USER MOD reduce.3.24.130724 H: found=0, std=0, add=1041, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1041 hydrogens (8 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 NoAdj-H: B1139 PTR HN2 : B1139 PTR N : B1138 GLU C :(H bumps) USER MOD NoAdj-H: B1139 PTR H : B1139 PTR N : B1138 GLU C :(H bumps) USER MOD Set 1.1: A 103 ASN : amide:sc= 1.52 K(o=2.7,f=-5.6!) USER MOD Set 1.2: A 113 HIS : no HD1:sc= 1.19 K(o=2.7,f=-9!) USER MOD Set 2.1: A 82 SER OG : rot 180:sc= 0 USER MOD Set 2.2: B1141 ASN : amide:sc= -1.03 K(o=-1,f=-2) USER MOD Set 3.1: A 68 TYR OH : rot -3:sc= 0.653 USER MOD Set 3.2: A 88 THR OG1 : rot -75:sc= 0.02 USER MOD Set 4.1: A 29 SER OG : rot -105:sc= 0.871 USER MOD Set 4.2: A 67 HIS : no HD1:sc= -0.292 K(o=0.58,f=-6.4!) USER MOD Set 5.1: A 16 THR OG1 : rot -86:sc= 1.08 USER MOD Set 5.2: A 17 GLN : amide:sc= -1.07 X(o=0.006,f=0.03) USER MOD Single : A 1 GLY N :NH3+ -113:sc= 0.0405 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 21 HIS : no HD1:sc= 0.718 K(o=0.72,f=-4.9!) USER MOD Single : A 25 SER OG : rot 65:sc= 1.09 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 GLN : amide:sc= 0.852 K(o=0.85,f=0) USER MOD Single : A 36 GLN : amide:sc= -0.11 X(o=-0.11,f=-0.3) USER MOD Single : A 48 SER OG : rot -61:sc= 0.814 USER MOD Single : A 49 GLN : amide:sc= -1.02 K(o=-1,f=-8.5!) USER MOD Single : A 51 ASN : amide:sc= 0.869 K(o=0.87,f=-6!) USER MOD Single : A 53 GLN : amide:sc= -0.0386 X(o=-0.039,f=-0.49) USER MOD Single : A 58 SER OG : rot -5:sc= 0.827 USER MOD Single : A 60 CYS SG : rot -85:sc= 0.0796 USER MOD Single : A 61 HIS : no HD1:sc= -2.25! C(o=-2.3!,f=-10!) USER MOD Single : A 63 GLN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 180:sc= 0.539 USER MOD Single : A 83 MET CE :methyl 167:sc= 0 (180deg=-0.283) USER MOD Single : A 87 GLN : amide:sc= 0.591 K(o=0.59,f=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= 0.896 K(o=0.9,f=-1.2) USER MOD Single : A 100 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 101 GLN : amide:sc= 0.861 K(o=0.86,f=-4!) USER MOD Single : A 109 CYS SG : rot 180:sc= 0.0464 USER MOD Single : A 114 CYS SG : rot 180:sc= -0.192 USER MOD Single : A 115 CYS SG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : B1136 GLN : amide:sc= -0.0299 X(o=-0.03,f=-0.49) USER MOD Single : B1142 GLN : amide:sc= -0.0846 X(o=-0.085,f=-0.13) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -0.822 7.588 32.997 1.00 0.00 N ATOM 2 CA GLY A 1 -1.491 8.904 32.849 1.00 0.00 C ATOM 3 C GLY A 1 -0.643 9.896 32.061 1.00 0.00 C ATOM 4 O GLY A 1 0.584 9.776 32.006 1.00 0.00 O ATOM 0 H1 GLY A 1 -1.350 6.868 32.463 1.00 0.00 H new ATOM 0 H2 GLY A 1 0.149 7.649 32.630 1.00 0.00 H new ATOM 0 H3 GLY A 1 -0.796 7.323 34.002 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -2.449 8.768 32.347 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.704 9.314 33.836 1.00 0.00 H new ATOM 10 N SER A 2 -1.288 10.892 31.448 1.00 0.00 N ATOM 11 CA SER A 2 -0.632 11.969 30.678 1.00 0.00 C ATOM 12 C SER A 2 0.008 13.054 31.576 1.00 0.00 C ATOM 13 O SER A 2 -0.365 13.179 32.751 1.00 0.00 O ATOM 14 CB SER A 2 -1.639 12.591 29.695 1.00 0.00 C ATOM 15 OG SER A 2 -2.802 13.052 30.366 1.00 0.00 O ATOM 0 H SER A 2 -2.304 10.980 31.470 1.00 0.00 H new ATOM 0 HA SER A 2 0.190 11.517 30.123 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.169 13.421 29.167 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.919 11.853 28.944 1.00 0.00 H new ATOM 0 HG SER A 2 -3.422 13.443 29.715 1.00 0.00 H new ATOM 21 N PRO A 3 0.970 13.854 31.059 1.00 0.00 N ATOM 22 CA PRO A 3 1.605 14.944 31.811 1.00 0.00 C ATOM 23 C PRO A 3 0.627 16.023 32.306 1.00 0.00 C ATOM 24 O PRO A 3 -0.390 16.310 31.667 1.00 0.00 O ATOM 25 CB PRO A 3 2.653 15.550 30.869 1.00 0.00 C ATOM 26 CG PRO A 3 2.988 14.400 29.922 1.00 0.00 C ATOM 27 CD PRO A 3 1.645 13.687 29.777 1.00 0.00 C ATOM 0 HA PRO A 3 2.042 14.541 32.725 1.00 0.00 H new ATOM 0 HB2 PRO A 3 2.258 16.412 30.330 1.00 0.00 H new ATOM 0 HB3 PRO A 3 3.533 15.891 31.414 1.00 0.00 H new ATOM 0 HG2 PRO A 3 3.362 14.760 28.963 1.00 0.00 H new ATOM 0 HG3 PRO A 3 3.753 13.743 30.336 1.00 0.00 H new ATOM 0 HD2 PRO A 3 1.058 14.118 28.966 1.00 0.00 H new ATOM 0 HD3 PRO A 3 1.785 12.632 29.543 1.00 0.00 H new ATOM 35 N ALA A 4 0.967 16.671 33.427 1.00 0.00 N ATOM 36 CA ALA A 4 0.184 17.773 34.003 1.00 0.00 C ATOM 37 C ALA A 4 0.381 19.120 33.266 1.00 0.00 C ATOM 38 O ALA A 4 -0.479 20.000 33.343 1.00 0.00 O ATOM 39 CB ALA A 4 0.549 17.885 35.489 1.00 0.00 C ATOM 0 H ALA A 4 1.802 16.443 33.966 1.00 0.00 H new ATOM 0 HA ALA A 4 -0.875 17.545 33.884 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -0.019 18.697 35.943 1.00 0.00 H new ATOM 0 HB2 ALA A 4 0.310 16.949 35.994 1.00 0.00 H new ATOM 0 HB3 ALA A 4 1.615 18.089 35.587 1.00 0.00 H new ATOM 45 N SER A 5 1.505 19.281 32.555 1.00 0.00 N ATOM 46 CA SER A 5 1.850 20.461 31.742 1.00 0.00 C ATOM 47 C SER A 5 2.744 20.073 30.549 1.00 0.00 C ATOM 48 O SER A 5 3.363 19.006 30.548 1.00 0.00 O ATOM 49 CB SER A 5 2.544 21.505 32.627 1.00 0.00 C ATOM 50 OG SER A 5 2.652 22.747 31.950 1.00 0.00 O ATOM 0 H SER A 5 2.230 18.565 32.528 1.00 0.00 H new ATOM 0 HA SER A 5 0.933 20.888 31.336 1.00 0.00 H new ATOM 0 HB2 SER A 5 1.981 21.637 33.551 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.536 21.150 32.906 1.00 0.00 H new ATOM 0 HG SER A 5 3.096 23.399 32.532 1.00 0.00 H new ATOM 56 N GLY A 6 2.816 20.931 29.525 1.00 0.00 N ATOM 57 CA GLY A 6 3.667 20.734 28.339 1.00 0.00 C ATOM 58 C GLY A 6 3.167 19.671 27.348 1.00 0.00 C ATOM 59 O GLY A 6 3.938 19.200 26.512 1.00 0.00 O ATOM 0 H GLY A 6 2.277 21.797 29.494 1.00 0.00 H new ATOM 0 HA2 GLY A 6 3.757 21.685 27.813 1.00 0.00 H new ATOM 0 HA3 GLY A 6 4.668 20.457 28.671 1.00 0.00 H new ATOM 63 N THR A 7 1.887 19.287 27.412 1.00 0.00 N ATOM 64 CA THR A 7 1.289 18.210 26.590 1.00 0.00 C ATOM 65 C THR A 7 1.287 18.499 25.082 1.00 0.00 C ATOM 66 O THR A 7 1.250 17.566 24.278 1.00 0.00 O ATOM 67 CB THR A 7 -0.148 17.903 27.047 1.00 0.00 C ATOM 68 OG1 THR A 7 -0.916 19.089 27.097 1.00 0.00 O ATOM 69 CG2 THR A 7 -0.178 17.278 28.442 1.00 0.00 C ATOM 0 H THR A 7 1.218 19.721 28.048 1.00 0.00 H new ATOM 0 HA THR A 7 1.932 17.344 26.747 1.00 0.00 H new ATOM 0 HB THR A 7 -0.561 17.202 26.322 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.827 18.876 27.388 1.00 0.00 H new ATOM 0 HG21 THR A 7 -1.210 17.076 28.728 1.00 0.00 H new ATOM 0 HG22 THR A 7 0.386 16.345 28.435 1.00 0.00 H new ATOM 0 HG23 THR A 7 0.269 17.967 29.159 1.00 0.00 H new ATOM 77 N SER A 8 1.404 19.770 24.678 1.00 0.00 N ATOM 78 CA SER A 8 1.526 20.190 23.269 1.00 0.00 C ATOM 79 C SER A 8 2.891 19.881 22.628 1.00 0.00 C ATOM 80 O SER A 8 3.061 20.060 21.419 1.00 0.00 O ATOM 81 CB SER A 8 1.219 21.690 23.133 1.00 0.00 C ATOM 82 OG SER A 8 -0.054 22.001 23.678 1.00 0.00 O ATOM 0 H SER A 8 1.417 20.553 25.331 1.00 0.00 H new ATOM 0 HA SER A 8 0.793 19.595 22.723 1.00 0.00 H new ATOM 0 HB2 SER A 8 1.988 22.270 23.643 1.00 0.00 H new ATOM 0 HB3 SER A 8 1.248 21.977 22.082 1.00 0.00 H new ATOM 0 HG SER A 8 -0.226 22.961 23.581 1.00 0.00 H new ATOM 88 N LEU A 9 3.860 19.412 23.421 1.00 0.00 N ATOM 89 CA LEU A 9 5.237 19.098 23.000 1.00 0.00 C ATOM 90 C LEU A 9 5.477 17.597 22.723 1.00 0.00 C ATOM 91 O LEU A 9 6.577 17.212 22.320 1.00 0.00 O ATOM 92 CB LEU A 9 6.232 19.643 24.046 1.00 0.00 C ATOM 93 CG LEU A 9 6.093 21.140 24.387 1.00 0.00 C ATOM 94 CD1 LEU A 9 7.114 21.520 25.459 1.00 0.00 C ATOM 95 CD2 LEU A 9 6.319 22.041 23.169 1.00 0.00 C ATOM 0 H LEU A 9 3.705 19.232 24.413 1.00 0.00 H new ATOM 0 HA LEU A 9 5.401 19.593 22.043 1.00 0.00 H new ATOM 0 HB2 LEU A 9 6.116 19.068 24.965 1.00 0.00 H new ATOM 0 HB3 LEU A 9 7.245 19.464 23.684 1.00 0.00 H new ATOM 0 HG LEU A 9 5.073 21.291 24.742 1.00 0.00 H new ATOM 0 HD11 LEU A 9 7.014 22.579 25.698 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.937 20.927 26.356 1.00 0.00 H new ATOM 0 HD13 LEU A 9 8.120 21.326 25.088 1.00 0.00 H new ATOM 0 HD21 LEU A 9 6.210 23.085 23.463 1.00 0.00 H new ATOM 0 HD22 LEU A 9 7.323 21.878 22.777 1.00 0.00 H new ATOM 0 HD23 LEU A 9 5.585 21.803 22.399 1.00 0.00 H new ATOM 107 N SER A 10 4.469 16.746 22.933 1.00 0.00 N ATOM 108 CA SER A 10 4.559 15.285 22.758 1.00 0.00 C ATOM 109 C SER A 10 4.766 14.869 21.291 1.00 0.00 C ATOM 110 O SER A 10 4.166 15.443 20.375 1.00 0.00 O ATOM 111 CB SER A 10 3.309 14.595 23.318 1.00 0.00 C ATOM 112 OG SER A 10 3.189 14.833 24.713 1.00 0.00 O ATOM 0 H SER A 10 3.546 17.055 23.236 1.00 0.00 H new ATOM 0 HA SER A 10 5.439 14.964 23.315 1.00 0.00 H new ATOM 0 HB2 SER A 10 2.422 14.964 22.803 1.00 0.00 H new ATOM 0 HB3 SER A 10 3.364 13.523 23.130 1.00 0.00 H new ATOM 0 HG SER A 10 2.385 14.387 25.053 1.00 0.00 H new ATOM 118 N ALA A 11 5.594 13.843 21.071 1.00 0.00 N ATOM 119 CA ALA A 11 5.909 13.294 19.748 1.00 0.00 C ATOM 120 C ALA A 11 4.837 12.306 19.227 1.00 0.00 C ATOM 121 O ALA A 11 3.997 11.811 19.986 1.00 0.00 O ATOM 122 CB ALA A 11 7.299 12.647 19.820 1.00 0.00 C ATOM 0 H ALA A 11 6.076 13.359 21.828 1.00 0.00 H new ATOM 0 HA ALA A 11 5.911 14.107 19.022 1.00 0.00 H new ATOM 0 HB1 ALA A 11 7.557 12.230 18.846 1.00 0.00 H new ATOM 0 HB2 ALA A 11 8.036 13.399 20.100 1.00 0.00 H new ATOM 0 HB3 ALA A 11 7.292 11.851 20.565 1.00 0.00 H new ATOM 128 N ALA A 12 4.888 11.999 17.927 1.00 0.00 N ATOM 129 CA ALA A 12 4.025 11.003 17.282 1.00 0.00 C ATOM 130 C ALA A 12 4.352 9.556 17.723 1.00 0.00 C ATOM 131 O ALA A 12 5.463 9.258 18.176 1.00 0.00 O ATOM 132 CB ALA A 12 4.140 11.168 15.759 1.00 0.00 C ATOM 0 H ALA A 12 5.541 12.443 17.282 1.00 0.00 H new ATOM 0 HA ALA A 12 2.996 11.178 17.596 1.00 0.00 H new ATOM 0 HB1 ALA A 12 3.504 10.434 15.264 1.00 0.00 H new ATOM 0 HB2 ALA A 12 3.823 12.172 15.477 1.00 0.00 H new ATOM 0 HB3 ALA A 12 5.175 11.015 15.454 1.00 0.00 H new ATOM 138 N ILE A 13 3.385 8.644 17.562 1.00 0.00 N ATOM 139 CA ILE A 13 3.531 7.218 17.907 1.00 0.00 C ATOM 140 C ILE A 13 4.426 6.523 16.867 1.00 0.00 C ATOM 141 O ILE A 13 4.299 6.767 15.664 1.00 0.00 O ATOM 142 CB ILE A 13 2.147 6.535 18.069 1.00 0.00 C ATOM 143 CG1 ILE A 13 1.283 7.281 19.119 1.00 0.00 C ATOM 144 CG2 ILE A 13 2.303 5.055 18.481 1.00 0.00 C ATOM 145 CD1 ILE A 13 -0.152 6.754 19.266 1.00 0.00 C ATOM 0 H ILE A 13 2.466 8.875 17.184 1.00 0.00 H new ATOM 0 HA ILE A 13 4.023 7.128 18.876 1.00 0.00 H new ATOM 0 HB ILE A 13 1.645 6.578 17.102 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.779 7.218 20.088 1.00 0.00 H new ATOM 0 HG13 ILE A 13 1.241 8.337 18.850 1.00 0.00 H new ATOM 0 HG21 ILE A 13 1.318 4.601 18.587 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.867 4.522 17.716 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.834 4.996 19.431 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -0.678 7.337 20.022 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.672 6.843 18.312 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -0.126 5.707 19.569 1.00 0.00 H new ATOM 157 N HIS A 14 5.296 5.607 17.311 1.00 0.00 N ATOM 158 CA HIS A 14 6.315 4.901 16.507 1.00 0.00 C ATOM 159 C HIS A 14 5.765 3.789 15.583 1.00 0.00 C ATOM 160 O HIS A 14 6.357 2.718 15.446 1.00 0.00 O ATOM 161 CB HIS A 14 7.439 4.412 17.442 1.00 0.00 C ATOM 162 CG HIS A 14 8.048 5.516 18.274 1.00 0.00 C ATOM 163 ND1 HIS A 14 7.971 5.622 19.669 1.00 0.00 N ATOM 164 CD2 HIS A 14 8.724 6.594 17.785 1.00 0.00 C ATOM 165 CE1 HIS A 14 8.611 6.764 19.984 1.00 0.00 C ATOM 166 NE2 HIS A 14 9.072 7.366 18.874 1.00 0.00 N ATOM 0 H HIS A 14 5.313 5.320 18.290 1.00 0.00 H new ATOM 0 HA HIS A 14 6.722 5.619 15.795 1.00 0.00 H new ATOM 0 HB2 HIS A 14 7.042 3.644 18.105 1.00 0.00 H new ATOM 0 HB3 HIS A 14 8.221 3.944 16.844 1.00 0.00 H new ATOM 0 HD2 HIS A 14 8.944 6.803 16.748 1.00 0.00 H new ATOM 0 HE1 HIS A 14 8.736 7.143 20.987 1.00 0.00 H new ATOM 0 HE2 HIS A 14 9.591 8.244 18.842 1.00 0.00 H new ATOM 174 N ARG A 15 4.627 4.062 14.932 1.00 0.00 N ATOM 175 CA ARG A 15 3.921 3.202 13.949 1.00 0.00 C ATOM 176 C ARG A 15 3.447 3.940 12.688 1.00 0.00 C ATOM 177 O ARG A 15 2.632 3.456 11.907 1.00 0.00 O ATOM 178 CB ARG A 15 2.750 2.505 14.674 1.00 0.00 C ATOM 179 CG ARG A 15 1.632 3.517 14.994 1.00 0.00 C ATOM 180 CD ARG A 15 0.532 2.947 15.885 1.00 0.00 C ATOM 181 NE ARG A 15 -0.520 3.962 16.107 1.00 0.00 N ATOM 182 CZ ARG A 15 -1.580 3.842 16.888 1.00 0.00 C ATOM 183 NH1 ARG A 15 -1.786 2.776 17.608 1.00 0.00 N ATOM 184 NH2 ARG A 15 -2.462 4.797 16.959 1.00 0.00 N ATOM 0 H ARG A 15 4.136 4.944 15.081 1.00 0.00 H new ATOM 0 HA ARG A 15 4.635 2.468 13.574 1.00 0.00 H new ATOM 0 HB2 ARG A 15 2.355 1.703 14.051 1.00 0.00 H new ATOM 0 HB3 ARG A 15 3.107 2.046 15.596 1.00 0.00 H new ATOM 0 HG2 ARG A 15 2.070 4.388 15.483 1.00 0.00 H new ATOM 0 HG3 ARG A 15 1.189 3.864 14.061 1.00 0.00 H new ATOM 0 HD2 ARG A 15 0.100 2.060 15.421 1.00 0.00 H new ATOM 0 HD3 ARG A 15 0.953 2.634 16.840 1.00 0.00 H new ATOM 0 HE ARG A 15 -0.417 4.845 15.607 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -1.120 2.004 17.579 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -2.614 2.713 18.201 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -2.339 5.647 16.409 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -3.277 4.695 17.564 1.00 0.00 H new ATOM 198 N THR A 16 3.991 5.139 12.533 1.00 0.00 N ATOM 199 CA THR A 16 3.649 6.144 11.509 1.00 0.00 C ATOM 200 C THR A 16 4.669 6.199 10.370 1.00 0.00 C ATOM 201 O THR A 16 4.428 5.650 9.298 1.00 0.00 O ATOM 202 CB THR A 16 3.414 7.501 12.191 1.00 0.00 C ATOM 203 OG1 THR A 16 4.480 7.796 13.074 1.00 0.00 O ATOM 204 CG2 THR A 16 2.123 7.521 13.012 1.00 0.00 C ATOM 0 H THR A 16 4.731 5.467 13.154 1.00 0.00 H new ATOM 0 HA THR A 16 2.721 5.848 11.019 1.00 0.00 H new ATOM 0 HB THR A 16 3.344 8.239 11.392 1.00 0.00 H new ATOM 0 HG1 THR A 16 4.305 7.386 13.947 1.00 0.00 H new ATOM 0 HG21 THR A 16 2.001 8.501 13.474 1.00 0.00 H new ATOM 0 HG22 THR A 16 1.274 7.319 12.359 1.00 0.00 H new ATOM 0 HG23 THR A 16 2.173 6.757 13.788 1.00 0.00 H new ATOM 212 N GLN A 17 5.851 6.775 10.617 1.00 0.00 N ATOM 213 CA GLN A 17 6.965 6.803 9.648 1.00 0.00 C ATOM 214 C GLN A 17 7.728 5.463 9.628 1.00 0.00 C ATOM 215 O GLN A 17 8.527 5.210 8.727 1.00 0.00 O ATOM 216 CB GLN A 17 7.934 7.963 9.952 1.00 0.00 C ATOM 217 CG GLN A 17 7.329 9.378 9.831 1.00 0.00 C ATOM 218 CD GLN A 17 6.260 9.679 10.860 1.00 0.00 C ATOM 219 OE1 GLN A 17 5.113 9.969 10.549 1.00 0.00 O ATOM 220 NE2 GLN A 17 6.583 9.550 12.125 1.00 0.00 N ATOM 0 H GLN A 17 6.068 7.239 11.499 1.00 0.00 H new ATOM 0 HA GLN A 17 6.532 6.962 8.661 1.00 0.00 H new ATOM 0 HB2 GLN A 17 8.320 7.836 10.963 1.00 0.00 H new ATOM 0 HB3 GLN A 17 8.785 7.891 9.275 1.00 0.00 H new ATOM 0 HG2 GLN A 17 8.128 10.113 9.926 1.00 0.00 H new ATOM 0 HG3 GLN A 17 6.904 9.496 8.834 1.00 0.00 H new ATOM 0 HE21 GLN A 17 7.539 9.308 12.385 1.00 0.00 H new ATOM 0 HE22 GLN A 17 5.878 9.691 12.848 1.00 0.00 H new ATOM 229 N LEU A 18 7.468 4.592 10.615 1.00 0.00 N ATOM 230 CA LEU A 18 8.193 3.319 10.793 1.00 0.00 C ATOM 231 C LEU A 18 7.777 2.210 9.802 1.00 0.00 C ATOM 232 O LEU A 18 8.501 1.228 9.628 1.00 0.00 O ATOM 233 CB LEU A 18 8.087 2.868 12.265 1.00 0.00 C ATOM 234 CG LEU A 18 8.997 3.591 13.282 1.00 0.00 C ATOM 235 CD1 LEU A 18 10.485 3.412 12.978 1.00 0.00 C ATOM 236 CD2 LEU A 18 8.714 5.089 13.427 1.00 0.00 C ATOM 0 H LEU A 18 6.745 4.750 11.317 1.00 0.00 H new ATOM 0 HA LEU A 18 9.239 3.505 10.551 1.00 0.00 H new ATOM 0 HB2 LEU A 18 7.053 2.994 12.585 1.00 0.00 H new ATOM 0 HB3 LEU A 18 8.307 1.801 12.310 1.00 0.00 H new ATOM 0 HG LEU A 18 8.751 3.105 14.226 1.00 0.00 H new ATOM 0 HD11 LEU A 18 11.075 3.942 13.726 1.00 0.00 H new ATOM 0 HD12 LEU A 18 10.736 2.352 13.002 1.00 0.00 H new ATOM 0 HD13 LEU A 18 10.705 3.815 11.989 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.397 5.519 14.160 1.00 0.00 H new ATOM 0 HD22 LEU A 18 8.857 5.581 12.465 1.00 0.00 H new ATOM 0 HD23 LEU A 18 7.686 5.235 13.759 1.00 0.00 H new ATOM 248 N TRP A 19 6.648 2.407 9.119 1.00 0.00 N ATOM 249 CA TRP A 19 6.109 1.554 8.045 1.00 0.00 C ATOM 250 C TRP A 19 5.893 2.377 6.759 1.00 0.00 C ATOM 251 O TRP A 19 4.852 2.298 6.102 1.00 0.00 O ATOM 252 CB TRP A 19 4.873 0.778 8.542 1.00 0.00 C ATOM 253 CG TRP A 19 5.193 -0.457 9.330 1.00 0.00 C ATOM 254 CD1 TRP A 19 5.275 -1.706 8.816 1.00 0.00 C ATOM 255 CD2 TRP A 19 5.500 -0.600 10.753 1.00 0.00 C ATOM 256 NE1 TRP A 19 5.628 -2.600 9.806 1.00 0.00 N ATOM 257 CE2 TRP A 19 5.782 -1.974 11.022 1.00 0.00 C ATOM 258 CE3 TRP A 19 5.575 0.293 11.847 1.00 0.00 C ATOM 259 CZ2 TRP A 19 6.130 -2.438 12.299 1.00 0.00 C ATOM 260 CZ3 TRP A 19 5.923 -0.162 13.134 1.00 0.00 C ATOM 261 CH2 TRP A 19 6.201 -1.522 13.362 1.00 0.00 C ATOM 0 H TRP A 19 6.048 3.210 9.307 1.00 0.00 H new ATOM 0 HA TRP A 19 6.834 0.787 7.772 1.00 0.00 H new ATOM 0 HB2 TRP A 19 4.267 1.441 9.159 1.00 0.00 H new ATOM 0 HB3 TRP A 19 4.265 0.498 7.682 1.00 0.00 H new ATOM 0 HD1 TRP A 19 5.091 -1.965 7.784 1.00 0.00 H new ATOM 0 HE1 TRP A 19 5.759 -3.600 9.655 1.00 0.00 H new ATOM 0 HE3 TRP A 19 5.362 1.341 11.693 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 6.340 -3.485 12.463 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 5.977 0.540 13.953 1.00 0.00 H new ATOM 0 HH2 TRP A 19 6.468 -1.861 14.352 1.00 0.00 H new ATOM 272 N PHE A 20 6.889 3.205 6.418 1.00 0.00 N ATOM 273 CA PHE A 20 6.878 4.110 5.265 1.00 0.00 C ATOM 274 C PHE A 20 8.263 4.230 4.594 1.00 0.00 C ATOM 275 O PHE A 20 9.288 4.374 5.263 1.00 0.00 O ATOM 276 CB PHE A 20 6.372 5.484 5.724 1.00 0.00 C ATOM 277 CG PHE A 20 6.346 6.520 4.616 1.00 0.00 C ATOM 278 CD1 PHE A 20 5.278 6.542 3.699 1.00 0.00 C ATOM 279 CD2 PHE A 20 7.409 7.433 4.473 1.00 0.00 C ATOM 280 CE1 PHE A 20 5.272 7.474 2.646 1.00 0.00 C ATOM 281 CE2 PHE A 20 7.405 8.362 3.417 1.00 0.00 C ATOM 282 CZ PHE A 20 6.335 8.383 2.503 1.00 0.00 C ATOM 0 H PHE A 20 7.753 3.264 6.957 1.00 0.00 H new ATOM 0 HA PHE A 20 6.210 3.697 4.509 1.00 0.00 H new ATOM 0 HB2 PHE A 20 5.367 5.375 6.132 1.00 0.00 H new ATOM 0 HB3 PHE A 20 7.007 5.845 6.533 1.00 0.00 H new ATOM 0 HD1 PHE A 20 4.462 5.842 3.804 1.00 0.00 H new ATOM 0 HD2 PHE A 20 8.229 7.420 5.176 1.00 0.00 H new ATOM 0 HE1 PHE A 20 4.450 7.492 1.946 1.00 0.00 H new ATOM 0 HE2 PHE A 20 8.223 9.059 3.308 1.00 0.00 H new ATOM 0 HZ PHE A 20 6.330 9.097 1.692 1.00 0.00 H new ATOM 292 N HIS A 21 8.282 4.153 3.258 1.00 0.00 N ATOM 293 CA HIS A 21 9.456 4.348 2.388 1.00 0.00 C ATOM 294 C HIS A 21 9.036 5.095 1.110 1.00 0.00 C ATOM 295 O HIS A 21 7.861 5.038 0.751 1.00 0.00 O ATOM 296 CB HIS A 21 10.071 2.971 2.052 1.00 0.00 C ATOM 297 CG HIS A 21 11.541 3.032 1.724 1.00 0.00 C ATOM 298 ND1 HIS A 21 12.083 3.585 0.559 1.00 0.00 N ATOM 299 CD2 HIS A 21 12.553 2.547 2.498 1.00 0.00 C ATOM 300 CE1 HIS A 21 13.412 3.416 0.659 1.00 0.00 C ATOM 301 NE2 HIS A 21 13.723 2.797 1.811 1.00 0.00 N ATOM 0 H HIS A 21 7.439 3.943 2.724 1.00 0.00 H new ATOM 0 HA HIS A 21 10.207 4.950 2.900 1.00 0.00 H new ATOM 0 HB2 HIS A 21 9.923 2.300 2.898 1.00 0.00 H new ATOM 0 HB3 HIS A 21 9.536 2.540 1.206 1.00 0.00 H new ATOM 0 HD2 HIS A 21 12.458 2.063 3.459 1.00 0.00 H new ATOM 0 HE1 HIS A 21 14.130 3.733 -0.083 1.00 0.00 H new ATOM 0 HE2 HIS A 21 14.663 2.554 2.124 1.00 0.00 H new ATOM 309 N GLY A 22 9.912 5.780 0.372 1.00 0.00 N ATOM 310 CA GLY A 22 9.509 6.369 -0.902 1.00 0.00 C ATOM 311 C GLY A 22 10.568 6.269 -2.000 1.00 0.00 C ATOM 312 O GLY A 22 10.547 7.056 -2.936 1.00 0.00 O ATOM 0 H GLY A 22 10.886 5.938 0.630 1.00 0.00 H new ATOM 0 HA2 GLY A 22 8.598 5.878 -1.245 1.00 0.00 H new ATOM 0 HA3 GLY A 22 9.264 7.419 -0.743 1.00 0.00 H new ATOM 316 N ARG A 23 11.497 5.307 -1.910 1.00 0.00 N ATOM 317 CA ARG A 23 12.503 5.020 -2.954 1.00 0.00 C ATOM 318 C ARG A 23 12.839 3.517 -2.997 1.00 0.00 C ATOM 319 O ARG A 23 13.990 3.096 -2.910 1.00 0.00 O ATOM 320 CB ARG A 23 13.724 5.960 -2.771 1.00 0.00 C ATOM 321 CG ARG A 23 14.821 5.800 -3.848 1.00 0.00 C ATOM 322 CD ARG A 23 15.711 7.042 -3.999 1.00 0.00 C ATOM 323 NE ARG A 23 16.470 7.340 -2.766 1.00 0.00 N ATOM 324 CZ ARG A 23 17.636 6.837 -2.392 1.00 0.00 C ATOM 325 NH1 ARG A 23 18.278 5.954 -3.106 1.00 0.00 N ATOM 326 NH2 ARG A 23 18.187 7.217 -1.275 1.00 0.00 N ATOM 0 H ARG A 23 11.576 4.694 -1.099 1.00 0.00 H new ATOM 0 HA ARG A 23 12.100 5.238 -3.943 1.00 0.00 H new ATOM 0 HB2 ARG A 23 13.376 6.993 -2.775 1.00 0.00 H new ATOM 0 HB3 ARG A 23 14.165 5.776 -1.791 1.00 0.00 H new ATOM 0 HG2 ARG A 23 15.445 4.943 -3.596 1.00 0.00 H new ATOM 0 HG3 ARG A 23 14.350 5.581 -4.806 1.00 0.00 H new ATOM 0 HD2 ARG A 23 16.407 6.890 -4.824 1.00 0.00 H new ATOM 0 HD3 ARG A 23 15.092 7.901 -4.259 1.00 0.00 H new ATOM 0 HE ARG A 23 16.045 8.013 -2.128 1.00 0.00 H new ATOM 0 HH11 ARG A 23 17.883 5.627 -3.988 1.00 0.00 H new ATOM 0 HH12 ARG A 23 19.175 5.591 -2.783 1.00 0.00 H new ATOM 0 HH21 ARG A 23 17.720 7.905 -0.684 1.00 0.00 H new ATOM 0 HH22 ARG A 23 19.086 6.827 -0.991 1.00 0.00 H new ATOM 340 N ILE A 24 11.793 2.699 -3.111 1.00 0.00 N ATOM 341 CA ILE A 24 11.892 1.237 -3.286 1.00 0.00 C ATOM 342 C ILE A 24 10.816 0.775 -4.288 1.00 0.00 C ATOM 343 O ILE A 24 9.905 0.003 -3.995 1.00 0.00 O ATOM 344 CB ILE A 24 11.974 0.520 -1.915 1.00 0.00 C ATOM 345 CG1 ILE A 24 12.531 -0.904 -2.118 1.00 0.00 C ATOM 346 CG2 ILE A 24 10.671 0.584 -1.102 1.00 0.00 C ATOM 347 CD1 ILE A 24 12.605 -1.749 -0.840 1.00 0.00 C ATOM 0 H ILE A 24 10.830 3.034 -3.085 1.00 0.00 H new ATOM 0 HA ILE A 24 12.831 0.936 -3.752 1.00 0.00 H new ATOM 0 HB ILE A 24 12.675 1.064 -1.282 1.00 0.00 H new ATOM 0 HG12 ILE A 24 11.908 -1.423 -2.846 1.00 0.00 H new ATOM 0 HG13 ILE A 24 13.530 -0.831 -2.548 1.00 0.00 H new ATOM 0 HG21 ILE A 24 10.807 0.060 -0.156 1.00 0.00 H new ATOM 0 HG22 ILE A 24 10.414 1.625 -0.907 1.00 0.00 H new ATOM 0 HG23 ILE A 24 9.867 0.112 -1.666 1.00 0.00 H new ATOM 0 HD11 ILE A 24 13.008 -2.734 -1.078 1.00 0.00 H new ATOM 0 HD12 ILE A 24 13.254 -1.257 -0.115 1.00 0.00 H new ATOM 0 HD13 ILE A 24 11.606 -1.858 -0.418 1.00 0.00 H new ATOM 359 N SER A 25 10.936 1.342 -5.495 1.00 0.00 N ATOM 360 CA SER A 25 10.027 1.215 -6.648 1.00 0.00 C ATOM 361 C SER A 25 9.527 -0.212 -6.924 1.00 0.00 C ATOM 362 O SER A 25 10.210 -1.188 -6.619 1.00 0.00 O ATOM 363 CB SER A 25 10.750 1.795 -7.873 1.00 0.00 C ATOM 364 OG SER A 25 9.882 1.946 -8.973 1.00 0.00 O ATOM 0 H SER A 25 11.729 1.947 -5.710 1.00 0.00 H new ATOM 0 HA SER A 25 9.118 1.769 -6.416 1.00 0.00 H new ATOM 0 HB2 SER A 25 11.181 2.762 -7.616 1.00 0.00 H new ATOM 0 HB3 SER A 25 11.577 1.141 -8.150 1.00 0.00 H new ATOM 0 HG SER A 25 9.199 2.616 -8.761 1.00 0.00 H new ATOM 370 N ARG A 26 8.346 -0.340 -7.539 1.00 0.00 N ATOM 371 CA ARG A 26 7.608 -1.594 -7.805 1.00 0.00 C ATOM 372 C ARG A 26 8.393 -2.770 -8.394 1.00 0.00 C ATOM 373 O ARG A 26 8.112 -3.914 -8.043 1.00 0.00 O ATOM 374 CB ARG A 26 6.319 -1.269 -8.597 1.00 0.00 C ATOM 375 CG ARG A 26 6.433 -0.761 -10.050 1.00 0.00 C ATOM 376 CD ARG A 26 7.218 0.543 -10.221 1.00 0.00 C ATOM 377 NE ARG A 26 6.886 1.268 -11.463 1.00 0.00 N ATOM 378 CZ ARG A 26 7.061 2.557 -11.691 1.00 0.00 C ATOM 379 NH1 ARG A 26 7.558 3.400 -10.838 1.00 0.00 N ATOM 380 NH2 ARG A 26 6.683 3.066 -12.821 1.00 0.00 N ATOM 0 H ARG A 26 7.843 0.476 -7.888 1.00 0.00 H new ATOM 0 HA ARG A 26 7.363 -1.992 -6.821 1.00 0.00 H new ATOM 0 HB2 ARG A 26 5.708 -2.171 -8.612 1.00 0.00 H new ATOM 0 HB3 ARG A 26 5.767 -0.519 -8.030 1.00 0.00 H new ATOM 0 HG2 ARG A 26 6.908 -1.535 -10.653 1.00 0.00 H new ATOM 0 HG3 ARG A 26 5.429 -0.618 -10.449 1.00 0.00 H new ATOM 0 HD2 ARG A 26 7.022 1.191 -9.367 1.00 0.00 H new ATOM 0 HD3 ARG A 26 8.285 0.320 -10.213 1.00 0.00 H new ATOM 0 HE ARG A 26 6.481 0.719 -12.221 1.00 0.00 H new ATOM 0 HH11 ARG A 26 7.846 3.080 -9.913 1.00 0.00 H new ATOM 0 HH12 ARG A 26 7.661 4.382 -11.092 1.00 0.00 H new ATOM 0 HH21 ARG A 26 6.253 2.472 -13.529 1.00 0.00 H new ATOM 0 HH22 ARG A 26 6.816 4.061 -13.002 1.00 0.00 H new ATOM 394 N GLU A 27 9.385 -2.519 -9.247 1.00 0.00 N ATOM 395 CA GLU A 27 10.266 -3.578 -9.778 1.00 0.00 C ATOM 396 C GLU A 27 11.393 -3.981 -8.800 1.00 0.00 C ATOM 397 O GLU A 27 11.864 -5.117 -8.827 1.00 0.00 O ATOM 398 CB GLU A 27 10.840 -3.158 -11.140 1.00 0.00 C ATOM 399 CG GLU A 27 9.745 -2.952 -12.198 1.00 0.00 C ATOM 400 CD GLU A 27 10.359 -2.819 -13.604 1.00 0.00 C ATOM 401 OE1 GLU A 27 10.870 -1.725 -13.949 1.00 0.00 O ATOM 402 OE2 GLU A 27 10.341 -3.817 -14.366 1.00 0.00 O ATOM 0 H GLU A 27 9.606 -1.585 -9.592 1.00 0.00 H new ATOM 0 HA GLU A 27 9.649 -4.468 -9.907 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.407 -2.234 -11.023 1.00 0.00 H new ATOM 0 HB3 GLU A 27 11.539 -3.919 -11.487 1.00 0.00 H new ATOM 0 HG2 GLU A 27 9.051 -3.792 -12.178 1.00 0.00 H new ATOM 0 HG3 GLU A 27 9.169 -2.057 -11.962 1.00 0.00 H new ATOM 409 N GLU A 28 11.826 -3.061 -7.929 1.00 0.00 N ATOM 410 CA GLU A 28 12.872 -3.266 -6.917 1.00 0.00 C ATOM 411 C GLU A 28 12.366 -3.962 -5.648 1.00 0.00 C ATOM 412 O GLU A 28 12.962 -4.939 -5.197 1.00 0.00 O ATOM 413 CB GLU A 28 13.543 -1.924 -6.565 1.00 0.00 C ATOM 414 CG GLU A 28 14.202 -1.218 -7.760 1.00 0.00 C ATOM 415 CD GLU A 28 15.293 -2.095 -8.400 1.00 0.00 C ATOM 416 OE1 GLU A 28 16.340 -2.341 -7.756 1.00 0.00 O ATOM 417 OE2 GLU A 28 15.106 -2.609 -9.526 1.00 0.00 O ATOM 0 H GLU A 28 11.443 -2.116 -7.908 1.00 0.00 H new ATOM 0 HA GLU A 28 13.605 -3.939 -7.362 1.00 0.00 H new ATOM 0 HB2 GLU A 28 12.796 -1.259 -6.131 1.00 0.00 H new ATOM 0 HB3 GLU A 28 14.298 -2.098 -5.798 1.00 0.00 H new ATOM 0 HG2 GLU A 28 13.444 -0.977 -8.505 1.00 0.00 H new ATOM 0 HG3 GLU A 28 14.638 -0.274 -7.432 1.00 0.00 H new ATOM 424 N SER A 29 11.252 -3.496 -5.077 1.00 0.00 N ATOM 425 CA SER A 29 10.726 -4.006 -3.799 1.00 0.00 C ATOM 426 C SER A 29 10.311 -5.475 -3.860 1.00 0.00 C ATOM 427 O SER A 29 10.536 -6.208 -2.897 1.00 0.00 O ATOM 428 CB SER A 29 9.576 -3.130 -3.276 1.00 0.00 C ATOM 429 OG SER A 29 8.799 -2.566 -4.313 1.00 0.00 O ATOM 0 H SER A 29 10.685 -2.753 -5.485 1.00 0.00 H new ATOM 0 HA SER A 29 11.553 -3.949 -3.091 1.00 0.00 H new ATOM 0 HB2 SER A 29 8.933 -3.730 -2.632 1.00 0.00 H new ATOM 0 HB3 SER A 29 9.987 -2.330 -2.660 1.00 0.00 H new ATOM 0 HG SER A 29 9.015 -1.614 -4.403 1.00 0.00 H new ATOM 435 N GLN A 30 9.808 -5.957 -5.001 1.00 0.00 N ATOM 436 CA GLN A 30 9.453 -7.377 -5.167 1.00 0.00 C ATOM 437 C GLN A 30 10.663 -8.334 -5.193 1.00 0.00 C ATOM 438 O GLN A 30 10.493 -9.528 -4.952 1.00 0.00 O ATOM 439 CB GLN A 30 8.508 -7.579 -6.364 1.00 0.00 C ATOM 440 CG GLN A 30 9.112 -7.273 -7.743 1.00 0.00 C ATOM 441 CD GLN A 30 8.177 -7.709 -8.875 1.00 0.00 C ATOM 442 OE1 GLN A 30 8.531 -8.503 -9.734 1.00 0.00 O ATOM 443 NE2 GLN A 30 6.949 -7.230 -8.921 1.00 0.00 N ATOM 0 H GLN A 30 9.636 -5.385 -5.828 1.00 0.00 H new ATOM 0 HA GLN A 30 8.910 -7.658 -4.265 1.00 0.00 H new ATOM 0 HB2 GLN A 30 8.161 -8.612 -6.360 1.00 0.00 H new ATOM 0 HB3 GLN A 30 7.631 -6.947 -6.223 1.00 0.00 H new ATOM 0 HG2 GLN A 30 9.311 -6.204 -7.825 1.00 0.00 H new ATOM 0 HG3 GLN A 30 10.070 -7.784 -7.843 1.00 0.00 H new ATOM 0 HE21 GLN A 30 6.634 -6.566 -8.214 1.00 0.00 H new ATOM 0 HE22 GLN A 30 6.315 -7.523 -9.664 1.00 0.00 H new ATOM 452 N ARG A 31 11.883 -7.826 -5.421 1.00 0.00 N ATOM 453 CA ARG A 31 13.127 -8.621 -5.361 1.00 0.00 C ATOM 454 C ARG A 31 13.552 -8.922 -3.913 1.00 0.00 C ATOM 455 O ARG A 31 14.137 -9.972 -3.647 1.00 0.00 O ATOM 456 CB ARG A 31 14.221 -7.874 -6.145 1.00 0.00 C ATOM 457 CG ARG A 31 15.404 -8.779 -6.536 1.00 0.00 C ATOM 458 CD ARG A 31 16.567 -7.993 -7.162 1.00 0.00 C ATOM 459 NE ARG A 31 16.142 -7.207 -8.341 1.00 0.00 N ATOM 460 CZ ARG A 31 16.088 -5.888 -8.453 1.00 0.00 C ATOM 461 NH1 ARG A 31 16.474 -5.087 -7.506 1.00 0.00 N ATOM 462 NH2 ARG A 31 15.631 -5.330 -9.532 1.00 0.00 N ATOM 0 H ARG A 31 12.040 -6.845 -5.654 1.00 0.00 H new ATOM 0 HA ARG A 31 12.957 -9.594 -5.821 1.00 0.00 H new ATOM 0 HB2 ARG A 31 13.785 -7.445 -7.047 1.00 0.00 H new ATOM 0 HB3 ARG A 31 14.589 -7.044 -5.543 1.00 0.00 H new ATOM 0 HG2 ARG A 31 15.761 -9.306 -5.651 1.00 0.00 H new ATOM 0 HG3 ARG A 31 15.060 -9.536 -7.241 1.00 0.00 H new ATOM 0 HD2 ARG A 31 16.993 -7.323 -6.416 1.00 0.00 H new ATOM 0 HD3 ARG A 31 17.355 -8.686 -7.455 1.00 0.00 H new ATOM 0 HE ARG A 31 15.858 -7.742 -9.162 1.00 0.00 H new ATOM 0 HH11 ARG A 31 16.837 -5.468 -6.632 1.00 0.00 H new ATOM 0 HH12 ARG A 31 16.414 -4.077 -7.636 1.00 0.00 H new ATOM 0 HH21 ARG A 31 15.308 -5.908 -10.308 1.00 0.00 H new ATOM 0 HH22 ARG A 31 15.595 -4.313 -9.604 1.00 0.00 H new ATOM 476 N LEU A 32 13.235 -8.013 -2.982 1.00 0.00 N ATOM 477 CA LEU A 32 13.596 -8.093 -1.558 1.00 0.00 C ATOM 478 C LEU A 32 12.446 -8.660 -0.708 1.00 0.00 C ATOM 479 O LEU A 32 12.585 -9.703 -0.068 1.00 0.00 O ATOM 480 CB LEU A 32 14.018 -6.693 -1.049 1.00 0.00 C ATOM 481 CG LEU A 32 15.450 -6.237 -1.401 1.00 0.00 C ATOM 482 CD1 LEU A 32 15.692 -6.056 -2.900 1.00 0.00 C ATOM 483 CD2 LEU A 32 15.732 -4.893 -0.726 1.00 0.00 C ATOM 0 H LEU A 32 12.702 -7.173 -3.206 1.00 0.00 H new ATOM 0 HA LEU A 32 14.436 -8.781 -1.457 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.318 -5.959 -1.448 1.00 0.00 H new ATOM 0 HB3 LEU A 32 13.912 -6.678 0.036 1.00 0.00 H new ATOM 0 HG LEU A 32 16.111 -7.029 -1.050 1.00 0.00 H new ATOM 0 HD11 LEU A 32 16.720 -5.735 -3.066 1.00 0.00 H new ATOM 0 HD12 LEU A 32 15.520 -7.002 -3.413 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.009 -5.302 -3.290 1.00 0.00 H new ATOM 0 HD21 LEU A 32 16.743 -4.567 -0.972 1.00 0.00 H new ATOM 0 HD22 LEU A 32 15.016 -4.151 -1.079 1.00 0.00 H new ATOM 0 HD23 LEU A 32 15.639 -5.002 0.355 1.00 0.00 H new ATOM 495 N ILE A 33 11.300 -7.968 -0.715 1.00 0.00 N ATOM 496 CA ILE A 33 10.098 -8.248 0.101 1.00 0.00 C ATOM 497 C ILE A 33 9.213 -9.359 -0.494 1.00 0.00 C ATOM 498 O ILE A 33 8.284 -9.826 0.155 1.00 0.00 O ATOM 499 CB ILE A 33 9.365 -6.901 0.354 1.00 0.00 C ATOM 500 CG1 ILE A 33 10.296 -5.885 1.070 1.00 0.00 C ATOM 501 CG2 ILE A 33 8.083 -7.009 1.200 1.00 0.00 C ATOM 502 CD1 ILE A 33 10.316 -4.535 0.346 1.00 0.00 C ATOM 0 H ILE A 33 11.173 -7.155 -1.318 1.00 0.00 H new ATOM 0 HA ILE A 33 10.389 -8.664 1.065 1.00 0.00 H new ATOM 0 HB ILE A 33 9.084 -6.568 -0.645 1.00 0.00 H new ATOM 0 HG12 ILE A 33 9.960 -5.743 2.097 1.00 0.00 H new ATOM 0 HG13 ILE A 33 11.308 -6.288 1.118 1.00 0.00 H new ATOM 0 HG21 ILE A 33 7.643 -6.019 1.322 1.00 0.00 H new ATOM 0 HG22 ILE A 33 7.370 -7.663 0.698 1.00 0.00 H new ATOM 0 HG23 ILE A 33 8.327 -7.421 2.179 1.00 0.00 H new ATOM 0 HD11 ILE A 33 10.977 -3.848 0.874 1.00 0.00 H new ATOM 0 HD12 ILE A 33 10.677 -4.674 -0.673 1.00 0.00 H new ATOM 0 HD13 ILE A 33 9.308 -4.121 0.321 1.00 0.00 H new ATOM 514 N GLY A 34 9.551 -9.901 -1.669 1.00 0.00 N ATOM 515 CA GLY A 34 8.711 -10.887 -2.374 1.00 0.00 C ATOM 516 C GLY A 34 9.085 -12.349 -2.128 1.00 0.00 C ATOM 517 O GLY A 34 8.511 -13.245 -2.745 1.00 0.00 O ATOM 0 H GLY A 34 10.414 -9.671 -2.162 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.674 -10.738 -2.075 1.00 0.00 H new ATOM 0 HA3 GLY A 34 8.766 -10.689 -3.444 1.00 0.00 H new ATOM 521 N GLN A 35 10.001 -12.596 -1.186 1.00 0.00 N ATOM 522 CA GLN A 35 10.387 -13.940 -0.734 1.00 0.00 C ATOM 523 C GLN A 35 9.385 -14.537 0.283 1.00 0.00 C ATOM 524 O GLN A 35 9.548 -15.679 0.716 1.00 0.00 O ATOM 525 CB GLN A 35 11.828 -13.896 -0.195 1.00 0.00 C ATOM 526 CG GLN A 35 11.986 -13.127 1.130 1.00 0.00 C ATOM 527 CD GLN A 35 13.457 -12.972 1.509 1.00 0.00 C ATOM 528 OE1 GLN A 35 14.069 -13.841 2.118 1.00 0.00 O ATOM 529 NE2 GLN A 35 14.088 -11.872 1.152 1.00 0.00 N ATOM 0 H GLN A 35 10.507 -11.852 -0.705 1.00 0.00 H new ATOM 0 HA GLN A 35 10.355 -14.619 -1.586 1.00 0.00 H new ATOM 0 HB2 GLN A 35 12.182 -14.917 -0.053 1.00 0.00 H new ATOM 0 HB3 GLN A 35 12.471 -13.437 -0.947 1.00 0.00 H new ATOM 0 HG2 GLN A 35 11.526 -12.143 1.039 1.00 0.00 H new ATOM 0 HG3 GLN A 35 11.457 -13.654 1.924 1.00 0.00 H new ATOM 0 HE21 GLN A 35 13.590 -11.140 0.644 1.00 0.00 H new ATOM 0 HE22 GLN A 35 15.074 -11.752 1.383 1.00 0.00 H new ATOM 538 N GLN A 36 8.362 -13.767 0.692 1.00 0.00 N ATOM 539 CA GLN A 36 7.389 -14.153 1.719 1.00 0.00 C ATOM 540 C GLN A 36 6.406 -15.246 1.248 1.00 0.00 C ATOM 541 O GLN A 36 5.972 -15.255 0.093 1.00 0.00 O ATOM 542 CB GLN A 36 6.592 -12.928 2.214 1.00 0.00 C ATOM 543 CG GLN A 36 7.455 -11.819 2.835 1.00 0.00 C ATOM 544 CD GLN A 36 8.370 -12.308 3.954 1.00 0.00 C ATOM 545 OE1 GLN A 36 7.983 -13.057 4.843 1.00 0.00 O ATOM 546 NE2 GLN A 36 9.631 -11.932 3.931 1.00 0.00 N ATOM 0 H GLN A 36 8.188 -12.839 0.307 1.00 0.00 H new ATOM 0 HA GLN A 36 7.975 -14.570 2.538 1.00 0.00 H new ATOM 0 HB2 GLN A 36 6.033 -12.511 1.376 1.00 0.00 H new ATOM 0 HB3 GLN A 36 5.861 -13.259 2.952 1.00 0.00 H new ATOM 0 HG2 GLN A 36 8.063 -11.363 2.053 1.00 0.00 H new ATOM 0 HG3 GLN A 36 6.802 -11.039 3.226 1.00 0.00 H new ATOM 0 HE21 GLN A 36 9.964 -11.309 3.195 1.00 0.00 H new ATOM 0 HE22 GLN A 36 10.275 -12.264 4.649 1.00 0.00 H new ATOM 555 N GLY A 37 6.001 -16.130 2.171 1.00 0.00 N ATOM 556 CA GLY A 37 4.987 -17.184 1.965 1.00 0.00 C ATOM 557 C GLY A 37 3.640 -16.908 2.662 1.00 0.00 C ATOM 558 O GLY A 37 2.846 -17.830 2.866 1.00 0.00 O ATOM 0 H GLY A 37 6.382 -16.134 3.117 1.00 0.00 H new ATOM 0 HA2 GLY A 37 4.813 -17.301 0.895 1.00 0.00 H new ATOM 0 HA3 GLY A 37 5.385 -18.131 2.329 1.00 0.00 H new ATOM 562 N LEU A 38 3.411 -15.658 3.083 1.00 0.00 N ATOM 563 CA LEU A 38 2.251 -15.199 3.863 1.00 0.00 C ATOM 564 C LEU A 38 0.985 -14.949 3.002 1.00 0.00 C ATOM 565 O LEU A 38 0.997 -15.112 1.781 1.00 0.00 O ATOM 566 CB LEU A 38 2.690 -13.959 4.683 1.00 0.00 C ATOM 567 CG LEU A 38 3.449 -14.224 6.005 1.00 0.00 C ATOM 568 CD1 LEU A 38 2.552 -14.891 7.050 1.00 0.00 C ATOM 569 CD2 LEU A 38 4.720 -15.061 5.848 1.00 0.00 C ATOM 0 H LEU A 38 4.062 -14.900 2.879 1.00 0.00 H new ATOM 0 HA LEU A 38 1.939 -15.992 4.542 1.00 0.00 H new ATOM 0 HB2 LEU A 38 3.323 -13.339 4.048 1.00 0.00 H new ATOM 0 HB3 LEU A 38 1.800 -13.374 4.915 1.00 0.00 H new ATOM 0 HG LEU A 38 3.750 -13.231 6.340 1.00 0.00 H new ATOM 0 HD11 LEU A 38 3.122 -15.060 7.964 1.00 0.00 H new ATOM 0 HD12 LEU A 38 1.702 -14.243 7.267 1.00 0.00 H new ATOM 0 HD13 LEU A 38 2.192 -15.845 6.665 1.00 0.00 H new ATOM 0 HD21 LEU A 38 5.188 -15.198 6.823 1.00 0.00 H new ATOM 0 HD22 LEU A 38 4.465 -16.034 5.428 1.00 0.00 H new ATOM 0 HD23 LEU A 38 5.413 -14.548 5.181 1.00 0.00 H new ATOM 581 N VAL A 39 -0.121 -14.577 3.664 1.00 0.00 N ATOM 582 CA VAL A 39 -1.448 -14.291 3.066 1.00 0.00 C ATOM 583 C VAL A 39 -1.538 -12.995 2.275 1.00 0.00 C ATOM 584 O VAL A 39 -0.648 -12.147 2.369 1.00 0.00 O ATOM 585 CB VAL A 39 -2.576 -14.396 4.120 1.00 0.00 C ATOM 586 CG1 VAL A 39 -2.668 -15.811 4.700 1.00 0.00 C ATOM 587 CG2 VAL A 39 -2.429 -13.393 5.272 1.00 0.00 C ATOM 0 H VAL A 39 -0.122 -14.460 4.677 1.00 0.00 H new ATOM 0 HA VAL A 39 -1.589 -15.073 2.320 1.00 0.00 H new ATOM 0 HB VAL A 39 -3.493 -14.154 3.583 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -3.470 -15.851 5.437 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.876 -16.520 3.899 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -1.723 -16.071 5.178 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -3.253 -13.522 5.974 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -1.484 -13.566 5.786 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -2.446 -12.378 4.875 1.00 0.00 H new ATOM 597 N ASP A 40 -2.664 -12.840 1.553 1.00 0.00 N ATOM 598 CA ASP A 40 -3.112 -11.669 0.776 1.00 0.00 C ATOM 599 C ASP A 40 -3.265 -10.355 1.582 1.00 0.00 C ATOM 600 O ASP A 40 -4.045 -9.461 1.241 1.00 0.00 O ATOM 601 CB ASP A 40 -4.395 -11.993 0.009 1.00 0.00 C ATOM 602 CG ASP A 40 -4.225 -13.137 -0.984 1.00 0.00 C ATOM 603 OD1 ASP A 40 -3.544 -12.889 -2.002 1.00 0.00 O ATOM 604 OD2 ASP A 40 -4.780 -14.236 -0.736 1.00 0.00 O ATOM 0 H ASP A 40 -3.343 -13.598 1.493 1.00 0.00 H new ATOM 0 HA ASP A 40 -2.300 -11.467 0.077 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -5.181 -12.250 0.719 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -4.727 -11.103 -0.525 1.00 0.00 H new ATOM 609 N GLY A 41 -2.575 -10.272 2.716 1.00 0.00 N ATOM 610 CA GLY A 41 -2.679 -9.156 3.659 1.00 0.00 C ATOM 611 C GLY A 41 -1.432 -8.641 4.374 1.00 0.00 C ATOM 612 O GLY A 41 -1.574 -7.835 5.291 1.00 0.00 O ATOM 0 H GLY A 41 -1.915 -10.990 3.013 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.113 -8.315 3.119 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.396 -9.446 4.427 1.00 0.00 H new ATOM 616 N LEU A 42 -0.216 -9.041 4.004 1.00 0.00 N ATOM 617 CA LEU A 42 1.000 -8.561 4.690 1.00 0.00 C ATOM 618 C LEU A 42 1.591 -7.401 3.876 1.00 0.00 C ATOM 619 O LEU A 42 2.638 -7.516 3.241 1.00 0.00 O ATOM 620 CB LEU A 42 1.981 -9.732 4.967 1.00 0.00 C ATOM 621 CG LEU A 42 1.721 -10.581 6.222 1.00 0.00 C ATOM 622 CD1 LEU A 42 1.985 -9.794 7.503 1.00 0.00 C ATOM 623 CD2 LEU A 42 0.322 -11.192 6.254 1.00 0.00 C ATOM 0 H LEU A 42 -0.039 -9.692 3.239 1.00 0.00 H new ATOM 0 HA LEU A 42 0.766 -8.168 5.680 1.00 0.00 H new ATOM 0 HB2 LEU A 42 1.970 -10.395 4.102 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.988 -9.320 5.040 1.00 0.00 H new ATOM 0 HG LEU A 42 2.431 -11.406 6.168 1.00 0.00 H new ATOM 0 HD11 LEU A 42 1.790 -10.429 8.367 1.00 0.00 H new ATOM 0 HD12 LEU A 42 3.024 -9.466 7.521 1.00 0.00 H new ATOM 0 HD13 LEU A 42 1.330 -8.924 7.537 1.00 0.00 H new ATOM 0 HD21 LEU A 42 0.202 -11.779 7.165 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -0.423 -10.397 6.234 1.00 0.00 H new ATOM 0 HD23 LEU A 42 0.187 -11.837 5.386 1.00 0.00 H new ATOM 635 N PHE A 43 0.892 -6.263 3.924 1.00 0.00 N ATOM 636 CA PHE A 43 1.207 -5.084 3.114 1.00 0.00 C ATOM 637 C PHE A 43 2.015 -3.977 3.810 1.00 0.00 C ATOM 638 O PHE A 43 2.173 -3.943 5.031 1.00 0.00 O ATOM 639 CB PHE A 43 -0.093 -4.549 2.489 1.00 0.00 C ATOM 640 CG PHE A 43 -1.036 -3.705 3.339 1.00 0.00 C ATOM 641 CD1 PHE A 43 -0.696 -2.395 3.744 1.00 0.00 C ATOM 642 CD2 PHE A 43 -2.318 -4.198 3.644 1.00 0.00 C ATOM 643 CE1 PHE A 43 -1.604 -1.609 4.477 1.00 0.00 C ATOM 644 CE2 PHE A 43 -3.238 -3.394 4.342 1.00 0.00 C ATOM 645 CZ PHE A 43 -2.880 -2.109 4.774 1.00 0.00 C ATOM 0 H PHE A 43 0.084 -6.134 4.533 1.00 0.00 H new ATOM 0 HA PHE A 43 1.896 -5.423 2.341 1.00 0.00 H new ATOM 0 HB2 PHE A 43 0.182 -3.955 1.617 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -0.659 -5.407 2.125 1.00 0.00 H new ATOM 0 HD1 PHE A 43 0.273 -1.992 3.488 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -2.597 -5.197 3.341 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -1.319 -0.622 4.810 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -4.229 -3.770 4.547 1.00 0.00 H new ATOM 0 HZ PHE A 43 -3.583 -1.508 5.332 1.00 0.00 H new ATOM 655 N LEU A 44 2.487 -3.047 2.976 1.00 0.00 N ATOM 656 CA LEU A 44 3.247 -1.830 3.316 1.00 0.00 C ATOM 657 C LEU A 44 2.740 -0.647 2.461 1.00 0.00 C ATOM 658 O LEU A 44 2.236 -0.868 1.357 1.00 0.00 O ATOM 659 CB LEU A 44 4.754 -2.140 3.114 1.00 0.00 C ATOM 660 CG LEU A 44 5.800 -1.079 3.531 1.00 0.00 C ATOM 661 CD1 LEU A 44 5.735 -0.798 5.030 1.00 0.00 C ATOM 662 CD2 LEU A 44 7.204 -1.600 3.219 1.00 0.00 C ATOM 0 H LEU A 44 2.340 -3.126 1.970 1.00 0.00 H new ATOM 0 HA LEU A 44 3.102 -1.535 4.355 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.978 -3.056 3.661 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.907 -2.355 2.056 1.00 0.00 H new ATOM 0 HG LEU A 44 5.584 -0.164 2.979 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.482 -0.049 5.292 1.00 0.00 H new ATOM 0 HD12 LEU A 44 4.743 -0.428 5.288 1.00 0.00 H new ATOM 0 HD13 LEU A 44 5.934 -1.717 5.581 1.00 0.00 H new ATOM 0 HD21 LEU A 44 7.942 -0.854 3.512 1.00 0.00 H new ATOM 0 HD22 LEU A 44 7.381 -2.522 3.772 1.00 0.00 H new ATOM 0 HD23 LEU A 44 7.290 -1.796 2.150 1.00 0.00 H new ATOM 674 N VAL A 45 2.868 0.595 2.937 1.00 0.00 N ATOM 675 CA VAL A 45 2.502 1.818 2.182 1.00 0.00 C ATOM 676 C VAL A 45 3.766 2.643 1.941 1.00 0.00 C ATOM 677 O VAL A 45 4.307 3.284 2.842 1.00 0.00 O ATOM 678 CB VAL A 45 1.401 2.631 2.893 1.00 0.00 C ATOM 679 CG1 VAL A 45 0.933 3.795 2.006 1.00 0.00 C ATOM 680 CG2 VAL A 45 0.172 1.761 3.193 1.00 0.00 C ATOM 0 H VAL A 45 3.233 0.792 3.869 1.00 0.00 H new ATOM 0 HA VAL A 45 2.076 1.531 1.220 1.00 0.00 H new ATOM 0 HB VAL A 45 1.832 3.002 3.823 1.00 0.00 H new ATOM 0 HG11 VAL A 45 0.156 4.358 2.524 1.00 0.00 H new ATOM 0 HG12 VAL A 45 1.776 4.452 1.793 1.00 0.00 H new ATOM 0 HG13 VAL A 45 0.534 3.402 1.071 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -0.586 2.363 3.694 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -0.234 1.370 2.260 1.00 0.00 H new ATOM 0 HG23 VAL A 45 0.462 0.932 3.838 1.00 0.00 H new ATOM 690 N ARG A 46 4.281 2.537 0.715 1.00 0.00 N ATOM 691 CA ARG A 46 5.542 3.131 0.239 1.00 0.00 C ATOM 692 C ARG A 46 5.366 3.618 -1.189 1.00 0.00 C ATOM 693 O ARG A 46 4.402 3.249 -1.845 1.00 0.00 O ATOM 694 CB ARG A 46 6.673 2.085 0.427 1.00 0.00 C ATOM 695 CG ARG A 46 7.175 1.318 -0.813 1.00 0.00 C ATOM 696 CD ARG A 46 6.071 0.446 -1.416 1.00 0.00 C ATOM 697 NE ARG A 46 6.304 -0.055 -2.789 1.00 0.00 N ATOM 698 CZ ARG A 46 6.590 0.551 -3.920 1.00 0.00 C ATOM 699 NH1 ARG A 46 6.976 1.784 -4.056 1.00 0.00 N ATOM 700 NH2 ARG A 46 6.411 -0.137 -4.995 1.00 0.00 N ATOM 0 H ARG A 46 3.807 2.006 -0.016 1.00 0.00 H new ATOM 0 HA ARG A 46 5.825 4.011 0.816 1.00 0.00 H new ATOM 0 HB2 ARG A 46 7.528 2.596 0.870 1.00 0.00 H new ATOM 0 HB3 ARG A 46 6.328 1.350 1.155 1.00 0.00 H new ATOM 0 HG2 ARG A 46 7.531 2.026 -1.561 1.00 0.00 H new ATOM 0 HG3 ARG A 46 8.024 0.693 -0.537 1.00 0.00 H new ATOM 0 HD2 ARG A 46 5.917 -0.412 -0.761 1.00 0.00 H new ATOM 0 HD3 ARG A 46 5.144 1.019 -1.414 1.00 0.00 H new ATOM 0 HE ARG A 46 6.228 -1.069 -2.874 1.00 0.00 H new ATOM 0 HH11 ARG A 46 7.082 2.379 -3.234 1.00 0.00 H new ATOM 0 HH12 ARG A 46 7.173 2.157 -4.985 1.00 0.00 H new ATOM 0 HH21 ARG A 46 6.066 -1.095 -4.936 1.00 0.00 H new ATOM 0 HH22 ARG A 46 6.615 0.276 -5.905 1.00 0.00 H new ATOM 714 N GLU A 47 6.278 4.439 -1.684 1.00 0.00 N ATOM 715 CA GLU A 47 6.261 4.861 -3.087 1.00 0.00 C ATOM 716 C GLU A 47 7.667 4.985 -3.694 1.00 0.00 C ATOM 717 O GLU A 47 8.624 4.349 -3.247 1.00 0.00 O ATOM 718 CB GLU A 47 5.361 6.114 -3.223 1.00 0.00 C ATOM 719 CG GLU A 47 5.796 7.332 -2.372 1.00 0.00 C ATOM 720 CD GLU A 47 4.839 7.640 -1.211 1.00 0.00 C ATOM 721 OE1 GLU A 47 4.111 6.811 -0.666 1.00 0.00 O ATOM 722 OE2 GLU A 47 4.844 8.932 -0.791 1.00 0.00 O ATOM 0 H GLU A 47 7.045 4.831 -1.137 1.00 0.00 H new ATOM 0 HA GLU A 47 5.813 4.081 -3.702 1.00 0.00 H new ATOM 0 HB2 GLU A 47 5.337 6.413 -4.271 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.342 5.842 -2.946 1.00 0.00 H new ATOM 0 HG2 GLU A 47 6.793 7.148 -1.972 1.00 0.00 H new ATOM 0 HG3 GLU A 47 5.868 8.208 -3.016 1.00 0.00 H new ATOM 730 N SER A 48 7.736 5.835 -4.701 1.00 0.00 N ATOM 731 CA SER A 48 8.838 6.331 -5.489 1.00 0.00 C ATOM 732 C SER A 48 8.884 7.850 -5.345 1.00 0.00 C ATOM 733 O SER A 48 7.867 8.542 -5.264 1.00 0.00 O ATOM 734 CB SER A 48 8.600 6.001 -6.982 1.00 0.00 C ATOM 735 OG SER A 48 7.228 6.091 -7.319 1.00 0.00 O ATOM 0 H SER A 48 6.870 6.259 -5.034 1.00 0.00 H new ATOM 0 HA SER A 48 9.767 5.873 -5.150 1.00 0.00 H new ATOM 0 HB2 SER A 48 9.175 6.687 -7.604 1.00 0.00 H new ATOM 0 HB3 SER A 48 8.964 4.996 -7.196 1.00 0.00 H new ATOM 0 HG SER A 48 6.718 5.445 -6.787 1.00 0.00 H new ATOM 741 N GLN A 49 10.106 8.360 -5.403 1.00 0.00 N ATOM 742 CA GLN A 49 10.426 9.786 -5.429 1.00 0.00 C ATOM 743 C GLN A 49 10.670 10.187 -6.917 1.00 0.00 C ATOM 744 O GLN A 49 11.086 11.304 -7.225 1.00 0.00 O ATOM 745 CB GLN A 49 11.571 10.029 -4.411 1.00 0.00 C ATOM 746 CG GLN A 49 13.030 10.009 -4.920 1.00 0.00 C ATOM 747 CD GLN A 49 13.344 9.106 -6.107 1.00 0.00 C ATOM 748 OE1 GLN A 49 13.747 9.548 -7.171 1.00 0.00 O ATOM 749 NE2 GLN A 49 13.159 7.810 -5.988 1.00 0.00 N ATOM 0 H GLN A 49 10.938 7.770 -5.435 1.00 0.00 H new ATOM 0 HA GLN A 49 9.627 10.450 -5.098 1.00 0.00 H new ATOM 0 HB2 GLN A 49 11.397 10.998 -3.942 1.00 0.00 H new ATOM 0 HB3 GLN A 49 11.483 9.276 -3.628 1.00 0.00 H new ATOM 0 HG2 GLN A 49 13.307 11.028 -5.189 1.00 0.00 H new ATOM 0 HG3 GLN A 49 13.672 9.712 -4.091 1.00 0.00 H new ATOM 0 HE21 GLN A 49 12.823 7.422 -5.107 1.00 0.00 H new ATOM 0 HE22 GLN A 49 13.352 7.193 -6.777 1.00 0.00 H new ATOM 758 N ARG A 50 10.385 9.224 -7.822 1.00 0.00 N ATOM 759 CA ARG A 50 10.584 9.202 -9.275 1.00 0.00 C ATOM 760 C ARG A 50 9.288 9.558 -10.015 1.00 0.00 C ATOM 761 O ARG A 50 9.281 10.643 -10.594 1.00 0.00 O ATOM 762 CB ARG A 50 11.211 7.851 -9.685 1.00 0.00 C ATOM 763 CG ARG A 50 11.972 7.928 -11.024 1.00 0.00 C ATOM 764 CD ARG A 50 13.481 8.158 -10.841 1.00 0.00 C ATOM 765 NE ARG A 50 13.781 9.331 -9.998 1.00 0.00 N ATOM 766 CZ ARG A 50 13.984 10.584 -10.357 1.00 0.00 C ATOM 767 NH1 ARG A 50 13.977 10.974 -11.600 1.00 0.00 N ATOM 768 NH2 ARG A 50 14.185 11.472 -9.428 1.00 0.00 N ATOM 0 H ARG A 50 9.963 8.350 -7.509 1.00 0.00 H new ATOM 0 HA ARG A 50 11.292 9.975 -9.574 1.00 0.00 H new ATOM 0 HB2 ARG A 50 11.894 7.520 -8.903 1.00 0.00 H new ATOM 0 HB3 ARG A 50 10.425 7.099 -9.761 1.00 0.00 H new ATOM 0 HG2 ARG A 50 11.815 7.003 -11.579 1.00 0.00 H new ATOM 0 HG3 ARG A 50 11.557 8.736 -11.626 1.00 0.00 H new ATOM 0 HD2 ARG A 50 13.928 7.270 -10.393 1.00 0.00 H new ATOM 0 HD3 ARG A 50 13.945 8.290 -11.818 1.00 0.00 H new ATOM 0 HE ARG A 50 13.840 9.147 -8.996 1.00 0.00 H new ATOM 0 HH11 ARG A 50 13.809 10.298 -12.346 1.00 0.00 H new ATOM 0 HH12 ARG A 50 14.139 11.955 -11.828 1.00 0.00 H new ATOM 0 HH21 ARG A 50 14.183 11.193 -8.447 1.00 0.00 H new ATOM 0 HH22 ARG A 50 14.344 12.447 -9.681 1.00 0.00 H new ATOM 782 N ASN A 51 8.198 8.755 -10.021 1.00 0.00 N ATOM 783 CA ASN A 51 6.957 9.238 -10.645 1.00 0.00 C ATOM 784 C ASN A 51 6.251 10.205 -9.653 1.00 0.00 C ATOM 785 O ASN A 51 5.863 9.755 -8.571 1.00 0.00 O ATOM 786 CB ASN A 51 6.095 8.037 -11.091 1.00 0.00 C ATOM 787 CG ASN A 51 6.836 7.037 -11.974 1.00 0.00 C ATOM 788 OD1 ASN A 51 6.682 5.835 -11.856 1.00 0.00 O ATOM 789 ND2 ASN A 51 7.683 7.468 -12.880 1.00 0.00 N ATOM 0 H ASN A 51 8.155 7.818 -9.621 1.00 0.00 H new ATOM 0 HA ASN A 51 7.155 9.807 -11.554 1.00 0.00 H new ATOM 0 HB2 ASN A 51 5.724 7.520 -10.206 1.00 0.00 H new ATOM 0 HB3 ASN A 51 5.224 8.408 -11.631 1.00 0.00 H new ATOM 0 HD21 ASN A 51 8.191 6.801 -13.462 1.00 0.00 H new ATOM 0 HD22 ASN A 51 7.833 8.469 -13.002 1.00 0.00 H new ATOM 796 N PRO A 52 6.061 11.514 -9.957 1.00 0.00 N ATOM 797 CA PRO A 52 5.618 12.511 -8.959 1.00 0.00 C ATOM 798 C PRO A 52 4.194 12.294 -8.416 1.00 0.00 C ATOM 799 O PRO A 52 3.813 12.847 -7.383 1.00 0.00 O ATOM 800 CB PRO A 52 5.723 13.875 -9.654 1.00 0.00 C ATOM 801 CG PRO A 52 6.756 13.644 -10.749 1.00 0.00 C ATOM 802 CD PRO A 52 6.450 12.214 -11.179 1.00 0.00 C ATOM 0 HA PRO A 52 6.252 12.427 -8.076 1.00 0.00 H new ATOM 0 HB2 PRO A 52 4.764 14.188 -10.068 1.00 0.00 H new ATOM 0 HB3 PRO A 52 6.041 14.654 -8.961 1.00 0.00 H new ATOM 0 HG2 PRO A 52 6.643 14.350 -11.572 1.00 0.00 H new ATOM 0 HG3 PRO A 52 7.775 13.749 -10.377 1.00 0.00 H new ATOM 0 HD2 PRO A 52 5.649 12.189 -11.918 1.00 0.00 H new ATOM 0 HD3 PRO A 52 7.321 11.747 -11.638 1.00 0.00 H new ATOM 810 N GLN A 53 3.418 11.469 -9.119 1.00 0.00 N ATOM 811 CA GLN A 53 2.052 11.055 -8.815 1.00 0.00 C ATOM 812 C GLN A 53 2.019 9.815 -7.899 1.00 0.00 C ATOM 813 O GLN A 53 0.932 9.269 -7.732 1.00 0.00 O ATOM 814 CB GLN A 53 1.336 10.795 -10.159 1.00 0.00 C ATOM 815 CG GLN A 53 1.251 12.059 -11.043 1.00 0.00 C ATOM 816 CD GLN A 53 0.637 11.817 -12.426 1.00 0.00 C ATOM 817 OE1 GLN A 53 0.389 10.702 -12.866 1.00 0.00 O ATOM 818 NE2 GLN A 53 0.378 12.866 -13.178 1.00 0.00 N ATOM 0 H GLN A 53 3.756 11.041 -9.981 1.00 0.00 H new ATOM 0 HA GLN A 53 1.537 11.841 -8.262 1.00 0.00 H new ATOM 0 HB2 GLN A 53 1.865 10.012 -10.702 1.00 0.00 H new ATOM 0 HB3 GLN A 53 0.330 10.424 -9.964 1.00 0.00 H new ATOM 0 HG2 GLN A 53 0.661 12.814 -10.523 1.00 0.00 H new ATOM 0 HG3 GLN A 53 2.253 12.469 -11.169 1.00 0.00 H new ATOM 0 HE21 GLN A 53 0.577 13.804 -12.831 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -0.022 12.741 -14.108 1.00 0.00 H new ATOM 827 N GLY A 54 3.125 9.395 -7.240 1.00 0.00 N ATOM 828 CA GLY A 54 3.127 8.128 -6.499 1.00 0.00 C ATOM 829 C GLY A 54 2.878 8.051 -4.988 1.00 0.00 C ATOM 830 O GLY A 54 3.553 8.654 -4.157 1.00 0.00 O ATOM 0 H GLY A 54 4.006 9.908 -7.210 1.00 0.00 H new ATOM 0 HA2 GLY A 54 2.378 7.491 -6.970 1.00 0.00 H new ATOM 0 HA3 GLY A 54 4.097 7.665 -6.678 1.00 0.00 H new ATOM 834 N PHE A 55 1.863 7.231 -4.709 1.00 0.00 N ATOM 835 CA PHE A 55 1.305 6.736 -3.439 1.00 0.00 C ATOM 836 C PHE A 55 0.822 5.256 -3.590 1.00 0.00 C ATOM 837 O PHE A 55 -0.358 5.030 -3.853 1.00 0.00 O ATOM 838 CB PHE A 55 0.156 7.673 -3.006 1.00 0.00 C ATOM 839 CG PHE A 55 0.517 9.148 -2.951 1.00 0.00 C ATOM 840 CD1 PHE A 55 1.153 9.683 -1.814 1.00 0.00 C ATOM 841 CD2 PHE A 55 0.245 9.980 -4.057 1.00 0.00 C ATOM 842 CE1 PHE A 55 1.519 11.042 -1.786 1.00 0.00 C ATOM 843 CE2 PHE A 55 0.624 11.335 -4.032 1.00 0.00 C ATOM 844 CZ PHE A 55 1.258 11.866 -2.895 1.00 0.00 C ATOM 0 H PHE A 55 1.331 6.838 -5.485 1.00 0.00 H new ATOM 0 HA PHE A 55 2.073 6.740 -2.666 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -0.678 7.544 -3.696 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -0.194 7.363 -2.021 1.00 0.00 H new ATOM 0 HD1 PHE A 55 1.360 9.050 -0.963 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -0.255 9.576 -4.925 1.00 0.00 H new ATOM 0 HE1 PHE A 55 2.001 11.452 -0.911 1.00 0.00 H new ATOM 0 HE2 PHE A 55 0.428 11.967 -4.886 1.00 0.00 H new ATOM 0 HZ PHE A 55 1.545 12.907 -2.873 1.00 0.00 H new ATOM 854 N VAL A 56 1.684 4.235 -3.458 1.00 0.00 N ATOM 855 CA VAL A 56 1.363 2.800 -3.697 1.00 0.00 C ATOM 856 C VAL A 56 1.053 2.029 -2.416 1.00 0.00 C ATOM 857 O VAL A 56 1.642 2.227 -1.351 1.00 0.00 O ATOM 858 CB VAL A 56 2.442 2.022 -4.566 1.00 0.00 C ATOM 859 CG1 VAL A 56 3.654 2.868 -4.981 1.00 0.00 C ATOM 860 CG2 VAL A 56 3.090 0.828 -3.844 1.00 0.00 C ATOM 0 H VAL A 56 2.653 4.379 -3.174 1.00 0.00 H new ATOM 0 HA VAL A 56 0.452 2.841 -4.293 1.00 0.00 H new ATOM 0 HB VAL A 56 1.834 1.719 -5.419 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.339 2.258 -5.570 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.318 3.716 -5.578 1.00 0.00 H new ATOM 0 HG13 VAL A 56 4.167 3.231 -4.090 1.00 0.00 H new ATOM 0 HG21 VAL A 56 3.814 0.352 -4.506 1.00 0.00 H new ATOM 0 HG22 VAL A 56 3.596 1.178 -2.944 1.00 0.00 H new ATOM 0 HG23 VAL A 56 2.320 0.107 -3.570 1.00 0.00 H new ATOM 870 N LEU A 57 0.107 1.103 -2.562 1.00 0.00 N ATOM 871 CA LEU A 57 -0.257 0.122 -1.547 1.00 0.00 C ATOM 872 C LEU A 57 0.512 -1.113 -2.043 1.00 0.00 C ATOM 873 O LEU A 57 0.371 -1.489 -3.207 1.00 0.00 O ATOM 874 CB LEU A 57 -1.788 -0.051 -1.482 1.00 0.00 C ATOM 875 CG LEU A 57 -2.331 -0.115 -0.045 1.00 0.00 C ATOM 876 CD1 LEU A 57 -3.842 -0.336 -0.079 1.00 0.00 C ATOM 877 CD2 LEU A 57 -1.696 -1.246 0.764 1.00 0.00 C ATOM 0 H LEU A 57 -0.443 1.014 -3.417 1.00 0.00 H new ATOM 0 HA LEU A 57 -0.001 0.378 -0.519 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.263 0.778 -2.006 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -2.067 -0.963 -2.010 1.00 0.00 H new ATOM 0 HG LEU A 57 -2.083 0.832 0.435 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.226 -0.381 0.940 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.318 0.488 -0.610 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -4.061 -1.273 -0.591 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -2.112 -1.250 1.772 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.905 -2.201 0.281 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.618 -1.095 0.817 1.00 0.00 H new ATOM 889 N SER A 58 1.387 -1.700 -1.230 1.00 0.00 N ATOM 890 CA SER A 58 2.263 -2.798 -1.664 1.00 0.00 C ATOM 891 C SER A 58 1.856 -3.992 -0.844 1.00 0.00 C ATOM 892 O SER A 58 2.153 -4.059 0.343 1.00 0.00 O ATOM 893 CB SER A 58 3.738 -2.405 -1.557 1.00 0.00 C ATOM 894 OG SER A 58 4.093 -1.911 -0.286 1.00 0.00 O ATOM 0 H SER A 58 1.513 -1.433 -0.254 1.00 0.00 H new ATOM 0 HA SER A 58 2.150 -3.042 -2.720 1.00 0.00 H new ATOM 0 HB2 SER A 58 4.356 -3.273 -1.787 1.00 0.00 H new ATOM 0 HB3 SER A 58 3.960 -1.647 -2.309 1.00 0.00 H new ATOM 0 HG SER A 58 3.291 -1.841 0.273 1.00 0.00 H new ATOM 900 N LEU A 59 1.152 -4.917 -1.479 1.00 0.00 N ATOM 901 CA LEU A 59 0.534 -6.051 -0.817 1.00 0.00 C ATOM 902 C LEU A 59 1.362 -7.321 -0.909 1.00 0.00 C ATOM 903 O LEU A 59 2.213 -7.466 -1.784 1.00 0.00 O ATOM 904 CB LEU A 59 -0.906 -6.151 -1.371 1.00 0.00 C ATOM 905 CG LEU A 59 -1.730 -4.897 -0.972 1.00 0.00 C ATOM 906 CD1 LEU A 59 -2.480 -4.251 -2.133 1.00 0.00 C ATOM 907 CD2 LEU A 59 -2.710 -5.207 0.153 1.00 0.00 C ATOM 0 H LEU A 59 0.993 -4.898 -2.486 1.00 0.00 H new ATOM 0 HA LEU A 59 0.485 -5.904 0.262 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -0.879 -6.245 -2.457 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.389 -7.049 -0.985 1.00 0.00 H new ATOM 0 HG LEU A 59 -0.989 -4.176 -0.629 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.031 -3.382 -1.772 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -1.768 -3.938 -2.897 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -3.178 -4.971 -2.561 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.270 -4.307 0.406 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -3.401 -5.985 -0.171 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -2.161 -5.552 1.029 1.00 0.00 H new ATOM 919 N CYS A 60 1.091 -8.231 0.024 1.00 0.00 N ATOM 920 CA CYS A 60 1.687 -9.557 0.048 1.00 0.00 C ATOM 921 C CYS A 60 0.458 -10.303 -0.369 1.00 0.00 C ATOM 922 O CYS A 60 -0.617 -10.080 0.191 1.00 0.00 O ATOM 923 CB CYS A 60 2.240 -9.943 1.414 1.00 0.00 C ATOM 924 SG CYS A 60 2.596 -11.723 1.473 1.00 0.00 S ATOM 0 H CYS A 60 0.442 -8.062 0.793 1.00 0.00 H new ATOM 0 HA CYS A 60 2.573 -9.721 -0.566 1.00 0.00 H new ATOM 0 HB2 CYS A 60 3.149 -9.377 1.619 1.00 0.00 H new ATOM 0 HB3 CYS A 60 1.521 -9.684 2.191 1.00 0.00 H new ATOM 0 HG CYS A 60 1.516 -12.371 1.795 1.00 0.00 H new ATOM 930 N HIS A 61 0.612 -11.079 -1.413 1.00 0.00 N ATOM 931 CA HIS A 61 -0.499 -11.722 -2.055 1.00 0.00 C ATOM 932 C HIS A 61 -0.448 -13.246 -1.876 1.00 0.00 C ATOM 933 O HIS A 61 0.043 -13.738 -0.860 1.00 0.00 O ATOM 934 CB HIS A 61 -0.503 -11.029 -3.435 1.00 0.00 C ATOM 935 CG HIS A 61 -0.634 -11.783 -4.728 1.00 0.00 C ATOM 936 ND1 HIS A 61 0.283 -12.712 -5.227 1.00 0.00 N ATOM 937 CD2 HIS A 61 -1.609 -11.578 -5.656 1.00 0.00 C ATOM 938 CE1 HIS A 61 -0.186 -13.068 -6.434 1.00 0.00 C ATOM 939 NE2 HIS A 61 -1.328 -12.418 -6.708 1.00 0.00 N ATOM 0 H HIS A 61 1.516 -11.281 -1.840 1.00 0.00 H new ATOM 0 HA HIS A 61 -1.502 -11.603 -1.644 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -1.317 -10.305 -3.415 1.00 0.00 H new ATOM 0 HB3 HIS A 61 0.426 -10.463 -3.500 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -2.439 -10.891 -5.581 1.00 0.00 H new ATOM 0 HE1 HIS A 61 0.290 -13.779 -7.093 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -1.891 -12.528 -7.552 1.00 0.00 H new ATOM 947 N LEU A 62 -0.908 -13.988 -2.871 1.00 0.00 N ATOM 948 CA LEU A 62 -1.032 -15.463 -2.834 1.00 0.00 C ATOM 949 C LEU A 62 0.118 -16.200 -3.437 1.00 0.00 C ATOM 950 O LEU A 62 0.203 -17.425 -3.299 1.00 0.00 O ATOM 951 CB LEU A 62 -2.437 -15.914 -3.292 1.00 0.00 C ATOM 952 CG LEU A 62 -2.899 -17.334 -2.909 1.00 0.00 C ATOM 953 CD1 LEU A 62 -3.123 -17.493 -1.403 1.00 0.00 C ATOM 954 CD2 LEU A 62 -4.225 -17.630 -3.609 1.00 0.00 C ATOM 0 H LEU A 62 -1.217 -13.585 -3.755 1.00 0.00 H new ATOM 0 HA LEU A 62 -0.952 -15.766 -1.790 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -3.163 -15.207 -2.891 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -2.478 -15.831 -4.378 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.111 -18.022 -3.215 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -3.447 -18.511 -1.189 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -2.192 -17.290 -0.873 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.889 -16.791 -1.073 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -4.560 -18.633 -3.344 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -4.973 -16.902 -3.294 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -4.089 -17.566 -4.689 1.00 0.00 H new ATOM 966 N GLN A 63 1.025 -15.455 -4.054 1.00 0.00 N ATOM 967 CA GLN A 63 2.255 -16.079 -4.456 1.00 0.00 C ATOM 968 C GLN A 63 3.469 -15.147 -4.503 1.00 0.00 C ATOM 969 O GLN A 63 4.606 -15.631 -4.494 1.00 0.00 O ATOM 970 CB GLN A 63 2.135 -16.971 -5.712 1.00 0.00 C ATOM 971 CG GLN A 63 1.564 -16.226 -6.928 1.00 0.00 C ATOM 972 CD GLN A 63 1.731 -17.021 -8.223 1.00 0.00 C ATOM 973 OE1 GLN A 63 2.555 -16.704 -9.072 1.00 0.00 O ATOM 974 NE2 GLN A 63 0.964 -18.072 -8.432 1.00 0.00 N ATOM 0 H GLN A 63 0.932 -14.464 -4.275 1.00 0.00 H new ATOM 0 HA GLN A 63 2.461 -16.761 -3.631 1.00 0.00 H new ATOM 0 HB2 GLN A 63 3.119 -17.366 -5.965 1.00 0.00 H new ATOM 0 HB3 GLN A 63 1.497 -17.825 -5.484 1.00 0.00 H new ATOM 0 HG2 GLN A 63 0.506 -16.022 -6.763 1.00 0.00 H new ATOM 0 HG3 GLN A 63 2.063 -15.262 -7.029 1.00 0.00 H new ATOM 0 HE21 GLN A 63 0.274 -18.347 -7.733 1.00 0.00 H new ATOM 0 HE22 GLN A 63 1.061 -18.611 -9.293 1.00 0.00 H new ATOM 983 N LYS A 64 3.243 -13.827 -4.538 1.00 0.00 N ATOM 984 CA LYS A 64 4.310 -12.817 -4.524 1.00 0.00 C ATOM 985 C LYS A 64 3.849 -11.509 -3.861 1.00 0.00 C ATOM 986 O LYS A 64 2.879 -11.505 -3.107 1.00 0.00 O ATOM 987 CB LYS A 64 4.798 -12.640 -5.982 1.00 0.00 C ATOM 988 CG LYS A 64 3.741 -12.005 -6.912 1.00 0.00 C ATOM 989 CD LYS A 64 4.052 -12.229 -8.402 1.00 0.00 C ATOM 990 CE LYS A 64 3.827 -13.690 -8.829 1.00 0.00 C ATOM 991 NZ LYS A 64 4.170 -13.915 -10.261 1.00 0.00 N ATOM 0 H LYS A 64 2.306 -13.426 -4.577 1.00 0.00 H new ATOM 0 HA LYS A 64 5.149 -13.145 -3.910 1.00 0.00 H new ATOM 0 HB2 LYS A 64 5.693 -12.018 -5.984 1.00 0.00 H new ATOM 0 HB3 LYS A 64 5.085 -13.613 -6.382 1.00 0.00 H new ATOM 0 HG2 LYS A 64 2.762 -12.424 -6.682 1.00 0.00 H new ATOM 0 HG3 LYS A 64 3.684 -10.935 -6.714 1.00 0.00 H new ATOM 0 HD2 LYS A 64 3.422 -11.575 -9.005 1.00 0.00 H new ATOM 0 HD3 LYS A 64 5.086 -11.949 -8.602 1.00 0.00 H new ATOM 0 HE2 LYS A 64 4.432 -14.347 -8.204 1.00 0.00 H new ATOM 0 HE3 LYS A 64 2.785 -13.960 -8.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 4.003 -14.912 -10.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 3.575 -13.308 -10.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 5.171 -13.683 -10.419 1.00 0.00 H new ATOM 1005 N VAL A 65 4.545 -10.399 -4.127 1.00 0.00 N ATOM 1006 CA VAL A 65 4.169 -9.042 -3.680 1.00 0.00 C ATOM 1007 C VAL A 65 3.842 -8.178 -4.900 1.00 0.00 C ATOM 1008 O VAL A 65 4.496 -8.303 -5.937 1.00 0.00 O ATOM 1009 CB VAL A 65 5.228 -8.390 -2.767 1.00 0.00 C ATOM 1010 CG1 VAL A 65 5.356 -9.161 -1.452 1.00 0.00 C ATOM 1011 CG2 VAL A 65 6.599 -8.279 -3.424 1.00 0.00 C ATOM 0 H VAL A 65 5.407 -10.413 -4.672 1.00 0.00 H new ATOM 0 HA VAL A 65 3.278 -9.126 -3.058 1.00 0.00 H new ATOM 0 HB VAL A 65 4.876 -7.377 -2.573 1.00 0.00 H new ATOM 0 HG11 VAL A 65 6.108 -8.685 -0.823 1.00 0.00 H new ATOM 0 HG12 VAL A 65 4.397 -9.160 -0.935 1.00 0.00 H new ATOM 0 HG13 VAL A 65 5.655 -10.188 -1.660 1.00 0.00 H new ATOM 0 HG21 VAL A 65 7.298 -7.812 -2.730 1.00 0.00 H new ATOM 0 HG22 VAL A 65 6.958 -9.274 -3.687 1.00 0.00 H new ATOM 0 HG23 VAL A 65 6.522 -7.671 -4.326 1.00 0.00 H new ATOM 1021 N LYS A 66 2.826 -7.314 -4.793 1.00 0.00 N ATOM 1022 CA LYS A 66 2.322 -6.496 -5.918 1.00 0.00 C ATOM 1023 C LYS A 66 2.018 -5.062 -5.473 1.00 0.00 C ATOM 1024 O LYS A 66 1.647 -4.847 -4.322 1.00 0.00 O ATOM 1025 CB LYS A 66 1.124 -7.226 -6.565 1.00 0.00 C ATOM 1026 CG LYS A 66 1.107 -7.015 -8.086 1.00 0.00 C ATOM 1027 CD LYS A 66 -0.009 -7.794 -8.800 1.00 0.00 C ATOM 1028 CE LYS A 66 0.225 -9.314 -8.771 1.00 0.00 C ATOM 1029 NZ LYS A 66 -0.720 -10.031 -9.677 1.00 0.00 N ATOM 0 H LYS A 66 2.322 -7.157 -3.920 1.00 0.00 H new ATOM 0 HA LYS A 66 3.090 -6.388 -6.684 1.00 0.00 H new ATOM 0 HB2 LYS A 66 1.180 -8.292 -6.343 1.00 0.00 H new ATOM 0 HB3 LYS A 66 0.193 -6.859 -6.133 1.00 0.00 H new ATOM 0 HG2 LYS A 66 0.989 -5.952 -8.296 1.00 0.00 H new ATOM 0 HG3 LYS A 66 2.070 -7.316 -8.498 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -0.965 -7.567 -8.328 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -0.077 -7.459 -9.835 1.00 0.00 H new ATOM 0 HE2 LYS A 66 1.251 -9.531 -9.069 1.00 0.00 H new ATOM 0 HE3 LYS A 66 0.104 -9.682 -7.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -0.535 -11.053 -9.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -1.698 -9.843 -9.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -0.587 -9.697 -10.653 1.00 0.00 H new ATOM 1043 N HIS A 67 2.151 -4.098 -6.388 1.00 0.00 N ATOM 1044 CA HIS A 67 2.028 -2.655 -6.097 1.00 0.00 C ATOM 1045 C HIS A 67 0.814 -2.002 -6.751 1.00 0.00 C ATOM 1046 O HIS A 67 0.477 -2.256 -7.901 1.00 0.00 O ATOM 1047 CB HIS A 67 3.346 -1.972 -6.450 1.00 0.00 C ATOM 1048 CG HIS A 67 4.514 -2.687 -5.815 1.00 0.00 C ATOM 1049 ND1 HIS A 67 4.907 -2.559 -4.480 1.00 0.00 N ATOM 1050 CD2 HIS A 67 5.249 -3.676 -6.394 1.00 0.00 C ATOM 1051 CE1 HIS A 67 5.868 -3.478 -4.288 1.00 0.00 C ATOM 1052 NE2 HIS A 67 6.108 -4.144 -5.426 1.00 0.00 N ATOM 0 H HIS A 67 2.350 -4.294 -7.369 1.00 0.00 H new ATOM 0 HA HIS A 67 1.840 -2.529 -5.031 1.00 0.00 H new ATOM 0 HB2 HIS A 67 3.471 -1.954 -7.533 1.00 0.00 H new ATOM 0 HB3 HIS A 67 3.324 -0.935 -6.114 1.00 0.00 H new ATOM 0 HD2 HIS A 67 5.173 -4.025 -7.413 1.00 0.00 H new ATOM 0 HE1 HIS A 67 6.375 -3.655 -3.351 1.00 0.00 H new ATOM 0 HE2 HIS A 67 6.809 -4.874 -5.553 1.00 0.00 H new ATOM 1060 N TYR A 68 0.227 -1.050 -6.035 1.00 0.00 N ATOM 1061 CA TYR A 68 -1.045 -0.392 -6.374 1.00 0.00 C ATOM 1062 C TYR A 68 -1.006 1.153 -6.414 1.00 0.00 C ATOM 1063 O TYR A 68 -1.551 1.802 -5.529 1.00 0.00 O ATOM 1064 CB TYR A 68 -2.016 -0.975 -5.312 1.00 0.00 C ATOM 1065 CG TYR A 68 -3.518 -1.045 -5.519 1.00 0.00 C ATOM 1066 CD1 TYR A 68 -4.155 -0.781 -6.750 1.00 0.00 C ATOM 1067 CD2 TYR A 68 -4.281 -1.502 -4.427 1.00 0.00 C ATOM 1068 CE1 TYR A 68 -5.548 -0.989 -6.876 1.00 0.00 C ATOM 1069 CE2 TYR A 68 -5.663 -1.706 -4.548 1.00 0.00 C ATOM 1070 CZ TYR A 68 -6.303 -1.458 -5.773 1.00 0.00 C ATOM 1071 OH TYR A 68 -7.642 -1.672 -5.867 1.00 0.00 O ATOM 0 H TYR A 68 0.633 -0.697 -5.169 1.00 0.00 H new ATOM 0 HA TYR A 68 -1.350 -0.596 -7.400 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -1.683 -1.994 -5.113 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -1.855 -0.403 -4.398 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -3.582 -0.422 -7.592 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -3.795 -1.698 -3.483 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -6.038 -0.789 -7.817 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -6.235 -2.053 -3.700 1.00 0.00 H new ATOM 0 HH TYR A 68 -7.953 -1.412 -6.759 1.00 0.00 H new ATOM 1081 N LEU A 69 -0.324 1.767 -7.395 1.00 0.00 N ATOM 1082 CA LEU A 69 -0.304 3.225 -7.620 1.00 0.00 C ATOM 1083 C LEU A 69 -0.305 3.573 -9.109 1.00 0.00 C ATOM 1084 O LEU A 69 0.621 3.120 -9.755 1.00 0.00 O ATOM 1085 CB LEU A 69 0.999 3.771 -7.051 1.00 0.00 C ATOM 1086 CG LEU A 69 1.343 5.238 -7.326 1.00 0.00 C ATOM 1087 CD1 LEU A 69 2.011 5.483 -8.682 1.00 0.00 C ATOM 1088 CD2 LEU A 69 0.100 6.118 -7.121 1.00 0.00 C ATOM 0 H LEU A 69 0.242 1.253 -8.070 1.00 0.00 H new ATOM 0 HA LEU A 69 -1.191 3.649 -7.148 1.00 0.00 H new ATOM 0 HB2 LEU A 69 0.977 3.630 -5.970 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.814 3.159 -7.436 1.00 0.00 H new ATOM 0 HG LEU A 69 2.102 5.524 -6.598 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.221 6.546 -8.797 1.00 0.00 H new ATOM 0 HD12 LEU A 69 2.943 4.921 -8.735 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.345 5.156 -9.480 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.355 7.159 -7.319 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.687 5.801 -7.805 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.250 6.019 -6.094 1.00 0.00 H new ATOM 1100 N ILE A 70 -1.243 4.352 -9.675 1.00 0.00 N ATOM 1101 CA ILE A 70 -1.119 4.785 -11.099 1.00 0.00 C ATOM 1102 C ILE A 70 -1.536 6.245 -11.318 1.00 0.00 C ATOM 1103 O ILE A 70 -0.822 6.938 -12.046 1.00 0.00 O ATOM 1104 CB ILE A 70 -1.747 3.808 -12.135 1.00 0.00 C ATOM 1105 CG1 ILE A 70 -1.093 2.437 -11.908 1.00 0.00 C ATOM 1106 CG2 ILE A 70 -1.472 4.210 -13.595 1.00 0.00 C ATOM 1107 CD1 ILE A 70 -1.354 1.211 -12.760 1.00 0.00 C ATOM 0 H ILE A 70 -2.076 4.692 -9.195 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.049 4.737 -11.304 1.00 0.00 H new ATOM 0 HB ILE A 70 -2.827 3.812 -11.990 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -0.017 2.606 -11.944 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -1.337 2.151 -10.885 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.937 3.487 -14.265 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -1.887 5.200 -13.784 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.396 4.228 -13.771 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -0.765 0.375 -12.384 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.413 0.957 -12.717 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.072 1.419 -13.792 1.00 0.00 H new ATOM 1119 N LEU A 71 -2.623 6.744 -10.695 1.00 0.00 N ATOM 1120 CA LEU A 71 -3.095 8.120 -10.986 1.00 0.00 C ATOM 1121 C LEU A 71 -3.353 8.981 -9.726 1.00 0.00 C ATOM 1122 O LEU A 71 -3.733 8.443 -8.681 1.00 0.00 O ATOM 1123 CB LEU A 71 -4.302 8.116 -11.973 1.00 0.00 C ATOM 1124 CG LEU A 71 -4.402 6.942 -12.981 1.00 0.00 C ATOM 1125 CD1 LEU A 71 -5.111 5.720 -12.387 1.00 0.00 C ATOM 1126 CD2 LEU A 71 -5.200 7.289 -14.238 1.00 0.00 C ATOM 0 H LEU A 71 -3.179 6.236 -10.007 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.266 8.618 -11.488 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.218 8.131 -11.383 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -4.274 9.045 -12.542 1.00 0.00 H new ATOM 0 HG LEU A 71 -3.361 6.731 -13.225 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.155 4.926 -13.133 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -4.560 5.368 -11.515 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.123 5.995 -12.090 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.231 6.424 -14.900 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.216 7.568 -13.959 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -4.723 8.123 -14.753 1.00 0.00 H new ATOM 1138 N PRO A 72 -3.157 10.316 -9.808 1.00 0.00 N ATOM 1139 CA PRO A 72 -3.399 11.252 -8.708 1.00 0.00 C ATOM 1140 C PRO A 72 -4.889 11.616 -8.599 1.00 0.00 C ATOM 1141 O PRO A 72 -5.717 11.167 -9.400 1.00 0.00 O ATOM 1142 CB PRO A 72 -2.524 12.465 -9.049 1.00 0.00 C ATOM 1143 CG PRO A 72 -2.639 12.532 -10.569 1.00 0.00 C ATOM 1144 CD PRO A 72 -2.663 11.057 -10.967 1.00 0.00 C ATOM 0 HA PRO A 72 -3.147 10.833 -7.734 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -2.888 13.376 -8.573 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -1.493 12.326 -8.725 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -3.544 13.052 -10.885 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -1.796 13.059 -11.016 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -3.309 10.900 -11.831 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -1.667 10.716 -11.248 1.00 0.00 H new ATOM 1152 N SER A 73 -5.238 12.458 -7.625 1.00 0.00 N ATOM 1153 CA SER A 73 -6.624 12.874 -7.362 1.00 0.00 C ATOM 1154 C SER A 73 -7.312 13.569 -8.547 1.00 0.00 C ATOM 1155 O SER A 73 -6.709 14.374 -9.258 1.00 0.00 O ATOM 1156 CB SER A 73 -6.694 13.728 -6.094 1.00 0.00 C ATOM 1157 OG SER A 73 -6.231 12.979 -4.987 1.00 0.00 O ATOM 0 H SER A 73 -4.561 12.877 -6.987 1.00 0.00 H new ATOM 0 HA SER A 73 -7.191 11.956 -7.209 1.00 0.00 H new ATOM 0 HB2 SER A 73 -6.089 14.627 -6.216 1.00 0.00 H new ATOM 0 HB3 SER A 73 -7.719 14.055 -5.921 1.00 0.00 H new ATOM 0 HG SER A 73 -6.276 13.530 -4.178 1.00 0.00 H new ATOM 1163 N GLU A 74 -8.593 13.234 -8.751 1.00 0.00 N ATOM 1164 CA GLU A 74 -9.438 13.674 -9.876 1.00 0.00 C ATOM 1165 C GLU A 74 -10.690 14.435 -9.377 1.00 0.00 C ATOM 1166 O GLU A 74 -10.785 14.777 -8.199 1.00 0.00 O ATOM 1167 CB GLU A 74 -9.804 12.429 -10.719 1.00 0.00 C ATOM 1168 CG GLU A 74 -8.605 11.589 -11.204 1.00 0.00 C ATOM 1169 CD GLU A 74 -7.627 12.361 -12.095 1.00 0.00 C ATOM 1170 OE1 GLU A 74 -7.968 13.075 -13.038 1.00 0.00 O ATOM 1171 OE2 GLU A 74 -6.310 12.202 -11.799 1.00 0.00 O ATOM 0 H GLU A 74 -9.094 12.621 -8.108 1.00 0.00 H new ATOM 0 HA GLU A 74 -8.892 14.381 -10.501 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -10.460 11.790 -10.128 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -10.375 12.754 -11.589 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -8.067 11.207 -10.337 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -8.978 10.725 -11.754 1.00 0.00 H new ATOM 1179 N GLU A 75 -11.675 14.676 -10.250 1.00 0.00 N ATOM 1180 CA GLU A 75 -12.899 15.442 -9.923 1.00 0.00 C ATOM 1181 C GLU A 75 -14.121 14.558 -9.585 1.00 0.00 C ATOM 1182 O GLU A 75 -15.141 15.063 -9.114 1.00 0.00 O ATOM 1183 CB GLU A 75 -13.204 16.434 -11.061 1.00 0.00 C ATOM 1184 CG GLU A 75 -13.599 15.765 -12.387 1.00 0.00 C ATOM 1185 CD GLU A 75 -13.883 16.823 -13.469 1.00 0.00 C ATOM 1186 OE1 GLU A 75 -15.048 17.283 -13.588 1.00 0.00 O ATOM 1187 OE2 GLU A 75 -12.947 17.203 -14.216 1.00 0.00 O ATOM 0 H GLU A 75 -11.651 14.345 -11.214 1.00 0.00 H new ATOM 0 HA GLU A 75 -12.698 15.994 -9.005 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -14.011 17.095 -10.746 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -12.327 17.059 -11.229 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -12.798 15.104 -12.719 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -14.483 15.145 -12.238 1.00 0.00 H new ATOM 1194 N GLU A 76 -14.010 13.237 -9.776 1.00 0.00 N ATOM 1195 CA GLU A 76 -15.021 12.224 -9.414 1.00 0.00 C ATOM 1196 C GLU A 76 -14.470 11.141 -8.453 1.00 0.00 C ATOM 1197 O GLU A 76 -15.012 10.038 -8.343 1.00 0.00 O ATOM 1198 CB GLU A 76 -15.682 11.649 -10.684 1.00 0.00 C ATOM 1199 CG GLU A 76 -14.707 10.938 -11.632 1.00 0.00 C ATOM 1200 CD GLU A 76 -15.479 10.176 -12.724 1.00 0.00 C ATOM 1201 OE1 GLU A 76 -15.766 10.760 -13.798 1.00 0.00 O ATOM 1202 OE2 GLU A 76 -15.794 8.978 -12.513 1.00 0.00 O ATOM 0 H GLU A 76 -13.181 12.824 -10.204 1.00 0.00 H new ATOM 0 HA GLU A 76 -15.805 12.718 -8.840 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -16.461 10.947 -10.388 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -16.171 12.459 -11.224 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -14.040 11.667 -12.091 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -14.082 10.245 -11.069 1.00 0.00 H new ATOM 1209 N GLY A 77 -13.374 11.459 -7.757 1.00 0.00 N ATOM 1210 CA GLY A 77 -12.663 10.592 -6.810 1.00 0.00 C ATOM 1211 C GLY A 77 -11.508 11.334 -6.133 1.00 0.00 C ATOM 1212 O GLY A 77 -11.368 12.549 -6.285 1.00 0.00 O ATOM 0 H GLY A 77 -12.935 12.376 -7.843 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -13.359 10.230 -6.053 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -12.278 9.717 -7.334 1.00 0.00 H new ATOM 1216 N ARG A 78 -10.665 10.625 -5.377 1.00 0.00 N ATOM 1217 CA ARG A 78 -9.435 11.165 -4.742 1.00 0.00 C ATOM 1218 C ARG A 78 -8.239 10.348 -5.248 1.00 0.00 C ATOM 1219 O ARG A 78 -8.218 10.066 -6.446 1.00 0.00 O ATOM 1220 CB ARG A 78 -9.585 11.233 -3.207 1.00 0.00 C ATOM 1221 CG ARG A 78 -10.836 11.954 -2.667 1.00 0.00 C ATOM 1222 CD ARG A 78 -10.731 13.488 -2.653 1.00 0.00 C ATOM 1223 NE ARG A 78 -10.755 14.092 -4.001 1.00 0.00 N ATOM 1224 CZ ARG A 78 -10.473 15.344 -4.313 1.00 0.00 C ATOM 1225 NH1 ARG A 78 -10.138 16.222 -3.410 1.00 0.00 N ATOM 1226 NH2 ARG A 78 -10.518 15.745 -5.551 1.00 0.00 N ATOM 0 H ARG A 78 -10.812 9.635 -5.178 1.00 0.00 H new ATOM 0 HA ARG A 78 -9.258 12.201 -5.030 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -9.585 10.214 -2.819 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -8.704 11.729 -2.800 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -11.695 11.667 -3.273 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -11.031 11.606 -1.652 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -11.554 13.895 -2.066 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -9.808 13.777 -2.150 1.00 0.00 H new ATOM 0 HE ARG A 78 -11.017 13.477 -4.772 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -10.087 15.950 -2.428 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -9.926 17.181 -3.685 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -10.773 15.090 -6.290 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -10.298 16.714 -5.781 1.00 0.00 H new ATOM 1240 N LEU A 79 -7.267 9.971 -4.400 1.00 0.00 N ATOM 1241 CA LEU A 79 -6.094 9.173 -4.812 1.00 0.00 C ATOM 1242 C LEU A 79 -6.607 7.976 -5.637 1.00 0.00 C ATOM 1243 O LEU A 79 -7.427 7.214 -5.133 1.00 0.00 O ATOM 1244 CB LEU A 79 -5.285 8.669 -3.598 1.00 0.00 C ATOM 1245 CG LEU A 79 -4.319 9.681 -2.952 1.00 0.00 C ATOM 1246 CD1 LEU A 79 -5.032 10.808 -2.200 1.00 0.00 C ATOM 1247 CD2 LEU A 79 -3.423 8.954 -1.948 1.00 0.00 C ATOM 0 H LEU A 79 -7.270 10.210 -3.408 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.424 9.799 -5.402 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -5.987 8.332 -2.835 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.709 7.797 -3.909 1.00 0.00 H new ATOM 0 HG LEU A 79 -3.751 10.125 -3.769 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -4.292 11.484 -1.770 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -5.670 11.360 -2.891 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -5.642 10.384 -1.403 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -2.738 9.667 -1.489 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -4.040 8.495 -1.176 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.851 8.182 -2.463 1.00 0.00 H new ATOM 1259 N TYR A 80 -6.151 7.794 -6.879 1.00 0.00 N ATOM 1260 CA TYR A 80 -6.719 6.769 -7.763 1.00 0.00 C ATOM 1261 C TYR A 80 -6.251 5.319 -7.557 1.00 0.00 C ATOM 1262 O TYR A 80 -5.059 5.039 -7.411 1.00 0.00 O ATOM 1263 CB TYR A 80 -6.627 7.215 -9.222 1.00 0.00 C ATOM 1264 CG TYR A 80 -7.950 7.155 -9.955 1.00 0.00 C ATOM 1265 CD1 TYR A 80 -8.835 8.247 -9.875 1.00 0.00 C ATOM 1266 CD2 TYR A 80 -8.296 6.024 -10.715 1.00 0.00 C ATOM 1267 CE1 TYR A 80 -10.041 8.236 -10.604 1.00 0.00 C ATOM 1268 CE2 TYR A 80 -9.486 6.019 -11.466 1.00 0.00 C ATOM 1269 CZ TYR A 80 -10.354 7.131 -11.423 1.00 0.00 C ATOM 1270 OH TYR A 80 -11.507 7.121 -12.142 1.00 0.00 O ATOM 0 H TYR A 80 -5.395 8.338 -7.295 1.00 0.00 H new ATOM 0 HA TYR A 80 -7.764 6.704 -7.459 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.246 8.236 -9.259 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -5.904 6.586 -9.741 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -8.589 9.095 -9.253 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -7.649 5.159 -10.722 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -10.723 9.071 -10.536 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -9.735 5.163 -12.076 1.00 0.00 H new ATOM 0 HH TYR A 80 -11.567 6.287 -12.653 1.00 0.00 H new ATOM 1280 N PHE A 81 -7.228 4.399 -7.613 1.00 0.00 N ATOM 1281 CA PHE A 81 -7.059 2.943 -7.561 1.00 0.00 C ATOM 1282 C PHE A 81 -8.104 2.216 -8.429 1.00 0.00 C ATOM 1283 O PHE A 81 -9.292 2.502 -8.271 1.00 0.00 O ATOM 1284 CB PHE A 81 -6.925 2.347 -6.147 1.00 0.00 C ATOM 1285 CG PHE A 81 -6.018 3.051 -5.140 1.00 0.00 C ATOM 1286 CD1 PHE A 81 -6.467 4.196 -4.453 1.00 0.00 C ATOM 1287 CD2 PHE A 81 -4.747 2.529 -4.830 1.00 0.00 C ATOM 1288 CE1 PHE A 81 -5.662 4.820 -3.485 1.00 0.00 C ATOM 1289 CE2 PHE A 81 -3.938 3.150 -3.858 1.00 0.00 C ATOM 1290 CZ PHE A 81 -4.392 4.297 -3.188 1.00 0.00 C ATOM 0 H PHE A 81 -8.208 4.668 -7.700 1.00 0.00 H new ATOM 0 HA PHE A 81 -6.080 2.757 -8.003 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -7.924 2.296 -5.713 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -6.570 1.322 -6.252 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -7.444 4.600 -4.674 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -4.390 1.647 -5.341 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -6.019 5.700 -2.970 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -2.965 2.742 -3.627 1.00 0.00 H new ATOM 0 HZ PHE A 81 -3.768 4.775 -2.448 1.00 0.00 H new ATOM 1300 N SER A 82 -7.699 1.267 -9.297 1.00 0.00 N ATOM 1301 CA SER A 82 -8.625 0.621 -10.273 1.00 0.00 C ATOM 1302 C SER A 82 -8.530 -0.889 -10.614 1.00 0.00 C ATOM 1303 O SER A 82 -9.297 -1.300 -11.484 1.00 0.00 O ATOM 1304 CB SER A 82 -8.591 1.398 -11.598 1.00 0.00 C ATOM 1305 OG SER A 82 -8.758 2.788 -11.396 1.00 0.00 O ATOM 0 H SER A 82 -6.739 0.925 -9.349 1.00 0.00 H new ATOM 0 HA SER A 82 -9.555 0.667 -9.707 1.00 0.00 H new ATOM 0 HB2 SER A 82 -7.642 1.215 -12.102 1.00 0.00 H new ATOM 0 HB3 SER A 82 -9.378 1.029 -12.256 1.00 0.00 H new ATOM 0 HG SER A 82 -8.730 3.250 -12.260 1.00 0.00 H new ATOM 1311 N MET A 83 -7.623 -1.705 -10.037 1.00 0.00 N ATOM 1312 CA MET A 83 -7.576 -3.183 -10.240 1.00 0.00 C ATOM 1313 C MET A 83 -8.897 -3.930 -10.528 1.00 0.00 C ATOM 1314 O MET A 83 -9.977 -3.556 -10.069 1.00 0.00 O ATOM 1315 CB MET A 83 -6.882 -3.872 -9.050 1.00 0.00 C ATOM 1316 CG MET A 83 -7.739 -4.429 -7.911 1.00 0.00 C ATOM 1317 SD MET A 83 -6.780 -5.279 -6.629 1.00 0.00 S ATOM 1318 CE MET A 83 -8.083 -5.596 -5.406 1.00 0.00 C ATOM 0 H MET A 83 -6.894 -1.362 -9.411 1.00 0.00 H new ATOM 0 HA MET A 83 -7.014 -3.259 -11.171 1.00 0.00 H new ATOM 0 HB2 MET A 83 -6.288 -4.695 -9.447 1.00 0.00 H new ATOM 0 HB3 MET A 83 -6.184 -3.156 -8.616 1.00 0.00 H new ATOM 0 HG2 MET A 83 -8.296 -3.611 -7.454 1.00 0.00 H new ATOM 0 HG3 MET A 83 -8.472 -5.122 -8.324 1.00 0.00 H new ATOM 0 HE1 MET A 83 -7.721 -6.308 -4.664 1.00 0.00 H new ATOM 0 HE2 MET A 83 -8.353 -4.663 -4.912 1.00 0.00 H new ATOM 0 HE3 MET A 83 -8.959 -6.008 -5.906 1.00 0.00 H new ATOM 1328 N ASP A 84 -8.770 -5.094 -11.171 1.00 0.00 N ATOM 1329 CA ASP A 84 -9.897 -5.920 -11.654 1.00 0.00 C ATOM 1330 C ASP A 84 -11.011 -6.242 -10.630 1.00 0.00 C ATOM 1331 O ASP A 84 -12.175 -6.357 -11.020 1.00 0.00 O ATOM 1332 CB ASP A 84 -9.357 -7.225 -12.256 1.00 0.00 C ATOM 1333 CG ASP A 84 -8.491 -6.972 -13.501 1.00 0.00 C ATOM 1334 OD1 ASP A 84 -7.261 -6.782 -13.357 1.00 0.00 O ATOM 1335 OD2 ASP A 84 -9.045 -6.960 -14.629 1.00 0.00 O ATOM 0 H ASP A 84 -7.860 -5.505 -11.379 1.00 0.00 H new ATOM 0 HA ASP A 84 -10.389 -5.296 -12.400 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -8.768 -7.753 -11.506 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -10.192 -7.874 -12.521 1.00 0.00 H new ATOM 1340 N ASP A 85 -10.685 -6.353 -9.335 1.00 0.00 N ATOM 1341 CA ASP A 85 -11.656 -6.551 -8.239 1.00 0.00 C ATOM 1342 C ASP A 85 -11.721 -5.374 -7.229 1.00 0.00 C ATOM 1343 O ASP A 85 -12.442 -5.445 -6.232 1.00 0.00 O ATOM 1344 CB ASP A 85 -11.346 -7.898 -7.564 1.00 0.00 C ATOM 1345 CG ASP A 85 -12.474 -8.383 -6.635 1.00 0.00 C ATOM 1346 OD1 ASP A 85 -13.629 -8.533 -7.109 1.00 0.00 O ATOM 1347 OD2 ASP A 85 -12.202 -8.670 -5.445 1.00 0.00 O ATOM 0 H ASP A 85 -9.720 -6.307 -9.009 1.00 0.00 H new ATOM 0 HA ASP A 85 -12.659 -6.571 -8.666 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -11.168 -8.650 -8.333 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -10.425 -7.806 -6.989 1.00 0.00 H new ATOM 1352 N GLY A 86 -10.954 -4.296 -7.452 1.00 0.00 N ATOM 1353 CA GLY A 86 -10.828 -3.143 -6.548 1.00 0.00 C ATOM 1354 C GLY A 86 -10.732 -1.785 -7.250 1.00 0.00 C ATOM 1355 O GLY A 86 -9.666 -1.384 -7.717 1.00 0.00 O ATOM 0 H GLY A 86 -10.386 -4.200 -8.294 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -11.687 -3.130 -5.877 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -9.942 -3.280 -5.929 1.00 0.00 H new ATOM 1359 N GLN A 87 -11.816 -1.015 -7.209 1.00 0.00 N ATOM 1360 CA GLN A 87 -11.919 0.363 -7.718 1.00 0.00 C ATOM 1361 C GLN A 87 -11.771 1.355 -6.551 1.00 0.00 C ATOM 1362 O GLN A 87 -12.628 2.208 -6.321 1.00 0.00 O ATOM 1363 CB GLN A 87 -13.241 0.520 -8.497 1.00 0.00 C ATOM 1364 CG GLN A 87 -14.494 0.162 -7.665 1.00 0.00 C ATOM 1365 CD GLN A 87 -15.589 1.211 -7.824 1.00 0.00 C ATOM 1366 OE1 GLN A 87 -16.627 0.996 -8.437 1.00 0.00 O ATOM 1367 NE2 GLN A 87 -15.382 2.394 -7.283 1.00 0.00 N ATOM 0 H GLN A 87 -12.692 -1.344 -6.802 1.00 0.00 H new ATOM 0 HA GLN A 87 -11.113 0.584 -8.417 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -13.328 1.549 -8.845 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -13.209 -0.115 -9.383 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -14.873 -0.811 -7.977 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -14.221 0.076 -6.613 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -14.519 2.577 -6.772 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -16.085 3.127 -7.375 1.00 0.00 H new ATOM 1376 N THR A 88 -10.677 1.223 -5.791 1.00 0.00 N ATOM 1377 CA THR A 88 -10.440 1.982 -4.547 1.00 0.00 C ATOM 1378 C THR A 88 -9.980 3.433 -4.574 1.00 0.00 C ATOM 1379 O THR A 88 -9.598 3.961 -3.533 1.00 0.00 O ATOM 1380 CB THR A 88 -9.822 1.109 -3.442 1.00 0.00 C ATOM 1381 OG1 THR A 88 -8.618 0.557 -3.914 1.00 0.00 O ATOM 1382 CG2 THR A 88 -10.750 -0.056 -3.084 1.00 0.00 C ATOM 0 H THR A 88 -9.920 0.580 -6.021 1.00 0.00 H new ATOM 0 HA THR A 88 -11.468 2.225 -4.279 1.00 0.00 H new ATOM 0 HB THR A 88 -9.660 1.735 -2.565 1.00 0.00 H new ATOM 0 HG1 THR A 88 -8.815 -0.172 -4.538 1.00 0.00 H new ATOM 0 HG21 THR A 88 -10.291 -0.659 -2.300 1.00 0.00 H new ATOM 0 HG22 THR A 88 -11.704 0.334 -2.730 1.00 0.00 H new ATOM 0 HG23 THR A 88 -10.916 -0.673 -3.967 1.00 0.00 H new ATOM 1390 N ARG A 89 -10.063 4.046 -5.760 1.00 0.00 N ATOM 1391 CA ARG A 89 -9.853 5.472 -6.158 1.00 0.00 C ATOM 1392 C ARG A 89 -10.349 6.644 -5.250 1.00 0.00 C ATOM 1393 O ARG A 89 -10.748 7.703 -5.738 1.00 0.00 O ATOM 1394 CB ARG A 89 -10.419 5.662 -7.588 1.00 0.00 C ATOM 1395 CG ARG A 89 -11.956 5.528 -7.668 1.00 0.00 C ATOM 1396 CD ARG A 89 -12.485 6.078 -8.997 1.00 0.00 C ATOM 1397 NE ARG A 89 -13.959 6.164 -9.009 1.00 0.00 N ATOM 1398 CZ ARG A 89 -14.693 6.812 -9.902 1.00 0.00 C ATOM 1399 NH1 ARG A 89 -14.177 7.384 -10.945 1.00 0.00 N ATOM 1400 NH2 ARG A 89 -15.986 6.898 -9.783 1.00 0.00 N ATOM 0 H ARG A 89 -10.311 3.494 -6.581 1.00 0.00 H new ATOM 0 HA ARG A 89 -8.773 5.579 -6.058 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -10.129 6.646 -7.957 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -9.964 4.926 -8.251 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -12.239 4.481 -7.565 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -12.416 6.066 -6.839 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -12.062 7.067 -9.175 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -12.152 5.437 -9.813 1.00 0.00 H new ATOM 0 HE ARG A 89 -14.458 5.681 -8.262 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -13.170 7.345 -11.102 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -14.778 7.873 -11.608 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -16.455 6.461 -8.990 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -16.530 7.402 -10.483 1.00 0.00 H new ATOM 1414 N PHE A 90 -10.294 6.501 -3.936 1.00 0.00 N ATOM 1415 CA PHE A 90 -10.620 7.483 -2.904 1.00 0.00 C ATOM 1416 C PHE A 90 -9.450 7.579 -1.905 1.00 0.00 C ATOM 1417 O PHE A 90 -8.472 6.834 -2.002 1.00 0.00 O ATOM 1418 CB PHE A 90 -11.948 7.084 -2.236 1.00 0.00 C ATOM 1419 CG PHE A 90 -13.057 6.757 -3.222 1.00 0.00 C ATOM 1420 CD1 PHE A 90 -13.742 7.793 -3.889 1.00 0.00 C ATOM 1421 CD2 PHE A 90 -13.369 5.414 -3.516 1.00 0.00 C ATOM 1422 CE1 PHE A 90 -14.734 7.486 -4.838 1.00 0.00 C ATOM 1423 CE2 PHE A 90 -14.362 5.109 -4.463 1.00 0.00 C ATOM 1424 CZ PHE A 90 -15.046 6.145 -5.122 1.00 0.00 C ATOM 0 H PHE A 90 -9.994 5.618 -3.524 1.00 0.00 H new ATOM 0 HA PHE A 90 -10.756 8.476 -3.333 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -11.776 6.218 -1.596 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -12.278 7.897 -1.590 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -13.505 8.824 -3.671 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -12.843 4.617 -3.012 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -15.256 8.281 -5.349 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -14.599 4.079 -4.684 1.00 0.00 H new ATOM 0 HZ PHE A 90 -15.812 5.911 -5.847 1.00 0.00 H new ATOM 1434 N THR A 91 -9.509 8.508 -0.943 1.00 0.00 N ATOM 1435 CA THR A 91 -8.391 8.722 -0.004 1.00 0.00 C ATOM 1436 C THR A 91 -8.229 7.530 0.956 1.00 0.00 C ATOM 1437 O THR A 91 -9.178 6.781 1.206 1.00 0.00 O ATOM 1438 CB THR A 91 -8.509 10.070 0.728 1.00 0.00 C ATOM 1439 OG1 THR A 91 -7.318 10.326 1.432 1.00 0.00 O ATOM 1440 CG2 THR A 91 -9.663 10.136 1.727 1.00 0.00 C ATOM 0 H THR A 91 -10.310 9.121 -0.791 1.00 0.00 H new ATOM 0 HA THR A 91 -7.472 8.777 -0.588 1.00 0.00 H new ATOM 0 HB THR A 91 -8.701 10.813 -0.046 1.00 0.00 H new ATOM 0 HG1 THR A 91 -7.391 11.185 1.897 1.00 0.00 H new ATOM 0 HG21 THR A 91 -9.678 11.118 2.201 1.00 0.00 H new ATOM 0 HG22 THR A 91 -10.606 9.970 1.205 1.00 0.00 H new ATOM 0 HG23 THR A 91 -9.529 9.368 2.488 1.00 0.00 H new ATOM 1448 N ASP A 92 -7.024 7.332 1.490 1.00 0.00 N ATOM 1449 CA ASP A 92 -6.704 6.195 2.362 1.00 0.00 C ATOM 1450 C ASP A 92 -7.330 6.327 3.762 1.00 0.00 C ATOM 1451 O ASP A 92 -7.892 5.361 4.274 1.00 0.00 O ATOM 1452 CB ASP A 92 -5.179 6.062 2.448 1.00 0.00 C ATOM 1453 CG ASP A 92 -4.761 4.870 3.326 1.00 0.00 C ATOM 1454 OD1 ASP A 92 -4.901 3.710 2.872 1.00 0.00 O ATOM 1455 OD2 ASP A 92 -4.267 5.099 4.456 1.00 0.00 O ATOM 0 H ASP A 92 -6.235 7.959 1.330 1.00 0.00 H new ATOM 0 HA ASP A 92 -7.136 5.293 1.928 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -4.767 5.938 1.446 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -4.756 6.980 2.855 1.00 0.00 H new ATOM 1460 N LEU A 93 -7.312 7.530 4.351 1.00 0.00 N ATOM 1461 CA LEU A 93 -7.771 7.773 5.727 1.00 0.00 C ATOM 1462 C LEU A 93 -9.261 7.458 5.944 1.00 0.00 C ATOM 1463 O LEU A 93 -9.624 6.873 6.966 1.00 0.00 O ATOM 1464 CB LEU A 93 -7.435 9.234 6.093 1.00 0.00 C ATOM 1465 CG LEU A 93 -7.800 9.647 7.535 1.00 0.00 C ATOM 1466 CD1 LEU A 93 -7.056 8.824 8.588 1.00 0.00 C ATOM 1467 CD2 LEU A 93 -7.451 11.120 7.744 1.00 0.00 C ATOM 0 H LEU A 93 -6.975 8.371 3.882 1.00 0.00 H new ATOM 0 HA LEU A 93 -7.248 7.085 6.391 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -6.367 9.393 5.945 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -7.955 9.895 5.399 1.00 0.00 H new ATOM 0 HG LEU A 93 -8.868 9.469 7.657 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -7.350 9.156 9.584 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -7.305 7.770 8.469 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -5.982 8.959 8.463 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -7.708 11.414 8.762 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -6.383 11.267 7.582 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -8.013 11.731 7.037 1.00 0.00 H new ATOM 1479 N LEU A 94 -10.125 7.809 4.984 1.00 0.00 N ATOM 1480 CA LEU A 94 -11.571 7.563 5.081 1.00 0.00 C ATOM 1481 C LEU A 94 -11.928 6.087 4.833 1.00 0.00 C ATOM 1482 O LEU A 94 -12.835 5.558 5.476 1.00 0.00 O ATOM 1483 CB LEU A 94 -12.333 8.498 4.119 1.00 0.00 C ATOM 1484 CG LEU A 94 -12.195 10.004 4.420 1.00 0.00 C ATOM 1485 CD1 LEU A 94 -13.019 10.803 3.408 1.00 0.00 C ATOM 1486 CD2 LEU A 94 -12.675 10.383 5.824 1.00 0.00 C ATOM 0 H LEU A 94 -9.843 8.271 4.119 1.00 0.00 H new ATOM 0 HA LEU A 94 -11.880 7.786 6.102 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -11.982 8.313 3.104 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -13.390 8.234 4.143 1.00 0.00 H new ATOM 0 HG LEU A 94 -11.133 10.238 4.352 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -12.922 11.868 3.620 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -12.656 10.599 2.401 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -14.067 10.512 3.482 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -12.552 11.456 5.974 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -13.727 10.120 5.932 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -12.088 9.843 6.567 1.00 0.00 H new ATOM 1498 N GLN A 95 -11.191 5.399 3.954 1.00 0.00 N ATOM 1499 CA GLN A 95 -11.349 3.985 3.678 1.00 0.00 C ATOM 1500 C GLN A 95 -10.806 3.103 4.815 1.00 0.00 C ATOM 1501 O GLN A 95 -11.414 2.083 5.130 1.00 0.00 O ATOM 1502 CB GLN A 95 -10.637 3.737 2.345 1.00 0.00 C ATOM 1503 CG GLN A 95 -11.498 4.179 1.151 1.00 0.00 C ATOM 1504 CD GLN A 95 -10.875 3.805 -0.191 1.00 0.00 C ATOM 1505 OE1 GLN A 95 -11.341 2.926 -0.904 1.00 0.00 O ATOM 1506 NE2 GLN A 95 -9.821 4.474 -0.604 1.00 0.00 N ATOM 0 H GLN A 95 -10.449 5.832 3.404 1.00 0.00 H new ATOM 0 HA GLN A 95 -12.402 3.712 3.611 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -9.691 4.278 2.332 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -10.400 2.677 2.250 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -12.484 3.722 1.230 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -11.643 5.259 1.192 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -9.422 5.209 -0.020 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -9.402 4.258 -1.509 1.00 0.00 H new ATOM 1515 N LEU A 96 -9.733 3.518 5.500 1.00 0.00 N ATOM 1516 CA LEU A 96 -9.140 2.805 6.641 1.00 0.00 C ATOM 1517 C LEU A 96 -10.152 2.548 7.769 1.00 0.00 C ATOM 1518 O LEU A 96 -10.161 1.458 8.336 1.00 0.00 O ATOM 1519 CB LEU A 96 -7.902 3.600 7.110 1.00 0.00 C ATOM 1520 CG LEU A 96 -7.086 2.960 8.253 1.00 0.00 C ATOM 1521 CD1 LEU A 96 -5.632 3.432 8.176 1.00 0.00 C ATOM 1522 CD2 LEU A 96 -7.592 3.344 9.649 1.00 0.00 C ATOM 0 H LEU A 96 -9.240 4.381 5.271 1.00 0.00 H new ATOM 0 HA LEU A 96 -8.829 1.808 6.328 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -7.242 3.745 6.255 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -8.229 4.589 7.432 1.00 0.00 H new ATOM 0 HG LEU A 96 -7.187 1.883 8.121 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -5.059 2.978 8.984 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -5.204 3.137 7.218 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -5.596 4.517 8.271 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -6.974 2.860 10.406 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -7.536 4.426 9.772 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -8.626 3.019 9.763 1.00 0.00 H new ATOM 1534 N VAL A 97 -11.047 3.501 8.056 1.00 0.00 N ATOM 1535 CA VAL A 97 -12.097 3.357 9.091 1.00 0.00 C ATOM 1536 C VAL A 97 -13.057 2.197 8.774 1.00 0.00 C ATOM 1537 O VAL A 97 -13.452 1.455 9.674 1.00 0.00 O ATOM 1538 CB VAL A 97 -12.870 4.683 9.266 1.00 0.00 C ATOM 1539 CG1 VAL A 97 -13.979 4.588 10.322 1.00 0.00 C ATOM 1540 CG2 VAL A 97 -11.932 5.818 9.702 1.00 0.00 C ATOM 0 H VAL A 97 -11.069 4.402 7.578 1.00 0.00 H new ATOM 0 HA VAL A 97 -11.603 3.117 10.032 1.00 0.00 H new ATOM 0 HB VAL A 97 -13.311 4.889 8.291 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -14.488 5.548 10.402 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -14.696 3.821 10.029 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -13.542 4.327 11.286 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -12.504 6.739 9.817 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -11.465 5.559 10.652 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -11.160 5.963 8.946 1.00 0.00 H new ATOM 1550 N GLU A 98 -13.395 1.997 7.496 1.00 0.00 N ATOM 1551 CA GLU A 98 -14.215 0.876 7.010 1.00 0.00 C ATOM 1552 C GLU A 98 -13.407 -0.425 6.849 1.00 0.00 C ATOM 1553 O GLU A 98 -13.933 -1.512 7.084 1.00 0.00 O ATOM 1554 CB GLU A 98 -14.879 1.319 5.690 1.00 0.00 C ATOM 1555 CG GLU A 98 -15.513 0.201 4.850 1.00 0.00 C ATOM 1556 CD GLU A 98 -16.594 -0.630 5.571 1.00 0.00 C ATOM 1557 OE1 GLU A 98 -17.232 -0.144 6.537 1.00 0.00 O ATOM 1558 OE2 GLU A 98 -16.827 -1.784 5.129 1.00 0.00 O ATOM 0 H GLU A 98 -13.099 2.626 6.749 1.00 0.00 H new ATOM 0 HA GLU A 98 -14.979 0.636 7.749 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -15.650 2.054 5.922 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -14.130 1.824 5.081 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -15.954 0.645 3.957 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -14.724 -0.472 4.515 1.00 0.00 H new ATOM 1565 N PHE A 99 -12.135 -0.340 6.454 1.00 0.00 N ATOM 1566 CA PHE A 99 -11.251 -1.493 6.248 1.00 0.00 C ATOM 1567 C PHE A 99 -10.626 -2.068 7.532 1.00 0.00 C ATOM 1568 O PHE A 99 -10.129 -3.192 7.502 1.00 0.00 O ATOM 1569 CB PHE A 99 -10.158 -1.109 5.233 1.00 0.00 C ATOM 1570 CG PHE A 99 -10.578 -0.767 3.806 1.00 0.00 C ATOM 1571 CD1 PHE A 99 -11.890 -0.978 3.325 1.00 0.00 C ATOM 1572 CD2 PHE A 99 -9.609 -0.235 2.931 1.00 0.00 C ATOM 1573 CE1 PHE A 99 -12.227 -0.637 2.003 1.00 0.00 C ATOM 1574 CE2 PHE A 99 -9.939 0.083 1.603 1.00 0.00 C ATOM 1575 CZ PHE A 99 -11.251 -0.111 1.140 1.00 0.00 C ATOM 0 H PHE A 99 -11.679 0.552 6.264 1.00 0.00 H new ATOM 0 HA PHE A 99 -11.876 -2.299 5.864 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -9.619 -0.251 5.635 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -9.449 -1.935 5.181 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -12.639 -1.404 3.977 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -8.602 -0.070 3.285 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -13.238 -0.780 1.650 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -9.184 0.476 0.938 1.00 0.00 H new ATOM 0 HZ PHE A 99 -11.509 0.144 0.123 1.00 0.00 H new ATOM 1585 N HIS A 100 -10.653 -1.347 8.660 1.00 0.00 N ATOM 1586 CA HIS A 100 -9.997 -1.741 9.922 1.00 0.00 C ATOM 1587 C HIS A 100 -10.353 -3.166 10.388 1.00 0.00 C ATOM 1588 O HIS A 100 -9.465 -3.946 10.727 1.00 0.00 O ATOM 1589 CB HIS A 100 -10.354 -0.693 10.995 1.00 0.00 C ATOM 1590 CG HIS A 100 -9.803 -1.007 12.364 1.00 0.00 C ATOM 1591 ND1 HIS A 100 -8.493 -0.839 12.779 1.00 0.00 N ATOM 1592 CD2 HIS A 100 -10.513 -1.512 13.421 1.00 0.00 C ATOM 1593 CE1 HIS A 100 -8.408 -1.237 14.064 1.00 0.00 C ATOM 1594 NE2 HIS A 100 -9.625 -1.651 14.474 1.00 0.00 N ATOM 0 H HIS A 100 -11.141 -0.454 8.726 1.00 0.00 H new ATOM 0 HA HIS A 100 -8.921 -1.767 9.752 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -9.979 0.280 10.678 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -11.439 -0.610 11.061 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -11.565 -1.755 13.431 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -7.512 -1.226 14.667 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -9.852 -2.006 15.403 1.00 0.00 H new ATOM 1603 N GLN A 101 -11.650 -3.497 10.408 1.00 0.00 N ATOM 1604 CA GLN A 101 -12.170 -4.822 10.780 1.00 0.00 C ATOM 1605 C GLN A 101 -12.116 -5.841 9.629 1.00 0.00 C ATOM 1606 O GLN A 101 -11.706 -6.986 9.833 1.00 0.00 O ATOM 1607 CB GLN A 101 -13.551 -4.704 11.467 1.00 0.00 C ATOM 1608 CG GLN A 101 -14.796 -4.414 10.596 1.00 0.00 C ATOM 1609 CD GLN A 101 -14.819 -3.051 9.898 1.00 0.00 C ATOM 1610 OE1 GLN A 101 -14.070 -2.135 10.204 1.00 0.00 O ATOM 1611 NE2 GLN A 101 -15.655 -2.872 8.904 1.00 0.00 N ATOM 0 H GLN A 101 -12.386 -2.836 10.160 1.00 0.00 H new ATOM 0 HA GLN A 101 -11.495 -5.243 11.525 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -13.733 -5.635 12.003 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -13.481 -3.914 12.215 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -14.873 -5.191 9.836 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -15.683 -4.494 11.225 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -16.290 -3.622 8.630 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -15.670 -1.983 8.404 1.00 0.00 H new ATOM 1620 N LEU A 102 -12.523 -5.420 8.423 1.00 0.00 N ATOM 1621 CA LEU A 102 -12.646 -6.250 7.215 1.00 0.00 C ATOM 1622 C LEU A 102 -12.244 -5.452 5.962 1.00 0.00 C ATOM 1623 O LEU A 102 -13.063 -4.809 5.300 1.00 0.00 O ATOM 1624 CB LEU A 102 -14.091 -6.785 7.094 1.00 0.00 C ATOM 1625 CG LEU A 102 -14.496 -7.879 8.103 1.00 0.00 C ATOM 1626 CD1 LEU A 102 -15.986 -8.186 7.953 1.00 0.00 C ATOM 1627 CD2 LEU A 102 -13.724 -9.184 7.888 1.00 0.00 C ATOM 0 H LEU A 102 -12.787 -4.449 8.255 1.00 0.00 H new ATOM 0 HA LEU A 102 -11.967 -7.098 7.297 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -14.778 -5.946 7.204 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -14.228 -7.179 6.087 1.00 0.00 H new ATOM 0 HG LEU A 102 -14.264 -7.496 9.097 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -16.272 -8.959 8.666 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -16.565 -7.283 8.146 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -16.185 -8.535 6.940 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -14.045 -9.922 8.623 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -13.920 -9.562 6.885 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -12.656 -8.998 8.003 1.00 0.00 H new ATOM 1639 N ASN A 103 -10.951 -5.479 5.646 1.00 0.00 N ATOM 1640 CA ASN A 103 -10.393 -4.884 4.429 1.00 0.00 C ATOM 1641 C ASN A 103 -10.839 -5.692 3.180 1.00 0.00 C ATOM 1642 O ASN A 103 -11.476 -6.739 3.286 1.00 0.00 O ATOM 1643 CB ASN A 103 -8.864 -4.781 4.639 1.00 0.00 C ATOM 1644 CG ASN A 103 -8.107 -3.860 3.691 1.00 0.00 C ATOM 1645 OD1 ASN A 103 -8.608 -3.380 2.689 1.00 0.00 O ATOM 1646 ND2 ASN A 103 -6.864 -3.583 3.992 1.00 0.00 N ATOM 0 H ASN A 103 -10.248 -5.922 6.237 1.00 0.00 H new ATOM 0 HA ASN A 103 -10.768 -3.878 4.239 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -8.682 -4.444 5.659 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -8.440 -5.781 4.553 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -6.318 -2.967 3.389 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -6.441 -3.983 4.830 1.00 0.00 H new ATOM 1653 N ARG A 104 -10.539 -5.191 1.979 1.00 0.00 N ATOM 1654 CA ARG A 104 -10.789 -5.850 0.682 1.00 0.00 C ATOM 1655 C ARG A 104 -9.512 -6.497 0.096 1.00 0.00 C ATOM 1656 O ARG A 104 -9.542 -7.025 -1.014 1.00 0.00 O ATOM 1657 CB ARG A 104 -11.443 -4.826 -0.271 1.00 0.00 C ATOM 1658 CG ARG A 104 -12.938 -4.540 -0.008 1.00 0.00 C ATOM 1659 CD ARG A 104 -13.302 -4.098 1.420 1.00 0.00 C ATOM 1660 NE ARG A 104 -14.643 -3.491 1.472 1.00 0.00 N ATOM 1661 CZ ARG A 104 -15.304 -3.096 2.547 1.00 0.00 C ATOM 1662 NH1 ARG A 104 -14.903 -3.283 3.768 1.00 0.00 N ATOM 1663 NH2 ARG A 104 -16.433 -2.462 2.450 1.00 0.00 N ATOM 0 H ARG A 104 -10.097 -4.278 1.873 1.00 0.00 H new ATOM 0 HA ARG A 104 -11.478 -6.683 0.823 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -10.893 -3.887 -0.202 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -11.333 -5.185 -1.294 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -13.266 -3.765 -0.701 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -13.506 -5.440 -0.244 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -13.265 -4.958 2.089 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -12.563 -3.382 1.780 1.00 0.00 H new ATOM 0 HE ARG A 104 -15.115 -3.361 0.577 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -14.022 -3.764 3.947 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -15.469 -2.949 4.548 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -16.827 -2.259 1.531 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -16.926 -2.167 3.293 1.00 0.00 H new ATOM 1677 N GLY A 105 -8.411 -6.465 0.862 1.00 0.00 N ATOM 1678 CA GLY A 105 -7.066 -6.967 0.537 1.00 0.00 C ATOM 1679 C GLY A 105 -6.613 -6.725 -0.912 1.00 0.00 C ATOM 1680 O GLY A 105 -6.860 -5.672 -1.503 1.00 0.00 O ATOM 0 H GLY A 105 -8.439 -6.056 1.796 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -6.348 -6.498 1.209 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -7.037 -8.038 0.737 1.00 0.00 H new ATOM 1684 N ILE A 106 -5.913 -7.722 -1.459 1.00 0.00 N ATOM 1685 CA ILE A 106 -5.464 -7.805 -2.862 1.00 0.00 C ATOM 1686 C ILE A 106 -6.303 -8.879 -3.605 1.00 0.00 C ATOM 1687 O ILE A 106 -6.957 -9.709 -2.974 1.00 0.00 O ATOM 1688 CB ILE A 106 -3.921 -7.959 -2.923 1.00 0.00 C ATOM 1689 CG1 ILE A 106 -3.275 -8.000 -4.325 1.00 0.00 C ATOM 1690 CG2 ILE A 106 -3.412 -9.164 -2.132 1.00 0.00 C ATOM 1691 CD1 ILE A 106 -3.495 -6.736 -5.164 1.00 0.00 C ATOM 0 H ILE A 106 -5.627 -8.535 -0.914 1.00 0.00 H new ATOM 0 HA ILE A 106 -5.652 -6.880 -3.407 1.00 0.00 H new ATOM 0 HB ILE A 106 -3.603 -7.023 -2.464 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -2.203 -8.164 -4.213 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -3.673 -8.856 -4.870 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -2.326 -9.220 -2.212 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -3.694 -9.057 -1.084 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -3.853 -10.076 -2.535 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -3.008 -6.852 -6.132 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -4.563 -6.579 -5.312 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -3.071 -5.876 -4.645 1.00 0.00 H new ATOM 1703 N LEU A 107 -6.312 -8.832 -4.945 1.00 0.00 N ATOM 1704 CA LEU A 107 -7.113 -9.656 -5.879 1.00 0.00 C ATOM 1705 C LEU A 107 -7.484 -11.119 -5.472 1.00 0.00 C ATOM 1706 O LEU A 107 -8.648 -11.480 -5.690 1.00 0.00 O ATOM 1707 CB LEU A 107 -6.412 -9.626 -7.262 1.00 0.00 C ATOM 1708 CG LEU A 107 -7.228 -8.963 -8.389 1.00 0.00 C ATOM 1709 CD1 LEU A 107 -6.323 -8.748 -9.602 1.00 0.00 C ATOM 1710 CD2 LEU A 107 -8.416 -9.827 -8.813 1.00 0.00 C ATOM 0 H LEU A 107 -5.719 -8.171 -5.447 1.00 0.00 H new ATOM 0 HA LEU A 107 -8.097 -9.187 -5.878 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -5.464 -9.098 -7.161 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -6.178 -10.649 -7.556 1.00 0.00 H new ATOM 0 HG LEU A 107 -7.610 -8.014 -8.012 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -6.894 -8.279 -10.403 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -5.490 -8.102 -9.324 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -5.939 -9.709 -9.944 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -8.966 -9.325 -9.609 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -8.055 -10.790 -9.173 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -9.076 -9.983 -7.959 1.00 0.00 H new ATOM 1722 N PRO A 108 -6.580 -11.978 -4.941 1.00 0.00 N ATOM 1723 CA PRO A 108 -6.867 -13.400 -4.669 1.00 0.00 C ATOM 1724 C PRO A 108 -7.750 -13.713 -3.427 1.00 0.00 C ATOM 1725 O PRO A 108 -8.554 -12.899 -2.970 1.00 0.00 O ATOM 1726 CB PRO A 108 -5.496 -14.095 -4.606 1.00 0.00 C ATOM 1727 CG PRO A 108 -4.547 -13.131 -5.297 1.00 0.00 C ATOM 1728 CD PRO A 108 -5.139 -11.780 -4.912 1.00 0.00 C ATOM 0 HA PRO A 108 -7.501 -13.780 -5.470 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -5.192 -14.280 -3.576 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -5.517 -15.061 -5.111 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -3.522 -13.243 -4.944 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -4.531 -13.277 -6.377 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -4.803 -11.470 -3.923 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -4.833 -11.002 -5.611 1.00 0.00 H new ATOM 1736 N CYS A 109 -7.623 -14.943 -2.910 1.00 0.00 N ATOM 1737 CA CYS A 109 -8.373 -15.582 -1.838 1.00 0.00 C ATOM 1738 C CYS A 109 -8.629 -14.775 -0.544 1.00 0.00 C ATOM 1739 O CYS A 109 -9.795 -14.619 -0.166 1.00 0.00 O ATOM 1740 CB CYS A 109 -7.596 -16.871 -1.539 1.00 0.00 C ATOM 1741 SG CYS A 109 -7.733 -18.034 -2.934 1.00 0.00 S ATOM 0 H CYS A 109 -6.913 -15.577 -3.278 1.00 0.00 H new ATOM 0 HA CYS A 109 -9.394 -15.726 -2.190 1.00 0.00 H new ATOM 0 HB2 CYS A 109 -6.548 -16.637 -1.355 1.00 0.00 H new ATOM 0 HB3 CYS A 109 -7.983 -17.334 -0.632 1.00 0.00 H new ATOM 0 HG CYS A 109 -7.067 -19.117 -2.663 1.00 0.00 H new ATOM 1747 N LEU A 110 -7.594 -14.315 0.170 1.00 0.00 N ATOM 1748 CA LEU A 110 -7.752 -13.634 1.470 1.00 0.00 C ATOM 1749 C LEU A 110 -7.985 -12.115 1.301 1.00 0.00 C ATOM 1750 O LEU A 110 -7.607 -11.526 0.286 1.00 0.00 O ATOM 1751 CB LEU A 110 -6.565 -13.969 2.408 1.00 0.00 C ATOM 1752 CG LEU A 110 -6.650 -15.278 3.220 1.00 0.00 C ATOM 1753 CD1 LEU A 110 -7.764 -15.235 4.268 1.00 0.00 C ATOM 1754 CD2 LEU A 110 -6.836 -16.523 2.354 1.00 0.00 C ATOM 0 H LEU A 110 -6.624 -14.402 -0.133 1.00 0.00 H new ATOM 0 HA LEU A 110 -8.654 -14.015 1.950 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -5.658 -14.005 1.804 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -6.447 -13.144 3.110 1.00 0.00 H new ATOM 0 HG LEU A 110 -5.683 -15.353 3.717 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -7.786 -16.178 4.815 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -7.578 -14.416 4.963 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -8.723 -15.080 3.774 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -6.887 -17.405 2.992 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -7.760 -16.434 1.782 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -5.993 -16.619 1.669 1.00 0.00 H new ATOM 1766 N LEU A 111 -8.612 -11.477 2.306 1.00 0.00 N ATOM 1767 CA LEU A 111 -9.000 -10.055 2.235 1.00 0.00 C ATOM 1768 C LEU A 111 -8.612 -9.152 3.424 1.00 0.00 C ATOM 1769 O LEU A 111 -8.645 -7.934 3.264 1.00 0.00 O ATOM 1770 CB LEU A 111 -10.490 -9.923 1.835 1.00 0.00 C ATOM 1771 CG LEU A 111 -11.616 -10.448 2.752 1.00 0.00 C ATOM 1772 CD1 LEU A 111 -11.788 -11.968 2.701 1.00 0.00 C ATOM 1773 CD2 LEU A 111 -11.484 -10.030 4.216 1.00 0.00 C ATOM 0 H LEU A 111 -8.863 -11.929 3.185 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.370 -9.643 1.447 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -10.682 -8.863 1.671 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -10.606 -10.421 0.872 1.00 0.00 H new ATOM 0 HG LEU A 111 -12.502 -9.970 2.335 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -12.596 -12.265 3.370 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -12.029 -12.273 1.683 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -10.862 -12.450 3.015 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -12.315 -10.441 4.788 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -10.544 -10.408 4.619 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -11.498 -8.942 4.287 1.00 0.00 H new ATOM 1785 N ARG A 112 -8.221 -9.685 4.592 1.00 0.00 N ATOM 1786 CA ARG A 112 -7.858 -8.868 5.771 1.00 0.00 C ATOM 1787 C ARG A 112 -6.350 -8.900 6.045 1.00 0.00 C ATOM 1788 O ARG A 112 -5.698 -9.930 5.871 1.00 0.00 O ATOM 1789 CB ARG A 112 -8.766 -9.175 6.975 1.00 0.00 C ATOM 1790 CG ARG A 112 -8.537 -10.534 7.657 1.00 0.00 C ATOM 1791 CD ARG A 112 -9.695 -10.882 8.609 1.00 0.00 C ATOM 1792 NE ARG A 112 -10.002 -9.791 9.562 1.00 0.00 N ATOM 1793 CZ ARG A 112 -9.446 -9.551 10.735 1.00 0.00 C ATOM 1794 NH1 ARG A 112 -8.507 -10.303 11.237 1.00 0.00 N ATOM 1795 NH2 ARG A 112 -9.843 -8.523 11.426 1.00 0.00 N ATOM 0 H ARG A 112 -8.146 -10.690 4.750 1.00 0.00 H new ATOM 0 HA ARG A 112 -8.059 -7.820 5.548 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -8.630 -8.389 7.718 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -9.804 -9.126 6.645 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -8.439 -11.312 6.900 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -7.600 -10.511 8.213 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -10.586 -11.108 8.023 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -9.443 -11.784 9.166 1.00 0.00 H new ATOM 0 HE ARG A 112 -10.736 -9.143 9.276 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -8.173 -11.116 10.719 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -8.106 -10.079 12.148 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -10.575 -7.914 11.060 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -9.422 -8.326 12.334 1.00 0.00 H new ATOM 1809 N HIS A 113 -5.802 -7.753 6.440 1.00 0.00 N ATOM 1810 CA HIS A 113 -4.370 -7.521 6.644 1.00 0.00 C ATOM 1811 C HIS A 113 -3.872 -7.727 8.072 1.00 0.00 C ATOM 1812 O HIS A 113 -4.632 -7.862 9.035 1.00 0.00 O ATOM 1813 CB HIS A 113 -4.017 -6.110 6.160 1.00 0.00 C ATOM 1814 CG HIS A 113 -4.806 -5.021 6.848 1.00 0.00 C ATOM 1815 ND1 HIS A 113 -6.162 -4.756 6.649 1.00 0.00 N ATOM 1816 CD2 HIS A 113 -4.323 -4.172 7.798 1.00 0.00 C ATOM 1817 CE1 HIS A 113 -6.470 -3.757 7.496 1.00 0.00 C ATOM 1818 NE2 HIS A 113 -5.382 -3.381 8.189 1.00 0.00 N ATOM 0 H HIS A 113 -6.365 -6.925 6.635 1.00 0.00 H new ATOM 0 HA HIS A 113 -3.857 -8.285 6.059 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -2.953 -5.935 6.322 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -4.190 -6.049 5.086 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -3.310 -4.128 8.171 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -7.452 -3.320 7.604 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -5.346 -2.637 8.886 1.00 0.00 H new ATOM 1826 N CYS A 114 -2.545 -7.721 8.156 1.00 0.00 N ATOM 1827 CA CYS A 114 -1.728 -7.948 9.339 1.00 0.00 C ATOM 1828 C CYS A 114 -0.579 -6.903 9.378 1.00 0.00 C ATOM 1829 O CYS A 114 -0.696 -5.829 8.781 1.00 0.00 O ATOM 1830 CB CYS A 114 -1.224 -9.394 9.214 1.00 0.00 C ATOM 1831 SG CYS A 114 -2.570 -10.620 9.134 1.00 0.00 S ATOM 0 H CYS A 114 -1.970 -7.543 7.333 1.00 0.00 H new ATOM 0 HA CYS A 114 -2.273 -7.827 10.275 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -0.608 -9.481 8.319 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -0.583 -9.623 10.065 1.00 0.00 H new ATOM 0 HG CYS A 114 -2.065 -11.813 9.027 1.00 0.00 H new ATOM 1837 N CYS A 115 0.542 -7.216 10.041 1.00 0.00 N ATOM 1838 CA CYS A 115 1.731 -6.352 10.127 1.00 0.00 C ATOM 1839 C CYS A 115 2.977 -7.062 9.558 1.00 0.00 C ATOM 1840 O CYS A 115 3.340 -8.145 10.018 1.00 0.00 O ATOM 1841 CB CYS A 115 1.945 -5.923 11.590 1.00 0.00 C ATOM 1842 SG CYS A 115 0.518 -4.982 12.214 1.00 0.00 S ATOM 0 H CYS A 115 0.652 -8.096 10.544 1.00 0.00 H new ATOM 0 HA CYS A 115 1.570 -5.461 9.520 1.00 0.00 H new ATOM 0 HB2 CYS A 115 2.102 -6.805 12.211 1.00 0.00 H new ATOM 0 HB3 CYS A 115 2.846 -5.315 11.665 1.00 0.00 H new ATOM 0 HG CYS A 115 0.731 -4.639 13.450 1.00 0.00 H new ATOM 1848 N THR A 116 3.635 -6.448 8.563 1.00 0.00 N ATOM 1849 CA THR A 116 4.822 -6.999 7.872 1.00 0.00 C ATOM 1850 C THR A 116 6.134 -6.335 8.323 1.00 0.00 C ATOM 1851 O THR A 116 6.115 -5.307 9.003 1.00 0.00 O ATOM 1852 CB THR A 116 4.627 -6.942 6.345 1.00 0.00 C ATOM 1853 OG1 THR A 116 5.485 -7.873 5.730 1.00 0.00 O ATOM 1854 CG2 THR A 116 4.894 -5.572 5.721 1.00 0.00 C ATOM 0 H THR A 116 3.355 -5.535 8.205 1.00 0.00 H new ATOM 0 HA THR A 116 4.916 -8.046 8.160 1.00 0.00 H new ATOM 0 HB THR A 116 3.575 -7.170 6.176 1.00 0.00 H new ATOM 0 HG1 THR A 116 5.361 -7.840 4.758 1.00 0.00 H new ATOM 0 HG21 THR A 116 4.733 -5.625 4.644 1.00 0.00 H new ATOM 0 HG22 THR A 116 4.216 -4.837 6.154 1.00 0.00 H new ATOM 0 HG23 THR A 116 5.924 -5.276 5.919 1.00 0.00 H new ATOM 1862 N ARG A 117 7.282 -6.911 7.942 1.00 0.00 N ATOM 1863 CA ARG A 117 8.626 -6.355 8.210 1.00 0.00 C ATOM 1864 C ARG A 117 9.079 -5.379 7.117 1.00 0.00 C ATOM 1865 O ARG A 117 8.633 -5.451 5.970 1.00 0.00 O ATOM 1866 CB ARG A 117 9.656 -7.485 8.402 1.00 0.00 C ATOM 1867 CG ARG A 117 9.353 -8.435 9.569 1.00 0.00 C ATOM 1868 CD ARG A 117 9.272 -7.741 10.937 1.00 0.00 C ATOM 1869 NE ARG A 117 9.047 -8.716 12.025 1.00 0.00 N ATOM 1870 CZ ARG A 117 9.954 -9.401 12.700 1.00 0.00 C ATOM 1871 NH1 ARG A 117 11.232 -9.298 12.461 1.00 0.00 N ATOM 1872 NH2 ARG A 117 9.586 -10.218 13.646 1.00 0.00 N ATOM 0 H ARG A 117 7.309 -7.792 7.429 1.00 0.00 H new ATOM 0 HA ARG A 117 8.560 -5.785 9.137 1.00 0.00 H new ATOM 0 HB2 ARG A 117 9.713 -8.067 7.482 1.00 0.00 H new ATOM 0 HB3 ARG A 117 10.639 -7.040 8.559 1.00 0.00 H new ATOM 0 HG2 ARG A 117 8.408 -8.943 9.374 1.00 0.00 H new ATOM 0 HG3 ARG A 117 10.125 -9.203 9.608 1.00 0.00 H new ATOM 0 HD2 ARG A 117 10.195 -7.192 11.123 1.00 0.00 H new ATOM 0 HD3 ARG A 117 8.463 -7.010 10.928 1.00 0.00 H new ATOM 0 HE ARG A 117 8.075 -8.880 12.286 1.00 0.00 H new ATOM 0 HH11 ARG A 117 11.565 -8.670 11.729 1.00 0.00 H new ATOM 0 HH12 ARG A 117 11.898 -9.845 13.006 1.00 0.00 H new ATOM 0 HH21 ARG A 117 8.597 -10.330 13.867 1.00 0.00 H new ATOM 0 HH22 ARG A 117 10.287 -10.746 14.166 1.00 0.00 H new ATOM 1886 N VAL A 118 9.992 -4.481 7.493 1.00 0.00 N ATOM 1887 CA VAL A 118 10.494 -3.381 6.635 1.00 0.00 C ATOM 1888 C VAL A 118 12.006 -3.475 6.382 1.00 0.00 C ATOM 1889 O VAL A 118 12.455 -3.236 5.257 1.00 0.00 O ATOM 1890 CB VAL A 118 10.100 -2.009 7.228 1.00 0.00 C ATOM 1891 CG1 VAL A 118 10.475 -0.844 6.302 1.00 0.00 C ATOM 1892 CG2 VAL A 118 8.587 -1.921 7.473 1.00 0.00 C ATOM 0 H VAL A 118 10.418 -4.490 8.420 1.00 0.00 H new ATOM 0 HA VAL A 118 10.016 -3.484 5.661 1.00 0.00 H new ATOM 0 HB VAL A 118 10.651 -1.928 8.165 1.00 0.00 H new ATOM 0 HG11 VAL A 118 10.178 0.098 6.763 1.00 0.00 H new ATOM 0 HG12 VAL A 118 11.552 -0.843 6.137 1.00 0.00 H new ATOM 0 HG13 VAL A 118 9.962 -0.958 5.347 1.00 0.00 H new ATOM 0 HG21 VAL A 118 8.342 -0.944 7.890 1.00 0.00 H new ATOM 0 HG22 VAL A 118 8.057 -2.056 6.530 1.00 0.00 H new ATOM 0 HG23 VAL A 118 8.286 -2.700 8.173 1.00 0.00 H new ATOM 1902 N ALA A 119 12.795 -3.860 7.393 1.00 0.00 N ATOM 1903 CA ALA A 119 14.237 -4.094 7.258 1.00 0.00 C ATOM 1904 C ALA A 119 14.556 -5.398 6.488 1.00 0.00 C ATOM 1905 O ALA A 119 13.760 -6.346 6.489 1.00 0.00 O ATOM 1906 CB ALA A 119 14.867 -4.082 8.655 1.00 0.00 C ATOM 0 H ALA A 119 12.445 -4.019 8.338 1.00 0.00 H new ATOM 0 HA ALA A 119 14.670 -3.294 6.658 1.00 0.00 H new ATOM 0 HB1 ALA A 119 15.940 -4.255 8.572 1.00 0.00 H new ATOM 0 HB2 ALA A 119 14.691 -3.115 9.125 1.00 0.00 H new ATOM 0 HB3 ALA A 119 14.419 -4.868 9.263 1.00 0.00 H new ATOM 1912 N LEU A 120 15.738 -5.442 5.854 1.00 0.00 N ATOM 1913 CA LEU A 120 16.253 -6.569 5.056 1.00 0.00 C ATOM 1914 C LEU A 120 17.740 -6.828 5.375 1.00 0.00 C ATOM 1915 O LEU A 120 18.588 -5.943 5.110 1.00 0.00 O ATOM 1916 CB LEU A 120 15.957 -6.280 3.560 1.00 0.00 C ATOM 1917 CG LEU A 120 16.053 -7.448 2.559 1.00 0.00 C ATOM 1918 CD1 LEU A 120 17.457 -8.024 2.406 1.00 0.00 C ATOM 1919 CD2 LEU A 120 15.083 -8.578 2.896 1.00 0.00 C ATOM 1920 OXT LEU A 120 18.043 -7.904 5.945 1.00 0.00 O ATOM 0 H LEU A 120 16.391 -4.659 5.884 1.00 0.00 H new ATOM 0 HA LEU A 120 15.749 -7.501 5.313 1.00 0.00 H new ATOM 0 HB2 LEU A 120 14.951 -5.867 3.494 1.00 0.00 H new ATOM 0 HB3 LEU A 120 16.644 -5.501 3.229 1.00 0.00 H new ATOM 0 HG LEU A 120 15.776 -7.002 1.604 1.00 0.00 H new ATOM 0 HD11 LEU A 120 17.439 -8.841 1.685 1.00 0.00 H new ATOM 0 HD12 LEU A 120 18.134 -7.245 2.055 1.00 0.00 H new ATOM 0 HD13 LEU A 120 17.804 -8.398 3.369 1.00 0.00 H new ATOM 0 HD21 LEU A 120 15.187 -9.378 2.163 1.00 0.00 H new ATOM 0 HD22 LEU A 120 15.307 -8.965 3.890 1.00 0.00 H new ATOM 0 HD23 LEU A 120 14.061 -8.199 2.876 1.00 0.00 H new TER 1932 LEU A 120 ATOM 1933 N PRO B1135 10.464 -6.566 -14.784 1.00 0.00 N ATOM 1934 CA PRO B1135 9.259 -7.429 -14.760 1.00 0.00 C ATOM 1935 C PRO B1135 8.200 -7.072 -15.818 1.00 0.00 C ATOM 1936 O PRO B1135 8.206 -5.965 -16.360 1.00 0.00 O ATOM 1937 CB PRO B1135 8.736 -7.344 -13.320 1.00 0.00 C ATOM 1938 CG PRO B1135 10.013 -7.163 -12.484 1.00 0.00 C ATOM 1939 CD PRO B1135 11.124 -6.921 -13.510 1.00 0.00 C ATOM 0 HA PRO B1135 9.513 -8.452 -15.036 1.00 0.00 H new ATOM 0 HB2 PRO B1135 8.050 -6.507 -13.191 1.00 0.00 H new ATOM 0 HB3 PRO B1135 8.195 -8.246 -13.036 1.00 0.00 H new ATOM 0 HG2 PRO B1135 9.920 -6.322 -11.797 1.00 0.00 H new ATOM 0 HG3 PRO B1135 10.219 -8.047 -11.880 1.00 0.00 H new ATOM 0 HD2 PRO B1135 11.785 -6.119 -13.181 1.00 0.00 H new ATOM 0 HD3 PRO B1135 11.740 -7.812 -13.630 1.00 0.00 H new ATOM 1949 N GLN B1136 7.292 -8.012 -16.118 1.00 0.00 N ATOM 1950 CA GLN B1136 6.196 -7.807 -17.082 1.00 0.00 C ATOM 1951 C GLN B1136 5.050 -6.929 -16.520 1.00 0.00 C ATOM 1952 O GLN B1136 4.748 -5.909 -17.149 1.00 0.00 O ATOM 1953 CB GLN B1136 5.697 -9.156 -17.636 1.00 0.00 C ATOM 1954 CG GLN B1136 6.727 -9.883 -18.522 1.00 0.00 C ATOM 1955 CD GLN B1136 7.015 -9.207 -19.869 1.00 0.00 C ATOM 1956 OE1 GLN B1136 6.365 -8.261 -20.301 1.00 0.00 O ATOM 1957 NE2 GLN B1136 8.002 -9.682 -20.601 1.00 0.00 N ATOM 0 H GLN B1136 7.296 -8.941 -15.698 1.00 0.00 H new ATOM 0 HA GLN B1136 6.603 -7.238 -17.918 1.00 0.00 H new ATOM 0 HB2 GLN B1136 5.428 -9.804 -16.802 1.00 0.00 H new ATOM 0 HB3 GLN B1136 4.789 -8.987 -18.214 1.00 0.00 H new ATOM 0 HG2 GLN B1136 7.662 -9.970 -17.969 1.00 0.00 H new ATOM 0 HG3 GLN B1136 6.372 -10.896 -18.710 1.00 0.00 H new ATOM 0 HE21 GLN B1136 8.556 -10.468 -20.262 1.00 0.00 H new ATOM 0 HE22 GLN B1136 8.212 -9.263 -21.507 1.00 0.00 H new ATOM 1966 N PRO B1137 4.430 -7.242 -15.358 1.00 0.00 N ATOM 1967 CA PRO B1137 3.512 -6.319 -14.683 1.00 0.00 C ATOM 1968 C PRO B1137 4.271 -5.166 -14.002 1.00 0.00 C ATOM 1969 O PRO B1137 5.469 -5.278 -13.721 1.00 0.00 O ATOM 1970 CB PRO B1137 2.750 -7.175 -13.670 1.00 0.00 C ATOM 1971 CG PRO B1137 3.788 -8.223 -13.272 1.00 0.00 C ATOM 1972 CD PRO B1137 4.535 -8.475 -14.583 1.00 0.00 C ATOM 0 HA PRO B1137 2.833 -5.838 -15.387 1.00 0.00 H new ATOM 0 HB2 PRO B1137 2.417 -6.589 -12.814 1.00 0.00 H new ATOM 0 HB3 PRO B1137 1.863 -7.630 -14.110 1.00 0.00 H new ATOM 0 HG2 PRO B1137 4.454 -7.856 -12.491 1.00 0.00 H new ATOM 0 HG3 PRO B1137 3.321 -9.131 -12.892 1.00 0.00 H new ATOM 0 HD2 PRO B1137 5.578 -8.728 -14.394 1.00 0.00 H new ATOM 0 HD3 PRO B1137 4.097 -9.313 -15.125 1.00 0.00 H new ATOM 1980 N GLU B1138 3.572 -4.068 -13.698 1.00 0.00 N ATOM 1981 CA GLU B1138 4.171 -2.895 -13.040 1.00 0.00 C ATOM 1982 C GLU B1138 3.279 -2.317 -11.918 1.00 0.00 C ATOM 1983 O GLU B1138 3.595 -2.539 -10.748 1.00 0.00 O ATOM 1984 CB GLU B1138 4.617 -1.867 -14.097 1.00 0.00 C ATOM 1985 CG GLU B1138 5.865 -1.114 -13.654 1.00 0.00 C ATOM 1986 CD GLU B1138 6.269 -0.069 -14.705 1.00 0.00 C ATOM 1987 OE1 GLU B1138 7.012 -0.404 -15.660 1.00 0.00 O ATOM 1988 OE2 GLU B1138 5.869 1.111 -14.551 1.00 0.00 O ATOM 0 H GLU B1138 2.577 -3.964 -13.899 1.00 0.00 H new ATOM 0 HA GLU B1138 5.071 -3.212 -12.513 1.00 0.00 H new ATOM 0 HB2 GLU B1138 4.814 -2.376 -15.040 1.00 0.00 H new ATOM 0 HB3 GLU B1138 3.809 -1.158 -14.280 1.00 0.00 H new ATOM 0 HG2 GLU B1138 5.680 -0.623 -12.698 1.00 0.00 H new ATOM 0 HG3 GLU B1138 6.684 -1.816 -13.499 1.00 0.00 H new HETATM 1995 N PTR B1139 2.159 -1.651 -12.241 1.00 0.00 N HETATM 1996 CA PTR B1139 1.187 -1.158 -11.255 1.00 0.00 C HETATM 1997 C PTR B1139 -0.267 -1.693 -11.497 1.00 0.00 C HETATM 1998 O PTR B1139 -0.768 -1.807 -12.607 1.00 0.00 O HETATM 1999 CB PTR B1139 1.377 0.366 -10.997 1.00 0.00 C HETATM 2000 CG PTR B1139 2.604 0.990 -10.272 1.00 0.00 C HETATM 2001 CD1 PTR B1139 2.806 0.843 -8.871 1.00 0.00 C HETATM 2002 CD2 PTR B1139 3.374 1.988 -10.938 1.00 0.00 C HETATM 2003 CE1 PTR B1139 3.825 1.571 -8.219 1.00 0.00 C HETATM 2004 CE2 PTR B1139 4.294 2.819 -10.236 1.00 0.00 C HETATM 2005 CZ PTR B1139 4.588 2.558 -8.888 1.00 0.00 C HETATM 2006 OH PTR B1139 5.427 3.387 -8.303 1.00 0.00 O HETATM 2007 P PTR B1139 6.601 2.928 -7.346 1.00 0.00 P HETATM 2008 O1P PTR B1139 6.508 3.816 -6.198 1.00 0.00 O HETATM 2009 O2P PTR B1139 6.393 1.539 -7.010 1.00 0.00 O HETATM 2010 O3P PTR B1139 7.800 3.104 -8.156 1.00 0.00 O HETATM 0 HE2 PTR B1139 4.770 3.657 -10.745 1.00 0.00 H new HETATM 0 HE1 PTR B1139 4.030 1.367 -7.168 1.00 0.00 H new HETATM 0 HD2 PTR B1139 3.256 2.119 -12.014 1.00 0.00 H new HETATM 0 HD1 PTR B1139 2.172 0.166 -8.299 1.00 0.00 H new HETATM 0 HB3 PTR B1139 1.327 0.846 -11.974 1.00 0.00 H new HETATM 0 HB2 PTR B1139 0.499 0.689 -10.438 1.00 0.00 H new HETATM 0 HA PTR B1139 1.399 -1.603 -10.283 1.00 0.00 H new ATOM 2019 N VAL B1140 -1.014 -1.912 -10.412 1.00 0.00 N ATOM 2020 CA VAL B1140 -2.363 -2.551 -10.226 1.00 0.00 C ATOM 2021 C VAL B1140 -3.585 -1.769 -10.476 1.00 0.00 C ATOM 2022 O VAL B1140 -4.678 -2.297 -10.320 1.00 0.00 O ATOM 2023 CB VAL B1140 -2.389 -3.374 -8.911 1.00 0.00 C ATOM 2024 CG1 VAL B1140 -3.631 -4.087 -8.395 1.00 0.00 C ATOM 2025 CG2 VAL B1140 -1.350 -4.504 -9.022 1.00 0.00 C ATOM 0 H VAL B1140 -0.655 -1.611 -9.506 1.00 0.00 H new ATOM 0 HA VAL B1140 -2.441 -3.213 -11.088 1.00 0.00 H new ATOM 0 HB VAL B1140 -2.238 -2.557 -8.205 1.00 0.00 H new ATOM 0 HG11 VAL B1140 -3.397 -4.593 -7.458 1.00 0.00 H new ATOM 0 HG12 VAL B1140 -4.424 -3.359 -8.226 1.00 0.00 H new ATOM 0 HG13 VAL B1140 -3.962 -4.820 -9.131 1.00 0.00 H new ATOM 0 HG21 VAL B1140 -1.354 -5.094 -8.105 1.00 0.00 H new ATOM 0 HG22 VAL B1140 -1.599 -5.146 -9.867 1.00 0.00 H new ATOM 0 HG23 VAL B1140 -0.360 -4.074 -9.172 1.00 0.00 H new ATOM 2035 N ASN B1141 -3.462 -0.502 -10.854 1.00 0.00 N ATOM 2036 CA ASN B1141 -4.707 0.048 -11.379 1.00 0.00 C ATOM 2037 C ASN B1141 -4.829 -0.818 -12.694 1.00 0.00 C ATOM 2038 O ASN B1141 -5.950 -0.963 -13.172 1.00 0.00 O ATOM 2039 CB ASN B1141 -4.705 1.558 -11.605 1.00 0.00 C ATOM 2040 CG ASN B1141 -4.661 2.413 -10.356 1.00 0.00 C ATOM 2041 OD1 ASN B1141 -5.405 3.358 -10.219 1.00 0.00 O ATOM 2042 ND2 ASN B1141 -3.807 2.121 -9.398 1.00 0.00 N ATOM 0 H ASN B1141 -2.637 0.096 -10.819 1.00 0.00 H new ATOM 0 HA ASN B1141 -5.557 -0.022 -10.700 1.00 0.00 H new ATOM 0 HB2 ASN B1141 -3.846 1.812 -12.226 1.00 0.00 H new ATOM 0 HB3 ASN B1141 -5.598 1.822 -12.172 1.00 0.00 H new ATOM 0 HD21 ASN B1141 -3.777 2.689 -8.551 1.00 0.00 H new ATOM 0 HD22 ASN B1141 -3.175 1.327 -9.502 1.00 0.00 H new ATOM 2049 N GLN B1142 -3.713 -1.474 -13.183 1.00 0.00 N ATOM 2050 CA GLN B1142 -3.710 -2.395 -14.282 1.00 0.00 C ATOM 2051 C GLN B1142 -3.021 -3.791 -14.290 1.00 0.00 C ATOM 2052 O GLN B1142 -3.123 -4.482 -15.309 1.00 0.00 O ATOM 2053 CB GLN B1142 -3.190 -1.552 -15.459 1.00 0.00 C ATOM 2054 CG GLN B1142 -3.765 -0.150 -15.778 1.00 0.00 C ATOM 2055 CD GLN B1142 -5.280 -0.041 -15.960 1.00 0.00 C ATOM 2056 OE1 GLN B1142 -5.975 -0.984 -16.320 1.00 0.00 O ATOM 2057 NE2 GLN B1142 -5.843 1.133 -15.721 1.00 0.00 N ATOM 0 H GLN B1142 -2.786 -1.341 -12.779 1.00 0.00 H new ATOM 0 HA GLN B1142 -4.730 -2.780 -14.277 1.00 0.00 H new ATOM 0 HB2 GLN B1142 -2.118 -1.425 -15.306 1.00 0.00 H new ATOM 0 HB3 GLN B1142 -3.315 -2.156 -16.358 1.00 0.00 H new ATOM 0 HG2 GLN B1142 -3.472 0.526 -14.975 1.00 0.00 H new ATOM 0 HG3 GLN B1142 -3.288 0.211 -16.689 1.00 0.00 H new ATOM 0 HE21 GLN B1142 -5.270 1.922 -15.421 1.00 0.00 H new ATOM 0 HE22 GLN B1142 -6.850 1.249 -15.837 1.00 0.00 H new ATOM 2066 N PRO B1143 -2.424 -4.293 -13.192 1.00 0.00 N ATOM 2067 CA PRO B1143 -1.014 -4.766 -13.211 1.00 0.00 C ATOM 2068 C PRO B1143 -0.279 -4.481 -14.556 1.00 0.00 C ATOM 2069 O PRO B1143 0.205 -5.376 -15.250 1.00 0.00 O ATOM 2070 CB PRO B1143 -1.024 -6.243 -12.777 1.00 0.00 C ATOM 2071 CG PRO B1143 -2.492 -6.650 -12.826 1.00 0.00 C ATOM 2072 CD PRO B1143 -3.195 -5.336 -12.515 1.00 0.00 C ATOM 0 HA PRO B1143 -0.413 -4.195 -12.504 1.00 0.00 H new ATOM 0 HB2 PRO B1143 -0.420 -6.856 -13.446 1.00 0.00 H new ATOM 0 HB3 PRO B1143 -0.613 -6.364 -11.775 1.00 0.00 H new ATOM 0 HG2 PRO B1143 -2.774 -7.043 -13.803 1.00 0.00 H new ATOM 0 HG3 PRO B1143 -2.726 -7.422 -12.093 1.00 0.00 H new ATOM 0 HD2 PRO B1143 -4.225 -5.352 -12.870 1.00 0.00 H new ATOM 0 HD3 PRO B1143 -3.231 -5.158 -11.440 1.00 0.00 H new ATOM 2080 N ASP B1144 -0.238 -3.189 -14.887 1.00 0.00 N ATOM 2081 CA ASP B1144 0.233 -2.474 -16.081 1.00 0.00 C ATOM 2082 C ASP B1144 -0.120 -3.095 -17.459 1.00 0.00 C ATOM 2083 O ASP B1144 -1.178 -2.725 -18.021 1.00 0.00 O ATOM 2084 CB ASP B1144 1.711 -2.077 -15.966 1.00 0.00 C ATOM 2085 CG ASP B1144 2.198 -1.213 -17.155 1.00 0.00 C ATOM 2086 OD1 ASP B1144 1.561 -0.170 -17.454 1.00 0.00 O ATOM 2087 OD2 ASP B1144 3.246 -1.538 -17.767 1.00 0.00 O ATOM 2088 OXT ASP B1144 0.665 -3.901 -18.014 1.00 0.00 O ATOM 0 H ASP B1144 -0.592 -2.510 -14.213 1.00 0.00 H new ATOM 0 HA ASP B1144 -0.368 -1.565 -16.081 1.00 0.00 H new ATOM 0 HB2 ASP B1144 1.863 -1.527 -15.038 1.00 0.00 H new ATOM 0 HB3 ASP B1144 2.320 -2.979 -15.905 1.00 0.00 H new TER 2093 ASP B1144