USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 908 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 77:sc= 0.67 USER MOD Single : A 23 SER OG : rot 180:sc= -0.0093 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 CYS SG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 173:sc= 0.125 (180deg=0.115) USER MOD Single : A 37 SER OG : rot 82:sc= 0.00207 USER MOD Single : A 38 SER OG : rot 105:sc= -3.38! USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 ASN : amide:sc=-0.00502 X(o=-0.005,f=-0.15) USER MOD Single : A 46 CYS SG : rot 79:sc= -1.56 USER MOD Single : A 47 LYS NZ :NH3+ -137:sc= -0.179 (180deg=-0.688) USER MOD Single : A 50 ASN : amide:sc= -4! C(o=-4!,f=-13!) USER MOD Single : A 53 MET CE :methyl -146:sc= 0 (180deg=-0.0189) USER MOD Single : A 56 SER OG : rot 143:sc= -0.258 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 CYS SG : rot 150:sc= -0.0211 USER MOD Single : A 65 GLN : amide:sc= -0.555 X(o=-0.55,f=-0.55) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 CYS SG : rot 180:sc= -1.59 USER MOD Single : A 72 ASN : amide:sc= -0.132 K(o=-0.13,f=-1.7!) USER MOD Single : A 73 ASN : amide:sc= -1.92 K(o=-1.9,f=-9.7!) USER MOD Single : A 75 ASN : amide:sc= -0.519 K(o=-0.52,f=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 CYS SG : rot -46:sc= -2.17 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= -0.0939 K(o=-0.094,f=1.1) USER MOD Single : A 95 TYR OH : rot 0:sc= -0.302 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -0.165 K(o=-0.16,f=-2.3) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0176) USER MOD Single : A 105 SER OG : rot 76:sc= 0.607 USER MOD Single : A 106 THR OG1 : rot 75:sc= 0.161 USER MOD Single : A 111 ASN : amide:sc= 0.853 K(o=0.85,f=-0.069) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 THR OG1 : rot -7:sc= 0.605 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -22.642 0.795 -1.085 1.00 0.00 N ATOM 2 CA GLY A 1 -21.496 1.004 -1.951 1.00 0.00 C ATOM 3 C GLY A 1 -21.845 0.862 -3.419 1.00 0.00 C ATOM 4 O GLY A 1 -22.080 -0.245 -3.904 1.00 0.00 O ATOM 0 H1 GLY A 1 -22.351 0.903 -0.092 1.00 0.00 H new ATOM 0 H2 GLY A 1 -23.378 1.495 -1.308 1.00 0.00 H new ATOM 0 H3 GLY A 1 -23.019 -0.163 -1.233 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -21.086 1.998 -1.773 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -20.716 0.287 -1.695 1.00 0.00 H new ATOM 8 N SER A 2 -21.881 1.985 -4.129 1.00 0.00 N ATOM 9 CA SER A 2 -22.210 1.981 -5.550 1.00 0.00 C ATOM 10 C SER A 2 -21.164 1.207 -6.347 1.00 0.00 C ATOM 11 O SER A 2 -21.501 0.384 -7.198 1.00 0.00 O ATOM 12 CB SER A 2 -22.310 3.415 -6.075 1.00 0.00 C ATOM 13 OG SER A 2 -21.126 4.143 -5.800 1.00 0.00 O ATOM 0 H SER A 2 -21.686 2.909 -3.744 1.00 0.00 H new ATOM 0 HA SER A 2 -23.174 1.488 -5.674 1.00 0.00 H new ATOM 0 HB2 SER A 2 -22.490 3.400 -7.150 1.00 0.00 H new ATOM 0 HB3 SER A 2 -23.163 3.915 -5.616 1.00 0.00 H new ATOM 0 HG SER A 2 -21.215 5.055 -6.147 1.00 0.00 H new ATOM 19 N SER A 3 -19.894 1.478 -6.064 1.00 0.00 N ATOM 20 CA SER A 3 -18.798 0.811 -6.757 1.00 0.00 C ATOM 21 C SER A 3 -19.007 -0.701 -6.775 1.00 0.00 C ATOM 22 O SER A 3 -19.409 -1.295 -5.776 1.00 0.00 O ATOM 23 CB SER A 3 -17.464 1.145 -6.086 1.00 0.00 C ATOM 24 OG SER A 3 -16.988 2.413 -6.503 1.00 0.00 O ATOM 0 H SER A 3 -19.599 2.154 -5.360 1.00 0.00 H new ATOM 0 HA SER A 3 -18.779 1.170 -7.786 1.00 0.00 H new ATOM 0 HB2 SER A 3 -17.586 1.137 -5.003 1.00 0.00 H new ATOM 0 HB3 SER A 3 -16.728 0.378 -6.330 1.00 0.00 H new ATOM 0 HG SER A 3 -16.135 2.604 -6.059 1.00 0.00 H new ATOM 30 N GLY A 4 -18.730 -1.316 -7.920 1.00 0.00 N ATOM 31 CA GLY A 4 -18.893 -2.753 -8.049 1.00 0.00 C ATOM 32 C GLY A 4 -17.586 -3.502 -7.878 1.00 0.00 C ATOM 33 O GLY A 4 -16.806 -3.626 -8.822 1.00 0.00 O ATOM 0 H GLY A 4 -18.396 -0.845 -8.761 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -19.609 -3.103 -7.305 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -19.314 -2.981 -9.028 1.00 0.00 H new ATOM 37 N SER A 5 -17.346 -4.003 -6.670 1.00 0.00 N ATOM 38 CA SER A 5 -16.122 -4.740 -6.378 1.00 0.00 C ATOM 39 C SER A 5 -14.913 -4.055 -7.007 1.00 0.00 C ATOM 40 O SER A 5 -14.041 -4.711 -7.576 1.00 0.00 O ATOM 41 CB SER A 5 -16.232 -6.177 -6.890 1.00 0.00 C ATOM 42 OG SER A 5 -17.094 -6.946 -6.070 1.00 0.00 O ATOM 0 H SER A 5 -17.983 -3.912 -5.878 1.00 0.00 H new ATOM 0 HA SER A 5 -15.987 -4.757 -5.297 1.00 0.00 H new ATOM 0 HB2 SER A 5 -16.606 -6.174 -7.914 1.00 0.00 H new ATOM 0 HB3 SER A 5 -15.243 -6.635 -6.913 1.00 0.00 H new ATOM 0 HG SER A 5 -17.149 -7.860 -6.419 1.00 0.00 H new ATOM 48 N SER A 6 -14.868 -2.731 -6.899 1.00 0.00 N ATOM 49 CA SER A 6 -13.768 -1.955 -7.459 1.00 0.00 C ATOM 50 C SER A 6 -12.465 -2.249 -6.723 1.00 0.00 C ATOM 51 O SER A 6 -11.419 -2.444 -7.341 1.00 0.00 O ATOM 52 CB SER A 6 -14.082 -0.459 -7.387 1.00 0.00 C ATOM 53 OG SER A 6 -14.943 -0.067 -8.441 1.00 0.00 O ATOM 0 H SER A 6 -15.581 -2.173 -6.429 1.00 0.00 H new ATOM 0 HA SER A 6 -13.648 -2.244 -8.503 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.547 -0.228 -6.429 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.156 0.113 -7.438 1.00 0.00 H new ATOM 0 HG SER A 6 -15.130 0.893 -8.371 1.00 0.00 H new ATOM 59 N GLY A 7 -12.536 -2.279 -5.395 1.00 0.00 N ATOM 60 CA GLY A 7 -11.356 -2.549 -4.595 1.00 0.00 C ATOM 61 C GLY A 7 -10.757 -1.290 -4.001 1.00 0.00 C ATOM 62 O GLY A 7 -10.389 -1.263 -2.827 1.00 0.00 O ATOM 0 H GLY A 7 -13.390 -2.121 -4.860 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -11.616 -3.238 -3.791 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -10.608 -3.047 -5.213 1.00 0.00 H new ATOM 66 N GLU A 8 -10.656 -0.243 -4.815 1.00 0.00 N ATOM 67 CA GLU A 8 -10.094 1.024 -4.364 1.00 0.00 C ATOM 68 C GLU A 8 -10.539 1.339 -2.938 1.00 0.00 C ATOM 69 O GLU A 8 -9.717 1.641 -2.074 1.00 0.00 O ATOM 70 CB GLU A 8 -10.515 2.157 -5.302 1.00 0.00 C ATOM 71 CG GLU A 8 -9.875 2.076 -6.678 1.00 0.00 C ATOM 72 CD GLU A 8 -10.713 2.745 -7.751 1.00 0.00 C ATOM 73 OE1 GLU A 8 -10.851 3.986 -7.708 1.00 0.00 O ATOM 74 OE2 GLU A 8 -11.231 2.028 -8.632 1.00 0.00 O ATOM 0 H GLU A 8 -10.956 -0.248 -5.790 1.00 0.00 H new ATOM 0 HA GLU A 8 -9.008 0.935 -4.377 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -11.599 2.142 -5.413 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -10.255 3.112 -4.845 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -8.891 2.545 -6.645 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -9.721 1.030 -6.942 1.00 0.00 H new ATOM 81 N GLU A 9 -11.845 1.266 -2.702 1.00 0.00 N ATOM 82 CA GLU A 9 -12.398 1.544 -1.382 1.00 0.00 C ATOM 83 C GLU A 9 -11.913 0.519 -0.361 1.00 0.00 C ATOM 84 O GLU A 9 -11.502 0.875 0.743 1.00 0.00 O ATOM 85 CB GLU A 9 -13.928 1.543 -1.435 1.00 0.00 C ATOM 86 CG GLU A 9 -14.508 2.661 -2.284 1.00 0.00 C ATOM 87 CD GLU A 9 -14.361 2.401 -3.771 1.00 0.00 C ATOM 88 OE1 GLU A 9 -14.288 1.218 -4.162 1.00 0.00 O ATOM 89 OE2 GLU A 9 -14.320 3.382 -4.543 1.00 0.00 O ATOM 0 H GLU A 9 -12.539 1.017 -3.407 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.053 2.530 -1.072 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -14.269 0.585 -1.828 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -14.318 1.628 -0.421 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -15.564 2.785 -2.043 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -14.012 3.598 -2.032 1.00 0.00 H new ATOM 96 N GLN A 10 -11.966 -0.754 -0.739 1.00 0.00 N ATOM 97 CA GLN A 10 -11.533 -1.831 0.144 1.00 0.00 C ATOM 98 C GLN A 10 -10.153 -1.539 0.724 1.00 0.00 C ATOM 99 O GLN A 10 -9.926 -1.703 1.923 1.00 0.00 O ATOM 100 CB GLN A 10 -11.510 -3.161 -0.612 1.00 0.00 C ATOM 101 CG GLN A 10 -12.862 -3.855 -0.664 1.00 0.00 C ATOM 102 CD GLN A 10 -12.740 -5.362 -0.765 1.00 0.00 C ATOM 103 OE1 GLN A 10 -12.712 -5.923 -1.861 1.00 0.00 O ATOM 104 NE2 GLN A 10 -12.667 -6.029 0.381 1.00 0.00 N ATOM 0 H GLN A 10 -12.304 -1.065 -1.650 1.00 0.00 H new ATOM 0 HA GLN A 10 -12.245 -1.900 0.966 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -11.162 -2.985 -1.630 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -10.788 -3.826 -0.139 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -13.432 -3.599 0.229 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -13.425 -3.482 -1.519 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -12.694 -5.525 1.267 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -12.584 -7.046 0.375 1.00 0.00 H new ATOM 113 N ILE A 11 -9.236 -1.105 -0.134 1.00 0.00 N ATOM 114 CA ILE A 11 -7.879 -0.789 0.294 1.00 0.00 C ATOM 115 C ILE A 11 -7.861 0.432 1.207 1.00 0.00 C ATOM 116 O ILE A 11 -7.262 0.407 2.282 1.00 0.00 O ATOM 117 CB ILE A 11 -6.956 -0.528 -0.911 1.00 0.00 C ATOM 118 CG1 ILE A 11 -6.940 -1.742 -1.842 1.00 0.00 C ATOM 119 CG2 ILE A 11 -5.548 -0.199 -0.437 1.00 0.00 C ATOM 120 CD1 ILE A 11 -6.335 -2.978 -1.213 1.00 0.00 C ATOM 0 H ILE A 11 -9.408 -0.964 -1.129 1.00 0.00 H new ATOM 0 HA ILE A 11 -7.511 -1.656 0.843 1.00 0.00 H new ATOM 0 HB ILE A 11 -7.341 0.327 -1.467 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.961 -1.965 -2.153 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -6.380 -1.491 -2.743 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -4.907 -0.017 -1.300 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -5.574 0.692 0.190 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -5.153 -1.036 0.138 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -6.357 -3.799 -1.930 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -5.303 -2.773 -0.927 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -6.909 -3.254 -0.328 1.00 0.00 H new ATOM 132 N VAL A 12 -8.524 1.499 0.773 1.00 0.00 N ATOM 133 CA VAL A 12 -8.587 2.729 1.554 1.00 0.00 C ATOM 134 C VAL A 12 -8.973 2.443 3.000 1.00 0.00 C ATOM 135 O VAL A 12 -8.242 2.788 3.930 1.00 0.00 O ATOM 136 CB VAL A 12 -9.597 3.724 0.952 1.00 0.00 C ATOM 137 CG1 VAL A 12 -9.715 4.962 1.829 1.00 0.00 C ATOM 138 CG2 VAL A 12 -9.193 4.102 -0.465 1.00 0.00 C ATOM 0 H VAL A 12 -9.025 1.537 -0.115 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.591 3.172 1.528 1.00 0.00 H new ATOM 0 HB VAL A 12 -10.574 3.242 0.911 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -10.433 5.653 1.388 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -10.054 4.672 2.824 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -8.742 5.448 1.905 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -9.918 4.806 -0.875 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -8.206 4.565 -0.451 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -9.165 3.207 -1.086 1.00 0.00 H new ATOM 148 N THR A 13 -10.126 1.809 3.186 1.00 0.00 N ATOM 149 CA THR A 13 -10.610 1.477 4.520 1.00 0.00 C ATOM 150 C THR A 13 -9.692 0.469 5.202 1.00 0.00 C ATOM 151 O THR A 13 -9.377 0.604 6.384 1.00 0.00 O ATOM 152 CB THR A 13 -12.039 0.903 4.472 1.00 0.00 C ATOM 153 OG1 THR A 13 -12.919 1.832 3.830 1.00 0.00 O ATOM 154 CG2 THR A 13 -12.547 0.600 5.874 1.00 0.00 C ATOM 0 H THR A 13 -10.743 1.515 2.429 1.00 0.00 H new ATOM 0 HA THR A 13 -10.618 2.404 5.094 1.00 0.00 H new ATOM 0 HB THR A 13 -12.015 -0.026 3.902 1.00 0.00 H new ATOM 0 HG1 THR A 13 -13.825 1.459 3.802 1.00 0.00 H new ATOM 0 HG21 THR A 13 -13.558 0.196 5.815 1.00 0.00 H new ATOM 0 HG22 THR A 13 -11.891 -0.130 6.349 1.00 0.00 H new ATOM 0 HG23 THR A 13 -12.557 1.517 6.464 1.00 0.00 H new ATOM 162 N TRP A 14 -9.267 -0.540 4.451 1.00 0.00 N ATOM 163 CA TRP A 14 -8.383 -1.570 4.984 1.00 0.00 C ATOM 164 C TRP A 14 -7.171 -0.948 5.668 1.00 0.00 C ATOM 165 O TRP A 14 -6.948 -1.149 6.863 1.00 0.00 O ATOM 166 CB TRP A 14 -7.927 -2.509 3.866 1.00 0.00 C ATOM 167 CG TRP A 14 -6.983 -3.575 4.334 1.00 0.00 C ATOM 168 CD1 TRP A 14 -7.049 -4.271 5.507 1.00 0.00 C ATOM 169 CD2 TRP A 14 -5.831 -4.064 3.639 1.00 0.00 C ATOM 170 NE1 TRP A 14 -6.007 -5.164 5.583 1.00 0.00 N ATOM 171 CE2 TRP A 14 -5.246 -5.057 4.449 1.00 0.00 C ATOM 172 CE3 TRP A 14 -5.237 -3.761 2.410 1.00 0.00 C ATOM 173 CZ2 TRP A 14 -4.097 -5.746 4.069 1.00 0.00 C ATOM 174 CZ3 TRP A 14 -4.097 -4.446 2.035 1.00 0.00 C ATOM 175 CH2 TRP A 14 -3.537 -5.429 2.861 1.00 0.00 C ATOM 0 H TRP A 14 -9.520 -0.667 3.471 1.00 0.00 H new ATOM 0 HA TRP A 14 -8.940 -2.143 5.725 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -8.802 -2.980 3.417 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -7.444 -1.923 3.084 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -7.808 -4.139 6.264 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -5.829 -5.803 6.358 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -5.661 -3.005 1.766 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -3.663 -6.504 4.705 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -3.629 -4.219 1.088 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -2.646 -5.947 2.538 1.00 0.00 H new ATOM 186 N LEU A 15 -6.391 -0.191 4.905 1.00 0.00 N ATOM 187 CA LEU A 15 -5.200 0.462 5.438 1.00 0.00 C ATOM 188 C LEU A 15 -5.507 1.158 6.760 1.00 0.00 C ATOM 189 O LEU A 15 -4.952 0.807 7.801 1.00 0.00 O ATOM 190 CB LEU A 15 -4.655 1.475 4.430 1.00 0.00 C ATOM 191 CG LEU A 15 -4.199 0.905 3.086 1.00 0.00 C ATOM 192 CD1 LEU A 15 -3.915 2.027 2.099 1.00 0.00 C ATOM 193 CD2 LEU A 15 -2.969 0.028 3.268 1.00 0.00 C ATOM 0 H LEU A 15 -6.561 -0.014 3.915 1.00 0.00 H new ATOM 0 HA LEU A 15 -4.445 -0.304 5.618 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -5.426 2.222 4.242 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -3.812 1.995 4.886 1.00 0.00 H new ATOM 0 HG LEU A 15 -5.003 0.289 2.683 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -3.592 1.602 1.149 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -4.820 2.614 1.945 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -3.129 2.670 2.495 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -2.659 -0.369 2.301 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.159 0.621 3.694 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -3.207 -0.797 3.940 1.00 0.00 H new ATOM 205 N ILE A 16 -6.395 2.145 6.711 1.00 0.00 N ATOM 206 CA ILE A 16 -6.778 2.888 7.905 1.00 0.00 C ATOM 207 C ILE A 16 -7.109 1.945 9.056 1.00 0.00 C ATOM 208 O ILE A 16 -6.519 2.032 10.133 1.00 0.00 O ATOM 209 CB ILE A 16 -7.990 3.799 7.637 1.00 0.00 C ATOM 210 CG1 ILE A 16 -7.667 4.802 6.528 1.00 0.00 C ATOM 211 CG2 ILE A 16 -8.401 4.523 8.910 1.00 0.00 C ATOM 212 CD1 ILE A 16 -8.889 5.488 5.958 1.00 0.00 C ATOM 0 H ILE A 16 -6.863 2.449 5.857 1.00 0.00 H new ATOM 0 HA ILE A 16 -5.923 3.507 8.179 1.00 0.00 H new ATOM 0 HB ILE A 16 -8.825 3.180 7.309 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -6.986 5.558 6.920 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -7.142 4.286 5.724 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -9.259 5.163 8.704 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -8.668 3.793 9.674 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -7.571 5.133 9.266 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -8.584 6.185 5.177 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -9.562 4.741 5.536 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -9.403 6.033 6.750 1.00 0.00 H new ATOM 224 N SER A 17 -8.056 1.042 8.821 1.00 0.00 N ATOM 225 CA SER A 17 -8.467 0.083 9.839 1.00 0.00 C ATOM 226 C SER A 17 -7.253 -0.554 10.508 1.00 0.00 C ATOM 227 O SER A 17 -7.200 -0.680 11.732 1.00 0.00 O ATOM 228 CB SER A 17 -9.350 -1.003 9.220 1.00 0.00 C ATOM 229 OG SER A 17 -10.575 -0.461 8.757 1.00 0.00 O ATOM 0 H SER A 17 -8.553 0.955 7.934 1.00 0.00 H new ATOM 0 HA SER A 17 -9.039 0.619 10.597 1.00 0.00 H new ATOM 0 HB2 SER A 17 -8.823 -1.477 8.392 1.00 0.00 H new ATOM 0 HB3 SER A 17 -9.548 -1.780 9.958 1.00 0.00 H new ATOM 0 HG SER A 17 -10.426 0.005 7.908 1.00 0.00 H new ATOM 235 N LEU A 18 -6.280 -0.953 9.697 1.00 0.00 N ATOM 236 CA LEU A 18 -5.065 -1.577 10.209 1.00 0.00 C ATOM 237 C LEU A 18 -4.302 -0.619 11.118 1.00 0.00 C ATOM 238 O LEU A 18 -3.825 -1.006 12.184 1.00 0.00 O ATOM 239 CB LEU A 18 -4.169 -2.021 9.051 1.00 0.00 C ATOM 240 CG LEU A 18 -4.443 -3.416 8.488 1.00 0.00 C ATOM 241 CD1 LEU A 18 -3.680 -3.626 7.189 1.00 0.00 C ATOM 242 CD2 LEU A 18 -4.073 -4.485 9.505 1.00 0.00 C ATOM 0 H LEU A 18 -6.308 -0.856 8.682 1.00 0.00 H new ATOM 0 HA LEU A 18 -5.354 -2.451 10.793 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -4.270 -1.298 8.242 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -3.132 -1.983 9.385 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.509 -3.499 8.277 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -3.887 -4.624 6.803 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.995 -2.881 6.458 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -2.611 -3.523 7.374 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.275 -5.471 9.086 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -3.014 -4.404 9.749 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.665 -4.347 10.410 1.00 0.00 H new ATOM 254 N GLY A 19 -4.193 0.635 10.690 1.00 0.00 N ATOM 255 CA GLY A 19 -3.489 1.630 11.478 1.00 0.00 C ATOM 256 C GLY A 19 -2.294 2.209 10.747 1.00 0.00 C ATOM 257 O GLY A 19 -1.263 2.493 11.357 1.00 0.00 O ATOM 0 H GLY A 19 -4.580 0.980 9.811 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -4.176 2.435 11.739 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -3.156 1.179 12.413 1.00 0.00 H new ATOM 261 N VAL A 20 -2.432 2.384 9.437 1.00 0.00 N ATOM 262 CA VAL A 20 -1.354 2.933 8.622 1.00 0.00 C ATOM 263 C VAL A 20 -1.799 4.204 7.907 1.00 0.00 C ATOM 264 O VAL A 20 -1.054 5.183 7.839 1.00 0.00 O ATOM 265 CB VAL A 20 -0.867 1.913 7.576 1.00 0.00 C ATOM 266 CG1 VAL A 20 -0.302 0.676 8.258 1.00 0.00 C ATOM 267 CG2 VAL A 20 -1.997 1.540 6.628 1.00 0.00 C ATOM 0 H VAL A 20 -3.279 2.154 8.917 1.00 0.00 H new ATOM 0 HA VAL A 20 -0.533 3.169 9.299 1.00 0.00 H new ATOM 0 HB VAL A 20 -0.070 2.372 6.991 1.00 0.00 H new ATOM 0 HG11 VAL A 20 0.037 -0.033 7.503 1.00 0.00 H new ATOM 0 HG12 VAL A 20 0.538 0.961 8.891 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -1.076 0.212 8.870 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.634 0.818 5.896 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -2.818 1.100 7.195 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -2.350 2.434 6.113 1.00 0.00 H new ATOM 277 N LEU A 21 -3.016 4.183 7.377 1.00 0.00 N ATOM 278 CA LEU A 21 -3.562 5.335 6.667 1.00 0.00 C ATOM 279 C LEU A 21 -4.451 6.169 7.584 1.00 0.00 C ATOM 280 O LEU A 21 -5.215 5.628 8.382 1.00 0.00 O ATOM 281 CB LEU A 21 -4.358 4.876 5.445 1.00 0.00 C ATOM 282 CG LEU A 21 -4.958 5.984 4.579 1.00 0.00 C ATOM 283 CD1 LEU A 21 -3.857 6.821 3.947 1.00 0.00 C ATOM 284 CD2 LEU A 21 -5.863 5.393 3.508 1.00 0.00 C ATOM 0 H LEU A 21 -3.644 3.381 7.425 1.00 0.00 H new ATOM 0 HA LEU A 21 -2.729 5.955 6.337 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.706 4.267 4.819 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -5.167 4.230 5.785 1.00 0.00 H new ATOM 0 HG LEU A 21 -5.559 6.632 5.216 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -4.302 7.605 3.334 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -3.249 7.274 4.730 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -3.229 6.185 3.323 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -6.281 6.196 2.901 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -5.285 4.722 2.873 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -6.672 4.837 3.982 1.00 0.00 H new ATOM 296 N GLU A 22 -4.346 7.488 7.462 1.00 0.00 N ATOM 297 CA GLU A 22 -5.142 8.396 8.280 1.00 0.00 C ATOM 298 C GLU A 22 -6.633 8.177 8.041 1.00 0.00 C ATOM 299 O GLU A 22 -7.046 7.766 6.956 1.00 0.00 O ATOM 300 CB GLU A 22 -4.774 9.849 7.974 1.00 0.00 C ATOM 301 CG GLU A 22 -3.492 10.307 8.648 1.00 0.00 C ATOM 302 CD GLU A 22 -2.249 9.793 7.949 1.00 0.00 C ATOM 303 OE1 GLU A 22 -1.939 10.293 6.847 1.00 0.00 O ATOM 304 OE2 GLU A 22 -1.587 8.890 8.502 1.00 0.00 O ATOM 0 H GLU A 22 -3.718 7.952 6.805 1.00 0.00 H new ATOM 0 HA GLU A 22 -4.924 8.186 9.327 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -4.671 9.969 6.896 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -5.592 10.496 8.290 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -3.467 11.396 8.671 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -3.489 9.967 9.683 1.00 0.00 H new ATOM 311 N SER A 23 -7.437 8.453 9.063 1.00 0.00 N ATOM 312 CA SER A 23 -8.882 8.281 8.968 1.00 0.00 C ATOM 313 C SER A 23 -9.585 9.633 8.888 1.00 0.00 C ATOM 314 O SER A 23 -10.050 10.180 9.889 1.00 0.00 O ATOM 315 CB SER A 23 -9.404 7.492 10.170 1.00 0.00 C ATOM 316 OG SER A 23 -10.668 6.915 9.890 1.00 0.00 O ATOM 0 H SER A 23 -7.112 8.797 9.967 1.00 0.00 H new ATOM 0 HA SER A 23 -9.098 7.724 8.056 1.00 0.00 H new ATOM 0 HB2 SER A 23 -8.693 6.709 10.432 1.00 0.00 H new ATOM 0 HB3 SER A 23 -9.485 8.151 11.035 1.00 0.00 H new ATOM 0 HG SER A 23 -10.980 6.415 10.673 1.00 0.00 H new ATOM 322 N PRO A 24 -9.665 10.187 7.669 1.00 0.00 N ATOM 323 CA PRO A 24 -10.310 11.481 7.428 1.00 0.00 C ATOM 324 C PRO A 24 -11.823 11.417 7.606 1.00 0.00 C ATOM 325 O PRO A 24 -12.462 10.437 7.224 1.00 0.00 O ATOM 326 CB PRO A 24 -9.955 11.789 5.971 1.00 0.00 C ATOM 327 CG PRO A 24 -9.719 10.456 5.350 1.00 0.00 C ATOM 328 CD PRO A 24 -9.133 9.592 6.432 1.00 0.00 C ATOM 0 HA PRO A 24 -9.973 12.241 8.133 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -10.764 12.322 5.470 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -9.069 12.420 5.904 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.649 10.031 4.973 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -9.038 10.535 4.503 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -9.437 8.551 6.324 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -8.043 9.609 6.414 1.00 0.00 H new ATOM 336 N LYS A 25 -12.391 12.468 8.187 1.00 0.00 N ATOM 337 CA LYS A 25 -13.830 12.533 8.414 1.00 0.00 C ATOM 338 C LYS A 25 -14.558 12.997 7.157 1.00 0.00 C ATOM 339 O LYS A 25 -15.384 13.909 7.207 1.00 0.00 O ATOM 340 CB LYS A 25 -14.141 13.479 9.576 1.00 0.00 C ATOM 341 CG LYS A 25 -15.414 13.123 10.325 1.00 0.00 C ATOM 342 CD LYS A 25 -15.577 13.966 11.578 1.00 0.00 C ATOM 343 CE LYS A 25 -16.278 15.282 11.278 1.00 0.00 C ATOM 344 NZ LYS A 25 -15.877 16.355 12.230 1.00 0.00 N ATOM 0 H LYS A 25 -11.876 13.287 8.510 1.00 0.00 H new ATOM 0 HA LYS A 25 -14.179 11.532 8.666 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.304 13.471 10.274 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -14.227 14.496 9.193 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -16.275 13.270 9.672 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -15.395 12.067 10.595 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -16.149 13.409 12.320 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -14.598 14.165 12.013 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -16.044 15.594 10.260 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -17.357 15.138 11.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -16.377 17.235 11.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -16.123 16.069 13.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -14.851 16.511 12.165 1.00 0.00 H new ATOM 358 N LYS A 26 -14.249 12.364 6.031 1.00 0.00 N ATOM 359 CA LYS A 26 -14.876 12.709 4.761 1.00 0.00 C ATOM 360 C LYS A 26 -14.966 11.490 3.849 1.00 0.00 C ATOM 361 O LYS A 26 -14.503 10.404 4.199 1.00 0.00 O ATOM 362 CB LYS A 26 -14.088 13.822 4.066 1.00 0.00 C ATOM 363 CG LYS A 26 -14.140 15.152 4.797 1.00 0.00 C ATOM 364 CD LYS A 26 -13.940 16.320 3.845 1.00 0.00 C ATOM 365 CE LYS A 26 -13.731 17.624 4.599 1.00 0.00 C ATOM 366 NZ LYS A 26 -13.401 18.749 3.681 1.00 0.00 N ATOM 0 H LYS A 26 -13.567 11.608 5.972 1.00 0.00 H new ATOM 0 HA LYS A 26 -15.887 13.061 4.967 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -13.048 13.512 3.967 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -14.478 13.956 3.057 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -15.101 15.253 5.302 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -13.370 15.174 5.569 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -13.079 16.126 3.206 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -14.808 16.411 3.192 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -14.633 17.867 5.161 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -12.927 17.499 5.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -13.266 19.620 4.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -12.527 18.529 3.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -14.179 18.885 3.005 1.00 0.00 H new ATOM 380 N THR A 27 -15.564 11.677 2.676 1.00 0.00 N ATOM 381 CA THR A 27 -15.714 10.592 1.714 1.00 0.00 C ATOM 382 C THR A 27 -14.976 10.902 0.416 1.00 0.00 C ATOM 383 O THR A 27 -15.383 11.780 -0.345 1.00 0.00 O ATOM 384 CB THR A 27 -17.197 10.324 1.396 1.00 0.00 C ATOM 385 OG1 THR A 27 -18.008 10.656 2.529 1.00 0.00 O ATOM 386 CG2 THR A 27 -17.415 8.867 1.019 1.00 0.00 C ATOM 0 H THR A 27 -15.952 12.569 2.370 1.00 0.00 H new ATOM 0 HA THR A 27 -15.281 9.702 2.171 1.00 0.00 H new ATOM 0 HB THR A 27 -17.483 10.948 0.549 1.00 0.00 H new ATOM 0 HG1 THR A 27 -18.950 10.485 2.319 1.00 0.00 H new ATOM 0 HG21 THR A 27 -18.470 8.702 0.799 1.00 0.00 H new ATOM 0 HG22 THR A 27 -16.819 8.626 0.139 1.00 0.00 H new ATOM 0 HG23 THR A 27 -17.113 8.227 1.848 1.00 0.00 H new ATOM 394 N ILE A 28 -13.891 10.176 0.170 1.00 0.00 N ATOM 395 CA ILE A 28 -13.098 10.374 -1.037 1.00 0.00 C ATOM 396 C ILE A 28 -13.788 9.766 -2.254 1.00 0.00 C ATOM 397 O ILE A 28 -13.852 8.544 -2.398 1.00 0.00 O ATOM 398 CB ILE A 28 -11.694 9.757 -0.896 1.00 0.00 C ATOM 399 CG1 ILE A 28 -10.967 10.361 0.307 1.00 0.00 C ATOM 400 CG2 ILE A 28 -10.891 9.970 -2.170 1.00 0.00 C ATOM 401 CD1 ILE A 28 -9.984 9.412 0.957 1.00 0.00 C ATOM 0 H ILE A 28 -13.541 9.446 0.790 1.00 0.00 H new ATOM 0 HA ILE A 28 -13.000 11.451 -1.177 1.00 0.00 H new ATOM 0 HB ILE A 28 -11.799 8.684 -0.732 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -10.437 11.258 -0.012 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -11.703 10.672 1.048 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -9.901 9.528 -2.054 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -11.404 9.496 -3.007 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -10.791 11.038 -2.363 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -9.506 9.907 1.802 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -10.512 8.525 1.307 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -9.225 9.120 0.231 1.00 0.00 H new ATOM 413 N CYS A 29 -14.303 10.625 -3.126 1.00 0.00 N ATOM 414 CA CYS A 29 -14.988 10.173 -4.332 1.00 0.00 C ATOM 415 C CYS A 29 -14.008 9.520 -5.301 1.00 0.00 C ATOM 416 O CYS A 29 -14.299 8.476 -5.885 1.00 0.00 O ATOM 417 CB CYS A 29 -15.692 11.347 -5.013 1.00 0.00 C ATOM 418 SG CYS A 29 -16.508 10.916 -6.569 1.00 0.00 S ATOM 0 H CYS A 29 -14.259 11.639 -3.021 1.00 0.00 H new ATOM 0 HA CYS A 29 -15.732 9.431 -4.042 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -16.433 11.759 -4.328 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -14.962 12.134 -5.204 1.00 0.00 H new ATOM 0 HG CYS A 29 -17.077 11.973 -7.068 1.00 0.00 H new ATOM 424 N ASP A 30 -12.846 10.143 -5.469 1.00 0.00 N ATOM 425 CA ASP A 30 -11.823 9.623 -6.369 1.00 0.00 C ATOM 426 C ASP A 30 -10.655 9.036 -5.582 1.00 0.00 C ATOM 427 O ASP A 30 -9.622 9.677 -5.387 1.00 0.00 O ATOM 428 CB ASP A 30 -11.323 10.728 -7.300 1.00 0.00 C ATOM 429 CG ASP A 30 -12.414 11.253 -8.212 1.00 0.00 C ATOM 430 OD1 ASP A 30 -12.745 10.564 -9.200 1.00 0.00 O ATOM 431 OD2 ASP A 30 -12.937 12.355 -7.939 1.00 0.00 O ATOM 0 H ASP A 30 -12.589 11.008 -4.994 1.00 0.00 H new ATOM 0 HA ASP A 30 -12.270 8.829 -6.968 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -10.925 11.549 -6.704 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -10.501 10.345 -7.905 1.00 0.00 H new ATOM 436 N PRO A 31 -10.821 7.789 -5.117 1.00 0.00 N ATOM 437 CA PRO A 31 -9.791 7.089 -4.344 1.00 0.00 C ATOM 438 C PRO A 31 -8.580 6.717 -5.193 1.00 0.00 C ATOM 439 O PRO A 31 -7.514 6.404 -4.666 1.00 0.00 O ATOM 440 CB PRO A 31 -10.509 5.829 -3.855 1.00 0.00 C ATOM 441 CG PRO A 31 -11.593 5.601 -4.851 1.00 0.00 C ATOM 442 CD PRO A 31 -12.026 6.966 -5.312 1.00 0.00 C ATOM 0 HA PRO A 31 -9.394 7.709 -3.540 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -9.829 4.979 -3.808 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -10.915 5.968 -2.853 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -11.234 5.002 -5.688 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -12.426 5.058 -4.404 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -12.342 6.957 -6.355 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -12.867 7.340 -4.728 1.00 0.00 H new ATOM 450 N GLU A 32 -8.754 6.755 -6.511 1.00 0.00 N ATOM 451 CA GLU A 32 -7.674 6.421 -7.432 1.00 0.00 C ATOM 452 C GLU A 32 -6.470 7.332 -7.214 1.00 0.00 C ATOM 453 O GLU A 32 -5.339 6.864 -7.089 1.00 0.00 O ATOM 454 CB GLU A 32 -8.156 6.533 -8.880 1.00 0.00 C ATOM 455 CG GLU A 32 -7.059 6.308 -9.907 1.00 0.00 C ATOM 456 CD GLU A 32 -7.545 6.495 -11.331 1.00 0.00 C ATOM 457 OE1 GLU A 32 -8.292 7.464 -11.581 1.00 0.00 O ATOM 458 OE2 GLU A 32 -7.177 5.672 -12.195 1.00 0.00 O ATOM 0 H GLU A 32 -9.631 7.013 -6.964 1.00 0.00 H new ATOM 0 HA GLU A 32 -7.370 5.393 -7.236 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -8.952 5.807 -9.046 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -8.589 7.521 -9.034 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -6.238 6.999 -9.714 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -6.661 5.300 -9.793 1.00 0.00 H new ATOM 465 N GLU A 33 -6.723 8.637 -7.168 1.00 0.00 N ATOM 466 CA GLU A 33 -5.660 9.614 -6.966 1.00 0.00 C ATOM 467 C GLU A 33 -5.219 9.644 -5.505 1.00 0.00 C ATOM 468 O GLU A 33 -4.025 9.646 -5.206 1.00 0.00 O ATOM 469 CB GLU A 33 -6.127 11.006 -7.397 1.00 0.00 C ATOM 470 CG GLU A 33 -5.975 11.264 -8.887 1.00 0.00 C ATOM 471 CD GLU A 33 -4.525 11.345 -9.320 1.00 0.00 C ATOM 472 OE1 GLU A 33 -3.750 12.074 -8.665 1.00 0.00 O ATOM 473 OE2 GLU A 33 -4.163 10.680 -10.313 1.00 0.00 O ATOM 0 H GLU A 33 -7.654 9.041 -7.268 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.809 9.318 -7.579 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -7.174 11.131 -7.120 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -5.560 11.757 -6.847 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -6.472 10.469 -9.442 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -6.480 12.195 -9.144 1.00 0.00 H new ATOM 480 N PHE A 34 -6.192 9.668 -4.600 1.00 0.00 N ATOM 481 CA PHE A 34 -5.905 9.699 -3.171 1.00 0.00 C ATOM 482 C PHE A 34 -4.952 8.573 -2.782 1.00 0.00 C ATOM 483 O PHE A 34 -3.964 8.794 -2.081 1.00 0.00 O ATOM 484 CB PHE A 34 -7.202 9.585 -2.366 1.00 0.00 C ATOM 485 CG PHE A 34 -6.987 9.577 -0.880 1.00 0.00 C ATOM 486 CD1 PHE A 34 -6.834 10.765 -0.183 1.00 0.00 C ATOM 487 CD2 PHE A 34 -6.938 8.383 -0.180 1.00 0.00 C ATOM 488 CE1 PHE A 34 -6.635 10.760 1.185 1.00 0.00 C ATOM 489 CE2 PHE A 34 -6.740 8.372 1.188 1.00 0.00 C ATOM 490 CZ PHE A 34 -6.589 9.563 1.871 1.00 0.00 C ATOM 0 H PHE A 34 -7.186 9.667 -4.831 1.00 0.00 H new ATOM 0 HA PHE A 34 -5.426 10.651 -2.943 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -7.856 10.418 -2.626 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -7.720 8.671 -2.655 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -6.871 11.705 -0.714 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -7.056 7.449 -0.709 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -6.516 11.692 1.717 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -6.703 7.434 1.722 1.00 0.00 H new ATOM 0 HZ PHE A 34 -6.435 9.558 2.940 1.00 0.00 H new ATOM 500 N LEU A 35 -5.256 7.364 -3.242 1.00 0.00 N ATOM 501 CA LEU A 35 -4.427 6.201 -2.943 1.00 0.00 C ATOM 502 C LEU A 35 -3.023 6.372 -3.514 1.00 0.00 C ATOM 503 O LEU A 35 -2.034 6.332 -2.781 1.00 0.00 O ATOM 504 CB LEU A 35 -5.069 4.933 -3.509 1.00 0.00 C ATOM 505 CG LEU A 35 -6.156 4.289 -2.648 1.00 0.00 C ATOM 506 CD1 LEU A 35 -7.034 3.377 -3.490 1.00 0.00 C ATOM 507 CD2 LEU A 35 -5.534 3.517 -1.494 1.00 0.00 C ATOM 0 H LEU A 35 -6.070 7.164 -3.823 1.00 0.00 H new ATOM 0 HA LEU A 35 -4.350 6.109 -1.860 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -5.498 5.171 -4.483 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.283 4.196 -3.678 1.00 0.00 H new ATOM 0 HG LEU A 35 -6.781 5.080 -2.235 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.802 2.928 -2.860 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -7.508 3.958 -4.281 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -6.423 2.591 -3.933 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -6.322 3.065 -0.892 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.885 2.735 -1.887 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -4.949 4.197 -0.875 1.00 0.00 H new ATOM 519 N LYS A 36 -2.942 6.565 -4.826 1.00 0.00 N ATOM 520 CA LYS A 36 -1.660 6.746 -5.496 1.00 0.00 C ATOM 521 C LYS A 36 -0.801 7.769 -4.760 1.00 0.00 C ATOM 522 O LYS A 36 0.405 7.581 -4.599 1.00 0.00 O ATOM 523 CB LYS A 36 -1.876 7.193 -6.943 1.00 0.00 C ATOM 524 CG LYS A 36 -2.610 6.170 -7.793 1.00 0.00 C ATOM 525 CD LYS A 36 -3.347 6.829 -8.947 1.00 0.00 C ATOM 526 CE LYS A 36 -2.459 6.954 -10.176 1.00 0.00 C ATOM 527 NZ LYS A 36 -3.104 7.763 -11.247 1.00 0.00 N ATOM 0 H LYS A 36 -3.750 6.600 -5.447 1.00 0.00 H new ATOM 0 HA LYS A 36 -1.138 5.789 -5.492 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -2.439 8.126 -6.946 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -0.908 7.403 -7.398 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.899 5.442 -8.183 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -3.319 5.622 -7.173 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -4.233 6.245 -9.195 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -3.691 7.818 -8.643 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -1.512 7.414 -9.894 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -2.229 5.960 -10.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -2.424 7.924 -12.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -3.931 7.253 -11.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -3.408 8.678 -10.856 1.00 0.00 H new ATOM 541 N SER A 37 -1.430 8.852 -4.313 1.00 0.00 N ATOM 542 CA SER A 37 -0.723 9.906 -3.596 1.00 0.00 C ATOM 543 C SER A 37 -0.118 9.370 -2.301 1.00 0.00 C ATOM 544 O SER A 37 0.997 9.734 -1.927 1.00 0.00 O ATOM 545 CB SER A 37 -1.670 11.067 -3.288 1.00 0.00 C ATOM 546 OG SER A 37 -1.855 11.890 -4.426 1.00 0.00 O ATOM 0 H SER A 37 -2.428 9.022 -4.435 1.00 0.00 H new ATOM 0 HA SER A 37 0.085 10.266 -4.233 1.00 0.00 H new ATOM 0 HB2 SER A 37 -2.633 10.677 -2.957 1.00 0.00 H new ATOM 0 HB3 SER A 37 -1.267 11.661 -2.467 1.00 0.00 H new ATOM 0 HG SER A 37 -2.528 11.488 -5.015 1.00 0.00 H new ATOM 552 N SER A 38 -0.863 8.504 -1.622 1.00 0.00 N ATOM 553 CA SER A 38 -0.403 7.920 -0.367 1.00 0.00 C ATOM 554 C SER A 38 0.661 6.857 -0.620 1.00 0.00 C ATOM 555 O SER A 38 1.772 6.936 -0.092 1.00 0.00 O ATOM 556 CB SER A 38 -1.580 7.309 0.396 1.00 0.00 C ATOM 557 OG SER A 38 -1.129 6.556 1.509 1.00 0.00 O ATOM 0 H SER A 38 -1.787 8.191 -1.919 1.00 0.00 H new ATOM 0 HA SER A 38 0.039 8.714 0.235 1.00 0.00 H new ATOM 0 HB2 SER A 38 -2.248 8.101 0.735 1.00 0.00 H new ATOM 0 HB3 SER A 38 -2.157 6.668 -0.271 1.00 0.00 H new ATOM 0 HG SER A 38 -1.296 7.059 2.333 1.00 0.00 H new ATOM 563 N LEU A 39 0.315 5.864 -1.431 1.00 0.00 N ATOM 564 CA LEU A 39 1.240 4.783 -1.755 1.00 0.00 C ATOM 565 C LEU A 39 2.528 5.333 -2.361 1.00 0.00 C ATOM 566 O LEU A 39 3.624 4.870 -2.043 1.00 0.00 O ATOM 567 CB LEU A 39 0.586 3.799 -2.726 1.00 0.00 C ATOM 568 CG LEU A 39 -0.790 3.269 -2.319 1.00 0.00 C ATOM 569 CD1 LEU A 39 -1.447 2.541 -3.481 1.00 0.00 C ATOM 570 CD2 LEU A 39 -0.671 2.352 -1.111 1.00 0.00 C ATOM 0 H LEU A 39 -0.599 5.784 -1.877 1.00 0.00 H new ATOM 0 HA LEU A 39 1.488 4.261 -0.831 1.00 0.00 H new ATOM 0 HB2 LEU A 39 0.493 4.285 -3.697 1.00 0.00 H new ATOM 0 HB3 LEU A 39 1.256 2.949 -2.857 1.00 0.00 H new ATOM 0 HG LEU A 39 -1.419 4.116 -2.047 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -2.425 2.171 -3.172 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -1.567 3.227 -4.319 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -0.821 1.702 -3.785 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -1.659 1.984 -0.835 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -0.025 1.509 -1.356 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -0.243 2.905 -0.275 1.00 0.00 H new ATOM 582 N LYS A 40 2.389 6.324 -3.235 1.00 0.00 N ATOM 583 CA LYS A 40 3.540 6.940 -3.883 1.00 0.00 C ATOM 584 C LYS A 40 4.715 7.049 -2.917 1.00 0.00 C ATOM 585 O LYS A 40 5.779 6.478 -3.152 1.00 0.00 O ATOM 586 CB LYS A 40 3.171 8.328 -4.413 1.00 0.00 C ATOM 587 CG LYS A 40 4.364 9.126 -4.910 1.00 0.00 C ATOM 588 CD LYS A 40 4.057 10.613 -4.960 1.00 0.00 C ATOM 589 CE LYS A 40 5.299 11.427 -5.292 1.00 0.00 C ATOM 590 NZ LYS A 40 5.031 12.891 -5.247 1.00 0.00 N ATOM 0 H LYS A 40 1.489 6.718 -3.511 1.00 0.00 H new ATOM 0 HA LYS A 40 3.837 6.306 -4.718 1.00 0.00 H new ATOM 0 HB2 LYS A 40 2.454 8.218 -5.226 1.00 0.00 H new ATOM 0 HB3 LYS A 40 2.673 8.889 -3.622 1.00 0.00 H new ATOM 0 HG2 LYS A 40 5.218 8.951 -4.256 1.00 0.00 H new ATOM 0 HG3 LYS A 40 4.647 8.778 -5.903 1.00 0.00 H new ATOM 0 HD2 LYS A 40 3.286 10.802 -5.707 1.00 0.00 H new ATOM 0 HD3 LYS A 40 3.655 10.935 -3.999 1.00 0.00 H new ATOM 0 HE2 LYS A 40 6.093 11.181 -4.587 1.00 0.00 H new ATOM 0 HE3 LYS A 40 5.658 11.154 -6.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 5.902 13.411 -5.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 4.291 13.130 -5.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 4.713 13.157 -4.293 1.00 0.00 H new ATOM 604 N ASN A 41 4.514 7.785 -1.829 1.00 0.00 N ATOM 605 CA ASN A 41 5.557 7.968 -0.826 1.00 0.00 C ATOM 606 C ASN A 41 6.302 6.661 -0.571 1.00 0.00 C ATOM 607 O ASN A 41 7.531 6.630 -0.541 1.00 0.00 O ATOM 608 CB ASN A 41 4.953 8.486 0.481 1.00 0.00 C ATOM 609 CG ASN A 41 4.835 9.998 0.503 1.00 0.00 C ATOM 610 OD1 ASN A 41 4.300 10.604 -0.425 1.00 0.00 O ATOM 611 ND2 ASN A 41 5.337 10.614 1.567 1.00 0.00 N ATOM 0 H ASN A 41 3.638 8.264 -1.619 1.00 0.00 H new ATOM 0 HA ASN A 41 6.267 8.703 -1.207 1.00 0.00 H new ATOM 0 HB2 ASN A 41 3.966 8.045 0.622 1.00 0.00 H new ATOM 0 HB3 ASN A 41 5.571 8.160 1.318 1.00 0.00 H new ATOM 0 HD21 ASN A 41 5.288 11.630 1.638 1.00 0.00 H new ATOM 0 HD22 ASN A 41 5.772 10.071 2.313 1.00 0.00 H new ATOM 618 N GLY A 42 5.547 5.581 -0.390 1.00 0.00 N ATOM 619 CA GLY A 42 6.152 4.286 -0.141 1.00 0.00 C ATOM 620 C GLY A 42 6.139 3.912 1.328 1.00 0.00 C ATOM 621 O GLY A 42 6.074 2.733 1.676 1.00 0.00 O ATOM 0 H GLY A 42 4.527 5.580 -0.411 1.00 0.00 H new ATOM 0 HA2 GLY A 42 5.620 3.524 -0.711 1.00 0.00 H new ATOM 0 HA3 GLY A 42 7.181 4.294 -0.502 1.00 0.00 H new ATOM 625 N VAL A 43 6.203 4.919 2.194 1.00 0.00 N ATOM 626 CA VAL A 43 6.198 4.691 3.634 1.00 0.00 C ATOM 627 C VAL A 43 4.900 4.030 4.081 1.00 0.00 C ATOM 628 O VAL A 43 4.892 3.208 4.998 1.00 0.00 O ATOM 629 CB VAL A 43 6.386 6.007 4.411 1.00 0.00 C ATOM 630 CG1 VAL A 43 5.329 7.023 4.005 1.00 0.00 C ATOM 631 CG2 VAL A 43 6.342 5.751 5.910 1.00 0.00 C ATOM 0 H VAL A 43 6.259 5.901 1.923 1.00 0.00 H new ATOM 0 HA VAL A 43 7.034 4.027 3.852 1.00 0.00 H new ATOM 0 HB VAL A 43 7.365 6.418 4.164 1.00 0.00 H new ATOM 0 HG11 VAL A 43 5.478 7.946 4.565 1.00 0.00 H new ATOM 0 HG12 VAL A 43 5.412 7.228 2.938 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.338 6.624 4.221 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.477 6.692 6.444 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.378 5.317 6.177 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.140 5.061 6.185 1.00 0.00 H new ATOM 641 N VAL A 44 3.801 4.393 3.427 1.00 0.00 N ATOM 642 CA VAL A 44 2.495 3.834 3.756 1.00 0.00 C ATOM 643 C VAL A 44 2.485 2.320 3.579 1.00 0.00 C ATOM 644 O VAL A 44 1.963 1.588 4.421 1.00 0.00 O ATOM 645 CB VAL A 44 1.385 4.450 2.884 1.00 0.00 C ATOM 646 CG1 VAL A 44 0.056 3.756 3.143 1.00 0.00 C ATOM 647 CG2 VAL A 44 1.274 5.945 3.141 1.00 0.00 C ATOM 0 H VAL A 44 3.789 5.072 2.666 1.00 0.00 H new ATOM 0 HA VAL A 44 2.301 4.076 4.801 1.00 0.00 H new ATOM 0 HB VAL A 44 1.646 4.303 1.836 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -0.716 4.204 2.518 1.00 0.00 H new ATOM 0 HG12 VAL A 44 0.146 2.696 2.904 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -0.215 3.869 4.193 1.00 0.00 H new ATOM 0 HG21 VAL A 44 0.485 6.364 2.517 1.00 0.00 H new ATOM 0 HG22 VAL A 44 1.036 6.117 4.191 1.00 0.00 H new ATOM 0 HG23 VAL A 44 2.222 6.427 2.900 1.00 0.00 H new ATOM 657 N LEU A 45 3.065 1.855 2.477 1.00 0.00 N ATOM 658 CA LEU A 45 3.124 0.427 2.188 1.00 0.00 C ATOM 659 C LEU A 45 4.072 -0.285 3.148 1.00 0.00 C ATOM 660 O LEU A 45 3.787 -1.389 3.612 1.00 0.00 O ATOM 661 CB LEU A 45 3.574 0.197 0.744 1.00 0.00 C ATOM 662 CG LEU A 45 2.546 0.524 -0.340 1.00 0.00 C ATOM 663 CD1 LEU A 45 3.242 0.930 -1.630 1.00 0.00 C ATOM 664 CD2 LEU A 45 1.626 -0.664 -0.578 1.00 0.00 C ATOM 0 H LEU A 45 3.501 2.447 1.770 1.00 0.00 H new ATOM 0 HA LEU A 45 2.124 0.013 2.321 1.00 0.00 H new ATOM 0 HB2 LEU A 45 4.466 0.796 0.563 1.00 0.00 H new ATOM 0 HB3 LEU A 45 3.865 -0.848 0.637 1.00 0.00 H new ATOM 0 HG LEU A 45 1.940 1.364 0.001 1.00 0.00 H new ATOM 0 HD11 LEU A 45 2.495 1.159 -2.390 1.00 0.00 H new ATOM 0 HD12 LEU A 45 3.858 1.811 -1.449 1.00 0.00 H new ATOM 0 HD13 LEU A 45 3.873 0.111 -1.976 1.00 0.00 H new ATOM 0 HD21 LEU A 45 0.901 -0.413 -1.352 1.00 0.00 H new ATOM 0 HD22 LEU A 45 2.216 -1.523 -0.898 1.00 0.00 H new ATOM 0 HD23 LEU A 45 1.101 -0.908 0.345 1.00 0.00 H new ATOM 676 N CYS A 46 5.198 0.356 3.442 1.00 0.00 N ATOM 677 CA CYS A 46 6.188 -0.215 4.348 1.00 0.00 C ATOM 678 C CYS A 46 5.572 -0.504 5.714 1.00 0.00 C ATOM 679 O CYS A 46 5.798 -1.565 6.297 1.00 0.00 O ATOM 680 CB CYS A 46 7.376 0.735 4.502 1.00 0.00 C ATOM 681 SG CYS A 46 8.480 0.773 3.071 1.00 0.00 S ATOM 0 H CYS A 46 5.448 1.271 3.066 1.00 0.00 H new ATOM 0 HA CYS A 46 6.537 -1.155 3.920 1.00 0.00 H new ATOM 0 HB2 CYS A 46 7.001 1.742 4.685 1.00 0.00 H new ATOM 0 HB3 CYS A 46 7.949 0.443 5.382 1.00 0.00 H new ATOM 0 HG CYS A 46 7.955 1.509 2.137 1.00 0.00 H new ATOM 687 N LYS A 47 4.794 0.447 6.219 1.00 0.00 N ATOM 688 CA LYS A 47 4.146 0.296 7.516 1.00 0.00 C ATOM 689 C LYS A 47 3.104 -0.817 7.478 1.00 0.00 C ATOM 690 O LYS A 47 2.902 -1.528 8.463 1.00 0.00 O ATOM 691 CB LYS A 47 3.486 1.612 7.936 1.00 0.00 C ATOM 692 CG LYS A 47 4.471 2.752 8.126 1.00 0.00 C ATOM 693 CD LYS A 47 3.766 4.036 8.531 1.00 0.00 C ATOM 694 CE LYS A 47 4.759 5.105 8.962 1.00 0.00 C ATOM 695 NZ LYS A 47 4.141 6.459 8.985 1.00 0.00 N ATOM 0 H LYS A 47 4.597 1.331 5.750 1.00 0.00 H new ATOM 0 HA LYS A 47 4.910 0.030 8.246 1.00 0.00 H new ATOM 0 HB2 LYS A 47 2.753 1.898 7.182 1.00 0.00 H new ATOM 0 HB3 LYS A 47 2.941 1.455 8.867 1.00 0.00 H new ATOM 0 HG2 LYS A 47 5.201 2.480 8.889 1.00 0.00 H new ATOM 0 HG3 LYS A 47 5.023 2.915 7.200 1.00 0.00 H new ATOM 0 HD2 LYS A 47 3.172 4.405 7.695 1.00 0.00 H new ATOM 0 HD3 LYS A 47 3.074 3.830 9.348 1.00 0.00 H new ATOM 0 HE2 LYS A 47 5.144 4.865 9.953 1.00 0.00 H new ATOM 0 HE3 LYS A 47 5.610 5.106 8.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 4.798 7.148 8.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 3.257 6.447 8.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 3.935 6.730 9.968 1.00 0.00 H new ATOM 709 N LEU A 48 2.445 -0.965 6.334 1.00 0.00 N ATOM 710 CA LEU A 48 1.424 -1.994 6.166 1.00 0.00 C ATOM 711 C LEU A 48 2.043 -3.387 6.207 1.00 0.00 C ATOM 712 O LEU A 48 1.721 -4.194 7.080 1.00 0.00 O ATOM 713 CB LEU A 48 0.681 -1.792 4.844 1.00 0.00 C ATOM 714 CG LEU A 48 -0.196 -2.956 4.383 1.00 0.00 C ATOM 715 CD1 LEU A 48 -1.358 -3.161 5.342 1.00 0.00 C ATOM 716 CD2 LEU A 48 -0.705 -2.714 2.969 1.00 0.00 C ATOM 0 H LEU A 48 2.599 -0.386 5.509 1.00 0.00 H new ATOM 0 HA LEU A 48 0.716 -1.907 6.990 1.00 0.00 H new ATOM 0 HB2 LEU A 48 0.054 -0.905 4.934 1.00 0.00 H new ATOM 0 HB3 LEU A 48 1.415 -1.586 4.065 1.00 0.00 H new ATOM 0 HG LEU A 48 0.409 -3.862 4.379 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -1.971 -3.994 4.998 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -0.973 -3.381 6.338 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -1.963 -2.255 5.379 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -1.327 -3.553 2.658 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -1.294 -1.797 2.946 1.00 0.00 H new ATOM 0 HD23 LEU A 48 0.141 -2.618 2.289 1.00 0.00 H new ATOM 728 N ILE A 49 2.934 -3.661 5.261 1.00 0.00 N ATOM 729 CA ILE A 49 3.601 -4.956 5.191 1.00 0.00 C ATOM 730 C ILE A 49 4.219 -5.328 6.535 1.00 0.00 C ATOM 731 O ILE A 49 4.367 -6.506 6.856 1.00 0.00 O ATOM 732 CB ILE A 49 4.700 -4.966 4.113 1.00 0.00 C ATOM 733 CG1 ILE A 49 5.302 -6.366 3.980 1.00 0.00 C ATOM 734 CG2 ILE A 49 5.781 -3.949 4.448 1.00 0.00 C ATOM 735 CD1 ILE A 49 4.378 -7.360 3.312 1.00 0.00 C ATOM 0 H ILE A 49 3.211 -3.004 4.532 1.00 0.00 H new ATOM 0 HA ILE A 49 2.839 -5.690 4.928 1.00 0.00 H new ATOM 0 HB ILE A 49 4.253 -4.691 3.158 1.00 0.00 H new ATOM 0 HG12 ILE A 49 6.228 -6.302 3.408 1.00 0.00 H new ATOM 0 HG13 ILE A 49 5.564 -6.736 4.971 1.00 0.00 H new ATOM 0 HG21 ILE A 49 6.551 -3.968 3.676 1.00 0.00 H new ATOM 0 HG22 ILE A 49 5.341 -2.953 4.497 1.00 0.00 H new ATOM 0 HG23 ILE A 49 6.227 -4.196 5.411 1.00 0.00 H new ATOM 0 HD11 ILE A 49 4.870 -8.331 3.252 1.00 0.00 H new ATOM 0 HD12 ILE A 49 3.462 -7.454 3.895 1.00 0.00 H new ATOM 0 HD13 ILE A 49 4.135 -7.013 2.308 1.00 0.00 H new ATOM 747 N ASN A 50 4.576 -4.315 7.317 1.00 0.00 N ATOM 748 CA ASN A 50 5.177 -4.536 8.627 1.00 0.00 C ATOM 749 C ASN A 50 4.128 -4.992 9.637 1.00 0.00 C ATOM 750 O ASN A 50 4.380 -5.882 10.450 1.00 0.00 O ATOM 751 CB ASN A 50 5.854 -3.257 9.123 1.00 0.00 C ATOM 752 CG ASN A 50 7.023 -2.846 8.248 1.00 0.00 C ATOM 753 OD1 ASN A 50 7.402 -3.563 7.322 1.00 0.00 O ATOM 754 ND2 ASN A 50 7.601 -1.686 8.540 1.00 0.00 N ATOM 0 H ASN A 50 4.460 -3.333 7.066 1.00 0.00 H new ATOM 0 HA ASN A 50 5.926 -5.321 8.527 1.00 0.00 H new ATOM 0 HB2 ASN A 50 5.123 -2.449 9.151 1.00 0.00 H new ATOM 0 HB3 ASN A 50 6.203 -3.406 10.145 1.00 0.00 H new ATOM 0 HD21 ASN A 50 8.393 -1.357 7.987 1.00 0.00 H new ATOM 0 HD22 ASN A 50 7.253 -1.124 9.317 1.00 0.00 H new ATOM 761 N ARG A 51 2.951 -4.377 9.579 1.00 0.00 N ATOM 762 CA ARG A 51 1.864 -4.720 10.488 1.00 0.00 C ATOM 763 C ARG A 51 1.355 -6.133 10.218 1.00 0.00 C ATOM 764 O ARG A 51 1.009 -6.867 11.145 1.00 0.00 O ATOM 765 CB ARG A 51 0.717 -3.718 10.346 1.00 0.00 C ATOM 766 CG ARG A 51 -0.348 -3.855 11.421 1.00 0.00 C ATOM 767 CD ARG A 51 -0.005 -3.032 12.653 1.00 0.00 C ATOM 768 NE ARG A 51 -0.596 -3.591 13.867 1.00 0.00 N ATOM 769 CZ ARG A 51 -0.049 -4.584 14.560 1.00 0.00 C ATOM 770 NH1 ARG A 51 1.095 -5.124 14.162 1.00 0.00 N ATOM 771 NH2 ARG A 51 -0.647 -5.038 15.654 1.00 0.00 N ATOM 0 H ARG A 51 2.726 -3.639 8.912 1.00 0.00 H new ATOM 0 HA ARG A 51 2.249 -4.679 11.507 1.00 0.00 H new ATOM 0 HB2 ARG A 51 1.123 -2.707 10.376 1.00 0.00 H new ATOM 0 HB3 ARG A 51 0.253 -3.846 9.368 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -1.311 -3.534 11.024 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -0.452 -4.904 11.700 1.00 0.00 H new ATOM 0 HD2 ARG A 51 1.078 -2.983 12.766 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -0.358 -2.010 12.516 1.00 0.00 H new ATOM 0 HE ARG A 51 -1.476 -3.198 14.200 1.00 0.00 H new ATOM 0 HH11 ARG A 51 1.558 -4.777 13.322 1.00 0.00 H new ATOM 0 HH12 ARG A 51 1.512 -5.886 14.696 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -1.527 -4.625 15.963 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -0.227 -5.800 16.186 1.00 0.00 H new ATOM 785 N LEU A 52 1.312 -6.508 8.945 1.00 0.00 N ATOM 786 CA LEU A 52 0.844 -7.833 8.552 1.00 0.00 C ATOM 787 C LEU A 52 1.864 -8.903 8.930 1.00 0.00 C ATOM 788 O LEU A 52 1.540 -9.863 9.629 1.00 0.00 O ATOM 789 CB LEU A 52 0.576 -7.876 7.047 1.00 0.00 C ATOM 790 CG LEU A 52 -0.282 -6.742 6.486 1.00 0.00 C ATOM 791 CD1 LEU A 52 -0.382 -6.847 4.972 1.00 0.00 C ATOM 792 CD2 LEU A 52 -1.667 -6.759 7.115 1.00 0.00 C ATOM 0 H LEU A 52 1.596 -5.913 8.166 1.00 0.00 H new ATOM 0 HA LEU A 52 -0.085 -8.037 9.085 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.534 -7.871 6.527 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.090 -8.823 6.812 1.00 0.00 H new ATOM 0 HG LEU A 52 0.196 -5.794 6.734 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -0.997 -6.032 4.591 1.00 0.00 H new ATOM 0 HD12 LEU A 52 0.615 -6.784 4.536 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -0.836 -7.800 4.703 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -2.263 -5.945 6.704 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -2.153 -7.710 6.899 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.578 -6.634 8.194 1.00 0.00 H new ATOM 804 N MET A 53 3.096 -8.730 8.463 1.00 0.00 N ATOM 805 CA MET A 53 4.163 -9.680 8.755 1.00 0.00 C ATOM 806 C MET A 53 5.224 -9.048 9.650 1.00 0.00 C ATOM 807 O MET A 53 5.802 -8.009 9.331 1.00 0.00 O ATOM 808 CB MET A 53 4.804 -10.174 7.456 1.00 0.00 C ATOM 809 CG MET A 53 3.848 -10.946 6.561 1.00 0.00 C ATOM 810 SD MET A 53 3.414 -12.560 7.237 1.00 0.00 S ATOM 811 CE MET A 53 4.872 -13.509 6.809 1.00 0.00 C ATOM 0 H MET A 53 3.380 -7.942 7.881 1.00 0.00 H new ATOM 0 HA MET A 53 3.726 -10.528 9.282 1.00 0.00 H new ATOM 0 HB2 MET A 53 5.194 -9.318 6.905 1.00 0.00 H new ATOM 0 HB3 MET A 53 5.655 -10.811 7.700 1.00 0.00 H new ATOM 0 HG2 MET A 53 2.940 -10.361 6.416 1.00 0.00 H new ATOM 0 HG3 MET A 53 4.302 -11.078 5.579 1.00 0.00 H new ATOM 0 HE1 MET A 53 4.585 -14.536 6.585 1.00 0.00 H new ATOM 0 HE2 MET A 53 5.350 -13.067 5.935 1.00 0.00 H new ATOM 0 HE3 MET A 53 5.570 -13.501 7.646 1.00 0.00 H new ATOM 821 N PRO A 54 5.486 -9.687 10.800 1.00 0.00 N ATOM 822 CA PRO A 54 6.479 -9.205 11.765 1.00 0.00 C ATOM 823 C PRO A 54 7.906 -9.345 11.248 1.00 0.00 C ATOM 824 O PRO A 54 8.481 -10.432 11.269 1.00 0.00 O ATOM 825 CB PRO A 54 6.260 -10.109 12.981 1.00 0.00 C ATOM 826 CG PRO A 54 5.668 -11.358 12.423 1.00 0.00 C ATOM 827 CD PRO A 54 4.835 -10.931 11.246 1.00 0.00 C ATOM 0 HA PRO A 54 6.357 -8.143 11.978 1.00 0.00 H new ATOM 0 HB2 PRO A 54 7.198 -10.312 13.497 1.00 0.00 H new ATOM 0 HB3 PRO A 54 5.592 -9.643 13.705 1.00 0.00 H new ATOM 0 HG2 PRO A 54 6.447 -12.056 12.117 1.00 0.00 H new ATOM 0 HG3 PRO A 54 5.058 -11.868 13.169 1.00 0.00 H new ATOM 0 HD2 PRO A 54 4.832 -11.687 10.461 1.00 0.00 H new ATOM 0 HD3 PRO A 54 3.796 -10.762 11.529 1.00 0.00 H new ATOM 835 N GLY A 55 8.474 -8.235 10.784 1.00 0.00 N ATOM 836 CA GLY A 55 9.830 -8.256 10.268 1.00 0.00 C ATOM 837 C GLY A 55 9.874 -8.228 8.753 1.00 0.00 C ATOM 838 O GLY A 55 10.488 -9.093 8.127 1.00 0.00 O ATOM 0 H GLY A 55 8.019 -7.323 10.757 1.00 0.00 H new ATOM 0 HA2 GLY A 55 10.378 -7.399 10.660 1.00 0.00 H new ATOM 0 HA3 GLY A 55 10.338 -9.151 10.627 1.00 0.00 H new ATOM 842 N SER A 56 9.221 -7.233 8.161 1.00 0.00 N ATOM 843 CA SER A 56 9.184 -7.100 6.709 1.00 0.00 C ATOM 844 C SER A 56 10.205 -6.072 6.232 1.00 0.00 C ATOM 845 O SER A 56 11.091 -6.383 5.437 1.00 0.00 O ATOM 846 CB SER A 56 7.782 -6.694 6.249 1.00 0.00 C ATOM 847 OG SER A 56 6.841 -7.720 6.516 1.00 0.00 O ATOM 0 H SER A 56 8.711 -6.507 8.664 1.00 0.00 H new ATOM 0 HA SER A 56 9.436 -8.067 6.273 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.480 -5.778 6.757 1.00 0.00 H new ATOM 0 HB3 SER A 56 7.795 -6.477 5.181 1.00 0.00 H new ATOM 0 HG SER A 56 5.988 -7.320 6.784 1.00 0.00 H new ATOM 853 N VAL A 57 10.074 -4.844 6.724 1.00 0.00 N ATOM 854 CA VAL A 57 10.985 -3.769 6.350 1.00 0.00 C ATOM 855 C VAL A 57 11.946 -3.442 7.487 1.00 0.00 C ATOM 856 O VAL A 57 11.523 -3.121 8.597 1.00 0.00 O ATOM 857 CB VAL A 57 10.216 -2.492 5.960 1.00 0.00 C ATOM 858 CG1 VAL A 57 11.184 -1.370 5.618 1.00 0.00 C ATOM 859 CG2 VAL A 57 9.278 -2.771 4.795 1.00 0.00 C ATOM 0 H VAL A 57 9.345 -4.569 7.383 1.00 0.00 H new ATOM 0 HA VAL A 57 11.552 -4.121 5.488 1.00 0.00 H new ATOM 0 HB VAL A 57 9.616 -2.175 6.813 1.00 0.00 H new ATOM 0 HG11 VAL A 57 10.623 -0.476 5.345 1.00 0.00 H new ATOM 0 HG12 VAL A 57 11.812 -1.155 6.483 1.00 0.00 H new ATOM 0 HG13 VAL A 57 11.812 -1.674 4.781 1.00 0.00 H new ATOM 0 HG21 VAL A 57 8.743 -1.859 4.532 1.00 0.00 H new ATOM 0 HG22 VAL A 57 9.856 -3.113 3.936 1.00 0.00 H new ATOM 0 HG23 VAL A 57 8.562 -3.542 5.081 1.00 0.00 H new ATOM 869 N GLU A 58 13.242 -3.526 7.202 1.00 0.00 N ATOM 870 CA GLU A 58 14.263 -3.239 8.202 1.00 0.00 C ATOM 871 C GLU A 58 14.149 -1.801 8.700 1.00 0.00 C ATOM 872 O GLU A 58 13.876 -1.558 9.875 1.00 0.00 O ATOM 873 CB GLU A 58 15.659 -3.481 7.622 1.00 0.00 C ATOM 874 CG GLU A 58 16.140 -4.914 7.772 1.00 0.00 C ATOM 875 CD GLU A 58 15.659 -5.812 6.649 1.00 0.00 C ATOM 876 OE1 GLU A 58 14.648 -5.464 6.004 1.00 0.00 O ATOM 877 OE2 GLU A 58 16.292 -6.862 6.416 1.00 0.00 O ATOM 0 H GLU A 58 13.609 -3.790 6.288 1.00 0.00 H new ATOM 0 HA GLU A 58 14.107 -3.910 9.046 1.00 0.00 H new ATOM 0 HB2 GLU A 58 15.655 -3.217 6.564 1.00 0.00 H new ATOM 0 HB3 GLU A 58 16.368 -2.815 8.114 1.00 0.00 H new ATOM 0 HG2 GLU A 58 17.230 -4.926 7.801 1.00 0.00 H new ATOM 0 HG3 GLU A 58 15.792 -5.312 8.725 1.00 0.00 H new ATOM 884 N LYS A 59 14.362 -0.850 7.796 1.00 0.00 N ATOM 885 CA LYS A 59 14.283 0.564 8.141 1.00 0.00 C ATOM 886 C LYS A 59 13.913 1.402 6.920 1.00 0.00 C ATOM 887 O LYS A 59 14.664 1.464 5.947 1.00 0.00 O ATOM 888 CB LYS A 59 15.616 1.045 8.717 1.00 0.00 C ATOM 889 CG LYS A 59 16.784 0.894 7.757 1.00 0.00 C ATOM 890 CD LYS A 59 18.109 1.184 8.440 1.00 0.00 C ATOM 891 CE LYS A 59 19.264 0.487 7.737 1.00 0.00 C ATOM 892 NZ LYS A 59 19.633 1.171 6.466 1.00 0.00 N ATOM 0 H LYS A 59 14.591 -1.034 6.819 1.00 0.00 H new ATOM 0 HA LYS A 59 13.504 0.686 8.894 1.00 0.00 H new ATOM 0 HB2 LYS A 59 15.523 2.093 9.000 1.00 0.00 H new ATOM 0 HB3 LYS A 59 15.831 0.487 9.628 1.00 0.00 H new ATOM 0 HG2 LYS A 59 16.796 -0.119 7.354 1.00 0.00 H new ATOM 0 HG3 LYS A 59 16.653 1.572 6.913 1.00 0.00 H new ATOM 0 HD2 LYS A 59 18.285 2.260 8.452 1.00 0.00 H new ATOM 0 HD3 LYS A 59 18.063 0.857 9.479 1.00 0.00 H new ATOM 0 HE2 LYS A 59 20.129 0.460 8.399 1.00 0.00 H new ATOM 0 HE3 LYS A 59 18.991 -0.547 7.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 20.424 0.666 6.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 18.815 1.175 5.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 19.918 2.150 6.669 1.00 0.00 H new ATOM 906 N PHE A 60 12.751 2.044 6.980 1.00 0.00 N ATOM 907 CA PHE A 60 12.282 2.878 5.879 1.00 0.00 C ATOM 908 C PHE A 60 12.238 4.347 6.291 1.00 0.00 C ATOM 909 O PHE A 60 12.608 4.700 7.411 1.00 0.00 O ATOM 910 CB PHE A 60 10.894 2.423 5.422 1.00 0.00 C ATOM 911 CG PHE A 60 9.887 2.362 6.535 1.00 0.00 C ATOM 912 CD1 PHE A 60 9.962 1.374 7.502 1.00 0.00 C ATOM 913 CD2 PHE A 60 8.864 3.294 6.613 1.00 0.00 C ATOM 914 CE1 PHE A 60 9.036 1.315 8.526 1.00 0.00 C ATOM 915 CE2 PHE A 60 7.935 3.241 7.635 1.00 0.00 C ATOM 916 CZ PHE A 60 8.022 2.250 8.593 1.00 0.00 C ATOM 0 H PHE A 60 12.117 2.003 7.778 1.00 0.00 H new ATOM 0 HA PHE A 60 12.983 2.771 5.051 1.00 0.00 H new ATOM 0 HB2 PHE A 60 10.532 3.105 4.652 1.00 0.00 H new ATOM 0 HB3 PHE A 60 10.976 1.438 4.963 1.00 0.00 H new ATOM 0 HD1 PHE A 60 10.754 0.641 7.455 1.00 0.00 H new ATOM 0 HD2 PHE A 60 8.792 4.071 5.866 1.00 0.00 H new ATOM 0 HE1 PHE A 60 9.105 0.538 9.273 1.00 0.00 H new ATOM 0 HE2 PHE A 60 7.143 3.973 7.684 1.00 0.00 H new ATOM 0 HZ PHE A 60 7.298 2.206 9.393 1.00 0.00 H new ATOM 926 N CYS A 61 11.783 5.197 5.377 1.00 0.00 N ATOM 927 CA CYS A 61 11.691 6.629 5.644 1.00 0.00 C ATOM 928 C CYS A 61 10.249 7.039 5.923 1.00 0.00 C ATOM 929 O CYS A 61 9.402 7.019 5.029 1.00 0.00 O ATOM 930 CB CYS A 61 12.240 7.425 4.459 1.00 0.00 C ATOM 931 SG CYS A 61 12.981 9.010 4.915 1.00 0.00 S ATOM 0 H CYS A 61 11.472 4.920 4.446 1.00 0.00 H new ATOM 0 HA CYS A 61 12.289 6.848 6.529 1.00 0.00 H new ATOM 0 HB2 CYS A 61 12.987 6.821 3.944 1.00 0.00 H new ATOM 0 HB3 CYS A 61 11.432 7.604 3.750 1.00 0.00 H new ATOM 0 HG CYS A 61 13.927 9.305 4.074 1.00 0.00 H new ATOM 937 N LEU A 62 9.975 7.408 7.169 1.00 0.00 N ATOM 938 CA LEU A 62 8.634 7.821 7.568 1.00 0.00 C ATOM 939 C LEU A 62 8.162 9.012 6.739 1.00 0.00 C ATOM 940 O LEU A 62 7.017 9.053 6.290 1.00 0.00 O ATOM 941 CB LEU A 62 8.610 8.179 9.055 1.00 0.00 C ATOM 942 CG LEU A 62 8.604 7.000 10.029 1.00 0.00 C ATOM 943 CD1 LEU A 62 8.435 7.490 11.459 1.00 0.00 C ATOM 944 CD2 LEU A 62 7.501 6.016 9.667 1.00 0.00 C ATOM 0 H LEU A 62 10.664 7.430 7.921 1.00 0.00 H new ATOM 0 HA LEU A 62 7.956 6.986 7.391 1.00 0.00 H new ATOM 0 HB2 LEU A 62 9.479 8.800 9.273 1.00 0.00 H new ATOM 0 HB3 LEU A 62 7.727 8.788 9.247 1.00 0.00 H new ATOM 0 HG LEU A 62 9.562 6.486 9.954 1.00 0.00 H new ATOM 0 HD11 LEU A 62 8.433 6.637 12.138 1.00 0.00 H new ATOM 0 HD12 LEU A 62 9.259 8.156 11.715 1.00 0.00 H new ATOM 0 HD13 LEU A 62 7.492 8.028 11.550 1.00 0.00 H new ATOM 0 HD21 LEU A 62 7.511 5.183 10.370 1.00 0.00 H new ATOM 0 HD22 LEU A 62 6.535 6.519 9.714 1.00 0.00 H new ATOM 0 HD23 LEU A 62 7.666 5.640 8.657 1.00 0.00 H new ATOM 956 N ASP A 63 9.053 9.977 6.540 1.00 0.00 N ATOM 957 CA ASP A 63 8.729 11.168 5.762 1.00 0.00 C ATOM 958 C ASP A 63 9.829 11.471 4.749 1.00 0.00 C ATOM 959 O ASP A 63 10.808 12.156 5.046 1.00 0.00 O ATOM 960 CB ASP A 63 8.526 12.368 6.688 1.00 0.00 C ATOM 961 CG ASP A 63 8.185 13.634 5.927 1.00 0.00 C ATOM 962 OD1 ASP A 63 8.898 13.952 4.952 1.00 0.00 O ATOM 963 OD2 ASP A 63 7.204 14.308 6.307 1.00 0.00 O ATOM 0 H ASP A 63 10.005 9.958 6.906 1.00 0.00 H new ATOM 0 HA ASP A 63 7.803 10.977 5.219 1.00 0.00 H new ATOM 0 HB2 ASP A 63 7.727 12.146 7.396 1.00 0.00 H new ATOM 0 HB3 ASP A 63 9.432 12.531 7.271 1.00 0.00 H new ATOM 968 N PRO A 64 9.667 10.949 3.524 1.00 0.00 N ATOM 969 CA PRO A 64 10.636 11.150 2.443 1.00 0.00 C ATOM 970 C PRO A 64 10.648 12.588 1.936 1.00 0.00 C ATOM 971 O PRO A 64 9.796 12.982 1.140 1.00 0.00 O ATOM 972 CB PRO A 64 10.146 10.201 1.347 1.00 0.00 C ATOM 973 CG PRO A 64 8.688 10.040 1.608 1.00 0.00 C ATOM 974 CD PRO A 64 8.524 10.123 3.101 1.00 0.00 C ATOM 0 HA PRO A 64 11.658 10.955 2.769 1.00 0.00 H new ATOM 0 HB2 PRO A 64 10.327 10.615 0.355 1.00 0.00 H new ATOM 0 HB3 PRO A 64 10.664 9.243 1.392 1.00 0.00 H new ATOM 0 HG2 PRO A 64 8.113 10.820 1.108 1.00 0.00 H new ATOM 0 HG3 PRO A 64 8.326 9.084 1.228 1.00 0.00 H new ATOM 0 HD2 PRO A 64 7.574 10.581 3.376 1.00 0.00 H new ATOM 0 HD3 PRO A 64 8.548 9.136 3.563 1.00 0.00 H new ATOM 982 N GLN A 65 11.620 13.366 2.401 1.00 0.00 N ATOM 983 CA GLN A 65 11.742 14.761 1.993 1.00 0.00 C ATOM 984 C GLN A 65 12.059 14.868 0.505 1.00 0.00 C ATOM 985 O GLN A 65 11.593 15.782 -0.176 1.00 0.00 O ATOM 986 CB GLN A 65 12.830 15.460 2.810 1.00 0.00 C ATOM 987 CG GLN A 65 12.628 16.961 2.936 1.00 0.00 C ATOM 988 CD GLN A 65 11.224 17.325 3.378 1.00 0.00 C ATOM 989 OE1 GLN A 65 10.506 18.040 2.678 1.00 0.00 O ATOM 990 NE2 GLN A 65 10.825 16.834 4.546 1.00 0.00 N ATOM 0 H GLN A 65 12.334 13.055 3.060 1.00 0.00 H new ATOM 0 HA GLN A 65 10.787 15.252 2.178 1.00 0.00 H new ATOM 0 HB2 GLN A 65 12.862 15.021 3.807 1.00 0.00 H new ATOM 0 HB3 GLN A 65 13.798 15.270 2.347 1.00 0.00 H new ATOM 0 HG2 GLN A 65 13.346 17.362 3.652 1.00 0.00 H new ATOM 0 HG3 GLN A 65 12.837 17.434 1.976 1.00 0.00 H new ATOM 0 HE21 GLN A 65 11.453 16.246 5.093 1.00 0.00 H new ATOM 0 HE22 GLN A 65 9.890 17.045 4.896 1.00 0.00 H new ATOM 999 N THR A 66 12.855 13.927 0.006 1.00 0.00 N ATOM 1000 CA THR A 66 13.235 13.916 -1.401 1.00 0.00 C ATOM 1001 C THR A 66 12.857 12.596 -2.062 1.00 0.00 C ATOM 1002 O THR A 66 12.431 11.655 -1.392 1.00 0.00 O ATOM 1003 CB THR A 66 14.748 14.150 -1.576 1.00 0.00 C ATOM 1004 OG1 THR A 66 15.483 13.102 -0.934 1.00 0.00 O ATOM 1005 CG2 THR A 66 15.158 15.494 -0.994 1.00 0.00 C ATOM 0 H THR A 66 13.249 13.163 0.555 1.00 0.00 H new ATOM 0 HA THR A 66 12.691 14.729 -1.882 1.00 0.00 H new ATOM 0 HB THR A 66 14.973 14.150 -2.643 1.00 0.00 H new ATOM 0 HG1 THR A 66 16.444 13.257 -1.051 1.00 0.00 H new ATOM 0 HG21 THR A 66 16.230 15.637 -1.129 1.00 0.00 H new ATOM 0 HG22 THR A 66 14.618 16.292 -1.505 1.00 0.00 H new ATOM 0 HG23 THR A 66 14.920 15.518 0.069 1.00 0.00 H new ATOM 1013 N GLU A 67 13.017 12.532 -3.381 1.00 0.00 N ATOM 1014 CA GLU A 67 12.691 11.325 -4.132 1.00 0.00 C ATOM 1015 C GLU A 67 13.458 10.123 -3.588 1.00 0.00 C ATOM 1016 O GLU A 67 12.863 9.127 -3.180 1.00 0.00 O ATOM 1017 CB GLU A 67 13.011 11.520 -5.616 1.00 0.00 C ATOM 1018 CG GLU A 67 12.953 10.234 -6.424 1.00 0.00 C ATOM 1019 CD GLU A 67 13.695 10.341 -7.742 1.00 0.00 C ATOM 1020 OE1 GLU A 67 14.620 11.175 -7.838 1.00 0.00 O ATOM 1021 OE2 GLU A 67 13.351 9.589 -8.678 1.00 0.00 O ATOM 0 H GLU A 67 13.370 13.301 -3.951 1.00 0.00 H new ATOM 0 HA GLU A 67 11.624 11.134 -4.020 1.00 0.00 H new ATOM 0 HB2 GLU A 67 12.308 12.238 -6.040 1.00 0.00 H new ATOM 0 HB3 GLU A 67 14.006 11.954 -5.711 1.00 0.00 H new ATOM 0 HG2 GLU A 67 13.378 9.420 -5.837 1.00 0.00 H new ATOM 0 HG3 GLU A 67 11.911 9.977 -6.617 1.00 0.00 H new ATOM 1028 N ALA A 68 14.783 10.225 -3.588 1.00 0.00 N ATOM 1029 CA ALA A 68 15.632 9.148 -3.094 1.00 0.00 C ATOM 1030 C ALA A 68 15.018 8.483 -1.867 1.00 0.00 C ATOM 1031 O ALA A 68 15.081 7.263 -1.713 1.00 0.00 O ATOM 1032 CB ALA A 68 17.021 9.677 -2.770 1.00 0.00 C ATOM 0 H ALA A 68 15.292 11.043 -3.925 1.00 0.00 H new ATOM 0 HA ALA A 68 15.715 8.396 -3.879 1.00 0.00 H new ATOM 0 HB1 ALA A 68 17.644 8.862 -2.402 1.00 0.00 H new ATOM 0 HB2 ALA A 68 17.469 10.099 -3.670 1.00 0.00 H new ATOM 0 HB3 ALA A 68 16.947 10.450 -2.005 1.00 0.00 H new ATOM 1038 N ASP A 69 14.424 9.293 -0.996 1.00 0.00 N ATOM 1039 CA ASP A 69 13.798 8.783 0.218 1.00 0.00 C ATOM 1040 C ASP A 69 12.541 7.984 -0.114 1.00 0.00 C ATOM 1041 O ASP A 69 12.284 6.937 0.483 1.00 0.00 O ATOM 1042 CB ASP A 69 13.451 9.936 1.161 1.00 0.00 C ATOM 1043 CG ASP A 69 14.675 10.714 1.599 1.00 0.00 C ATOM 1044 OD1 ASP A 69 15.665 10.742 0.838 1.00 0.00 O ATOM 1045 OD2 ASP A 69 14.644 11.296 2.703 1.00 0.00 O ATOM 0 H ASP A 69 14.363 10.305 -1.109 1.00 0.00 H new ATOM 0 HA ASP A 69 14.508 8.120 0.713 1.00 0.00 H new ATOM 0 HB2 ASP A 69 12.754 10.611 0.664 1.00 0.00 H new ATOM 0 HB3 ASP A 69 12.941 9.542 2.040 1.00 0.00 H new ATOM 1050 N CYS A 70 11.762 8.485 -1.066 1.00 0.00 N ATOM 1051 CA CYS A 70 10.531 7.818 -1.475 1.00 0.00 C ATOM 1052 C CYS A 70 10.828 6.448 -2.075 1.00 0.00 C ATOM 1053 O CYS A 70 10.365 5.425 -1.570 1.00 0.00 O ATOM 1054 CB CYS A 70 9.774 8.679 -2.488 1.00 0.00 C ATOM 1055 SG CYS A 70 8.904 10.086 -1.757 1.00 0.00 S ATOM 0 H CYS A 70 11.961 9.350 -1.569 1.00 0.00 H new ATOM 0 HA CYS A 70 9.910 7.679 -0.590 1.00 0.00 H new ATOM 0 HB2 CYS A 70 10.479 9.048 -3.233 1.00 0.00 H new ATOM 0 HB3 CYS A 70 9.053 8.053 -3.014 1.00 0.00 H new ATOM 0 HG CYS A 70 8.297 10.754 -2.692 1.00 0.00 H new ATOM 1061 N ILE A 71 11.600 6.436 -3.156 1.00 0.00 N ATOM 1062 CA ILE A 71 11.957 5.191 -3.825 1.00 0.00 C ATOM 1063 C ILE A 71 12.407 4.136 -2.820 1.00 0.00 C ATOM 1064 O ILE A 71 11.983 2.983 -2.884 1.00 0.00 O ATOM 1065 CB ILE A 71 13.078 5.409 -4.859 1.00 0.00 C ATOM 1066 CG1 ILE A 71 12.655 6.459 -5.888 1.00 0.00 C ATOM 1067 CG2 ILE A 71 13.427 4.097 -5.546 1.00 0.00 C ATOM 1068 CD1 ILE A 71 11.367 6.119 -6.604 1.00 0.00 C ATOM 0 H ILE A 71 11.990 7.274 -3.587 1.00 0.00 H new ATOM 0 HA ILE A 71 11.062 4.841 -4.339 1.00 0.00 H new ATOM 0 HB ILE A 71 13.965 5.772 -4.340 1.00 0.00 H new ATOM 0 HG12 ILE A 71 12.540 7.421 -5.388 1.00 0.00 H new ATOM 0 HG13 ILE A 71 13.450 6.576 -6.624 1.00 0.00 H new ATOM 0 HG21 ILE A 71 14.220 4.267 -6.274 1.00 0.00 H new ATOM 0 HG22 ILE A 71 13.765 3.376 -4.802 1.00 0.00 H new ATOM 0 HG23 ILE A 71 12.546 3.707 -6.055 1.00 0.00 H new ATOM 0 HD11 ILE A 71 11.129 6.907 -7.318 1.00 0.00 H new ATOM 0 HD12 ILE A 71 11.484 5.173 -7.133 1.00 0.00 H new ATOM 0 HD13 ILE A 71 10.559 6.031 -5.878 1.00 0.00 H new ATOM 1080 N ASN A 72 13.267 4.541 -1.891 1.00 0.00 N ATOM 1081 CA ASN A 72 13.773 3.630 -0.870 1.00 0.00 C ATOM 1082 C ASN A 72 12.627 2.923 -0.155 1.00 0.00 C ATOM 1083 O ASN A 72 12.669 1.712 0.061 1.00 0.00 O ATOM 1084 CB ASN A 72 14.629 4.393 0.144 1.00 0.00 C ATOM 1085 CG ASN A 72 16.010 4.715 -0.392 1.00 0.00 C ATOM 1086 OD1 ASN A 72 16.389 4.268 -1.475 1.00 0.00 O ATOM 1087 ND2 ASN A 72 16.772 5.495 0.367 1.00 0.00 N ATOM 0 H ASN A 72 13.628 5.493 -1.824 1.00 0.00 H new ATOM 0 HA ASN A 72 14.389 2.877 -1.363 1.00 0.00 H new ATOM 0 HB2 ASN A 72 14.124 5.319 0.418 1.00 0.00 H new ATOM 0 HB3 ASN A 72 14.724 3.800 1.054 1.00 0.00 H new ATOM 0 HD21 ASN A 72 17.712 5.746 0.059 1.00 0.00 H new ATOM 0 HD22 ASN A 72 16.417 5.843 1.258 1.00 0.00 H new ATOM 1094 N ASN A 73 11.603 3.688 0.210 1.00 0.00 N ATOM 1095 CA ASN A 73 10.444 3.134 0.901 1.00 0.00 C ATOM 1096 C ASN A 73 9.756 2.073 0.047 1.00 0.00 C ATOM 1097 O ASN A 73 9.575 0.935 0.481 1.00 0.00 O ATOM 1098 CB ASN A 73 9.452 4.246 1.248 1.00 0.00 C ATOM 1099 CG ASN A 73 10.086 5.350 2.072 1.00 0.00 C ATOM 1100 OD1 ASN A 73 11.300 5.369 2.275 1.00 0.00 O ATOM 1101 ND2 ASN A 73 9.265 6.277 2.551 1.00 0.00 N ATOM 0 H ASN A 73 11.552 4.692 0.039 1.00 0.00 H new ATOM 0 HA ASN A 73 10.792 2.665 1.821 1.00 0.00 H new ATOM 0 HB2 ASN A 73 9.048 4.669 0.328 1.00 0.00 H new ATOM 0 HB3 ASN A 73 8.613 3.822 1.799 1.00 0.00 H new ATOM 0 HD21 ASN A 73 9.634 7.045 3.112 1.00 0.00 H new ATOM 0 HD22 ASN A 73 8.265 6.222 2.358 1.00 0.00 H new ATOM 1108 N ILE A 74 9.377 2.454 -1.168 1.00 0.00 N ATOM 1109 CA ILE A 74 8.712 1.535 -2.083 1.00 0.00 C ATOM 1110 C ILE A 74 9.472 0.216 -2.187 1.00 0.00 C ATOM 1111 O ILE A 74 8.889 -0.859 -2.056 1.00 0.00 O ATOM 1112 CB ILE A 74 8.571 2.145 -3.490 1.00 0.00 C ATOM 1113 CG1 ILE A 74 7.755 3.438 -3.430 1.00 0.00 C ATOM 1114 CG2 ILE A 74 7.923 1.147 -4.438 1.00 0.00 C ATOM 1115 CD1 ILE A 74 7.990 4.356 -4.609 1.00 0.00 C ATOM 0 H ILE A 74 9.519 3.392 -1.541 1.00 0.00 H new ATOM 0 HA ILE A 74 7.718 1.348 -1.675 1.00 0.00 H new ATOM 0 HB ILE A 74 9.565 2.382 -3.868 1.00 0.00 H new ATOM 0 HG12 ILE A 74 6.695 3.187 -3.381 1.00 0.00 H new ATOM 0 HG13 ILE A 74 8.000 3.970 -2.511 1.00 0.00 H new ATOM 0 HG21 ILE A 74 7.830 1.593 -5.428 1.00 0.00 H new ATOM 0 HG22 ILE A 74 8.540 0.251 -4.500 1.00 0.00 H new ATOM 0 HG23 ILE A 74 6.934 0.881 -4.066 1.00 0.00 H new ATOM 0 HD11 ILE A 74 7.379 5.252 -4.500 1.00 0.00 H new ATOM 0 HD12 ILE A 74 9.043 4.637 -4.647 1.00 0.00 H new ATOM 0 HD13 ILE A 74 7.718 3.842 -5.531 1.00 0.00 H new ATOM 1127 N ASN A 75 10.777 0.308 -2.421 1.00 0.00 N ATOM 1128 CA ASN A 75 11.617 -0.877 -2.541 1.00 0.00 C ATOM 1129 C ASN A 75 11.591 -1.695 -1.254 1.00 0.00 C ATOM 1130 O ASN A 75 11.490 -2.922 -1.287 1.00 0.00 O ATOM 1131 CB ASN A 75 13.056 -0.477 -2.875 1.00 0.00 C ATOM 1132 CG ASN A 75 13.290 -0.356 -4.369 1.00 0.00 C ATOM 1133 OD1 ASN A 75 13.496 -1.355 -5.058 1.00 0.00 O ATOM 1134 ND2 ASN A 75 13.261 0.871 -4.875 1.00 0.00 N ATOM 0 H ASN A 75 11.275 1.191 -2.531 1.00 0.00 H new ATOM 0 HA ASN A 75 11.221 -1.491 -3.349 1.00 0.00 H new ATOM 0 HB2 ASN A 75 13.286 0.474 -2.396 1.00 0.00 H new ATOM 0 HB3 ASN A 75 13.741 -1.217 -2.461 1.00 0.00 H new ATOM 0 HD21 ASN A 75 13.413 1.015 -5.873 1.00 0.00 H new ATOM 0 HD22 ASN A 75 13.087 1.670 -4.265 1.00 0.00 H new ATOM 1141 N ASP A 76 11.682 -1.008 -0.121 1.00 0.00 N ATOM 1142 CA ASP A 76 11.667 -1.669 1.179 1.00 0.00 C ATOM 1143 C ASP A 76 10.401 -2.503 1.349 1.00 0.00 C ATOM 1144 O ASP A 76 10.457 -3.652 1.789 1.00 0.00 O ATOM 1145 CB ASP A 76 11.767 -0.636 2.302 1.00 0.00 C ATOM 1146 CG ASP A 76 13.203 -0.302 2.655 1.00 0.00 C ATOM 1147 OD1 ASP A 76 14.077 -0.436 1.774 1.00 0.00 O ATOM 1148 OD2 ASP A 76 13.453 0.092 3.814 1.00 0.00 O ATOM 0 H ASP A 76 11.767 0.007 -0.076 1.00 0.00 H new ATOM 0 HA ASP A 76 12.529 -2.334 1.231 1.00 0.00 H new ATOM 0 HB2 ASP A 76 11.249 0.274 2.001 1.00 0.00 H new ATOM 0 HB3 ASP A 76 11.257 -1.016 3.187 1.00 0.00 H new ATOM 1153 N PHE A 77 9.261 -1.917 0.999 1.00 0.00 N ATOM 1154 CA PHE A 77 7.981 -2.606 1.115 1.00 0.00 C ATOM 1155 C PHE A 77 7.975 -3.887 0.287 1.00 0.00 C ATOM 1156 O PHE A 77 7.534 -4.939 0.753 1.00 0.00 O ATOM 1157 CB PHE A 77 6.842 -1.689 0.664 1.00 0.00 C ATOM 1158 CG PHE A 77 5.608 -2.431 0.238 1.00 0.00 C ATOM 1159 CD1 PHE A 77 4.893 -3.194 1.147 1.00 0.00 C ATOM 1160 CD2 PHE A 77 5.162 -2.366 -1.073 1.00 0.00 C ATOM 1161 CE1 PHE A 77 3.757 -3.878 0.759 1.00 0.00 C ATOM 1162 CE2 PHE A 77 4.026 -3.048 -1.467 1.00 0.00 C ATOM 1163 CZ PHE A 77 3.324 -3.806 -0.551 1.00 0.00 C ATOM 0 H PHE A 77 9.197 -0.967 0.633 1.00 0.00 H new ATOM 0 HA PHE A 77 7.833 -2.871 2.162 1.00 0.00 H new ATOM 0 HB2 PHE A 77 6.586 -1.013 1.480 1.00 0.00 H new ATOM 0 HB3 PHE A 77 7.189 -1.072 -0.165 1.00 0.00 H new ATOM 0 HD1 PHE A 77 5.228 -3.255 2.172 1.00 0.00 H new ATOM 0 HD2 PHE A 77 5.708 -1.776 -1.794 1.00 0.00 H new ATOM 0 HE1 PHE A 77 3.208 -4.468 1.478 1.00 0.00 H new ATOM 0 HE2 PHE A 77 3.688 -2.988 -2.491 1.00 0.00 H new ATOM 0 HZ PHE A 77 2.438 -4.342 -0.858 1.00 0.00 H new ATOM 1173 N LEU A 78 8.467 -3.792 -0.943 1.00 0.00 N ATOM 1174 CA LEU A 78 8.519 -4.943 -1.838 1.00 0.00 C ATOM 1175 C LEU A 78 9.270 -6.103 -1.190 1.00 0.00 C ATOM 1176 O LEU A 78 8.806 -7.243 -1.207 1.00 0.00 O ATOM 1177 CB LEU A 78 9.192 -4.558 -3.157 1.00 0.00 C ATOM 1178 CG LEU A 78 8.457 -3.522 -4.008 1.00 0.00 C ATOM 1179 CD1 LEU A 78 9.310 -3.106 -5.196 1.00 0.00 C ATOM 1180 CD2 LEU A 78 7.117 -4.070 -4.476 1.00 0.00 C ATOM 0 H LEU A 78 8.836 -2.930 -1.344 1.00 0.00 H new ATOM 0 HA LEU A 78 7.497 -5.263 -2.039 1.00 0.00 H new ATOM 0 HB2 LEU A 78 10.188 -4.176 -2.935 1.00 0.00 H new ATOM 0 HB3 LEU A 78 9.322 -5.462 -3.753 1.00 0.00 H new ATOM 0 HG LEU A 78 8.271 -2.641 -3.394 1.00 0.00 H new ATOM 0 HD11 LEU A 78 8.771 -2.368 -5.790 1.00 0.00 H new ATOM 0 HD12 LEU A 78 10.244 -2.672 -4.839 1.00 0.00 H new ATOM 0 HD13 LEU A 78 9.527 -3.979 -5.811 1.00 0.00 H new ATOM 0 HD21 LEU A 78 6.608 -3.319 -5.080 1.00 0.00 H new ATOM 0 HD22 LEU A 78 7.279 -4.967 -5.073 1.00 0.00 H new ATOM 0 HD23 LEU A 78 6.502 -4.317 -3.610 1.00 0.00 H new ATOM 1192 N LYS A 79 10.431 -5.803 -0.618 1.00 0.00 N ATOM 1193 CA LYS A 79 11.245 -6.819 0.039 1.00 0.00 C ATOM 1194 C LYS A 79 10.367 -7.842 0.753 1.00 0.00 C ATOM 1195 O LYS A 79 10.694 -9.026 0.805 1.00 0.00 O ATOM 1196 CB LYS A 79 12.203 -6.166 1.039 1.00 0.00 C ATOM 1197 CG LYS A 79 13.191 -5.208 0.397 1.00 0.00 C ATOM 1198 CD LYS A 79 14.375 -4.934 1.309 1.00 0.00 C ATOM 1199 CE LYS A 79 15.241 -3.804 0.775 1.00 0.00 C ATOM 1200 NZ LYS A 79 16.633 -3.877 1.299 1.00 0.00 N ATOM 0 H LYS A 79 10.830 -4.864 -0.596 1.00 0.00 H new ATOM 0 HA LYS A 79 11.825 -7.335 -0.726 1.00 0.00 H new ATOM 0 HB2 LYS A 79 11.622 -5.628 1.788 1.00 0.00 H new ATOM 0 HB3 LYS A 79 12.755 -6.946 1.564 1.00 0.00 H new ATOM 0 HG2 LYS A 79 13.545 -5.627 -0.545 1.00 0.00 H new ATOM 0 HG3 LYS A 79 12.688 -4.270 0.160 1.00 0.00 H new ATOM 0 HD2 LYS A 79 14.016 -4.678 2.306 1.00 0.00 H new ATOM 0 HD3 LYS A 79 14.976 -5.838 1.409 1.00 0.00 H new ATOM 0 HE2 LYS A 79 15.260 -3.845 -0.314 1.00 0.00 H new ATOM 0 HE3 LYS A 79 14.799 -2.846 1.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 17.191 -3.090 0.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 16.617 -3.813 2.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 17.064 -4.780 1.015 1.00 0.00 H new ATOM 1214 N GLY A 80 9.249 -7.375 1.302 1.00 0.00 N ATOM 1215 CA GLY A 80 8.341 -8.263 2.005 1.00 0.00 C ATOM 1216 C GLY A 80 7.312 -8.887 1.083 1.00 0.00 C ATOM 1217 O GLY A 80 6.985 -10.067 1.215 1.00 0.00 O ATOM 0 H GLY A 80 8.956 -6.398 1.272 1.00 0.00 H new ATOM 0 HA2 GLY A 80 8.914 -9.052 2.492 1.00 0.00 H new ATOM 0 HA3 GLY A 80 7.830 -7.707 2.792 1.00 0.00 H new ATOM 1221 N CYS A 81 6.798 -8.094 0.150 1.00 0.00 N ATOM 1222 CA CYS A 81 5.797 -8.575 -0.796 1.00 0.00 C ATOM 1223 C CYS A 81 6.227 -9.901 -1.415 1.00 0.00 C ATOM 1224 O CYS A 81 5.396 -10.762 -1.701 1.00 0.00 O ATOM 1225 CB CYS A 81 5.563 -7.537 -1.895 1.00 0.00 C ATOM 1226 SG CYS A 81 6.827 -7.533 -3.188 1.00 0.00 S ATOM 0 H CYS A 81 7.058 -7.115 0.028 1.00 0.00 H new ATOM 0 HA CYS A 81 4.866 -8.734 -0.252 1.00 0.00 H new ATOM 0 HB2 CYS A 81 4.591 -7.721 -2.353 1.00 0.00 H new ATOM 0 HB3 CYS A 81 5.519 -6.547 -1.441 1.00 0.00 H new ATOM 0 HG CYS A 81 8.006 -7.575 -2.642 1.00 0.00 H new ATOM 1232 N ALA A 82 7.531 -10.056 -1.621 1.00 0.00 N ATOM 1233 CA ALA A 82 8.072 -11.277 -2.207 1.00 0.00 C ATOM 1234 C ALA A 82 7.668 -12.502 -1.392 1.00 0.00 C ATOM 1235 O ALA A 82 7.207 -13.502 -1.942 1.00 0.00 O ATOM 1236 CB ALA A 82 9.587 -11.186 -2.311 1.00 0.00 C ATOM 0 H ALA A 82 8.232 -9.352 -1.391 1.00 0.00 H new ATOM 0 HA ALA A 82 7.656 -11.386 -3.209 1.00 0.00 H new ATOM 0 HB1 ALA A 82 9.977 -12.104 -2.750 1.00 0.00 H new ATOM 0 HB2 ALA A 82 9.858 -10.339 -2.941 1.00 0.00 H new ATOM 0 HB3 ALA A 82 10.012 -11.050 -1.317 1.00 0.00 H new ATOM 1242 N THR A 83 7.845 -12.417 -0.077 1.00 0.00 N ATOM 1243 CA THR A 83 7.501 -13.518 0.813 1.00 0.00 C ATOM 1244 C THR A 83 6.115 -14.068 0.497 1.00 0.00 C ATOM 1245 O THR A 83 5.889 -15.278 0.550 1.00 0.00 O ATOM 1246 CB THR A 83 7.544 -13.082 2.289 1.00 0.00 C ATOM 1247 OG1 THR A 83 8.830 -12.535 2.601 1.00 0.00 O ATOM 1248 CG2 THR A 83 7.251 -14.257 3.210 1.00 0.00 C ATOM 0 H THR A 83 8.225 -11.596 0.395 1.00 0.00 H new ATOM 0 HA THR A 83 8.244 -14.299 0.651 1.00 0.00 H new ATOM 0 HB THR A 83 6.779 -12.321 2.442 1.00 0.00 H new ATOM 0 HG1 THR A 83 8.849 -12.259 3.541 1.00 0.00 H new ATOM 0 HG21 THR A 83 7.287 -13.924 4.247 1.00 0.00 H new ATOM 0 HG22 THR A 83 6.260 -14.653 2.990 1.00 0.00 H new ATOM 0 HG23 THR A 83 7.996 -15.037 3.053 1.00 0.00 H new ATOM 1256 N LEU A 84 5.190 -13.174 0.168 1.00 0.00 N ATOM 1257 CA LEU A 84 3.824 -13.570 -0.158 1.00 0.00 C ATOM 1258 C LEU A 84 3.761 -14.226 -1.533 1.00 0.00 C ATOM 1259 O LEU A 84 2.862 -15.020 -1.811 1.00 0.00 O ATOM 1260 CB LEU A 84 2.896 -12.354 -0.117 1.00 0.00 C ATOM 1261 CG LEU A 84 2.828 -11.606 1.215 1.00 0.00 C ATOM 1262 CD1 LEU A 84 2.486 -10.142 0.988 1.00 0.00 C ATOM 1263 CD2 LEU A 84 1.810 -12.257 2.140 1.00 0.00 C ATOM 0 H LEU A 84 5.360 -12.170 0.120 1.00 0.00 H new ATOM 0 HA LEU A 84 3.495 -14.296 0.586 1.00 0.00 H new ATOM 0 HB2 LEU A 84 3.214 -11.653 -0.889 1.00 0.00 H new ATOM 0 HB3 LEU A 84 1.890 -12.681 -0.379 1.00 0.00 H new ATOM 0 HG LEU A 84 3.807 -11.659 1.691 1.00 0.00 H new ATOM 0 HD11 LEU A 84 2.442 -9.626 1.947 1.00 0.00 H new ATOM 0 HD12 LEU A 84 3.252 -9.682 0.363 1.00 0.00 H new ATOM 0 HD13 LEU A 84 1.519 -10.067 0.491 1.00 0.00 H new ATOM 0 HD21 LEU A 84 1.775 -11.712 3.083 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.826 -12.235 1.671 1.00 0.00 H new ATOM 0 HD23 LEU A 84 2.099 -13.291 2.329 1.00 0.00 H new ATOM 1275 N GLN A 85 4.721 -13.890 -2.388 1.00 0.00 N ATOM 1276 CA GLN A 85 4.775 -14.449 -3.734 1.00 0.00 C ATOM 1277 C GLN A 85 3.513 -14.101 -4.518 1.00 0.00 C ATOM 1278 O GLN A 85 2.919 -14.960 -5.170 1.00 0.00 O ATOM 1279 CB GLN A 85 4.949 -15.967 -3.673 1.00 0.00 C ATOM 1280 CG GLN A 85 6.239 -16.404 -2.997 1.00 0.00 C ATOM 1281 CD GLN A 85 7.456 -16.207 -3.880 1.00 0.00 C ATOM 1282 OE1 GLN A 85 8.277 -15.322 -3.637 1.00 0.00 O ATOM 1283 NE2 GLN A 85 7.579 -17.034 -4.912 1.00 0.00 N ATOM 0 H GLN A 85 5.472 -13.234 -2.173 1.00 0.00 H new ATOM 0 HA GLN A 85 5.632 -14.013 -4.247 1.00 0.00 H new ATOM 0 HB2 GLN A 85 4.104 -16.400 -3.139 1.00 0.00 H new ATOM 0 HB3 GLN A 85 4.925 -16.368 -4.686 1.00 0.00 H new ATOM 0 HG2 GLN A 85 6.370 -15.840 -2.073 1.00 0.00 H new ATOM 0 HG3 GLN A 85 6.162 -17.455 -2.720 1.00 0.00 H new ATOM 0 HE21 GLN A 85 6.875 -17.753 -5.076 1.00 0.00 H new ATOM 0 HE22 GLN A 85 8.378 -16.950 -5.541 1.00 0.00 H new ATOM 1292 N VAL A 86 3.109 -12.837 -4.450 1.00 0.00 N ATOM 1293 CA VAL A 86 1.918 -12.376 -5.154 1.00 0.00 C ATOM 1294 C VAL A 86 2.270 -11.320 -6.195 1.00 0.00 C ATOM 1295 O VAL A 86 3.441 -11.000 -6.397 1.00 0.00 O ATOM 1296 CB VAL A 86 0.880 -11.792 -4.177 1.00 0.00 C ATOM 1297 CG1 VAL A 86 0.386 -12.865 -3.218 1.00 0.00 C ATOM 1298 CG2 VAL A 86 1.469 -10.614 -3.415 1.00 0.00 C ATOM 0 H VAL A 86 3.589 -12.114 -3.915 1.00 0.00 H new ATOM 0 HA VAL A 86 1.488 -13.245 -5.653 1.00 0.00 H new ATOM 0 HB VAL A 86 0.027 -11.433 -4.753 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -0.346 -12.434 -2.536 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -0.077 -13.673 -3.784 1.00 0.00 H new ATOM 0 HG13 VAL A 86 1.227 -13.258 -2.647 1.00 0.00 H new ATOM 0 HG21 VAL A 86 0.722 -10.214 -2.730 1.00 0.00 H new ATOM 0 HG22 VAL A 86 2.340 -10.945 -2.849 1.00 0.00 H new ATOM 0 HG23 VAL A 86 1.768 -9.838 -4.119 1.00 0.00 H new ATOM 1308 N GLU A 87 1.248 -10.781 -6.853 1.00 0.00 N ATOM 1309 CA GLU A 87 1.450 -9.761 -7.875 1.00 0.00 C ATOM 1310 C GLU A 87 2.223 -8.572 -7.310 1.00 0.00 C ATOM 1311 O GLU A 87 1.930 -8.092 -6.215 1.00 0.00 O ATOM 1312 CB GLU A 87 0.105 -9.291 -8.431 1.00 0.00 C ATOM 1313 CG GLU A 87 -0.514 -10.259 -9.425 1.00 0.00 C ATOM 1314 CD GLU A 87 -1.844 -9.770 -9.965 1.00 0.00 C ATOM 1315 OE1 GLU A 87 -2.835 -9.784 -9.206 1.00 0.00 O ATOM 1316 OE2 GLU A 87 -1.893 -9.373 -11.148 1.00 0.00 O ATOM 0 H GLU A 87 0.272 -11.034 -6.696 1.00 0.00 H new ATOM 0 HA GLU A 87 2.034 -10.202 -8.683 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -0.588 -9.140 -7.603 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.239 -8.323 -8.914 1.00 0.00 H new ATOM 0 HG2 GLU A 87 0.176 -10.413 -10.255 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.655 -11.227 -8.944 1.00 0.00 H new ATOM 1323 N ILE A 88 3.210 -8.103 -8.066 1.00 0.00 N ATOM 1324 CA ILE A 88 4.024 -6.971 -7.642 1.00 0.00 C ATOM 1325 C ILE A 88 4.138 -5.930 -8.751 1.00 0.00 C ATOM 1326 O ILE A 88 3.616 -6.118 -9.850 1.00 0.00 O ATOM 1327 CB ILE A 88 5.438 -7.418 -7.227 1.00 0.00 C ATOM 1328 CG1 ILE A 88 6.128 -8.143 -8.384 1.00 0.00 C ATOM 1329 CG2 ILE A 88 5.370 -8.314 -5.999 1.00 0.00 C ATOM 1330 CD1 ILE A 88 7.635 -8.008 -8.369 1.00 0.00 C ATOM 0 H ILE A 88 3.465 -8.489 -8.975 1.00 0.00 H new ATOM 0 HA ILE A 88 3.524 -6.528 -6.780 1.00 0.00 H new ATOM 0 HB ILE A 88 6.024 -6.534 -6.977 1.00 0.00 H new ATOM 0 HG12 ILE A 88 5.866 -9.200 -8.348 1.00 0.00 H new ATOM 0 HG13 ILE A 88 5.746 -7.752 -9.327 1.00 0.00 H new ATOM 0 HG21 ILE A 88 6.377 -8.622 -5.717 1.00 0.00 H new ATOM 0 HG22 ILE A 88 4.914 -7.767 -5.174 1.00 0.00 H new ATOM 0 HG23 ILE A 88 4.770 -9.196 -6.225 1.00 0.00 H new ATOM 0 HD11 ILE A 88 8.057 -8.547 -9.217 1.00 0.00 H new ATOM 0 HD12 ILE A 88 7.907 -6.955 -8.436 1.00 0.00 H new ATOM 0 HD13 ILE A 88 8.028 -8.425 -7.442 1.00 0.00 H new ATOM 1342 N PHE A 89 4.826 -4.832 -8.456 1.00 0.00 N ATOM 1343 CA PHE A 89 5.009 -3.760 -9.428 1.00 0.00 C ATOM 1344 C PHE A 89 6.380 -3.110 -9.267 1.00 0.00 C ATOM 1345 O PHE A 89 7.183 -3.525 -8.431 1.00 0.00 O ATOM 1346 CB PHE A 89 3.911 -2.707 -9.271 1.00 0.00 C ATOM 1347 CG PHE A 89 3.724 -2.242 -7.855 1.00 0.00 C ATOM 1348 CD1 PHE A 89 4.560 -1.281 -7.311 1.00 0.00 C ATOM 1349 CD2 PHE A 89 2.712 -2.767 -7.067 1.00 0.00 C ATOM 1350 CE1 PHE A 89 4.391 -0.850 -6.008 1.00 0.00 C ATOM 1351 CE2 PHE A 89 2.537 -2.341 -5.764 1.00 0.00 C ATOM 1352 CZ PHE A 89 3.378 -1.382 -5.234 1.00 0.00 C ATOM 0 H PHE A 89 5.266 -4.661 -7.552 1.00 0.00 H new ATOM 0 HA PHE A 89 4.946 -4.193 -10.426 1.00 0.00 H new ATOM 0 HB2 PHE A 89 4.150 -1.848 -9.898 1.00 0.00 H new ATOM 0 HB3 PHE A 89 2.970 -3.117 -9.637 1.00 0.00 H new ATOM 0 HD1 PHE A 89 5.354 -0.863 -7.912 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.052 -3.518 -7.476 1.00 0.00 H new ATOM 0 HE1 PHE A 89 5.049 -0.099 -5.596 1.00 0.00 H new ATOM 0 HE2 PHE A 89 1.744 -2.757 -5.161 1.00 0.00 H new ATOM 0 HZ PHE A 89 3.244 -1.048 -4.216 1.00 0.00 H new ATOM 1362 N ASP A 90 6.641 -2.088 -10.075 1.00 0.00 N ATOM 1363 CA ASP A 90 7.914 -1.378 -10.023 1.00 0.00 C ATOM 1364 C ASP A 90 7.781 -0.078 -9.238 1.00 0.00 C ATOM 1365 O ASP A 90 6.687 0.461 -9.063 1.00 0.00 O ATOM 1366 CB ASP A 90 8.417 -1.085 -11.438 1.00 0.00 C ATOM 1367 CG ASP A 90 9.170 -2.255 -12.040 1.00 0.00 C ATOM 1368 OD1 ASP A 90 8.510 -3.198 -12.524 1.00 0.00 O ATOM 1369 OD2 ASP A 90 10.418 -2.229 -12.025 1.00 0.00 O ATOM 0 H ASP A 90 5.988 -1.733 -10.774 1.00 0.00 H new ATOM 0 HA ASP A 90 8.636 -2.016 -9.513 1.00 0.00 H new ATOM 0 HB2 ASP A 90 7.570 -0.835 -12.077 1.00 0.00 H new ATOM 0 HB3 ASP A 90 9.068 -0.211 -11.415 1.00 0.00 H new ATOM 1374 N PRO A 91 8.918 0.440 -8.751 1.00 0.00 N ATOM 1375 CA PRO A 91 8.954 1.683 -7.975 1.00 0.00 C ATOM 1376 C PRO A 91 8.647 2.908 -8.829 1.00 0.00 C ATOM 1377 O PRO A 91 8.459 4.008 -8.309 1.00 0.00 O ATOM 1378 CB PRO A 91 10.394 1.738 -7.459 1.00 0.00 C ATOM 1379 CG PRO A 91 11.179 0.938 -8.440 1.00 0.00 C ATOM 1380 CD PRO A 91 10.257 -0.149 -8.920 1.00 0.00 C ATOM 0 HA PRO A 91 8.203 1.692 -7.185 1.00 0.00 H new ATOM 0 HB2 PRO A 91 10.756 2.765 -7.405 1.00 0.00 H new ATOM 0 HB3 PRO A 91 10.471 1.320 -6.455 1.00 0.00 H new ATOM 0 HG2 PRO A 91 11.515 1.559 -9.270 1.00 0.00 H new ATOM 0 HG3 PRO A 91 12.071 0.517 -7.976 1.00 0.00 H new ATOM 0 HD2 PRO A 91 10.452 -0.411 -9.960 1.00 0.00 H new ATOM 0 HD3 PRO A 91 10.372 -1.061 -8.334 1.00 0.00 H new ATOM 1388 N ASP A 92 8.599 2.711 -10.142 1.00 0.00 N ATOM 1389 CA ASP A 92 8.313 3.800 -11.069 1.00 0.00 C ATOM 1390 C ASP A 92 6.819 3.887 -11.362 1.00 0.00 C ATOM 1391 O ASP A 92 6.239 4.973 -11.369 1.00 0.00 O ATOM 1392 CB ASP A 92 9.091 3.607 -12.371 1.00 0.00 C ATOM 1393 CG ASP A 92 10.586 3.771 -12.183 1.00 0.00 C ATOM 1394 OD1 ASP A 92 11.148 3.106 -11.287 1.00 0.00 O ATOM 1395 OD2 ASP A 92 11.195 4.563 -12.931 1.00 0.00 O ATOM 0 H ASP A 92 8.754 1.807 -10.588 1.00 0.00 H new ATOM 0 HA ASP A 92 8.627 4.733 -10.602 1.00 0.00 H new ATOM 0 HB2 ASP A 92 8.885 2.614 -12.770 1.00 0.00 H new ATOM 0 HB3 ASP A 92 8.740 4.327 -13.111 1.00 0.00 H new ATOM 1400 N ASP A 93 6.201 2.736 -11.605 1.00 0.00 N ATOM 1401 CA ASP A 93 4.774 2.681 -11.899 1.00 0.00 C ATOM 1402 C ASP A 93 3.968 3.390 -10.815 1.00 0.00 C ATOM 1403 O ASP A 93 3.015 4.113 -11.108 1.00 0.00 O ATOM 1404 CB ASP A 93 4.313 1.228 -12.027 1.00 0.00 C ATOM 1405 CG ASP A 93 4.823 0.568 -13.293 1.00 0.00 C ATOM 1406 OD1 ASP A 93 4.450 1.027 -14.393 1.00 0.00 O ATOM 1407 OD2 ASP A 93 5.595 -0.407 -13.184 1.00 0.00 O ATOM 0 H ASP A 93 6.666 1.828 -11.604 1.00 0.00 H new ATOM 0 HA ASP A 93 4.604 3.193 -12.846 1.00 0.00 H new ATOM 0 HB2 ASP A 93 4.659 0.663 -11.162 1.00 0.00 H new ATOM 0 HB3 ASP A 93 3.224 1.193 -12.016 1.00 0.00 H new ATOM 1412 N LEU A 94 4.356 3.177 -9.563 1.00 0.00 N ATOM 1413 CA LEU A 94 3.669 3.795 -8.434 1.00 0.00 C ATOM 1414 C LEU A 94 4.126 5.237 -8.241 1.00 0.00 C ATOM 1415 O LEU A 94 3.316 6.164 -8.263 1.00 0.00 O ATOM 1416 CB LEU A 94 3.922 2.993 -7.156 1.00 0.00 C ATOM 1417 CG LEU A 94 3.550 3.685 -5.845 1.00 0.00 C ATOM 1418 CD1 LEU A 94 2.060 3.988 -5.805 1.00 0.00 C ATOM 1419 CD2 LEU A 94 3.953 2.825 -4.655 1.00 0.00 C ATOM 0 H LEU A 94 5.142 2.581 -9.304 1.00 0.00 H new ATOM 0 HA LEU A 94 2.600 3.798 -8.649 1.00 0.00 H new ATOM 0 HB2 LEU A 94 3.365 2.058 -7.221 1.00 0.00 H new ATOM 0 HB3 LEU A 94 4.980 2.732 -7.118 1.00 0.00 H new ATOM 0 HG LEU A 94 4.093 4.628 -5.788 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.814 4.481 -4.864 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.799 4.643 -6.636 1.00 0.00 H new ATOM 0 HD13 LEU A 94 1.497 3.058 -5.886 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.681 3.333 -3.730 1.00 0.00 H new ATOM 0 HD22 LEU A 94 3.437 1.866 -4.708 1.00 0.00 H new ATOM 0 HD23 LEU A 94 5.030 2.659 -4.674 1.00 0.00 H new ATOM 1431 N TYR A 95 5.428 5.420 -8.055 1.00 0.00 N ATOM 1432 CA TYR A 95 5.994 6.749 -7.859 1.00 0.00 C ATOM 1433 C TYR A 95 5.499 7.715 -8.931 1.00 0.00 C ATOM 1434 O TYR A 95 4.913 8.754 -8.624 1.00 0.00 O ATOM 1435 CB TYR A 95 7.522 6.685 -7.881 1.00 0.00 C ATOM 1436 CG TYR A 95 8.188 7.950 -7.390 1.00 0.00 C ATOM 1437 CD1 TYR A 95 7.804 8.541 -6.193 1.00 0.00 C ATOM 1438 CD2 TYR A 95 9.204 8.553 -8.122 1.00 0.00 C ATOM 1439 CE1 TYR A 95 8.410 9.698 -5.740 1.00 0.00 C ATOM 1440 CE2 TYR A 95 9.816 9.709 -7.676 1.00 0.00 C ATOM 1441 CZ TYR A 95 9.415 10.277 -6.485 1.00 0.00 C ATOM 1442 OH TYR A 95 10.022 11.428 -6.037 1.00 0.00 O ATOM 0 H TYR A 95 6.112 4.664 -8.036 1.00 0.00 H new ATOM 0 HA TYR A 95 5.667 7.115 -6.886 1.00 0.00 H new ATOM 0 HB2 TYR A 95 7.851 5.848 -7.265 1.00 0.00 H new ATOM 0 HB3 TYR A 95 7.854 6.481 -8.899 1.00 0.00 H new ATOM 0 HD1 TYR A 95 7.018 8.089 -5.606 1.00 0.00 H new ATOM 0 HD2 TYR A 95 9.521 8.111 -9.055 1.00 0.00 H new ATOM 0 HE1 TYR A 95 8.098 10.146 -4.808 1.00 0.00 H new ATOM 0 HE2 TYR A 95 10.604 10.165 -8.257 1.00 0.00 H new ATOM 0 HH TYR A 95 9.624 11.697 -5.183 1.00 0.00 H new ATOM 1452 N SER A 96 5.738 7.365 -10.191 1.00 0.00 N ATOM 1453 CA SER A 96 5.320 8.201 -11.309 1.00 0.00 C ATOM 1454 C SER A 96 3.803 8.167 -11.476 1.00 0.00 C ATOM 1455 O SER A 96 3.137 9.199 -11.407 1.00 0.00 O ATOM 1456 CB SER A 96 5.997 7.738 -12.601 1.00 0.00 C ATOM 1457 OG SER A 96 7.385 8.020 -12.579 1.00 0.00 O ATOM 0 H SER A 96 6.219 6.508 -10.463 1.00 0.00 H new ATOM 0 HA SER A 96 5.622 9.227 -11.096 1.00 0.00 H new ATOM 0 HB2 SER A 96 5.842 6.667 -12.733 1.00 0.00 H new ATOM 0 HB3 SER A 96 5.536 8.234 -13.455 1.00 0.00 H new ATOM 0 HG SER A 96 7.794 7.713 -13.415 1.00 0.00 H new ATOM 1463 N GLY A 97 3.265 6.972 -11.697 1.00 0.00 N ATOM 1464 CA GLY A 97 1.832 6.824 -11.870 1.00 0.00 C ATOM 1465 C GLY A 97 1.461 6.366 -13.267 1.00 0.00 C ATOM 1466 O GLY A 97 0.537 6.901 -13.879 1.00 0.00 O ATOM 0 H GLY A 97 3.796 6.103 -11.759 1.00 0.00 H new ATOM 0 HA2 GLY A 97 1.454 6.105 -11.143 1.00 0.00 H new ATOM 0 HA3 GLY A 97 1.344 7.776 -11.661 1.00 0.00 H new ATOM 1470 N VAL A 98 2.185 5.373 -13.774 1.00 0.00 N ATOM 1471 CA VAL A 98 1.928 4.843 -15.108 1.00 0.00 C ATOM 1472 C VAL A 98 0.972 3.656 -15.052 1.00 0.00 C ATOM 1473 O VAL A 98 -0.084 3.667 -15.683 1.00 0.00 O ATOM 1474 CB VAL A 98 3.233 4.405 -15.799 1.00 0.00 C ATOM 1475 CG1 VAL A 98 2.938 3.810 -17.168 1.00 0.00 C ATOM 1476 CG2 VAL A 98 4.194 5.578 -15.914 1.00 0.00 C ATOM 0 H VAL A 98 2.954 4.919 -13.281 1.00 0.00 H new ATOM 0 HA VAL A 98 1.472 5.647 -15.686 1.00 0.00 H new ATOM 0 HB VAL A 98 3.707 3.636 -15.189 1.00 0.00 H new ATOM 0 HG11 VAL A 98 3.872 3.506 -17.642 1.00 0.00 H new ATOM 0 HG12 VAL A 98 2.289 2.942 -17.055 1.00 0.00 H new ATOM 0 HG13 VAL A 98 2.442 4.555 -17.789 1.00 0.00 H new ATOM 0 HG21 VAL A 98 5.111 5.251 -16.405 1.00 0.00 H new ATOM 0 HG22 VAL A 98 3.731 6.371 -16.501 1.00 0.00 H new ATOM 0 HG23 VAL A 98 4.430 5.954 -14.919 1.00 0.00 H new ATOM 1486 N ASN A 99 1.350 2.633 -14.292 1.00 0.00 N ATOM 1487 CA ASN A 99 0.526 1.438 -14.155 1.00 0.00 C ATOM 1488 C ASN A 99 0.061 1.261 -12.712 1.00 0.00 C ATOM 1489 O ASN A 99 0.668 0.519 -11.940 1.00 0.00 O ATOM 1490 CB ASN A 99 1.305 0.201 -14.606 1.00 0.00 C ATOM 1491 CG ASN A 99 1.440 0.122 -16.115 1.00 0.00 C ATOM 1492 OD1 ASN A 99 0.888 0.947 -16.843 1.00 0.00 O ATOM 1493 ND2 ASN A 99 2.177 -0.875 -16.591 1.00 0.00 N ATOM 0 H ASN A 99 2.221 2.608 -13.762 1.00 0.00 H new ATOM 0 HA ASN A 99 -0.352 1.558 -14.790 1.00 0.00 H new ATOM 0 HB2 ASN A 99 2.297 0.215 -14.155 1.00 0.00 H new ATOM 0 HB3 ASN A 99 0.802 -0.695 -14.241 1.00 0.00 H new ATOM 0 HD21 ASN A 99 2.304 -0.980 -17.598 1.00 0.00 H new ATOM 0 HD22 ASN A 99 2.616 -1.536 -15.950 1.00 0.00 H new ATOM 1500 N PHE A 100 -1.019 1.948 -12.356 1.00 0.00 N ATOM 1501 CA PHE A 100 -1.566 1.867 -11.007 1.00 0.00 C ATOM 1502 C PHE A 100 -2.377 0.587 -10.824 1.00 0.00 C ATOM 1503 O PHE A 100 -2.249 -0.102 -9.812 1.00 0.00 O ATOM 1504 CB PHE A 100 -2.444 3.086 -10.716 1.00 0.00 C ATOM 1505 CG PHE A 100 -3.059 3.068 -9.346 1.00 0.00 C ATOM 1506 CD1 PHE A 100 -2.268 2.921 -8.218 1.00 0.00 C ATOM 1507 CD2 PHE A 100 -4.429 3.198 -9.185 1.00 0.00 C ATOM 1508 CE1 PHE A 100 -2.832 2.904 -6.956 1.00 0.00 C ATOM 1509 CE2 PHE A 100 -4.999 3.182 -7.926 1.00 0.00 C ATOM 1510 CZ PHE A 100 -4.199 3.035 -6.810 1.00 0.00 C ATOM 0 H PHE A 100 -1.533 2.567 -12.983 1.00 0.00 H new ATOM 0 HA PHE A 100 -0.733 1.852 -10.305 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -1.845 3.990 -10.825 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -3.238 3.138 -11.461 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -1.198 2.818 -8.326 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -5.059 3.313 -10.054 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -2.204 2.788 -6.085 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -6.068 3.284 -7.815 1.00 0.00 H new ATOM 0 HZ PHE A 100 -4.642 3.023 -5.825 1.00 0.00 H new ATOM 1520 N SER A 101 -3.211 0.276 -11.810 1.00 0.00 N ATOM 1521 CA SER A 101 -4.047 -0.918 -11.757 1.00 0.00 C ATOM 1522 C SER A 101 -3.320 -2.058 -11.050 1.00 0.00 C ATOM 1523 O SER A 101 -3.913 -2.793 -10.260 1.00 0.00 O ATOM 1524 CB SER A 101 -4.445 -1.350 -13.170 1.00 0.00 C ATOM 1525 OG SER A 101 -5.067 -2.624 -13.157 1.00 0.00 O ATOM 0 H SER A 101 -3.326 0.834 -12.656 1.00 0.00 H new ATOM 0 HA SER A 101 -4.947 -0.678 -11.191 1.00 0.00 H new ATOM 0 HB2 SER A 101 -5.124 -0.614 -13.601 1.00 0.00 H new ATOM 0 HB3 SER A 101 -3.561 -1.380 -13.807 1.00 0.00 H new ATOM 0 HG SER A 101 -5.313 -2.877 -14.071 1.00 0.00 H new ATOM 1531 N LYS A 102 -2.031 -2.200 -11.340 1.00 0.00 N ATOM 1532 CA LYS A 102 -1.221 -3.249 -10.733 1.00 0.00 C ATOM 1533 C LYS A 102 -1.084 -3.028 -9.230 1.00 0.00 C ATOM 1534 O LYS A 102 -1.422 -3.902 -8.431 1.00 0.00 O ATOM 1535 CB LYS A 102 0.165 -3.291 -11.381 1.00 0.00 C ATOM 1536 CG LYS A 102 0.184 -3.989 -12.730 1.00 0.00 C ATOM 1537 CD LYS A 102 1.512 -3.791 -13.442 1.00 0.00 C ATOM 1538 CE LYS A 102 2.561 -4.774 -12.946 1.00 0.00 C ATOM 1539 NZ LYS A 102 2.354 -6.138 -13.507 1.00 0.00 N ATOM 0 H LYS A 102 -1.525 -1.601 -11.992 1.00 0.00 H new ATOM 0 HA LYS A 102 -1.722 -4.203 -10.899 1.00 0.00 H new ATOM 0 HB2 LYS A 102 0.531 -2.272 -11.503 1.00 0.00 H new ATOM 0 HB3 LYS A 102 0.856 -3.799 -10.709 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -0.001 -5.054 -12.592 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.624 -3.603 -13.352 1.00 0.00 H new ATOM 0 HD2 LYS A 102 1.373 -3.917 -14.516 1.00 0.00 H new ATOM 0 HD3 LYS A 102 1.863 -2.771 -13.283 1.00 0.00 H new ATOM 0 HE2 LYS A 102 3.553 -4.415 -13.221 1.00 0.00 H new ATOM 0 HE3 LYS A 102 2.529 -4.821 -11.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 3.169 -6.738 -13.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 1.490 -6.552 -13.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 2.258 -6.077 -14.541 1.00 0.00 H new ATOM 1553 N VAL A 103 -0.586 -1.855 -8.851 1.00 0.00 N ATOM 1554 CA VAL A 103 -0.406 -1.520 -7.443 1.00 0.00 C ATOM 1555 C VAL A 103 -1.643 -1.884 -6.630 1.00 0.00 C ATOM 1556 O VAL A 103 -1.540 -2.469 -5.551 1.00 0.00 O ATOM 1557 CB VAL A 103 -0.107 -0.020 -7.258 1.00 0.00 C ATOM 1558 CG1 VAL A 103 0.012 0.322 -5.781 1.00 0.00 C ATOM 1559 CG2 VAL A 103 1.160 0.366 -8.006 1.00 0.00 C ATOM 0 H VAL A 103 -0.300 -1.121 -9.499 1.00 0.00 H new ATOM 0 HA VAL A 103 0.445 -2.100 -7.085 1.00 0.00 H new ATOM 0 HB VAL A 103 -0.936 0.552 -7.674 1.00 0.00 H new ATOM 0 HG11 VAL A 103 0.223 1.386 -5.670 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -0.924 0.083 -5.276 1.00 0.00 H new ATOM 0 HG13 VAL A 103 0.822 -0.257 -5.338 1.00 0.00 H new ATOM 0 HG21 VAL A 103 1.356 1.429 -7.865 1.00 0.00 H new ATOM 0 HG22 VAL A 103 2.000 -0.213 -7.622 1.00 0.00 H new ATOM 0 HG23 VAL A 103 1.033 0.159 -9.069 1.00 0.00 H new ATOM 1569 N LEU A 104 -2.813 -1.535 -7.153 1.00 0.00 N ATOM 1570 CA LEU A 104 -4.072 -1.825 -6.476 1.00 0.00 C ATOM 1571 C LEU A 104 -4.236 -3.325 -6.252 1.00 0.00 C ATOM 1572 O LEU A 104 -4.479 -3.773 -5.131 1.00 0.00 O ATOM 1573 CB LEU A 104 -5.249 -1.288 -7.292 1.00 0.00 C ATOM 1574 CG LEU A 104 -6.617 -1.339 -6.611 1.00 0.00 C ATOM 1575 CD1 LEU A 104 -6.689 -0.323 -5.481 1.00 0.00 C ATOM 1576 CD2 LEU A 104 -7.726 -1.094 -7.623 1.00 0.00 C ATOM 0 H LEU A 104 -2.916 -1.050 -8.045 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.056 -1.330 -5.505 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.037 -0.253 -7.560 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.308 -1.852 -8.223 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.754 -2.334 -6.187 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -7.670 -0.374 -5.008 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.918 -0.545 -4.743 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -6.531 0.678 -5.881 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -8.692 -1.134 -7.121 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -7.594 -0.112 -8.077 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.688 -1.860 -8.397 1.00 0.00 H new ATOM 1588 N SER A 105 -4.100 -4.097 -7.325 1.00 0.00 N ATOM 1589 CA SER A 105 -4.234 -5.547 -7.246 1.00 0.00 C ATOM 1590 C SER A 105 -3.230 -6.133 -6.259 1.00 0.00 C ATOM 1591 O SER A 105 -3.593 -6.897 -5.364 1.00 0.00 O ATOM 1592 CB SER A 105 -4.035 -6.175 -8.627 1.00 0.00 C ATOM 1593 OG SER A 105 -4.724 -5.442 -9.625 1.00 0.00 O ATOM 0 H SER A 105 -3.897 -3.743 -8.260 1.00 0.00 H new ATOM 0 HA SER A 105 -5.240 -5.775 -6.892 1.00 0.00 H new ATOM 0 HB2 SER A 105 -2.972 -6.208 -8.865 1.00 0.00 H new ATOM 0 HB3 SER A 105 -4.392 -7.205 -8.616 1.00 0.00 H new ATOM 0 HG SER A 105 -4.228 -4.622 -9.830 1.00 0.00 H new ATOM 1599 N THR A 106 -1.962 -5.769 -6.428 1.00 0.00 N ATOM 1600 CA THR A 106 -0.903 -6.258 -5.553 1.00 0.00 C ATOM 1601 C THR A 106 -1.359 -6.284 -4.099 1.00 0.00 C ATOM 1602 O THR A 106 -1.201 -7.290 -3.406 1.00 0.00 O ATOM 1603 CB THR A 106 0.364 -5.391 -5.667 1.00 0.00 C ATOM 1604 OG1 THR A 106 0.841 -5.394 -7.017 1.00 0.00 O ATOM 1605 CG2 THR A 106 1.455 -5.902 -4.737 1.00 0.00 C ATOM 0 H THR A 106 -1.644 -5.137 -7.163 1.00 0.00 H new ATOM 0 HA THR A 106 -0.670 -7.273 -5.875 1.00 0.00 H new ATOM 0 HB THR A 106 0.107 -4.372 -5.376 1.00 0.00 H new ATOM 0 HG1 THR A 106 0.261 -4.829 -7.570 1.00 0.00 H new ATOM 0 HG21 THR A 106 2.340 -5.274 -4.835 1.00 0.00 H new ATOM 0 HG22 THR A 106 1.100 -5.870 -3.707 1.00 0.00 H new ATOM 0 HG23 THR A 106 1.708 -6.929 -5.002 1.00 0.00 H new ATOM 1613 N LEU A 107 -1.927 -5.173 -3.642 1.00 0.00 N ATOM 1614 CA LEU A 107 -2.407 -5.069 -2.269 1.00 0.00 C ATOM 1615 C LEU A 107 -3.598 -5.993 -2.037 1.00 0.00 C ATOM 1616 O LEU A 107 -3.682 -6.670 -1.011 1.00 0.00 O ATOM 1617 CB LEU A 107 -2.798 -3.624 -1.953 1.00 0.00 C ATOM 1618 CG LEU A 107 -1.642 -2.640 -1.772 1.00 0.00 C ATOM 1619 CD1 LEU A 107 -2.160 -1.211 -1.721 1.00 0.00 C ATOM 1620 CD2 LEU A 107 -0.855 -2.968 -0.511 1.00 0.00 C ATOM 0 H LEU A 107 -2.066 -4.332 -4.202 1.00 0.00 H new ATOM 0 HA LEU A 107 -1.599 -5.374 -1.603 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -3.438 -3.258 -2.756 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -3.397 -3.622 -1.042 1.00 0.00 H new ATOM 0 HG LEU A 107 -0.974 -2.733 -2.628 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -1.323 -0.525 -1.592 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -2.679 -0.979 -2.651 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -2.850 -1.104 -0.884 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -0.036 -2.258 -0.398 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -1.513 -2.904 0.356 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -0.451 -3.978 -0.586 1.00 0.00 H new ATOM 1632 N LEU A 108 -4.517 -6.017 -2.996 1.00 0.00 N ATOM 1633 CA LEU A 108 -5.704 -6.860 -2.898 1.00 0.00 C ATOM 1634 C LEU A 108 -5.324 -8.299 -2.563 1.00 0.00 C ATOM 1635 O LEU A 108 -5.926 -8.923 -1.690 1.00 0.00 O ATOM 1636 CB LEU A 108 -6.491 -6.821 -4.209 1.00 0.00 C ATOM 1637 CG LEU A 108 -7.496 -5.678 -4.354 1.00 0.00 C ATOM 1638 CD1 LEU A 108 -8.019 -5.605 -5.780 1.00 0.00 C ATOM 1639 CD2 LEU A 108 -8.645 -5.849 -3.371 1.00 0.00 C ATOM 0 H LEU A 108 -4.463 -5.462 -3.850 1.00 0.00 H new ATOM 0 HA LEU A 108 -6.329 -6.472 -2.094 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -5.781 -6.761 -5.034 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -7.026 -7.765 -4.317 1.00 0.00 H new ATOM 0 HG LEU A 108 -6.987 -4.742 -4.127 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -8.733 -4.786 -5.864 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -7.188 -5.434 -6.464 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -8.512 -6.543 -6.035 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -9.350 -5.026 -3.489 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -9.153 -6.793 -3.566 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -8.256 -5.850 -2.353 1.00 0.00 H new ATOM 1651 N ALA A 109 -4.319 -8.818 -3.261 1.00 0.00 N ATOM 1652 CA ALA A 109 -3.856 -10.181 -3.035 1.00 0.00 C ATOM 1653 C ALA A 109 -3.322 -10.351 -1.616 1.00 0.00 C ATOM 1654 O ALA A 109 -3.756 -11.239 -0.882 1.00 0.00 O ATOM 1655 CB ALA A 109 -2.785 -10.550 -4.051 1.00 0.00 C ATOM 0 H ALA A 109 -3.810 -8.315 -3.988 1.00 0.00 H new ATOM 0 HA ALA A 109 -4.706 -10.852 -3.159 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -2.448 -11.571 -3.870 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -3.197 -10.477 -5.057 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -1.941 -9.867 -3.954 1.00 0.00 H new ATOM 1661 N VAL A 110 -2.379 -9.495 -1.237 1.00 0.00 N ATOM 1662 CA VAL A 110 -1.787 -9.551 0.095 1.00 0.00 C ATOM 1663 C VAL A 110 -2.863 -9.605 1.173 1.00 0.00 C ATOM 1664 O VAL A 110 -2.810 -10.439 2.075 1.00 0.00 O ATOM 1665 CB VAL A 110 -0.876 -8.336 0.355 1.00 0.00 C ATOM 1666 CG1 VAL A 110 -0.296 -8.395 1.760 1.00 0.00 C ATOM 1667 CG2 VAL A 110 0.232 -8.270 -0.686 1.00 0.00 C ATOM 0 H VAL A 110 -2.008 -8.755 -1.833 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.189 -10.461 0.138 1.00 0.00 H new ATOM 0 HB VAL A 110 -1.475 -7.429 0.273 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.345 -7.529 1.926 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -1.107 -8.391 2.489 1.00 0.00 H new ATOM 0 HG13 VAL A 110 0.290 -9.307 1.874 1.00 0.00 H new ATOM 0 HG21 VAL A 110 0.866 -7.406 -0.488 1.00 0.00 H new ATOM 0 HG22 VAL A 110 0.831 -9.179 -0.638 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -0.207 -8.177 -1.679 1.00 0.00 H new ATOM 1677 N ASN A 111 -3.840 -8.709 1.072 1.00 0.00 N ATOM 1678 CA ASN A 111 -4.930 -8.654 2.039 1.00 0.00 C ATOM 1679 C ASN A 111 -5.637 -10.002 2.138 1.00 0.00 C ATOM 1680 O ASN A 111 -5.961 -10.468 3.231 1.00 0.00 O ATOM 1681 CB ASN A 111 -5.932 -7.566 1.648 1.00 0.00 C ATOM 1682 CG ASN A 111 -7.289 -7.772 2.294 1.00 0.00 C ATOM 1683 OD1 ASN A 111 -8.182 -8.384 1.708 1.00 0.00 O ATOM 1684 ND2 ASN A 111 -7.450 -7.259 3.509 1.00 0.00 N ATOM 0 H ASN A 111 -3.899 -8.011 0.330 1.00 0.00 H new ATOM 0 HA ASN A 111 -4.506 -8.414 3.014 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -5.538 -6.592 1.938 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -6.046 -7.554 0.564 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -8.341 -7.365 3.993 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -6.682 -6.759 3.957 1.00 0.00 H new ATOM 1691 N LYS A 112 -5.875 -10.625 0.989 1.00 0.00 N ATOM 1692 CA LYS A 112 -6.542 -11.921 0.944 1.00 0.00 C ATOM 1693 C LYS A 112 -5.658 -13.009 1.545 1.00 0.00 C ATOM 1694 O LYS A 112 -6.112 -13.808 2.363 1.00 0.00 O ATOM 1695 CB LYS A 112 -6.904 -12.281 -0.499 1.00 0.00 C ATOM 1696 CG LYS A 112 -8.157 -11.586 -1.003 1.00 0.00 C ATOM 1697 CD LYS A 112 -9.405 -12.122 -0.322 1.00 0.00 C ATOM 1698 CE LYS A 112 -10.654 -11.832 -1.140 1.00 0.00 C ATOM 1699 NZ LYS A 112 -11.111 -10.425 -0.974 1.00 0.00 N ATOM 0 H LYS A 112 -5.616 -10.253 0.075 1.00 0.00 H new ATOM 0 HA LYS A 112 -7.455 -11.853 1.535 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.069 -12.022 -1.150 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -7.043 -13.360 -0.572 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.076 -10.514 -0.824 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -8.242 -11.724 -2.081 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -9.307 -13.198 -0.174 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -9.503 -11.672 0.666 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -10.452 -12.026 -2.193 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -11.452 -12.511 -0.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -11.964 -10.267 -1.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -11.329 -10.247 0.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -10.360 -9.777 -1.286 1.00 0.00 H new ATOM 1713 N ALA A 113 -4.395 -13.033 1.134 1.00 0.00 N ATOM 1714 CA ALA A 113 -3.447 -14.021 1.634 1.00 0.00 C ATOM 1715 C ALA A 113 -3.317 -13.937 3.151 1.00 0.00 C ATOM 1716 O ALA A 113 -3.227 -14.957 3.835 1.00 0.00 O ATOM 1717 CB ALA A 113 -2.089 -13.831 0.975 1.00 0.00 C ATOM 0 H ALA A 113 -4.004 -12.379 0.456 1.00 0.00 H new ATOM 0 HA ALA A 113 -3.825 -15.012 1.381 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -1.391 -14.576 1.358 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -2.189 -13.948 -0.104 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -1.713 -12.833 1.198 1.00 0.00 H new ATOM 1723 N THR A 114 -3.306 -12.714 3.673 1.00 0.00 N ATOM 1724 CA THR A 114 -3.184 -12.497 5.109 1.00 0.00 C ATOM 1725 C THR A 114 -4.451 -12.926 5.840 1.00 0.00 C ATOM 1726 O THR A 114 -4.386 -13.536 6.907 1.00 0.00 O ATOM 1727 CB THR A 114 -2.896 -11.018 5.431 1.00 0.00 C ATOM 1728 OG1 THR A 114 -3.894 -10.183 4.834 1.00 0.00 O ATOM 1729 CG2 THR A 114 -1.519 -10.613 4.926 1.00 0.00 C ATOM 0 H THR A 114 -3.380 -11.859 3.122 1.00 0.00 H new ATOM 0 HA THR A 114 -2.347 -13.106 5.450 1.00 0.00 H new ATOM 0 HB THR A 114 -2.920 -10.893 6.514 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.473 -10.725 4.259 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.338 -9.565 5.165 1.00 0.00 H new ATOM 0 HG22 THR A 114 -0.760 -11.231 5.405 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.472 -10.753 3.846 1.00 0.00 H new ATOM 1737 N GLU A 115 -5.602 -12.606 5.257 1.00 0.00 N ATOM 1738 CA GLU A 115 -6.885 -12.959 5.854 1.00 0.00 C ATOM 1739 C GLU A 115 -7.339 -14.340 5.389 1.00 0.00 C ATOM 1740 O GLU A 115 -7.459 -14.594 4.190 1.00 0.00 O ATOM 1741 CB GLU A 115 -7.944 -11.914 5.499 1.00 0.00 C ATOM 1742 CG GLU A 115 -8.475 -12.044 4.081 1.00 0.00 C ATOM 1743 CD GLU A 115 -9.629 -13.023 3.978 1.00 0.00 C ATOM 1744 OE1 GLU A 115 -10.547 -12.949 4.820 1.00 0.00 O ATOM 1745 OE2 GLU A 115 -9.613 -13.863 3.054 1.00 0.00 O ATOM 0 H GLU A 115 -5.672 -12.103 4.372 1.00 0.00 H new ATOM 0 HA GLU A 115 -6.759 -12.982 6.936 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -8.775 -11.999 6.199 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -7.519 -10.919 5.629 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -8.801 -11.066 3.728 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -7.669 -12.368 3.423 1.00 0.00 H new ATOM 1752 N SER A 116 -7.590 -15.228 6.345 1.00 0.00 N ATOM 1753 CA SER A 116 -8.027 -16.583 6.034 1.00 0.00 C ATOM 1754 C SER A 116 -8.948 -16.592 4.817 1.00 0.00 C ATOM 1755 O SER A 116 -10.031 -16.009 4.840 1.00 0.00 O ATOM 1756 CB SER A 116 -8.747 -17.198 7.236 1.00 0.00 C ATOM 1757 OG SER A 116 -7.826 -17.807 8.125 1.00 0.00 O ATOM 0 H SER A 116 -7.498 -15.033 7.342 1.00 0.00 H new ATOM 0 HA SER A 116 -7.144 -17.179 5.804 1.00 0.00 H new ATOM 0 HB2 SER A 116 -9.309 -16.426 7.762 1.00 0.00 H new ATOM 0 HB3 SER A 116 -9.469 -17.938 6.892 1.00 0.00 H new ATOM 0 HG SER A 116 -8.310 -18.191 8.885 1.00 0.00 H new ATOM 1763 N GLY A 117 -8.507 -17.258 3.754 1.00 0.00 N ATOM 1764 CA GLY A 117 -9.303 -17.330 2.542 1.00 0.00 C ATOM 1765 C GLY A 117 -8.860 -18.452 1.625 1.00 0.00 C ATOM 1766 O GLY A 117 -8.293 -19.454 2.062 1.00 0.00 O ATOM 0 H GLY A 117 -7.614 -17.749 3.710 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -10.351 -17.473 2.807 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -9.236 -16.381 2.010 1.00 0.00 H new ATOM 1770 N PRO A 118 -9.122 -18.293 0.319 1.00 0.00 N ATOM 1771 CA PRO A 118 -8.756 -19.291 -0.690 1.00 0.00 C ATOM 1772 C PRO A 118 -7.248 -19.375 -0.902 1.00 0.00 C ATOM 1773 O PRO A 118 -6.645 -18.483 -1.500 1.00 0.00 O ATOM 1774 CB PRO A 118 -9.447 -18.784 -1.958 1.00 0.00 C ATOM 1775 CG PRO A 118 -9.589 -17.315 -1.750 1.00 0.00 C ATOM 1776 CD PRO A 118 -9.795 -17.124 -0.273 1.00 0.00 C ATOM 0 HA PRO A 118 -9.058 -20.296 -0.397 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -8.854 -19.003 -2.846 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -10.418 -19.260 -2.097 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -8.700 -16.785 -2.092 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -10.433 -16.920 -2.316 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -9.357 -16.189 0.076 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -10.854 -17.096 -0.015 1.00 0.00 H new ATOM 1784 N SER A 119 -6.644 -20.452 -0.410 1.00 0.00 N ATOM 1785 CA SER A 119 -5.206 -20.650 -0.543 1.00 0.00 C ATOM 1786 C SER A 119 -4.880 -21.418 -1.820 1.00 0.00 C ATOM 1787 O SER A 119 -4.931 -22.648 -1.849 1.00 0.00 O ATOM 1788 CB SER A 119 -4.659 -21.402 0.672 1.00 0.00 C ATOM 1789 OG SER A 119 -4.845 -20.654 1.861 1.00 0.00 O ATOM 0 H SER A 119 -7.129 -21.201 0.084 1.00 0.00 H new ATOM 0 HA SER A 119 -4.732 -19.670 -0.598 1.00 0.00 H new ATOM 0 HB2 SER A 119 -5.160 -22.366 0.763 1.00 0.00 H new ATOM 0 HB3 SER A 119 -3.598 -21.607 0.530 1.00 0.00 H new ATOM 0 HG SER A 119 -4.489 -21.157 2.623 1.00 0.00 H new ATOM 1795 N SER A 120 -4.544 -20.684 -2.876 1.00 0.00 N ATOM 1796 CA SER A 120 -4.212 -21.294 -4.158 1.00 0.00 C ATOM 1797 C SER A 120 -2.722 -21.158 -4.455 1.00 0.00 C ATOM 1798 O SER A 120 -2.189 -20.052 -4.523 1.00 0.00 O ATOM 1799 CB SER A 120 -5.028 -20.649 -5.280 1.00 0.00 C ATOM 1800 OG SER A 120 -6.368 -21.112 -5.268 1.00 0.00 O ATOM 0 H SER A 120 -4.495 -19.665 -2.869 1.00 0.00 H new ATOM 0 HA SER A 120 -4.458 -22.354 -4.102 1.00 0.00 H new ATOM 0 HB2 SER A 120 -5.014 -19.565 -5.167 1.00 0.00 H new ATOM 0 HB3 SER A 120 -4.570 -20.875 -6.243 1.00 0.00 H new ATOM 0 HG SER A 120 -6.869 -20.684 -5.993 1.00 0.00 H new ATOM 1806 N GLY A 121 -2.054 -22.295 -4.631 1.00 0.00 N ATOM 1807 CA GLY A 121 -0.632 -22.283 -4.919 1.00 0.00 C ATOM 1808 C GLY A 121 -0.341 -22.318 -6.406 1.00 0.00 C ATOM 1809 O GLY A 121 -0.255 -23.391 -7.003 1.00 0.00 O ATOM 0 H GLY A 121 -2.473 -23.224 -4.579 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -0.184 -21.389 -4.485 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -0.160 -23.141 -4.439 1.00 0.00 H new TER 1813 GLY A 121