USER MOD reduce.3.24.130724 H: found=0, std=0, add=1006, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1000 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 54 ASN : amide:sc= -0.875 K(o=-0.94,f=-9.3!) USER MOD Set 1.2: A 56 THR OG1 : rot 180:sc= -0.0665 USER MOD Set 2.1: A 11 GLN : amide:sc= -1.19 K(o=-2,f=-5.3!) USER MOD Set 2.2: A 38 SER OG : rot 74:sc= -0.799 USER MOD Single : A 1 GLY N :NH3+ -131:sc= 0.0765 (180deg=0) USER MOD Single : A 2 SER OG : rot 53:sc= 1.25 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 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -0.223 K(o=-0.22,f=-1.3!) USER MOD Single : A 14 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.00931) USER MOD Single : A 16 HIS :FLIP no HE2:sc= -1.68 F(o=-4.9!,f=-1.7) USER MOD Single : A 17 TYR OH : rot 150:sc= -1.47 USER MOD Single : A 18 CYS SG : rot 180:sc= -0.232 USER MOD Single : A 21 TYR OH : rot -39:sc= -2.23! USER MOD Single : A 23 CYS SG : rot 137:sc= 0.368 USER MOD Single : A 24 GLN : amide:sc= -0.0127 X(o=-0.013,f=-0.022) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0.0819 USER MOD Single : A 37 THR OG1 : rot -1:sc= 0.625! USER MOD Single : A 39 ASN : amide:sc= -0.248 K(o=-0.25,f=-2.2!) USER MOD Single : A 40 HIS : no HD1:sc= -0.0236 X(o=-0.024,f=-0.004) USER MOD Single : A 44 CYS SG : rot 26:sc= 0.11 USER MOD Single : A 46 CYS SG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= -1.47 USER MOD Single : A 49 GLN : amide:sc= -2.16 K(o=-2.2,f=-9!) USER MOD Single : A 51 SER OG : rot 180:sc= -2.19 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.448 K(o=-0.45,f=-1.5) USER MOD Single : A 63 THR OG1 : rot 121:sc= 0.361 USER MOD Single : A 66 LYS NZ :NH3+ 173:sc= 1.19 (180deg=1.05) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= -0.435 K(o=-0.44,f=-1.6!) USER MOD Single : A 71 HIS : no HE2:sc= -0.287 X(o=-0.29,f=-0.19) USER MOD Single : A 72 THR OG1 : rot -140:sc= 0.182 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 91:sc= -1.76! USER MOD Single : A 91 THR OG1 : rot 180:sc= -0.129 USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.215 USER MOD Single : A 95 THR OG1 : rot 180:sc=-0.00682 USER MOD Single : A 98 THR OG1 : rot 46:sc= 0.103 USER MOD Single : A 99 CYS SG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot -93:sc= 0.877 USER MOD Single : A 105 HIS : no HD1:sc= -0.0925 X(o=-0.092,f=-0.17) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 106:sc= 0.867 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 126 GLN : amide:sc= -0.362 K(o=-0.36,f=-2.1!) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot -54:sc= 1.26 USER MOD Single : A 136 SER OG : rot 180:sc= -0.0143 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 14.057 18.236 22.658 1.00 0.00 N ATOM 2 CA GLY A 1 14.550 17.458 21.535 1.00 0.00 C ATOM 3 C GLY A 1 16.021 17.772 21.253 1.00 0.00 C ATOM 4 O GLY A 1 16.744 18.224 22.140 1.00 0.00 O ATOM 0 H1 GLY A 1 13.565 17.609 23.326 1.00 0.00 H new ATOM 0 H2 GLY A 1 14.856 18.695 23.140 1.00 0.00 H new ATOM 0 H3 GLY A 1 13.396 18.962 22.314 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.436 16.395 21.747 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.952 17.673 20.649 1.00 0.00 H new ATOM 8 N SER A 2 16.421 17.520 20.015 1.00 0.00 N ATOM 9 CA SER A 2 17.792 17.771 19.606 1.00 0.00 C ATOM 10 C SER A 2 17.955 17.474 18.114 1.00 0.00 C ATOM 11 O SER A 2 18.342 18.350 17.342 1.00 0.00 O ATOM 12 CB SER A 2 18.773 16.930 20.425 1.00 0.00 C ATOM 13 OG SER A 2 19.178 17.594 21.619 1.00 0.00 O ATOM 0 H SER A 2 15.819 17.145 19.282 1.00 0.00 H new ATOM 0 HA SER A 2 18.017 18.822 19.787 1.00 0.00 H new ATOM 0 HB2 SER A 2 18.309 15.977 20.680 1.00 0.00 H new ATOM 0 HB3 SER A 2 19.651 16.705 19.820 1.00 0.00 H new ATOM 0 HG SER A 2 18.385 17.871 22.124 1.00 0.00 H new ATOM 19 N SER A 3 17.653 16.235 17.753 1.00 0.00 N ATOM 20 CA SER A 3 17.762 15.812 16.367 1.00 0.00 C ATOM 21 C SER A 3 17.219 16.904 15.443 1.00 0.00 C ATOM 22 O SER A 3 16.426 17.743 15.866 1.00 0.00 O ATOM 23 CB SER A 3 17.014 14.498 16.133 1.00 0.00 C ATOM 24 OG SER A 3 17.856 13.498 15.566 1.00 0.00 O ATOM 0 H SER A 3 17.333 15.511 18.396 1.00 0.00 H new ATOM 0 HA SER A 3 18.815 15.645 16.141 1.00 0.00 H new ATOM 0 HB2 SER A 3 16.610 14.138 17.079 1.00 0.00 H new ATOM 0 HB3 SER A 3 16.166 14.676 15.471 1.00 0.00 H new ATOM 0 HG SER A 3 17.342 12.674 15.434 1.00 0.00 H new ATOM 30 N GLY A 4 17.669 16.857 14.197 1.00 0.00 N ATOM 31 CA GLY A 4 17.239 17.831 13.209 1.00 0.00 C ATOM 32 C GLY A 4 17.781 17.482 11.822 1.00 0.00 C ATOM 33 O GLY A 4 18.514 16.506 11.666 1.00 0.00 O ATOM 0 H GLY A 4 18.327 16.159 13.850 1.00 0.00 H new ATOM 0 HA2 GLY A 4 16.150 17.867 13.179 1.00 0.00 H new ATOM 0 HA3 GLY A 4 17.583 18.824 13.498 1.00 0.00 H new ATOM 37 N SER A 5 17.400 18.297 10.850 1.00 0.00 N ATOM 38 CA SER A 5 17.839 18.086 9.481 1.00 0.00 C ATOM 39 C SER A 5 18.097 19.432 8.801 1.00 0.00 C ATOM 40 O SER A 5 17.750 20.481 9.341 1.00 0.00 O ATOM 41 CB SER A 5 16.806 17.282 8.689 1.00 0.00 C ATOM 42 OG SER A 5 15.653 18.057 8.373 1.00 0.00 O ATOM 0 H SER A 5 16.792 19.105 10.983 1.00 0.00 H new ATOM 0 HA SER A 5 18.766 17.513 9.504 1.00 0.00 H new ATOM 0 HB2 SER A 5 17.260 16.916 7.768 1.00 0.00 H new ATOM 0 HB3 SER A 5 16.507 16.407 9.267 1.00 0.00 H new ATOM 0 HG SER A 5 15.019 17.508 7.866 1.00 0.00 H new ATOM 48 N SER A 6 18.705 19.359 7.626 1.00 0.00 N ATOM 49 CA SER A 6 19.014 20.558 6.866 1.00 0.00 C ATOM 50 C SER A 6 18.659 20.350 5.393 1.00 0.00 C ATOM 51 O SER A 6 17.845 21.086 4.837 1.00 0.00 O ATOM 52 CB SER A 6 20.490 20.935 7.009 1.00 0.00 C ATOM 53 OG SER A 6 20.729 21.725 8.171 1.00 0.00 O ATOM 0 H SER A 6 18.992 18.487 7.181 1.00 0.00 H new ATOM 0 HA SER A 6 18.417 21.379 7.264 1.00 0.00 H new ATOM 0 HB2 SER A 6 21.093 20.028 7.057 1.00 0.00 H new ATOM 0 HB3 SER A 6 20.811 21.485 6.124 1.00 0.00 H new ATOM 0 HG SER A 6 21.683 21.944 8.228 1.00 0.00 H new ATOM 59 N GLY A 7 19.288 19.345 4.802 1.00 0.00 N ATOM 60 CA GLY A 7 19.049 19.031 3.403 1.00 0.00 C ATOM 61 C GLY A 7 20.004 19.809 2.496 1.00 0.00 C ATOM 62 O GLY A 7 20.893 19.224 1.878 1.00 0.00 O ATOM 0 H GLY A 7 19.963 18.737 5.266 1.00 0.00 H new ATOM 0 HA2 GLY A 7 19.177 17.961 3.240 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.018 19.272 3.143 1.00 0.00 H new ATOM 66 N SER A 8 19.788 21.115 2.444 1.00 0.00 N ATOM 67 CA SER A 8 20.619 21.979 1.623 1.00 0.00 C ATOM 68 C SER A 8 20.205 21.861 0.155 1.00 0.00 C ATOM 69 O SER A 8 19.779 22.841 -0.454 1.00 0.00 O ATOM 70 CB SER A 8 22.101 21.634 1.785 1.00 0.00 C ATOM 71 OG SER A 8 22.934 22.783 1.650 1.00 0.00 O ATOM 0 H SER A 8 19.049 21.596 2.957 1.00 0.00 H new ATOM 0 HA SER A 8 20.475 23.007 1.954 1.00 0.00 H new ATOM 0 HB2 SER A 8 22.263 21.181 2.763 1.00 0.00 H new ATOM 0 HB3 SER A 8 22.384 20.891 1.039 1.00 0.00 H new ATOM 0 HG SER A 8 23.872 22.522 1.761 1.00 0.00 H new ATOM 77 N TRP A 9 20.343 20.653 -0.371 1.00 0.00 N ATOM 78 CA TRP A 9 19.989 20.394 -1.757 1.00 0.00 C ATOM 79 C TRP A 9 18.504 20.720 -1.933 1.00 0.00 C ATOM 80 O TRP A 9 17.754 20.760 -0.959 1.00 0.00 O ATOM 81 CB TRP A 9 20.337 18.958 -2.153 1.00 0.00 C ATOM 82 CG TRP A 9 20.066 17.927 -1.056 1.00 0.00 C ATOM 83 CD1 TRP A 9 18.889 17.590 -0.513 1.00 0.00 C ATOM 84 CD2 TRP A 9 21.047 17.105 -0.387 1.00 0.00 C ATOM 85 NE1 TRP A 9 19.037 16.616 0.453 1.00 0.00 N ATOM 86 CE2 TRP A 9 20.391 16.312 0.532 1.00 0.00 C ATOM 87 CE3 TRP A 9 22.441 17.035 -0.554 1.00 0.00 C ATOM 88 CZ2 TRP A 9 21.049 15.391 1.357 1.00 0.00 C ATOM 89 CZ3 TRP A 9 23.083 16.110 0.278 1.00 0.00 C ATOM 90 CH2 TRP A 9 22.438 15.304 1.209 1.00 0.00 C ATOM 0 H TRP A 9 20.695 19.842 0.138 1.00 0.00 H new ATOM 0 HA TRP A 9 20.567 21.028 -2.428 1.00 0.00 H new ATOM 0 HB2 TRP A 9 19.765 18.688 -3.041 1.00 0.00 H new ATOM 0 HB3 TRP A 9 21.391 18.913 -2.427 1.00 0.00 H new ATOM 0 HD1 TRP A 9 17.942 18.026 -0.796 1.00 0.00 H new ATOM 0 HE1 TRP A 9 18.290 16.196 1.007 1.00 0.00 H new ATOM 0 HE3 TRP A 9 22.974 17.646 -1.267 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 20.513 14.781 2.069 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 24.155 16.016 0.190 1.00 0.00 H new ATOM 0 HH2 TRP A 9 23.006 14.614 1.815 1.00 0.00 H new ATOM 101 N ASN A 10 18.125 20.943 -3.183 1.00 0.00 N ATOM 102 CA ASN A 10 16.743 21.263 -3.499 1.00 0.00 C ATOM 103 C ASN A 10 16.143 20.136 -4.342 1.00 0.00 C ATOM 104 O ASN A 10 16.251 20.146 -5.567 1.00 0.00 O ATOM 105 CB ASN A 10 16.649 22.559 -4.308 1.00 0.00 C ATOM 106 CG ASN A 10 15.872 23.629 -3.540 1.00 0.00 C ATOM 107 OD1 ASN A 10 14.996 23.343 -2.740 1.00 0.00 O ATOM 108 ND2 ASN A 10 16.239 24.875 -3.826 1.00 0.00 N ATOM 0 H ASN A 10 18.750 20.908 -3.988 1.00 0.00 H new ATOM 0 HA ASN A 10 16.202 21.383 -2.561 1.00 0.00 H new ATOM 0 HB2 ASN A 10 17.651 22.924 -4.534 1.00 0.00 H new ATOM 0 HB3 ASN A 10 16.158 22.362 -5.261 1.00 0.00 H new ATOM 0 HD21 ASN A 10 15.779 25.660 -3.365 1.00 0.00 H new ATOM 0 HD22 ASN A 10 16.980 25.045 -4.506 1.00 0.00 H new ATOM 115 N GLN A 11 15.523 19.190 -3.651 1.00 0.00 N ATOM 116 CA GLN A 11 14.906 18.057 -4.321 1.00 0.00 C ATOM 117 C GLN A 11 14.199 17.160 -3.303 1.00 0.00 C ATOM 118 O GLN A 11 14.615 17.077 -2.149 1.00 0.00 O ATOM 119 CB GLN A 11 15.939 17.266 -5.125 1.00 0.00 C ATOM 120 CG GLN A 11 16.954 16.591 -4.200 1.00 0.00 C ATOM 121 CD GLN A 11 17.087 15.102 -4.524 1.00 0.00 C ATOM 122 OE1 GLN A 11 16.470 14.582 -5.440 1.00 0.00 O ATOM 123 NE2 GLN A 11 17.924 14.447 -3.725 1.00 0.00 N ATOM 0 H GLN A 11 15.435 19.185 -2.635 1.00 0.00 H new ATOM 0 HA GLN A 11 14.162 18.435 -5.022 1.00 0.00 H new ATOM 0 HB2 GLN A 11 15.435 16.512 -5.729 1.00 0.00 H new ATOM 0 HB3 GLN A 11 16.457 17.933 -5.814 1.00 0.00 H new ATOM 0 HG2 GLN A 11 17.924 17.077 -4.303 1.00 0.00 H new ATOM 0 HG3 GLN A 11 16.644 16.715 -3.162 1.00 0.00 H new ATOM 0 HE21 GLN A 11 18.409 14.943 -2.977 1.00 0.00 H new ATOM 0 HE22 GLN A 11 18.082 13.448 -3.860 1.00 0.00 H new ATOM 132 N ALA A 12 13.141 16.511 -3.768 1.00 0.00 N ATOM 133 CA ALA A 12 12.372 15.623 -2.913 1.00 0.00 C ATOM 134 C ALA A 12 11.874 14.434 -3.737 1.00 0.00 C ATOM 135 O ALA A 12 11.687 14.547 -4.947 1.00 0.00 O ATOM 136 CB ALA A 12 11.228 16.404 -2.264 1.00 0.00 C ATOM 0 H ALA A 12 12.799 16.583 -4.726 1.00 0.00 H new ATOM 0 HA ALA A 12 12.994 15.229 -2.109 1.00 0.00 H new ATOM 0 HB1 ALA A 12 10.651 15.738 -1.622 1.00 0.00 H new ATOM 0 HB2 ALA A 12 11.637 17.219 -1.667 1.00 0.00 H new ATOM 0 HB3 ALA A 12 10.580 16.812 -3.040 1.00 0.00 H new ATOM 142 N PRO A 13 11.667 13.291 -3.029 1.00 0.00 N ATOM 143 CA PRO A 13 11.193 12.082 -3.682 1.00 0.00 C ATOM 144 C PRO A 13 9.704 12.187 -4.015 1.00 0.00 C ATOM 145 O PRO A 13 8.932 12.766 -3.252 1.00 0.00 O ATOM 146 CB PRO A 13 11.506 10.960 -2.705 1.00 0.00 C ATOM 147 CG PRO A 13 11.716 11.628 -1.356 1.00 0.00 C ATOM 148 CD PRO A 13 11.877 13.120 -1.594 1.00 0.00 C ATOM 0 HA PRO A 13 11.678 11.904 -4.642 1.00 0.00 H new ATOM 0 HB2 PRO A 13 10.688 10.241 -2.661 1.00 0.00 H new ATOM 0 HB3 PRO A 13 12.397 10.412 -3.012 1.00 0.00 H new ATOM 0 HG2 PRO A 13 10.868 11.436 -0.699 1.00 0.00 H new ATOM 0 HG3 PRO A 13 12.600 11.223 -0.863 1.00 0.00 H new ATOM 0 HD2 PRO A 13 11.152 13.694 -1.017 1.00 0.00 H new ATOM 0 HD3 PRO A 13 12.867 13.464 -1.295 1.00 0.00 H new ATOM 156 N LYS A 14 9.344 11.617 -5.156 1.00 0.00 N ATOM 157 CA LYS A 14 7.961 11.639 -5.600 1.00 0.00 C ATOM 158 C LYS A 14 7.428 10.206 -5.663 1.00 0.00 C ATOM 159 O LYS A 14 8.169 9.277 -5.977 1.00 0.00 O ATOM 160 CB LYS A 14 7.834 12.400 -6.921 1.00 0.00 C ATOM 161 CG LYS A 14 7.257 13.799 -6.694 1.00 0.00 C ATOM 162 CD LYS A 14 6.473 14.274 -7.920 1.00 0.00 C ATOM 163 CE LYS A 14 7.411 14.858 -8.978 1.00 0.00 C ATOM 164 NZ LYS A 14 7.804 16.239 -8.618 1.00 0.00 N ATOM 0 H LYS A 14 9.987 11.137 -5.786 1.00 0.00 H new ATOM 0 HA LYS A 14 7.340 12.180 -4.886 1.00 0.00 H new ATOM 0 HB2 LYS A 14 8.812 12.479 -7.395 1.00 0.00 H new ATOM 0 HB3 LYS A 14 7.192 11.844 -7.605 1.00 0.00 H new ATOM 0 HG2 LYS A 14 6.604 13.790 -5.821 1.00 0.00 H new ATOM 0 HG3 LYS A 14 8.065 14.499 -6.480 1.00 0.00 H new ATOM 0 HD2 LYS A 14 5.915 13.440 -8.345 1.00 0.00 H new ATOM 0 HD3 LYS A 14 5.743 15.026 -7.620 1.00 0.00 H new ATOM 0 HE2 LYS A 14 8.299 14.233 -9.069 1.00 0.00 H new ATOM 0 HE3 LYS A 14 6.918 14.856 -9.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 7.899 16.809 -9.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 7.076 16.658 -8.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 8.713 16.221 -8.114 1.00 0.00 H new ATOM 178 N LEU A 15 6.145 10.073 -5.358 1.00 0.00 N ATOM 179 CA LEU A 15 5.504 8.769 -5.375 1.00 0.00 C ATOM 180 C LEU A 15 4.128 8.891 -6.035 1.00 0.00 C ATOM 181 O LEU A 15 3.280 9.653 -5.573 1.00 0.00 O ATOM 182 CB LEU A 15 5.460 8.174 -3.966 1.00 0.00 C ATOM 183 CG LEU A 15 4.611 6.913 -3.797 1.00 0.00 C ATOM 184 CD1 LEU A 15 4.977 5.860 -4.845 1.00 0.00 C ATOM 185 CD2 LEU A 15 4.720 6.366 -2.372 1.00 0.00 C ATOM 0 H LEU A 15 5.533 10.846 -5.098 1.00 0.00 H new ATOM 0 HA LEU A 15 6.085 8.067 -5.973 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.480 7.945 -3.658 1.00 0.00 H new ATOM 0 HB3 LEU A 15 5.084 8.936 -3.283 1.00 0.00 H new ATOM 0 HG LEU A 15 3.567 7.180 -3.961 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.358 4.974 -4.702 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.806 6.265 -5.843 1.00 0.00 H new ATOM 0 HD13 LEU A 15 6.028 5.590 -4.738 1.00 0.00 H new ATOM 0 HD21 LEU A 15 4.107 5.470 -2.278 1.00 0.00 H new ATOM 0 HD22 LEU A 15 5.759 6.119 -2.156 1.00 0.00 H new ATOM 0 HD23 LEU A 15 4.371 7.119 -1.665 1.00 0.00 H new ATOM 197 N HIS A 16 3.950 8.128 -7.104 1.00 0.00 N ATOM 198 CA HIS A 16 2.693 8.141 -7.831 1.00 0.00 C ATOM 199 C HIS A 16 1.739 7.110 -7.225 1.00 0.00 C ATOM 200 O HIS A 16 2.105 5.949 -7.048 1.00 0.00 O ATOM 201 CB HIS A 16 2.928 7.924 -9.327 1.00 0.00 C ATOM 202 CG HIS A 16 1.886 8.566 -10.212 1.00 0.00 C ATOM 203 ND1 HIS A 16 1.410 9.844 -10.246 1.00 0.00 N flip ATOM 204 CD2 HIS A 16 1.212 7.871 -11.201 1.00 0.00 C flip ATOM 205 CE1 HIS A 16 0.496 9.925 -11.205 1.00 0.00 C flip ATOM 206 NE2 HIS A 16 0.371 8.703 -11.798 1.00 0.00 N flip ATOM 0 H HIS A 16 4.656 7.497 -7.484 1.00 0.00 H new ATOM 0 HA HIS A 16 2.223 9.120 -7.735 1.00 0.00 H new ATOM 0 HB2 HIS A 16 3.908 8.320 -9.592 1.00 0.00 H new ATOM 0 HB3 HIS A 16 2.952 6.853 -9.529 1.00 0.00 H new ATOM 0 HD1 HIS A 16 1.706 10.607 -9.638 1.00 0.00 H new ATOM 0 HD2 HIS A 16 1.348 6.828 -11.445 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -0.058 10.813 -11.472 1.00 0.00 H new ATOM 214 N TYR A 17 0.534 7.571 -6.924 1.00 0.00 N ATOM 215 CA TYR A 17 -0.476 6.703 -6.341 1.00 0.00 C ATOM 216 C TYR A 17 -1.881 7.261 -6.578 1.00 0.00 C ATOM 217 O TYR A 17 -2.087 8.473 -6.538 1.00 0.00 O ATOM 218 CB TYR A 17 -0.196 6.681 -4.837 1.00 0.00 C ATOM 219 CG TYR A 17 -0.094 8.069 -4.202 1.00 0.00 C ATOM 220 CD1 TYR A 17 1.126 8.711 -4.137 1.00 0.00 C ATOM 221 CD2 TYR A 17 -1.223 8.680 -3.695 1.00 0.00 C ATOM 222 CE1 TYR A 17 1.222 10.017 -3.540 1.00 0.00 C ATOM 223 CE2 TYR A 17 -1.127 9.986 -3.097 1.00 0.00 C ATOM 224 CZ TYR A 17 0.090 10.591 -3.049 1.00 0.00 C ATOM 225 OH TYR A 17 0.180 11.825 -2.485 1.00 0.00 O ATOM 0 H TYR A 17 0.234 8.534 -7.073 1.00 0.00 H new ATOM 0 HA TYR A 17 -0.434 5.710 -6.789 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -0.988 6.122 -4.339 1.00 0.00 H new ATOM 0 HB3 TYR A 17 0.735 6.142 -4.659 1.00 0.00 H new ATOM 0 HD1 TYR A 17 2.009 8.233 -4.534 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -2.178 8.179 -3.747 1.00 0.00 H new ATOM 0 HE1 TYR A 17 2.171 10.530 -3.483 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -2.002 10.475 -2.695 1.00 0.00 H new ATOM 0 HH TYR A 17 -0.664 12.306 -2.613 1.00 0.00 H new ATOM 235 N CYS A 18 -2.811 6.349 -6.819 1.00 0.00 N ATOM 236 CA CYS A 18 -4.191 6.734 -7.062 1.00 0.00 C ATOM 237 C CYS A 18 -5.069 6.074 -5.997 1.00 0.00 C ATOM 238 O CYS A 18 -5.216 4.853 -5.977 1.00 0.00 O ATOM 239 CB CYS A 18 -4.640 6.367 -8.478 1.00 0.00 C ATOM 240 SG CYS A 18 -6.150 7.303 -8.918 1.00 0.00 S ATOM 0 H CYS A 18 -2.636 5.345 -6.851 1.00 0.00 H new ATOM 0 HA CYS A 18 -4.286 7.817 -6.990 1.00 0.00 H new ATOM 0 HB2 CYS A 18 -3.845 6.589 -9.190 1.00 0.00 H new ATOM 0 HB3 CYS A 18 -4.835 5.296 -8.541 1.00 0.00 H new ATOM 0 HG CYS A 18 -6.522 6.986 -10.123 1.00 0.00 H new ATOM 246 N LEU A 19 -5.629 6.911 -5.136 1.00 0.00 N ATOM 247 CA LEU A 19 -6.489 6.424 -4.070 1.00 0.00 C ATOM 248 C LEU A 19 -7.932 6.359 -4.574 1.00 0.00 C ATOM 249 O LEU A 19 -8.499 7.373 -4.978 1.00 0.00 O ATOM 250 CB LEU A 19 -6.315 7.276 -2.811 1.00 0.00 C ATOM 251 CG LEU A 19 -4.874 7.520 -2.360 1.00 0.00 C ATOM 252 CD1 LEU A 19 -3.991 6.308 -2.664 1.00 0.00 C ATOM 253 CD2 LEU A 19 -4.316 8.805 -2.977 1.00 0.00 C ATOM 0 H LEU A 19 -5.504 7.923 -5.155 1.00 0.00 H new ATOM 0 HA LEU A 19 -6.205 5.411 -3.784 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -6.790 8.242 -2.982 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -6.854 6.796 -1.994 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.873 7.655 -1.278 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.972 6.508 -2.333 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.378 5.435 -2.139 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.993 6.116 -3.737 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.290 8.955 -2.640 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.333 8.724 -4.064 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.927 9.653 -2.667 1.00 0.00 H new ATOM 265 N ASP A 20 -8.485 5.156 -4.534 1.00 0.00 N ATOM 266 CA ASP A 20 -9.851 4.945 -4.982 1.00 0.00 C ATOM 267 C ASP A 20 -10.510 3.875 -4.108 1.00 0.00 C ATOM 268 O ASP A 20 -10.148 2.701 -4.179 1.00 0.00 O ATOM 269 CB ASP A 20 -9.887 4.459 -6.432 1.00 0.00 C ATOM 270 CG ASP A 20 -11.262 4.012 -6.931 1.00 0.00 C ATOM 271 OD1 ASP A 20 -12.141 4.895 -7.036 1.00 0.00 O ATOM 272 OD2 ASP A 20 -11.404 2.799 -7.196 1.00 0.00 O ATOM 0 H ASP A 20 -8.012 4.317 -4.198 1.00 0.00 H new ATOM 0 HA ASP A 20 -10.381 5.895 -4.907 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -9.526 5.260 -7.077 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -9.191 3.627 -6.538 1.00 0.00 H new ATOM 277 N TYR A 21 -11.465 4.319 -3.304 1.00 0.00 N ATOM 278 CA TYR A 21 -12.177 3.414 -2.418 1.00 0.00 C ATOM 279 C TYR A 21 -13.433 2.860 -3.094 1.00 0.00 C ATOM 280 O TYR A 21 -14.140 3.588 -3.790 1.00 0.00 O ATOM 281 CB TYR A 21 -12.592 4.251 -1.206 1.00 0.00 C ATOM 282 CG TYR A 21 -13.322 3.456 -0.121 1.00 0.00 C ATOM 283 CD1 TYR A 21 -12.601 2.723 0.800 1.00 0.00 C ATOM 284 CD2 TYR A 21 -14.701 3.472 -0.064 1.00 0.00 C ATOM 285 CE1 TYR A 21 -13.288 1.975 1.821 1.00 0.00 C ATOM 286 CE2 TYR A 21 -15.387 2.724 0.957 1.00 0.00 C ATOM 287 CZ TYR A 21 -14.647 2.012 1.849 1.00 0.00 C ATOM 288 OH TYR A 21 -15.296 1.306 2.813 1.00 0.00 O ATOM 0 H TYR A 21 -11.762 5.293 -3.248 1.00 0.00 H new ATOM 0 HA TYR A 21 -11.546 2.568 -2.146 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -11.703 4.708 -0.771 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -13.236 5.064 -1.542 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -11.522 2.710 0.755 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -15.265 4.045 -0.785 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -12.736 1.398 2.548 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -16.466 2.728 1.013 1.00 0.00 H new ATOM 0 HH TYR A 21 -14.842 0.449 2.952 1.00 0.00 H new ATOM 298 N ASP A 22 -13.672 1.577 -2.866 1.00 0.00 N ATOM 299 CA ASP A 22 -14.830 0.917 -3.445 1.00 0.00 C ATOM 300 C ASP A 22 -15.740 0.417 -2.321 1.00 0.00 C ATOM 301 O ASP A 22 -15.645 -0.738 -1.908 1.00 0.00 O ATOM 302 CB ASP A 22 -14.412 -0.289 -4.288 1.00 0.00 C ATOM 303 CG ASP A 22 -15.350 -0.622 -5.450 1.00 0.00 C ATOM 304 OD1 ASP A 22 -16.544 -0.269 -5.335 1.00 0.00 O ATOM 305 OD2 ASP A 22 -14.852 -1.222 -6.427 1.00 0.00 O ATOM 0 H ASP A 22 -13.084 0.977 -2.288 1.00 0.00 H new ATOM 0 HA ASP A 22 -15.348 1.637 -4.079 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -13.414 -0.106 -4.687 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -14.340 -1.161 -3.637 1.00 0.00 H new ATOM 310 N CYS A 23 -16.602 1.310 -1.859 1.00 0.00 N ATOM 311 CA CYS A 23 -17.529 0.974 -0.792 1.00 0.00 C ATOM 312 C CYS A 23 -18.070 -0.433 -1.051 1.00 0.00 C ATOM 313 O CYS A 23 -18.350 -1.178 -0.113 1.00 0.00 O ATOM 314 CB CYS A 23 -18.653 2.005 -0.673 1.00 0.00 C ATOM 315 SG CYS A 23 -20.016 1.330 0.345 1.00 0.00 S ATOM 0 H CYS A 23 -16.678 2.267 -2.204 1.00 0.00 H new ATOM 0 HA CYS A 23 -17.007 0.991 0.165 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -18.271 2.921 -0.223 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -19.024 2.267 -1.664 1.00 0.00 H new ATOM 0 HG CYS A 23 -20.438 2.245 1.167 1.00 0.00 H new ATOM 321 N GLN A 24 -18.202 -0.756 -2.330 1.00 0.00 N ATOM 322 CA GLN A 24 -18.704 -2.061 -2.725 1.00 0.00 C ATOM 323 C GLN A 24 -17.797 -3.166 -2.181 1.00 0.00 C ATOM 324 O GLN A 24 -18.277 -4.134 -1.593 1.00 0.00 O ATOM 325 CB GLN A 24 -18.838 -2.160 -4.246 1.00 0.00 C ATOM 326 CG GLN A 24 -19.445 -0.881 -4.827 1.00 0.00 C ATOM 327 CD GLN A 24 -20.733 -1.186 -5.594 1.00 0.00 C ATOM 328 OE1 GLN A 24 -20.767 -1.998 -6.504 1.00 0.00 O ATOM 329 NE2 GLN A 24 -21.788 -0.491 -5.178 1.00 0.00 N ATOM 0 H GLN A 24 -17.970 -0.136 -3.106 1.00 0.00 H new ATOM 0 HA GLN A 24 -19.698 -2.191 -2.297 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -17.858 -2.336 -4.690 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -19.464 -3.014 -4.505 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -19.655 -0.176 -4.023 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -18.726 -0.402 -5.492 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -21.691 0.173 -4.410 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -22.694 -0.622 -5.627 1.00 0.00 H new ATOM 338 N LYS A 25 -16.502 -2.984 -2.396 1.00 0.00 N ATOM 339 CA LYS A 25 -15.524 -3.954 -1.934 1.00 0.00 C ATOM 340 C LYS A 25 -15.070 -3.582 -0.522 1.00 0.00 C ATOM 341 O LYS A 25 -14.421 -4.377 0.156 1.00 0.00 O ATOM 342 CB LYS A 25 -14.375 -4.075 -2.938 1.00 0.00 C ATOM 343 CG LYS A 25 -14.877 -3.890 -4.371 1.00 0.00 C ATOM 344 CD LYS A 25 -13.908 -4.516 -5.376 1.00 0.00 C ATOM 345 CE LYS A 25 -14.666 -5.264 -6.475 1.00 0.00 C ATOM 346 NZ LYS A 25 -13.739 -6.104 -7.265 1.00 0.00 N ATOM 0 H LYS A 25 -16.108 -2.180 -2.884 1.00 0.00 H new ATOM 0 HA LYS A 25 -15.971 -4.946 -1.874 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.613 -3.327 -2.716 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -13.901 -5.052 -2.838 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -15.861 -4.346 -4.477 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -14.993 -2.828 -4.585 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -13.288 -3.738 -5.822 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -13.237 -5.203 -4.860 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -15.441 -5.888 -6.030 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -15.167 -4.551 -7.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -14.270 -6.604 -8.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.014 -5.502 -7.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.280 -6.797 -6.640 1.00 0.00 H new ATOM 360 N ALA A 26 -15.430 -2.372 -0.119 1.00 0.00 N ATOM 361 CA ALA A 26 -15.067 -1.884 1.201 1.00 0.00 C ATOM 362 C ALA A 26 -13.559 -2.040 1.401 1.00 0.00 C ATOM 363 O ALA A 26 -13.105 -2.377 2.494 1.00 0.00 O ATOM 364 CB ALA A 26 -15.877 -2.633 2.262 1.00 0.00 C ATOM 0 H ALA A 26 -15.969 -1.715 -0.683 1.00 0.00 H new ATOM 0 HA ALA A 26 -15.304 -0.824 1.297 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -15.605 -2.268 3.252 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -16.941 -2.466 2.093 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -15.663 -3.700 2.198 1.00 0.00 H new ATOM 370 N GLU A 27 -12.822 -1.786 0.329 1.00 0.00 N ATOM 371 CA GLU A 27 -11.374 -1.894 0.373 1.00 0.00 C ATOM 372 C GLU A 27 -10.732 -0.742 -0.402 1.00 0.00 C ATOM 373 O GLU A 27 -11.118 -0.461 -1.536 1.00 0.00 O ATOM 374 CB GLU A 27 -10.908 -3.247 -0.169 1.00 0.00 C ATOM 375 CG GLU A 27 -11.399 -4.392 0.718 1.00 0.00 C ATOM 376 CD GLU A 27 -10.229 -5.246 1.209 1.00 0.00 C ATOM 377 OE1 GLU A 27 -9.096 -4.718 1.196 1.00 0.00 O ATOM 378 OE2 GLU A 27 -10.493 -6.408 1.587 1.00 0.00 O ATOM 0 H GLU A 27 -13.201 -1.506 -0.575 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.056 -1.828 1.413 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -11.280 -3.384 -1.184 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -9.820 -3.266 -0.223 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -11.942 -3.988 1.572 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.099 -5.014 0.160 1.00 0.00 H new ATOM 385 N LEU A 28 -9.764 -0.106 0.241 1.00 0.00 N ATOM 386 CA LEU A 28 -9.065 1.010 -0.375 1.00 0.00 C ATOM 387 C LEU A 28 -8.080 0.477 -1.417 1.00 0.00 C ATOM 388 O LEU A 28 -7.499 -0.593 -1.238 1.00 0.00 O ATOM 389 CB LEU A 28 -8.413 1.889 0.695 1.00 0.00 C ATOM 390 CG LEU A 28 -8.005 3.295 0.250 1.00 0.00 C ATOM 391 CD1 LEU A 28 -6.704 3.260 -0.554 1.00 0.00 C ATOM 392 CD2 LEU A 28 -9.138 3.976 -0.521 1.00 0.00 C ATOM 0 H LEU A 28 -9.447 -0.342 1.181 1.00 0.00 H new ATOM 0 HA LEU A 28 -9.767 1.656 -0.902 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -9.104 1.981 1.533 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -7.527 1.376 1.068 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.816 3.894 1.141 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -6.437 4.272 -0.858 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -5.907 2.844 0.062 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -6.840 2.639 -1.440 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.822 4.974 -0.826 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -9.382 3.387 -1.405 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -10.018 4.053 0.118 1.00 0.00 H new ATOM 404 N PHE A 29 -7.921 1.247 -2.483 1.00 0.00 N ATOM 405 CA PHE A 29 -7.016 0.865 -3.554 1.00 0.00 C ATOM 406 C PHE A 29 -6.008 1.979 -3.843 1.00 0.00 C ATOM 407 O PHE A 29 -6.354 3.159 -3.807 1.00 0.00 O ATOM 408 CB PHE A 29 -7.872 0.633 -4.801 1.00 0.00 C ATOM 409 CG PHE A 29 -8.779 -0.597 -4.713 1.00 0.00 C ATOM 410 CD1 PHE A 29 -8.273 -1.834 -4.963 1.00 0.00 C ATOM 411 CD2 PHE A 29 -10.091 -0.452 -4.385 1.00 0.00 C ATOM 412 CE1 PHE A 29 -9.114 -2.975 -4.881 1.00 0.00 C ATOM 413 CE2 PHE A 29 -10.932 -1.593 -4.303 1.00 0.00 C ATOM 414 CZ PHE A 29 -10.426 -2.830 -4.553 1.00 0.00 C ATOM 0 H PHE A 29 -8.404 2.134 -2.628 1.00 0.00 H new ATOM 0 HA PHE A 29 -6.459 -0.028 -3.270 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -8.489 1.515 -4.975 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -7.216 0.527 -5.665 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -7.231 -1.949 -5.224 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -10.493 0.531 -4.187 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -8.712 -3.958 -5.079 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -11.974 -1.478 -4.042 1.00 0.00 H new ATOM 0 HZ PHE A 29 -11.066 -3.698 -4.491 1.00 0.00 H new ATOM 424 N VAL A 30 -4.781 1.565 -4.122 1.00 0.00 N ATOM 425 CA VAL A 30 -3.720 2.513 -4.416 1.00 0.00 C ATOM 426 C VAL A 30 -2.966 2.056 -5.667 1.00 0.00 C ATOM 427 O VAL A 30 -1.836 1.579 -5.575 1.00 0.00 O ATOM 428 CB VAL A 30 -2.810 2.676 -3.197 1.00 0.00 C ATOM 429 CG1 VAL A 30 -1.682 3.668 -3.484 1.00 0.00 C ATOM 430 CG2 VAL A 30 -3.614 3.101 -1.966 1.00 0.00 C ATOM 0 H VAL A 30 -4.498 0.586 -4.151 1.00 0.00 H new ATOM 0 HA VAL A 30 -4.136 3.498 -4.628 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.358 1.707 -2.984 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.050 3.766 -2.601 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.084 3.307 -4.321 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.107 4.640 -3.735 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.944 3.210 -1.113 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.107 4.053 -2.164 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.365 2.343 -1.743 1.00 0.00 H new ATOM 440 N THR A 31 -3.622 2.218 -6.807 1.00 0.00 N ATOM 441 CA THR A 31 -3.028 1.827 -8.074 1.00 0.00 C ATOM 442 C THR A 31 -2.131 2.945 -8.609 1.00 0.00 C ATOM 443 O THR A 31 -1.907 3.945 -7.929 1.00 0.00 O ATOM 444 CB THR A 31 -4.161 1.447 -9.030 1.00 0.00 C ATOM 445 OG1 THR A 31 -5.079 2.533 -8.930 1.00 0.00 O ATOM 446 CG2 THR A 31 -4.959 0.237 -8.540 1.00 0.00 C ATOM 0 H THR A 31 -4.559 2.615 -6.879 1.00 0.00 H new ATOM 0 HA THR A 31 -2.378 0.960 -7.956 1.00 0.00 H new ATOM 0 HB THR A 31 -3.748 1.234 -10.016 1.00 0.00 H new ATOM 0 HG1 THR A 31 -5.844 2.370 -9.520 1.00 0.00 H new ATOM 0 HG21 THR A 31 -5.750 0.009 -9.254 1.00 0.00 H new ATOM 0 HG22 THR A 31 -4.296 -0.623 -8.447 1.00 0.00 H new ATOM 0 HG23 THR A 31 -5.400 0.461 -7.569 1.00 0.00 H new ATOM 454 N ARG A 32 -1.642 2.738 -9.823 1.00 0.00 N ATOM 455 CA ARG A 32 -0.775 3.716 -10.457 1.00 0.00 C ATOM 456 C ARG A 32 0.432 4.013 -9.564 1.00 0.00 C ATOM 457 O ARG A 32 0.525 5.091 -8.979 1.00 0.00 O ATOM 458 CB ARG A 32 -1.526 5.019 -10.738 1.00 0.00 C ATOM 459 CG ARG A 32 -2.660 4.793 -11.740 1.00 0.00 C ATOM 460 CD ARG A 32 -3.835 5.731 -11.459 1.00 0.00 C ATOM 461 NE ARG A 32 -4.677 5.864 -12.669 1.00 0.00 N ATOM 462 CZ ARG A 32 -5.612 4.977 -13.035 1.00 0.00 C ATOM 463 NH1 ARG A 32 -5.829 3.886 -12.288 1.00 0.00 N ATOM 464 NH2 ARG A 32 -6.328 5.180 -14.149 1.00 0.00 N ATOM 0 H ARG A 32 -1.830 1.907 -10.384 1.00 0.00 H new ATOM 0 HA ARG A 32 -0.436 3.294 -11.403 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -1.932 5.417 -9.808 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -0.834 5.765 -11.129 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -2.293 4.957 -12.753 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -2.996 3.757 -11.687 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -4.431 5.344 -10.632 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -3.465 6.710 -11.154 1.00 0.00 H new ATOM 0 HE ARG A 32 -4.537 6.682 -13.261 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -5.282 3.731 -11.441 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -6.541 3.211 -12.566 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -6.161 6.010 -14.718 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -7.040 4.505 -14.428 1.00 0.00 H new ATOM 478 N LEU A 33 1.326 3.038 -9.488 1.00 0.00 N ATOM 479 CA LEU A 33 2.522 3.182 -8.676 1.00 0.00 C ATOM 480 C LEU A 33 3.692 3.601 -9.569 1.00 0.00 C ATOM 481 O LEU A 33 4.041 2.893 -10.513 1.00 0.00 O ATOM 482 CB LEU A 33 2.785 1.903 -7.878 1.00 0.00 C ATOM 483 CG LEU A 33 2.003 1.755 -6.572 1.00 0.00 C ATOM 484 CD1 LEU A 33 1.953 3.081 -5.809 1.00 0.00 C ATOM 485 CD2 LEU A 33 0.605 1.190 -6.830 1.00 0.00 C ATOM 0 H LEU A 33 1.246 2.146 -9.975 1.00 0.00 H new ATOM 0 HA LEU A 33 2.387 3.970 -7.935 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.556 1.048 -8.514 1.00 0.00 H new ATOM 0 HB3 LEU A 33 3.849 1.854 -7.649 1.00 0.00 H new ATOM 0 HG LEU A 33 2.528 1.039 -5.940 1.00 0.00 H new ATOM 0 HD11 LEU A 33 1.391 2.948 -4.884 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.967 3.404 -5.574 1.00 0.00 H new ATOM 0 HD13 LEU A 33 1.465 3.837 -6.424 1.00 0.00 H new ATOM 0 HD21 LEU A 33 0.071 1.095 -5.885 1.00 0.00 H new ATOM 0 HD22 LEU A 33 0.057 1.862 -7.490 1.00 0.00 H new ATOM 0 HD23 LEU A 33 0.690 0.210 -7.299 1.00 0.00 H new ATOM 497 N GLU A 34 4.265 4.749 -9.240 1.00 0.00 N ATOM 498 CA GLU A 34 5.387 5.271 -10.001 1.00 0.00 C ATOM 499 C GLU A 34 6.247 6.181 -9.121 1.00 0.00 C ATOM 500 O GLU A 34 5.973 7.374 -9.003 1.00 0.00 O ATOM 501 CB GLU A 34 4.907 6.010 -11.251 1.00 0.00 C ATOM 502 CG GLU A 34 4.042 5.102 -12.127 1.00 0.00 C ATOM 503 CD GLU A 34 3.744 5.762 -13.475 1.00 0.00 C ATOM 504 OE1 GLU A 34 4.682 6.378 -14.024 1.00 0.00 O ATOM 505 OE2 GLU A 34 2.585 5.634 -13.925 1.00 0.00 O ATOM 0 H GLU A 34 3.973 5.333 -8.456 1.00 0.00 H new ATOM 0 HA GLU A 34 6.000 4.432 -10.330 1.00 0.00 H new ATOM 0 HB2 GLU A 34 4.336 6.892 -10.960 1.00 0.00 H new ATOM 0 HB3 GLU A 34 5.766 6.361 -11.822 1.00 0.00 H new ATOM 0 HG2 GLU A 34 4.552 4.152 -12.288 1.00 0.00 H new ATOM 0 HG3 GLU A 34 3.107 4.878 -11.613 1.00 0.00 H new ATOM 512 N ALA A 35 7.269 5.583 -8.527 1.00 0.00 N ATOM 513 CA ALA A 35 8.171 6.325 -7.662 1.00 0.00 C ATOM 514 C ALA A 35 9.044 7.248 -8.515 1.00 0.00 C ATOM 515 O ALA A 35 9.367 6.923 -9.656 1.00 0.00 O ATOM 516 CB ALA A 35 8.998 5.346 -6.827 1.00 0.00 C ATOM 0 H ALA A 35 7.493 4.593 -8.628 1.00 0.00 H new ATOM 0 HA ALA A 35 7.610 6.951 -6.968 1.00 0.00 H new ATOM 0 HB1 ALA A 35 9.675 5.902 -6.178 1.00 0.00 H new ATOM 0 HB2 ALA A 35 8.332 4.735 -6.218 1.00 0.00 H new ATOM 0 HB3 ALA A 35 9.577 4.702 -7.489 1.00 0.00 H new ATOM 522 N VAL A 36 9.403 8.380 -7.927 1.00 0.00 N ATOM 523 CA VAL A 36 10.233 9.352 -8.619 1.00 0.00 C ATOM 524 C VAL A 36 11.315 9.862 -7.665 1.00 0.00 C ATOM 525 O VAL A 36 11.296 11.024 -7.264 1.00 0.00 O ATOM 526 CB VAL A 36 9.361 10.473 -9.189 1.00 0.00 C ATOM 527 CG1 VAL A 36 10.210 11.687 -9.569 1.00 0.00 C ATOM 528 CG2 VAL A 36 8.545 9.978 -10.385 1.00 0.00 C ATOM 0 H VAL A 36 9.134 8.646 -6.980 1.00 0.00 H new ATOM 0 HA VAL A 36 10.738 8.889 -9.467 1.00 0.00 H new ATOM 0 HB VAL A 36 8.662 10.783 -8.412 1.00 0.00 H new ATOM 0 HG11 VAL A 36 9.567 12.469 -9.971 1.00 0.00 H new ATOM 0 HG12 VAL A 36 10.726 12.061 -8.685 1.00 0.00 H new ATOM 0 HG13 VAL A 36 10.943 11.397 -10.322 1.00 0.00 H new ATOM 0 HG21 VAL A 36 7.934 10.794 -10.771 1.00 0.00 H new ATOM 0 HG22 VAL A 36 9.220 9.629 -11.166 1.00 0.00 H new ATOM 0 HG23 VAL A 36 7.899 9.158 -10.070 1.00 0.00 H new ATOM 538 N THR A 37 12.233 8.967 -7.330 1.00 0.00 N ATOM 539 CA THR A 37 13.321 9.312 -6.431 1.00 0.00 C ATOM 540 C THR A 37 14.648 9.354 -7.191 1.00 0.00 C ATOM 541 O THR A 37 14.994 8.407 -7.895 1.00 0.00 O ATOM 542 CB THR A 37 13.315 8.310 -5.274 1.00 0.00 C ATOM 543 OG1 THR A 37 13.928 7.146 -5.821 1.00 0.00 O ATOM 544 CG2 THR A 37 11.903 7.850 -4.906 1.00 0.00 C ATOM 0 H THR A 37 12.246 8.004 -7.665 1.00 0.00 H new ATOM 0 HA THR A 37 13.189 10.311 -6.016 1.00 0.00 H new ATOM 0 HB THR A 37 13.789 8.759 -4.401 1.00 0.00 H new ATOM 0 HG1 THR A 37 14.154 7.306 -6.761 1.00 0.00 H new ATOM 0 HG21 THR A 37 11.955 7.140 -4.080 1.00 0.00 H new ATOM 0 HG22 THR A 37 11.306 8.712 -4.607 1.00 0.00 H new ATOM 0 HG23 THR A 37 11.440 7.370 -5.768 1.00 0.00 H new ATOM 552 N SER A 38 15.354 10.463 -7.024 1.00 0.00 N ATOM 553 CA SER A 38 16.635 10.641 -7.685 1.00 0.00 C ATOM 554 C SER A 38 17.775 10.402 -6.693 1.00 0.00 C ATOM 555 O SER A 38 17.602 10.585 -5.489 1.00 0.00 O ATOM 556 CB SER A 38 16.749 12.038 -8.298 1.00 0.00 C ATOM 557 OG SER A 38 16.476 13.062 -7.346 1.00 0.00 O ATOM 0 H SER A 38 15.063 11.247 -6.440 1.00 0.00 H new ATOM 0 HA SER A 38 16.707 9.912 -8.492 1.00 0.00 H new ATOM 0 HB2 SER A 38 17.752 12.176 -8.702 1.00 0.00 H new ATOM 0 HB3 SER A 38 16.054 12.125 -9.134 1.00 0.00 H new ATOM 0 HG SER A 38 17.232 13.144 -6.728 1.00 0.00 H new ATOM 563 N ASN A 39 18.914 9.997 -7.234 1.00 0.00 N ATOM 564 CA ASN A 39 20.081 9.732 -6.411 1.00 0.00 C ATOM 565 C ASN A 39 19.713 8.722 -5.322 1.00 0.00 C ATOM 566 O ASN A 39 18.550 8.345 -5.188 1.00 0.00 O ATOM 567 CB ASN A 39 20.574 11.008 -5.726 1.00 0.00 C ATOM 568 CG ASN A 39 22.097 11.125 -5.814 1.00 0.00 C ATOM 569 OD1 ASN A 39 22.791 10.217 -6.242 1.00 0.00 O ATOM 570 ND2 ASN A 39 22.576 12.289 -5.385 1.00 0.00 N ATOM 0 H ASN A 39 19.054 9.846 -8.233 1.00 0.00 H new ATOM 0 HA ASN A 39 20.868 9.343 -7.057 1.00 0.00 H new ATOM 0 HB2 ASN A 39 20.111 11.878 -6.193 1.00 0.00 H new ATOM 0 HB3 ASN A 39 20.266 11.006 -4.680 1.00 0.00 H new ATOM 0 HD21 ASN A 39 23.581 12.464 -5.402 1.00 0.00 H new ATOM 0 HD22 ASN A 39 21.939 13.006 -5.039 1.00 0.00 H new ATOM 577 N HIS A 40 20.726 8.314 -4.572 1.00 0.00 N ATOM 578 CA HIS A 40 20.524 7.356 -3.498 1.00 0.00 C ATOM 579 C HIS A 40 20.060 6.020 -4.084 1.00 0.00 C ATOM 580 O HIS A 40 19.838 5.909 -5.288 1.00 0.00 O ATOM 581 CB HIS A 40 19.558 7.911 -2.450 1.00 0.00 C ATOM 582 CG HIS A 40 20.104 9.082 -1.670 1.00 0.00 C ATOM 583 ND1 HIS A 40 19.332 10.175 -1.318 1.00 0.00 N ATOM 584 CD2 HIS A 40 21.354 9.320 -1.177 1.00 0.00 C ATOM 585 CE1 HIS A 40 20.092 11.026 -0.646 1.00 0.00 C ATOM 586 NE2 HIS A 40 21.345 10.494 -0.559 1.00 0.00 N ATOM 0 H HIS A 40 21.689 8.629 -4.687 1.00 0.00 H new ATOM 0 HA HIS A 40 21.467 7.179 -2.981 1.00 0.00 H new ATOM 0 HB2 HIS A 40 18.636 8.216 -2.946 1.00 0.00 H new ATOM 0 HB3 HIS A 40 19.297 7.114 -1.754 1.00 0.00 H new ATOM 0 HD2 HIS A 40 22.206 8.664 -1.274 1.00 0.00 H new ATOM 0 HE1 HIS A 40 19.775 11.975 -0.238 1.00 0.00 H new ATOM 0 HE2 HIS A 40 22.143 10.927 -0.095 1.00 0.00 H new ATOM 594 N ASP A 41 19.928 5.039 -3.203 1.00 0.00 N ATOM 595 CA ASP A 41 19.495 3.715 -3.617 1.00 0.00 C ATOM 596 C ASP A 41 20.490 3.153 -4.634 1.00 0.00 C ATOM 597 O ASP A 41 20.631 3.689 -5.732 1.00 0.00 O ATOM 598 CB ASP A 41 18.118 3.769 -4.283 1.00 0.00 C ATOM 599 CG ASP A 41 16.932 3.621 -3.328 1.00 0.00 C ATOM 600 OD1 ASP A 41 16.512 4.662 -2.779 1.00 0.00 O ATOM 601 OD2 ASP A 41 16.472 2.470 -3.168 1.00 0.00 O ATOM 0 H ASP A 41 20.113 5.135 -2.205 1.00 0.00 H new ATOM 0 HA ASP A 41 19.442 3.085 -2.729 1.00 0.00 H new ATOM 0 HB2 ASP A 41 18.024 4.718 -4.811 1.00 0.00 H new ATOM 0 HB3 ASP A 41 18.062 2.980 -5.033 1.00 0.00 H new ATOM 606 N GLY A 42 21.154 2.079 -4.232 1.00 0.00 N ATOM 607 CA GLY A 42 22.132 1.438 -5.095 1.00 0.00 C ATOM 608 C GLY A 42 21.500 0.288 -5.881 1.00 0.00 C ATOM 609 O GLY A 42 20.613 0.508 -6.704 1.00 0.00 O ATOM 0 H GLY A 42 21.034 1.637 -3.321 1.00 0.00 H new ATOM 0 HA2 GLY A 42 22.547 2.171 -5.787 1.00 0.00 H new ATOM 0 HA3 GLY A 42 22.960 1.061 -4.495 1.00 0.00 H new ATOM 613 N GLY A 43 21.981 -0.914 -5.599 1.00 0.00 N ATOM 614 CA GLY A 43 21.473 -2.099 -6.270 1.00 0.00 C ATOM 615 C GLY A 43 20.652 -2.962 -5.310 1.00 0.00 C ATOM 616 O GLY A 43 21.157 -3.940 -4.761 1.00 0.00 O ATOM 0 H GLY A 43 22.717 -1.093 -4.915 1.00 0.00 H new ATOM 0 HA2 GLY A 43 20.856 -1.804 -7.119 1.00 0.00 H new ATOM 0 HA3 GLY A 43 22.304 -2.681 -6.668 1.00 0.00 H new ATOM 620 N CYS A 44 19.398 -2.570 -5.138 1.00 0.00 N ATOM 621 CA CYS A 44 18.501 -3.295 -4.255 1.00 0.00 C ATOM 622 C CYS A 44 17.086 -3.208 -4.830 1.00 0.00 C ATOM 623 O CYS A 44 16.757 -2.258 -5.539 1.00 0.00 O ATOM 624 CB CYS A 44 18.568 -2.766 -2.821 1.00 0.00 C ATOM 625 SG CYS A 44 19.913 -3.605 -1.906 1.00 0.00 S ATOM 0 H CYS A 44 18.982 -1.759 -5.596 1.00 0.00 H new ATOM 0 HA CYS A 44 18.806 -4.340 -4.201 1.00 0.00 H new ATOM 0 HB2 CYS A 44 18.739 -1.690 -2.829 1.00 0.00 H new ATOM 0 HB3 CYS A 44 17.616 -2.933 -2.318 1.00 0.00 H new ATOM 0 HG CYS A 44 20.815 -4.021 -2.745 1.00 0.00 H new ATOM 631 N ASP A 45 16.286 -4.212 -4.503 1.00 0.00 N ATOM 632 CA ASP A 45 14.913 -4.261 -4.978 1.00 0.00 C ATOM 633 C ASP A 45 14.057 -3.301 -4.150 1.00 0.00 C ATOM 634 O ASP A 45 14.212 -3.219 -2.932 1.00 0.00 O ATOM 635 CB ASP A 45 14.328 -5.667 -4.827 1.00 0.00 C ATOM 636 CG ASP A 45 15.075 -6.763 -5.589 1.00 0.00 C ATOM 637 OD1 ASP A 45 15.407 -6.510 -6.767 1.00 0.00 O ATOM 638 OD2 ASP A 45 15.296 -7.830 -4.976 1.00 0.00 O ATOM 0 H ASP A 45 16.562 -4.998 -3.915 1.00 0.00 H new ATOM 0 HA ASP A 45 14.910 -3.980 -6.031 1.00 0.00 H new ATOM 0 HB2 ASP A 45 14.314 -5.927 -3.768 1.00 0.00 H new ATOM 0 HB3 ASP A 45 13.292 -5.652 -5.165 1.00 0.00 H new ATOM 643 N CYS A 46 13.173 -2.599 -4.843 1.00 0.00 N ATOM 644 CA CYS A 46 12.292 -1.648 -4.187 1.00 0.00 C ATOM 645 C CYS A 46 10.846 -2.057 -4.471 1.00 0.00 C ATOM 646 O CYS A 46 10.587 -2.846 -5.379 1.00 0.00 O ATOM 647 CB CYS A 46 12.577 -0.212 -4.633 1.00 0.00 C ATOM 648 SG CYS A 46 11.884 0.073 -6.303 1.00 0.00 S ATOM 0 H CYS A 46 13.048 -2.670 -5.853 1.00 0.00 H new ATOM 0 HA CYS A 46 12.469 -1.667 -3.112 1.00 0.00 H new ATOM 0 HB2 CYS A 46 12.140 0.491 -3.924 1.00 0.00 H new ATOM 0 HB3 CYS A 46 13.652 -0.031 -4.640 1.00 0.00 H new ATOM 0 HG CYS A 46 12.129 1.295 -6.672 1.00 0.00 H new ATOM 654 N TYR A 47 9.941 -1.504 -3.677 1.00 0.00 N ATOM 655 CA TYR A 47 8.527 -1.802 -3.831 1.00 0.00 C ATOM 656 C TYR A 47 7.669 -0.821 -3.029 1.00 0.00 C ATOM 657 O TYR A 47 8.151 -0.199 -2.084 1.00 0.00 O ATOM 658 CB TYR A 47 8.330 -3.211 -3.270 1.00 0.00 C ATOM 659 CG TYR A 47 8.807 -3.379 -1.826 1.00 0.00 C ATOM 660 CD1 TYR A 47 8.001 -2.970 -0.782 1.00 0.00 C ATOM 661 CD2 TYR A 47 10.041 -3.937 -1.567 1.00 0.00 C ATOM 662 CE1 TYR A 47 8.450 -3.128 0.578 1.00 0.00 C ATOM 663 CE2 TYR A 47 10.490 -4.095 -0.208 1.00 0.00 C ATOM 664 CZ TYR A 47 9.672 -3.682 0.798 1.00 0.00 C ATOM 665 OH TYR A 47 10.096 -3.831 2.081 1.00 0.00 O ATOM 0 H TYR A 47 10.159 -0.851 -2.925 1.00 0.00 H new ATOM 0 HA TYR A 47 8.230 -1.723 -4.877 1.00 0.00 H new ATOM 0 HB2 TYR A 47 7.272 -3.468 -3.324 1.00 0.00 H new ATOM 0 HB3 TYR A 47 8.863 -3.921 -3.903 1.00 0.00 H new ATOM 0 HD1 TYR A 47 7.035 -2.532 -0.985 1.00 0.00 H new ATOM 0 HD2 TYR A 47 10.671 -4.256 -2.384 1.00 0.00 H new ATOM 0 HE1 TYR A 47 7.830 -2.813 1.404 1.00 0.00 H new ATOM 0 HE2 TYR A 47 11.454 -4.531 0.008 1.00 0.00 H new ATOM 0 HH TYR A 47 10.986 -4.241 2.086 1.00 0.00 H new ATOM 675 N VAL A 48 6.413 -0.715 -3.436 1.00 0.00 N ATOM 676 CA VAL A 48 5.483 0.180 -2.767 1.00 0.00 C ATOM 677 C VAL A 48 4.745 -0.588 -1.668 1.00 0.00 C ATOM 678 O VAL A 48 4.425 -1.764 -1.835 1.00 0.00 O ATOM 679 CB VAL A 48 4.539 0.814 -3.790 1.00 0.00 C ATOM 680 CG1 VAL A 48 3.866 2.062 -3.214 1.00 0.00 C ATOM 681 CG2 VAL A 48 5.279 1.140 -5.089 1.00 0.00 C ATOM 0 H VAL A 48 6.017 -1.233 -4.220 1.00 0.00 H new ATOM 0 HA VAL A 48 6.019 0.999 -2.288 1.00 0.00 H new ATOM 0 HB VAL A 48 3.759 0.089 -4.022 1.00 0.00 H new ATOM 0 HG11 VAL A 48 3.200 2.494 -3.961 1.00 0.00 H new ATOM 0 HG12 VAL A 48 3.291 1.790 -2.329 1.00 0.00 H new ATOM 0 HG13 VAL A 48 4.627 2.793 -2.941 1.00 0.00 H new ATOM 0 HG21 VAL A 48 4.586 1.590 -5.800 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.089 1.839 -4.881 1.00 0.00 H new ATOM 0 HG23 VAL A 48 5.690 0.224 -5.513 1.00 0.00 H new ATOM 691 N GLN A 49 4.497 0.108 -0.569 1.00 0.00 N ATOM 692 CA GLN A 49 3.802 -0.493 0.557 1.00 0.00 C ATOM 693 C GLN A 49 2.746 0.469 1.105 1.00 0.00 C ATOM 694 O GLN A 49 3.046 1.626 1.396 1.00 0.00 O ATOM 695 CB GLN A 49 4.788 -0.906 1.652 1.00 0.00 C ATOM 696 CG GLN A 49 4.071 -1.645 2.784 1.00 0.00 C ATOM 697 CD GLN A 49 4.692 -1.303 4.141 1.00 0.00 C ATOM 698 OE1 GLN A 49 5.899 -1.219 4.297 1.00 0.00 O ATOM 699 NE2 GLN A 49 3.801 -1.110 5.110 1.00 0.00 N ATOM 0 H GLN A 49 4.765 1.083 -0.434 1.00 0.00 H new ATOM 0 HA GLN A 49 3.298 -1.394 0.208 1.00 0.00 H new ATOM 0 HB2 GLN A 49 5.562 -1.546 1.228 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.288 -0.022 2.049 1.00 0.00 H new ATOM 0 HG2 GLN A 49 3.014 -1.378 2.786 1.00 0.00 H new ATOM 0 HG3 GLN A 49 4.128 -2.720 2.615 1.00 0.00 H new ATOM 0 HE21 GLN A 49 2.804 -1.196 4.911 1.00 0.00 H new ATOM 0 HE22 GLN A 49 4.115 -0.876 6.052 1.00 0.00 H new ATOM 708 N GLY A 50 1.531 -0.045 1.228 1.00 0.00 N ATOM 709 CA GLY A 50 0.429 0.755 1.735 1.00 0.00 C ATOM 710 C GLY A 50 -0.082 0.201 3.067 1.00 0.00 C ATOM 711 O GLY A 50 -0.085 -1.010 3.280 1.00 0.00 O ATOM 0 H GLY A 50 1.286 -1.005 0.986 1.00 0.00 H new ATOM 0 HA2 GLY A 50 0.754 1.787 1.867 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -0.382 0.767 1.007 1.00 0.00 H new ATOM 715 N SER A 51 -0.502 1.116 3.929 1.00 0.00 N ATOM 716 CA SER A 51 -1.013 0.735 5.235 1.00 0.00 C ATOM 717 C SER A 51 -2.218 1.605 5.599 1.00 0.00 C ATOM 718 O SER A 51 -2.316 2.750 5.161 1.00 0.00 O ATOM 719 CB SER A 51 0.071 0.854 6.308 1.00 0.00 C ATOM 720 OG SER A 51 -0.259 0.120 7.483 1.00 0.00 O ATOM 0 H SER A 51 -0.499 2.120 3.748 1.00 0.00 H new ATOM 0 HA SER A 51 -1.326 -0.308 5.188 1.00 0.00 H new ATOM 0 HB2 SER A 51 1.018 0.492 5.908 1.00 0.00 H new ATOM 0 HB3 SER A 51 0.214 1.904 6.564 1.00 0.00 H new ATOM 0 HG SER A 51 0.458 0.220 8.143 1.00 0.00 H new ATOM 726 N VAL A 52 -3.105 1.027 6.396 1.00 0.00 N ATOM 727 CA VAL A 52 -4.300 1.736 6.824 1.00 0.00 C ATOM 728 C VAL A 52 -4.564 1.435 8.300 1.00 0.00 C ATOM 729 O VAL A 52 -4.076 0.438 8.832 1.00 0.00 O ATOM 730 CB VAL A 52 -5.477 1.370 5.918 1.00 0.00 C ATOM 731 CG1 VAL A 52 -6.735 1.086 6.743 1.00 0.00 C ATOM 732 CG2 VAL A 52 -5.736 2.467 4.884 1.00 0.00 C ATOM 0 H VAL A 52 -3.020 0.077 6.757 1.00 0.00 H new ATOM 0 HA VAL A 52 -4.160 2.813 6.732 1.00 0.00 H new ATOM 0 HB VAL A 52 -5.215 0.459 5.380 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -7.557 0.828 6.076 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -6.545 0.255 7.422 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -7.000 1.972 7.319 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -6.578 2.181 4.253 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -5.967 3.402 5.395 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -4.848 2.601 4.266 1.00 0.00 H new ATOM 742 N ALA A 53 -5.337 2.314 8.921 1.00 0.00 N ATOM 743 CA ALA A 53 -5.672 2.155 10.326 1.00 0.00 C ATOM 744 C ALA A 53 -7.142 2.521 10.539 1.00 0.00 C ATOM 745 O ALA A 53 -7.525 3.681 10.393 1.00 0.00 O ATOM 746 CB ALA A 53 -4.730 3.009 11.176 1.00 0.00 C ATOM 0 H ALA A 53 -5.741 3.139 8.477 1.00 0.00 H new ATOM 0 HA ALA A 53 -5.541 1.118 10.637 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -4.982 2.889 12.230 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -3.701 2.690 11.010 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -4.835 4.057 10.895 1.00 0.00 H new ATOM 752 N ASN A 54 -7.927 1.509 10.882 1.00 0.00 N ATOM 753 CA ASN A 54 -9.347 1.710 11.117 1.00 0.00 C ATOM 754 C ASN A 54 -9.651 1.482 12.599 1.00 0.00 C ATOM 755 O ASN A 54 -8.763 1.127 13.371 1.00 0.00 O ATOM 756 CB ASN A 54 -10.185 0.721 10.304 1.00 0.00 C ATOM 757 CG ASN A 54 -9.398 -0.560 10.020 1.00 0.00 C ATOM 758 OD1 ASN A 54 -8.784 -1.150 10.894 1.00 0.00 O ATOM 759 ND2 ASN A 54 -9.450 -0.956 8.752 1.00 0.00 N ATOM 0 H ASN A 54 -7.606 0.548 11.003 1.00 0.00 H new ATOM 0 HA ASN A 54 -9.598 2.727 10.817 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -11.098 0.478 10.849 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -10.488 1.182 9.364 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -8.957 -1.800 8.461 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -9.983 -0.416 8.070 1.00 0.00 H new ATOM 766 N ARG A 55 -10.911 1.696 12.951 1.00 0.00 N ATOM 767 CA ARG A 55 -11.343 1.518 14.327 1.00 0.00 C ATOM 768 C ARG A 55 -11.454 0.029 14.660 1.00 0.00 C ATOM 769 O ARG A 55 -11.763 -0.336 15.793 1.00 0.00 O ATOM 770 CB ARG A 55 -12.696 2.190 14.570 1.00 0.00 C ATOM 771 CG ARG A 55 -12.516 3.650 14.991 1.00 0.00 C ATOM 772 CD ARG A 55 -13.803 4.447 14.769 1.00 0.00 C ATOM 773 NE ARG A 55 -13.902 5.536 15.766 1.00 0.00 N ATOM 774 CZ ARG A 55 -14.113 5.339 17.075 1.00 0.00 C ATOM 775 NH1 ARG A 55 -14.248 4.094 17.552 1.00 0.00 N ATOM 776 NH2 ARG A 55 -14.189 6.387 17.907 1.00 0.00 N ATOM 0 H ARG A 55 -11.646 1.991 12.308 1.00 0.00 H new ATOM 0 HA ARG A 55 -10.597 1.983 14.972 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.298 2.141 13.663 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -13.241 1.649 15.344 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -12.232 3.697 16.042 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -11.703 4.099 14.421 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -13.814 4.863 13.762 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -14.667 3.788 14.851 1.00 0.00 H new ATOM 0 HE ARG A 55 -13.804 6.496 15.437 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -14.190 3.296 16.919 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -14.409 3.944 18.548 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -14.086 7.335 17.544 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -14.350 6.237 18.903 1.00 0.00 H new ATOM 790 N THR A 56 -11.195 -0.791 13.652 1.00 0.00 N ATOM 791 CA THR A 56 -11.262 -2.232 13.824 1.00 0.00 C ATOM 792 C THR A 56 -9.859 -2.812 14.017 1.00 0.00 C ATOM 793 O THR A 56 -9.691 -3.831 14.685 1.00 0.00 O ATOM 794 CB THR A 56 -12.001 -2.819 12.620 1.00 0.00 C ATOM 795 OG1 THR A 56 -11.157 -2.514 11.513 1.00 0.00 O ATOM 796 CG2 THR A 56 -13.302 -2.075 12.312 1.00 0.00 C ATOM 0 H THR A 56 -10.938 -0.485 12.713 1.00 0.00 H new ATOM 0 HA THR A 56 -11.816 -2.497 14.724 1.00 0.00 H new ATOM 0 HB THR A 56 -12.219 -3.871 12.805 1.00 0.00 H new ATOM 0 HG1 THR A 56 -11.560 -2.860 10.689 1.00 0.00 H new ATOM 0 HG21 THR A 56 -13.787 -2.532 11.449 1.00 0.00 H new ATOM 0 HG22 THR A 56 -13.967 -2.132 13.174 1.00 0.00 H new ATOM 0 HG23 THR A 56 -13.081 -1.030 12.093 1.00 0.00 H new ATOM 804 N GLY A 57 -8.888 -2.137 13.420 1.00 0.00 N ATOM 805 CA GLY A 57 -7.505 -2.572 13.517 1.00 0.00 C ATOM 806 C GLY A 57 -6.621 -1.817 12.523 1.00 0.00 C ATOM 807 O GLY A 57 -6.577 -0.588 12.535 1.00 0.00 O ATOM 0 H GLY A 57 -9.032 -1.292 12.867 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -7.139 -2.409 14.531 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -7.443 -3.643 13.324 1.00 0.00 H new ATOM 811 N SER A 58 -5.939 -2.584 11.685 1.00 0.00 N ATOM 812 CA SER A 58 -5.059 -2.003 10.686 1.00 0.00 C ATOM 813 C SER A 58 -4.777 -3.022 9.580 1.00 0.00 C ATOM 814 O SER A 58 -4.784 -4.227 9.825 1.00 0.00 O ATOM 815 CB SER A 58 -3.748 -1.528 11.316 1.00 0.00 C ATOM 816 OG SER A 58 -3.215 -2.486 12.226 1.00 0.00 O ATOM 0 H SER A 58 -5.978 -3.603 11.678 1.00 0.00 H new ATOM 0 HA SER A 58 -5.559 -1.136 10.254 1.00 0.00 H new ATOM 0 HB2 SER A 58 -3.019 -1.330 10.530 1.00 0.00 H new ATOM 0 HB3 SER A 58 -3.917 -0.587 11.839 1.00 0.00 H new ATOM 0 HG SER A 58 -2.378 -2.146 12.605 1.00 0.00 H new ATOM 822 N VAL A 59 -4.537 -2.501 8.386 1.00 0.00 N ATOM 823 CA VAL A 59 -4.254 -3.350 7.241 1.00 0.00 C ATOM 824 C VAL A 59 -3.023 -2.816 6.507 1.00 0.00 C ATOM 825 O VAL A 59 -2.666 -1.648 6.654 1.00 0.00 O ATOM 826 CB VAL A 59 -5.490 -3.448 6.344 1.00 0.00 C ATOM 827 CG1 VAL A 59 -6.449 -4.528 6.848 1.00 0.00 C ATOM 828 CG2 VAL A 59 -6.196 -2.095 6.234 1.00 0.00 C ATOM 0 H VAL A 59 -4.533 -1.501 8.186 1.00 0.00 H new ATOM 0 HA VAL A 59 -4.023 -4.365 7.566 1.00 0.00 H new ATOM 0 HB VAL A 59 -5.158 -3.735 5.346 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -7.319 -4.577 6.193 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -5.942 -5.493 6.850 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -6.771 -4.285 7.861 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -7.071 -2.192 5.591 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -6.509 -1.766 7.225 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -5.512 -1.361 5.807 1.00 0.00 H new ATOM 838 N GLU A 60 -2.407 -3.696 5.732 1.00 0.00 N ATOM 839 CA GLU A 60 -1.223 -3.328 4.975 1.00 0.00 C ATOM 840 C GLU A 60 -1.182 -4.091 3.649 1.00 0.00 C ATOM 841 O GLU A 60 -1.866 -5.101 3.489 1.00 0.00 O ATOM 842 CB GLU A 60 0.048 -3.574 5.789 1.00 0.00 C ATOM 843 CG GLU A 60 0.326 -2.406 6.739 1.00 0.00 C ATOM 844 CD GLU A 60 1.399 -2.777 7.764 1.00 0.00 C ATOM 845 OE1 GLU A 60 2.590 -2.713 7.387 1.00 0.00 O ATOM 846 OE2 GLU A 60 1.006 -3.115 8.901 1.00 0.00 O ATOM 0 H GLU A 60 -2.706 -4.664 5.612 1.00 0.00 H new ATOM 0 HA GLU A 60 -1.273 -2.261 4.757 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -0.055 -4.496 6.361 1.00 0.00 H new ATOM 0 HB3 GLU A 60 0.895 -3.709 5.116 1.00 0.00 H new ATOM 0 HG2 GLU A 60 0.650 -1.536 6.167 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -0.593 -2.125 7.254 1.00 0.00 H new ATOM 853 N ALA A 61 -0.372 -3.581 2.734 1.00 0.00 N ATOM 854 CA ALA A 61 -0.232 -4.202 1.428 1.00 0.00 C ATOM 855 C ALA A 61 0.953 -3.573 0.693 1.00 0.00 C ATOM 856 O ALA A 61 1.452 -2.524 1.096 1.00 0.00 O ATOM 857 CB ALA A 61 -1.543 -4.059 0.651 1.00 0.00 C ATOM 0 H ALA A 61 0.195 -2.744 2.871 1.00 0.00 H new ATOM 0 HA ALA A 61 -0.028 -5.268 1.530 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -1.438 -4.525 -0.329 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -2.347 -4.548 1.201 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -1.779 -3.002 0.527 1.00 0.00 H new ATOM 863 N GLN A 62 1.370 -4.241 -0.373 1.00 0.00 N ATOM 864 CA GLN A 62 2.487 -3.761 -1.168 1.00 0.00 C ATOM 865 C GLN A 62 2.463 -4.400 -2.558 1.00 0.00 C ATOM 866 O GLN A 62 1.688 -5.322 -2.808 1.00 0.00 O ATOM 867 CB GLN A 62 3.818 -4.031 -0.463 1.00 0.00 C ATOM 868 CG GLN A 62 3.892 -5.477 0.033 1.00 0.00 C ATOM 869 CD GLN A 62 4.712 -5.573 1.321 1.00 0.00 C ATOM 870 OE1 GLN A 62 4.353 -5.038 2.357 1.00 0.00 O ATOM 871 NE2 GLN A 62 5.830 -6.282 1.199 1.00 0.00 N ATOM 0 H GLN A 62 0.954 -5.111 -0.704 1.00 0.00 H new ATOM 0 HA GLN A 62 2.388 -2.682 -1.284 1.00 0.00 H new ATOM 0 HB2 GLN A 62 4.643 -3.835 -1.148 1.00 0.00 H new ATOM 0 HB3 GLN A 62 3.933 -3.348 0.378 1.00 0.00 H new ATOM 0 HG2 GLN A 62 2.886 -5.857 0.209 1.00 0.00 H new ATOM 0 HG3 GLN A 62 4.340 -6.107 -0.736 1.00 0.00 H new ATOM 0 HE21 GLN A 62 6.071 -6.703 0.302 1.00 0.00 H new ATOM 0 HE22 GLN A 62 6.446 -6.405 2.002 1.00 0.00 H new ATOM 880 N THR A 63 3.322 -3.886 -3.426 1.00 0.00 N ATOM 881 CA THR A 63 3.409 -4.395 -4.784 1.00 0.00 C ATOM 882 C THR A 63 4.581 -5.368 -4.914 1.00 0.00 C ATOM 883 O THR A 63 5.240 -5.689 -3.926 1.00 0.00 O ATOM 884 CB THR A 63 3.504 -3.198 -5.732 1.00 0.00 C ATOM 885 OG1 THR A 63 4.588 -2.431 -5.215 1.00 0.00 O ATOM 886 CG2 THR A 63 2.298 -2.263 -5.619 1.00 0.00 C ATOM 0 H THR A 63 3.964 -3.122 -3.215 1.00 0.00 H new ATOM 0 HA THR A 63 2.521 -4.968 -5.050 1.00 0.00 H new ATOM 0 HB THR A 63 3.591 -3.554 -6.758 1.00 0.00 H new ATOM 0 HG1 THR A 63 5.282 -2.341 -5.901 1.00 0.00 H new ATOM 0 HG21 THR A 63 2.416 -1.431 -6.313 1.00 0.00 H new ATOM 0 HG22 THR A 63 1.388 -2.812 -5.862 1.00 0.00 H new ATOM 0 HG23 THR A 63 2.229 -1.879 -4.601 1.00 0.00 H new ATOM 894 N ALA A 64 4.807 -5.812 -6.142 1.00 0.00 N ATOM 895 CA ALA A 64 5.889 -6.743 -6.415 1.00 0.00 C ATOM 896 C ALA A 64 7.205 -5.970 -6.525 1.00 0.00 C ATOM 897 O ALA A 64 7.245 -4.886 -7.104 1.00 0.00 O ATOM 898 CB ALA A 64 5.571 -7.538 -7.683 1.00 0.00 C ATOM 0 H ALA A 64 4.259 -5.544 -6.959 1.00 0.00 H new ATOM 0 HA ALA A 64 5.995 -7.459 -5.600 1.00 0.00 H new ATOM 0 HB1 ALA A 64 6.383 -8.236 -7.888 1.00 0.00 H new ATOM 0 HB2 ALA A 64 4.643 -8.092 -7.542 1.00 0.00 H new ATOM 0 HB3 ALA A 64 5.461 -6.853 -8.524 1.00 0.00 H new ATOM 904 N LEU A 65 8.249 -6.559 -5.961 1.00 0.00 N ATOM 905 CA LEU A 65 9.563 -5.940 -5.989 1.00 0.00 C ATOM 906 C LEU A 65 9.941 -5.620 -7.436 1.00 0.00 C ATOM 907 O LEU A 65 9.707 -6.427 -8.335 1.00 0.00 O ATOM 908 CB LEU A 65 10.585 -6.819 -5.266 1.00 0.00 C ATOM 909 CG LEU A 65 10.606 -6.709 -3.740 1.00 0.00 C ATOM 910 CD1 LEU A 65 9.973 -7.942 -3.093 1.00 0.00 C ATOM 911 CD2 LEU A 65 12.025 -6.457 -3.228 1.00 0.00 C ATOM 0 H LEU A 65 8.212 -7.459 -5.482 1.00 0.00 H new ATOM 0 HA LEU A 65 9.550 -4.995 -5.447 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.393 -7.858 -5.533 1.00 0.00 H new ATOM 0 HB3 LEU A 65 11.578 -6.571 -5.642 1.00 0.00 H new ATOM 0 HG LEU A 65 10.003 -5.849 -3.451 1.00 0.00 H new ATOM 0 HD11 LEU A 65 10.001 -7.838 -2.008 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.938 -8.035 -3.422 1.00 0.00 H new ATOM 0 HD13 LEU A 65 10.529 -8.833 -3.387 1.00 0.00 H new ATOM 0 HD21 LEU A 65 12.012 -6.383 -2.141 1.00 0.00 H new ATOM 0 HD22 LEU A 65 12.672 -7.282 -3.528 1.00 0.00 H new ATOM 0 HD23 LEU A 65 12.404 -5.527 -3.650 1.00 0.00 H new ATOM 923 N LYS A 66 10.518 -4.441 -7.617 1.00 0.00 N ATOM 924 CA LYS A 66 10.930 -4.005 -8.941 1.00 0.00 C ATOM 925 C LYS A 66 12.358 -3.458 -8.871 1.00 0.00 C ATOM 926 O LYS A 66 12.888 -3.234 -7.784 1.00 0.00 O ATOM 927 CB LYS A 66 9.919 -3.013 -9.517 1.00 0.00 C ATOM 928 CG LYS A 66 8.704 -3.741 -10.095 1.00 0.00 C ATOM 929 CD LYS A 66 8.613 -3.540 -11.609 1.00 0.00 C ATOM 930 CE LYS A 66 7.201 -3.839 -12.118 1.00 0.00 C ATOM 931 NZ LYS A 66 7.003 -3.261 -13.466 1.00 0.00 N ATOM 0 H LYS A 66 10.710 -3.774 -6.869 1.00 0.00 H new ATOM 0 HA LYS A 66 10.944 -4.847 -9.633 1.00 0.00 H new ATOM 0 HB2 LYS A 66 9.597 -2.323 -8.737 1.00 0.00 H new ATOM 0 HB3 LYS A 66 10.394 -2.415 -10.295 1.00 0.00 H new ATOM 0 HG2 LYS A 66 8.772 -4.805 -9.869 1.00 0.00 H new ATOM 0 HG3 LYS A 66 7.795 -3.372 -9.620 1.00 0.00 H new ATOM 0 HD2 LYS A 66 8.884 -2.515 -11.860 1.00 0.00 H new ATOM 0 HD3 LYS A 66 9.329 -4.191 -12.110 1.00 0.00 H new ATOM 0 HE2 LYS A 66 7.040 -4.917 -12.151 1.00 0.00 H new ATOM 0 HE3 LYS A 66 6.464 -3.428 -11.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 6.086 -3.572 -13.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 7.018 -2.223 -13.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 7.765 -3.581 -14.097 1.00 0.00 H new ATOM 945 N LYS A 67 12.939 -3.258 -10.045 1.00 0.00 N ATOM 946 CA LYS A 67 14.294 -2.741 -10.130 1.00 0.00 C ATOM 947 C LYS A 67 14.276 -1.231 -9.884 1.00 0.00 C ATOM 948 O LYS A 67 13.489 -0.508 -10.494 1.00 0.00 O ATOM 949 CB LYS A 67 14.936 -3.140 -11.460 1.00 0.00 C ATOM 950 CG LYS A 67 16.170 -2.283 -11.752 1.00 0.00 C ATOM 951 CD LYS A 67 17.436 -3.141 -11.791 1.00 0.00 C ATOM 952 CE LYS A 67 17.863 -3.553 -10.380 1.00 0.00 C ATOM 953 NZ LYS A 67 18.983 -4.518 -10.439 1.00 0.00 N ATOM 0 H LYS A 67 12.496 -3.445 -10.945 1.00 0.00 H new ATOM 0 HA LYS A 67 14.920 -3.183 -9.355 1.00 0.00 H new ATOM 0 HB2 LYS A 67 15.218 -4.192 -11.430 1.00 0.00 H new ATOM 0 HB3 LYS A 67 14.211 -3.027 -12.266 1.00 0.00 H new ATOM 0 HG2 LYS A 67 16.044 -1.771 -12.706 1.00 0.00 H new ATOM 0 HG3 LYS A 67 16.272 -1.513 -10.987 1.00 0.00 H new ATOM 0 HD2 LYS A 67 17.258 -4.031 -12.395 1.00 0.00 H new ATOM 0 HD3 LYS A 67 18.242 -2.585 -12.271 1.00 0.00 H new ATOM 0 HE2 LYS A 67 18.164 -2.672 -9.813 1.00 0.00 H new ATOM 0 HE3 LYS A 67 17.019 -3.998 -9.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 19.260 -4.787 -9.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 18.684 -5.365 -10.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 19.793 -4.080 -10.923 1.00 0.00 H new ATOM 967 N ARG A 68 15.152 -0.799 -8.989 1.00 0.00 N ATOM 968 CA ARG A 68 15.246 0.612 -8.655 1.00 0.00 C ATOM 969 C ARG A 68 15.722 1.414 -9.868 1.00 0.00 C ATOM 970 O ARG A 68 16.746 1.091 -10.468 1.00 0.00 O ATOM 971 CB ARG A 68 16.214 0.839 -7.491 1.00 0.00 C ATOM 972 CG ARG A 68 15.675 1.900 -6.530 1.00 0.00 C ATOM 973 CD ARG A 68 15.627 3.274 -7.201 1.00 0.00 C ATOM 974 NE ARG A 68 14.243 3.799 -7.182 1.00 0.00 N ATOM 975 CZ ARG A 68 13.536 4.012 -6.063 1.00 0.00 C ATOM 976 NH1 ARG A 68 14.079 3.747 -4.867 1.00 0.00 N ATOM 977 NH2 ARG A 68 12.287 4.490 -6.141 1.00 0.00 N ATOM 0 H ARG A 68 15.803 -1.401 -8.485 1.00 0.00 H new ATOM 0 HA ARG A 68 14.253 0.950 -8.359 1.00 0.00 H new ATOM 0 HB2 ARG A 68 16.370 -0.097 -6.955 1.00 0.00 H new ATOM 0 HB3 ARG A 68 17.185 1.151 -7.876 1.00 0.00 H new ATOM 0 HG2 ARG A 68 14.676 1.619 -6.196 1.00 0.00 H new ATOM 0 HG3 ARG A 68 16.306 1.947 -5.643 1.00 0.00 H new ATOM 0 HD2 ARG A 68 16.294 3.964 -6.684 1.00 0.00 H new ATOM 0 HD3 ARG A 68 15.982 3.198 -8.229 1.00 0.00 H new ATOM 0 HE ARG A 68 13.800 4.012 -8.076 1.00 0.00 H new ATOM 0 HH11 ARG A 68 15.030 3.383 -4.808 1.00 0.00 H new ATOM 0 HH12 ARG A 68 13.541 3.909 -4.016 1.00 0.00 H new ATOM 0 HH21 ARG A 68 11.874 4.692 -7.052 1.00 0.00 H new ATOM 0 HH22 ARG A 68 11.749 4.652 -5.290 1.00 0.00 H new ATOM 991 N GLN A 69 14.955 2.445 -10.193 1.00 0.00 N ATOM 992 CA GLN A 69 15.285 3.296 -11.324 1.00 0.00 C ATOM 993 C GLN A 69 14.867 4.740 -11.041 1.00 0.00 C ATOM 994 O GLN A 69 14.254 5.023 -10.012 1.00 0.00 O ATOM 995 CB GLN A 69 14.635 2.778 -12.608 1.00 0.00 C ATOM 996 CG GLN A 69 15.250 1.443 -13.034 1.00 0.00 C ATOM 997 CD GLN A 69 16.591 1.657 -13.738 1.00 0.00 C ATOM 998 OE1 GLN A 69 17.026 2.772 -13.975 1.00 0.00 O ATOM 999 NE2 GLN A 69 17.221 0.530 -14.057 1.00 0.00 N ATOM 0 H GLN A 69 14.106 2.710 -9.693 1.00 0.00 H new ATOM 0 HA GLN A 69 16.365 3.273 -11.468 1.00 0.00 H new ATOM 0 HB2 GLN A 69 13.563 2.656 -12.453 1.00 0.00 H new ATOM 0 HB3 GLN A 69 14.761 3.511 -13.405 1.00 0.00 H new ATOM 0 HG2 GLN A 69 15.392 0.808 -12.159 1.00 0.00 H new ATOM 0 HG3 GLN A 69 14.565 0.919 -13.700 1.00 0.00 H new ATOM 0 HE21 GLN A 69 16.801 -0.371 -13.830 1.00 0.00 H new ATOM 0 HE22 GLN A 69 18.124 0.567 -14.529 1.00 0.00 H new ATOM 1008 N LEU A 70 15.214 5.616 -11.973 1.00 0.00 N ATOM 1009 CA LEU A 70 14.882 7.024 -11.837 1.00 0.00 C ATOM 1010 C LEU A 70 13.369 7.203 -11.980 1.00 0.00 C ATOM 1011 O LEU A 70 12.829 8.254 -11.637 1.00 0.00 O ATOM 1012 CB LEU A 70 15.696 7.864 -12.823 1.00 0.00 C ATOM 1013 CG LEU A 70 16.683 8.855 -12.203 1.00 0.00 C ATOM 1014 CD1 LEU A 70 15.954 9.899 -11.355 1.00 0.00 C ATOM 1015 CD2 LEU A 70 17.766 8.125 -11.406 1.00 0.00 C ATOM 0 H LEU A 70 15.722 5.378 -12.825 1.00 0.00 H new ATOM 0 HA LEU A 70 15.154 7.385 -10.845 1.00 0.00 H new ATOM 0 HB2 LEU A 70 16.251 7.188 -13.474 1.00 0.00 H new ATOM 0 HB3 LEU A 70 15.003 8.419 -13.455 1.00 0.00 H new ATOM 0 HG LEU A 70 17.182 9.389 -13.011 1.00 0.00 H new ATOM 0 HD11 LEU A 70 16.679 10.591 -10.926 1.00 0.00 H new ATOM 0 HD12 LEU A 70 15.253 10.451 -11.981 1.00 0.00 H new ATOM 0 HD13 LEU A 70 15.410 9.401 -10.553 1.00 0.00 H new ATOM 0 HD21 LEU A 70 18.454 8.853 -10.976 1.00 0.00 H new ATOM 0 HD22 LEU A 70 17.302 7.548 -10.606 1.00 0.00 H new ATOM 0 HD23 LEU A 70 18.314 7.454 -12.067 1.00 0.00 H new ATOM 1027 N HIS A 71 12.727 6.160 -12.486 1.00 0.00 N ATOM 1028 CA HIS A 71 11.287 6.189 -12.678 1.00 0.00 C ATOM 1029 C HIS A 71 10.767 4.764 -12.874 1.00 0.00 C ATOM 1030 O HIS A 71 10.655 4.289 -14.003 1.00 0.00 O ATOM 1031 CB HIS A 71 10.912 7.121 -13.833 1.00 0.00 C ATOM 1032 CG HIS A 71 9.460 7.538 -13.838 1.00 0.00 C ATOM 1033 ND1 HIS A 71 8.833 8.053 -14.959 1.00 0.00 N ATOM 1034 CD2 HIS A 71 8.521 7.509 -12.849 1.00 0.00 C ATOM 1035 CE1 HIS A 71 7.573 8.320 -14.647 1.00 0.00 C ATOM 1036 NE2 HIS A 71 7.382 7.983 -13.339 1.00 0.00 N ATOM 0 H HIS A 71 13.178 5.290 -12.769 1.00 0.00 H new ATOM 0 HA HIS A 71 10.806 6.595 -11.788 1.00 0.00 H new ATOM 0 HB2 HIS A 71 11.536 8.014 -13.784 1.00 0.00 H new ATOM 0 HB3 HIS A 71 11.140 6.624 -14.776 1.00 0.00 H new ATOM 0 HD1 HIS A 71 9.267 8.202 -15.870 1.00 0.00 H new ATOM 0 HD2 HIS A 71 8.678 7.160 -11.839 1.00 0.00 H new ATOM 0 HE1 HIS A 71 6.828 8.732 -15.312 1.00 0.00 H new ATOM 1044 N THR A 72 10.462 4.121 -11.756 1.00 0.00 N ATOM 1045 CA THR A 72 9.956 2.759 -11.790 1.00 0.00 C ATOM 1046 C THR A 72 8.426 2.758 -11.778 1.00 0.00 C ATOM 1047 O THR A 72 7.806 3.666 -11.227 1.00 0.00 O ATOM 1048 CB THR A 72 10.574 1.996 -10.616 1.00 0.00 C ATOM 1049 OG1 THR A 72 11.951 1.882 -10.962 1.00 0.00 O ATOM 1050 CG2 THR A 72 10.088 0.547 -10.539 1.00 0.00 C ATOM 0 H THR A 72 10.556 4.518 -10.821 1.00 0.00 H new ATOM 0 HA THR A 72 10.242 2.253 -12.712 1.00 0.00 H new ATOM 0 HB THR A 72 10.336 2.509 -9.684 1.00 0.00 H new ATOM 0 HG1 THR A 72 12.277 0.991 -10.716 1.00 0.00 H new ATOM 0 HG21 THR A 72 10.557 0.051 -9.689 1.00 0.00 H new ATOM 0 HG22 THR A 72 9.005 0.533 -10.416 1.00 0.00 H new ATOM 0 HG23 THR A 72 10.356 0.024 -11.457 1.00 0.00 H new ATOM 1058 N THR A 73 7.862 1.729 -12.392 1.00 0.00 N ATOM 1059 CA THR A 73 6.417 1.598 -12.459 1.00 0.00 C ATOM 1060 C THR A 73 5.999 0.153 -12.177 1.00 0.00 C ATOM 1061 O THR A 73 6.783 -0.774 -12.374 1.00 0.00 O ATOM 1062 CB THR A 73 5.959 2.106 -13.827 1.00 0.00 C ATOM 1063 OG1 THR A 73 6.789 1.410 -14.753 1.00 0.00 O ATOM 1064 CG2 THR A 73 6.307 3.580 -14.051 1.00 0.00 C ATOM 0 H THR A 73 8.380 0.978 -12.848 1.00 0.00 H new ATOM 0 HA THR A 73 5.930 2.200 -11.692 1.00 0.00 H new ATOM 0 HB THR A 73 4.882 1.968 -13.922 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.557 1.679 -15.666 1.00 0.00 H new ATOM 0 HG21 THR A 73 5.960 3.890 -15.037 1.00 0.00 H new ATOM 0 HG22 THR A 73 5.822 4.188 -13.288 1.00 0.00 H new ATOM 0 HG23 THR A 73 7.387 3.712 -13.988 1.00 0.00 H new ATOM 1072 N TRP A 74 4.764 0.007 -11.720 1.00 0.00 N ATOM 1073 CA TRP A 74 4.232 -1.309 -11.409 1.00 0.00 C ATOM 1074 C TRP A 74 3.012 -1.549 -12.301 1.00 0.00 C ATOM 1075 O TRP A 74 2.584 -0.654 -13.027 1.00 0.00 O ATOM 1076 CB TRP A 74 3.916 -1.434 -9.917 1.00 0.00 C ATOM 1077 CG TRP A 74 5.154 -1.567 -9.028 1.00 0.00 C ATOM 1078 CD1 TRP A 74 5.697 -2.687 -8.532 1.00 0.00 C ATOM 1079 CD2 TRP A 74 5.986 -0.490 -8.546 1.00 0.00 C ATOM 1080 NE1 TRP A 74 6.814 -2.413 -7.769 1.00 0.00 N ATOM 1081 CE2 TRP A 74 6.995 -1.034 -7.778 1.00 0.00 C ATOM 1082 CE3 TRP A 74 5.889 0.897 -8.753 1.00 0.00 C ATOM 1083 CZ2 TRP A 74 7.984 -0.264 -7.154 1.00 0.00 C ATOM 1084 CZ3 TRP A 74 6.885 1.653 -8.123 1.00 0.00 C ATOM 1085 CH2 TRP A 74 7.908 1.121 -7.346 1.00 0.00 C ATOM 0 H TRP A 74 4.116 0.778 -11.558 1.00 0.00 H new ATOM 0 HA TRP A 74 4.972 -2.083 -11.616 1.00 0.00 H new ATOM 0 HB2 TRP A 74 3.347 -0.559 -9.602 1.00 0.00 H new ATOM 0 HB3 TRP A 74 3.276 -2.303 -9.763 1.00 0.00 H new ATOM 0 HD1 TRP A 74 5.309 -3.680 -8.707 1.00 0.00 H new ATOM 0 HE1 TRP A 74 7.399 -3.096 -7.287 1.00 0.00 H new ATOM 0 HE3 TRP A 74 5.108 1.344 -9.351 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 8.763 -0.714 -6.557 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 6.857 2.725 -8.250 1.00 0.00 H new ATOM 0 HH2 TRP A 74 8.640 1.773 -6.893 1.00 0.00 H new ATOM 1096 N GLU A 75 2.486 -2.762 -12.216 1.00 0.00 N ATOM 1097 CA GLU A 75 1.324 -3.131 -13.006 1.00 0.00 C ATOM 1098 C GLU A 75 0.085 -3.229 -12.114 1.00 0.00 C ATOM 1099 O GLU A 75 -1.024 -2.927 -12.551 1.00 0.00 O ATOM 1100 CB GLU A 75 1.565 -4.443 -13.756 1.00 0.00 C ATOM 1101 CG GLU A 75 1.018 -4.367 -15.182 1.00 0.00 C ATOM 1102 CD GLU A 75 1.115 -5.726 -15.880 1.00 0.00 C ATOM 1103 OE1 GLU A 75 0.162 -6.517 -15.717 1.00 0.00 O ATOM 1104 OE2 GLU A 75 2.141 -5.942 -16.560 1.00 0.00 O ATOM 0 H GLU A 75 2.843 -3.502 -11.612 1.00 0.00 H new ATOM 0 HA GLU A 75 1.152 -2.352 -13.749 1.00 0.00 H new ATOM 0 HB2 GLU A 75 2.633 -4.660 -13.783 1.00 0.00 H new ATOM 0 HB3 GLU A 75 1.087 -5.264 -13.222 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -0.021 -4.039 -15.160 1.00 0.00 H new ATOM 0 HG3 GLU A 75 1.575 -3.622 -15.750 1.00 0.00 H new ATOM 1111 N GLU A 76 0.316 -3.653 -10.880 1.00 0.00 N ATOM 1112 CA GLU A 76 -0.768 -3.794 -9.922 1.00 0.00 C ATOM 1113 C GLU A 76 -0.672 -2.709 -8.848 1.00 0.00 C ATOM 1114 O GLU A 76 0.347 -2.029 -8.736 1.00 0.00 O ATOM 1115 CB GLU A 76 -0.766 -5.189 -9.294 1.00 0.00 C ATOM 1116 CG GLU A 76 0.497 -5.414 -8.462 1.00 0.00 C ATOM 1117 CD GLU A 76 0.602 -6.871 -8.007 1.00 0.00 C ATOM 1118 OE1 GLU A 76 0.065 -7.166 -6.918 1.00 0.00 O ATOM 1119 OE2 GLU A 76 1.217 -7.657 -8.759 1.00 0.00 O ATOM 0 H GLU A 76 1.237 -3.903 -10.521 1.00 0.00 H new ATOM 0 HA GLU A 76 -1.713 -3.671 -10.451 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -1.647 -5.309 -8.664 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -0.829 -5.944 -10.077 1.00 0.00 H new ATOM 0 HG2 GLU A 76 1.376 -5.149 -9.050 1.00 0.00 H new ATOM 0 HG3 GLU A 76 0.485 -4.758 -7.592 1.00 0.00 H new ATOM 1126 N GLY A 77 -1.748 -2.580 -8.084 1.00 0.00 N ATOM 1127 CA GLY A 77 -1.797 -1.589 -7.023 1.00 0.00 C ATOM 1128 C GLY A 77 -1.908 -2.259 -5.652 1.00 0.00 C ATOM 1129 O GLY A 77 -1.648 -3.454 -5.518 1.00 0.00 O ATOM 0 H GLY A 77 -2.592 -3.145 -8.179 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -0.901 -0.969 -7.058 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -2.649 -0.927 -7.178 1.00 0.00 H new ATOM 1133 N LEU A 78 -2.294 -1.461 -4.668 1.00 0.00 N ATOM 1134 CA LEU A 78 -2.442 -1.961 -3.312 1.00 0.00 C ATOM 1135 C LEU A 78 -3.930 -2.077 -2.975 1.00 0.00 C ATOM 1136 O LEU A 78 -4.764 -1.419 -3.596 1.00 0.00 O ATOM 1137 CB LEU A 78 -1.655 -1.091 -2.330 1.00 0.00 C ATOM 1138 CG LEU A 78 -0.179 -0.868 -2.665 1.00 0.00 C ATOM 1139 CD1 LEU A 78 0.494 0.016 -1.615 1.00 0.00 C ATOM 1140 CD2 LEU A 78 0.549 -2.202 -2.844 1.00 0.00 C ATOM 0 H LEU A 78 -2.509 -0.471 -4.783 1.00 0.00 H new ATOM 0 HA LEU A 78 -2.016 -2.961 -3.227 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -2.143 -0.119 -2.265 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.718 -1.546 -1.341 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.120 -0.338 -3.616 1.00 0.00 H new ATOM 0 HD11 LEU A 78 1.542 0.159 -1.877 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -0.006 0.984 -1.580 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.426 -0.463 -0.638 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.596 -2.016 -3.081 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.483 -2.779 -1.922 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.087 -2.763 -3.657 1.00 0.00 H new ATOM 1152 N VAL A 79 -4.219 -2.918 -1.993 1.00 0.00 N ATOM 1153 CA VAL A 79 -5.592 -3.128 -1.566 1.00 0.00 C ATOM 1154 C VAL A 79 -5.633 -3.263 -0.043 1.00 0.00 C ATOM 1155 O VAL A 79 -4.859 -4.023 0.538 1.00 0.00 O ATOM 1156 CB VAL A 79 -6.185 -4.339 -2.290 1.00 0.00 C ATOM 1157 CG1 VAL A 79 -7.690 -4.447 -2.035 1.00 0.00 C ATOM 1158 CG2 VAL A 79 -5.886 -4.282 -3.789 1.00 0.00 C ATOM 0 H VAL A 79 -3.525 -3.462 -1.480 1.00 0.00 H new ATOM 0 HA VAL A 79 -6.211 -2.271 -1.833 1.00 0.00 H new ATOM 0 HB VAL A 79 -5.712 -5.235 -1.888 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -8.087 -5.316 -2.561 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -7.871 -4.556 -0.966 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -8.186 -3.546 -2.397 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -6.318 -5.154 -4.280 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.319 -3.376 -4.212 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -4.807 -4.276 -3.945 1.00 0.00 H new ATOM 1168 N LEU A 80 -6.543 -2.514 0.561 1.00 0.00 N ATOM 1169 CA LEU A 80 -6.696 -2.540 2.006 1.00 0.00 C ATOM 1170 C LEU A 80 -8.184 -2.524 2.358 1.00 0.00 C ATOM 1171 O LEU A 80 -8.942 -1.710 1.832 1.00 0.00 O ATOM 1172 CB LEU A 80 -5.899 -1.404 2.649 1.00 0.00 C ATOM 1173 CG LEU A 80 -4.428 -1.299 2.240 1.00 0.00 C ATOM 1174 CD1 LEU A 80 -4.032 0.156 1.983 1.00 0.00 C ATOM 1175 CD2 LEU A 80 -3.522 -1.966 3.277 1.00 0.00 C ATOM 0 H LEU A 80 -7.183 -1.885 0.076 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.282 -3.461 2.416 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -6.390 -0.461 2.409 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -5.947 -1.521 3.732 1.00 0.00 H new ATOM 0 HG LEU A 80 -4.295 -1.838 1.302 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -2.982 0.202 1.694 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -4.647 0.564 1.181 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -4.184 0.740 2.890 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -2.482 -1.877 2.962 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -3.652 -1.477 4.242 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -3.785 -3.020 3.366 1.00 0.00 H new ATOM 1187 N PRO A 81 -8.570 -3.457 3.269 1.00 0.00 N ATOM 1188 CA PRO A 81 -9.954 -3.558 3.698 1.00 0.00 C ATOM 1189 C PRO A 81 -10.315 -2.422 4.657 1.00 0.00 C ATOM 1190 O PRO A 81 -9.697 -2.274 5.710 1.00 0.00 O ATOM 1191 CB PRO A 81 -10.070 -4.933 4.335 1.00 0.00 C ATOM 1192 CG PRO A 81 -8.649 -5.363 4.658 1.00 0.00 C ATOM 1193 CD PRO A 81 -7.701 -4.438 3.913 1.00 0.00 C ATOM 0 HA PRO A 81 -10.658 -3.456 2.872 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -10.681 -4.896 5.237 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -10.547 -5.639 3.656 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -8.469 -5.310 5.732 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -8.486 -6.398 4.358 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -6.999 -3.958 4.595 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -7.109 -4.985 3.179 1.00 0.00 H new ATOM 1201 N LEU A 82 -11.314 -1.648 4.258 1.00 0.00 N ATOM 1202 CA LEU A 82 -11.765 -0.530 5.069 1.00 0.00 C ATOM 1203 C LEU A 82 -13.252 -0.281 4.806 1.00 0.00 C ATOM 1204 O LEU A 82 -13.685 -0.252 3.656 1.00 0.00 O ATOM 1205 CB LEU A 82 -10.884 0.697 4.827 1.00 0.00 C ATOM 1206 CG LEU A 82 -11.382 2.011 5.433 1.00 0.00 C ATOM 1207 CD1 LEU A 82 -12.364 2.711 4.491 1.00 0.00 C ATOM 1208 CD2 LEU A 82 -11.983 1.782 6.821 1.00 0.00 C ATOM 0 H LEU A 82 -11.824 -1.773 3.383 1.00 0.00 H new ATOM 0 HA LEU A 82 -11.663 -0.763 6.129 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -9.890 0.490 5.225 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -10.775 0.835 3.751 1.00 0.00 H new ATOM 0 HG LEU A 82 -10.527 2.675 5.559 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -12.703 3.642 4.945 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -11.868 2.928 3.545 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -13.221 2.062 4.311 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -12.329 2.732 7.229 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -12.824 1.092 6.744 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -11.225 1.359 7.480 1.00 0.00 H new ATOM 1220 N ALA A 83 -13.991 -0.108 5.892 1.00 0.00 N ATOM 1221 CA ALA A 83 -15.420 0.138 5.793 1.00 0.00 C ATOM 1222 C ALA A 83 -15.657 1.608 5.444 1.00 0.00 C ATOM 1223 O ALA A 83 -14.842 2.468 5.776 1.00 0.00 O ATOM 1224 CB ALA A 83 -16.100 -0.268 7.102 1.00 0.00 C ATOM 0 H ALA A 83 -13.627 -0.133 6.845 1.00 0.00 H new ATOM 0 HA ALA A 83 -15.859 -0.464 4.998 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -17.172 -0.083 7.028 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -15.926 -1.328 7.289 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -15.687 0.318 7.923 1.00 0.00 H new ATOM 1230 N GLU A 84 -16.777 1.852 4.779 1.00 0.00 N ATOM 1231 CA GLU A 84 -17.131 3.204 4.381 1.00 0.00 C ATOM 1232 C GLU A 84 -17.513 4.035 5.608 1.00 0.00 C ATOM 1233 O GLU A 84 -17.470 5.264 5.568 1.00 0.00 O ATOM 1234 CB GLU A 84 -18.264 3.194 3.353 1.00 0.00 C ATOM 1235 CG GLU A 84 -18.339 4.528 2.606 1.00 0.00 C ATOM 1236 CD GLU A 84 -19.792 4.950 2.383 1.00 0.00 C ATOM 1237 OE1 GLU A 84 -20.616 4.042 2.141 1.00 0.00 O ATOM 1238 OE2 GLU A 84 -20.046 6.172 2.460 1.00 0.00 O ATOM 0 H GLU A 84 -17.451 1.137 4.506 1.00 0.00 H new ATOM 0 HA GLU A 84 -16.261 3.663 3.911 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -18.107 2.383 2.642 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -19.212 3.000 3.854 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -17.816 5.297 3.175 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -17.830 4.440 1.646 1.00 0.00 H new ATOM 1245 N GLU A 85 -17.877 3.331 6.670 1.00 0.00 N ATOM 1246 CA GLU A 85 -18.266 3.989 7.906 1.00 0.00 C ATOM 1247 C GLU A 85 -17.026 4.363 8.721 1.00 0.00 C ATOM 1248 O GLU A 85 -17.138 4.984 9.777 1.00 0.00 O ATOM 1249 CB GLU A 85 -19.213 3.106 8.722 1.00 0.00 C ATOM 1250 CG GLU A 85 -18.588 1.736 8.993 1.00 0.00 C ATOM 1251 CD GLU A 85 -19.215 1.082 10.226 1.00 0.00 C ATOM 1252 OE1 GLU A 85 -18.804 1.466 11.343 1.00 0.00 O ATOM 1253 OE2 GLU A 85 -20.091 0.214 10.024 1.00 0.00 O ATOM 0 H GLU A 85 -17.911 2.312 6.700 1.00 0.00 H new ATOM 0 HA GLU A 85 -18.801 4.905 7.655 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -19.449 3.596 9.667 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -20.153 2.981 8.185 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -18.726 1.091 8.125 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -17.514 1.845 9.141 1.00 0.00 H new ATOM 1260 N GLU A 86 -15.874 3.970 8.199 1.00 0.00 N ATOM 1261 CA GLU A 86 -14.615 4.256 8.865 1.00 0.00 C ATOM 1262 C GLU A 86 -13.731 5.132 7.975 1.00 0.00 C ATOM 1263 O GLU A 86 -12.675 5.594 8.405 1.00 0.00 O ATOM 1264 CB GLU A 86 -13.893 2.964 9.252 1.00 0.00 C ATOM 1265 CG GLU A 86 -14.801 2.057 10.086 1.00 0.00 C ATOM 1266 CD GLU A 86 -14.106 1.625 11.379 1.00 0.00 C ATOM 1267 OE1 GLU A 86 -12.859 1.706 11.408 1.00 0.00 O ATOM 1268 OE2 GLU A 86 -14.837 1.223 12.310 1.00 0.00 O ATOM 0 H GLU A 86 -15.786 3.456 7.322 1.00 0.00 H new ATOM 0 HA GLU A 86 -14.829 4.803 9.783 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -13.575 2.438 8.352 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -12.992 3.202 9.818 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -15.726 2.582 10.324 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -15.075 1.177 9.504 1.00 0.00 H new ATOM 1275 N LEU A 87 -14.194 5.333 6.750 1.00 0.00 N ATOM 1276 CA LEU A 87 -13.459 6.146 5.796 1.00 0.00 C ATOM 1277 C LEU A 87 -12.910 7.386 6.504 1.00 0.00 C ATOM 1278 O LEU A 87 -11.723 7.690 6.401 1.00 0.00 O ATOM 1279 CB LEU A 87 -14.332 6.467 4.581 1.00 0.00 C ATOM 1280 CG LEU A 87 -14.300 5.444 3.443 1.00 0.00 C ATOM 1281 CD1 LEU A 87 -15.461 5.667 2.473 1.00 0.00 C ATOM 1282 CD2 LEU A 87 -12.946 5.459 2.730 1.00 0.00 C ATOM 0 H LEU A 87 -15.069 4.947 6.396 1.00 0.00 H new ATOM 0 HA LEU A 87 -12.602 5.596 5.407 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -15.363 6.574 4.918 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -14.024 7.434 4.183 1.00 0.00 H new ATOM 0 HG LEU A 87 -14.426 4.450 3.873 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -15.415 4.927 1.674 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -16.406 5.566 3.007 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -15.391 6.667 2.046 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -12.950 4.723 1.926 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -12.765 6.450 2.314 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -12.157 5.215 3.442 1.00 0.00 H new ATOM 1294 N PRO A 88 -13.825 8.087 7.226 1.00 0.00 N ATOM 1295 CA PRO A 88 -13.445 9.287 7.951 1.00 0.00 C ATOM 1296 C PRO A 88 -12.662 8.938 9.218 1.00 0.00 C ATOM 1297 O PRO A 88 -11.915 9.765 9.739 1.00 0.00 O ATOM 1298 CB PRO A 88 -14.755 10.003 8.241 1.00 0.00 C ATOM 1299 CG PRO A 88 -15.846 8.957 8.080 1.00 0.00 C ATOM 1300 CD PRO A 88 -15.240 7.757 7.371 1.00 0.00 C ATOM 0 HA PRO A 88 -12.773 9.928 7.380 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -14.758 10.419 9.249 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -14.906 10.834 7.553 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -16.242 8.666 9.053 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -16.679 9.360 7.504 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -15.376 6.844 7.951 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -15.709 7.592 6.401 1.00 0.00 H new ATOM 1308 N THR A 89 -12.860 7.711 9.678 1.00 0.00 N ATOM 1309 CA THR A 89 -12.181 7.242 10.874 1.00 0.00 C ATOM 1310 C THR A 89 -11.033 6.302 10.502 1.00 0.00 C ATOM 1311 O THR A 89 -10.627 5.464 11.306 1.00 0.00 O ATOM 1312 CB THR A 89 -13.225 6.595 11.787 1.00 0.00 C ATOM 1313 OG1 THR A 89 -13.378 5.280 11.262 1.00 0.00 O ATOM 1314 CG2 THR A 89 -14.611 7.223 11.629 1.00 0.00 C ATOM 0 H THR A 89 -13.481 7.028 9.244 1.00 0.00 H new ATOM 0 HA THR A 89 -11.720 8.067 11.417 1.00 0.00 H new ATOM 0 HB THR A 89 -12.903 6.682 12.825 1.00 0.00 H new ATOM 0 HG1 THR A 89 -12.750 4.674 11.708 1.00 0.00 H new ATOM 0 HG21 THR A 89 -15.314 6.727 12.299 1.00 0.00 H new ATOM 0 HG22 THR A 89 -14.560 8.283 11.876 1.00 0.00 H new ATOM 0 HG23 THR A 89 -14.948 7.106 10.599 1.00 0.00 H new ATOM 1322 N ALA A 90 -10.543 6.472 9.283 1.00 0.00 N ATOM 1323 CA ALA A 90 -9.450 5.649 8.795 1.00 0.00 C ATOM 1324 C ALA A 90 -8.505 6.510 7.954 1.00 0.00 C ATOM 1325 O ALA A 90 -8.930 7.490 7.344 1.00 0.00 O ATOM 1326 CB ALA A 90 -10.014 4.464 8.008 1.00 0.00 C ATOM 0 H ALA A 90 -10.883 7.168 8.619 1.00 0.00 H new ATOM 0 HA ALA A 90 -8.875 5.243 9.627 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -9.194 3.847 7.642 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -10.655 3.868 8.658 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.596 4.832 7.163 1.00 0.00 H new ATOM 1332 N THR A 91 -7.241 6.113 7.949 1.00 0.00 N ATOM 1333 CA THR A 91 -6.232 6.836 7.193 1.00 0.00 C ATOM 1334 C THR A 91 -5.315 5.858 6.456 1.00 0.00 C ATOM 1335 O THR A 91 -5.133 4.722 6.892 1.00 0.00 O ATOM 1336 CB THR A 91 -5.486 7.756 8.161 1.00 0.00 C ATOM 1337 OG1 THR A 91 -6.517 8.525 8.774 1.00 0.00 O ATOM 1338 CG2 THR A 91 -4.627 8.795 7.437 1.00 0.00 C ATOM 0 H THR A 91 -6.892 5.300 8.456 1.00 0.00 H new ATOM 0 HA THR A 91 -6.686 7.454 6.418 1.00 0.00 H new ATOM 0 HB THR A 91 -4.855 7.157 8.817 1.00 0.00 H new ATOM 0 HG1 THR A 91 -6.121 9.148 9.419 1.00 0.00 H new ATOM 0 HG21 THR A 91 -4.119 9.422 8.170 1.00 0.00 H new ATOM 0 HG22 THR A 91 -3.887 8.288 6.818 1.00 0.00 H new ATOM 0 HG23 THR A 91 -5.262 9.416 6.806 1.00 0.00 H new ATOM 1346 N LEU A 92 -4.762 6.334 5.350 1.00 0.00 N ATOM 1347 CA LEU A 92 -3.869 5.516 4.548 1.00 0.00 C ATOM 1348 C LEU A 92 -2.438 6.040 4.691 1.00 0.00 C ATOM 1349 O LEU A 92 -2.227 7.238 4.874 1.00 0.00 O ATOM 1350 CB LEU A 92 -4.357 5.452 3.099 1.00 0.00 C ATOM 1351 CG LEU A 92 -3.310 5.059 2.055 1.00 0.00 C ATOM 1352 CD1 LEU A 92 -2.726 3.678 2.357 1.00 0.00 C ATOM 1353 CD2 LEU A 92 -3.889 5.139 0.641 1.00 0.00 C ATOM 0 H LEU A 92 -4.915 7.276 4.991 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.870 4.487 4.907 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -5.180 4.740 3.045 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -4.762 6.428 2.829 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.489 5.774 2.108 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -1.985 3.423 1.600 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -2.253 3.690 3.339 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -3.524 2.936 2.348 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -3.124 4.855 -0.082 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -4.738 4.461 0.557 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.218 6.159 0.440 1.00 0.00 H new ATOM 1365 N THR A 93 -1.492 5.116 4.603 1.00 0.00 N ATOM 1366 CA THR A 93 -0.088 5.469 4.721 1.00 0.00 C ATOM 1367 C THR A 93 0.756 4.627 3.762 1.00 0.00 C ATOM 1368 O THR A 93 0.759 3.400 3.847 1.00 0.00 O ATOM 1369 CB THR A 93 0.318 5.311 6.187 1.00 0.00 C ATOM 1370 OG1 THR A 93 -0.135 6.513 6.805 1.00 0.00 O ATOM 1371 CG2 THR A 93 1.835 5.341 6.382 1.00 0.00 C ATOM 0 H THR A 93 -1.671 4.123 4.451 1.00 0.00 H new ATOM 0 HA THR A 93 0.085 6.506 4.431 1.00 0.00 H new ATOM 0 HB THR A 93 -0.079 4.372 6.573 1.00 0.00 H new ATOM 0 HG1 THR A 93 0.086 6.494 7.759 1.00 0.00 H new ATOM 0 HG21 THR A 93 2.068 5.225 7.440 1.00 0.00 H new ATOM 0 HG22 THR A 93 2.290 4.527 5.819 1.00 0.00 H new ATOM 0 HG23 THR A 93 2.229 6.293 6.026 1.00 0.00 H new ATOM 1379 N LEU A 94 1.452 5.320 2.873 1.00 0.00 N ATOM 1380 CA LEU A 94 2.298 4.651 1.899 1.00 0.00 C ATOM 1381 C LEU A 94 3.740 4.629 2.412 1.00 0.00 C ATOM 1382 O LEU A 94 4.159 5.533 3.133 1.00 0.00 O ATOM 1383 CB LEU A 94 2.146 5.299 0.522 1.00 0.00 C ATOM 1384 CG LEU A 94 0.868 4.951 -0.245 1.00 0.00 C ATOM 1385 CD1 LEU A 94 -0.239 4.500 0.709 1.00 0.00 C ATOM 1386 CD2 LEU A 94 0.423 6.120 -1.127 1.00 0.00 C ATOM 0 H LEU A 94 1.448 6.338 2.807 1.00 0.00 H new ATOM 0 HA LEU A 94 1.987 3.614 1.774 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.189 6.381 0.645 1.00 0.00 H new ATOM 0 HB3 LEU A 94 3.002 5.013 -0.089 1.00 0.00 H new ATOM 0 HG LEU A 94 1.084 4.112 -0.906 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -1.136 4.259 0.138 1.00 0.00 H new ATOM 0 HD12 LEU A 94 0.090 3.617 1.257 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.462 5.302 1.413 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -0.487 5.847 -1.661 1.00 0.00 H new ATOM 0 HD22 LEU A 94 0.230 6.993 -0.504 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.209 6.354 -1.845 1.00 0.00 H new ATOM 1398 N THR A 95 4.458 3.587 2.021 1.00 0.00 N ATOM 1399 CA THR A 95 5.843 3.435 2.432 1.00 0.00 C ATOM 1400 C THR A 95 6.646 2.718 1.345 1.00 0.00 C ATOM 1401 O THR A 95 6.202 1.706 0.806 1.00 0.00 O ATOM 1402 CB THR A 95 5.859 2.709 3.779 1.00 0.00 C ATOM 1403 OG1 THR A 95 4.537 2.195 3.912 1.00 0.00 O ATOM 1404 CG2 THR A 95 6.006 3.670 4.960 1.00 0.00 C ATOM 0 H THR A 95 4.106 2.839 1.423 1.00 0.00 H new ATOM 0 HA THR A 95 6.326 4.403 2.563 1.00 0.00 H new ATOM 0 HB THR A 95 6.677 1.989 3.793 1.00 0.00 H new ATOM 0 HG1 THR A 95 4.459 1.707 4.758 1.00 0.00 H new ATOM 0 HG21 THR A 95 6.012 3.104 5.891 1.00 0.00 H new ATOM 0 HG22 THR A 95 6.941 4.222 4.865 1.00 0.00 H new ATOM 0 HG23 THR A 95 5.170 4.370 4.966 1.00 0.00 H new ATOM 1412 N LEU A 96 7.815 3.271 1.056 1.00 0.00 N ATOM 1413 CA LEU A 96 8.685 2.696 0.044 1.00 0.00 C ATOM 1414 C LEU A 96 9.919 2.095 0.719 1.00 0.00 C ATOM 1415 O LEU A 96 10.871 2.809 1.030 1.00 0.00 O ATOM 1416 CB LEU A 96 9.016 3.735 -1.029 1.00 0.00 C ATOM 1417 CG LEU A 96 8.534 3.414 -2.445 1.00 0.00 C ATOM 1418 CD1 LEU A 96 8.422 4.686 -3.288 1.00 0.00 C ATOM 1419 CD2 LEU A 96 9.432 2.366 -3.106 1.00 0.00 C ATOM 0 H LEU A 96 8.180 4.111 1.505 1.00 0.00 H new ATOM 0 HA LEU A 96 8.179 1.883 -0.476 1.00 0.00 H new ATOM 0 HB2 LEU A 96 8.585 4.690 -0.727 1.00 0.00 H new ATOM 0 HB3 LEU A 96 10.097 3.868 -1.056 1.00 0.00 H new ATOM 0 HG LEU A 96 7.535 2.984 -2.376 1.00 0.00 H new ATOM 0 HD11 LEU A 96 8.077 4.429 -4.290 1.00 0.00 H new ATOM 0 HD12 LEU A 96 7.711 5.369 -2.823 1.00 0.00 H new ATOM 0 HD13 LEU A 96 9.398 5.167 -3.352 1.00 0.00 H new ATOM 0 HD21 LEU A 96 9.067 2.156 -4.111 1.00 0.00 H new ATOM 0 HD22 LEU A 96 10.453 2.745 -3.162 1.00 0.00 H new ATOM 0 HD23 LEU A 96 9.417 1.450 -2.516 1.00 0.00 H new ATOM 1431 N ARG A 97 9.862 0.787 0.926 1.00 0.00 N ATOM 1432 CA ARG A 97 10.963 0.081 1.559 1.00 0.00 C ATOM 1433 C ARG A 97 11.946 -0.426 0.502 1.00 0.00 C ATOM 1434 O ARG A 97 11.563 -0.668 -0.642 1.00 0.00 O ATOM 1435 CB ARG A 97 10.457 -1.103 2.384 1.00 0.00 C ATOM 1436 CG ARG A 97 10.088 -0.666 3.803 1.00 0.00 C ATOM 1437 CD ARG A 97 8.577 -0.478 3.944 1.00 0.00 C ATOM 1438 NE ARG A 97 8.202 -0.442 5.375 1.00 0.00 N ATOM 1439 CZ ARG A 97 8.181 -1.517 6.173 1.00 0.00 C ATOM 1440 NH1 ARG A 97 8.512 -2.721 5.685 1.00 0.00 N ATOM 1441 NH2 ARG A 97 7.828 -1.390 7.460 1.00 0.00 N ATOM 0 H ARG A 97 9.071 0.198 0.667 1.00 0.00 H new ATOM 0 HA ARG A 97 11.468 0.782 2.223 1.00 0.00 H new ATOM 0 HB2 ARG A 97 9.587 -1.544 1.898 1.00 0.00 H new ATOM 0 HB3 ARG A 97 11.224 -1.876 2.426 1.00 0.00 H new ATOM 0 HG2 ARG A 97 10.433 -1.412 4.518 1.00 0.00 H new ATOM 0 HG3 ARG A 97 10.598 0.267 4.044 1.00 0.00 H new ATOM 0 HD2 ARG A 97 8.270 0.447 3.456 1.00 0.00 H new ATOM 0 HD3 ARG A 97 8.053 -1.292 3.443 1.00 0.00 H new ATOM 0 HE ARG A 97 7.943 0.458 5.779 1.00 0.00 H new ATOM 0 HH11 ARG A 97 8.780 -2.818 4.706 1.00 0.00 H new ATOM 0 HH12 ARG A 97 8.496 -3.540 6.293 1.00 0.00 H new ATOM 0 HH21 ARG A 97 7.575 -0.474 7.832 1.00 0.00 H new ATOM 0 HH22 ARG A 97 7.812 -2.209 8.068 1.00 0.00 H new ATOM 1455 N THR A 98 13.195 -0.570 0.921 1.00 0.00 N ATOM 1456 CA THR A 98 14.235 -1.044 0.025 1.00 0.00 C ATOM 1457 C THR A 98 14.731 -2.423 0.464 1.00 0.00 C ATOM 1458 O THR A 98 15.212 -2.586 1.584 1.00 0.00 O ATOM 1459 CB THR A 98 15.340 0.014 -0.018 1.00 0.00 C ATOM 1460 OG1 THR A 98 15.507 0.396 1.345 1.00 0.00 O ATOM 1461 CG2 THR A 98 14.893 1.300 -0.714 1.00 0.00 C ATOM 0 H THR A 98 13.510 -0.366 1.870 1.00 0.00 H new ATOM 0 HA THR A 98 13.853 -1.178 -0.987 1.00 0.00 H new ATOM 0 HB THR A 98 16.211 -0.392 -0.532 1.00 0.00 H new ATOM 0 HG1 THR A 98 15.537 -0.406 1.908 1.00 0.00 H new ATOM 0 HG21 THR A 98 15.714 2.017 -0.717 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.603 1.076 -1.741 1.00 0.00 H new ATOM 0 HG23 THR A 98 14.042 1.725 -0.181 1.00 0.00 H new ATOM 1469 N CYS A 99 14.596 -3.381 -0.441 1.00 0.00 N ATOM 1470 CA CYS A 99 15.024 -4.741 -0.161 1.00 0.00 C ATOM 1471 C CYS A 99 16.478 -4.699 0.315 1.00 0.00 C ATOM 1472 O CYS A 99 17.395 -4.554 -0.492 1.00 0.00 O ATOM 1473 CB CYS A 99 14.848 -5.652 -1.378 1.00 0.00 C ATOM 1474 SG CYS A 99 15.493 -7.324 -1.007 1.00 0.00 S ATOM 0 H CYS A 99 14.196 -3.242 -1.369 1.00 0.00 H new ATOM 0 HA CYS A 99 14.398 -5.167 0.623 1.00 0.00 H new ATOM 0 HB2 CYS A 99 13.794 -5.712 -1.648 1.00 0.00 H new ATOM 0 HB3 CYS A 99 15.374 -5.232 -2.236 1.00 0.00 H new ATOM 0 HG CYS A 99 15.337 -8.090 -2.046 1.00 0.00 H new ATOM 1480 N ASP A 100 16.643 -4.828 1.623 1.00 0.00 N ATOM 1481 CA ASP A 100 17.969 -4.807 2.216 1.00 0.00 C ATOM 1482 C ASP A 100 18.169 -6.071 3.053 1.00 0.00 C ATOM 1483 O ASP A 100 17.297 -6.938 3.094 1.00 0.00 O ATOM 1484 CB ASP A 100 18.141 -3.597 3.137 1.00 0.00 C ATOM 1485 CG ASP A 100 18.776 -2.370 2.480 1.00 0.00 C ATOM 1486 OD1 ASP A 100 20.025 -2.313 2.471 1.00 0.00 O ATOM 1487 OD2 ASP A 100 17.999 -1.516 2.002 1.00 0.00 O ATOM 0 H ASP A 100 15.880 -4.948 2.289 1.00 0.00 H new ATOM 0 HA ASP A 100 18.699 -4.752 1.408 1.00 0.00 H new ATOM 0 HB2 ASP A 100 17.164 -3.316 3.529 1.00 0.00 H new ATOM 0 HB3 ASP A 100 18.753 -3.892 3.989 1.00 0.00 H new ATOM 1492 N ARG A 101 19.323 -6.137 3.701 1.00 0.00 N ATOM 1493 CA ARG A 101 19.649 -7.281 4.535 1.00 0.00 C ATOM 1494 C ARG A 101 18.524 -7.544 5.538 1.00 0.00 C ATOM 1495 O ARG A 101 17.971 -8.642 5.582 1.00 0.00 O ATOM 1496 CB ARG A 101 20.958 -7.054 5.295 1.00 0.00 C ATOM 1497 CG ARG A 101 21.574 -8.384 5.734 1.00 0.00 C ATOM 1498 CD ARG A 101 22.875 -8.156 6.507 1.00 0.00 C ATOM 1499 NE ARG A 101 23.930 -9.063 6.001 1.00 0.00 N ATOM 1500 CZ ARG A 101 24.714 -8.790 4.949 1.00 0.00 C ATOM 1501 NH1 ARG A 101 24.566 -7.635 4.285 1.00 0.00 N ATOM 1502 NH2 ARG A 101 25.645 -9.672 4.560 1.00 0.00 N ATOM 0 H ARG A 101 20.044 -5.416 3.665 1.00 0.00 H new ATOM 0 HA ARG A 101 19.767 -8.145 3.881 1.00 0.00 H new ATOM 0 HB2 ARG A 101 21.662 -6.515 4.661 1.00 0.00 H new ATOM 0 HB3 ARG A 101 20.772 -6.429 6.169 1.00 0.00 H new ATOM 0 HG2 ARG A 101 20.866 -8.928 6.359 1.00 0.00 H new ATOM 0 HG3 ARG A 101 21.770 -9.005 4.860 1.00 0.00 H new ATOM 0 HD2 ARG A 101 23.194 -7.119 6.401 1.00 0.00 H new ATOM 0 HD3 ARG A 101 22.712 -8.332 7.570 1.00 0.00 H new ATOM 0 HE ARG A 101 24.069 -9.951 6.483 1.00 0.00 H new ATOM 0 HH11 ARG A 101 23.857 -6.964 4.581 1.00 0.00 H new ATOM 0 HH12 ARG A 101 25.163 -7.427 3.484 1.00 0.00 H new ATOM 0 HH21 ARG A 101 25.757 -10.551 5.065 1.00 0.00 H new ATOM 0 HH22 ARG A 101 26.242 -9.464 3.759 1.00 0.00 H new ATOM 1516 N PHE A 102 18.219 -6.518 6.319 1.00 0.00 N ATOM 1517 CA PHE A 102 17.170 -6.625 7.319 1.00 0.00 C ATOM 1518 C PHE A 102 16.026 -5.654 7.019 1.00 0.00 C ATOM 1519 O PHE A 102 14.860 -5.975 7.242 1.00 0.00 O ATOM 1520 CB PHE A 102 17.796 -6.255 8.665 1.00 0.00 C ATOM 1521 CG PHE A 102 18.627 -7.376 9.293 1.00 0.00 C ATOM 1522 CD1 PHE A 102 18.012 -8.374 9.983 1.00 0.00 C ATOM 1523 CD2 PHE A 102 19.981 -7.375 9.162 1.00 0.00 C ATOM 1524 CE1 PHE A 102 18.783 -9.414 10.566 1.00 0.00 C ATOM 1525 CE2 PHE A 102 20.752 -8.415 9.745 1.00 0.00 C ATOM 1526 CZ PHE A 102 20.137 -9.413 10.434 1.00 0.00 C ATOM 0 H PHE A 102 18.680 -5.609 6.280 1.00 0.00 H new ATOM 0 HA PHE A 102 16.762 -7.636 7.324 1.00 0.00 H new ATOM 0 HB2 PHE A 102 18.430 -5.378 8.531 1.00 0.00 H new ATOM 0 HB3 PHE A 102 17.003 -5.972 9.358 1.00 0.00 H new ATOM 0 HD1 PHE A 102 16.937 -8.375 10.087 1.00 0.00 H new ATOM 0 HD2 PHE A 102 20.470 -6.583 8.614 1.00 0.00 H new ATOM 0 HE1 PHE A 102 18.295 -10.206 11.114 1.00 0.00 H new ATOM 0 HE2 PHE A 102 21.827 -8.413 9.641 1.00 0.00 H new ATOM 0 HZ PHE A 102 20.723 -10.205 10.876 1.00 0.00 H new ATOM 1536 N SER A 103 16.400 -4.486 6.517 1.00 0.00 N ATOM 1537 CA SER A 103 15.420 -3.467 6.184 1.00 0.00 C ATOM 1538 C SER A 103 14.723 -2.976 7.454 1.00 0.00 C ATOM 1539 O SER A 103 13.495 -2.968 7.529 1.00 0.00 O ATOM 1540 CB SER A 103 14.390 -3.998 5.185 1.00 0.00 C ATOM 1541 OG SER A 103 14.987 -4.357 3.942 1.00 0.00 O ATOM 0 H SER A 103 17.368 -4.223 6.333 1.00 0.00 H new ATOM 0 HA SER A 103 15.942 -2.631 5.717 1.00 0.00 H new ATOM 0 HB2 SER A 103 13.887 -4.867 5.610 1.00 0.00 H new ATOM 0 HB3 SER A 103 13.626 -3.240 5.014 1.00 0.00 H new ATOM 0 HG SER A 103 14.936 -3.599 3.323 1.00 0.00 H new ATOM 1547 N ARG A 104 15.536 -2.578 8.421 1.00 0.00 N ATOM 1548 CA ARG A 104 15.013 -2.087 9.685 1.00 0.00 C ATOM 1549 C ARG A 104 14.326 -0.735 9.485 1.00 0.00 C ATOM 1550 O ARG A 104 14.406 -0.147 8.407 1.00 0.00 O ATOM 1551 CB ARG A 104 16.128 -1.936 10.721 1.00 0.00 C ATOM 1552 CG ARG A 104 16.299 -3.222 11.534 1.00 0.00 C ATOM 1553 CD ARG A 104 17.557 -3.979 11.103 1.00 0.00 C ATOM 1554 NE ARG A 104 18.713 -3.548 11.922 1.00 0.00 N ATOM 1555 CZ ARG A 104 19.961 -4.007 11.759 1.00 0.00 C ATOM 1556 NH1 ARG A 104 20.223 -4.914 10.808 1.00 0.00 N ATOM 1557 NH2 ARG A 104 20.947 -3.560 12.548 1.00 0.00 N ATOM 0 H ARG A 104 16.554 -2.585 8.355 1.00 0.00 H new ATOM 0 HA ARG A 104 14.290 -2.816 10.050 1.00 0.00 H new ATOM 0 HB2 ARG A 104 17.064 -1.691 10.220 1.00 0.00 H new ATOM 0 HB3 ARG A 104 15.898 -1.107 11.390 1.00 0.00 H new ATOM 0 HG2 ARG A 104 16.361 -2.980 12.595 1.00 0.00 H new ATOM 0 HG3 ARG A 104 15.424 -3.859 11.403 1.00 0.00 H new ATOM 0 HD2 ARG A 104 17.402 -5.052 11.215 1.00 0.00 H new ATOM 0 HD3 ARG A 104 17.759 -3.794 10.048 1.00 0.00 H new ATOM 0 HE ARG A 104 18.549 -2.859 12.656 1.00 0.00 H new ATOM 0 HH11 ARG A 104 19.472 -5.255 10.208 1.00 0.00 H new ATOM 0 HH12 ARG A 104 21.173 -5.263 10.684 1.00 0.00 H new ATOM 0 HH21 ARG A 104 20.747 -2.870 13.273 1.00 0.00 H new ATOM 0 HH22 ARG A 104 21.897 -3.909 12.424 1.00 0.00 H new ATOM 1571 N HIS A 105 13.666 -0.281 10.540 1.00 0.00 N ATOM 1572 CA HIS A 105 12.965 0.991 10.494 1.00 0.00 C ATOM 1573 C HIS A 105 13.813 2.017 9.739 1.00 0.00 C ATOM 1574 O HIS A 105 14.868 2.428 10.218 1.00 0.00 O ATOM 1575 CB HIS A 105 12.588 1.455 11.903 1.00 0.00 C ATOM 1576 CG HIS A 105 11.755 0.459 12.675 1.00 0.00 C ATOM 1577 ND1 HIS A 105 12.290 -0.379 13.637 1.00 0.00 N ATOM 1578 CD2 HIS A 105 10.422 0.178 12.617 1.00 0.00 C ATOM 1579 CE1 HIS A 105 11.314 -1.127 14.129 1.00 0.00 C ATOM 1580 NE2 HIS A 105 10.157 -0.782 13.495 1.00 0.00 N ATOM 0 H HIS A 105 13.602 -0.771 11.432 1.00 0.00 H new ATOM 0 HA HIS A 105 12.028 0.874 9.950 1.00 0.00 H new ATOM 0 HB2 HIS A 105 13.500 1.662 12.463 1.00 0.00 H new ATOM 0 HB3 HIS A 105 12.039 2.394 11.831 1.00 0.00 H new ATOM 0 HD2 HIS A 105 9.704 0.655 11.967 1.00 0.00 H new ATOM 0 HE1 HIS A 105 11.417 -1.879 14.898 1.00 0.00 H new ATOM 0 HE2 HIS A 105 9.240 -1.193 13.667 1.00 0.00 H new ATOM 1588 N SER A 106 13.318 2.401 8.572 1.00 0.00 N ATOM 1589 CA SER A 106 14.017 3.371 7.746 1.00 0.00 C ATOM 1590 C SER A 106 13.034 4.049 6.789 1.00 0.00 C ATOM 1591 O SER A 106 12.832 5.260 6.855 1.00 0.00 O ATOM 1592 CB SER A 106 15.152 2.711 6.961 1.00 0.00 C ATOM 1593 OG SER A 106 16.434 3.115 7.434 1.00 0.00 O ATOM 0 H SER A 106 12.442 2.058 8.179 1.00 0.00 H new ATOM 0 HA SER A 106 14.455 4.124 8.401 1.00 0.00 H new ATOM 0 HB2 SER A 106 15.063 1.627 7.037 1.00 0.00 H new ATOM 0 HB3 SER A 106 15.058 2.966 5.905 1.00 0.00 H new ATOM 0 HG SER A 106 17.132 2.671 6.908 1.00 0.00 H new ATOM 1599 N VAL A 107 12.448 3.237 5.921 1.00 0.00 N ATOM 1600 CA VAL A 107 11.491 3.742 4.952 1.00 0.00 C ATOM 1601 C VAL A 107 12.199 4.705 3.997 1.00 0.00 C ATOM 1602 O VAL A 107 12.813 5.678 4.433 1.00 0.00 O ATOM 1603 CB VAL A 107 10.303 4.382 5.674 1.00 0.00 C ATOM 1604 CG1 VAL A 107 9.537 5.323 4.742 1.00 0.00 C ATOM 1605 CG2 VAL A 107 9.376 3.314 6.257 1.00 0.00 C ATOM 0 H VAL A 107 12.618 2.233 5.869 1.00 0.00 H new ATOM 0 HA VAL A 107 11.088 2.926 4.352 1.00 0.00 H new ATOM 0 HB VAL A 107 10.694 4.975 6.501 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.698 5.764 5.280 1.00 0.00 H new ATOM 0 HG12 VAL A 107 10.203 6.114 4.396 1.00 0.00 H new ATOM 0 HG13 VAL A 107 9.164 4.762 3.885 1.00 0.00 H new ATOM 0 HG21 VAL A 107 8.540 3.795 6.765 1.00 0.00 H new ATOM 0 HG22 VAL A 107 8.997 2.683 5.453 1.00 0.00 H new ATOM 0 HG23 VAL A 107 9.929 2.702 6.969 1.00 0.00 H new ATOM 1615 N ALA A 108 12.090 4.400 2.712 1.00 0.00 N ATOM 1616 CA ALA A 108 12.712 5.227 1.692 1.00 0.00 C ATOM 1617 C ALA A 108 11.814 6.429 1.397 1.00 0.00 C ATOM 1618 O ALA A 108 12.227 7.366 0.715 1.00 0.00 O ATOM 1619 CB ALA A 108 12.983 4.382 0.445 1.00 0.00 C ATOM 0 H ALA A 108 11.580 3.592 2.354 1.00 0.00 H new ATOM 0 HA ALA A 108 13.671 5.610 2.042 1.00 0.00 H new ATOM 0 HB1 ALA A 108 13.450 5.002 -0.320 1.00 0.00 H new ATOM 0 HB2 ALA A 108 13.650 3.559 0.701 1.00 0.00 H new ATOM 0 HB3 ALA A 108 12.043 3.983 0.065 1.00 0.00 H new ATOM 1625 N GLY A 109 10.601 6.365 1.926 1.00 0.00 N ATOM 1626 CA GLY A 109 9.640 7.437 1.728 1.00 0.00 C ATOM 1627 C GLY A 109 8.284 7.078 2.340 1.00 0.00 C ATOM 1628 O GLY A 109 7.896 5.911 2.356 1.00 0.00 O ATOM 0 H GLY A 109 10.261 5.587 2.492 1.00 0.00 H new ATOM 0 HA2 GLY A 109 10.016 8.355 2.180 1.00 0.00 H new ATOM 0 HA3 GLY A 109 9.522 7.632 0.662 1.00 0.00 H new ATOM 1632 N GLU A 110 7.602 8.103 2.829 1.00 0.00 N ATOM 1633 CA GLU A 110 6.298 7.910 3.441 1.00 0.00 C ATOM 1634 C GLU A 110 5.279 8.876 2.834 1.00 0.00 C ATOM 1635 O GLU A 110 5.510 10.084 2.795 1.00 0.00 O ATOM 1636 CB GLU A 110 6.374 8.076 4.959 1.00 0.00 C ATOM 1637 CG GLU A 110 6.369 6.717 5.661 1.00 0.00 C ATOM 1638 CD GLU A 110 7.202 6.758 6.944 1.00 0.00 C ATOM 1639 OE1 GLU A 110 8.274 7.401 6.904 1.00 0.00 O ATOM 1640 OE2 GLU A 110 6.749 6.146 7.935 1.00 0.00 O ATOM 0 H GLU A 110 7.928 9.070 2.814 1.00 0.00 H new ATOM 0 HA GLU A 110 5.970 6.891 3.237 1.00 0.00 H new ATOM 0 HB2 GLU A 110 7.279 8.622 5.224 1.00 0.00 H new ATOM 0 HB3 GLU A 110 5.529 8.671 5.306 1.00 0.00 H new ATOM 0 HG2 GLU A 110 5.344 6.430 5.898 1.00 0.00 H new ATOM 0 HG3 GLU A 110 6.766 5.956 4.990 1.00 0.00 H new ATOM 1647 N LEU A 111 4.173 8.309 2.375 1.00 0.00 N ATOM 1648 CA LEU A 111 3.118 9.106 1.772 1.00 0.00 C ATOM 1649 C LEU A 111 1.784 8.767 2.440 1.00 0.00 C ATOM 1650 O LEU A 111 1.218 7.701 2.201 1.00 0.00 O ATOM 1651 CB LEU A 111 3.109 8.921 0.253 1.00 0.00 C ATOM 1652 CG LEU A 111 2.978 10.200 -0.577 1.00 0.00 C ATOM 1653 CD1 LEU A 111 2.042 11.201 0.103 1.00 0.00 C ATOM 1654 CD2 LEU A 111 4.352 10.807 -0.869 1.00 0.00 C ATOM 0 H LEU A 111 3.984 7.307 2.409 1.00 0.00 H new ATOM 0 HA LEU A 111 3.299 10.168 1.940 1.00 0.00 H new ATOM 0 HB2 LEU A 111 4.030 8.416 -0.037 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.285 8.256 -0.007 1.00 0.00 H new ATOM 0 HG LEU A 111 2.530 9.941 -1.536 1.00 0.00 H new ATOM 0 HD11 LEU A 111 1.966 12.101 -0.507 1.00 0.00 H new ATOM 0 HD12 LEU A 111 1.054 10.756 0.217 1.00 0.00 H new ATOM 0 HD13 LEU A 111 2.438 11.461 1.085 1.00 0.00 H new ATOM 0 HD21 LEU A 111 4.231 11.715 -1.460 1.00 0.00 H new ATOM 0 HD22 LEU A 111 4.850 11.049 0.070 1.00 0.00 H new ATOM 0 HD23 LEU A 111 4.956 10.090 -1.425 1.00 0.00 H new ATOM 1666 N ARG A 112 1.319 9.694 3.265 1.00 0.00 N ATOM 1667 CA ARG A 112 0.063 9.507 3.970 1.00 0.00 C ATOM 1668 C ARG A 112 -1.075 10.201 3.219 1.00 0.00 C ATOM 1669 O ARG A 112 -0.907 11.313 2.719 1.00 0.00 O ATOM 1670 CB ARG A 112 0.140 10.065 5.392 1.00 0.00 C ATOM 1671 CG ARG A 112 -1.227 10.012 6.077 1.00 0.00 C ATOM 1672 CD ARG A 112 -1.146 9.255 7.404 1.00 0.00 C ATOM 1673 NE ARG A 112 -1.515 10.152 8.522 1.00 0.00 N ATOM 1674 CZ ARG A 112 -0.759 11.174 8.946 1.00 0.00 C ATOM 1675 NH1 ARG A 112 0.411 11.435 8.347 1.00 0.00 N ATOM 1676 NH2 ARG A 112 -1.173 11.935 9.968 1.00 0.00 N ATOM 0 H ARG A 112 1.790 10.577 3.461 1.00 0.00 H new ATOM 0 HA ARG A 112 -0.131 8.436 4.023 1.00 0.00 H new ATOM 0 HB2 ARG A 112 0.864 9.493 5.972 1.00 0.00 H new ATOM 0 HB3 ARG A 112 0.497 11.095 5.364 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -1.589 11.025 6.254 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -1.948 9.526 5.420 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -1.814 8.394 7.382 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -0.136 8.872 7.552 1.00 0.00 H new ATOM 0 HE ARG A 112 -2.400 9.982 9.000 1.00 0.00 H new ATOM 0 HH11 ARG A 112 0.726 10.856 7.569 1.00 0.00 H new ATOM 0 HH12 ARG A 112 0.987 12.213 8.669 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -2.064 11.737 10.424 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -0.597 12.713 10.291 1.00 0.00 H new ATOM 1690 N LEU A 113 -2.208 9.517 3.162 1.00 0.00 N ATOM 1691 CA LEU A 113 -3.374 10.054 2.480 1.00 0.00 C ATOM 1692 C LEU A 113 -4.583 9.984 3.415 1.00 0.00 C ATOM 1693 O LEU A 113 -4.497 9.424 4.506 1.00 0.00 O ATOM 1694 CB LEU A 113 -3.588 9.342 1.143 1.00 0.00 C ATOM 1695 CG LEU A 113 -2.408 9.375 0.169 1.00 0.00 C ATOM 1696 CD1 LEU A 113 -2.168 10.792 -0.353 1.00 0.00 C ATOM 1697 CD2 LEU A 113 -1.153 8.778 0.809 1.00 0.00 C ATOM 0 H LEU A 113 -2.344 8.595 3.577 1.00 0.00 H new ATOM 0 HA LEU A 113 -3.221 11.105 2.234 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -3.838 8.300 1.345 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -4.452 9.788 0.651 1.00 0.00 H new ATOM 0 HG LEU A 113 -2.657 8.754 -0.691 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -1.324 10.788 -1.043 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -3.059 11.144 -0.872 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -1.949 11.456 0.483 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -0.329 8.813 0.096 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -0.889 9.352 1.697 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -1.345 7.743 1.090 1.00 0.00 H new ATOM 1709 N GLY A 114 -5.682 10.562 2.952 1.00 0.00 N ATOM 1710 CA GLY A 114 -6.908 10.572 3.733 1.00 0.00 C ATOM 1711 C GLY A 114 -8.047 9.889 2.974 1.00 0.00 C ATOM 1712 O GLY A 114 -8.221 10.110 1.777 1.00 0.00 O ATOM 0 H GLY A 114 -5.749 11.027 2.046 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -6.743 10.063 4.683 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -7.186 11.600 3.966 1.00 0.00 H new ATOM 1716 N LEU A 115 -8.794 9.072 3.703 1.00 0.00 N ATOM 1717 CA LEU A 115 -9.912 8.355 3.113 1.00 0.00 C ATOM 1718 C LEU A 115 -11.204 9.135 3.368 1.00 0.00 C ATOM 1719 O LEU A 115 -12.296 8.635 3.105 1.00 0.00 O ATOM 1720 CB LEU A 115 -9.953 6.914 3.624 1.00 0.00 C ATOM 1721 CG LEU A 115 -8.606 6.192 3.706 1.00 0.00 C ATOM 1722 CD1 LEU A 115 -8.776 4.775 4.255 1.00 0.00 C ATOM 1723 CD2 LEU A 115 -7.897 6.200 2.350 1.00 0.00 C ATOM 0 H LEU A 115 -8.647 8.891 4.696 1.00 0.00 H new ATOM 0 HA LEU A 115 -9.791 8.283 2.032 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.403 6.914 4.617 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -10.612 6.338 2.975 1.00 0.00 H new ATOM 0 HG LEU A 115 -7.970 6.734 4.406 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -7.804 4.284 4.303 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -9.209 4.821 5.254 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -9.437 4.208 3.600 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -6.942 5.681 2.435 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -8.520 5.696 1.611 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -7.723 7.229 2.036 1.00 0.00 H new ATOM 1735 N ASP A 116 -11.035 10.347 3.876 1.00 0.00 N ATOM 1736 CA ASP A 116 -12.174 11.200 4.169 1.00 0.00 C ATOM 1737 C ASP A 116 -12.466 12.087 2.957 1.00 0.00 C ATOM 1738 O ASP A 116 -13.560 12.636 2.835 1.00 0.00 O ATOM 1739 CB ASP A 116 -11.886 12.112 5.364 1.00 0.00 C ATOM 1740 CG ASP A 116 -12.781 13.349 5.463 1.00 0.00 C ATOM 1741 OD1 ASP A 116 -12.514 14.305 4.703 1.00 0.00 O ATOM 1742 OD2 ASP A 116 -13.711 13.311 6.297 1.00 0.00 O ATOM 0 H ASP A 116 -10.127 10.758 4.092 1.00 0.00 H new ATOM 0 HA ASP A 116 -13.025 10.559 4.401 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -11.993 11.531 6.280 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -10.847 12.437 5.312 1.00 0.00 H new ATOM 1747 N GLY A 117 -11.469 12.200 2.092 1.00 0.00 N ATOM 1748 CA GLY A 117 -11.606 13.010 0.894 1.00 0.00 C ATOM 1749 C GLY A 117 -11.327 14.484 1.195 1.00 0.00 C ATOM 1750 O GLY A 117 -12.220 15.323 1.086 1.00 0.00 O ATOM 0 H GLY A 117 -10.563 11.744 2.197 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -10.916 12.654 0.129 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -12.613 12.902 0.490 1.00 0.00 H new ATOM 1754 N THR A 118 -10.085 14.755 1.568 1.00 0.00 N ATOM 1755 CA THR A 118 -9.678 16.113 1.885 1.00 0.00 C ATOM 1756 C THR A 118 -8.268 16.384 1.357 1.00 0.00 C ATOM 1757 O THR A 118 -8.103 16.982 0.294 1.00 0.00 O ATOM 1758 CB THR A 118 -9.807 16.304 3.397 1.00 0.00 C ATOM 1759 OG1 THR A 118 -11.189 16.593 3.594 1.00 0.00 O ATOM 1760 CG2 THR A 118 -9.090 17.562 3.892 1.00 0.00 C ATOM 0 H THR A 118 -9.347 14.057 1.658 1.00 0.00 H new ATOM 0 HA THR A 118 -10.321 16.843 1.394 1.00 0.00 H new ATOM 0 HB THR A 118 -9.403 15.430 3.908 1.00 0.00 H new ATOM 0 HG1 THR A 118 -11.634 15.813 3.986 1.00 0.00 H new ATOM 0 HG21 THR A 118 -9.213 17.650 4.971 1.00 0.00 H new ATOM 0 HG22 THR A 118 -8.029 17.494 3.652 1.00 0.00 H new ATOM 0 HG23 THR A 118 -9.517 18.439 3.406 1.00 0.00 H new ATOM 1768 N SER A 119 -7.286 15.932 2.123 1.00 0.00 N ATOM 1769 CA SER A 119 -5.895 16.118 1.745 1.00 0.00 C ATOM 1770 C SER A 119 -5.660 15.579 0.333 1.00 0.00 C ATOM 1771 O SER A 119 -4.897 16.159 -0.438 1.00 0.00 O ATOM 1772 CB SER A 119 -4.958 15.430 2.739 1.00 0.00 C ATOM 1773 OG SER A 119 -4.711 16.238 3.887 1.00 0.00 O ATOM 0 H SER A 119 -7.426 15.437 3.004 1.00 0.00 H new ATOM 0 HA SER A 119 -5.676 17.186 1.760 1.00 0.00 H new ATOM 0 HB2 SER A 119 -5.394 14.481 3.051 1.00 0.00 H new ATOM 0 HB3 SER A 119 -4.013 15.200 2.247 1.00 0.00 H new ATOM 0 HG SER A 119 -4.110 15.763 4.498 1.00 0.00 H new ATOM 1779 N VAL A 120 -6.330 14.475 0.036 1.00 0.00 N ATOM 1780 CA VAL A 120 -6.203 13.851 -1.270 1.00 0.00 C ATOM 1781 C VAL A 120 -7.558 13.280 -1.691 1.00 0.00 C ATOM 1782 O VAL A 120 -8.197 12.560 -0.925 1.00 0.00 O ATOM 1783 CB VAL A 120 -5.093 12.799 -1.242 1.00 0.00 C ATOM 1784 CG1 VAL A 120 -5.187 11.936 0.019 1.00 0.00 C ATOM 1785 CG2 VAL A 120 -5.126 11.933 -2.502 1.00 0.00 C ATOM 0 H VAL A 120 -6.962 13.997 0.678 1.00 0.00 H new ATOM 0 HA VAL A 120 -5.914 14.588 -2.019 1.00 0.00 H new ATOM 0 HB VAL A 120 -4.137 13.322 -1.220 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -4.387 11.196 0.014 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -5.091 12.569 0.901 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -6.151 11.427 0.041 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.327 11.194 -2.456 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -6.088 11.424 -2.569 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -4.987 12.563 -3.380 1.00 0.00 H new ATOM 1795 N PRO A 121 -7.967 13.631 -2.940 1.00 0.00 N ATOM 1796 CA PRO A 121 -9.234 13.160 -3.472 1.00 0.00 C ATOM 1797 C PRO A 121 -9.147 11.688 -3.877 1.00 0.00 C ATOM 1798 O PRO A 121 -8.062 11.108 -3.894 1.00 0.00 O ATOM 1799 CB PRO A 121 -9.535 14.081 -4.643 1.00 0.00 C ATOM 1800 CG PRO A 121 -8.212 14.732 -5.012 1.00 0.00 C ATOM 1801 CD PRO A 121 -7.236 14.481 -3.875 1.00 0.00 C ATOM 0 HA PRO A 121 -10.038 13.196 -2.736 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -9.943 13.522 -5.485 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.277 14.831 -4.369 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -7.828 14.316 -5.943 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -8.345 15.802 -5.172 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -6.330 13.990 -4.232 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -6.928 15.415 -3.404 1.00 0.00 H new ATOM 1809 N LEU A 122 -10.303 11.124 -4.194 1.00 0.00 N ATOM 1810 CA LEU A 122 -10.371 9.730 -4.598 1.00 0.00 C ATOM 1811 C LEU A 122 -10.426 9.648 -6.125 1.00 0.00 C ATOM 1812 O LEU A 122 -10.874 10.585 -6.785 1.00 0.00 O ATOM 1813 CB LEU A 122 -11.537 9.026 -3.902 1.00 0.00 C ATOM 1814 CG LEU A 122 -11.342 8.715 -2.416 1.00 0.00 C ATOM 1815 CD1 LEU A 122 -12.669 8.329 -1.759 1.00 0.00 C ATOM 1816 CD2 LEU A 122 -10.270 7.643 -2.217 1.00 0.00 C ATOM 0 H LEU A 122 -11.201 11.608 -4.179 1.00 0.00 H new ATOM 0 HA LEU A 122 -9.474 9.198 -4.282 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -12.427 9.647 -4.009 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -11.736 8.091 -4.426 1.00 0.00 H new ATOM 0 HG LEU A 122 -10.988 9.619 -1.920 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.503 8.113 -0.704 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -13.375 9.154 -1.854 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -13.075 7.445 -2.251 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -10.151 7.441 -1.153 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -10.570 6.729 -2.729 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -9.323 7.994 -2.628 1.00 0.00 H new ATOM 1828 N GLY A 123 -9.965 8.519 -6.642 1.00 0.00 N ATOM 1829 CA GLY A 123 -9.956 8.302 -8.079 1.00 0.00 C ATOM 1830 C GLY A 123 -9.145 9.386 -8.792 1.00 0.00 C ATOM 1831 O GLY A 123 -9.272 9.566 -10.002 1.00 0.00 O ATOM 0 H GLY A 123 -9.595 7.744 -6.091 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -9.533 7.322 -8.300 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -10.979 8.300 -8.457 1.00 0.00 H new ATOM 1835 N ALA A 124 -8.329 10.079 -8.011 1.00 0.00 N ATOM 1836 CA ALA A 124 -7.497 11.140 -8.553 1.00 0.00 C ATOM 1837 C ALA A 124 -6.044 10.908 -8.132 1.00 0.00 C ATOM 1838 O ALA A 124 -5.674 11.181 -6.991 1.00 0.00 O ATOM 1839 CB ALA A 124 -8.030 12.496 -8.086 1.00 0.00 C ATOM 0 H ALA A 124 -8.226 9.927 -7.008 1.00 0.00 H new ATOM 0 HA ALA A 124 -7.530 11.135 -9.643 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -7.406 13.292 -8.493 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -9.055 12.624 -8.435 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -8.010 12.539 -6.997 1.00 0.00 H new ATOM 1845 N ALA A 125 -5.261 10.407 -9.075 1.00 0.00 N ATOM 1846 CA ALA A 125 -3.857 10.136 -8.817 1.00 0.00 C ATOM 1847 C ALA A 125 -3.131 11.452 -8.535 1.00 0.00 C ATOM 1848 O ALA A 125 -3.338 12.442 -9.235 1.00 0.00 O ATOM 1849 CB ALA A 125 -3.256 9.380 -10.003 1.00 0.00 C ATOM 0 H ALA A 125 -5.572 10.181 -10.020 1.00 0.00 H new ATOM 0 HA ALA A 125 -3.744 9.503 -7.937 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -2.203 9.177 -9.809 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -3.788 8.439 -10.141 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -3.349 9.985 -10.905 1.00 0.00 H new ATOM 1855 N GLN A 126 -2.294 11.422 -7.508 1.00 0.00 N ATOM 1856 CA GLN A 126 -1.536 12.601 -7.125 1.00 0.00 C ATOM 1857 C GLN A 126 -0.045 12.270 -7.043 1.00 0.00 C ATOM 1858 O GLN A 126 0.330 11.176 -6.622 1.00 0.00 O ATOM 1859 CB GLN A 126 -2.044 13.173 -5.800 1.00 0.00 C ATOM 1860 CG GLN A 126 -3.574 13.209 -5.768 1.00 0.00 C ATOM 1861 CD GLN A 126 -4.100 14.566 -6.242 1.00 0.00 C ATOM 1862 OE1 GLN A 126 -3.416 15.575 -6.199 1.00 0.00 O ATOM 1863 NE2 GLN A 126 -5.350 14.533 -6.695 1.00 0.00 N ATOM 0 H GLN A 126 -2.124 10.599 -6.929 1.00 0.00 H new ATOM 0 HA GLN A 126 -1.677 13.364 -7.890 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -1.674 12.568 -4.973 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -1.650 14.180 -5.660 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -3.973 12.418 -6.403 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -3.925 13.012 -4.755 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -5.866 13.653 -6.703 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -5.792 15.387 -7.034 1.00 0.00 H new ATOM 1872 N TRP A 127 0.766 13.234 -7.453 1.00 0.00 N ATOM 1873 CA TRP A 127 2.208 13.058 -7.431 1.00 0.00 C ATOM 1874 C TRP A 127 2.729 13.583 -6.092 1.00 0.00 C ATOM 1875 O TRP A 127 3.521 14.524 -6.055 1.00 0.00 O ATOM 1876 CB TRP A 127 2.862 13.740 -8.635 1.00 0.00 C ATOM 1877 CG TRP A 127 3.065 12.818 -9.839 1.00 0.00 C ATOM 1878 CD1 TRP A 127 2.427 12.845 -11.016 1.00 0.00 C ATOM 1879 CD2 TRP A 127 4.002 11.724 -9.934 1.00 0.00 C ATOM 1880 NE1 TRP A 127 2.881 11.852 -11.861 1.00 0.00 N ATOM 1881 CE2 TRP A 127 3.869 11.149 -11.182 1.00 0.00 C ATOM 1882 CE3 TRP A 127 4.930 11.236 -8.998 1.00 0.00 C ATOM 1883 CZ2 TRP A 127 4.633 10.055 -11.607 1.00 0.00 C ATOM 1884 CZ3 TRP A 127 5.686 10.143 -9.438 1.00 0.00 C ATOM 1885 CH2 TRP A 127 5.564 9.553 -10.691 1.00 0.00 C ATOM 0 H TRP A 127 0.452 14.139 -7.802 1.00 0.00 H new ATOM 0 HA TRP A 127 2.468 12.003 -7.516 1.00 0.00 H new ATOM 0 HB2 TRP A 127 2.246 14.587 -8.939 1.00 0.00 H new ATOM 0 HB3 TRP A 127 3.829 14.142 -8.331 1.00 0.00 H new ATOM 0 HD1 TRP A 127 1.654 13.555 -11.272 1.00 0.00 H new ATOM 0 HE1 TRP A 127 2.552 11.668 -12.809 1.00 0.00 H new ATOM 0 HE3 TRP A 127 5.050 11.670 -8.016 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 4.510 9.622 -12.589 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 6.415 9.729 -8.757 1.00 0.00 H new ATOM 0 HH2 TRP A 127 6.185 8.710 -10.956 1.00 0.00 H new ATOM 1896 N GLY A 128 2.262 12.952 -5.024 1.00 0.00 N ATOM 1897 CA GLY A 128 2.671 13.344 -3.686 1.00 0.00 C ATOM 1898 C GLY A 128 4.169 13.113 -3.480 1.00 0.00 C ATOM 1899 O GLY A 128 4.758 12.237 -4.112 1.00 0.00 O ATOM 0 H GLY A 128 1.605 12.173 -5.058 1.00 0.00 H new ATOM 0 HA2 GLY A 128 2.436 14.396 -3.524 1.00 0.00 H new ATOM 0 HA3 GLY A 128 2.107 12.774 -2.948 1.00 0.00 H new ATOM 1903 N GLU A 129 4.743 13.914 -2.594 1.00 0.00 N ATOM 1904 CA GLU A 129 6.161 13.808 -2.297 1.00 0.00 C ATOM 1905 C GLU A 129 6.383 12.904 -1.083 1.00 0.00 C ATOM 1906 O GLU A 129 5.796 13.125 -0.025 1.00 0.00 O ATOM 1907 CB GLU A 129 6.779 15.190 -2.073 1.00 0.00 C ATOM 1908 CG GLU A 129 7.493 15.682 -3.333 1.00 0.00 C ATOM 1909 CD GLU A 129 7.367 17.200 -3.477 1.00 0.00 C ATOM 1910 OE1 GLU A 129 6.253 17.646 -3.828 1.00 0.00 O ATOM 1911 OE2 GLU A 129 8.387 17.880 -3.233 1.00 0.00 O ATOM 0 H GLU A 129 4.251 14.639 -2.072 1.00 0.00 H new ATOM 0 HA GLU A 129 6.660 13.358 -3.156 1.00 0.00 H new ATOM 0 HB2 GLU A 129 6.001 15.899 -1.792 1.00 0.00 H new ATOM 0 HB3 GLU A 129 7.485 15.146 -1.244 1.00 0.00 H new ATOM 0 HG2 GLU A 129 8.546 15.403 -3.291 1.00 0.00 H new ATOM 0 HG3 GLU A 129 7.069 15.193 -4.210 1.00 0.00 H new ATOM 1918 N LEU A 130 7.232 11.905 -1.277 1.00 0.00 N ATOM 1919 CA LEU A 130 7.539 10.967 -0.210 1.00 0.00 C ATOM 1920 C LEU A 130 8.050 11.737 1.009 1.00 0.00 C ATOM 1921 O LEU A 130 8.844 12.666 0.873 1.00 0.00 O ATOM 1922 CB LEU A 130 8.505 9.889 -0.707 1.00 0.00 C ATOM 1923 CG LEU A 130 7.878 8.742 -1.502 1.00 0.00 C ATOM 1924 CD1 LEU A 130 8.957 7.858 -2.131 1.00 0.00 C ATOM 1925 CD2 LEU A 130 6.912 7.935 -0.632 1.00 0.00 C ATOM 0 H LEU A 130 7.716 11.725 -2.156 1.00 0.00 H new ATOM 0 HA LEU A 130 6.639 10.437 0.103 1.00 0.00 H new ATOM 0 HB2 LEU A 130 9.261 10.366 -1.330 1.00 0.00 H new ATOM 0 HB3 LEU A 130 9.022 9.467 0.155 1.00 0.00 H new ATOM 0 HG LEU A 130 7.295 9.170 -2.318 1.00 0.00 H new ATOM 0 HD11 LEU A 130 8.485 7.050 -2.690 1.00 0.00 H new ATOM 0 HD12 LEU A 130 9.570 8.456 -2.805 1.00 0.00 H new ATOM 0 HD13 LEU A 130 9.585 7.437 -1.346 1.00 0.00 H new ATOM 0 HD21 LEU A 130 6.480 7.126 -1.222 1.00 0.00 H new ATOM 0 HD22 LEU A 130 7.451 7.517 0.218 1.00 0.00 H new ATOM 0 HD23 LEU A 130 6.116 8.586 -0.272 1.00 0.00 H new ATOM 1937 N LYS A 131 7.573 11.322 2.173 1.00 0.00 N ATOM 1938 CA LYS A 131 7.972 11.960 3.416 1.00 0.00 C ATOM 1939 C LYS A 131 9.061 11.123 4.089 1.00 0.00 C ATOM 1940 O LYS A 131 8.885 10.657 5.213 1.00 0.00 O ATOM 1941 CB LYS A 131 6.752 12.211 4.305 1.00 0.00 C ATOM 1942 CG LYS A 131 5.789 13.202 3.648 1.00 0.00 C ATOM 1943 CD LYS A 131 6.328 14.631 3.734 1.00 0.00 C ATOM 1944 CE LYS A 131 6.563 15.213 2.339 1.00 0.00 C ATOM 1945 NZ LYS A 131 7.821 15.992 2.307 1.00 0.00 N ATOM 0 H LYS A 131 6.914 10.551 2.282 1.00 0.00 H new ATOM 0 HA LYS A 131 8.402 12.942 3.218 1.00 0.00 H new ATOM 0 HB2 LYS A 131 6.237 11.270 4.496 1.00 0.00 H new ATOM 0 HB3 LYS A 131 7.075 12.599 5.271 1.00 0.00 H new ATOM 0 HG2 LYS A 131 5.638 12.929 2.604 1.00 0.00 H new ATOM 0 HG3 LYS A 131 4.816 13.147 4.136 1.00 0.00 H new ATOM 0 HD2 LYS A 131 5.622 15.258 4.279 1.00 0.00 H new ATOM 0 HD3 LYS A 131 7.261 14.638 4.297 1.00 0.00 H new ATOM 0 HE2 LYS A 131 6.608 14.408 1.606 1.00 0.00 H new ATOM 0 HE3 LYS A 131 5.725 15.852 2.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 7.965 16.380 1.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 7.764 16.772 2.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 8.619 15.372 2.553 1.00 0.00 H new ATOM 1959 N THR A 132 10.162 10.956 3.371 1.00 0.00 N ATOM 1960 CA THR A 132 11.280 10.183 3.884 1.00 0.00 C ATOM 1961 C THR A 132 11.457 10.432 5.383 1.00 0.00 C ATOM 1962 O THR A 132 11.160 11.520 5.875 1.00 0.00 O ATOM 1963 CB THR A 132 12.519 10.536 3.059 1.00 0.00 C ATOM 1964 OG1 THR A 132 12.700 11.931 3.285 1.00 0.00 O ATOM 1965 CG2 THR A 132 12.268 10.432 1.553 1.00 0.00 C ATOM 0 H THR A 132 10.304 11.343 2.438 1.00 0.00 H new ATOM 0 HA THR A 132 11.100 9.113 3.783 1.00 0.00 H new ATOM 0 HB THR A 132 13.341 9.876 3.337 1.00 0.00 H new ATOM 0 HG1 THR A 132 13.484 12.244 2.788 1.00 0.00 H new ATOM 0 HG21 THR A 132 13.179 10.693 1.014 1.00 0.00 H new ATOM 0 HG22 THR A 132 11.977 9.412 1.302 1.00 0.00 H new ATOM 0 HG23 THR A 132 11.469 11.117 1.269 1.00 0.00 H new ATOM 1973 N SER A 133 11.942 9.406 6.068 1.00 0.00 N ATOM 1974 CA SER A 133 12.162 9.500 7.501 1.00 0.00 C ATOM 1975 C SER A 133 10.864 9.900 8.206 1.00 0.00 C ATOM 1976 O SER A 133 9.823 10.039 7.565 1.00 0.00 O ATOM 1977 CB SER A 133 13.271 10.504 7.823 1.00 0.00 C ATOM 1978 OG SER A 133 12.775 11.836 7.916 1.00 0.00 O ATOM 0 H SER A 133 12.189 8.506 5.657 1.00 0.00 H new ATOM 0 HA SER A 133 12.477 8.521 7.863 1.00 0.00 H new ATOM 0 HB2 SER A 133 13.748 10.228 8.764 1.00 0.00 H new ATOM 0 HB3 SER A 133 14.039 10.456 7.051 1.00 0.00 H new ATOM 0 HG SER A 133 12.286 12.061 7.097 1.00 0.00 H new ATOM 1984 N GLY A 134 10.968 10.075 9.515 1.00 0.00 N ATOM 1985 CA GLY A 134 9.815 10.456 10.313 1.00 0.00 C ATOM 1986 C GLY A 134 10.226 11.376 11.464 1.00 0.00 C ATOM 1987 O GLY A 134 11.387 11.769 11.566 1.00 0.00 O ATOM 0 H GLY A 134 11.833 9.960 10.043 1.00 0.00 H new ATOM 0 HA2 GLY A 134 9.083 10.961 9.683 1.00 0.00 H new ATOM 0 HA3 GLY A 134 9.332 9.563 10.711 1.00 0.00 H new ATOM 1991 N PRO A 135 9.224 11.703 12.324 1.00 0.00 N ATOM 1992 CA PRO A 135 9.469 12.570 13.464 1.00 0.00 C ATOM 1993 C PRO A 135 10.220 11.825 14.568 1.00 0.00 C ATOM 1994 O PRO A 135 11.284 12.262 15.004 1.00 0.00 O ATOM 1995 CB PRO A 135 8.092 13.046 13.899 1.00 0.00 C ATOM 1996 CG PRO A 135 7.101 12.069 13.287 1.00 0.00 C ATOM 1997 CD PRO A 135 7.836 11.257 12.234 1.00 0.00 C ATOM 0 HA PRO A 135 10.110 13.417 13.218 1.00 0.00 H new ATOM 0 HB2 PRO A 135 8.008 13.058 14.986 1.00 0.00 H new ATOM 0 HB3 PRO A 135 7.903 14.062 13.553 1.00 0.00 H new ATOM 0 HG2 PRO A 135 6.688 11.414 14.054 1.00 0.00 H new ATOM 0 HG3 PRO A 135 6.264 12.605 12.840 1.00 0.00 H new ATOM 0 HD2 PRO A 135 7.750 10.188 12.427 1.00 0.00 H new ATOM 0 HD3 PRO A 135 7.427 11.435 11.240 1.00 0.00 H new ATOM 2005 N SER A 136 9.638 10.712 14.989 1.00 0.00 N ATOM 2006 CA SER A 136 10.240 9.901 16.034 1.00 0.00 C ATOM 2007 C SER A 136 11.596 9.369 15.568 1.00 0.00 C ATOM 2008 O SER A 136 12.617 9.611 16.210 1.00 0.00 O ATOM 2009 CB SER A 136 9.322 8.743 16.430 1.00 0.00 C ATOM 2010 OG SER A 136 8.858 8.018 15.295 1.00 0.00 O ATOM 0 H SER A 136 8.755 10.352 14.625 1.00 0.00 H new ATOM 0 HA SER A 136 10.387 10.529 16.913 1.00 0.00 H new ATOM 0 HB2 SER A 136 9.857 8.068 17.097 1.00 0.00 H new ATOM 0 HB3 SER A 136 8.469 9.131 16.986 1.00 0.00 H new ATOM 0 HG SER A 136 8.277 7.286 15.590 1.00 0.00 H new ATOM 2016 N SER A 137 11.563 8.652 14.454 1.00 0.00 N ATOM 2017 CA SER A 137 12.777 8.083 13.894 1.00 0.00 C ATOM 2018 C SER A 137 13.374 7.063 14.867 1.00 0.00 C ATOM 2019 O SER A 137 13.686 7.398 16.008 1.00 0.00 O ATOM 2020 CB SER A 137 13.801 9.174 13.576 1.00 0.00 C ATOM 2021 OG SER A 137 14.655 8.805 12.496 1.00 0.00 O ATOM 0 H SER A 137 10.715 8.452 13.924 1.00 0.00 H new ATOM 0 HA SER A 137 12.520 7.580 12.962 1.00 0.00 H new ATOM 0 HB2 SER A 137 13.280 10.099 13.327 1.00 0.00 H new ATOM 0 HB3 SER A 137 14.403 9.376 14.462 1.00 0.00 H new ATOM 0 HG SER A 137 15.293 9.528 12.322 1.00 0.00 H new ATOM 2027 N GLY A 138 13.513 5.839 14.379 1.00 0.00 N ATOM 2028 CA GLY A 138 14.067 4.768 15.190 1.00 0.00 C ATOM 2029 C GLY A 138 13.487 3.413 14.779 1.00 0.00 C ATOM 2030 O GLY A 138 14.226 2.445 14.608 1.00 0.00 O ATOM 0 H GLY A 138 13.251 5.565 13.432 1.00 0.00 H new ATOM 0 HA2 GLY A 138 15.152 4.751 15.084 1.00 0.00 H new ATOM 0 HA3 GLY A 138 13.852 4.955 16.242 1.00 0.00 H new TER 2034 GLY A 138