USER MOD reduce.3.24.130724 H: found=0, std=0, add=744, rem=0, adj=32 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 70 GLN :FLIP amide:sc= -0.0616 F(o=-1,f=-0.04) USER MOD Set 1.2: A 97 THR OG1 : rot 180:sc= 0.0213 USER MOD Set 2.1: A 20 GLN : amide:sc= -1.1 K(o=0.51,f=-0.055) USER MOD Set 2.2: A 56 LYS NZ :NH3+ 142:sc= 1.61 (180deg=-0.0291!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 177:sc= 1.26 (180deg=1.24) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ -152:sc= 0.987 (180deg=-0.141!) USER MOD Single : A 15 LYS NZ :NH3+ -152:sc= 1.2 (180deg=0.931) USER MOD Single : A 17 SER OG : rot -109:sc= 1.17 USER MOD Single : A 21 LYS NZ :NH3+ -118:sc= 0.79 (180deg=-0.391!) USER MOD Single : A 22 THR OG1 : rot 68:sc= 0.287 USER MOD Single : A 23 HIS : no HE2:sc= -0.845 X(o=-0.85,f=-0.88) USER MOD Single : A 28 LYS NZ :NH3+ 179:sc= 1.14 (180deg=1.06) USER MOD Single : A 33 ASN : amide:sc= -0.0361 K(o=-0.036,f=-3.7!) USER MOD Single : A 39 LYS NZ :NH3+ -142:sc= 0.565 (180deg=-0.00319) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 84:sc= 1.27 USER MOD Single : A 47 LYS NZ :NH3+ -176:sc= 1.21 (180deg=1.03) USER MOD Single : A 49 LYS NZ :NH3+ -148:sc= 0.187 (180deg=0.00504) USER MOD Single : A 50 THR OG1 : rot 90:sc= 0.542 USER MOD Single : A 54 HIS : no HD1:sc= 0.631 K(o=0.63,f=-5.5!) USER MOD Single : A 57 SER OG : rot 75:sc= 1.27 USER MOD Single : A 61 LYS NZ :NH3+ 152:sc= 0.857 (180deg=0.0341) USER MOD Single : A 63 ASN : amide:sc= 1.22 K(o=1.2,f=-0.15) USER MOD Single : A 65 ASN : amide:sc= -0.218 X(o=-0.22,f=-0.13) USER MOD Single : A 69 GLN :FLIP amide:sc= -0.624 F(o=-1.4,f=-0.62) USER MOD Single : A 71 LYS NZ :NH3+ 149:sc= 1.25 (180deg=1.06) USER MOD Single : A 72 THR OG1 : rot 70:sc= 1.21 USER MOD Single : A 73 THR OG1 : rot 79:sc= 1.32 USER MOD Single : A 75 LYS NZ :NH3+ 158:sc= 1.27 (180deg=0.618) USER MOD Single : A 76 GLN :FLIP amide:sc= 0 F(o=-0.99,f=0) USER MOD Single : A 77 THR OG1 : rot 63:sc= 0.641 USER MOD Single : A 79 GLN : amide:sc= 0.0268 K(o=0.027,f=-0.8) USER MOD Single : A 83 SER OG : rot -96:sc= 1.22 USER MOD Single : A 91 SER OG : rot 180:sc= 0.0448 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 93 ASN : amide:sc= -0.264 K(o=-0.26,f=-10!) USER MOD Single : A 96 THR OG1 : rot 164:sc= 0.376 USER MOD Single : A 100 ASN :FLIP amide:sc= -0.0244 F(o=-1.2!,f=-0.024) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 9.604 -1.665 -3.717 1.00 0.00 N ATOM 2 CA GLY A 1 8.524 -1.370 -2.746 1.00 0.00 C ATOM 3 C GLY A 1 7.147 -1.690 -3.292 1.00 0.00 C ATOM 4 O GLY A 1 6.645 -2.797 -3.110 1.00 0.00 O ATOM 0 H1 GLY A 1 10.525 -1.429 -3.295 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.584 -2.676 -3.962 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.462 -1.098 -4.577 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.692 -1.945 -1.835 1.00 0.00 H new ATOM 0 HA3 GLY A 1 8.566 -0.316 -2.470 1.00 0.00 H new ATOM 7 N ALA A 2 6.541 -0.719 -3.964 1.00 0.00 N ATOM 8 CA ALA A 2 5.198 -0.885 -4.502 1.00 0.00 C ATOM 9 C ALA A 2 5.231 -1.501 -5.898 1.00 0.00 C ATOM 10 O ALA A 2 4.569 -2.507 -6.156 1.00 0.00 O ATOM 11 CB ALA A 2 4.471 0.453 -4.526 1.00 0.00 C ATOM 0 H ALA A 2 6.960 0.193 -4.149 1.00 0.00 H new ATOM 0 HA ALA A 2 4.656 -1.570 -3.850 1.00 0.00 H new ATOM 0 HB1 ALA A 2 3.468 0.315 -4.930 1.00 0.00 H new ATOM 0 HB2 ALA A 2 4.402 0.848 -3.512 1.00 0.00 H new ATOM 0 HB3 ALA A 2 5.021 1.155 -5.152 1.00 0.00 H new ATOM 17 N MET A 3 5.992 -0.891 -6.796 1.00 0.00 N ATOM 18 CA MET A 3 6.080 -1.367 -8.170 1.00 0.00 C ATOM 19 C MET A 3 7.390 -2.110 -8.396 1.00 0.00 C ATOM 20 O MET A 3 8.472 -1.569 -8.154 1.00 0.00 O ATOM 21 CB MET A 3 5.972 -0.192 -9.147 1.00 0.00 C ATOM 22 CG MET A 3 4.725 0.654 -8.944 1.00 0.00 C ATOM 23 SD MET A 3 3.200 -0.284 -9.162 1.00 0.00 S ATOM 24 CE MET A 3 1.983 0.943 -8.696 1.00 0.00 C ATOM 0 H MET A 3 6.557 -0.065 -6.598 1.00 0.00 H new ATOM 0 HA MET A 3 5.253 -2.054 -8.348 1.00 0.00 H new ATOM 0 HB2 MET A 3 6.852 0.442 -9.039 1.00 0.00 H new ATOM 0 HB3 MET A 3 5.978 -0.576 -10.167 1.00 0.00 H new ATOM 0 HG2 MET A 3 4.742 1.083 -7.942 1.00 0.00 H new ATOM 0 HG3 MET A 3 4.738 1.486 -9.648 1.00 0.00 H new ATOM 0 HE1 MET A 3 0.984 0.514 -8.779 1.00 0.00 H new ATOM 0 HE2 MET A 3 2.159 1.258 -7.667 1.00 0.00 H new ATOM 0 HE3 MET A 3 2.064 1.805 -9.358 1.00 0.00 H new ATOM 34 N GLY A 4 7.291 -3.345 -8.857 1.00 0.00 N ATOM 35 CA GLY A 4 8.474 -4.147 -9.091 1.00 0.00 C ATOM 36 C GLY A 4 8.140 -5.496 -9.696 1.00 0.00 C ATOM 37 O GLY A 4 7.167 -5.614 -10.439 1.00 0.00 O ATOM 0 H GLY A 4 6.409 -3.809 -9.075 1.00 0.00 H new ATOM 0 HA2 GLY A 4 9.150 -3.609 -9.756 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.004 -4.294 -8.150 1.00 0.00 H new ATOM 41 N PRO A 5 8.934 -6.536 -9.398 1.00 0.00 N ATOM 42 CA PRO A 5 8.693 -7.897 -9.892 1.00 0.00 C ATOM 43 C PRO A 5 7.448 -8.516 -9.260 1.00 0.00 C ATOM 44 O PRO A 5 6.913 -7.990 -8.278 1.00 0.00 O ATOM 45 CB PRO A 5 9.951 -8.674 -9.472 1.00 0.00 C ATOM 46 CG PRO A 5 10.941 -7.637 -9.057 1.00 0.00 C ATOM 47 CD PRO A 5 10.134 -6.477 -8.556 1.00 0.00 C ATOM 0 HA PRO A 5 8.517 -7.914 -10.968 1.00 0.00 H new ATOM 0 HB2 PRO A 5 9.734 -9.359 -8.653 1.00 0.00 H new ATOM 0 HB3 PRO A 5 10.335 -9.275 -10.297 1.00 0.00 H new ATOM 0 HG2 PRO A 5 11.603 -8.018 -8.279 1.00 0.00 H new ATOM 0 HG3 PRO A 5 11.572 -7.341 -9.895 1.00 0.00 H new ATOM 0 HD2 PRO A 5 9.892 -6.578 -7.498 1.00 0.00 H new ATOM 0 HD3 PRO A 5 10.665 -5.533 -8.673 1.00 0.00 H new ATOM 55 N LYS A 6 6.995 -9.631 -9.814 1.00 0.00 N ATOM 56 CA LYS A 6 5.786 -10.282 -9.340 1.00 0.00 C ATOM 57 C LYS A 6 5.982 -10.884 -7.949 1.00 0.00 C ATOM 58 O LYS A 6 6.993 -11.533 -7.668 1.00 0.00 O ATOM 59 CB LYS A 6 5.324 -11.342 -10.338 1.00 0.00 C ATOM 60 CG LYS A 6 6.338 -12.431 -10.619 1.00 0.00 C ATOM 61 CD LYS A 6 5.766 -13.449 -11.583 1.00 0.00 C ATOM 62 CE LYS A 6 6.721 -14.604 -11.817 1.00 0.00 C ATOM 63 NZ LYS A 6 6.105 -15.673 -12.643 1.00 0.00 N ATOM 0 H LYS A 6 7.450 -10.104 -10.595 1.00 0.00 H new ATOM 0 HA LYS A 6 5.007 -9.524 -9.258 1.00 0.00 H new ATOM 0 HB2 LYS A 6 4.411 -11.803 -9.961 1.00 0.00 H new ATOM 0 HB3 LYS A 6 5.069 -10.851 -11.277 1.00 0.00 H new ATOM 0 HG2 LYS A 6 7.244 -11.994 -11.038 1.00 0.00 H new ATOM 0 HG3 LYS A 6 6.622 -12.922 -9.688 1.00 0.00 H new ATOM 0 HD2 LYS A 6 4.823 -13.831 -11.191 1.00 0.00 H new ATOM 0 HD3 LYS A 6 5.543 -12.964 -12.533 1.00 0.00 H new ATOM 0 HE2 LYS A 6 7.621 -14.237 -12.311 1.00 0.00 H new ATOM 0 HE3 LYS A 6 7.031 -15.019 -10.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 6.806 -16.420 -12.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 5.291 -16.076 -12.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 5.787 -15.272 -13.548 1.00 0.00 H new ATOM 77 N SER A 7 5.013 -10.638 -7.078 1.00 0.00 N ATOM 78 CA SER A 7 5.072 -11.099 -5.698 1.00 0.00 C ATOM 79 C SER A 7 4.401 -12.464 -5.543 1.00 0.00 C ATOM 80 O SER A 7 3.929 -13.038 -6.528 1.00 0.00 O ATOM 81 CB SER A 7 4.403 -10.065 -4.794 1.00 0.00 C ATOM 82 OG SER A 7 4.972 -8.784 -4.998 1.00 0.00 O ATOM 0 H SER A 7 4.167 -10.116 -7.307 1.00 0.00 H new ATOM 0 HA SER A 7 6.116 -11.214 -5.408 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.333 -10.031 -5.000 1.00 0.00 H new ATOM 0 HB3 SER A 7 4.517 -10.358 -3.750 1.00 0.00 H new ATOM 0 HG SER A 7 4.531 -8.133 -4.413 1.00 0.00 H new ATOM 88 N LYS A 8 4.349 -12.976 -4.307 1.00 0.00 N ATOM 89 CA LYS A 8 3.762 -14.293 -4.045 1.00 0.00 C ATOM 90 C LYS A 8 2.315 -14.319 -4.496 1.00 0.00 C ATOM 91 O LYS A 8 1.833 -15.320 -5.022 1.00 0.00 O ATOM 92 CB LYS A 8 3.814 -14.658 -2.558 1.00 0.00 C ATOM 93 CG LYS A 8 5.196 -14.618 -1.936 1.00 0.00 C ATOM 94 CD LYS A 8 5.202 -15.345 -0.600 1.00 0.00 C ATOM 95 CE LYS A 8 6.423 -14.991 0.229 1.00 0.00 C ATOM 96 NZ LYS A 8 6.334 -13.612 0.773 1.00 0.00 N ATOM 0 H LYS A 8 4.705 -12.500 -3.478 1.00 0.00 H new ATOM 0 HA LYS A 8 4.350 -15.021 -4.604 1.00 0.00 H new ATOM 0 HB2 LYS A 8 3.165 -13.976 -2.009 1.00 0.00 H new ATOM 0 HB3 LYS A 8 3.404 -15.660 -2.431 1.00 0.00 H new ATOM 0 HG2 LYS A 8 5.918 -15.079 -2.610 1.00 0.00 H new ATOM 0 HG3 LYS A 8 5.507 -13.583 -1.795 1.00 0.00 H new ATOM 0 HD2 LYS A 8 4.299 -15.091 -0.044 1.00 0.00 H new ATOM 0 HD3 LYS A 8 5.179 -16.421 -0.772 1.00 0.00 H new ATOM 0 HE2 LYS A 8 6.524 -15.701 1.050 1.00 0.00 H new ATOM 0 HE3 LYS A 8 7.319 -15.084 -0.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 7.292 -13.229 0.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 5.810 -13.009 0.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 5.838 -13.631 1.687 1.00 0.00 H new ATOM 110 N GLU A 9 1.631 -13.201 -4.287 1.00 0.00 N ATOM 111 CA GLU A 9 0.248 -13.061 -4.702 1.00 0.00 C ATOM 112 C GLU A 9 0.117 -13.312 -6.195 1.00 0.00 C ATOM 113 O GLU A 9 -0.763 -14.042 -6.631 1.00 0.00 O ATOM 114 CB GLU A 9 -0.277 -11.664 -4.351 1.00 0.00 C ATOM 115 CG GLU A 9 0.554 -10.535 -4.936 1.00 0.00 C ATOM 116 CD GLU A 9 -0.029 -9.173 -4.646 1.00 0.00 C ATOM 117 OE1 GLU A 9 0.545 -8.439 -3.813 1.00 0.00 O ATOM 118 OE2 GLU A 9 -1.066 -8.830 -5.249 1.00 0.00 O ATOM 0 H GLU A 9 2.018 -12.376 -3.829 1.00 0.00 H new ATOM 0 HA GLU A 9 -0.350 -13.801 -4.170 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -1.303 -11.571 -4.708 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.306 -11.558 -3.267 1.00 0.00 H new ATOM 0 HG2 GLU A 9 1.565 -10.587 -4.532 1.00 0.00 H new ATOM 0 HG3 GLU A 9 0.634 -10.669 -6.015 1.00 0.00 H new ATOM 125 N GLU A 10 1.032 -12.740 -6.967 1.00 0.00 N ATOM 126 CA GLU A 10 0.986 -12.821 -8.403 1.00 0.00 C ATOM 127 C GLU A 10 1.397 -14.204 -8.883 1.00 0.00 C ATOM 128 O GLU A 10 0.918 -14.682 -9.906 1.00 0.00 O ATOM 129 CB GLU A 10 1.892 -11.744 -8.964 1.00 0.00 C ATOM 130 CG GLU A 10 1.357 -10.344 -8.712 1.00 0.00 C ATOM 131 CD GLU A 10 2.310 -9.261 -9.154 1.00 0.00 C ATOM 132 OE1 GLU A 10 3.247 -8.949 -8.391 1.00 0.00 O ATOM 133 OE2 GLU A 10 2.122 -8.715 -10.262 1.00 0.00 O ATOM 0 H GLU A 10 1.824 -12.209 -6.605 1.00 0.00 H new ATOM 0 HA GLU A 10 -0.033 -12.660 -8.756 1.00 0.00 H new ATOM 0 HB2 GLU A 10 2.882 -11.837 -8.517 1.00 0.00 H new ATOM 0 HB3 GLU A 10 2.011 -11.896 -10.037 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.409 -10.223 -9.237 1.00 0.00 H new ATOM 0 HG3 GLU A 10 1.150 -10.226 -7.648 1.00 0.00 H new ATOM 140 N LEU A 11 2.286 -14.835 -8.132 1.00 0.00 N ATOM 141 CA LEU A 11 2.654 -16.223 -8.380 1.00 0.00 C ATOM 142 C LEU A 11 1.448 -17.123 -8.154 1.00 0.00 C ATOM 143 O LEU A 11 1.179 -18.038 -8.933 1.00 0.00 O ATOM 144 CB LEU A 11 3.788 -16.649 -7.443 1.00 0.00 C ATOM 145 CG LEU A 11 5.068 -15.820 -7.541 1.00 0.00 C ATOM 146 CD1 LEU A 11 6.053 -16.219 -6.453 1.00 0.00 C ATOM 147 CD2 LEU A 11 5.699 -15.986 -8.910 1.00 0.00 C ATOM 0 H LEU A 11 2.769 -14.407 -7.342 1.00 0.00 H new ATOM 0 HA LEU A 11 2.992 -16.315 -9.412 1.00 0.00 H new ATOM 0 HB2 LEU A 11 3.424 -16.604 -6.417 1.00 0.00 H new ATOM 0 HB3 LEU A 11 4.034 -17.691 -7.649 1.00 0.00 H new ATOM 0 HG LEU A 11 4.809 -14.771 -7.400 1.00 0.00 H new ATOM 0 HD11 LEU A 11 6.957 -15.616 -6.542 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.601 -16.054 -5.475 1.00 0.00 H new ATOM 0 HD13 LEU A 11 6.308 -17.273 -6.562 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.610 -15.390 -8.966 1.00 0.00 H new ATOM 0 HD22 LEU A 11 5.942 -17.036 -9.074 1.00 0.00 H new ATOM 0 HD23 LEU A 11 4.999 -15.652 -9.676 1.00 0.00 H new ATOM 159 N LEU A 12 0.721 -16.849 -7.078 1.00 0.00 N ATOM 160 CA LEU A 12 -0.473 -17.599 -6.743 1.00 0.00 C ATOM 161 C LEU A 12 -1.563 -17.367 -7.786 1.00 0.00 C ATOM 162 O LEU A 12 -2.325 -18.275 -8.102 1.00 0.00 O ATOM 163 CB LEU A 12 -0.968 -17.197 -5.354 1.00 0.00 C ATOM 164 CG LEU A 12 -2.183 -17.968 -4.843 1.00 0.00 C ATOM 165 CD1 LEU A 12 -1.857 -19.447 -4.687 1.00 0.00 C ATOM 166 CD2 LEU A 12 -2.663 -17.384 -3.525 1.00 0.00 C ATOM 0 H LEU A 12 0.945 -16.104 -6.419 1.00 0.00 H new ATOM 0 HA LEU A 12 -0.229 -18.661 -6.737 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -0.151 -17.327 -4.644 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -1.212 -16.135 -5.367 1.00 0.00 H new ATOM 0 HG LEU A 12 -2.984 -17.873 -5.576 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.737 -19.977 -4.322 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -1.560 -19.858 -5.652 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -1.040 -19.566 -3.975 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -3.530 -17.944 -3.173 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.864 -17.449 -2.786 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -2.940 -16.340 -3.669 1.00 0.00 H new ATOM 178 N ARG A 13 -1.619 -16.153 -8.330 1.00 0.00 N ATOM 179 CA ARG A 13 -2.588 -15.817 -9.373 1.00 0.00 C ATOM 180 C ARG A 13 -2.400 -16.709 -10.592 1.00 0.00 C ATOM 181 O ARG A 13 -3.356 -17.015 -11.300 1.00 0.00 O ATOM 182 CB ARG A 13 -2.460 -14.344 -9.778 1.00 0.00 C ATOM 183 CG ARG A 13 -2.728 -13.378 -8.637 1.00 0.00 C ATOM 184 CD ARG A 13 -2.428 -11.937 -9.019 1.00 0.00 C ATOM 185 NE ARG A 13 -3.550 -11.301 -9.706 1.00 0.00 N ATOM 186 CZ ARG A 13 -4.359 -10.402 -9.139 1.00 0.00 C ATOM 187 NH1 ARG A 13 -4.173 -10.032 -7.875 1.00 0.00 N ATOM 188 NH2 ARG A 13 -5.355 -9.869 -9.830 1.00 0.00 N ATOM 0 H ARG A 13 -1.004 -15.384 -8.066 1.00 0.00 H new ATOM 0 HA ARG A 13 -3.586 -15.984 -8.969 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -1.457 -14.167 -10.165 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -3.156 -14.137 -10.591 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -3.771 -13.461 -8.331 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -2.120 -13.658 -7.777 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -2.185 -11.368 -8.121 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -1.548 -11.909 -9.662 1.00 0.00 H new ATOM 0 HE ARG A 13 -3.726 -11.559 -10.677 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -3.409 -10.435 -7.333 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -4.794 -9.345 -7.448 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -5.507 -10.145 -10.800 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -5.970 -9.183 -9.392 1.00 0.00 H new ATOM 202 N GLU A 14 -1.165 -17.138 -10.822 1.00 0.00 N ATOM 203 CA GLU A 14 -0.860 -18.023 -11.937 1.00 0.00 C ATOM 204 C GLU A 14 -1.438 -19.413 -11.681 1.00 0.00 C ATOM 205 O GLU A 14 -1.751 -20.152 -12.613 1.00 0.00 O ATOM 206 CB GLU A 14 0.654 -18.112 -12.143 1.00 0.00 C ATOM 207 CG GLU A 14 1.329 -16.755 -12.253 1.00 0.00 C ATOM 208 CD GLU A 14 2.769 -16.848 -12.706 1.00 0.00 C ATOM 209 OE1 GLU A 14 3.005 -17.332 -13.832 1.00 0.00 O ATOM 210 OE2 GLU A 14 3.668 -16.421 -11.953 1.00 0.00 O ATOM 0 H GLU A 14 -0.359 -16.887 -10.250 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.314 -17.615 -12.840 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.095 -18.662 -11.312 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.857 -18.685 -13.048 1.00 0.00 H new ATOM 0 HG2 GLU A 14 0.772 -16.134 -12.955 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.290 -16.256 -11.285 1.00 0.00 H new ATOM 217 N LYS A 15 -1.584 -19.750 -10.406 1.00 0.00 N ATOM 218 CA LYS A 15 -2.118 -21.041 -9.992 1.00 0.00 C ATOM 219 C LYS A 15 -3.625 -20.972 -9.761 1.00 0.00 C ATOM 220 O LYS A 15 -4.257 -21.976 -9.431 1.00 0.00 O ATOM 221 CB LYS A 15 -1.436 -21.476 -8.700 1.00 0.00 C ATOM 222 CG LYS A 15 0.061 -21.677 -8.834 1.00 0.00 C ATOM 223 CD LYS A 15 0.720 -21.695 -7.469 1.00 0.00 C ATOM 224 CE LYS A 15 2.055 -22.425 -7.487 1.00 0.00 C ATOM 225 NZ LYS A 15 1.883 -23.885 -7.714 1.00 0.00 N ATOM 0 H LYS A 15 -1.336 -19.136 -9.630 1.00 0.00 H new ATOM 0 HA LYS A 15 -1.925 -21.760 -10.788 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -1.625 -20.727 -7.931 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -1.889 -22.406 -8.357 1.00 0.00 H new ATOM 0 HG2 LYS A 15 0.263 -22.614 -9.354 1.00 0.00 H new ATOM 0 HG3 LYS A 15 0.488 -20.878 -9.440 1.00 0.00 H new ATOM 0 HD2 LYS A 15 0.872 -20.671 -7.127 1.00 0.00 H new ATOM 0 HD3 LYS A 15 0.054 -22.175 -6.752 1.00 0.00 H new ATOM 0 HE2 LYS A 15 2.687 -22.007 -8.271 1.00 0.00 H new ATOM 0 HE3 LYS A 15 2.571 -22.263 -6.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 2.670 -24.400 -7.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 0.984 -24.198 -7.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 1.874 -24.079 -8.736 1.00 0.00 H new ATOM 239 N LEU A 16 -4.195 -19.789 -9.931 1.00 0.00 N ATOM 240 CA LEU A 16 -5.598 -19.573 -9.613 1.00 0.00 C ATOM 241 C LEU A 16 -6.437 -19.361 -10.865 1.00 0.00 C ATOM 242 O LEU A 16 -5.932 -18.946 -11.909 1.00 0.00 O ATOM 243 CB LEU A 16 -5.760 -18.362 -8.689 1.00 0.00 C ATOM 244 CG LEU A 16 -5.191 -18.527 -7.280 1.00 0.00 C ATOM 245 CD1 LEU A 16 -5.372 -17.245 -6.487 1.00 0.00 C ATOM 246 CD2 LEU A 16 -5.857 -19.691 -6.566 1.00 0.00 C ATOM 0 H LEU A 16 -3.709 -18.966 -10.286 1.00 0.00 H new ATOM 0 HA LEU A 16 -5.952 -20.472 -9.109 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.280 -17.503 -9.157 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -6.822 -18.129 -8.608 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.125 -18.740 -7.361 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -4.963 -17.376 -5.485 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -4.850 -16.430 -6.989 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -6.433 -17.007 -6.417 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -5.438 -19.792 -5.565 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.929 -19.508 -6.494 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.682 -20.610 -7.126 1.00 0.00 H new ATOM 258 N SER A 17 -7.722 -19.665 -10.745 1.00 0.00 N ATOM 259 CA SER A 17 -8.693 -19.364 -11.785 1.00 0.00 C ATOM 260 C SER A 17 -8.948 -17.855 -11.827 1.00 0.00 C ATOM 261 O SER A 17 -8.522 -17.128 -10.929 1.00 0.00 O ATOM 262 CB SER A 17 -9.992 -20.133 -11.518 1.00 0.00 C ATOM 263 OG SER A 17 -10.957 -19.903 -12.531 1.00 0.00 O ATOM 0 H SER A 17 -8.119 -20.126 -9.926 1.00 0.00 H new ATOM 0 HA SER A 17 -8.304 -19.676 -12.754 1.00 0.00 H new ATOM 0 HB2 SER A 17 -9.777 -21.200 -11.456 1.00 0.00 H new ATOM 0 HB3 SER A 17 -10.400 -19.834 -10.553 1.00 0.00 H new ATOM 0 HG SER A 17 -11.680 -19.347 -12.174 1.00 0.00 H new ATOM 269 N GLU A 18 -9.668 -17.390 -12.841 1.00 0.00 N ATOM 270 CA GLU A 18 -9.849 -15.960 -13.048 1.00 0.00 C ATOM 271 C GLU A 18 -10.754 -15.389 -11.970 1.00 0.00 C ATOM 272 O GLU A 18 -10.561 -14.268 -11.493 1.00 0.00 O ATOM 273 CB GLU A 18 -10.439 -15.692 -14.432 1.00 0.00 C ATOM 274 CG GLU A 18 -9.652 -16.337 -15.562 1.00 0.00 C ATOM 275 CD GLU A 18 -8.171 -16.031 -15.497 1.00 0.00 C ATOM 276 OE1 GLU A 18 -7.369 -16.986 -15.426 1.00 0.00 O ATOM 277 OE2 GLU A 18 -7.797 -14.842 -15.503 1.00 0.00 O ATOM 0 H GLU A 18 -10.134 -17.980 -13.530 1.00 0.00 H new ATOM 0 HA GLU A 18 -8.876 -15.472 -12.987 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -11.465 -16.060 -14.458 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -10.482 -14.616 -14.598 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -9.797 -17.417 -15.529 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -10.048 -15.992 -16.517 1.00 0.00 H new ATOM 284 N ASP A 19 -11.736 -16.185 -11.582 1.00 0.00 N ATOM 285 CA ASP A 19 -12.646 -15.821 -10.510 1.00 0.00 C ATOM 286 C ASP A 19 -11.896 -15.740 -9.183 1.00 0.00 C ATOM 287 O ASP A 19 -12.133 -14.842 -8.377 1.00 0.00 O ATOM 288 CB ASP A 19 -13.786 -16.839 -10.433 1.00 0.00 C ATOM 289 CG ASP A 19 -13.301 -18.251 -10.174 1.00 0.00 C ATOM 290 OD1 ASP A 19 -12.928 -18.937 -11.145 1.00 0.00 O ATOM 291 OD2 ASP A 19 -13.294 -18.683 -9.005 1.00 0.00 O ATOM 0 H ASP A 19 -11.924 -17.097 -11.999 1.00 0.00 H new ATOM 0 HA ASP A 19 -13.071 -14.839 -10.717 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -14.475 -16.546 -9.641 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -14.348 -16.819 -11.367 1.00 0.00 H new ATOM 296 N GLN A 20 -10.959 -16.660 -8.993 1.00 0.00 N ATOM 297 CA GLN A 20 -10.153 -16.713 -7.780 1.00 0.00 C ATOM 298 C GLN A 20 -9.266 -15.477 -7.667 1.00 0.00 C ATOM 299 O GLN A 20 -9.080 -14.933 -6.581 1.00 0.00 O ATOM 300 CB GLN A 20 -9.292 -17.976 -7.784 1.00 0.00 C ATOM 301 CG GLN A 20 -10.099 -19.261 -7.848 1.00 0.00 C ATOM 302 CD GLN A 20 -10.837 -19.555 -6.560 1.00 0.00 C ATOM 303 OE1 GLN A 20 -11.974 -19.130 -6.359 1.00 0.00 O ATOM 304 NE2 GLN A 20 -10.189 -20.296 -5.680 1.00 0.00 N ATOM 0 H GLN A 20 -10.737 -17.388 -9.672 1.00 0.00 H new ATOM 0 HA GLN A 20 -10.822 -16.736 -6.920 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -8.613 -17.940 -8.636 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -8.675 -17.988 -6.885 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -10.817 -19.193 -8.665 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -9.432 -20.092 -8.077 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -9.247 -20.628 -5.888 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -10.630 -20.537 -4.793 1.00 0.00 H new ATOM 313 N LYS A 21 -8.728 -15.034 -8.800 1.00 0.00 N ATOM 314 CA LYS A 21 -7.890 -13.837 -8.840 1.00 0.00 C ATOM 315 C LYS A 21 -8.682 -12.611 -8.400 1.00 0.00 C ATOM 316 O LYS A 21 -8.169 -11.742 -7.697 1.00 0.00 O ATOM 317 CB LYS A 21 -7.355 -13.608 -10.253 1.00 0.00 C ATOM 318 CG LYS A 21 -6.566 -14.775 -10.817 1.00 0.00 C ATOM 319 CD LYS A 21 -6.216 -14.535 -12.273 1.00 0.00 C ATOM 320 CE LYS A 21 -5.580 -15.758 -12.906 1.00 0.00 C ATOM 321 NZ LYS A 21 -5.263 -15.534 -14.339 1.00 0.00 N ATOM 0 H LYS A 21 -8.857 -15.486 -9.705 1.00 0.00 H new ATOM 0 HA LYS A 21 -7.055 -13.989 -8.156 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -8.193 -13.396 -10.917 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -6.720 -12.722 -10.250 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -5.654 -14.917 -10.238 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -7.148 -15.692 -10.725 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -7.117 -14.267 -12.824 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -5.533 -13.689 -12.348 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -4.667 -16.013 -12.367 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -6.255 -16.609 -12.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -5.804 -16.203 -14.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -5.517 -14.560 -14.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -4.246 -15.681 -14.497 1.00 0.00 H new ATOM 335 N THR A 22 -9.941 -12.563 -8.817 1.00 0.00 N ATOM 336 CA THR A 22 -10.818 -11.450 -8.493 1.00 0.00 C ATOM 337 C THR A 22 -11.023 -11.338 -6.982 1.00 0.00 C ATOM 338 O THR A 22 -10.900 -10.255 -6.403 1.00 0.00 O ATOM 339 CB THR A 22 -12.181 -11.610 -9.198 1.00 0.00 C ATOM 340 OG1 THR A 22 -11.987 -11.673 -10.621 1.00 0.00 O ATOM 341 CG2 THR A 22 -13.114 -10.455 -8.865 1.00 0.00 C ATOM 0 H THR A 22 -10.378 -13.289 -9.385 1.00 0.00 H new ATOM 0 HA THR A 22 -10.342 -10.536 -8.847 1.00 0.00 H new ATOM 0 HB THR A 22 -12.638 -12.534 -8.844 1.00 0.00 H new ATOM 0 HG1 THR A 22 -11.531 -12.509 -10.852 1.00 0.00 H new ATOM 0 HG21 THR A 22 -14.066 -10.597 -9.377 1.00 0.00 H new ATOM 0 HG22 THR A 22 -13.282 -10.422 -7.789 1.00 0.00 H new ATOM 0 HG23 THR A 22 -12.663 -9.518 -9.191 1.00 0.00 H new ATOM 349 N HIS A 23 -11.308 -12.464 -6.341 1.00 0.00 N ATOM 350 CA HIS A 23 -11.539 -12.478 -4.902 1.00 0.00 C ATOM 351 C HIS A 23 -10.228 -12.428 -4.131 1.00 0.00 C ATOM 352 O HIS A 23 -10.213 -12.165 -2.930 1.00 0.00 O ATOM 353 CB HIS A 23 -12.366 -13.699 -4.502 1.00 0.00 C ATOM 354 CG HIS A 23 -13.762 -13.627 -5.025 1.00 0.00 C ATOM 355 ND1 HIS A 23 -14.142 -14.320 -6.143 1.00 0.00 N ATOM 356 CD2 HIS A 23 -14.807 -12.895 -4.580 1.00 0.00 C ATOM 357 CE1 HIS A 23 -15.400 -13.994 -6.358 1.00 0.00 C ATOM 358 NE2 HIS A 23 -15.852 -13.127 -5.438 1.00 0.00 N ATOM 0 H HIS A 23 -11.385 -13.376 -6.792 1.00 0.00 H new ATOM 0 HA HIS A 23 -12.105 -11.583 -4.643 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -11.884 -14.602 -4.878 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -12.390 -13.780 -3.415 1.00 0.00 H new ATOM 0 HD1 HIS A 23 -13.569 -14.958 -6.696 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -14.818 -12.250 -3.714 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -15.995 -14.377 -7.174 1.00 0.00 H new ATOM 366 N LEU A 24 -9.128 -12.666 -4.828 1.00 0.00 N ATOM 367 CA LEU A 24 -7.810 -12.518 -4.233 1.00 0.00 C ATOM 368 C LEU A 24 -7.532 -11.038 -3.987 1.00 0.00 C ATOM 369 O LEU A 24 -7.115 -10.647 -2.897 1.00 0.00 O ATOM 370 CB LEU A 24 -6.736 -13.124 -5.140 1.00 0.00 C ATOM 371 CG LEU A 24 -5.339 -13.208 -4.525 1.00 0.00 C ATOM 372 CD1 LEU A 24 -5.349 -14.110 -3.301 1.00 0.00 C ATOM 373 CD2 LEU A 24 -4.334 -13.713 -5.546 1.00 0.00 C ATOM 0 H LEU A 24 -9.122 -12.962 -5.804 1.00 0.00 H new ATOM 0 HA LEU A 24 -7.784 -13.052 -3.283 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -7.050 -14.127 -5.428 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.679 -12.533 -6.054 1.00 0.00 H new ATOM 0 HG LEU A 24 -5.041 -12.206 -4.215 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -4.346 -14.158 -2.876 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -6.039 -13.708 -2.559 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.669 -15.111 -3.589 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -3.346 -13.766 -5.089 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -4.629 -14.705 -5.887 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -4.305 -13.031 -6.396 1.00 0.00 H new ATOM 385 N ASP A 25 -7.793 -10.217 -5.002 1.00 0.00 N ATOM 386 CA ASP A 25 -7.687 -8.764 -4.870 1.00 0.00 C ATOM 387 C ASP A 25 -8.679 -8.248 -3.834 1.00 0.00 C ATOM 388 O ASP A 25 -8.423 -7.259 -3.150 1.00 0.00 O ATOM 389 CB ASP A 25 -7.946 -8.068 -6.208 1.00 0.00 C ATOM 390 CG ASP A 25 -6.784 -8.177 -7.175 1.00 0.00 C ATOM 391 OD1 ASP A 25 -5.620 -8.113 -6.729 1.00 0.00 O ATOM 392 OD2 ASP A 25 -7.031 -8.300 -8.395 1.00 0.00 O ATOM 0 H ASP A 25 -8.080 -10.534 -5.928 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.672 -8.536 -4.546 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -8.835 -8.500 -6.668 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -8.161 -7.015 -6.026 1.00 0.00 H new ATOM 397 N TRP A 26 -9.819 -8.921 -3.733 1.00 0.00 N ATOM 398 CA TRP A 26 -10.822 -8.579 -2.736 1.00 0.00 C ATOM 399 C TRP A 26 -10.288 -8.847 -1.331 1.00 0.00 C ATOM 400 O TRP A 26 -10.392 -8.003 -0.440 1.00 0.00 O ATOM 401 CB TRP A 26 -12.108 -9.380 -2.977 1.00 0.00 C ATOM 402 CG TRP A 26 -13.183 -9.108 -1.969 1.00 0.00 C ATOM 403 CD1 TRP A 26 -14.168 -8.166 -2.055 1.00 0.00 C ATOM 404 CD2 TRP A 26 -13.379 -9.783 -0.721 1.00 0.00 C ATOM 405 NE1 TRP A 26 -14.962 -8.212 -0.935 1.00 0.00 N ATOM 406 CE2 TRP A 26 -14.497 -9.194 -0.100 1.00 0.00 C ATOM 407 CE3 TRP A 26 -12.715 -10.824 -0.065 1.00 0.00 C ATOM 408 CZ2 TRP A 26 -14.964 -9.618 1.141 1.00 0.00 C ATOM 409 CZ3 TRP A 26 -13.179 -11.241 1.164 1.00 0.00 C ATOM 410 CH2 TRP A 26 -14.293 -10.638 1.758 1.00 0.00 C ATOM 0 H TRP A 26 -10.071 -9.708 -4.331 1.00 0.00 H new ATOM 0 HA TRP A 26 -11.051 -7.517 -2.825 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -12.488 -9.150 -3.972 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -11.871 -10.444 -2.965 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -14.303 -7.485 -2.882 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -15.767 -7.612 -0.754 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -11.852 -11.294 -0.514 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -15.826 -9.158 1.601 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -12.674 -12.046 1.677 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -14.630 -10.985 2.724 1.00 0.00 H new ATOM 421 N LEU A 27 -9.706 -10.026 -1.144 1.00 0.00 N ATOM 422 CA LEU A 27 -9.176 -10.423 0.154 1.00 0.00 C ATOM 423 C LEU A 27 -7.980 -9.549 0.517 1.00 0.00 C ATOM 424 O LEU A 27 -7.696 -9.312 1.693 1.00 0.00 O ATOM 425 CB LEU A 27 -8.789 -11.905 0.131 1.00 0.00 C ATOM 426 CG LEU A 27 -8.853 -12.620 1.484 1.00 0.00 C ATOM 427 CD1 LEU A 27 -8.962 -14.118 1.287 1.00 0.00 C ATOM 428 CD2 LEU A 27 -7.642 -12.300 2.336 1.00 0.00 C ATOM 0 H LEU A 27 -9.589 -10.725 -1.877 1.00 0.00 H new ATOM 0 HA LEU A 27 -9.943 -10.284 0.915 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -9.446 -12.424 -0.567 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -7.775 -11.993 -0.260 1.00 0.00 H new ATOM 0 HG LEU A 27 -9.741 -12.261 2.005 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.006 -14.610 2.258 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -9.866 -14.346 0.723 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -8.092 -14.477 0.738 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -7.719 -12.823 3.289 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -6.738 -12.620 1.818 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.596 -11.226 2.515 1.00 0.00 H new ATOM 440 N LYS A 28 -7.296 -9.065 -0.508 1.00 0.00 N ATOM 441 CA LYS A 28 -6.216 -8.114 -0.344 1.00 0.00 C ATOM 442 C LYS A 28 -6.693 -6.897 0.446 1.00 0.00 C ATOM 443 O LYS A 28 -5.980 -6.386 1.312 1.00 0.00 O ATOM 444 CB LYS A 28 -5.719 -7.708 -1.726 1.00 0.00 C ATOM 445 CG LYS A 28 -4.360 -7.051 -1.738 1.00 0.00 C ATOM 446 CD LYS A 28 -3.837 -6.942 -3.155 1.00 0.00 C ATOM 447 CE LYS A 28 -2.408 -6.456 -3.172 1.00 0.00 C ATOM 448 NZ LYS A 28 -1.841 -6.451 -4.545 1.00 0.00 N ATOM 0 H LYS A 28 -7.477 -9.323 -1.478 1.00 0.00 H new ATOM 0 HA LYS A 28 -5.399 -8.568 0.217 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -5.685 -8.594 -2.360 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.442 -7.025 -2.171 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -4.425 -6.059 -1.291 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -3.664 -7.630 -1.131 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -3.899 -7.914 -3.645 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -4.464 -6.257 -3.725 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -2.362 -5.449 -2.757 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -1.800 -7.094 -2.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -0.864 -6.095 -4.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -1.846 -7.419 -4.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -2.416 -5.836 -5.156 1.00 0.00 H new ATOM 462 N GLU A 29 -7.915 -6.455 0.156 1.00 0.00 N ATOM 463 CA GLU A 29 -8.531 -5.363 0.900 1.00 0.00 C ATOM 464 C GLU A 29 -9.103 -5.873 2.216 1.00 0.00 C ATOM 465 O GLU A 29 -9.094 -5.165 3.222 1.00 0.00 O ATOM 466 CB GLU A 29 -9.656 -4.707 0.100 1.00 0.00 C ATOM 467 CG GLU A 29 -9.229 -4.153 -1.246 1.00 0.00 C ATOM 468 CD GLU A 29 -10.283 -3.248 -1.845 1.00 0.00 C ATOM 469 OE1 GLU A 29 -9.911 -2.232 -2.466 1.00 0.00 O ATOM 470 OE2 GLU A 29 -11.491 -3.531 -1.670 1.00 0.00 O ATOM 0 H GLU A 29 -8.497 -6.838 -0.589 1.00 0.00 H new ATOM 0 HA GLU A 29 -7.753 -4.624 1.091 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -10.448 -5.439 -0.057 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -10.083 -3.898 0.693 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -8.298 -3.599 -1.131 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -9.027 -4.977 -1.930 1.00 0.00 H new ATOM 477 N ALA A 30 -9.615 -7.102 2.190 1.00 0.00 N ATOM 478 CA ALA A 30 -10.225 -7.718 3.367 1.00 0.00 C ATOM 479 C ALA A 30 -9.276 -7.700 4.555 1.00 0.00 C ATOM 480 O ALA A 30 -9.649 -7.285 5.652 1.00 0.00 O ATOM 481 CB ALA A 30 -10.658 -9.143 3.058 1.00 0.00 C ATOM 0 H ALA A 30 -9.619 -7.695 1.360 1.00 0.00 H new ATOM 0 HA ALA A 30 -11.105 -7.132 3.631 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -11.110 -9.586 3.945 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -11.385 -9.134 2.246 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -9.790 -9.731 2.761 1.00 0.00 H new ATOM 487 N LEU A 31 -8.049 -8.143 4.327 1.00 0.00 N ATOM 488 CA LEU A 31 -7.026 -8.095 5.357 1.00 0.00 C ATOM 489 C LEU A 31 -6.427 -6.694 5.436 1.00 0.00 C ATOM 490 O LEU A 31 -6.115 -6.203 6.521 1.00 0.00 O ATOM 491 CB LEU A 31 -5.942 -9.144 5.080 1.00 0.00 C ATOM 492 CG LEU A 31 -6.406 -10.597 5.214 1.00 0.00 C ATOM 493 CD1 LEU A 31 -5.280 -11.556 4.867 1.00 0.00 C ATOM 494 CD2 LEU A 31 -6.913 -10.868 6.621 1.00 0.00 C ATOM 0 H LEU A 31 -7.739 -8.539 3.439 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.480 -8.326 6.320 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -5.558 -8.992 4.071 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.111 -8.978 5.766 1.00 0.00 H new ATOM 0 HG LEU A 31 -7.224 -10.757 4.512 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -5.632 -12.583 4.969 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -4.958 -11.383 3.840 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.441 -11.391 5.543 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -7.238 -11.906 6.697 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -6.112 -10.685 7.338 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.752 -10.208 6.839 1.00 0.00 H new ATOM 506 N GLY A 32 -6.283 -6.056 4.275 1.00 0.00 N ATOM 507 CA GLY A 32 -5.791 -4.688 4.219 1.00 0.00 C ATOM 508 C GLY A 32 -4.383 -4.551 4.759 1.00 0.00 C ATOM 509 O GLY A 32 -4.028 -3.519 5.333 1.00 0.00 O ATOM 0 H GLY A 32 -6.500 -6.466 3.367 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -5.815 -4.339 3.187 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -6.459 -4.042 4.789 1.00 0.00 H new ATOM 513 N ASN A 33 -3.583 -5.591 4.582 1.00 0.00 N ATOM 514 CA ASN A 33 -2.218 -5.598 5.085 1.00 0.00 C ATOM 515 C ASN A 33 -1.344 -6.475 4.205 1.00 0.00 C ATOM 516 O ASN A 33 -1.697 -7.619 3.920 1.00 0.00 O ATOM 517 CB ASN A 33 -2.188 -6.126 6.522 1.00 0.00 C ATOM 518 CG ASN A 33 -0.934 -5.725 7.277 1.00 0.00 C ATOM 519 OD1 ASN A 33 0.144 -5.576 6.700 1.00 0.00 O ATOM 520 ND2 ASN A 33 -1.075 -5.552 8.582 1.00 0.00 N ATOM 0 H ASN A 33 -3.856 -6.443 4.093 1.00 0.00 H new ATOM 0 HA ASN A 33 -1.836 -4.577 5.070 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -3.062 -5.755 7.058 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -2.263 -7.213 6.505 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -0.272 -5.285 9.151 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -1.987 -5.686 9.019 1.00 0.00 H new ATOM 527 N ASP A 34 -0.211 -5.931 3.779 1.00 0.00 N ATOM 528 CA ASP A 34 0.731 -6.653 2.931 1.00 0.00 C ATOM 529 C ASP A 34 1.151 -7.965 3.581 1.00 0.00 C ATOM 530 O ASP A 34 1.022 -9.034 2.987 1.00 0.00 O ATOM 531 CB ASP A 34 1.977 -5.801 2.673 1.00 0.00 C ATOM 532 CG ASP A 34 1.667 -4.486 1.991 1.00 0.00 C ATOM 533 OD1 ASP A 34 1.016 -3.623 2.619 1.00 0.00 O ATOM 534 OD2 ASP A 34 2.087 -4.301 0.829 1.00 0.00 O ATOM 0 H ASP A 34 0.081 -4.981 4.010 1.00 0.00 H new ATOM 0 HA ASP A 34 0.232 -6.867 1.986 1.00 0.00 H new ATOM 0 HB2 ASP A 34 2.477 -5.603 3.621 1.00 0.00 H new ATOM 0 HB3 ASP A 34 2.676 -6.367 2.057 1.00 0.00 H new ATOM 539 N GLY A 35 1.620 -7.873 4.819 1.00 0.00 N ATOM 540 CA GLY A 35 2.154 -9.032 5.510 1.00 0.00 C ATOM 541 C GLY A 35 1.102 -10.076 5.837 1.00 0.00 C ATOM 542 O GLY A 35 1.347 -11.274 5.687 1.00 0.00 O ATOM 0 H GLY A 35 1.640 -7.009 5.361 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.929 -9.488 4.894 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.632 -8.707 6.434 1.00 0.00 H new ATOM 546 N GLU A 36 -0.071 -9.634 6.275 1.00 0.00 N ATOM 547 CA GLU A 36 -1.120 -10.561 6.681 1.00 0.00 C ATOM 548 C GLU A 36 -1.731 -11.258 5.469 1.00 0.00 C ATOM 549 O GLU A 36 -2.095 -12.433 5.533 1.00 0.00 O ATOM 550 CB GLU A 36 -2.189 -9.826 7.489 1.00 0.00 C ATOM 551 CG GLU A 36 -1.625 -9.121 8.715 1.00 0.00 C ATOM 552 CD GLU A 36 -2.683 -8.425 9.546 1.00 0.00 C ATOM 553 OE1 GLU A 36 -3.530 -7.716 8.969 1.00 0.00 O ATOM 554 OE2 GLU A 36 -2.647 -8.562 10.790 1.00 0.00 O ATOM 0 H GLU A 36 -0.318 -8.648 6.358 1.00 0.00 H new ATOM 0 HA GLU A 36 -0.677 -11.330 7.315 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.681 -9.093 6.849 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.952 -10.538 7.804 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -1.105 -9.849 9.337 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -0.884 -8.388 8.395 1.00 0.00 H new ATOM 561 N PHE A 37 -1.821 -10.537 4.357 1.00 0.00 N ATOM 562 CA PHE A 37 -2.342 -11.106 3.120 1.00 0.00 C ATOM 563 C PHE A 37 -1.315 -12.056 2.511 1.00 0.00 C ATOM 564 O PHE A 37 -1.671 -13.079 1.925 1.00 0.00 O ATOM 565 CB PHE A 37 -2.714 -9.982 2.148 1.00 0.00 C ATOM 566 CG PHE A 37 -3.229 -10.445 0.814 1.00 0.00 C ATOM 567 CD1 PHE A 37 -2.481 -10.238 -0.333 1.00 0.00 C ATOM 568 CD2 PHE A 37 -4.462 -11.072 0.702 1.00 0.00 C ATOM 569 CE1 PHE A 37 -2.950 -10.644 -1.566 1.00 0.00 C ATOM 570 CE2 PHE A 37 -4.933 -11.483 -0.529 1.00 0.00 C ATOM 571 CZ PHE A 37 -4.177 -11.266 -1.664 1.00 0.00 C ATOM 0 H PHE A 37 -1.540 -9.559 4.287 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.244 -11.680 3.332 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -3.472 -9.353 2.615 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.836 -9.356 1.985 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.519 -9.753 -0.262 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -5.059 -11.240 1.586 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.357 -10.475 -2.453 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -5.892 -11.974 -0.604 1.00 0.00 H new ATOM 0 HZ PHE A 37 -4.546 -11.583 -2.628 1.00 0.00 H new ATOM 581 N ASP A 38 -0.041 -11.721 2.687 1.00 0.00 N ATOM 582 CA ASP A 38 1.062 -12.568 2.239 1.00 0.00 C ATOM 583 C ASP A 38 0.981 -13.933 2.899 1.00 0.00 C ATOM 584 O ASP A 38 1.246 -14.962 2.277 1.00 0.00 O ATOM 585 CB ASP A 38 2.392 -11.912 2.593 1.00 0.00 C ATOM 586 CG ASP A 38 3.570 -12.515 1.851 1.00 0.00 C ATOM 587 OD1 ASP A 38 4.236 -13.412 2.407 1.00 0.00 O ATOM 588 OD2 ASP A 38 3.858 -12.076 0.715 1.00 0.00 O ATOM 0 H ASP A 38 0.257 -10.858 3.142 1.00 0.00 H new ATOM 0 HA ASP A 38 0.991 -12.691 1.158 1.00 0.00 H new ATOM 0 HB2 ASP A 38 2.336 -10.847 2.369 1.00 0.00 H new ATOM 0 HB3 ASP A 38 2.561 -12.003 3.666 1.00 0.00 H new ATOM 593 N LYS A 39 0.600 -13.922 4.169 1.00 0.00 N ATOM 594 CA LYS A 39 0.447 -15.149 4.945 1.00 0.00 C ATOM 595 C LYS A 39 -0.549 -16.108 4.288 1.00 0.00 C ATOM 596 O LYS A 39 -0.343 -17.325 4.288 1.00 0.00 O ATOM 597 CB LYS A 39 -0.019 -14.832 6.370 1.00 0.00 C ATOM 598 CG LYS A 39 -0.137 -16.067 7.245 1.00 0.00 C ATOM 599 CD LYS A 39 1.227 -16.670 7.546 1.00 0.00 C ATOM 600 CE LYS A 39 1.132 -18.166 7.792 1.00 0.00 C ATOM 601 NZ LYS A 39 0.909 -18.912 6.524 1.00 0.00 N ATOM 0 H LYS A 39 0.389 -13.070 4.689 1.00 0.00 H new ATOM 0 HA LYS A 39 1.423 -15.632 4.980 1.00 0.00 H new ATOM 0 HB2 LYS A 39 0.682 -14.134 6.829 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -0.986 -14.330 6.327 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -0.635 -15.806 8.179 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -0.762 -16.808 6.747 1.00 0.00 H new ATOM 0 HD2 LYS A 39 1.902 -16.479 6.712 1.00 0.00 H new ATOM 0 HD3 LYS A 39 1.656 -16.183 8.421 1.00 0.00 H new ATOM 0 HE2 LYS A 39 2.049 -18.517 8.266 1.00 0.00 H new ATOM 0 HE3 LYS A 39 0.316 -18.371 8.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 0.254 -19.701 6.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 0.502 -18.273 5.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 1.816 -19.285 6.176 1.00 0.00 H new ATOM 615 N PHE A 40 -1.627 -15.555 3.742 1.00 0.00 N ATOM 616 CA PHE A 40 -2.654 -16.352 3.076 1.00 0.00 C ATOM 617 C PHE A 40 -2.096 -16.991 1.812 1.00 0.00 C ATOM 618 O PHE A 40 -2.421 -18.131 1.476 1.00 0.00 O ATOM 619 CB PHE A 40 -3.858 -15.468 2.744 1.00 0.00 C ATOM 620 CG PHE A 40 -4.889 -16.117 1.857 1.00 0.00 C ATOM 621 CD1 PHE A 40 -5.025 -15.713 0.539 1.00 0.00 C ATOM 622 CD2 PHE A 40 -5.719 -17.123 2.334 1.00 0.00 C ATOM 623 CE1 PHE A 40 -5.967 -16.297 -0.286 1.00 0.00 C ATOM 624 CE2 PHE A 40 -6.661 -17.710 1.512 1.00 0.00 C ATOM 625 CZ PHE A 40 -6.786 -17.296 0.200 1.00 0.00 C ATOM 0 H PHE A 40 -1.814 -14.552 3.747 1.00 0.00 H new ATOM 0 HA PHE A 40 -2.975 -17.150 3.746 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -4.338 -15.166 3.675 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -3.502 -14.559 2.259 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -4.387 -14.932 0.152 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -5.627 -17.450 3.359 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -6.062 -15.972 -1.311 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -7.300 -18.492 1.895 1.00 0.00 H new ATOM 0 HZ PHE A 40 -7.523 -17.753 -0.444 1.00 0.00 H new ATOM 635 N LEU A 41 -1.235 -16.249 1.139 1.00 0.00 N ATOM 636 CA LEU A 41 -0.617 -16.699 -0.104 1.00 0.00 C ATOM 637 C LEU A 41 0.319 -17.881 0.143 1.00 0.00 C ATOM 638 O LEU A 41 0.684 -18.601 -0.786 1.00 0.00 O ATOM 639 CB LEU A 41 0.175 -15.550 -0.730 1.00 0.00 C ATOM 640 CG LEU A 41 -0.567 -14.215 -0.811 1.00 0.00 C ATOM 641 CD1 LEU A 41 0.382 -13.107 -1.232 1.00 0.00 C ATOM 642 CD2 LEU A 41 -1.737 -14.310 -1.777 1.00 0.00 C ATOM 0 H LEU A 41 -0.942 -15.318 1.435 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.409 -17.019 -0.781 1.00 0.00 H new ATOM 0 HB2 LEU A 41 1.089 -15.405 -0.155 1.00 0.00 H new ATOM 0 HB3 LEU A 41 0.475 -15.842 -1.736 1.00 0.00 H new ATOM 0 HG LEU A 41 -0.959 -13.978 0.178 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -0.161 -12.163 -1.285 1.00 0.00 H new ATOM 0 HD12 LEU A 41 1.188 -13.021 -0.503 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.802 -13.340 -2.211 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -2.252 -13.350 -1.820 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -1.369 -14.570 -2.770 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -2.430 -15.078 -1.435 1.00 0.00 H new ATOM 654 N GLY A 42 0.700 -18.074 1.400 1.00 0.00 N ATOM 655 CA GLY A 42 1.640 -19.120 1.740 1.00 0.00 C ATOM 656 C GLY A 42 0.974 -20.381 2.261 1.00 0.00 C ATOM 657 O GLY A 42 1.639 -21.242 2.837 1.00 0.00 O ATOM 0 H GLY A 42 0.372 -17.521 2.192 1.00 0.00 H new ATOM 0 HA2 GLY A 42 2.232 -19.368 0.859 1.00 0.00 H new ATOM 0 HA3 GLY A 42 2.333 -18.745 2.494 1.00 0.00 H new ATOM 661 N TYR A 43 -0.333 -20.499 2.070 1.00 0.00 N ATOM 662 CA TYR A 43 -1.053 -21.688 2.509 1.00 0.00 C ATOM 663 C TYR A 43 -1.080 -22.757 1.423 1.00 0.00 C ATOM 664 O TYR A 43 -0.487 -22.596 0.353 1.00 0.00 O ATOM 665 CB TYR A 43 -2.488 -21.348 2.917 1.00 0.00 C ATOM 666 CG TYR A 43 -2.631 -20.824 4.326 1.00 0.00 C ATOM 667 CD1 TYR A 43 -2.352 -21.639 5.414 1.00 0.00 C ATOM 668 CD2 TYR A 43 -3.073 -19.531 4.572 1.00 0.00 C ATOM 669 CE1 TYR A 43 -2.508 -21.184 6.705 1.00 0.00 C ATOM 670 CE2 TYR A 43 -3.230 -19.066 5.865 1.00 0.00 C ATOM 671 CZ TYR A 43 -2.946 -19.896 6.926 1.00 0.00 C ATOM 672 OH TYR A 43 -3.102 -19.440 8.214 1.00 0.00 O ATOM 0 H TYR A 43 -0.913 -19.792 1.618 1.00 0.00 H new ATOM 0 HA TYR A 43 -0.518 -22.078 3.375 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -2.883 -20.604 2.225 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -3.104 -22.241 2.811 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -2.006 -22.648 5.246 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -3.298 -18.879 3.741 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -2.288 -21.833 7.540 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -3.573 -18.057 6.041 1.00 0.00 H new ATOM 0 HH TYR A 43 -3.416 -18.512 8.197 1.00 0.00 H new ATOM 682 N ASP A 44 -1.765 -23.856 1.724 1.00 0.00 N ATOM 683 CA ASP A 44 -1.989 -24.931 0.756 1.00 0.00 C ATOM 684 C ASP A 44 -2.878 -24.418 -0.366 1.00 0.00 C ATOM 685 O ASP A 44 -3.899 -23.790 -0.095 1.00 0.00 O ATOM 686 CB ASP A 44 -2.681 -26.116 1.448 1.00 0.00 C ATOM 687 CG ASP A 44 -2.727 -27.388 0.610 1.00 0.00 C ATOM 688 OD1 ASP A 44 -2.964 -27.307 -0.611 1.00 0.00 O ATOM 689 OD2 ASP A 44 -2.572 -28.482 1.189 1.00 0.00 O ATOM 0 H ASP A 44 -2.179 -24.029 2.640 1.00 0.00 H new ATOM 0 HA ASP A 44 -1.031 -25.257 0.350 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -2.163 -26.329 2.383 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -3.700 -25.827 1.706 1.00 0.00 H new ATOM 694 N GLU A 45 -2.501 -24.682 -1.614 1.00 0.00 N ATOM 695 CA GLU A 45 -3.322 -24.305 -2.756 1.00 0.00 C ATOM 696 C GLU A 45 -4.733 -24.851 -2.608 1.00 0.00 C ATOM 697 O GLU A 45 -5.706 -24.188 -2.961 1.00 0.00 O ATOM 698 CB GLU A 45 -2.708 -24.828 -4.052 1.00 0.00 C ATOM 699 CG GLU A 45 -1.779 -23.843 -4.736 1.00 0.00 C ATOM 700 CD GLU A 45 -1.212 -24.394 -6.027 1.00 0.00 C ATOM 701 OE1 GLU A 45 -1.964 -24.497 -7.023 1.00 0.00 O ATOM 702 OE2 GLU A 45 -0.007 -24.732 -6.049 1.00 0.00 O ATOM 0 H GLU A 45 -1.631 -25.156 -1.858 1.00 0.00 H new ATOM 0 HA GLU A 45 -3.365 -23.216 -2.793 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -2.156 -25.743 -3.837 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.510 -25.094 -4.741 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -2.320 -22.920 -4.944 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -0.962 -23.589 -4.061 1.00 0.00 H new ATOM 709 N SER A 46 -4.831 -26.052 -2.060 1.00 0.00 N ATOM 710 CA SER A 46 -6.110 -26.708 -1.875 1.00 0.00 C ATOM 711 C SER A 46 -6.976 -25.908 -0.906 1.00 0.00 C ATOM 712 O SER A 46 -8.186 -25.792 -1.084 1.00 0.00 O ATOM 713 CB SER A 46 -5.891 -28.124 -1.341 1.00 0.00 C ATOM 714 OG SER A 46 -4.758 -28.726 -1.954 1.00 0.00 O ATOM 0 H SER A 46 -4.031 -26.594 -1.734 1.00 0.00 H new ATOM 0 HA SER A 46 -6.624 -26.765 -2.835 1.00 0.00 H new ATOM 0 HB2 SER A 46 -5.751 -28.092 -0.260 1.00 0.00 H new ATOM 0 HB3 SER A 46 -6.777 -28.730 -1.530 1.00 0.00 H new ATOM 0 HG SER A 46 -3.945 -28.450 -1.481 1.00 0.00 H new ATOM 720 N LYS A 47 -6.335 -25.318 0.096 1.00 0.00 N ATOM 721 CA LYS A 47 -7.049 -24.569 1.114 1.00 0.00 C ATOM 722 C LYS A 47 -7.318 -23.151 0.627 1.00 0.00 C ATOM 723 O LYS A 47 -8.386 -22.595 0.871 1.00 0.00 O ATOM 724 CB LYS A 47 -6.248 -24.555 2.419 1.00 0.00 C ATOM 725 CG LYS A 47 -5.967 -25.950 2.960 1.00 0.00 C ATOM 726 CD LYS A 47 -5.336 -25.912 4.341 1.00 0.00 C ATOM 727 CE LYS A 47 -4.832 -27.284 4.760 1.00 0.00 C ATOM 728 NZ LYS A 47 -5.870 -28.339 4.619 1.00 0.00 N ATOM 0 H LYS A 47 -5.323 -25.346 0.222 1.00 0.00 H new ATOM 0 HA LYS A 47 -8.006 -25.053 1.307 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -5.303 -24.039 2.253 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -6.796 -23.984 3.169 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -6.898 -26.516 3.003 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -5.305 -26.478 2.274 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -4.509 -25.202 4.345 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -6.067 -25.554 5.067 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -3.965 -27.549 4.156 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -4.498 -27.244 5.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -5.499 -29.241 4.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -6.715 -28.069 5.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -6.123 -28.446 3.616 1.00 0.00 H new ATOM 742 N ILE A 48 -6.348 -22.585 -0.080 1.00 0.00 N ATOM 743 CA ILE A 48 -6.473 -21.251 -0.652 1.00 0.00 C ATOM 744 C ILE A 48 -7.638 -21.180 -1.636 1.00 0.00 C ATOM 745 O ILE A 48 -8.478 -20.283 -1.560 1.00 0.00 O ATOM 746 CB ILE A 48 -5.175 -20.843 -1.376 1.00 0.00 C ATOM 747 CG1 ILE A 48 -4.023 -20.743 -0.377 1.00 0.00 C ATOM 748 CG2 ILE A 48 -5.359 -19.529 -2.117 1.00 0.00 C ATOM 749 CD1 ILE A 48 -2.688 -20.442 -1.019 1.00 0.00 C ATOM 0 H ILE A 48 -5.454 -23.037 -0.273 1.00 0.00 H new ATOM 0 HA ILE A 48 -6.661 -20.562 0.171 1.00 0.00 H new ATOM 0 HB ILE A 48 -4.933 -21.611 -2.110 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -4.251 -19.964 0.350 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -3.948 -21.681 0.174 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -4.430 -19.262 -2.620 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -6.154 -19.636 -2.855 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -5.626 -18.746 -1.408 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -1.918 -20.386 -0.249 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -2.437 -21.233 -1.725 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -2.744 -19.490 -1.546 1.00 0.00 H new ATOM 761 N LYS A 49 -7.688 -22.140 -2.552 1.00 0.00 N ATOM 762 CA LYS A 49 -8.709 -22.146 -3.589 1.00 0.00 C ATOM 763 C LYS A 49 -10.094 -22.390 -2.997 1.00 0.00 C ATOM 764 O LYS A 49 -11.069 -21.789 -3.442 1.00 0.00 O ATOM 765 CB LYS A 49 -8.376 -23.179 -4.669 1.00 0.00 C ATOM 766 CG LYS A 49 -7.058 -22.879 -5.364 1.00 0.00 C ATOM 767 CD LYS A 49 -6.692 -23.928 -6.398 1.00 0.00 C ATOM 768 CE LYS A 49 -5.281 -23.705 -6.921 1.00 0.00 C ATOM 769 NZ LYS A 49 -4.913 -24.676 -7.982 1.00 0.00 N ATOM 0 H LYS A 49 -7.035 -22.922 -2.597 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.722 -21.162 -4.057 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -8.330 -24.171 -4.219 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -9.177 -23.201 -5.408 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -7.120 -21.904 -5.847 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -6.265 -22.816 -4.619 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -6.768 -24.922 -5.956 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -7.401 -23.892 -7.225 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -5.198 -22.692 -7.314 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -4.573 -23.786 -6.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.893 -24.873 -7.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -5.443 -25.560 -7.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -5.145 -24.277 -8.914 1.00 0.00 H new ATOM 783 N THR A 50 -10.176 -23.247 -1.986 1.00 0.00 N ATOM 784 CA THR A 50 -11.430 -23.458 -1.283 1.00 0.00 C ATOM 785 C THR A 50 -11.842 -22.192 -0.529 1.00 0.00 C ATOM 786 O THR A 50 -13.002 -21.787 -0.578 1.00 0.00 O ATOM 787 CB THR A 50 -11.334 -24.653 -0.313 1.00 0.00 C ATOM 788 OG1 THR A 50 -11.130 -25.858 -1.061 1.00 0.00 O ATOM 789 CG2 THR A 50 -12.595 -24.786 0.527 1.00 0.00 C ATOM 0 H THR A 50 -9.394 -23.802 -1.639 1.00 0.00 H new ATOM 0 HA THR A 50 -12.194 -23.688 -2.026 1.00 0.00 H new ATOM 0 HB THR A 50 -10.493 -24.481 0.359 1.00 0.00 H new ATOM 0 HG1 THR A 50 -10.169 -26.011 -1.178 1.00 0.00 H new ATOM 0 HG21 THR A 50 -12.496 -25.637 1.200 1.00 0.00 H new ATOM 0 HG22 THR A 50 -12.741 -23.877 1.111 1.00 0.00 H new ATOM 0 HG23 THR A 50 -13.453 -24.939 -0.127 1.00 0.00 H new ATOM 797 N ALA A 51 -10.880 -21.556 0.139 1.00 0.00 N ATOM 798 CA ALA A 51 -11.140 -20.315 0.862 1.00 0.00 C ATOM 799 C ALA A 51 -11.727 -19.259 -0.072 1.00 0.00 C ATOM 800 O ALA A 51 -12.797 -18.713 0.190 1.00 0.00 O ATOM 801 CB ALA A 51 -9.862 -19.798 1.517 1.00 0.00 C ATOM 0 H ALA A 51 -9.915 -21.881 0.194 1.00 0.00 H new ATOM 0 HA ALA A 51 -11.869 -20.523 1.645 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.076 -18.872 2.051 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.485 -20.543 2.218 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -9.111 -19.609 0.750 1.00 0.00 H new ATOM 807 N LEU A 52 -11.034 -19.008 -1.179 1.00 0.00 N ATOM 808 CA LEU A 52 -11.471 -18.007 -2.150 1.00 0.00 C ATOM 809 C LEU A 52 -12.829 -18.363 -2.750 1.00 0.00 C ATOM 810 O LEU A 52 -13.675 -17.493 -2.956 1.00 0.00 O ATOM 811 CB LEU A 52 -10.437 -17.855 -3.267 1.00 0.00 C ATOM 812 CG LEU A 52 -9.100 -17.242 -2.845 1.00 0.00 C ATOM 813 CD1 LEU A 52 -8.124 -17.246 -4.011 1.00 0.00 C ATOM 814 CD2 LEU A 52 -9.306 -15.824 -2.330 1.00 0.00 C ATOM 0 H LEU A 52 -10.167 -19.484 -1.427 1.00 0.00 H new ATOM 0 HA LEU A 52 -11.570 -17.060 -1.619 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.247 -18.838 -3.699 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -10.867 -17.238 -4.056 1.00 0.00 H new ATOM 0 HG LEU A 52 -8.680 -17.845 -2.040 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -7.178 -16.807 -3.695 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -7.956 -18.271 -4.341 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.538 -16.663 -4.834 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -8.346 -15.401 -2.034 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -9.745 -15.211 -3.117 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -9.975 -15.843 -1.470 1.00 0.00 H new ATOM 826 N ASP A 53 -13.042 -19.645 -3.020 1.00 0.00 N ATOM 827 CA ASP A 53 -14.283 -20.089 -3.644 1.00 0.00 C ATOM 828 C ASP A 53 -15.448 -19.984 -2.666 1.00 0.00 C ATOM 829 O ASP A 53 -16.562 -19.623 -3.048 1.00 0.00 O ATOM 830 CB ASP A 53 -14.156 -21.522 -4.159 1.00 0.00 C ATOM 831 CG ASP A 53 -15.271 -21.879 -5.118 1.00 0.00 C ATOM 832 OD1 ASP A 53 -15.165 -21.521 -6.310 1.00 0.00 O ATOM 833 OD2 ASP A 53 -16.262 -22.501 -4.687 1.00 0.00 O ATOM 0 H ASP A 53 -12.377 -20.391 -2.818 1.00 0.00 H new ATOM 0 HA ASP A 53 -14.480 -19.435 -4.493 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -13.195 -21.644 -4.658 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -14.167 -22.213 -3.316 1.00 0.00 H new ATOM 838 N HIS A 54 -15.187 -20.293 -1.401 1.00 0.00 N ATOM 839 CA HIS A 54 -16.187 -20.134 -0.352 1.00 0.00 C ATOM 840 C HIS A 54 -16.569 -18.663 -0.227 1.00 0.00 C ATOM 841 O HIS A 54 -17.749 -18.323 -0.137 1.00 0.00 O ATOM 842 CB HIS A 54 -15.657 -20.666 0.987 1.00 0.00 C ATOM 843 CG HIS A 54 -16.592 -20.456 2.137 1.00 0.00 C ATOM 844 ND1 HIS A 54 -17.716 -21.232 2.312 1.00 0.00 N ATOM 845 CD2 HIS A 54 -16.531 -19.537 3.124 1.00 0.00 C ATOM 846 CE1 HIS A 54 -18.307 -20.764 3.398 1.00 0.00 C ATOM 847 NE2 HIS A 54 -17.625 -19.738 3.922 1.00 0.00 N ATOM 0 H HIS A 54 -14.290 -20.655 -1.077 1.00 0.00 H new ATOM 0 HA HIS A 54 -17.072 -20.711 -0.618 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -15.453 -21.732 0.888 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -14.708 -20.179 1.210 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -15.766 -18.787 3.258 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -19.224 -21.159 3.810 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -17.873 -19.207 4.757 1.00 0.00 H new ATOM 855 N ILE A 55 -15.558 -17.797 -0.235 1.00 0.00 N ATOM 856 CA ILE A 55 -15.779 -16.356 -0.234 1.00 0.00 C ATOM 857 C ILE A 55 -16.666 -15.953 -1.409 1.00 0.00 C ATOM 858 O ILE A 55 -17.647 -15.235 -1.237 1.00 0.00 O ATOM 859 CB ILE A 55 -14.445 -15.582 -0.302 1.00 0.00 C ATOM 860 CG1 ILE A 55 -13.631 -15.829 0.971 1.00 0.00 C ATOM 861 CG2 ILE A 55 -14.689 -14.091 -0.498 1.00 0.00 C ATOM 862 CD1 ILE A 55 -12.265 -15.177 0.960 1.00 0.00 C ATOM 0 H ILE A 55 -14.576 -18.071 -0.242 1.00 0.00 H new ATOM 0 HA ILE A 55 -16.278 -16.100 0.701 1.00 0.00 H new ATOM 0 HB ILE A 55 -13.879 -15.945 -1.160 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -14.193 -15.458 1.828 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -13.509 -16.903 1.110 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -13.733 -13.569 -0.543 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -15.234 -13.931 -1.428 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -15.275 -13.705 0.337 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -11.749 -15.397 1.895 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -11.683 -15.566 0.124 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -12.378 -14.098 0.853 1.00 0.00 H new ATOM 874 N LYS A 56 -16.326 -16.447 -2.597 1.00 0.00 N ATOM 875 CA LYS A 56 -17.105 -16.176 -3.804 1.00 0.00 C ATOM 876 C LYS A 56 -18.550 -16.646 -3.647 1.00 0.00 C ATOM 877 O LYS A 56 -19.472 -16.049 -4.201 1.00 0.00 O ATOM 878 CB LYS A 56 -16.459 -16.857 -5.019 1.00 0.00 C ATOM 879 CG LYS A 56 -17.236 -16.654 -6.314 1.00 0.00 C ATOM 880 CD LYS A 56 -16.450 -17.091 -7.545 1.00 0.00 C ATOM 881 CE LYS A 56 -16.162 -18.581 -7.541 1.00 0.00 C ATOM 882 NZ LYS A 56 -14.851 -18.909 -6.915 1.00 0.00 N ATOM 0 H LYS A 56 -15.511 -17.041 -2.751 1.00 0.00 H new ATOM 0 HA LYS A 56 -17.114 -15.098 -3.962 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -15.448 -16.471 -5.147 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -16.370 -17.925 -4.822 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -18.169 -17.216 -6.265 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -17.502 -15.602 -6.412 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -17.012 -16.833 -8.443 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -15.510 -16.541 -7.588 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -16.957 -19.099 -7.004 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -16.174 -18.952 -8.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -14.939 -19.787 -6.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -14.134 -19.037 -7.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -14.563 -18.133 -6.285 1.00 0.00 H new ATOM 896 N SER A 57 -18.739 -17.711 -2.882 1.00 0.00 N ATOM 897 CA SER A 57 -20.063 -18.267 -2.660 1.00 0.00 C ATOM 898 C SER A 57 -20.872 -17.383 -1.709 1.00 0.00 C ATOM 899 O SER A 57 -21.974 -16.947 -2.043 1.00 0.00 O ATOM 900 CB SER A 57 -19.944 -19.690 -2.107 1.00 0.00 C ATOM 901 OG SER A 57 -19.150 -20.498 -2.962 1.00 0.00 O ATOM 0 H SER A 57 -17.988 -18.208 -2.403 1.00 0.00 H new ATOM 0 HA SER A 57 -20.591 -18.303 -3.613 1.00 0.00 H new ATOM 0 HB2 SER A 57 -19.502 -19.662 -1.111 1.00 0.00 H new ATOM 0 HB3 SER A 57 -20.936 -20.129 -2.003 1.00 0.00 H new ATOM 0 HG SER A 57 -18.205 -20.261 -2.851 1.00 0.00 H new ATOM 907 N GLU A 58 -20.313 -17.106 -0.535 1.00 0.00 N ATOM 908 CA GLU A 58 -20.982 -16.278 0.454 1.00 0.00 C ATOM 909 C GLU A 58 -21.189 -14.855 -0.055 1.00 0.00 C ATOM 910 O GLU A 58 -22.288 -14.308 0.040 1.00 0.00 O ATOM 911 CB GLU A 58 -20.176 -16.263 1.752 1.00 0.00 C ATOM 912 CG GLU A 58 -20.228 -17.578 2.508 1.00 0.00 C ATOM 913 CD GLU A 58 -21.637 -17.942 2.928 1.00 0.00 C ATOM 914 OE1 GLU A 58 -22.283 -18.751 2.229 1.00 0.00 O ATOM 915 OE2 GLU A 58 -22.115 -17.405 3.946 1.00 0.00 O ATOM 0 H GLU A 58 -19.395 -17.446 -0.248 1.00 0.00 H new ATOM 0 HA GLU A 58 -21.965 -16.708 0.644 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -19.137 -16.024 1.523 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -20.552 -15.467 2.395 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -19.821 -18.372 1.881 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -19.593 -17.512 3.391 1.00 0.00 H new ATOM 922 N LEU A 59 -20.141 -14.270 -0.612 1.00 0.00 N ATOM 923 CA LEU A 59 -20.180 -12.881 -1.058 1.00 0.00 C ATOM 924 C LEU A 59 -21.209 -12.689 -2.171 1.00 0.00 C ATOM 925 O LEU A 59 -21.795 -11.615 -2.312 1.00 0.00 O ATOM 926 CB LEU A 59 -18.792 -12.452 -1.533 1.00 0.00 C ATOM 927 CG LEU A 59 -18.614 -10.965 -1.836 1.00 0.00 C ATOM 928 CD1 LEU A 59 -18.998 -10.125 -0.628 1.00 0.00 C ATOM 929 CD2 LEU A 59 -17.176 -10.691 -2.242 1.00 0.00 C ATOM 0 H LEU A 59 -19.247 -14.736 -0.768 1.00 0.00 H new ATOM 0 HA LEU A 59 -20.480 -12.256 -0.217 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -18.066 -12.736 -0.771 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -18.548 -13.017 -2.433 1.00 0.00 H new ATOM 0 HG LEU A 59 -19.271 -10.691 -2.661 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -18.865 -9.069 -0.862 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -20.041 -10.311 -0.372 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -18.364 -10.392 0.217 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -17.055 -9.629 -2.457 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -16.508 -10.975 -1.429 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -16.932 -11.271 -3.132 1.00 0.00 H new ATOM 941 N ASP A 60 -21.444 -13.748 -2.940 1.00 0.00 N ATOM 942 CA ASP A 60 -22.410 -13.703 -4.034 1.00 0.00 C ATOM 943 C ASP A 60 -23.819 -13.478 -3.508 1.00 0.00 C ATOM 944 O ASP A 60 -24.619 -12.795 -4.142 1.00 0.00 O ATOM 945 CB ASP A 60 -22.361 -14.996 -4.849 1.00 0.00 C ATOM 946 CG ASP A 60 -23.189 -14.910 -6.115 1.00 0.00 C ATOM 947 OD1 ASP A 60 -24.358 -15.345 -6.101 1.00 0.00 O ATOM 948 OD2 ASP A 60 -22.668 -14.403 -7.133 1.00 0.00 O ATOM 0 H ASP A 60 -20.979 -14.648 -2.826 1.00 0.00 H new ATOM 0 HA ASP A 60 -22.143 -12.866 -4.680 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -21.326 -15.220 -5.109 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -22.722 -15.822 -4.237 1.00 0.00 H new ATOM 953 N LYS A 61 -24.108 -14.031 -2.331 1.00 0.00 N ATOM 954 CA LYS A 61 -25.425 -13.885 -1.718 1.00 0.00 C ATOM 955 C LYS A 61 -25.676 -12.431 -1.325 1.00 0.00 C ATOM 956 O LYS A 61 -26.817 -12.014 -1.127 1.00 0.00 O ATOM 957 CB LYS A 61 -25.543 -14.767 -0.472 1.00 0.00 C ATOM 958 CG LYS A 61 -25.177 -16.226 -0.704 1.00 0.00 C ATOM 959 CD LYS A 61 -25.360 -17.057 0.557 1.00 0.00 C ATOM 960 CE LYS A 61 -24.611 -16.457 1.734 1.00 0.00 C ATOM 961 NZ LYS A 61 -24.706 -17.297 2.957 1.00 0.00 N ATOM 0 H LYS A 61 -23.448 -14.584 -1.784 1.00 0.00 H new ATOM 0 HA LYS A 61 -26.169 -14.196 -2.451 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -24.899 -14.362 0.308 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -26.566 -14.715 -0.100 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -25.796 -16.634 -1.503 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -24.141 -16.293 -1.038 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -26.421 -17.127 0.797 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -25.006 -18.073 0.379 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -23.562 -16.329 1.466 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -25.009 -15.465 1.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -23.863 -17.147 3.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -25.556 -17.033 3.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -24.765 -18.299 2.686 1.00 0.00 H new ATOM 975 N CYS A 62 -24.606 -11.662 -1.209 1.00 0.00 N ATOM 976 CA CYS A 62 -24.714 -10.270 -0.816 1.00 0.00 C ATOM 977 C CYS A 62 -24.974 -9.394 -2.034 1.00 0.00 C ATOM 978 O CYS A 62 -24.103 -8.647 -2.478 1.00 0.00 O ATOM 979 CB CYS A 62 -23.444 -9.820 -0.094 1.00 0.00 C ATOM 980 SG CYS A 62 -22.919 -10.942 1.243 1.00 0.00 S ATOM 0 H CYS A 62 -23.652 -11.980 -1.382 1.00 0.00 H new ATOM 0 HA CYS A 62 -25.555 -10.167 -0.131 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -22.636 -9.733 -0.820 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -23.607 -8.826 0.322 1.00 0.00 H new ATOM 985 N ASN A 63 -26.170 -9.520 -2.590 1.00 0.00 N ATOM 986 CA ASN A 63 -26.574 -8.717 -3.735 1.00 0.00 C ATOM 987 C ASN A 63 -27.886 -7.995 -3.449 1.00 0.00 C ATOM 988 O ASN A 63 -28.556 -7.507 -4.361 1.00 0.00 O ATOM 989 CB ASN A 63 -26.707 -9.588 -4.992 1.00 0.00 C ATOM 990 CG ASN A 63 -27.667 -10.754 -4.820 1.00 0.00 C ATOM 991 OD1 ASN A 63 -28.876 -10.618 -5.019 1.00 0.00 O ATOM 992 ND2 ASN A 63 -27.131 -11.915 -4.478 1.00 0.00 N ATOM 0 H ASN A 63 -26.881 -10.175 -2.265 1.00 0.00 H new ATOM 0 HA ASN A 63 -25.800 -7.971 -3.915 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -27.046 -8.967 -5.821 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -25.724 -9.973 -5.264 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -27.723 -12.738 -4.370 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -26.126 -11.986 -4.322 1.00 0.00 H new ATOM 999 N GLY A 64 -28.240 -7.917 -2.170 1.00 0.00 N ATOM 1000 CA GLY A 64 -29.460 -7.241 -1.770 1.00 0.00 C ATOM 1001 C GLY A 64 -29.271 -5.744 -1.625 1.00 0.00 C ATOM 1002 O GLY A 64 -28.280 -5.191 -2.093 1.00 0.00 O ATOM 0 H GLY A 64 -27.700 -8.312 -1.400 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -30.239 -7.436 -2.507 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -29.807 -7.654 -0.823 1.00 0.00 H new ATOM 1006 N ASN A 65 -30.222 -5.089 -0.967 1.00 0.00 N ATOM 1007 CA ASN A 65 -30.168 -3.638 -0.775 1.00 0.00 C ATOM 1008 C ASN A 65 -28.943 -3.225 0.042 1.00 0.00 C ATOM 1009 O ASN A 65 -28.327 -2.195 -0.228 1.00 0.00 O ATOM 1010 CB ASN A 65 -31.450 -3.126 -0.097 1.00 0.00 C ATOM 1011 CG ASN A 65 -31.685 -3.716 1.285 1.00 0.00 C ATOM 1012 OD1 ASN A 65 -31.234 -3.175 2.294 1.00 0.00 O ATOM 1013 ND2 ASN A 65 -32.401 -4.829 1.339 1.00 0.00 N ATOM 0 H ASN A 65 -31.041 -5.537 -0.556 1.00 0.00 H new ATOM 0 HA ASN A 65 -30.087 -3.184 -1.763 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -31.399 -2.040 -0.016 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -32.305 -3.358 -0.732 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -32.595 -5.267 2.239 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -32.758 -5.248 0.480 1.00 0.00 H new ATOM 1020 N ASP A 66 -28.588 -4.037 1.027 1.00 0.00 N ATOM 1021 CA ASP A 66 -27.446 -3.750 1.886 1.00 0.00 C ATOM 1022 C ASP A 66 -26.250 -4.593 1.450 1.00 0.00 C ATOM 1023 O ASP A 66 -25.510 -5.138 2.269 1.00 0.00 O ATOM 1024 CB ASP A 66 -27.810 -4.037 3.347 1.00 0.00 C ATOM 1025 CG ASP A 66 -26.783 -3.497 4.323 1.00 0.00 C ATOM 1026 OD1 ASP A 66 -26.520 -2.275 4.295 1.00 0.00 O ATOM 1027 OD2 ASP A 66 -26.253 -4.283 5.134 1.00 0.00 O ATOM 0 H ASP A 66 -29.076 -4.904 1.253 1.00 0.00 H new ATOM 0 HA ASP A 66 -27.179 -2.697 1.798 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -28.782 -3.596 3.568 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -27.908 -5.113 3.488 1.00 0.00 H new ATOM 1032 N ALA A 67 -26.059 -4.679 0.142 1.00 0.00 N ATOM 1033 CA ALA A 67 -25.034 -5.535 -0.435 1.00 0.00 C ATOM 1034 C ALA A 67 -23.634 -5.066 -0.062 1.00 0.00 C ATOM 1035 O ALA A 67 -22.837 -5.834 0.479 1.00 0.00 O ATOM 1036 CB ALA A 67 -25.180 -5.583 -1.949 1.00 0.00 C ATOM 0 H ALA A 67 -26.606 -4.161 -0.545 1.00 0.00 H new ATOM 0 HA ALA A 67 -25.171 -6.536 -0.026 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -24.407 -6.227 -2.369 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -26.162 -5.979 -2.207 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -25.076 -4.578 -2.357 1.00 0.00 H new ATOM 1042 N ASP A 68 -23.352 -3.801 -0.334 1.00 0.00 N ATOM 1043 CA ASP A 68 -22.004 -3.263 -0.197 1.00 0.00 C ATOM 1044 C ASP A 68 -21.553 -3.185 1.249 1.00 0.00 C ATOM 1045 O ASP A 68 -20.368 -3.373 1.543 1.00 0.00 O ATOM 1046 CB ASP A 68 -21.906 -1.894 -0.859 1.00 0.00 C ATOM 1047 CG ASP A 68 -21.612 -2.005 -2.347 1.00 0.00 C ATOM 1048 OD1 ASP A 68 -22.428 -2.609 -3.079 1.00 0.00 O ATOM 1049 OD2 ASP A 68 -20.559 -1.508 -2.787 1.00 0.00 O ATOM 0 H ASP A 68 -24.043 -3.122 -0.653 1.00 0.00 H new ATOM 0 HA ASP A 68 -21.332 -3.956 -0.704 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -22.840 -1.352 -0.713 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -21.121 -1.312 -0.376 1.00 0.00 H new ATOM 1054 N GLN A 69 -22.478 -2.921 2.158 1.00 0.00 N ATOM 1055 CA GLN A 69 -22.131 -2.889 3.565 1.00 0.00 C ATOM 1056 C GLN A 69 -21.738 -4.287 4.023 1.00 0.00 C ATOM 1057 O GLN A 69 -20.755 -4.460 4.744 1.00 0.00 O ATOM 1058 CB GLN A 69 -23.281 -2.356 4.418 1.00 0.00 C ATOM 1059 CG GLN A 69 -22.851 -2.011 5.835 1.00 0.00 C ATOM 1060 CD GLN A 69 -21.800 -0.918 5.858 1.00 0.00 C ATOM 1061 OE1 GLN A 69 -20.543 -1.304 5.696 1.00 0.00 O flip ATOM 1062 NE2 GLN A 69 -22.116 0.265 5.988 1.00 0.00 N flip ATOM 0 H GLN A 69 -23.458 -2.729 1.950 1.00 0.00 H new ATOM 0 HA GLN A 69 -21.288 -2.210 3.693 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -23.699 -1.468 3.943 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -24.076 -3.101 4.455 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -23.720 -1.691 6.410 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.457 -2.903 6.322 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -23.096 0.521 6.111 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -21.398 0.989 5.973 1.00 0.00 H new ATOM 1071 N GLN A 70 -22.499 -5.282 3.580 1.00 0.00 N ATOM 1072 CA GLN A 70 -22.185 -6.672 3.867 1.00 0.00 C ATOM 1073 C GLN A 70 -20.854 -7.071 3.237 1.00 0.00 C ATOM 1074 O GLN A 70 -20.051 -7.751 3.870 1.00 0.00 O ATOM 1075 CB GLN A 70 -23.308 -7.572 3.366 1.00 0.00 C ATOM 1076 CG GLN A 70 -24.590 -7.433 4.174 1.00 0.00 C ATOM 1077 CD GLN A 70 -24.490 -8.027 5.572 1.00 0.00 C ATOM 1078 OE1 GLN A 70 -23.733 -9.106 5.720 1.00 0.00 O flip ATOM 1079 NE2 GLN A 70 -25.111 -7.532 6.513 1.00 0.00 N flip ATOM 0 H GLN A 70 -23.340 -5.148 3.019 1.00 0.00 H new ATOM 0 HA GLN A 70 -22.092 -6.792 4.946 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -23.516 -7.336 2.322 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -22.976 -8.610 3.398 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -24.848 -6.377 4.253 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -25.404 -7.921 3.637 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -25.684 -6.702 6.365 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -25.052 -7.952 7.440 1.00 0.00 H new ATOM 1088 N LYS A 71 -20.617 -6.633 2.000 1.00 0.00 N ATOM 1089 CA LYS A 71 -19.337 -6.875 1.331 1.00 0.00 C ATOM 1090 C LYS A 71 -18.191 -6.351 2.186 1.00 0.00 C ATOM 1091 O LYS A 71 -17.194 -7.036 2.410 1.00 0.00 O ATOM 1092 CB LYS A 71 -19.280 -6.175 -0.031 1.00 0.00 C ATOM 1093 CG LYS A 71 -20.349 -6.603 -1.018 1.00 0.00 C ATOM 1094 CD LYS A 71 -20.314 -5.719 -2.256 1.00 0.00 C ATOM 1095 CE LYS A 71 -21.507 -5.960 -3.163 1.00 0.00 C ATOM 1096 NZ LYS A 71 -21.594 -4.931 -4.233 1.00 0.00 N ATOM 0 H LYS A 71 -21.292 -6.110 1.442 1.00 0.00 H new ATOM 0 HA LYS A 71 -19.243 -7.951 1.187 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -19.362 -5.100 0.127 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -18.302 -6.358 -0.476 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -20.194 -7.644 -1.302 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -21.331 -6.543 -0.549 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -20.295 -4.672 -1.953 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -19.394 -5.907 -2.810 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -21.429 -6.949 -3.614 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -22.423 -5.950 -2.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -22.018 -5.351 -5.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -22.184 -4.139 -3.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -20.640 -4.582 -4.457 1.00 0.00 H new ATOM 1110 N THR A 72 -18.353 -5.123 2.665 1.00 0.00 N ATOM 1111 CA THR A 72 -17.327 -4.467 3.459 1.00 0.00 C ATOM 1112 C THR A 72 -17.140 -5.164 4.809 1.00 0.00 C ATOM 1113 O THR A 72 -16.024 -5.266 5.318 1.00 0.00 O ATOM 1114 CB THR A 72 -17.677 -2.981 3.670 1.00 0.00 C ATOM 1115 OG1 THR A 72 -17.940 -2.364 2.399 1.00 0.00 O ATOM 1116 CG2 THR A 72 -16.542 -2.241 4.362 1.00 0.00 C ATOM 0 H THR A 72 -19.191 -4.561 2.515 1.00 0.00 H new ATOM 0 HA THR A 72 -16.387 -4.534 2.911 1.00 0.00 H new ATOM 0 HB THR A 72 -18.562 -2.927 4.304 1.00 0.00 H new ATOM 0 HG1 THR A 72 -18.787 -2.702 2.040 1.00 0.00 H new ATOM 0 HG21 THR A 72 -16.818 -1.195 4.497 1.00 0.00 H new ATOM 0 HG22 THR A 72 -16.352 -2.695 5.335 1.00 0.00 H new ATOM 0 HG23 THR A 72 -15.642 -2.302 3.751 1.00 0.00 H new ATOM 1124 N THR A 73 -18.230 -5.667 5.370 1.00 0.00 N ATOM 1125 CA THR A 73 -18.179 -6.342 6.658 1.00 0.00 C ATOM 1126 C THR A 73 -17.607 -7.755 6.512 1.00 0.00 C ATOM 1127 O THR A 73 -16.960 -8.278 7.424 1.00 0.00 O ATOM 1128 CB THR A 73 -19.579 -6.402 7.301 1.00 0.00 C ATOM 1129 OG1 THR A 73 -20.163 -5.093 7.300 1.00 0.00 O ATOM 1130 CG2 THR A 73 -19.512 -6.919 8.731 1.00 0.00 C ATOM 0 H THR A 73 -19.160 -5.620 4.954 1.00 0.00 H new ATOM 0 HA THR A 73 -17.521 -5.767 7.309 1.00 0.00 H new ATOM 0 HB THR A 73 -20.190 -7.089 6.716 1.00 0.00 H new ATOM 0 HG1 THR A 73 -20.517 -4.894 6.408 1.00 0.00 H new ATOM 0 HG21 THR A 73 -20.516 -6.949 9.155 1.00 0.00 H new ATOM 0 HG22 THR A 73 -19.086 -7.922 8.736 1.00 0.00 H new ATOM 0 HG23 THR A 73 -18.886 -6.257 9.328 1.00 0.00 H new ATOM 1138 N PHE A 74 -17.832 -8.359 5.350 1.00 0.00 N ATOM 1139 CA PHE A 74 -17.306 -9.687 5.058 1.00 0.00 C ATOM 1140 C PHE A 74 -15.781 -9.636 5.016 1.00 0.00 C ATOM 1141 O PHE A 74 -15.104 -10.605 5.357 1.00 0.00 O ATOM 1142 CB PHE A 74 -17.873 -10.191 3.729 1.00 0.00 C ATOM 1143 CG PHE A 74 -17.604 -11.645 3.444 1.00 0.00 C ATOM 1144 CD1 PHE A 74 -17.369 -12.071 2.149 1.00 0.00 C ATOM 1145 CD2 PHE A 74 -17.606 -12.586 4.464 1.00 0.00 C ATOM 1146 CE1 PHE A 74 -17.139 -13.403 1.872 1.00 0.00 C ATOM 1147 CE2 PHE A 74 -17.373 -13.922 4.193 1.00 0.00 C ATOM 1148 CZ PHE A 74 -17.141 -14.330 2.892 1.00 0.00 C ATOM 0 H PHE A 74 -18.377 -7.948 4.593 1.00 0.00 H new ATOM 0 HA PHE A 74 -17.608 -10.381 5.843 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -18.950 -10.026 3.723 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -17.455 -9.592 2.920 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -17.366 -11.351 1.344 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -17.792 -12.272 5.480 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -16.957 -13.719 0.855 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -17.372 -14.645 4.995 1.00 0.00 H new ATOM 0 HZ PHE A 74 -16.962 -15.373 2.676 1.00 0.00 H new ATOM 1158 N LYS A 75 -15.255 -8.486 4.610 1.00 0.00 N ATOM 1159 CA LYS A 75 -13.825 -8.227 4.658 1.00 0.00 C ATOM 1160 C LYS A 75 -13.294 -8.427 6.073 1.00 0.00 C ATOM 1161 O LYS A 75 -12.320 -9.147 6.294 1.00 0.00 O ATOM 1162 CB LYS A 75 -13.549 -6.794 4.209 1.00 0.00 C ATOM 1163 CG LYS A 75 -13.745 -6.564 2.722 1.00 0.00 C ATOM 1164 CD LYS A 75 -13.557 -5.101 2.369 1.00 0.00 C ATOM 1165 CE LYS A 75 -13.417 -4.895 0.867 1.00 0.00 C ATOM 1166 NZ LYS A 75 -13.067 -3.488 0.532 1.00 0.00 N ATOM 0 H LYS A 75 -15.807 -7.712 4.240 1.00 0.00 H new ATOM 0 HA LYS A 75 -13.320 -8.926 3.991 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -14.204 -6.119 4.760 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -12.525 -6.532 4.475 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -13.036 -7.171 2.160 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -14.744 -6.887 2.429 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -14.407 -4.526 2.737 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -12.670 -4.717 2.873 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -12.648 -5.563 0.479 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -14.351 -5.164 0.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -12.624 -3.455 -0.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -13.930 -2.907 0.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -12.402 -3.117 1.241 1.00 0.00 H new ATOM 1180 N GLN A 76 -13.970 -7.799 7.024 1.00 0.00 N ATOM 1181 CA GLN A 76 -13.610 -7.886 8.423 1.00 0.00 C ATOM 1182 C GLN A 76 -13.802 -9.310 8.923 1.00 0.00 C ATOM 1183 O GLN A 76 -13.068 -9.790 9.788 1.00 0.00 O ATOM 1184 CB GLN A 76 -14.490 -6.936 9.220 1.00 0.00 C ATOM 1185 CG GLN A 76 -14.473 -5.502 8.708 1.00 0.00 C ATOM 1186 CD GLN A 76 -15.331 -4.568 9.540 1.00 0.00 C ATOM 1187 OE1 GLN A 76 -16.350 -5.110 10.191 1.00 0.00 O flip ATOM 1188 NE2 GLN A 76 -15.068 -3.368 9.611 1.00 0.00 N flip ATOM 0 H GLN A 76 -14.785 -7.214 6.842 1.00 0.00 H new ATOM 0 HA GLN A 76 -12.563 -7.610 8.548 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -15.515 -7.305 9.202 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -14.166 -6.944 10.261 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -13.446 -5.136 8.702 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -14.823 -5.486 7.676 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -14.275 -2.988 9.095 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -15.643 -2.753 10.186 1.00 0.00 H new ATOM 1197 N THR A 77 -14.805 -9.969 8.369 1.00 0.00 N ATOM 1198 CA THR A 77 -15.091 -11.358 8.681 1.00 0.00 C ATOM 1199 C THR A 77 -13.899 -12.254 8.338 1.00 0.00 C ATOM 1200 O THR A 77 -13.471 -13.062 9.163 1.00 0.00 O ATOM 1201 CB THR A 77 -16.340 -11.842 7.919 1.00 0.00 C ATOM 1202 OG1 THR A 77 -17.454 -10.989 8.220 1.00 0.00 O ATOM 1203 CG2 THR A 77 -16.682 -13.278 8.284 1.00 0.00 C ATOM 0 H THR A 77 -15.444 -9.556 7.690 1.00 0.00 H new ATOM 0 HA THR A 77 -15.281 -11.423 9.752 1.00 0.00 H new ATOM 0 HB THR A 77 -16.124 -11.801 6.851 1.00 0.00 H new ATOM 0 HG1 THR A 77 -17.263 -10.080 7.908 1.00 0.00 H new ATOM 0 HG21 THR A 77 -17.567 -13.593 7.732 1.00 0.00 H new ATOM 0 HG22 THR A 77 -15.845 -13.928 8.029 1.00 0.00 H new ATOM 0 HG23 THR A 77 -16.879 -13.344 9.354 1.00 0.00 H new ATOM 1211 N VAL A 78 -13.354 -12.089 7.130 1.00 0.00 N ATOM 1212 CA VAL A 78 -12.216 -12.882 6.684 1.00 0.00 C ATOM 1213 C VAL A 78 -10.966 -12.532 7.494 1.00 0.00 C ATOM 1214 O VAL A 78 -10.144 -13.407 7.789 1.00 0.00 O ATOM 1215 CB VAL A 78 -11.952 -12.676 5.175 1.00 0.00 C ATOM 1216 CG1 VAL A 78 -10.776 -13.513 4.704 1.00 0.00 C ATOM 1217 CG2 VAL A 78 -13.190 -13.028 4.364 1.00 0.00 C ATOM 0 H VAL A 78 -13.687 -11.410 6.445 1.00 0.00 H new ATOM 0 HA VAL A 78 -12.456 -13.933 6.847 1.00 0.00 H new ATOM 0 HB VAL A 78 -11.711 -11.624 5.022 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -10.615 -13.347 3.639 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -9.881 -13.226 5.256 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -10.987 -14.568 4.879 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -12.986 -12.877 3.304 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -13.454 -14.071 4.538 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -14.018 -12.388 4.669 1.00 0.00 H new ATOM 1227 N GLN A 79 -10.836 -11.257 7.866 1.00 0.00 N ATOM 1228 CA GLN A 79 -9.765 -10.812 8.748 1.00 0.00 C ATOM 1229 C GLN A 79 -9.733 -11.659 10.019 1.00 0.00 C ATOM 1230 O GLN A 79 -8.684 -12.156 10.428 1.00 0.00 O ATOM 1231 CB GLN A 79 -9.986 -9.344 9.104 1.00 0.00 C ATOM 1232 CG GLN A 79 -8.815 -8.440 8.773 1.00 0.00 C ATOM 1233 CD GLN A 79 -7.605 -8.680 9.657 1.00 0.00 C ATOM 1234 OE1 GLN A 79 -7.731 -9.112 10.801 1.00 0.00 O ATOM 1235 NE2 GLN A 79 -6.424 -8.381 9.137 1.00 0.00 N ATOM 0 H GLN A 79 -11.466 -10.513 7.566 1.00 0.00 H new ATOM 0 HA GLN A 79 -8.809 -10.925 8.236 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -10.869 -8.983 8.577 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -10.198 -9.269 10.170 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -8.531 -8.591 7.731 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -9.128 -7.400 8.871 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -6.362 -8.025 8.183 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -5.576 -8.507 9.690 1.00 0.00 H new ATOM 1244 N GLY A 80 -10.902 -11.849 10.614 1.00 0.00 N ATOM 1245 CA GLY A 80 -11.002 -12.647 11.821 1.00 0.00 C ATOM 1246 C GLY A 80 -11.304 -14.102 11.525 1.00 0.00 C ATOM 1247 O GLY A 80 -11.818 -14.824 12.379 1.00 0.00 O ATOM 0 H GLY A 80 -11.786 -11.464 10.282 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -10.067 -12.578 12.378 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -11.785 -12.238 12.460 1.00 0.00 H new ATOM 1251 N ALA A 81 -11.006 -14.529 10.307 1.00 0.00 N ATOM 1252 CA ALA A 81 -11.225 -15.910 9.906 1.00 0.00 C ATOM 1253 C ALA A 81 -9.904 -16.602 9.589 1.00 0.00 C ATOM 1254 O ALA A 81 -9.614 -17.672 10.119 1.00 0.00 O ATOM 1255 CB ALA A 81 -12.166 -15.977 8.711 1.00 0.00 C ATOM 0 H ALA A 81 -10.610 -13.936 9.577 1.00 0.00 H new ATOM 0 HA ALA A 81 -11.689 -16.435 10.741 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -12.318 -17.018 8.425 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -13.124 -15.530 8.977 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -11.731 -15.431 7.874 1.00 0.00 H new ATOM 1261 N LEU A 82 -9.091 -15.972 8.741 1.00 0.00 N ATOM 1262 CA LEU A 82 -7.803 -16.544 8.340 1.00 0.00 C ATOM 1263 C LEU A 82 -6.751 -16.358 9.419 1.00 0.00 C ATOM 1264 O LEU A 82 -5.604 -16.781 9.278 1.00 0.00 O ATOM 1265 CB LEU A 82 -7.324 -15.920 7.030 1.00 0.00 C ATOM 1266 CG LEU A 82 -8.203 -16.207 5.816 1.00 0.00 C ATOM 1267 CD1 LEU A 82 -7.681 -15.456 4.606 1.00 0.00 C ATOM 1268 CD2 LEU A 82 -8.252 -17.701 5.533 1.00 0.00 C ATOM 0 H LEU A 82 -9.300 -15.067 8.319 1.00 0.00 H new ATOM 0 HA LEU A 82 -7.951 -17.614 8.193 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -7.257 -14.840 7.163 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.316 -16.279 6.822 1.00 0.00 H new ATOM 0 HG LEU A 82 -9.216 -15.866 6.031 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -8.315 -15.668 3.745 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.691 -14.385 4.810 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -6.661 -15.775 4.392 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -8.883 -17.886 4.664 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -7.245 -18.067 5.334 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -8.663 -18.222 6.398 1.00 0.00 H new ATOM 1280 N SER A 83 -7.160 -15.743 10.504 1.00 0.00 N ATOM 1281 CA SER A 83 -6.286 -15.532 11.640 1.00 0.00 C ATOM 1282 C SER A 83 -6.320 -16.741 12.569 1.00 0.00 C ATOM 1283 O SER A 83 -5.483 -16.880 13.463 1.00 0.00 O ATOM 1284 CB SER A 83 -6.695 -14.258 12.374 1.00 0.00 C ATOM 1285 OG SER A 83 -8.097 -14.062 12.294 1.00 0.00 O ATOM 0 H SER A 83 -8.103 -15.375 10.627 1.00 0.00 H new ATOM 0 HA SER A 83 -5.261 -15.413 11.289 1.00 0.00 H new ATOM 0 HB2 SER A 83 -6.391 -14.321 13.419 1.00 0.00 H new ATOM 0 HB3 SER A 83 -6.178 -13.401 11.942 1.00 0.00 H new ATOM 0 HG SER A 83 -8.300 -13.447 11.558 1.00 0.00 H new ATOM 1291 N GLY A 84 -7.291 -17.620 12.341 1.00 0.00 N ATOM 1292 CA GLY A 84 -7.395 -18.836 13.124 1.00 0.00 C ATOM 1293 C GLY A 84 -6.984 -20.061 12.333 1.00 0.00 C ATOM 1294 O GLY A 84 -7.089 -21.191 12.815 1.00 0.00 O ATOM 0 H GLY A 84 -8.009 -17.510 11.625 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -6.767 -18.750 14.011 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -8.421 -18.957 13.471 1.00 0.00 H new ATOM 1298 N GLY A 85 -6.522 -19.835 11.111 1.00 0.00 N ATOM 1299 CA GLY A 85 -6.092 -20.920 10.259 1.00 0.00 C ATOM 1300 C GLY A 85 -6.553 -20.722 8.833 1.00 0.00 C ATOM 1301 O GLY A 85 -6.448 -19.621 8.287 1.00 0.00 O ATOM 0 H GLY A 85 -6.438 -18.908 10.693 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -5.005 -20.994 10.284 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -6.485 -21.862 10.642 1.00 0.00 H new ATOM 1305 N ILE A 86 -7.077 -21.783 8.240 1.00 0.00 N ATOM 1306 CA ILE A 86 -7.600 -21.732 6.880 1.00 0.00 C ATOM 1307 C ILE A 86 -8.341 -23.022 6.533 1.00 0.00 C ATOM 1308 O ILE A 86 -9.270 -23.015 5.731 1.00 0.00 O ATOM 1309 CB ILE A 86 -6.484 -21.483 5.838 1.00 0.00 C ATOM 1310 CG1 ILE A 86 -7.104 -21.193 4.467 1.00 0.00 C ATOM 1311 CG2 ILE A 86 -5.539 -22.678 5.761 1.00 0.00 C ATOM 1312 CD1 ILE A 86 -6.100 -20.825 3.401 1.00 0.00 C ATOM 0 H ILE A 86 -7.153 -22.699 8.683 1.00 0.00 H new ATOM 0 HA ILE A 86 -8.295 -20.893 6.843 1.00 0.00 H new ATOM 0 HB ILE A 86 -5.902 -20.616 6.150 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -7.661 -22.071 4.139 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -7.823 -20.380 4.570 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.762 -22.481 5.022 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -5.079 -22.842 6.736 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -6.099 -23.567 5.470 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -6.620 -20.635 2.462 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -5.560 -19.928 3.704 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -5.395 -21.645 3.266 1.00 0.00 H new ATOM 1324 N ASP A 87 -7.932 -24.132 7.138 1.00 0.00 N ATOM 1325 CA ASP A 87 -8.610 -25.407 6.913 1.00 0.00 C ATOM 1326 C ASP A 87 -10.002 -25.374 7.535 1.00 0.00 C ATOM 1327 O ASP A 87 -10.951 -25.958 7.008 1.00 0.00 O ATOM 1328 CB ASP A 87 -7.801 -26.566 7.501 1.00 0.00 C ATOM 1329 CG ASP A 87 -8.395 -27.919 7.160 1.00 0.00 C ATOM 1330 OD1 ASP A 87 -9.157 -28.467 7.984 1.00 0.00 O ATOM 1331 OD2 ASP A 87 -8.102 -28.439 6.064 1.00 0.00 O ATOM 0 H ASP A 87 -7.142 -24.177 7.782 1.00 0.00 H new ATOM 0 HA ASP A 87 -8.700 -25.563 5.838 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -6.778 -26.517 7.128 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -7.751 -26.457 8.584 1.00 0.00 H new ATOM 1336 N GLY A 88 -10.111 -24.668 8.654 1.00 0.00 N ATOM 1337 CA GLY A 88 -11.391 -24.494 9.313 1.00 0.00 C ATOM 1338 C GLY A 88 -12.120 -23.258 8.823 1.00 0.00 C ATOM 1339 O GLY A 88 -13.048 -22.776 9.473 1.00 0.00 O ATOM 0 H GLY A 88 -9.328 -24.209 9.120 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -12.011 -25.373 9.138 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -11.237 -24.421 10.390 1.00 0.00 H new ATOM 1343 N PHE A 89 -11.686 -22.737 7.681 1.00 0.00 N ATOM 1344 CA PHE A 89 -12.333 -21.594 7.063 1.00 0.00 C ATOM 1345 C PHE A 89 -13.549 -22.066 6.282 1.00 0.00 C ATOM 1346 O PHE A 89 -13.449 -22.930 5.408 1.00 0.00 O ATOM 1347 CB PHE A 89 -11.353 -20.854 6.142 1.00 0.00 C ATOM 1348 CG PHE A 89 -11.924 -19.628 5.475 1.00 0.00 C ATOM 1349 CD1 PHE A 89 -12.597 -19.727 4.263 1.00 0.00 C ATOM 1350 CD2 PHE A 89 -11.782 -18.377 6.056 1.00 0.00 C ATOM 1351 CE1 PHE A 89 -13.116 -18.604 3.649 1.00 0.00 C ATOM 1352 CE2 PHE A 89 -12.301 -17.251 5.443 1.00 0.00 C ATOM 1353 CZ PHE A 89 -12.967 -17.365 4.238 1.00 0.00 C ATOM 0 H PHE A 89 -10.882 -23.094 7.164 1.00 0.00 H new ATOM 0 HA PHE A 89 -12.654 -20.899 7.839 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -10.479 -20.562 6.723 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -11.008 -21.543 5.372 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -12.716 -20.693 3.796 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -11.261 -18.281 6.997 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -13.638 -18.696 2.708 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -12.186 -16.282 5.906 1.00 0.00 H new ATOM 0 HZ PHE A 89 -13.370 -16.486 3.758 1.00 0.00 H new ATOM 1363 N GLY A 90 -14.695 -21.518 6.622 1.00 0.00 N ATOM 1364 CA GLY A 90 -15.920 -21.879 5.950 1.00 0.00 C ATOM 1365 C GLY A 90 -17.122 -21.429 6.738 1.00 0.00 C ATOM 1366 O GLY A 90 -17.065 -20.408 7.415 1.00 0.00 O ATOM 0 H GLY A 90 -14.802 -20.822 7.359 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -15.941 -21.427 4.958 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -15.957 -22.959 5.809 1.00 0.00 H new ATOM 1370 N SER A 91 -18.191 -22.213 6.700 1.00 0.00 N ATOM 1371 CA SER A 91 -19.419 -21.874 7.409 1.00 0.00 C ATOM 1372 C SER A 91 -19.225 -21.945 8.924 1.00 0.00 C ATOM 1373 O SER A 91 -20.123 -21.607 9.694 1.00 0.00 O ATOM 1374 CB SER A 91 -20.546 -22.808 6.969 1.00 0.00 C ATOM 1375 OG SER A 91 -20.075 -24.136 6.809 1.00 0.00 O ATOM 0 H SER A 91 -18.233 -23.092 6.184 1.00 0.00 H new ATOM 0 HA SER A 91 -19.686 -20.847 7.159 1.00 0.00 H new ATOM 0 HB2 SER A 91 -21.347 -22.790 7.708 1.00 0.00 H new ATOM 0 HB3 SER A 91 -20.970 -22.454 6.030 1.00 0.00 H new ATOM 0 HG SER A 91 -20.815 -24.714 6.529 1.00 0.00 H new ATOM 1381 N ASN A 92 -18.041 -22.372 9.336 1.00 0.00 N ATOM 1382 CA ASN A 92 -17.710 -22.476 10.744 1.00 0.00 C ATOM 1383 C ASN A 92 -17.327 -21.113 11.311 1.00 0.00 C ATOM 1384 O ASN A 92 -17.512 -20.852 12.498 1.00 0.00 O ATOM 1385 CB ASN A 92 -16.555 -23.465 10.937 1.00 0.00 C ATOM 1386 CG ASN A 92 -16.221 -23.706 12.397 1.00 0.00 C ATOM 1387 OD1 ASN A 92 -15.394 -23.007 12.983 1.00 0.00 O ATOM 1388 ND2 ASN A 92 -16.849 -24.709 12.988 1.00 0.00 N ATOM 0 H ASN A 92 -17.289 -22.654 8.707 1.00 0.00 H new ATOM 0 HA ASN A 92 -18.588 -22.838 11.279 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -16.814 -24.414 10.467 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -15.670 -23.087 10.425 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -16.655 -24.927 13.965 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -17.528 -25.264 12.467 1.00 0.00 H new ATOM 1395 N ASN A 93 -16.807 -20.234 10.461 1.00 0.00 N ATOM 1396 CA ASN A 93 -16.291 -18.958 10.942 1.00 0.00 C ATOM 1397 C ASN A 93 -16.550 -17.806 9.970 1.00 0.00 C ATOM 1398 O ASN A 93 -16.662 -16.653 10.389 1.00 0.00 O ATOM 1399 CB ASN A 93 -14.790 -19.071 11.244 1.00 0.00 C ATOM 1400 CG ASN A 93 -13.932 -19.339 10.016 1.00 0.00 C ATOM 1401 OD1 ASN A 93 -14.389 -19.904 9.019 1.00 0.00 O ATOM 1402 ND2 ASN A 93 -12.669 -18.952 10.093 1.00 0.00 N ATOM 0 H ASN A 93 -16.732 -20.377 9.454 1.00 0.00 H new ATOM 0 HA ASN A 93 -16.833 -18.725 11.859 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -14.454 -18.148 11.715 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -14.634 -19.873 11.966 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -12.036 -19.118 9.311 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -12.328 -18.488 10.935 1.00 0.00 H new ATOM 1409 N ALA A 94 -16.653 -18.103 8.683 1.00 0.00 N ATOM 1410 CA ALA A 94 -16.837 -17.062 7.683 1.00 0.00 C ATOM 1411 C ALA A 94 -18.125 -17.275 6.901 1.00 0.00 C ATOM 1412 O ALA A 94 -18.187 -18.112 6.003 1.00 0.00 O ATOM 1413 CB ALA A 94 -15.648 -17.014 6.737 1.00 0.00 C ATOM 0 H ALA A 94 -16.613 -19.051 8.308 1.00 0.00 H new ATOM 0 HA ALA A 94 -16.909 -16.107 8.203 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -15.804 -16.230 5.996 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -14.741 -16.803 7.303 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -15.546 -17.975 6.232 1.00 0.00 H new ATOM 1419 N VAL A 95 -19.150 -16.522 7.257 1.00 0.00 N ATOM 1420 CA VAL A 95 -20.434 -16.598 6.578 1.00 0.00 C ATOM 1421 C VAL A 95 -20.982 -15.209 6.335 1.00 0.00 C ATOM 1422 O VAL A 95 -20.795 -14.308 7.156 1.00 0.00 O ATOM 1423 CB VAL A 95 -21.479 -17.398 7.387 1.00 0.00 C ATOM 1424 CG1 VAL A 95 -21.244 -18.895 7.248 1.00 0.00 C ATOM 1425 CG2 VAL A 95 -21.456 -16.988 8.855 1.00 0.00 C ATOM 0 H VAL A 95 -19.118 -15.845 8.019 1.00 0.00 H new ATOM 0 HA VAL A 95 -20.257 -17.113 5.634 1.00 0.00 H new ATOM 0 HB VAL A 95 -22.464 -17.169 6.982 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -21.993 -19.436 7.827 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -21.321 -19.180 6.199 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -20.250 -19.143 7.619 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -22.200 -17.564 9.405 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -20.467 -17.181 9.271 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -21.685 -15.926 8.940 1.00 0.00 H new ATOM 1435 N THR A 96 -21.642 -15.026 5.214 1.00 0.00 N ATOM 1436 CA THR A 96 -22.302 -13.773 4.951 1.00 0.00 C ATOM 1437 C THR A 96 -23.769 -13.861 5.335 1.00 0.00 C ATOM 1438 O THR A 96 -24.529 -14.655 4.772 1.00 0.00 O ATOM 1439 CB THR A 96 -22.187 -13.359 3.479 1.00 0.00 C ATOM 1440 OG1 THR A 96 -22.620 -14.427 2.639 1.00 0.00 O ATOM 1441 CG2 THR A 96 -20.760 -12.978 3.130 1.00 0.00 C ATOM 0 H THR A 96 -21.734 -15.724 4.476 1.00 0.00 H new ATOM 0 HA THR A 96 -21.804 -13.015 5.555 1.00 0.00 H new ATOM 0 HB THR A 96 -22.824 -12.489 3.319 1.00 0.00 H new ATOM 0 HG1 THR A 96 -22.793 -14.084 1.737 1.00 0.00 H new ATOM 0 HG21 THR A 96 -20.707 -12.689 2.080 1.00 0.00 H new ATOM 0 HG22 THR A 96 -20.444 -12.142 3.753 1.00 0.00 H new ATOM 0 HG23 THR A 96 -20.103 -13.830 3.305 1.00 0.00 H new ATOM 1449 N THR A 97 -24.154 -13.072 6.319 1.00 0.00 N ATOM 1450 CA THR A 97 -25.551 -12.927 6.681 1.00 0.00 C ATOM 1451 C THR A 97 -26.285 -12.098 5.625 1.00 0.00 C ATOM 1452 O THR A 97 -26.876 -11.059 5.920 1.00 0.00 O ATOM 1453 CB THR A 97 -25.681 -12.269 8.066 1.00 0.00 C ATOM 1454 OG1 THR A 97 -24.830 -11.114 8.142 1.00 0.00 O ATOM 1455 CG2 THR A 97 -25.305 -13.251 9.166 1.00 0.00 C ATOM 0 H THR A 97 -23.513 -12.517 6.886 1.00 0.00 H new ATOM 0 HA THR A 97 -26.005 -13.917 6.726 1.00 0.00 H new ATOM 0 HB THR A 97 -26.719 -11.967 8.206 1.00 0.00 H new ATOM 0 HG1 THR A 97 -24.919 -10.699 9.026 1.00 0.00 H new ATOM 0 HG21 THR A 97 -25.404 -12.765 10.137 1.00 0.00 H new ATOM 0 HG22 THR A 97 -25.967 -14.116 9.124 1.00 0.00 H new ATOM 0 HG23 THR A 97 -24.274 -13.576 9.026 1.00 0.00 H new ATOM 1463 N CYS A 98 -26.223 -12.566 4.387 1.00 0.00 N ATOM 1464 CA CYS A 98 -26.790 -11.852 3.259 1.00 0.00 C ATOM 1465 C CYS A 98 -27.973 -12.609 2.679 1.00 0.00 C ATOM 1466 O CYS A 98 -27.809 -13.657 2.053 1.00 0.00 O ATOM 1467 CB CYS A 98 -25.732 -11.640 2.175 1.00 0.00 C ATOM 1468 SG CYS A 98 -24.293 -10.660 2.714 1.00 0.00 S ATOM 0 H CYS A 98 -25.778 -13.450 4.139 1.00 0.00 H new ATOM 0 HA CYS A 98 -27.136 -10.882 3.615 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -25.385 -12.613 1.827 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -26.196 -11.144 1.323 1.00 0.00 H new ATOM 1473 N GLY A 99 -29.161 -12.082 2.909 1.00 0.00 N ATOM 1474 CA GLY A 99 -30.355 -12.663 2.347 1.00 0.00 C ATOM 1475 C GLY A 99 -31.511 -11.696 2.428 1.00 0.00 C ATOM 1476 O GLY A 99 -31.345 -10.562 2.883 1.00 0.00 O ATOM 0 H GLY A 99 -29.320 -11.253 3.482 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -30.177 -12.937 1.307 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -30.604 -13.580 2.880 1.00 0.00 H new ATOM 1480 N ASN A 100 -32.679 -12.119 1.984 1.00 0.00 N ATOM 1481 CA ASN A 100 -33.858 -11.278 2.080 1.00 0.00 C ATOM 1482 C ASN A 100 -34.872 -11.924 3.007 1.00 0.00 C ATOM 1483 O ASN A 100 -35.556 -12.875 2.633 1.00 0.00 O ATOM 1484 CB ASN A 100 -34.466 -11.028 0.699 1.00 0.00 C ATOM 1485 CG ASN A 100 -35.595 -10.011 0.732 1.00 0.00 C ATOM 1486 OD1 ASN A 100 -35.507 -9.038 1.631 1.00 0.00 O flip ATOM 1487 ND2 ASN A 100 -36.534 -10.090 -0.056 1.00 0.00 N flip ATOM 0 H ASN A 100 -32.837 -13.032 1.557 1.00 0.00 H new ATOM 0 HA ASN A 100 -33.567 -10.312 2.492 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -33.687 -10.679 0.021 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -34.841 -11.969 0.296 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -36.569 -10.852 -0.733 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -37.279 -9.394 -0.033 1.00 0.00 H new ATOM 1494 N GLY A 101 -34.930 -11.432 4.233 1.00 0.00 N ATOM 1495 CA GLY A 101 -35.794 -12.023 5.232 1.00 0.00 C ATOM 1496 C GLY A 101 -35.005 -12.879 6.196 1.00 0.00 C ATOM 1497 O GLY A 101 -35.474 -13.209 7.286 1.00 0.00 O ATOM 0 H GLY A 101 -34.391 -10.629 4.556 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -36.313 -11.236 5.780 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -36.558 -12.629 4.744 1.00 0.00 H new ATOM 1501 N SER A 102 -33.798 -13.229 5.775 1.00 0.00 N ATOM 1502 CA SER A 102 -32.879 -14.014 6.579 1.00 0.00 C ATOM 1503 C SER A 102 -31.479 -13.928 5.974 1.00 0.00 C ATOM 1504 O SER A 102 -30.827 -12.880 6.146 1.00 0.00 O ATOM 1505 CB SER A 102 -33.343 -15.477 6.664 1.00 0.00 C ATOM 1506 OG SER A 102 -32.391 -16.278 7.344 1.00 0.00 O ATOM 0 H SER A 102 -33.429 -12.973 4.859 1.00 0.00 H new ATOM 0 HA SER A 102 -32.858 -13.612 7.592 1.00 0.00 H new ATOM 0 HB2 SER A 102 -34.301 -15.528 7.181 1.00 0.00 H new ATOM 0 HB3 SER A 102 -33.502 -15.870 5.660 1.00 0.00 H new ATOM 0 HG SER A 102 -32.712 -17.203 7.385 1.00 0.00 H new TER 1512 SER A 102