USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 843 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -103:sc= 0.0372 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0899 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -42:sc= 1.12 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= -1.34 USER MOD Single : A 25 LYS NZ :NH3+ -177:sc= 0.0996 (180deg=0.0971) USER MOD Single : A 26 HIS : no HD1:sc= -4.29! C(o=-4.3!,f=-12!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.116 X(o=-0.12,f=0) USER MOD Single : A 44 GLN : amide:sc= -0.0172 K(o=-0.017,f=-0.6) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 TYR OH : rot 14:sc= -4.84! USER MOD Single : A 60 MET CE :methyl 161:sc= -0.317 (180deg=-1.27) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot -87:sc= 0.232 USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00879) USER MOD Single : A 95 GLN : amide:sc=-0.00617 X(o=-0.0062,f=-0.22) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.0434 USER MOD Single : A 100 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0635) USER MOD Single : A 103 GLN : amide:sc=-0.00301 X(o=-0.003,f=0) USER MOD Single : A 104 LYS NZ :NH3+ -177:sc= -0.8! (180deg=-0.956!) USER MOD Single : A 106 SER OG : rot -43:sc= 0.0601 USER MOD Single : A 109 SER OG : rot 19:sc= 0.268 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 0.146 -20.109 16.902 1.00 0.00 N ATOM 2 CA GLY A 1 -1.288 -20.119 16.666 1.00 0.00 C ATOM 3 C GLY A 1 -1.857 -18.698 16.683 1.00 0.00 C ATOM 4 O GLY A 1 -1.355 -17.834 17.400 1.00 0.00 O ATOM 0 H1 GLY A 1 0.647 -20.253 16.002 1.00 0.00 H new ATOM 0 H2 GLY A 1 0.424 -19.194 17.310 1.00 0.00 H new ATOM 0 H3 GLY A 1 0.394 -20.873 17.563 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -1.499 -20.587 15.705 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.781 -20.721 17.429 1.00 0.00 H new ATOM 8 N SER A 2 -2.896 -18.502 15.885 1.00 0.00 N ATOM 9 CA SER A 2 -3.538 -17.201 15.799 1.00 0.00 C ATOM 10 C SER A 2 -4.938 -17.347 15.199 1.00 0.00 C ATOM 11 O SER A 2 -5.103 -17.950 14.140 1.00 0.00 O ATOM 12 CB SER A 2 -2.702 -16.228 14.965 1.00 0.00 C ATOM 13 OG SER A 2 -2.848 -14.882 15.409 1.00 0.00 O ATOM 0 H SER A 2 -3.309 -19.222 15.292 1.00 0.00 H new ATOM 0 HA SER A 2 -3.622 -16.794 16.807 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.652 -16.515 15.018 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.000 -16.299 13.919 1.00 0.00 H new ATOM 0 HG SER A 2 -2.297 -14.292 14.852 1.00 0.00 H new ATOM 19 N SER A 3 -5.910 -16.784 15.902 1.00 0.00 N ATOM 20 CA SER A 3 -7.290 -16.844 15.452 1.00 0.00 C ATOM 21 C SER A 3 -8.169 -15.965 16.344 1.00 0.00 C ATOM 22 O SER A 3 -7.785 -15.628 17.462 1.00 0.00 O ATOM 23 CB SER A 3 -7.807 -18.284 15.451 1.00 0.00 C ATOM 24 OG SER A 3 -9.177 -18.359 15.069 1.00 0.00 O ATOM 0 H SER A 3 -5.769 -16.284 16.780 1.00 0.00 H new ATOM 0 HA SER A 3 -7.333 -16.471 14.429 1.00 0.00 H new ATOM 0 HB2 SER A 3 -7.207 -18.884 14.767 1.00 0.00 H new ATOM 0 HB3 SER A 3 -7.684 -18.714 16.445 1.00 0.00 H new ATOM 0 HG SER A 3 -9.469 -19.295 15.079 1.00 0.00 H new ATOM 30 N GLY A 4 -9.334 -15.620 15.815 1.00 0.00 N ATOM 31 CA GLY A 4 -10.271 -14.786 16.549 1.00 0.00 C ATOM 32 C GLY A 4 -11.104 -13.927 15.595 1.00 0.00 C ATOM 33 O GLY A 4 -12.329 -13.891 15.696 1.00 0.00 O ATOM 0 H GLY A 4 -9.650 -15.903 14.887 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.930 -15.414 17.148 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.727 -14.144 17.241 1.00 0.00 H new ATOM 37 N SER A 5 -10.405 -13.257 14.691 1.00 0.00 N ATOM 38 CA SER A 5 -11.065 -12.400 13.720 1.00 0.00 C ATOM 39 C SER A 5 -12.312 -13.095 13.171 1.00 0.00 C ATOM 40 O SER A 5 -13.430 -12.622 13.372 1.00 0.00 O ATOM 41 CB SER A 5 -10.117 -12.031 12.578 1.00 0.00 C ATOM 42 OG SER A 5 -9.162 -11.049 12.972 1.00 0.00 O ATOM 0 H SER A 5 -9.389 -13.290 14.610 1.00 0.00 H new ATOM 0 HA SER A 5 -11.362 -11.479 14.222 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.597 -12.926 12.236 1.00 0.00 H new ATOM 0 HB3 SER A 5 -10.695 -11.656 11.734 1.00 0.00 H new ATOM 0 HG SER A 5 -8.574 -10.842 12.215 1.00 0.00 H new ATOM 48 N SER A 6 -12.079 -14.206 12.489 1.00 0.00 N ATOM 49 CA SER A 6 -13.171 -14.971 11.909 1.00 0.00 C ATOM 50 C SER A 6 -14.060 -14.057 11.065 1.00 0.00 C ATOM 51 O SER A 6 -13.828 -12.851 10.996 1.00 0.00 O ATOM 52 CB SER A 6 -13.998 -15.661 12.996 1.00 0.00 C ATOM 53 OG SER A 6 -14.964 -14.784 13.568 1.00 0.00 O ATOM 0 H SER A 6 -11.151 -14.595 12.325 1.00 0.00 H new ATOM 0 HA SER A 6 -12.745 -15.744 11.269 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.502 -16.529 12.572 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.334 -16.029 13.778 1.00 0.00 H new ATOM 0 HG SER A 6 -14.563 -13.901 13.706 1.00 0.00 H new ATOM 59 N GLY A 7 -15.060 -14.665 10.444 1.00 0.00 N ATOM 60 CA GLY A 7 -15.985 -13.921 9.607 1.00 0.00 C ATOM 61 C GLY A 7 -17.162 -14.798 9.176 1.00 0.00 C ATOM 62 O GLY A 7 -17.218 -15.979 9.516 1.00 0.00 O ATOM 0 H GLY A 7 -15.250 -15.665 10.504 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -16.355 -13.052 10.151 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -15.464 -13.547 8.726 1.00 0.00 H new ATOM 66 N ALA A 8 -18.074 -14.187 8.435 1.00 0.00 N ATOM 67 CA ALA A 8 -19.247 -14.898 7.954 1.00 0.00 C ATOM 68 C ALA A 8 -19.004 -15.359 6.515 1.00 0.00 C ATOM 69 O ALA A 8 -18.043 -14.932 5.877 1.00 0.00 O ATOM 70 CB ALA A 8 -20.477 -13.996 8.077 1.00 0.00 C ATOM 0 H ALA A 8 -18.025 -13.207 8.156 1.00 0.00 H new ATOM 0 HA ALA A 8 -19.432 -15.786 8.558 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -21.357 -14.529 7.716 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -20.623 -13.720 9.121 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -20.329 -13.095 7.481 1.00 0.00 H new ATOM 76 N PRO A 9 -19.915 -16.247 6.035 1.00 0.00 N ATOM 77 CA PRO A 9 -19.809 -16.771 4.684 1.00 0.00 C ATOM 78 C PRO A 9 -20.237 -15.723 3.655 1.00 0.00 C ATOM 79 O PRO A 9 -21.029 -14.833 3.962 1.00 0.00 O ATOM 80 CB PRO A 9 -20.690 -18.010 4.672 1.00 0.00 C ATOM 81 CG PRO A 9 -21.616 -17.874 5.869 1.00 0.00 C ATOM 82 CD PRO A 9 -21.065 -16.775 6.763 1.00 0.00 C ATOM 0 HA PRO A 9 -18.785 -17.025 4.410 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -21.258 -18.076 3.744 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -20.090 -18.917 4.744 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -22.627 -17.630 5.543 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -21.675 -18.816 6.415 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -21.810 -16.000 6.943 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -20.771 -17.167 7.737 1.00 0.00 H new ATOM 90 N ALA A 10 -19.694 -15.863 2.454 1.00 0.00 N ATOM 91 CA ALA A 10 -20.010 -14.939 1.378 1.00 0.00 C ATOM 92 C ALA A 10 -19.359 -15.430 0.083 1.00 0.00 C ATOM 93 O ALA A 10 -18.587 -16.387 0.096 1.00 0.00 O ATOM 94 CB ALA A 10 -19.553 -13.530 1.763 1.00 0.00 C ATOM 0 H ALA A 10 -19.038 -16.602 2.203 1.00 0.00 H new ATOM 0 HA ALA A 10 -21.086 -14.898 1.211 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -19.790 -12.837 0.956 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -20.066 -13.217 2.672 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -18.477 -13.531 1.936 1.00 0.00 H new ATOM 100 N GLU A 11 -19.695 -14.751 -1.004 1.00 0.00 N ATOM 101 CA GLU A 11 -19.153 -15.106 -2.305 1.00 0.00 C ATOM 102 C GLU A 11 -17.687 -14.679 -2.404 1.00 0.00 C ATOM 103 O GLU A 11 -17.287 -13.678 -1.811 1.00 0.00 O ATOM 104 CB GLU A 11 -19.982 -14.487 -3.432 1.00 0.00 C ATOM 105 CG GLU A 11 -21.262 -15.289 -3.676 1.00 0.00 C ATOM 106 CD GLU A 11 -22.315 -14.976 -2.611 1.00 0.00 C ATOM 107 OE1 GLU A 11 -22.839 -13.842 -2.646 1.00 0.00 O ATOM 108 OE2 GLU A 11 -22.573 -15.879 -1.786 1.00 0.00 O ATOM 0 H GLU A 11 -20.336 -13.957 -1.011 1.00 0.00 H new ATOM 0 HA GLU A 11 -19.204 -16.189 -2.414 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -20.236 -13.458 -3.178 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -19.390 -14.453 -4.347 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -21.659 -15.056 -4.664 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -21.035 -16.355 -3.666 1.00 0.00 H new ATOM 115 N PRO A 12 -16.906 -15.479 -3.177 1.00 0.00 N ATOM 116 CA PRO A 12 -15.493 -15.194 -3.361 1.00 0.00 C ATOM 117 C PRO A 12 -15.291 -14.016 -4.316 1.00 0.00 C ATOM 118 O PRO A 12 -16.259 -13.440 -4.810 1.00 0.00 O ATOM 119 CB PRO A 12 -14.895 -16.491 -3.882 1.00 0.00 C ATOM 120 CG PRO A 12 -16.063 -17.306 -4.410 1.00 0.00 C ATOM 121 CD PRO A 12 -17.345 -16.673 -3.894 1.00 0.00 C ATOM 0 HA PRO A 12 -15.002 -14.887 -2.438 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -14.167 -16.297 -4.669 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -14.372 -17.026 -3.089 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -16.056 -17.321 -5.500 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -15.988 -18.341 -4.077 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -18.018 -16.418 -4.713 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -17.886 -17.353 -3.236 1.00 0.00 H new ATOM 129 N ALA A 13 -14.027 -13.692 -4.547 1.00 0.00 N ATOM 130 CA ALA A 13 -13.686 -12.593 -5.434 1.00 0.00 C ATOM 131 C ALA A 13 -12.195 -12.278 -5.298 1.00 0.00 C ATOM 132 O ALA A 13 -11.606 -12.492 -4.240 1.00 0.00 O ATOM 133 CB ALA A 13 -14.569 -11.385 -5.113 1.00 0.00 C ATOM 0 H ALA A 13 -13.227 -14.172 -4.135 1.00 0.00 H new ATOM 0 HA ALA A 13 -13.872 -12.866 -6.473 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -14.313 -10.560 -5.778 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -15.616 -11.653 -5.253 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -14.407 -11.080 -4.079 1.00 0.00 H new ATOM 139 N ALA A 14 -11.628 -11.774 -6.384 1.00 0.00 N ATOM 140 CA ALA A 14 -10.217 -11.427 -6.399 1.00 0.00 C ATOM 141 C ALA A 14 -9.896 -10.674 -7.692 1.00 0.00 C ATOM 142 O ALA A 14 -10.569 -10.857 -8.705 1.00 0.00 O ATOM 143 CB ALA A 14 -9.378 -12.696 -6.239 1.00 0.00 C ATOM 0 H ALA A 14 -12.120 -11.598 -7.260 1.00 0.00 H new ATOM 0 HA ALA A 14 -9.974 -10.769 -5.565 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -8.319 -12.436 -6.250 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -9.623 -13.178 -5.292 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -9.592 -13.380 -7.060 1.00 0.00 H new ATOM 149 N PRO A 15 -8.839 -9.821 -7.613 1.00 0.00 N ATOM 150 CA PRO A 15 -8.420 -9.040 -8.764 1.00 0.00 C ATOM 151 C PRO A 15 -7.683 -9.914 -9.781 1.00 0.00 C ATOM 152 O PRO A 15 -7.536 -11.118 -9.579 1.00 0.00 O ATOM 153 CB PRO A 15 -7.551 -7.932 -8.192 1.00 0.00 C ATOM 154 CG PRO A 15 -7.136 -8.400 -6.807 1.00 0.00 C ATOM 155 CD PRO A 15 -8.019 -9.579 -6.430 1.00 0.00 C ATOM 0 HA PRO A 15 -9.261 -8.623 -9.318 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -6.679 -7.755 -8.822 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -8.101 -6.993 -8.138 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -6.086 -8.692 -6.801 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -7.246 -7.593 -6.082 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -7.422 -10.455 -6.176 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -8.636 -9.350 -5.561 1.00 0.00 H new ATOM 163 N LYS A 16 -7.239 -9.273 -10.852 1.00 0.00 N ATOM 164 CA LYS A 16 -6.520 -9.977 -11.901 1.00 0.00 C ATOM 165 C LYS A 16 -5.350 -9.115 -12.378 1.00 0.00 C ATOM 166 O LYS A 16 -5.545 -8.152 -13.118 1.00 0.00 O ATOM 167 CB LYS A 16 -7.477 -10.390 -13.021 1.00 0.00 C ATOM 168 CG LYS A 16 -7.220 -11.835 -13.456 1.00 0.00 C ATOM 169 CD LYS A 16 -8.502 -12.485 -13.981 1.00 0.00 C ATOM 170 CE LYS A 16 -8.299 -13.032 -15.395 1.00 0.00 C ATOM 171 NZ LYS A 16 -9.586 -13.071 -16.126 1.00 0.00 N ATOM 0 H LYS A 16 -7.363 -8.274 -11.016 1.00 0.00 H new ATOM 0 HA LYS A 16 -6.096 -10.905 -11.517 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -8.507 -10.287 -12.681 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -7.354 -9.722 -13.874 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -6.454 -11.855 -14.231 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -6.835 -12.409 -12.613 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -8.804 -13.293 -13.314 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -9.311 -11.754 -13.982 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -7.587 -12.407 -15.934 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -7.871 -14.033 -15.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -9.430 -13.445 -17.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -10.255 -13.686 -15.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -9.979 -12.110 -16.189 1.00 0.00 H new ATOM 185 N SER A 17 -4.160 -9.492 -11.935 1.00 0.00 N ATOM 186 CA SER A 17 -2.958 -8.765 -12.308 1.00 0.00 C ATOM 187 C SER A 17 -1.720 -9.497 -11.785 1.00 0.00 C ATOM 188 O SER A 17 -1.838 -10.462 -11.031 1.00 0.00 O ATOM 189 CB SER A 17 -2.992 -7.332 -11.773 1.00 0.00 C ATOM 190 OG SER A 17 -3.441 -7.277 -10.422 1.00 0.00 O ATOM 0 H SER A 17 -4.002 -10.291 -11.321 1.00 0.00 H new ATOM 0 HA SER A 17 -2.912 -8.717 -13.396 1.00 0.00 H new ATOM 0 HB2 SER A 17 -1.996 -6.896 -11.842 1.00 0.00 H new ATOM 0 HB3 SER A 17 -3.649 -6.727 -12.398 1.00 0.00 H new ATOM 0 HG SER A 17 -3.447 -6.346 -10.117 1.00 0.00 H new ATOM 196 N GLY A 18 -0.562 -9.010 -12.205 1.00 0.00 N ATOM 197 CA GLY A 18 0.696 -9.606 -11.788 1.00 0.00 C ATOM 198 C GLY A 18 1.851 -8.614 -11.945 1.00 0.00 C ATOM 199 O GLY A 18 2.807 -8.879 -12.672 1.00 0.00 O ATOM 0 H GLY A 18 -0.468 -8.209 -12.830 1.00 0.00 H new ATOM 0 HA2 GLY A 18 0.625 -9.925 -10.748 1.00 0.00 H new ATOM 0 HA3 GLY A 18 0.895 -10.498 -12.382 1.00 0.00 H new ATOM 203 N GLU A 19 1.724 -7.493 -11.251 1.00 0.00 N ATOM 204 CA GLU A 19 2.745 -6.460 -11.305 1.00 0.00 C ATOM 205 C GLU A 19 2.935 -5.975 -12.743 1.00 0.00 C ATOM 206 O GLU A 19 2.632 -6.698 -13.691 1.00 0.00 O ATOM 207 CB GLU A 19 4.065 -6.964 -10.718 1.00 0.00 C ATOM 208 CG GLU A 19 3.919 -7.275 -9.227 1.00 0.00 C ATOM 209 CD GLU A 19 4.209 -8.751 -8.944 1.00 0.00 C ATOM 210 OE1 GLU A 19 5.081 -9.303 -9.649 1.00 0.00 O ATOM 211 OE2 GLU A 19 3.553 -9.293 -8.028 1.00 0.00 O ATOM 0 H GLU A 19 0.930 -7.277 -10.648 1.00 0.00 H new ATOM 0 HA GLU A 19 2.413 -5.617 -10.699 1.00 0.00 H new ATOM 0 HB2 GLU A 19 4.385 -7.860 -11.250 1.00 0.00 H new ATOM 0 HB3 GLU A 19 4.842 -6.213 -10.862 1.00 0.00 H new ATOM 0 HG2 GLU A 19 4.603 -6.650 -8.653 1.00 0.00 H new ATOM 0 HG3 GLU A 19 2.909 -7.029 -8.898 1.00 0.00 H new ATOM 218 N ALA A 20 3.434 -4.753 -12.860 1.00 0.00 N ATOM 219 CA ALA A 20 3.667 -4.163 -14.167 1.00 0.00 C ATOM 220 C ALA A 20 4.268 -2.767 -13.991 1.00 0.00 C ATOM 221 O ALA A 20 3.932 -2.057 -13.045 1.00 0.00 O ATOM 222 CB ALA A 20 2.358 -4.138 -14.958 1.00 0.00 C ATOM 0 H ALA A 20 3.683 -4.156 -12.072 1.00 0.00 H new ATOM 0 HA ALA A 20 4.380 -4.760 -14.736 1.00 0.00 H new ATOM 0 HB1 ALA A 20 2.534 -3.695 -15.938 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.987 -5.156 -15.081 1.00 0.00 H new ATOM 0 HB3 ALA A 20 1.619 -3.545 -14.419 1.00 0.00 H new ATOM 228 N GLU A 21 5.147 -2.414 -14.918 1.00 0.00 N ATOM 229 CA GLU A 21 5.798 -1.116 -14.878 1.00 0.00 C ATOM 230 C GLU A 21 4.782 -0.023 -14.542 1.00 0.00 C ATOM 231 O GLU A 21 3.620 -0.107 -14.939 1.00 0.00 O ATOM 232 CB GLU A 21 6.509 -0.817 -16.199 1.00 0.00 C ATOM 233 CG GLU A 21 7.870 -1.514 -16.260 1.00 0.00 C ATOM 234 CD GLU A 21 8.498 -1.370 -17.648 1.00 0.00 C ATOM 235 OE1 GLU A 21 9.224 -0.371 -17.840 1.00 0.00 O ATOM 236 OE2 GLU A 21 8.238 -2.261 -18.484 1.00 0.00 O ATOM 0 H GLU A 21 5.423 -3.005 -15.702 1.00 0.00 H new ATOM 0 HA GLU A 21 6.555 -1.135 -14.094 1.00 0.00 H new ATOM 0 HB2 GLU A 21 5.889 -1.148 -17.032 1.00 0.00 H new ATOM 0 HB3 GLU A 21 6.642 0.259 -16.309 1.00 0.00 H new ATOM 0 HG2 GLU A 21 8.535 -1.087 -15.510 1.00 0.00 H new ATOM 0 HG3 GLU A 21 7.753 -2.570 -16.018 1.00 0.00 H new ATOM 243 N THR A 22 5.256 0.978 -13.815 1.00 0.00 N ATOM 244 CA THR A 22 4.402 2.087 -13.422 1.00 0.00 C ATOM 245 C THR A 22 5.250 3.296 -13.020 1.00 0.00 C ATOM 246 O THR A 22 6.365 3.139 -12.524 1.00 0.00 O ATOM 247 CB THR A 22 3.475 1.598 -12.308 1.00 0.00 C ATOM 248 OG1 THR A 22 2.274 2.340 -12.505 1.00 0.00 O ATOM 249 CG2 THR A 22 3.953 2.024 -10.919 1.00 0.00 C ATOM 0 H THR A 22 6.220 1.045 -13.488 1.00 0.00 H new ATOM 0 HA THR A 22 3.784 2.425 -14.254 1.00 0.00 H new ATOM 0 HB THR A 22 3.401 0.511 -12.348 1.00 0.00 H new ATOM 0 HG1 THR A 22 1.616 2.084 -11.825 1.00 0.00 H new ATOM 0 HG21 THR A 22 3.259 1.651 -10.165 1.00 0.00 H new ATOM 0 HG22 THR A 22 4.945 1.613 -10.734 1.00 0.00 H new ATOM 0 HG23 THR A 22 3.995 3.112 -10.867 1.00 0.00 H new ATOM 257 N PRO A 23 4.674 4.505 -13.255 1.00 0.00 N ATOM 258 CA PRO A 23 5.364 5.740 -12.923 1.00 0.00 C ATOM 259 C PRO A 23 5.350 5.987 -11.413 1.00 0.00 C ATOM 260 O PRO A 23 4.639 5.306 -10.675 1.00 0.00 O ATOM 261 CB PRO A 23 4.639 6.820 -13.708 1.00 0.00 C ATOM 262 CG PRO A 23 3.290 6.227 -14.084 1.00 0.00 C ATOM 263 CD PRO A 23 3.355 4.728 -13.840 1.00 0.00 C ATOM 0 HA PRO A 23 6.421 5.715 -13.189 1.00 0.00 H new ATOM 0 HB2 PRO A 23 4.516 7.722 -13.109 1.00 0.00 H new ATOM 0 HB3 PRO A 23 5.203 7.102 -14.597 1.00 0.00 H new ATOM 0 HG2 PRO A 23 2.496 6.677 -13.488 1.00 0.00 H new ATOM 0 HG3 PRO A 23 3.060 6.434 -15.129 1.00 0.00 H new ATOM 0 HD2 PRO A 23 2.563 4.402 -13.166 1.00 0.00 H new ATOM 0 HD3 PRO A 23 3.234 4.170 -14.768 1.00 0.00 H new ATOM 271 N PRO A 24 6.164 6.989 -10.987 1.00 0.00 N ATOM 272 CA PRO A 24 6.251 7.335 -9.578 1.00 0.00 C ATOM 273 C PRO A 24 5.009 8.104 -9.124 1.00 0.00 C ATOM 274 O PRO A 24 4.652 9.121 -9.719 1.00 0.00 O ATOM 275 CB PRO A 24 7.531 8.145 -9.450 1.00 0.00 C ATOM 276 CG PRO A 24 7.868 8.617 -10.855 1.00 0.00 C ATOM 277 CD PRO A 24 7.020 7.817 -11.831 1.00 0.00 C ATOM 0 HA PRO A 24 6.284 6.458 -8.931 1.00 0.00 H new ATOM 0 HB2 PRO A 24 7.392 8.991 -8.777 1.00 0.00 H new ATOM 0 HB3 PRO A 24 8.337 7.538 -9.038 1.00 0.00 H new ATOM 0 HG2 PRO A 24 7.666 9.683 -10.958 1.00 0.00 H new ATOM 0 HG3 PRO A 24 8.928 8.472 -11.062 1.00 0.00 H new ATOM 0 HD2 PRO A 24 6.430 8.472 -12.472 1.00 0.00 H new ATOM 0 HD3 PRO A 24 7.641 7.206 -12.486 1.00 0.00 H new ATOM 285 N LYS A 25 4.384 7.590 -8.075 1.00 0.00 N ATOM 286 CA LYS A 25 3.189 8.216 -7.535 1.00 0.00 C ATOM 287 C LYS A 25 3.439 8.610 -6.078 1.00 0.00 C ATOM 288 O LYS A 25 4.466 9.209 -5.760 1.00 0.00 O ATOM 289 CB LYS A 25 1.974 7.306 -7.726 1.00 0.00 C ATOM 290 CG LYS A 25 2.186 5.957 -7.037 1.00 0.00 C ATOM 291 CD LYS A 25 0.971 5.578 -6.188 1.00 0.00 C ATOM 292 CE LYS A 25 0.688 4.076 -6.275 1.00 0.00 C ATOM 293 NZ LYS A 25 -0.653 3.834 -6.852 1.00 0.00 N ATOM 0 H LYS A 25 4.683 6.747 -7.585 1.00 0.00 H new ATOM 0 HA LYS A 25 2.960 9.132 -8.079 1.00 0.00 H new ATOM 0 HB2 LYS A 25 1.085 7.790 -7.320 1.00 0.00 H new ATOM 0 HB3 LYS A 25 1.795 7.151 -8.790 1.00 0.00 H new ATOM 0 HG2 LYS A 25 2.365 5.186 -7.786 1.00 0.00 H new ATOM 0 HG3 LYS A 25 3.074 6.002 -6.407 1.00 0.00 H new ATOM 0 HD2 LYS A 25 1.147 5.859 -5.150 1.00 0.00 H new ATOM 0 HD3 LYS A 25 0.098 6.136 -6.526 1.00 0.00 H new ATOM 0 HE2 LYS A 25 1.447 3.592 -6.889 1.00 0.00 H new ATOM 0 HE3 LYS A 25 0.749 3.630 -5.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -0.850 2.813 -6.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -1.371 4.322 -6.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -0.682 4.197 -7.826 1.00 0.00 H new ATOM 307 N HIS A 26 2.483 8.259 -5.231 1.00 0.00 N ATOM 308 CA HIS A 26 2.587 8.569 -3.815 1.00 0.00 C ATOM 309 C HIS A 26 3.142 7.356 -3.064 1.00 0.00 C ATOM 310 O HIS A 26 2.751 6.222 -3.334 1.00 0.00 O ATOM 311 CB HIS A 26 1.241 9.043 -3.262 1.00 0.00 C ATOM 312 CG HIS A 26 1.328 9.672 -1.892 1.00 0.00 C ATOM 313 ND1 HIS A 26 1.515 8.931 -0.738 1.00 0.00 N ATOM 314 CD2 HIS A 26 1.251 10.977 -1.504 1.00 0.00 C ATOM 315 CE1 HIS A 26 1.547 9.764 0.292 1.00 0.00 C ATOM 316 NE2 HIS A 26 1.383 11.031 -0.184 1.00 0.00 N ATOM 0 H HIS A 26 1.633 7.763 -5.498 1.00 0.00 H new ATOM 0 HA HIS A 26 3.285 9.394 -3.670 1.00 0.00 H new ATOM 0 HB2 HIS A 26 0.809 9.765 -3.955 1.00 0.00 H new ATOM 0 HB3 HIS A 26 0.558 8.194 -3.218 1.00 0.00 H new ATOM 0 HD2 HIS A 26 1.107 11.823 -2.159 1.00 0.00 H new ATOM 0 HE1 HIS A 26 1.680 9.488 1.328 1.00 0.00 H new ATOM 0 HE2 HIS A 26 1.365 11.880 0.381 1.00 0.00 H new ATOM 324 N PRO A 27 4.068 7.645 -2.111 1.00 0.00 N ATOM 325 CA PRO A 27 4.680 6.592 -1.319 1.00 0.00 C ATOM 326 C PRO A 27 3.707 6.064 -0.263 1.00 0.00 C ATOM 327 O PRO A 27 3.702 4.872 0.041 1.00 0.00 O ATOM 328 CB PRO A 27 5.924 7.225 -0.717 1.00 0.00 C ATOM 329 CG PRO A 27 5.716 8.728 -0.814 1.00 0.00 C ATOM 330 CD PRO A 27 4.555 8.977 -1.763 1.00 0.00 C ATOM 0 HA PRO A 27 4.943 5.717 -1.914 1.00 0.00 H new ATOM 0 HB2 PRO A 27 6.057 6.915 0.320 1.00 0.00 H new ATOM 0 HB3 PRO A 27 6.819 6.919 -1.259 1.00 0.00 H new ATOM 0 HG2 PRO A 27 5.503 9.148 0.169 1.00 0.00 H new ATOM 0 HG3 PRO A 27 6.620 9.216 -1.180 1.00 0.00 H new ATOM 0 HD2 PRO A 27 3.775 9.572 -1.287 1.00 0.00 H new ATOM 0 HD3 PRO A 27 4.878 9.524 -2.649 1.00 0.00 H new ATOM 338 N GLY A 28 2.908 6.978 0.268 1.00 0.00 N ATOM 339 CA GLY A 28 1.933 6.619 1.284 1.00 0.00 C ATOM 340 C GLY A 28 1.057 5.455 0.817 1.00 0.00 C ATOM 341 O GLY A 28 0.645 4.621 1.622 1.00 0.00 O ATOM 0 H GLY A 28 2.916 7.966 0.014 1.00 0.00 H new ATOM 0 HA2 GLY A 28 2.447 6.345 2.205 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.307 7.481 1.513 1.00 0.00 H new ATOM 345 N VAL A 29 0.798 5.436 -0.482 1.00 0.00 N ATOM 346 CA VAL A 29 -0.022 4.388 -1.067 1.00 0.00 C ATOM 347 C VAL A 29 0.850 3.164 -1.352 1.00 0.00 C ATOM 348 O VAL A 29 0.574 2.072 -0.857 1.00 0.00 O ATOM 349 CB VAL A 29 -0.737 4.917 -2.312 1.00 0.00 C ATOM 350 CG1 VAL A 29 -1.768 3.908 -2.822 1.00 0.00 C ATOM 351 CG2 VAL A 29 -1.388 6.274 -2.037 1.00 0.00 C ATOM 0 H VAL A 29 1.141 6.130 -1.146 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.800 4.077 -0.370 1.00 0.00 H new ATOM 0 HB VAL A 29 0.011 5.057 -3.093 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -2.262 4.308 -3.707 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -1.268 2.974 -3.077 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -2.510 3.722 -2.046 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.889 6.627 -2.939 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -2.117 6.172 -1.233 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -0.622 6.992 -1.743 1.00 0.00 H new ATOM 361 N LEU A 30 1.884 3.387 -2.150 1.00 0.00 N ATOM 362 CA LEU A 30 2.798 2.315 -2.507 1.00 0.00 C ATOM 363 C LEU A 30 3.127 1.494 -1.258 1.00 0.00 C ATOM 364 O LEU A 30 3.272 0.275 -1.333 1.00 0.00 O ATOM 365 CB LEU A 30 4.032 2.877 -3.216 1.00 0.00 C ATOM 366 CG LEU A 30 3.762 3.716 -4.467 1.00 0.00 C ATOM 367 CD1 LEU A 30 4.807 4.824 -4.620 1.00 0.00 C ATOM 368 CD2 LEU A 30 3.678 2.831 -5.713 1.00 0.00 C ATOM 0 H LEU A 30 2.109 4.294 -2.559 1.00 0.00 H new ATOM 0 HA LEU A 30 2.330 1.637 -3.221 1.00 0.00 H new ATOM 0 HB2 LEU A 30 4.588 3.489 -2.505 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.678 2.044 -3.494 1.00 0.00 H new ATOM 0 HG LEU A 30 2.793 4.201 -4.351 1.00 0.00 H new ATOM 0 HD11 LEU A 30 4.592 5.405 -5.517 1.00 0.00 H new ATOM 0 HD12 LEU A 30 4.775 5.477 -3.748 1.00 0.00 H new ATOM 0 HD13 LEU A 30 5.799 4.380 -4.705 1.00 0.00 H new ATOM 0 HD21 LEU A 30 3.485 3.452 -6.588 1.00 0.00 H new ATOM 0 HD22 LEU A 30 4.620 2.299 -5.846 1.00 0.00 H new ATOM 0 HD23 LEU A 30 2.868 2.111 -5.594 1.00 0.00 H new ATOM 380 N LYS A 31 3.236 2.195 -0.139 1.00 0.00 N ATOM 381 CA LYS A 31 3.545 1.547 1.123 1.00 0.00 C ATOM 382 C LYS A 31 2.659 0.310 1.287 1.00 0.00 C ATOM 383 O LYS A 31 3.078 -0.685 1.876 1.00 0.00 O ATOM 384 CB LYS A 31 3.431 2.542 2.279 1.00 0.00 C ATOM 385 CG LYS A 31 4.714 2.564 3.113 1.00 0.00 C ATOM 386 CD LYS A 31 4.964 3.955 3.698 1.00 0.00 C ATOM 387 CE LYS A 31 6.321 4.018 4.402 1.00 0.00 C ATOM 388 NZ LYS A 31 6.606 5.397 4.857 1.00 0.00 N ATOM 0 H LYS A 31 3.116 3.206 -0.081 1.00 0.00 H new ATOM 0 HA LYS A 31 4.579 1.203 1.130 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.231 3.539 1.887 1.00 0.00 H new ATOM 0 HB3 LYS A 31 2.586 2.273 2.913 1.00 0.00 H new ATOM 0 HG2 LYS A 31 4.640 1.834 3.919 1.00 0.00 H new ATOM 0 HG3 LYS A 31 5.560 2.269 2.493 1.00 0.00 H new ATOM 0 HD2 LYS A 31 4.928 4.700 2.903 1.00 0.00 H new ATOM 0 HD3 LYS A 31 4.172 4.204 4.404 1.00 0.00 H new ATOM 0 HE2 LYS A 31 6.327 3.339 5.255 1.00 0.00 H new ATOM 0 HE3 LYS A 31 7.105 3.683 3.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 7.531 5.422 5.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 6.621 6.037 4.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 5.867 5.703 5.521 1.00 0.00 H new ATOM 402 N VAL A 32 1.450 0.414 0.756 1.00 0.00 N ATOM 403 CA VAL A 32 0.501 -0.684 0.835 1.00 0.00 C ATOM 404 C VAL A 32 0.709 -1.620 -0.357 1.00 0.00 C ATOM 405 O VAL A 32 0.777 -2.837 -0.190 1.00 0.00 O ATOM 406 CB VAL A 32 -0.925 -0.137 0.924 1.00 0.00 C ATOM 407 CG1 VAL A 32 -0.946 1.233 1.606 1.00 0.00 C ATOM 408 CG2 VAL A 32 -1.574 -0.070 -0.460 1.00 0.00 C ATOM 0 H VAL A 32 1.105 1.242 0.269 1.00 0.00 H new ATOM 0 HA VAL A 32 0.668 -1.269 1.740 1.00 0.00 H new ATOM 0 HB VAL A 32 -1.509 -0.824 1.535 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -1.972 1.599 1.656 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.543 1.143 2.615 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -0.338 1.934 1.033 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -2.587 0.322 -0.368 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.988 0.585 -1.105 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -1.610 -1.069 -0.894 1.00 0.00 H new ATOM 418 N GLU A 33 0.805 -1.017 -1.532 1.00 0.00 N ATOM 419 CA GLU A 33 1.004 -1.782 -2.752 1.00 0.00 C ATOM 420 C GLU A 33 2.244 -2.670 -2.625 1.00 0.00 C ATOM 421 O GLU A 33 2.297 -3.754 -3.204 1.00 0.00 O ATOM 422 CB GLU A 33 1.113 -0.858 -3.967 1.00 0.00 C ATOM 423 CG GLU A 33 -0.127 0.029 -4.094 1.00 0.00 C ATOM 424 CD GLU A 33 -0.639 0.053 -5.535 1.00 0.00 C ATOM 425 OE1 GLU A 33 -0.038 0.798 -6.339 1.00 0.00 O ATOM 426 OE2 GLU A 33 -1.620 -0.675 -5.801 1.00 0.00 O ATOM 0 H GLU A 33 0.749 -0.007 -1.666 1.00 0.00 H new ATOM 0 HA GLU A 33 0.135 -2.423 -2.902 1.00 0.00 H new ATOM 0 HB2 GLU A 33 2.003 -0.235 -3.876 1.00 0.00 H new ATOM 0 HB3 GLU A 33 1.233 -1.454 -4.872 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -0.911 -0.339 -3.432 1.00 0.00 H new ATOM 0 HG3 GLU A 33 0.112 1.043 -3.772 1.00 0.00 H new ATOM 433 N ALA A 34 3.210 -2.177 -1.864 1.00 0.00 N ATOM 434 CA ALA A 34 4.445 -2.912 -1.654 1.00 0.00 C ATOM 435 C ALA A 34 4.140 -4.213 -0.908 1.00 0.00 C ATOM 436 O ALA A 34 4.707 -5.259 -1.219 1.00 0.00 O ATOM 437 CB ALA A 34 5.443 -2.029 -0.901 1.00 0.00 C ATOM 0 H ALA A 34 3.162 -1.278 -1.385 1.00 0.00 H new ATOM 0 HA ALA A 34 4.899 -3.178 -2.608 1.00 0.00 H new ATOM 0 HB1 ALA A 34 6.370 -2.580 -0.743 1.00 0.00 H new ATOM 0 HB2 ALA A 34 5.649 -1.133 -1.486 1.00 0.00 H new ATOM 0 HB3 ALA A 34 5.022 -1.744 0.063 1.00 0.00 H new ATOM 443 N ILE A 35 3.243 -4.105 0.062 1.00 0.00 N ATOM 444 CA ILE A 35 2.855 -5.259 0.854 1.00 0.00 C ATOM 445 C ILE A 35 1.865 -6.110 0.056 1.00 0.00 C ATOM 446 O ILE A 35 2.017 -7.328 -0.031 1.00 0.00 O ATOM 447 CB ILE A 35 2.327 -4.819 2.220 1.00 0.00 C ATOM 448 CG1 ILE A 35 3.372 -3.993 2.973 1.00 0.00 C ATOM 449 CG2 ILE A 35 1.849 -6.021 3.037 1.00 0.00 C ATOM 450 CD1 ILE A 35 2.762 -2.700 3.517 1.00 0.00 C ATOM 0 H ILE A 35 2.774 -3.236 0.317 1.00 0.00 H new ATOM 0 HA ILE A 35 3.721 -5.887 1.061 1.00 0.00 H new ATOM 0 HB ILE A 35 1.463 -4.175 2.060 1.00 0.00 H new ATOM 0 HG12 ILE A 35 3.781 -4.580 3.795 1.00 0.00 H new ATOM 0 HG13 ILE A 35 4.202 -3.756 2.307 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.479 -5.680 4.004 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.048 -6.530 2.501 1.00 0.00 H new ATOM 0 HG23 ILE A 35 2.679 -6.711 3.189 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.526 -2.132 4.048 1.00 0.00 H new ATOM 0 HD12 ILE A 35 2.376 -2.104 2.690 1.00 0.00 H new ATOM 0 HD13 ILE A 35 1.949 -2.941 4.201 1.00 0.00 H new ATOM 462 N LEU A 36 0.872 -5.435 -0.505 1.00 0.00 N ATOM 463 CA LEU A 36 -0.143 -6.114 -1.292 1.00 0.00 C ATOM 464 C LEU A 36 0.534 -7.086 -2.260 1.00 0.00 C ATOM 465 O LEU A 36 0.078 -8.216 -2.432 1.00 0.00 O ATOM 466 CB LEU A 36 -1.056 -5.097 -1.980 1.00 0.00 C ATOM 467 CG LEU A 36 -2.259 -4.617 -1.166 1.00 0.00 C ATOM 468 CD1 LEU A 36 -3.037 -3.538 -1.922 1.00 0.00 C ATOM 469 CD2 LEU A 36 -3.152 -5.792 -0.762 1.00 0.00 C ATOM 0 H LEU A 36 0.749 -4.425 -0.430 1.00 0.00 H new ATOM 0 HA LEU A 36 -0.792 -6.706 -0.647 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -0.458 -4.228 -2.254 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -1.422 -5.537 -2.908 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.890 -4.163 -0.246 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -3.887 -3.214 -1.321 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -2.384 -2.687 -2.116 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.395 -3.943 -2.868 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -4.000 -5.423 -0.184 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.515 -6.298 -1.657 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -2.578 -6.494 -0.157 1.00 0.00 H new ATOM 481 N GLU A 37 1.612 -6.612 -2.868 1.00 0.00 N ATOM 482 CA GLU A 37 2.356 -7.426 -3.814 1.00 0.00 C ATOM 483 C GLU A 37 2.811 -8.728 -3.152 1.00 0.00 C ATOM 484 O GLU A 37 2.594 -9.811 -3.692 1.00 0.00 O ATOM 485 CB GLU A 37 3.549 -6.653 -4.382 1.00 0.00 C ATOM 486 CG GLU A 37 3.266 -6.178 -5.808 1.00 0.00 C ATOM 487 CD GLU A 37 4.329 -5.181 -6.275 1.00 0.00 C ATOM 488 OE1 GLU A 37 5.465 -5.284 -5.766 1.00 0.00 O ATOM 489 OE2 GLU A 37 3.980 -4.339 -7.130 1.00 0.00 O ATOM 0 H GLU A 37 1.988 -5.675 -2.724 1.00 0.00 H new ATOM 0 HA GLU A 37 1.697 -7.676 -4.646 1.00 0.00 H new ATOM 0 HB2 GLU A 37 3.767 -5.795 -3.746 1.00 0.00 H new ATOM 0 HB3 GLU A 37 4.435 -7.288 -4.376 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.244 -7.034 -6.483 1.00 0.00 H new ATOM 0 HG3 GLU A 37 2.281 -5.712 -5.851 1.00 0.00 H new ATOM 496 N LYS A 38 3.433 -8.578 -1.992 1.00 0.00 N ATOM 497 CA LYS A 38 3.920 -9.729 -1.250 1.00 0.00 C ATOM 498 C LYS A 38 2.745 -10.649 -0.915 1.00 0.00 C ATOM 499 O LYS A 38 2.841 -11.866 -1.066 1.00 0.00 O ATOM 500 CB LYS A 38 4.718 -9.279 -0.025 1.00 0.00 C ATOM 501 CG LYS A 38 6.120 -8.813 -0.424 1.00 0.00 C ATOM 502 CD LYS A 38 6.676 -7.814 0.593 1.00 0.00 C ATOM 503 CE LYS A 38 8.204 -7.777 0.546 1.00 0.00 C ATOM 504 NZ LYS A 38 8.692 -6.383 0.636 1.00 0.00 N ATOM 0 H LYS A 38 3.611 -7.677 -1.548 1.00 0.00 H new ATOM 0 HA LYS A 38 4.615 -10.308 -1.858 1.00 0.00 H new ATOM 0 HB2 LYS A 38 4.191 -8.469 0.479 1.00 0.00 H new ATOM 0 HB3 LYS A 38 4.793 -10.101 0.687 1.00 0.00 H new ATOM 0 HG2 LYS A 38 6.786 -9.673 -0.496 1.00 0.00 H new ATOM 0 HG3 LYS A 38 6.087 -8.352 -1.411 1.00 0.00 H new ATOM 0 HD2 LYS A 38 6.278 -6.820 0.387 1.00 0.00 H new ATOM 0 HD3 LYS A 38 6.346 -8.088 1.595 1.00 0.00 H new ATOM 0 HE2 LYS A 38 8.613 -8.365 1.367 1.00 0.00 H new ATOM 0 HE3 LYS A 38 8.556 -8.233 -0.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 9.731 -6.376 0.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 8.316 -5.832 -0.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 8.372 -5.960 1.530 1.00 0.00 H new ATOM 518 N VAL A 39 1.662 -10.033 -0.465 1.00 0.00 N ATOM 519 CA VAL A 39 0.469 -10.781 -0.107 1.00 0.00 C ATOM 520 C VAL A 39 0.135 -11.768 -1.228 1.00 0.00 C ATOM 521 O VAL A 39 -0.111 -12.945 -0.970 1.00 0.00 O ATOM 522 CB VAL A 39 -0.679 -9.818 0.203 1.00 0.00 C ATOM 523 CG1 VAL A 39 -1.958 -10.584 0.548 1.00 0.00 C ATOM 524 CG2 VAL A 39 -0.297 -8.854 1.328 1.00 0.00 C ATOM 0 H VAL A 39 1.586 -9.024 -0.340 1.00 0.00 H new ATOM 0 HA VAL A 39 0.641 -11.363 0.798 1.00 0.00 H new ATOM 0 HB VAL A 39 -0.873 -9.228 -0.693 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.759 -9.877 0.764 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.246 -11.211 -0.296 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -1.782 -11.211 1.422 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -1.130 -8.181 1.529 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -0.063 -9.421 2.229 1.00 0.00 H new ATOM 0 HG23 VAL A 39 0.575 -8.273 1.029 1.00 0.00 H new ATOM 534 N GLN A 40 0.138 -11.251 -2.448 1.00 0.00 N ATOM 535 CA GLN A 40 -0.161 -12.072 -3.609 1.00 0.00 C ATOM 536 C GLN A 40 0.479 -13.454 -3.461 1.00 0.00 C ATOM 537 O GLN A 40 -0.189 -14.472 -3.630 1.00 0.00 O ATOM 538 CB GLN A 40 0.301 -11.388 -4.897 1.00 0.00 C ATOM 539 CG GLN A 40 -0.300 -9.987 -5.020 1.00 0.00 C ATOM 540 CD GLN A 40 -0.320 -9.525 -6.479 1.00 0.00 C ATOM 541 OE1 GLN A 40 -1.313 -9.638 -7.179 1.00 0.00 O ATOM 542 NE2 GLN A 40 0.828 -8.999 -6.896 1.00 0.00 N ATOM 0 H GLN A 40 0.343 -10.274 -2.658 1.00 0.00 H new ATOM 0 HA GLN A 40 -1.242 -12.199 -3.672 1.00 0.00 H new ATOM 0 HB2 GLN A 40 1.389 -11.323 -4.908 1.00 0.00 H new ATOM 0 HB3 GLN A 40 0.009 -11.990 -5.758 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -1.314 -9.986 -4.621 1.00 0.00 H new ATOM 0 HG3 GLN A 40 0.279 -9.285 -4.420 1.00 0.00 H new ATOM 0 HE21 GLN A 40 1.621 -8.934 -6.258 1.00 0.00 H new ATOM 0 HE22 GLN A 40 0.916 -8.660 -7.854 1.00 0.00 H new ATOM 551 N GLY A 41 1.766 -13.444 -3.148 1.00 0.00 N ATOM 552 CA GLY A 41 2.504 -14.683 -2.976 1.00 0.00 C ATOM 553 C GLY A 41 1.842 -15.573 -1.921 1.00 0.00 C ATOM 554 O GLY A 41 1.710 -16.780 -2.117 1.00 0.00 O ATOM 0 H GLY A 41 2.317 -12.597 -3.009 1.00 0.00 H new ATOM 0 HA2 GLY A 41 2.555 -15.215 -3.926 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.529 -14.462 -2.679 1.00 0.00 H new ATOM 558 N LEU A 42 1.444 -14.943 -0.826 1.00 0.00 N ATOM 559 CA LEU A 42 0.800 -15.662 0.259 1.00 0.00 C ATOM 560 C LEU A 42 -0.568 -16.164 -0.209 1.00 0.00 C ATOM 561 O LEU A 42 -1.050 -17.192 0.263 1.00 0.00 O ATOM 562 CB LEU A 42 0.739 -14.792 1.516 1.00 0.00 C ATOM 563 CG LEU A 42 2.081 -14.284 2.046 1.00 0.00 C ATOM 564 CD1 LEU A 42 1.882 -13.113 3.011 1.00 0.00 C ATOM 565 CD2 LEU A 42 2.885 -15.420 2.682 1.00 0.00 C ATOM 0 H LEU A 42 1.555 -13.942 -0.667 1.00 0.00 H new ATOM 0 HA LEU A 42 1.385 -16.540 0.535 1.00 0.00 H new ATOM 0 HB2 LEU A 42 0.104 -13.931 1.307 1.00 0.00 H new ATOM 0 HB3 LEU A 42 0.252 -15.363 2.306 1.00 0.00 H new ATOM 0 HG LEU A 42 2.662 -13.911 1.202 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.852 -12.771 3.373 1.00 0.00 H new ATOM 0 HD12 LEU A 42 1.379 -12.296 2.493 1.00 0.00 H new ATOM 0 HD13 LEU A 42 1.273 -13.437 3.855 1.00 0.00 H new ATOM 0 HD21 LEU A 42 3.834 -15.032 3.051 1.00 0.00 H new ATOM 0 HD22 LEU A 42 2.320 -15.845 3.512 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.074 -16.193 1.937 1.00 0.00 H new ATOM 577 N GLU A 43 -1.154 -15.414 -1.131 1.00 0.00 N ATOM 578 CA GLU A 43 -2.457 -15.770 -1.667 1.00 0.00 C ATOM 579 C GLU A 43 -2.318 -16.898 -2.692 1.00 0.00 C ATOM 580 O GLU A 43 -3.245 -17.684 -2.883 1.00 0.00 O ATOM 581 CB GLU A 43 -3.147 -14.552 -2.283 1.00 0.00 C ATOM 582 CG GLU A 43 -4.293 -14.978 -3.204 1.00 0.00 C ATOM 583 CD GLU A 43 -5.435 -15.607 -2.403 1.00 0.00 C ATOM 584 OE1 GLU A 43 -5.148 -16.585 -1.679 1.00 0.00 O ATOM 585 OE2 GLU A 43 -6.568 -15.096 -2.534 1.00 0.00 O ATOM 0 H GLU A 43 -0.751 -14.562 -1.520 1.00 0.00 H new ATOM 0 HA GLU A 43 -3.082 -16.125 -0.847 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -3.532 -13.909 -1.492 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -2.422 -13.965 -2.847 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -4.663 -14.113 -3.754 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -3.926 -15.691 -3.942 1.00 0.00 H new ATOM 592 N GLN A 44 -1.154 -16.942 -3.323 1.00 0.00 N ATOM 593 CA GLN A 44 -0.883 -17.960 -4.323 1.00 0.00 C ATOM 594 C GLN A 44 -0.848 -19.345 -3.674 1.00 0.00 C ATOM 595 O GLN A 44 -1.235 -20.335 -4.293 1.00 0.00 O ATOM 596 CB GLN A 44 0.424 -17.668 -5.063 1.00 0.00 C ATOM 597 CG GLN A 44 0.151 -17.039 -6.430 1.00 0.00 C ATOM 598 CD GLN A 44 0.144 -18.101 -7.531 1.00 0.00 C ATOM 599 OE1 GLN A 44 -0.133 -19.267 -7.303 1.00 0.00 O ATOM 600 NE2 GLN A 44 0.463 -17.635 -8.735 1.00 0.00 N ATOM 0 H GLN A 44 -0.388 -16.289 -3.161 1.00 0.00 H new ATOM 0 HA GLN A 44 -1.689 -17.944 -5.057 1.00 0.00 H new ATOM 0 HB2 GLN A 44 1.042 -16.996 -4.467 1.00 0.00 H new ATOM 0 HB3 GLN A 44 0.988 -18.592 -5.190 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -0.809 -16.523 -6.412 1.00 0.00 H new ATOM 0 HG3 GLN A 44 0.912 -16.289 -6.648 1.00 0.00 H new ATOM 0 HE21 GLN A 44 0.684 -16.647 -8.857 1.00 0.00 H new ATOM 0 HE22 GLN A 44 0.486 -18.266 -9.536 1.00 0.00 H new ATOM 609 N ALA A 45 -0.380 -19.371 -2.434 1.00 0.00 N ATOM 610 CA ALA A 45 -0.289 -20.618 -1.694 1.00 0.00 C ATOM 611 C ALA A 45 -1.696 -21.088 -1.320 1.00 0.00 C ATOM 612 O ALA A 45 -1.985 -22.283 -1.354 1.00 0.00 O ATOM 613 CB ALA A 45 0.605 -20.421 -0.469 1.00 0.00 C ATOM 0 H ALA A 45 -0.060 -18.548 -1.924 1.00 0.00 H new ATOM 0 HA ALA A 45 0.166 -21.396 -2.307 1.00 0.00 H new ATOM 0 HB1 ALA A 45 0.673 -21.357 0.086 1.00 0.00 H new ATOM 0 HB2 ALA A 45 1.601 -20.117 -0.791 1.00 0.00 H new ATOM 0 HB3 ALA A 45 0.179 -19.649 0.172 1.00 0.00 H new ATOM 619 N VAL A 46 -2.534 -20.123 -0.972 1.00 0.00 N ATOM 620 CA VAL A 46 -3.904 -20.423 -0.592 1.00 0.00 C ATOM 621 C VAL A 46 -4.655 -20.978 -1.804 1.00 0.00 C ATOM 622 O VAL A 46 -5.418 -21.936 -1.681 1.00 0.00 O ATOM 623 CB VAL A 46 -4.567 -19.179 0.003 1.00 0.00 C ATOM 624 CG1 VAL A 46 -6.089 -19.326 0.026 1.00 0.00 C ATOM 625 CG2 VAL A 46 -4.023 -18.885 1.403 1.00 0.00 C ATOM 0 H VAL A 46 -2.291 -19.133 -0.945 1.00 0.00 H new ATOM 0 HA VAL A 46 -3.926 -21.189 0.183 1.00 0.00 H new ATOM 0 HB VAL A 46 -4.323 -18.331 -0.637 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -6.535 -18.428 0.454 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -6.457 -19.465 -0.991 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -6.362 -20.190 0.632 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -4.510 -17.996 1.803 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -4.223 -19.734 2.057 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -2.948 -18.715 1.347 1.00 0.00 H new ATOM 635 N ASP A 47 -4.413 -20.354 -2.947 1.00 0.00 N ATOM 636 CA ASP A 47 -5.057 -20.773 -4.180 1.00 0.00 C ATOM 637 C ASP A 47 -4.634 -22.206 -4.509 1.00 0.00 C ATOM 638 O ASP A 47 -5.315 -22.901 -5.262 1.00 0.00 O ATOM 639 CB ASP A 47 -4.644 -19.878 -5.349 1.00 0.00 C ATOM 640 CG ASP A 47 -5.571 -19.933 -6.565 1.00 0.00 C ATOM 641 OD1 ASP A 47 -6.789 -19.741 -6.360 1.00 0.00 O ATOM 642 OD2 ASP A 47 -5.041 -20.167 -7.673 1.00 0.00 O ATOM 0 H ASP A 47 -3.779 -19.561 -3.045 1.00 0.00 H new ATOM 0 HA ASP A 47 -6.135 -20.704 -4.037 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -4.592 -18.848 -4.997 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -3.639 -20.159 -5.664 1.00 0.00 H new ATOM 647 N SER A 48 -3.512 -22.606 -3.928 1.00 0.00 N ATOM 648 CA SER A 48 -2.990 -23.944 -4.151 1.00 0.00 C ATOM 649 C SER A 48 -2.366 -24.483 -2.862 1.00 0.00 C ATOM 650 O SER A 48 -1.205 -24.888 -2.853 1.00 0.00 O ATOM 651 CB SER A 48 -1.961 -23.953 -5.283 1.00 0.00 C ATOM 652 OG SER A 48 -2.120 -25.080 -6.140 1.00 0.00 O ATOM 0 H SER A 48 -2.950 -22.027 -3.304 1.00 0.00 H new ATOM 0 HA SER A 48 -3.818 -24.589 -4.445 1.00 0.00 H new ATOM 0 HB2 SER A 48 -2.056 -23.037 -5.867 1.00 0.00 H new ATOM 0 HB3 SER A 48 -0.957 -23.958 -4.860 1.00 0.00 H new ATOM 0 HG SER A 48 -1.446 -25.048 -6.850 1.00 0.00 H new ATOM 658 N PHE A 49 -3.164 -24.469 -1.805 1.00 0.00 N ATOM 659 CA PHE A 49 -2.704 -24.952 -0.514 1.00 0.00 C ATOM 660 C PHE A 49 -3.254 -26.350 -0.223 1.00 0.00 C ATOM 661 O PHE A 49 -4.242 -26.769 -0.824 1.00 0.00 O ATOM 662 CB PHE A 49 -3.234 -23.979 0.542 1.00 0.00 C ATOM 663 CG PHE A 49 -3.598 -24.641 1.872 1.00 0.00 C ATOM 664 CD1 PHE A 49 -2.620 -25.154 2.666 1.00 0.00 C ATOM 665 CD2 PHE A 49 -4.899 -24.718 2.260 1.00 0.00 C ATOM 666 CE1 PHE A 49 -2.957 -25.769 3.901 1.00 0.00 C ATOM 667 CE2 PHE A 49 -5.236 -25.333 3.495 1.00 0.00 C ATOM 668 CZ PHE A 49 -4.259 -25.845 4.289 1.00 0.00 C ATOM 0 H PHE A 49 -4.126 -24.131 -1.816 1.00 0.00 H new ATOM 0 HA PHE A 49 -1.616 -25.010 -0.505 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -2.482 -23.211 0.724 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -4.115 -23.474 0.146 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -1.587 -25.094 2.357 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -5.676 -24.312 1.629 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.180 -26.176 4.532 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -6.269 -25.394 3.803 1.00 0.00 H new ATOM 0 HZ PHE A 49 -4.516 -26.312 5.228 1.00 0.00 H new ATOM 678 N GLU A 50 -2.590 -27.032 0.699 1.00 0.00 N ATOM 679 CA GLU A 50 -3.000 -28.374 1.076 1.00 0.00 C ATOM 680 C GLU A 50 -2.948 -28.536 2.597 1.00 0.00 C ATOM 681 O GLU A 50 -1.879 -28.448 3.198 1.00 0.00 O ATOM 682 CB GLU A 50 -2.134 -29.427 0.383 1.00 0.00 C ATOM 683 CG GLU A 50 -1.941 -29.091 -1.097 1.00 0.00 C ATOM 684 CD GLU A 50 -0.963 -30.064 -1.758 1.00 0.00 C ATOM 685 OE1 GLU A 50 0.227 -30.018 -1.380 1.00 0.00 O ATOM 686 OE2 GLU A 50 -1.429 -30.833 -2.627 1.00 0.00 O ATOM 0 H GLU A 50 -1.771 -26.680 1.196 1.00 0.00 H new ATOM 0 HA GLU A 50 -4.029 -28.525 0.748 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -1.163 -29.486 0.876 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -2.601 -30.407 0.479 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -2.902 -29.131 -1.611 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -1.568 -28.072 -1.196 1.00 0.00 H new ATOM 693 N GLY A 51 -4.117 -28.771 3.175 1.00 0.00 N ATOM 694 CA GLY A 51 -4.219 -28.946 4.614 1.00 0.00 C ATOM 695 C GLY A 51 -5.567 -28.443 5.133 1.00 0.00 C ATOM 696 O GLY A 51 -6.401 -27.979 4.358 1.00 0.00 O ATOM 0 H GLY A 51 -5.002 -28.844 2.673 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -4.099 -30.000 4.865 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.411 -28.406 5.108 1.00 0.00 H new ATOM 700 N LYS A 52 -5.738 -28.553 6.443 1.00 0.00 N ATOM 701 CA LYS A 52 -6.971 -28.115 7.075 1.00 0.00 C ATOM 702 C LYS A 52 -6.696 -26.858 7.902 1.00 0.00 C ATOM 703 O LYS A 52 -5.636 -26.246 7.774 1.00 0.00 O ATOM 704 CB LYS A 52 -7.595 -29.257 7.881 1.00 0.00 C ATOM 705 CG LYS A 52 -6.880 -30.580 7.600 1.00 0.00 C ATOM 706 CD LYS A 52 -5.760 -30.824 8.613 1.00 0.00 C ATOM 707 CE LYS A 52 -6.129 -31.954 9.577 1.00 0.00 C ATOM 708 NZ LYS A 52 -5.110 -33.027 9.531 1.00 0.00 N ATOM 0 H LYS A 52 -5.044 -28.939 7.083 1.00 0.00 H new ATOM 0 HA LYS A 52 -7.711 -27.846 6.321 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -7.540 -29.028 8.945 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -8.651 -29.350 7.629 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -7.597 -31.400 7.640 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -6.467 -30.567 6.592 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -4.838 -31.075 8.088 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -5.568 -29.910 9.175 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -6.209 -31.563 10.591 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -7.106 -32.360 9.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -5.375 -33.786 10.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -5.053 -33.411 8.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -4.185 -32.639 9.804 1.00 0.00 H new ATOM 722 N LYS A 53 -7.668 -26.509 8.732 1.00 0.00 N ATOM 723 CA LYS A 53 -7.544 -25.335 9.579 1.00 0.00 C ATOM 724 C LYS A 53 -6.765 -25.705 10.843 1.00 0.00 C ATOM 725 O LYS A 53 -6.660 -24.901 11.769 1.00 0.00 O ATOM 726 CB LYS A 53 -8.921 -24.730 9.860 1.00 0.00 C ATOM 727 CG LYS A 53 -9.565 -24.211 8.573 1.00 0.00 C ATOM 728 CD LYS A 53 -11.018 -23.797 8.815 1.00 0.00 C ATOM 729 CE LYS A 53 -11.125 -22.290 9.055 1.00 0.00 C ATOM 730 NZ LYS A 53 -11.633 -22.017 10.418 1.00 0.00 N ATOM 0 H LYS A 53 -8.545 -27.019 8.836 1.00 0.00 H new ATOM 0 HA LYS A 53 -6.977 -24.555 9.071 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -9.566 -25.481 10.316 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -8.824 -23.915 10.577 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -8.998 -23.359 8.196 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -9.526 -24.984 7.805 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -11.628 -24.076 7.956 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -11.415 -24.335 9.676 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -10.148 -21.825 8.925 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -11.791 -21.845 8.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -11.700 -20.990 10.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -12.575 -22.444 10.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -10.982 -22.425 11.119 1.00 0.00 H new ATOM 744 N THR A 54 -6.239 -26.921 10.842 1.00 0.00 N ATOM 745 CA THR A 54 -5.473 -27.406 11.977 1.00 0.00 C ATOM 746 C THR A 54 -4.019 -27.654 11.572 1.00 0.00 C ATOM 747 O THR A 54 -3.108 -27.491 12.382 1.00 0.00 O ATOM 748 CB THR A 54 -6.173 -28.652 12.522 1.00 0.00 C ATOM 749 OG1 THR A 54 -6.258 -28.417 13.925 1.00 0.00 O ATOM 750 CG2 THR A 54 -5.307 -29.908 12.407 1.00 0.00 C ATOM 0 H THR A 54 -6.328 -27.585 10.073 1.00 0.00 H new ATOM 0 HA THR A 54 -5.433 -26.663 12.774 1.00 0.00 H new ATOM 0 HB THR A 54 -7.109 -28.806 11.985 1.00 0.00 H new ATOM 0 HG1 THR A 54 -6.701 -29.177 14.358 1.00 0.00 H new ATOM 0 HG21 THR A 54 -5.851 -30.763 12.808 1.00 0.00 H new ATOM 0 HG22 THR A 54 -5.067 -30.090 11.359 1.00 0.00 H new ATOM 0 HG23 THR A 54 -4.385 -29.767 12.972 1.00 0.00 H new ATOM 758 N ASP A 55 -3.846 -28.045 10.317 1.00 0.00 N ATOM 759 CA ASP A 55 -2.518 -28.318 9.795 1.00 0.00 C ATOM 760 C ASP A 55 -1.607 -27.122 10.080 1.00 0.00 C ATOM 761 O ASP A 55 -2.078 -25.992 10.198 1.00 0.00 O ATOM 762 CB ASP A 55 -2.555 -28.533 8.281 1.00 0.00 C ATOM 763 CG ASP A 55 -2.505 -29.995 7.833 1.00 0.00 C ATOM 764 OD1 ASP A 55 -2.124 -30.834 8.678 1.00 0.00 O ATOM 765 OD2 ASP A 55 -2.849 -30.241 6.657 1.00 0.00 O ATOM 0 H ASP A 55 -4.604 -28.179 9.647 1.00 0.00 H new ATOM 0 HA ASP A 55 -2.145 -29.221 10.279 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.464 -28.079 7.887 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -1.714 -28.003 7.833 1.00 0.00 H new ATOM 770 N LYS A 56 -0.318 -27.412 10.183 1.00 0.00 N ATOM 771 CA LYS A 56 0.663 -26.375 10.453 1.00 0.00 C ATOM 772 C LYS A 56 0.771 -25.453 9.237 1.00 0.00 C ATOM 773 O LYS A 56 0.711 -24.232 9.372 1.00 0.00 O ATOM 774 CB LYS A 56 1.997 -26.996 10.874 1.00 0.00 C ATOM 775 CG LYS A 56 3.099 -25.936 10.938 1.00 0.00 C ATOM 776 CD LYS A 56 2.896 -25.006 12.136 1.00 0.00 C ATOM 777 CE LYS A 56 3.876 -25.342 13.262 1.00 0.00 C ATOM 778 NZ LYS A 56 3.222 -25.188 14.581 1.00 0.00 N ATOM 0 H LYS A 56 0.069 -28.350 10.084 1.00 0.00 H new ATOM 0 HA LYS A 56 0.345 -25.759 11.294 1.00 0.00 H new ATOM 0 HB2 LYS A 56 1.889 -27.473 11.848 1.00 0.00 H new ATOM 0 HB3 LYS A 56 2.278 -27.776 10.167 1.00 0.00 H new ATOM 0 HG2 LYS A 56 4.072 -26.422 11.011 1.00 0.00 H new ATOM 0 HG3 LYS A 56 3.102 -25.353 10.017 1.00 0.00 H new ATOM 0 HD2 LYS A 56 3.035 -23.971 11.825 1.00 0.00 H new ATOM 0 HD3 LYS A 56 1.873 -25.095 12.501 1.00 0.00 H new ATOM 0 HE2 LYS A 56 4.237 -26.364 13.145 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.746 -24.688 13.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 3.901 -25.420 15.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 2.899 -24.206 14.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 2.406 -25.830 14.641 1.00 0.00 H new ATOM 792 N LYS A 57 0.928 -26.072 8.076 1.00 0.00 N ATOM 793 CA LYS A 57 1.045 -25.322 6.837 1.00 0.00 C ATOM 794 C LYS A 57 -0.001 -24.205 6.822 1.00 0.00 C ATOM 795 O LYS A 57 0.312 -23.062 6.492 1.00 0.00 O ATOM 796 CB LYS A 57 0.959 -26.261 5.632 1.00 0.00 C ATOM 797 CG LYS A 57 1.253 -25.511 4.331 1.00 0.00 C ATOM 798 CD LYS A 57 1.727 -26.473 3.239 1.00 0.00 C ATOM 799 CE LYS A 57 3.176 -26.183 2.845 1.00 0.00 C ATOM 800 NZ LYS A 57 3.943 -27.444 2.726 1.00 0.00 N ATOM 0 H LYS A 57 0.977 -27.085 7.967 1.00 0.00 H new ATOM 0 HA LYS A 57 2.023 -24.845 6.771 1.00 0.00 H new ATOM 0 HB2 LYS A 57 1.669 -27.079 5.753 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -0.035 -26.706 5.583 1.00 0.00 H new ATOM 0 HG2 LYS A 57 0.356 -24.989 3.997 1.00 0.00 H new ATOM 0 HG3 LYS A 57 2.015 -24.752 4.509 1.00 0.00 H new ATOM 0 HD2 LYS A 57 1.641 -27.501 3.592 1.00 0.00 H new ATOM 0 HD3 LYS A 57 1.083 -26.382 2.364 1.00 0.00 H new ATOM 0 HE2 LYS A 57 3.201 -25.645 1.898 1.00 0.00 H new ATOM 0 HE3 LYS A 57 3.640 -25.537 3.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 4.925 -27.229 2.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 3.935 -27.943 3.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 3.509 -28.047 1.998 1.00 0.00 H new ATOM 814 N TYR A 58 -1.220 -24.575 7.184 1.00 0.00 N ATOM 815 CA TYR A 58 -2.314 -23.619 7.216 1.00 0.00 C ATOM 816 C TYR A 58 -2.008 -22.468 8.177 1.00 0.00 C ATOM 817 O TYR A 58 -2.277 -21.309 7.868 1.00 0.00 O ATOM 818 CB TYR A 58 -3.532 -24.388 7.731 1.00 0.00 C ATOM 819 CG TYR A 58 -4.758 -23.510 7.990 1.00 0.00 C ATOM 820 CD1 TYR A 58 -4.910 -22.880 9.209 1.00 0.00 C ATOM 821 CD2 TYR A 58 -5.712 -23.349 7.006 1.00 0.00 C ATOM 822 CE1 TYR A 58 -6.064 -22.054 9.454 1.00 0.00 C ATOM 823 CE2 TYR A 58 -6.866 -22.523 7.251 1.00 0.00 C ATOM 824 CZ TYR A 58 -6.985 -21.916 8.462 1.00 0.00 C ATOM 825 OH TYR A 58 -8.075 -21.136 8.694 1.00 0.00 O ATOM 0 H TYR A 58 -1.475 -25.524 7.458 1.00 0.00 H new ATOM 0 HA TYR A 58 -2.478 -23.191 6.227 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -3.796 -25.158 7.006 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -3.262 -24.899 8.655 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -4.163 -23.007 9.979 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -5.593 -23.842 6.053 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -6.195 -21.556 10.403 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -7.620 -22.389 6.490 1.00 0.00 H new ATOM 0 HH TYR A 58 -7.926 -20.596 9.498 1.00 0.00 H new ATOM 835 N LEU A 59 -1.451 -22.830 9.323 1.00 0.00 N ATOM 836 CA LEU A 59 -1.106 -21.842 10.332 1.00 0.00 C ATOM 837 C LEU A 59 -0.038 -20.900 9.772 1.00 0.00 C ATOM 838 O LEU A 59 -0.081 -19.695 10.015 1.00 0.00 O ATOM 839 CB LEU A 59 -0.696 -22.529 11.636 1.00 0.00 C ATOM 840 CG LEU A 59 -1.734 -23.469 12.254 1.00 0.00 C ATOM 841 CD1 LEU A 59 -1.102 -24.351 13.332 1.00 0.00 C ATOM 842 CD2 LEU A 59 -2.936 -22.686 12.786 1.00 0.00 C ATOM 0 H LEU A 59 -1.230 -23.793 9.576 1.00 0.00 H new ATOM 0 HA LEU A 59 -1.974 -21.231 10.579 1.00 0.00 H new ATOM 0 HB2 LEU A 59 0.216 -23.097 11.453 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -0.451 -21.759 12.368 1.00 0.00 H new ATOM 0 HG LEU A 59 -2.103 -24.132 11.471 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -1.861 -25.009 13.755 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -0.306 -24.951 12.891 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.688 -23.722 14.120 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.658 -23.378 13.220 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -2.603 -21.983 13.550 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -3.404 -22.138 11.968 1.00 0.00 H new ATOM 854 N MET A 60 0.894 -21.484 9.034 1.00 0.00 N ATOM 855 CA MET A 60 1.970 -20.712 8.438 1.00 0.00 C ATOM 856 C MET A 60 1.417 -19.608 7.534 1.00 0.00 C ATOM 857 O MET A 60 1.798 -18.445 7.665 1.00 0.00 O ATOM 858 CB MET A 60 2.872 -21.638 7.619 1.00 0.00 C ATOM 859 CG MET A 60 4.111 -22.045 8.420 1.00 0.00 C ATOM 860 SD MET A 60 4.697 -23.639 7.870 1.00 0.00 S ATOM 861 CE MET A 60 4.562 -23.426 6.102 1.00 0.00 C ATOM 0 H MET A 60 0.926 -22.484 8.835 1.00 0.00 H new ATOM 0 HA MET A 60 2.544 -20.247 9.239 1.00 0.00 H new ATOM 0 HB2 MET A 60 2.315 -22.528 7.326 1.00 0.00 H new ATOM 0 HB3 MET A 60 3.177 -21.136 6.701 1.00 0.00 H new ATOM 0 HG2 MET A 60 4.895 -21.298 8.297 1.00 0.00 H new ATOM 0 HG3 MET A 60 3.871 -22.083 9.483 1.00 0.00 H new ATOM 0 HE1 MET A 60 5.184 -24.166 5.598 1.00 0.00 H new ATOM 0 HE2 MET A 60 3.524 -23.557 5.798 1.00 0.00 H new ATOM 0 HE3 MET A 60 4.896 -22.425 5.830 1.00 0.00 H new ATOM 871 N ILE A 61 0.529 -20.010 6.638 1.00 0.00 N ATOM 872 CA ILE A 61 -0.080 -19.070 5.713 1.00 0.00 C ATOM 873 C ILE A 61 -0.900 -18.046 6.500 1.00 0.00 C ATOM 874 O ILE A 61 -0.918 -16.864 6.158 1.00 0.00 O ATOM 875 CB ILE A 61 -0.886 -19.813 4.646 1.00 0.00 C ATOM 876 CG1 ILE A 61 0.038 -20.574 3.692 1.00 0.00 C ATOM 877 CG2 ILE A 61 -1.819 -18.858 3.899 1.00 0.00 C ATOM 878 CD1 ILE A 61 -0.654 -21.819 3.134 1.00 0.00 C ATOM 0 H ILE A 61 0.216 -20.975 6.533 1.00 0.00 H new ATOM 0 HA ILE A 61 0.688 -18.517 5.172 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.514 -20.551 5.145 1.00 0.00 H new ATOM 0 HG12 ILE A 61 0.337 -19.921 2.872 1.00 0.00 H new ATOM 0 HG13 ILE A 61 0.949 -20.864 4.216 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.380 -19.412 3.146 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.512 -18.401 4.605 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -1.230 -18.080 3.413 1.00 0.00 H new ATOM 0 HD11 ILE A 61 0.025 -22.341 2.459 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -0.930 -22.481 3.955 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -1.551 -21.524 2.590 1.00 0.00 H new ATOM 890 N GLU A 62 -1.561 -18.536 7.539 1.00 0.00 N ATOM 891 CA GLU A 62 -2.381 -17.678 8.377 1.00 0.00 C ATOM 892 C GLU A 62 -1.543 -16.528 8.940 1.00 0.00 C ATOM 893 O GLU A 62 -1.840 -15.360 8.693 1.00 0.00 O ATOM 894 CB GLU A 62 -3.039 -18.479 9.502 1.00 0.00 C ATOM 895 CG GLU A 62 -4.143 -17.665 10.181 1.00 0.00 C ATOM 896 CD GLU A 62 -3.551 -16.538 11.030 1.00 0.00 C ATOM 897 OE1 GLU A 62 -2.544 -16.815 11.718 1.00 0.00 O ATOM 898 OE2 GLU A 62 -4.118 -15.426 10.972 1.00 0.00 O ATOM 0 H GLU A 62 -1.545 -19.517 7.819 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.176 -17.255 7.763 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.457 -19.402 9.100 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -2.287 -18.764 10.238 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.807 -17.245 9.425 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.748 -18.319 10.809 1.00 0.00 H new ATOM 905 N GLU A 63 -0.512 -16.899 9.685 1.00 0.00 N ATOM 906 CA GLU A 63 0.370 -15.912 10.285 1.00 0.00 C ATOM 907 C GLU A 63 1.051 -15.078 9.198 1.00 0.00 C ATOM 908 O GLU A 63 1.128 -13.855 9.306 1.00 0.00 O ATOM 909 CB GLU A 63 1.406 -16.582 11.191 1.00 0.00 C ATOM 910 CG GLU A 63 2.690 -16.892 10.419 1.00 0.00 C ATOM 911 CD GLU A 63 3.721 -17.574 11.322 1.00 0.00 C ATOM 912 OE1 GLU A 63 3.677 -17.300 12.541 1.00 0.00 O ATOM 913 OE2 GLU A 63 4.528 -18.354 10.773 1.00 0.00 O ATOM 0 H GLU A 63 -0.268 -17.869 9.887 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.230 -15.246 10.904 1.00 0.00 H new ATOM 0 HB2 GLU A 63 1.633 -15.930 12.034 1.00 0.00 H new ATOM 0 HB3 GLU A 63 0.993 -17.503 11.602 1.00 0.00 H new ATOM 0 HG2 GLU A 63 2.462 -17.536 9.570 1.00 0.00 H new ATOM 0 HG3 GLU A 63 3.108 -15.970 10.016 1.00 0.00 H new ATOM 920 N TYR A 64 1.527 -15.773 8.175 1.00 0.00 N ATOM 921 CA TYR A 64 2.198 -15.111 7.069 1.00 0.00 C ATOM 922 C TYR A 64 1.319 -14.009 6.474 1.00 0.00 C ATOM 923 O TYR A 64 1.797 -12.909 6.201 1.00 0.00 O ATOM 924 CB TYR A 64 2.429 -16.191 6.009 1.00 0.00 C ATOM 925 CG TYR A 64 3.775 -16.907 6.133 1.00 0.00 C ATOM 926 CD1 TYR A 64 4.924 -16.180 6.372 1.00 0.00 C ATOM 927 CD2 TYR A 64 3.841 -18.279 6.006 1.00 0.00 C ATOM 928 CE1 TYR A 64 6.191 -16.854 6.489 1.00 0.00 C ATOM 929 CE2 TYR A 64 5.109 -18.953 6.123 1.00 0.00 C ATOM 930 CZ TYR A 64 6.221 -18.207 6.359 1.00 0.00 C ATOM 931 OH TYR A 64 7.418 -18.843 6.469 1.00 0.00 O ATOM 0 H TYR A 64 1.461 -16.787 8.089 1.00 0.00 H new ATOM 0 HA TYR A 64 3.126 -14.649 7.405 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.629 -16.929 6.076 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.361 -15.736 5.021 1.00 0.00 H new ATOM 0 HD1 TYR A 64 4.873 -15.106 6.471 1.00 0.00 H new ATOM 0 HD2 TYR A 64 2.942 -18.848 5.819 1.00 0.00 H new ATOM 0 HE1 TYR A 64 7.097 -16.297 6.676 1.00 0.00 H new ATOM 0 HE2 TYR A 64 5.175 -20.027 6.025 1.00 0.00 H new ATOM 0 HH TYR A 64 7.288 -19.808 6.355 1.00 0.00 H new ATOM 941 N LEU A 65 0.050 -14.343 6.291 1.00 0.00 N ATOM 942 CA LEU A 65 -0.900 -13.395 5.734 1.00 0.00 C ATOM 943 C LEU A 65 -0.981 -12.167 6.642 1.00 0.00 C ATOM 944 O LEU A 65 -0.617 -11.064 6.235 1.00 0.00 O ATOM 945 CB LEU A 65 -2.251 -14.071 5.491 1.00 0.00 C ATOM 946 CG LEU A 65 -2.310 -15.051 4.318 1.00 0.00 C ATOM 947 CD1 LEU A 65 -3.380 -16.120 4.550 1.00 0.00 C ATOM 948 CD2 LEU A 65 -2.516 -14.311 2.995 1.00 0.00 C ATOM 0 H LEU A 65 -0.342 -15.257 6.518 1.00 0.00 H new ATOM 0 HA LEU A 65 -0.563 -13.047 4.757 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -2.537 -14.604 6.398 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -2.999 -13.295 5.328 1.00 0.00 H new ATOM 0 HG LEU A 65 -1.351 -15.565 4.253 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -3.401 -16.804 3.701 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -3.148 -16.676 5.458 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -4.354 -15.643 4.656 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.554 -15.031 2.178 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -3.452 -13.754 3.032 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.689 -13.620 2.832 1.00 0.00 H new ATOM 960 N THR A 66 -1.459 -12.398 7.856 1.00 0.00 N ATOM 961 CA THR A 66 -1.592 -11.324 8.825 1.00 0.00 C ATOM 962 C THR A 66 -0.300 -10.509 8.899 1.00 0.00 C ATOM 963 O THR A 66 -0.337 -9.280 8.921 1.00 0.00 O ATOM 964 CB THR A 66 -1.998 -11.943 10.164 1.00 0.00 C ATOM 965 OG1 THR A 66 -3.395 -12.188 10.025 1.00 0.00 O ATOM 966 CG2 THR A 66 -1.908 -10.946 11.321 1.00 0.00 C ATOM 0 H THR A 66 -1.759 -13.314 8.191 1.00 0.00 H new ATOM 0 HA THR A 66 -2.368 -10.618 8.529 1.00 0.00 H new ATOM 0 HB THR A 66 -1.361 -12.802 10.374 1.00 0.00 H new ATOM 0 HG1 THR A 66 -3.740 -12.591 10.849 1.00 0.00 H new ATOM 0 HG21 THR A 66 -2.207 -11.436 12.248 1.00 0.00 H new ATOM 0 HG22 THR A 66 -0.883 -10.588 11.414 1.00 0.00 H new ATOM 0 HG23 THR A 66 -2.570 -10.102 11.127 1.00 0.00 H new ATOM 974 N LYS A 67 0.813 -11.227 8.936 1.00 0.00 N ATOM 975 CA LYS A 67 2.115 -10.586 9.007 1.00 0.00 C ATOM 976 C LYS A 67 2.125 -9.357 8.095 1.00 0.00 C ATOM 977 O LYS A 67 2.635 -8.304 8.472 1.00 0.00 O ATOM 978 CB LYS A 67 3.225 -11.591 8.696 1.00 0.00 C ATOM 979 CG LYS A 67 3.798 -12.192 9.981 1.00 0.00 C ATOM 980 CD LYS A 67 4.525 -13.507 9.696 1.00 0.00 C ATOM 981 CE LYS A 67 5.135 -14.085 10.974 1.00 0.00 C ATOM 982 NZ LYS A 67 6.585 -14.322 10.795 1.00 0.00 N ATOM 0 H LYS A 67 0.840 -12.246 8.918 1.00 0.00 H new ATOM 0 HA LYS A 67 2.311 -10.233 10.020 1.00 0.00 H new ATOM 0 HB2 LYS A 67 2.833 -12.386 8.062 1.00 0.00 H new ATOM 0 HB3 LYS A 67 4.019 -11.099 8.135 1.00 0.00 H new ATOM 0 HG2 LYS A 67 4.487 -11.484 10.442 1.00 0.00 H new ATOM 0 HG3 LYS A 67 2.993 -12.365 10.696 1.00 0.00 H new ATOM 0 HD2 LYS A 67 3.828 -14.226 9.264 1.00 0.00 H new ATOM 0 HD3 LYS A 67 5.309 -13.340 8.958 1.00 0.00 H new ATOM 0 HE2 LYS A 67 4.973 -13.398 11.805 1.00 0.00 H new ATOM 0 HE3 LYS A 67 4.637 -15.020 11.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 6.983 -14.714 11.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 6.733 -14.995 10.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 7.059 -13.424 10.571 1.00 0.00 H new ATOM 996 N GLU A 68 1.554 -9.534 6.912 1.00 0.00 N ATOM 997 CA GLU A 68 1.490 -8.453 5.943 1.00 0.00 C ATOM 998 C GLU A 68 0.529 -7.365 6.425 1.00 0.00 C ATOM 999 O GLU A 68 0.834 -6.177 6.333 1.00 0.00 O ATOM 1000 CB GLU A 68 1.081 -8.975 4.565 1.00 0.00 C ATOM 1001 CG GLU A 68 2.019 -10.092 4.102 1.00 0.00 C ATOM 1002 CD GLU A 68 3.234 -9.520 3.369 1.00 0.00 C ATOM 1003 OE1 GLU A 68 3.015 -8.891 2.312 1.00 0.00 O ATOM 1004 OE2 GLU A 68 4.355 -9.724 3.884 1.00 0.00 O ATOM 0 H GLU A 68 1.132 -10.410 6.603 1.00 0.00 H new ATOM 0 HA GLU A 68 2.484 -8.016 5.849 1.00 0.00 H new ATOM 0 HB2 GLU A 68 0.057 -9.347 4.602 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.098 -8.159 3.843 1.00 0.00 H new ATOM 0 HG2 GLU A 68 2.350 -10.674 4.962 1.00 0.00 H new ATOM 0 HG3 GLU A 68 1.481 -10.774 3.444 1.00 0.00 H new ATOM 1011 N LEU A 69 -0.614 -7.809 6.928 1.00 0.00 N ATOM 1012 CA LEU A 69 -1.622 -6.888 7.423 1.00 0.00 C ATOM 1013 C LEU A 69 -0.960 -5.861 8.344 1.00 0.00 C ATOM 1014 O LEU A 69 -1.173 -4.659 8.193 1.00 0.00 O ATOM 1015 CB LEU A 69 -2.770 -7.655 8.083 1.00 0.00 C ATOM 1016 CG LEU A 69 -3.791 -8.284 7.133 1.00 0.00 C ATOM 1017 CD1 LEU A 69 -4.452 -9.508 7.769 1.00 0.00 C ATOM 1018 CD2 LEU A 69 -4.821 -7.250 6.672 1.00 0.00 C ATOM 0 H LEU A 69 -0.864 -8.795 7.003 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.071 -6.335 6.598 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -2.344 -8.445 8.702 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -3.297 -6.975 8.752 1.00 0.00 H new ATOM 0 HG LEU A 69 -3.262 -8.630 6.245 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -5.173 -9.935 7.072 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -3.691 -10.251 8.005 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -4.964 -9.211 8.684 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -5.535 -7.723 5.998 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.349 -6.851 7.538 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.313 -6.438 6.151 1.00 0.00 H new ATOM 1030 N LEU A 70 -0.170 -6.372 9.277 1.00 0.00 N ATOM 1031 CA LEU A 70 0.525 -5.514 10.221 1.00 0.00 C ATOM 1032 C LEU A 70 1.373 -4.499 9.453 1.00 0.00 C ATOM 1033 O LEU A 70 1.798 -3.489 10.012 1.00 0.00 O ATOM 1034 CB LEU A 70 1.324 -6.353 11.220 1.00 0.00 C ATOM 1035 CG LEU A 70 0.517 -7.011 12.341 1.00 0.00 C ATOM 1036 CD1 LEU A 70 0.017 -5.967 13.341 1.00 0.00 C ATOM 1037 CD2 LEU A 70 -0.626 -7.854 11.772 1.00 0.00 C ATOM 0 H LEU A 70 0.004 -7.370 9.399 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.190 -4.946 10.817 1.00 0.00 H new ATOM 0 HB2 LEU A 70 1.848 -7.134 10.670 1.00 0.00 H new ATOM 0 HB3 LEU A 70 2.084 -5.716 11.672 1.00 0.00 H new ATOM 0 HG LEU A 70 1.176 -7.688 12.885 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -0.554 -6.461 14.128 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.868 -5.448 13.781 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -0.621 -5.247 12.827 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -1.184 -8.310 12.590 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -1.292 -7.218 11.189 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -0.218 -8.635 11.131 1.00 0.00 H new ATOM 1049 N ALA A 71 1.595 -4.802 8.182 1.00 0.00 N ATOM 1050 CA ALA A 71 2.386 -3.929 7.331 1.00 0.00 C ATOM 1051 C ALA A 71 1.500 -2.796 6.808 1.00 0.00 C ATOM 1052 O ALA A 71 2.003 -1.766 6.362 1.00 0.00 O ATOM 1053 CB ALA A 71 3.013 -4.748 6.201 1.00 0.00 C ATOM 0 H ALA A 71 1.241 -5.640 7.721 1.00 0.00 H new ATOM 0 HA ALA A 71 3.201 -3.477 7.896 1.00 0.00 H new ATOM 0 HB1 ALA A 71 3.606 -4.093 5.563 1.00 0.00 H new ATOM 0 HB2 ALA A 71 3.655 -5.521 6.624 1.00 0.00 H new ATOM 0 HB3 ALA A 71 2.225 -5.215 5.610 1.00 0.00 H new ATOM 1059 N LEU A 72 0.197 -3.025 6.880 1.00 0.00 N ATOM 1060 CA LEU A 72 -0.763 -2.037 6.419 1.00 0.00 C ATOM 1061 C LEU A 72 -0.852 -0.903 7.442 1.00 0.00 C ATOM 1062 O LEU A 72 -0.548 0.247 7.127 1.00 0.00 O ATOM 1063 CB LEU A 72 -2.109 -2.698 6.115 1.00 0.00 C ATOM 1064 CG LEU A 72 -2.149 -3.601 4.881 1.00 0.00 C ATOM 1065 CD1 LEU A 72 -2.676 -2.841 3.662 1.00 0.00 C ATOM 1066 CD2 LEU A 72 -0.779 -4.229 4.616 1.00 0.00 C ATOM 0 H LEU A 72 -0.216 -3.881 7.251 1.00 0.00 H new ATOM 0 HA LEU A 72 -0.432 -1.594 5.479 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.406 -3.288 6.982 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -2.857 -1.914 5.992 1.00 0.00 H new ATOM 0 HG LEU A 72 -2.845 -4.417 5.078 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.694 -3.506 2.799 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -3.685 -2.482 3.865 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -2.025 -1.992 3.453 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -0.835 -4.866 3.733 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -0.044 -3.442 4.449 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.480 -4.827 5.477 1.00 0.00 H new ATOM 1078 N ASP A 73 -1.269 -1.266 8.646 1.00 0.00 N ATOM 1079 CA ASP A 73 -1.402 -0.294 9.717 1.00 0.00 C ATOM 1080 C ASP A 73 -0.104 0.508 9.836 1.00 0.00 C ATOM 1081 O ASP A 73 -0.135 1.731 9.963 1.00 0.00 O ATOM 1082 CB ASP A 73 -1.657 -0.983 11.059 1.00 0.00 C ATOM 1083 CG ASP A 73 -2.373 -0.124 12.102 1.00 0.00 C ATOM 1084 OD1 ASP A 73 -3.610 0.006 11.978 1.00 0.00 O ATOM 1085 OD2 ASP A 73 -1.668 0.384 13.000 1.00 0.00 O ATOM 0 H ASP A 73 -1.519 -2.221 8.903 1.00 0.00 H new ATOM 0 HA ASP A 73 -2.245 0.355 9.480 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -2.249 -1.881 10.882 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -0.701 -1.307 11.471 1.00 0.00 H new ATOM 1090 N SER A 74 1.006 -0.214 9.792 1.00 0.00 N ATOM 1091 CA SER A 74 2.312 0.414 9.893 1.00 0.00 C ATOM 1092 C SER A 74 2.353 1.677 9.031 1.00 0.00 C ATOM 1093 O SER A 74 3.106 2.606 9.320 1.00 0.00 O ATOM 1094 CB SER A 74 3.422 -0.552 9.473 1.00 0.00 C ATOM 1095 OG SER A 74 3.961 -0.222 8.196 1.00 0.00 O ATOM 0 H SER A 74 1.028 -1.228 9.688 1.00 0.00 H new ATOM 0 HA SER A 74 2.481 0.687 10.935 1.00 0.00 H new ATOM 0 HB2 SER A 74 4.218 -0.536 10.218 1.00 0.00 H new ATOM 0 HB3 SER A 74 3.029 -1.568 9.449 1.00 0.00 H new ATOM 0 HG SER A 74 3.429 -0.654 7.495 1.00 0.00 H new ATOM 1101 N VAL A 75 1.535 1.671 7.989 1.00 0.00 N ATOM 1102 CA VAL A 75 1.468 2.805 7.083 1.00 0.00 C ATOM 1103 C VAL A 75 0.737 3.960 7.771 1.00 0.00 C ATOM 1104 O VAL A 75 -0.331 3.766 8.349 1.00 0.00 O ATOM 1105 CB VAL A 75 0.815 2.384 5.765 1.00 0.00 C ATOM 1106 CG1 VAL A 75 0.752 3.558 4.785 1.00 0.00 C ATOM 1107 CG2 VAL A 75 1.547 1.192 5.146 1.00 0.00 C ATOM 0 H VAL A 75 0.913 0.898 7.752 1.00 0.00 H new ATOM 0 HA VAL A 75 2.470 3.156 6.836 1.00 0.00 H new ATOM 0 HB VAL A 75 -0.207 2.073 5.982 1.00 0.00 H new ATOM 0 HG11 VAL A 75 0.284 3.232 3.856 1.00 0.00 H new ATOM 0 HG12 VAL A 75 0.166 4.366 5.223 1.00 0.00 H new ATOM 0 HG13 VAL A 75 1.761 3.913 4.577 1.00 0.00 H new ATOM 0 HG21 VAL A 75 1.062 0.913 4.210 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.584 1.464 4.950 1.00 0.00 H new ATOM 0 HG23 VAL A 75 1.517 0.348 5.836 1.00 0.00 H new ATOM 1117 N ASP A 76 1.341 5.136 7.685 1.00 0.00 N ATOM 1118 CA ASP A 76 0.761 6.322 8.292 1.00 0.00 C ATOM 1119 C ASP A 76 0.236 7.247 7.192 1.00 0.00 C ATOM 1120 O ASP A 76 1.010 7.950 6.546 1.00 0.00 O ATOM 1121 CB ASP A 76 1.805 7.094 9.101 1.00 0.00 C ATOM 1122 CG ASP A 76 1.569 7.112 10.612 1.00 0.00 C ATOM 1123 OD1 ASP A 76 0.618 7.807 11.030 1.00 0.00 O ATOM 1124 OD2 ASP A 76 2.345 6.430 11.316 1.00 0.00 O ATOM 0 H ASP A 76 2.227 5.293 7.204 1.00 0.00 H new ATOM 0 HA ASP A 76 -0.044 6.003 8.954 1.00 0.00 H new ATOM 0 HB2 ASP A 76 2.786 6.661 8.907 1.00 0.00 H new ATOM 0 HB3 ASP A 76 1.834 8.122 8.741 1.00 0.00 H new ATOM 1129 N PRO A 77 -1.112 7.215 7.010 1.00 0.00 N ATOM 1130 CA PRO A 77 -1.750 8.042 6.000 1.00 0.00 C ATOM 1131 C PRO A 77 -1.810 9.504 6.446 1.00 0.00 C ATOM 1132 O PRO A 77 -1.891 10.408 5.616 1.00 0.00 O ATOM 1133 CB PRO A 77 -3.124 7.426 5.798 1.00 0.00 C ATOM 1134 CG PRO A 77 -3.381 6.567 7.025 1.00 0.00 C ATOM 1135 CD PRO A 77 -2.060 6.394 7.757 1.00 0.00 C ATOM 0 HA PRO A 77 -1.196 8.063 5.062 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -3.887 8.198 5.695 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -3.153 6.826 4.888 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -4.118 7.039 7.674 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -3.786 5.598 6.735 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -2.136 6.721 8.794 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -1.751 5.349 7.774 1.00 0.00 H new ATOM 1143 N GLU A 78 -1.767 9.692 7.757 1.00 0.00 N ATOM 1144 CA GLU A 78 -1.816 11.029 8.324 1.00 0.00 C ATOM 1145 C GLU A 78 -3.235 11.593 8.232 1.00 0.00 C ATOM 1146 O GLU A 78 -3.876 11.841 9.252 1.00 0.00 O ATOM 1147 CB GLU A 78 -0.812 11.954 7.634 1.00 0.00 C ATOM 1148 CG GLU A 78 0.558 11.283 7.513 1.00 0.00 C ATOM 1149 CD GLU A 78 1.685 12.299 7.709 1.00 0.00 C ATOM 1150 OE1 GLU A 78 1.846 13.149 6.807 1.00 0.00 O ATOM 1151 OE2 GLU A 78 2.360 12.203 8.757 1.00 0.00 O ATOM 0 H GLU A 78 -1.699 8.940 8.443 1.00 0.00 H new ATOM 0 HA GLU A 78 -1.539 10.967 9.376 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -1.179 12.221 6.643 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.718 12.881 8.199 1.00 0.00 H new ATOM 0 HG2 GLU A 78 0.645 10.490 8.256 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.652 10.814 6.533 1.00 0.00 H new ATOM 1158 N GLY A 79 -3.684 11.780 6.999 1.00 0.00 N ATOM 1159 CA GLY A 79 -5.015 12.311 6.760 1.00 0.00 C ATOM 1160 C GLY A 79 -5.328 12.353 5.263 1.00 0.00 C ATOM 1161 O GLY A 79 -5.981 13.281 4.788 1.00 0.00 O ATOM 0 H GLY A 79 -3.149 11.573 6.155 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -5.754 11.695 7.272 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.091 13.314 7.179 1.00 0.00 H new ATOM 1165 N ARG A 80 -4.847 11.338 4.562 1.00 0.00 N ATOM 1166 CA ARG A 80 -5.067 11.247 3.128 1.00 0.00 C ATOM 1167 C ARG A 80 -6.070 10.135 2.815 1.00 0.00 C ATOM 1168 O ARG A 80 -6.148 9.143 3.537 1.00 0.00 O ATOM 1169 CB ARG A 80 -3.758 10.968 2.387 1.00 0.00 C ATOM 1170 CG ARG A 80 -3.043 12.272 2.027 1.00 0.00 C ATOM 1171 CD ARG A 80 -2.084 12.066 0.853 1.00 0.00 C ATOM 1172 NE ARG A 80 -2.611 12.738 -0.356 1.00 0.00 N ATOM 1173 CZ ARG A 80 -2.743 14.066 -0.479 1.00 0.00 C ATOM 1174 NH1 ARG A 80 -2.388 14.871 0.531 1.00 0.00 N ATOM 1175 NH2 ARG A 80 -3.231 14.588 -1.613 1.00 0.00 N ATOM 0 H ARG A 80 -4.305 10.571 4.960 1.00 0.00 H new ATOM 0 HA ARG A 80 -5.464 12.205 2.791 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -3.108 10.352 3.009 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -3.963 10.399 1.480 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -3.778 13.035 1.771 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -2.491 12.639 2.892 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -1.101 12.466 1.102 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -1.956 11.001 0.660 1.00 0.00 H new ATOM 0 HE ARG A 80 -2.891 12.154 -1.144 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -2.017 14.473 1.394 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -2.489 15.882 0.437 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -3.502 13.975 -2.382 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -3.332 15.599 -1.707 1.00 0.00 H new ATOM 1189 N ALA A 81 -6.813 10.339 1.736 1.00 0.00 N ATOM 1190 CA ALA A 81 -7.807 9.366 1.318 1.00 0.00 C ATOM 1191 C ALA A 81 -7.143 8.315 0.426 1.00 0.00 C ATOM 1192 O ALA A 81 -7.320 7.116 0.636 1.00 0.00 O ATOM 1193 CB ALA A 81 -8.960 10.085 0.614 1.00 0.00 C ATOM 0 H ALA A 81 -6.746 11.164 1.139 1.00 0.00 H new ATOM 0 HA ALA A 81 -8.224 8.848 2.182 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -9.706 9.355 0.300 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -9.416 10.799 1.300 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -8.580 10.614 -0.260 1.00 0.00 H new ATOM 1199 N ASP A 82 -6.393 8.804 -0.551 1.00 0.00 N ATOM 1200 CA ASP A 82 -5.702 7.922 -1.476 1.00 0.00 C ATOM 1201 C ASP A 82 -4.912 6.877 -0.685 1.00 0.00 C ATOM 1202 O ASP A 82 -4.681 5.771 -1.169 1.00 0.00 O ATOM 1203 CB ASP A 82 -4.714 8.701 -2.347 1.00 0.00 C ATOM 1204 CG ASP A 82 -5.327 9.853 -3.147 1.00 0.00 C ATOM 1205 OD1 ASP A 82 -6.555 9.797 -3.373 1.00 0.00 O ATOM 1206 OD2 ASP A 82 -4.553 10.763 -3.514 1.00 0.00 O ATOM 0 H ASP A 82 -6.249 9.799 -0.722 1.00 0.00 H new ATOM 0 HA ASP A 82 -6.450 7.450 -2.113 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -3.926 9.101 -1.708 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -4.240 8.008 -3.042 1.00 0.00 H new ATOM 1211 N VAL A 83 -4.521 7.266 0.520 1.00 0.00 N ATOM 1212 CA VAL A 83 -3.762 6.377 1.383 1.00 0.00 C ATOM 1213 C VAL A 83 -4.728 5.575 2.257 1.00 0.00 C ATOM 1214 O VAL A 83 -4.681 4.346 2.273 1.00 0.00 O ATOM 1215 CB VAL A 83 -2.745 7.180 2.198 1.00 0.00 C ATOM 1216 CG1 VAL A 83 -1.752 6.254 2.902 1.00 0.00 C ATOM 1217 CG2 VAL A 83 -2.017 8.197 1.316 1.00 0.00 C ATOM 0 H VAL A 83 -4.716 8.184 0.919 1.00 0.00 H new ATOM 0 HA VAL A 83 -3.191 5.663 0.789 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.290 7.731 2.965 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.041 6.850 3.474 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -2.291 5.587 3.575 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -1.216 5.663 2.159 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -1.300 8.754 1.919 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -1.491 7.675 0.517 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -2.741 8.887 0.883 1.00 0.00 H new ATOM 1227 N ARG A 84 -5.581 6.302 2.962 1.00 0.00 N ATOM 1228 CA ARG A 84 -6.557 5.674 3.837 1.00 0.00 C ATOM 1229 C ARG A 84 -7.232 4.501 3.122 1.00 0.00 C ATOM 1230 O ARG A 84 -7.555 3.492 3.746 1.00 0.00 O ATOM 1231 CB ARG A 84 -7.625 6.675 4.280 1.00 0.00 C ATOM 1232 CG ARG A 84 -7.264 7.301 5.629 1.00 0.00 C ATOM 1233 CD ARG A 84 -8.462 7.283 6.580 1.00 0.00 C ATOM 1234 NE ARG A 84 -8.006 7.484 7.973 1.00 0.00 N ATOM 1235 CZ ARG A 84 -8.825 7.734 9.004 1.00 0.00 C ATOM 1236 NH1 ARG A 84 -10.148 7.815 8.804 1.00 0.00 N ATOM 1237 NH2 ARG A 84 -8.322 7.903 10.234 1.00 0.00 N ATOM 0 H ARG A 84 -5.617 7.321 2.946 1.00 0.00 H new ATOM 0 HA ARG A 84 -6.028 5.312 4.718 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -7.729 7.457 3.528 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -8.590 6.174 4.354 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -6.432 6.756 6.076 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -6.929 8.327 5.480 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -9.168 8.066 6.303 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -8.990 6.333 6.495 1.00 0.00 H new ATOM 0 HE ARG A 84 -7.005 7.429 8.161 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -10.531 7.686 7.867 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -10.772 8.005 9.588 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -7.315 7.841 10.386 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -8.946 8.093 11.018 1.00 0.00 H new ATOM 1251 N GLN A 85 -7.425 4.674 1.822 1.00 0.00 N ATOM 1252 CA GLN A 85 -8.056 3.643 1.016 1.00 0.00 C ATOM 1253 C GLN A 85 -7.088 2.479 0.790 1.00 0.00 C ATOM 1254 O GLN A 85 -7.375 1.345 1.169 1.00 0.00 O ATOM 1255 CB GLN A 85 -8.549 4.212 -0.315 1.00 0.00 C ATOM 1256 CG GLN A 85 -8.877 3.092 -1.304 1.00 0.00 C ATOM 1257 CD GLN A 85 -10.316 3.210 -1.810 1.00 0.00 C ATOM 1258 OE1 GLN A 85 -10.609 3.906 -2.768 1.00 0.00 O ATOM 1259 NE2 GLN A 85 -11.195 2.494 -1.115 1.00 0.00 N ATOM 0 H GLN A 85 -7.155 5.512 1.308 1.00 0.00 H new ATOM 0 HA GLN A 85 -8.925 3.268 1.557 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -9.435 4.824 -0.147 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -7.787 4.865 -0.740 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -8.187 3.133 -2.147 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -8.735 2.124 -0.823 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -10.883 1.932 -0.323 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -12.182 2.507 -1.374 1.00 0.00 H new ATOM 1268 N ALA A 86 -5.960 2.801 0.173 1.00 0.00 N ATOM 1269 CA ALA A 86 -4.948 1.797 -0.108 1.00 0.00 C ATOM 1270 C ALA A 86 -4.847 0.835 1.077 1.00 0.00 C ATOM 1271 O ALA A 86 -4.818 -0.381 0.893 1.00 0.00 O ATOM 1272 CB ALA A 86 -3.617 2.486 -0.415 1.00 0.00 C ATOM 0 H ALA A 86 -5.725 3.743 -0.140 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.222 1.211 -0.985 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -2.858 1.733 -0.626 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -3.735 3.135 -1.283 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -3.309 3.081 0.444 1.00 0.00 H new ATOM 1278 N ARG A 87 -4.797 1.415 2.267 1.00 0.00 N ATOM 1279 CA ARG A 87 -4.700 0.624 3.482 1.00 0.00 C ATOM 1280 C ARG A 87 -5.876 -0.350 3.576 1.00 0.00 C ATOM 1281 O ARG A 87 -5.701 -1.556 3.411 1.00 0.00 O ATOM 1282 CB ARG A 87 -4.688 1.520 4.723 1.00 0.00 C ATOM 1283 CG ARG A 87 -3.442 1.264 5.572 1.00 0.00 C ATOM 1284 CD ARG A 87 -2.858 2.576 6.099 1.00 0.00 C ATOM 1285 NE ARG A 87 -2.525 2.442 7.535 1.00 0.00 N ATOM 1286 CZ ARG A 87 -3.412 2.592 8.528 1.00 0.00 C ATOM 1287 NH1 ARG A 87 -4.690 2.883 8.248 1.00 0.00 N ATOM 1288 NH2 ARG A 87 -3.020 2.452 9.802 1.00 0.00 N ATOM 0 H ARG A 87 -4.822 2.424 2.416 1.00 0.00 H new ATOM 0 HA ARG A 87 -3.764 0.066 3.441 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -4.717 2.567 4.420 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -5.582 1.335 5.318 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -3.695 0.613 6.409 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -2.693 0.742 4.977 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -1.964 2.839 5.533 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -3.574 3.385 5.957 1.00 0.00 H new ATOM 0 HE ARG A 87 -1.561 2.222 7.784 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -4.988 2.990 7.278 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -5.365 2.997 9.004 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -2.047 2.231 10.015 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -3.695 2.566 10.559 1.00 0.00 H new ATOM 1302 N ARG A 88 -7.047 0.209 3.841 1.00 0.00 N ATOM 1303 CA ARG A 88 -8.251 -0.595 3.959 1.00 0.00 C ATOM 1304 C ARG A 88 -8.346 -1.583 2.795 1.00 0.00 C ATOM 1305 O ARG A 88 -8.522 -2.782 3.006 1.00 0.00 O ATOM 1306 CB ARG A 88 -9.503 0.285 3.975 1.00 0.00 C ATOM 1307 CG ARG A 88 -10.694 -0.445 3.352 1.00 0.00 C ATOM 1308 CD ARG A 88 -12.004 0.285 3.655 1.00 0.00 C ATOM 1309 NE ARG A 88 -13.059 -0.691 4.005 1.00 0.00 N ATOM 1310 CZ ARG A 88 -13.575 -1.580 3.145 1.00 0.00 C ATOM 1311 NH1 ARG A 88 -13.136 -1.621 1.879 1.00 0.00 N ATOM 1312 NH2 ARG A 88 -14.530 -2.429 3.550 1.00 0.00 N ATOM 0 H ARG A 88 -7.188 1.210 3.977 1.00 0.00 H new ATOM 0 HA ARG A 88 -8.193 -1.141 4.900 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -9.741 0.567 5.001 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -9.310 1.208 3.427 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -10.556 -0.519 2.273 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -10.743 -1.463 3.738 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -11.858 0.985 4.478 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -12.312 0.871 2.789 1.00 0.00 H new ATOM 0 HE ARG A 88 -13.416 -0.687 4.960 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -12.409 -0.976 1.570 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -13.529 -2.298 1.225 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -14.864 -2.399 4.513 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -14.922 -3.105 2.895 1.00 0.00 H new ATOM 1326 N ASP A 89 -8.224 -1.043 1.591 1.00 0.00 N ATOM 1327 CA ASP A 89 -8.293 -1.862 0.393 1.00 0.00 C ATOM 1328 C ASP A 89 -7.216 -2.947 0.458 1.00 0.00 C ATOM 1329 O ASP A 89 -7.460 -4.093 0.084 1.00 0.00 O ATOM 1330 CB ASP A 89 -8.045 -1.024 -0.863 1.00 0.00 C ATOM 1331 CG ASP A 89 -8.778 -1.504 -2.117 1.00 0.00 C ATOM 1332 OD1 ASP A 89 -8.662 -2.713 -2.414 1.00 0.00 O ATOM 1333 OD2 ASP A 89 -9.438 -0.652 -2.750 1.00 0.00 O ATOM 0 H ASP A 89 -8.078 -0.048 1.420 1.00 0.00 H new ATOM 0 HA ASP A 89 -9.289 -2.301 0.343 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -8.341 0.005 -0.659 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -6.975 -1.013 -1.068 1.00 0.00 H new ATOM 1338 N GLY A 90 -6.047 -2.547 0.937 1.00 0.00 N ATOM 1339 CA GLY A 90 -4.932 -3.470 1.056 1.00 0.00 C ATOM 1340 C GLY A 90 -5.241 -4.575 2.068 1.00 0.00 C ATOM 1341 O GLY A 90 -5.339 -5.746 1.704 1.00 0.00 O ATOM 0 H GLY A 90 -5.848 -1.596 1.247 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -4.716 -3.912 0.084 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -4.038 -2.928 1.365 1.00 0.00 H new ATOM 1345 N VAL A 91 -5.385 -4.164 3.320 1.00 0.00 N ATOM 1346 CA VAL A 91 -5.681 -5.104 4.387 1.00 0.00 C ATOM 1347 C VAL A 91 -6.783 -6.060 3.927 1.00 0.00 C ATOM 1348 O VAL A 91 -6.677 -7.271 4.114 1.00 0.00 O ATOM 1349 CB VAL A 91 -6.042 -4.347 5.667 1.00 0.00 C ATOM 1350 CG1 VAL A 91 -4.849 -3.536 6.178 1.00 0.00 C ATOM 1351 CG2 VAL A 91 -7.261 -3.449 5.447 1.00 0.00 C ATOM 0 H VAL A 91 -5.302 -3.192 3.619 1.00 0.00 H new ATOM 0 HA VAL A 91 -4.803 -5.707 4.619 1.00 0.00 H new ATOM 0 HB VAL A 91 -6.300 -5.081 6.430 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -5.132 -3.007 7.088 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -4.017 -4.207 6.392 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -4.547 -2.815 5.418 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -7.497 -2.922 6.372 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -7.042 -2.725 4.662 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -8.114 -4.059 5.150 1.00 0.00 H new ATOM 1361 N ARG A 92 -7.817 -5.480 3.335 1.00 0.00 N ATOM 1362 CA ARG A 92 -8.938 -6.265 2.847 1.00 0.00 C ATOM 1363 C ARG A 92 -8.437 -7.435 1.998 1.00 0.00 C ATOM 1364 O ARG A 92 -8.726 -8.593 2.296 1.00 0.00 O ATOM 1365 CB ARG A 92 -9.889 -5.407 2.011 1.00 0.00 C ATOM 1366 CG ARG A 92 -11.028 -4.855 2.871 1.00 0.00 C ATOM 1367 CD ARG A 92 -12.379 -5.405 2.410 1.00 0.00 C ATOM 1368 NE ARG A 92 -12.338 -6.884 2.376 1.00 0.00 N ATOM 1369 CZ ARG A 92 -13.425 -7.665 2.309 1.00 0.00 C ATOM 1370 NH1 ARG A 92 -14.645 -7.113 2.270 1.00 0.00 N ATOM 1371 NH2 ARG A 92 -13.291 -8.998 2.282 1.00 0.00 N ATOM 0 H ARG A 92 -7.902 -4.475 3.182 1.00 0.00 H new ATOM 0 HA ARG A 92 -9.478 -6.646 3.714 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -9.338 -4.583 1.558 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -10.300 -6.002 1.195 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -10.861 -5.119 3.915 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -11.036 -3.766 2.815 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -13.167 -5.070 3.085 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -12.621 -5.017 1.421 1.00 0.00 H new ATOM 0 HE ARG A 92 -11.425 -7.338 2.405 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -14.747 -6.098 2.291 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -15.472 -7.707 2.219 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -12.362 -9.418 2.312 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -14.118 -9.593 2.231 1.00 0.00 H new ATOM 1385 N LYS A 93 -7.694 -7.092 0.956 1.00 0.00 N ATOM 1386 CA LYS A 93 -7.150 -8.099 0.061 1.00 0.00 C ATOM 1387 C LYS A 93 -6.721 -9.321 0.876 1.00 0.00 C ATOM 1388 O LYS A 93 -7.121 -10.444 0.574 1.00 0.00 O ATOM 1389 CB LYS A 93 -6.029 -7.506 -0.795 1.00 0.00 C ATOM 1390 CG LYS A 93 -4.998 -8.575 -1.165 1.00 0.00 C ATOM 1391 CD LYS A 93 -5.602 -9.617 -2.107 1.00 0.00 C ATOM 1392 CE LYS A 93 -4.507 -10.411 -2.823 1.00 0.00 C ATOM 1393 NZ LYS A 93 -4.171 -9.778 -4.118 1.00 0.00 N ATOM 0 H LYS A 93 -7.456 -6.131 0.712 1.00 0.00 H new ATOM 0 HA LYS A 93 -7.912 -8.436 -0.642 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -6.450 -7.072 -1.702 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -5.541 -6.697 -0.252 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -4.137 -8.105 -1.641 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -4.635 -9.064 -0.261 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -6.239 -10.298 -1.542 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -6.237 -9.123 -2.842 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -3.618 -10.463 -2.195 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -4.841 -11.435 -2.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -3.451 -10.348 -4.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -5.025 -9.720 -4.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -3.800 -8.821 -3.951 1.00 0.00 H new ATOM 1407 N VAL A 94 -5.912 -9.060 1.892 1.00 0.00 N ATOM 1408 CA VAL A 94 -5.424 -10.125 2.752 1.00 0.00 C ATOM 1409 C VAL A 94 -6.611 -10.808 3.434 1.00 0.00 C ATOM 1410 O VAL A 94 -6.757 -12.027 3.359 1.00 0.00 O ATOM 1411 CB VAL A 94 -4.403 -9.568 3.747 1.00 0.00 C ATOM 1412 CG1 VAL A 94 -3.579 -10.693 4.375 1.00 0.00 C ATOM 1413 CG2 VAL A 94 -3.497 -8.531 3.080 1.00 0.00 C ATOM 0 H VAL A 94 -5.582 -8.127 2.139 1.00 0.00 H new ATOM 0 HA VAL A 94 -4.906 -10.883 2.165 1.00 0.00 H new ATOM 0 HB VAL A 94 -4.952 -9.069 4.546 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -2.861 -10.270 5.078 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -4.242 -11.379 4.902 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -3.045 -11.233 3.593 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -2.781 -8.151 3.809 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -2.961 -8.995 2.252 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -4.103 -7.707 2.703 1.00 0.00 H new ATOM 1423 N GLN A 95 -7.429 -9.993 4.084 1.00 0.00 N ATOM 1424 CA GLN A 95 -8.598 -10.504 4.779 1.00 0.00 C ATOM 1425 C GLN A 95 -9.278 -11.591 3.944 1.00 0.00 C ATOM 1426 O GLN A 95 -9.424 -12.725 4.397 1.00 0.00 O ATOM 1427 CB GLN A 95 -9.576 -9.374 5.109 1.00 0.00 C ATOM 1428 CG GLN A 95 -9.033 -8.490 6.233 1.00 0.00 C ATOM 1429 CD GLN A 95 -10.168 -7.763 6.957 1.00 0.00 C ATOM 1430 OE1 GLN A 95 -11.140 -8.357 7.395 1.00 0.00 O ATOM 1431 NE2 GLN A 95 -9.992 -6.449 7.056 1.00 0.00 N ATOM 0 H GLN A 95 -7.305 -8.982 4.144 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.273 -10.946 5.721 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -9.753 -8.770 4.219 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -10.537 -9.795 5.404 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -8.476 -9.101 6.944 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -8.334 -7.762 5.822 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -9.154 -6.016 6.667 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -10.694 -5.874 7.521 1.00 0.00 H new ATOM 1440 N THR A 96 -9.676 -11.206 2.740 1.00 0.00 N ATOM 1441 CA THR A 96 -10.338 -12.134 1.839 1.00 0.00 C ATOM 1442 C THR A 96 -9.538 -13.434 1.730 1.00 0.00 C ATOM 1443 O THR A 96 -10.104 -14.523 1.800 1.00 0.00 O ATOM 1444 CB THR A 96 -10.535 -11.429 0.496 1.00 0.00 C ATOM 1445 OG1 THR A 96 -11.543 -10.456 0.759 1.00 0.00 O ATOM 1446 CG2 THR A 96 -11.165 -12.342 -0.558 1.00 0.00 C ATOM 0 H THR A 96 -9.553 -10.264 2.368 1.00 0.00 H new ATOM 0 HA THR A 96 -11.318 -12.423 2.219 1.00 0.00 H new ATOM 0 HB THR A 96 -9.574 -11.065 0.133 1.00 0.00 H new ATOM 0 HG1 THR A 96 -11.732 -9.951 -0.059 1.00 0.00 H new ATOM 0 HG21 THR A 96 -11.283 -11.792 -1.492 1.00 0.00 H new ATOM 0 HG22 THR A 96 -10.520 -13.205 -0.724 1.00 0.00 H new ATOM 0 HG23 THR A 96 -12.141 -12.680 -0.210 1.00 0.00 H new ATOM 1454 N ILE A 97 -8.233 -13.276 1.563 1.00 0.00 N ATOM 1455 CA ILE A 97 -7.349 -14.423 1.444 1.00 0.00 C ATOM 1456 C ILE A 97 -7.452 -15.274 2.712 1.00 0.00 C ATOM 1457 O ILE A 97 -7.399 -16.501 2.646 1.00 0.00 O ATOM 1458 CB ILE A 97 -5.924 -13.971 1.121 1.00 0.00 C ATOM 1459 CG1 ILE A 97 -5.901 -13.071 -0.116 1.00 0.00 C ATOM 1460 CG2 ILE A 97 -4.988 -15.172 0.974 1.00 0.00 C ATOM 1461 CD1 ILE A 97 -4.714 -12.107 -0.070 1.00 0.00 C ATOM 0 H ILE A 97 -7.767 -12.371 1.507 1.00 0.00 H new ATOM 0 HA ILE A 97 -7.655 -15.054 0.610 1.00 0.00 H new ATOM 0 HB ILE A 97 -5.556 -13.377 1.958 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -5.842 -13.684 -1.015 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -6.831 -12.506 -0.176 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -3.981 -14.823 0.744 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -4.972 -15.737 1.906 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -5.343 -15.813 0.167 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -4.721 -11.479 -0.961 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -4.789 -11.479 0.818 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -3.785 -12.676 -0.034 1.00 0.00 H new ATOM 1473 N LEU A 98 -7.599 -14.588 3.836 1.00 0.00 N ATOM 1474 CA LEU A 98 -7.710 -15.266 5.117 1.00 0.00 C ATOM 1475 C LEU A 98 -9.001 -16.085 5.145 1.00 0.00 C ATOM 1476 O LEU A 98 -8.970 -17.292 5.381 1.00 0.00 O ATOM 1477 CB LEU A 98 -7.594 -14.262 6.265 1.00 0.00 C ATOM 1478 CG LEU A 98 -6.186 -14.041 6.823 1.00 0.00 C ATOM 1479 CD1 LEU A 98 -5.515 -15.373 7.161 1.00 0.00 C ATOM 1480 CD2 LEU A 98 -5.341 -13.201 5.863 1.00 0.00 C ATOM 0 H LEU A 98 -7.644 -13.570 3.887 1.00 0.00 H new ATOM 0 HA LEU A 98 -6.885 -15.966 5.251 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.983 -13.303 5.923 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.238 -14.595 7.079 1.00 0.00 H new ATOM 0 HG LEU A 98 -6.272 -13.479 7.753 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -4.516 -15.187 7.555 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -6.108 -15.900 7.908 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -5.442 -15.982 6.260 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -4.346 -13.059 6.284 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -5.260 -13.714 4.905 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -5.814 -12.230 5.716 1.00 0.00 H new ATOM 1492 N GLU A 99 -10.107 -15.397 4.900 1.00 0.00 N ATOM 1493 CA GLU A 99 -11.407 -16.047 4.894 1.00 0.00 C ATOM 1494 C GLU A 99 -11.434 -17.171 3.857 1.00 0.00 C ATOM 1495 O GLU A 99 -12.280 -18.061 3.923 1.00 0.00 O ATOM 1496 CB GLU A 99 -12.524 -15.035 4.635 1.00 0.00 C ATOM 1497 CG GLU A 99 -13.650 -15.186 5.661 1.00 0.00 C ATOM 1498 CD GLU A 99 -14.781 -14.194 5.384 1.00 0.00 C ATOM 1499 OE1 GLU A 99 -14.844 -13.713 4.232 1.00 0.00 O ATOM 1500 OE2 GLU A 99 -15.557 -13.939 6.330 1.00 0.00 O ATOM 0 H GLU A 99 -10.130 -14.396 4.704 1.00 0.00 H new ATOM 0 HA GLU A 99 -11.578 -16.484 5.878 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -12.120 -14.023 4.679 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -12.922 -15.176 3.630 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -14.039 -16.204 5.632 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -13.257 -15.024 6.664 1.00 0.00 H new ATOM 1507 N LYS A 100 -10.497 -17.093 2.922 1.00 0.00 N ATOM 1508 CA LYS A 100 -10.403 -18.093 1.872 1.00 0.00 C ATOM 1509 C LYS A 100 -9.772 -19.366 2.441 1.00 0.00 C ATOM 1510 O LYS A 100 -10.457 -20.368 2.640 1.00 0.00 O ATOM 1511 CB LYS A 100 -9.662 -17.528 0.659 1.00 0.00 C ATOM 1512 CG LYS A 100 -9.451 -18.606 -0.405 1.00 0.00 C ATOM 1513 CD LYS A 100 -9.644 -18.035 -1.811 1.00 0.00 C ATOM 1514 CE LYS A 100 -8.372 -17.339 -2.300 1.00 0.00 C ATOM 1515 NZ LYS A 100 -7.650 -18.197 -3.266 1.00 0.00 N ATOM 0 H LYS A 100 -9.797 -16.353 2.870 1.00 0.00 H new ATOM 0 HA LYS A 100 -11.396 -18.363 1.512 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -10.230 -16.700 0.235 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -8.698 -17.127 0.972 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -8.448 -19.022 -0.312 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -10.152 -19.425 -0.242 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -9.912 -18.837 -2.499 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -10.473 -17.327 -1.809 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -8.628 -16.389 -2.769 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -7.726 -17.112 -1.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -6.726 -17.773 -3.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -7.509 -19.141 -2.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -8.207 -18.281 -4.140 1.00 0.00 H new ATOM 1529 N LEU A 101 -8.472 -19.284 2.686 1.00 0.00 N ATOM 1530 CA LEU A 101 -7.741 -20.417 3.228 1.00 0.00 C ATOM 1531 C LEU A 101 -8.581 -21.088 4.316 1.00 0.00 C ATOM 1532 O LEU A 101 -8.713 -22.311 4.338 1.00 0.00 O ATOM 1533 CB LEU A 101 -6.353 -19.981 3.703 1.00 0.00 C ATOM 1534 CG LEU A 101 -5.556 -21.023 4.490 1.00 0.00 C ATOM 1535 CD1 LEU A 101 -4.791 -21.954 3.548 1.00 0.00 C ATOM 1536 CD2 LEU A 101 -4.631 -20.352 5.508 1.00 0.00 C ATOM 0 H LEU A 101 -7.907 -18.451 2.519 1.00 0.00 H new ATOM 0 HA LEU A 101 -7.568 -21.164 2.454 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -5.768 -19.687 2.831 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -6.466 -19.093 4.325 1.00 0.00 H new ATOM 0 HG LEU A 101 -6.259 -21.639 5.051 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.233 -22.685 4.133 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -5.495 -22.472 2.897 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -4.099 -21.370 2.942 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -4.076 -21.115 6.054 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -3.932 -19.697 4.988 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.225 -19.765 6.208 1.00 0.00 H new ATOM 1548 N GLU A 102 -9.128 -20.258 5.193 1.00 0.00 N ATOM 1549 CA GLU A 102 -9.952 -20.756 6.281 1.00 0.00 C ATOM 1550 C GLU A 102 -11.102 -21.602 5.732 1.00 0.00 C ATOM 1551 O GLU A 102 -11.397 -22.673 6.259 1.00 0.00 O ATOM 1552 CB GLU A 102 -10.478 -19.605 7.141 1.00 0.00 C ATOM 1553 CG GLU A 102 -9.327 -18.840 7.797 1.00 0.00 C ATOM 1554 CD GLU A 102 -9.410 -18.926 9.322 1.00 0.00 C ATOM 1555 OE1 GLU A 102 -10.544 -18.816 9.836 1.00 0.00 O ATOM 1556 OE2 GLU A 102 -8.337 -19.100 9.940 1.00 0.00 O ATOM 0 H GLU A 102 -9.016 -19.244 5.172 1.00 0.00 H new ATOM 0 HA GLU A 102 -9.335 -21.389 6.918 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -11.066 -18.925 6.525 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -11.144 -19.996 7.910 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -8.375 -19.248 7.458 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -9.356 -17.796 7.486 1.00 0.00 H new ATOM 1563 N GLN A 103 -11.722 -21.088 4.680 1.00 0.00 N ATOM 1564 CA GLN A 103 -12.834 -21.782 4.054 1.00 0.00 C ATOM 1565 C GLN A 103 -12.334 -22.654 2.900 1.00 0.00 C ATOM 1566 O GLN A 103 -13.131 -23.188 2.131 1.00 0.00 O ATOM 1567 CB GLN A 103 -13.897 -20.792 3.572 1.00 0.00 C ATOM 1568 CG GLN A 103 -14.592 -20.114 4.754 1.00 0.00 C ATOM 1569 CD GLN A 103 -16.047 -20.572 4.872 1.00 0.00 C ATOM 1570 OE1 GLN A 103 -16.915 -20.168 4.116 1.00 0.00 O ATOM 1571 NE2 GLN A 103 -16.263 -21.437 5.859 1.00 0.00 N ATOM 0 H GLN A 103 -11.475 -20.199 4.245 1.00 0.00 H new ATOM 0 HA GLN A 103 -13.298 -22.429 4.798 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -13.434 -20.037 2.936 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -14.635 -21.314 2.962 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -14.058 -20.346 5.676 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -14.557 -19.032 4.629 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -15.490 -21.734 6.455 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -17.201 -21.804 6.020 1.00 0.00 H new ATOM 1580 N LYS A 104 -11.017 -22.771 2.818 1.00 0.00 N ATOM 1581 CA LYS A 104 -10.401 -23.569 1.771 1.00 0.00 C ATOM 1582 C LYS A 104 -9.963 -24.914 2.353 1.00 0.00 C ATOM 1583 O LYS A 104 -10.231 -25.964 1.770 1.00 0.00 O ATOM 1584 CB LYS A 104 -9.267 -22.790 1.101 1.00 0.00 C ATOM 1585 CG LYS A 104 -7.919 -23.477 1.332 1.00 0.00 C ATOM 1586 CD LYS A 104 -7.795 -24.741 0.479 1.00 0.00 C ATOM 1587 CE LYS A 104 -7.238 -24.415 -0.908 1.00 0.00 C ATOM 1588 NZ LYS A 104 -6.229 -25.419 -1.311 1.00 0.00 N ATOM 0 H LYS A 104 -10.359 -22.327 3.459 1.00 0.00 H new ATOM 0 HA LYS A 104 -11.121 -23.782 0.981 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -9.459 -22.709 0.031 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -9.235 -21.775 1.497 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -7.110 -22.789 1.089 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -7.813 -23.733 2.386 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -7.142 -25.458 0.978 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -8.772 -25.214 0.380 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -8.049 -24.393 -1.636 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -6.789 -23.422 -0.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -5.825 -25.155 -2.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -5.472 -25.456 -0.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -6.680 -26.353 -1.386 1.00 0.00 H new ATOM 1602 N ALA A 105 -9.296 -24.840 3.496 1.00 0.00 N ATOM 1603 CA ALA A 105 -8.818 -26.039 4.163 1.00 0.00 C ATOM 1604 C ALA A 105 -10.007 -26.947 4.483 1.00 0.00 C ATOM 1605 O ALA A 105 -10.002 -28.127 4.136 1.00 0.00 O ATOM 1606 CB ALA A 105 -8.030 -25.647 5.414 1.00 0.00 C ATOM 0 H ALA A 105 -9.075 -23.968 3.977 1.00 0.00 H new ATOM 0 HA ALA A 105 -8.143 -26.597 3.514 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.671 -26.546 5.915 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -7.180 -25.027 5.129 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -8.676 -25.088 6.091 1.00 0.00 H new ATOM 1612 N SER A 106 -10.997 -26.363 5.141 1.00 0.00 N ATOM 1613 CA SER A 106 -12.190 -27.105 5.512 1.00 0.00 C ATOM 1614 C SER A 106 -13.239 -26.995 4.404 1.00 0.00 C ATOM 1615 O SER A 106 -14.342 -27.526 4.534 1.00 0.00 O ATOM 1616 CB SER A 106 -12.763 -26.600 6.838 1.00 0.00 C ATOM 1617 OG SER A 106 -13.632 -27.554 7.442 1.00 0.00 O ATOM 0 H SER A 106 -10.998 -25.384 5.427 1.00 0.00 H new ATOM 0 HA SER A 106 -11.916 -28.152 5.642 1.00 0.00 H new ATOM 0 HB2 SER A 106 -11.946 -26.370 7.522 1.00 0.00 H new ATOM 0 HB3 SER A 106 -13.307 -25.671 6.667 1.00 0.00 H new ATOM 0 HG SER A 106 -14.220 -27.939 6.759 1.00 0.00 H new ATOM 1623 N GLY A 107 -12.860 -26.304 3.340 1.00 0.00 N ATOM 1624 CA GLY A 107 -13.755 -26.119 2.210 1.00 0.00 C ATOM 1625 C GLY A 107 -14.021 -27.446 1.497 1.00 0.00 C ATOM 1626 O GLY A 107 -13.628 -28.505 1.984 1.00 0.00 O ATOM 0 H GLY A 107 -11.945 -25.865 3.236 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -14.697 -25.692 2.554 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -13.319 -25.407 1.509 1.00 0.00 H new ATOM 1630 N PRO A 108 -14.703 -27.343 0.326 1.00 0.00 N ATOM 1631 CA PRO A 108 -15.026 -28.522 -0.459 1.00 0.00 C ATOM 1632 C PRO A 108 -13.789 -29.053 -1.186 1.00 0.00 C ATOM 1633 O PRO A 108 -13.571 -30.262 -1.247 1.00 0.00 O ATOM 1634 CB PRO A 108 -16.127 -28.075 -1.407 1.00 0.00 C ATOM 1635 CG PRO A 108 -16.056 -26.557 -1.441 1.00 0.00 C ATOM 1636 CD PRO A 108 -15.184 -26.105 -0.281 1.00 0.00 C ATOM 0 HA PRO A 108 -15.363 -29.357 0.156 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -15.980 -28.495 -2.402 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -17.103 -28.413 -1.059 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -15.638 -26.216 -2.388 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -17.054 -26.126 -1.359 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -14.356 -25.485 -0.626 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -15.752 -25.509 0.433 1.00 0.00 H new ATOM 1644 N SER A 109 -13.012 -28.122 -1.720 1.00 0.00 N ATOM 1645 CA SER A 109 -11.802 -28.481 -2.441 1.00 0.00 C ATOM 1646 C SER A 109 -10.692 -28.844 -1.453 1.00 0.00 C ATOM 1647 O SER A 109 -10.394 -28.076 -0.539 1.00 0.00 O ATOM 1648 CB SER A 109 -11.347 -27.341 -3.355 1.00 0.00 C ATOM 1649 OG SER A 109 -10.931 -26.197 -2.615 1.00 0.00 O ATOM 0 H SER A 109 -13.196 -27.120 -1.668 1.00 0.00 H new ATOM 0 HA SER A 109 -12.021 -29.347 -3.066 1.00 0.00 H new ATOM 0 HB2 SER A 109 -10.525 -27.686 -3.982 1.00 0.00 H new ATOM 0 HB3 SER A 109 -12.163 -27.064 -4.023 1.00 0.00 H new ATOM 0 HG SER A 109 -10.727 -26.460 -1.693 1.00 0.00 H new ATOM 1655 N SER A 110 -10.111 -30.014 -1.669 1.00 0.00 N ATOM 1656 CA SER A 110 -9.040 -30.489 -0.809 1.00 0.00 C ATOM 1657 C SER A 110 -7.834 -30.903 -1.654 1.00 0.00 C ATOM 1658 O SER A 110 -6.739 -30.368 -1.485 1.00 0.00 O ATOM 1659 CB SER A 110 -9.508 -31.659 0.058 1.00 0.00 C ATOM 1660 OG SER A 110 -10.249 -31.220 1.193 1.00 0.00 O ATOM 0 H SER A 110 -10.361 -30.648 -2.428 1.00 0.00 H new ATOM 0 HA SER A 110 -8.748 -29.675 -0.146 1.00 0.00 H new ATOM 0 HB2 SER A 110 -10.125 -32.329 -0.540 1.00 0.00 H new ATOM 0 HB3 SER A 110 -8.643 -32.233 0.390 1.00 0.00 H new ATOM 0 HG SER A 110 -10.531 -31.997 1.720 1.00 0.00 H new ATOM 1666 N GLY A 111 -8.075 -31.852 -2.547 1.00 0.00 N ATOM 1667 CA GLY A 111 -7.022 -32.344 -3.419 1.00 0.00 C ATOM 1668 C GLY A 111 -7.593 -33.261 -4.503 1.00 0.00 C ATOM 1669 O GLY A 111 -8.640 -33.877 -4.312 1.00 0.00 O ATOM 0 H GLY A 111 -8.984 -32.293 -2.685 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -6.506 -31.503 -3.883 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -6.282 -32.887 -2.831 1.00 0.00 H new TER 1673 GLY A 111