USER MOD reduce.3.24.130724 H: found=0, std=0, add=744, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 739 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 54 HIS : no HD1:sc= -0.146 K(o=-0.52,f=-5!) USER MOD Set 1.2: A 91 SER OG : rot 180:sc= -0.375 USER MOD Single : A 1 GLY N :NH3+ -133:sc= 0.0141 (180deg=0) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ -126:sc= 0.0488 (180deg=-2.17!) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 164:sc= 0.79 (180deg=0.436) USER MOD Single : A 15 LYS NZ :NH3+ -154:sc= -1.03 (180deg=-2.15!) USER MOD Single : A 17 SER OG : rot -118:sc= 1.28 USER MOD Single : A 20 GLN : amide:sc= 0.479 K(o=0.48,f=-6.5!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc= -1.25 K(o=-1.3,f=-0.74) USER MOD Single : A 28 LYS NZ :NH3+ -179:sc= 1.19 (180deg=1.16) USER MOD Single : A 33 ASN : amide:sc= -0.0274 K(o=-0.027,f=-2!) USER MOD Single : A 39 LYS NZ :NH3+ -171:sc= -0.969 (180deg=-1.19) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 84:sc= 1.24 USER MOD Single : A 47 LYS NZ :NH3+ -173:sc= 1.25 (180deg=0.981) USER MOD Single : A 49 LYS NZ :NH3+ 149:sc= 0.591 (180deg=0.178) USER MOD Single : A 50 THR OG1 : rot 88:sc= 1.19 USER MOD Single : A 56 LYS NZ :NH3+ -147:sc= 1.25 (180deg=0.652) USER MOD Single : A 57 SER OG : rot 74:sc= 1.23 USER MOD Single : A 61 LYS NZ :NH3+ -121:sc= -0.178 (180deg=-2.6!) USER MOD Single : A 63 ASN : amide:sc= 0.849 K(o=0.85,f=-0.033) USER MOD Single : A 65 ASN : amide:sc= -0.232 X(o=-0.23,f=-0.042) USER MOD Single : A 69 GLN : amide:sc= -1.38! K(o=-1.4!,f=-0.71) USER MOD Single : A 70 GLN : amide:sc= -1.04 K(o=-1,f=-0.075) USER MOD Single : A 71 LYS NZ :NH3+ 148:sc= 1.23 (180deg=0.781) USER MOD Single : A 72 THR OG1 : rot 73:sc= 1.02 USER MOD Single : A 73 THR OG1 : rot 70:sc= 1.16 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -1.85! K(o=-1.8!,f=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= 1.17 K(o=1.2,f=-1) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 93 ASN : amide:sc= -2.15! C(o=-2.2!,f=-11!) USER MOD Single : A 96 THR OG1 : rot -174:sc= -0.385 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.0183 USER MOD Single : A 100 ASN : amide:sc= -0.35 K(o=-0.35,f=-4.8!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.381 -0.358 -14.091 1.00 0.00 N ATOM 2 CA GLY A 1 6.919 -0.655 -12.715 1.00 0.00 C ATOM 3 C GLY A 1 7.966 -0.319 -11.678 1.00 0.00 C ATOM 4 O GLY A 1 8.730 0.634 -11.845 1.00 0.00 O ATOM 0 H1 GLY A 1 6.638 0.160 -14.602 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.243 0.223 -14.050 1.00 0.00 H new ATOM 0 H3 GLY A 1 7.587 -1.248 -14.588 1.00 0.00 H new ATOM 0 HA2 GLY A 1 6.010 -0.090 -12.508 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.661 -1.711 -12.640 1.00 0.00 H new ATOM 7 N ALA A 2 8.012 -1.103 -10.614 1.00 0.00 N ATOM 8 CA ALA A 2 8.956 -0.866 -9.534 1.00 0.00 C ATOM 9 C ALA A 2 10.108 -1.860 -9.589 1.00 0.00 C ATOM 10 O ALA A 2 10.030 -2.883 -10.274 1.00 0.00 O ATOM 11 CB ALA A 2 8.250 -0.947 -8.189 1.00 0.00 C ATOM 0 H ALA A 2 7.405 -1.911 -10.475 1.00 0.00 H new ATOM 0 HA ALA A 2 9.367 0.136 -9.655 1.00 0.00 H new ATOM 0 HB1 ALA A 2 8.969 -0.768 -7.389 1.00 0.00 H new ATOM 0 HB2 ALA A 2 7.463 -0.194 -8.145 1.00 0.00 H new ATOM 0 HB3 ALA A 2 7.812 -1.938 -8.067 1.00 0.00 H new ATOM 17 N MET A 3 11.185 -1.546 -8.880 1.00 0.00 N ATOM 18 CA MET A 3 12.327 -2.444 -8.785 1.00 0.00 C ATOM 19 C MET A 3 12.011 -3.604 -7.847 1.00 0.00 C ATOM 20 O MET A 3 12.071 -3.465 -6.624 1.00 0.00 O ATOM 21 CB MET A 3 13.566 -1.687 -8.296 1.00 0.00 C ATOM 22 CG MET A 3 14.799 -2.562 -8.130 1.00 0.00 C ATOM 23 SD MET A 3 15.303 -3.357 -9.669 1.00 0.00 S ATOM 24 CE MET A 3 16.773 -4.225 -9.129 1.00 0.00 C ATOM 0 H MET A 3 11.291 -0.674 -8.362 1.00 0.00 H new ATOM 0 HA MET A 3 12.536 -2.844 -9.777 1.00 0.00 H new ATOM 0 HB2 MET A 3 13.793 -0.887 -9.001 1.00 0.00 H new ATOM 0 HB3 MET A 3 13.337 -1.214 -7.341 1.00 0.00 H new ATOM 0 HG2 MET A 3 15.622 -1.955 -7.753 1.00 0.00 H new ATOM 0 HG3 MET A 3 14.598 -3.327 -7.380 1.00 0.00 H new ATOM 0 HE1 MET A 3 17.204 -4.768 -9.970 1.00 0.00 H new ATOM 0 HE2 MET A 3 17.500 -3.508 -8.749 1.00 0.00 H new ATOM 0 HE3 MET A 3 16.510 -4.929 -8.339 1.00 0.00 H new ATOM 34 N GLY A 4 11.641 -4.734 -8.424 1.00 0.00 N ATOM 35 CA GLY A 4 11.337 -5.909 -7.638 1.00 0.00 C ATOM 36 C GLY A 4 10.782 -7.034 -8.486 1.00 0.00 C ATOM 37 O GLY A 4 10.428 -6.816 -9.648 1.00 0.00 O ATOM 0 H GLY A 4 11.545 -4.859 -9.432 1.00 0.00 H new ATOM 0 HA2 GLY A 4 12.240 -6.249 -7.131 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.615 -5.650 -6.863 1.00 0.00 H new ATOM 41 N PRO A 5 10.712 -8.256 -7.939 1.00 0.00 N ATOM 42 CA PRO A 5 10.177 -9.413 -8.648 1.00 0.00 C ATOM 43 C PRO A 5 8.664 -9.533 -8.509 1.00 0.00 C ATOM 44 O PRO A 5 7.992 -8.611 -8.035 1.00 0.00 O ATOM 45 CB PRO A 5 10.873 -10.577 -7.949 1.00 0.00 C ATOM 46 CG PRO A 5 11.046 -10.117 -6.540 1.00 0.00 C ATOM 47 CD PRO A 5 11.169 -8.612 -6.583 1.00 0.00 C ATOM 0 HA PRO A 5 10.353 -9.363 -9.722 1.00 0.00 H new ATOM 0 HB2 PRO A 5 10.273 -11.486 -7.999 1.00 0.00 H new ATOM 0 HB3 PRO A 5 11.833 -10.802 -8.414 1.00 0.00 H new ATOM 0 HG2 PRO A 5 10.196 -10.418 -5.928 1.00 0.00 H new ATOM 0 HG3 PRO A 5 11.934 -10.565 -6.094 1.00 0.00 H new ATOM 0 HD2 PRO A 5 10.554 -8.139 -5.817 1.00 0.00 H new ATOM 0 HD3 PRO A 5 12.196 -8.290 -6.410 1.00 0.00 H new ATOM 55 N LYS A 6 8.129 -10.664 -8.934 1.00 0.00 N ATOM 56 CA LYS A 6 6.713 -10.934 -8.799 1.00 0.00 C ATOM 57 C LYS A 6 6.400 -11.498 -7.428 1.00 0.00 C ATOM 58 O LYS A 6 7.119 -12.351 -6.910 1.00 0.00 O ATOM 59 CB LYS A 6 6.252 -11.885 -9.893 1.00 0.00 C ATOM 60 CG LYS A 6 5.993 -11.179 -11.207 1.00 0.00 C ATOM 61 CD LYS A 6 5.967 -12.147 -12.368 1.00 0.00 C ATOM 62 CE LYS A 6 4.921 -13.236 -12.194 1.00 0.00 C ATOM 63 NZ LYS A 6 4.911 -14.164 -13.355 1.00 0.00 N ATOM 0 H LYS A 6 8.660 -11.413 -9.378 1.00 0.00 H new ATOM 0 HA LYS A 6 6.170 -9.995 -8.906 1.00 0.00 H new ATOM 0 HB2 LYS A 6 7.008 -12.656 -10.042 1.00 0.00 H new ATOM 0 HB3 LYS A 6 5.341 -12.390 -9.570 1.00 0.00 H new ATOM 0 HG2 LYS A 6 5.042 -10.649 -11.154 1.00 0.00 H new ATOM 0 HG3 LYS A 6 6.766 -10.430 -11.376 1.00 0.00 H new ATOM 0 HD2 LYS A 6 5.767 -11.599 -13.289 1.00 0.00 H new ATOM 0 HD3 LYS A 6 6.950 -12.606 -12.477 1.00 0.00 H new ATOM 0 HE2 LYS A 6 5.123 -13.795 -11.280 1.00 0.00 H new ATOM 0 HE3 LYS A 6 3.936 -12.783 -12.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 3.948 -14.226 -13.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 5.557 -13.809 -14.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 5.222 -15.108 -13.048 1.00 0.00 H new ATOM 77 N SER A 7 5.325 -11.001 -6.855 1.00 0.00 N ATOM 78 CA SER A 7 4.915 -11.389 -5.515 1.00 0.00 C ATOM 79 C SER A 7 4.153 -12.710 -5.537 1.00 0.00 C ATOM 80 O SER A 7 3.778 -13.201 -6.606 1.00 0.00 O ATOM 81 CB SER A 7 4.052 -10.285 -4.900 1.00 0.00 C ATOM 82 OG SER A 7 4.743 -9.046 -4.894 1.00 0.00 O ATOM 0 H SER A 7 4.710 -10.319 -7.299 1.00 0.00 H new ATOM 0 HA SER A 7 5.808 -11.528 -4.905 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.125 -10.186 -5.464 1.00 0.00 H new ATOM 0 HB3 SER A 7 3.777 -10.558 -3.881 1.00 0.00 H new ATOM 0 HG SER A 7 4.172 -8.355 -4.498 1.00 0.00 H new ATOM 88 N LYS A 8 3.932 -13.279 -4.351 1.00 0.00 N ATOM 89 CA LYS A 8 3.185 -14.526 -4.219 1.00 0.00 C ATOM 90 C LYS A 8 1.832 -14.413 -4.899 1.00 0.00 C ATOM 91 O LYS A 8 1.404 -15.325 -5.596 1.00 0.00 O ATOM 92 CB LYS A 8 2.983 -14.885 -2.748 1.00 0.00 C ATOM 93 CG LYS A 8 4.260 -15.232 -2.008 1.00 0.00 C ATOM 94 CD LYS A 8 3.969 -15.499 -0.544 1.00 0.00 C ATOM 95 CE LYS A 8 5.232 -15.820 0.234 1.00 0.00 C ATOM 96 NZ LYS A 8 4.979 -15.843 1.698 1.00 0.00 N ATOM 0 H LYS A 8 4.262 -12.893 -3.467 1.00 0.00 H new ATOM 0 HA LYS A 8 3.765 -15.313 -4.701 1.00 0.00 H new ATOM 0 HB2 LYS A 8 2.502 -14.046 -2.245 1.00 0.00 H new ATOM 0 HB3 LYS A 8 2.299 -15.731 -2.683 1.00 0.00 H new ATOM 0 HG2 LYS A 8 4.722 -16.110 -2.459 1.00 0.00 H new ATOM 0 HG3 LYS A 8 4.974 -14.414 -2.100 1.00 0.00 H new ATOM 0 HD2 LYS A 8 3.484 -14.627 -0.105 1.00 0.00 H new ATOM 0 HD3 LYS A 8 3.269 -16.330 -0.459 1.00 0.00 H new ATOM 0 HE2 LYS A 8 5.621 -16.787 -0.084 1.00 0.00 H new ATOM 0 HE3 LYS A 8 5.998 -15.079 0.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 5.768 -16.320 2.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 4.897 -14.868 2.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 4.095 -16.356 1.890 1.00 0.00 H new ATOM 110 N GLU A 9 1.175 -13.275 -4.704 1.00 0.00 N ATOM 111 CA GLU A 9 -0.129 -13.025 -5.303 1.00 0.00 C ATOM 112 C GLU A 9 -0.060 -13.147 -6.824 1.00 0.00 C ATOM 113 O GLU A 9 -0.956 -13.702 -7.451 1.00 0.00 O ATOM 114 CB GLU A 9 -0.636 -11.635 -4.907 1.00 0.00 C ATOM 115 CG GLU A 9 0.278 -10.503 -5.353 1.00 0.00 C ATOM 116 CD GLU A 9 -0.205 -9.143 -4.907 1.00 0.00 C ATOM 117 OE1 GLU A 9 0.420 -8.560 -4.001 1.00 0.00 O ATOM 118 OE2 GLU A 9 -1.206 -8.645 -5.466 1.00 0.00 O ATOM 0 H GLU A 9 1.528 -12.507 -4.132 1.00 0.00 H new ATOM 0 HA GLU A 9 -0.826 -13.775 -4.930 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -1.626 -11.482 -5.337 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.749 -11.594 -3.824 1.00 0.00 H new ATOM 0 HG2 GLU A 9 1.279 -10.675 -4.957 1.00 0.00 H new ATOM 0 HG3 GLU A 9 0.358 -10.515 -6.440 1.00 0.00 H new ATOM 125 N GLU A 10 1.028 -12.654 -7.403 1.00 0.00 N ATOM 126 CA GLU A 10 1.213 -12.664 -8.831 1.00 0.00 C ATOM 127 C GLU A 10 1.432 -14.078 -9.340 1.00 0.00 C ATOM 128 O GLU A 10 0.844 -14.487 -10.343 1.00 0.00 O ATOM 129 CB GLU A 10 2.408 -11.789 -9.165 1.00 0.00 C ATOM 130 CG GLU A 10 2.159 -10.321 -8.902 1.00 0.00 C ATOM 131 CD GLU A 10 1.075 -9.760 -9.793 1.00 0.00 C ATOM 132 OE1 GLU A 10 1.411 -9.023 -10.744 1.00 0.00 O ATOM 133 OE2 GLU A 10 -0.110 -10.067 -9.560 1.00 0.00 O ATOM 0 H GLU A 10 1.802 -12.238 -6.886 1.00 0.00 H new ATOM 0 HA GLU A 10 0.318 -12.276 -9.318 1.00 0.00 H new ATOM 0 HB2 GLU A 10 3.266 -12.117 -8.578 1.00 0.00 H new ATOM 0 HB3 GLU A 10 2.669 -11.925 -10.215 1.00 0.00 H new ATOM 0 HG2 GLU A 10 1.877 -10.183 -7.858 1.00 0.00 H new ATOM 0 HG3 GLU A 10 3.082 -9.763 -9.060 1.00 0.00 H new ATOM 140 N LEU A 11 2.275 -14.818 -8.635 1.00 0.00 N ATOM 141 CA LEU A 11 2.582 -16.192 -9.000 1.00 0.00 C ATOM 142 C LEU A 11 1.370 -17.084 -8.769 1.00 0.00 C ATOM 143 O LEU A 11 1.102 -18.001 -9.543 1.00 0.00 O ATOM 144 CB LEU A 11 3.768 -16.705 -8.180 1.00 0.00 C ATOM 145 CG LEU A 11 5.030 -15.840 -8.242 1.00 0.00 C ATOM 146 CD1 LEU A 11 6.101 -16.387 -7.311 1.00 0.00 C ATOM 147 CD2 LEU A 11 5.555 -15.764 -9.668 1.00 0.00 C ATOM 0 H LEU A 11 2.761 -14.487 -7.802 1.00 0.00 H new ATOM 0 HA LEU A 11 2.844 -16.219 -10.058 1.00 0.00 H new ATOM 0 HB2 LEU A 11 3.458 -16.792 -7.139 1.00 0.00 H new ATOM 0 HB3 LEU A 11 4.018 -17.709 -8.523 1.00 0.00 H new ATOM 0 HG LEU A 11 4.771 -14.833 -7.914 1.00 0.00 H new ATOM 0 HD11 LEU A 11 6.990 -15.758 -7.370 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.726 -16.391 -6.288 1.00 0.00 H new ATOM 0 HD13 LEU A 11 6.356 -17.404 -7.608 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.452 -15.145 -9.693 1.00 0.00 H new ATOM 0 HD22 LEU A 11 5.796 -16.767 -10.021 1.00 0.00 H new ATOM 0 HD23 LEU A 11 4.794 -15.325 -10.313 1.00 0.00 H new ATOM 159 N LEU A 12 0.639 -16.803 -7.698 1.00 0.00 N ATOM 160 CA LEU A 12 -0.547 -17.563 -7.359 1.00 0.00 C ATOM 161 C LEU A 12 -1.639 -17.330 -8.393 1.00 0.00 C ATOM 162 O LEU A 12 -2.327 -18.262 -8.783 1.00 0.00 O ATOM 163 CB LEU A 12 -1.036 -17.178 -5.962 1.00 0.00 C ATOM 164 CG LEU A 12 -2.192 -18.017 -5.423 1.00 0.00 C ATOM 165 CD1 LEU A 12 -1.771 -19.468 -5.249 1.00 0.00 C ATOM 166 CD2 LEU A 12 -2.694 -17.440 -4.111 1.00 0.00 C ATOM 0 H LEU A 12 0.853 -16.047 -7.047 1.00 0.00 H new ATOM 0 HA LEU A 12 -0.297 -18.624 -7.359 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -0.199 -17.254 -5.268 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -1.344 -16.132 -5.978 1.00 0.00 H new ATOM 0 HG LEU A 12 -3.006 -17.989 -6.147 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.611 -20.047 -4.864 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -1.461 -19.875 -6.212 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -0.939 -19.524 -4.547 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -3.518 -18.048 -3.738 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.885 -17.438 -3.381 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -3.040 -16.419 -4.271 1.00 0.00 H new ATOM 178 N ARG A 13 -1.774 -16.084 -8.850 1.00 0.00 N ATOM 179 CA ARG A 13 -2.742 -15.743 -9.894 1.00 0.00 C ATOM 180 C ARG A 13 -2.540 -16.606 -11.134 1.00 0.00 C ATOM 181 O ARG A 13 -3.498 -16.963 -11.818 1.00 0.00 O ATOM 182 CB ARG A 13 -2.625 -14.264 -10.276 1.00 0.00 C ATOM 183 CG ARG A 13 -3.313 -13.321 -9.304 1.00 0.00 C ATOM 184 CD ARG A 13 -2.969 -11.870 -9.597 1.00 0.00 C ATOM 185 NE ARG A 13 -3.828 -10.952 -8.851 1.00 0.00 N ATOM 186 CZ ARG A 13 -3.399 -10.067 -7.947 1.00 0.00 C ATOM 187 NH1 ARG A 13 -2.098 -9.886 -7.737 1.00 0.00 N ATOM 188 NH2 ARG A 13 -4.277 -9.321 -7.293 1.00 0.00 N ATOM 0 H ARG A 13 -1.225 -15.293 -8.513 1.00 0.00 H new ATOM 0 HA ARG A 13 -3.738 -15.933 -9.494 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -1.570 -13.998 -10.340 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -3.051 -14.121 -11.269 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -4.393 -13.459 -9.364 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -3.016 -13.568 -8.285 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -1.926 -11.684 -9.340 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -3.073 -11.679 -10.665 1.00 0.00 H new ATOM 0 HE ARG A 13 -4.831 -10.990 -9.035 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -1.416 -10.426 -8.269 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -1.783 -9.207 -7.044 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -5.274 -9.424 -7.481 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -3.956 -8.643 -6.602 1.00 0.00 H new ATOM 202 N GLU A 14 -1.288 -16.945 -11.411 1.00 0.00 N ATOM 203 CA GLU A 14 -0.954 -17.768 -12.566 1.00 0.00 C ATOM 204 C GLU A 14 -1.439 -19.205 -12.372 1.00 0.00 C ATOM 205 O GLU A 14 -1.685 -19.926 -13.338 1.00 0.00 O ATOM 206 CB GLU A 14 0.558 -17.751 -12.796 1.00 0.00 C ATOM 207 CG GLU A 14 1.148 -16.349 -12.825 1.00 0.00 C ATOM 208 CD GLU A 14 2.635 -16.337 -13.101 1.00 0.00 C ATOM 209 OE1 GLU A 14 3.031 -16.021 -14.241 1.00 0.00 O ATOM 210 OE2 GLU A 14 3.421 -16.622 -12.177 1.00 0.00 O ATOM 0 H GLU A 14 -0.485 -16.662 -10.850 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.457 -17.354 -13.440 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.045 -18.326 -12.008 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.780 -18.251 -13.739 1.00 0.00 H new ATOM 0 HG2 GLU A 14 0.638 -15.762 -13.589 1.00 0.00 H new ATOM 0 HG3 GLU A 14 0.958 -15.861 -11.869 1.00 0.00 H new ATOM 217 N LYS A 15 -1.571 -19.611 -11.117 1.00 0.00 N ATOM 218 CA LYS A 15 -2.006 -20.958 -10.782 1.00 0.00 C ATOM 219 C LYS A 15 -3.476 -20.985 -10.366 1.00 0.00 C ATOM 220 O LYS A 15 -4.037 -22.050 -10.092 1.00 0.00 O ATOM 221 CB LYS A 15 -1.144 -21.494 -9.654 1.00 0.00 C ATOM 222 CG LYS A 15 0.341 -21.372 -9.933 1.00 0.00 C ATOM 223 CD LYS A 15 1.159 -21.921 -8.787 1.00 0.00 C ATOM 224 CE LYS A 15 1.527 -23.388 -8.992 1.00 0.00 C ATOM 225 NZ LYS A 15 0.332 -24.257 -9.165 1.00 0.00 N ATOM 0 H LYS A 15 -1.381 -19.020 -10.308 1.00 0.00 H new ATOM 0 HA LYS A 15 -1.899 -21.584 -11.668 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -1.381 -20.956 -8.736 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -1.391 -22.542 -9.482 1.00 0.00 H new ATOM 0 HG2 LYS A 15 0.587 -21.909 -10.849 1.00 0.00 H new ATOM 0 HG3 LYS A 15 0.598 -20.326 -10.098 1.00 0.00 H new ATOM 0 HD2 LYS A 15 2.069 -21.332 -8.678 1.00 0.00 H new ATOM 0 HD3 LYS A 15 0.598 -21.815 -7.859 1.00 0.00 H new ATOM 0 HE2 LYS A 15 2.168 -23.479 -9.869 1.00 0.00 H new ATOM 0 HE3 LYS A 15 2.105 -23.737 -8.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 0.561 -25.226 -8.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -0.450 -23.892 -8.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 0.048 -24.261 -10.165 1.00 0.00 H new ATOM 239 N LEU A 16 -4.088 -19.809 -10.300 1.00 0.00 N ATOM 240 CA LEU A 16 -5.480 -19.689 -9.880 1.00 0.00 C ATOM 241 C LEU A 16 -6.408 -19.539 -11.074 1.00 0.00 C ATOM 242 O LEU A 16 -5.975 -19.267 -12.197 1.00 0.00 O ATOM 243 CB LEU A 16 -5.680 -18.480 -8.959 1.00 0.00 C ATOM 244 CG LEU A 16 -5.013 -18.560 -7.588 1.00 0.00 C ATOM 245 CD1 LEU A 16 -5.385 -17.343 -6.761 1.00 0.00 C ATOM 246 CD2 LEU A 16 -5.404 -19.837 -6.861 1.00 0.00 C ATOM 0 H LEU A 16 -3.641 -18.922 -10.533 1.00 0.00 H new ATOM 0 HA LEU A 16 -5.722 -20.605 -9.342 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.306 -17.594 -9.471 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -6.750 -18.335 -8.812 1.00 0.00 H new ATOM 0 HG LEU A 16 -3.933 -18.577 -7.732 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -4.906 -17.407 -5.784 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -5.050 -16.440 -7.271 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -6.467 -17.307 -6.633 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -4.914 -19.866 -5.888 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.485 -19.861 -6.724 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.094 -20.700 -7.450 1.00 0.00 H new ATOM 258 N SER A 17 -7.691 -19.707 -10.808 1.00 0.00 N ATOM 259 CA SER A 17 -8.721 -19.448 -11.792 1.00 0.00 C ATOM 260 C SER A 17 -8.974 -17.940 -11.858 1.00 0.00 C ATOM 261 O SER A 17 -8.427 -17.183 -11.055 1.00 0.00 O ATOM 262 CB SER A 17 -9.992 -20.213 -11.413 1.00 0.00 C ATOM 263 OG SER A 17 -10.999 -20.086 -12.404 1.00 0.00 O ATOM 0 H SER A 17 -8.045 -20.026 -9.906 1.00 0.00 H new ATOM 0 HA SER A 17 -8.404 -19.790 -12.777 1.00 0.00 H new ATOM 0 HB2 SER A 17 -9.753 -21.267 -11.271 1.00 0.00 H new ATOM 0 HB3 SER A 17 -10.370 -19.841 -10.461 1.00 0.00 H new ATOM 0 HG SER A 17 -11.781 -19.636 -12.020 1.00 0.00 H new ATOM 269 N GLU A 18 -9.810 -17.503 -12.788 1.00 0.00 N ATOM 270 CA GLU A 18 -9.992 -16.077 -13.035 1.00 0.00 C ATOM 271 C GLU A 18 -10.831 -15.453 -11.932 1.00 0.00 C ATOM 272 O GLU A 18 -10.590 -14.320 -11.508 1.00 0.00 O ATOM 273 CB GLU A 18 -10.646 -15.860 -14.396 1.00 0.00 C ATOM 274 CG GLU A 18 -9.864 -16.481 -15.541 1.00 0.00 C ATOM 275 CD GLU A 18 -10.573 -16.339 -16.866 1.00 0.00 C ATOM 276 OE1 GLU A 18 -11.361 -17.240 -17.223 1.00 0.00 O ATOM 277 OE2 GLU A 18 -10.353 -15.322 -17.556 1.00 0.00 O ATOM 0 H GLU A 18 -10.372 -18.111 -13.383 1.00 0.00 H new ATOM 0 HA GLU A 18 -9.016 -15.592 -13.038 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -11.651 -16.281 -14.380 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -10.752 -14.790 -14.575 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -8.883 -16.010 -15.605 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -9.697 -17.538 -15.333 1.00 0.00 H new ATOM 284 N ASP A 19 -11.799 -16.214 -11.461 1.00 0.00 N ATOM 285 CA ASP A 19 -12.653 -15.794 -10.363 1.00 0.00 C ATOM 286 C ASP A 19 -11.847 -15.696 -9.071 1.00 0.00 C ATOM 287 O ASP A 19 -12.013 -14.754 -8.300 1.00 0.00 O ATOM 288 CB ASP A 19 -13.827 -16.774 -10.207 1.00 0.00 C ATOM 289 CG ASP A 19 -13.395 -18.211 -9.990 1.00 0.00 C ATOM 290 OD1 ASP A 19 -13.907 -18.855 -9.052 1.00 0.00 O ATOM 291 OD2 ASP A 19 -12.562 -18.712 -10.772 1.00 0.00 O ATOM 0 H ASP A 19 -12.017 -17.141 -11.827 1.00 0.00 H new ATOM 0 HA ASP A 19 -13.057 -14.806 -10.584 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -14.443 -16.458 -9.365 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -14.453 -16.722 -11.098 1.00 0.00 H new ATOM 296 N GLN A 20 -10.939 -16.645 -8.880 1.00 0.00 N ATOM 297 CA GLN A 20 -10.118 -16.707 -7.673 1.00 0.00 C ATOM 298 C GLN A 20 -9.176 -15.504 -7.563 1.00 0.00 C ATOM 299 O GLN A 20 -8.887 -15.032 -6.464 1.00 0.00 O ATOM 300 CB GLN A 20 -9.323 -18.015 -7.659 1.00 0.00 C ATOM 301 CG GLN A 20 -10.211 -19.247 -7.590 1.00 0.00 C ATOM 302 CD GLN A 20 -9.430 -20.542 -7.673 1.00 0.00 C ATOM 303 OE1 GLN A 20 -8.371 -20.607 -8.297 1.00 0.00 O ATOM 304 NE2 GLN A 20 -9.949 -21.586 -7.050 1.00 0.00 N ATOM 0 H GLN A 20 -10.750 -17.389 -9.551 1.00 0.00 H new ATOM 0 HA GLN A 20 -10.782 -16.676 -6.809 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -8.705 -18.068 -8.556 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -8.646 -18.013 -6.805 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -10.777 -19.229 -6.659 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -10.935 -19.213 -8.404 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -10.829 -21.492 -6.543 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -9.469 -22.486 -7.076 1.00 0.00 H new ATOM 313 N LYS A 21 -8.710 -15.006 -8.705 1.00 0.00 N ATOM 314 CA LYS A 21 -7.836 -13.831 -8.729 1.00 0.00 C ATOM 315 C LYS A 21 -8.573 -12.611 -8.195 1.00 0.00 C ATOM 316 O LYS A 21 -8.009 -11.800 -7.464 1.00 0.00 O ATOM 317 CB LYS A 21 -7.374 -13.530 -10.152 1.00 0.00 C ATOM 318 CG LYS A 21 -6.728 -14.699 -10.865 1.00 0.00 C ATOM 319 CD LYS A 21 -6.414 -14.335 -12.301 1.00 0.00 C ATOM 320 CE LYS A 21 -5.978 -15.541 -13.108 1.00 0.00 C ATOM 321 NZ LYS A 21 -5.676 -15.172 -14.512 1.00 0.00 N ATOM 0 H LYS A 21 -8.921 -15.394 -9.624 1.00 0.00 H new ATOM 0 HA LYS A 21 -6.972 -14.049 -8.101 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -8.232 -13.195 -10.735 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -6.665 -12.702 -10.123 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -5.813 -14.987 -10.348 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -7.394 -15.562 -10.839 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -7.294 -13.888 -12.763 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -5.627 -13.581 -12.321 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -5.096 -15.988 -12.650 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -6.764 -16.296 -13.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -5.381 -16.019 -15.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -6.526 -14.768 -14.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -4.910 -14.469 -14.529 1.00 0.00 H new ATOM 335 N THR A 22 -9.837 -12.496 -8.571 1.00 0.00 N ATOM 336 CA THR A 22 -10.660 -11.369 -8.167 1.00 0.00 C ATOM 337 C THR A 22 -10.808 -11.324 -6.647 1.00 0.00 C ATOM 338 O THR A 22 -10.812 -10.252 -6.039 1.00 0.00 O ATOM 339 CB THR A 22 -12.048 -11.450 -8.828 1.00 0.00 C ATOM 340 OG1 THR A 22 -11.893 -11.688 -10.235 1.00 0.00 O ATOM 341 CG2 THR A 22 -12.838 -10.166 -8.613 1.00 0.00 C ATOM 0 H THR A 22 -10.318 -13.176 -9.160 1.00 0.00 H new ATOM 0 HA THR A 22 -10.166 -10.455 -8.496 1.00 0.00 H new ATOM 0 HB THR A 22 -12.599 -12.270 -8.368 1.00 0.00 H new ATOM 0 HG1 THR A 22 -12.776 -11.742 -10.657 1.00 0.00 H new ATOM 0 HG21 THR A 22 -13.813 -10.254 -9.092 1.00 0.00 H new ATOM 0 HG22 THR A 22 -12.972 -9.996 -7.545 1.00 0.00 H new ATOM 0 HG23 THR A 22 -12.295 -9.327 -9.049 1.00 0.00 H new ATOM 349 N HIS A 23 -10.895 -12.496 -6.033 1.00 0.00 N ATOM 350 CA HIS A 23 -11.039 -12.581 -4.590 1.00 0.00 C ATOM 351 C HIS A 23 -9.713 -12.318 -3.892 1.00 0.00 C ATOM 352 O HIS A 23 -9.687 -12.034 -2.701 1.00 0.00 O ATOM 353 CB HIS A 23 -11.611 -13.938 -4.182 1.00 0.00 C ATOM 354 CG HIS A 23 -13.004 -14.151 -4.685 1.00 0.00 C ATOM 355 ND1 HIS A 23 -13.273 -15.052 -5.680 1.00 0.00 N ATOM 356 CD2 HIS A 23 -14.154 -13.530 -4.325 1.00 0.00 C ATOM 357 CE1 HIS A 23 -14.569 -14.956 -5.911 1.00 0.00 C ATOM 358 NE2 HIS A 23 -15.147 -14.048 -5.115 1.00 0.00 N ATOM 0 H HIS A 23 -10.868 -13.397 -6.511 1.00 0.00 H new ATOM 0 HA HIS A 23 -11.741 -11.808 -4.275 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -10.966 -14.729 -4.564 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -11.605 -14.018 -3.095 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -14.266 -12.773 -3.563 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -15.098 -15.538 -6.651 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -16.134 -13.792 -5.099 1.00 0.00 H new ATOM 366 N LEU A 24 -8.613 -12.401 -4.634 1.00 0.00 N ATOM 367 CA LEU A 24 -7.319 -12.009 -4.104 1.00 0.00 C ATOM 368 C LEU A 24 -7.282 -10.504 -3.888 1.00 0.00 C ATOM 369 O LEU A 24 -6.891 -10.032 -2.823 1.00 0.00 O ATOM 370 CB LEU A 24 -6.191 -12.425 -5.046 1.00 0.00 C ATOM 371 CG LEU A 24 -5.753 -13.884 -4.950 1.00 0.00 C ATOM 372 CD1 LEU A 24 -4.540 -14.125 -5.832 1.00 0.00 C ATOM 373 CD2 LEU A 24 -5.451 -14.271 -3.510 1.00 0.00 C ATOM 0 H LEU A 24 -8.595 -12.734 -5.598 1.00 0.00 H new ATOM 0 HA LEU A 24 -7.173 -12.517 -3.151 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -6.506 -12.226 -6.070 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -5.326 -11.791 -4.850 1.00 0.00 H new ATOM 0 HG LEU A 24 -6.573 -14.511 -5.300 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -4.236 -15.169 -5.756 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.792 -13.895 -6.867 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -3.721 -13.484 -5.507 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -5.141 -15.315 -3.471 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -4.650 -13.640 -3.124 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -6.345 -14.135 -2.901 1.00 0.00 H new ATOM 385 N ASP A 25 -7.704 -9.758 -4.902 1.00 0.00 N ATOM 386 CA ASP A 25 -7.789 -8.307 -4.804 1.00 0.00 C ATOM 387 C ASP A 25 -8.781 -7.904 -3.725 1.00 0.00 C ATOM 388 O ASP A 25 -8.545 -6.962 -2.967 1.00 0.00 O ATOM 389 CB ASP A 25 -8.209 -7.698 -6.143 1.00 0.00 C ATOM 390 CG ASP A 25 -7.125 -7.791 -7.195 1.00 0.00 C ATOM 391 OD1 ASP A 25 -7.048 -8.826 -7.889 1.00 0.00 O ATOM 392 OD2 ASP A 25 -6.341 -6.829 -7.339 1.00 0.00 O ATOM 0 H ASP A 25 -7.993 -10.136 -5.804 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.802 -7.929 -4.539 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -9.103 -8.206 -6.503 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -8.475 -6.652 -5.994 1.00 0.00 H new ATOM 397 N TRP A 26 -9.889 -8.632 -3.659 1.00 0.00 N ATOM 398 CA TRP A 26 -10.908 -8.395 -2.647 1.00 0.00 C ATOM 399 C TRP A 26 -10.353 -8.675 -1.250 1.00 0.00 C ATOM 400 O TRP A 26 -10.519 -7.870 -0.334 1.00 0.00 O ATOM 401 CB TRP A 26 -12.130 -9.278 -2.921 1.00 0.00 C ATOM 402 CG TRP A 26 -13.276 -9.032 -1.987 1.00 0.00 C ATOM 403 CD1 TRP A 26 -14.301 -8.146 -2.164 1.00 0.00 C ATOM 404 CD2 TRP A 26 -13.520 -9.683 -0.732 1.00 0.00 C ATOM 405 NE1 TRP A 26 -15.162 -8.202 -1.095 1.00 0.00 N ATOM 406 CE2 TRP A 26 -14.707 -9.140 -0.205 1.00 0.00 C ATOM 407 CE3 TRP A 26 -12.849 -10.672 -0.005 1.00 0.00 C ATOM 408 CZ2 TRP A 26 -15.233 -9.552 1.016 1.00 0.00 C ATOM 409 CZ3 TRP A 26 -13.375 -11.081 1.205 1.00 0.00 C ATOM 410 CH2 TRP A 26 -14.555 -10.521 1.705 1.00 0.00 C ATOM 0 H TRP A 26 -10.104 -9.396 -4.299 1.00 0.00 H new ATOM 0 HA TRP A 26 -11.209 -7.348 -2.692 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -12.465 -9.111 -3.945 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -11.834 -10.325 -2.850 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -14.417 -7.497 -3.019 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -16.004 -7.637 -0.982 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -11.936 -11.108 -0.383 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -16.144 -9.122 1.406 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -12.867 -11.845 1.774 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -14.940 -10.861 2.655 1.00 0.00 H new ATOM 421 N LEU A 27 -9.687 -9.815 -1.099 1.00 0.00 N ATOM 422 CA LEU A 27 -9.121 -10.211 0.185 1.00 0.00 C ATOM 423 C LEU A 27 -7.984 -9.280 0.584 1.00 0.00 C ATOM 424 O LEU A 27 -7.767 -9.026 1.766 1.00 0.00 O ATOM 425 CB LEU A 27 -8.621 -11.656 0.127 1.00 0.00 C ATOM 426 CG LEU A 27 -8.059 -12.204 1.438 1.00 0.00 C ATOM 427 CD1 LEU A 27 -9.100 -12.123 2.541 1.00 0.00 C ATOM 428 CD2 LEU A 27 -7.598 -13.638 1.253 1.00 0.00 C ATOM 0 H LEU A 27 -9.526 -10.483 -1.853 1.00 0.00 H new ATOM 0 HA LEU A 27 -9.906 -10.141 0.938 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -9.444 -12.296 -0.192 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -7.848 -11.725 -0.638 1.00 0.00 H new ATOM 0 HG LEU A 27 -7.203 -11.595 1.728 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -8.681 -12.518 3.467 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -9.393 -11.084 2.690 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.975 -12.709 2.260 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -7.200 -14.016 2.194 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -8.442 -14.254 0.942 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -6.821 -13.675 0.489 1.00 0.00 H new ATOM 440 N LYS A 28 -7.265 -8.778 -0.410 1.00 0.00 N ATOM 441 CA LYS A 28 -6.209 -7.804 -0.186 1.00 0.00 C ATOM 442 C LYS A 28 -6.777 -6.568 0.500 1.00 0.00 C ATOM 443 O LYS A 28 -6.189 -6.040 1.443 1.00 0.00 O ATOM 444 CB LYS A 28 -5.574 -7.429 -1.524 1.00 0.00 C ATOM 445 CG LYS A 28 -4.133 -6.979 -1.423 1.00 0.00 C ATOM 446 CD LYS A 28 -3.551 -6.736 -2.802 1.00 0.00 C ATOM 447 CE LYS A 28 -2.046 -6.598 -2.741 1.00 0.00 C ATOM 448 NZ LYS A 28 -1.459 -6.324 -4.078 1.00 0.00 N ATOM 0 H LYS A 28 -7.397 -9.033 -1.389 1.00 0.00 H new ATOM 0 HA LYS A 28 -5.446 -8.236 0.461 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -5.628 -8.288 -2.193 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.161 -6.632 -1.981 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -4.072 -6.066 -0.831 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -3.546 -7.736 -0.903 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -3.817 -7.561 -3.463 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -3.985 -5.832 -3.229 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -1.783 -5.791 -2.057 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -1.614 -7.513 -2.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -0.425 -6.253 -3.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -1.702 -7.098 -4.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -1.839 -5.429 -4.447 1.00 0.00 H new ATOM 462 N GLU A 29 -7.940 -6.131 0.029 1.00 0.00 N ATOM 463 CA GLU A 29 -8.645 -5.006 0.629 1.00 0.00 C ATOM 464 C GLU A 29 -9.230 -5.400 1.982 1.00 0.00 C ATOM 465 O GLU A 29 -9.208 -4.621 2.936 1.00 0.00 O ATOM 466 CB GLU A 29 -9.761 -4.532 -0.301 1.00 0.00 C ATOM 467 CG GLU A 29 -9.263 -4.001 -1.632 1.00 0.00 C ATOM 468 CD GLU A 29 -8.506 -2.697 -1.496 1.00 0.00 C ATOM 469 OE1 GLU A 29 -9.149 -1.629 -1.598 1.00 0.00 O ATOM 470 OE2 GLU A 29 -7.272 -2.733 -1.294 1.00 0.00 O ATOM 0 H GLU A 29 -8.417 -6.543 -0.773 1.00 0.00 H new ATOM 0 HA GLU A 29 -7.934 -4.193 0.780 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -10.446 -5.360 -0.484 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -10.332 -3.751 0.201 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -8.616 -4.745 -2.096 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -10.111 -3.856 -2.301 1.00 0.00 H new ATOM 477 N ALA A 30 -9.750 -6.621 2.045 1.00 0.00 N ATOM 478 CA ALA A 30 -10.343 -7.155 3.265 1.00 0.00 C ATOM 479 C ALA A 30 -9.325 -7.184 4.397 1.00 0.00 C ATOM 480 O ALA A 30 -9.593 -6.702 5.496 1.00 0.00 O ATOM 481 CB ALA A 30 -10.891 -8.554 3.012 1.00 0.00 C ATOM 0 H ALA A 30 -9.772 -7.266 1.255 1.00 0.00 H new ATOM 0 HA ALA A 30 -11.163 -6.501 3.562 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -11.332 -8.944 3.930 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -11.653 -8.511 2.233 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.081 -9.210 2.692 1.00 0.00 H new ATOM 487 N LEU A 31 -8.159 -7.744 4.116 1.00 0.00 N ATOM 488 CA LEU A 31 -7.093 -7.843 5.100 1.00 0.00 C ATOM 489 C LEU A 31 -6.432 -6.489 5.328 1.00 0.00 C ATOM 490 O LEU A 31 -6.052 -6.157 6.450 1.00 0.00 O ATOM 491 CB LEU A 31 -6.060 -8.879 4.649 1.00 0.00 C ATOM 492 CG LEU A 31 -6.569 -10.322 4.646 1.00 0.00 C ATOM 493 CD1 LEU A 31 -5.496 -11.275 4.153 1.00 0.00 C ATOM 494 CD2 LEU A 31 -7.047 -10.729 6.032 1.00 0.00 C ATOM 0 H LEU A 31 -7.926 -8.140 3.206 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.526 -8.166 6.047 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -5.723 -8.624 3.644 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.190 -8.815 5.303 1.00 0.00 H new ATOM 0 HG LEU A 31 -7.415 -10.377 3.961 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -5.883 -12.294 4.161 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -5.207 -11.004 3.137 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.626 -11.213 4.806 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -7.404 -11.758 6.006 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -6.222 -10.649 6.739 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.858 -10.071 6.345 1.00 0.00 H new ATOM 506 N GLY A 32 -6.288 -5.714 4.259 1.00 0.00 N ATOM 507 CA GLY A 32 -5.733 -4.379 4.374 1.00 0.00 C ATOM 508 C GLY A 32 -4.218 -4.377 4.433 1.00 0.00 C ATOM 509 O GLY A 32 -3.565 -3.573 3.765 1.00 0.00 O ATOM 0 H GLY A 32 -6.547 -5.988 3.311 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -6.060 -3.780 3.524 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -6.128 -3.902 5.271 1.00 0.00 H new ATOM 513 N ASN A 33 -3.661 -5.268 5.237 1.00 0.00 N ATOM 514 CA ASN A 33 -2.220 -5.360 5.398 1.00 0.00 C ATOM 515 C ASN A 33 -1.643 -6.424 4.478 1.00 0.00 C ATOM 516 O ASN A 33 -2.057 -7.586 4.517 1.00 0.00 O ATOM 517 CB ASN A 33 -1.858 -5.659 6.853 1.00 0.00 C ATOM 518 CG ASN A 33 -2.087 -4.469 7.766 1.00 0.00 C ATOM 519 OD1 ASN A 33 -2.942 -3.621 7.509 1.00 0.00 O ATOM 520 ND2 ASN A 33 -1.313 -4.389 8.830 1.00 0.00 N ATOM 0 H ASN A 33 -4.189 -5.942 5.791 1.00 0.00 H new ATOM 0 HA ASN A 33 -1.786 -4.398 5.125 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -2.451 -6.503 7.206 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -0.812 -5.960 6.909 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -1.411 -3.604 9.474 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -0.616 -5.112 9.009 1.00 0.00 H new ATOM 527 N ASP A 34 -0.685 -6.014 3.657 1.00 0.00 N ATOM 528 CA ASP A 34 -0.075 -6.896 2.667 1.00 0.00 C ATOM 529 C ASP A 34 0.613 -8.073 3.346 1.00 0.00 C ATOM 530 O ASP A 34 0.598 -9.189 2.833 1.00 0.00 O ATOM 531 CB ASP A 34 0.940 -6.132 1.811 1.00 0.00 C ATOM 532 CG ASP A 34 0.341 -4.913 1.141 1.00 0.00 C ATOM 533 OD1 ASP A 34 0.620 -3.786 1.600 1.00 0.00 O ATOM 534 OD2 ASP A 34 -0.423 -5.071 0.167 1.00 0.00 O ATOM 0 H ASP A 34 -0.309 -5.066 3.657 1.00 0.00 H new ATOM 0 HA ASP A 34 -0.869 -7.273 2.022 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.777 -5.823 2.437 1.00 0.00 H new ATOM 0 HB3 ASP A 34 1.342 -6.800 1.049 1.00 0.00 H new ATOM 539 N GLY A 35 1.204 -7.818 4.506 1.00 0.00 N ATOM 540 CA GLY A 35 1.871 -8.868 5.252 1.00 0.00 C ATOM 541 C GLY A 35 0.914 -9.946 5.721 1.00 0.00 C ATOM 542 O GLY A 35 1.267 -11.124 5.758 1.00 0.00 O ATOM 0 H GLY A 35 1.233 -6.898 4.946 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.643 -9.319 4.628 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.374 -8.432 6.116 1.00 0.00 H new ATOM 546 N GLU A 36 -0.303 -9.551 6.070 1.00 0.00 N ATOM 547 CA GLU A 36 -1.310 -10.507 6.504 1.00 0.00 C ATOM 548 C GLU A 36 -1.910 -11.232 5.303 1.00 0.00 C ATOM 549 O GLU A 36 -2.361 -12.369 5.410 1.00 0.00 O ATOM 550 CB GLU A 36 -2.396 -9.801 7.312 1.00 0.00 C ATOM 551 CG GLU A 36 -1.864 -9.112 8.559 1.00 0.00 C ATOM 552 CD GLU A 36 -1.098 -10.058 9.470 1.00 0.00 C ATOM 553 OE1 GLU A 36 -0.095 -9.628 10.078 1.00 0.00 O ATOM 554 OE2 GLU A 36 -1.483 -11.240 9.570 1.00 0.00 O ATOM 0 H GLU A 36 -0.615 -8.580 6.061 1.00 0.00 H new ATOM 0 HA GLU A 36 -0.835 -11.250 7.145 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.888 -9.063 6.679 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.154 -10.528 7.602 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -1.212 -8.290 8.265 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -2.696 -8.676 9.112 1.00 0.00 H new ATOM 561 N PHE A 37 -1.898 -10.570 4.155 1.00 0.00 N ATOM 562 CA PHE A 37 -2.332 -11.191 2.912 1.00 0.00 C ATOM 563 C PHE A 37 -1.269 -12.189 2.447 1.00 0.00 C ATOM 564 O PHE A 37 -1.582 -13.236 1.879 1.00 0.00 O ATOM 565 CB PHE A 37 -2.601 -10.106 1.859 1.00 0.00 C ATOM 566 CG PHE A 37 -3.126 -10.614 0.544 1.00 0.00 C ATOM 567 CD1 PHE A 37 -2.421 -10.392 -0.629 1.00 0.00 C ATOM 568 CD2 PHE A 37 -4.328 -11.298 0.479 1.00 0.00 C ATOM 569 CE1 PHE A 37 -2.910 -10.841 -1.842 1.00 0.00 C ATOM 570 CE2 PHE A 37 -4.818 -11.753 -0.729 1.00 0.00 C ATOM 571 CZ PHE A 37 -4.110 -11.523 -1.893 1.00 0.00 C ATOM 0 H PHE A 37 -1.592 -9.602 4.059 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.262 -11.738 3.066 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -3.317 -9.393 2.268 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.676 -9.560 1.677 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.480 -9.863 -0.595 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -4.889 -11.478 1.384 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.354 -10.658 -2.749 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -5.755 -12.289 -0.764 1.00 0.00 H new ATOM 0 HZ PHE A 37 -4.493 -11.875 -2.839 1.00 0.00 H new ATOM 581 N ASP A 38 -0.012 -11.858 2.729 1.00 0.00 N ATOM 582 CA ASP A 38 1.122 -12.756 2.496 1.00 0.00 C ATOM 583 C ASP A 38 0.914 -14.078 3.211 1.00 0.00 C ATOM 584 O ASP A 38 1.180 -15.149 2.664 1.00 0.00 O ATOM 585 CB ASP A 38 2.401 -12.113 3.020 1.00 0.00 C ATOM 586 CG ASP A 38 3.613 -13.018 2.902 1.00 0.00 C ATOM 587 OD1 ASP A 38 4.141 -13.449 3.952 1.00 0.00 O ATOM 588 OD2 ASP A 38 4.041 -13.308 1.771 1.00 0.00 O ATOM 0 H ASP A 38 0.253 -10.957 3.127 1.00 0.00 H new ATOM 0 HA ASP A 38 1.201 -12.936 1.424 1.00 0.00 H new ATOM 0 HB2 ASP A 38 2.589 -11.191 2.470 1.00 0.00 H new ATOM 0 HB3 ASP A 38 2.261 -11.838 4.065 1.00 0.00 H new ATOM 593 N LYS A 39 0.457 -13.971 4.448 1.00 0.00 N ATOM 594 CA LYS A 39 0.125 -15.135 5.272 1.00 0.00 C ATOM 595 C LYS A 39 -0.765 -16.106 4.494 1.00 0.00 C ATOM 596 O LYS A 39 -0.464 -17.294 4.387 1.00 0.00 O ATOM 597 CB LYS A 39 -0.598 -14.688 6.551 1.00 0.00 C ATOM 598 CG LYS A 39 -0.866 -15.816 7.540 1.00 0.00 C ATOM 599 CD LYS A 39 0.308 -16.032 8.488 1.00 0.00 C ATOM 600 CE LYS A 39 0.207 -15.160 9.740 1.00 0.00 C ATOM 601 NZ LYS A 39 0.213 -13.703 9.429 1.00 0.00 N ATOM 0 H LYS A 39 0.304 -13.077 4.915 1.00 0.00 H new ATOM 0 HA LYS A 39 1.052 -15.642 5.540 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -0.001 -13.921 7.044 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -1.547 -14.226 6.277 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -1.762 -15.587 8.118 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -1.066 -16.738 6.994 1.00 0.00 H new ATOM 0 HD2 LYS A 39 0.348 -17.081 8.780 1.00 0.00 H new ATOM 0 HD3 LYS A 39 1.239 -15.810 7.967 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -0.708 -15.409 10.278 1.00 0.00 H new ATOM 0 HE3 LYS A 39 1.040 -15.389 10.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 0.296 -13.160 10.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 1.019 -13.483 8.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -0.673 -13.447 8.948 1.00 0.00 H new ATOM 615 N PHE A 40 -1.849 -15.573 3.937 1.00 0.00 N ATOM 616 CA PHE A 40 -2.797 -16.358 3.153 1.00 0.00 C ATOM 617 C PHE A 40 -2.132 -16.911 1.893 1.00 0.00 C ATOM 618 O PHE A 40 -2.356 -18.059 1.514 1.00 0.00 O ATOM 619 CB PHE A 40 -4.000 -15.482 2.785 1.00 0.00 C ATOM 620 CG PHE A 40 -5.033 -16.173 1.937 1.00 0.00 C ATOM 621 CD1 PHE A 40 -6.016 -16.959 2.517 1.00 0.00 C ATOM 622 CD2 PHE A 40 -5.025 -16.026 0.559 1.00 0.00 C ATOM 623 CE1 PHE A 40 -6.969 -17.588 1.738 1.00 0.00 C ATOM 624 CE2 PHE A 40 -5.974 -16.652 -0.224 1.00 0.00 C ATOM 625 CZ PHE A 40 -6.948 -17.434 0.366 1.00 0.00 C ATOM 0 H PHE A 40 -2.094 -14.586 4.016 1.00 0.00 H new ATOM 0 HA PHE A 40 -3.137 -17.204 3.750 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -4.474 -15.133 3.702 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -3.643 -14.599 2.255 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -6.038 -17.081 3.590 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -4.267 -15.414 0.092 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -7.729 -18.199 2.202 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -5.955 -16.530 -1.297 1.00 0.00 H new ATOM 0 HZ PHE A 40 -7.692 -17.924 -0.245 1.00 0.00 H new ATOM 635 N LEU A 41 -1.304 -16.090 1.262 1.00 0.00 N ATOM 636 CA LEU A 41 -0.610 -16.478 0.036 1.00 0.00 C ATOM 637 C LEU A 41 0.409 -17.588 0.291 1.00 0.00 C ATOM 638 O LEU A 41 0.854 -18.258 -0.643 1.00 0.00 O ATOM 639 CB LEU A 41 0.103 -15.269 -0.570 1.00 0.00 C ATOM 640 CG LEU A 41 -0.801 -14.099 -0.952 1.00 0.00 C ATOM 641 CD1 LEU A 41 0.037 -12.920 -1.419 1.00 0.00 C ATOM 642 CD2 LEU A 41 -1.790 -14.513 -2.030 1.00 0.00 C ATOM 0 H LEU A 41 -1.094 -15.144 1.580 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.361 -16.854 -0.659 1.00 0.00 H new ATOM 0 HB2 LEU A 41 0.848 -14.913 0.142 1.00 0.00 H new ATOM 0 HB3 LEU A 41 0.642 -15.595 -1.459 1.00 0.00 H new ATOM 0 HG LEU A 41 -1.368 -13.797 -0.071 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -0.618 -12.092 -1.689 1.00 0.00 H new ATOM 0 HD12 LEU A 41 0.705 -12.608 -0.616 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.626 -13.214 -2.288 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -2.424 -13.665 -2.287 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -1.246 -14.841 -2.916 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -2.410 -15.330 -1.661 1.00 0.00 H new ATOM 654 N GLY A 42 0.774 -17.776 1.552 1.00 0.00 N ATOM 655 CA GLY A 42 1.762 -18.777 1.899 1.00 0.00 C ATOM 656 C GLY A 42 1.140 -20.084 2.349 1.00 0.00 C ATOM 657 O GLY A 42 1.767 -20.861 3.072 1.00 0.00 O ATOM 0 H GLY A 42 0.402 -17.251 2.343 1.00 0.00 H new ATOM 0 HA2 GLY A 42 2.403 -18.963 1.037 1.00 0.00 H new ATOM 0 HA3 GLY A 42 2.400 -18.391 2.694 1.00 0.00 H new ATOM 661 N TYR A 43 -0.094 -20.327 1.936 1.00 0.00 N ATOM 662 CA TYR A 43 -0.774 -21.569 2.273 1.00 0.00 C ATOM 663 C TYR A 43 -0.837 -22.514 1.083 1.00 0.00 C ATOM 664 O TYR A 43 -0.411 -22.173 -0.022 1.00 0.00 O ATOM 665 CB TYR A 43 -2.183 -21.292 2.793 1.00 0.00 C ATOM 666 CG TYR A 43 -2.210 -20.879 4.242 1.00 0.00 C ATOM 667 CD1 TYR A 43 -2.741 -19.658 4.634 1.00 0.00 C ATOM 668 CD2 TYR A 43 -1.699 -21.719 5.220 1.00 0.00 C ATOM 669 CE1 TYR A 43 -2.766 -19.289 5.965 1.00 0.00 C ATOM 670 CE2 TYR A 43 -1.721 -21.359 6.548 1.00 0.00 C ATOM 671 CZ TYR A 43 -2.253 -20.142 6.919 1.00 0.00 C ATOM 672 OH TYR A 43 -2.277 -19.781 8.245 1.00 0.00 O ATOM 0 H TYR A 43 -0.645 -19.683 1.368 1.00 0.00 H new ATOM 0 HA TYR A 43 -0.194 -22.052 3.059 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -2.638 -20.507 2.189 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -2.793 -22.186 2.665 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -3.140 -18.987 3.888 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -1.277 -22.671 4.935 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -3.185 -18.337 6.257 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -1.323 -22.027 7.297 1.00 0.00 H new ATOM 0 HH TYR A 43 -1.878 -20.494 8.786 1.00 0.00 H new ATOM 682 N ASP A 44 -1.354 -23.712 1.329 1.00 0.00 N ATOM 683 CA ASP A 44 -1.532 -24.710 0.276 1.00 0.00 C ATOM 684 C ASP A 44 -2.537 -24.214 -0.750 1.00 0.00 C ATOM 685 O ASP A 44 -3.564 -23.643 -0.379 1.00 0.00 O ATOM 686 CB ASP A 44 -2.046 -26.023 0.868 1.00 0.00 C ATOM 687 CG ASP A 44 -1.877 -27.203 -0.070 1.00 0.00 C ATOM 688 OD1 ASP A 44 -1.101 -28.121 0.266 1.00 0.00 O ATOM 689 OD2 ASP A 44 -2.525 -27.229 -1.134 1.00 0.00 O ATOM 0 H ASP A 44 -1.659 -24.019 2.253 1.00 0.00 H new ATOM 0 HA ASP A 44 -0.566 -24.876 -0.201 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -1.517 -26.227 1.799 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -3.101 -25.914 1.119 1.00 0.00 H new ATOM 694 N GLU A 45 -2.253 -24.445 -2.027 1.00 0.00 N ATOM 695 CA GLU A 45 -3.172 -24.083 -3.092 1.00 0.00 C ATOM 696 C GLU A 45 -4.540 -24.702 -2.859 1.00 0.00 C ATOM 697 O GLU A 45 -5.566 -24.081 -3.126 1.00 0.00 O ATOM 698 CB GLU A 45 -2.630 -24.544 -4.439 1.00 0.00 C ATOM 699 CG GLU A 45 -1.602 -23.609 -5.040 1.00 0.00 C ATOM 700 CD GLU A 45 -1.109 -24.092 -6.386 1.00 0.00 C ATOM 701 OE1 GLU A 45 -1.806 -23.864 -7.398 1.00 0.00 O ATOM 702 OE2 GLU A 45 -0.024 -24.699 -6.445 1.00 0.00 O ATOM 0 H GLU A 45 -1.389 -24.883 -2.347 1.00 0.00 H new ATOM 0 HA GLU A 45 -3.272 -22.998 -3.095 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -2.184 -25.531 -4.321 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.461 -24.651 -5.136 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -2.037 -22.615 -5.149 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -0.757 -23.514 -4.358 1.00 0.00 H new ATOM 709 N SER A 46 -4.541 -25.920 -2.339 1.00 0.00 N ATOM 710 CA SER A 46 -5.773 -26.641 -2.083 1.00 0.00 C ATOM 711 C SER A 46 -6.615 -25.900 -1.054 1.00 0.00 C ATOM 712 O SER A 46 -7.835 -25.848 -1.159 1.00 0.00 O ATOM 713 CB SER A 46 -5.457 -28.050 -1.585 1.00 0.00 C ATOM 714 OG SER A 46 -4.421 -28.636 -2.358 1.00 0.00 O ATOM 0 H SER A 46 -3.695 -26.430 -2.085 1.00 0.00 H new ATOM 0 HA SER A 46 -6.339 -26.710 -3.012 1.00 0.00 H new ATOM 0 HB2 SER A 46 -5.158 -28.012 -0.537 1.00 0.00 H new ATOM 0 HB3 SER A 46 -6.352 -28.669 -1.639 1.00 0.00 H new ATOM 0 HG SER A 46 -3.551 -28.346 -2.012 1.00 0.00 H new ATOM 720 N LYS A 47 -5.951 -25.294 -0.079 1.00 0.00 N ATOM 721 CA LYS A 47 -6.650 -24.604 0.992 1.00 0.00 C ATOM 722 C LYS A 47 -6.994 -23.184 0.567 1.00 0.00 C ATOM 723 O LYS A 47 -8.075 -22.681 0.872 1.00 0.00 O ATOM 724 CB LYS A 47 -5.797 -24.625 2.263 1.00 0.00 C ATOM 725 CG LYS A 47 -5.478 -26.043 2.718 1.00 0.00 C ATOM 726 CD LYS A 47 -4.763 -26.080 4.060 1.00 0.00 C ATOM 727 CE LYS A 47 -4.367 -27.502 4.446 1.00 0.00 C ATOM 728 NZ LYS A 47 -5.540 -28.418 4.494 1.00 0.00 N ATOM 0 H LYS A 47 -4.934 -25.267 -0.009 1.00 0.00 H new ATOM 0 HA LYS A 47 -7.587 -25.117 1.207 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -4.867 -24.085 2.084 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -6.323 -24.099 3.060 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -6.403 -26.615 2.788 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -4.857 -26.531 1.966 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -3.873 -25.453 4.016 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -5.411 -25.660 4.830 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -3.640 -27.882 3.729 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -3.877 -27.490 5.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -5.245 -29.340 4.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -6.274 -28.010 5.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -5.921 -28.544 3.535 1.00 0.00 H new ATOM 742 N ILE A 48 -6.082 -22.556 -0.164 1.00 0.00 N ATOM 743 CA ILE A 48 -6.306 -21.221 -0.703 1.00 0.00 C ATOM 744 C ILE A 48 -7.518 -21.202 -1.633 1.00 0.00 C ATOM 745 O ILE A 48 -8.438 -20.402 -1.458 1.00 0.00 O ATOM 746 CB ILE A 48 -5.062 -20.729 -1.472 1.00 0.00 C ATOM 747 CG1 ILE A 48 -3.890 -20.546 -0.509 1.00 0.00 C ATOM 748 CG2 ILE A 48 -5.352 -19.439 -2.232 1.00 0.00 C ATOM 749 CD1 ILE A 48 -2.614 -20.110 -1.189 1.00 0.00 C ATOM 0 H ILE A 48 -5.173 -22.954 -0.399 1.00 0.00 H new ATOM 0 HA ILE A 48 -6.496 -20.554 0.138 1.00 0.00 H new ATOM 0 HB ILE A 48 -4.794 -21.486 -2.209 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -4.161 -19.807 0.245 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -3.711 -21.485 0.015 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -4.455 -19.120 -2.763 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -6.155 -19.611 -2.948 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -5.653 -18.662 -1.529 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -1.825 -20.000 -0.445 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -2.319 -20.859 -1.923 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -2.776 -19.156 -1.690 1.00 0.00 H new ATOM 761 N LYS A 49 -7.517 -22.097 -2.613 1.00 0.00 N ATOM 762 CA LYS A 49 -8.592 -22.161 -3.592 1.00 0.00 C ATOM 763 C LYS A 49 -9.930 -22.502 -2.939 1.00 0.00 C ATOM 764 O LYS A 49 -10.980 -22.057 -3.400 1.00 0.00 O ATOM 765 CB LYS A 49 -8.241 -23.170 -4.686 1.00 0.00 C ATOM 766 CG LYS A 49 -7.018 -22.759 -5.495 1.00 0.00 C ATOM 767 CD LYS A 49 -6.657 -23.782 -6.561 1.00 0.00 C ATOM 768 CE LYS A 49 -5.444 -23.327 -7.359 1.00 0.00 C ATOM 769 NZ LYS A 49 -5.118 -24.254 -8.475 1.00 0.00 N ATOM 0 H LYS A 49 -6.781 -22.790 -2.750 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.700 -21.175 -4.044 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -8.060 -24.144 -4.232 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -9.093 -23.284 -5.356 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -7.206 -21.796 -5.969 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -6.170 -22.624 -4.823 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -6.449 -24.744 -6.092 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -7.504 -23.930 -7.231 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -5.630 -22.331 -7.761 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -4.584 -23.247 -6.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -4.694 -23.718 -9.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -4.444 -24.973 -8.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -5.987 -24.720 -8.804 1.00 0.00 H new ATOM 783 N THR A 50 -9.891 -23.277 -1.860 1.00 0.00 N ATOM 784 CA THR A 50 -11.098 -23.603 -1.115 1.00 0.00 C ATOM 785 C THR A 50 -11.625 -22.369 -0.378 1.00 0.00 C ATOM 786 O THR A 50 -12.818 -22.072 -0.418 1.00 0.00 O ATOM 787 CB THR A 50 -10.839 -24.743 -0.108 1.00 0.00 C ATOM 788 OG1 THR A 50 -10.375 -25.912 -0.800 1.00 0.00 O ATOM 789 CG2 THR A 50 -12.099 -25.087 0.668 1.00 0.00 C ATOM 0 H THR A 50 -9.037 -23.690 -1.484 1.00 0.00 H new ATOM 0 HA THR A 50 -11.849 -23.938 -1.831 1.00 0.00 H new ATOM 0 HB THR A 50 -10.079 -24.403 0.595 1.00 0.00 H new ATOM 0 HG1 THR A 50 -9.399 -25.879 -0.880 1.00 0.00 H new ATOM 0 HG21 THR A 50 -11.885 -25.893 1.370 1.00 0.00 H new ATOM 0 HG22 THR A 50 -12.439 -24.209 1.217 1.00 0.00 H new ATOM 0 HG23 THR A 50 -12.878 -25.406 -0.025 1.00 0.00 H new ATOM 797 N ALA A 51 -10.720 -21.644 0.274 1.00 0.00 N ATOM 798 CA ALA A 51 -11.086 -20.437 1.006 1.00 0.00 C ATOM 799 C ALA A 51 -11.712 -19.398 0.079 1.00 0.00 C ATOM 800 O ALA A 51 -12.765 -18.835 0.384 1.00 0.00 O ATOM 801 CB ALA A 51 -9.866 -19.857 1.710 1.00 0.00 C ATOM 0 H ALA A 51 -9.727 -21.873 0.310 1.00 0.00 H new ATOM 0 HA ALA A 51 -11.830 -20.708 1.756 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.153 -18.956 2.253 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.467 -20.591 2.410 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -9.104 -19.608 0.972 1.00 0.00 H new ATOM 807 N LEU A 52 -11.067 -19.164 -1.059 1.00 0.00 N ATOM 808 CA LEU A 52 -11.556 -18.200 -2.041 1.00 0.00 C ATOM 809 C LEU A 52 -12.926 -18.612 -2.574 1.00 0.00 C ATOM 810 O LEU A 52 -13.824 -17.782 -2.711 1.00 0.00 O ATOM 811 CB LEU A 52 -10.563 -18.066 -3.200 1.00 0.00 C ATOM 812 CG LEU A 52 -9.182 -17.529 -2.819 1.00 0.00 C ATOM 813 CD1 LEU A 52 -8.267 -17.516 -4.030 1.00 0.00 C ATOM 814 CD2 LEU A 52 -9.292 -16.134 -2.226 1.00 0.00 C ATOM 0 H LEU A 52 -10.200 -19.631 -1.326 1.00 0.00 H new ATOM 0 HA LEU A 52 -11.654 -17.235 -1.545 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.439 -19.044 -3.665 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -10.996 -17.407 -3.953 1.00 0.00 H new ATOM 0 HG LEU A 52 -8.755 -18.190 -2.065 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -7.288 -17.131 -3.743 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -8.159 -18.530 -4.416 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.695 -16.877 -4.803 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -8.299 -15.771 -1.962 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -9.741 -15.462 -2.957 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -9.915 -16.167 -1.332 1.00 0.00 H new ATOM 826 N ASP A 53 -13.081 -19.902 -2.855 1.00 0.00 N ATOM 827 CA ASP A 53 -14.343 -20.435 -3.363 1.00 0.00 C ATOM 828 C ASP A 53 -15.467 -20.258 -2.342 1.00 0.00 C ATOM 829 O ASP A 53 -16.604 -19.938 -2.699 1.00 0.00 O ATOM 830 CB ASP A 53 -14.184 -21.913 -3.725 1.00 0.00 C ATOM 831 CG ASP A 53 -15.462 -22.521 -4.265 1.00 0.00 C ATOM 832 OD1 ASP A 53 -15.717 -22.394 -5.483 1.00 0.00 O ATOM 833 OD2 ASP A 53 -16.205 -23.147 -3.483 1.00 0.00 O ATOM 0 H ASP A 53 -12.347 -20.600 -2.739 1.00 0.00 H new ATOM 0 HA ASP A 53 -14.611 -19.876 -4.260 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -13.394 -22.018 -4.468 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -13.867 -22.468 -2.842 1.00 0.00 H new ATOM 838 N HIS A 54 -15.147 -20.451 -1.067 1.00 0.00 N ATOM 839 CA HIS A 54 -16.125 -20.264 -0.003 1.00 0.00 C ATOM 840 C HIS A 54 -16.545 -18.796 0.088 1.00 0.00 C ATOM 841 O HIS A 54 -17.735 -18.489 0.182 1.00 0.00 O ATOM 842 CB HIS A 54 -15.569 -20.746 1.340 1.00 0.00 C ATOM 843 CG HIS A 54 -16.516 -20.545 2.477 1.00 0.00 C ATOM 844 ND1 HIS A 54 -17.608 -21.359 2.666 1.00 0.00 N ATOM 845 CD2 HIS A 54 -16.511 -19.584 3.420 1.00 0.00 C ATOM 846 CE1 HIS A 54 -18.240 -20.866 3.718 1.00 0.00 C ATOM 847 NE2 HIS A 54 -17.609 -19.794 4.204 1.00 0.00 N ATOM 0 H HIS A 54 -14.221 -20.736 -0.747 1.00 0.00 H new ATOM 0 HA HIS A 54 -17.004 -20.862 -0.242 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -15.322 -21.805 1.264 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -14.640 -20.217 1.552 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -15.779 -18.798 3.534 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -19.149 -21.277 4.131 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -17.894 -19.237 5.010 1.00 0.00 H new ATOM 855 N ILE A 55 -15.562 -17.898 0.055 1.00 0.00 N ATOM 856 CA ILE A 55 -15.832 -16.461 0.026 1.00 0.00 C ATOM 857 C ILE A 55 -16.764 -16.133 -1.134 1.00 0.00 C ATOM 858 O ILE A 55 -17.756 -15.424 -0.974 1.00 0.00 O ATOM 859 CB ILE A 55 -14.528 -15.639 -0.119 1.00 0.00 C ATOM 860 CG1 ILE A 55 -13.618 -15.862 1.089 1.00 0.00 C ATOM 861 CG2 ILE A 55 -14.843 -14.159 -0.276 1.00 0.00 C ATOM 862 CD1 ILE A 55 -12.273 -15.176 0.972 1.00 0.00 C ATOM 0 H ILE A 55 -14.571 -18.140 0.048 1.00 0.00 H new ATOM 0 HA ILE A 55 -16.302 -16.193 0.972 1.00 0.00 H new ATOM 0 HB ILE A 55 -14.007 -15.979 -1.014 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -14.123 -15.501 1.985 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -13.460 -16.932 1.221 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -13.914 -13.598 -0.376 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -15.455 -14.010 -1.165 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -15.386 -13.808 0.601 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -11.682 -15.379 1.865 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -11.747 -15.554 0.095 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -12.421 -14.101 0.871 1.00 0.00 H new ATOM 874 N LYS A 56 -16.441 -16.692 -2.289 1.00 0.00 N ATOM 875 CA LYS A 56 -17.227 -16.519 -3.504 1.00 0.00 C ATOM 876 C LYS A 56 -18.669 -16.989 -3.301 1.00 0.00 C ATOM 877 O LYS A 56 -19.606 -16.411 -3.853 1.00 0.00 O ATOM 878 CB LYS A 56 -16.558 -17.314 -4.629 1.00 0.00 C ATOM 879 CG LYS A 56 -17.246 -17.226 -5.979 1.00 0.00 C ATOM 880 CD LYS A 56 -16.450 -17.993 -7.021 1.00 0.00 C ATOM 881 CE LYS A 56 -17.166 -18.075 -8.354 1.00 0.00 C ATOM 882 NZ LYS A 56 -16.568 -19.125 -9.220 1.00 0.00 N ATOM 0 H LYS A 56 -15.619 -17.284 -2.413 1.00 0.00 H new ATOM 0 HA LYS A 56 -17.265 -15.461 -3.763 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -15.531 -16.964 -4.739 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -16.508 -18.362 -4.332 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -18.255 -17.632 -5.909 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -17.343 -16.183 -6.279 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -15.482 -17.511 -7.161 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -16.254 -19.001 -6.655 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -18.222 -18.292 -8.190 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -17.113 -17.110 -8.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -16.635 -18.833 -10.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -15.569 -19.258 -8.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -17.081 -20.019 -9.086 1.00 0.00 H new ATOM 896 N SER A 57 -18.836 -18.023 -2.488 1.00 0.00 N ATOM 897 CA SER A 57 -20.148 -18.600 -2.237 1.00 0.00 C ATOM 898 C SER A 57 -20.983 -17.713 -1.315 1.00 0.00 C ATOM 899 O SER A 57 -22.132 -17.400 -1.620 1.00 0.00 O ATOM 900 CB SER A 57 -19.989 -19.996 -1.634 1.00 0.00 C ATOM 901 OG SER A 57 -19.193 -20.828 -2.470 1.00 0.00 O ATOM 0 H SER A 57 -18.074 -18.481 -1.989 1.00 0.00 H new ATOM 0 HA SER A 57 -20.677 -18.674 -3.187 1.00 0.00 H new ATOM 0 HB2 SER A 57 -19.530 -19.920 -0.649 1.00 0.00 H new ATOM 0 HB3 SER A 57 -20.971 -20.449 -1.494 1.00 0.00 H new ATOM 0 HG SER A 57 -18.254 -20.553 -2.406 1.00 0.00 H new ATOM 907 N GLU A 58 -20.412 -17.310 -0.189 1.00 0.00 N ATOM 908 CA GLU A 58 -21.115 -16.445 0.744 1.00 0.00 C ATOM 909 C GLU A 58 -21.370 -15.067 0.139 1.00 0.00 C ATOM 910 O GLU A 58 -22.496 -14.574 0.162 1.00 0.00 O ATOM 911 CB GLU A 58 -20.324 -16.321 2.044 1.00 0.00 C ATOM 912 CG GLU A 58 -20.404 -17.563 2.911 1.00 0.00 C ATOM 913 CD GLU A 58 -21.834 -17.907 3.274 1.00 0.00 C ATOM 914 OE1 GLU A 58 -22.418 -18.797 2.622 1.00 0.00 O ATOM 915 OE2 GLU A 58 -22.388 -17.268 4.193 1.00 0.00 O ATOM 0 H GLU A 58 -19.468 -17.567 0.099 1.00 0.00 H new ATOM 0 HA GLU A 58 -22.083 -16.896 0.961 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -19.280 -16.116 1.809 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -20.697 -15.466 2.609 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -19.951 -18.403 2.385 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -19.825 -17.408 3.822 1.00 0.00 H new ATOM 922 N LEU A 59 -20.332 -14.475 -0.440 1.00 0.00 N ATOM 923 CA LEU A 59 -20.412 -13.118 -0.982 1.00 0.00 C ATOM 924 C LEU A 59 -21.495 -13.011 -2.060 1.00 0.00 C ATOM 925 O LEU A 59 -22.058 -11.940 -2.287 1.00 0.00 O ATOM 926 CB LEU A 59 -19.047 -12.716 -1.544 1.00 0.00 C ATOM 927 CG LEU A 59 -18.886 -11.248 -1.934 1.00 0.00 C ATOM 928 CD1 LEU A 59 -19.188 -10.339 -0.751 1.00 0.00 C ATOM 929 CD2 LEU A 59 -17.476 -11.005 -2.446 1.00 0.00 C ATOM 0 H LEU A 59 -19.418 -14.915 -0.548 1.00 0.00 H new ATOM 0 HA LEU A 59 -20.687 -12.436 -0.178 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -18.286 -12.959 -0.803 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -18.844 -13.328 -2.422 1.00 0.00 H new ATOM 0 HG LEU A 59 -19.597 -11.016 -2.727 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -19.067 -9.298 -1.052 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -20.213 -10.504 -0.418 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -18.501 -10.563 0.065 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -17.365 -9.957 -2.723 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -16.758 -11.252 -1.664 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -17.293 -11.632 -3.318 1.00 0.00 H new ATOM 941 N ASP A 60 -21.787 -14.139 -2.705 1.00 0.00 N ATOM 942 CA ASP A 60 -22.842 -14.220 -3.721 1.00 0.00 C ATOM 943 C ASP A 60 -24.207 -13.822 -3.152 1.00 0.00 C ATOM 944 O ASP A 60 -25.070 -13.316 -3.872 1.00 0.00 O ATOM 945 CB ASP A 60 -22.901 -15.643 -4.294 1.00 0.00 C ATOM 946 CG ASP A 60 -24.182 -15.931 -5.058 1.00 0.00 C ATOM 947 OD1 ASP A 60 -24.308 -15.494 -6.223 1.00 0.00 O ATOM 948 OD2 ASP A 60 -25.067 -16.615 -4.497 1.00 0.00 O ATOM 0 H ASP A 60 -21.302 -15.021 -2.541 1.00 0.00 H new ATOM 0 HA ASP A 60 -22.600 -13.515 -4.517 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -22.049 -15.796 -4.956 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -22.804 -16.360 -3.479 1.00 0.00 H new ATOM 953 N LYS A 61 -24.405 -14.050 -1.862 1.00 0.00 N ATOM 954 CA LYS A 61 -25.667 -13.701 -1.213 1.00 0.00 C ATOM 955 C LYS A 61 -25.832 -12.191 -1.068 1.00 0.00 C ATOM 956 O LYS A 61 -26.951 -11.680 -1.029 1.00 0.00 O ATOM 957 CB LYS A 61 -25.744 -14.348 0.166 1.00 0.00 C ATOM 958 CG LYS A 61 -25.679 -15.859 0.132 1.00 0.00 C ATOM 959 CD LYS A 61 -25.525 -16.433 1.527 1.00 0.00 C ATOM 960 CE LYS A 61 -25.363 -17.937 1.485 1.00 0.00 C ATOM 961 NZ LYS A 61 -24.252 -18.347 0.593 1.00 0.00 N ATOM 0 H LYS A 61 -23.713 -14.473 -1.243 1.00 0.00 H new ATOM 0 HA LYS A 61 -26.472 -14.074 -1.847 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -24.926 -13.972 0.781 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -26.672 -14.044 0.649 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -26.584 -16.254 -0.329 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -24.841 -16.176 -0.489 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -24.659 -15.985 2.014 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -26.397 -16.175 2.128 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -25.177 -18.311 2.492 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -26.292 -18.393 1.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -24.619 -18.967 -0.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -23.822 -17.503 0.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -23.535 -18.859 1.145 1.00 0.00 H new ATOM 975 N CYS A 62 -24.723 -11.476 -0.998 1.00 0.00 N ATOM 976 CA CYS A 62 -24.768 -10.057 -0.699 1.00 0.00 C ATOM 977 C CYS A 62 -24.701 -9.230 -1.977 1.00 0.00 C ATOM 978 O CYS A 62 -23.680 -8.611 -2.284 1.00 0.00 O ATOM 979 CB CYS A 62 -23.623 -9.696 0.246 1.00 0.00 C ATOM 980 SG CYS A 62 -23.259 -11.005 1.466 1.00 0.00 S ATOM 0 H CYS A 62 -23.786 -11.852 -1.143 1.00 0.00 H new ATOM 0 HA CYS A 62 -25.715 -9.828 -0.209 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -22.726 -9.495 -0.340 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -23.872 -8.775 0.774 1.00 0.00 H new ATOM 985 N ASN A 63 -25.792 -9.246 -2.736 1.00 0.00 N ATOM 986 CA ASN A 63 -25.880 -8.475 -3.971 1.00 0.00 C ATOM 987 C ASN A 63 -27.159 -7.646 -4.004 1.00 0.00 C ATOM 988 O ASN A 63 -27.528 -7.098 -5.047 1.00 0.00 O ATOM 989 CB ASN A 63 -25.822 -9.393 -5.199 1.00 0.00 C ATOM 990 CG ASN A 63 -24.418 -9.874 -5.514 1.00 0.00 C ATOM 991 OD1 ASN A 63 -23.670 -9.214 -6.236 1.00 0.00 O ATOM 992 ND2 ASN A 63 -24.058 -11.035 -4.998 1.00 0.00 N ATOM 0 H ASN A 63 -26.629 -9.786 -2.517 1.00 0.00 H new ATOM 0 HA ASN A 63 -25.024 -7.801 -4.000 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -26.467 -10.256 -5.031 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -26.220 -8.861 -6.063 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -23.132 -11.415 -5.193 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -24.706 -11.552 -4.404 1.00 0.00 H new ATOM 999 N GLY A 64 -27.811 -7.527 -2.856 1.00 0.00 N ATOM 1000 CA GLY A 64 -29.068 -6.810 -2.789 1.00 0.00 C ATOM 1001 C GLY A 64 -28.891 -5.345 -2.445 1.00 0.00 C ATOM 1002 O GLY A 64 -27.914 -4.711 -2.850 1.00 0.00 O ATOM 0 H GLY A 64 -27.491 -7.915 -1.969 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -29.580 -6.894 -3.747 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -29.709 -7.279 -2.043 1.00 0.00 H new ATOM 1006 N ASN A 65 -29.837 -4.808 -1.689 1.00 0.00 N ATOM 1007 CA ASN A 65 -29.821 -3.399 -1.306 1.00 0.00 C ATOM 1008 C ASN A 65 -28.681 -3.110 -0.330 1.00 0.00 C ATOM 1009 O ASN A 65 -28.132 -2.007 -0.301 1.00 0.00 O ATOM 1010 CB ASN A 65 -31.168 -3.001 -0.680 1.00 0.00 C ATOM 1011 CG ASN A 65 -31.488 -3.774 0.593 1.00 0.00 C ATOM 1012 OD1 ASN A 65 -31.143 -3.347 1.693 1.00 0.00 O ATOM 1013 ND2 ASN A 65 -32.158 -4.909 0.455 1.00 0.00 N ATOM 0 H ASN A 65 -30.634 -5.330 -1.324 1.00 0.00 H new ATOM 0 HA ASN A 65 -29.659 -2.805 -2.206 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -31.157 -1.934 -0.457 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -31.963 -3.166 -1.408 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -32.404 -5.459 1.278 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -32.428 -5.232 -0.474 1.00 0.00 H new ATOM 1020 N ASP A 66 -28.317 -4.118 0.443 1.00 0.00 N ATOM 1021 CA ASP A 66 -27.283 -3.991 1.464 1.00 0.00 C ATOM 1022 C ASP A 66 -25.959 -4.570 0.979 1.00 0.00 C ATOM 1023 O ASP A 66 -25.033 -4.758 1.765 1.00 0.00 O ATOM 1024 CB ASP A 66 -27.729 -4.725 2.731 1.00 0.00 C ATOM 1025 CG ASP A 66 -28.209 -6.137 2.438 1.00 0.00 C ATOM 1026 OD1 ASP A 66 -27.373 -7.062 2.369 1.00 0.00 O ATOM 1027 OD2 ASP A 66 -29.431 -6.320 2.255 1.00 0.00 O ATOM 0 H ASP A 66 -28.728 -5.050 0.383 1.00 0.00 H new ATOM 0 HA ASP A 66 -27.136 -2.932 1.677 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -26.899 -4.764 3.437 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -28.530 -4.163 3.211 1.00 0.00 H new ATOM 1032 N ALA A 67 -25.855 -4.777 -0.329 1.00 0.00 N ATOM 1033 CA ALA A 67 -24.783 -5.576 -0.910 1.00 0.00 C ATOM 1034 C ALA A 67 -23.409 -5.074 -0.510 1.00 0.00 C ATOM 1035 O ALA A 67 -22.687 -5.733 0.231 1.00 0.00 O ATOM 1036 CB ALA A 67 -24.903 -5.588 -2.425 1.00 0.00 C ATOM 0 H ALA A 67 -26.509 -4.397 -1.014 1.00 0.00 H new ATOM 0 HA ALA A 67 -24.890 -6.589 -0.521 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -24.097 -6.188 -2.849 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -25.864 -6.017 -2.711 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -24.834 -4.568 -2.804 1.00 0.00 H new ATOM 1042 N ASP A 68 -23.073 -3.894 -0.991 1.00 0.00 N ATOM 1043 CA ASP A 68 -21.743 -3.331 -0.826 1.00 0.00 C ATOM 1044 C ASP A 68 -21.389 -3.087 0.633 1.00 0.00 C ATOM 1045 O ASP A 68 -20.222 -3.192 1.025 1.00 0.00 O ATOM 1046 CB ASP A 68 -21.645 -2.045 -1.631 1.00 0.00 C ATOM 1047 CG ASP A 68 -21.277 -2.320 -3.075 1.00 0.00 C ATOM 1048 OD1 ASP A 68 -20.160 -1.953 -3.491 1.00 0.00 O ATOM 1049 OD2 ASP A 68 -22.087 -2.952 -3.790 1.00 0.00 O ATOM 0 H ASP A 68 -23.715 -3.295 -1.509 1.00 0.00 H new ATOM 0 HA ASP A 68 -21.019 -4.057 -1.197 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -22.597 -1.516 -1.592 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -20.898 -1.390 -1.183 1.00 0.00 H new ATOM 1054 N GLN A 69 -22.388 -2.785 1.446 1.00 0.00 N ATOM 1055 CA GLN A 69 -22.150 -2.560 2.858 1.00 0.00 C ATOM 1056 C GLN A 69 -21.816 -3.880 3.537 1.00 0.00 C ATOM 1057 O GLN A 69 -20.916 -3.951 4.377 1.00 0.00 O ATOM 1058 CB GLN A 69 -23.357 -1.908 3.527 1.00 0.00 C ATOM 1059 CG GLN A 69 -23.014 -1.291 4.869 1.00 0.00 C ATOM 1060 CD GLN A 69 -21.978 -0.193 4.734 1.00 0.00 C ATOM 1061 OE1 GLN A 69 -22.315 0.979 4.586 1.00 0.00 O ATOM 1062 NE2 GLN A 69 -20.709 -0.569 4.751 1.00 0.00 N ATOM 0 H GLN A 69 -23.361 -2.691 1.155 1.00 0.00 H new ATOM 0 HA GLN A 69 -21.307 -1.877 2.961 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -23.761 -1.138 2.869 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -24.140 -2.654 3.663 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -23.917 -0.885 5.324 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.639 -2.064 5.540 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -20.470 -1.553 4.876 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -19.970 0.125 4.639 1.00 0.00 H new ATOM 1071 N GLN A 70 -22.532 -4.926 3.150 1.00 0.00 N ATOM 1072 CA GLN A 70 -22.273 -6.257 3.660 1.00 0.00 C ATOM 1073 C GLN A 70 -20.960 -6.800 3.108 1.00 0.00 C ATOM 1074 O GLN A 70 -20.252 -7.517 3.803 1.00 0.00 O ATOM 1075 CB GLN A 70 -23.427 -7.185 3.311 1.00 0.00 C ATOM 1076 CG GLN A 70 -24.728 -6.793 3.991 1.00 0.00 C ATOM 1077 CD GLN A 70 -24.727 -7.047 5.487 1.00 0.00 C ATOM 1078 OE1 GLN A 70 -25.349 -6.307 6.250 1.00 0.00 O ATOM 1079 NE2 GLN A 70 -24.059 -8.107 5.918 1.00 0.00 N ATOM 0 H GLN A 70 -23.300 -4.874 2.481 1.00 0.00 H new ATOM 0 HA GLN A 70 -22.186 -6.202 4.745 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -23.573 -7.184 2.231 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -23.166 -8.204 3.597 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -24.920 -5.735 3.810 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -25.549 -7.348 3.536 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -23.555 -8.697 5.255 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -24.048 -8.333 6.912 1.00 0.00 H new ATOM 1088 N LYS A 71 -20.637 -6.451 1.864 1.00 0.00 N ATOM 1089 CA LYS A 71 -19.333 -6.790 1.287 1.00 0.00 C ATOM 1090 C LYS A 71 -18.225 -6.257 2.182 1.00 0.00 C ATOM 1091 O LYS A 71 -17.272 -6.963 2.508 1.00 0.00 O ATOM 1092 CB LYS A 71 -19.159 -6.183 -0.108 1.00 0.00 C ATOM 1093 CG LYS A 71 -20.144 -6.676 -1.152 1.00 0.00 C ATOM 1094 CD LYS A 71 -19.933 -5.944 -2.467 1.00 0.00 C ATOM 1095 CE LYS A 71 -21.028 -6.242 -3.478 1.00 0.00 C ATOM 1096 NZ LYS A 71 -20.955 -5.316 -4.643 1.00 0.00 N ATOM 0 H LYS A 71 -21.255 -5.936 1.237 1.00 0.00 H new ATOM 0 HA LYS A 71 -19.280 -7.876 1.208 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -19.248 -5.100 -0.030 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -18.148 -6.395 -0.456 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -20.019 -7.748 -1.301 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -21.164 -6.520 -0.801 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -19.897 -4.871 -2.280 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -18.968 -6.227 -2.887 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -20.937 -7.272 -3.823 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -22.003 -6.151 -2.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -21.281 -5.809 -5.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -21.561 -4.489 -4.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -19.972 -5.003 -4.777 1.00 0.00 H new ATOM 1110 N THR A 72 -18.374 -4.996 2.572 1.00 0.00 N ATOM 1111 CA THR A 72 -17.419 -4.340 3.446 1.00 0.00 C ATOM 1112 C THR A 72 -17.366 -5.030 4.812 1.00 0.00 C ATOM 1113 O THR A 72 -16.305 -5.144 5.427 1.00 0.00 O ATOM 1114 CB THR A 72 -17.779 -2.846 3.625 1.00 0.00 C ATOM 1115 OG1 THR A 72 -17.933 -2.222 2.341 1.00 0.00 O ATOM 1116 CG2 THR A 72 -16.707 -2.110 4.418 1.00 0.00 C ATOM 0 H THR A 72 -19.157 -4.406 2.291 1.00 0.00 H new ATOM 0 HA THR A 72 -16.436 -4.412 2.980 1.00 0.00 H new ATOM 0 HB THR A 72 -18.717 -2.792 4.178 1.00 0.00 H new ATOM 0 HG1 THR A 72 -18.767 -2.527 1.927 1.00 0.00 H new ATOM 0 HG21 THR A 72 -16.989 -1.063 4.527 1.00 0.00 H new ATOM 0 HG22 THR A 72 -16.608 -2.563 5.404 1.00 0.00 H new ATOM 0 HG23 THR A 72 -15.755 -2.176 3.891 1.00 0.00 H new ATOM 1124 N THR A 73 -18.513 -5.515 5.262 1.00 0.00 N ATOM 1125 CA THR A 73 -18.613 -6.180 6.552 1.00 0.00 C ATOM 1126 C THR A 73 -18.019 -7.589 6.494 1.00 0.00 C ATOM 1127 O THR A 73 -17.394 -8.056 7.449 1.00 0.00 O ATOM 1128 CB THR A 73 -20.084 -6.247 7.003 1.00 0.00 C ATOM 1129 OG1 THR A 73 -20.658 -4.933 6.963 1.00 0.00 O ATOM 1130 CG2 THR A 73 -20.206 -6.814 8.409 1.00 0.00 C ATOM 0 H THR A 73 -19.393 -5.460 4.749 1.00 0.00 H new ATOM 0 HA THR A 73 -18.042 -5.599 7.276 1.00 0.00 H new ATOM 0 HB THR A 73 -20.619 -6.909 6.322 1.00 0.00 H new ATOM 0 HG1 THR A 73 -20.755 -4.647 6.031 1.00 0.00 H new ATOM 0 HG21 THR A 73 -21.257 -6.848 8.698 1.00 0.00 H new ATOM 0 HG22 THR A 73 -19.790 -7.821 8.432 1.00 0.00 H new ATOM 0 HG23 THR A 73 -19.659 -6.179 9.106 1.00 0.00 H new ATOM 1138 N PHE A 74 -18.191 -8.243 5.354 1.00 0.00 N ATOM 1139 CA PHE A 74 -17.705 -9.602 5.151 1.00 0.00 C ATOM 1140 C PHE A 74 -16.180 -9.626 5.204 1.00 0.00 C ATOM 1141 O PHE A 74 -15.574 -10.616 5.615 1.00 0.00 O ATOM 1142 CB PHE A 74 -18.221 -10.135 3.807 1.00 0.00 C ATOM 1143 CG PHE A 74 -17.909 -11.583 3.539 1.00 0.00 C ATOM 1144 CD1 PHE A 74 -17.650 -12.013 2.247 1.00 0.00 C ATOM 1145 CD2 PHE A 74 -17.879 -12.512 4.568 1.00 0.00 C ATOM 1146 CE1 PHE A 74 -17.367 -13.337 1.987 1.00 0.00 C ATOM 1147 CE2 PHE A 74 -17.594 -13.840 4.312 1.00 0.00 C ATOM 1148 CZ PHE A 74 -17.338 -14.252 3.019 1.00 0.00 C ATOM 0 H PHE A 74 -18.670 -7.848 4.545 1.00 0.00 H new ATOM 0 HA PHE A 74 -18.079 -10.247 5.946 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -19.302 -9.998 3.769 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -17.795 -9.532 3.005 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -17.670 -11.302 1.434 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -18.081 -12.194 5.580 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -17.168 -13.658 0.975 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -17.572 -14.554 5.122 1.00 0.00 H new ATOM 0 HZ PHE A 74 -17.115 -15.289 2.816 1.00 0.00 H new ATOM 1158 N LYS A 75 -15.573 -8.512 4.813 1.00 0.00 N ATOM 1159 CA LYS A 75 -14.127 -8.353 4.861 1.00 0.00 C ATOM 1160 C LYS A 75 -13.596 -8.556 6.279 1.00 0.00 C ATOM 1161 O LYS A 75 -12.514 -9.111 6.476 1.00 0.00 O ATOM 1162 CB LYS A 75 -13.754 -6.962 4.360 1.00 0.00 C ATOM 1163 CG LYS A 75 -14.104 -6.741 2.899 1.00 0.00 C ATOM 1164 CD LYS A 75 -13.876 -5.301 2.473 1.00 0.00 C ATOM 1165 CE LYS A 75 -14.113 -5.132 0.980 1.00 0.00 C ATOM 1166 NZ LYS A 75 -13.868 -3.740 0.518 1.00 0.00 N ATOM 0 H LYS A 75 -16.069 -7.696 4.455 1.00 0.00 H new ATOM 0 HA LYS A 75 -13.674 -9.110 4.221 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -14.265 -6.215 4.967 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -12.684 -6.807 4.498 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -13.501 -7.403 2.277 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -15.147 -7.008 2.731 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -14.545 -4.643 3.028 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -12.857 -5.002 2.720 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -13.461 -5.813 0.433 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -15.139 -5.414 0.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -14.043 -3.678 -0.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -14.507 -3.090 1.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -12.882 -3.477 0.717 1.00 0.00 H new ATOM 1180 N GLN A 76 -14.376 -8.117 7.260 1.00 0.00 N ATOM 1181 CA GLN A 76 -14.005 -8.236 8.653 1.00 0.00 C ATOM 1182 C GLN A 76 -14.171 -9.673 9.130 1.00 0.00 C ATOM 1183 O GLN A 76 -13.381 -10.171 9.931 1.00 0.00 O ATOM 1184 CB GLN A 76 -14.877 -7.305 9.486 1.00 0.00 C ATOM 1185 CG GLN A 76 -14.747 -5.840 9.102 1.00 0.00 C ATOM 1186 CD GLN A 76 -15.629 -4.939 9.941 1.00 0.00 C ATOM 1187 OE1 GLN A 76 -15.216 -4.445 10.989 1.00 0.00 O ATOM 1188 NE2 GLN A 76 -16.848 -4.716 9.481 1.00 0.00 N ATOM 0 H GLN A 76 -15.280 -7.671 7.106 1.00 0.00 H new ATOM 0 HA GLN A 76 -12.958 -7.957 8.768 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -15.919 -7.608 9.382 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -14.615 -7.420 10.538 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -13.708 -5.530 9.212 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -15.006 -5.719 8.050 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -17.150 -5.146 8.607 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -17.487 -4.114 10.000 1.00 0.00 H new ATOM 1197 N THR A 77 -15.202 -10.332 8.616 1.00 0.00 N ATOM 1198 CA THR A 77 -15.478 -11.720 8.952 1.00 0.00 C ATOM 1199 C THR A 77 -14.339 -12.626 8.486 1.00 0.00 C ATOM 1200 O THR A 77 -13.863 -13.485 9.231 1.00 0.00 O ATOM 1201 CB THR A 77 -16.794 -12.183 8.302 1.00 0.00 C ATOM 1202 OG1 THR A 77 -17.848 -11.272 8.647 1.00 0.00 O ATOM 1203 CG2 THR A 77 -17.162 -13.589 8.753 1.00 0.00 C ATOM 0 H THR A 77 -15.865 -9.921 7.959 1.00 0.00 H new ATOM 0 HA THR A 77 -15.569 -11.789 10.036 1.00 0.00 H new ATOM 0 HB THR A 77 -16.657 -12.196 7.221 1.00 0.00 H new ATOM 0 HG1 THR A 77 -18.685 -11.567 8.231 1.00 0.00 H new ATOM 0 HG21 THR A 77 -18.096 -13.891 8.278 1.00 0.00 H new ATOM 0 HG22 THR A 77 -16.370 -14.282 8.468 1.00 0.00 H new ATOM 0 HG23 THR A 77 -17.284 -13.603 9.836 1.00 0.00 H new ATOM 1211 N VAL A 78 -13.902 -12.415 7.248 1.00 0.00 N ATOM 1212 CA VAL A 78 -12.809 -13.179 6.674 1.00 0.00 C ATOM 1213 C VAL A 78 -11.525 -13.013 7.497 1.00 0.00 C ATOM 1214 O VAL A 78 -10.765 -13.965 7.661 1.00 0.00 O ATOM 1215 CB VAL A 78 -12.572 -12.770 5.201 1.00 0.00 C ATOM 1216 CG1 VAL A 78 -11.435 -13.562 4.586 1.00 0.00 C ATOM 1217 CG2 VAL A 78 -13.839 -12.969 4.387 1.00 0.00 C ATOM 0 H VAL A 78 -14.295 -11.713 6.621 1.00 0.00 H new ATOM 0 HA VAL A 78 -13.087 -14.233 6.698 1.00 0.00 H new ATOM 0 HB VAL A 78 -12.299 -11.715 5.189 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -11.293 -13.251 3.551 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -10.519 -13.380 5.148 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -11.674 -14.625 4.616 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -13.657 -12.677 3.353 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -14.133 -14.018 4.421 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -14.638 -12.355 4.802 1.00 0.00 H new ATOM 1227 N GLN A 79 -11.307 -11.818 8.045 1.00 0.00 N ATOM 1228 CA GLN A 79 -10.154 -11.567 8.901 1.00 0.00 C ATOM 1229 C GLN A 79 -10.120 -12.543 10.076 1.00 0.00 C ATOM 1230 O GLN A 79 -9.074 -13.104 10.401 1.00 0.00 O ATOM 1231 CB GLN A 79 -10.186 -10.133 9.426 1.00 0.00 C ATOM 1232 CG GLN A 79 -9.743 -9.083 8.418 1.00 0.00 C ATOM 1233 CD GLN A 79 -9.717 -7.690 9.017 1.00 0.00 C ATOM 1234 OE1 GLN A 79 -9.501 -7.523 10.217 1.00 0.00 O ATOM 1235 NE2 GLN A 79 -9.909 -6.678 8.187 1.00 0.00 N ATOM 0 H GLN A 79 -11.915 -11.010 7.910 1.00 0.00 H new ATOM 0 HA GLN A 79 -9.255 -11.713 8.302 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -11.200 -9.901 9.752 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -9.546 -10.067 10.306 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -8.750 -9.335 8.046 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -10.417 -9.096 7.562 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -10.085 -6.856 7.198 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -9.881 -5.720 8.536 1.00 0.00 H new ATOM 1244 N GLY A 80 -11.276 -12.763 10.691 1.00 0.00 N ATOM 1245 CA GLY A 80 -11.346 -13.654 11.831 1.00 0.00 C ATOM 1246 C GLY A 80 -11.269 -15.111 11.423 1.00 0.00 C ATOM 1247 O GLY A 80 -10.959 -15.980 12.239 1.00 0.00 O ATOM 0 H GLY A 80 -12.164 -12.341 10.420 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -10.531 -13.427 12.518 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -12.276 -13.478 12.371 1.00 0.00 H new ATOM 1251 N ALA A 81 -11.531 -15.374 10.150 1.00 0.00 N ATOM 1252 CA ALA A 81 -11.512 -16.729 9.630 1.00 0.00 C ATOM 1253 C ALA A 81 -10.088 -17.249 9.489 1.00 0.00 C ATOM 1254 O ALA A 81 -9.744 -18.290 10.046 1.00 0.00 O ATOM 1255 CB ALA A 81 -12.252 -16.791 8.307 1.00 0.00 C ATOM 0 H ALA A 81 -11.760 -14.661 9.458 1.00 0.00 H new ATOM 0 HA ALA A 81 -12.023 -17.377 10.343 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -12.231 -17.812 7.926 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -13.286 -16.479 8.454 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -11.771 -16.126 7.589 1.00 0.00 H new ATOM 1261 N LEU A 82 -9.247 -16.513 8.766 1.00 0.00 N ATOM 1262 CA LEU A 82 -7.866 -16.925 8.544 1.00 0.00 C ATOM 1263 C LEU A 82 -7.009 -16.696 9.778 1.00 0.00 C ATOM 1264 O LEU A 82 -5.823 -17.022 9.802 1.00 0.00 O ATOM 1265 CB LEU A 82 -7.282 -16.198 7.336 1.00 0.00 C ATOM 1266 CG LEU A 82 -7.980 -16.514 6.014 1.00 0.00 C ATOM 1267 CD1 LEU A 82 -8.129 -18.014 5.822 1.00 0.00 C ATOM 1268 CD2 LEU A 82 -9.307 -15.803 5.916 1.00 0.00 C ATOM 0 H LEU A 82 -9.499 -15.629 8.325 1.00 0.00 H new ATOM 0 HA LEU A 82 -7.865 -17.996 8.341 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -7.334 -15.124 7.513 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.227 -16.456 7.247 1.00 0.00 H new ATOM 0 HG LEU A 82 -7.353 -16.142 5.203 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -8.629 -18.212 4.874 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.144 -18.480 5.817 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -8.722 -18.428 6.638 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -9.781 -16.046 4.965 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -9.952 -16.122 6.735 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -9.148 -14.726 5.977 1.00 0.00 H new ATOM 1280 N SER A 83 -7.633 -16.161 10.805 1.00 0.00 N ATOM 1281 CA SER A 83 -6.973 -15.955 12.084 1.00 0.00 C ATOM 1282 C SER A 83 -6.888 -17.283 12.830 1.00 0.00 C ATOM 1283 O SER A 83 -6.008 -17.491 13.666 1.00 0.00 O ATOM 1284 CB SER A 83 -7.736 -14.913 12.913 1.00 0.00 C ATOM 1285 OG SER A 83 -7.077 -14.627 14.138 1.00 0.00 O ATOM 0 H SER A 83 -8.606 -15.857 10.782 1.00 0.00 H new ATOM 0 HA SER A 83 -5.964 -15.579 11.915 1.00 0.00 H new ATOM 0 HB2 SER A 83 -7.842 -13.995 12.335 1.00 0.00 H new ATOM 0 HB3 SER A 83 -8.742 -15.278 13.118 1.00 0.00 H new ATOM 0 HG SER A 83 -7.591 -13.959 14.638 1.00 0.00 H new ATOM 1291 N GLY A 84 -7.795 -18.189 12.495 1.00 0.00 N ATOM 1292 CA GLY A 84 -7.815 -19.489 13.129 1.00 0.00 C ATOM 1293 C GLY A 84 -7.338 -20.582 12.201 1.00 0.00 C ATOM 1294 O GLY A 84 -7.712 -21.743 12.353 1.00 0.00 O ATOM 0 H GLY A 84 -8.520 -18.045 11.792 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -7.184 -19.468 14.018 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -8.828 -19.714 13.462 1.00 0.00 H new ATOM 1298 N GLY A 85 -6.516 -20.210 11.229 1.00 0.00 N ATOM 1299 CA GLY A 85 -6.000 -21.174 10.290 1.00 0.00 C ATOM 1300 C GLY A 85 -6.894 -21.313 9.086 1.00 0.00 C ATOM 1301 O GLY A 85 -8.114 -21.408 9.214 1.00 0.00 O ATOM 0 H GLY A 85 -6.199 -19.252 11.078 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -5.003 -20.872 9.970 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -5.898 -22.142 10.781 1.00 0.00 H new ATOM 1305 N ILE A 86 -6.287 -21.329 7.917 1.00 0.00 N ATOM 1306 CA ILE A 86 -7.027 -21.434 6.666 1.00 0.00 C ATOM 1307 C ILE A 86 -7.729 -22.788 6.564 1.00 0.00 C ATOM 1308 O ILE A 86 -8.690 -22.954 5.816 1.00 0.00 O ATOM 1309 CB ILE A 86 -6.079 -21.247 5.469 1.00 0.00 C ATOM 1310 CG1 ILE A 86 -6.867 -21.113 4.162 1.00 0.00 C ATOM 1311 CG2 ILE A 86 -5.102 -22.409 5.394 1.00 0.00 C ATOM 1312 CD1 ILE A 86 -6.003 -20.766 2.972 1.00 0.00 C ATOM 0 H ILE A 86 -5.275 -21.270 7.802 1.00 0.00 H new ATOM 0 HA ILE A 86 -7.782 -20.648 6.651 1.00 0.00 H new ATOM 0 HB ILE A 86 -5.516 -20.325 5.613 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -7.387 -22.050 3.963 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -7.630 -20.344 4.284 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.434 -22.269 4.544 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -4.516 -22.452 6.312 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -5.654 -23.341 5.272 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -6.626 -20.687 2.081 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -5.503 -19.814 3.151 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -5.256 -21.546 2.825 1.00 0.00 H new ATOM 1324 N ASP A 87 -7.250 -23.746 7.348 1.00 0.00 N ATOM 1325 CA ASP A 87 -7.788 -25.096 7.329 1.00 0.00 C ATOM 1326 C ASP A 87 -9.101 -25.148 8.106 1.00 0.00 C ATOM 1327 O ASP A 87 -9.889 -26.082 7.967 1.00 0.00 O ATOM 1328 CB ASP A 87 -6.768 -26.069 7.919 1.00 0.00 C ATOM 1329 CG ASP A 87 -7.091 -27.509 7.595 1.00 0.00 C ATOM 1330 OD1 ASP A 87 -7.173 -28.331 8.528 1.00 0.00 O ATOM 1331 OD2 ASP A 87 -7.249 -27.830 6.400 1.00 0.00 O ATOM 0 H ASP A 87 -6.485 -23.609 8.008 1.00 0.00 H new ATOM 0 HA ASP A 87 -7.989 -25.389 6.299 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.776 -25.827 7.537 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -6.733 -25.942 9.001 1.00 0.00 H new ATOM 1336 N GLY A 88 -9.334 -24.118 8.915 1.00 0.00 N ATOM 1337 CA GLY A 88 -10.572 -24.013 9.661 1.00 0.00 C ATOM 1338 C GLY A 88 -11.486 -22.963 9.068 1.00 0.00 C ATOM 1339 O GLY A 88 -12.379 -22.444 9.737 1.00 0.00 O ATOM 0 H GLY A 88 -8.681 -23.350 9.066 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -11.079 -24.978 9.666 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -10.353 -23.763 10.699 1.00 0.00 H new ATOM 1343 N PHE A 89 -11.241 -22.642 7.807 1.00 0.00 N ATOM 1344 CA PHE A 89 -12.038 -21.666 7.084 1.00 0.00 C ATOM 1345 C PHE A 89 -13.258 -22.348 6.477 1.00 0.00 C ATOM 1346 O PHE A 89 -13.125 -23.270 5.668 1.00 0.00 O ATOM 1347 CB PHE A 89 -11.178 -21.026 5.990 1.00 0.00 C ATOM 1348 CG PHE A 89 -11.775 -19.820 5.311 1.00 0.00 C ATOM 1349 CD1 PHE A 89 -11.313 -18.548 5.609 1.00 0.00 C ATOM 1350 CD2 PHE A 89 -12.766 -19.956 4.352 1.00 0.00 C ATOM 1351 CE1 PHE A 89 -11.825 -17.438 4.967 1.00 0.00 C ATOM 1352 CE2 PHE A 89 -13.287 -18.847 3.713 1.00 0.00 C ATOM 1353 CZ PHE A 89 -12.816 -17.587 4.020 1.00 0.00 C ATOM 0 H PHE A 89 -10.485 -23.051 7.258 1.00 0.00 H new ATOM 0 HA PHE A 89 -12.381 -20.888 7.766 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -10.222 -20.738 6.427 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -10.967 -21.780 5.232 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -10.541 -18.423 6.354 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -13.135 -20.939 4.101 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -11.450 -16.454 5.206 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -14.064 -18.967 2.972 1.00 0.00 H new ATOM 0 HZ PHE A 89 -13.222 -16.720 3.520 1.00 0.00 H new ATOM 1363 N GLY A 90 -14.437 -21.911 6.875 1.00 0.00 N ATOM 1364 CA GLY A 90 -15.655 -22.495 6.354 1.00 0.00 C ATOM 1365 C GLY A 90 -16.890 -21.780 6.849 1.00 0.00 C ATOM 1366 O GLY A 90 -16.800 -20.670 7.378 1.00 0.00 O ATOM 0 H GLY A 90 -14.576 -21.160 7.551 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -15.633 -22.465 5.265 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -15.705 -23.545 6.643 1.00 0.00 H new ATOM 1370 N SER A 91 -18.039 -22.428 6.713 1.00 0.00 N ATOM 1371 CA SER A 91 -19.317 -21.835 7.100 1.00 0.00 C ATOM 1372 C SER A 91 -19.475 -21.789 8.623 1.00 0.00 C ATOM 1373 O SER A 91 -20.533 -21.425 9.142 1.00 0.00 O ATOM 1374 CB SER A 91 -20.466 -22.640 6.490 1.00 0.00 C ATOM 1375 OG SER A 91 -20.243 -22.897 5.112 1.00 0.00 O ATOM 0 H SER A 91 -18.114 -23.372 6.335 1.00 0.00 H new ATOM 0 HA SER A 91 -19.340 -20.812 6.725 1.00 0.00 H new ATOM 0 HB2 SER A 91 -20.575 -23.584 7.025 1.00 0.00 H new ATOM 0 HB3 SER A 91 -21.401 -22.093 6.613 1.00 0.00 H new ATOM 0 HG SER A 91 -20.993 -23.414 4.750 1.00 0.00 H new ATOM 1381 N ASN A 92 -18.421 -22.161 9.332 1.00 0.00 N ATOM 1382 CA ASN A 92 -18.454 -22.215 10.785 1.00 0.00 C ATOM 1383 C ASN A 92 -17.951 -20.908 11.382 1.00 0.00 C ATOM 1384 O ASN A 92 -18.230 -20.589 12.538 1.00 0.00 O ATOM 1385 CB ASN A 92 -17.592 -23.379 11.284 1.00 0.00 C ATOM 1386 CG ASN A 92 -17.994 -24.710 10.674 1.00 0.00 C ATOM 1387 OD1 ASN A 92 -19.165 -24.942 10.374 1.00 0.00 O ATOM 1388 ND2 ASN A 92 -17.024 -25.589 10.483 1.00 0.00 N ATOM 0 H ASN A 92 -17.527 -22.431 8.922 1.00 0.00 H new ATOM 0 HA ASN A 92 -19.486 -22.368 11.102 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -16.547 -23.178 11.050 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -17.669 -23.443 12.369 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -17.234 -26.499 10.073 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -16.066 -25.357 10.746 1.00 0.00 H new ATOM 1395 N ASN A 93 -17.216 -20.144 10.583 1.00 0.00 N ATOM 1396 CA ASN A 93 -16.618 -18.902 11.059 1.00 0.00 C ATOM 1397 C ASN A 93 -16.749 -17.782 10.030 1.00 0.00 C ATOM 1398 O ASN A 93 -16.973 -16.628 10.387 1.00 0.00 O ATOM 1399 CB ASN A 93 -15.143 -19.119 11.433 1.00 0.00 C ATOM 1400 CG ASN A 93 -14.279 -19.602 10.277 1.00 0.00 C ATOM 1401 OD1 ASN A 93 -14.760 -20.219 9.325 1.00 0.00 O ATOM 1402 ND2 ASN A 93 -12.986 -19.351 10.367 1.00 0.00 N ATOM 0 H ASN A 93 -17.020 -20.361 9.606 1.00 0.00 H new ATOM 0 HA ASN A 93 -17.165 -18.597 11.951 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -14.733 -18.183 11.814 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -15.087 -19.845 12.244 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -12.352 -19.671 9.635 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -12.621 -18.837 11.169 1.00 0.00 H new ATOM 1409 N ALA A 94 -16.613 -18.120 8.755 1.00 0.00 N ATOM 1410 CA ALA A 94 -16.742 -17.135 7.693 1.00 0.00 C ATOM 1411 C ALA A 94 -18.079 -17.285 6.985 1.00 0.00 C ATOM 1412 O ALA A 94 -18.232 -18.124 6.106 1.00 0.00 O ATOM 1413 CB ALA A 94 -15.594 -17.266 6.701 1.00 0.00 C ATOM 0 H ALA A 94 -16.414 -19.067 8.433 1.00 0.00 H new ATOM 0 HA ALA A 94 -16.699 -16.141 8.139 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -15.707 -16.521 5.913 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -14.647 -17.107 7.217 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -15.605 -18.263 6.261 1.00 0.00 H new ATOM 1419 N VAL A 95 -19.057 -16.491 7.388 1.00 0.00 N ATOM 1420 CA VAL A 95 -20.371 -16.533 6.767 1.00 0.00 C ATOM 1421 C VAL A 95 -20.905 -15.141 6.515 1.00 0.00 C ATOM 1422 O VAL A 95 -20.616 -14.206 7.265 1.00 0.00 O ATOM 1423 CB VAL A 95 -21.402 -17.305 7.615 1.00 0.00 C ATOM 1424 CG1 VAL A 95 -21.234 -18.803 7.429 1.00 0.00 C ATOM 1425 CG2 VAL A 95 -21.284 -16.932 9.087 1.00 0.00 C ATOM 0 H VAL A 95 -18.966 -15.810 8.142 1.00 0.00 H new ATOM 0 HA VAL A 95 -20.233 -17.057 5.821 1.00 0.00 H new ATOM 0 HB VAL A 95 -22.398 -17.025 7.273 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -21.971 -19.330 8.036 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -21.379 -19.058 6.379 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -20.231 -19.098 7.739 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -22.022 -17.490 9.664 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -20.284 -17.176 9.445 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -21.462 -15.863 9.207 1.00 0.00 H new ATOM 1435 N THR A 96 -21.669 -15.008 5.449 1.00 0.00 N ATOM 1436 CA THR A 96 -22.333 -13.759 5.148 1.00 0.00 C ATOM 1437 C THR A 96 -23.705 -13.695 5.805 1.00 0.00 C ATOM 1438 O THR A 96 -24.633 -14.398 5.406 1.00 0.00 O ATOM 1439 CB THR A 96 -22.480 -13.561 3.634 1.00 0.00 C ATOM 1440 OG1 THR A 96 -22.906 -14.779 3.010 1.00 0.00 O ATOM 1441 CG2 THR A 96 -21.167 -13.098 3.029 1.00 0.00 C ATOM 0 H THR A 96 -21.845 -15.754 4.776 1.00 0.00 H new ATOM 0 HA THR A 96 -21.711 -12.959 5.549 1.00 0.00 H new ATOM 0 HB THR A 96 -23.235 -12.794 3.460 1.00 0.00 H new ATOM 0 HG1 THR A 96 -22.906 -14.665 2.037 1.00 0.00 H new ATOM 0 HG21 THR A 96 -21.289 -12.963 1.954 1.00 0.00 H new ATOM 0 HG22 THR A 96 -20.871 -12.152 3.483 1.00 0.00 H new ATOM 0 HG23 THR A 96 -20.397 -13.846 3.215 1.00 0.00 H new ATOM 1449 N THR A 97 -23.820 -12.857 6.823 1.00 0.00 N ATOM 1450 CA THR A 97 -25.090 -12.627 7.498 1.00 0.00 C ATOM 1451 C THR A 97 -25.945 -11.625 6.721 1.00 0.00 C ATOM 1452 O THR A 97 -26.761 -10.905 7.297 1.00 0.00 O ATOM 1453 CB THR A 97 -24.843 -12.100 8.923 1.00 0.00 C ATOM 1454 OG1 THR A 97 -23.894 -11.022 8.884 1.00 0.00 O ATOM 1455 CG2 THR A 97 -24.323 -13.207 9.829 1.00 0.00 C ATOM 0 H THR A 97 -23.041 -12.319 7.204 1.00 0.00 H new ATOM 0 HA THR A 97 -25.625 -13.575 7.550 1.00 0.00 H new ATOM 0 HB THR A 97 -25.790 -11.741 9.325 1.00 0.00 H new ATOM 0 HG1 THR A 97 -23.741 -10.688 9.793 1.00 0.00 H new ATOM 0 HG21 THR A 97 -24.156 -12.810 10.830 1.00 0.00 H new ATOM 0 HG22 THR A 97 -25.055 -14.013 9.876 1.00 0.00 H new ATOM 0 HG23 THR A 97 -23.384 -13.592 9.431 1.00 0.00 H new ATOM 1463 N CYS A 98 -25.758 -11.601 5.406 1.00 0.00 N ATOM 1464 CA CYS A 98 -26.436 -10.649 4.540 1.00 0.00 C ATOM 1465 C CYS A 98 -27.916 -10.990 4.405 1.00 0.00 C ATOM 1466 O CYS A 98 -28.299 -11.870 3.632 1.00 0.00 O ATOM 1467 CB CYS A 98 -25.767 -10.632 3.165 1.00 0.00 C ATOM 1468 SG CYS A 98 -23.976 -10.302 3.229 1.00 0.00 S ATOM 0 H CYS A 98 -25.134 -12.240 4.913 1.00 0.00 H new ATOM 0 HA CYS A 98 -26.359 -9.658 4.988 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -25.934 -11.592 2.677 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -26.246 -9.873 2.547 1.00 0.00 H new ATOM 1473 N GLY A 99 -28.739 -10.294 5.174 1.00 0.00 N ATOM 1474 CA GLY A 99 -30.164 -10.514 5.127 1.00 0.00 C ATOM 1475 C GLY A 99 -30.862 -9.361 4.455 1.00 0.00 C ATOM 1476 O GLY A 99 -31.086 -8.320 5.072 1.00 0.00 O ATOM 0 H GLY A 99 -28.440 -9.576 5.834 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -30.376 -11.437 4.588 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -30.551 -10.639 6.138 1.00 0.00 H new ATOM 1480 N ASN A 100 -31.202 -9.546 3.191 1.00 0.00 N ATOM 1481 CA ASN A 100 -31.758 -8.468 2.382 1.00 0.00 C ATOM 1482 C ASN A 100 -33.183 -8.115 2.809 1.00 0.00 C ATOM 1483 O ASN A 100 -33.710 -7.063 2.437 1.00 0.00 O ATOM 1484 CB ASN A 100 -31.712 -8.831 0.890 1.00 0.00 C ATOM 1485 CG ASN A 100 -32.336 -10.180 0.574 1.00 0.00 C ATOM 1486 OD1 ASN A 100 -33.286 -10.615 1.224 1.00 0.00 O ATOM 1487 ND2 ASN A 100 -31.792 -10.856 -0.422 1.00 0.00 N ATOM 0 H ASN A 100 -31.104 -10.434 2.699 1.00 0.00 H new ATOM 0 HA ASN A 100 -31.140 -7.585 2.545 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -32.229 -8.058 0.320 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -30.674 -8.833 0.557 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -32.159 -11.773 -0.676 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -31.005 -10.461 -0.937 1.00 0.00 H new ATOM 1494 N GLY A 101 -33.798 -9.000 3.580 1.00 0.00 N ATOM 1495 CA GLY A 101 -35.126 -8.751 4.100 1.00 0.00 C ATOM 1496 C GLY A 101 -35.513 -9.790 5.126 1.00 0.00 C ATOM 1497 O GLY A 101 -36.664 -10.223 5.184 1.00 0.00 O ATOM 0 H GLY A 101 -33.395 -9.895 3.857 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -35.163 -7.759 4.551 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -35.847 -8.757 3.282 1.00 0.00 H new ATOM 1501 N SER A 102 -34.540 -10.185 5.934 1.00 0.00 N ATOM 1502 CA SER A 102 -34.725 -11.248 6.905 1.00 0.00 C ATOM 1503 C SER A 102 -34.986 -10.672 8.298 1.00 0.00 C ATOM 1504 O SER A 102 -36.121 -10.811 8.799 1.00 0.00 O ATOM 1505 CB SER A 102 -33.483 -12.142 6.916 1.00 0.00 C ATOM 1506 OG SER A 102 -33.137 -12.542 5.597 1.00 0.00 O ATOM 0 H SER A 102 -33.605 -9.778 5.934 1.00 0.00 H new ATOM 0 HA SER A 102 -35.595 -11.842 6.623 1.00 0.00 H new ATOM 0 HB2 SER A 102 -32.648 -11.607 7.369 1.00 0.00 H new ATOM 0 HB3 SER A 102 -33.669 -13.023 7.531 1.00 0.00 H new ATOM 0 HG SER A 102 -32.340 -13.111 5.626 1.00 0.00 H new TER 1512 SER A 102