LEU A 48 -15.787 -11.496 0.548 1.00 0.00 C ATOM 709 CD1 LEU A 48 -16.973 -11.861 -0.361 1.00 0.00 C ATOM 710 CD2 LEU A 48 -15.505 -9.991 0.410 1.00 0.00 C ATOM 0 H LEU A 48 -14.332 -13.473 1.979 1.00 0.00 H new ATOM 0 HA LEU A 48 -14.404 -10.897 2.942 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -16.516 -12.899 1.993 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -16.937 -11.232 2.335 1.00 0.00 H new ATOM 0 HG LEU A 48 -14.889 -12.042 0.258 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -16.739 -11.591 -1.391 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -17.162 -12.933 -0.300 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -17.861 -11.318 -0.037 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -15.268 -9.759 -0.628 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -16.386 -9.426 0.716 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -14.661 -9.719 1.044 1.00 0.00 H new ATOM 722 N GLN A 49 -16.097 -12.808 5.026 1.00 0.00 N ATOM 723 CA GLN A 49 -16.571 -12.924 6.371 1.00 0.00 C ATOM 724 C GLN A 49 -15.583 -12.583 7.433 1.00 0.00 C ATOM 725 O GLN A 49 -15.919 -12.058 8.493 1.00 0.00 O ATOM 726 CB GLN A 49 -17.014 -14.379 6.601 1.00 0.00 C ATOM 727 CG GLN A 49 -18.045 -14.595 7.711 1.00 0.00 C ATOM 728 CD GLN A 49 -19.421 -14.069 7.329 1.00 0.00 C ATOM 729 OE1 GLN A 49 -19.642 -13.481 6.272 1.00 0.00 O ATOM 730 NE2 GLN A 49 -20.372 -14.538 8.180 1.00 0.00 N ATOM 0 H GLN A 49 -16.206 -13.688 4.523 1.00 0.00 H new ATOM 0 HA GLN A 49 -17.378 -12.197 6.460 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -17.426 -14.765 5.669 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -16.131 -14.976 6.830 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -18.115 -15.659 7.937 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -17.707 -14.097 8.620 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -20.097 -15.016 9.038 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -21.360 -14.412 7.960 1.00 0.00 H new ATOM 739 N ASP A 50 -14.291 -12.860 7.182 1.00 0.00 N ATOM 740 CA ASP A 50 -13.274 -12.552 8.139 1.00 0.00 C ATOM 741 C ASP A 50 -12.941 -11.100 8.191 1.00 0.00 C ATOM 742 O ASP A 50 -12.810 -10.479 9.245 1.00 0.00 O ATOM 743 CB ASP A 50 -12.019 -13.427 7.984 1.00 0.00 C ATOM 744 CG ASP A 50 -12.240 -14.858 8.453 1.00 0.00 C ATOM 745 OD1 ASP A 50 -12.735 -14.800 9.610 1.00 0.00 O ATOM 746 OD2 ASP A 50 -11.856 -15.923 7.899 1.00 0.00 O ATOM 0 H ASP A 50 -13.952 -13.294 6.323 1.00 0.00 H new ATOM 0 HA ASP A 50 -13.707 -12.802 9.108 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -11.713 -13.435 6.938 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -11.200 -12.985 8.552 1.00 0.00 H new ATOM 751 N MET A 51 -12.878 -10.538 6.971 1.00 0.00 N ATOM 752 CA MET A 51 -12.861 -9.119 6.799 1.00 0.00 C ATOM 753 C MET A 51 -14.053 -8.378 7.299 1.00 0.00 C ATOM 754 O MET A 51 -13.965 -7.203 7.654 1.00 0.00 O ATOM 755 CB MET A 51 -12.845 -8.581 5.358 1.00 0.00 C ATOM 756 CG MET A 51 -11.571 -9.046 4.650 1.00 0.00 C ATOM 757 SD MET A 51 -11.597 -9.371 2.861 1.00 0.00 S ATOM 758 CE MET A 51 -9.881 -9.911 2.610 1.00 0.00 C ATOM 0 H MET A 51 -12.839 -11.069 6.101 1.00 0.00 H new ATOM 0 HA MET A 51 -11.937 -8.951 7.353 1.00 0.00 H new ATOM 0 HB2 MET A 51 -13.723 -8.935 4.817 1.00 0.00 H new ATOM 0 HB3 MET A 51 -12.892 -7.492 5.365 1.00 0.00 H new ATOM 0 HG2 MET A 51 -10.805 -8.293 4.832 1.00 0.00 H new ATOM 0 HG3 MET A 51 -11.242 -9.961 5.142 1.00 0.00 H new ATOM 0 HE1 MET A 51 -9.725 -10.151 1.558 1.00 0.00 H new ATOM 0 HE2 MET A 51 -9.201 -9.111 2.904 1.00 0.00 H new ATOM 0 HE3 MET A 51 -9.685 -10.795 3.217 1.00 0.00 H new ATOM 768 N ILE A 52 -15.296 -8.877 7.422 1.00 0.00 N ATOM 769 CA ILE A 52 -16.384 -8.335 8.175 1.00 0.00 C ATOM 770 C ILE A 52 -16.063 -8.069 9.606 1.00 0.00 C ATOM 771 O ILE A 52 -16.372 -7.041 10.207 1.00 0.00 O ATOM 772 CB ILE A 52 -17.622 -9.172 8.052 1.00 0.00 C ATOM 773 CG1 ILE A 52 -18.232 -9.168 6.640 1.00 0.00 C ATOM 774 CG2 ILE A 52 -18.722 -8.764 9.047 1.00 0.00 C ATOM 775 CD1 ILE A 52 -19.423 -10.115 6.497 1.00 0.00 C ATOM 0 H ILE A 52 -15.562 -9.741 6.949 1.00 0.00 H new ATOM 0 HA ILE A 52 -16.577 -7.362 7.724 1.00 0.00 H new ATOM 0 HB ILE A 52 -17.273 -10.179 8.283 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -18.549 -8.155 6.391 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -17.464 -9.448 5.919 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -19.593 -9.405 8.910 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -18.349 -8.871 10.066 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -19.005 -7.726 8.871 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -19.807 -10.065 5.478 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -19.105 -11.135 6.716 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -20.207 -9.822 7.195 1.00 0.00 H new ATOM 787 N ASN A 53 -15.401 -9.023 10.284 1.00 0.00 N ATOM 788 CA ASN A 53 -15.000 -8.923 11.653 1.00 0.00 C ATOM 789 C ASN A 53 -13.859 -7.993 11.885 1.00 0.00 C ATOM 790 O ASN A 53 -13.442 -7.769 13.020 1.00 0.00 O ATOM 791 CB ASN A 53 -14.710 -10.360 12.119 1.00 0.00 C ATOM 792 CG ASN A 53 -14.981 -10.735 13.569 1.00 0.00 C ATOM 793 OD1 ASN A 53 -15.795 -10.228 14.338 1.00 0.00 O ATOM 794 ND2 ASN A 53 -14.109 -11.685 14.002 1.00 0.00 N ATOM 0 H ASN A 53 -15.132 -9.909 9.856 1.00 0.00 H new ATOM 0 HA ASN A 53 -15.798 -8.473 12.244 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -15.293 -11.033 11.491 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -13.659 -10.565 11.917 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -14.125 -11.986 14.977 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -13.439 -12.097 13.352 1.00 0.00 H new ATOM 801 N GLU A 54 -13.279 -7.412 10.820 1.00 0.00 N ATOM 802 CA GLU A 54 -12.243 -6.439 10.978 1.00 0.00 C ATOM 803 C GLU A 54 -12.757 -5.048 10.835 1.00 0.00 C ATOM 804 O GLU A 54 -12.552 -4.219 11.720 1.00 0.00 O ATOM 805 CB GLU A 54 -11.147 -6.726 9.938 1.00 0.00 C ATOM 806 CG GLU A 54 -9.878 -5.872 9.908 1.00 0.00 C ATOM 807 CD GLU A 54 -8.911 -6.212 11.033 1.00 0.00 C ATOM 808 OE1 GLU A 54 -8.286 -7.306 11.021 1.00 0.00 O ATOM 809 OE2 GLU A 54 -8.570 -5.325 11.860 1.00 0.00 O ATOM 0 H GLU A 54 -13.526 -7.615 9.852 1.00 0.00 H new ATOM 0 HA GLU A 54 -11.836 -6.515 11.986 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -10.837 -7.762 10.071 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -11.608 -6.656 8.953 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -9.376 -6.009 8.950 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.152 -4.819 9.977 1.00 0.00 H new ATOM 816 N VAL A 55 -13.472 -4.787 9.726 1.00 0.00 N ATOM 817 CA VAL A 55 -13.937 -3.482 9.374 1.00 0.00 C ATOM 818 C VAL A 55 -15.119 -3.096 10.195 1.00 0.00 C ATOM 819 O VAL A 55 -15.154 -1.988 10.728 1.00 0.00 O ATOM 820 CB VAL A 55 -14.141 -3.312 7.897 1.00 0.00 C ATOM 821 CG1 VAL A 55 -12.731 -3.356 7.283 1.00 0.00 C ATOM 822 CG2 VAL A 55 -15.033 -4.267 7.086 1.00 0.00 C ATOM 0 H VAL A 55 -13.735 -5.507 9.053 1.00 0.00 H new ATOM 0 HA VAL A 55 -13.146 -2.774 9.619 1.00 0.00 H new ATOM 0 HB VAL A 55 -14.714 -2.387 7.827 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -12.801 -3.238 6.202 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.128 -2.548 7.698 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -12.263 -4.313 7.514 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -15.038 -3.960 6.040 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -14.644 -5.282 7.164 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -16.049 -4.237 7.478 1.00 0.00 H new ATOM 832 N ASP A 56 -16.085 -4.003 10.428 1.00 0.00 N ATOM 833 CA ASP A 56 -17.396 -3.635 10.864 1.00 0.00 C ATOM 834 C ASP A 56 -17.533 -3.693 12.347 1.00 0.00 C ATOM 835 O ASP A 56 -17.601 -4.744 12.983 1.00 0.00 O ATOM 836 CB ASP A 56 -18.427 -4.504 10.124 1.00 0.00 C ATOM 837 CG ASP A 56 -19.735 -3.827 9.742 1.00 0.00 C ATOM 838 OD1 ASP A 56 -20.693 -3.616 10.532 1.00 0.00 O ATOM 839 OD2 ASP A 56 -19.796 -3.290 8.603 1.00 0.00 O ATOM 0 H ASP A 56 -15.953 -5.008 10.312 1.00 0.00 H new ATOM 0 HA ASP A 56 -17.583 -2.592 10.611 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -17.962 -4.886 9.215 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -18.659 -5.366 10.750 1.00 0.00 H new ATOM 844 N ALA A 57 -17.497 -2.507 12.980 1.00 0.00 N ATOM 845 CA ALA A 57 -17.400 -2.277 14.388 1.00 0.00 C ATOM 846 C ALA A 57 -18.769 -2.331 14.974 1.00 0.00 C ATOM 847 O ALA A 57 -18.976 -2.900 16.045 1.00 0.00 O ATOM 848 CB ALA A 57 -16.639 -0.963 14.630 1.00 0.00 C ATOM 0 H ALA A 57 -17.540 -1.632 12.458 1.00 0.00 H new ATOM 0 HA ALA A 57 -16.823 -3.049 14.897 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -16.561 -0.780 15.702 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -15.640 -1.037 14.200 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -17.176 -0.139 14.160 1.00 0.00 H new ATOM 854 N ASP A 58 -19.735 -1.808 14.198 1.00 0.00 N ATOM 855 CA ASP A 58 -21.133 -1.752 14.494 1.00 0.00 C ATOM 856 C ASP A 58 -21.646 -3.135 14.290 1.00 0.00 C ATOM 857 O ASP A 58 -22.736 -3.399 14.797 1.00 0.00 O ATOM 858 CB ASP A 58 -21.851 -0.618 13.743 1.00 0.00 C ATOM 859 CG ASP A 58 -21.602 -0.627 12.242 1.00 0.00 C ATOM 860 OD1 ASP A 58 -20.442 -0.592 11.752 1.00 0.00 O ATOM 861 OD2 ASP A 58 -22.598 -0.728 11.477 1.00 0.00 O ATOM 0 H ASP A 58 -19.520 -1.392 13.292 1.00 0.00 H new ATOM 0 HA ASP A 58 -21.339 -1.466 15.525 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -22.923 -0.695 13.925 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -21.526 0.339 14.151 1.00 0.00 H new ATOM 866 N GLY A 59 -20.930 -3.991 13.540 1.00 0.00 N ATOM 867 CA GLY A 59 -21.024 -5.417 13.468 1.00 0.00 C ATOM 868 C GLY A 59 -22.075 -5.978 12.574 1.00 0.00 C ATOM 869 O GLY A 59 -22.310 -7.185 12.582 1.00 0.00 O ATOM 0 H GLY A 59 -20.204 -3.641 12.915 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -20.059 -5.805 13.142 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -21.197 -5.797 14.475 1.00 0.00 H new ATOM 873 N ASN A 60 -22.725 -5.148 11.738 1.00 0.00 N ATOM 874 CA ASN A 60 -23.907 -5.563 11.049 1.00 0.00 C ATOM 875 C ASN A 60 -23.608 -6.359 9.825 1.00 0.00 C ATOM 876 O ASN A 60 -24.484 -7.074 9.340 1.00 0.00 O ATOM 877 CB ASN A 60 -24.952 -4.457 10.826 1.00 0.00 C ATOM 878 CG ASN A 60 -24.400 -3.223 10.127 1.00 0.00 C ATOM 879 OD1 ASN A 60 -23.275 -2.997 9.685 1.00 0.00 O ATOM 880 ND2 ASN A 60 -25.401 -2.356 9.818 1.00 0.00 N ATOM 0 H ASN A 60 -22.432 -4.191 11.540 1.00 0.00 H new ATOM 0 HA ASN A 60 -24.404 -6.242 11.741 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -25.774 -4.861 10.235 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -25.367 -4.162 11.790 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -25.209 -1.543 9.233 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -26.344 -2.519 10.171 1.00 0.00 H new ATOM 887 N GLY A 61 -22.406 -6.195 9.244 1.00 0.00 N ATOM 888 CA GLY A 61 -22.022 -6.761 7.989 1.00 0.00 C ATOM 889 C GLY A 61 -22.026 -5.749 6.896 1.00 0.00 C ATOM 890 O GLY A 61 -21.294 -5.938 5.925 1.00 0.00 O ATOM 0 H GLY A 61 -21.665 -5.639 9.672 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -21.026 -7.196 8.077 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -22.703 -7.573 7.734 1.00 0.00 H new ATOM 894 N THR A 62 -22.860 -4.717 7.115 1.00 0.00 N ATOM 895 CA THR A 62 -23.197 -3.704 6.163 1.00 0.00 C ATOM 896 C THR A 62 -22.440 -2.420 6.144 1.00 0.00 C ATOM 897 O THR A 62 -22.045 -1.886 7.180 1.00 0.00 O ATOM 898 CB THR A 62 -24.664 -3.400 6.093 1.00 0.00 C ATOM 899 OG1 THR A 62 -25.434 -4.376 6.780 1.00 0.00 O ATOM 900 CG2 THR A 62 -25.139 -3.450 4.631 1.00 0.00 C ATOM 0 H THR A 62 -23.327 -4.582 8.012 1.00 0.00 H new ATOM 0 HA THR A 62 -22.852 -4.227 5.271 1.00 0.00 H new ATOM 0 HB THR A 62 -24.800 -2.416 6.541 1.00 0.00 H new ATOM 0 HG1 THR A 62 -26.385 -4.147 6.716 1.00 0.00 H new ATOM 0 HG21 THR A 62 -26.205 -3.228 4.587 1.00 0.00 H new ATOM 0 HG22 THR A 62 -24.591 -2.713 4.045 1.00 0.00 H new ATOM 0 HG23 THR A 62 -24.958 -4.445 4.223 1.00 0.00 H new ATOM 908 N ILE A 63 -22.192 -1.907 4.926 1.00 0.00 N ATOM 909 CA ILE A 63 -21.444 -0.720 4.650 1.00 0.00 C ATOM 910 C ILE A 63 -22.277 0.267 3.906 1.00 0.00 C ATOM 911 O ILE A 63 -22.747 -0.026 2.808 1.00 0.00 O ATOM 912 CB ILE A 63 -20.213 -1.062 3.865 1.00 0.00 C ATOM 913 CG1 ILE A 63 -19.335 -2.114 4.562 1.00 0.00 C ATOM 914 CG2 ILE A 63 -19.403 0.192 3.497 1.00 0.00 C ATOM 915 CD1 ILE A 63 -18.043 -2.409 3.801 1.00 0.00 C ATOM 0 H ILE A 63 -22.538 -2.353 4.076 1.00 0.00 H new ATOM 0 HA ILE A 63 -21.146 -0.268 5.596 1.00 0.00 H new ATOM 0 HB ILE A 63 -20.562 -1.514 2.937 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -19.089 -1.767 5.565 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -19.903 -3.037 4.675 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -18.519 -0.099 2.929 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -20.019 0.859 2.893 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -19.096 0.707 4.407 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -17.465 -3.159 4.342 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -18.284 -2.784 2.807 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -17.457 -1.495 3.711 1.00 0.00 H new ATOM 927 N ASP A 64 -22.498 1.471 4.464 1.00 0.00 N ATOM 928 CA ASP A 64 -23.037 2.638 3.838 1.00 0.00 C ATOM 929 C ASP A 64 -22.196 3.867 3.812 1.00 0.00 C ATOM 930 O ASP A 64 -21.052 3.825 4.263 1.00 0.00 O ATOM 931 CB ASP A 64 -24.427 2.964 4.411 1.00 0.00 C ATOM 932 CG ASP A 64 -24.455 3.428 5.860 1.00 0.00 C ATOM 933 OD1 ASP A 64 -24.083 2.568 6.702 1.00 0.00 O ATOM 934 OD2 ASP A 64 -24.953 4.542 6.173 1.00 0.00 O ATOM 0 H ASP A 64 -22.278 1.641 5.445 1.00 0.00 H new ATOM 0 HA ASP A 64 -23.087 2.346 2.789 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -24.881 3.738 3.793 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -25.053 2.076 4.322 1.00 0.00 H new ATOM 939 N PHE A 65 -22.677 5.017 3.307 1.00 0.00 N ATOM 940 CA PHE A 65 -21.837 6.102 2.904 1.00 0.00 C ATOM 941 C PHE A 65 -20.868 6.587 3.927 1.00 0.00 C ATOM 942 O PHE A 65 -19.681 6.481 3.624 1.00 0.00 O ATOM 943 CB PHE A 65 -22.625 7.233 2.221 1.00 0.00 C ATOM 944 CG PHE A 65 -21.799 8.142 1.377 1.00 0.00 C ATOM 945 CD1 PHE A 65 -20.895 7.732 0.426 1.00 0.00 C ATOM 946 CD2 PHE A 65 -22.022 9.492 1.509 1.00 0.00 C ATOM 947 CE1 PHE A 65 -20.052 8.659 -0.141 1.00 0.00 C ATOM 948 CE2 PHE A 65 -21.264 10.454 0.884 1.00 0.00 C ATOM 949 CZ PHE A 65 -20.275 10.003 0.042 1.00 0.00 C ATOM 0 H PHE A 65 -23.672 5.197 3.176 1.00 0.00 H new ATOM 0 HA PHE A 65 -21.187 5.665 2.146 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -23.405 6.791 1.601 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -23.125 7.825 2.988 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.847 6.695 0.128 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -22.838 9.815 2.139 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -19.211 8.329 -0.733 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -21.436 11.508 1.046 1.00 0.00 H new ATOM 0 HZ PHE A 65 -19.662 10.718 -0.486 1.00 0.00 H new ATOM 959 N PRO A 66 -21.154 7.053 5.106 1.00 0.00 N ATOM 960 CA PRO A 66 -20.157 7.624 5.964 1.00 0.00 C ATOM 961 C PRO A 66 -19.309 6.607 6.647 1.00 0.00 C ATOM 962 O PRO A 66 -18.264 7.006 7.159 1.00 0.00 O ATOM 963 CB PRO A 66 -20.974 8.520 6.892 1.00 0.00 C ATOM 964 CG PRO A 66 -22.259 7.700 7.089 1.00 0.00 C ATOM 965 CD PRO A 66 -22.492 7.162 5.668 1.00 0.00 C ATOM 0 HA PRO A 66 -19.397 8.192 5.427 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -20.460 8.704 7.836 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -21.177 9.493 6.444 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -22.128 6.898 7.816 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -23.089 8.314 7.438 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.997 6.196 5.685 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -23.116 7.838 5.083 1.00 0.00 H new ATOM 973 N GLU A 67 -19.639 5.306 6.559 1.00 0.00 N ATOM 974 CA GLU A 67 -18.772 4.238 6.946 1.00 0.00 C ATOM 975 C GLU A 67 -17.811 3.922 5.852 1.00 0.00 C ATOM 976 O GLU A 67 -16.621 4.008 6.153 1.00 0.00 O ATOM 977 CB GLU A 67 -19.529 2.961 7.348 1.00 0.00 C ATOM 978 CG GLU A 67 -18.771 1.761 7.920 1.00 0.00 C ATOM 979 CD GLU A 67 -19.723 0.745 8.534 1.00 0.00 C ATOM 980 OE1 GLU A 67 -20.928 1.023 8.777 1.00 0.00 O ATOM 981 OE2 GLU A 67 -19.257 -0.339 8.975 1.00 0.00 O ATOM 0 H GLU A 67 -20.541 4.987 6.206 1.00 0.00 H new ATOM 0 HA GLU A 67 -18.234 4.588 7.827 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -20.279 3.249 8.084 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -20.066 2.613 6.465 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -18.189 1.286 7.130 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -18.063 2.102 8.676 1.00 0.00 H new ATOM 988 N PHE A 68 -18.203 3.784 4.573 1.00 0.00 N ATOM 989 CA PHE A 68 -17.425 3.557 3.396 1.00 0.00 C ATOM 990 C PHE A 68 -16.420 4.639 3.202 1.00 0.00 C ATOM 991 O PHE A 68 -15.265 4.349 2.893 1.00 0.00 O ATOM 992 CB PHE A 68 -18.362 3.536 2.176 1.00 0.00 C ATOM 993 CG PHE A 68 -17.761 3.325 0.829 1.00 0.00 C ATOM 994 CD1 PHE A 68 -17.364 2.072 0.426 1.00 0.00 C ATOM 995 CD2 PHE A 68 -17.635 4.414 -0.001 1.00 0.00 C ATOM 996 CE1 PHE A 68 -16.953 1.860 -0.869 1.00 0.00 C ATOM 997 CE2 PHE A 68 -17.245 4.177 -1.298 1.00 0.00 C ATOM 998 CZ PHE A 68 -16.987 2.908 -1.759 1.00 0.00 C ATOM 0 H PHE A 68 -19.194 3.840 4.340 1.00 0.00 H new ATOM 0 HA PHE A 68 -16.903 2.606 3.505 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -19.101 2.751 2.337 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -18.902 4.483 2.155 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -17.375 1.252 1.129 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -17.834 5.415 0.352 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.609 0.885 -1.182 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -17.138 5.012 -1.974 1.00 0.00 H new ATOM 0 HZ PHE A 68 -16.813 2.735 -2.811 1.00 0.00 H new ATOM 1008 N LEU A 69 -16.780 5.905 3.479 1.00 0.00 N ATOM 1009 CA LEU A 69 -16.013 7.095 3.276 1.00 0.00 C ATOM 1010 C LEU A 69 -14.651 7.026 3.876 1.00 0.00 C ATOM 1011 O LEU A 69 -13.626 7.274 3.243 1.00 0.00 O ATOM 1012 CB LEU A 69 -16.745 8.383 3.688 1.00 0.00 C ATOM 1013 CG LEU A 69 -16.133 9.739 3.300 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -17.087 10.708 2.581 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -15.546 10.305 4.604 1.00 0.00 C ATOM 0 H LEU A 69 -17.693 6.112 3.883 1.00 0.00 H new ATOM 0 HA LEU A 69 -15.882 7.149 2.195 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -17.749 8.341 3.266 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -16.854 8.368 4.772 1.00 0.00 H new ATOM 0 HG LEU A 69 -15.366 9.599 2.538 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -16.560 11.634 2.351 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -17.440 10.252 1.656 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -17.938 10.926 3.226 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -15.090 11.275 4.407 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -16.341 10.421 5.341 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -14.790 9.621 4.990 1.00 0.00 H new ATOM 1027 N THR A 70 -14.550 6.630 5.157 1.00 0.00 N ATOM 1028 CA THR A 70 -13.287 6.753 5.817 1.00 0.00 C ATOM 1029 C THR A 70 -12.325 5.697 5.394 1.00 0.00 C ATOM 1030 O THR A 70 -11.101 5.816 5.426 1.00 0.00 O ATOM 1031 CB THR A 70 -13.468 6.793 7.305 1.00 0.00 C ATOM 1032 OG1 THR A 70 -14.043 5.554 7.693 1.00 0.00 O ATOM 1033 CG2 THR A 70 -14.416 7.962 7.621 1.00 0.00 C ATOM 0 H THR A 70 -15.308 6.240 5.717 1.00 0.00 H new ATOM 0 HA THR A 70 -12.845 7.702 5.512 1.00 0.00 H new ATOM 0 HB THR A 70 -12.530 6.938 7.840 1.00 0.00 H new ATOM 0 HG1 THR A 70 -14.175 5.544 8.664 1.00 0.00 H new ATOM 0 HG21 THR A 70 -14.572 8.023 8.698 1.00 0.00 H new ATOM 0 HG22 THR A 70 -13.976 8.894 7.265 1.00 0.00 H new ATOM 0 HG23 THR A 70 -15.373 7.799 7.124 1.00 0.00 H new ATOM 1041 N MET A 71 -12.883 4.528 5.032 1.00 0.00 N ATOM 1042 CA MET A 71 -12.213 3.410 4.445 1.00 0.00 C ATOM 1043 C MET A 71 -11.736 3.756 3.077 1.00 0.00 C ATOM 1044 O MET A 71 -10.623 3.445 2.656 1.00 0.00 O ATOM 1045 CB MET A 71 -13.002 2.090 4.464 1.00 0.00 C ATOM 1046 CG MET A 71 -13.396 1.740 5.900 1.00 0.00 C ATOM 1047 SD MET A 71 -14.132 0.081 5.994 1.00 0.00 S ATOM 1048 CE MET A 71 -15.523 0.536 4.919 1.00 0.00 C ATOM 0 H MET A 71 -13.880 4.353 5.160 1.00 0.00 H new ATOM 0 HA MET A 71 -11.356 3.208 5.087 1.00 0.00 H new ATOM 0 HB2 MET A 71 -13.894 2.181 3.845 1.00 0.00 H new ATOM 0 HB3 MET A 71 -12.398 1.289 4.038 1.00 0.00 H new ATOM 0 HG2 MET A 71 -12.517 1.788 6.543 1.00 0.00 H new ATOM 0 HG3 MET A 71 -14.106 2.477 6.275 1.00 0.00 H new ATOM 0 HE1 MET A 71 -16.394 -0.066 5.177 1.00 0.00 H new ATOM 0 HE2 MET A 71 -15.758 1.591 5.056 1.00 0.00 H new ATOM 0 HE3 MET A 71 -15.253 0.356 3.878 1.00 0.00 H new ATOM 1058 N MET A 72 -12.677 4.303 2.286 1.00 0.00 N ATOM 1059 CA MET A 72 -12.435 4.686 0.930 1.00 0.00 C ATOM 1060 C MET A 72 -11.343 5.694 0.812 1.00 0.00 C ATOM 1061 O MET A 72 -10.365 5.650 0.068 1.00 0.00 O ATOM 1062 CB MET A 72 -13.686 5.111 0.143 1.00 0.00 C ATOM 1063 CG MET A 72 -13.612 5.084 -1.385 1.00 0.00 C ATOM 1064 SD MET A 72 -13.002 3.490 -2.011 1.00 0.00 S ATOM 1065 CE MET A 72 -13.372 3.842 -3.754 1.00 0.00 C ATOM 0 H MET A 72 -13.631 4.484 2.598 1.00 0.00 H new ATOM 0 HA MET A 72 -12.099 3.767 0.450 1.00 0.00 H new ATOM 0 HB2 MET A 72 -14.509 4.466 0.450 1.00 0.00 H new ATOM 0 HB3 MET A 72 -13.945 6.125 0.448 1.00 0.00 H new ATOM 0 HG2 MET A 72 -14.601 5.281 -1.799 1.00 0.00 H new ATOM 0 HG3 MET A 72 -12.956 5.884 -1.730 1.00 0.00 H new ATOM 0 HE1 MET A 72 -12.731 3.234 -4.392 1.00 0.00 H new ATOM 0 HE2 MET A 72 -14.416 3.607 -3.959 1.00 0.00 H new ATOM 0 HE3 MET A 72 -13.191 4.897 -3.958 1.00 0.00 H new ATOM 1075 N ALA A 73 -11.329 6.670 1.736 1.00 0.00 N ATOM 1076 CA ALA A 73 -10.332 7.687 1.872 1.00 0.00 C ATOM 1077 C ALA A 73 -9.031 7.042 2.203 1.00 0.00 C ATOM 1078 O ALA A 73 -8.102 7.273 1.430 1.00 0.00 O ATOM 1079 CB ALA A 73 -10.808 8.858 2.748 1.00 0.00 C ATOM 0 H ALA A 73 -12.066 6.754 2.437 1.00 0.00 H new ATOM 0 HA ALA A 73 -10.152 8.204 0.930 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -10.016 9.603 2.821 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -11.693 9.311 2.301 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -11.053 8.491 3.745 1.00 0.00 H new ATOM 1234 N GLU A 83 2.733 15.025 2.639 1.00 0.00 N ATOM 1235 CA GLU A 83 3.025 14.906 4.034 1.00 0.00 C ATOM 1236 C GLU A 83 1.950 14.383 4.924 1.00 0.00 C ATOM 1237 O GLU A 83 1.937 14.582 6.137 1.00 0.00 O ATOM 1238 CB GLU A 83 3.479 16.237 4.656 1.00 0.00 C ATOM 1239 CG GLU A 83 4.695 16.967 4.081 1.00 0.00 C ATOM 1240 CD GLU A 83 5.894 16.172 4.577 1.00 0.00 C ATOM 1241 OE1 GLU A 83 6.077 15.047 4.040 1.00 0.00 O ATOM 1242 OE2 GLU A 83 6.669 16.616 5.466 1.00 0.00 O ATOM 0 HA GLU A 83 3.815 14.156 4.001 1.00 0.00 H new ATOM 0 HB2 GLU A 83 2.634 16.924 4.608 1.00 0.00 H new ATOM 0 HB3 GLU A 83 3.679 16.052 5.711 1.00 0.00 H new ATOM 0 HG2 GLU A 83 4.662 16.995 2.992 1.00 0.00 H new ATOM 0 HG3 GLU A 83 4.735 18.000 4.425 1.00 0.00 H new ATOM 1249 N GLU A 84 0.941 13.643 4.430 1.00 0.00 N ATOM 1250 CA GLU A 84 -0.267 13.315 5.120 1.00 0.00 C ATOM 1251 C GLU A 84 0.044 12.382 6.239 1.00 0.00 C ATOM 1252 O GLU A 84 -0.410 12.589 7.364 1.00 0.00 O ATOM 1253 CB GLU A 84 -1.375 12.890 4.142 1.00 0.00 C ATOM 1254 CG GLU A 84 -1.555 13.836 2.953 1.00 0.00 C ATOM 1255 CD GLU A 84 -2.824 13.631 2.137 1.00 0.00 C ATOM 1256 OE1 GLU A 84 -2.705 12.701 1.295 1.00 0.00 O ATOM 1257 OE2 GLU A 84 -3.721 14.511 2.223 1.00 0.00 O ATOM 0 H GLU A 84 0.972 13.250 3.489 1.00 0.00 H new ATOM 0 HA GLU A 84 -0.702 14.192 5.599 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -1.151 11.891 3.767 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -2.318 12.822 4.685 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -1.543 14.861 3.322 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -0.696 13.726 2.291 1.00 0.00 H new ATOM 1264 N ILE A 85 0.946 11.423 5.961 1.00 0.00 N ATOM 1265 CA ILE A 85 1.384 10.478 6.940 1.00 0.00 C ATOM 1266 C ILE A 85 2.208 11.102 8.013 1.00 0.00 C ATOM 1267 O ILE A 85 2.218 10.681 9.169 1.00 0.00 O ATOM 1268 CB ILE A 85 2.018 9.306 6.251 1.00 0.00 C ATOM 1269 CG1 ILE A 85 3.452 9.436 5.710 1.00 0.00 C ATOM 1270 CG2 ILE A 85 1.030 8.841 5.168 1.00 0.00 C ATOM 1271 CD1 ILE A 85 3.526 10.154 4.363 1.00 0.00 C ATOM 0 H ILE A 85 1.377 11.302 5.044 1.00 0.00 H new ATOM 0 HA ILE A 85 0.522 10.094 7.486 1.00 0.00 H new ATOM 0 HB ILE A 85 2.192 8.567 7.033 1.00 0.00 H new ATOM 0 HG12 ILE A 85 4.059 9.976 6.436 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.886 8.441 5.608 1.00 0.00 H new ATOM 0 HG21 ILE A 85 1.448 7.986 4.637 1.00 0.00 H new ATOM 0 HG22 ILE A 85 0.088 8.553 5.634 1.00 0.00 H new ATOM 0 HG23 ILE A 85 0.852 9.654 4.464 1.00 0.00 H new ATOM 0 HD11 ILE A 85 4.565 10.212 4.038 1.00 0.00 H new ATOM 0 HD12 ILE A 85 2.945 9.602 3.624 1.00 0.00 H new ATOM 0 HD13 ILE A 85 3.121 11.161 4.465 1.00 0.00 H new ATOM 1283 N ARG A 86 3.030 12.088 7.613 1.00 0.00 N ATOM 1284 CA ARG A 86 3.942 12.781 8.469 1.00 0.00 C ATOM 1285 C ARG A 86 3.153 13.677 9.360 1.00 0.00 C ATOM 1286 O ARG A 86 3.487 13.765 10.541 1.00 0.00 O ATOM 1287 CB ARG A 86 4.996 13.490 7.601 1.00 0.00 C ATOM 1288 CG ARG A 86 5.966 12.612 6.808 1.00 0.00 C ATOM 1289 CD ARG A 86 7.327 13.202 6.433 1.00 0.00 C ATOM 1290 NE ARG A 86 8.039 12.169 5.629 1.00 0.00 N ATOM 1291 CZ ARG A 86 7.853 11.790 4.331 1.00 0.00 C ATOM 1292 NH1 ARG A 86 6.880 12.359 3.560 1.00 0.00 N ATOM 1293 NH2 ARG A 86 8.539 10.692 3.902 1.00 0.00 N ATOM 0 H ARG A 86 3.060 12.417 6.648 1.00 0.00 H new ATOM 0 HA ARG A 86 4.501 12.112 9.123 1.00 0.00 H new ATOM 0 HB2 ARG A 86 4.472 14.134 6.895 1.00 0.00 H new ATOM 0 HB3 ARG A 86 5.584 14.140 8.250 1.00 0.00 H new ATOM 0 HG2 ARG A 86 6.143 11.705 7.385 1.00 0.00 H new ATOM 0 HG3 ARG A 86 5.467 12.311 5.887 1.00 0.00 H new ATOM 0 HD2 ARG A 86 7.205 14.121 5.860 1.00 0.00 H new ATOM 0 HD3 ARG A 86 7.897 13.457 7.326 1.00 0.00 H new ATOM 0 HE ARG A 86 8.778 11.669 6.124 1.00 0.00 H new ATOM 0 HH11 ARG A 86 6.276 13.081 3.952 1.00 0.00 H new ATOM 0 HH12 ARG A 86 6.757 12.062 2.592 1.00 0.00 H new ATOM 0 HH21 ARG A 86 9.157 10.194 4.543 1.00 0.00 H new ATOM 0 HH22 ARG A 86 8.434 10.369 2.940 1.00 0.00 H new ATOM 1307 N GLU A 87 2.114 14.403 8.911 1.00 0.00 N ATOM 1308 CA GLU A 87 1.252 15.146 9.778 1.00 0.00 C ATOM 1309 C GLU A 87 0.256 14.273 10.462 1.00 0.00 C ATOM 1310 O GLU A 87 -0.356 14.654 11.458 1.00 0.00 O ATOM 1311 CB GLU A 87 0.578 16.341 9.083 1.00 0.00 C ATOM 1312 CG GLU A 87 -0.386 15.995 7.947 1.00 0.00 C ATOM 1313 CD GLU A 87 -1.532 16.994 7.884 1.00 0.00 C ATOM 1314 OE1 GLU A 87 -2.241 16.998 8.925 1.00 0.00 O ATOM 1315 OE2 GLU A 87 -1.792 17.660 6.846 1.00 0.00 O ATOM 0 H GLU A 87 1.867 14.476 7.924 1.00 0.00 H new ATOM 0 HA GLU A 87 1.899 15.567 10.547 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.034 16.914 9.834 1.00 0.00 H new ATOM 0 HB3 GLU A 87 1.357 16.993 8.687 1.00 0.00 H new ATOM 0 HG2 GLU A 87 0.150 15.991 6.998 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.782 14.990 8.094 1.00 0.00 H new ATOM 1322 N ALA A 88 -0.013 13.037 10.005 1.00 0.00 N ATOM 1323 CA ALA A 88 -0.729 12.137 10.855 1.00 0.00 C ATOM 1324 C ALA A 88 0.074 11.623 11.999 1.00 0.00 C ATOM 1325 O ALA A 88 -0.425 11.429 13.106 1.00 0.00 O ATOM 1326 CB ALA A 88 -1.142 10.876 10.077 1.00 0.00 C ATOM 0 H ALA A 88 0.251 12.672 9.090 1.00 0.00 H new ATOM 0 HA ALA A 88 -1.573 12.723 11.218 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -1.686 10.202 10.739 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -1.782 11.158 9.241 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -0.251 10.373 9.699 1.00 0.00 H new ATOM 1332 N PHE A 89 1.399 11.438 11.859 1.00 0.00 N ATOM 1333 CA PHE A 89 2.296 11.001 12.884 1.00 0.00 C ATOM 1334 C PHE A 89 2.351 12.048 13.943 1.00 0.00 C ATOM 1335 O PHE A 89 2.463 11.648 15.101 1.00 0.00 O ATOM 1336 CB PHE A 89 3.654 10.666 12.245 1.00 0.00 C ATOM 1337 CG PHE A 89 4.352 9.863 13.289 1.00 0.00 C ATOM 1338 CD1 PHE A 89 5.082 10.442 14.300 1.00 0.00 C ATOM 1339 CD2 PHE A 89 4.346 8.495 13.152 1.00 0.00 C ATOM 1340 CE1 PHE A 89 5.718 9.657 15.233 1.00 0.00 C ATOM 1341 CE2 PHE A 89 4.980 7.672 14.052 1.00 0.00 C ATOM 1342 CZ PHE A 89 5.642 8.292 15.086 1.00 0.00 C ATOM 0 H PHE A 89 1.874 11.605 10.972 1.00 0.00 H new ATOM 0 HA PHE A 89 1.957 10.087 13.372 1.00 0.00 H new ATOM 0 HB2 PHE A 89 3.532 10.101 11.321 1.00 0.00 H new ATOM 0 HB3 PHE A 89 4.212 11.569 11.996 1.00 0.00 H new ATOM 0 HD1 PHE A 89 5.156 11.518 14.362 1.00 0.00 H new ATOM 0 HD2 PHE A 89 3.828 8.054 12.313 1.00 0.00 H new ATOM 0 HE1 PHE A 89 6.260 10.099 16.056 1.00 0.00 H new ATOM 0 HE2 PHE A 89 4.959 6.597 13.953 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.129 7.672 15.824 1.00 0.00 H new ATOM 1352 N ARG A 90 2.482 13.349 13.628 1.00 0.00 N ATOM 1353 CA ARG A 90 2.637 14.377 14.609 1.00 0.00 C ATOM 1354 C ARG A 90 1.384 14.750 15.324 1.00 0.00 C ATOM 1355 O ARG A 90 1.354 15.181 16.476 1.00 0.00 O ATOM 1356 CB ARG A 90 2.978 15.649 13.814 1.00 0.00 C ATOM 1357 CG ARG A 90 3.187 16.938 14.612 1.00 0.00 C ATOM 1358 CD ARG A 90 3.915 18.022 13.814 1.00 0.00 C ATOM 1359 NE ARG A 90 2.991 18.535 12.764 1.00 0.00 N ATOM 1360 CZ ARG A 90 3.292 18.643 11.437 1.00 0.00 C ATOM 1361 NH1 ARG A 90 4.584 18.525 11.014 1.00 0.00 N ATOM 1362 NH2 ARG A 90 2.346 19.142 10.589 1.00 0.00 N ATOM 0 H ARG A 90 2.480 13.694 12.668 1.00 0.00 H new ATOM 0 HA ARG A 90 3.367 14.018 15.335 1.00 0.00 H new ATOM 0 HB2 ARG A 90 3.885 15.456 13.241 1.00 0.00 H new ATOM 0 HB3 ARG A 90 2.177 15.823 13.095 1.00 0.00 H new ATOM 0 HG2 ARG A 90 2.219 17.320 14.935 1.00 0.00 H new ATOM 0 HG3 ARG A 90 3.757 16.713 15.513 1.00 0.00 H new ATOM 0 HD2 ARG A 90 4.227 18.832 14.473 1.00 0.00 H new ATOM 0 HD3 ARG A 90 4.818 17.615 13.359 1.00 0.00 H new ATOM 0 HE ARG A 90 2.060 18.829 13.060 1.00 0.00 H new ATOM 0 HH11 ARG A 90 5.329 18.356 11.690 1.00 0.00 H new ATOM 0 HH12 ARG A 90 4.805 18.606 10.022 1.00 0.00 H new ATOM 0 HH21 ARG A 90 1.435 19.426 10.951 1.00 0.00 H new ATOM 0 HH22 ARG A 90 2.550 19.231 9.594 1.00 0.00 H new ATOM 1376 N VAL A 91 0.230 14.621 14.646 1.00 0.00 N ATOM 1377 CA VAL A 91 -1.055 14.561 15.272 1.00 0.00 C ATOM 1378 C VAL A 91 -1.155 13.487 16.300 1.00 0.00 C ATOM 1379 O VAL A 91 -1.746 13.758 17.344 1.00 0.00 O ATOM 1380 CB VAL A 91 -2.165 14.521 14.264 1.00 0.00 C ATOM 1381 CG1 VAL A 91 -3.491 13.953 14.798 1.00 0.00 C ATOM 1382 CG2 VAL A 91 -2.389 15.941 13.717 1.00 0.00 C ATOM 0 H VAL A 91 0.189 14.556 13.629 1.00 0.00 H new ATOM 0 HA VAL A 91 -1.175 15.492 15.826 1.00 0.00 H new ATOM 0 HB VAL A 91 -1.848 13.834 13.479 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -4.237 13.961 14.003 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.337 12.930 15.140 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -3.840 14.565 15.630 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -3.194 15.925 12.983 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -2.658 16.608 14.536 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -1.474 16.297 13.244 1.00 0.00 H new ATOM 1392 N PHE A 92 -0.578 12.279 16.171 1.00 0.00 N ATOM 1393 CA PHE A 92 -0.648 11.274 17.186 1.00 0.00 C ATOM 1394 C PHE A 92 0.350 11.530 18.261 1.00 0.00 C ATOM 1395 O PHE A 92 -0.074 11.650 19.410 1.00 0.00 O ATOM 1396 CB PHE A 92 -0.468 9.808 16.756 1.00 0.00 C ATOM 1397 CG PHE A 92 -1.607 9.145 16.061 1.00 0.00 C ATOM 1398 CD1 PHE A 92 -2.793 8.957 16.730 1.00 0.00 C ATOM 1399 CD2 PHE A 92 -1.505 8.904 14.711 1.00 0.00 C ATOM 1400 CE1 PHE A 92 -3.837 8.415 16.018 1.00 0.00 C ATOM 1401 CE2 PHE A 92 -2.550 8.339 14.018 1.00 0.00 C ATOM 1402 CZ PHE A 92 -3.734 8.115 14.680 1.00 0.00 C ATOM 0 H PHE A 92 -0.052 11.994 15.345 1.00 0.00 H new ATOM 0 HA PHE A 92 -1.682 11.371 17.517 1.00 0.00 H new ATOM 0 HB2 PHE A 92 0.401 9.755 16.101 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -0.232 9.224 17.646 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -2.900 9.224 17.771 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -0.595 9.161 14.190 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -4.769 8.218 16.527 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -2.443 8.077 12.976 1.00 0.00 H new ATOM 0 HZ PHE A 92 -4.581 7.704 14.150 1.00 0.00 H new ATOM 1412 N ASP A 93 1.612 11.728 17.842 1.00 0.00 N ATOM 1413 CA ASP A 93 2.718 11.839 18.743 1.00 0.00 C ATOM 1414 C ASP A 93 2.702 13.151 19.449 1.00 0.00 C ATOM 1415 O ASP A 93 2.954 14.220 18.895 1.00 0.00 O ATOM 1416 CB ASP A 93 4.011 11.685 17.925 1.00 0.00 C ATOM 1417 CG ASP A 93 5.228 11.461 18.811 1.00 0.00 C ATOM 1418 OD1 ASP A 93 5.122 10.942 19.954 1.00 0.00 O ATOM 1419 OD2 ASP A 93 6.345 11.739 18.299 1.00 0.00 O ATOM 0 H ASP A 93 1.870 11.813 16.859 1.00 0.00 H new ATOM 0 HA ASP A 93 2.655 11.061 19.504 1.00 0.00 H new ATOM 0 HB2 ASP A 93 3.906 10.847 17.236 1.00 0.00 H new ATOM 0 HB3 ASP A 93 4.164 12.578 17.319 1.00 0.00 H new ATOM 1424 N LYS A 94 2.372 13.160 20.752 1.00 0.00 N ATOM 1425 CA LYS A 94 2.091 14.258 21.624 1.00 0.00 C ATOM 1426 C LYS A 94 3.365 14.907 22.042 1.00 0.00 C ATOM 1427 O LYS A 94 3.580 16.076 21.725 1.00 0.00 O ATOM 1428 CB LYS A 94 1.171 13.881 22.798 1.00 0.00 C ATOM 1429 CG LYS A 94 0.698 15.018 23.706 1.00 0.00 C ATOM 1430 CD LYS A 94 -0.501 14.671 24.591 1.00 0.00 C ATOM 1431 CE LYS A 94 -1.180 15.840 25.308 1.00 0.00 C ATOM 1432 NZ LYS A 94 -1.430 16.886 24.291 1.00 0.00 N ATOM 0 H LYS A 94 2.293 12.277 21.257 1.00 0.00 H new ATOM 0 HA LYS A 94 1.511 14.996 21.069 1.00 0.00 H new ATOM 0 HB2 LYS A 94 0.290 13.384 22.391 1.00 0.00 H new ATOM 0 HB3 LYS A 94 1.693 13.150 23.415 1.00 0.00 H new ATOM 0 HG2 LYS A 94 1.527 15.324 24.344 1.00 0.00 H new ATOM 0 HG3 LYS A 94 0.439 15.876 23.086 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.247 14.169 23.974 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -0.174 13.953 25.343 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -2.114 15.519 25.769 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -0.545 16.223 26.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -2.215 17.493 24.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -0.574 17.463 24.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -1.678 16.438 23.386 1.00 0.00 H new ATOM 1446 N ASP A 95 4.243 14.203 22.780 1.00 0.00 N ATOM 1447 CA ASP A 95 5.488 14.690 23.287 1.00 0.00 C ATOM 1448 C ASP A 95 6.534 15.004 22.273 1.00 0.00 C ATOM 1449 O ASP A 95 7.589 15.514 22.646 1.00 0.00 O ATOM 1450 CB ASP A 95 5.998 13.708 24.354 1.00 0.00 C ATOM 1451 CG ASP A 95 5.971 12.270 23.856 1.00 0.00 C ATOM 1452 OD1 ASP A 95 6.563 12.074 22.761 1.00 0.00 O ATOM 1453 OD2 ASP A 95 5.253 11.376 24.378 1.00 0.00 O ATOM 0 H ASP A 95 4.071 13.231 23.038 1.00 0.00 H new ATOM 0 HA ASP A 95 5.281 15.668 23.721 1.00 0.00 H new ATOM 0 HB2 ASP A 95 7.016 13.976 24.638 1.00 0.00 H new ATOM 0 HB3 ASP A 95 5.384 13.794 25.251 1.00 0.00 H new ATOM 1458 N GLY A 96 6.358 14.578 21.010 1.00 0.00 N ATOM 1459 CA GLY A 96 7.315 14.781 19.967 1.00 0.00 C ATOM 1460 C GLY A 96 8.619 14.063 20.020 1.00 0.00 C ATOM 1461 O GLY A 96 9.610 14.408 19.377 1.00 0.00 O ATOM 0 H GLY A 96 5.524 14.077 20.705 1.00 0.00 H new ATOM 0 HA2 GLY A 96 6.834 14.516 19.026 1.00 0.00 H new ATOM 0 HA3 GLY A 96 7.531 15.849 19.925 1.00 0.00 H new ATOM 1465 N ASN A 97 8.564 12.861 20.621 1.00 0.00 N ATOM 1466 CA ASN A 97 9.722 12.026 20.704 1.00 0.00 C ATOM 1467 C ASN A 97 10.018 11.379 19.396 1.00 0.00 C ATOM 1468 O ASN A 97 11.186 11.291 19.019 1.00 0.00 O ATOM 1469 CB ASN A 97 9.830 11.207 22.002 1.00 0.00 C ATOM 1470 CG ASN A 97 8.795 10.090 22.013 1.00 0.00 C ATOM 1471 OD1 ASN A 97 7.775 9.931 21.345 1.00 0.00 O ATOM 1472 ND2 ASN A 97 9.050 9.024 22.817 1.00 0.00 N ATOM 0 H ASN A 97 7.724 12.469 21.047 1.00 0.00 H new ATOM 0 HA ASN A 97 10.603 12.650 20.855 1.00 0.00 H new ATOM 0 HB2 ASN A 97 10.831 10.785 22.091 1.00 0.00 H new ATOM 0 HB3 ASN A 97 9.681 11.858 22.864 1.00 0.00 H new ATOM 0 HD21 ASN A 97 8.422 8.220 22.813 1.00 0.00 H new ATOM 0 HD22 ASN A 97 9.869 9.028 23.425 1.00 0.00 H new ATOM 1479 N GLY A 98 8.951 10.860 18.762 1.00 0.00 N ATOM 1480 CA GLY A 98 9.125 10.227 17.491 1.00 0.00 C ATOM 1481 C GLY A 98 8.502 8.873 17.503 1.00 0.00 C ATOM 1482 O GLY A 98 8.565 8.100 16.548 1.00 0.00 O ATOM 0 H GLY A 98 7.994 10.876 19.116 1.00 0.00 H new ATOM 0 HA2 GLY A 98 8.674 10.836 16.708 1.00 0.00 H new ATOM 0 HA3 GLY A 98 10.187 10.145 17.259 1.00 0.00 H new ATOM 1486 N TYR A 99 7.811 8.494 18.593 1.00 0.00 N ATOM 1487 CA TYR A 99 7.324 7.189 18.915 1.00 0.00 C ATOM 1488 C TYR A 99 5.970 7.367 19.510 1.00 0.00 C ATOM 1489 O TYR A 99 5.825 7.993 20.559 1.00 0.00 O ATOM 1490 CB TYR A 99 8.295 6.498 19.886 1.00 0.00 C ATOM 1491 CG TYR A 99 9.661 6.476 19.292 1.00 0.00 C ATOM 1492 CD1 TYR A 99 10.586 7.469 19.518 1.00 0.00 C ATOM 1493 CD2 TYR A 99 10.062 5.340 18.629 1.00 0.00 C ATOM 1494 CE1 TYR A 99 11.903 7.298 19.162 1.00 0.00 C ATOM 1495 CE2 TYR A 99 11.343 5.214 18.144 1.00 0.00 C ATOM 1496 CZ TYR A 99 12.273 6.176 18.460 1.00 0.00 C ATOM 1497 OH TYR A 99 13.623 6.021 18.079 1.00 0.00 O ATOM 0 H TYR A 99 7.571 9.170 19.318 1.00 0.00 H new ATOM 0 HA TYR A 99 7.255 6.552 18.034 1.00 0.00 H new ATOM 0 HB2 TYR A 99 8.310 7.026 20.839 1.00 0.00 H new ATOM 0 HB3 TYR A 99 7.959 5.481 20.090 1.00 0.00 H new ATOM 0 HD1 TYR A 99 10.274 8.394 19.980 1.00 0.00 H new ATOM 0 HD2 TYR A 99 9.359 4.533 18.487 1.00 0.00 H new ATOM 0 HE1 TYR A 99 12.641 8.039 19.432 1.00 0.00 H new ATOM 0 HE2 TYR A 99 11.614 4.372 17.524 1.00 0.00 H new ATOM 0 HH TYR A 99 13.730 5.178 17.590 1.00 0.00 H new ATOM 1507 N ILE A 100 4.919 6.736 18.957 1.00 0.00 N ATOM 1508 CA ILE A 100 3.549 6.654 19.361 1.00 0.00 C ATOM 1509 C ILE A 100 3.369 5.684 20.477 1.00 0.00 C ATOM 1510 O ILE A 100 3.492 4.479 20.264 1.00 0.00 O ATOM 1511 CB ILE A 100 2.473 6.523 18.324 1.00 0.00 C ATOM 1512 CG1 ILE A 100 2.556 7.706 17.345 1.00 0.00 C ATOM 1513 CG2 ILE A 100 1.095 6.306 18.971 1.00 0.00 C ATOM 1514 CD1 ILE A 100 2.088 7.247 15.965 1.00 0.00 C ATOM 0 H ILE A 100 5.058 6.205 18.097 1.00 0.00 H new ATOM 0 HA ILE A 100 3.370 7.675 19.697 1.00 0.00 H new ATOM 0 HB ILE A 100 2.630 5.625 17.727 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.936 8.530 17.698 1.00 0.00 H new ATOM 0 HG13 ILE A 100 3.579 8.078 17.291 1.00 0.00 H new ATOM 0 HG21 ILE A 100 0.338 6.215 18.192 1.00 0.00 H new ATOM 0 HG22 ILE A 100 1.113 5.394 19.568 1.00 0.00 H new ATOM 0 HG23 ILE A 100 0.856 7.155 19.612 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.144 8.081 15.266 1.00 0.00 H new ATOM 0 HD12 ILE A 100 2.727 6.436 15.615 1.00 0.00 H new ATOM 0 HD13 ILE A 100 1.058 6.896 16.028 1.00 0.00 H new ATOM 1526 N SER A 101 3.000 6.150 21.684 1.00 0.00 N ATOM 1527 CA SER A 101 2.555 5.310 22.752 1.00 0.00 C ATOM 1528 C SER A 101 1.110 4.972 22.616 1.00 0.00 C ATOM 1529 O SER A 101 0.413 5.814 22.052 1.00 0.00 O ATOM 1530 CB SER A 101 2.804 5.859 24.166 1.00 0.00 C ATOM 1531 OG SER A 101 2.180 7.114 24.396 1.00 0.00 O ATOM 0 H SER A 101 3.012 7.141 21.924 1.00 0.00 H new ATOM 0 HA SER A 101 3.172 4.417 22.650 1.00 0.00 H new ATOM 0 HB2 SER A 101 2.438 5.139 24.898 1.00 0.00 H new ATOM 0 HB3 SER A 101 3.877 5.959 24.326 1.00 0.00 H new ATOM 0 HG SER A 101 2.647 7.810 23.888 1.00 0.00 H new ATOM 1537 N ALA A 102 0.666 3.855 23.220 1.00 0.00 N ATOM 1538 CA ALA A 102 -0.708 3.469 23.303 1.00 0.00 C ATOM 1539 C ALA A 102 -1.592 4.577 23.761 1.00 0.00 C ATOM 1540 O ALA A 102 -2.623 4.781 23.123 1.00 0.00 O ATOM 1541 CB ALA A 102 -0.875 2.239 24.211 1.00 0.00 C ATOM 0 H ALA A 102 1.295 3.191 23.671 1.00 0.00 H new ATOM 0 HA ALA A 102 -1.020 3.211 22.291 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -1.928 1.963 24.260 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -0.300 1.407 23.805 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -0.515 2.475 25.213 1.00 0.00 H new ATOM 1547 N ALA A 103 -1.241 5.321 24.825 1.00 0.00 N ATOM 1548 CA ALA A 103 -2.013 6.352 25.447 1.00 0.00 C ATOM 1549 C ALA A 103 -2.126 7.520 24.529 1.00 0.00 C ATOM 1550 O ALA A 103 -3.148 8.203 24.479 1.00 0.00 O ATOM 1551 CB ALA A 103 -1.266 6.676 26.752 1.00 0.00 C ATOM 0 H ALA A 103 -0.342 5.189 25.288 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.039 6.056 25.666 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -1.797 7.461 27.290 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -1.214 5.782 27.373 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -0.256 7.015 26.519 1.00 0.00 H new ATOM 1557 N GLU A 104 -1.040 7.915 23.841 1.00 0.00 N ATOM 1558 CA GLU A 104 -1.107 8.917 22.824 1.00 0.00 C ATOM 1559 C GLU A 104 -2.021 8.622 21.685 1.00 0.00 C ATOM 1560 O GLU A 104 -2.799 9.449 21.213 1.00 0.00 O ATOM 1561 CB GLU A 104 0.254 9.199 22.165 1.00 0.00 C ATOM 1562 CG GLU A 104 1.267 9.823 23.126 1.00 0.00 C ATOM 1563 CD GLU A 104 2.672 9.848 22.542 1.00 0.00 C ATOM 1564 OE1 GLU A 104 3.393 8.815 22.549 1.00 0.00 O ATOM 1565 OE2 GLU A 104 3.119 10.954 22.134 1.00 0.00 O ATOM 0 H GLU A 104 -0.106 7.535 23.992 1.00 0.00 H new ATOM 0 HA GLU A 104 -1.484 9.766 23.395 1.00 0.00 H new ATOM 0 HB2 GLU A 104 0.661 8.267 21.772 1.00 0.00 H new ATOM 0 HB3 GLU A 104 0.109 9.867 21.316 1.00 0.00 H new ATOM 0 HG2 GLU A 104 0.958 10.840 23.368 1.00 0.00 H new ATOM 0 HG3 GLU A 104 1.273 9.261 24.060 1.00 0.00 H new ATOM 1572 N LEU A 105 -2.089 7.336 21.294 1.00 0.00 N ATOM 1573 CA LEU A 105 -3.044 6.816 20.365 1.00 0.00 C ATOM 1574 C LEU A 105 -4.459 6.965 20.807 1.00 0.00 C ATOM 1575 O LEU A 105 -5.356 7.379 20.074 1.00 0.00 O ATOM 1576 CB LEU A 105 -2.765 5.418 19.788 1.00 0.00 C ATOM 1577 CG LEU A 105 -3.505 5.046 18.493 1.00 0.00 C ATOM 1578 CD1 LEU A 105 -2.753 5.582 17.263 1.00 0.00 C ATOM 1579 CD2 LEU A 105 -3.706 3.523 18.418 1.00 0.00 C ATOM 0 H LEU A 105 -1.446 6.625 21.643 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.894 7.480 19.514 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -1.694 5.333 19.604 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -3.018 4.679 20.549 1.00 0.00 H new ATOM 0 HG LEU A 105 -4.489 5.515 18.500 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -3.294 5.307 16.358 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.679 6.668 17.326 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -1.752 5.151 17.232 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -4.231 3.270 17.497 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -2.736 3.027 18.430 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.294 3.191 19.274 1.00 0.00 H new ATOM 1591 N ARG A 106 -4.688 6.731 22.112 1.00 0.00 N ATOM 1592 CA ARG A 106 -5.951 6.872 22.767 1.00 0.00 C ATOM 1593 C ARG A 106 -6.424 8.276 22.928 1.00 0.00 C ATOM 1594 O ARG A 106 -7.510 8.682 22.518 1.00 0.00 O ATOM 1595 CB ARG A 106 -5.988 5.994 24.029 1.00 0.00 C ATOM 1596 CG ARG A 106 -7.313 5.747 24.753 1.00 0.00 C ATOM 1597 CD ARG A 106 -7.138 5.006 26.080 1.00 0.00 C ATOM 1598 NE ARG A 106 -8.415 4.355 26.488 1.00 0.00 N ATOM 1599 CZ ARG A 106 -9.603 4.968 26.765 1.00 0.00 C ATOM 1600 NH1 ARG A 106 -9.790 6.313 26.904 1.00 0.00 N ATOM 1601 NH2 ARG A 106 -10.487 4.228 27.495 1.00 0.00 N ATOM 0 H ARG A 106 -3.949 6.426 22.745 1.00 0.00 H new ATOM 0 HA ARG A 106 -6.720 6.485 22.099 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -5.581 5.020 23.758 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -5.302 6.436 24.751 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -7.803 6.703 24.938 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -7.973 5.170 24.105 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -6.355 4.254 25.983 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -6.816 5.704 26.853 1.00 0.00 H new ATOM 0 HE ARG A 106 -8.400 3.338 26.569 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -9.001 6.951 26.800 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -10.719 6.680 27.112 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -10.238 3.285 27.794 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -11.397 4.618 27.742 1.00 0.00 H new ATOM 1615 N HIS A 107 -5.467 9.085 23.418 1.00 0.00 N ATOM 1616 CA HIS A 107 -5.596 10.499 23.585 1.00 0.00 C ATOM 1617 C HIS A 107 -6.053 11.243 22.377 1.00 0.00 C ATOM 1618 O HIS A 107 -7.087 11.910 22.394 1.00 0.00 O ATOM 1619 CB HIS A 107 -4.272 11.138 24.035 1.00 0.00 C ATOM 1620 CG HIS A 107 -4.216 12.636 23.972 1.00 0.00 C ATOM 1621 ND1 HIS A 107 -4.965 13.458 24.789 1.00 0.00 N ATOM 1622 CD2 HIS A 107 -3.557 13.458 23.113 1.00 0.00 C ATOM 1623 CE1 HIS A 107 -4.752 14.741 24.391 1.00 0.00 C ATOM 1624 NE2 HIS A 107 -3.870 14.769 23.410 1.00 0.00 N ATOM 0 H HIS A 107 -4.556 8.733 23.713 1.00 0.00 H new ATOM 0 HA HIS A 107 -6.370 10.588 24.347 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -4.071 10.828 25.061 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -3.468 10.737 23.418 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -2.894 13.136 22.324 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -5.234 15.609 24.816 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -3.492 15.601 22.957 1.00 0.00 H new ATOM 1632 N VAL A 108 -5.410 11.032 21.215 1.00 0.00 N ATOM 1633 CA VAL A 108 -5.725 11.678 19.979 1.00 0.00 C ATOM 1634 C VAL A 108 -6.986 11.156 19.380 1.00 0.00 C ATOM 1635 O VAL A 108 -7.827 11.936 18.938 1.00 0.00 O ATOM 1636 CB VAL A 108 -4.530 11.510 19.089 1.00 0.00 C ATOM 1637 CG1 VAL A 108 -4.801 12.089 17.690 1.00 0.00 C ATOM 1638 CG2 VAL A 108 -3.542 12.478 19.762 1.00 0.00 C ATOM 0 H VAL A 108 -4.631 10.378 21.134 1.00 0.00 H new ATOM 0 HA VAL A 108 -5.924 12.739 20.131 1.00 0.00 H new ATOM 0 HB VAL A 108 -4.222 10.470 18.976 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -3.919 11.955 17.064 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -5.648 11.571 17.240 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -5.028 13.152 17.774 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -2.598 12.470 19.218 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -3.957 13.486 19.754 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -3.370 12.165 20.792 1.00 0.00 H new ATOM 1648 N MET A 109 -7.257 9.838 19.358 1.00 0.00 N ATOM 1649 CA MET A 109 -8.423 9.294 18.735 1.00 0.00 C ATOM 1650 C MET A 109 -9.645 9.787 19.431 1.00 0.00 C ATOM 1651 O MET A 109 -10.617 10.271 18.853 1.00 0.00 O ATOM 1652 CB MET A 109 -8.405 7.761 18.857 1.00 0.00 C ATOM 1653 CG MET A 109 -7.562 7.089 17.771 1.00 0.00 C ATOM 1654 SD MET A 109 -8.256 6.962 16.095 1.00 0.00 S ATOM 1655 CE MET A 109 -8.128 8.589 15.298 1.00 0.00 C ATOM 0 H MET A 109 -6.652 9.135 19.783 1.00 0.00 H new ATOM 0 HA MET A 109 -8.431 9.598 17.688 1.00 0.00 H new ATOM 0 HB2 MET A 109 -8.015 7.484 19.836 1.00 0.00 H new ATOM 0 HB3 MET A 109 -9.427 7.385 18.802 1.00 0.00 H new ATOM 0 HG2 MET A 109 -6.619 7.631 17.700 1.00 0.00 H new ATOM 0 HG3 MET A 109 -7.326 6.080 18.110 1.00 0.00 H new ATOM 0 HE1 MET A 109 -8.000 8.459 14.223 1.00 0.00 H new ATOM 0 HE2 MET A 109 -9.037 9.160 15.488 1.00 0.00 H new ATOM 0 HE3 MET A 109 -7.271 9.126 15.703 1.00 0.00 H new ATOM 1665 N THR A 110 -9.749 9.748 20.771 1.00 0.00 N ATOM 1666 CA THR A 110 -10.836 10.229 21.567 1.00 0.00 C ATOM 1667 C THR A 110 -11.058 11.703 21.576 1.00 0.00 C ATOM 1668 O THR A 110 -12.171 12.213 21.692 1.00 0.00 O ATOM 1669 CB THR A 110 -10.802 9.929 23.036 1.00 0.00 C ATOM 1670 OG1 THR A 110 -9.640 10.353 23.734 1.00 0.00 O ATOM 1671 CG2 THR A 110 -10.862 8.397 23.158 1.00 0.00 C ATOM 0 H THR A 110 -9.009 9.345 21.345 1.00 0.00 H new ATOM 0 HA THR A 110 -11.613 9.674 21.041 1.00 0.00 H new ATOM 0 HB THR A 110 -11.632 10.475 23.485 1.00 0.00 H new ATOM 0 HG1 THR A 110 -8.862 9.855 23.407 1.00 0.00 H new ATOM 0 HG21 THR A 110 -10.840 8.115 24.211 1.00 0.00 H new ATOM 0 HG22 THR A 110 -11.783 8.032 22.703 1.00 0.00 H new ATOM 0 HG23 THR A 110 -10.005 7.957 22.647 1.00 0.00 H new ATOM 1679 N ASN A 111 -9.972 12.486 21.446 1.00 0.00 N ATOM 1680 CA ASN A 111 -9.918 13.910 21.331 1.00 0.00 C ATOM 1681 C ASN A 111 -10.589 14.340 20.072 1.00 0.00 C ATOM 1682 O ASN A 111 -11.370 15.286 20.164 1.00 0.00 O ATOM 1683 CB ASN A 111 -8.496 14.493 21.260 1.00 0.00 C ATOM 1684 CG ASN A 111 -8.610 15.992 21.495 1.00 0.00 C ATOM 1685 OD1 ASN A 111 -8.920 16.403 22.612 1.00 0.00 O ATOM 1686 ND2 ASN A 111 -8.258 16.842 20.493 1.00 0.00 N ATOM 0 H ASN A 111 -9.038 12.077 21.419 1.00 0.00 H new ATOM 0 HA ASN A 111 -10.404 14.276 22.235 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -7.854 14.034 22.012 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -8.045 14.289 20.289 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -8.247 17.848 20.658 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -8.005 16.473 19.576 1.00 0.00 H new ATOM 1693 N LEU A 112 -10.472 13.651 18.923 1.00 0.00 N ATOM 1694 CA LEU A 112 -11.188 13.914 17.713 1.00 0.00 C ATOM 1695 C LEU A 112 -12.622 13.535 17.851 1.00 0.00 C ATOM 1696 O LEU A 112 -13.473 14.019 17.107 1.00 0.00 O ATOM 1697 CB LEU A 112 -10.610 13.080 16.557 1.00 0.00 C ATOM 1698 CG LEU A 112 -9.109 13.340 16.343 1.00 0.00 C ATOM 1699 CD1 LEU A 112 -8.358 12.178 15.671 1.00 0.00 C ATOM 1700 CD2 LEU A 112 -8.991 14.571 15.429 1.00 0.00 C ATOM 0 H LEU A 112 -9.836 12.859 18.834 1.00 0.00 H new ATOM 0 HA LEU A 112 -11.094 14.981 17.510 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -10.767 12.021 16.762 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -11.151 13.311 15.639 1.00 0.00 H new ATOM 0 HG LEU A 112 -8.657 13.476 17.325 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -7.307 12.442 15.557 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -8.443 11.284 16.289 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.792 11.983 14.690 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.939 14.792 15.250 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.485 14.368 14.479 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.465 15.427 15.909 1.00 0.00 H new ATOM 1712 N GLY A 113 -12.951 12.619 18.780 1.00 0.00 N ATOM 1713 CA GLY A 113 -14.265 12.075 18.935 1.00 0.00 C ATOM 1714 C GLY A 113 -14.458 10.767 18.249 1.00 0.00 C ATOM 1715 O GLY A 113 -15.574 10.281 18.071 1.00 0.00 O ATOM 0 H GLY A 113 -12.277 12.243 19.448 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -14.474 11.952 19.998 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -14.992 12.789 18.548 1.00 0.00 H new ATOM 1719 N GLU A 114 -13.330 10.081 17.993 1.00 0.00 N ATOM 1720 CA GLU A 114 -13.407 8.727 17.541 1.00 0.00 C ATOM 1721 C GLU A 114 -13.627 7.770 18.662 1.00 0.00 C ATOM 1722 O GLU A 114 -13.015 8.033 19.695 1.00 0.00 O ATOM 1723 CB GLU A 114 -12.116 8.319 16.811 1.00 0.00 C ATOM 1724 CG GLU A 114 -12.192 6.932 16.170 1.00 0.00 C ATOM 1725 CD GLU A 114 -13.062 6.994 14.922 1.00 0.00 C ATOM 1726 OE1 GLU A 114 -12.587 7.493 13.868 1.00 0.00 O ATOM 1727 OE2 GLU A 114 -14.213 6.491 15.024 1.00 0.00 O ATOM 0 H GLU A 114 -12.386 10.453 18.096 1.00 0.00 H new ATOM 0 HA GLU A 114 -14.259 8.682 16.862 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -11.896 9.056 16.039 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -11.286 8.340 17.517 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -11.192 6.584 15.912 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -12.606 6.215 16.879 1.00 0.00 H new ATOM 1734 N LYS A 115 -14.456 6.713 18.589 1.00 0.00 N ATOM 1735 CA LYS A 115 -14.825 6.082 19.818 1.00 0.00 C ATOM 1736 C LYS A 115 -14.136 4.772 19.990 1.00 0.00 C ATOM 1737 O LYS A 115 -14.739 3.777 19.591 1.00 0.00 O ATOM 1738 CB LYS A 115 -16.343 5.837 19.841 1.00 0.00 C ATOM 1739 CG LYS A 115 -17.154 7.116 20.063 1.00 0.00 C ATOM 1740 CD LYS A 115 -18.665 6.955 19.887 1.00 0.00 C ATOM 1741 CE LYS A 115 -19.447 8.268 19.962 1.00 0.00 C ATOM 1742 NZ LYS A 115 -20.877 8.000 19.691 1.00 0.00 N ATOM 0 H LYS A 115 -14.850 6.314 17.737 1.00 0.00 H new ATOM 0 HA LYS A 115 -14.528 6.747 20.629 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -16.646 5.381 18.898 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -16.578 5.123 20.631 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -16.957 7.485 21.070 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -16.801 7.879 19.369 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -18.859 6.484 18.924 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -19.039 6.278 20.655 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -19.330 8.719 20.947 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -19.055 8.981 19.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -21.413 8.890 19.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -20.979 7.587 18.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -21.246 7.334 20.400 1.00 0.00 H new ATOM 1756 N LEU A 116 -12.966 4.718 20.651 1.00 0.00 N ATOM 1757 CA LEU A 116 -12.162 3.563 20.908 1.00 0.00 C ATOM 1758 C LEU A 116 -12.319 3.021 22.287 1.00 0.00 C ATOM 1759 O LEU A 116 -12.500 3.709 23.290 1.00 0.00 O ATOM 1760 CB LEU A 116 -10.678 3.758 20.555 1.00 0.00 C ATOM 1761 CG LEU A 116 -10.432 4.090 19.074 1.00 0.00 C ATOM 1762 CD1 LEU A 116 -8.942 4.221 18.716 1.00 0.00 C ATOM 1763 CD2 LEU A 116 -10.943 3.013 18.102 1.00 0.00 C ATOM 0 H LEU A 116 -12.546 5.562 21.041 1.00 0.00 H new ATOM 0 HA LEU A 116 -12.555 2.809 20.226 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -10.270 4.560 21.170 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -10.131 2.850 20.810 1.00 0.00 H new ATOM 0 HG LEU A 116 -10.971 5.031 18.963 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -8.842 4.456 17.656 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -8.494 5.019 19.308 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -8.433 3.281 18.929 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -10.733 3.319 17.077 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -10.440 2.068 18.309 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -12.018 2.888 18.230 1.00 0.00 H new ATOM 1775 N THR A 117 -12.153 1.690 22.393 1.00 0.00 N ATOM 1776 CA THR A 117 -11.945 1.033 23.645 1.00 0.00 C ATOM 1777 C THR A 117 -10.469 0.884 23.790 1.00 0.00 C ATOM 1778 O THR A 117 -9.759 1.098 22.809 1.00 0.00 O ATOM 1779 CB THR A 117 -12.690 -0.265 23.751 1.00 0.00 C ATOM 1780 OG1 THR A 117 -12.516 -1.086 22.605 1.00 0.00 O ATOM 1781 CG2 THR A 117 -14.206 -0.041 23.882 1.00 0.00 C ATOM 0 H THR A 117 -12.164 1.058 21.592 1.00 0.00 H new ATOM 0 HA THR A 117 -12.350 1.621 24.469 1.00 0.00 H new ATOM 0 HB THR A 117 -12.280 -0.749 24.637 1.00 0.00 H new ATOM 0 HG1 THR A 117 -12.902 -0.641 21.822 1.00 0.00 H new ATOM 0 HG21 THR A 117 -14.711 -1.004 23.956 1.00 0.00 H new ATOM 0 HG22 THR A 117 -14.411 0.546 24.777 1.00 0.00 H new ATOM 0 HG23 THR A 117 -14.572 0.494 23.006 1.00 0.00 H new ATOM 1789 N ASP A 118 -9.959 0.436 24.950 1.00 0.00 N ATOM 1790 CA ASP A 118 -8.590 0.037 25.057 1.00 0.00 C ATOM 1791 C ASP A 118 -8.176 -1.147 24.253 1.00 0.00 C ATOM 1792 O ASP A 118 -7.097 -1.137 23.661 1.00 0.00 O ATOM 1793 CB ASP A 118 -8.275 -0.197 26.544 1.00 0.00 C ATOM 1794 CG ASP A 118 -8.302 1.194 27.162 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -9.407 1.723 27.456 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -7.202 1.732 27.463 1.00 0.00 O ATOM 0 H ASP A 118 -10.494 0.350 25.814 1.00 0.00 H new ATOM 0 HA ASP A 118 -8.010 0.853 24.626 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -9.013 -0.852 27.008 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -7.302 -0.670 26.674 1.00 0.00 H new ATOM 1801 N GLU A 119 -9.103 -2.108 24.091 1.00 0.00 N ATOM 1802 CA GLU A 119 -8.777 -3.285 23.346 1.00 0.00 C ATOM 1803 C GLU A 119 -8.541 -3.007 21.902 1.00 0.00 C ATOM 1804 O GLU A 119 -7.732 -3.626 21.213 1.00 0.00 O ATOM 1805 CB GLU A 119 -9.885 -4.335 23.537 1.00 0.00 C ATOM 1806 CG GLU A 119 -9.665 -5.706 22.895 1.00 0.00 C ATOM 1807 CD GLU A 119 -10.593 -6.818 23.361 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -11.837 -6.657 23.474 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -10.040 -7.931 23.568 1.00 0.00 O ATOM 0 H GLU A 119 -10.052 -2.075 24.464 1.00 0.00 H new ATOM 0 HA GLU A 119 -7.836 -3.675 23.733 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -10.030 -4.482 24.607 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -10.814 -3.922 23.143 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -9.771 -5.601 21.815 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -8.637 -6.014 23.086 1.00 0.00 H new ATOM 1816 N GLU A 120 -9.243 -2.016 21.324 1.00 0.00 N ATOM 1817 CA GLU A 120 -9.055 -1.381 20.057 1.00 0.00 C ATOM 1818 C GLU A 120 -7.728 -0.725 19.887 1.00 0.00 C ATOM 1819 O GLU A 120 -6.967 -1.028 18.969 1.00 0.00 O ATOM 1820 CB GLU A 120 -10.257 -0.450 19.822 1.00 0.00 C ATOM 1821 CG GLU A 120 -11.457 -1.242 19.300 1.00 0.00 C ATOM 1822 CD GLU A 120 -12.623 -0.271 19.180 1.00 0.00 C ATOM 1823 OE1 GLU A 120 -13.182 0.163 20.222 1.00 0.00 O ATOM 1824 OE2 GLU A 120 -13.127 -0.239 18.025 1.00 0.00 O ATOM 0 H GLU A 120 -10.043 -1.612 21.811 1.00 0.00 H new ATOM 0 HA GLU A 120 -9.027 -2.140 19.275 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -10.523 0.052 20.752 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -9.988 0.327 19.106 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -11.230 -1.691 18.333 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -11.704 -2.057 19.980 1.00 0.00 H new ATOM 1831 N VAL A 121 -7.339 0.130 20.849 1.00 0.00 N ATOM 1832 CA VAL A 121 -6.080 0.797 20.971 1.00 0.00 C ATOM 1833 C VAL A 121 -4.903 -0.115 20.920 1.00 0.00 C ATOM 1834 O VAL A 121 -3.962 0.125 20.165 1.00 0.00 O ATOM 1835 CB VAL A 121 -6.091 1.689 22.176 1.00 0.00 C ATOM 1836 CG1 VAL A 121 -4.678 2.249 22.413 1.00 0.00 C ATOM 1837 CG2 VAL A 121 -7.145 2.776 21.905 1.00 0.00 C ATOM 0 H VAL A 121 -7.968 0.376 21.613 1.00 0.00 H new ATOM 0 HA VAL A 121 -5.954 1.422 20.087 1.00 0.00 H new ATOM 0 HB VAL A 121 -6.358 1.161 23.092 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -4.686 2.898 23.289 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -3.983 1.425 22.577 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -4.362 2.821 21.541 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -7.194 3.456 22.756 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -6.870 3.334 21.010 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -8.119 2.310 21.757 1.00 0.00 H new ATOM 1847 N ASP A 122 -4.842 -1.145 21.783 1.00 0.00 N ATOM 1848 CA ASP A 122 -3.679 -1.945 22.012 1.00 0.00 C ATOM 1849 C ASP A 122 -3.520 -2.777 20.786 1.00 0.00 C ATOM 1850 O ASP A 122 -2.384 -3.051 20.404 1.00 0.00 O ATOM 1851 CB ASP A 122 -3.974 -2.806 23.251 1.00 0.00 C ATOM 1852 CG ASP A 122 -2.861 -3.712 23.760 1.00 0.00 C ATOM 1853 OD1 ASP A 122 -2.007 -3.205 24.535 1.00 0.00 O ATOM 1854 OD2 ASP A 122 -2.820 -4.927 23.428 1.00 0.00 O ATOM 0 H ASP A 122 -5.641 -1.433 22.347 1.00 0.00 H new ATOM 0 HA ASP A 122 -2.766 -1.377 22.192 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -4.262 -2.139 24.063 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -4.840 -3.430 23.029 1.00 0.00 H new ATOM 1859 N GLU A 123 -4.620 -3.154 20.110 1.00 0.00 N ATOM 1860 CA GLU A 123 -4.648 -3.845 18.858 1.00 0.00 C ATOM 1861 C GLU A 123 -3.903 -3.157 17.767 1.00 0.00 C ATOM 1862 O GLU A 123 -3.068 -3.752 17.088 1.00 0.00 O ATOM 1863 CB GLU A 123 -6.073 -4.207 18.407 1.00 0.00 C ATOM 1864 CG GLU A 123 -6.103 -4.976 17.085 1.00 0.00 C ATOM 1865 CD GLU A 123 -7.512 -5.457 16.772 1.00 0.00 C ATOM 1866 OE1 GLU A 123 -8.066 -6.336 17.485 1.00 0.00 O ATOM 1867 OE2 GLU A 123 -8.169 -4.902 15.850 1.00 0.00 O ATOM 0 H GLU A 123 -5.557 -2.962 20.465 1.00 0.00 H new ATOM 0 HA GLU A 123 -4.115 -4.775 19.055 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -6.552 -4.807 19.181 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -6.659 -3.294 18.303 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -5.745 -4.336 16.279 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -5.426 -5.829 17.140 1.00 0.00 H new ATOM 1874 N MET A 124 -4.123 -1.830 17.724 1.00 0.00 N ATOM 1875 CA MET A 124 -3.518 -1.021 16.712 1.00 0.00 C ATOM 1876 C MET A 124 -2.048 -0.997 16.956 1.00 0.00 C ATOM 1877 O MET A 124 -1.293 -1.128 15.994 1.00 0.00 O ATOM 1878 CB MET A 124 -4.204 0.356 16.752 1.00 0.00 C ATOM 1879 CG MET A 124 -5.682 0.198 16.393 1.00 0.00 C ATOM 1880 SD MET A 124 -6.725 1.639 16.769 1.00 0.00 S ATOM 1881 CE MET A 124 -8.213 0.936 16.000 1.00 0.00 C ATOM 0 H MET A 124 -4.713 -1.322 18.383 1.00 0.00 H new ATOM 0 HA MET A 124 -3.650 -1.409 15.702 1.00 0.00 H new ATOM 0 HB2 MET A 124 -4.105 0.795 17.745 1.00 0.00 H new ATOM 0 HB3 MET A 124 -3.719 1.037 16.052 1.00 0.00 H new ATOM 0 HG2 MET A 124 -5.760 -0.019 15.328 1.00 0.00 H new ATOM 0 HG3 MET A 124 -6.079 -0.667 16.925 1.00 0.00 H new ATOM 0 HE1 MET A 124 -9.038 1.642 16.092 1.00 0.00 H new ATOM 0 HE2 MET A 124 -8.019 0.740 14.945 1.00 0.00 H new ATOM 0 HE3 MET A 124 -8.475 0.004 16.500 1.00 0.00 H new ATOM 1891 N ILE A 125 -1.595 -0.888 18.218 1.00 0.00 N ATOM 1892 CA ILE A 125 -0.213 -0.737 18.551 1.00 0.00 C ATOM 1893 C ILE A 125 0.611 -1.945 18.263 1.00 0.00 C ATOM 1894 O ILE A 125 1.736 -1.910 17.767 1.00 0.00 O ATOM 1895 CB ILE A 125 -0.174 -0.386 20.009 1.00 0.00 C ATOM 1896 CG1 ILE A 125 -0.625 1.058 20.283 1.00 0.00 C ATOM 1897 CG2 ILE A 125 1.202 -0.620 20.656 1.00 0.00 C ATOM 1898 CD1 ILE A 125 0.243 2.167 19.690 1.00 0.00 C ATOM 0 H ILE A 125 -2.210 -0.906 19.032 1.00 0.00 H new ATOM 0 HA ILE A 125 0.229 0.041 17.929 1.00 0.00 H new ATOM 0 HB ILE A 125 -0.886 -1.071 20.471 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -1.639 1.177 19.901 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -0.672 1.202 21.362 1.00 0.00 H new ATOM 0 HG21 ILE A 125 1.160 -0.346 21.710 1.00 0.00 H new ATOM 0 HG22 ILE A 125 1.473 -1.672 20.565 1.00 0.00 H new ATOM 0 HG23 ILE A 125 1.950 -0.008 20.152 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.178 3.138 19.952 1.00 0.00 H new ATOM 0 HD12 ILE A 125 1.254 2.090 20.089 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.272 2.065 18.605 1.00 0.00 H new ATOM 1910 N ARG A 126 0.080 -3.083 18.743 1.00 0.00 N ATOM 1911 CA ARG A 126 0.650 -4.393 18.683 1.00 0.00 C ATOM 1912 C ARG A 126 0.880 -4.837 17.279 1.00 0.00 C ATOM 1913 O ARG A 126 1.962 -5.362 17.021 1.00 0.00 O ATOM 1914 CB ARG A 126 -0.227 -5.421 19.419 1.00 0.00 C ATOM 1915 CG ARG A 126 0.381 -6.728 19.932 1.00 0.00 C ATOM 1916 CD ARG A 126 -0.700 -7.781 20.182 1.00 0.00 C ATOM 1917 NE ARG A 126 -1.769 -7.210 21.049 1.00 0.00 N ATOM 1918 CZ ARG A 126 -3.114 -7.309 20.844 1.00 0.00 C ATOM 1919 NH1 ARG A 126 -3.754 -8.016 19.868 1.00 0.00 N ATOM 1920 NH2 ARG A 126 -3.914 -6.489 21.587 1.00 0.00 N ATOM 0 H ARG A 126 -0.825 -3.085 19.213 1.00 0.00 H new ATOM 0 HA ARG A 126 1.616 -4.334 19.184 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -0.670 -4.913 20.276 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -1.044 -5.687 18.749 1.00 0.00 H new ATOM 0 HG2 ARG A 126 1.100 -7.107 19.206 1.00 0.00 H new ATOM 0 HG3 ARG A 126 0.929 -6.539 20.855 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -1.125 -8.111 19.234 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -0.263 -8.659 20.658 1.00 0.00 H new ATOM 0 HE ARG A 126 -1.466 -6.695 21.876 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -3.214 -8.550 19.187 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -4.773 -8.011 19.819 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -3.499 -5.842 22.257 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -4.927 -6.524 21.472 1.00 0.00 H new ATOM 1934 N GLU A 127 -0.071 -4.693 16.339 1.00 0.00 N ATOM 1935 CA GLU A 127 0.132 -5.118 14.989 1.00 0.00 C ATOM 1936 C GLU A 127 1.052 -4.253 14.197 1.00 0.00 C ATOM 1937 O GLU A 127 1.671 -4.679 13.223 1.00 0.00 O ATOM 1938 CB GLU A 127 -1.197 -5.228 14.223 1.00 0.00 C ATOM 1939 CG GLU A 127 -2.160 -6.273 14.789 1.00 0.00 C ATOM 1940 CD GLU A 127 -1.494 -7.635 14.652 1.00 0.00 C ATOM 1941 OE1 GLU A 127 -1.276 -8.063 13.488 1.00 0.00 O ATOM 1942 OE2 GLU A 127 -1.256 -8.328 15.678 1.00 0.00 O ATOM 0 H GLU A 127 -0.986 -4.279 16.516 1.00 0.00 H new ATOM 0 HA GLU A 127 0.604 -6.095 15.092 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -1.689 -4.255 14.229 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -0.985 -5.471 13.182 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -2.385 -6.060 15.834 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -3.107 -6.254 14.249 1.00 0.00 H new ATOM 1949 N ALA A 128 1.264 -2.986 14.596 1.00 0.00 N ATOM 1950 CA ALA A 128 2.170 -2.019 14.060 1.00 0.00 C ATOM 1951 C ALA A 128 3.597 -2.092 14.484 1.00 0.00 C ATOM 1952 O ALA A 128 4.475 -1.763 13.688 1.00 0.00 O ATOM 1953 CB ALA A 128 1.544 -0.675 14.469 1.00 0.00 C ATOM 0 H ALA A 128 0.740 -2.600 15.382 1.00 0.00 H new ATOM 0 HA ALA A 128 2.267 -2.191 12.988 1.00 0.00 H new ATOM 0 HB1 ALA A 128 2.166 0.142 14.104 1.00 0.00 H new ATOM 0 HB2 ALA A 128 0.546 -0.592 14.038 1.00 0.00 H new ATOM 0 HB3 ALA A 128 1.475 -0.621 15.556 1.00 0.00 H new ATOM 1959 N ASP A 129 3.915 -2.498 15.726 1.00 0.00 N ATOM 1960 CA ASP A 129 5.229 -2.598 16.280 1.00 0.00 C ATOM 1961 C ASP A 129 5.982 -3.736 15.682 1.00 0.00 C ATOM 1962 O ASP A 129 5.559 -4.891 15.639 1.00 0.00 O ATOM 1963 CB ASP A 129 5.248 -2.605 17.818 1.00 0.00 C ATOM 1964 CG ASP A 129 6.606 -2.759 18.487 1.00 0.00 C ATOM 1965 OD1 ASP A 129 7.633 -2.083 18.211 1.00 0.00 O ATOM 1966 OD2 ASP A 129 6.692 -3.633 19.390 1.00 0.00 O ATOM 0 H ASP A 129 3.196 -2.778 16.393 1.00 0.00 H new ATOM 0 HA ASP A 129 5.754 -1.684 16.004 1.00 0.00 H new ATOM 0 HB2 ASP A 129 4.801 -1.674 18.167 1.00 0.00 H new ATOM 0 HB3 ASP A 129 4.606 -3.416 18.162 1.00 0.00 H new ATOM 1971 N ILE A 130 7.135 -3.406 15.074 1.00 0.00 N ATOM 1972 CA ILE A 130 8.073 -4.291 14.457 1.00 0.00 C ATOM 1973 C ILE A 130 9.182 -4.645 15.388 1.00 0.00 C ATOM 1974 O ILE A 130 9.470 -5.821 15.602 1.00 0.00 O ATOM 1975 CB ILE A 130 8.469 -3.679 13.146 1.00 0.00 C ATOM 1976 CG1 ILE A 130 7.228 -3.880 12.261 1.00 0.00 C ATOM 1977 CG2 ILE A 130 9.744 -4.349 12.607 1.00 0.00 C ATOM 1978 CD1 ILE A 130 7.353 -3.148 10.925 1.00 0.00 C ATOM 0 H ILE A 130 7.436 -2.433 15.010 1.00 0.00 H new ATOM 0 HA ILE A 130 7.639 -5.265 14.232 1.00 0.00 H new ATOM 0 HB ILE A 130 8.731 -2.623 13.203 1.00 0.00 H new ATOM 0 HG12 ILE A 130 7.081 -4.945 12.079 1.00 0.00 H new ATOM 0 HG13 ILE A 130 6.344 -3.522 12.789 1.00 0.00 H new ATOM 0 HG21 ILE A 130 10.019 -3.895 11.655 1.00 0.00 H new ATOM 0 HG22 ILE A 130 10.556 -4.214 13.322 1.00 0.00 H new ATOM 0 HG23 ILE A 130 9.562 -5.414 12.461 1.00 0.00 H new ATOM 0 HD11 ILE A 130 6.454 -3.317 10.332 1.00 0.00 H new ATOM 0 HD12 ILE A 130 7.473 -2.080 11.105 1.00 0.00 H new ATOM 0 HD13 ILE A 130 8.221 -3.524 10.384 1.00 0.00 H new ATOM 1990 N ASP A 131 9.870 -3.684 16.031 1.00 0.00 N ATOM 1991 CA ASP A 131 11.101 -3.915 16.721 1.00 0.00 C ATOM 1992 C ASP A 131 10.996 -4.313 18.153 1.00 0.00 C ATOM 1993 O ASP A 131 12.002 -4.525 18.829 1.00 0.00 O ATOM 1994 CB ASP A 131 11.963 -2.647 16.603 1.00 0.00 C ATOM 1995 CG ASP A 131 11.244 -1.402 17.103 1.00 0.00 C ATOM 1996 OD1 ASP A 131 10.778 -1.441 18.274 1.00 0.00 O ATOM 1997 OD2 ASP A 131 11.017 -0.378 16.406 1.00 0.00 O ATOM 0 H ASP A 131 9.559 -2.714 16.072 1.00 0.00 H new ATOM 0 HA ASP A 131 11.548 -4.783 16.236 1.00 0.00 H new ATOM 0 HB2 ASP A 131 12.883 -2.783 17.171 1.00 0.00 H new ATOM 0 HB3 ASP A 131 12.250 -2.503 15.561 1.00 0.00 H new ATOM 2002 N GLY A 132 9.780 -4.566 18.669 1.00 0.00 N ATOM 2003 CA GLY A 132 9.565 -5.109 19.974 1.00 0.00 C ATOM 2004 C GLY A 132 9.631 -4.111 21.078 1.00 0.00 C ATOM 2005 O GLY A 132 9.810 -4.576 22.202 1.00 0.00 O ATOM 0 H GLY A 132 8.915 -4.386 18.159 1.00 0.00 H new ATOM 0 HA2 GLY A 132 8.588 -5.592 19.996 1.00 0.00 H new ATOM 0 HA3 GLY A 132 10.308 -5.885 20.158 1.00 0.00 H new ATOM 2009 N ASP A 133 9.374 -2.812 20.838 1.00 0.00 N ATOM 2010 CA ASP A 133 9.191 -1.896 21.921 1.00 0.00 C ATOM 2011 C ASP A 133 7.843 -1.542 22.446 1.00 0.00 C ATOM 2012 O ASP A 133 7.669 -1.098 23.580 1.00 0.00 O ATOM 2013 CB ASP A 133 10.090 -0.652 21.815 1.00 0.00 C ATOM 2014 CG ASP A 133 9.676 0.329 20.727 1.00 0.00 C ATOM 2015 OD1 ASP A 133 8.649 0.142 20.021 1.00 0.00 O ATOM 2016 OD2 ASP A 133 10.345 1.338 20.379 1.00 0.00 O ATOM 0 H ASP A 133 9.294 -2.401 19.908 1.00 0.00 H new ATOM 0 HA ASP A 133 9.513 -2.574 22.712 1.00 0.00 H new ATOM 0 HB2 ASP A 133 10.089 -0.134 22.774 1.00 0.00 H new ATOM 0 HB3 ASP A 133 11.115 -0.973 21.628 1.00 0.00 H new ATOM 2021 N GLY A 134 6.818 -1.812 21.619 1.00 0.00 N ATOM 2022 CA GLY A 134 5.462 -1.437 21.875 1.00 0.00 C ATOM 2023 C GLY A 134 5.061 -0.028 21.604 1.00 0.00 C ATOM 2024 O GLY A 134 4.010 0.461 22.017 1.00 0.00 O ATOM 0 H GLY A 134 6.938 -2.311 20.738 1.00 0.00 H new ATOM 0 HA2 GLY A 134 4.819 -2.087 21.282 1.00 0.00 H new ATOM 0 HA3 GLY A 134 5.250 -1.649 22.923 1.00 0.00 H new ATOM 2028 N GLN A 135 5.918 0.760 20.931 1.00 0.00 N ATOM 2029 CA GLN A 135 5.612 2.087 20.494 1.00 0.00 C ATOM 2030 C GLN A 135 5.765 2.034 19.013 1.00 0.00 C ATOM 2031 O GLN A 135 6.542 1.212 18.530 1.00 0.00 O ATOM 2032 CB GLN A 135 6.523 3.199 21.041 1.00 0.00 C ATOM 2033 CG GLN A 135 6.413 3.373 22.557 1.00 0.00 C ATOM 2034 CD GLN A 135 7.248 4.576 22.974 1.00 0.00 C ATOM 2035 OE1 GLN A 135 6.906 5.733 22.735 1.00 0.00 O ATOM 2036 NE2 GLN A 135 8.367 4.368 23.718 1.00 0.00 N ATOM 0 H GLN A 135 6.861 0.461 20.681 1.00 0.00 H new ATOM 0 HA GLN A 135 4.619 2.350 20.858 1.00 0.00 H new ATOM 0 HB2 GLN A 135 7.557 2.974 20.781 1.00 0.00 H new ATOM 0 HB3 GLN A 135 6.270 4.141 20.554 1.00 0.00 H new ATOM 0 HG2 GLN A 135 5.372 3.518 22.846 1.00 0.00 H new ATOM 0 HG3 GLN A 135 6.763 2.475 23.066 1.00 0.00 H new ATOM 0 HE21 GLN A 135 8.670 3.417 23.929 1.00 0.00 H new ATOM 0 HE22 GLN A 135 8.904 5.163 24.065 1.00 0.00 H new ATOM 2045 N VAL A 136 5.067 2.916 18.274 1.00 0.00 N ATOM 2046 CA VAL A 136 5.072 2.819 16.848 1.00 0.00 C ATOM 2047 C VAL A 136 5.807 3.973 16.259 1.00 0.00 C ATOM 2048 O VAL A 136 5.426 5.130 16.434 1.00 0.00 O ATOM 2049 CB VAL A 136 3.669 2.776 16.318 1.00 0.00 C ATOM 2050 CG1 VAL A 136 3.638 2.449 14.815 1.00 0.00 C ATOM 2051 CG2 VAL A 136 2.769 1.801 17.096 1.00 0.00 C ATOM 0 H VAL A 136 4.510 3.681 18.654 1.00 0.00 H new ATOM 0 HA VAL A 136 5.577 1.895 16.565 1.00 0.00 H new ATOM 0 HB VAL A 136 3.265 3.778 16.462 1.00 0.00 H new ATOM 0 HG11 VAL A 136 2.605 2.427 14.469 1.00 0.00 H new ATOM 0 HG12 VAL A 136 4.189 3.212 14.265 1.00 0.00 H new ATOM 0 HG13 VAL A 136 4.099 1.476 14.645 1.00 0.00 H new ATOM 0 HG21 VAL A 136 1.766 1.812 16.669 1.00 0.00 H new ATOM 0 HG22 VAL A 136 3.181 0.794 17.030 1.00 0.00 H new ATOM 0 HG23 VAL A 136 2.721 2.106 18.141 1.00 0.00 H new ATOM 2061 N ASN A 137 6.955 3.787 15.583 1.00 0.00 N ATOM 2062 CA ASN A 137 7.830 4.834 15.157 1.00 0.00 C ATOM 2063 C ASN A 137 7.450 5.145 13.750 1.00 0.00 C ATOM 2064 O ASN A 137 6.518 4.543 13.220 1.00 0.00 O ATOM 2065 CB ASN A 137 9.327 4.591 15.412 1.00 0.00 C ATOM 2066 CG ASN A 137 10.221 3.812 14.458 1.00 0.00 C ATOM 2067 OD1 ASN A 137 10.501 4.160 13.312 1.00 0.00 O ATOM 2068 ND2 ASN A 137 10.661 2.618 14.937 1.00 0.00 N ATOM 0 H ASN A 137 7.289 2.860 15.321 1.00 0.00 H new ATOM 0 HA ASN A 137 7.692 5.718 15.780 1.00 0.00 H new ATOM 0 HB2 ASN A 137 9.783 5.574 15.528 1.00 0.00 H new ATOM 0 HB3 ASN A 137 9.398 4.091 16.378 1.00 0.00 H new ATOM 0 HD21 ASN A 137 11.225 2.008 14.345 1.00 0.00 H new ATOM 0 HD22 ASN A 137 10.427 2.332 15.888 1.00 0.00 H new ATOM 2075 N TYR A 138 8.094 6.160 13.145 1.00 0.00 N ATOM 2076 CA TYR A 138 7.716 6.573 11.829 1.00 0.00 C ATOM 2077 C TYR A 138 7.681 5.414 10.893 1.00 0.00 C ATOM 2078 O TYR A 138 6.618 5.206 10.310 1.00 0.00 O ATOM 2079 CB TYR A 138 8.578 7.773 11.401 1.00 0.00 C ATOM 2080 CG TYR A 138 8.278 8.267 10.028 1.00 0.00 C ATOM 2081 CD1 TYR A 138 7.106 8.979 9.938 1.00 0.00 C ATOM 2082 CD2 TYR A 138 9.061 7.967 8.937 1.00 0.00 C ATOM 2083 CE1 TYR A 138 6.645 9.266 8.675 1.00 0.00 C ATOM 2084 CE2 TYR A 138 8.573 8.295 7.694 1.00 0.00 C ATOM 2085 CZ TYR A 138 7.390 8.982 7.555 1.00 0.00 C ATOM 2086 OH TYR A 138 6.948 9.269 6.246 1.00 0.00 O ATOM 0 H TYR A 138 8.863 6.687 13.558 1.00 0.00 H new ATOM 0 HA TYR A 138 6.690 6.940 11.811 1.00 0.00 H new ATOM 0 HB2 TYR A 138 8.430 8.587 12.111 1.00 0.00 H new ATOM 0 HB3 TYR A 138 9.630 7.491 11.454 1.00 0.00 H new ATOM 0 HD1 TYR A 138 6.571 9.299 10.820 1.00 0.00 H new ATOM 0 HD2 TYR A 138 10.024 7.491 9.053 1.00 0.00 H new ATOM 0 HE1 TYR A 138 5.674 9.726 8.560 1.00 0.00 H new ATOM 0 HE2 TYR A 138 9.128 8.008 6.813 1.00 0.00 H new ATOM 0 HH TYR A 138 7.630 8.987 5.601 1.00 0.00 H new ATOM 2096 N GLU A 139 8.750 4.603 10.796 1.00 0.00 N ATOM 2097 CA GLU A 139 8.849 3.645 9.739 1.00 0.00 C ATOM 2098 C GLU A 139 7.791 2.615 9.937 1.00 0.00 C ATOM 2099 O GLU A 139 7.337 1.985 8.983 1.00 0.00 O ATOM 2100 CB GLU A 139 10.285 3.113 9.592 1.00 0.00 C ATOM 2101 CG GLU A 139 11.168 4.042 8.757 1.00 0.00 C ATOM 2102 CD GLU A 139 12.663 3.758 8.727 1.00 0.00 C ATOM 2103 OE1 GLU A 139 13.187 2.855 8.021 1.00 0.00 O ATOM 2104 OE2 GLU A 139 13.410 4.545 9.367 1.00 0.00 O ATOM 0 H GLU A 139 9.539 4.610 11.443 1.00 0.00 H new ATOM 0 HA GLU A 139 8.657 4.104 8.769 1.00 0.00 H new ATOM 0 HB2 GLU A 139 10.726 2.988 10.581 1.00 0.00 H new ATOM 0 HB3 GLU A 139 10.259 2.127 9.128 1.00 0.00 H new ATOM 0 HG2 GLU A 139 10.802 4.020 7.731 1.00 0.00 H new ATOM 0 HG3 GLU A 139 11.027 5.059 9.124 1.00 0.00 H new ATOM 2111 N GLU A 140 7.361 2.365 11.187 1.00 0.00 N ATOM 2112 CA GLU A 140 6.447 1.343 11.594 1.00 0.00 C ATOM 2113 C GLU A 140 5.028 1.735 11.367 1.00 0.00 C ATOM 2114 O GLU A 140 4.276 0.989 10.742 1.00 0.00 O ATOM 2115 CB GLU A 140 6.571 0.974 13.082 1.00 0.00 C ATOM 2116 CG GLU A 140 7.932 0.374 13.441 1.00 0.00 C ATOM 2117 CD GLU A 140 8.075 0.070 14.925 1.00 0.00 C ATOM 2118 OE1 GLU A 140 8.071 1.068 15.694 1.00 0.00 O ATOM 2119 OE2 GLU A 140 8.267 -1.083 15.396 1.00 0.00 O ATOM 0 H GLU A 140 7.680 2.925 11.977 1.00 0.00 H new ATOM 0 HA GLU A 140 6.718 0.486 10.978 1.00 0.00 H new ATOM 0 HB2 GLU A 140 6.403 1.865 13.686 1.00 0.00 H new ATOM 0 HB3 GLU A 140 5.787 0.262 13.340 1.00 0.00 H new ATOM 0 HG2 GLU A 140 8.080 -0.544 12.872 1.00 0.00 H new ATOM 0 HG3 GLU A 140 8.719 1.066 13.140 1.00 0.00 H new ATOM 2126 N PHE A 141 4.696 3.018 11.600 1.00 0.00 N ATOM 2127 CA PHE A 141 3.454 3.655 11.293 1.00 0.00 C ATOM 2128 C PHE A 141 3.232 3.750 9.822 1.00 0.00 C ATOM 2129 O PHE A 141 2.186 3.450 9.247 1.00 0.00 O ATOM 2130 CB PHE A 141 3.498 5.065 11.906 1.00 0.00 C ATOM 2131 CG PHE A 141 2.247 5.872 11.859 1.00 0.00 C ATOM 2132 CD1 PHE A 141 1.979 6.631 10.745 1.00 0.00 C ATOM 2133 CD2 PHE A 141 1.415 6.003 12.946 1.00 0.00 C ATOM 2134 CE1 PHE A 141 0.812 7.355 10.669 1.00 0.00 C ATOM 2135 CE2 PHE A 141 0.276 6.774 12.930 1.00 0.00 C ATOM 2136 CZ PHE A 141 -0.013 7.444 11.765 1.00 0.00 C ATOM 0 H PHE A 141 5.354 3.662 12.040 1.00 0.00 H new ATOM 0 HA PHE A 141 2.632 3.068 11.703 1.00 0.00 H new ATOM 0 HB2 PHE A 141 3.798 4.969 12.949 1.00 0.00 H new ATOM 0 HB3 PHE A 141 4.282 5.628 11.399 1.00 0.00 H new ATOM 0 HD1 PHE A 141 2.685 6.659 9.929 1.00 0.00 H new ATOM 0 HD2 PHE A 141 1.668 5.476 13.854 1.00 0.00 H new ATOM 0 HE1 PHE A 141 0.544 7.853 9.749 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -0.364 6.850 13.796 1.00 0.00 H new ATOM 0 HZ PHE A 141 -0.904 8.051 11.710 1.00 0.00 H new ATOM 2146 N VAL A 142 4.286 4.028 9.034 1.00 0.00 N ATOM 2147 CA VAL A 142 4.146 4.011 7.611 1.00 0.00 C ATOM 2148 C VAL A 142 3.896 2.669 7.014 1.00 0.00 C ATOM 2149 O VAL A 142 2.954 2.491 6.244 1.00 0.00 O ATOM 2150 CB VAL A 142 5.264 4.806 7.006 1.00 0.00 C ATOM 2151 CG1 VAL A 142 5.269 4.652 5.476 1.00 0.00 C ATOM 2152 CG2 VAL A 142 5.156 6.285 7.413 1.00 0.00 C ATOM 0 H VAL A 142 5.219 4.261 9.374 1.00 0.00 H new ATOM 0 HA VAL A 142 3.212 4.507 7.347 1.00 0.00 H new ATOM 0 HB VAL A 142 6.210 4.420 7.386 1.00 0.00 H new ATOM 0 HG11 VAL A 142 6.087 5.236 5.054 1.00 0.00 H new ATOM 0 HG12 VAL A 142 5.401 3.602 5.216 1.00 0.00 H new ATOM 0 HG13 VAL A 142 4.322 5.009 5.071 1.00 0.00 H new ATOM 0 HG21 VAL A 142 5.976 6.847 6.965 1.00 0.00 H new ATOM 0 HG22 VAL A 142 4.206 6.690 7.065 1.00 0.00 H new ATOM 0 HG23 VAL A 142 5.210 6.369 8.498 1.00 0.00 H new ATOM 2162 N GLN A 143 4.590 1.653 7.558 1.00 0.00 N ATOM 2163 CA GLN A 143 4.470 0.295 7.125 1.00 0.00 C ATOM 2164 C GLN A 143 3.197 -0.336 7.573 1.00 0.00 C ATOM 2165 O GLN A 143 2.655 -1.255 6.959 1.00 0.00 O ATOM 2166 CB GLN A 143 5.648 -0.526 7.676 1.00 0.00 C ATOM 2167 CG GLN A 143 6.949 -0.300 6.904 1.00 0.00 C ATOM 2168 CD GLN A 143 8.101 -1.137 7.443 1.00 0.00 C ATOM 2169 OE1 GLN A 143 7.917 -2.253 7.925 1.00 0.00 O ATOM 2170 NE2 GLN A 143 9.335 -0.586 7.294 1.00 0.00 N ATOM 0 H GLN A 143 5.254 1.780 8.322 1.00 0.00 H new ATOM 0 HA GLN A 143 4.475 0.304 6.035 1.00 0.00 H new ATOM 0 HB2 GLN A 143 5.804 -0.268 8.723 1.00 0.00 H new ATOM 0 HB3 GLN A 143 5.392 -1.585 7.643 1.00 0.00 H new ATOM 0 HG2 GLN A 143 6.790 -0.541 5.853 1.00 0.00 H new ATOM 0 HG3 GLN A 143 7.217 0.755 6.952 1.00 0.00 H new ATOM 0 HE21 GLN A 143 9.432 0.345 6.888 1.00 0.00 H new ATOM 0 HE22 GLN A 143 10.163 -1.103 7.588 1.00 0.00 H new ATOM 2179 N MET A 144 2.627 0.138 8.695 1.00 0.00 N ATOM 2180 CA MET A 144 1.281 -0.080 9.128 1.00 0.00 C ATOM 2181 C MET A 144 0.254 0.401 8.161 1.00 0.00 C ATOM 2182 O MET A 144 -0.652 -0.325 7.757 1.00 0.00 O ATOM 2183 CB MET A 144 0.998 0.432 10.550 1.00 0.00 C ATOM 2184 CG MET A 144 -0.460 0.588 10.985 1.00 0.00 C ATOM 2185 SD MET A 144 -0.823 1.491 12.521 1.00 0.00 S ATOM 2186 CE MET A 144 -1.176 3.073 11.703 1.00 0.00 C ATOM 0 H MET A 144 3.149 0.719 9.350 1.00 0.00 H new ATOM 0 HA MET A 144 1.190 -1.166 9.164 1.00 0.00 H new ATOM 0 HB2 MET A 144 1.484 -0.247 11.251 1.00 0.00 H new ATOM 0 HB3 MET A 144 1.483 1.402 10.657 1.00 0.00 H new ATOM 0 HG2 MET A 144 -0.995 1.085 10.176 1.00 0.00 H new ATOM 0 HG3 MET A 144 -0.885 -0.411 11.081 1.00 0.00 H new ATOM 0 HE1 MET A 144 -1.400 3.830 12.455 1.00 0.00 H new ATOM 0 HE2 MET A 144 -0.308 3.384 11.122 1.00 0.00 H new ATOM 0 HE3 MET A 144 -2.033 2.956 11.040 1.00 0.00 H new ATOM 2196 N MET A 145 0.436 1.629 7.644 1.00 0.00 N ATOM 2197 CA MET A 145 -0.506 2.075 6.665 1.00 0.00 C ATOM 2198 C MET A 145 -0.473 1.440 5.318 1.00 0.00 C ATOM 2199 O MET A 145 -1.463 1.206 4.626 1.00 0.00 O ATOM 2200 CB MET A 145 -0.347 3.604 6.620 1.00 0.00 C ATOM 2201 CG MET A 145 -0.923 4.250 7.881 1.00 0.00 C ATOM 2202 SD MET A 145 -0.881 6.065 7.973 1.00 0.00 S ATOM 2203 CE MET A 145 -2.266 6.173 9.142 1.00 0.00 C ATOM 0 H MET A 145 1.185 2.278 7.883 1.00 0.00 H new ATOM 0 HA MET A 145 -1.498 1.751 6.980 1.00 0.00 H new ATOM 0 HB2 MET A 145 0.708 3.861 6.524 1.00 0.00 H new ATOM 0 HB3 MET A 145 -0.853 4.001 5.740 1.00 0.00 H new ATOM 0 HG2 MET A 145 -1.960 3.930 7.982 1.00 0.00 H new ATOM 0 HG3 MET A 145 -0.382 3.855 8.741 1.00 0.00 H new ATOM 0 HE1 MET A 145 -2.461 7.219 9.379 1.00 0.00 H new ATOM 0 HE2 MET A 145 -3.156 5.730 8.694 1.00 0.00 H new ATOM 0 HE3 MET A 145 -2.014 5.635 10.056 1.00 0.00 H new