USER MOD reduce.3.24.130724 H: found=0, std=0, add=1085, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1085 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 NoAdj : A 139 ASNHD21 : A 139 ASN OD1 : A 201 CUCU :(metal ligand) USER MOD NoAdj : A 139 ASNHD22 : A 139 ASN OD1 : A 201 CUCU :(metal ligand) USER MOD Set 1.1: A 122 LYS NZ :NH3+ 153:sc= 1.13 (180deg=0.119) USER MOD Set 1.2: A 137 THR OG1 : rot 180:sc= 0.95 USER MOD Set 2.1: A 110 HIS : no HD1:sc= 0 X(o=-0.4,f=-0.4) USER MOD Set 2.2: A 111 SER OG : rot -110:sc= -0.405 USER MOD Set 3.1: A 58 THR OG1 : rot 180:sc= 0.165 USER MOD Set 3.2: A 59 SER OG : rot 131:sc= 1.16 USER MOD Set 4.1: A 26 ASN : amide:sc= -0.274 K(o=-0.27,f=-5.4!) USER MOD Set 4.2: A 102 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 1 ALA N :NH3+ 151:sc= -0.063 (180deg=-1.22) USER MOD Set 5.2: A 22 GLN : amide:sc= -1.47! C(o=-1.5!,f=-15!) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0.00334 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 ASN : amide:sc= -2.3 K(o=-2.3,f=0) USER MOD Single : A 23 LYS NZ :NH3+ -178:sc= 0.98 (180deg=0.974) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 50:sc= 0.197 USER MOD Single : A 43 HIS : no HD1:sc= -0.0105 X(o=-0.011,f=-0.011) USER MOD Single : A 46 HIS : no HE2:sc= -1.26 K(o=-1.3,f=-6.6!) USER MOD Single : A 48 HIS : no HE2:sc= -3.61 K(o=-3.6,f=-11!) USER MOD Single : A 53 ASN : amide:sc= -0.326 K(o=-0.33,f=-2.2) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 HIS : no HD1:sc= -2.09 K(o=-2.1,f=0.61) USER MOD Single : A 65 ASN : amide:sc= -3.84! C(o=-3.8!,f=-5.5!) USER MOD Single : A 68 SER OG : rot 164:sc= 1.73 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : no HD1:sc= -1.34 K(o=-1.3,f=-4!) USER MOD Single : A 86 ASN : amide:sc= -0.281 K(o=-0.28,f=-6.9!) USER MOD Single : A 88 THR OG1 : rot -63:sc= 1.11 USER MOD Single : A 91 LYS NZ :NH3+ -179:sc= 1.12 (180deg=1.07) USER MOD Single : A 98 SER OG : rot 170:sc= -0.342 USER MOD Single : A 105 SER OG : rot 100:sc= 0.672 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot -126:sc= 1.3 USER MOD Single : A 120 HIS : no HE2:sc= -1.05 K(o=-0.95,f=-7.9!) USER MOD Single : A 128 LYS NZ :NH3+ 168:sc= -0.0357 (180deg=-0.199) USER MOD Single : A 131 ASN : amide:sc= -1.18! K(o=-1.2!,f=-0.19) USER MOD Single : A 134 SER OG : rot 180:sc= -0.611 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 160:sc= -0.727 USER MOD Single : A 153 GLN : amide:sc= -0.0175 X(o=-0.017,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 7.023 -13.648 2.418 1.00 0.00 N ATOM 2 CA ALA A 1 7.571 -14.643 1.505 1.00 0.00 C ATOM 3 C ALA A 1 6.599 -14.969 0.394 1.00 0.00 C ATOM 4 O ALA A 1 6.494 -14.246 -0.579 1.00 0.00 O ATOM 5 CB ALA A 1 7.985 -15.903 2.245 1.00 0.00 C ATOM 0 H1 ALA A 1 7.424 -13.789 3.367 1.00 0.00 H new ATOM 0 H2 ALA A 1 7.264 -12.695 2.078 1.00 0.00 H new ATOM 0 H3 ALA A 1 5.989 -13.749 2.461 1.00 0.00 H new ATOM 0 HA ALA A 1 8.463 -14.210 1.052 1.00 0.00 H new ATOM 0 HB1 ALA A 1 8.390 -16.625 1.536 1.00 0.00 H new ATOM 0 HB2 ALA A 1 8.746 -15.657 2.986 1.00 0.00 H new ATOM 0 HB3 ALA A 1 7.117 -16.333 2.745 1.00 0.00 H new ATOM 13 N THR A 2 5.844 -16.024 0.596 1.00 0.00 N ATOM 14 CA THR A 2 4.913 -16.531 -0.368 1.00 0.00 C ATOM 15 C THR A 2 3.609 -15.718 -0.360 1.00 0.00 C ATOM 16 O THR A 2 2.935 -15.605 -1.367 1.00 0.00 O ATOM 17 CB THR A 2 4.619 -17.988 0.014 1.00 0.00 C ATOM 18 OG1 THR A 2 5.861 -18.600 0.420 1.00 0.00 O ATOM 19 CG2 THR A 2 4.052 -18.764 -1.160 1.00 0.00 C ATOM 0 H THR A 2 5.866 -16.563 1.461 1.00 0.00 H new ATOM 0 HA THR A 2 5.335 -16.459 -1.370 1.00 0.00 H new ATOM 0 HB THR A 2 3.883 -18.003 0.818 1.00 0.00 H new ATOM 0 HG1 THR A 2 5.699 -19.533 0.671 1.00 0.00 H new ATOM 0 HG21 THR A 2 3.855 -19.792 -0.856 1.00 0.00 H new ATOM 0 HG22 THR A 2 3.123 -18.299 -1.489 1.00 0.00 H new ATOM 0 HG23 THR A 2 4.770 -18.760 -1.980 1.00 0.00 H new ATOM 27 N LYS A 3 3.278 -15.161 0.779 1.00 0.00 N ATOM 28 CA LYS A 3 2.059 -14.414 0.929 1.00 0.00 C ATOM 29 C LYS A 3 2.234 -13.364 1.999 1.00 0.00 C ATOM 30 O LYS A 3 3.281 -13.336 2.686 1.00 0.00 O ATOM 31 CB LYS A 3 0.853 -15.335 1.245 1.00 0.00 C ATOM 32 CG LYS A 3 1.032 -16.169 2.499 1.00 0.00 C ATOM 33 CD LYS A 3 -0.211 -16.962 2.886 1.00 0.00 C ATOM 34 CE LYS A 3 -0.560 -18.013 1.859 1.00 0.00 C ATOM 35 NZ LYS A 3 -1.675 -18.862 2.308 1.00 0.00 N ATOM 0 H LYS A 3 3.846 -15.214 1.625 1.00 0.00 H new ATOM 0 HA LYS A 3 1.841 -13.923 -0.020 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -0.042 -14.722 1.352 1.00 0.00 H new ATOM 0 HB3 LYS A 3 0.684 -16.000 0.398 1.00 0.00 H new ATOM 0 HG2 LYS A 3 1.862 -16.860 2.351 1.00 0.00 H new ATOM 0 HG3 LYS A 3 1.307 -15.513 3.325 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -0.049 -17.440 3.852 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -1.053 -16.280 3.006 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -0.826 -17.529 0.919 1.00 0.00 H new ATOM 0 HE3 LYS A 3 0.314 -18.634 1.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -1.887 -19.572 1.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -1.411 -19.343 3.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -2.516 -18.273 2.472 1.00 0.00 H new ATOM 49 N ALA A 4 1.260 -12.492 2.107 1.00 0.00 N ATOM 50 CA ALA A 4 1.245 -11.457 3.099 1.00 0.00 C ATOM 51 C ALA A 4 -0.153 -11.286 3.605 1.00 0.00 C ATOM 52 O ALA A 4 -1.106 -11.603 2.904 1.00 0.00 O ATOM 53 CB ALA A 4 1.781 -10.140 2.562 1.00 0.00 C ATOM 0 H ALA A 4 0.444 -12.486 1.495 1.00 0.00 H new ATOM 0 HA ALA A 4 1.904 -11.756 3.915 1.00 0.00 H new ATOM 0 HB1 ALA A 4 1.750 -9.387 3.349 1.00 0.00 H new ATOM 0 HB2 ALA A 4 2.810 -10.275 2.229 1.00 0.00 H new ATOM 0 HB3 ALA A 4 1.168 -9.813 1.722 1.00 0.00 H new ATOM 59 N VAL A 5 -0.274 -10.799 4.802 1.00 0.00 N ATOM 60 CA VAL A 5 -1.548 -10.618 5.425 1.00 0.00 C ATOM 61 C VAL A 5 -1.692 -9.161 5.876 1.00 0.00 C ATOM 62 O VAL A 5 -0.843 -8.637 6.613 1.00 0.00 O ATOM 63 CB VAL A 5 -1.730 -11.589 6.633 1.00 0.00 C ATOM 64 CG1 VAL A 5 -3.079 -11.373 7.311 1.00 0.00 C ATOM 65 CG2 VAL A 5 -1.601 -13.047 6.191 1.00 0.00 C ATOM 0 H VAL A 5 0.517 -10.513 5.379 1.00 0.00 H new ATOM 0 HA VAL A 5 -2.328 -10.850 4.700 1.00 0.00 H new ATOM 0 HB VAL A 5 -0.938 -11.369 7.349 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.179 -12.063 8.149 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -3.143 -10.348 7.675 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -3.880 -11.554 6.594 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -1.732 -13.701 7.053 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.365 -13.270 5.446 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -0.614 -13.210 5.758 1.00 0.00 H new ATOM 75 N ALA A 6 -2.715 -8.527 5.381 1.00 0.00 N ATOM 76 CA ALA A 6 -3.036 -7.130 5.691 1.00 0.00 C ATOM 77 C ALA A 6 -4.498 -7.000 6.062 1.00 0.00 C ATOM 78 O ALA A 6 -5.339 -7.568 5.382 1.00 0.00 O ATOM 79 CB ALA A 6 -2.781 -6.266 4.472 1.00 0.00 C ATOM 0 H ALA A 6 -3.375 -8.960 4.735 1.00 0.00 H new ATOM 0 HA ALA A 6 -2.410 -6.809 6.524 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -3.020 -5.228 4.705 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -1.732 -6.341 4.186 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.407 -6.606 3.647 1.00 0.00 H new ATOM 85 N VAL A 7 -4.796 -6.292 7.148 1.00 0.00 N ATOM 86 CA VAL A 7 -6.184 -6.031 7.557 1.00 0.00 C ATOM 87 C VAL A 7 -6.333 -4.546 7.943 1.00 0.00 C ATOM 88 O VAL A 7 -5.748 -4.099 8.938 1.00 0.00 O ATOM 89 CB VAL A 7 -6.638 -6.909 8.760 1.00 0.00 C ATOM 90 CG1 VAL A 7 -8.124 -6.722 9.021 1.00 0.00 C ATOM 91 CG2 VAL A 7 -6.318 -8.380 8.543 1.00 0.00 C ATOM 0 H VAL A 7 -4.095 -5.885 7.767 1.00 0.00 H new ATOM 0 HA VAL A 7 -6.818 -6.284 6.707 1.00 0.00 H new ATOM 0 HB VAL A 7 -6.078 -6.579 9.635 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -8.426 -7.342 9.865 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -8.324 -5.675 9.250 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -8.689 -7.014 8.136 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -6.652 -8.956 9.406 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -6.830 -8.736 7.649 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -5.242 -8.504 8.418 1.00 0.00 H new ATOM 101 N LEU A 8 -7.100 -3.807 7.160 1.00 0.00 N ATOM 102 CA LEU A 8 -7.296 -2.359 7.349 1.00 0.00 C ATOM 103 C LEU A 8 -8.502 -2.070 8.253 1.00 0.00 C ATOM 104 O LEU A 8 -9.580 -2.616 8.038 1.00 0.00 O ATOM 105 CB LEU A 8 -7.548 -1.661 5.987 1.00 0.00 C ATOM 106 CG LEU A 8 -6.409 -1.542 4.950 1.00 0.00 C ATOM 107 CD1 LEU A 8 -5.247 -0.758 5.503 1.00 0.00 C ATOM 108 CD2 LEU A 8 -5.967 -2.898 4.401 1.00 0.00 C ATOM 0 H LEU A 8 -7.614 -4.188 6.365 1.00 0.00 H new ATOM 0 HA LEU A 8 -6.388 -1.975 7.814 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -8.372 -2.186 5.503 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.896 -0.651 6.202 1.00 0.00 H new ATOM 0 HG LEU A 8 -6.812 -0.988 4.103 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.462 -0.692 4.750 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.579 0.245 5.770 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -4.858 -1.260 6.389 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.165 -2.754 3.677 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.609 -3.523 5.219 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -6.811 -3.386 3.914 1.00 0.00 H new ATOM 120 N LYS A 9 -8.318 -1.211 9.259 1.00 0.00 N ATOM 121 CA LYS A 9 -9.404 -0.767 10.127 1.00 0.00 C ATOM 122 C LYS A 9 -9.126 0.668 10.557 1.00 0.00 C ATOM 123 O LYS A 9 -8.027 0.977 10.997 1.00 0.00 O ATOM 124 CB LYS A 9 -9.594 -1.669 11.380 1.00 0.00 C ATOM 125 CG LYS A 9 -9.812 -3.151 11.068 1.00 0.00 C ATOM 126 CD LYS A 9 -10.433 -3.918 12.221 1.00 0.00 C ATOM 127 CE LYS A 9 -11.871 -3.473 12.456 1.00 0.00 C ATOM 128 NZ LYS A 9 -12.566 -4.329 13.428 1.00 0.00 N ATOM 0 H LYS A 9 -7.411 -0.806 9.492 1.00 0.00 H new ATOM 0 HA LYS A 9 -10.332 -0.834 9.559 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -8.717 -1.571 12.019 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -10.447 -1.302 11.951 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -10.454 -3.241 10.192 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -8.856 -3.606 10.810 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -10.409 -4.987 12.008 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -9.846 -3.760 13.126 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -11.877 -2.443 12.812 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -12.413 -3.486 11.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -13.540 -3.989 13.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -12.585 -5.308 13.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -12.066 -4.297 14.339 1.00 0.00 H new ATOM 142 N GLY A 10 -10.077 1.549 10.352 1.00 0.00 N ATOM 143 CA GLY A 10 -9.890 2.926 10.720 1.00 0.00 C ATOM 144 C GLY A 10 -11.200 3.621 10.960 1.00 0.00 C ATOM 145 O GLY A 10 -12.213 2.968 11.210 1.00 0.00 O ATOM 0 H GLY A 10 -10.983 1.335 9.934 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -9.278 2.982 11.620 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -9.344 3.442 9.931 1.00 0.00 H new ATOM 149 N ASP A 11 -11.167 4.944 10.864 1.00 0.00 N ATOM 150 CA ASP A 11 -12.359 5.796 10.978 1.00 0.00 C ATOM 151 C ASP A 11 -13.311 5.465 9.839 1.00 0.00 C ATOM 152 O ASP A 11 -14.532 5.386 10.016 1.00 0.00 O ATOM 153 CB ASP A 11 -11.956 7.271 10.896 1.00 0.00 C ATOM 154 CG ASP A 11 -13.126 8.211 11.067 1.00 0.00 C ATOM 155 OD1 ASP A 11 -13.430 8.582 12.213 1.00 0.00 O ATOM 156 OD2 ASP A 11 -13.733 8.630 10.072 1.00 0.00 O ATOM 0 H ASP A 11 -10.307 5.468 10.703 1.00 0.00 H new ATOM 0 HA ASP A 11 -12.847 5.615 11.936 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -11.212 7.482 11.664 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -11.483 7.460 9.933 1.00 0.00 H new ATOM 161 N GLY A 12 -12.725 5.256 8.673 1.00 0.00 N ATOM 162 CA GLY A 12 -13.449 4.783 7.530 1.00 0.00 C ATOM 163 C GLY A 12 -12.894 3.433 7.175 1.00 0.00 C ATOM 164 O GLY A 12 -12.022 3.335 6.311 1.00 0.00 O ATOM 0 H GLY A 12 -11.732 5.413 8.503 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -14.514 4.714 7.752 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -13.341 5.474 6.694 1.00 0.00 H new ATOM 168 N PRO A 13 -13.350 2.364 7.852 1.00 0.00 N ATOM 169 CA PRO A 13 -12.757 1.053 7.709 1.00 0.00 C ATOM 170 C PRO A 13 -13.069 0.378 6.386 1.00 0.00 C ATOM 171 O PRO A 13 -14.233 0.229 5.988 1.00 0.00 O ATOM 172 CB PRO A 13 -13.346 0.257 8.879 1.00 0.00 C ATOM 173 CG PRO A 13 -14.650 0.916 9.179 1.00 0.00 C ATOM 174 CD PRO A 13 -14.508 2.356 8.781 1.00 0.00 C ATOM 0 HA PRO A 13 -11.669 1.115 7.719 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -13.486 -0.791 8.613 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -12.684 0.280 9.745 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -15.460 0.440 8.627 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -14.893 0.829 10.238 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -15.411 2.726 8.295 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -14.328 2.993 9.647 1.00 0.00 H new ATOM 182 N VAL A 14 -12.024 -0.036 5.735 1.00 0.00 N ATOM 183 CA VAL A 14 -12.104 -0.780 4.526 1.00 0.00 C ATOM 184 C VAL A 14 -11.609 -2.167 4.820 1.00 0.00 C ATOM 185 O VAL A 14 -10.469 -2.366 5.214 1.00 0.00 O ATOM 186 CB VAL A 14 -11.322 -0.118 3.343 1.00 0.00 C ATOM 187 CG1 VAL A 14 -12.021 1.145 2.923 1.00 0.00 C ATOM 188 CG2 VAL A 14 -9.876 0.209 3.716 1.00 0.00 C ATOM 0 H VAL A 14 -11.068 0.142 6.043 1.00 0.00 H new ATOM 0 HA VAL A 14 -13.140 -0.807 4.187 1.00 0.00 H new ATOM 0 HB VAL A 14 -11.301 -0.836 2.523 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -11.476 1.606 2.099 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -13.035 0.910 2.601 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -12.059 1.837 3.764 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.375 0.666 2.863 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -9.865 0.902 4.558 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -9.356 -0.708 3.994 1.00 0.00 H new ATOM 198 N GLN A 15 -12.455 -3.119 4.675 1.00 0.00 N ATOM 199 CA GLN A 15 -12.105 -4.442 5.090 1.00 0.00 C ATOM 200 C GLN A 15 -11.670 -5.257 3.928 1.00 0.00 C ATOM 201 O GLN A 15 -12.421 -5.450 2.972 1.00 0.00 O ATOM 202 CB GLN A 15 -13.248 -5.107 5.851 1.00 0.00 C ATOM 203 CG GLN A 15 -13.549 -4.438 7.185 1.00 0.00 C ATOM 204 CD GLN A 15 -14.688 -5.096 7.928 1.00 0.00 C ATOM 205 OE1 GLN A 15 -14.484 -6.031 8.700 1.00 0.00 O ATOM 206 NE2 GLN A 15 -15.879 -4.609 7.728 1.00 0.00 N ATOM 0 H GLN A 15 -13.389 -3.017 4.277 1.00 0.00 H new ATOM 0 HA GLN A 15 -11.264 -4.370 5.779 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -14.146 -5.091 5.233 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -13.000 -6.154 6.025 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -12.654 -4.461 7.807 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -13.791 -3.389 7.013 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -16.010 -3.832 7.080 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -16.681 -5.004 8.220 1.00 0.00 H new ATOM 215 N GLY A 16 -10.450 -5.689 3.984 1.00 0.00 N ATOM 216 CA GLY A 16 -9.919 -6.504 2.967 1.00 0.00 C ATOM 217 C GLY A 16 -8.602 -7.037 3.356 1.00 0.00 C ATOM 218 O GLY A 16 -8.049 -6.611 4.371 1.00 0.00 O ATOM 0 H GLY A 16 -9.802 -5.479 4.743 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -10.603 -7.327 2.761 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -9.826 -5.929 2.046 1.00 0.00 H new ATOM 222 N ILE A 17 -8.093 -7.952 2.577 1.00 0.00 N ATOM 223 CA ILE A 17 -6.825 -8.569 2.849 1.00 0.00 C ATOM 224 C ILE A 17 -6.023 -8.528 1.581 1.00 0.00 C ATOM 225 O ILE A 17 -6.542 -8.874 0.526 1.00 0.00 O ATOM 226 CB ILE A 17 -6.967 -10.047 3.366 1.00 0.00 C ATOM 227 CG1 ILE A 17 -7.826 -10.904 2.406 1.00 0.00 C ATOM 228 CG2 ILE A 17 -7.531 -10.079 4.787 1.00 0.00 C ATOM 229 CD1 ILE A 17 -7.943 -12.361 2.803 1.00 0.00 C ATOM 0 H ILE A 17 -8.550 -8.292 1.731 1.00 0.00 H new ATOM 0 HA ILE A 17 -6.327 -8.021 3.649 1.00 0.00 H new ATOM 0 HB ILE A 17 -5.969 -10.484 3.390 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -8.826 -10.474 2.351 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -7.398 -10.846 1.405 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -7.619 -11.113 5.120 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -6.862 -9.538 5.456 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -8.514 -9.609 4.799 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -8.562 -12.888 2.076 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -6.951 -12.812 2.829 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -8.401 -12.434 3.789 1.00 0.00 H new ATOM 241 N ILE A 18 -4.806 -8.051 1.645 1.00 0.00 N ATOM 242 CA ILE A 18 -4.001 -7.945 0.444 1.00 0.00 C ATOM 243 C ILE A 18 -2.836 -8.886 0.615 1.00 0.00 C ATOM 244 O ILE A 18 -2.269 -8.945 1.703 1.00 0.00 O ATOM 245 CB ILE A 18 -3.435 -6.512 0.225 1.00 0.00 C ATOM 246 CG1 ILE A 18 -4.456 -5.395 0.588 1.00 0.00 C ATOM 247 CG2 ILE A 18 -3.011 -6.366 -1.228 1.00 0.00 C ATOM 248 CD1 ILE A 18 -5.718 -5.357 -0.254 1.00 0.00 C ATOM 0 H ILE A 18 -4.351 -7.733 2.501 1.00 0.00 H new ATOM 0 HA ILE A 18 -4.625 -8.185 -0.417 1.00 0.00 H new ATOM 0 HB ILE A 18 -2.583 -6.389 0.894 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -4.742 -5.516 1.633 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -3.956 -4.430 0.504 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -2.613 -5.365 -1.392 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -2.243 -7.104 -1.459 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -3.873 -6.524 -1.876 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -6.357 -4.542 0.085 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -5.453 -5.200 -1.300 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -6.251 -6.302 -0.153 1.00 0.00 H new ATOM 260 N ASN A 19 -2.491 -9.649 -0.407 1.00 0.00 N ATOM 261 CA ASN A 19 -1.406 -10.606 -0.261 1.00 0.00 C ATOM 262 C ASN A 19 -0.236 -10.222 -1.149 1.00 0.00 C ATOM 263 O ASN A 19 -0.435 -9.973 -2.321 1.00 0.00 O ATOM 264 CB ASN A 19 -1.852 -12.055 -0.605 1.00 0.00 C ATOM 265 CG ASN A 19 -2.859 -12.717 0.357 1.00 0.00 C ATOM 266 OD1 ASN A 19 -2.832 -13.933 0.549 1.00 0.00 O ATOM 267 ND2 ASN A 19 -3.774 -11.965 0.920 1.00 0.00 N ATOM 0 H ASN A 19 -2.933 -9.628 -1.326 1.00 0.00 H new ATOM 0 HA ASN A 19 -1.103 -10.582 0.786 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -2.289 -12.048 -1.603 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -0.962 -12.683 -0.651 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -4.477 -12.386 1.527 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -3.782 -10.959 0.751 1.00 0.00 H new ATOM 274 N PHE A 20 0.978 -10.166 -0.591 1.00 0.00 N ATOM 275 CA PHE A 20 2.170 -9.813 -1.355 1.00 0.00 C ATOM 276 C PHE A 20 3.241 -10.865 -1.233 1.00 0.00 C ATOM 277 O PHE A 20 3.497 -11.392 -0.145 1.00 0.00 O ATOM 278 CB PHE A 20 2.750 -8.455 -0.934 1.00 0.00 C ATOM 279 CG PHE A 20 2.017 -7.266 -1.471 1.00 0.00 C ATOM 280 CD1 PHE A 20 0.920 -6.754 -0.822 1.00 0.00 C ATOM 281 CD2 PHE A 20 2.449 -6.651 -2.634 1.00 0.00 C ATOM 282 CE1 PHE A 20 0.262 -5.655 -1.320 1.00 0.00 C ATOM 283 CE2 PHE A 20 1.793 -5.550 -3.136 1.00 0.00 C ATOM 284 CZ PHE A 20 0.699 -5.052 -2.479 1.00 0.00 C ATOM 0 H PHE A 20 1.157 -10.363 0.394 1.00 0.00 H new ATOM 0 HA PHE A 20 1.848 -9.747 -2.394 1.00 0.00 H new ATOM 0 HB2 PHE A 20 2.755 -8.400 0.155 1.00 0.00 H new ATOM 0 HB3 PHE A 20 3.788 -8.402 -1.261 1.00 0.00 H new ATOM 0 HD1 PHE A 20 0.571 -7.219 0.088 1.00 0.00 H new ATOM 0 HD2 PHE A 20 3.312 -7.040 -3.154 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -0.600 -5.263 -0.801 1.00 0.00 H new ATOM 0 HE2 PHE A 20 2.140 -5.080 -4.045 1.00 0.00 H new ATOM 0 HZ PHE A 20 0.180 -4.189 -2.869 1.00 0.00 H new ATOM 294 N GLU A 21 3.854 -11.158 -2.342 1.00 0.00 N ATOM 295 CA GLU A 21 4.934 -12.106 -2.415 1.00 0.00 C ATOM 296 C GLU A 21 6.246 -11.429 -2.850 1.00 0.00 C ATOM 297 O GLU A 21 6.394 -11.030 -4.018 1.00 0.00 O ATOM 298 CB GLU A 21 4.579 -13.261 -3.390 1.00 0.00 C ATOM 299 CG GLU A 21 4.000 -12.801 -4.741 1.00 0.00 C ATOM 300 CD GLU A 21 3.971 -13.891 -5.791 1.00 0.00 C ATOM 301 OE1 GLU A 21 3.790 -15.076 -5.453 1.00 0.00 O ATOM 302 OE2 GLU A 21 4.189 -13.585 -6.992 1.00 0.00 O ATOM 0 H GLU A 21 3.615 -10.738 -3.240 1.00 0.00 H new ATOM 0 HA GLU A 21 5.081 -12.518 -1.417 1.00 0.00 H new ATOM 0 HB2 GLU A 21 5.476 -13.851 -3.576 1.00 0.00 H new ATOM 0 HB3 GLU A 21 3.858 -13.920 -2.906 1.00 0.00 H new ATOM 0 HG2 GLU A 21 2.987 -12.431 -4.585 1.00 0.00 H new ATOM 0 HG3 GLU A 21 4.591 -11.964 -5.114 1.00 0.00 H new ATOM 309 N GLN A 22 7.185 -11.242 -1.929 1.00 0.00 N ATOM 310 CA GLN A 22 8.451 -10.794 -2.334 1.00 0.00 C ATOM 311 C GLN A 22 9.240 -12.044 -2.712 1.00 0.00 C ATOM 312 O GLN A 22 9.345 -13.013 -1.938 1.00 0.00 O ATOM 313 CB GLN A 22 9.141 -9.894 -1.267 1.00 0.00 C ATOM 314 CG GLN A 22 9.943 -10.557 -0.144 1.00 0.00 C ATOM 315 CD GLN A 22 9.198 -11.540 0.728 1.00 0.00 C ATOM 316 OE1 GLN A 22 7.976 -11.462 0.928 1.00 0.00 O ATOM 317 NE2 GLN A 22 9.942 -12.452 1.283 1.00 0.00 N ATOM 0 H GLN A 22 7.070 -11.398 -0.928 1.00 0.00 H new ATOM 0 HA GLN A 22 8.383 -10.129 -3.195 1.00 0.00 H new ATOM 0 HB2 GLN A 22 9.811 -9.215 -1.793 1.00 0.00 H new ATOM 0 HB3 GLN A 22 8.368 -9.282 -0.802 1.00 0.00 H new ATOM 0 HG2 GLN A 22 10.793 -11.073 -0.591 1.00 0.00 H new ATOM 0 HG3 GLN A 22 10.347 -9.772 0.495 1.00 0.00 H new ATOM 0 HE21 GLN A 22 10.943 -12.480 1.091 1.00 0.00 H new ATOM 0 HE22 GLN A 22 9.524 -13.139 1.910 1.00 0.00 H new ATOM 326 N LYS A 23 9.709 -12.056 -3.906 1.00 0.00 N ATOM 327 CA LYS A 23 10.282 -13.224 -4.471 1.00 0.00 C ATOM 328 C LYS A 23 11.531 -12.830 -5.219 1.00 0.00 C ATOM 329 O LYS A 23 11.455 -12.300 -6.321 1.00 0.00 O ATOM 330 CB LYS A 23 9.233 -13.842 -5.405 1.00 0.00 C ATOM 331 CG LYS A 23 9.510 -15.253 -5.902 1.00 0.00 C ATOM 332 CD LYS A 23 8.357 -15.754 -6.791 1.00 0.00 C ATOM 333 CE LYS A 23 7.006 -15.724 -6.054 1.00 0.00 C ATOM 334 NZ LYS A 23 5.869 -16.153 -6.904 1.00 0.00 N ATOM 0 H LYS A 23 9.706 -11.246 -4.526 1.00 0.00 H new ATOM 0 HA LYS A 23 10.561 -13.956 -3.713 1.00 0.00 H new ATOM 0 HB2 LYS A 23 8.275 -13.846 -4.886 1.00 0.00 H new ATOM 0 HB3 LYS A 23 9.123 -13.191 -6.272 1.00 0.00 H new ATOM 0 HG2 LYS A 23 10.443 -15.269 -6.465 1.00 0.00 H new ATOM 0 HG3 LYS A 23 9.639 -15.924 -5.053 1.00 0.00 H new ATOM 0 HD2 LYS A 23 8.295 -15.136 -7.687 1.00 0.00 H new ATOM 0 HD3 LYS A 23 8.568 -16.772 -7.120 1.00 0.00 H new ATOM 0 HE2 LYS A 23 7.062 -16.371 -5.179 1.00 0.00 H new ATOM 0 HE3 LYS A 23 6.819 -14.713 -5.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 4.984 -16.079 -6.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 5.814 -15.542 -7.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 6.011 -17.139 -7.202 1.00 0.00 H new ATOM 348 N GLU A 24 12.679 -13.092 -4.621 1.00 0.00 N ATOM 349 CA GLU A 24 13.982 -12.674 -5.161 1.00 0.00 C ATOM 350 C GLU A 24 14.309 -13.321 -6.519 1.00 0.00 C ATOM 351 O GLU A 24 15.283 -12.956 -7.176 1.00 0.00 O ATOM 352 CB GLU A 24 15.096 -12.933 -4.145 1.00 0.00 C ATOM 353 CG GLU A 24 15.263 -14.385 -3.754 1.00 0.00 C ATOM 354 CD GLU A 24 16.364 -14.576 -2.755 1.00 0.00 C ATOM 355 OE1 GLU A 24 17.536 -14.698 -3.165 1.00 0.00 O ATOM 356 OE2 GLU A 24 16.081 -14.607 -1.541 1.00 0.00 O ATOM 0 H GLU A 24 12.745 -13.603 -3.741 1.00 0.00 H new ATOM 0 HA GLU A 24 13.915 -11.602 -5.344 1.00 0.00 H new ATOM 0 HB2 GLU A 24 16.038 -12.570 -4.557 1.00 0.00 H new ATOM 0 HB3 GLU A 24 14.895 -12.349 -3.247 1.00 0.00 H new ATOM 0 HG2 GLU A 24 14.327 -14.758 -3.338 1.00 0.00 H new ATOM 0 HG3 GLU A 24 15.474 -14.978 -4.644 1.00 0.00 H new ATOM 363 N SER A 25 13.510 -14.284 -6.910 1.00 0.00 N ATOM 364 CA SER A 25 13.638 -14.936 -8.189 1.00 0.00 C ATOM 365 C SER A 25 13.188 -13.982 -9.329 1.00 0.00 C ATOM 366 O SER A 25 13.620 -14.130 -10.478 1.00 0.00 O ATOM 367 CB SER A 25 12.763 -16.180 -8.160 1.00 0.00 C ATOM 368 OG SER A 25 12.991 -16.896 -6.950 1.00 0.00 O ATOM 0 H SER A 25 12.743 -14.641 -6.341 1.00 0.00 H new ATOM 0 HA SER A 25 14.677 -15.207 -8.377 1.00 0.00 H new ATOM 0 HB2 SER A 25 11.712 -15.900 -8.236 1.00 0.00 H new ATOM 0 HB3 SER A 25 12.987 -16.814 -9.018 1.00 0.00 H new ATOM 0 HG SER A 25 12.425 -17.696 -6.932 1.00 0.00 H new ATOM 374 N ASN A 26 12.331 -12.995 -8.963 1.00 0.00 N ATOM 375 CA ASN A 26 11.755 -11.968 -9.880 1.00 0.00 C ATOM 376 C ASN A 26 10.700 -12.585 -10.803 1.00 0.00 C ATOM 377 O ASN A 26 10.878 -13.691 -11.322 1.00 0.00 O ATOM 378 CB ASN A 26 12.858 -11.218 -10.691 1.00 0.00 C ATOM 379 CG ASN A 26 12.384 -9.931 -11.403 1.00 0.00 C ATOM 380 OD1 ASN A 26 11.223 -9.768 -11.760 1.00 0.00 O ATOM 381 ND2 ASN A 26 13.296 -9.022 -11.624 1.00 0.00 N ATOM 0 H ASN A 26 12.012 -12.885 -8.001 1.00 0.00 H new ATOM 0 HA ASN A 26 11.261 -11.221 -9.259 1.00 0.00 H new ATOM 0 HB2 ASN A 26 13.674 -10.962 -10.015 1.00 0.00 H new ATOM 0 HB3 ASN A 26 13.265 -11.899 -11.438 1.00 0.00 H new ATOM 0 HD21 ASN A 26 13.048 -8.156 -12.102 1.00 0.00 H new ATOM 0 HD22 ASN A 26 14.256 -9.178 -11.318 1.00 0.00 H new ATOM 388 N GLY A 27 9.591 -11.906 -10.958 1.00 0.00 N ATOM 389 CA GLY A 27 8.553 -12.384 -11.824 1.00 0.00 C ATOM 390 C GLY A 27 7.280 -11.649 -11.610 1.00 0.00 C ATOM 391 O GLY A 27 7.210 -10.801 -10.702 1.00 0.00 O ATOM 0 H GLY A 27 9.388 -11.021 -10.494 1.00 0.00 H new ATOM 0 HA2 GLY A 27 8.866 -12.276 -12.862 1.00 0.00 H new ATOM 0 HA3 GLY A 27 8.393 -13.448 -11.649 1.00 0.00 H new ATOM 395 N PRO A 28 6.251 -11.925 -12.416 1.00 0.00 N ATOM 396 CA PRO A 28 4.959 -11.305 -12.256 1.00 0.00 C ATOM 397 C PRO A 28 4.382 -11.747 -10.949 1.00 0.00 C ATOM 398 O PRO A 28 4.250 -12.954 -10.686 1.00 0.00 O ATOM 399 CB PRO A 28 4.122 -11.874 -13.403 1.00 0.00 C ATOM 400 CG PRO A 28 5.107 -12.429 -14.355 1.00 0.00 C ATOM 401 CD PRO A 28 6.267 -12.872 -13.531 1.00 0.00 C ATOM 0 HA PRO A 28 4.996 -10.216 -12.269 1.00 0.00 H new ATOM 0 HB2 PRO A 28 3.438 -12.645 -13.048 1.00 0.00 H new ATOM 0 HB3 PRO A 28 3.514 -11.099 -13.870 1.00 0.00 H new ATOM 0 HG2 PRO A 28 4.683 -13.264 -14.913 1.00 0.00 H new ATOM 0 HG3 PRO A 28 5.410 -11.679 -15.085 1.00 0.00 H new ATOM 0 HD2 PRO A 28 6.152 -13.901 -13.190 1.00 0.00 H new ATOM 0 HD3 PRO A 28 7.202 -12.824 -14.089 1.00 0.00 H new ATOM 409 N VAL A 29 4.061 -10.807 -10.133 1.00 0.00 N ATOM 410 CA VAL A 29 3.558 -11.113 -8.848 1.00 0.00 C ATOM 411 C VAL A 29 2.121 -11.541 -8.904 1.00 0.00 C ATOM 412 O VAL A 29 1.337 -11.083 -9.750 1.00 0.00 O ATOM 413 CB VAL A 29 3.752 -9.958 -7.833 1.00 0.00 C ATOM 414 CG1 VAL A 29 5.225 -9.751 -7.553 1.00 0.00 C ATOM 415 CG2 VAL A 29 3.126 -8.666 -8.338 1.00 0.00 C ATOM 0 H VAL A 29 4.140 -9.811 -10.338 1.00 0.00 H new ATOM 0 HA VAL A 29 4.150 -11.953 -8.486 1.00 0.00 H new ATOM 0 HB VAL A 29 3.248 -10.236 -6.907 1.00 0.00 H new ATOM 0 HG11 VAL A 29 5.349 -8.937 -6.839 1.00 0.00 H new ATOM 0 HG12 VAL A 29 5.649 -10.666 -7.138 1.00 0.00 H new ATOM 0 HG13 VAL A 29 5.740 -9.501 -8.481 1.00 0.00 H new ATOM 0 HG21 VAL A 29 3.280 -7.876 -7.603 1.00 0.00 H new ATOM 0 HG22 VAL A 29 3.592 -8.380 -9.281 1.00 0.00 H new ATOM 0 HG23 VAL A 29 2.057 -8.815 -8.492 1.00 0.00 H new ATOM 425 N LYS A 30 1.811 -12.472 -8.086 1.00 0.00 N ATOM 426 CA LYS A 30 0.476 -12.907 -7.911 1.00 0.00 C ATOM 427 C LYS A 30 0.010 -12.374 -6.581 1.00 0.00 C ATOM 428 O LYS A 30 0.337 -12.912 -5.521 1.00 0.00 O ATOM 429 CB LYS A 30 0.362 -14.425 -8.025 1.00 0.00 C ATOM 430 CG LYS A 30 0.697 -14.923 -9.425 1.00 0.00 C ATOM 431 CD LYS A 30 0.652 -16.432 -9.536 1.00 0.00 C ATOM 432 CE LYS A 30 0.978 -16.874 -10.952 1.00 0.00 C ATOM 433 NZ LYS A 30 0.940 -18.342 -11.107 1.00 0.00 N ATOM 0 H LYS A 30 2.490 -12.965 -7.506 1.00 0.00 H new ATOM 0 HA LYS A 30 -0.170 -12.523 -8.701 1.00 0.00 H new ATOM 0 HB2 LYS A 30 1.033 -14.893 -7.304 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -0.651 -14.732 -7.764 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -0.005 -14.490 -10.138 1.00 0.00 H new ATOM 0 HG3 LYS A 30 1.691 -14.572 -9.703 1.00 0.00 H new ATOM 0 HD2 LYS A 30 1.363 -16.875 -8.838 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -0.337 -16.793 -9.255 1.00 0.00 H new ATOM 0 HE2 LYS A 30 0.268 -16.420 -11.644 1.00 0.00 H new ATOM 0 HE3 LYS A 30 1.968 -16.508 -11.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 1.169 -18.593 -12.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 1.635 -18.777 -10.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -0.011 -18.691 -10.873 1.00 0.00 H new ATOM 447 N VAL A 31 -0.673 -11.269 -6.665 1.00 0.00 N ATOM 448 CA VAL A 31 -1.097 -10.455 -5.560 1.00 0.00 C ATOM 449 C VAL A 31 -2.559 -10.189 -5.721 1.00 0.00 C ATOM 450 O VAL A 31 -3.004 -9.801 -6.808 1.00 0.00 O ATOM 451 CB VAL A 31 -0.332 -9.078 -5.590 1.00 0.00 C ATOM 452 CG1 VAL A 31 -0.929 -8.052 -4.626 1.00 0.00 C ATOM 453 CG2 VAL A 31 1.137 -9.282 -5.279 1.00 0.00 C ATOM 0 H VAL A 31 -0.968 -10.887 -7.564 1.00 0.00 H new ATOM 0 HA VAL A 31 -0.890 -10.965 -4.619 1.00 0.00 H new ATOM 0 HB VAL A 31 -0.442 -8.680 -6.599 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -0.363 -7.122 -4.688 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -1.968 -7.863 -4.894 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -0.881 -8.439 -3.608 1.00 0.00 H new ATOM 0 HG21 VAL A 31 1.651 -8.321 -5.304 1.00 0.00 H new ATOM 0 HG22 VAL A 31 1.241 -9.724 -4.288 1.00 0.00 H new ATOM 0 HG23 VAL A 31 1.577 -9.948 -6.021 1.00 0.00 H new ATOM 463 N TRP A 32 -3.299 -10.418 -4.695 1.00 0.00 N ATOM 464 CA TRP A 32 -4.697 -10.159 -4.721 1.00 0.00 C ATOM 465 C TRP A 32 -5.145 -9.579 -3.398 1.00 0.00 C ATOM 466 O TRP A 32 -4.656 -9.989 -2.335 1.00 0.00 O ATOM 467 CB TRP A 32 -5.486 -11.446 -5.042 1.00 0.00 C ATOM 468 CG TRP A 32 -6.972 -11.237 -5.045 1.00 0.00 C ATOM 469 CD1 TRP A 32 -7.715 -10.688 -6.040 1.00 0.00 C ATOM 470 CD2 TRP A 32 -7.895 -11.560 -3.988 1.00 0.00 C ATOM 471 NE1 TRP A 32 -9.034 -10.632 -5.672 1.00 0.00 N ATOM 472 CE2 TRP A 32 -9.174 -11.169 -4.422 1.00 0.00 C ATOM 473 CE3 TRP A 32 -7.758 -12.141 -2.722 1.00 0.00 C ATOM 474 CZ2 TRP A 32 -10.311 -11.336 -3.638 1.00 0.00 C ATOM 475 CZ3 TRP A 32 -8.888 -12.308 -1.944 1.00 0.00 C ATOM 476 CH2 TRP A 32 -10.149 -11.907 -2.404 1.00 0.00 C ATOM 0 H TRP A 32 -2.953 -10.791 -3.811 1.00 0.00 H new ATOM 0 HA TRP A 32 -4.899 -9.432 -5.508 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -5.176 -11.822 -6.017 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -5.234 -12.213 -4.309 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -7.323 -10.345 -6.986 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -9.791 -10.251 -6.240 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -6.789 -12.452 -2.361 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -11.284 -11.027 -3.989 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -8.797 -12.755 -0.965 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -11.012 -12.051 -1.771 1.00 0.00 H new ATOM 487 N GLY A 33 -5.978 -8.584 -3.470 1.00 0.00 N ATOM 488 CA GLY A 33 -6.622 -8.095 -2.322 1.00 0.00 C ATOM 489 C GLY A 33 -7.851 -7.327 -2.696 1.00 0.00 C ATOM 490 O GLY A 33 -7.852 -6.588 -3.680 1.00 0.00 O ATOM 0 H GLY A 33 -6.220 -8.099 -4.334 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -6.890 -8.924 -1.667 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -5.942 -7.453 -1.762 1.00 0.00 H new ATOM 494 N SER A 34 -8.895 -7.540 -1.956 1.00 0.00 N ATOM 495 CA SER A 34 -10.139 -6.885 -2.148 1.00 0.00 C ATOM 496 C SER A 34 -10.446 -6.096 -0.899 1.00 0.00 C ATOM 497 O SER A 34 -10.387 -6.678 0.172 1.00 0.00 O ATOM 498 CB SER A 34 -11.214 -7.939 -2.435 1.00 0.00 C ATOM 499 OG SER A 34 -12.495 -7.358 -2.603 1.00 0.00 O ATOM 0 H SER A 34 -8.898 -8.198 -1.177 1.00 0.00 H new ATOM 0 HA SER A 34 -10.108 -6.201 -2.996 1.00 0.00 H new ATOM 0 HB2 SER A 34 -10.947 -8.494 -3.334 1.00 0.00 H new ATOM 0 HB3 SER A 34 -11.246 -8.657 -1.615 1.00 0.00 H new ATOM 0 HG SER A 34 -13.152 -8.062 -2.786 1.00 0.00 H new ATOM 505 N ILE A 35 -10.746 -4.824 -0.990 1.00 0.00 N ATOM 506 CA ILE A 35 -11.158 -4.081 0.194 1.00 0.00 C ATOM 507 C ILE A 35 -12.557 -3.515 0.004 1.00 0.00 C ATOM 508 O ILE A 35 -12.858 -2.923 -1.028 1.00 0.00 O ATOM 509 CB ILE A 35 -10.161 -2.956 0.645 1.00 0.00 C ATOM 510 CG1 ILE A 35 -9.865 -1.967 -0.481 1.00 0.00 C ATOM 511 CG2 ILE A 35 -8.874 -3.549 1.206 1.00 0.00 C ATOM 512 CD1 ILE A 35 -9.007 -0.785 -0.066 1.00 0.00 C ATOM 0 H ILE A 35 -10.716 -4.281 -1.853 1.00 0.00 H new ATOM 0 HA ILE A 35 -11.156 -4.806 1.008 1.00 0.00 H new ATOM 0 HB ILE A 35 -10.651 -2.398 1.443 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -9.365 -2.497 -1.292 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -10.809 -1.594 -0.878 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.204 -2.744 1.509 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -9.107 -4.172 2.069 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -8.389 -4.155 0.441 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -8.845 -0.133 -0.925 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -9.513 -0.228 0.723 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -8.046 -1.144 0.303 1.00 0.00 H new ATOM 524 N LYS A 36 -13.403 -3.769 0.966 1.00 0.00 N ATOM 525 CA LYS A 36 -14.758 -3.300 0.976 1.00 0.00 C ATOM 526 C LYS A 36 -14.817 -2.035 1.804 1.00 0.00 C ATOM 527 O LYS A 36 -14.437 -2.025 2.980 1.00 0.00 O ATOM 528 CB LYS A 36 -15.706 -4.365 1.533 1.00 0.00 C ATOM 529 CG LYS A 36 -17.172 -3.979 1.442 1.00 0.00 C ATOM 530 CD LYS A 36 -18.073 -5.076 1.955 1.00 0.00 C ATOM 531 CE LYS A 36 -19.523 -4.711 1.775 1.00 0.00 C ATOM 532 NZ LYS A 36 -20.422 -5.766 2.264 1.00 0.00 N ATOM 0 H LYS A 36 -13.159 -4.324 1.786 1.00 0.00 H new ATOM 0 HA LYS A 36 -15.081 -3.089 -0.043 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -15.550 -5.298 0.991 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -15.453 -4.556 2.576 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -17.345 -3.069 2.016 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -17.425 -3.755 0.406 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -17.859 -6.004 1.425 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -17.868 -5.256 3.010 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -19.732 -3.782 2.306 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -19.722 -4.526 0.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -21.410 -5.474 2.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -20.242 -6.646 1.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -20.251 -5.925 3.277 1.00 0.00 H new ATOM 546 N GLY A 37 -15.291 -1.024 1.191 1.00 0.00 N ATOM 547 CA GLY A 37 -15.270 0.297 1.708 1.00 0.00 C ATOM 548 C GLY A 37 -16.574 0.962 1.478 1.00 0.00 C ATOM 549 O GLY A 37 -17.509 0.331 0.981 1.00 0.00 O ATOM 0 H GLY A 37 -15.726 -1.091 0.271 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -15.050 0.273 2.775 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -14.474 0.869 1.231 1.00 0.00 H new ATOM 553 N LEU A 38 -16.713 2.150 1.969 1.00 0.00 N ATOM 554 CA LEU A 38 -17.873 2.973 1.649 1.00 0.00 C ATOM 555 C LEU A 38 -17.743 3.377 0.156 1.00 0.00 C ATOM 556 O LEU A 38 -16.715 3.097 -0.458 1.00 0.00 O ATOM 557 CB LEU A 38 -17.908 4.258 2.523 1.00 0.00 C ATOM 558 CG LEU A 38 -18.094 4.116 4.059 1.00 0.00 C ATOM 559 CD1 LEU A 38 -16.904 3.441 4.740 1.00 0.00 C ATOM 560 CD2 LEU A 38 -18.343 5.479 4.678 1.00 0.00 C ATOM 0 H LEU A 38 -16.042 2.590 2.599 1.00 0.00 H new ATOM 0 HA LEU A 38 -18.789 2.415 1.842 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -16.977 4.798 2.352 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -18.715 4.888 2.150 1.00 0.00 H new ATOM 0 HG LEU A 38 -18.958 3.471 4.218 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -17.091 3.369 5.812 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -16.768 2.441 4.328 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -16.004 4.030 4.567 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -18.472 5.371 5.755 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -17.492 6.130 4.478 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -19.244 5.916 4.246 1.00 0.00 H new ATOM 572 N THR A 39 -18.755 3.986 -0.445 1.00 0.00 N ATOM 573 CA THR A 39 -18.573 4.444 -1.812 1.00 0.00 C ATOM 574 C THR A 39 -17.574 5.587 -1.767 1.00 0.00 C ATOM 575 O THR A 39 -17.801 6.632 -1.180 1.00 0.00 O ATOM 576 CB THR A 39 -19.914 4.828 -2.523 1.00 0.00 C ATOM 577 OG1 THR A 39 -19.669 5.213 -3.884 1.00 0.00 O ATOM 578 CG2 THR A 39 -20.648 5.945 -1.798 1.00 0.00 C ATOM 0 H THR A 39 -19.669 4.168 -0.031 1.00 0.00 H new ATOM 0 HA THR A 39 -18.187 3.631 -2.427 1.00 0.00 H new ATOM 0 HB THR A 39 -20.550 3.943 -2.503 1.00 0.00 H new ATOM 0 HG1 THR A 39 -19.110 4.537 -4.320 1.00 0.00 H new ATOM 0 HG21 THR A 39 -21.572 6.177 -2.328 1.00 0.00 H new ATOM 0 HG22 THR A 39 -20.882 5.627 -0.782 1.00 0.00 H new ATOM 0 HG23 THR A 39 -20.017 6.833 -1.764 1.00 0.00 H new ATOM 586 N GLU A 40 -16.470 5.325 -2.313 1.00 0.00 N ATOM 587 CA GLU A 40 -15.316 6.103 -2.141 1.00 0.00 C ATOM 588 C GLU A 40 -14.727 6.454 -3.493 1.00 0.00 C ATOM 589 O GLU A 40 -15.373 6.234 -4.524 1.00 0.00 O ATOM 590 CB GLU A 40 -14.357 5.345 -1.238 1.00 0.00 C ATOM 591 CG GLU A 40 -13.356 6.204 -0.487 1.00 0.00 C ATOM 592 CD GLU A 40 -13.987 7.273 0.360 1.00 0.00 C ATOM 593 OE1 GLU A 40 -14.218 8.395 -0.153 1.00 0.00 O ATOM 594 OE2 GLU A 40 -14.198 7.049 1.571 1.00 0.00 O ATOM 0 H GLU A 40 -16.331 4.522 -2.926 1.00 0.00 H new ATOM 0 HA GLU A 40 -15.543 7.052 -1.656 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -14.939 4.777 -0.513 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -13.809 4.622 -1.843 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -12.746 5.562 0.149 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -12.683 6.673 -1.205 1.00 0.00 H new ATOM 601 N GLY A 41 -13.668 7.191 -3.454 1.00 0.00 N ATOM 602 CA GLY A 41 -12.901 7.594 -4.617 1.00 0.00 C ATOM 603 C GLY A 41 -12.325 6.415 -5.448 1.00 0.00 C ATOM 604 O GLY A 41 -12.900 5.349 -5.497 1.00 0.00 O ATOM 0 H GLY A 41 -13.285 7.552 -2.580 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -13.536 8.201 -5.263 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -12.077 8.229 -4.291 1.00 0.00 H new ATOM 608 N LEU A 42 -11.146 6.571 -6.068 1.00 0.00 N ATOM 609 CA LEU A 42 -10.795 5.620 -7.092 1.00 0.00 C ATOM 610 C LEU A 42 -9.320 5.594 -7.524 1.00 0.00 C ATOM 611 O LEU A 42 -8.988 4.977 -8.542 1.00 0.00 O ATOM 612 CB LEU A 42 -11.720 5.816 -8.297 1.00 0.00 C ATOM 613 CG LEU A 42 -11.888 7.244 -8.864 1.00 0.00 C ATOM 614 CD1 LEU A 42 -10.653 7.726 -9.617 1.00 0.00 C ATOM 615 CD2 LEU A 42 -13.117 7.320 -9.737 1.00 0.00 C ATOM 0 H LEU A 42 -10.465 7.307 -5.883 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.937 4.639 -6.638 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -11.357 5.178 -9.103 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -12.709 5.449 -8.021 1.00 0.00 H new ATOM 0 HG LEU A 42 -12.014 7.915 -8.015 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -10.827 8.734 -9.993 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -9.796 7.733 -8.944 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -10.452 7.056 -10.453 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -13.223 8.331 -10.129 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -13.019 6.618 -10.565 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -13.998 7.066 -9.148 1.00 0.00 H new ATOM 627 N HIS A 43 -8.436 6.194 -6.776 1.00 0.00 N ATOM 628 CA HIS A 43 -7.033 6.166 -7.149 1.00 0.00 C ATOM 629 C HIS A 43 -6.252 6.076 -5.880 1.00 0.00 C ATOM 630 O HIS A 43 -6.769 6.454 -4.861 1.00 0.00 O ATOM 631 CB HIS A 43 -6.643 7.435 -7.954 1.00 0.00 C ATOM 632 CG HIS A 43 -5.245 7.392 -8.527 1.00 0.00 C ATOM 633 ND1 HIS A 43 -4.941 6.742 -9.697 1.00 0.00 N ATOM 634 CD2 HIS A 43 -4.069 7.883 -8.060 1.00 0.00 C ATOM 635 CE1 HIS A 43 -3.648 6.826 -9.923 1.00 0.00 C ATOM 636 NE2 HIS A 43 -3.102 7.513 -8.946 1.00 0.00 N ATOM 0 H HIS A 43 -8.648 6.702 -5.917 1.00 0.00 H new ATOM 0 HA HIS A 43 -6.822 5.314 -7.795 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -7.355 7.569 -8.768 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -6.732 8.306 -7.305 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -3.927 8.458 -7.157 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -3.125 6.402 -10.768 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -2.110 7.735 -8.863 1.00 0.00 H new ATOM 645 N GLY A 44 -5.068 5.527 -5.922 1.00 0.00 N ATOM 646 CA GLY A 44 -4.243 5.512 -4.745 1.00 0.00 C ATOM 647 C GLY A 44 -3.130 4.515 -4.848 1.00 0.00 C ATOM 648 O GLY A 44 -2.899 3.973 -5.924 1.00 0.00 O ATOM 0 H GLY A 44 -4.657 5.090 -6.747 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.825 6.506 -4.584 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -4.858 5.280 -3.875 1.00 0.00 H new ATOM 652 N PHE A 45 -2.452 4.272 -3.729 1.00 0.00 N ATOM 653 CA PHE A 45 -1.391 3.292 -3.636 1.00 0.00 C ATOM 654 C PHE A 45 -1.086 3.054 -2.180 1.00 0.00 C ATOM 655 O PHE A 45 -1.436 3.877 -1.318 1.00 0.00 O ATOM 656 CB PHE A 45 -0.101 3.604 -4.479 1.00 0.00 C ATOM 657 CG PHE A 45 0.872 4.646 -3.969 1.00 0.00 C ATOM 658 CD1 PHE A 45 0.698 5.970 -4.245 1.00 0.00 C ATOM 659 CD2 PHE A 45 1.987 4.268 -3.244 1.00 0.00 C ATOM 660 CE1 PHE A 45 1.603 6.916 -3.806 1.00 0.00 C ATOM 661 CE2 PHE A 45 2.897 5.204 -2.795 1.00 0.00 C ATOM 662 CZ PHE A 45 2.704 6.533 -3.077 1.00 0.00 C ATOM 0 H PHE A 45 -2.633 4.761 -2.853 1.00 0.00 H new ATOM 0 HA PHE A 45 -1.760 2.378 -4.102 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.449 2.670 -4.598 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -0.424 3.913 -5.473 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.163 6.284 -4.817 1.00 0.00 H new ATOM 0 HD2 PHE A 45 2.149 3.223 -3.025 1.00 0.00 H new ATOM 0 HE1 PHE A 45 1.446 7.959 -4.036 1.00 0.00 H new ATOM 0 HE2 PHE A 45 3.758 4.891 -2.223 1.00 0.00 H new ATOM 0 HZ PHE A 45 3.411 7.272 -2.729 1.00 0.00 H new ATOM 672 N HIS A 46 -0.424 1.980 -1.889 1.00 0.00 N ATOM 673 CA HIS A 46 -0.249 1.563 -0.520 1.00 0.00 C ATOM 674 C HIS A 46 1.035 2.169 0.008 1.00 0.00 C ATOM 675 O HIS A 46 1.846 2.609 -0.765 1.00 0.00 O ATOM 676 CB HIS A 46 -0.200 0.035 -0.385 1.00 0.00 C ATOM 677 CG HIS A 46 -1.235 -0.793 -1.138 1.00 0.00 C ATOM 678 ND1 HIS A 46 -1.184 -2.155 -1.170 1.00 0.00 N ATOM 679 CD2 HIS A 46 -2.285 -0.454 -1.930 1.00 0.00 C ATOM 680 CE1 HIS A 46 -2.128 -2.626 -1.938 1.00 0.00 C ATOM 681 NE2 HIS A 46 -2.822 -1.615 -2.417 1.00 0.00 N ATOM 0 H HIS A 46 0.009 1.368 -2.580 1.00 0.00 H new ATOM 0 HA HIS A 46 -1.105 1.909 0.059 1.00 0.00 H new ATOM 0 HB2 HIS A 46 0.788 -0.295 -0.707 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -0.287 -0.208 0.674 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -0.505 -2.725 -0.666 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -2.632 0.547 -2.137 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -2.310 -3.670 -2.146 1.00 0.00 H new ATOM 690 N VAL A 47 1.200 2.165 1.310 1.00 0.00 N ATOM 691 CA VAL A 47 2.358 2.835 2.013 1.00 0.00 C ATOM 692 C VAL A 47 2.473 2.366 3.488 1.00 0.00 C ATOM 693 O VAL A 47 1.802 2.879 4.354 1.00 0.00 O ATOM 694 CB VAL A 47 2.274 4.457 2.027 1.00 0.00 C ATOM 695 CG1 VAL A 47 3.328 5.095 2.939 1.00 0.00 C ATOM 696 CG2 VAL A 47 2.441 5.075 0.654 1.00 0.00 C ATOM 0 H VAL A 47 0.551 1.704 1.948 1.00 0.00 H new ATOM 0 HA VAL A 47 3.232 2.538 1.433 1.00 0.00 H new ATOM 0 HB VAL A 47 1.272 4.663 2.404 1.00 0.00 H new ATOM 0 HG11 VAL A 47 3.226 6.180 2.910 1.00 0.00 H new ATOM 0 HG12 VAL A 47 3.185 4.744 3.961 1.00 0.00 H new ATOM 0 HG13 VAL A 47 4.324 4.815 2.595 1.00 0.00 H new ATOM 0 HG21 VAL A 47 2.375 6.160 0.733 1.00 0.00 H new ATOM 0 HG22 VAL A 47 3.414 4.800 0.247 1.00 0.00 H new ATOM 0 HG23 VAL A 47 1.655 4.711 -0.007 1.00 0.00 H new ATOM 706 N HIS A 48 3.188 1.315 3.715 1.00 0.00 N ATOM 707 CA HIS A 48 3.615 0.926 5.039 1.00 0.00 C ATOM 708 C HIS A 48 5.183 1.113 5.282 1.00 0.00 C ATOM 709 O HIS A 48 5.981 0.288 4.869 1.00 0.00 O ATOM 710 CB HIS A 48 3.155 -0.543 5.342 1.00 0.00 C ATOM 711 CG HIS A 48 3.862 -1.691 4.613 1.00 0.00 C ATOM 712 ND1 HIS A 48 3.409 -2.252 3.463 1.00 0.00 N ATOM 713 CD2 HIS A 48 4.965 -2.407 4.940 1.00 0.00 C ATOM 714 CE1 HIS A 48 4.192 -3.252 3.129 1.00 0.00 C ATOM 715 NE2 HIS A 48 5.139 -3.359 4.000 1.00 0.00 N ATOM 0 H HIS A 48 3.504 0.683 2.979 1.00 0.00 H new ATOM 0 HA HIS A 48 3.131 1.603 5.743 1.00 0.00 H new ATOM 0 HB2 HIS A 48 3.265 -0.712 6.413 1.00 0.00 H new ATOM 0 HB3 HIS A 48 2.091 -0.611 5.116 1.00 0.00 H new ATOM 0 HD1 HIS A 48 2.589 -1.945 2.940 1.00 0.00 H new ATOM 0 HD2 HIS A 48 5.595 -2.244 5.802 1.00 0.00 H new ATOM 0 HE1 HIS A 48 4.064 -3.885 2.263 1.00 0.00 H new ATOM 724 N GLU A 49 5.611 2.192 5.965 1.00 0.00 N ATOM 725 CA GLU A 49 7.054 2.321 6.325 1.00 0.00 C ATOM 726 C GLU A 49 7.245 2.475 7.881 1.00 0.00 C ATOM 727 O GLU A 49 6.596 3.318 8.495 1.00 0.00 O ATOM 728 CB GLU A 49 7.708 3.503 5.598 1.00 0.00 C ATOM 729 CG GLU A 49 9.096 3.185 5.030 1.00 0.00 C ATOM 730 CD GLU A 49 10.028 2.544 6.038 1.00 0.00 C ATOM 731 OE1 GLU A 49 10.035 1.285 6.135 1.00 0.00 O ATOM 732 OE2 GLU A 49 10.758 3.282 6.744 1.00 0.00 O ATOM 0 H GLU A 49 5.016 2.961 6.272 1.00 0.00 H new ATOM 0 HA GLU A 49 7.546 1.403 6.005 1.00 0.00 H new ATOM 0 HB2 GLU A 49 7.057 3.823 4.785 1.00 0.00 H new ATOM 0 HB3 GLU A 49 7.791 4.342 6.289 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.986 2.519 4.174 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.549 4.105 4.662 1.00 0.00 H new ATOM 739 N PHE A 50 8.038 1.547 8.474 1.00 0.00 N ATOM 740 CA PHE A 50 8.449 1.501 9.911 1.00 0.00 C ATOM 741 C PHE A 50 7.296 1.021 10.795 1.00 0.00 C ATOM 742 O PHE A 50 6.440 1.787 11.157 1.00 0.00 O ATOM 743 CB PHE A 50 9.028 2.844 10.392 1.00 0.00 C ATOM 744 CG PHE A 50 9.640 2.787 11.764 1.00 0.00 C ATOM 745 CD1 PHE A 50 10.920 2.296 11.937 1.00 0.00 C ATOM 746 CD2 PHE A 50 8.938 3.216 12.875 1.00 0.00 C ATOM 747 CE1 PHE A 50 11.489 2.234 13.189 1.00 0.00 C ATOM 748 CE2 PHE A 50 9.498 3.157 14.127 1.00 0.00 C ATOM 749 CZ PHE A 50 10.778 2.664 14.286 1.00 0.00 C ATOM 0 H PHE A 50 8.430 0.770 7.942 1.00 0.00 H new ATOM 0 HA PHE A 50 9.255 0.773 9.999 1.00 0.00 H new ATOM 0 HB2 PHE A 50 9.784 3.178 9.681 1.00 0.00 H new ATOM 0 HB3 PHE A 50 8.235 3.592 10.389 1.00 0.00 H new ATOM 0 HD1 PHE A 50 11.481 1.957 11.079 1.00 0.00 H new ATOM 0 HD2 PHE A 50 7.936 3.602 12.756 1.00 0.00 H new ATOM 0 HE1 PHE A 50 12.491 1.849 13.310 1.00 0.00 H new ATOM 0 HE2 PHE A 50 8.938 3.496 14.986 1.00 0.00 H new ATOM 0 HZ PHE A 50 11.221 2.616 15.270 1.00 0.00 H new ATOM 759 N GLY A 51 7.261 -0.290 11.058 1.00 0.00 N ATOM 760 CA GLY A 51 6.151 -0.941 11.729 1.00 0.00 C ATOM 761 C GLY A 51 5.754 -0.396 13.049 1.00 0.00 C ATOM 762 O GLY A 51 6.613 -0.187 13.911 1.00 0.00 O ATOM 0 H GLY A 51 8.015 -0.928 10.805 1.00 0.00 H new ATOM 0 HA2 GLY A 51 5.284 -0.899 11.070 1.00 0.00 H new ATOM 0 HA3 GLY A 51 6.403 -1.994 11.858 1.00 0.00 H new ATOM 766 N ASP A 52 4.430 -0.212 13.251 1.00 0.00 N ATOM 767 CA ASP A 52 3.999 0.362 14.545 1.00 0.00 C ATOM 768 C ASP A 52 2.751 -0.233 15.094 1.00 0.00 C ATOM 769 O ASP A 52 2.790 -1.221 15.812 1.00 0.00 O ATOM 770 CB ASP A 52 3.788 1.882 14.515 1.00 0.00 C ATOM 771 CG ASP A 52 5.022 2.684 14.394 1.00 0.00 C ATOM 772 OD1 ASP A 52 5.728 2.854 15.403 1.00 0.00 O ATOM 773 OD2 ASP A 52 5.267 3.205 13.301 1.00 0.00 O ATOM 0 H ASP A 52 3.688 -0.434 12.588 1.00 0.00 H new ATOM 0 HA ASP A 52 4.841 0.113 15.190 1.00 0.00 H new ATOM 0 HB2 ASP A 52 3.132 2.126 13.680 1.00 0.00 H new ATOM 0 HB3 ASP A 52 3.268 2.179 15.426 1.00 0.00 H new ATOM 778 N ASN A 53 1.632 0.307 14.690 1.00 0.00 N ATOM 779 CA ASN A 53 0.374 -0.034 15.316 1.00 0.00 C ATOM 780 C ASN A 53 -0.561 -0.657 14.328 1.00 0.00 C ATOM 781 O ASN A 53 -0.637 -0.214 13.200 1.00 0.00 O ATOM 782 CB ASN A 53 -0.242 1.227 15.962 1.00 0.00 C ATOM 783 CG ASN A 53 -1.583 0.995 16.649 1.00 0.00 C ATOM 784 OD1 ASN A 53 -1.880 -0.101 17.138 1.00 0.00 O ATOM 785 ND2 ASN A 53 -2.389 2.020 16.705 1.00 0.00 N ATOM 0 H ASN A 53 1.562 0.985 13.931 1.00 0.00 H new ATOM 0 HA ASN A 53 0.552 -0.771 16.099 1.00 0.00 H new ATOM 0 HB2 ASN A 53 0.462 1.626 16.692 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -0.369 1.989 15.193 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -3.296 1.931 17.163 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -2.112 2.910 16.291 1.00 0.00 H new ATOM 792 N THR A 54 -1.249 -1.675 14.777 1.00 0.00 N ATOM 793 CA THR A 54 -2.182 -2.499 14.017 1.00 0.00 C ATOM 794 C THR A 54 -3.139 -1.729 13.092 1.00 0.00 C ATOM 795 O THR A 54 -3.360 -2.154 11.971 1.00 0.00 O ATOM 796 CB THR A 54 -2.974 -3.468 14.974 1.00 0.00 C ATOM 797 OG1 THR A 54 -3.868 -4.314 14.246 1.00 0.00 O ATOM 798 CG2 THR A 54 -3.757 -2.707 16.041 1.00 0.00 C ATOM 0 H THR A 54 -1.174 -1.979 15.748 1.00 0.00 H new ATOM 0 HA THR A 54 -1.557 -3.079 13.338 1.00 0.00 H new ATOM 0 HB THR A 54 -2.223 -4.085 15.468 1.00 0.00 H new ATOM 0 HG1 THR A 54 -4.342 -4.903 14.870 1.00 0.00 H new ATOM 0 HG21 THR A 54 -4.287 -3.415 16.678 1.00 0.00 H new ATOM 0 HG22 THR A 54 -3.068 -2.119 16.648 1.00 0.00 H new ATOM 0 HG23 THR A 54 -4.475 -2.043 15.561 1.00 0.00 H new ATOM 806 N ALA A 55 -3.649 -0.601 13.531 1.00 0.00 N ATOM 807 CA ALA A 55 -4.602 0.155 12.744 1.00 0.00 C ATOM 808 C ALA A 55 -4.236 1.628 12.745 1.00 0.00 C ATOM 809 O ALA A 55 -5.023 2.487 12.337 1.00 0.00 O ATOM 810 CB ALA A 55 -6.002 -0.052 13.305 1.00 0.00 C ATOM 0 H ALA A 55 -3.420 -0.184 14.433 1.00 0.00 H new ATOM 0 HA ALA A 55 -4.579 -0.198 11.713 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -6.719 0.517 12.713 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -6.257 -1.111 13.265 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -6.034 0.290 14.340 1.00 0.00 H new ATOM 816 N GLY A 56 -3.021 1.916 13.149 1.00 0.00 N ATOM 817 CA GLY A 56 -2.603 3.287 13.242 1.00 0.00 C ATOM 818 C GLY A 56 -1.321 3.531 12.500 1.00 0.00 C ATOM 819 O GLY A 56 -0.263 3.006 12.876 1.00 0.00 O ATOM 0 H GLY A 56 -2.317 1.228 13.414 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -3.384 3.933 12.841 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -2.473 3.557 14.290 1.00 0.00 H new ATOM 823 N CYS A 57 -1.381 4.263 11.421 1.00 0.00 N ATOM 824 CA CYS A 57 -0.198 4.523 10.685 1.00 0.00 C ATOM 825 C CYS A 57 0.440 5.857 10.985 1.00 0.00 C ATOM 826 O CYS A 57 0.157 6.851 10.357 1.00 0.00 O ATOM 827 CB CYS A 57 -0.346 4.247 9.190 1.00 0.00 C ATOM 828 SG CYS A 57 -1.753 5.007 8.307 1.00 0.00 S ATOM 0 H CYS A 57 -2.232 4.681 11.044 1.00 0.00 H new ATOM 0 HA CYS A 57 0.520 3.790 11.053 1.00 0.00 H new ATOM 0 HB2 CYS A 57 0.571 4.573 8.699 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -0.413 3.167 9.056 1.00 0.00 H new ATOM 833 N THR A 58 1.286 5.864 11.965 1.00 0.00 N ATOM 834 CA THR A 58 2.021 7.028 12.310 1.00 0.00 C ATOM 835 C THR A 58 3.188 7.224 11.342 1.00 0.00 C ATOM 836 O THR A 58 3.226 8.180 10.568 1.00 0.00 O ATOM 837 CB THR A 58 2.531 6.857 13.739 1.00 0.00 C ATOM 838 OG1 THR A 58 3.034 5.502 13.870 1.00 0.00 O ATOM 839 CG2 THR A 58 1.403 7.078 14.734 1.00 0.00 C ATOM 0 H THR A 58 1.484 5.053 12.550 1.00 0.00 H new ATOM 0 HA THR A 58 1.385 7.911 12.245 1.00 0.00 H new ATOM 0 HB THR A 58 3.316 7.585 13.945 1.00 0.00 H new ATOM 0 HG1 THR A 58 3.370 5.365 14.780 1.00 0.00 H new ATOM 0 HG21 THR A 58 1.783 6.953 15.748 1.00 0.00 H new ATOM 0 HG22 THR A 58 1.007 8.087 14.617 1.00 0.00 H new ATOM 0 HG23 THR A 58 0.610 6.353 14.551 1.00 0.00 H new ATOM 847 N SER A 59 4.071 6.266 11.337 1.00 0.00 N ATOM 848 CA SER A 59 5.286 6.325 10.575 1.00 0.00 C ATOM 849 C SER A 59 5.100 6.271 9.068 1.00 0.00 C ATOM 850 O SER A 59 5.910 6.816 8.319 1.00 0.00 O ATOM 851 CB SER A 59 6.211 5.249 11.060 1.00 0.00 C ATOM 852 OG SER A 59 6.374 5.368 12.467 1.00 0.00 O ATOM 0 H SER A 59 3.964 5.405 11.873 1.00 0.00 H new ATOM 0 HA SER A 59 5.722 7.309 10.745 1.00 0.00 H new ATOM 0 HB2 SER A 59 5.808 4.267 10.811 1.00 0.00 H new ATOM 0 HB3 SER A 59 7.177 5.332 10.562 1.00 0.00 H new ATOM 0 HG SER A 59 6.238 4.493 12.887 1.00 0.00 H new ATOM 858 N ALA A 60 4.039 5.639 8.612 1.00 0.00 N ATOM 859 CA ALA A 60 3.749 5.581 7.180 1.00 0.00 C ATOM 860 C ALA A 60 3.124 6.886 6.692 1.00 0.00 C ATOM 861 O ALA A 60 2.939 7.095 5.480 1.00 0.00 O ATOM 862 CB ALA A 60 2.845 4.417 6.873 1.00 0.00 C ATOM 0 H ALA A 60 3.361 5.158 9.203 1.00 0.00 H new ATOM 0 HA ALA A 60 4.691 5.440 6.651 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.639 4.389 5.803 1.00 0.00 H new ATOM 0 HB2 ALA A 60 3.332 3.489 7.174 1.00 0.00 H new ATOM 0 HB3 ALA A 60 1.909 4.529 7.420 1.00 0.00 H new ATOM 868 N GLY A 61 2.784 7.734 7.644 1.00 0.00 N ATOM 869 CA GLY A 61 2.192 9.012 7.366 1.00 0.00 C ATOM 870 C GLY A 61 3.081 9.907 6.521 1.00 0.00 C ATOM 871 O GLY A 61 2.723 10.219 5.377 1.00 0.00 O ATOM 0 H GLY A 61 2.915 7.546 8.638 1.00 0.00 H new ATOM 0 HA2 GLY A 61 1.243 8.862 6.852 1.00 0.00 H new ATOM 0 HA3 GLY A 61 1.969 9.515 8.307 1.00 0.00 H new ATOM 875 N PRO A 62 4.271 10.334 7.032 1.00 0.00 N ATOM 876 CA PRO A 62 5.171 11.233 6.289 1.00 0.00 C ATOM 877 C PRO A 62 5.927 10.552 5.117 1.00 0.00 C ATOM 878 O PRO A 62 7.162 10.649 5.017 1.00 0.00 O ATOM 879 CB PRO A 62 6.163 11.687 7.368 1.00 0.00 C ATOM 880 CG PRO A 62 6.203 10.562 8.336 1.00 0.00 C ATOM 881 CD PRO A 62 4.811 10.014 8.375 1.00 0.00 C ATOM 0 HA PRO A 62 4.614 12.036 5.807 1.00 0.00 H new ATOM 0 HB2 PRO A 62 7.148 11.881 6.944 1.00 0.00 H new ATOM 0 HB3 PRO A 62 5.834 12.610 7.846 1.00 0.00 H new ATOM 0 HG2 PRO A 62 6.916 9.800 8.021 1.00 0.00 H new ATOM 0 HG3 PRO A 62 6.517 10.904 9.322 1.00 0.00 H new ATOM 0 HD2 PRO A 62 4.808 8.940 8.563 1.00 0.00 H new ATOM 0 HD3 PRO A 62 4.220 10.477 9.165 1.00 0.00 H new ATOM 889 N HIS A 63 5.159 9.900 4.238 1.00 0.00 N ATOM 890 CA HIS A 63 5.625 9.371 2.940 1.00 0.00 C ATOM 891 C HIS A 63 6.521 8.117 3.127 1.00 0.00 C ATOM 892 O HIS A 63 6.971 7.811 4.231 1.00 0.00 O ATOM 893 CB HIS A 63 6.335 10.514 2.132 1.00 0.00 C ATOM 894 CG HIS A 63 6.472 10.319 0.638 1.00 0.00 C ATOM 895 ND1 HIS A 63 5.545 10.799 -0.266 1.00 0.00 N ATOM 896 CD2 HIS A 63 7.438 9.733 -0.111 1.00 0.00 C ATOM 897 CE1 HIS A 63 5.937 10.511 -1.488 1.00 0.00 C ATOM 898 NE2 HIS A 63 7.074 9.867 -1.417 1.00 0.00 N ATOM 0 H HIS A 63 4.170 9.718 4.408 1.00 0.00 H new ATOM 0 HA HIS A 63 4.767 9.036 2.358 1.00 0.00 H new ATOM 0 HB2 HIS A 63 5.787 11.440 2.303 1.00 0.00 H new ATOM 0 HB3 HIS A 63 7.333 10.653 2.548 1.00 0.00 H new ATOM 0 HD2 HIS A 63 8.330 9.250 0.259 1.00 0.00 H new ATOM 0 HE1 HIS A 63 5.410 10.763 -2.396 1.00 0.00 H new ATOM 0 HE2 HIS A 63 7.605 9.519 -2.215 1.00 0.00 H new ATOM 907 N PHE A 64 6.714 7.375 2.056 1.00 0.00 N ATOM 908 CA PHE A 64 7.525 6.167 2.073 1.00 0.00 C ATOM 909 C PHE A 64 8.949 6.569 1.675 1.00 0.00 C ATOM 910 O PHE A 64 9.163 7.714 1.272 1.00 0.00 O ATOM 911 CB PHE A 64 6.960 5.184 1.052 1.00 0.00 C ATOM 912 CG PHE A 64 7.076 3.723 1.419 1.00 0.00 C ATOM 913 CD1 PHE A 64 8.289 3.057 1.421 1.00 0.00 C ATOM 914 CD2 PHE A 64 5.947 3.016 1.742 1.00 0.00 C ATOM 915 CE1 PHE A 64 8.353 1.725 1.746 1.00 0.00 C ATOM 916 CE2 PHE A 64 6.003 1.694 2.062 1.00 0.00 C ATOM 917 CZ PHE A 64 7.197 1.044 2.070 1.00 0.00 C ATOM 0 H PHE A 64 6.313 7.591 1.143 1.00 0.00 H new ATOM 0 HA PHE A 64 7.523 5.698 3.057 1.00 0.00 H new ATOM 0 HB2 PHE A 64 5.907 5.418 0.893 1.00 0.00 H new ATOM 0 HB3 PHE A 64 7.469 5.343 0.101 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.193 3.590 1.165 1.00 0.00 H new ATOM 0 HD2 PHE A 64 4.991 3.519 1.743 1.00 0.00 H new ATOM 0 HE1 PHE A 64 9.303 1.212 1.748 1.00 0.00 H new ATOM 0 HE2 PHE A 64 5.097 1.161 2.310 1.00 0.00 H new ATOM 0 HZ PHE A 64 7.241 -0.003 2.329 1.00 0.00 H new ATOM 927 N ASN A 65 9.906 5.673 1.798 1.00 0.00 N ATOM 928 CA ASN A 65 11.271 6.013 1.441 1.00 0.00 C ATOM 929 C ASN A 65 11.395 6.180 -0.107 1.00 0.00 C ATOM 930 O ASN A 65 10.817 5.411 -0.880 1.00 0.00 O ATOM 931 CB ASN A 65 12.226 4.888 1.921 1.00 0.00 C ATOM 932 CG ASN A 65 13.696 5.310 2.001 1.00 0.00 C ATOM 933 OD1 ASN A 65 14.014 6.433 2.351 1.00 0.00 O ATOM 934 ND2 ASN A 65 14.593 4.433 1.637 1.00 0.00 N ATOM 0 H ASN A 65 9.771 4.720 2.136 1.00 0.00 H new ATOM 0 HA ASN A 65 11.542 6.953 1.922 1.00 0.00 H new ATOM 0 HB2 ASN A 65 11.903 4.546 2.904 1.00 0.00 H new ATOM 0 HB3 ASN A 65 12.139 4.038 1.244 1.00 0.00 H new ATOM 0 HD21 ASN A 65 15.582 4.683 1.642 1.00 0.00 H new ATOM 0 HD22 ASN A 65 14.304 3.498 1.348 1.00 0.00 H new ATOM 941 N PRO A 66 12.174 7.176 -0.527 1.00 0.00 N ATOM 942 CA PRO A 66 12.476 7.474 -1.906 1.00 0.00 C ATOM 943 C PRO A 66 13.501 6.542 -2.528 1.00 0.00 C ATOM 944 O PRO A 66 13.748 6.626 -3.719 1.00 0.00 O ATOM 945 CB PRO A 66 12.994 8.909 -1.878 1.00 0.00 C ATOM 946 CG PRO A 66 13.601 9.044 -0.542 1.00 0.00 C ATOM 947 CD PRO A 66 12.750 8.223 0.365 1.00 0.00 C ATOM 0 HA PRO A 66 11.590 7.342 -2.527 1.00 0.00 H new ATOM 0 HB2 PRO A 66 13.724 9.085 -2.668 1.00 0.00 H new ATOM 0 HB3 PRO A 66 12.187 9.627 -2.024 1.00 0.00 H new ATOM 0 HG2 PRO A 66 14.632 8.689 -0.541 1.00 0.00 H new ATOM 0 HG3 PRO A 66 13.622 10.086 -0.224 1.00 0.00 H new ATOM 0 HD2 PRO A 66 13.336 7.782 1.171 1.00 0.00 H new ATOM 0 HD3 PRO A 66 11.969 8.824 0.831 1.00 0.00 H new ATOM 955 N LEU A 67 14.156 5.660 -1.739 1.00 0.00 N ATOM 956 CA LEU A 67 15.299 4.912 -2.291 1.00 0.00 C ATOM 957 C LEU A 67 14.794 3.684 -3.037 1.00 0.00 C ATOM 958 O LEU A 67 15.510 2.746 -3.379 1.00 0.00 O ATOM 959 CB LEU A 67 16.331 4.578 -1.202 1.00 0.00 C ATOM 960 CG LEU A 67 17.633 3.902 -1.669 1.00 0.00 C ATOM 961 CD1 LEU A 67 18.348 4.763 -2.697 1.00 0.00 C ATOM 962 CD2 LEU A 67 18.544 3.631 -0.494 1.00 0.00 C ATOM 0 H LEU A 67 13.926 5.457 -0.766 1.00 0.00 H new ATOM 0 HA LEU A 67 15.828 5.537 -3.010 1.00 0.00 H new ATOM 0 HB2 LEU A 67 16.593 5.502 -0.686 1.00 0.00 H new ATOM 0 HB3 LEU A 67 15.854 3.928 -0.469 1.00 0.00 H new ATOM 0 HG LEU A 67 17.371 2.952 -2.134 1.00 0.00 H new ATOM 0 HD11 LEU A 67 19.265 4.266 -3.013 1.00 0.00 H new ATOM 0 HD12 LEU A 67 17.700 4.912 -3.561 1.00 0.00 H new ATOM 0 HD13 LEU A 67 18.592 5.729 -2.256 1.00 0.00 H new ATOM 0 HD21 LEU A 67 19.458 3.153 -0.845 1.00 0.00 H new ATOM 0 HD22 LEU A 67 18.792 4.571 -0.001 1.00 0.00 H new ATOM 0 HD23 LEU A 67 18.039 2.973 0.213 1.00 0.00 H new ATOM 974 N SER A 68 13.564 3.737 -3.313 1.00 0.00 N ATOM 975 CA SER A 68 12.925 2.799 -4.055 1.00 0.00 C ATOM 976 C SER A 68 13.203 3.081 -5.526 1.00 0.00 C ATOM 977 O SER A 68 14.099 2.499 -6.130 1.00 0.00 O ATOM 978 CB SER A 68 11.476 2.936 -3.707 1.00 0.00 C ATOM 979 OG SER A 68 11.083 4.302 -3.775 1.00 0.00 O ATOM 0 H SER A 68 12.955 4.492 -2.998 1.00 0.00 H new ATOM 0 HA SER A 68 13.256 1.779 -3.859 1.00 0.00 H new ATOM 0 HB2 SER A 68 10.872 2.341 -4.392 1.00 0.00 H new ATOM 0 HB3 SER A 68 11.297 2.548 -2.705 1.00 0.00 H new ATOM 0 HG SER A 68 10.105 4.360 -3.805 1.00 0.00 H new ATOM 985 N ARG A 69 12.409 3.922 -6.100 1.00 0.00 N ATOM 986 CA ARG A 69 12.699 4.478 -7.387 1.00 0.00 C ATOM 987 C ARG A 69 12.407 5.964 -7.346 1.00 0.00 C ATOM 988 O ARG A 69 12.270 6.604 -8.373 1.00 0.00 O ATOM 989 CB ARG A 69 11.883 3.812 -8.413 1.00 0.00 C ATOM 990 CG ARG A 69 12.316 4.031 -9.852 1.00 0.00 C ATOM 991 CD ARG A 69 11.300 3.466 -10.826 1.00 0.00 C ATOM 992 NE ARG A 69 11.790 3.519 -12.191 1.00 0.00 N ATOM 993 CZ ARG A 69 11.054 3.754 -13.282 1.00 0.00 C ATOM 994 NH1 ARG A 69 9.759 4.053 -13.184 1.00 0.00 N ATOM 995 NH2 ARG A 69 11.622 3.707 -14.473 1.00 0.00 N ATOM 0 H ARG A 69 11.534 4.248 -5.690 1.00 0.00 H new ATOM 0 HA ARG A 69 13.748 4.324 -7.639 1.00 0.00 H new ATOM 0 HB2 ARG A 69 11.886 2.741 -8.212 1.00 0.00 H new ATOM 0 HB3 ARG A 69 10.853 4.153 -8.308 1.00 0.00 H new ATOM 0 HG2 ARG A 69 12.446 5.097 -10.037 1.00 0.00 H new ATOM 0 HG3 ARG A 69 13.284 3.559 -10.018 1.00 0.00 H new ATOM 0 HD2 ARG A 69 11.072 2.434 -10.559 1.00 0.00 H new ATOM 0 HD3 ARG A 69 10.369 4.028 -10.750 1.00 0.00 H new ATOM 0 HE ARG A 69 12.788 3.362 -12.331 1.00 0.00 H new ATOM 0 HH11 ARG A 69 9.316 4.105 -12.267 1.00 0.00 H new ATOM 0 HH12 ARG A 69 9.211 4.230 -14.026 1.00 0.00 H new ATOM 0 HH21 ARG A 69 12.616 3.493 -14.556 1.00 0.00 H new ATOM 0 HH22 ARG A 69 11.067 3.885 -15.310 1.00 0.00 H new ATOM 1009 N LYS A 70 12.173 6.459 -6.137 1.00 0.00 N ATOM 1010 CA LYS A 70 12.004 7.893 -5.817 1.00 0.00 C ATOM 1011 C LYS A 70 10.640 8.453 -6.250 1.00 0.00 C ATOM 1012 O LYS A 70 10.273 9.561 -5.881 1.00 0.00 O ATOM 1013 CB LYS A 70 13.187 8.715 -6.392 1.00 0.00 C ATOM 1014 CG LYS A 70 13.323 10.135 -5.864 1.00 0.00 C ATOM 1015 CD LYS A 70 14.566 10.795 -6.432 1.00 0.00 C ATOM 1016 CE LYS A 70 14.797 12.175 -5.844 1.00 0.00 C ATOM 1017 NZ LYS A 70 16.011 12.807 -6.402 1.00 0.00 N ATOM 0 H LYS A 70 12.091 5.861 -5.315 1.00 0.00 H new ATOM 0 HA LYS A 70 12.017 7.987 -4.731 1.00 0.00 H new ATOM 0 HB2 LYS A 70 14.113 8.179 -6.183 1.00 0.00 H new ATOM 0 HB3 LYS A 70 13.082 8.759 -7.476 1.00 0.00 H new ATOM 0 HG2 LYS A 70 12.440 10.716 -6.133 1.00 0.00 H new ATOM 0 HG3 LYS A 70 13.376 10.121 -4.775 1.00 0.00 H new ATOM 0 HD2 LYS A 70 15.434 10.166 -6.232 1.00 0.00 H new ATOM 0 HD3 LYS A 70 14.472 10.874 -7.515 1.00 0.00 H new ATOM 0 HE2 LYS A 70 13.932 12.807 -6.045 1.00 0.00 H new ATOM 0 HE3 LYS A 70 14.891 12.099 -4.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 16.138 13.748 -5.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 16.840 12.216 -6.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 15.910 12.902 -7.433 1.00 0.00 H new ATOM 1031 N HIS A 71 9.881 7.685 -6.995 1.00 0.00 N ATOM 1032 CA HIS A 71 8.591 8.168 -7.455 1.00 0.00 C ATOM 1033 C HIS A 71 7.443 7.649 -6.607 1.00 0.00 C ATOM 1034 O HIS A 71 6.685 8.438 -6.081 1.00 0.00 O ATOM 1035 CB HIS A 71 8.361 7.918 -8.949 1.00 0.00 C ATOM 1036 CG HIS A 71 9.290 8.693 -9.845 1.00 0.00 C ATOM 1037 ND1 HIS A 71 9.069 10.000 -10.221 1.00 0.00 N ATOM 1038 CD2 HIS A 71 10.446 8.332 -10.440 1.00 0.00 C ATOM 1039 CE1 HIS A 71 10.042 10.399 -11.005 1.00 0.00 C ATOM 1040 NE2 HIS A 71 10.893 9.408 -11.155 1.00 0.00 N ATOM 0 H HIS A 71 10.123 6.740 -7.294 1.00 0.00 H new ATOM 0 HA HIS A 71 8.614 9.250 -7.326 1.00 0.00 H new ATOM 0 HB2 HIS A 71 8.479 6.854 -9.152 1.00 0.00 H new ATOM 0 HB3 HIS A 71 7.332 8.177 -9.197 1.00 0.00 H new ATOM 0 HD2 HIS A 71 10.930 7.369 -10.365 1.00 0.00 H new ATOM 0 HE1 HIS A 71 10.129 11.378 -11.453 1.00 0.00 H new ATOM 0 HE2 HIS A 71 11.746 9.437 -11.713 1.00 0.00 H new ATOM 1049 N GLY A 72 7.341 6.337 -6.445 1.00 0.00 N ATOM 1050 CA GLY A 72 6.257 5.775 -5.620 1.00 0.00 C ATOM 1051 C GLY A 72 4.985 5.493 -6.410 1.00 0.00 C ATOM 1052 O GLY A 72 3.896 5.570 -5.874 1.00 0.00 O ATOM 0 H GLY A 72 7.972 5.650 -6.857 1.00 0.00 H new ATOM 0 HA2 GLY A 72 6.603 4.850 -5.159 1.00 0.00 H new ATOM 0 HA3 GLY A 72 6.028 6.469 -4.811 1.00 0.00 H new ATOM 1056 N GLY A 73 5.127 5.169 -7.693 1.00 0.00 N ATOM 1057 CA GLY A 73 3.959 4.988 -8.543 1.00 0.00 C ATOM 1058 C GLY A 73 3.132 3.728 -8.240 1.00 0.00 C ATOM 1059 O GLY A 73 3.699 2.667 -7.999 1.00 0.00 O ATOM 0 H GLY A 73 6.024 5.029 -8.158 1.00 0.00 H new ATOM 0 HA2 GLY A 73 3.315 5.862 -8.443 1.00 0.00 H new ATOM 0 HA3 GLY A 73 4.285 4.950 -9.582 1.00 0.00 H new ATOM 1063 N PRO A 74 1.767 3.817 -8.362 1.00 0.00 N ATOM 1064 CA PRO A 74 0.823 2.685 -8.094 1.00 0.00 C ATOM 1065 C PRO A 74 0.812 1.684 -9.237 1.00 0.00 C ATOM 1066 O PRO A 74 0.235 0.614 -9.153 1.00 0.00 O ATOM 1067 CB PRO A 74 -0.557 3.367 -8.050 1.00 0.00 C ATOM 1068 CG PRO A 74 -0.300 4.839 -8.071 1.00 0.00 C ATOM 1069 CD PRO A 74 1.027 5.033 -8.731 1.00 0.00 C ATOM 0 HA PRO A 74 1.097 2.144 -7.189 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -1.166 3.067 -8.903 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -1.103 3.081 -7.151 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -1.085 5.361 -8.618 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -0.292 5.245 -7.060 1.00 0.00 H new ATOM 0 HD2 PRO A 74 0.928 5.132 -9.812 1.00 0.00 H new ATOM 0 HD3 PRO A 74 1.527 5.933 -8.373 1.00 0.00 H new ATOM 1077 N LYS A 75 1.454 2.085 -10.281 1.00 0.00 N ATOM 1078 CA LYS A 75 1.574 1.345 -11.540 1.00 0.00 C ATOM 1079 C LYS A 75 2.640 0.243 -11.481 1.00 0.00 C ATOM 1080 O LYS A 75 2.974 -0.367 -12.505 1.00 0.00 O ATOM 1081 CB LYS A 75 1.858 2.324 -12.676 1.00 0.00 C ATOM 1082 CG LYS A 75 3.068 3.225 -12.429 1.00 0.00 C ATOM 1083 CD LYS A 75 3.266 4.233 -13.549 1.00 0.00 C ATOM 1084 CE LYS A 75 2.092 5.190 -13.649 1.00 0.00 C ATOM 1085 NZ LYS A 75 2.259 6.167 -14.734 1.00 0.00 N ATOM 0 H LYS A 75 1.942 2.980 -10.304 1.00 0.00 H new ATOM 0 HA LYS A 75 0.627 0.837 -11.722 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.018 1.762 -13.596 1.00 0.00 H new ATOM 0 HB3 LYS A 75 0.978 2.948 -12.833 1.00 0.00 H new ATOM 0 HG2 LYS A 75 2.940 3.753 -11.484 1.00 0.00 H new ATOM 0 HG3 LYS A 75 3.963 2.611 -12.332 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.183 4.797 -13.375 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.390 3.707 -14.496 1.00 0.00 H new ATOM 0 HE2 LYS A 75 1.176 4.622 -13.812 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.975 5.718 -12.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 1.433 6.798 -14.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 3.118 6.728 -14.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 2.344 5.667 -15.642 1.00 0.00 H new ATOM 1099 N ASP A 76 3.133 -0.008 -10.281 1.00 0.00 N ATOM 1100 CA ASP A 76 4.103 -1.070 -9.975 1.00 0.00 C ATOM 1101 C ASP A 76 5.425 -0.835 -10.706 1.00 0.00 C ATOM 1102 O ASP A 76 5.687 -1.425 -11.755 1.00 0.00 O ATOM 1103 CB ASP A 76 3.575 -2.484 -10.335 1.00 0.00 C ATOM 1104 CG ASP A 76 2.130 -2.757 -9.966 1.00 0.00 C ATOM 1105 OD1 ASP A 76 1.721 -2.450 -8.859 1.00 0.00 O ATOM 1106 OD2 ASP A 76 1.352 -3.243 -10.868 1.00 0.00 O ATOM 0 H ASP A 76 2.867 0.534 -9.459 1.00 0.00 H new ATOM 0 HA ASP A 76 4.262 -1.029 -8.897 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.692 -2.633 -11.408 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.204 -3.224 -9.840 1.00 0.00 H new ATOM 1111 N GLU A 77 6.244 0.061 -10.193 1.00 0.00 N ATOM 1112 CA GLU A 77 7.522 0.361 -10.846 1.00 0.00 C ATOM 1113 C GLU A 77 8.653 0.494 -9.870 1.00 0.00 C ATOM 1114 O GLU A 77 9.668 -0.187 -9.978 1.00 0.00 O ATOM 1115 CB GLU A 77 7.470 1.645 -11.669 1.00 0.00 C ATOM 1116 CG GLU A 77 6.557 1.618 -12.863 1.00 0.00 C ATOM 1117 CD GLU A 77 6.659 2.884 -13.655 1.00 0.00 C ATOM 1118 OE1 GLU A 77 6.553 3.975 -13.062 1.00 0.00 O ATOM 1119 OE2 GLU A 77 6.905 2.818 -14.882 1.00 0.00 O ATOM 0 H GLU A 77 6.061 0.591 -9.341 1.00 0.00 H new ATOM 0 HA GLU A 77 7.700 -0.492 -11.501 1.00 0.00 H new ATOM 0 HB2 GLU A 77 7.160 2.461 -11.016 1.00 0.00 H new ATOM 0 HB3 GLU A 77 8.479 1.876 -12.011 1.00 0.00 H new ATOM 0 HG2 GLU A 77 6.810 0.768 -13.497 1.00 0.00 H new ATOM 0 HG3 GLU A 77 5.528 1.475 -12.533 1.00 0.00 H new ATOM 1126 N GLU A 78 8.477 1.383 -8.926 1.00 0.00 N ATOM 1127 CA GLU A 78 9.480 1.761 -8.020 1.00 0.00 C ATOM 1128 C GLU A 78 9.913 0.602 -7.116 1.00 0.00 C ATOM 1129 O GLU A 78 9.135 -0.322 -6.879 1.00 0.00 O ATOM 1130 CB GLU A 78 8.991 2.989 -7.283 1.00 0.00 C ATOM 1131 CG GLU A 78 7.875 2.755 -6.346 1.00 0.00 C ATOM 1132 CD GLU A 78 8.422 2.767 -4.990 1.00 0.00 C ATOM 1133 OE1 GLU A 78 8.658 3.883 -4.481 1.00 0.00 O ATOM 1134 OE2 GLU A 78 8.747 1.689 -4.453 1.00 0.00 O ATOM 0 H GLU A 78 7.592 1.869 -8.779 1.00 0.00 H new ATOM 0 HA GLU A 78 10.399 2.022 -8.545 1.00 0.00 H new ATOM 0 HB2 GLU A 78 9.826 3.417 -6.729 1.00 0.00 H new ATOM 0 HB3 GLU A 78 8.679 3.733 -8.016 1.00 0.00 H new ATOM 0 HG2 GLU A 78 7.114 3.527 -6.458 1.00 0.00 H new ATOM 0 HG3 GLU A 78 7.394 1.800 -6.556 1.00 0.00 H new ATOM 1141 N ARG A 79 11.139 0.641 -6.611 1.00 0.00 N ATOM 1142 CA ARG A 79 11.628 -0.525 -5.931 1.00 0.00 C ATOM 1143 C ARG A 79 11.989 -0.308 -4.457 1.00 0.00 C ATOM 1144 O ARG A 79 13.159 -0.114 -4.125 1.00 0.00 O ATOM 1145 CB ARG A 79 12.781 -1.159 -6.717 1.00 0.00 C ATOM 1146 CG ARG A 79 13.262 -2.475 -6.158 1.00 0.00 C ATOM 1147 CD ARG A 79 14.370 -3.057 -7.001 1.00 0.00 C ATOM 1148 NE ARG A 79 14.851 -4.329 -6.458 1.00 0.00 N ATOM 1149 CZ ARG A 79 15.968 -4.943 -6.830 1.00 0.00 C ATOM 1150 NH1 ARG A 79 16.725 -4.425 -7.791 1.00 0.00 N ATOM 1151 NH2 ARG A 79 16.326 -6.077 -6.249 1.00 0.00 N ATOM 0 H ARG A 79 11.779 1.433 -6.660 1.00 0.00 H new ATOM 0 HA ARG A 79 10.792 -1.223 -5.899 1.00 0.00 H new ATOM 0 HB2 ARG A 79 12.463 -1.310 -7.748 1.00 0.00 H new ATOM 0 HB3 ARG A 79 13.617 -0.460 -6.741 1.00 0.00 H new ATOM 0 HG2 ARG A 79 13.616 -2.331 -5.137 1.00 0.00 H new ATOM 0 HG3 ARG A 79 12.430 -3.178 -6.111 1.00 0.00 H new ATOM 0 HD2 ARG A 79 14.012 -3.208 -8.019 1.00 0.00 H new ATOM 0 HD3 ARG A 79 15.197 -2.349 -7.056 1.00 0.00 H new ATOM 0 HE ARG A 79 14.284 -4.778 -5.739 1.00 0.00 H new ATOM 0 HH11 ARG A 79 16.449 -3.554 -8.244 1.00 0.00 H new ATOM 0 HH12 ARG A 79 17.583 -4.898 -8.075 1.00 0.00 H new ATOM 0 HH21 ARG A 79 15.744 -6.480 -5.515 1.00 0.00 H new ATOM 0 HH22 ARG A 79 17.184 -6.548 -6.535 1.00 0.00 H new ATOM 1165 N HIS A 80 10.956 -0.145 -3.624 1.00 0.00 N ATOM 1166 CA HIS A 80 11.065 -0.246 -2.130 1.00 0.00 C ATOM 1167 C HIS A 80 9.796 0.031 -1.404 1.00 0.00 C ATOM 1168 O HIS A 80 9.695 -0.335 -0.253 1.00 0.00 O ATOM 1169 CB HIS A 80 12.247 0.460 -1.419 1.00 0.00 C ATOM 1170 CG HIS A 80 13.352 -0.486 -0.995 1.00 0.00 C ATOM 1171 ND1 HIS A 80 13.268 -1.296 0.127 1.00 0.00 N ATOM 1172 CD2 HIS A 80 14.576 -0.731 -1.528 1.00 0.00 C ATOM 1173 CE1 HIS A 80 14.385 -1.976 0.258 1.00 0.00 C ATOM 1174 NE2 HIS A 80 15.190 -1.658 -0.724 1.00 0.00 N ATOM 0 H HIS A 80 10.011 0.062 -3.948 1.00 0.00 H new ATOM 0 HA HIS A 80 11.308 -1.306 -2.058 1.00 0.00 H new ATOM 0 HB2 HIS A 80 12.663 1.215 -2.086 1.00 0.00 H new ATOM 0 HB3 HIS A 80 11.871 0.983 -0.540 1.00 0.00 H new ATOM 0 HD2 HIS A 80 14.989 -0.281 -2.418 1.00 0.00 H new ATOM 0 HE1 HIS A 80 14.603 -2.681 1.046 1.00 0.00 H new ATOM 0 HE2 HIS A 80 16.125 -2.039 -0.869 1.00 0.00 H new ATOM 1183 N VAL A 81 8.846 0.710 -2.021 1.00 0.00 N ATOM 1184 CA VAL A 81 7.535 0.806 -1.418 1.00 0.00 C ATOM 1185 C VAL A 81 6.944 -0.549 -1.571 1.00 0.00 C ATOM 1186 O VAL A 81 6.637 -1.233 -0.585 1.00 0.00 O ATOM 1187 CB VAL A 81 6.601 1.860 -2.099 1.00 0.00 C ATOM 1188 CG1 VAL A 81 5.190 1.803 -1.517 1.00 0.00 C ATOM 1189 CG2 VAL A 81 7.152 3.254 -1.924 1.00 0.00 C ATOM 0 H VAL A 81 8.954 1.190 -2.914 1.00 0.00 H new ATOM 0 HA VAL A 81 7.631 1.136 -0.383 1.00 0.00 H new ATOM 0 HB VAL A 81 6.557 1.618 -3.161 1.00 0.00 H new ATOM 0 HG11 VAL A 81 4.563 2.546 -2.009 1.00 0.00 H new ATOM 0 HG12 VAL A 81 4.770 0.810 -1.678 1.00 0.00 H new ATOM 0 HG13 VAL A 81 5.229 2.012 -0.448 1.00 0.00 H new ATOM 0 HG21 VAL A 81 6.487 3.971 -2.405 1.00 0.00 H new ATOM 0 HG22 VAL A 81 7.227 3.485 -0.861 1.00 0.00 H new ATOM 0 HG23 VAL A 81 8.141 3.314 -2.379 1.00 0.00 H new ATOM 1199 N GLY A 82 6.883 -0.967 -2.824 1.00 0.00 N ATOM 1200 CA GLY A 82 6.411 -2.275 -3.180 1.00 0.00 C ATOM 1201 C GLY A 82 4.937 -2.455 -2.953 1.00 0.00 C ATOM 1202 O GLY A 82 4.202 -2.709 -3.895 1.00 0.00 O ATOM 0 H GLY A 82 7.164 -0.397 -3.622 1.00 0.00 H new ATOM 0 HA2 GLY A 82 6.636 -2.462 -4.230 1.00 0.00 H new ATOM 0 HA3 GLY A 82 6.955 -3.021 -2.600 1.00 0.00 H new ATOM 1206 N ASP A 83 4.550 -2.417 -1.725 1.00 0.00 N ATOM 1207 CA ASP A 83 3.202 -2.581 -1.355 1.00 0.00 C ATOM 1208 C ASP A 83 2.509 -1.401 -1.830 1.00 0.00 C ATOM 1209 O ASP A 83 2.603 -0.329 -1.242 1.00 0.00 O ATOM 1210 CB ASP A 83 3.087 -2.744 0.150 1.00 0.00 C ATOM 1211 CG ASP A 83 1.707 -2.490 0.727 1.00 0.00 C ATOM 1212 OD1 ASP A 83 0.732 -3.081 0.257 1.00 0.00 O ATOM 1213 OD2 ASP A 83 1.604 -1.657 1.672 1.00 0.00 O ATOM 0 H ASP A 83 5.182 -2.267 -0.939 1.00 0.00 H new ATOM 0 HA ASP A 83 2.762 -3.478 -1.791 1.00 0.00 H new ATOM 0 HB2 ASP A 83 3.392 -3.757 0.413 1.00 0.00 H new ATOM 0 HB3 ASP A 83 3.793 -2.064 0.627 1.00 0.00 H new ATOM 1218 N LEU A 84 1.909 -1.555 -2.945 1.00 0.00 N ATOM 1219 CA LEU A 84 1.254 -0.544 -3.658 1.00 0.00 C ATOM 1220 C LEU A 84 0.467 -1.174 -4.745 1.00 0.00 C ATOM 1221 O LEU A 84 0.602 -2.348 -5.010 1.00 0.00 O ATOM 1222 CB LEU A 84 2.241 0.557 -4.193 1.00 0.00 C ATOM 1223 CG LEU A 84 3.494 0.124 -5.001 1.00 0.00 C ATOM 1224 CD1 LEU A 84 3.150 -0.443 -6.371 1.00 0.00 C ATOM 1225 CD2 LEU A 84 4.458 1.285 -5.139 1.00 0.00 C ATOM 0 H LEU A 84 1.862 -2.460 -3.414 1.00 0.00 H new ATOM 0 HA LEU A 84 0.581 -0.011 -2.986 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.665 1.237 -4.821 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.587 1.132 -3.334 1.00 0.00 H new ATOM 0 HG LEU A 84 3.968 -0.680 -4.438 1.00 0.00 H new ATOM 0 HD11 LEU A 84 4.067 -0.728 -6.888 1.00 0.00 H new ATOM 0 HD12 LEU A 84 2.513 -1.320 -6.253 1.00 0.00 H new ATOM 0 HD13 LEU A 84 2.624 0.312 -6.955 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.332 0.967 -5.708 1.00 0.00 H new ATOM 0 HD22 LEU A 84 3.966 2.107 -5.659 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.771 1.618 -4.149 1.00 0.00 H new ATOM 1237 N GLY A 85 -0.417 -0.444 -5.236 1.00 0.00 N ATOM 1238 CA GLY A 85 -1.210 -0.819 -6.335 1.00 0.00 C ATOM 1239 C GLY A 85 -2.130 0.288 -6.488 1.00 0.00 C ATOM 1240 O GLY A 85 -2.168 1.128 -5.583 1.00 0.00 O ATOM 0 H GLY A 85 -0.633 0.486 -4.876 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -0.608 -0.966 -7.232 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.737 -1.755 -6.148 1.00 0.00 H new ATOM 1244 N ASN A 86 -2.852 0.362 -7.531 1.00 0.00 N ATOM 1245 CA ASN A 86 -3.837 1.412 -7.607 1.00 0.00 C ATOM 1246 C ASN A 86 -5.046 0.958 -6.803 1.00 0.00 C ATOM 1247 O ASN A 86 -5.388 -0.226 -6.813 1.00 0.00 O ATOM 1248 CB ASN A 86 -4.217 1.731 -9.054 1.00 0.00 C ATOM 1249 CG ASN A 86 -5.153 2.932 -9.167 1.00 0.00 C ATOM 1250 OD1 ASN A 86 -5.116 3.864 -8.344 1.00 0.00 O ATOM 1251 ND2 ASN A 86 -5.978 2.934 -10.174 1.00 0.00 N ATOM 0 H ASN A 86 -2.801 -0.263 -8.336 1.00 0.00 H new ATOM 0 HA ASN A 86 -3.431 2.336 -7.195 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -3.311 1.926 -9.628 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -4.696 0.859 -9.500 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -6.620 3.716 -10.306 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -5.983 2.154 -10.831 1.00 0.00 H new ATOM 1258 N VAL A 87 -5.669 1.862 -6.070 1.00 0.00 N ATOM 1259 CA VAL A 87 -6.798 1.514 -5.229 1.00 0.00 C ATOM 1260 C VAL A 87 -8.012 2.235 -5.773 1.00 0.00 C ATOM 1261 O VAL A 87 -7.970 3.426 -5.969 1.00 0.00 O ATOM 1262 CB VAL A 87 -6.551 1.953 -3.754 1.00 0.00 C ATOM 1263 CG1 VAL A 87 -7.684 1.503 -2.853 1.00 0.00 C ATOM 1264 CG2 VAL A 87 -5.219 1.421 -3.239 1.00 0.00 C ATOM 0 H VAL A 87 -5.410 2.848 -6.041 1.00 0.00 H new ATOM 0 HA VAL A 87 -6.944 0.434 -5.236 1.00 0.00 H new ATOM 0 HB VAL A 87 -6.514 3.042 -3.738 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -7.485 1.823 -1.830 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -8.619 1.945 -3.196 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -7.764 0.416 -2.884 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -5.073 1.743 -2.208 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -5.221 0.332 -3.283 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -4.409 1.808 -3.858 1.00 0.00 H new ATOM 1274 N THR A 88 -9.070 1.517 -6.009 1.00 0.00 N ATOM 1275 CA THR A 88 -10.222 2.039 -6.640 1.00 0.00 C ATOM 1276 C THR A 88 -11.507 1.461 -6.028 1.00 0.00 C ATOM 1277 O THR A 88 -11.878 0.341 -6.381 1.00 0.00 O ATOM 1278 CB THR A 88 -10.185 1.693 -8.163 1.00 0.00 C ATOM 1279 OG1 THR A 88 -8.971 2.189 -8.765 1.00 0.00 O ATOM 1280 CG2 THR A 88 -11.389 2.258 -8.908 1.00 0.00 C ATOM 0 H THR A 88 -9.147 0.531 -5.758 1.00 0.00 H new ATOM 0 HA THR A 88 -10.225 3.119 -6.495 1.00 0.00 H new ATOM 0 HB THR A 88 -10.217 0.606 -8.243 1.00 0.00 H new ATOM 0 HG1 THR A 88 -8.951 3.167 -8.702 1.00 0.00 H new ATOM 0 HG21 THR A 88 -11.321 1.993 -9.963 1.00 0.00 H new ATOM 0 HG22 THR A 88 -12.305 1.842 -8.488 1.00 0.00 H new ATOM 0 HG23 THR A 88 -11.403 3.343 -8.807 1.00 0.00 H new ATOM 1288 N ALA A 89 -12.161 2.135 -5.093 1.00 0.00 N ATOM 1289 CA ALA A 89 -13.469 1.638 -4.738 1.00 0.00 C ATOM 1290 C ALA A 89 -14.434 2.754 -4.858 1.00 0.00 C ATOM 1291 O ALA A 89 -14.562 3.556 -3.981 1.00 0.00 O ATOM 1292 CB ALA A 89 -13.492 1.076 -3.335 1.00 0.00 C ATOM 0 H ALA A 89 -11.834 2.967 -4.601 1.00 0.00 H new ATOM 0 HA ALA A 89 -13.737 0.824 -5.412 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -14.493 0.712 -3.105 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -12.781 0.253 -3.261 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -13.218 1.857 -2.626 1.00 0.00 H new ATOM 1298 N ASP A 90 -15.191 2.716 -5.893 1.00 0.00 N ATOM 1299 CA ASP A 90 -16.035 3.854 -6.201 1.00 0.00 C ATOM 1300 C ASP A 90 -17.433 3.453 -6.398 1.00 0.00 C ATOM 1301 O ASP A 90 -18.334 4.274 -6.318 1.00 0.00 O ATOM 1302 CB ASP A 90 -15.547 4.580 -7.463 1.00 0.00 C ATOM 1303 CG ASP A 90 -15.790 3.807 -8.746 1.00 0.00 C ATOM 1304 OD1 ASP A 90 -15.046 2.856 -9.045 1.00 0.00 O ATOM 1305 OD2 ASP A 90 -16.735 4.144 -9.480 1.00 0.00 O ATOM 0 H ASP A 90 -15.257 1.932 -6.543 1.00 0.00 H new ATOM 0 HA ASP A 90 -15.974 4.527 -5.346 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -16.047 5.546 -7.531 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -14.480 4.780 -7.366 1.00 0.00 H new ATOM 1310 N LYS A 91 -17.628 2.194 -6.644 1.00 0.00 N ATOM 1311 CA LYS A 91 -18.949 1.708 -6.944 1.00 0.00 C ATOM 1312 C LYS A 91 -19.783 1.732 -5.682 1.00 0.00 C ATOM 1313 O LYS A 91 -20.764 2.466 -5.567 1.00 0.00 O ATOM 1314 CB LYS A 91 -18.912 0.262 -7.512 1.00 0.00 C ATOM 1315 CG LYS A 91 -18.127 0.047 -8.818 1.00 0.00 C ATOM 1316 CD LYS A 91 -16.614 -0.006 -8.605 1.00 0.00 C ATOM 1317 CE LYS A 91 -15.859 -0.173 -9.921 1.00 0.00 C ATOM 1318 NZ LYS A 91 -16.020 1.001 -10.807 1.00 0.00 N ATOM 0 H LYS A 91 -16.896 1.483 -6.644 1.00 0.00 H new ATOM 0 HA LYS A 91 -19.387 2.355 -7.704 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -18.488 -0.391 -6.750 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -19.939 -0.065 -7.676 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -18.455 -0.882 -9.284 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -18.362 0.853 -9.513 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -16.285 0.908 -8.111 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -16.370 -0.834 -7.939 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -14.800 -0.328 -9.714 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -16.218 -1.066 -10.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -15.505 0.838 -11.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -17.029 1.145 -11.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -15.639 1.846 -10.336 1.00 0.00 H new ATOM 1332 N ASP A 92 -19.296 1.033 -4.701 1.00 0.00 N ATOM 1333 CA ASP A 92 -19.985 0.860 -3.449 1.00 0.00 C ATOM 1334 C ASP A 92 -19.010 0.334 -2.423 1.00 0.00 C ATOM 1335 O ASP A 92 -19.400 -0.246 -1.407 1.00 0.00 O ATOM 1336 CB ASP A 92 -21.175 -0.107 -3.624 1.00 0.00 C ATOM 1337 CG ASP A 92 -20.785 -1.507 -4.070 1.00 0.00 C ATOM 1338 OD1 ASP A 92 -20.528 -1.724 -5.283 1.00 0.00 O ATOM 1339 OD2 ASP A 92 -20.764 -2.417 -3.233 1.00 0.00 O ATOM 0 H ASP A 92 -18.395 0.558 -4.745 1.00 0.00 H new ATOM 0 HA ASP A 92 -20.381 1.817 -3.109 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -21.713 -0.177 -2.679 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -21.866 0.315 -4.354 1.00 0.00 H new ATOM 1344 N GLY A 93 -17.745 0.655 -2.651 1.00 0.00 N ATOM 1345 CA GLY A 93 -16.691 0.195 -1.785 1.00 0.00 C ATOM 1346 C GLY A 93 -16.272 -1.257 -1.982 1.00 0.00 C ATOM 1347 O GLY A 93 -16.640 -2.112 -1.197 1.00 0.00 O ATOM 0 H GLY A 93 -17.432 1.233 -3.431 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -15.818 0.831 -1.933 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -17.010 0.327 -0.751 1.00 0.00 H new ATOM 1351 N VAL A 94 -15.479 -1.493 -3.004 1.00 0.00 N ATOM 1352 CA VAL A 94 -14.885 -2.769 -3.384 1.00 0.00 C ATOM 1353 C VAL A 94 -13.704 -2.393 -4.269 1.00 0.00 C ATOM 1354 O VAL A 94 -13.910 -1.910 -5.384 1.00 0.00 O ATOM 1355 CB VAL A 94 -15.830 -3.708 -4.235 1.00 0.00 C ATOM 1356 CG1 VAL A 94 -15.090 -4.976 -4.658 1.00 0.00 C ATOM 1357 CG2 VAL A 94 -17.088 -4.099 -3.486 1.00 0.00 C ATOM 0 H VAL A 94 -15.208 -0.746 -3.643 1.00 0.00 H new ATOM 0 HA VAL A 94 -14.643 -3.326 -2.479 1.00 0.00 H new ATOM 0 HB VAL A 94 -16.123 -3.134 -5.114 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -15.758 -5.609 -5.243 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -14.223 -4.707 -5.262 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -14.760 -5.518 -3.771 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -17.701 -4.744 -4.116 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -16.818 -4.633 -2.575 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -17.651 -3.202 -3.228 1.00 0.00 H new ATOM 1367 N ALA A 95 -12.508 -2.498 -3.762 1.00 0.00 N ATOM 1368 CA ALA A 95 -11.342 -2.196 -4.552 1.00 0.00 C ATOM 1369 C ALA A 95 -10.629 -3.462 -4.894 1.00 0.00 C ATOM 1370 O ALA A 95 -10.252 -4.229 -4.002 1.00 0.00 O ATOM 1371 CB ALA A 95 -10.403 -1.241 -3.835 1.00 0.00 C ATOM 0 H ALA A 95 -12.312 -2.790 -2.805 1.00 0.00 H new ATOM 0 HA ALA A 95 -11.672 -1.701 -5.465 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -9.537 -1.040 -4.466 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -10.924 -0.307 -3.626 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -10.073 -1.690 -2.898 1.00 0.00 H new ATOM 1377 N ASP A 96 -10.464 -3.683 -6.161 1.00 0.00 N ATOM 1378 CA ASP A 96 -9.785 -4.861 -6.663 1.00 0.00 C ATOM 1379 C ASP A 96 -8.320 -4.555 -6.875 1.00 0.00 C ATOM 1380 O ASP A 96 -7.965 -3.707 -7.715 1.00 0.00 O ATOM 1381 CB ASP A 96 -10.419 -5.335 -7.976 1.00 0.00 C ATOM 1382 CG ASP A 96 -9.664 -6.490 -8.614 1.00 0.00 C ATOM 1383 OD1 ASP A 96 -9.832 -7.638 -8.169 1.00 0.00 O ATOM 1384 OD2 ASP A 96 -8.897 -6.259 -9.581 1.00 0.00 O ATOM 0 H ASP A 96 -10.796 -3.052 -6.891 1.00 0.00 H new ATOM 0 HA ASP A 96 -9.884 -5.659 -5.928 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -11.448 -5.640 -7.787 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -10.457 -4.501 -8.677 1.00 0.00 H new ATOM 1389 N VAL A 97 -7.480 -5.175 -6.087 1.00 0.00 N ATOM 1390 CA VAL A 97 -6.057 -5.003 -6.208 1.00 0.00 C ATOM 1391 C VAL A 97 -5.412 -6.317 -6.652 1.00 0.00 C ATOM 1392 O VAL A 97 -5.360 -7.285 -5.899 1.00 0.00 O ATOM 1393 CB VAL A 97 -5.407 -4.522 -4.871 1.00 0.00 C ATOM 1394 CG1 VAL A 97 -3.906 -4.300 -5.039 1.00 0.00 C ATOM 1395 CG2 VAL A 97 -6.078 -3.247 -4.363 1.00 0.00 C ATOM 0 H VAL A 97 -7.764 -5.813 -5.344 1.00 0.00 H new ATOM 0 HA VAL A 97 -5.882 -4.230 -6.956 1.00 0.00 H new ATOM 0 HB VAL A 97 -5.557 -5.308 -4.131 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -3.480 -3.966 -4.093 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -3.432 -5.234 -5.341 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -3.734 -3.542 -5.803 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -5.606 -2.934 -3.431 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -5.970 -2.458 -5.107 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -7.137 -3.438 -4.187 1.00 0.00 H new ATOM 1405 N SER A 98 -5.019 -6.363 -7.887 1.00 0.00 N ATOM 1406 CA SER A 98 -4.287 -7.463 -8.455 1.00 0.00 C ATOM 1407 C SER A 98 -3.302 -6.880 -9.427 1.00 0.00 C ATOM 1408 O SER A 98 -3.683 -6.316 -10.442 1.00 0.00 O ATOM 1409 CB SER A 98 -5.230 -8.438 -9.151 1.00 0.00 C ATOM 1410 OG SER A 98 -6.190 -8.935 -8.227 1.00 0.00 O ATOM 0 H SER A 98 -5.203 -5.613 -8.553 1.00 0.00 H new ATOM 0 HA SER A 98 -3.770 -8.026 -7.678 1.00 0.00 H new ATOM 0 HB2 SER A 98 -5.735 -7.939 -9.979 1.00 0.00 H new ATOM 0 HB3 SER A 98 -4.661 -9.265 -9.576 1.00 0.00 H new ATOM 0 HG SER A 98 -6.884 -9.430 -8.711 1.00 0.00 H new ATOM 1416 N ILE A 99 -2.059 -6.972 -9.100 1.00 0.00 N ATOM 1417 CA ILE A 99 -1.018 -6.337 -9.869 1.00 0.00 C ATOM 1418 C ILE A 99 0.000 -7.365 -10.325 1.00 0.00 C ATOM 1419 O ILE A 99 0.114 -8.435 -9.708 1.00 0.00 O ATOM 1420 CB ILE A 99 -0.309 -5.262 -9.001 1.00 0.00 C ATOM 1421 CG1 ILE A 99 0.276 -5.908 -7.725 1.00 0.00 C ATOM 1422 CG2 ILE A 99 -1.278 -4.130 -8.649 1.00 0.00 C ATOM 1423 CD1 ILE A 99 0.972 -4.952 -6.790 1.00 0.00 C ATOM 0 H ILE A 99 -1.723 -7.491 -8.288 1.00 0.00 H new ATOM 0 HA ILE A 99 -1.466 -5.866 -10.744 1.00 0.00 H new ATOM 0 HB ILE A 99 0.512 -4.833 -9.575 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -0.531 -6.401 -7.183 1.00 0.00 H new ATOM 0 HG13 ILE A 99 0.983 -6.684 -8.020 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.763 -3.386 -8.041 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -1.639 -3.662 -9.565 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -2.122 -4.534 -8.091 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.348 -5.498 -5.925 1.00 0.00 H new ATOM 0 HD12 ILE A 99 1.804 -4.476 -7.309 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.267 -4.189 -6.459 1.00 0.00 H new ATOM 1435 N GLU A 100 0.694 -7.082 -11.414 1.00 0.00 N ATOM 1436 CA GLU A 100 1.781 -7.933 -11.859 1.00 0.00 C ATOM 1437 C GLU A 100 2.864 -7.121 -12.577 1.00 0.00 C ATOM 1438 O GLU A 100 2.721 -6.727 -13.730 1.00 0.00 O ATOM 1439 CB GLU A 100 1.293 -9.131 -12.705 1.00 0.00 C ATOM 1440 CG GLU A 100 0.539 -8.785 -13.981 1.00 0.00 C ATOM 1441 CD GLU A 100 0.142 -10.013 -14.746 1.00 0.00 C ATOM 1442 OE1 GLU A 100 1.006 -10.648 -15.376 1.00 0.00 O ATOM 1443 OE2 GLU A 100 -1.046 -10.374 -14.735 1.00 0.00 O ATOM 0 H GLU A 100 0.523 -6.269 -12.006 1.00 0.00 H new ATOM 0 HA GLU A 100 2.233 -8.364 -10.965 1.00 0.00 H new ATOM 0 HB2 GLU A 100 2.158 -9.738 -12.971 1.00 0.00 H new ATOM 0 HB3 GLU A 100 0.648 -9.751 -12.082 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -0.352 -8.209 -13.731 1.00 0.00 H new ATOM 0 HG3 GLU A 100 1.163 -8.151 -14.611 1.00 0.00 H new ATOM 1450 N ASP A 101 3.898 -6.827 -11.843 1.00 0.00 N ATOM 1451 CA ASP A 101 5.089 -6.126 -12.296 1.00 0.00 C ATOM 1452 C ASP A 101 6.081 -6.316 -11.184 1.00 0.00 C ATOM 1453 O ASP A 101 5.710 -6.969 -10.198 1.00 0.00 O ATOM 1454 CB ASP A 101 4.887 -4.651 -12.628 1.00 0.00 C ATOM 1455 CG ASP A 101 5.951 -4.156 -13.605 1.00 0.00 C ATOM 1456 OD1 ASP A 101 7.143 -4.103 -13.253 1.00 0.00 O ATOM 1457 OD2 ASP A 101 5.623 -3.872 -14.771 1.00 0.00 O ATOM 0 H ASP A 101 3.946 -7.079 -10.856 1.00 0.00 H new ATOM 0 HA ASP A 101 5.422 -6.536 -13.250 1.00 0.00 H new ATOM 0 HB2 ASP A 101 3.897 -4.505 -13.059 1.00 0.00 H new ATOM 0 HB3 ASP A 101 4.927 -4.060 -11.713 1.00 0.00 H new ATOM 1462 N SER A 102 7.335 -5.927 -11.359 1.00 0.00 N ATOM 1463 CA SER A 102 8.356 -6.123 -10.329 1.00 0.00 C ATOM 1464 C SER A 102 7.994 -5.419 -9.005 1.00 0.00 C ATOM 1465 O SER A 102 8.269 -4.230 -8.780 1.00 0.00 O ATOM 1466 CB SER A 102 9.714 -5.680 -10.813 1.00 0.00 C ATOM 1467 OG SER A 102 9.985 -6.283 -12.085 1.00 0.00 O ATOM 0 H SER A 102 7.675 -5.472 -12.206 1.00 0.00 H new ATOM 0 HA SER A 102 8.395 -7.194 -10.127 1.00 0.00 H new ATOM 0 HB2 SER A 102 9.745 -4.594 -10.899 1.00 0.00 H new ATOM 0 HB3 SER A 102 10.480 -5.965 -10.092 1.00 0.00 H new ATOM 0 HG SER A 102 10.866 -5.995 -12.402 1.00 0.00 H new ATOM 1473 N VAL A 103 7.276 -6.159 -8.226 1.00 0.00 N ATOM 1474 CA VAL A 103 6.854 -5.838 -6.898 1.00 0.00 C ATOM 1475 C VAL A 103 7.568 -6.812 -5.961 1.00 0.00 C ATOM 1476 O VAL A 103 7.531 -6.672 -4.772 1.00 0.00 O ATOM 1477 CB VAL A 103 5.297 -5.959 -6.765 1.00 0.00 C ATOM 1478 CG1 VAL A 103 4.806 -5.603 -5.370 1.00 0.00 C ATOM 1479 CG2 VAL A 103 4.609 -5.074 -7.791 1.00 0.00 C ATOM 0 H VAL A 103 6.942 -7.076 -8.523 1.00 0.00 H new ATOM 0 HA VAL A 103 7.107 -4.809 -6.645 1.00 0.00 H new ATOM 0 HB VAL A 103 5.043 -7.003 -6.948 1.00 0.00 H new ATOM 0 HG11 VAL A 103 3.721 -5.703 -5.330 1.00 0.00 H new ATOM 0 HG12 VAL A 103 5.259 -6.276 -4.642 1.00 0.00 H new ATOM 0 HG13 VAL A 103 5.085 -4.575 -5.137 1.00 0.00 H new ATOM 0 HG21 VAL A 103 3.528 -5.168 -7.687 1.00 0.00 H new ATOM 0 HG22 VAL A 103 4.900 -4.036 -7.630 1.00 0.00 H new ATOM 0 HG23 VAL A 103 4.905 -5.382 -8.794 1.00 0.00 H new ATOM 1489 N ILE A 104 8.211 -7.840 -6.581 1.00 0.00 N ATOM 1490 CA ILE A 104 8.919 -8.956 -5.884 1.00 0.00 C ATOM 1491 C ILE A 104 9.951 -8.493 -4.853 1.00 0.00 C ATOM 1492 O ILE A 104 10.493 -9.310 -4.106 1.00 0.00 O ATOM 1493 CB ILE A 104 9.661 -9.927 -6.845 1.00 0.00 C ATOM 1494 CG1 ILE A 104 10.913 -9.270 -7.515 1.00 0.00 C ATOM 1495 CG2 ILE A 104 8.717 -10.514 -7.873 1.00 0.00 C ATOM 1496 CD1 ILE A 104 10.637 -8.237 -8.576 1.00 0.00 C ATOM 0 H ILE A 104 8.254 -7.919 -7.597 1.00 0.00 H new ATOM 0 HA ILE A 104 8.098 -9.471 -5.386 1.00 0.00 H new ATOM 0 HB ILE A 104 10.037 -10.748 -6.234 1.00 0.00 H new ATOM 0 HG12 ILE A 104 11.515 -8.806 -6.734 1.00 0.00 H new ATOM 0 HG13 ILE A 104 11.519 -10.061 -7.957 1.00 0.00 H new ATOM 0 HG21 ILE A 104 9.267 -11.188 -8.529 1.00 0.00 H new ATOM 0 HG22 ILE A 104 7.925 -11.066 -7.367 1.00 0.00 H new ATOM 0 HG23 ILE A 104 8.278 -9.711 -8.464 1.00 0.00 H new ATOM 0 HD11 ILE A 104 11.580 -7.854 -8.965 1.00 0.00 H new ATOM 0 HD12 ILE A 104 10.067 -8.691 -9.387 1.00 0.00 H new ATOM 0 HD13 ILE A 104 10.063 -7.417 -8.145 1.00 0.00 H new ATOM 1508 N SER A 105 10.301 -7.250 -4.879 1.00 0.00 N ATOM 1509 CA SER A 105 11.133 -6.722 -3.859 1.00 0.00 C ATOM 1510 C SER A 105 10.327 -6.583 -2.600 1.00 0.00 C ATOM 1511 O SER A 105 9.114 -6.414 -2.635 1.00 0.00 O ATOM 1512 CB SER A 105 11.756 -5.409 -4.285 1.00 0.00 C ATOM 1513 OG SER A 105 12.597 -5.622 -5.411 1.00 0.00 O ATOM 0 H SER A 105 10.021 -6.583 -5.598 1.00 0.00 H new ATOM 0 HA SER A 105 11.961 -7.405 -3.671 1.00 0.00 H new ATOM 0 HB2 SER A 105 10.976 -4.688 -4.532 1.00 0.00 H new ATOM 0 HB3 SER A 105 12.333 -4.985 -3.463 1.00 0.00 H new ATOM 0 HG SER A 105 12.122 -5.362 -6.228 1.00 0.00 H new ATOM 1519 N LEU A 106 10.996 -6.663 -1.471 1.00 0.00 N ATOM 1520 CA LEU A 106 10.357 -6.600 -0.224 1.00 0.00 C ATOM 1521 C LEU A 106 9.764 -5.252 -0.033 1.00 0.00 C ATOM 1522 O LEU A 106 10.419 -4.217 -0.206 1.00 0.00 O ATOM 1523 CB LEU A 106 11.312 -7.048 0.924 1.00 0.00 C ATOM 1524 CG LEU A 106 12.805 -6.625 0.877 1.00 0.00 C ATOM 1525 CD1 LEU A 106 13.007 -5.139 1.073 1.00 0.00 C ATOM 1526 CD2 LEU A 106 13.590 -7.398 1.913 1.00 0.00 C ATOM 0 H LEU A 106 12.009 -6.775 -1.418 1.00 0.00 H new ATOM 0 HA LEU A 106 9.531 -7.311 -0.194 1.00 0.00 H new ATOM 0 HB2 LEU A 106 10.895 -6.677 1.860 1.00 0.00 H new ATOM 0 HB3 LEU A 106 11.281 -8.137 0.970 1.00 0.00 H new ATOM 0 HG LEU A 106 13.171 -6.860 -0.123 1.00 0.00 H new ATOM 0 HD11 LEU A 106 14.071 -4.908 1.030 1.00 0.00 H new ATOM 0 HD12 LEU A 106 12.485 -4.594 0.287 1.00 0.00 H new ATOM 0 HD13 LEU A 106 12.611 -4.843 2.044 1.00 0.00 H new ATOM 0 HD21 LEU A 106 14.637 -7.097 1.875 1.00 0.00 H new ATOM 0 HD22 LEU A 106 13.188 -7.189 2.904 1.00 0.00 H new ATOM 0 HD23 LEU A 106 13.512 -8.465 1.707 1.00 0.00 H new ATOM 1538 N SER A 107 8.483 -5.281 0.171 1.00 0.00 N ATOM 1539 CA SER A 107 7.709 -4.122 0.260 1.00 0.00 C ATOM 1540 C SER A 107 8.019 -3.370 1.533 1.00 0.00 C ATOM 1541 O SER A 107 7.427 -3.612 2.598 1.00 0.00 O ATOM 1542 CB SER A 107 6.259 -4.535 0.198 1.00 0.00 C ATOM 1543 OG SER A 107 6.069 -5.454 -0.872 1.00 0.00 O ATOM 0 H SER A 107 7.950 -6.144 0.281 1.00 0.00 H new ATOM 0 HA SER A 107 7.934 -3.445 -0.564 1.00 0.00 H new ATOM 0 HB2 SER A 107 5.960 -4.993 1.141 1.00 0.00 H new ATOM 0 HB3 SER A 107 5.627 -3.659 0.055 1.00 0.00 H new ATOM 0 HG SER A 107 5.127 -5.722 -0.909 1.00 0.00 H new ATOM 1549 N GLY A 108 8.989 -2.534 1.430 1.00 0.00 N ATOM 1550 CA GLY A 108 9.349 -1.679 2.491 1.00 0.00 C ATOM 1551 C GLY A 108 10.819 -1.471 2.574 1.00 0.00 C ATOM 1552 O GLY A 108 11.587 -2.393 2.323 1.00 0.00 O ATOM 0 H GLY A 108 9.560 -2.427 0.592 1.00 0.00 H new ATOM 0 HA2 GLY A 108 8.855 -0.716 2.362 1.00 0.00 H new ATOM 0 HA3 GLY A 108 8.990 -2.099 3.431 1.00 0.00 H new ATOM 1556 N ASP A 109 11.249 -0.235 2.792 1.00 0.00 N ATOM 1557 CA ASP A 109 12.627 -0.014 3.111 1.00 0.00 C ATOM 1558 C ASP A 109 12.973 -0.618 4.461 1.00 0.00 C ATOM 1559 O ASP A 109 13.857 -1.474 4.548 1.00 0.00 O ATOM 1560 CB ASP A 109 12.987 1.464 3.104 1.00 0.00 C ATOM 1561 CG ASP A 109 14.397 1.696 3.614 1.00 0.00 C ATOM 1562 OD1 ASP A 109 15.368 1.379 2.894 1.00 0.00 O ATOM 1563 OD2 ASP A 109 14.556 2.199 4.727 1.00 0.00 O ATOM 0 H ASP A 109 10.669 0.603 2.752 1.00 0.00 H new ATOM 0 HA ASP A 109 13.212 -0.507 2.334 1.00 0.00 H new ATOM 0 HB2 ASP A 109 12.896 1.857 2.091 1.00 0.00 H new ATOM 0 HB3 ASP A 109 12.280 2.015 3.724 1.00 0.00 H new ATOM 1568 N HIS A 110 12.263 -0.213 5.501 1.00 0.00 N ATOM 1569 CA HIS A 110 12.624 -0.635 6.824 1.00 0.00 C ATOM 1570 C HIS A 110 11.685 -1.722 7.356 1.00 0.00 C ATOM 1571 O HIS A 110 12.154 -2.732 7.875 1.00 0.00 O ATOM 1572 CB HIS A 110 12.675 0.578 7.769 1.00 0.00 C ATOM 1573 CG HIS A 110 13.323 0.319 9.096 1.00 0.00 C ATOM 1574 ND1 HIS A 110 14.628 0.657 9.363 1.00 0.00 N ATOM 1575 CD2 HIS A 110 12.837 -0.215 10.241 1.00 0.00 C ATOM 1576 CE1 HIS A 110 14.917 0.343 10.605 1.00 0.00 C ATOM 1577 NE2 HIS A 110 13.849 -0.186 11.158 1.00 0.00 N ATOM 0 H HIS A 110 11.448 0.398 5.447 1.00 0.00 H new ATOM 0 HA HIS A 110 13.618 -1.081 6.777 1.00 0.00 H new ATOM 0 HB2 HIS A 110 13.211 1.386 7.271 1.00 0.00 H new ATOM 0 HB3 HIS A 110 11.658 0.929 7.941 1.00 0.00 H new ATOM 0 HD2 HIS A 110 11.838 -0.593 10.400 1.00 0.00 H new ATOM 0 HE1 HIS A 110 15.870 0.494 11.089 1.00 0.00 H new ATOM 0 HE2 HIS A 110 13.786 -0.522 12.119 1.00 0.00 H new ATOM 1586 N SER A 111 10.381 -1.549 7.230 1.00 0.00 N ATOM 1587 CA SER A 111 9.495 -2.533 7.777 1.00 0.00 C ATOM 1588 C SER A 111 8.495 -3.032 6.772 1.00 0.00 C ATOM 1589 O SER A 111 7.639 -2.291 6.308 1.00 0.00 O ATOM 1590 CB SER A 111 8.758 -1.977 8.961 1.00 0.00 C ATOM 1591 OG SER A 111 9.645 -1.437 9.923 1.00 0.00 O ATOM 0 H SER A 111 9.933 -0.759 6.767 1.00 0.00 H new ATOM 0 HA SER A 111 10.119 -3.374 8.081 1.00 0.00 H new ATOM 0 HB2 SER A 111 8.066 -1.203 8.629 1.00 0.00 H new ATOM 0 HB3 SER A 111 8.159 -2.764 9.419 1.00 0.00 H new ATOM 0 HG SER A 111 9.649 -2.007 10.720 1.00 0.00 H new ATOM 1597 N ILE A 112 8.626 -4.279 6.443 1.00 0.00 N ATOM 1598 CA ILE A 112 7.700 -4.973 5.616 1.00 0.00 C ATOM 1599 C ILE A 112 6.652 -5.570 6.546 1.00 0.00 C ATOM 1600 O ILE A 112 5.481 -5.587 6.242 1.00 0.00 O ATOM 1601 CB ILE A 112 8.357 -6.145 4.793 1.00 0.00 C ATOM 1602 CG1 ILE A 112 9.550 -5.693 3.920 1.00 0.00 C ATOM 1603 CG2 ILE A 112 7.321 -6.828 3.908 1.00 0.00 C ATOM 1604 CD1 ILE A 112 10.836 -5.353 4.660 1.00 0.00 C ATOM 0 H ILE A 112 9.407 -4.857 6.755 1.00 0.00 H new ATOM 0 HA ILE A 112 7.288 -4.271 4.891 1.00 0.00 H new ATOM 0 HB ILE A 112 8.744 -6.845 5.534 1.00 0.00 H new ATOM 0 HG12 ILE A 112 9.767 -6.484 3.202 1.00 0.00 H new ATOM 0 HG13 ILE A 112 9.243 -4.818 3.348 1.00 0.00 H new ATOM 0 HG21 ILE A 112 7.795 -7.634 3.348 1.00 0.00 H new ATOM 0 HG22 ILE A 112 6.525 -7.237 4.530 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.901 -6.102 3.212 1.00 0.00 H new ATOM 0 HD11 ILE A 112 11.599 -5.050 3.943 1.00 0.00 H new ATOM 0 HD12 ILE A 112 10.649 -4.537 5.358 1.00 0.00 H new ATOM 0 HD13 ILE A 112 11.182 -6.228 5.210 1.00 0.00 H new ATOM 1616 N ILE A 113 7.115 -6.042 7.698 1.00 0.00 N ATOM 1617 CA ILE A 113 6.255 -6.629 8.706 1.00 0.00 C ATOM 1618 C ILE A 113 6.034 -5.594 9.812 1.00 0.00 C ATOM 1619 O ILE A 113 6.912 -4.757 10.070 1.00 0.00 O ATOM 1620 CB ILE A 113 6.863 -7.944 9.361 1.00 0.00 C ATOM 1621 CG1 ILE A 113 7.266 -9.013 8.323 1.00 0.00 C ATOM 1622 CG2 ILE A 113 5.902 -8.563 10.372 1.00 0.00 C ATOM 1623 CD1 ILE A 113 8.616 -8.781 7.668 1.00 0.00 C ATOM 0 H ILE A 113 8.102 -6.026 7.955 1.00 0.00 H new ATOM 0 HA ILE A 113 5.324 -6.913 8.215 1.00 0.00 H new ATOM 0 HB ILE A 113 7.769 -7.617 9.870 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.276 -9.988 8.810 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.502 -9.053 7.546 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.351 -9.460 10.799 1.00 0.00 H new ATOM 0 HG22 ILE A 113 5.698 -7.845 11.167 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.969 -8.827 9.873 1.00 0.00 H new ATOM 0 HD11 ILE A 113 8.816 -9.580 6.954 1.00 0.00 H new ATOM 0 HD12 ILE A 113 8.608 -7.823 7.148 1.00 0.00 H new ATOM 0 HD13 ILE A 113 9.394 -8.773 8.431 1.00 0.00 H new ATOM 1635 N GLY A 114 4.846 -5.591 10.389 1.00 0.00 N ATOM 1636 CA GLY A 114 4.536 -4.741 11.522 1.00 0.00 C ATOM 1637 C GLY A 114 4.049 -3.397 11.083 1.00 0.00 C ATOM 1638 O GLY A 114 3.507 -2.610 11.877 1.00 0.00 O ATOM 0 H GLY A 114 4.069 -6.178 10.085 1.00 0.00 H new ATOM 0 HA2 GLY A 114 3.777 -5.220 12.140 1.00 0.00 H new ATOM 0 HA3 GLY A 114 5.424 -4.622 12.143 1.00 0.00 H new ATOM 1642 N ARG A 115 4.229 -3.125 9.825 1.00 0.00 N ATOM 1643 CA ARG A 115 3.909 -1.875 9.292 1.00 0.00 C ATOM 1644 C ARG A 115 2.516 -1.811 8.749 1.00 0.00 C ATOM 1645 O ARG A 115 2.098 -2.615 7.981 1.00 0.00 O ATOM 1646 CB ARG A 115 4.902 -1.519 8.260 1.00 0.00 C ATOM 1647 CG ARG A 115 5.396 -0.116 8.346 1.00 0.00 C ATOM 1648 CD ARG A 115 4.294 0.939 8.445 1.00 0.00 C ATOM 1649 NE ARG A 115 4.302 1.625 9.725 1.00 0.00 N ATOM 1650 CZ ARG A 115 3.343 2.353 10.223 1.00 0.00 C ATOM 1651 NH1 ARG A 115 2.270 2.578 9.520 1.00 0.00 N ATOM 1652 NH2 ARG A 115 3.478 2.907 11.417 1.00 0.00 N ATOM 0 H ARG A 115 4.608 -3.787 9.148 1.00 0.00 H new ATOM 0 HA ARG A 115 3.943 -1.147 10.102 1.00 0.00 H new ATOM 0 HB2 ARG A 115 5.752 -2.197 8.340 1.00 0.00 H new ATOM 0 HB3 ARG A 115 4.460 -1.677 7.276 1.00 0.00 H new ATOM 0 HG2 ARG A 115 6.047 -0.026 9.216 1.00 0.00 H new ATOM 0 HG3 ARG A 115 6.006 0.095 7.468 1.00 0.00 H new ATOM 0 HD2 ARG A 115 4.418 1.668 7.644 1.00 0.00 H new ATOM 0 HD3 ARG A 115 3.324 0.464 8.296 1.00 0.00 H new ATOM 0 HE ARG A 115 5.144 1.527 10.292 1.00 0.00 H new ATOM 0 HH11 ARG A 115 2.182 2.185 8.583 1.00 0.00 H new ATOM 0 HH12 ARG A 115 1.517 3.147 9.907 1.00 0.00 H new ATOM 0 HH21 ARG A 115 4.335 2.765 11.951 1.00 0.00 H new ATOM 0 HH22 ARG A 115 2.725 3.476 11.803 1.00 0.00 H new ATOM 1666 N THR A 116 1.895 -0.762 9.096 1.00 0.00 N ATOM 1667 CA THR A 116 0.566 -0.452 8.813 1.00 0.00 C ATOM 1668 C THR A 116 0.542 0.284 7.470 1.00 0.00 C ATOM 1669 O THR A 116 1.181 1.349 7.350 1.00 0.00 O ATOM 1670 CB THR A 116 0.152 0.515 9.923 1.00 0.00 C ATOM 1671 OG1 THR A 116 0.994 0.282 11.076 1.00 0.00 O ATOM 1672 CG2 THR A 116 -1.255 0.322 10.330 1.00 0.00 C ATOM 0 H THR A 116 2.352 -0.029 9.638 1.00 0.00 H new ATOM 0 HA THR A 116 -0.087 -1.323 8.762 1.00 0.00 H new ATOM 0 HB THR A 116 0.261 1.530 9.542 1.00 0.00 H new ATOM 0 HG1 THR A 116 0.433 0.117 11.863 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.506 1.030 11.120 1.00 0.00 H new ATOM 0 HG22 THR A 116 -1.908 0.489 9.473 1.00 0.00 H new ATOM 0 HG23 THR A 116 -1.391 -0.695 10.697 1.00 0.00 H new ATOM 1680 N LEU A 117 -0.097 -0.285 6.461 1.00 0.00 N ATOM 1681 CA LEU A 117 -0.162 0.371 5.169 1.00 0.00 C ATOM 1682 C LEU A 117 -1.204 1.424 5.208 1.00 0.00 C ATOM 1683 O LEU A 117 -2.209 1.286 5.917 1.00 0.00 O ATOM 1684 CB LEU A 117 -0.410 -0.581 3.954 1.00 0.00 C ATOM 1685 CG LEU A 117 -1.824 -1.197 3.755 1.00 0.00 C ATOM 1686 CD1 LEU A 117 -1.929 -1.852 2.394 1.00 0.00 C ATOM 1687 CD2 LEU A 117 -2.139 -2.225 4.804 1.00 0.00 C ATOM 0 H LEU A 117 -0.571 -1.187 6.511 1.00 0.00 H new ATOM 0 HA LEU A 117 0.827 0.796 5.000 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -0.161 -0.029 3.048 1.00 0.00 H new ATOM 0 HB3 LEU A 117 0.300 -1.405 4.031 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.539 -0.379 3.837 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -2.925 -2.278 2.271 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -1.755 -1.107 1.617 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -1.183 -2.643 2.312 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -3.135 -2.630 4.629 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.406 -3.030 4.756 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -2.104 -1.761 5.790 1.00 0.00 H new ATOM 1699 N VAL A 118 -0.948 2.490 4.524 1.00 0.00 N ATOM 1700 CA VAL A 118 -1.948 3.552 4.462 1.00 0.00 C ATOM 1701 C VAL A 118 -2.600 3.677 3.077 1.00 0.00 C ATOM 1702 O VAL A 118 -1.927 4.042 2.060 1.00 0.00 O ATOM 1703 CB VAL A 118 -1.444 4.927 5.007 1.00 0.00 C ATOM 1704 CG1 VAL A 118 -0.265 5.484 4.233 1.00 0.00 C ATOM 1705 CG2 VAL A 118 -2.579 5.925 5.060 1.00 0.00 C ATOM 0 H VAL A 118 -0.086 2.665 4.007 1.00 0.00 H new ATOM 0 HA VAL A 118 -2.733 3.237 5.149 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.081 4.746 6.019 1.00 0.00 H new ATOM 0 HG11 VAL A 118 0.034 6.440 4.664 1.00 0.00 H new ATOM 0 HG12 VAL A 118 0.569 4.784 4.287 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -0.550 5.629 3.191 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -2.209 6.877 5.442 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -2.984 6.069 4.058 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -3.363 5.550 5.718 1.00 0.00 H new ATOM 1715 N VAL A 119 -3.891 3.315 3.030 1.00 0.00 N ATOM 1716 CA VAL A 119 -4.730 3.348 1.867 1.00 0.00 C ATOM 1717 C VAL A 119 -6.162 3.650 2.268 1.00 0.00 C ATOM 1718 O VAL A 119 -6.608 3.288 3.352 1.00 0.00 O ATOM 1719 CB VAL A 119 -4.756 1.993 1.077 1.00 0.00 C ATOM 1720 CG1 VAL A 119 -3.432 1.693 0.472 1.00 0.00 C ATOM 1721 CG2 VAL A 119 -5.197 0.827 1.962 1.00 0.00 C ATOM 0 H VAL A 119 -4.385 2.977 3.856 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.308 4.121 1.225 1.00 0.00 H new ATOM 0 HB VAL A 119 -5.488 2.112 0.278 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -3.485 0.748 -0.068 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -3.158 2.491 -0.219 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -2.681 1.620 1.258 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -5.202 -0.093 1.377 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -4.505 0.722 2.797 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -6.200 1.019 2.344 1.00 0.00 H new ATOM 1731 N HIS A 120 -6.821 4.340 1.411 1.00 0.00 N ATOM 1732 CA HIS A 120 -8.234 4.552 1.424 1.00 0.00 C ATOM 1733 C HIS A 120 -8.478 5.188 0.106 1.00 0.00 C ATOM 1734 O HIS A 120 -7.555 5.818 -0.419 1.00 0.00 O ATOM 1735 CB HIS A 120 -8.747 5.417 2.596 1.00 0.00 C ATOM 1736 CG HIS A 120 -10.260 5.389 2.731 1.00 0.00 C ATOM 1737 ND1 HIS A 120 -11.040 4.329 2.313 1.00 0.00 N ATOM 1738 CD2 HIS A 120 -11.130 6.303 3.210 1.00 0.00 C ATOM 1739 CE1 HIS A 120 -12.299 4.594 2.530 1.00 0.00 C ATOM 1740 NE2 HIS A 120 -12.394 5.783 3.067 1.00 0.00 N ATOM 0 H HIS A 120 -6.363 4.805 0.627 1.00 0.00 H new ATOM 0 HA HIS A 120 -8.779 3.621 1.578 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -8.297 5.066 3.525 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.419 6.446 2.453 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -10.685 3.468 1.897 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -10.879 7.266 3.629 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -13.127 3.939 2.303 1.00 0.00 H new ATOM 1749 N GLU A 121 -9.586 4.969 -0.454 1.00 0.00 N ATOM 1750 CA GLU A 121 -9.851 5.378 -1.797 1.00 0.00 C ATOM 1751 C GLU A 121 -9.963 6.910 -1.955 1.00 0.00 C ATOM 1752 O GLU A 121 -11.012 7.532 -1.792 1.00 0.00 O ATOM 1753 CB GLU A 121 -11.037 4.607 -2.375 1.00 0.00 C ATOM 1754 CG GLU A 121 -11.018 3.092 -2.066 1.00 0.00 C ATOM 1755 CD GLU A 121 -11.494 2.731 -0.637 1.00 0.00 C ATOM 1756 OE1 GLU A 121 -10.645 2.680 0.300 1.00 0.00 O ATOM 1757 OE2 GLU A 121 -12.683 2.544 -0.432 1.00 0.00 O ATOM 0 H GLU A 121 -10.365 4.492 -0.001 1.00 0.00 H new ATOM 0 HA GLU A 121 -8.982 5.114 -2.399 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -11.960 5.035 -1.984 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -11.055 4.746 -3.456 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -11.651 2.577 -2.789 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -10.004 2.717 -2.205 1.00 0.00 H new ATOM 1764 N LYS A 122 -8.836 7.465 -2.210 1.00 0.00 N ATOM 1765 CA LYS A 122 -8.572 8.859 -2.423 1.00 0.00 C ATOM 1766 C LYS A 122 -7.215 8.846 -3.023 1.00 0.00 C ATOM 1767 O LYS A 122 -6.423 7.974 -2.649 1.00 0.00 O ATOM 1768 CB LYS A 122 -8.529 9.637 -1.098 1.00 0.00 C ATOM 1769 CG LYS A 122 -8.159 11.099 -1.267 1.00 0.00 C ATOM 1770 CD LYS A 122 -7.997 11.807 0.057 1.00 0.00 C ATOM 1771 CE LYS A 122 -7.571 13.247 -0.165 1.00 0.00 C ATOM 1772 NZ LYS A 122 -7.347 13.959 1.105 1.00 0.00 N ATOM 0 H LYS A 122 -7.985 6.908 -2.284 1.00 0.00 H new ATOM 0 HA LYS A 122 -9.337 9.337 -3.034 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -9.504 9.570 -0.615 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -7.809 9.163 -0.431 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -7.230 11.173 -1.832 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -8.929 11.601 -1.853 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -8.936 11.779 0.609 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -7.254 11.290 0.665 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -6.657 13.267 -0.758 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -8.336 13.767 -0.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -6.657 14.723 0.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -8.245 14.363 1.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -6.981 13.294 1.816 1.00 0.00 H new ATOM 1786 N ALA A 123 -6.934 9.738 -3.944 1.00 0.00 N ATOM 1787 CA ALA A 123 -5.685 9.683 -4.648 1.00 0.00 C ATOM 1788 C ALA A 123 -4.482 9.859 -3.735 1.00 0.00 C ATOM 1789 O ALA A 123 -4.117 10.965 -3.362 1.00 0.00 O ATOM 1790 CB ALA A 123 -5.660 10.706 -5.775 1.00 0.00 C ATOM 0 H ALA A 123 -7.551 10.503 -4.218 1.00 0.00 H new ATOM 0 HA ALA A 123 -5.609 8.682 -5.073 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -4.705 10.649 -6.297 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -6.469 10.496 -6.475 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -5.788 11.706 -5.361 1.00 0.00 H new ATOM 1796 N ASP A 124 -3.871 8.730 -3.442 1.00 0.00 N ATOM 1797 CA ASP A 124 -2.614 8.616 -2.741 1.00 0.00 C ATOM 1798 C ASP A 124 -1.679 8.707 -3.893 1.00 0.00 C ATOM 1799 O ASP A 124 -1.533 7.750 -4.637 1.00 0.00 O ATOM 1800 CB ASP A 124 -2.540 7.188 -2.054 1.00 0.00 C ATOM 1801 CG ASP A 124 -1.382 6.884 -1.052 1.00 0.00 C ATOM 1802 OD1 ASP A 124 -0.220 6.682 -1.338 1.00 0.00 O ATOM 1803 OD2 ASP A 124 -1.552 6.685 0.145 1.00 0.00 O ATOM 0 H ASP A 124 -4.259 7.823 -3.700 1.00 0.00 H new ATOM 0 HA ASP A 124 -2.428 9.342 -1.950 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -3.481 7.029 -1.527 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -2.490 6.444 -2.849 1.00 0.00 H new ATOM 1808 N ASP A 125 -1.215 9.893 -4.170 1.00 0.00 N ATOM 1809 CA ASP A 125 -0.477 10.106 -5.383 1.00 0.00 C ATOM 1810 C ASP A 125 1.007 10.196 -5.109 1.00 0.00 C ATOM 1811 O ASP A 125 1.450 10.831 -4.150 1.00 0.00 O ATOM 1812 CB ASP A 125 -1.046 11.285 -6.169 1.00 0.00 C ATOM 1813 CG ASP A 125 -0.611 11.309 -7.611 1.00 0.00 C ATOM 1814 OD1 ASP A 125 -0.971 10.389 -8.368 1.00 0.00 O ATOM 1815 OD2 ASP A 125 0.089 12.244 -8.016 1.00 0.00 O ATOM 0 H ASP A 125 -1.332 10.718 -3.581 1.00 0.00 H new ATOM 0 HA ASP A 125 -0.598 9.239 -6.032 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -2.135 11.249 -6.126 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -0.739 12.214 -5.689 1.00 0.00 H new ATOM 1820 N LEU A 126 1.736 9.594 -5.992 1.00 0.00 N ATOM 1821 CA LEU A 126 3.136 9.194 -5.820 1.00 0.00 C ATOM 1822 C LEU A 126 4.188 10.169 -5.340 1.00 0.00 C ATOM 1823 O LEU A 126 4.613 10.094 -4.188 1.00 0.00 O ATOM 1824 CB LEU A 126 3.637 8.470 -7.112 1.00 0.00 C ATOM 1825 CG LEU A 126 3.778 9.256 -8.466 1.00 0.00 C ATOM 1826 CD1 LEU A 126 4.409 8.373 -9.523 1.00 0.00 C ATOM 1827 CD2 LEU A 126 2.448 9.766 -8.984 1.00 0.00 C ATOM 0 H LEU A 126 1.370 9.345 -6.911 1.00 0.00 H new ATOM 0 HA LEU A 126 3.050 8.556 -4.940 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.615 8.045 -6.884 1.00 0.00 H new ATOM 0 HB3 LEU A 126 2.961 7.634 -7.294 1.00 0.00 H new ATOM 0 HG LEU A 126 4.414 10.117 -8.260 1.00 0.00 H new ATOM 0 HD11 LEU A 126 4.500 8.930 -10.455 1.00 0.00 H new ATOM 0 HD12 LEU A 126 5.398 8.057 -9.190 1.00 0.00 H new ATOM 0 HD13 LEU A 126 3.783 7.495 -9.685 1.00 0.00 H new ATOM 0 HD21 LEU A 126 2.603 10.301 -9.921 1.00 0.00 H new ATOM 0 HD22 LEU A 126 1.777 8.924 -9.154 1.00 0.00 H new ATOM 0 HD23 LEU A 126 2.006 10.440 -8.250 1.00 0.00 H new ATOM 1839 N GLY A 127 4.587 11.055 -6.185 1.00 0.00 N ATOM 1840 CA GLY A 127 5.706 11.885 -5.891 1.00 0.00 C ATOM 1841 C GLY A 127 5.427 12.864 -4.830 1.00 0.00 C ATOM 1842 O GLY A 127 6.069 12.874 -3.776 1.00 0.00 O ATOM 0 H GLY A 127 4.152 11.225 -7.092 1.00 0.00 H new ATOM 0 HA2 GLY A 127 6.547 11.260 -5.590 1.00 0.00 H new ATOM 0 HA3 GLY A 127 6.009 12.413 -6.795 1.00 0.00 H new ATOM 1846 N LYS A 128 4.479 13.675 -5.081 1.00 0.00 N ATOM 1847 CA LYS A 128 4.166 14.743 -4.205 1.00 0.00 C ATOM 1848 C LYS A 128 2.676 14.874 -4.021 1.00 0.00 C ATOM 1849 O LYS A 128 2.206 15.998 -3.859 1.00 0.00 O ATOM 1850 CB LYS A 128 4.681 16.094 -4.788 1.00 0.00 C ATOM 1851 CG LYS A 128 6.195 16.401 -4.714 1.00 0.00 C ATOM 1852 CD LYS A 128 7.053 15.524 -5.613 1.00 0.00 C ATOM 1853 CE LYS A 128 8.525 15.888 -5.518 1.00 0.00 C ATOM 1854 NZ LYS A 128 9.066 15.745 -4.145 1.00 0.00 N ATOM 0 H LYS A 128 3.887 13.621 -5.910 1.00 0.00 H new ATOM 0 HA LYS A 128 4.645 14.524 -3.251 1.00 0.00 H new ATOM 0 HB2 LYS A 128 4.385 16.137 -5.836 1.00 0.00 H new ATOM 0 HB3 LYS A 128 4.154 16.899 -4.275 1.00 0.00 H new ATOM 0 HG2 LYS A 128 6.356 17.445 -4.983 1.00 0.00 H new ATOM 0 HG3 LYS A 128 6.529 16.282 -3.683 1.00 0.00 H new ATOM 0 HD2 LYS A 128 6.919 14.478 -5.336 1.00 0.00 H new ATOM 0 HD3 LYS A 128 6.719 15.626 -6.646 1.00 0.00 H new ATOM 0 HE2 LYS A 128 9.096 15.254 -6.196 1.00 0.00 H new ATOM 0 HE3 LYS A 128 8.662 16.916 -5.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 10.104 15.806 -4.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 8.690 16.505 -3.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 8.784 14.823 -3.755 1.00 0.00 H new ATOM 1868 N GLY A 129 1.924 13.794 -3.990 1.00 0.00 N ATOM 1869 CA GLY A 129 0.434 13.859 -3.914 1.00 0.00 C ATOM 1870 C GLY A 129 -0.269 14.609 -5.086 1.00 0.00 C ATOM 1871 O GLY A 129 -1.383 14.274 -5.466 1.00 0.00 O ATOM 0 H GLY A 129 2.298 12.845 -4.015 1.00 0.00 H new ATOM 0 HA2 GLY A 129 0.046 12.841 -3.873 1.00 0.00 H new ATOM 0 HA3 GLY A 129 0.157 14.344 -2.978 1.00 0.00 H new ATOM 1875 N GLY A 130 0.362 15.627 -5.600 1.00 0.00 N ATOM 1876 CA GLY A 130 -0.156 16.379 -6.663 1.00 0.00 C ATOM 1877 C GLY A 130 0.246 17.809 -6.579 1.00 0.00 C ATOM 1878 O GLY A 130 0.302 18.484 -7.602 1.00 0.00 O ATOM 0 H GLY A 130 1.272 15.949 -5.270 1.00 0.00 H new ATOM 0 HA2 GLY A 130 0.191 15.959 -7.607 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -1.244 16.307 -6.662 1.00 0.00 H new ATOM 1882 N ASN A 131 0.554 18.276 -5.391 1.00 0.00 N ATOM 1883 CA ASN A 131 0.847 19.725 -5.253 1.00 0.00 C ATOM 1884 C ASN A 131 1.413 19.957 -3.879 1.00 0.00 C ATOM 1885 O ASN A 131 1.511 18.986 -3.120 1.00 0.00 O ATOM 1886 CB ASN A 131 -0.460 20.517 -5.471 1.00 0.00 C ATOM 1887 CG ASN A 131 -0.298 21.983 -5.800 1.00 0.00 C ATOM 1888 OD1 ASN A 131 -1.159 22.786 -5.464 1.00 0.00 O ATOM 1889 ND2 ASN A 131 0.750 22.341 -6.502 1.00 0.00 N ATOM 0 H ASN A 131 0.613 17.726 -4.534 1.00 0.00 H new ATOM 0 HA ASN A 131 1.574 20.061 -5.993 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -1.018 20.043 -6.278 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -1.068 20.432 -4.570 1.00 0.00 H new ATOM 0 HD21 ASN A 131 0.866 23.314 -6.785 1.00 0.00 H new ATOM 0 HD22 ASN A 131 1.449 21.646 -6.765 1.00 0.00 H new ATOM 1896 N GLU A 132 1.767 21.202 -3.507 1.00 0.00 N ATOM 1897 CA GLU A 132 2.417 21.375 -2.199 1.00 0.00 C ATOM 1898 C GLU A 132 1.517 20.962 -1.005 1.00 0.00 C ATOM 1899 O GLU A 132 1.992 20.365 -0.051 1.00 0.00 O ATOM 1900 CB GLU A 132 3.038 22.758 -2.009 1.00 0.00 C ATOM 1901 CG GLU A 132 2.076 23.923 -1.805 1.00 0.00 C ATOM 1902 CD GLU A 132 1.094 24.087 -2.908 1.00 0.00 C ATOM 1903 OE1 GLU A 132 1.466 24.602 -3.976 1.00 0.00 O ATOM 1904 OE2 GLU A 132 -0.066 23.711 -2.718 1.00 0.00 O ATOM 0 H GLU A 132 1.626 22.051 -4.054 1.00 0.00 H new ATOM 0 HA GLU A 132 3.249 20.671 -2.205 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.706 22.715 -1.149 1.00 0.00 H new ATOM 0 HB3 GLU A 132 3.655 22.976 -2.881 1.00 0.00 H new ATOM 0 HG2 GLU A 132 1.537 23.778 -0.869 1.00 0.00 H new ATOM 0 HG3 GLU A 132 2.651 24.843 -1.702 1.00 0.00 H new ATOM 1911 N GLU A 133 0.241 21.292 -1.051 1.00 0.00 N ATOM 1912 CA GLU A 133 -0.652 20.813 -0.008 1.00 0.00 C ATOM 1913 C GLU A 133 -1.157 19.427 -0.349 1.00 0.00 C ATOM 1914 O GLU A 133 -1.375 18.594 0.528 1.00 0.00 O ATOM 1915 CB GLU A 133 -1.801 21.772 0.269 1.00 0.00 C ATOM 1916 CG GLU A 133 -2.667 22.111 -0.921 1.00 0.00 C ATOM 1917 CD GLU A 133 -3.758 23.063 -0.541 1.00 0.00 C ATOM 1918 OE1 GLU A 133 -3.471 24.270 -0.363 1.00 0.00 O ATOM 1919 OE2 GLU A 133 -4.914 22.633 -0.396 1.00 0.00 O ATOM 0 H GLU A 133 -0.192 21.870 -1.772 1.00 0.00 H new ATOM 0 HA GLU A 133 -0.076 20.760 0.916 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -2.433 21.340 1.045 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -1.390 22.697 0.672 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -2.054 22.551 -1.707 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -3.102 21.199 -1.329 1.00 0.00 H new ATOM 1926 N SER A 134 -1.280 19.162 -1.630 1.00 0.00 N ATOM 1927 CA SER A 134 -1.752 17.900 -2.122 1.00 0.00 C ATOM 1928 C SER A 134 -0.819 16.736 -1.760 1.00 0.00 C ATOM 1929 O SER A 134 -1.205 15.618 -1.842 1.00 0.00 O ATOM 1930 CB SER A 134 -2.007 17.981 -3.606 1.00 0.00 C ATOM 1931 OG SER A 134 -2.821 19.096 -3.885 1.00 0.00 O ATOM 0 H SER A 134 -1.050 19.831 -2.365 1.00 0.00 H new ATOM 0 HA SER A 134 -2.697 17.684 -1.623 1.00 0.00 H new ATOM 0 HB2 SER A 134 -1.062 18.064 -4.144 1.00 0.00 H new ATOM 0 HB3 SER A 134 -2.492 17.068 -3.952 1.00 0.00 H new ATOM 0 HG SER A 134 -2.984 19.148 -4.850 1.00 0.00 H new ATOM 1937 N THR A 135 0.438 17.007 -1.427 1.00 0.00 N ATOM 1938 CA THR A 135 1.333 15.932 -0.988 1.00 0.00 C ATOM 1939 C THR A 135 0.946 15.463 0.390 1.00 0.00 C ATOM 1940 O THR A 135 0.979 14.264 0.700 1.00 0.00 O ATOM 1941 CB THR A 135 2.848 16.346 -1.025 1.00 0.00 C ATOM 1942 OG1 THR A 135 3.700 15.230 -0.694 1.00 0.00 O ATOM 1943 CG2 THR A 135 3.173 17.511 -0.109 1.00 0.00 C ATOM 0 H THR A 135 0.857 17.937 -1.450 1.00 0.00 H new ATOM 0 HA THR A 135 1.217 15.112 -1.696 1.00 0.00 H new ATOM 0 HB THR A 135 3.039 16.668 -2.049 1.00 0.00 H new ATOM 0 HG1 THR A 135 4.638 15.514 -0.726 1.00 0.00 H new ATOM 0 HG21 THR A 135 4.235 17.746 -0.182 1.00 0.00 H new ATOM 0 HG22 THR A 135 2.587 18.381 -0.405 1.00 0.00 H new ATOM 0 HG23 THR A 135 2.931 17.244 0.920 1.00 0.00 H new ATOM 1951 N LYS A 136 0.515 16.401 1.165 1.00 0.00 N ATOM 1952 CA LYS A 136 0.175 16.180 2.553 1.00 0.00 C ATOM 1953 C LYS A 136 -1.131 15.431 2.614 1.00 0.00 C ATOM 1954 O LYS A 136 -1.263 14.422 3.294 1.00 0.00 O ATOM 1955 CB LYS A 136 0.007 17.531 3.258 1.00 0.00 C ATOM 1956 CG LYS A 136 1.181 18.483 3.097 1.00 0.00 C ATOM 1957 CD LYS A 136 0.865 19.838 3.705 1.00 0.00 C ATOM 1958 CE LYS A 136 1.990 20.830 3.471 1.00 0.00 C ATOM 1959 NZ LYS A 136 1.685 22.157 4.038 1.00 0.00 N ATOM 0 H LYS A 136 0.383 17.364 0.857 1.00 0.00 H new ATOM 0 HA LYS A 136 0.964 15.609 3.042 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -0.891 18.016 2.875 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -0.155 17.353 4.321 1.00 0.00 H new ATOM 0 HG2 LYS A 136 2.065 18.062 3.576 1.00 0.00 H new ATOM 0 HG3 LYS A 136 1.417 18.600 2.039 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -0.058 20.225 3.273 1.00 0.00 H new ATOM 0 HD3 LYS A 136 0.694 19.726 4.776 1.00 0.00 H new ATOM 0 HE2 LYS A 136 2.908 20.448 3.917 1.00 0.00 H new ATOM 0 HE3 LYS A 136 2.171 20.926 2.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 2.479 22.803 3.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 0.823 22.534 3.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 1.537 22.071 5.064 1.00 0.00 H new ATOM 1973 N THR A 137 -2.076 15.934 1.870 1.00 0.00 N ATOM 1974 CA THR A 137 -3.402 15.404 1.855 1.00 0.00 C ATOM 1975 C THR A 137 -3.569 14.233 0.857 1.00 0.00 C ATOM 1976 O THR A 137 -4.485 13.404 1.012 1.00 0.00 O ATOM 1977 CB THR A 137 -4.406 16.542 1.550 1.00 0.00 C ATOM 1978 OG1 THR A 137 -5.765 16.098 1.724 1.00 0.00 O ATOM 1979 CG2 THR A 137 -4.243 17.112 0.161 1.00 0.00 C ATOM 0 H THR A 137 -1.941 16.733 1.251 1.00 0.00 H new ATOM 0 HA THR A 137 -3.606 14.989 2.842 1.00 0.00 H new ATOM 0 HB THR A 137 -4.184 17.334 2.265 1.00 0.00 H new ATOM 0 HG1 THR A 137 -6.378 16.836 1.527 1.00 0.00 H new ATOM 0 HG21 THR A 137 -4.974 17.906 0.005 1.00 0.00 H new ATOM 0 HG22 THR A 137 -3.237 17.518 0.050 1.00 0.00 H new ATOM 0 HG23 THR A 137 -4.400 16.325 -0.576 1.00 0.00 H new ATOM 1987 N GLY A 138 -2.704 14.188 -0.150 1.00 0.00 N ATOM 1988 CA GLY A 138 -2.781 13.195 -1.214 1.00 0.00 C ATOM 1989 C GLY A 138 -2.476 11.837 -0.718 1.00 0.00 C ATOM 1990 O GLY A 138 -3.348 10.977 -0.735 1.00 0.00 O ATOM 0 H GLY A 138 -1.927 14.841 -0.251 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -3.779 13.207 -1.651 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -2.082 13.458 -2.008 1.00 0.00 H new ATOM 1994 N ASN A 139 -1.215 11.606 -0.300 1.00 0.00 N ATOM 1995 CA ASN A 139 -0.919 10.291 0.398 1.00 0.00 C ATOM 1996 C ASN A 139 -1.984 10.160 1.503 1.00 0.00 C ATOM 1997 O ASN A 139 -2.204 11.118 2.267 1.00 0.00 O ATOM 1998 CB ASN A 139 0.504 10.231 1.022 1.00 0.00 C ATOM 1999 CG ASN A 139 0.914 8.832 1.630 1.00 0.00 C ATOM 2000 OD1 ASN A 139 0.600 7.677 1.069 1.00 0.00 O ATOM 2001 ND2 ASN A 139 1.574 8.886 2.767 1.00 0.00 N ATOM 0 H ASN A 139 -0.425 12.242 -0.410 1.00 0.00 H new ATOM 0 HA ASN A 139 -0.950 9.476 -0.325 1.00 0.00 H new ATOM 0 HB2 ASN A 139 1.231 10.503 0.257 1.00 0.00 H new ATOM 0 HB3 ASN A 139 0.571 10.984 1.807 1.00 0.00 H new ATOM 0 HD21 ASN A 139 1.855 8.024 3.235 1.00 0.00 H new ATOM 0 HD22 ASN A 139 1.805 9.790 3.180 1.00 0.00 H new ATOM 2008 N ALA A 140 -2.613 9.003 1.606 1.00 0.00 N ATOM 2009 CA ALA A 140 -3.862 8.894 2.345 1.00 0.00 C ATOM 2010 C ALA A 140 -3.728 9.124 3.842 1.00 0.00 C ATOM 2011 O ALA A 140 -2.626 9.061 4.414 1.00 0.00 O ATOM 2012 CB ALA A 140 -4.537 7.559 2.051 1.00 0.00 C ATOM 0 H ALA A 140 -2.284 8.131 1.192 1.00 0.00 H new ATOM 0 HA ALA A 140 -4.493 9.708 1.989 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -5.470 7.492 2.611 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.748 7.485 0.984 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -3.877 6.744 2.348 1.00 0.00 H new ATOM 2018 N GLY A 141 -4.877 9.434 4.440 1.00 0.00 N ATOM 2019 CA GLY A 141 -4.972 9.782 5.832 1.00 0.00 C ATOM 2020 C GLY A 141 -4.452 8.718 6.736 1.00 0.00 C ATOM 2021 O GLY A 141 -5.027 7.627 6.824 1.00 0.00 O ATOM 0 H GLY A 141 -5.773 9.447 3.953 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -4.418 10.704 6.009 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -6.014 9.984 6.080 1.00 0.00 H new ATOM 2025 N SER A 142 -3.436 9.074 7.475 1.00 0.00 N ATOM 2026 CA SER A 142 -2.681 8.178 8.316 1.00 0.00 C ATOM 2027 C SER A 142 -3.460 7.715 9.563 1.00 0.00 C ATOM 2028 O SER A 142 -2.917 7.038 10.442 1.00 0.00 O ATOM 2029 CB SER A 142 -1.424 8.912 8.706 1.00 0.00 C ATOM 2030 OG SER A 142 -0.842 9.488 7.542 1.00 0.00 O ATOM 0 H SER A 142 -3.096 10.035 7.511 1.00 0.00 H new ATOM 0 HA SER A 142 -2.460 7.263 7.767 1.00 0.00 H new ATOM 0 HB2 SER A 142 -1.653 9.689 9.436 1.00 0.00 H new ATOM 0 HB3 SER A 142 -0.720 8.227 9.179 1.00 0.00 H new ATOM 0 HG SER A 142 -0.234 10.211 7.804 1.00 0.00 H new ATOM 2036 N ARG A 143 -4.683 8.116 9.667 1.00 0.00 N ATOM 2037 CA ARG A 143 -5.512 7.679 10.753 1.00 0.00 C ATOM 2038 C ARG A 143 -6.845 7.221 10.220 1.00 0.00 C ATOM 2039 O ARG A 143 -7.659 6.672 10.959 1.00 0.00 O ATOM 2040 CB ARG A 143 -5.720 8.801 11.774 1.00 0.00 C ATOM 2041 CG ARG A 143 -4.435 9.352 12.365 1.00 0.00 C ATOM 2042 CD ARG A 143 -4.726 10.397 13.406 1.00 0.00 C ATOM 2043 NE ARG A 143 -3.510 11.013 13.929 1.00 0.00 N ATOM 2044 CZ ARG A 143 -3.438 11.674 15.088 1.00 0.00 C ATOM 2045 NH1 ARG A 143 -4.499 11.738 15.891 1.00 0.00 N ATOM 2046 NH2 ARG A 143 -2.304 12.253 15.450 1.00 0.00 N ATOM 0 H ARG A 143 -5.138 8.750 9.011 1.00 0.00 H new ATOM 0 HA ARG A 143 -5.012 6.850 11.255 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -6.265 9.615 11.296 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -6.348 8.429 12.583 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -3.858 8.541 12.810 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -3.822 9.783 11.573 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -5.364 11.168 12.975 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -5.283 9.944 14.226 1.00 0.00 H new ATOM 0 HE ARG A 143 -2.659 10.933 13.373 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -5.370 11.281 15.622 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -4.440 12.244 16.775 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -1.485 12.195 14.844 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -2.249 12.758 16.335 1.00 0.00 H new ATOM 2060 N LEU A 144 -7.049 7.386 8.930 1.00 0.00 N ATOM 2061 CA LEU A 144 -8.345 7.112 8.341 1.00 0.00 C ATOM 2062 C LEU A 144 -8.545 5.641 8.137 1.00 0.00 C ATOM 2063 O LEU A 144 -9.638 5.122 8.385 1.00 0.00 O ATOM 2064 CB LEU A 144 -8.546 7.867 7.023 1.00 0.00 C ATOM 2065 CG LEU A 144 -8.566 9.398 7.112 1.00 0.00 C ATOM 2066 CD1 LEU A 144 -8.752 10.003 5.731 1.00 0.00 C ATOM 2067 CD2 LEU A 144 -9.670 9.875 8.049 1.00 0.00 C ATOM 0 H LEU A 144 -6.339 7.707 8.271 1.00 0.00 H new ATOM 0 HA LEU A 144 -9.096 7.470 9.045 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -7.751 7.575 6.337 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.486 7.538 6.580 1.00 0.00 H new ATOM 0 HG LEU A 144 -7.609 9.728 7.517 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -8.764 11.090 5.809 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -7.930 9.695 5.085 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -9.695 9.659 5.307 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -9.663 10.964 8.095 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -10.636 9.534 7.677 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -9.501 9.469 9.046 1.00 0.00 H new ATOM 2079 N ALA A 145 -7.505 4.971 7.706 1.00 0.00 N ATOM 2080 CA ALA A 145 -7.545 3.566 7.456 1.00 0.00 C ATOM 2081 C ALA A 145 -6.142 3.057 7.358 1.00 0.00 C ATOM 2082 O ALA A 145 -5.421 3.380 6.418 1.00 0.00 O ATOM 2083 CB ALA A 145 -8.290 3.279 6.168 1.00 0.00 C ATOM 0 H ALA A 145 -6.598 5.399 7.519 1.00 0.00 H new ATOM 0 HA ALA A 145 -8.067 3.066 8.271 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -8.311 2.204 5.992 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -9.310 3.654 6.246 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -7.785 3.773 5.338 1.00 0.00 H new ATOM 2089 N CYS A 146 -5.728 2.331 8.340 1.00 0.00 N ATOM 2090 CA CYS A 146 -4.425 1.763 8.319 1.00 0.00 C ATOM 2091 C CYS A 146 -4.560 0.337 8.826 1.00 0.00 C ATOM 2092 O CYS A 146 -5.540 0.007 9.513 1.00 0.00 O ATOM 2093 CB CYS A 146 -3.451 2.542 9.234 1.00 0.00 C ATOM 2094 SG CYS A 146 -3.513 4.361 9.160 1.00 0.00 S ATOM 0 H CYS A 146 -6.277 2.116 9.172 1.00 0.00 H new ATOM 0 HA CYS A 146 -4.021 1.801 7.307 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -3.640 2.239 10.264 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -2.436 2.229 8.991 1.00 0.00 H new ATOM 2099 N GLY A 147 -3.636 -0.499 8.471 1.00 0.00 N ATOM 2100 CA GLY A 147 -3.629 -1.851 8.945 1.00 0.00 C ATOM 2101 C GLY A 147 -2.265 -2.437 8.772 1.00 0.00 C ATOM 2102 O GLY A 147 -1.647 -2.204 7.758 1.00 0.00 O ATOM 0 H GLY A 147 -2.865 -0.266 7.845 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -3.917 -1.880 9.996 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -4.362 -2.443 8.397 1.00 0.00 H new ATOM 2106 N VAL A 148 -1.754 -3.122 9.767 1.00 0.00 N ATOM 2107 CA VAL A 148 -0.484 -3.765 9.650 1.00 0.00 C ATOM 2108 C VAL A 148 -0.533 -4.868 8.636 1.00 0.00 C ATOM 2109 O VAL A 148 -1.366 -5.780 8.690 1.00 0.00 O ATOM 2110 CB VAL A 148 -0.020 -4.322 11.021 1.00 0.00 C ATOM 2111 CG1 VAL A 148 1.150 -5.286 10.870 1.00 0.00 C ATOM 2112 CG2 VAL A 148 0.391 -3.178 11.906 1.00 0.00 C ATOM 0 H VAL A 148 -2.210 -3.244 10.671 1.00 0.00 H new ATOM 0 HA VAL A 148 0.237 -3.019 9.315 1.00 0.00 H new ATOM 0 HB VAL A 148 -0.853 -4.869 11.464 1.00 0.00 H new ATOM 0 HG11 VAL A 148 1.447 -5.655 11.852 1.00 0.00 H new ATOM 0 HG12 VAL A 148 0.851 -6.125 10.242 1.00 0.00 H new ATOM 0 HG13 VAL A 148 1.991 -4.768 10.408 1.00 0.00 H new ATOM 0 HG21 VAL A 148 0.718 -3.564 12.871 1.00 0.00 H new ATOM 0 HG22 VAL A 148 1.209 -2.631 11.438 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -0.456 -2.508 12.052 1.00 0.00 H new ATOM 2122 N ILE A 149 0.314 -4.710 7.681 1.00 0.00 N ATOM 2123 CA ILE A 149 0.513 -5.648 6.665 1.00 0.00 C ATOM 2124 C ILE A 149 1.883 -6.183 6.848 1.00 0.00 C ATOM 2125 O ILE A 149 2.816 -5.460 7.267 1.00 0.00 O ATOM 2126 CB ILE A 149 0.339 -5.044 5.235 1.00 0.00 C ATOM 2127 CG1 ILE A 149 0.749 -6.052 4.125 1.00 0.00 C ATOM 2128 CG2 ILE A 149 1.091 -3.750 5.097 1.00 0.00 C ATOM 2129 CD1 ILE A 149 0.530 -5.554 2.711 1.00 0.00 C ATOM 0 H ILE A 149 0.906 -3.884 7.594 1.00 0.00 H new ATOM 0 HA ILE A 149 -0.241 -6.432 6.738 1.00 0.00 H new ATOM 0 HB ILE A 149 -0.722 -4.833 5.102 1.00 0.00 H new ATOM 0 HG12 ILE A 149 1.803 -6.301 4.250 1.00 0.00 H new ATOM 0 HG13 ILE A 149 0.185 -6.974 4.263 1.00 0.00 H new ATOM 0 HG21 ILE A 149 0.951 -3.353 4.091 1.00 0.00 H new ATOM 0 HG22 ILE A 149 0.716 -3.032 5.826 1.00 0.00 H new ATOM 0 HG23 ILE A 149 2.152 -3.925 5.274 1.00 0.00 H new ATOM 0 HD11 ILE A 149 0.843 -6.321 2.003 1.00 0.00 H new ATOM 0 HD12 ILE A 149 -0.527 -5.333 2.563 1.00 0.00 H new ATOM 0 HD13 ILE A 149 1.116 -4.649 2.549 1.00 0.00 H new ATOM 2141 N GLY A 150 2.002 -7.406 6.627 1.00 0.00 N ATOM 2142 CA GLY A 150 3.235 -8.021 6.745 1.00 0.00 C ATOM 2143 C GLY A 150 3.191 -9.269 6.025 1.00 0.00 C ATOM 2144 O GLY A 150 2.119 -9.873 5.907 1.00 0.00 O ATOM 0 H GLY A 150 1.237 -8.023 6.354 1.00 0.00 H new ATOM 0 HA2 GLY A 150 4.019 -7.379 6.344 1.00 0.00 H new ATOM 0 HA3 GLY A 150 3.473 -8.196 7.794 1.00 0.00 H new ATOM 2148 N ILE A 151 4.290 -9.659 5.486 1.00 0.00 N ATOM 2149 CA ILE A 151 4.387 -10.917 4.845 1.00 0.00 C ATOM 2150 C ILE A 151 4.323 -12.062 5.878 1.00 0.00 C ATOM 2151 O ILE A 151 5.293 -12.343 6.586 1.00 0.00 O ATOM 2152 CB ILE A 151 5.690 -10.995 3.986 1.00 0.00 C ATOM 2153 CG1 ILE A 151 6.926 -10.558 4.819 1.00 0.00 C ATOM 2154 CG2 ILE A 151 5.547 -10.142 2.728 1.00 0.00 C ATOM 2155 CD1 ILE A 151 8.240 -10.595 4.078 1.00 0.00 C ATOM 0 H ILE A 151 5.150 -9.111 5.478 1.00 0.00 H new ATOM 0 HA ILE A 151 3.537 -11.031 4.173 1.00 0.00 H new ATOM 0 HB ILE A 151 5.843 -12.030 3.681 1.00 0.00 H new ATOM 0 HG12 ILE A 151 6.760 -9.544 5.183 1.00 0.00 H new ATOM 0 HG13 ILE A 151 7.002 -11.203 5.695 1.00 0.00 H new ATOM 0 HG21 ILE A 151 6.462 -10.206 2.139 1.00 0.00 H new ATOM 0 HG22 ILE A 151 4.708 -10.506 2.135 1.00 0.00 H new ATOM 0 HG23 ILE A 151 5.369 -9.104 3.010 1.00 0.00 H new ATOM 0 HD11 ILE A 151 9.042 -10.273 4.743 1.00 0.00 H new ATOM 0 HD12 ILE A 151 8.437 -11.611 3.737 1.00 0.00 H new ATOM 0 HD13 ILE A 151 8.192 -9.927 3.218 1.00 0.00 H new ATOM 2167 N ALA A 152 3.186 -12.700 5.956 1.00 0.00 N ATOM 2168 CA ALA A 152 3.002 -13.851 6.813 1.00 0.00 C ATOM 2169 C ALA A 152 2.658 -15.003 5.921 1.00 0.00 C ATOM 2170 O ALA A 152 1.920 -14.817 4.982 1.00 0.00 O ATOM 2171 CB ALA A 152 1.887 -13.593 7.817 1.00 0.00 C ATOM 0 H ALA A 152 2.355 -12.438 5.426 1.00 0.00 H new ATOM 0 HA ALA A 152 3.905 -14.063 7.385 1.00 0.00 H new ATOM 0 HB1 ALA A 152 1.761 -14.468 8.454 1.00 0.00 H new ATOM 0 HB2 ALA A 152 2.144 -12.730 8.432 1.00 0.00 H new ATOM 0 HB3 ALA A 152 0.957 -13.395 7.285 1.00 0.00 H new ATOM 2177 N GLN A 153 3.196 -16.168 6.185 1.00 0.00 N ATOM 2178 CA GLN A 153 2.988 -17.294 5.299 1.00 0.00 C ATOM 2179 C GLN A 153 2.223 -18.416 5.987 1.00 0.00 C ATOM 2180 O GLN A 153 2.740 -19.006 6.958 1.00 0.00 O ATOM 2181 CB GLN A 153 4.317 -17.783 4.666 1.00 0.00 C ATOM 2182 CG GLN A 153 5.363 -18.285 5.655 1.00 0.00 C ATOM 2183 CD GLN A 153 6.648 -18.714 4.987 1.00 0.00 C ATOM 2184 OE1 GLN A 153 6.795 -19.865 4.577 1.00 0.00 O ATOM 2185 NE2 GLN A 153 7.598 -17.825 4.917 1.00 0.00 N ATOM 2186 OXT GLN A 153 1.125 -18.753 5.536 1.00 0.00 O ATOM 0 H GLN A 153 3.778 -16.364 7.000 1.00 0.00 H new ATOM 0 HA GLN A 153 2.363 -16.949 4.475 1.00 0.00 H new ATOM 0 HB2 GLN A 153 4.092 -18.584 3.962 1.00 0.00 H new ATOM 0 HB3 GLN A 153 4.749 -16.965 4.090 1.00 0.00 H new ATOM 0 HG2 GLN A 153 5.580 -17.498 6.377 1.00 0.00 H new ATOM 0 HG3 GLN A 153 4.952 -19.126 6.214 1.00 0.00 H new ATOM 0 HE21 GLN A 153 7.439 -16.880 5.267 1.00 0.00 H new ATOM 0 HE22 GLN A 153 8.500 -18.074 4.512 1.00 0.00 H new TER 2195 GLN A 153 HETATM 2196 CU CU A 201 0.000 6.206 0.172 1.00 0.00 CU