USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 783 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 36 ASN : amide:sc= -0.419 K(o=-0.23,f=-6.1!) USER MOD Set 1.2: A 93 ASN : amide:sc= 0.19 X(o=-0.23,f=-0.6) USER MOD Set 2.1: A 57 ASN : amide:sc= -0.479 K(o=1.3,f=-1.9!) USER MOD Set 2.2: A 60 SER OG : rot -146:sc= 1.01 USER MOD Set 2.3: A 104 ASN : amide:sc= 0.742 K(o=1.3,f=-1.6) USER MOD Single : A 1 SER N :NH3+ 148:sc= 0.403 (180deg=-0.145) USER MOD Single : A 1 SER OG : rot 180:sc= 0.175 USER MOD Single : A 5 SER OG : rot 180:sc= 0.119 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 ASN : amide:sc= 0.0758 K(o=0.076,f=-1.6!) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot -119:sc= 0.913 USER MOD Single : A 15 SER OG : rot 166:sc= 0.382 USER MOD Single : A 20 LYS NZ :NH3+ -156:sc= 1.17 (180deg=0.909) USER MOD Single : A 21 GLN : amide:sc= 0.779 K(o=0.78,f=-3.3!) USER MOD Single : A 25 THR OG1 : rot 81:sc= 1.27 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= -0.248 K(o=-0.25,f=-0.94) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 112:sc= 1.37 USER MOD Single : A 41 THR OG1 : rot 180:sc= -0.518 USER MOD Single : A 42 ASN : amide:sc= -0.697 K(o=-0.7,f=0) USER MOD Single : A 43 ASN : amide:sc= 0.797 K(o=0.8,f=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0.17 USER MOD Single : A 48 SER OG : rot 180:sc= 0.183 USER MOD Single : A 62 ASN : amide:sc= 0.146 K(o=0.15,f=-3.2!) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot -60:sc= 0.735 USER MOD Single : A 69 LYS NZ :NH3+ -114:sc= 1.74 (180deg=-2.6) USER MOD Single : A 71 SER OG : rot 109:sc= 1.09 USER MOD Single : A 75 GLN : amide:sc= -0.276 X(o=-0.28,f=-0.012) USER MOD Single : A 84 HIS : no HE2:sc= -0.168 K(o=-0.17,f=-0.97) USER MOD Single : A 85 THR OG1 : rot 160:sc= 0.592 USER MOD Single : A 92 LYS NZ :NH3+ -145:sc= 1.27 (180deg=-0.444) USER MOD Single : A 102 THR OG1 : rot 180:sc= -0.158 USER MOD Single : A 103 THR OG1 : rot -11:sc= 1.16 USER MOD Single : A 110 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0.135 USER MOD Single : A 116 LYS NZ :NH3+ -121:sc= 0 (180deg=-1.21) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 14.301 -10.704 19.929 1.00 0.00 N ATOM 2 CA SER A 1 13.212 -9.709 19.884 1.00 0.00 C ATOM 3 C SER A 1 13.762 -8.288 19.947 1.00 0.00 C ATOM 4 O SER A 1 13.091 -7.374 20.428 1.00 0.00 O ATOM 5 CB SER A 1 12.264 -9.962 21.052 1.00 0.00 C ATOM 6 OG SER A 1 12.505 -11.243 21.616 1.00 0.00 O ATOM 0 H1 SER A 1 13.967 -11.563 20.411 1.00 0.00 H new ATOM 0 H2 SER A 1 14.593 -10.943 18.960 1.00 0.00 H new ATOM 0 H3 SER A 1 15.111 -10.309 20.447 1.00 0.00 H new ATOM 0 HA SER A 1 12.675 -9.812 18.941 1.00 0.00 H new ATOM 0 HB2 SER A 1 12.399 -9.192 21.812 1.00 0.00 H new ATOM 0 HB3 SER A 1 11.231 -9.896 20.711 1.00 0.00 H new ATOM 0 HG SER A 1 11.891 -11.391 22.365 1.00 0.00 H new ATOM 14 N LEU A 2 14.977 -8.097 19.450 1.00 0.00 N ATOM 15 CA LEU A 2 15.613 -6.792 19.502 1.00 0.00 C ATOM 16 C LEU A 2 16.114 -6.381 18.123 1.00 0.00 C ATOM 17 O LEU A 2 16.977 -7.041 17.545 1.00 0.00 O ATOM 18 CB LEU A 2 16.776 -6.809 20.495 1.00 0.00 C ATOM 19 CG LEU A 2 16.539 -6.030 21.789 1.00 0.00 C ATOM 20 CD1 LEU A 2 17.222 -6.724 22.956 1.00 0.00 C ATOM 21 CD2 LEU A 2 17.041 -4.602 21.648 1.00 0.00 C ATOM 0 H LEU A 2 15.537 -8.826 19.009 1.00 0.00 H new ATOM 0 HA LEU A 2 14.872 -6.064 19.834 1.00 0.00 H new ATOM 0 HB2 LEU A 2 17.000 -7.845 20.749 1.00 0.00 H new ATOM 0 HB3 LEU A 2 17.659 -6.403 20.002 1.00 0.00 H new ATOM 0 HG LEU A 2 15.467 -5.999 21.985 1.00 0.00 H new ATOM 0 HD11 LEU A 2 17.045 -6.158 23.870 1.00 0.00 H new ATOM 0 HD12 LEU A 2 16.818 -7.730 23.068 1.00 0.00 H new ATOM 0 HD13 LEU A 2 18.294 -6.782 22.768 1.00 0.00 H new ATOM 0 HD21 LEU A 2 16.865 -4.061 22.578 1.00 0.00 H new ATOM 0 HD22 LEU A 2 18.109 -4.612 21.431 1.00 0.00 H new ATOM 0 HD23 LEU A 2 16.510 -4.108 20.835 1.00 0.00 H new ATOM 33 N PRO A 3 15.563 -5.292 17.573 1.00 0.00 N ATOM 34 CA PRO A 3 15.994 -4.743 16.292 1.00 0.00 C ATOM 35 C PRO A 3 17.303 -3.975 16.431 1.00 0.00 C ATOM 36 O PRO A 3 17.514 -3.262 17.416 1.00 0.00 O ATOM 37 CB PRO A 3 14.850 -3.792 15.892 1.00 0.00 C ATOM 38 CG PRO A 3 13.791 -3.952 16.937 1.00 0.00 C ATOM 39 CD PRO A 3 14.474 -4.504 18.153 1.00 0.00 C ATOM 0 HA PRO A 3 16.181 -5.521 15.551 1.00 0.00 H new ATOM 0 HB2 PRO A 3 15.199 -2.760 15.846 1.00 0.00 H new ATOM 0 HB3 PRO A 3 14.463 -4.042 14.904 1.00 0.00 H new ATOM 0 HG2 PRO A 3 13.317 -2.996 17.159 1.00 0.00 H new ATOM 0 HG3 PRO A 3 13.006 -4.625 16.594 1.00 0.00 H new ATOM 0 HD2 PRO A 3 14.847 -3.713 18.803 1.00 0.00 H new ATOM 0 HD3 PRO A 3 13.802 -5.119 18.752 1.00 0.00 H new ATOM 47 N ALA A 4 18.181 -4.118 15.453 1.00 0.00 N ATOM 48 CA ALA A 4 19.478 -3.466 15.505 1.00 0.00 C ATOM 49 C ALA A 4 19.969 -3.138 14.100 1.00 0.00 C ATOM 50 O ALA A 4 19.486 -2.200 13.469 1.00 0.00 O ATOM 51 CB ALA A 4 20.485 -4.348 16.235 1.00 0.00 C ATOM 0 H ALA A 4 18.020 -4.678 14.616 1.00 0.00 H new ATOM 0 HA ALA A 4 19.375 -2.531 16.056 1.00 0.00 H new ATOM 0 HB1 ALA A 4 21.452 -3.847 16.266 1.00 0.00 H new ATOM 0 HB2 ALA A 4 20.138 -4.531 17.252 1.00 0.00 H new ATOM 0 HB3 ALA A 4 20.585 -5.298 15.709 1.00 0.00 H new ATOM 57 N SER A 5 20.922 -3.923 13.616 1.00 0.00 N ATOM 58 CA SER A 5 21.456 -3.753 12.275 1.00 0.00 C ATOM 59 C SER A 5 20.455 -4.249 11.237 1.00 0.00 C ATOM 60 O SER A 5 20.508 -3.869 10.068 1.00 0.00 O ATOM 61 CB SER A 5 22.764 -4.529 12.167 1.00 0.00 C ATOM 62 OG SER A 5 23.066 -5.151 13.408 1.00 0.00 O ATOM 0 H SER A 5 21.343 -4.690 14.139 1.00 0.00 H new ATOM 0 HA SER A 5 21.640 -2.696 12.085 1.00 0.00 H new ATOM 0 HB2 SER A 5 22.685 -5.282 11.383 1.00 0.00 H new ATOM 0 HB3 SER A 5 23.573 -3.856 11.882 1.00 0.00 H new ATOM 0 HG SER A 5 23.907 -5.648 13.329 1.00 0.00 H new ATOM 68 N ALA A 6 19.543 -5.100 11.686 1.00 0.00 N ATOM 69 CA ALA A 6 18.500 -5.641 10.832 1.00 0.00 C ATOM 70 C ALA A 6 17.141 -5.486 11.503 1.00 0.00 C ATOM 71 O ALA A 6 17.071 -5.084 12.669 1.00 0.00 O ATOM 72 CB ALA A 6 18.779 -7.105 10.518 1.00 0.00 C ATOM 0 H ALA A 6 19.507 -5.433 12.650 1.00 0.00 H new ATOM 0 HA ALA A 6 18.489 -5.086 9.894 1.00 0.00 H new ATOM 0 HB1 ALA A 6 17.989 -7.497 9.877 1.00 0.00 H new ATOM 0 HB2 ALA A 6 19.737 -7.191 10.006 1.00 0.00 H new ATOM 0 HB3 ALA A 6 18.811 -7.676 11.446 1.00 0.00 H new ATOM 78 N ALA A 7 16.080 -5.814 10.763 1.00 0.00 N ATOM 79 CA ALA A 7 14.705 -5.701 11.253 1.00 0.00 C ATOM 80 C ALA A 7 14.345 -4.249 11.560 1.00 0.00 C ATOM 81 O ALA A 7 13.831 -3.932 12.631 1.00 0.00 O ATOM 82 CB ALA A 7 14.490 -6.591 12.472 1.00 0.00 C ATOM 0 H ALA A 7 16.150 -6.165 9.808 1.00 0.00 H new ATOM 0 HA ALA A 7 14.038 -6.045 10.463 1.00 0.00 H new ATOM 0 HB1 ALA A 7 13.462 -6.491 12.819 1.00 0.00 H new ATOM 0 HB2 ALA A 7 14.683 -7.630 12.203 1.00 0.00 H new ATOM 0 HB3 ALA A 7 15.172 -6.290 13.267 1.00 0.00 H new ATOM 88 N LYS A 8 14.606 -3.375 10.597 1.00 0.00 N ATOM 89 CA LYS A 8 14.325 -1.952 10.747 1.00 0.00 C ATOM 90 C LYS A 8 13.754 -1.394 9.446 1.00 0.00 C ATOM 91 O LYS A 8 14.052 -0.268 9.043 1.00 0.00 O ATOM 92 CB LYS A 8 15.591 -1.185 11.152 1.00 0.00 C ATOM 93 CG LYS A 8 16.820 -1.536 10.328 1.00 0.00 C ATOM 94 CD LYS A 8 17.971 -0.580 10.607 1.00 0.00 C ATOM 95 CE LYS A 8 18.000 0.571 9.614 1.00 0.00 C ATOM 96 NZ LYS A 8 18.149 1.890 10.293 1.00 0.00 N ATOM 0 H LYS A 8 15.015 -3.628 9.697 1.00 0.00 H new ATOM 0 HA LYS A 8 13.587 -1.825 11.539 1.00 0.00 H new ATOM 0 HB2 LYS A 8 15.400 -0.116 11.062 1.00 0.00 H new ATOM 0 HB3 LYS A 8 15.802 -1.383 12.203 1.00 0.00 H new ATOM 0 HG2 LYS A 8 17.131 -2.556 10.553 1.00 0.00 H new ATOM 0 HG3 LYS A 8 16.569 -1.505 9.268 1.00 0.00 H new ATOM 0 HD2 LYS A 8 17.879 -0.185 11.619 1.00 0.00 H new ATOM 0 HD3 LYS A 8 18.915 -1.124 10.562 1.00 0.00 H new ATOM 0 HE2 LYS A 8 18.825 0.427 8.916 1.00 0.00 H new ATOM 0 HE3 LYS A 8 17.081 0.567 9.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 18.164 2.647 9.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 17.349 2.040 10.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 19.038 1.904 10.833 1.00 0.00 H new ATOM 110 N ASN A 9 12.930 -2.200 8.796 1.00 0.00 N ATOM 111 CA ASN A 9 12.326 -1.841 7.518 1.00 0.00 C ATOM 112 C ASN A 9 11.155 -0.881 7.716 1.00 0.00 C ATOM 113 O ASN A 9 9.994 -1.258 7.572 1.00 0.00 O ATOM 114 CB ASN A 9 11.859 -3.107 6.787 1.00 0.00 C ATOM 115 CG ASN A 9 11.304 -4.163 7.730 1.00 0.00 C ATOM 116 OD1 ASN A 9 12.054 -4.906 8.365 1.00 0.00 O ATOM 117 ND2 ASN A 9 9.990 -4.224 7.844 1.00 0.00 N ATOM 0 H ASN A 9 12.659 -3.122 9.138 1.00 0.00 H new ATOM 0 HA ASN A 9 13.078 -1.335 6.912 1.00 0.00 H new ATOM 0 HB2 ASN A 9 11.094 -2.839 6.059 1.00 0.00 H new ATOM 0 HB3 ASN A 9 12.696 -3.528 6.230 1.00 0.00 H new ATOM 0 HD21 ASN A 9 9.564 -4.903 8.474 1.00 0.00 H new ATOM 0 HD22 ASN A 9 9.401 -3.592 7.302 1.00 0.00 H new ATOM 124 N ALA A 10 11.476 0.361 8.056 1.00 0.00 N ATOM 125 CA ALA A 10 10.462 1.383 8.279 1.00 0.00 C ATOM 126 C ALA A 10 10.091 2.100 6.982 1.00 0.00 C ATOM 127 O ALA A 10 8.959 2.550 6.815 1.00 0.00 O ATOM 128 CB ALA A 10 10.943 2.390 9.314 1.00 0.00 C ATOM 0 H ALA A 10 12.435 0.685 8.184 1.00 0.00 H new ATOM 0 HA ALA A 10 9.568 0.884 8.653 1.00 0.00 H new ATOM 0 HB1 ALA A 10 10.174 3.147 9.470 1.00 0.00 H new ATOM 0 HB2 ALA A 10 11.143 1.877 10.255 1.00 0.00 H new ATOM 0 HB3 ALA A 10 11.856 2.868 8.960 1.00 0.00 H new ATOM 134 N LYS A 11 11.048 2.207 6.063 1.00 0.00 N ATOM 135 CA LYS A 11 10.819 2.907 4.807 1.00 0.00 C ATOM 136 C LYS A 11 10.547 1.915 3.687 1.00 0.00 C ATOM 137 O LYS A 11 11.075 0.801 3.689 1.00 0.00 O ATOM 138 CB LYS A 11 12.025 3.780 4.443 1.00 0.00 C ATOM 139 CG LYS A 11 11.854 5.249 4.811 1.00 0.00 C ATOM 140 CD LYS A 11 13.051 6.078 4.369 1.00 0.00 C ATOM 141 CE LYS A 11 13.808 6.646 5.561 1.00 0.00 C ATOM 142 NZ LYS A 11 14.650 7.810 5.183 1.00 0.00 N ATOM 0 H LYS A 11 11.985 1.818 6.166 1.00 0.00 H new ATOM 0 HA LYS A 11 9.947 3.549 4.934 1.00 0.00 H new ATOM 0 HB2 LYS A 11 12.910 3.390 4.946 1.00 0.00 H new ATOM 0 HB3 LYS A 11 12.208 3.702 3.371 1.00 0.00 H new ATOM 0 HG2 LYS A 11 10.949 5.639 4.346 1.00 0.00 H new ATOM 0 HG3 LYS A 11 11.724 5.342 5.889 1.00 0.00 H new ATOM 0 HD2 LYS A 11 13.722 5.460 3.772 1.00 0.00 H new ATOM 0 HD3 LYS A 11 12.714 6.893 3.729 1.00 0.00 H new ATOM 0 HE2 LYS A 11 13.098 6.947 6.331 1.00 0.00 H new ATOM 0 HE3 LYS A 11 14.438 5.869 5.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 15.148 8.166 6.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 15.345 7.518 4.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 14.047 8.563 4.793 1.00 0.00 H new ATOM 156 N LEU A 12 9.735 2.330 2.726 1.00 0.00 N ATOM 157 CA LEU A 12 9.396 1.490 1.585 1.00 0.00 C ATOM 158 C LEU A 12 10.546 1.483 0.585 1.00 0.00 C ATOM 159 O LEU A 12 10.408 1.992 -0.527 1.00 0.00 O ATOM 160 CB LEU A 12 8.122 2.001 0.907 1.00 0.00 C ATOM 161 CG LEU A 12 6.803 1.472 1.477 1.00 0.00 C ATOM 162 CD1 LEU A 12 6.499 2.130 2.812 1.00 0.00 C ATOM 163 CD2 LEU A 12 5.668 1.710 0.491 1.00 0.00 C ATOM 0 H LEU A 12 9.295 3.250 2.714 1.00 0.00 H new ATOM 0 HA LEU A 12 9.222 0.474 1.939 1.00 0.00 H new ATOM 0 HB2 LEU A 12 8.112 3.089 0.969 1.00 0.00 H new ATOM 0 HB3 LEU A 12 8.168 1.743 -0.151 1.00 0.00 H new ATOM 0 HG LEU A 12 6.900 0.398 1.639 1.00 0.00 H new ATOM 0 HD11 LEU A 12 5.558 1.742 3.203 1.00 0.00 H new ATOM 0 HD12 LEU A 12 7.302 1.912 3.516 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.419 3.209 2.676 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.737 1.329 0.910 1.00 0.00 H new ATOM 0 HD22 LEU A 12 5.570 2.779 0.300 1.00 0.00 H new ATOM 0 HD23 LEU A 12 5.884 1.193 -0.444 1.00 0.00 H new ATOM 175 N ALA A 13 11.696 0.960 1.026 1.00 0.00 N ATOM 176 CA ALA A 13 12.930 0.902 0.225 1.00 0.00 C ATOM 177 C ALA A 13 13.540 2.293 0.038 1.00 0.00 C ATOM 178 O ALA A 13 14.744 2.433 -0.178 1.00 0.00 O ATOM 179 CB ALA A 13 12.683 0.231 -1.121 1.00 0.00 C ATOM 0 H ALA A 13 11.800 0.560 1.959 1.00 0.00 H new ATOM 0 HA ALA A 13 13.649 0.295 0.776 1.00 0.00 H new ATOM 0 HB1 ALA A 13 13.612 0.203 -1.690 1.00 0.00 H new ATOM 0 HB2 ALA A 13 12.325 -0.786 -0.960 1.00 0.00 H new ATOM 0 HB3 ALA A 13 11.934 0.795 -1.677 1.00 0.00 H new ATOM 185 N THR A 14 12.695 3.308 0.127 1.00 0.00 N ATOM 186 CA THR A 14 13.099 4.694 -0.023 1.00 0.00 C ATOM 187 C THR A 14 11.935 5.597 0.368 1.00 0.00 C ATOM 188 O THR A 14 12.117 6.584 1.083 1.00 0.00 O ATOM 189 CB THR A 14 13.557 5.029 -1.474 1.00 0.00 C ATOM 190 OG1 THR A 14 13.305 6.411 -1.771 1.00 0.00 O ATOM 191 CG2 THR A 14 12.848 4.157 -2.504 1.00 0.00 C ATOM 0 H THR A 14 11.698 3.189 0.308 1.00 0.00 H new ATOM 0 HA THR A 14 13.955 4.863 0.631 1.00 0.00 H new ATOM 0 HB THR A 14 14.627 4.828 -1.530 1.00 0.00 H new ATOM 0 HG1 THR A 14 12.686 6.475 -2.528 1.00 0.00 H new ATOM 0 HG21 THR A 14 13.194 4.420 -3.504 1.00 0.00 H new ATOM 0 HG22 THR A 14 13.070 3.108 -2.308 1.00 0.00 H new ATOM 0 HG23 THR A 14 11.772 4.318 -2.438 1.00 0.00 H new ATOM 199 N SER A 15 10.731 5.216 -0.081 1.00 0.00 N ATOM 200 CA SER A 15 9.512 5.991 0.153 1.00 0.00 C ATOM 201 C SER A 15 9.572 7.349 -0.544 1.00 0.00 C ATOM 202 O SER A 15 8.921 7.538 -1.571 1.00 0.00 O ATOM 203 CB SER A 15 9.256 6.152 1.656 1.00 0.00 C ATOM 204 OG SER A 15 8.782 4.939 2.219 1.00 0.00 O ATOM 0 H SER A 15 10.578 4.361 -0.616 1.00 0.00 H new ATOM 0 HA SER A 15 8.676 5.441 -0.279 1.00 0.00 H new ATOM 0 HB2 SER A 15 10.176 6.455 2.156 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.527 6.945 1.822 1.00 0.00 H new ATOM 0 HG SER A 15 8.838 4.988 3.196 1.00 0.00 H new ATOM 210 N ALA A 16 10.360 8.274 0.009 1.00 0.00 N ATOM 211 CA ALA A 16 10.481 9.636 -0.514 1.00 0.00 C ATOM 212 C ALA A 16 9.110 10.296 -0.668 1.00 0.00 C ATOM 213 O ALA A 16 8.593 10.900 0.270 1.00 0.00 O ATOM 214 CB ALA A 16 11.233 9.632 -1.839 1.00 0.00 C ATOM 0 H ALA A 16 10.933 8.099 0.834 1.00 0.00 H new ATOM 0 HA ALA A 16 11.051 10.224 0.205 1.00 0.00 H new ATOM 0 HB1 ALA A 16 11.314 10.652 -2.214 1.00 0.00 H new ATOM 0 HB2 ALA A 16 12.231 9.220 -1.690 1.00 0.00 H new ATOM 0 HB3 ALA A 16 10.693 9.021 -2.562 1.00 0.00 H new ATOM 220 N ALA A 17 8.516 10.158 -1.846 1.00 0.00 N ATOM 221 CA ALA A 17 7.184 10.684 -2.100 1.00 0.00 C ATOM 222 C ALA A 17 6.156 9.997 -1.201 1.00 0.00 C ATOM 223 O ALA A 17 5.174 10.610 -0.784 1.00 0.00 O ATOM 224 CB ALA A 17 6.823 10.516 -3.567 1.00 0.00 C ATOM 0 H ALA A 17 8.939 9.684 -2.644 1.00 0.00 H new ATOM 0 HA ALA A 17 7.177 11.749 -1.866 1.00 0.00 H new ATOM 0 HB1 ALA A 17 5.824 10.914 -3.744 1.00 0.00 H new ATOM 0 HB2 ALA A 17 7.542 11.056 -4.183 1.00 0.00 H new ATOM 0 HB3 ALA A 17 6.844 9.458 -3.828 1.00 0.00 H new ATOM 230 N PHE A 18 6.404 8.726 -0.889 1.00 0.00 N ATOM 231 CA PHE A 18 5.542 7.973 0.019 1.00 0.00 C ATOM 232 C PHE A 18 5.671 8.520 1.436 1.00 0.00 C ATOM 233 O PHE A 18 4.718 8.515 2.207 1.00 0.00 O ATOM 234 CB PHE A 18 5.906 6.484 -0.002 1.00 0.00 C ATOM 235 CG PHE A 18 4.861 5.596 0.616 1.00 0.00 C ATOM 236 CD1 PHE A 18 4.831 5.378 1.987 1.00 0.00 C ATOM 237 CD2 PHE A 18 3.919 4.967 -0.176 1.00 0.00 C ATOM 238 CE1 PHE A 18 3.868 4.567 2.552 1.00 0.00 C ATOM 239 CE2 PHE A 18 2.955 4.153 0.385 1.00 0.00 C ATOM 240 CZ PHE A 18 2.936 3.946 1.751 1.00 0.00 C ATOM 0 H PHE A 18 7.196 8.196 -1.252 1.00 0.00 H new ATOM 0 HA PHE A 18 4.510 8.083 -0.314 1.00 0.00 H new ATOM 0 HB2 PHE A 18 6.069 6.174 -1.034 1.00 0.00 H new ATOM 0 HB3 PHE A 18 6.849 6.342 0.526 1.00 0.00 H new ATOM 0 HD1 PHE A 18 5.570 5.849 2.619 1.00 0.00 H new ATOM 0 HD2 PHE A 18 3.937 5.114 -1.246 1.00 0.00 H new ATOM 0 HE1 PHE A 18 3.845 4.419 3.622 1.00 0.00 H new ATOM 0 HE2 PHE A 18 2.216 3.678 -0.244 1.00 0.00 H new ATOM 0 HZ PHE A 18 2.191 3.298 2.190 1.00 0.00 H new ATOM 250 N ALA A 19 6.860 8.998 1.767 1.00 0.00 N ATOM 251 CA ALA A 19 7.101 9.595 3.072 1.00 0.00 C ATOM 252 C ALA A 19 6.345 10.911 3.207 1.00 0.00 C ATOM 253 O ALA A 19 5.829 11.229 4.276 1.00 0.00 O ATOM 254 CB ALA A 19 8.585 9.804 3.293 1.00 0.00 C ATOM 0 H ALA A 19 7.673 8.985 1.151 1.00 0.00 H new ATOM 0 HA ALA A 19 6.734 8.911 3.837 1.00 0.00 H new ATOM 0 HB1 ALA A 19 8.747 10.251 4.274 1.00 0.00 H new ATOM 0 HB2 ALA A 19 9.099 8.844 3.242 1.00 0.00 H new ATOM 0 HB3 ALA A 19 8.978 10.467 2.522 1.00 0.00 H new ATOM 260 N LYS A 20 6.274 11.663 2.113 1.00 0.00 N ATOM 261 CA LYS A 20 5.480 12.888 2.084 1.00 0.00 C ATOM 262 C LYS A 20 4.010 12.541 2.253 1.00 0.00 C ATOM 263 O LYS A 20 3.254 13.258 2.905 1.00 0.00 O ATOM 264 CB LYS A 20 5.688 13.647 0.773 1.00 0.00 C ATOM 265 CG LYS A 20 7.142 13.968 0.478 1.00 0.00 C ATOM 266 CD LYS A 20 7.382 14.149 -1.012 1.00 0.00 C ATOM 267 CE LYS A 20 8.634 14.970 -1.283 1.00 0.00 C ATOM 268 NZ LYS A 20 8.523 15.737 -2.548 1.00 0.00 N ATOM 0 H LYS A 20 6.754 11.448 1.239 1.00 0.00 H new ATOM 0 HA LYS A 20 5.804 13.531 2.902 1.00 0.00 H new ATOM 0 HB2 LYS A 20 5.282 13.055 -0.047 1.00 0.00 H new ATOM 0 HB3 LYS A 20 5.120 14.576 0.807 1.00 0.00 H new ATOM 0 HG2 LYS A 20 7.429 14.877 1.007 1.00 0.00 H new ATOM 0 HG3 LYS A 20 7.776 13.166 0.855 1.00 0.00 H new ATOM 0 HD2 LYS A 20 7.477 13.172 -1.487 1.00 0.00 H new ATOM 0 HD3 LYS A 20 6.520 14.640 -1.463 1.00 0.00 H new ATOM 0 HE2 LYS A 20 8.805 15.657 -0.454 1.00 0.00 H new ATOM 0 HE3 LYS A 20 9.499 14.309 -1.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 9.475 15.946 -2.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 7.999 15.176 -3.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 8.017 16.628 -2.370 1.00 0.00 H new ATOM 282 N GLN A 21 3.621 11.424 1.660 1.00 0.00 N ATOM 283 CA GLN A 21 2.278 10.890 1.810 1.00 0.00 C ATOM 284 C GLN A 21 1.987 10.591 3.281 1.00 0.00 C ATOM 285 O GLN A 21 0.901 10.877 3.784 1.00 0.00 O ATOM 286 CB GLN A 21 2.140 9.616 0.976 1.00 0.00 C ATOM 287 CG GLN A 21 1.017 9.667 -0.045 1.00 0.00 C ATOM 288 CD GLN A 21 0.856 8.356 -0.786 1.00 0.00 C ATOM 289 OE1 GLN A 21 1.627 8.032 -1.691 1.00 0.00 O ATOM 290 NE2 GLN A 21 -0.150 7.591 -0.410 1.00 0.00 N ATOM 0 H GLN A 21 4.227 10.863 1.062 1.00 0.00 H new ATOM 0 HA GLN A 21 1.558 11.630 1.460 1.00 0.00 H new ATOM 0 HB2 GLN A 21 3.081 9.429 0.458 1.00 0.00 H new ATOM 0 HB3 GLN A 21 1.971 8.772 1.645 1.00 0.00 H new ATOM 0 HG2 GLN A 21 0.082 9.915 0.458 1.00 0.00 H new ATOM 0 HG3 GLN A 21 1.215 10.465 -0.761 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -0.767 7.894 0.344 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -0.311 6.696 -0.873 1.00 0.00 H new ATOM 299 N ALA A 22 2.979 10.042 3.970 1.00 0.00 N ATOM 300 CA ALA A 22 2.839 9.701 5.384 1.00 0.00 C ATOM 301 C ALA A 22 2.847 10.946 6.261 1.00 0.00 C ATOM 302 O ALA A 22 2.452 10.904 7.426 1.00 0.00 O ATOM 303 CB ALA A 22 3.951 8.758 5.813 1.00 0.00 C ATOM 0 H ALA A 22 3.893 9.822 3.573 1.00 0.00 H new ATOM 0 HA ALA A 22 1.877 9.204 5.510 1.00 0.00 H new ATOM 0 HB1 ALA A 22 3.833 8.513 6.869 1.00 0.00 H new ATOM 0 HB2 ALA A 22 3.902 7.844 5.221 1.00 0.00 H new ATOM 0 HB3 ALA A 22 4.916 9.239 5.658 1.00 0.00 H new ATOM 309 N GLU A 23 3.308 12.047 5.695 1.00 0.00 N ATOM 310 CA GLU A 23 3.380 13.304 6.419 1.00 0.00 C ATOM 311 C GLU A 23 2.099 14.117 6.218 1.00 0.00 C ATOM 312 O GLU A 23 1.581 14.718 7.157 1.00 0.00 O ATOM 313 CB GLU A 23 4.611 14.098 5.960 1.00 0.00 C ATOM 314 CG GLU A 23 4.557 15.582 6.281 1.00 0.00 C ATOM 315 CD GLU A 23 5.800 16.066 6.995 1.00 0.00 C ATOM 316 OE1 GLU A 23 6.883 16.073 6.375 1.00 0.00 O ATOM 317 OE2 GLU A 23 5.695 16.453 8.177 1.00 0.00 O ATOM 0 H GLU A 23 3.640 12.096 4.732 1.00 0.00 H new ATOM 0 HA GLU A 23 3.477 13.094 7.484 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.499 13.670 6.426 1.00 0.00 H new ATOM 0 HB3 GLU A 23 4.726 13.976 4.883 1.00 0.00 H new ATOM 0 HG2 GLU A 23 4.430 16.146 5.357 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.684 15.785 6.901 1.00 0.00 H new ATOM 324 N GLY A 24 1.583 14.113 4.993 1.00 0.00 N ATOM 325 CA GLY A 24 0.395 14.889 4.681 1.00 0.00 C ATOM 326 C GLY A 24 -0.878 14.253 5.211 1.00 0.00 C ATOM 327 O GLY A 24 -1.854 14.951 5.500 1.00 0.00 O ATOM 0 H GLY A 24 1.967 13.585 4.209 1.00 0.00 H new ATOM 0 HA2 GLY A 24 0.499 15.889 5.102 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.315 15.005 3.600 1.00 0.00 H new ATOM 331 N THR A 25 -0.866 12.933 5.338 1.00 0.00 N ATOM 332 CA THR A 25 -2.016 12.194 5.842 1.00 0.00 C ATOM 333 C THR A 25 -1.684 11.542 7.177 1.00 0.00 C ATOM 334 O THR A 25 -0.546 11.131 7.408 1.00 0.00 O ATOM 335 CB THR A 25 -2.464 11.111 4.838 1.00 0.00 C ATOM 336 OG1 THR A 25 -1.701 11.218 3.626 1.00 0.00 O ATOM 337 CG2 THR A 25 -3.948 11.245 4.519 1.00 0.00 C ATOM 0 H THR A 25 -0.066 12.348 5.097 1.00 0.00 H new ATOM 0 HA THR A 25 -2.833 12.903 5.978 1.00 0.00 H new ATOM 0 HB THR A 25 -2.292 10.135 5.293 1.00 0.00 H new ATOM 0 HG1 THR A 25 -0.830 10.787 3.749 1.00 0.00 H new ATOM 0 HG21 THR A 25 -4.239 10.470 3.809 1.00 0.00 H new ATOM 0 HG22 THR A 25 -4.528 11.135 5.435 1.00 0.00 H new ATOM 0 HG23 THR A 25 -4.140 12.226 4.084 1.00 0.00 H new ATOM 345 N THR A 26 -2.667 11.448 8.059 1.00 0.00 N ATOM 346 CA THR A 26 -2.436 10.873 9.367 1.00 0.00 C ATOM 347 C THR A 26 -2.693 9.369 9.362 1.00 0.00 C ATOM 348 O THR A 26 -3.816 8.910 9.566 1.00 0.00 O ATOM 349 CB THR A 26 -3.336 11.544 10.420 1.00 0.00 C ATOM 350 OG1 THR A 26 -3.568 12.911 10.053 1.00 0.00 O ATOM 351 CG2 THR A 26 -2.703 11.483 11.803 1.00 0.00 C ATOM 0 H THR A 26 -3.623 11.761 7.891 1.00 0.00 H new ATOM 0 HA THR A 26 -1.391 11.048 9.622 1.00 0.00 H new ATOM 0 HB THR A 26 -4.283 11.005 10.456 1.00 0.00 H new ATOM 0 HG1 THR A 26 -4.142 13.337 10.723 1.00 0.00 H new ATOM 0 HG21 THR A 26 -3.361 11.965 12.526 1.00 0.00 H new ATOM 0 HG22 THR A 26 -2.551 10.442 12.088 1.00 0.00 H new ATOM 0 HG23 THR A 26 -1.743 11.999 11.787 1.00 0.00 H new ATOM 359 N CYS A 27 -1.629 8.621 9.132 1.00 0.00 N ATOM 360 CA CYS A 27 -1.630 7.175 9.286 1.00 0.00 C ATOM 361 C CYS A 27 -0.190 6.709 9.426 1.00 0.00 C ATOM 362 O CYS A 27 0.673 7.105 8.644 1.00 0.00 O ATOM 363 CB CYS A 27 -2.318 6.462 8.103 1.00 0.00 C ATOM 364 SG CYS A 27 -2.809 7.540 6.709 1.00 0.00 S ATOM 0 H CYS A 27 -0.732 9.002 8.831 1.00 0.00 H new ATOM 0 HA CYS A 27 -2.203 6.917 10.177 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -1.645 5.693 7.725 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -3.207 5.953 8.476 1.00 0.00 H new ATOM 369 N ASN A 28 0.071 5.886 10.424 1.00 0.00 N ATOM 370 CA ASN A 28 1.436 5.470 10.736 1.00 0.00 C ATOM 371 C ASN A 28 1.628 3.997 10.423 1.00 0.00 C ATOM 372 O ASN A 28 0.736 3.360 9.865 1.00 0.00 O ATOM 373 CB ASN A 28 1.751 5.734 12.213 1.00 0.00 C ATOM 374 CG ASN A 28 0.545 5.548 13.118 1.00 0.00 C ATOM 375 OD1 ASN A 28 -0.368 6.373 13.135 1.00 0.00 O ATOM 376 ND2 ASN A 28 0.532 4.471 13.885 1.00 0.00 N ATOM 0 H ASN A 28 -0.641 5.489 11.036 1.00 0.00 H new ATOM 0 HA ASN A 28 2.120 6.053 10.119 1.00 0.00 H new ATOM 0 HB2 ASN A 28 2.547 5.063 12.535 1.00 0.00 H new ATOM 0 HB3 ASN A 28 2.128 6.751 12.323 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -0.252 4.304 14.516 1.00 0.00 H new ATOM 0 HD22 ASN A 28 1.306 3.807 13.846 1.00 0.00 H new ATOM 383 N VAL A 29 2.797 3.459 10.752 1.00 0.00 N ATOM 384 CA VAL A 29 3.044 2.037 10.566 1.00 0.00 C ATOM 385 C VAL A 29 2.019 1.227 11.350 1.00 0.00 C ATOM 386 O VAL A 29 1.943 1.311 12.578 1.00 0.00 O ATOM 387 CB VAL A 29 4.464 1.631 11.006 1.00 0.00 C ATOM 388 CG1 VAL A 29 4.587 0.114 11.094 1.00 0.00 C ATOM 389 CG2 VAL A 29 5.505 2.200 10.052 1.00 0.00 C ATOM 0 H VAL A 29 3.580 3.981 11.145 1.00 0.00 H new ATOM 0 HA VAL A 29 2.953 1.828 9.500 1.00 0.00 H new ATOM 0 HB VAL A 29 4.646 2.046 11.997 1.00 0.00 H new ATOM 0 HG11 VAL A 29 5.597 -0.152 11.406 1.00 0.00 H new ATOM 0 HG12 VAL A 29 3.870 -0.268 11.821 1.00 0.00 H new ATOM 0 HG13 VAL A 29 4.382 -0.325 10.118 1.00 0.00 H new ATOM 0 HG21 VAL A 29 6.501 1.902 10.380 1.00 0.00 H new ATOM 0 HG22 VAL A 29 5.325 1.818 9.047 1.00 0.00 H new ATOM 0 HG23 VAL A 29 5.436 3.288 10.045 1.00 0.00 H new ATOM 399 N GLY A 30 1.221 0.463 10.627 1.00 0.00 N ATOM 400 CA GLY A 30 0.137 -0.262 11.240 1.00 0.00 C ATOM 401 C GLY A 30 -1.201 0.256 10.767 1.00 0.00 C ATOM 402 O GLY A 30 -2.195 -0.460 10.800 1.00 0.00 O ATOM 0 H GLY A 30 1.307 0.332 9.619 1.00 0.00 H new ATOM 0 HA2 GLY A 30 0.224 -1.322 11.002 1.00 0.00 H new ATOM 0 HA3 GLY A 30 0.203 -0.172 12.324 1.00 0.00 H new ATOM 406 N SER A 31 -1.223 1.507 10.313 1.00 0.00 N ATOM 407 CA SER A 31 -2.441 2.110 9.796 1.00 0.00 C ATOM 408 C SER A 31 -2.207 2.737 8.417 1.00 0.00 C ATOM 409 O SER A 31 -3.099 3.362 7.851 1.00 0.00 O ATOM 410 CB SER A 31 -2.955 3.173 10.772 1.00 0.00 C ATOM 411 OG SER A 31 -1.970 3.504 11.739 1.00 0.00 O ATOM 0 H SER A 31 -0.408 2.120 10.294 1.00 0.00 H new ATOM 0 HA SER A 31 -3.189 1.324 9.690 1.00 0.00 H new ATOM 0 HB2 SER A 31 -3.241 4.068 10.220 1.00 0.00 H new ATOM 0 HB3 SER A 31 -3.851 2.807 11.273 1.00 0.00 H new ATOM 0 HG SER A 31 -2.325 4.186 12.347 1.00 0.00 H new ATOM 417 N ILE A 32 -1.009 2.566 7.877 1.00 0.00 N ATOM 418 CA ILE A 32 -0.662 3.160 6.594 1.00 0.00 C ATOM 419 C ILE A 32 -0.844 2.150 5.461 1.00 0.00 C ATOM 420 O ILE A 32 -0.397 1.005 5.556 1.00 0.00 O ATOM 421 CB ILE A 32 0.780 3.736 6.614 1.00 0.00 C ATOM 422 CG1 ILE A 32 0.868 4.965 5.712 1.00 0.00 C ATOM 423 CG2 ILE A 32 1.824 2.701 6.212 1.00 0.00 C ATOM 424 CD1 ILE A 32 2.141 5.756 5.904 1.00 0.00 C ATOM 0 H ILE A 32 -0.261 2.021 8.307 1.00 0.00 H new ATOM 0 HA ILE A 32 -1.343 3.992 6.412 1.00 0.00 H new ATOM 0 HB ILE A 32 1.000 4.026 7.641 1.00 0.00 H new ATOM 0 HG12 ILE A 32 0.798 4.649 4.671 1.00 0.00 H new ATOM 0 HG13 ILE A 32 0.013 5.612 5.907 1.00 0.00 H new ATOM 0 HG21 ILE A 32 2.815 3.153 6.242 1.00 0.00 H new ATOM 0 HG22 ILE A 32 1.788 1.860 6.904 1.00 0.00 H new ATOM 0 HG23 ILE A 32 1.617 2.348 5.202 1.00 0.00 H new ATOM 0 HD11 ILE A 32 2.140 6.615 5.234 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.203 6.101 6.936 1.00 0.00 H new ATOM 0 HD13 ILE A 32 3.000 5.123 5.681 1.00 0.00 H new ATOM 436 N ALA A 33 -1.555 2.558 4.418 1.00 0.00 N ATOM 437 CA ALA A 33 -1.855 1.664 3.314 1.00 0.00 C ATOM 438 C ALA A 33 -2.011 2.417 1.998 1.00 0.00 C ATOM 439 O ALA A 33 -2.011 3.648 1.963 1.00 0.00 O ATOM 440 CB ALA A 33 -3.121 0.883 3.617 1.00 0.00 C ATOM 0 H ALA A 33 -1.933 3.500 4.316 1.00 0.00 H new ATOM 0 HA ALA A 33 -1.015 0.979 3.203 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -3.343 0.213 2.786 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -2.979 0.299 4.526 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -3.951 1.575 3.756 1.00 0.00 H new ATOM 446 N CYS A 34 -2.138 1.656 0.922 1.00 0.00 N ATOM 447 CA CYS A 34 -2.497 2.202 -0.379 1.00 0.00 C ATOM 448 C CYS A 34 -3.729 1.477 -0.889 1.00 0.00 C ATOM 449 O CYS A 34 -3.874 0.274 -0.676 1.00 0.00 O ATOM 450 CB CYS A 34 -1.355 2.038 -1.385 1.00 0.00 C ATOM 451 SG CYS A 34 0.246 2.707 -0.832 1.00 0.00 S ATOM 0 H CYS A 34 -1.996 0.646 0.925 1.00 0.00 H new ATOM 0 HA CYS A 34 -2.698 3.268 -0.268 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -1.234 0.978 -1.607 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -1.636 2.528 -2.317 1.00 0.00 H new ATOM 456 N CYS A 35 -4.619 2.201 -1.536 1.00 0.00 N ATOM 457 CA CYS A 35 -5.815 1.601 -2.091 1.00 0.00 C ATOM 458 C CYS A 35 -5.804 1.759 -3.601 1.00 0.00 C ATOM 459 O CYS A 35 -5.298 2.755 -4.123 1.00 0.00 O ATOM 460 CB CYS A 35 -7.068 2.248 -1.490 1.00 0.00 C ATOM 461 SG CYS A 35 -7.797 1.313 -0.104 1.00 0.00 S ATOM 0 H CYS A 35 -4.537 3.206 -1.691 1.00 0.00 H new ATOM 0 HA CYS A 35 -5.832 0.540 -1.843 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -6.816 3.251 -1.145 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -7.818 2.359 -2.273 1.00 0.00 H new ATOM 466 N ASN A 36 -6.323 0.773 -4.308 1.00 0.00 N ATOM 467 CA ASN A 36 -6.357 0.836 -5.760 1.00 0.00 C ATOM 468 C ASN A 36 -7.733 0.487 -6.287 1.00 0.00 C ATOM 469 O ASN A 36 -8.541 -0.133 -5.590 1.00 0.00 O ATOM 470 CB ASN A 36 -5.315 -0.103 -6.374 1.00 0.00 C ATOM 471 CG ASN A 36 -4.793 0.410 -7.703 1.00 0.00 C ATOM 472 OD1 ASN A 36 -5.085 1.536 -8.104 1.00 0.00 O ATOM 473 ND2 ASN A 36 -4.010 -0.405 -8.388 1.00 0.00 N ATOM 0 H ASN A 36 -6.724 -0.075 -3.907 1.00 0.00 H new ATOM 0 HA ASN A 36 -6.121 1.860 -6.048 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -4.483 -0.222 -5.680 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -5.756 -1.090 -6.515 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -3.624 -0.108 -9.284 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -3.792 -1.331 -8.021 1.00 0.00 H new ATOM 480 N SER A 37 -7.991 0.907 -7.513 1.00 0.00 N ATOM 481 CA SER A 37 -9.221 0.584 -8.211 1.00 0.00 C ATOM 482 C SER A 37 -9.440 -0.930 -8.244 1.00 0.00 C ATOM 483 O SER A 37 -8.485 -1.701 -8.396 1.00 0.00 O ATOM 484 CB SER A 37 -9.143 1.150 -9.624 1.00 0.00 C ATOM 485 OG SER A 37 -8.157 2.170 -9.695 1.00 0.00 O ATOM 0 H SER A 37 -7.349 1.485 -8.055 1.00 0.00 H new ATOM 0 HA SER A 37 -10.068 1.027 -7.687 1.00 0.00 H new ATOM 0 HB2 SER A 37 -8.903 0.354 -10.329 1.00 0.00 H new ATOM 0 HB3 SER A 37 -10.113 1.552 -9.916 1.00 0.00 H new ATOM 0 HG SER A 37 -7.410 1.865 -10.251 1.00 0.00 H new ATOM 491 N PRO A 38 -10.699 -1.379 -8.101 1.00 0.00 N ATOM 492 CA PRO A 38 -11.037 -2.803 -8.022 1.00 0.00 C ATOM 493 C PRO A 38 -10.518 -3.601 -9.215 1.00 0.00 C ATOM 494 O PRO A 38 -10.043 -4.719 -9.055 1.00 0.00 O ATOM 495 CB PRO A 38 -12.574 -2.825 -7.982 1.00 0.00 C ATOM 496 CG PRO A 38 -13.006 -1.460 -8.404 1.00 0.00 C ATOM 497 CD PRO A 38 -11.896 -0.527 -8.011 1.00 0.00 C ATOM 0 HA PRO A 38 -10.576 -3.270 -7.152 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -12.973 -3.587 -8.652 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -12.937 -3.059 -6.981 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -13.183 -1.423 -9.479 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -13.940 -1.180 -7.917 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -11.833 0.330 -8.682 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -12.037 -0.134 -7.004 1.00 0.00 H new ATOM 505 N ALA A 39 -10.581 -3.011 -10.403 1.00 0.00 N ATOM 506 CA ALA A 39 -10.140 -3.684 -11.625 1.00 0.00 C ATOM 507 C ALA A 39 -8.630 -3.934 -11.627 1.00 0.00 C ATOM 508 O ALA A 39 -8.124 -4.748 -12.399 1.00 0.00 O ATOM 509 CB ALA A 39 -10.539 -2.869 -12.844 1.00 0.00 C ATOM 0 H ALA A 39 -10.934 -2.065 -10.549 1.00 0.00 H new ATOM 0 HA ALA A 39 -10.633 -4.655 -11.662 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -10.206 -3.379 -13.748 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -11.623 -2.758 -12.869 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -10.075 -1.884 -12.791 1.00 0.00 H new ATOM 515 N GLU A 40 -7.918 -3.237 -10.752 1.00 0.00 N ATOM 516 CA GLU A 40 -6.475 -3.388 -10.646 1.00 0.00 C ATOM 517 C GLU A 40 -6.114 -4.235 -9.431 1.00 0.00 C ATOM 518 O GLU A 40 -5.254 -5.108 -9.503 1.00 0.00 O ATOM 519 CB GLU A 40 -5.796 -2.022 -10.553 1.00 0.00 C ATOM 520 CG GLU A 40 -6.223 -1.051 -11.638 1.00 0.00 C ATOM 521 CD GLU A 40 -5.506 0.279 -11.538 1.00 0.00 C ATOM 522 OE1 GLU A 40 -4.285 0.326 -11.797 1.00 0.00 O ATOM 523 OE2 GLU A 40 -6.167 1.289 -11.214 1.00 0.00 O ATOM 0 H GLU A 40 -8.319 -2.559 -10.104 1.00 0.00 H new ATOM 0 HA GLU A 40 -6.119 -3.894 -11.544 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.015 -1.583 -9.579 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.716 -2.159 -10.606 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.028 -1.493 -12.615 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.299 -0.887 -11.572 1.00 0.00 H new ATOM 530 N THR A 41 -6.786 -3.982 -8.316 1.00 0.00 N ATOM 531 CA THR A 41 -6.551 -4.742 -7.095 1.00 0.00 C ATOM 532 C THR A 41 -7.039 -6.189 -7.250 1.00 0.00 C ATOM 533 O THR A 41 -6.540 -7.101 -6.592 1.00 0.00 O ATOM 534 CB THR A 41 -7.227 -4.053 -5.879 1.00 0.00 C ATOM 535 OG1 THR A 41 -6.355 -4.089 -4.747 1.00 0.00 O ATOM 536 CG2 THR A 41 -8.558 -4.697 -5.510 1.00 0.00 C ATOM 0 H THR A 41 -7.498 -3.257 -8.231 1.00 0.00 H new ATOM 0 HA THR A 41 -5.477 -4.769 -6.912 1.00 0.00 H new ATOM 0 HB THR A 41 -7.426 -3.021 -6.169 1.00 0.00 H new ATOM 0 HG1 THR A 41 -6.789 -3.651 -3.986 1.00 0.00 H new ATOM 0 HG21 THR A 41 -8.989 -4.178 -4.654 1.00 0.00 H new ATOM 0 HG22 THR A 41 -9.242 -4.630 -6.356 1.00 0.00 H new ATOM 0 HG23 THR A 41 -8.397 -5.745 -5.255 1.00 0.00 H new ATOM 544 N ASN A 42 -8.008 -6.388 -8.136 1.00 0.00 N ATOM 545 CA ASN A 42 -8.562 -7.712 -8.396 1.00 0.00 C ATOM 546 C ASN A 42 -8.049 -8.250 -9.722 1.00 0.00 C ATOM 547 O ASN A 42 -8.595 -9.206 -10.268 1.00 0.00 O ATOM 548 CB ASN A 42 -10.091 -7.659 -8.416 1.00 0.00 C ATOM 549 CG ASN A 42 -10.711 -8.226 -7.155 1.00 0.00 C ATOM 550 OD1 ASN A 42 -11.427 -9.229 -7.192 1.00 0.00 O ATOM 551 ND2 ASN A 42 -10.447 -7.577 -6.031 1.00 0.00 N ATOM 0 H ASN A 42 -8.429 -5.643 -8.691 1.00 0.00 H new ATOM 0 HA ASN A 42 -8.243 -8.379 -7.595 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -10.413 -6.625 -8.542 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -10.459 -8.215 -9.279 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -10.842 -7.903 -5.149 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -9.849 -6.751 -6.047 1.00 0.00 H new ATOM 558 N ASN A 43 -7.011 -7.609 -10.242 1.00 0.00 N ATOM 559 CA ASN A 43 -6.462 -7.950 -11.556 1.00 0.00 C ATOM 560 C ASN A 43 -5.922 -9.380 -11.598 1.00 0.00 C ATOM 561 O ASN A 43 -5.873 -10.001 -12.660 1.00 0.00 O ATOM 562 CB ASN A 43 -5.355 -6.964 -11.937 1.00 0.00 C ATOM 563 CG ASN A 43 -5.206 -6.801 -13.438 1.00 0.00 C ATOM 564 OD1 ASN A 43 -4.363 -7.443 -14.060 1.00 0.00 O ATOM 565 ND2 ASN A 43 -6.023 -5.943 -14.029 1.00 0.00 N ATOM 0 H ASN A 43 -6.526 -6.844 -9.773 1.00 0.00 H new ATOM 0 HA ASN A 43 -7.277 -7.883 -12.277 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -5.569 -5.993 -11.490 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -4.409 -7.306 -11.517 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -5.966 -5.796 -15.037 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -6.710 -5.429 -13.477 1.00 0.00 H new ATOM 572 N ASP A 44 -5.522 -9.905 -10.447 1.00 0.00 N ATOM 573 CA ASP A 44 -5.010 -11.268 -10.369 1.00 0.00 C ATOM 574 C ASP A 44 -5.839 -12.091 -9.393 1.00 0.00 C ATOM 575 O ASP A 44 -6.398 -11.553 -8.437 1.00 0.00 O ATOM 576 CB ASP A 44 -3.540 -11.272 -9.943 1.00 0.00 C ATOM 577 CG ASP A 44 -2.893 -12.632 -10.108 1.00 0.00 C ATOM 578 OD1 ASP A 44 -2.995 -13.462 -9.182 1.00 0.00 O ATOM 579 OD2 ASP A 44 -2.304 -12.883 -11.177 1.00 0.00 O ATOM 0 H ASP A 44 -5.542 -9.409 -9.556 1.00 0.00 H new ATOM 0 HA ASP A 44 -5.084 -11.716 -11.360 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -2.992 -10.538 -10.534 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -3.466 -10.962 -8.901 1.00 0.00 H new ATOM 584 N SER A 45 -5.906 -13.392 -9.645 1.00 0.00 N ATOM 585 CA SER A 45 -6.675 -14.311 -8.818 1.00 0.00 C ATOM 586 C SER A 45 -6.084 -14.418 -7.415 1.00 0.00 C ATOM 587 O SER A 45 -6.810 -14.566 -6.431 1.00 0.00 O ATOM 588 CB SER A 45 -6.698 -15.684 -9.490 1.00 0.00 C ATOM 589 OG SER A 45 -5.878 -15.685 -10.651 1.00 0.00 O ATOM 0 H SER A 45 -5.429 -13.839 -10.428 1.00 0.00 H new ATOM 0 HA SER A 45 -7.692 -13.931 -8.718 1.00 0.00 H new ATOM 0 HB2 SER A 45 -6.349 -16.443 -8.790 1.00 0.00 H new ATOM 0 HB3 SER A 45 -7.721 -15.946 -9.760 1.00 0.00 H new ATOM 0 HG SER A 45 -5.903 -16.571 -11.068 1.00 0.00 H new ATOM 595 N LEU A 46 -4.762 -14.343 -7.326 1.00 0.00 N ATOM 596 CA LEU A 46 -4.088 -14.429 -6.044 1.00 0.00 C ATOM 597 C LEU A 46 -3.880 -13.042 -5.459 1.00 0.00 C ATOM 598 O LEU A 46 -3.612 -12.893 -4.269 1.00 0.00 O ATOM 599 CB LEU A 46 -2.751 -15.157 -6.185 1.00 0.00 C ATOM 600 CG LEU A 46 -2.308 -15.927 -4.940 1.00 0.00 C ATOM 601 CD1 LEU A 46 -2.671 -17.399 -5.057 1.00 0.00 C ATOM 602 CD2 LEU A 46 -0.815 -15.766 -4.723 1.00 0.00 C ATOM 0 H LEU A 46 -4.140 -14.223 -8.126 1.00 0.00 H new ATOM 0 HA LEU A 46 -4.718 -15.001 -5.363 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -2.818 -15.853 -7.021 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -1.981 -14.428 -6.438 1.00 0.00 H new ATOM 0 HG LEU A 46 -2.833 -15.514 -4.078 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -2.346 -17.926 -4.160 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -3.751 -17.500 -5.166 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -2.177 -17.827 -5.929 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -0.515 -16.320 -3.833 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -0.278 -16.152 -5.589 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -0.578 -14.710 -4.590 1.00 0.00 H new ATOM 614 N LEU A 47 -4.020 -12.025 -6.306 1.00 0.00 N ATOM 615 CA LEU A 47 -3.824 -10.640 -5.886 1.00 0.00 C ATOM 616 C LEU A 47 -4.809 -10.255 -4.796 1.00 0.00 C ATOM 617 O LEU A 47 -4.448 -9.586 -3.827 1.00 0.00 O ATOM 618 CB LEU A 47 -3.986 -9.695 -7.074 1.00 0.00 C ATOM 619 CG LEU A 47 -2.956 -8.569 -7.162 1.00 0.00 C ATOM 620 CD1 LEU A 47 -1.542 -9.132 -7.147 1.00 0.00 C ATOM 621 CD2 LEU A 47 -3.187 -7.749 -8.420 1.00 0.00 C ATOM 0 H LEU A 47 -4.269 -12.135 -7.289 1.00 0.00 H new ATOM 0 HA LEU A 47 -2.812 -10.554 -5.490 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.938 -10.281 -7.992 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.981 -9.252 -7.031 1.00 0.00 H new ATOM 0 HG LEU A 47 -3.074 -7.921 -6.293 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -0.824 -8.314 -7.210 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -1.381 -9.686 -6.222 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -1.407 -9.800 -7.998 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.448 -6.949 -8.474 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.091 -8.391 -9.296 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.188 -7.318 -8.394 1.00 0.00 H new ATOM 633 N SER A 48 -6.050 -10.699 -4.952 1.00 0.00 N ATOM 634 CA SER A 48 -7.108 -10.366 -4.017 1.00 0.00 C ATOM 635 C SER A 48 -6.854 -11.000 -2.649 1.00 0.00 C ATOM 636 O SER A 48 -7.255 -10.459 -1.619 1.00 0.00 O ATOM 637 CB SER A 48 -8.446 -10.825 -4.588 1.00 0.00 C ATOM 638 OG SER A 48 -8.242 -11.576 -5.772 1.00 0.00 O ATOM 0 H SER A 48 -6.346 -11.295 -5.725 1.00 0.00 H new ATOM 0 HA SER A 48 -7.129 -9.285 -3.875 1.00 0.00 H new ATOM 0 HB2 SER A 48 -8.975 -11.430 -3.852 1.00 0.00 H new ATOM 0 HB3 SER A 48 -9.074 -9.960 -4.801 1.00 0.00 H new ATOM 0 HG SER A 48 -9.107 -11.866 -6.128 1.00 0.00 H new ATOM 644 N GLY A 49 -6.183 -12.145 -2.650 1.00 0.00 N ATOM 645 CA GLY A 49 -5.833 -12.800 -1.404 1.00 0.00 C ATOM 646 C GLY A 49 -4.546 -12.247 -0.820 1.00 0.00 C ATOM 647 O GLY A 49 -4.362 -12.225 0.396 1.00 0.00 O ATOM 0 H GLY A 49 -5.875 -12.632 -3.492 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -6.643 -12.672 -0.686 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -5.724 -13.871 -1.574 1.00 0.00 H new ATOM 651 N LEU A 50 -3.664 -11.789 -1.700 1.00 0.00 N ATOM 652 CA LEU A 50 -2.383 -11.210 -1.304 1.00 0.00 C ATOM 653 C LEU A 50 -2.583 -9.879 -0.595 1.00 0.00 C ATOM 654 O LEU A 50 -1.714 -9.419 0.140 1.00 0.00 O ATOM 655 CB LEU A 50 -1.507 -11.014 -2.544 1.00 0.00 C ATOM 656 CG LEU A 50 -0.182 -11.784 -2.548 1.00 0.00 C ATOM 657 CD1 LEU A 50 -0.338 -13.140 -1.871 1.00 0.00 C ATOM 658 CD2 LEU A 50 0.324 -11.950 -3.973 1.00 0.00 C ATOM 0 H LEU A 50 -3.815 -11.808 -2.709 1.00 0.00 H new ATOM 0 HA LEU A 50 -1.892 -11.893 -0.611 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -2.081 -11.310 -3.422 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.289 -9.951 -2.648 1.00 0.00 H new ATOM 0 HG LEU A 50 0.551 -11.210 -1.982 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.616 -13.667 -1.887 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.656 -12.997 -0.838 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -1.086 -13.728 -2.403 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.266 -12.498 -3.963 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -0.411 -12.502 -4.558 1.00 0.00 H new ATOM 0 HD23 LEU A 50 0.481 -10.968 -4.420 1.00 0.00 H new ATOM 670 N LEU A 51 -3.744 -9.276 -0.828 1.00 0.00 N ATOM 671 CA LEU A 51 -4.098 -7.995 -0.225 1.00 0.00 C ATOM 672 C LEU A 51 -4.022 -8.061 1.297 1.00 0.00 C ATOM 673 O LEU A 51 -3.722 -7.066 1.963 1.00 0.00 O ATOM 674 CB LEU A 51 -5.514 -7.582 -0.647 1.00 0.00 C ATOM 675 CG LEU A 51 -5.611 -6.457 -1.688 1.00 0.00 C ATOM 676 CD1 LEU A 51 -4.292 -5.715 -1.824 1.00 0.00 C ATOM 677 CD2 LEU A 51 -6.058 -7.015 -3.032 1.00 0.00 C ATOM 0 H LEU A 51 -4.465 -9.660 -1.439 1.00 0.00 H new ATOM 0 HA LEU A 51 -3.381 -7.254 -0.577 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -6.023 -8.460 -1.044 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -6.060 -7.272 0.244 1.00 0.00 H new ATOM 0 HG LEU A 51 -6.358 -5.742 -1.343 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -4.394 -4.925 -2.568 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -4.021 -5.276 -0.864 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -3.514 -6.411 -2.138 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -6.122 -6.205 -3.759 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -5.337 -7.756 -3.376 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -7.036 -7.484 -2.924 1.00 0.00 H new ATOM 689 N GLY A 52 -4.295 -9.236 1.843 1.00 0.00 N ATOM 690 CA GLY A 52 -4.269 -9.408 3.273 1.00 0.00 C ATOM 691 C GLY A 52 -3.597 -10.698 3.676 1.00 0.00 C ATOM 692 O GLY A 52 -4.208 -11.763 3.621 1.00 0.00 O ATOM 0 H GLY A 52 -4.535 -10.075 1.315 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -3.745 -8.568 3.730 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -5.289 -9.395 3.658 1.00 0.00 H new ATOM 696 N ALA A 53 -2.334 -10.603 4.082 1.00 0.00 N ATOM 697 CA ALA A 53 -1.586 -11.763 4.556 1.00 0.00 C ATOM 698 C ALA A 53 -2.040 -12.154 5.963 1.00 0.00 C ATOM 699 O ALA A 53 -1.235 -12.235 6.892 1.00 0.00 O ATOM 700 CB ALA A 53 -0.090 -11.471 4.543 1.00 0.00 C ATOM 0 H ALA A 53 -1.805 -9.731 4.092 1.00 0.00 H new ATOM 0 HA ALA A 53 -1.783 -12.599 3.885 1.00 0.00 H new ATOM 0 HB1 ALA A 53 0.455 -12.346 4.899 1.00 0.00 H new ATOM 0 HB2 ALA A 53 0.226 -11.236 3.527 1.00 0.00 H new ATOM 0 HB3 ALA A 53 0.121 -10.622 5.194 1.00 0.00 H new ATOM 706 N GLY A 54 -3.335 -12.381 6.107 1.00 0.00 N ATOM 707 CA GLY A 54 -3.905 -12.732 7.387 1.00 0.00 C ATOM 708 C GLY A 54 -5.408 -12.576 7.387 1.00 0.00 C ATOM 709 O GLY A 54 -6.099 -13.226 6.610 1.00 0.00 O ATOM 0 H GLY A 54 -4.011 -12.327 5.345 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -3.645 -13.762 7.632 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -3.473 -12.101 8.164 1.00 0.00 H new ATOM 713 N LEU A 55 -5.916 -11.693 8.235 1.00 0.00 N ATOM 714 CA LEU A 55 -7.354 -11.497 8.356 1.00 0.00 C ATOM 715 C LEU A 55 -7.720 -10.051 8.019 1.00 0.00 C ATOM 716 O LEU A 55 -8.378 -9.370 8.797 1.00 0.00 O ATOM 717 CB LEU A 55 -7.819 -11.844 9.777 1.00 0.00 C ATOM 718 CG LEU A 55 -8.464 -13.222 9.939 1.00 0.00 C ATOM 719 CD1 LEU A 55 -7.418 -14.324 9.817 1.00 0.00 C ATOM 720 CD2 LEU A 55 -9.186 -13.314 11.275 1.00 0.00 C ATOM 0 H LEU A 55 -5.355 -11.102 8.848 1.00 0.00 H new ATOM 0 HA LEU A 55 -7.858 -12.159 7.652 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.961 -11.782 10.447 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -8.533 -11.087 10.102 1.00 0.00 H new ATOM 0 HG LEU A 55 -9.194 -13.357 9.141 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.898 -15.296 9.935 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.945 -14.270 8.836 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.662 -14.196 10.592 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -9.640 -14.300 11.376 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.474 -13.158 12.085 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -9.962 -12.550 11.322 1.00 0.00 H new ATOM 732 N LEU A 56 -7.280 -9.586 6.858 1.00 0.00 N ATOM 733 CA LEU A 56 -7.487 -8.196 6.465 1.00 0.00 C ATOM 734 C LEU A 56 -8.818 -8.003 5.738 1.00 0.00 C ATOM 735 O LEU A 56 -9.469 -8.965 5.331 1.00 0.00 O ATOM 736 CB LEU A 56 -6.329 -7.724 5.582 1.00 0.00 C ATOM 737 CG LEU A 56 -5.156 -7.076 6.331 1.00 0.00 C ATOM 738 CD1 LEU A 56 -5.628 -6.388 7.606 1.00 0.00 C ATOM 739 CD2 LEU A 56 -4.087 -8.113 6.653 1.00 0.00 C ATOM 0 H LEU A 56 -6.778 -10.149 6.171 1.00 0.00 H new ATOM 0 HA LEU A 56 -7.519 -7.595 7.374 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -5.952 -8.577 5.018 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -6.715 -7.008 4.856 1.00 0.00 H new ATOM 0 HG LEU A 56 -4.723 -6.318 5.679 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -4.775 -5.939 8.114 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -6.351 -5.612 7.354 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -6.097 -7.121 8.263 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -3.264 -7.634 7.184 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.516 -8.896 7.279 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -3.715 -8.552 5.727 1.00 0.00 H new ATOM 751 N ASN A 57 -9.208 -6.746 5.588 1.00 0.00 N ATOM 752 CA ASN A 57 -10.450 -6.388 4.935 1.00 0.00 C ATOM 753 C ASN A 57 -10.189 -5.269 3.927 1.00 0.00 C ATOM 754 O ASN A 57 -9.049 -4.827 3.771 1.00 0.00 O ATOM 755 CB ASN A 57 -11.465 -5.950 5.993 1.00 0.00 C ATOM 756 CG ASN A 57 -12.897 -5.893 5.501 1.00 0.00 C ATOM 757 OD1 ASN A 57 -13.237 -6.406 4.435 1.00 0.00 O ATOM 758 ND2 ASN A 57 -13.751 -5.273 6.293 1.00 0.00 N ATOM 0 H ASN A 57 -8.668 -5.946 5.918 1.00 0.00 H new ATOM 0 HA ASN A 57 -10.856 -7.245 4.398 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -11.411 -6.637 6.837 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -11.182 -4.965 6.365 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -14.734 -5.206 6.030 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -13.428 -4.861 7.168 1.00 0.00 H new ATOM 765 N GLY A 58 -11.235 -4.814 3.255 1.00 0.00 N ATOM 766 CA GLY A 58 -11.066 -3.812 2.220 1.00 0.00 C ATOM 767 C GLY A 58 -11.444 -2.419 2.687 1.00 0.00 C ATOM 768 O GLY A 58 -11.386 -2.117 3.879 1.00 0.00 O ATOM 0 H GLY A 58 -12.197 -5.119 3.406 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -10.028 -3.810 1.888 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -11.676 -4.080 1.358 1.00 0.00 H new ATOM 772 N LEU A 59 -11.843 -1.572 1.748 1.00 0.00 N ATOM 773 CA LEU A 59 -12.229 -0.198 2.057 1.00 0.00 C ATOM 774 C LEU A 59 -13.513 -0.167 2.880 1.00 0.00 C ATOM 775 O LEU A 59 -14.409 -0.987 2.674 1.00 0.00 O ATOM 776 CB LEU A 59 -12.417 0.590 0.757 1.00 0.00 C ATOM 777 CG LEU A 59 -12.267 2.108 0.870 1.00 0.00 C ATOM 778 CD1 LEU A 59 -11.020 2.463 1.658 1.00 0.00 C ATOM 779 CD2 LEU A 59 -12.220 2.740 -0.516 1.00 0.00 C ATOM 0 H LEU A 59 -11.909 -1.813 0.759 1.00 0.00 H new ATOM 0 HA LEU A 59 -11.436 0.262 2.647 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -11.695 0.226 0.026 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -13.409 0.370 0.362 1.00 0.00 H new ATOM 0 HG LEU A 59 -13.133 2.502 1.402 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -10.930 3.547 1.728 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -11.090 2.039 2.660 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -10.143 2.058 1.153 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -12.113 3.820 -0.420 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -11.371 2.339 -1.070 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -13.142 2.513 -1.051 1.00 0.00 H new ATOM 791 N SER A 60 -13.587 0.776 3.814 1.00 0.00 N ATOM 792 CA SER A 60 -14.743 0.928 4.691 1.00 0.00 C ATOM 793 C SER A 60 -16.020 1.184 3.895 1.00 0.00 C ATOM 794 O SER A 60 -16.321 2.318 3.529 1.00 0.00 O ATOM 795 CB SER A 60 -14.501 2.072 5.680 1.00 0.00 C ATOM 796 OG SER A 60 -13.550 1.700 6.665 1.00 0.00 O ATOM 0 H SER A 60 -12.847 1.457 3.984 1.00 0.00 H new ATOM 0 HA SER A 60 -14.874 -0.005 5.240 1.00 0.00 H new ATOM 0 HB2 SER A 60 -14.148 2.953 5.143 1.00 0.00 H new ATOM 0 HB3 SER A 60 -15.440 2.346 6.161 1.00 0.00 H new ATOM 0 HG SER A 60 -13.778 2.126 7.517 1.00 0.00 H new ATOM 802 N GLY A 61 -16.754 0.115 3.623 1.00 0.00 N ATOM 803 CA GLY A 61 -18.003 0.235 2.909 1.00 0.00 C ATOM 804 C GLY A 61 -17.858 -0.056 1.429 1.00 0.00 C ATOM 805 O GLY A 61 -18.853 -0.252 0.735 1.00 0.00 O ATOM 0 H GLY A 61 -16.503 -0.838 3.887 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -18.732 -0.451 3.341 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -18.397 1.243 3.041 1.00 0.00 H new ATOM 809 N ASN A 62 -16.624 -0.093 0.940 1.00 0.00 N ATOM 810 CA ASN A 62 -16.387 -0.322 -0.479 1.00 0.00 C ATOM 811 C ASN A 62 -16.012 -1.772 -0.740 1.00 0.00 C ATOM 812 O ASN A 62 -14.841 -2.147 -0.671 1.00 0.00 O ATOM 813 CB ASN A 62 -15.286 0.597 -1.001 1.00 0.00 C ATOM 814 CG ASN A 62 -15.379 0.818 -2.497 1.00 0.00 C ATOM 815 OD1 ASN A 62 -14.953 -0.023 -3.292 1.00 0.00 O ATOM 816 ND2 ASN A 62 -15.943 1.949 -2.885 1.00 0.00 N ATOM 0 H ASN A 62 -15.780 0.031 1.499 1.00 0.00 H new ATOM 0 HA ASN A 62 -17.313 -0.098 -1.008 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -15.346 1.558 -0.490 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -14.314 0.168 -0.760 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -16.040 2.156 -3.879 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -16.281 2.615 -2.190 1.00 0.00 H new ATOM 823 N THR A 63 -17.019 -2.584 -1.033 1.00 0.00 N ATOM 824 CA THR A 63 -16.814 -3.981 -1.372 1.00 0.00 C ATOM 825 C THR A 63 -16.285 -4.128 -2.800 1.00 0.00 C ATOM 826 O THR A 63 -17.005 -4.554 -3.702 1.00 0.00 O ATOM 827 CB THR A 63 -18.130 -4.765 -1.224 1.00 0.00 C ATOM 828 OG1 THR A 63 -18.922 -4.189 -0.171 1.00 0.00 O ATOM 829 CG2 THR A 63 -17.853 -6.227 -0.916 1.00 0.00 C ATOM 0 H THR A 63 -17.996 -2.292 -1.042 1.00 0.00 H new ATOM 0 HA THR A 63 -16.073 -4.387 -0.684 1.00 0.00 H new ATOM 0 HB THR A 63 -18.676 -4.706 -2.165 1.00 0.00 H new ATOM 0 HG1 THR A 63 -19.760 -4.689 -0.081 1.00 0.00 H new ATOM 0 HG21 THR A 63 -18.797 -6.763 -0.815 1.00 0.00 H new ATOM 0 HG22 THR A 63 -17.271 -6.666 -1.727 1.00 0.00 H new ATOM 0 HG23 THR A 63 -17.292 -6.303 0.015 1.00 0.00 H new ATOM 837 N GLY A 64 -15.028 -3.760 -2.991 1.00 0.00 N ATOM 838 CA GLY A 64 -14.401 -3.862 -4.293 1.00 0.00 C ATOM 839 C GLY A 64 -12.966 -3.394 -4.248 1.00 0.00 C ATOM 840 O GLY A 64 -12.064 -4.068 -4.744 1.00 0.00 O ATOM 0 H GLY A 64 -14.424 -3.388 -2.258 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -14.438 -4.896 -4.637 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -14.958 -3.265 -5.015 1.00 0.00 H new ATOM 844 N SER A 65 -12.758 -2.234 -3.646 1.00 0.00 N ATOM 845 CA SER A 65 -11.422 -1.695 -3.467 1.00 0.00 C ATOM 846 C SER A 65 -10.842 -2.143 -2.125 1.00 0.00 C ATOM 847 O SER A 65 -11.501 -2.040 -1.089 1.00 0.00 O ATOM 848 CB SER A 65 -11.453 -0.168 -3.551 1.00 0.00 C ATOM 849 OG SER A 65 -11.166 0.275 -4.867 1.00 0.00 O ATOM 0 H SER A 65 -13.503 -1.646 -3.272 1.00 0.00 H new ATOM 0 HA SER A 65 -10.783 -2.075 -4.264 1.00 0.00 H new ATOM 0 HB2 SER A 65 -12.434 0.197 -3.247 1.00 0.00 H new ATOM 0 HB3 SER A 65 -10.727 0.253 -2.855 1.00 0.00 H new ATOM 0 HG SER A 65 -10.273 -0.033 -5.129 1.00 0.00 H new ATOM 855 N ALA A 66 -9.618 -2.653 -2.152 1.00 0.00 N ATOM 856 CA ALA A 66 -8.952 -3.112 -0.941 1.00 0.00 C ATOM 857 C ALA A 66 -7.701 -2.281 -0.681 1.00 0.00 C ATOM 858 O ALA A 66 -7.222 -1.577 -1.572 1.00 0.00 O ATOM 859 CB ALA A 66 -8.610 -4.593 -1.057 1.00 0.00 C ATOM 0 H ALA A 66 -9.065 -2.759 -3.002 1.00 0.00 H new ATOM 0 HA ALA A 66 -9.627 -2.984 -0.095 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -8.112 -4.924 -0.145 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -9.525 -5.168 -1.200 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -7.947 -4.748 -1.909 1.00 0.00 H new ATOM 865 N CYS A 67 -7.173 -2.368 0.532 1.00 0.00 N ATOM 866 CA CYS A 67 -6.003 -1.598 0.903 1.00 0.00 C ATOM 867 C CYS A 67 -4.953 -2.506 1.524 1.00 0.00 C ATOM 868 O CYS A 67 -5.237 -3.247 2.471 1.00 0.00 O ATOM 869 CB CYS A 67 -6.397 -0.506 1.897 1.00 0.00 C ATOM 870 SG CYS A 67 -6.286 1.192 1.246 1.00 0.00 S ATOM 0 H CYS A 67 -7.539 -2.965 1.273 1.00 0.00 H new ATOM 0 HA CYS A 67 -5.585 -1.137 0.008 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -7.419 -0.687 2.229 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -5.758 -0.586 2.776 1.00 0.00 H new ATOM 875 N ALA A 68 -3.735 -2.435 1.006 1.00 0.00 N ATOM 876 CA ALA A 68 -2.638 -3.224 1.543 1.00 0.00 C ATOM 877 C ALA A 68 -1.651 -2.320 2.260 1.00 0.00 C ATOM 878 O ALA A 68 -1.475 -1.162 1.884 1.00 0.00 O ATOM 879 CB ALA A 68 -1.937 -4.016 0.453 1.00 0.00 C ATOM 0 H ALA A 68 -3.483 -1.840 0.217 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.052 -3.938 2.255 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.123 -4.594 0.890 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -2.649 -4.692 -0.020 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -1.536 -3.331 -0.294 1.00 0.00 H new ATOM 885 N LYS A 69 -1.011 -2.857 3.282 1.00 0.00 N ATOM 886 CA LYS A 69 -0.110 -2.078 4.116 1.00 0.00 C ATOM 887 C LYS A 69 1.317 -2.178 3.601 1.00 0.00 C ATOM 888 O LYS A 69 1.613 -3.016 2.749 1.00 0.00 O ATOM 889 CB LYS A 69 -0.188 -2.562 5.566 1.00 0.00 C ATOM 890 CG LYS A 69 -1.275 -1.882 6.387 1.00 0.00 C ATOM 891 CD LYS A 69 -2.667 -2.143 5.824 1.00 0.00 C ATOM 892 CE LYS A 69 -3.145 -3.545 6.146 1.00 0.00 C ATOM 893 NZ LYS A 69 -4.631 -3.628 6.143 1.00 0.00 N ATOM 0 H LYS A 69 -1.098 -3.835 3.557 1.00 0.00 H new ATOM 0 HA LYS A 69 -0.415 -1.032 4.076 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -0.363 -3.638 5.570 1.00 0.00 H new ATOM 0 HB3 LYS A 69 0.776 -2.394 6.047 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -1.228 -2.239 7.416 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -1.091 -0.808 6.413 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -3.368 -1.416 6.234 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -2.656 -2.001 4.743 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -2.739 -4.246 5.417 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -2.765 -3.845 7.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -4.969 -3.830 7.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.029 -2.723 5.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -4.935 -4.389 5.502 1.00 0.00 H new ATOM 907 N ALA A 70 2.198 -1.328 4.121 1.00 0.00 N ATOM 908 CA ALA A 70 3.592 -1.319 3.689 1.00 0.00 C ATOM 909 C ALA A 70 4.265 -2.656 3.972 1.00 0.00 C ATOM 910 O ALA A 70 5.138 -3.092 3.220 1.00 0.00 O ATOM 911 CB ALA A 70 4.353 -0.189 4.358 1.00 0.00 C ATOM 0 H ALA A 70 1.973 -0.639 4.839 1.00 0.00 H new ATOM 0 HA ALA A 70 3.606 -1.156 2.611 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.390 -0.200 4.022 1.00 0.00 H new ATOM 0 HB2 ALA A 70 3.896 0.764 4.093 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.320 -0.319 5.440 1.00 0.00 H new ATOM 917 N SER A 71 3.846 -3.305 5.050 1.00 0.00 N ATOM 918 CA SER A 71 4.343 -4.625 5.391 1.00 0.00 C ATOM 919 C SER A 71 3.956 -5.614 4.298 1.00 0.00 C ATOM 920 O SER A 71 4.792 -6.352 3.789 1.00 0.00 O ATOM 921 CB SER A 71 3.764 -5.050 6.738 1.00 0.00 C ATOM 922 OG SER A 71 2.936 -4.026 7.271 1.00 0.00 O ATOM 0 H SER A 71 3.158 -2.933 5.705 1.00 0.00 H new ATOM 0 HA SER A 71 5.430 -4.605 5.469 1.00 0.00 H new ATOM 0 HB2 SER A 71 3.187 -5.967 6.619 1.00 0.00 H new ATOM 0 HB3 SER A 71 4.573 -5.271 7.434 1.00 0.00 H new ATOM 0 HG SER A 71 1.998 -4.305 7.222 1.00 0.00 H new ATOM 928 N LEU A 72 2.683 -5.586 3.915 1.00 0.00 N ATOM 929 CA LEU A 72 2.180 -6.431 2.838 1.00 0.00 C ATOM 930 C LEU A 72 2.946 -6.175 1.548 1.00 0.00 C ATOM 931 O LEU A 72 3.272 -7.106 0.809 1.00 0.00 O ATOM 932 CB LEU A 72 0.689 -6.167 2.617 1.00 0.00 C ATOM 933 CG LEU A 72 -0.233 -7.349 2.908 1.00 0.00 C ATOM 934 CD1 LEU A 72 0.435 -8.657 2.514 1.00 0.00 C ATOM 935 CD2 LEU A 72 -0.624 -7.368 4.379 1.00 0.00 C ATOM 0 H LEU A 72 1.977 -4.983 4.338 1.00 0.00 H new ATOM 0 HA LEU A 72 2.323 -7.473 3.125 1.00 0.00 H new ATOM 0 HB2 LEU A 72 0.388 -5.329 3.246 1.00 0.00 H new ATOM 0 HB3 LEU A 72 0.541 -5.858 1.582 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.139 -7.235 2.313 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -0.237 -9.488 2.729 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.664 -8.642 1.449 1.00 0.00 H new ATOM 0 HD13 LEU A 72 1.357 -8.780 3.082 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.281 -8.216 4.570 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.272 -7.458 4.993 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.144 -6.443 4.629 1.00 0.00 H new ATOM 947 N ILE A 73 3.237 -4.906 1.288 1.00 0.00 N ATOM 948 CA ILE A 73 3.972 -4.516 0.098 1.00 0.00 C ATOM 949 C ILE A 73 5.356 -5.159 0.086 1.00 0.00 C ATOM 950 O ILE A 73 5.771 -5.752 -0.913 1.00 0.00 O ATOM 951 CB ILE A 73 4.097 -2.982 0.000 1.00 0.00 C ATOM 952 CG1 ILE A 73 2.743 -2.377 -0.365 1.00 0.00 C ATOM 953 CG2 ILE A 73 5.143 -2.584 -1.032 1.00 0.00 C ATOM 954 CD1 ILE A 73 2.490 -1.016 0.249 1.00 0.00 C ATOM 0 H ILE A 73 2.972 -4.128 1.891 1.00 0.00 H new ATOM 0 HA ILE A 73 3.414 -4.869 -0.769 1.00 0.00 H new ATOM 0 HB ILE A 73 4.416 -2.599 0.969 1.00 0.00 H new ATOM 0 HG12 ILE A 73 2.675 -2.293 -1.450 1.00 0.00 H new ATOM 0 HG13 ILE A 73 1.954 -3.059 -0.048 1.00 0.00 H new ATOM 0 HG21 ILE A 73 5.211 -1.497 -1.081 1.00 0.00 H new ATOM 0 HG22 ILE A 73 6.111 -2.996 -0.746 1.00 0.00 H new ATOM 0 HG23 ILE A 73 4.857 -2.974 -2.009 1.00 0.00 H new ATOM 0 HD11 ILE A 73 1.508 -0.655 -0.058 1.00 0.00 H new ATOM 0 HD12 ILE A 73 2.524 -1.095 1.336 1.00 0.00 H new ATOM 0 HD13 ILE A 73 3.255 -0.317 -0.088 1.00 0.00 H new ATOM 966 N ASP A 74 6.050 -5.060 1.217 1.00 0.00 N ATOM 967 CA ASP A 74 7.386 -5.637 1.362 1.00 0.00 C ATOM 968 C ASP A 74 7.334 -7.164 1.315 1.00 0.00 C ATOM 969 O ASP A 74 8.265 -7.814 0.825 1.00 0.00 O ATOM 970 CB ASP A 74 8.022 -5.166 2.685 1.00 0.00 C ATOM 971 CG ASP A 74 9.071 -6.127 3.225 1.00 0.00 C ATOM 972 OD1 ASP A 74 10.261 -5.981 2.870 1.00 0.00 O ATOM 973 OD2 ASP A 74 8.711 -7.029 4.011 1.00 0.00 O ATOM 0 H ASP A 74 5.708 -4.583 2.051 1.00 0.00 H new ATOM 0 HA ASP A 74 7.999 -5.295 0.528 1.00 0.00 H new ATOM 0 HB2 ASP A 74 8.479 -4.188 2.532 1.00 0.00 H new ATOM 0 HB3 ASP A 74 7.238 -5.038 3.431 1.00 0.00 H new ATOM 978 N GLN A 75 6.222 -7.720 1.780 1.00 0.00 N ATOM 979 CA GLN A 75 6.091 -9.157 1.977 1.00 0.00 C ATOM 980 C GLN A 75 6.217 -9.939 0.675 1.00 0.00 C ATOM 981 O GLN A 75 7.036 -10.854 0.570 1.00 0.00 O ATOM 982 CB GLN A 75 4.745 -9.469 2.634 1.00 0.00 C ATOM 983 CG GLN A 75 4.870 -10.128 3.998 1.00 0.00 C ATOM 984 CD GLN A 75 5.073 -9.110 5.104 1.00 0.00 C ATOM 985 OE1 GLN A 75 4.171 -8.839 5.895 1.00 0.00 O ATOM 986 NE2 GLN A 75 6.260 -8.532 5.159 1.00 0.00 N ATOM 0 H GLN A 75 5.388 -7.189 2.030 1.00 0.00 H new ATOM 0 HA GLN A 75 6.910 -9.469 2.625 1.00 0.00 H new ATOM 0 HB2 GLN A 75 4.178 -8.544 2.738 1.00 0.00 H new ATOM 0 HB3 GLN A 75 4.172 -10.122 1.976 1.00 0.00 H new ATOM 0 HG2 GLN A 75 3.972 -10.711 4.202 1.00 0.00 H new ATOM 0 HG3 GLN A 75 5.708 -10.825 3.989 1.00 0.00 H new ATOM 0 HE21 GLN A 75 6.982 -8.785 4.484 1.00 0.00 H new ATOM 0 HE22 GLN A 75 6.454 -7.833 5.876 1.00 0.00 H new ATOM 995 N LEU A 76 5.416 -9.584 -0.323 1.00 0.00 N ATOM 996 CA LEU A 76 5.337 -10.397 -1.532 1.00 0.00 C ATOM 997 C LEU A 76 5.290 -9.550 -2.800 1.00 0.00 C ATOM 998 O LEU A 76 4.787 -10.003 -3.829 1.00 0.00 O ATOM 999 CB LEU A 76 4.104 -11.309 -1.471 1.00 0.00 C ATOM 1000 CG LEU A 76 3.804 -11.910 -0.095 1.00 0.00 C ATOM 1001 CD1 LEU A 76 2.498 -11.358 0.451 1.00 0.00 C ATOM 1002 CD2 LEU A 76 3.756 -13.430 -0.166 1.00 0.00 C ATOM 0 H LEU A 76 4.822 -8.755 -0.322 1.00 0.00 H new ATOM 0 HA LEU A 76 6.244 -11.000 -1.575 1.00 0.00 H new ATOM 0 HB2 LEU A 76 3.234 -10.739 -1.798 1.00 0.00 H new ATOM 0 HB3 LEU A 76 4.238 -12.123 -2.184 1.00 0.00 H new ATOM 0 HG LEU A 76 4.609 -11.629 0.584 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.299 -11.795 1.430 1.00 0.00 H new ATOM 0 HD12 LEU A 76 2.572 -10.275 0.546 1.00 0.00 H new ATOM 0 HD13 LEU A 76 1.684 -11.608 -0.230 1.00 0.00 H new ATOM 0 HD21 LEU A 76 3.541 -13.834 0.823 1.00 0.00 H new ATOM 0 HD22 LEU A 76 2.974 -13.737 -0.861 1.00 0.00 H new ATOM 0 HD23 LEU A 76 4.718 -13.809 -0.512 1.00 0.00 H new ATOM 1014 N GLY A 77 5.828 -8.339 -2.740 1.00 0.00 N ATOM 1015 CA GLY A 77 5.806 -7.481 -3.912 1.00 0.00 C ATOM 1016 C GLY A 77 4.396 -7.053 -4.260 1.00 0.00 C ATOM 1017 O GLY A 77 3.949 -7.208 -5.397 1.00 0.00 O ATOM 0 H GLY A 77 6.273 -7.938 -1.915 1.00 0.00 H new ATOM 0 HA2 GLY A 77 6.421 -6.599 -3.730 1.00 0.00 H new ATOM 0 HA3 GLY A 77 6.247 -8.008 -4.758 1.00 0.00 H new ATOM 1021 N LEU A 78 3.693 -6.534 -3.265 1.00 0.00 N ATOM 1022 CA LEU A 78 2.284 -6.187 -3.402 1.00 0.00 C ATOM 1023 C LEU A 78 2.085 -4.924 -4.246 1.00 0.00 C ATOM 1024 O LEU A 78 1.733 -3.868 -3.724 1.00 0.00 O ATOM 1025 CB LEU A 78 1.658 -5.986 -2.016 1.00 0.00 C ATOM 1026 CG LEU A 78 0.915 -7.186 -1.429 1.00 0.00 C ATOM 1027 CD1 LEU A 78 -0.575 -6.930 -1.454 1.00 0.00 C ATOM 1028 CD2 LEU A 78 1.249 -8.467 -2.178 1.00 0.00 C ATOM 0 H LEU A 78 4.081 -6.341 -2.341 1.00 0.00 H new ATOM 0 HA LEU A 78 1.791 -7.012 -3.916 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.448 -5.700 -1.322 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.964 -5.148 -2.072 1.00 0.00 H new ATOM 0 HG LEU A 78 1.239 -7.316 -0.396 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -1.099 -7.789 -1.034 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -0.802 -6.043 -0.863 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -0.900 -6.774 -2.483 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.704 -9.300 -1.735 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.963 -8.362 -3.224 1.00 0.00 H new ATOM 0 HD23 LEU A 78 2.320 -8.658 -2.112 1.00 0.00 H new ATOM 1040 N LEU A 79 2.294 -5.041 -5.553 1.00 0.00 N ATOM 1041 CA LEU A 79 2.095 -3.914 -6.464 1.00 0.00 C ATOM 1042 C LEU A 79 0.646 -3.851 -6.945 1.00 0.00 C ATOM 1043 O LEU A 79 0.347 -3.233 -7.963 1.00 0.00 O ATOM 1044 CB LEU A 79 3.044 -4.007 -7.667 1.00 0.00 C ATOM 1045 CG LEU A 79 3.732 -5.358 -7.859 1.00 0.00 C ATOM 1046 CD1 LEU A 79 3.165 -6.078 -9.071 1.00 0.00 C ATOM 1047 CD2 LEU A 79 5.231 -5.174 -8.007 1.00 0.00 C ATOM 0 H LEU A 79 2.600 -5.902 -6.007 1.00 0.00 H new ATOM 0 HA LEU A 79 2.319 -3.000 -5.914 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.481 -3.774 -8.571 1.00 0.00 H new ATOM 0 HB3 LEU A 79 3.811 -3.240 -7.563 1.00 0.00 H new ATOM 0 HG LEU A 79 3.543 -5.968 -6.976 1.00 0.00 H new ATOM 0 HD11 LEU A 79 3.667 -7.038 -9.192 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.097 -6.242 -8.930 1.00 0.00 H new ATOM 0 HD13 LEU A 79 3.324 -5.471 -9.962 1.00 0.00 H new ATOM 0 HD21 LEU A 79 5.705 -6.146 -8.143 1.00 0.00 H new ATOM 0 HD22 LEU A 79 5.437 -4.546 -8.874 1.00 0.00 H new ATOM 0 HD23 LEU A 79 5.629 -4.698 -7.111 1.00 0.00 H new ATOM 1059 N ALA A 80 -0.255 -4.478 -6.192 1.00 0.00 N ATOM 1060 CA ALA A 80 -1.676 -4.479 -6.530 1.00 0.00 C ATOM 1061 C ALA A 80 -2.247 -3.071 -6.443 1.00 0.00 C ATOM 1062 O ALA A 80 -3.212 -2.729 -7.128 1.00 0.00 O ATOM 1063 CB ALA A 80 -2.441 -5.419 -5.609 1.00 0.00 C ATOM 0 H ALA A 80 -0.025 -4.993 -5.342 1.00 0.00 H new ATOM 0 HA ALA A 80 -1.785 -4.833 -7.555 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.498 -5.408 -5.874 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -2.051 -6.431 -5.716 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -2.323 -5.092 -4.576 1.00 0.00 H new ATOM 1069 N LEU A 81 -1.636 -2.258 -5.594 1.00 0.00 N ATOM 1070 CA LEU A 81 -2.055 -0.878 -5.404 1.00 0.00 C ATOM 1071 C LEU A 81 -0.852 0.043 -5.448 1.00 0.00 C ATOM 1072 O LEU A 81 -0.938 1.217 -5.081 1.00 0.00 O ATOM 1073 CB LEU A 81 -2.766 -0.713 -4.066 1.00 0.00 C ATOM 1074 CG LEU A 81 -2.753 -1.950 -3.179 1.00 0.00 C ATOM 1075 CD1 LEU A 81 -1.892 -1.719 -1.948 1.00 0.00 C ATOM 1076 CD2 LEU A 81 -4.172 -2.314 -2.800 1.00 0.00 C ATOM 0 H LEU A 81 -0.840 -2.535 -5.020 1.00 0.00 H new ATOM 0 HA LEU A 81 -2.744 -0.617 -6.208 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.302 0.111 -3.523 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -3.801 -0.428 -4.253 1.00 0.00 H new ATOM 0 HG LEU A 81 -2.316 -2.783 -3.729 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -1.896 -2.615 -1.328 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.870 -1.495 -2.255 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -2.291 -0.881 -1.377 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.163 -3.200 -2.165 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -4.628 -1.485 -2.260 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -4.748 -2.520 -3.702 1.00 0.00 H new ATOM 1088 N VAL A 82 0.265 -0.489 -5.903 1.00 0.00 N ATOM 1089 CA VAL A 82 1.518 0.235 -5.861 1.00 0.00 C ATOM 1090 C VAL A 82 2.021 0.515 -7.266 1.00 0.00 C ATOM 1091 O VAL A 82 1.956 -0.342 -8.147 1.00 0.00 O ATOM 1092 CB VAL A 82 2.588 -0.550 -5.062 1.00 0.00 C ATOM 1093 CG1 VAL A 82 3.973 0.071 -5.204 1.00 0.00 C ATOM 1094 CG2 VAL A 82 2.191 -0.631 -3.595 1.00 0.00 C ATOM 0 H VAL A 82 0.329 -1.423 -6.307 1.00 0.00 H new ATOM 0 HA VAL A 82 1.337 1.184 -5.355 1.00 0.00 H new ATOM 0 HB VAL A 82 2.638 -1.557 -5.477 1.00 0.00 H new ATOM 0 HG11 VAL A 82 4.693 -0.510 -4.628 1.00 0.00 H new ATOM 0 HG12 VAL A 82 4.265 0.073 -6.254 1.00 0.00 H new ATOM 0 HG13 VAL A 82 3.953 1.095 -4.831 1.00 0.00 H new ATOM 0 HG21 VAL A 82 2.950 -1.185 -3.043 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.106 0.375 -3.185 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.232 -1.142 -3.505 1.00 0.00 H new ATOM 1104 N ASP A 83 2.503 1.724 -7.459 1.00 0.00 N ATOM 1105 CA ASP A 83 3.104 2.137 -8.710 1.00 0.00 C ATOM 1106 C ASP A 83 4.547 2.523 -8.430 1.00 0.00 C ATOM 1107 O ASP A 83 4.863 2.966 -7.325 1.00 0.00 O ATOM 1108 CB ASP A 83 2.321 3.312 -9.316 1.00 0.00 C ATOM 1109 CG ASP A 83 2.650 3.546 -10.778 1.00 0.00 C ATOM 1110 OD1 ASP A 83 3.718 4.118 -11.074 1.00 0.00 O ATOM 1111 OD2 ASP A 83 1.832 3.161 -11.644 1.00 0.00 O ATOM 0 H ASP A 83 2.489 2.454 -6.747 1.00 0.00 H new ATOM 0 HA ASP A 83 3.076 1.324 -9.435 1.00 0.00 H new ATOM 0 HB2 ASP A 83 1.253 3.121 -9.215 1.00 0.00 H new ATOM 0 HB3 ASP A 83 2.538 4.218 -8.750 1.00 0.00 H new ATOM 1116 N HIS A 84 5.437 2.331 -9.387 1.00 0.00 N ATOM 1117 CA HIS A 84 6.841 2.606 -9.141 1.00 0.00 C ATOM 1118 C HIS A 84 7.314 3.827 -9.905 1.00 0.00 C ATOM 1119 O HIS A 84 7.333 3.840 -11.138 1.00 0.00 O ATOM 1120 CB HIS A 84 7.723 1.404 -9.483 1.00 0.00 C ATOM 1121 CG HIS A 84 9.008 1.410 -8.720 1.00 0.00 C ATOM 1122 ND1 HIS A 84 10.023 2.310 -8.968 1.00 0.00 N ATOM 1123 CD2 HIS A 84 9.418 0.668 -7.666 1.00 0.00 C ATOM 1124 CE1 HIS A 84 10.993 2.127 -8.099 1.00 0.00 C ATOM 1125 NE2 HIS A 84 10.655 1.135 -7.299 1.00 0.00 N ATOM 0 H HIS A 84 5.219 1.992 -10.324 1.00 0.00 H new ATOM 0 HA HIS A 84 6.934 2.808 -8.074 1.00 0.00 H new ATOM 0 HB2 HIS A 84 7.179 0.484 -9.268 1.00 0.00 H new ATOM 0 HB3 HIS A 84 7.937 1.405 -10.552 1.00 0.00 H new ATOM 0 HD1 HIS A 84 10.022 3.009 -9.710 1.00 0.00 H new ATOM 0 HD2 HIS A 84 8.874 -0.140 -7.201 1.00 0.00 H new ATOM 0 HE1 HIS A 84 11.911 2.693 -8.049 1.00 0.00 H new ATOM 1134 N THR A 85 7.692 4.848 -9.161 1.00 0.00 N ATOM 1135 CA THR A 85 8.278 6.044 -9.728 1.00 0.00 C ATOM 1136 C THR A 85 9.765 6.091 -9.390 1.00 0.00 C ATOM 1137 O THR A 85 10.299 5.144 -8.808 1.00 0.00 O ATOM 1138 CB THR A 85 7.579 7.300 -9.179 1.00 0.00 C ATOM 1139 OG1 THR A 85 7.354 7.157 -7.771 1.00 0.00 O ATOM 1140 CG2 THR A 85 6.252 7.533 -9.884 1.00 0.00 C ATOM 0 H THR A 85 7.601 4.870 -8.145 1.00 0.00 H new ATOM 0 HA THR A 85 8.149 6.021 -10.810 1.00 0.00 H new ATOM 0 HB THR A 85 8.226 8.158 -9.361 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.218 8.041 -7.370 1.00 0.00 H new ATOM 0 HG21 THR A 85 5.777 8.426 -9.479 1.00 0.00 H new ATOM 0 HG22 THR A 85 6.426 7.667 -10.952 1.00 0.00 H new ATOM 0 HG23 THR A 85 5.601 6.673 -9.728 1.00 0.00 H new ATOM 1148 N GLU A 86 10.430 7.186 -9.729 1.00 0.00 N ATOM 1149 CA GLU A 86 11.854 7.319 -9.455 1.00 0.00 C ATOM 1150 C GLU A 86 12.088 7.450 -7.951 1.00 0.00 C ATOM 1151 O GLU A 86 13.144 7.080 -7.438 1.00 0.00 O ATOM 1152 CB GLU A 86 12.431 8.526 -10.198 1.00 0.00 C ATOM 1153 CG GLU A 86 13.861 8.320 -10.672 1.00 0.00 C ATOM 1154 CD GLU A 86 13.947 7.821 -12.104 1.00 0.00 C ATOM 1155 OE1 GLU A 86 12.905 7.437 -12.678 1.00 0.00 O ATOM 1156 OE2 GLU A 86 15.065 7.806 -12.662 1.00 0.00 O ATOM 0 H GLU A 86 10.009 7.992 -10.192 1.00 0.00 H new ATOM 0 HA GLU A 86 12.365 6.424 -9.810 1.00 0.00 H new ATOM 0 HB2 GLU A 86 11.800 8.749 -11.058 1.00 0.00 H new ATOM 0 HB3 GLU A 86 12.396 9.397 -9.543 1.00 0.00 H new ATOM 0 HG2 GLU A 86 14.405 9.261 -10.588 1.00 0.00 H new ATOM 0 HG3 GLU A 86 14.356 7.606 -10.014 1.00 0.00 H new ATOM 1163 N GLU A 87 11.082 7.974 -7.255 1.00 0.00 N ATOM 1164 CA GLU A 87 11.129 8.096 -5.801 1.00 0.00 C ATOM 1165 C GLU A 87 11.082 6.722 -5.134 1.00 0.00 C ATOM 1166 O GLU A 87 11.540 6.560 -4.000 1.00 0.00 O ATOM 1167 CB GLU A 87 9.969 8.954 -5.289 1.00 0.00 C ATOM 1168 CG GLU A 87 9.681 10.182 -6.138 1.00 0.00 C ATOM 1169 CD GLU A 87 8.695 9.893 -7.249 1.00 0.00 C ATOM 1170 OE1 GLU A 87 7.486 9.773 -6.962 1.00 0.00 O ATOM 1171 OE2 GLU A 87 9.130 9.761 -8.412 1.00 0.00 O ATOM 0 H GLU A 87 10.221 8.322 -7.677 1.00 0.00 H new ATOM 0 HA GLU A 87 12.071 8.581 -5.543 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.070 8.339 -5.242 1.00 0.00 H new ATOM 0 HB3 GLU A 87 10.190 9.274 -4.271 1.00 0.00 H new ATOM 0 HG2 GLU A 87 9.287 10.976 -5.503 1.00 0.00 H new ATOM 0 HG3 GLU A 87 10.612 10.550 -6.568 1.00 0.00 H new ATOM 1178 N GLY A 88 10.523 5.745 -5.838 1.00 0.00 N ATOM 1179 CA GLY A 88 10.450 4.398 -5.312 1.00 0.00 C ATOM 1180 C GLY A 88 9.051 3.818 -5.399 1.00 0.00 C ATOM 1181 O GLY A 88 8.245 4.259 -6.220 1.00 0.00 O ATOM 0 H GLY A 88 10.118 5.864 -6.767 1.00 0.00 H new ATOM 0 HA2 GLY A 88 11.140 3.758 -5.862 1.00 0.00 H new ATOM 0 HA3 GLY A 88 10.776 4.399 -4.272 1.00 0.00 H new ATOM 1185 N PRO A 89 8.747 2.800 -4.579 1.00 0.00 N ATOM 1186 CA PRO A 89 7.414 2.202 -4.505 1.00 0.00 C ATOM 1187 C PRO A 89 6.432 3.113 -3.779 1.00 0.00 C ATOM 1188 O PRO A 89 6.638 3.465 -2.613 1.00 0.00 O ATOM 1189 CB PRO A 89 7.626 0.903 -3.707 1.00 0.00 C ATOM 1190 CG PRO A 89 9.104 0.764 -3.531 1.00 0.00 C ATOM 1191 CD PRO A 89 9.678 2.146 -3.656 1.00 0.00 C ATOM 0 HA PRO A 89 6.990 2.031 -5.495 1.00 0.00 H new ATOM 0 HB2 PRO A 89 7.121 0.951 -2.742 1.00 0.00 H new ATOM 0 HB3 PRO A 89 7.214 0.046 -4.240 1.00 0.00 H new ATOM 0 HG2 PRO A 89 9.340 0.332 -2.559 1.00 0.00 H new ATOM 0 HG3 PRO A 89 9.524 0.099 -4.286 1.00 0.00 H new ATOM 0 HD2 PRO A 89 9.719 2.656 -2.693 1.00 0.00 H new ATOM 0 HD3 PRO A 89 10.694 2.128 -4.051 1.00 0.00 H new ATOM 1199 N VAL A 90 5.377 3.499 -4.474 1.00 0.00 N ATOM 1200 CA VAL A 90 4.403 4.438 -3.941 1.00 0.00 C ATOM 1201 C VAL A 90 2.986 3.981 -4.281 1.00 0.00 C ATOM 1202 O VAL A 90 2.811 3.097 -5.115 1.00 0.00 O ATOM 1203 CB VAL A 90 4.645 5.848 -4.518 1.00 0.00 C ATOM 1204 CG1 VAL A 90 5.684 6.587 -3.690 1.00 0.00 C ATOM 1205 CG2 VAL A 90 5.091 5.770 -5.971 1.00 0.00 C ATOM 0 H VAL A 90 5.171 3.173 -5.418 1.00 0.00 H new ATOM 0 HA VAL A 90 4.517 4.473 -2.858 1.00 0.00 H new ATOM 0 HB VAL A 90 3.705 6.398 -4.477 1.00 0.00 H new ATOM 0 HG11 VAL A 90 5.844 7.580 -4.109 1.00 0.00 H new ATOM 0 HG12 VAL A 90 5.332 6.679 -2.663 1.00 0.00 H new ATOM 0 HG13 VAL A 90 6.622 6.032 -3.704 1.00 0.00 H new ATOM 0 HG21 VAL A 90 5.255 6.777 -6.356 1.00 0.00 H new ATOM 0 HG22 VAL A 90 6.018 5.200 -6.037 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.319 5.277 -6.562 1.00 0.00 H new ATOM 1215 N CYS A 91 1.971 4.570 -3.650 1.00 0.00 N ATOM 1216 CA CYS A 91 0.591 4.196 -3.956 1.00 0.00 C ATOM 1217 C CYS A 91 0.233 4.619 -5.377 1.00 0.00 C ATOM 1218 O CYS A 91 0.618 5.700 -5.832 1.00 0.00 O ATOM 1219 CB CYS A 91 -0.387 4.818 -2.960 1.00 0.00 C ATOM 1220 SG CYS A 91 0.137 4.702 -1.219 1.00 0.00 S ATOM 0 H CYS A 91 2.074 5.293 -2.938 1.00 0.00 H new ATOM 0 HA CYS A 91 0.511 3.112 -3.875 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -0.528 5.868 -3.215 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -1.356 4.331 -3.068 1.00 0.00 H new ATOM 1225 N LYS A 92 -0.483 3.747 -6.071 1.00 0.00 N ATOM 1226 CA LYS A 92 -0.830 3.963 -7.467 1.00 0.00 C ATOM 1227 C LYS A 92 -1.948 4.986 -7.616 1.00 0.00 C ATOM 1228 O LYS A 92 -1.831 5.934 -8.390 1.00 0.00 O ATOM 1229 CB LYS A 92 -1.269 2.639 -8.097 1.00 0.00 C ATOM 1230 CG LYS A 92 -1.199 2.623 -9.615 1.00 0.00 C ATOM 1231 CD LYS A 92 -0.581 1.330 -10.124 1.00 0.00 C ATOM 1232 CE LYS A 92 -1.040 1.003 -11.535 1.00 0.00 C ATOM 1233 NZ LYS A 92 -0.124 1.566 -12.560 1.00 0.00 N ATOM 0 H LYS A 92 -0.839 2.873 -5.684 1.00 0.00 H new ATOM 0 HA LYS A 92 0.054 4.349 -7.975 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.642 1.837 -7.706 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -2.292 2.423 -7.788 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -2.201 2.738 -10.029 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -0.611 3.472 -9.963 1.00 0.00 H new ATOM 0 HD2 LYS A 92 0.506 1.414 -10.106 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -0.848 0.511 -9.456 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -1.099 -0.079 -11.656 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -2.045 1.397 -11.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.674 1.862 -13.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 0.376 2.388 -12.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 0.568 0.843 -12.842 1.00 0.00 H new ATOM 1247 N ASN A 93 -3.022 4.797 -6.862 1.00 0.00 N ATOM 1248 CA ASN A 93 -4.231 5.588 -7.066 1.00 0.00 C ATOM 1249 C ASN A 93 -4.753 6.196 -5.766 1.00 0.00 C ATOM 1250 O ASN A 93 -4.417 7.324 -5.417 1.00 0.00 O ATOM 1251 CB ASN A 93 -5.326 4.720 -7.695 1.00 0.00 C ATOM 1252 CG ASN A 93 -5.531 5.000 -9.171 1.00 0.00 C ATOM 1253 OD1 ASN A 93 -5.877 6.114 -9.569 1.00 0.00 O ATOM 1254 ND2 ASN A 93 -5.340 3.978 -9.992 1.00 0.00 N ATOM 0 H ASN A 93 -3.083 4.110 -6.110 1.00 0.00 H new ATOM 0 HA ASN A 93 -3.968 6.407 -7.735 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -5.069 3.669 -7.563 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -6.264 4.888 -7.166 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -5.479 4.097 -10.995 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -5.054 3.072 -9.621 1.00 0.00 H new ATOM 1261 N ILE A 94 -5.553 5.424 -5.045 1.00 0.00 N ATOM 1262 CA ILE A 94 -6.320 5.943 -3.919 1.00 0.00 C ATOM 1263 C ILE A 94 -5.505 5.948 -2.622 1.00 0.00 C ATOM 1264 O ILE A 94 -4.850 4.962 -2.274 1.00 0.00 O ATOM 1265 CB ILE A 94 -7.617 5.121 -3.718 1.00 0.00 C ATOM 1266 CG1 ILE A 94 -8.431 5.091 -5.016 1.00 0.00 C ATOM 1267 CG2 ILE A 94 -8.458 5.688 -2.583 1.00 0.00 C ATOM 1268 CD1 ILE A 94 -9.042 3.742 -5.316 1.00 0.00 C ATOM 0 H ILE A 94 -5.689 4.429 -5.221 1.00 0.00 H new ATOM 0 HA ILE A 94 -6.578 6.975 -4.157 1.00 0.00 H new ATOM 0 HB ILE A 94 -7.333 4.103 -3.452 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -9.226 5.835 -4.954 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -7.787 5.381 -5.846 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -9.362 5.090 -2.466 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -7.884 5.663 -1.657 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -8.732 6.718 -2.812 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -9.603 3.796 -6.249 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -8.252 2.997 -5.411 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -9.713 3.458 -4.505 1.00 0.00 H new ATOM 1280 N VAL A 95 -5.550 7.073 -1.916 1.00 0.00 N ATOM 1281 CA VAL A 95 -4.877 7.208 -0.628 1.00 0.00 C ATOM 1282 C VAL A 95 -5.844 6.900 0.512 1.00 0.00 C ATOM 1283 O VAL A 95 -6.908 7.516 0.625 1.00 0.00 O ATOM 1284 CB VAL A 95 -4.301 8.628 -0.437 1.00 0.00 C ATOM 1285 CG1 VAL A 95 -3.477 8.714 0.841 1.00 0.00 C ATOM 1286 CG2 VAL A 95 -3.465 9.035 -1.643 1.00 0.00 C ATOM 0 H VAL A 95 -6.049 7.910 -2.216 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.053 6.494 -0.614 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.137 9.322 -0.348 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -3.083 9.724 0.952 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.107 8.474 1.697 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.650 8.005 0.789 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -3.068 10.038 -1.489 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.640 8.334 -1.767 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -4.088 9.025 -2.538 1.00 0.00 H new ATOM 1296 N ALA A 96 -5.476 5.945 1.353 1.00 0.00 N ATOM 1297 CA ALA A 96 -6.323 5.538 2.461 1.00 0.00 C ATOM 1298 C ALA A 96 -5.482 4.967 3.594 1.00 0.00 C ATOM 1299 O ALA A 96 -4.408 4.417 3.361 1.00 0.00 O ATOM 1300 CB ALA A 96 -7.342 4.512 1.988 1.00 0.00 C ATOM 0 H ALA A 96 -4.594 5.437 1.288 1.00 0.00 H new ATOM 0 HA ALA A 96 -6.853 6.414 2.836 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -7.973 4.213 2.825 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -7.962 4.949 1.205 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -6.823 3.638 1.594 1.00 0.00 H new ATOM 1306 N CYS A 97 -5.970 5.090 4.816 1.00 0.00 N ATOM 1307 CA CYS A 97 -5.263 4.545 5.965 1.00 0.00 C ATOM 1308 C CYS A 97 -5.969 3.282 6.452 1.00 0.00 C ATOM 1309 O CYS A 97 -7.163 3.294 6.759 1.00 0.00 O ATOM 1310 CB CYS A 97 -5.151 5.580 7.096 1.00 0.00 C ATOM 1311 SG CYS A 97 -4.827 7.290 6.535 1.00 0.00 S ATOM 0 H CYS A 97 -6.848 5.559 5.039 1.00 0.00 H new ATOM 0 HA CYS A 97 -4.249 4.289 5.658 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -6.076 5.570 7.673 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -4.351 5.276 7.771 1.00 0.00 H new ATOM 1316 N CYS A 98 -5.223 2.190 6.507 1.00 0.00 N ATOM 1317 CA CYS A 98 -5.786 0.883 6.794 1.00 0.00 C ATOM 1318 C CYS A 98 -5.000 0.180 7.892 1.00 0.00 C ATOM 1319 O CYS A 98 -3.779 0.076 7.813 1.00 0.00 O ATOM 1320 CB CYS A 98 -5.766 0.038 5.525 1.00 0.00 C ATOM 1321 SG CYS A 98 -6.701 -1.518 5.634 1.00 0.00 S ATOM 0 H CYS A 98 -4.214 2.186 6.354 1.00 0.00 H new ATOM 0 HA CYS A 98 -6.812 1.012 7.139 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -6.168 0.631 4.703 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -4.731 -0.193 5.275 1.00 0.00 H new ATOM 1326 N PRO A 99 -5.692 -0.306 8.926 1.00 0.00 N ATOM 1327 CA PRO A 99 -5.062 -1.020 10.034 1.00 0.00 C ATOM 1328 C PRO A 99 -4.562 -2.402 9.622 1.00 0.00 C ATOM 1329 O PRO A 99 -5.199 -3.090 8.816 1.00 0.00 O ATOM 1330 CB PRO A 99 -6.180 -1.158 11.076 1.00 0.00 C ATOM 1331 CG PRO A 99 -7.297 -0.292 10.596 1.00 0.00 C ATOM 1332 CD PRO A 99 -7.142 -0.192 9.109 1.00 0.00 C ATOM 0 HA PRO A 99 -4.186 -0.486 10.402 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -6.502 -2.195 11.168 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -5.837 -0.842 12.061 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -8.263 -0.723 10.858 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -7.251 0.694 11.059 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -7.679 -0.987 8.592 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -7.525 0.753 8.725 1.00 0.00 H new ATOM 1340 N GLU A 100 -3.405 -2.792 10.141 1.00 0.00 N ATOM 1341 CA GLU A 100 -2.922 -4.150 9.972 1.00 0.00 C ATOM 1342 C GLU A 100 -3.460 -5.027 11.093 1.00 0.00 C ATOM 1343 O GLU A 100 -3.004 -4.943 12.232 1.00 0.00 O ATOM 1344 CB GLU A 100 -1.394 -4.196 9.950 1.00 0.00 C ATOM 1345 CG GLU A 100 -0.839 -5.534 9.486 1.00 0.00 C ATOM 1346 CD GLU A 100 0.427 -5.394 8.667 1.00 0.00 C ATOM 1347 OE1 GLU A 100 0.359 -4.833 7.558 1.00 0.00 O ATOM 1348 OE2 GLU A 100 1.493 -5.855 9.128 1.00 0.00 O ATOM 0 H GLU A 100 -2.787 -2.186 10.681 1.00 0.00 H new ATOM 0 HA GLU A 100 -3.280 -4.526 9.014 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -1.023 -3.409 9.293 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -1.016 -3.981 10.950 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -0.636 -6.159 10.356 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -1.595 -6.049 8.893 1.00 0.00 H new ATOM 1355 N GLY A 101 -4.451 -5.836 10.772 1.00 0.00 N ATOM 1356 CA GLY A 101 -5.048 -6.706 11.754 1.00 0.00 C ATOM 1357 C GLY A 101 -6.363 -7.253 11.264 1.00 0.00 C ATOM 1358 O GLY A 101 -6.440 -8.392 10.810 1.00 0.00 O ATOM 0 H GLY A 101 -4.856 -5.906 9.838 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -4.369 -7.529 11.977 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -5.202 -6.159 12.684 1.00 0.00 H new ATOM 1362 N THR A 102 -7.397 -6.428 11.348 1.00 0.00 N ATOM 1363 CA THR A 102 -8.720 -6.776 10.850 1.00 0.00 C ATOM 1364 C THR A 102 -9.499 -5.514 10.522 1.00 0.00 C ATOM 1365 O THR A 102 -8.950 -4.416 10.594 1.00 0.00 O ATOM 1366 CB THR A 102 -9.522 -7.616 11.867 1.00 0.00 C ATOM 1367 OG1 THR A 102 -8.647 -8.182 12.851 1.00 0.00 O ATOM 1368 CG2 THR A 102 -10.266 -8.734 11.161 1.00 0.00 C ATOM 0 H THR A 102 -7.342 -5.498 11.764 1.00 0.00 H new ATOM 0 HA THR A 102 -8.579 -7.377 9.952 1.00 0.00 H new ATOM 0 HB THR A 102 -10.239 -6.957 12.357 1.00 0.00 H new ATOM 0 HG1 THR A 102 -9.171 -8.710 13.489 1.00 0.00 H new ATOM 0 HG21 THR A 102 -10.826 -9.317 11.892 1.00 0.00 H new ATOM 0 HG22 THR A 102 -10.955 -8.309 10.431 1.00 0.00 H new ATOM 0 HG23 THR A 102 -9.552 -9.381 10.652 1.00 0.00 H new ATOM 1376 N THR A 103 -10.768 -5.694 10.157 1.00 0.00 N ATOM 1377 CA THR A 103 -11.682 -4.600 9.837 1.00 0.00 C ATOM 1378 C THR A 103 -11.225 -3.794 8.619 1.00 0.00 C ATOM 1379 O THR A 103 -10.182 -4.071 8.019 1.00 0.00 O ATOM 1380 CB THR A 103 -11.943 -3.668 11.052 1.00 0.00 C ATOM 1381 OG1 THR A 103 -10.799 -2.859 11.351 1.00 0.00 O ATOM 1382 CG2 THR A 103 -12.316 -4.482 12.280 1.00 0.00 C ATOM 0 H THR A 103 -11.195 -6.617 10.074 1.00 0.00 H new ATOM 0 HA THR A 103 -12.629 -5.073 9.580 1.00 0.00 H new ATOM 0 HB THR A 103 -12.771 -3.012 10.783 1.00 0.00 H new ATOM 0 HG1 THR A 103 -10.029 -3.178 10.835 1.00 0.00 H new ATOM 0 HG21 THR A 103 -12.495 -3.811 13.120 1.00 0.00 H new ATOM 0 HG22 THR A 103 -13.220 -5.056 12.075 1.00 0.00 H new ATOM 0 HG23 THR A 103 -11.501 -5.163 12.526 1.00 0.00 H new ATOM 1390 N ASN A 104 -12.026 -2.812 8.253 1.00 0.00 N ATOM 1391 CA ASN A 104 -11.859 -2.112 6.988 1.00 0.00 C ATOM 1392 C ASN A 104 -10.997 -0.865 7.143 1.00 0.00 C ATOM 1393 O ASN A 104 -10.624 -0.481 8.252 1.00 0.00 O ATOM 1394 CB ASN A 104 -13.224 -1.742 6.390 1.00 0.00 C ATOM 1395 CG ASN A 104 -14.337 -1.695 7.418 1.00 0.00 C ATOM 1396 OD1 ASN A 104 -14.883 -2.725 7.816 1.00 0.00 O ATOM 1397 ND2 ASN A 104 -14.683 -0.496 7.854 1.00 0.00 N ATOM 0 H ASN A 104 -12.806 -2.477 8.818 1.00 0.00 H new ATOM 0 HA ASN A 104 -11.345 -2.790 6.306 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -13.148 -0.770 5.903 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -13.483 -2.466 5.618 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -15.427 -0.400 8.545 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -14.206 0.333 7.499 1.00 0.00 H new ATOM 1404 N CYS A 105 -10.692 -0.238 6.017 1.00 0.00 N ATOM 1405 CA CYS A 105 -9.813 0.920 5.994 1.00 0.00 C ATOM 1406 C CYS A 105 -10.567 2.184 5.600 1.00 0.00 C ATOM 1407 O CYS A 105 -11.446 2.147 4.740 1.00 0.00 O ATOM 1408 CB CYS A 105 -8.685 0.671 5.000 1.00 0.00 C ATOM 1409 SG CYS A 105 -8.405 -1.093 4.627 1.00 0.00 S ATOM 0 H CYS A 105 -11.044 -0.515 5.101 1.00 0.00 H new ATOM 0 HA CYS A 105 -9.411 1.066 6.996 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -8.909 1.197 4.072 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -7.764 1.099 5.396 1.00 0.00 H new ATOM 1414 N VAL A 106 -10.207 3.303 6.215 1.00 0.00 N ATOM 1415 CA VAL A 106 -10.848 4.577 5.910 1.00 0.00 C ATOM 1416 C VAL A 106 -10.145 5.262 4.736 1.00 0.00 C ATOM 1417 O VAL A 106 -8.919 5.201 4.608 1.00 0.00 O ATOM 1418 CB VAL A 106 -10.880 5.514 7.152 1.00 0.00 C ATOM 1419 CG1 VAL A 106 -10.960 4.700 8.434 1.00 0.00 C ATOM 1420 CG2 VAL A 106 -9.675 6.446 7.201 1.00 0.00 C ATOM 0 H VAL A 106 -9.477 3.355 6.926 1.00 0.00 H new ATOM 0 HA VAL A 106 -11.880 4.370 5.628 1.00 0.00 H new ATOM 0 HB VAL A 106 -11.773 6.133 7.061 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -10.981 5.373 9.291 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -11.867 4.095 8.425 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -10.089 4.048 8.506 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -9.741 7.080 8.085 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -8.760 5.856 7.246 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -9.661 7.070 6.307 1.00 0.00 H new ATOM 1430 N ALA A 107 -10.921 5.900 3.875 1.00 0.00 N ATOM 1431 CA ALA A 107 -10.367 6.560 2.705 1.00 0.00 C ATOM 1432 C ALA A 107 -10.353 8.067 2.889 1.00 0.00 C ATOM 1433 O ALA A 107 -11.385 8.682 3.157 1.00 0.00 O ATOM 1434 CB ALA A 107 -11.153 6.186 1.462 1.00 0.00 C ATOM 0 H ALA A 107 -11.934 5.975 3.964 1.00 0.00 H new ATOM 0 HA ALA A 107 -9.338 6.223 2.581 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -10.724 6.689 0.595 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -11.108 5.107 1.314 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -12.192 6.493 1.583 1.00 0.00 H new ATOM 1440 N VAL A 108 -9.176 8.659 2.743 1.00 0.00 N ATOM 1441 CA VAL A 108 -9.024 10.104 2.869 1.00 0.00 C ATOM 1442 C VAL A 108 -8.937 10.737 1.486 1.00 0.00 C ATOM 1443 O VAL A 108 -8.481 11.871 1.324 1.00 0.00 O ATOM 1444 CB VAL A 108 -7.778 10.494 3.699 1.00 0.00 C ATOM 1445 CG1 VAL A 108 -8.097 11.663 4.618 1.00 0.00 C ATOM 1446 CG2 VAL A 108 -7.259 9.307 4.503 1.00 0.00 C ATOM 0 H VAL A 108 -8.310 8.161 2.537 1.00 0.00 H new ATOM 0 HA VAL A 108 -9.901 10.478 3.398 1.00 0.00 H new ATOM 0 HB VAL A 108 -6.993 10.799 3.007 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.210 11.925 5.195 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -8.408 12.521 4.021 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -8.902 11.383 5.297 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -6.383 9.611 5.076 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -8.036 8.961 5.184 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -6.986 8.499 3.824 1.00 0.00 H new ATOM 1456 N ASP A 109 -9.391 9.983 0.493 1.00 0.00 N ATOM 1457 CA ASP A 109 -9.415 10.442 -0.893 1.00 0.00 C ATOM 1458 C ASP A 109 -10.574 11.414 -1.107 1.00 0.00 C ATOM 1459 O ASP A 109 -11.575 11.090 -1.747 1.00 0.00 O ATOM 1460 CB ASP A 109 -9.543 9.244 -1.841 1.00 0.00 C ATOM 1461 CG ASP A 109 -9.328 9.616 -3.296 1.00 0.00 C ATOM 1462 OD1 ASP A 109 -8.785 10.704 -3.564 1.00 0.00 O ATOM 1463 OD2 ASP A 109 -9.708 8.814 -4.180 1.00 0.00 O ATOM 0 H ASP A 109 -9.752 9.038 0.623 1.00 0.00 H new ATOM 0 HA ASP A 109 -8.481 10.962 -1.109 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -8.818 8.482 -1.555 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -10.532 8.801 -1.727 1.00 0.00 H new ATOM 1468 N ASN A 110 -10.442 12.598 -0.527 1.00 0.00 N ATOM 1469 CA ASN A 110 -11.462 13.636 -0.630 1.00 0.00 C ATOM 1470 C ASN A 110 -10.803 14.980 -0.916 1.00 0.00 C ATOM 1471 O ASN A 110 -11.390 16.034 -0.677 1.00 0.00 O ATOM 1472 CB ASN A 110 -12.266 13.734 0.674 1.00 0.00 C ATOM 1473 CG ASN A 110 -13.193 12.557 0.903 1.00 0.00 C ATOM 1474 OD1 ASN A 110 -14.175 12.368 0.183 1.00 0.00 O ATOM 1475 ND2 ASN A 110 -12.896 11.763 1.919 1.00 0.00 N ATOM 0 H ASN A 110 -9.629 12.867 0.027 1.00 0.00 H new ATOM 0 HA ASN A 110 -12.138 13.375 -1.444 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -11.574 13.810 1.513 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -12.854 14.652 0.661 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -13.489 10.960 2.129 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -12.074 11.953 2.492 1.00 0.00 H new ATOM 1482 N ALA A 111 -9.583 14.937 -1.426 1.00 0.00 N ATOM 1483 CA ALA A 111 -8.803 16.148 -1.625 1.00 0.00 C ATOM 1484 C ALA A 111 -8.585 16.430 -3.105 1.00 0.00 C ATOM 1485 O ALA A 111 -8.816 15.568 -3.949 1.00 0.00 O ATOM 1486 CB ALA A 111 -7.468 16.038 -0.904 1.00 0.00 C ATOM 0 H ALA A 111 -9.112 14.078 -1.709 1.00 0.00 H new ATOM 0 HA ALA A 111 -9.365 16.983 -1.206 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -6.893 16.951 -1.061 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -7.641 15.897 0.163 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -6.911 15.187 -1.297 1.00 0.00 H new ATOM 1492 N GLY A 112 -8.136 17.638 -3.410 1.00 0.00 N ATOM 1493 CA GLY A 112 -7.873 18.010 -4.786 1.00 0.00 C ATOM 1494 C GLY A 112 -6.439 18.453 -4.977 1.00 0.00 C ATOM 1495 O GLY A 112 -6.164 19.435 -5.674 1.00 0.00 O ATOM 0 H GLY A 112 -7.948 18.371 -2.726 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -8.083 17.163 -5.439 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -8.546 18.815 -5.081 1.00 0.00 H new ATOM 1499 N ALA A 113 -5.527 17.722 -4.355 1.00 0.00 N ATOM 1500 CA ALA A 113 -4.111 18.046 -4.404 1.00 0.00 C ATOM 1501 C ALA A 113 -3.376 17.112 -5.358 1.00 0.00 C ATOM 1502 O ALA A 113 -3.996 16.387 -6.138 1.00 0.00 O ATOM 1503 CB ALA A 113 -3.513 17.960 -3.003 1.00 0.00 C ATOM 0 H ALA A 113 -5.747 16.892 -3.805 1.00 0.00 H new ATOM 0 HA ALA A 113 -3.997 19.064 -4.776 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -2.451 18.204 -3.045 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -4.022 18.666 -2.346 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -3.638 16.949 -2.615 1.00 0.00 H new ATOM 1509 N GLY A 114 -2.053 17.141 -5.298 1.00 0.00 N ATOM 1510 CA GLY A 114 -1.257 16.228 -6.091 1.00 0.00 C ATOM 1511 C GLY A 114 -1.140 14.877 -5.422 1.00 0.00 C ATOM 1512 O GLY A 114 -1.377 14.762 -4.219 1.00 0.00 O ATOM 0 H GLY A 114 -1.516 17.782 -4.713 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -1.708 16.110 -7.076 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -0.263 16.648 -6.244 1.00 0.00 H new ATOM 1516 N THR A 115 -0.781 13.857 -6.195 1.00 0.00 N ATOM 1517 CA THR A 115 -0.643 12.502 -5.672 1.00 0.00 C ATOM 1518 C THR A 115 0.363 12.463 -4.522 1.00 0.00 C ATOM 1519 O THR A 115 0.051 12.019 -3.419 1.00 0.00 O ATOM 1520 CB THR A 115 -0.189 11.537 -6.783 1.00 0.00 C ATOM 1521 OG1 THR A 115 0.367 12.285 -7.877 1.00 0.00 O ATOM 1522 CG2 THR A 115 -1.352 10.688 -7.278 1.00 0.00 C ATOM 0 H THR A 115 -0.579 13.944 -7.191 1.00 0.00 H new ATOM 0 HA THR A 115 -1.618 12.188 -5.300 1.00 0.00 H new ATOM 0 HB THR A 115 0.569 10.871 -6.371 1.00 0.00 H new ATOM 0 HG1 THR A 115 0.656 11.668 -8.581 1.00 0.00 H new ATOM 0 HG21 THR A 115 -1.004 10.016 -8.062 1.00 0.00 H new ATOM 0 HG22 THR A 115 -1.754 10.103 -6.450 1.00 0.00 H new ATOM 0 HG23 THR A 115 -2.132 11.337 -7.676 1.00 0.00 H new ATOM 1530 N LYS A 116 1.573 12.927 -4.808 1.00 0.00 N ATOM 1531 CA LYS A 116 2.624 13.042 -3.802 1.00 0.00 C ATOM 1532 C LYS A 116 3.778 13.870 -4.357 1.00 0.00 C ATOM 1533 O LYS A 116 4.921 13.751 -3.915 1.00 0.00 O ATOM 1534 CB LYS A 116 3.130 11.657 -3.382 1.00 0.00 C ATOM 1535 CG LYS A 116 3.450 10.736 -4.550 1.00 0.00 C ATOM 1536 CD LYS A 116 3.473 9.279 -4.116 1.00 0.00 C ATOM 1537 CE LYS A 116 2.411 8.468 -4.845 1.00 0.00 C ATOM 1538 NZ LYS A 116 2.769 8.225 -6.270 1.00 0.00 N ATOM 0 H LYS A 116 1.854 13.233 -5.740 1.00 0.00 H new ATOM 0 HA LYS A 116 2.211 13.537 -2.923 1.00 0.00 H new ATOM 0 HB2 LYS A 116 4.025 11.778 -2.772 1.00 0.00 H new ATOM 0 HB3 LYS A 116 2.377 11.182 -2.753 1.00 0.00 H new ATOM 0 HG2 LYS A 116 2.708 10.871 -5.336 1.00 0.00 H new ATOM 0 HG3 LYS A 116 4.417 11.006 -4.974 1.00 0.00 H new ATOM 0 HD2 LYS A 116 4.457 8.854 -4.313 1.00 0.00 H new ATOM 0 HD3 LYS A 116 3.308 9.215 -3.040 1.00 0.00 H new ATOM 0 HE2 LYS A 116 2.274 7.513 -4.338 1.00 0.00 H new ATOM 0 HE3 LYS A 116 1.457 8.994 -4.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 2.031 8.622 -6.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 3.679 8.681 -6.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 2.847 7.202 -6.439 1.00 0.00 H new ATOM 1552 N ALA A 117 3.468 14.715 -5.331 1.00 0.00 N ATOM 1553 CA ALA A 117 4.490 15.472 -6.033 1.00 0.00 C ATOM 1554 C ALA A 117 4.529 16.919 -5.565 1.00 0.00 C ATOM 1555 O ALA A 117 3.996 17.813 -6.227 1.00 0.00 O ATOM 1556 CB ALA A 117 4.242 15.411 -7.531 1.00 0.00 C ATOM 0 H ALA A 117 2.516 14.892 -5.651 1.00 0.00 H new ATOM 0 HA ALA A 117 5.458 15.023 -5.809 1.00 0.00 H new ATOM 0 HB1 ALA A 117 5.012 15.981 -8.051 1.00 0.00 H new ATOM 0 HB2 ALA A 117 4.272 14.373 -7.863 1.00 0.00 H new ATOM 0 HB3 ALA A 117 3.263 15.835 -7.755 1.00 0.00 H new ATOM 1562 N GLU A 118 5.153 17.142 -4.423 1.00 0.00 N ATOM 1563 CA GLU A 118 5.347 18.483 -3.899 1.00 0.00 C ATOM 1564 C GLU A 118 6.606 18.512 -3.055 1.00 0.00 C ATOM 1565 O GLU A 118 6.761 17.617 -2.200 1.00 0.00 O ATOM 1566 CB GLU A 118 4.138 18.929 -3.073 1.00 0.00 C ATOM 1567 CG GLU A 118 3.682 20.346 -3.385 1.00 0.00 C ATOM 1568 CD GLU A 118 2.275 20.630 -2.903 1.00 0.00 C ATOM 1569 OE1 GLU A 118 1.913 20.182 -1.797 1.00 0.00 O ATOM 1570 OE2 GLU A 118 1.519 21.308 -3.631 1.00 0.00 O ATOM 1571 OXT GLU A 118 7.454 19.398 -3.278 1.00 0.00 O ATOM 0 H GLU A 118 5.538 16.403 -3.834 1.00 0.00 H new ATOM 0 HA GLU A 118 5.452 19.177 -4.733 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.311 18.242 -3.252 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.386 18.860 -2.014 1.00 0.00 H new ATOM 0 HG2 GLU A 118 4.369 21.054 -2.922 1.00 0.00 H new ATOM 0 HG3 GLU A 118 3.732 20.510 -4.461 1.00 0.00 H new TER 1578 GLU A 118