USER MOD reduce.3.24.130724 H: found=0, std=0, add=1057, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1058 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 88 GLN : amide:sc= -1.89 X(o=-3,f=-2.7) USER MOD Set 1.2: A 89 GLN : amide:sc= -1.07! C(o=-3!,f=-3.9!) USER MOD Set 2.1: A 53 ASN : amide:sc= -0.0158 X(o=-3.9,f=-4) USER MOD Set 2.2: A 70 HIS : no HE2:sc= -3.92! C(o=-3.9!,f=-4.7!) USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= -2.48! K(o=-2.5!,f=-1) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -0.943 K(o=-0.94,f=-1.8) USER MOD Single : A 11 ASN : amide:sc= -3 K(o=-3,f=-7.3!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 MET CE :methyl -106:sc= -3.69! (180deg=-8.89!) USER MOD Single : A 18 GLN : amide:sc= -0.0775 K(o=-0.078,f=-1.4!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 SER OG : rot 45:sc= 0.606 USER MOD Single : A 28 SER OG : rot 180:sc= -0.419 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -2.65 K(o=-2.6,f=-3.6) USER MOD Single : A 38 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.275) USER MOD Single : A 41 TYR OH : rot 74:sc= 0.235 USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0338) USER MOD Single : A 67 ASN : amide:sc= -2.39! K(o=-2.4!,f=-1.1) USER MOD Single : A 69 HIS : no HD1:sc= -5.18! K(o=-5.2!,f=-2.4) USER MOD Single : A 72 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl -108:sc= -8.39! (180deg=-15.7!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : no HE2:sc= -4.32! C(o=-4.3!,f=-7.8!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 MET CE :methyl 159:sc= -3.53! (180deg=-3.84!) USER MOD Single : A 95 HIS : no HD1:sc= -6.14! C(o=-6.1!,f=-6.7!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 107 LYS NZ :NH3+ -156:sc= -0.118 (180deg=-0.617) USER MOD Single : A 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ -127:sc= 0.0872 (180deg=-2.24!) USER MOD Single : A 111 THR OG1 : rot -170:sc= 0.0844 USER MOD Single : A 116 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 HIS : no HD1:sc= -16.6! C(o=-17!,f=-15!) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 ASN : amide:sc= -0.0322 X(o=-0.032,f=-0.0098) USER MOD Single : A 130 ASN : amide:sc= -0.0104 X(o=-0.01,f=-0.13) USER MOD Single : A 131 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 26 N GLU A 3 -5.697 -10.630 -10.308 1.00 0.00 N ATOM 27 CA GLU A 3 -5.898 -9.946 -9.043 1.00 0.00 C ATOM 28 C GLU A 3 -6.461 -8.544 -9.281 1.00 0.00 C ATOM 29 O GLU A 3 -7.126 -7.982 -8.411 1.00 0.00 O ATOM 30 CB GLU A 3 -4.596 -9.884 -8.239 1.00 0.00 C ATOM 31 CG GLU A 3 -3.929 -11.260 -8.172 1.00 0.00 C ATOM 32 CD GLU A 3 -3.903 -11.786 -6.736 1.00 0.00 C ATOM 33 OE1 GLU A 3 -4.999 -12.112 -6.231 1.00 0.00 O ATOM 34 OE2 GLU A 3 -2.788 -11.849 -6.175 1.00 0.00 O ATOM 0 HA GLU A 3 -6.622 -10.513 -8.458 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -3.915 -9.167 -8.697 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -4.803 -9.527 -7.230 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -4.467 -11.961 -8.810 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -2.912 -11.194 -8.558 1.00 0.00 H new ATOM 41 N ILE A 4 -6.174 -8.018 -10.462 1.00 0.00 N ATOM 42 CA ILE A 4 -6.644 -6.692 -10.825 1.00 0.00 C ATOM 43 C ILE A 4 -8.163 -6.629 -10.655 1.00 0.00 C ATOM 44 O ILE A 4 -8.701 -5.617 -10.210 1.00 0.00 O ATOM 45 CB ILE A 4 -6.167 -6.321 -12.231 1.00 0.00 C ATOM 46 CG1 ILE A 4 -4.717 -6.753 -12.450 1.00 0.00 C ATOM 47 CG2 ILE A 4 -6.368 -4.828 -12.502 1.00 0.00 C ATOM 48 CD1 ILE A 4 -3.845 -6.373 -11.251 1.00 0.00 C ATOM 0 H ILE A 4 -5.622 -8.486 -11.180 1.00 0.00 H new ATOM 0 HA ILE A 4 -6.217 -5.942 -10.160 1.00 0.00 H new ATOM 0 HB ILE A 4 -6.777 -6.864 -12.953 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -4.675 -7.831 -12.608 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -4.326 -6.283 -13.352 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -6.021 -4.591 -13.508 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -7.426 -4.582 -12.416 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -5.800 -4.247 -11.776 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -2.818 -6.691 -11.432 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -3.870 -5.292 -11.111 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -4.224 -6.864 -10.355 1.00 0.00 H new ATOM 60 N MET A 5 -8.814 -7.726 -11.018 1.00 0.00 N ATOM 61 CA MET A 5 -10.259 -7.809 -10.910 1.00 0.00 C ATOM 62 C MET A 5 -10.683 -8.219 -9.498 1.00 0.00 C ATOM 63 O MET A 5 -11.871 -8.377 -9.223 1.00 0.00 O ATOM 64 CB MET A 5 -10.789 -8.830 -11.918 1.00 0.00 C ATOM 65 CG MET A 5 -12.207 -8.472 -12.369 1.00 0.00 C ATOM 66 SD MET A 5 -12.292 -8.442 -14.152 1.00 0.00 S ATOM 67 CE MET A 5 -12.122 -6.689 -14.441 1.00 0.00 C ATOM 0 H MET A 5 -8.365 -8.564 -11.387 1.00 0.00 H new ATOM 0 HA MET A 5 -10.676 -6.825 -11.122 1.00 0.00 H new ATOM 0 HB2 MET A 5 -10.127 -8.869 -12.783 1.00 0.00 H new ATOM 0 HB3 MET A 5 -10.786 -9.824 -11.470 1.00 0.00 H new ATOM 0 HG2 MET A 5 -12.917 -9.199 -11.975 1.00 0.00 H new ATOM 0 HG3 MET A 5 -12.491 -7.499 -11.967 1.00 0.00 H new ATOM 0 HE1 MET A 5 -12.154 -6.492 -15.513 1.00 0.00 H new ATOM 0 HE2 MET A 5 -12.938 -6.158 -13.950 1.00 0.00 H new ATOM 0 HE3 MET A 5 -11.170 -6.344 -14.037 1.00 0.00 H new ATOM 77 N LYS A 6 -9.686 -8.379 -8.640 1.00 0.00 N ATOM 78 CA LYS A 6 -9.939 -8.769 -7.264 1.00 0.00 C ATOM 79 C LYS A 6 -9.651 -7.581 -6.342 1.00 0.00 C ATOM 80 O LYS A 6 -8.493 -7.240 -6.106 1.00 0.00 O ATOM 81 CB LYS A 6 -9.148 -10.030 -6.908 1.00 0.00 C ATOM 82 CG LYS A 6 -10.089 -11.188 -6.570 1.00 0.00 C ATOM 83 CD LYS A 6 -9.348 -12.289 -5.806 1.00 0.00 C ATOM 84 CE LYS A 6 -10.005 -12.550 -4.449 1.00 0.00 C ATOM 85 NZ LYS A 6 -10.087 -14.003 -4.183 1.00 0.00 N ATOM 0 H LYS A 6 -8.702 -8.246 -8.872 1.00 0.00 H new ATOM 0 HA LYS A 6 -10.988 -9.032 -7.130 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -8.506 -10.310 -7.744 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.495 -9.827 -6.059 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -10.922 -10.822 -5.971 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -10.512 -11.598 -7.487 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -9.344 -13.206 -6.395 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -8.307 -11.999 -5.661 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -9.431 -12.062 -3.661 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -11.004 -12.114 -4.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -10.535 -14.162 -3.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -10.653 -14.460 -4.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -9.130 -14.410 -4.178 1.00 0.00 H new ATOM 99 N ASN A 7 -10.724 -6.986 -5.844 1.00 0.00 N ATOM 100 CA ASN A 7 -10.601 -5.843 -4.953 1.00 0.00 C ATOM 101 C ASN A 7 -11.473 -6.071 -3.716 1.00 0.00 C ATOM 102 O ASN A 7 -12.590 -6.574 -3.824 1.00 0.00 O ATOM 103 CB ASN A 7 -11.076 -4.559 -5.635 1.00 0.00 C ATOM 104 CG ASN A 7 -12.602 -4.495 -5.685 1.00 0.00 C ATOM 105 OD1 ASN A 7 -13.250 -5.133 -6.500 1.00 0.00 O ATOM 106 ND2 ASN A 7 -13.141 -3.693 -4.771 1.00 0.00 N ATOM 0 H ASN A 7 -11.683 -7.273 -6.040 1.00 0.00 H new ATOM 0 HA ASN A 7 -9.551 -5.739 -4.681 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -10.690 -3.693 -5.097 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -10.673 -4.511 -6.647 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -14.154 -3.583 -4.723 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -12.541 -3.188 -4.119 1.00 0.00 H new ATOM 113 N LEU A 8 -10.928 -5.690 -2.570 1.00 0.00 N ATOM 114 CA LEU A 8 -11.641 -5.846 -1.314 1.00 0.00 C ATOM 115 C LEU A 8 -12.919 -5.006 -1.351 1.00 0.00 C ATOM 116 O LEU A 8 -13.176 -4.303 -2.325 1.00 0.00 O ATOM 117 CB LEU A 8 -10.724 -5.521 -0.133 1.00 0.00 C ATOM 118 CG LEU A 8 -11.148 -6.095 1.221 1.00 0.00 C ATOM 119 CD1 LEU A 8 -9.953 -6.703 1.956 1.00 0.00 C ATOM 120 CD2 LEU A 8 -11.861 -5.036 2.066 1.00 0.00 C ATOM 0 H LEU A 8 -10.001 -5.274 -2.485 1.00 0.00 H new ATOM 0 HA LEU A 8 -11.945 -6.883 -1.174 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -9.723 -5.887 -0.364 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -10.654 -4.437 -0.040 1.00 0.00 H new ATOM 0 HG LEU A 8 -11.861 -6.900 1.043 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -10.281 -7.104 2.915 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -9.526 -7.505 1.355 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -9.199 -5.934 2.123 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -12.152 -5.469 3.023 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -11.189 -4.195 2.238 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -12.750 -4.689 1.540 1.00 0.00 H new ATOM 132 N SER A 9 -13.687 -5.106 -0.275 1.00 0.00 N ATOM 133 CA SER A 9 -14.931 -4.364 -0.172 1.00 0.00 C ATOM 134 C SER A 9 -14.693 -2.893 -0.520 1.00 0.00 C ATOM 135 O SER A 9 -14.867 -2.487 -1.668 1.00 0.00 O ATOM 136 CB SER A 9 -15.530 -4.487 1.231 1.00 0.00 C ATOM 137 OG SER A 9 -16.662 -3.637 1.403 1.00 0.00 O ATOM 0 H SER A 9 -13.471 -5.690 0.533 1.00 0.00 H new ATOM 0 HA SER A 9 -15.642 -4.788 -0.881 1.00 0.00 H new ATOM 0 HB2 SER A 9 -15.822 -5.521 1.411 1.00 0.00 H new ATOM 0 HB3 SER A 9 -14.772 -4.236 1.973 1.00 0.00 H new ATOM 0 HG SER A 9 -17.017 -3.745 2.310 1.00 0.00 H new ATOM 143 N ASN A 10 -14.300 -2.134 0.492 1.00 0.00 N ATOM 144 CA ASN A 10 -14.036 -0.717 0.306 1.00 0.00 C ATOM 145 C ASN A 10 -12.584 -0.419 0.689 1.00 0.00 C ATOM 146 O ASN A 10 -11.919 0.384 0.036 1.00 0.00 O ATOM 147 CB ASN A 10 -14.944 0.133 1.197 1.00 0.00 C ATOM 148 CG ASN A 10 -16.219 0.536 0.454 1.00 0.00 C ATOM 149 OD1 ASN A 10 -16.708 -0.163 -0.417 1.00 0.00 O ATOM 150 ND2 ASN A 10 -16.729 1.700 0.848 1.00 0.00 N ATOM 0 H ASN A 10 -14.158 -2.473 1.443 1.00 0.00 H new ATOM 0 HA ASN A 10 -14.225 -0.472 -0.739 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -15.204 -0.426 2.096 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -14.409 1.026 1.520 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -17.580 2.057 0.414 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -16.269 2.236 1.584 1.00 0.00 H new ATOM 157 N ASN A 11 -12.135 -1.080 1.745 1.00 0.00 N ATOM 158 CA ASN A 11 -10.776 -0.896 2.222 1.00 0.00 C ATOM 159 C ASN A 11 -9.843 -0.697 1.025 1.00 0.00 C ATOM 160 O ASN A 11 -8.852 0.024 1.118 1.00 0.00 O ATOM 161 CB ASN A 11 -10.294 -2.122 3.000 1.00 0.00 C ATOM 162 CG ASN A 11 -8.766 -2.173 3.051 1.00 0.00 C ATOM 163 OD1 ASN A 11 -8.106 -1.299 3.590 1.00 0.00 O ATOM 164 ND2 ASN A 11 -8.240 -3.242 2.457 1.00 0.00 N ATOM 0 H ASN A 11 -12.689 -1.745 2.284 1.00 0.00 H new ATOM 0 HA ASN A 11 -10.764 -0.026 2.878 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -10.695 -2.095 4.013 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -10.676 -3.028 2.531 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -7.228 -3.367 2.434 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -8.849 -3.937 2.025 1.00 0.00 H new ATOM 171 N PHE A 12 -10.194 -1.353 -0.072 1.00 0.00 N ATOM 172 CA PHE A 12 -9.400 -1.258 -1.286 1.00 0.00 C ATOM 173 C PHE A 12 -10.177 -0.547 -2.396 1.00 0.00 C ATOM 174 O PHE A 12 -9.826 0.562 -2.792 1.00 0.00 O ATOM 175 CB PHE A 12 -9.092 -2.690 -1.732 1.00 0.00 C ATOM 176 CG PHE A 12 -7.673 -2.881 -2.273 1.00 0.00 C ATOM 177 CD1 PHE A 12 -6.633 -3.044 -1.412 1.00 0.00 C ATOM 178 CD2 PHE A 12 -7.453 -2.887 -3.615 1.00 0.00 C ATOM 179 CE1 PHE A 12 -5.318 -3.221 -1.915 1.00 0.00 C ATOM 180 CE2 PHE A 12 -6.138 -3.065 -4.118 1.00 0.00 C ATOM 181 CZ PHE A 12 -5.097 -3.228 -3.257 1.00 0.00 C ATOM 0 H PHE A 12 -11.017 -1.952 -0.146 1.00 0.00 H new ATOM 0 HA PHE A 12 -8.492 -0.687 -1.093 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -9.242 -3.363 -0.888 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -9.806 -2.981 -2.502 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -6.808 -3.039 -0.346 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.279 -2.756 -4.298 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -4.492 -3.350 -1.232 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -5.964 -3.071 -5.184 1.00 0.00 H new ATOM 0 HZ PHE A 12 -4.096 -3.363 -3.639 1.00 0.00 H new ATOM 191 N GLY A 13 -11.220 -1.217 -2.865 1.00 0.00 N ATOM 192 CA GLY A 13 -12.051 -0.663 -3.921 1.00 0.00 C ATOM 193 C GLY A 13 -12.366 0.811 -3.654 1.00 0.00 C ATOM 194 O GLY A 13 -12.480 1.602 -4.588 1.00 0.00 O ATOM 0 H GLY A 13 -11.508 -2.138 -2.533 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.541 -0.762 -4.879 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -12.979 -1.230 -3.993 1.00 0.00 H new ATOM 198 N LYS A 14 -12.499 1.132 -2.376 1.00 0.00 N ATOM 199 CA LYS A 14 -12.800 2.496 -1.976 1.00 0.00 C ATOM 200 C LYS A 14 -11.518 3.331 -2.023 1.00 0.00 C ATOM 201 O LYS A 14 -11.480 4.383 -2.659 1.00 0.00 O ATOM 202 CB LYS A 14 -13.495 2.514 -0.614 1.00 0.00 C ATOM 203 CG LYS A 14 -14.226 3.840 -0.388 1.00 0.00 C ATOM 204 CD LYS A 14 -13.512 4.685 0.669 1.00 0.00 C ATOM 205 CE LYS A 14 -13.693 4.089 2.065 1.00 0.00 C ATOM 206 NZ LYS A 14 -13.469 5.119 3.103 1.00 0.00 N ATOM 0 H LYS A 14 -12.404 0.472 -1.604 1.00 0.00 H new ATOM 0 HA LYS A 14 -13.504 2.951 -2.673 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -14.204 1.689 -0.553 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -12.759 2.361 0.176 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -14.281 4.394 -1.325 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -15.251 3.645 -0.072 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -12.450 4.748 0.432 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -13.903 5.702 0.651 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -14.698 3.678 2.164 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -12.996 3.264 2.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -13.596 4.696 4.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -12.502 5.492 3.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -14.151 5.894 2.976 1.00 0.00 H new ATOM 220 N ALA A 15 -10.499 2.830 -1.339 1.00 0.00 N ATOM 221 CA ALA A 15 -9.218 3.516 -1.295 1.00 0.00 C ATOM 222 C ALA A 15 -8.678 3.672 -2.718 1.00 0.00 C ATOM 223 O ALA A 15 -8.190 4.738 -3.087 1.00 0.00 O ATOM 224 CB ALA A 15 -8.257 2.746 -0.388 1.00 0.00 C ATOM 0 H ALA A 15 -10.534 1.958 -0.811 1.00 0.00 H new ATOM 0 HA ALA A 15 -9.333 4.515 -0.875 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -7.297 3.261 -0.355 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -8.673 2.689 0.618 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -8.116 1.739 -0.779 1.00 0.00 H new ATOM 230 N MET A 16 -8.784 2.592 -3.478 1.00 0.00 N ATOM 231 CA MET A 16 -8.312 2.595 -4.853 1.00 0.00 C ATOM 232 C MET A 16 -9.118 3.575 -5.707 1.00 0.00 C ATOM 233 O MET A 16 -8.563 4.253 -6.572 1.00 0.00 O ATOM 234 CB MET A 16 -8.436 1.186 -5.439 1.00 0.00 C ATOM 235 CG MET A 16 -7.615 0.181 -4.628 1.00 0.00 C ATOM 236 SD MET A 16 -5.872 0.493 -4.855 1.00 0.00 S ATOM 237 CE MET A 16 -5.621 1.763 -3.626 1.00 0.00 C ATOM 0 H MET A 16 -9.190 1.709 -3.168 1.00 0.00 H new ATOM 0 HA MET A 16 -7.269 2.910 -4.858 1.00 0.00 H new ATOM 0 HB2 MET A 16 -9.483 0.883 -5.448 1.00 0.00 H new ATOM 0 HB3 MET A 16 -8.096 1.188 -6.475 1.00 0.00 H new ATOM 0 HG2 MET A 16 -7.872 0.257 -3.571 1.00 0.00 H new ATOM 0 HG3 MET A 16 -7.855 -0.835 -4.942 1.00 0.00 H new ATOM 0 HE1 MET A 16 -5.508 2.729 -4.119 1.00 0.00 H new ATOM 0 HE2 MET A 16 -6.480 1.796 -2.956 1.00 0.00 H new ATOM 0 HE3 MET A 16 -4.722 1.541 -3.052 1.00 0.00 H new ATOM 247 N ASP A 17 -10.414 3.622 -5.435 1.00 0.00 N ATOM 248 CA ASP A 17 -11.302 4.509 -6.167 1.00 0.00 C ATOM 249 C ASP A 17 -11.057 5.952 -5.719 1.00 0.00 C ATOM 250 O ASP A 17 -10.901 6.846 -6.550 1.00 0.00 O ATOM 251 CB ASP A 17 -12.768 4.170 -5.893 1.00 0.00 C ATOM 252 CG ASP A 17 -13.782 5.042 -6.636 1.00 0.00 C ATOM 253 OD1 ASP A 17 -14.075 4.703 -7.803 1.00 0.00 O ATOM 254 OD2 ASP A 17 -14.242 6.028 -6.020 1.00 0.00 O ATOM 0 H ASP A 17 -10.871 3.059 -4.717 1.00 0.00 H new ATOM 0 HA ASP A 17 -11.098 4.388 -7.231 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -12.941 3.128 -6.162 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -12.952 4.257 -4.822 1.00 0.00 H new ATOM 259 N GLN A 18 -11.032 6.134 -4.407 1.00 0.00 N ATOM 260 CA GLN A 18 -10.809 7.453 -3.838 1.00 0.00 C ATOM 261 C GLN A 18 -9.395 7.938 -4.161 1.00 0.00 C ATOM 262 O GLN A 18 -9.192 9.114 -4.459 1.00 0.00 O ATOM 263 CB GLN A 18 -11.057 7.447 -2.329 1.00 0.00 C ATOM 264 CG GLN A 18 -12.472 7.926 -2.002 1.00 0.00 C ATOM 265 CD GLN A 18 -12.614 8.245 -0.513 1.00 0.00 C ATOM 266 OE1 GLN A 18 -11.646 8.451 0.199 1.00 0.00 O ATOM 267 NE2 GLN A 18 -13.873 8.273 -0.083 1.00 0.00 N ATOM 0 H GLN A 18 -11.162 5.390 -3.721 1.00 0.00 H new ATOM 0 HA GLN A 18 -11.520 8.147 -4.287 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -10.911 6.440 -1.937 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -10.329 8.090 -1.835 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -12.704 8.813 -2.591 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -13.193 7.159 -2.283 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -14.638 8.091 -0.733 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -14.073 8.476 0.896 1.00 0.00 H new ATOM 276 N CYS A 19 -8.454 7.007 -4.091 1.00 0.00 N ATOM 277 CA CYS A 19 -7.065 7.326 -4.372 1.00 0.00 C ATOM 278 C CYS A 19 -6.967 7.818 -5.817 1.00 0.00 C ATOM 279 O CYS A 19 -6.191 8.724 -6.117 1.00 0.00 O ATOM 280 CB CYS A 19 -6.147 6.130 -4.114 1.00 0.00 C ATOM 281 SG CYS A 19 -5.740 5.841 -2.353 1.00 0.00 S ATOM 0 H CYS A 19 -8.627 6.033 -3.844 1.00 0.00 H new ATOM 0 HA CYS A 19 -6.727 8.113 -3.698 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -6.620 5.234 -4.515 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -5.219 6.276 -4.668 1.00 0.00 H new ATOM 286 N LYS A 20 -7.766 7.199 -6.675 1.00 0.00 N ATOM 287 CA LYS A 20 -7.779 7.564 -8.082 1.00 0.00 C ATOM 288 C LYS A 20 -8.333 8.983 -8.231 1.00 0.00 C ATOM 289 O LYS A 20 -8.338 9.537 -9.330 1.00 0.00 O ATOM 290 CB LYS A 20 -8.541 6.517 -8.898 1.00 0.00 C ATOM 291 CG LYS A 20 -7.800 6.189 -10.195 1.00 0.00 C ATOM 292 CD LYS A 20 -8.692 5.393 -11.151 1.00 0.00 C ATOM 293 CE LYS A 20 -9.630 6.321 -11.924 1.00 0.00 C ATOM 294 NZ LYS A 20 -10.622 5.534 -12.690 1.00 0.00 N ATOM 0 H LYS A 20 -8.408 6.448 -6.423 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.766 7.574 -8.484 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -8.666 5.610 -8.307 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -9.540 6.887 -9.129 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -7.477 7.112 -10.677 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.901 5.616 -9.969 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -8.072 4.832 -11.850 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -9.277 4.665 -10.588 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -10.143 6.988 -11.231 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -9.052 6.949 -12.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -11.251 6.179 -13.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.128 4.915 -13.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -11.185 4.954 -12.036 1.00 0.00 H new ATOM 308 N ASP A 21 -8.782 9.529 -7.111 1.00 0.00 N ATOM 309 CA ASP A 21 -9.336 10.872 -7.104 1.00 0.00 C ATOM 310 C ASP A 21 -8.409 11.797 -6.311 1.00 0.00 C ATOM 311 O ASP A 21 -7.760 12.670 -6.885 1.00 0.00 O ATOM 312 CB ASP A 21 -10.712 10.898 -6.438 1.00 0.00 C ATOM 313 CG ASP A 21 -11.821 11.549 -7.267 1.00 0.00 C ATOM 314 OD1 ASP A 21 -11.684 12.759 -7.546 1.00 0.00 O ATOM 315 OD2 ASP A 21 -12.779 10.822 -7.604 1.00 0.00 O ATOM 0 H ASP A 21 -8.774 9.066 -6.202 1.00 0.00 H new ATOM 0 HA ASP A 21 -9.431 11.203 -8.138 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -11.006 9.874 -6.206 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -10.630 11.428 -5.489 1.00 0.00 H new ATOM 320 N GLU A 22 -8.377 11.574 -5.006 1.00 0.00 N ATOM 321 CA GLU A 22 -7.541 12.375 -4.129 1.00 0.00 C ATOM 322 C GLU A 22 -6.143 12.533 -4.730 1.00 0.00 C ATOM 323 O GLU A 22 -5.591 13.632 -4.744 1.00 0.00 O ATOM 324 CB GLU A 22 -7.472 11.763 -2.729 1.00 0.00 C ATOM 325 CG GLU A 22 -7.282 10.248 -2.801 1.00 0.00 C ATOM 326 CD GLU A 22 -8.387 9.519 -2.032 1.00 0.00 C ATOM 327 OE1 GLU A 22 -9.489 10.101 -1.936 1.00 0.00 O ATOM 328 OE2 GLU A 22 -8.105 8.398 -1.558 1.00 0.00 O ATOM 0 H GLU A 22 -8.917 10.849 -4.534 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.988 13.365 -4.034 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.648 12.210 -2.173 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -8.387 11.993 -2.183 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.286 9.927 -3.843 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.309 9.980 -2.388 1.00 0.00 H new ATOM 335 N LEU A 23 -5.610 11.420 -5.209 1.00 0.00 N ATOM 336 CA LEU A 23 -4.286 11.422 -5.808 1.00 0.00 C ATOM 337 C LEU A 23 -4.419 11.503 -7.330 1.00 0.00 C ATOM 338 O LEU A 23 -3.436 11.734 -8.032 1.00 0.00 O ATOM 339 CB LEU A 23 -3.478 10.215 -5.325 1.00 0.00 C ATOM 340 CG LEU A 23 -3.714 9.786 -3.876 1.00 0.00 C ATOM 341 CD1 LEU A 23 -3.559 8.273 -3.719 1.00 0.00 C ATOM 342 CD2 LEU A 23 -2.802 10.558 -2.920 1.00 0.00 C ATOM 0 H LEU A 23 -6.070 10.510 -5.195 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.725 12.301 -5.490 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -3.703 9.369 -5.975 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -2.418 10.439 -5.449 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.742 10.033 -3.611 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.732 7.995 -2.679 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.283 7.765 -4.356 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.551 7.978 -4.010 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -2.990 10.234 -1.896 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.760 10.365 -3.176 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.005 11.625 -3.006 1.00 0.00 H new ATOM 354 N SER A 24 -5.645 11.306 -7.796 1.00 0.00 N ATOM 355 CA SER A 24 -5.919 11.354 -9.222 1.00 0.00 C ATOM 356 C SER A 24 -4.947 10.444 -9.974 1.00 0.00 C ATOM 357 O SER A 24 -4.773 10.579 -11.184 1.00 0.00 O ATOM 358 CB SER A 24 -5.824 12.786 -9.753 1.00 0.00 C ATOM 359 OG SER A 24 -7.052 13.494 -9.604 1.00 0.00 O ATOM 0 H SER A 24 -6.458 11.113 -7.211 1.00 0.00 H new ATOM 0 HA SER A 24 -6.937 11.001 -9.386 1.00 0.00 H new ATOM 0 HB2 SER A 24 -5.033 13.317 -9.224 1.00 0.00 H new ATOM 0 HB3 SER A 24 -5.544 12.764 -10.806 1.00 0.00 H new ATOM 0 HG SER A 24 -7.420 13.327 -8.711 1.00 0.00 H new ATOM 365 N LEU A 25 -4.338 9.536 -9.224 1.00 0.00 N ATOM 366 CA LEU A 25 -3.388 8.601 -9.805 1.00 0.00 C ATOM 367 C LEU A 25 -4.147 7.443 -10.453 1.00 0.00 C ATOM 368 O LEU A 25 -5.349 7.289 -10.242 1.00 0.00 O ATOM 369 CB LEU A 25 -2.365 8.157 -8.758 1.00 0.00 C ATOM 370 CG LEU A 25 -2.789 6.995 -7.858 1.00 0.00 C ATOM 371 CD1 LEU A 25 -4.278 7.079 -7.518 1.00 0.00 C ATOM 372 CD2 LEU A 25 -2.420 5.651 -8.490 1.00 0.00 C ATOM 0 H LEU A 25 -4.484 9.428 -8.220 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.813 9.085 -10.594 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.446 7.876 -9.273 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.127 9.012 -8.126 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.241 7.072 -6.919 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.553 6.241 -6.877 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.480 8.015 -6.998 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.864 7.041 -8.436 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -2.732 4.841 -7.831 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.924 5.551 -9.451 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.341 5.603 -8.639 1.00 0.00 H new ATOM 384 N PRO A 26 -3.395 6.638 -11.250 1.00 0.00 N ATOM 385 CA PRO A 26 -3.985 5.497 -11.931 1.00 0.00 C ATOM 386 C PRO A 26 -4.243 4.349 -10.953 1.00 0.00 C ATOM 387 O PRO A 26 -3.310 3.823 -10.348 1.00 0.00 O ATOM 388 CB PRO A 26 -2.995 5.135 -13.024 1.00 0.00 C ATOM 389 CG PRO A 26 -1.678 5.783 -12.624 1.00 0.00 C ATOM 390 CD PRO A 26 -1.970 6.790 -11.523 1.00 0.00 C ATOM 0 HA PRO A 26 -4.963 5.721 -12.357 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -2.888 4.054 -13.112 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -3.332 5.501 -13.994 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -0.972 5.029 -12.275 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -1.219 6.276 -13.481 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -1.373 6.589 -10.634 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -1.734 7.805 -11.842 1.00 0.00 H new ATOM 398 N ASP A 27 -5.513 3.993 -10.829 1.00 0.00 N ATOM 399 CA ASP A 27 -5.906 2.917 -9.935 1.00 0.00 C ATOM 400 C ASP A 27 -5.352 1.593 -10.466 1.00 0.00 C ATOM 401 O ASP A 27 -5.529 0.548 -9.842 1.00 0.00 O ATOM 402 CB ASP A 27 -7.429 2.794 -9.857 1.00 0.00 C ATOM 403 CG ASP A 27 -8.110 2.343 -11.151 1.00 0.00 C ATOM 404 OD1 ASP A 27 -7.389 2.251 -12.167 1.00 0.00 O ATOM 405 OD2 ASP A 27 -9.335 2.105 -11.094 1.00 0.00 O ATOM 0 H ASP A 27 -6.284 4.431 -11.333 1.00 0.00 H new ATOM 0 HA ASP A 27 -5.511 3.140 -8.944 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -7.681 2.087 -9.066 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -7.842 3.760 -9.565 1.00 0.00 H new ATOM 410 N SER A 28 -4.692 1.680 -11.611 1.00 0.00 N ATOM 411 CA SER A 28 -4.110 0.502 -12.232 1.00 0.00 C ATOM 412 C SER A 28 -2.759 0.183 -11.586 1.00 0.00 C ATOM 413 O SER A 28 -2.435 -0.980 -11.361 1.00 0.00 O ATOM 414 CB SER A 28 -3.946 0.697 -13.739 1.00 0.00 C ATOM 415 OG SER A 28 -3.309 1.935 -14.051 1.00 0.00 O ATOM 0 H SER A 28 -4.547 2.549 -12.126 1.00 0.00 H new ATOM 0 HA SER A 28 -4.788 -0.337 -12.075 1.00 0.00 H new ATOM 0 HB2 SER A 28 -3.361 -0.126 -14.150 1.00 0.00 H new ATOM 0 HB3 SER A 28 -4.925 0.662 -14.218 1.00 0.00 H new ATOM 0 HG SER A 28 -3.221 2.022 -15.023 1.00 0.00 H new ATOM 421 N VAL A 29 -2.009 1.240 -11.310 1.00 0.00 N ATOM 422 CA VAL A 29 -0.701 1.088 -10.695 1.00 0.00 C ATOM 423 C VAL A 29 -0.865 0.492 -9.297 1.00 0.00 C ATOM 424 O VAL A 29 -0.043 -0.313 -8.860 1.00 0.00 O ATOM 425 CB VAL A 29 0.036 2.429 -10.692 1.00 0.00 C ATOM 426 CG1 VAL A 29 0.213 2.960 -12.116 1.00 0.00 C ATOM 427 CG2 VAL A 29 -0.691 3.450 -9.814 1.00 0.00 C ATOM 0 H VAL A 29 -2.282 2.204 -11.501 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.086 0.397 -11.272 1.00 0.00 H new ATOM 0 HB VAL A 29 1.027 2.266 -10.269 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.740 3.914 -12.086 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.791 2.245 -12.702 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -0.765 3.100 -12.576 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -0.147 4.395 -9.828 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.700 3.606 -10.196 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -0.744 3.078 -8.791 1.00 0.00 H new ATOM 437 N VAL A 30 -1.931 0.912 -8.631 1.00 0.00 N ATOM 438 CA VAL A 30 -2.213 0.431 -7.289 1.00 0.00 C ATOM 439 C VAL A 30 -2.873 -0.948 -7.375 1.00 0.00 C ATOM 440 O VAL A 30 -2.680 -1.787 -6.497 1.00 0.00 O ATOM 441 CB VAL A 30 -3.063 1.453 -6.533 1.00 0.00 C ATOM 442 CG1 VAL A 30 -2.203 2.615 -6.030 1.00 0.00 C ATOM 443 CG2 VAL A 30 -4.214 1.960 -7.404 1.00 0.00 C ATOM 0 H VAL A 30 -2.610 1.580 -8.996 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.289 0.316 -6.723 1.00 0.00 H new ATOM 0 HB VAL A 30 -3.494 0.954 -5.665 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -2.831 3.328 -5.496 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.434 2.234 -5.358 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -1.731 3.112 -6.878 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -4.803 2.685 -6.843 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.811 2.434 -8.299 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.849 1.122 -7.692 1.00 0.00 H new ATOM 453 N ALA A 31 -3.639 -1.136 -8.440 1.00 0.00 N ATOM 454 CA ALA A 31 -4.328 -2.397 -8.652 1.00 0.00 C ATOM 455 C ALA A 31 -3.302 -3.488 -8.964 1.00 0.00 C ATOM 456 O ALA A 31 -3.605 -4.677 -8.865 1.00 0.00 O ATOM 457 CB ALA A 31 -5.363 -2.234 -9.766 1.00 0.00 C ATOM 0 H ALA A 31 -3.797 -0.436 -9.165 1.00 0.00 H new ATOM 0 HA ALA A 31 -4.864 -2.697 -7.751 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -5.879 -3.181 -9.924 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -6.086 -1.469 -9.482 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -4.862 -1.935 -10.687 1.00 0.00 H new ATOM 463 N ASP A 32 -2.110 -3.046 -9.336 1.00 0.00 N ATOM 464 CA ASP A 32 -1.038 -3.971 -9.664 1.00 0.00 C ATOM 465 C ASP A 32 -0.474 -4.569 -8.373 1.00 0.00 C ATOM 466 O ASP A 32 0.129 -5.640 -8.393 1.00 0.00 O ATOM 467 CB ASP A 32 0.103 -3.255 -10.391 1.00 0.00 C ATOM 468 CG ASP A 32 1.436 -4.005 -10.400 1.00 0.00 C ATOM 469 OD1 ASP A 32 2.003 -4.169 -9.298 1.00 0.00 O ATOM 470 OD2 ASP A 32 1.857 -4.401 -11.510 1.00 0.00 O ATOM 0 H ASP A 32 -1.863 -2.060 -9.418 1.00 0.00 H new ATOM 0 HA ASP A 32 -1.447 -4.747 -10.311 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -0.201 -3.073 -11.422 1.00 0.00 H new ATOM 0 HB3 ASP A 32 0.255 -2.281 -9.926 1.00 0.00 H new ATOM 475 N LEU A 33 -0.688 -3.848 -7.282 1.00 0.00 N ATOM 476 CA LEU A 33 -0.208 -4.294 -5.985 1.00 0.00 C ATOM 477 C LEU A 33 -0.634 -5.747 -5.761 1.00 0.00 C ATOM 478 O LEU A 33 0.188 -6.592 -5.413 1.00 0.00 O ATOM 479 CB LEU A 33 -0.674 -3.341 -4.884 1.00 0.00 C ATOM 480 CG LEU A 33 0.161 -2.072 -4.699 1.00 0.00 C ATOM 481 CD1 LEU A 33 0.351 -1.342 -6.029 1.00 0.00 C ATOM 482 CD2 LEU A 33 -0.449 -1.166 -3.629 1.00 0.00 C ATOM 0 H LEU A 33 -1.187 -2.959 -7.270 1.00 0.00 H new ATOM 0 HA LEU A 33 0.881 -4.271 -5.954 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.702 -3.048 -5.095 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -0.685 -3.886 -3.940 1.00 0.00 H new ATOM 0 HG LEU A 33 1.151 -2.363 -4.348 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.948 -0.444 -5.869 1.00 0.00 H new ATOM 0 HD12 LEU A 33 0.863 -1.997 -6.734 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -0.622 -1.064 -6.434 1.00 0.00 H new ATOM 0 HD21 LEU A 33 0.164 -0.271 -3.517 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -1.458 -0.880 -3.926 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -0.488 -1.700 -2.679 1.00 0.00 H new ATOM 494 N TYR A 34 -1.920 -5.993 -5.972 1.00 0.00 N ATOM 495 CA TYR A 34 -2.464 -7.329 -5.796 1.00 0.00 C ATOM 496 C TYR A 34 -1.689 -8.350 -6.630 1.00 0.00 C ATOM 497 O TYR A 34 -1.731 -9.548 -6.348 1.00 0.00 O ATOM 498 CB TYR A 34 -3.907 -7.264 -6.303 1.00 0.00 C ATOM 499 CG TYR A 34 -4.921 -7.942 -5.379 1.00 0.00 C ATOM 500 CD1 TYR A 34 -4.682 -9.218 -4.909 1.00 0.00 C ATOM 501 CD2 TYR A 34 -6.074 -7.277 -5.014 1.00 0.00 C ATOM 502 CE1 TYR A 34 -5.636 -9.855 -4.039 1.00 0.00 C ATOM 503 CE2 TYR A 34 -7.029 -7.915 -4.145 1.00 0.00 C ATOM 504 CZ TYR A 34 -6.762 -9.172 -3.701 1.00 0.00 C ATOM 505 OH TYR A 34 -7.664 -9.775 -2.880 1.00 0.00 O ATOM 0 H TYR A 34 -2.600 -5.290 -6.263 1.00 0.00 H new ATOM 0 HA TYR A 34 -2.400 -7.637 -4.752 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -4.190 -6.219 -6.432 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -3.957 -7.731 -7.286 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -3.779 -9.738 -5.194 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -6.260 -6.278 -5.380 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -5.461 -10.852 -3.663 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -7.936 -7.407 -3.853 1.00 0.00 H new ATOM 0 HH TYR A 34 -8.419 -9.170 -2.723 1.00 0.00 H new ATOM 515 N ASN A 35 -0.998 -7.841 -7.640 1.00 0.00 N ATOM 516 CA ASN A 35 -0.214 -8.696 -8.515 1.00 0.00 C ATOM 517 C ASN A 35 1.171 -8.911 -7.903 1.00 0.00 C ATOM 518 O ASN A 35 1.480 -10.003 -7.427 1.00 0.00 O ATOM 519 CB ASN A 35 -0.029 -8.052 -9.890 1.00 0.00 C ATOM 520 CG ASN A 35 -0.502 -8.988 -11.004 1.00 0.00 C ATOM 521 OD1 ASN A 35 -0.423 -10.202 -10.904 1.00 0.00 O ATOM 522 ND2 ASN A 35 -0.997 -8.360 -12.065 1.00 0.00 N ATOM 0 H ASN A 35 -0.965 -6.848 -7.872 1.00 0.00 H new ATOM 0 HA ASN A 35 -0.744 -9.642 -8.628 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -0.587 -7.117 -9.935 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.022 -7.804 -10.041 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -1.340 -8.897 -12.861 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -1.034 -7.341 -12.083 1.00 0.00 H new ATOM 529 N PHE A 36 1.970 -7.854 -7.939 1.00 0.00 N ATOM 530 CA PHE A 36 3.316 -7.915 -7.393 1.00 0.00 C ATOM 531 C PHE A 36 4.001 -6.550 -7.472 1.00 0.00 C ATOM 532 O PHE A 36 4.934 -6.363 -8.252 1.00 0.00 O ATOM 533 CB PHE A 36 4.099 -8.915 -8.245 1.00 0.00 C ATOM 534 CG PHE A 36 3.709 -8.912 -9.725 1.00 0.00 C ATOM 535 CD1 PHE A 36 4.306 -8.042 -10.582 1.00 0.00 C ATOM 536 CD2 PHE A 36 2.766 -9.778 -10.182 1.00 0.00 C ATOM 537 CE1 PHE A 36 3.945 -8.038 -11.957 1.00 0.00 C ATOM 538 CE2 PHE A 36 2.406 -9.775 -11.555 1.00 0.00 C ATOM 539 CZ PHE A 36 3.002 -8.905 -12.414 1.00 0.00 C ATOM 0 H PHE A 36 1.711 -6.951 -8.337 1.00 0.00 H new ATOM 0 HA PHE A 36 3.280 -8.214 -6.345 1.00 0.00 H new ATOM 0 HB2 PHE A 36 5.163 -8.694 -8.160 1.00 0.00 H new ATOM 0 HB3 PHE A 36 3.948 -9.916 -7.842 1.00 0.00 H new ATOM 0 HD1 PHE A 36 5.055 -7.354 -10.218 1.00 0.00 H new ATOM 0 HD2 PHE A 36 2.291 -10.468 -9.501 1.00 0.00 H new ATOM 0 HE1 PHE A 36 4.419 -7.347 -12.638 1.00 0.00 H new ATOM 0 HE2 PHE A 36 1.658 -10.464 -11.918 1.00 0.00 H new ATOM 0 HZ PHE A 36 2.727 -8.903 -13.458 1.00 0.00 H new ATOM 549 N TRP A 37 3.511 -5.629 -6.654 1.00 0.00 N ATOM 550 CA TRP A 37 4.065 -4.287 -6.621 1.00 0.00 C ATOM 551 C TRP A 37 5.150 -4.248 -5.544 1.00 0.00 C ATOM 552 O TRP A 37 5.813 -3.229 -5.361 1.00 0.00 O ATOM 553 CB TRP A 37 2.966 -3.244 -6.400 1.00 0.00 C ATOM 554 CG TRP A 37 3.458 -1.798 -6.461 1.00 0.00 C ATOM 555 CD1 TRP A 37 4.205 -1.143 -5.563 1.00 0.00 C ATOM 556 CD2 TRP A 37 3.205 -0.847 -7.517 1.00 0.00 C ATOM 557 NE1 TRP A 37 4.452 0.156 -5.960 1.00 0.00 N ATOM 558 CE2 TRP A 37 3.824 0.340 -7.187 1.00 0.00 C ATOM 559 CE3 TRP A 37 2.477 -0.987 -8.712 1.00 0.00 C ATOM 560 CZ2 TRP A 37 3.779 1.481 -7.999 1.00 0.00 C ATOM 561 CZ3 TRP A 37 2.441 0.161 -9.513 1.00 0.00 C ATOM 562 CH2 TRP A 37 3.059 1.365 -9.194 1.00 0.00 C ATOM 0 H TRP A 37 2.736 -5.787 -6.009 1.00 0.00 H new ATOM 0 HA TRP A 37 4.518 -4.035 -7.580 1.00 0.00 H new ATOM 0 HB2 TRP A 37 2.190 -3.385 -7.152 1.00 0.00 H new ATOM 0 HB3 TRP A 37 2.504 -3.419 -5.428 1.00 0.00 H new ATOM 0 HD1 TRP A 37 4.569 -1.577 -4.643 1.00 0.00 H new ATOM 0 HE1 TRP A 37 4.995 0.852 -5.448 1.00 0.00 H new ATOM 0 HE3 TRP A 37 1.985 -1.907 -8.990 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 4.273 2.400 -7.718 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 1.895 0.108 -10.443 1.00 0.00 H new ATOM 0 HH2 TRP A 37 2.984 2.207 -9.866 1.00 0.00 H new ATOM 573 N LYS A 38 5.298 -5.371 -4.857 1.00 0.00 N ATOM 574 CA LYS A 38 6.291 -5.480 -3.802 1.00 0.00 C ATOM 575 C LYS A 38 7.617 -4.897 -4.295 1.00 0.00 C ATOM 576 O LYS A 38 8.150 -3.964 -3.696 1.00 0.00 O ATOM 577 CB LYS A 38 6.398 -6.925 -3.314 1.00 0.00 C ATOM 578 CG LYS A 38 5.088 -7.387 -2.673 1.00 0.00 C ATOM 579 CD LYS A 38 4.734 -6.519 -1.464 1.00 0.00 C ATOM 580 CE LYS A 38 3.515 -5.641 -1.756 1.00 0.00 C ATOM 581 NZ LYS A 38 2.385 -6.011 -0.874 1.00 0.00 N ATOM 0 H LYS A 38 4.746 -6.215 -5.011 1.00 0.00 H new ATOM 0 HA LYS A 38 5.989 -4.897 -2.932 1.00 0.00 H new ATOM 0 HB2 LYS A 38 6.647 -7.577 -4.151 1.00 0.00 H new ATOM 0 HB3 LYS A 38 7.210 -7.009 -2.591 1.00 0.00 H new ATOM 0 HG2 LYS A 38 4.283 -7.340 -3.407 1.00 0.00 H new ATOM 0 HG3 LYS A 38 5.178 -8.428 -2.364 1.00 0.00 H new ATOM 0 HD2 LYS A 38 4.530 -7.155 -0.603 1.00 0.00 H new ATOM 0 HD3 LYS A 38 5.585 -5.890 -1.202 1.00 0.00 H new ATOM 0 HE2 LYS A 38 3.771 -4.592 -1.608 1.00 0.00 H new ATOM 0 HE3 LYS A 38 3.221 -5.753 -2.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 1.673 -5.253 -0.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 1.955 -6.895 -1.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 2.732 -6.145 0.097 1.00 0.00 H new ATOM 595 N ASP A 39 8.111 -5.472 -5.381 1.00 0.00 N ATOM 596 CA ASP A 39 9.365 -5.020 -5.962 1.00 0.00 C ATOM 597 C ASP A 39 9.179 -3.618 -6.543 1.00 0.00 C ATOM 598 O ASP A 39 10.108 -2.813 -6.543 1.00 0.00 O ATOM 599 CB ASP A 39 9.813 -5.946 -7.095 1.00 0.00 C ATOM 600 CG ASP A 39 9.581 -5.401 -8.505 1.00 0.00 C ATOM 601 OD1 ASP A 39 8.481 -5.659 -9.040 1.00 0.00 O ATOM 602 OD2 ASP A 39 10.508 -4.737 -9.018 1.00 0.00 O ATOM 0 H ASP A 39 7.667 -6.246 -5.874 1.00 0.00 H new ATOM 0 HA ASP A 39 10.119 -5.021 -5.175 1.00 0.00 H new ATOM 0 HB2 ASP A 39 10.876 -6.156 -6.973 1.00 0.00 H new ATOM 0 HB3 ASP A 39 9.287 -6.896 -6.998 1.00 0.00 H new ATOM 607 N ASP A 40 7.968 -3.368 -7.024 1.00 0.00 N ATOM 608 CA ASP A 40 7.648 -2.076 -7.608 1.00 0.00 C ATOM 609 C ASP A 40 7.651 -1.011 -6.510 1.00 0.00 C ATOM 610 O ASP A 40 6.687 -0.890 -5.755 1.00 0.00 O ATOM 611 CB ASP A 40 6.260 -2.092 -8.248 1.00 0.00 C ATOM 612 CG ASP A 40 5.814 -0.761 -8.860 1.00 0.00 C ATOM 613 OD1 ASP A 40 6.236 0.282 -8.316 1.00 0.00 O ATOM 614 OD2 ASP A 40 5.062 -0.819 -9.857 1.00 0.00 O ATOM 0 H ASP A 40 7.199 -4.038 -7.021 1.00 0.00 H new ATOM 0 HA ASP A 40 8.395 -1.855 -8.371 1.00 0.00 H new ATOM 0 HB2 ASP A 40 6.244 -2.856 -9.026 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.532 -2.390 -7.493 1.00 0.00 H new ATOM 619 N TYR A 41 8.744 -0.266 -6.456 1.00 0.00 N ATOM 620 CA TYR A 41 8.885 0.786 -5.462 1.00 0.00 C ATOM 621 C TYR A 41 8.609 2.160 -6.076 1.00 0.00 C ATOM 622 O TYR A 41 8.619 2.313 -7.296 1.00 0.00 O ATOM 623 CB TYR A 41 10.341 0.732 -4.995 1.00 0.00 C ATOM 624 CG TYR A 41 10.704 1.802 -3.964 1.00 0.00 C ATOM 625 CD1 TYR A 41 9.915 1.976 -2.844 1.00 0.00 C ATOM 626 CD2 TYR A 41 11.819 2.593 -4.152 1.00 0.00 C ATOM 627 CE1 TYR A 41 10.257 2.983 -1.872 1.00 0.00 C ATOM 628 CE2 TYR A 41 12.159 3.600 -3.180 1.00 0.00 C ATOM 629 CZ TYR A 41 11.361 3.745 -2.089 1.00 0.00 C ATOM 630 OH TYR A 41 11.683 4.696 -1.171 1.00 0.00 O ATOM 0 H TYR A 41 9.541 -0.369 -7.084 1.00 0.00 H new ATOM 0 HA TYR A 41 8.178 0.640 -4.645 1.00 0.00 H new ATOM 0 HB2 TYR A 41 10.539 -0.251 -4.568 1.00 0.00 H new ATOM 0 HB3 TYR A 41 10.994 0.840 -5.861 1.00 0.00 H new ATOM 0 HD1 TYR A 41 9.042 1.357 -2.697 1.00 0.00 H new ATOM 0 HD2 TYR A 41 12.436 2.457 -5.028 1.00 0.00 H new ATOM 0 HE1 TYR A 41 9.650 3.129 -0.991 1.00 0.00 H new ATOM 0 HE2 TYR A 41 13.029 4.226 -3.315 1.00 0.00 H new ATOM 0 HH TYR A 41 12.057 4.267 -0.373 1.00 0.00 H new ATOM 640 N VAL A 42 8.369 3.126 -5.201 1.00 0.00 N ATOM 641 CA VAL A 42 8.091 4.482 -5.641 1.00 0.00 C ATOM 642 C VAL A 42 9.011 4.832 -6.811 1.00 0.00 C ATOM 643 O VAL A 42 8.654 5.644 -7.665 1.00 0.00 O ATOM 644 CB VAL A 42 8.223 5.451 -4.465 1.00 0.00 C ATOM 645 CG1 VAL A 42 8.044 6.899 -4.925 1.00 0.00 C ATOM 646 CG2 VAL A 42 7.234 5.102 -3.351 1.00 0.00 C ATOM 0 H VAL A 42 8.361 2.996 -4.189 1.00 0.00 H new ATOM 0 HA VAL A 42 7.065 4.565 -5.999 1.00 0.00 H new ATOM 0 HB VAL A 42 9.230 5.350 -4.060 1.00 0.00 H new ATOM 0 HG11 VAL A 42 8.143 7.567 -4.070 1.00 0.00 H new ATOM 0 HG12 VAL A 42 8.806 7.142 -5.665 1.00 0.00 H new ATOM 0 HG13 VAL A 42 7.056 7.020 -5.368 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.350 5.807 -2.528 1.00 0.00 H new ATOM 0 HG22 VAL A 42 6.216 5.159 -3.737 1.00 0.00 H new ATOM 0 HG23 VAL A 42 7.430 4.091 -2.994 1.00 0.00 H new ATOM 656 N MET A 43 10.176 4.203 -6.816 1.00 0.00 N ATOM 657 CA MET A 43 11.151 4.440 -7.868 1.00 0.00 C ATOM 658 C MET A 43 10.477 4.472 -9.242 1.00 0.00 C ATOM 659 O MET A 43 11.002 5.068 -10.180 1.00 0.00 O ATOM 660 CB MET A 43 12.208 3.333 -7.843 1.00 0.00 C ATOM 661 CG MET A 43 13.575 3.890 -7.443 1.00 0.00 C ATOM 662 SD MET A 43 14.864 3.041 -8.339 1.00 0.00 S ATOM 663 CE MET A 43 15.146 1.660 -7.243 1.00 0.00 C ATOM 0 H MET A 43 10.468 3.529 -6.108 1.00 0.00 H new ATOM 0 HA MET A 43 11.621 5.407 -7.692 1.00 0.00 H new ATOM 0 HB2 MET A 43 11.909 2.555 -7.141 1.00 0.00 H new ATOM 0 HB3 MET A 43 12.275 2.867 -8.826 1.00 0.00 H new ATOM 0 HG2 MET A 43 13.617 4.959 -7.653 1.00 0.00 H new ATOM 0 HG3 MET A 43 13.726 3.770 -6.370 1.00 0.00 H new ATOM 0 HE1 MET A 43 15.928 1.023 -7.655 1.00 0.00 H new ATOM 0 HE2 MET A 43 15.456 2.029 -6.265 1.00 0.00 H new ATOM 0 HE3 MET A 43 14.226 1.084 -7.139 1.00 0.00 H new ATOM 673 N THR A 44 9.324 3.823 -9.315 1.00 0.00 N ATOM 674 CA THR A 44 8.573 3.769 -10.558 1.00 0.00 C ATOM 675 C THR A 44 7.331 4.658 -10.469 1.00 0.00 C ATOM 676 O THR A 44 7.138 5.546 -11.296 1.00 0.00 O ATOM 677 CB THR A 44 8.253 2.303 -10.854 1.00 0.00 C ATOM 678 OG1 THR A 44 9.409 1.826 -11.538 1.00 0.00 O ATOM 679 CG2 THR A 44 7.125 2.144 -11.875 1.00 0.00 C ATOM 0 H THR A 44 8.892 3.330 -8.534 1.00 0.00 H new ATOM 0 HA THR A 44 9.156 4.163 -11.391 1.00 0.00 H new ATOM 0 HB THR A 44 7.978 1.798 -9.928 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.287 0.881 -11.766 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.938 1.084 -12.049 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.219 2.614 -11.493 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.413 2.620 -12.812 1.00 0.00 H new ATOM 687 N ASP A 45 6.520 4.384 -9.457 1.00 0.00 N ATOM 688 CA ASP A 45 5.300 5.147 -9.248 1.00 0.00 C ATOM 689 C ASP A 45 5.152 5.466 -7.758 1.00 0.00 C ATOM 690 O ASP A 45 4.996 4.561 -6.939 1.00 0.00 O ATOM 691 CB ASP A 45 4.071 4.351 -9.686 1.00 0.00 C ATOM 692 CG ASP A 45 2.997 5.165 -10.409 1.00 0.00 C ATOM 693 OD1 ASP A 45 3.391 6.048 -11.200 1.00 0.00 O ATOM 694 OD2 ASP A 45 1.805 4.886 -10.155 1.00 0.00 O ATOM 0 H ASP A 45 6.683 3.645 -8.773 1.00 0.00 H new ATOM 0 HA ASP A 45 5.367 6.060 -9.840 1.00 0.00 H new ATOM 0 HB2 ASP A 45 4.395 3.542 -10.341 1.00 0.00 H new ATOM 0 HB3 ASP A 45 3.624 3.888 -8.806 1.00 0.00 H new ATOM 699 N ARG A 46 5.205 6.754 -7.452 1.00 0.00 N ATOM 700 CA ARG A 46 5.078 7.202 -6.077 1.00 0.00 C ATOM 701 C ARG A 46 3.613 7.157 -5.637 1.00 0.00 C ATOM 702 O ARG A 46 3.315 6.803 -4.497 1.00 0.00 O ATOM 703 CB ARG A 46 5.609 8.628 -5.911 1.00 0.00 C ATOM 704 CG ARG A 46 5.266 9.184 -4.527 1.00 0.00 C ATOM 705 CD ARG A 46 4.509 10.509 -4.642 1.00 0.00 C ATOM 706 NE ARG A 46 4.161 11.010 -3.293 1.00 0.00 N ATOM 707 CZ ARG A 46 3.926 12.298 -3.008 1.00 0.00 C ATOM 708 NH1 ARG A 46 4.002 13.223 -3.975 1.00 0.00 N ATOM 709 NH2 ARG A 46 3.617 12.662 -1.756 1.00 0.00 N ATOM 0 H ARG A 46 5.334 7.502 -8.134 1.00 0.00 H new ATOM 0 HA ARG A 46 5.669 6.531 -5.454 1.00 0.00 H new ATOM 0 HB2 ARG A 46 6.690 8.636 -6.052 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.182 9.271 -6.681 1.00 0.00 H new ATOM 0 HG2 ARG A 46 4.660 8.461 -3.980 1.00 0.00 H new ATOM 0 HG3 ARG A 46 6.181 9.332 -3.953 1.00 0.00 H new ATOM 0 HD2 ARG A 46 5.121 11.243 -5.165 1.00 0.00 H new ATOM 0 HD3 ARG A 46 3.603 10.370 -5.233 1.00 0.00 H new ATOM 0 HE ARG A 46 4.096 10.333 -2.533 1.00 0.00 H new ATOM 0 HH11 ARG A 46 4.239 12.946 -4.928 1.00 0.00 H new ATOM 0 HH12 ARG A 46 3.823 14.203 -3.758 1.00 0.00 H new ATOM 0 HH21 ARG A 46 3.561 11.959 -1.020 1.00 0.00 H new ATOM 0 HH22 ARG A 46 3.438 13.643 -1.539 1.00 0.00 H new ATOM 723 N LEU A 47 2.739 7.519 -6.563 1.00 0.00 N ATOM 724 CA LEU A 47 1.313 7.524 -6.286 1.00 0.00 C ATOM 725 C LEU A 47 0.926 6.208 -5.605 1.00 0.00 C ATOM 726 O LEU A 47 0.164 6.205 -4.640 1.00 0.00 O ATOM 727 CB LEU A 47 0.520 7.814 -7.561 1.00 0.00 C ATOM 728 CG LEU A 47 1.086 8.905 -8.470 1.00 0.00 C ATOM 729 CD1 LEU A 47 1.731 10.023 -7.647 1.00 0.00 C ATOM 730 CD2 LEU A 47 2.056 8.316 -9.497 1.00 0.00 C ATOM 0 H LEU A 47 2.991 7.811 -7.507 1.00 0.00 H new ATOM 0 HA LEU A 47 1.062 8.328 -5.594 1.00 0.00 H new ATOM 0 HB2 LEU A 47 0.446 6.891 -8.137 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -0.494 8.095 -7.278 1.00 0.00 H new ATOM 0 HG LEU A 47 0.260 9.349 -9.026 1.00 0.00 H new ATOM 0 HD11 LEU A 47 2.126 10.787 -8.317 1.00 0.00 H new ATOM 0 HD12 LEU A 47 0.984 10.468 -6.990 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.543 9.611 -7.047 1.00 0.00 H new ATOM 0 HD21 LEU A 47 2.444 9.114 -10.131 1.00 0.00 H new ATOM 0 HD22 LEU A 47 2.883 7.829 -8.979 1.00 0.00 H new ATOM 0 HD23 LEU A 47 1.533 7.585 -10.113 1.00 0.00 H new ATOM 742 N ALA A 48 1.468 5.123 -6.137 1.00 0.00 N ATOM 743 CA ALA A 48 1.190 3.805 -5.594 1.00 0.00 C ATOM 744 C ALA A 48 1.551 3.783 -4.106 1.00 0.00 C ATOM 745 O ALA A 48 0.915 3.083 -3.321 1.00 0.00 O ATOM 746 CB ALA A 48 1.955 2.750 -6.394 1.00 0.00 C ATOM 0 H ALA A 48 2.099 5.130 -6.939 1.00 0.00 H new ATOM 0 HA ALA A 48 0.129 3.572 -5.679 1.00 0.00 H new ATOM 0 HB1 ALA A 48 1.746 1.761 -5.986 1.00 0.00 H new ATOM 0 HB2 ALA A 48 1.641 2.786 -7.437 1.00 0.00 H new ATOM 0 HB3 ALA A 48 3.025 2.950 -6.330 1.00 0.00 H new ATOM 752 N GLY A 49 2.569 4.559 -3.768 1.00 0.00 N ATOM 753 CA GLY A 49 3.023 4.638 -2.389 1.00 0.00 C ATOM 754 C GLY A 49 2.146 5.595 -1.578 1.00 0.00 C ATOM 755 O GLY A 49 2.077 5.493 -0.355 1.00 0.00 O ATOM 0 H GLY A 49 3.093 5.139 -4.424 1.00 0.00 H new ATOM 0 HA2 GLY A 49 3.000 3.646 -1.937 1.00 0.00 H new ATOM 0 HA3 GLY A 49 4.059 4.977 -2.362 1.00 0.00 H new ATOM 759 N CYS A 50 1.501 6.506 -2.293 1.00 0.00 N ATOM 760 CA CYS A 50 0.632 7.479 -1.655 1.00 0.00 C ATOM 761 C CYS A 50 -0.769 6.876 -1.545 1.00 0.00 C ATOM 762 O CYS A 50 -1.419 6.989 -0.507 1.00 0.00 O ATOM 763 CB CYS A 50 0.622 8.809 -2.411 1.00 0.00 C ATOM 764 SG CYS A 50 1.690 10.109 -1.691 1.00 0.00 S ATOM 0 H CYS A 50 1.563 6.590 -3.308 1.00 0.00 H new ATOM 0 HA CYS A 50 1.008 7.705 -0.657 1.00 0.00 H new ATOM 0 HB2 CYS A 50 0.936 8.629 -3.439 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -0.402 9.181 -2.451 1.00 0.00 H new ATOM 769 N ALA A 51 -1.194 6.247 -2.632 1.00 0.00 N ATOM 770 CA ALA A 51 -2.507 5.625 -2.670 1.00 0.00 C ATOM 771 C ALA A 51 -2.561 4.491 -1.643 1.00 0.00 C ATOM 772 O ALA A 51 -3.501 4.404 -0.857 1.00 0.00 O ATOM 773 CB ALA A 51 -2.800 5.138 -4.090 1.00 0.00 C ATOM 0 H ALA A 51 -0.653 6.155 -3.492 1.00 0.00 H new ATOM 0 HA ALA A 51 -3.280 6.346 -2.406 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -3.785 4.671 -4.119 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.779 5.984 -4.776 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -2.045 4.411 -4.388 1.00 0.00 H new ATOM 779 N ILE A 52 -1.536 3.650 -1.685 1.00 0.00 N ATOM 780 CA ILE A 52 -1.455 2.525 -0.769 1.00 0.00 C ATOM 781 C ILE A 52 -1.677 3.022 0.662 1.00 0.00 C ATOM 782 O ILE A 52 -2.460 2.439 1.409 1.00 0.00 O ATOM 783 CB ILE A 52 -0.138 1.773 -0.960 1.00 0.00 C ATOM 784 CG1 ILE A 52 -0.105 0.499 -0.114 1.00 0.00 C ATOM 785 CG2 ILE A 52 1.060 2.681 -0.674 1.00 0.00 C ATOM 786 CD1 ILE A 52 -1.484 -0.161 -0.062 1.00 0.00 C ATOM 0 H ILE A 52 -0.756 3.726 -2.338 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.242 1.802 -0.983 1.00 0.00 H new ATOM 0 HB ILE A 52 -0.069 1.468 -2.004 1.00 0.00 H new ATOM 0 HG12 ILE A 52 0.621 -0.199 -0.530 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.226 0.738 0.897 1.00 0.00 H new ATOM 0 HG21 ILE A 52 1.984 2.121 -0.817 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.042 3.532 -1.355 1.00 0.00 H new ATOM 0 HG23 ILE A 52 1.008 3.038 0.354 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.432 -1.064 0.546 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -2.202 0.531 0.377 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -1.801 -0.421 -1.072 1.00 0.00 H new ATOM 798 N ASN A 53 -0.975 4.094 0.998 1.00 0.00 N ATOM 799 CA ASN A 53 -1.086 4.674 2.326 1.00 0.00 C ATOM 800 C ASN A 53 -2.548 5.025 2.604 1.00 0.00 C ATOM 801 O ASN A 53 -3.050 4.784 3.701 1.00 0.00 O ATOM 802 CB ASN A 53 -0.262 5.960 2.435 1.00 0.00 C ATOM 803 CG ASN A 53 0.832 5.822 3.494 1.00 0.00 C ATOM 804 OD1 ASN A 53 0.606 5.367 4.603 1.00 0.00 O ATOM 805 ND2 ASN A 53 2.029 6.240 3.094 1.00 0.00 N ATOM 0 H ASN A 53 -0.328 4.576 0.374 1.00 0.00 H new ATOM 0 HA ASN A 53 -0.714 3.944 3.045 1.00 0.00 H new ATOM 0 HB2 ASN A 53 0.189 6.190 1.470 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -0.916 6.794 2.689 1.00 0.00 H new ATOM 0 HD21 ASN A 53 2.825 6.190 3.729 1.00 0.00 H new ATOM 0 HD22 ASN A 53 2.151 6.611 2.152 1.00 0.00 H new ATOM 812 N CYS A 54 -3.191 5.586 1.592 1.00 0.00 N ATOM 813 CA CYS A 54 -4.588 5.972 1.713 1.00 0.00 C ATOM 814 C CYS A 54 -5.399 4.728 2.080 1.00 0.00 C ATOM 815 O CYS A 54 -6.432 4.830 2.740 1.00 0.00 O ATOM 816 CB CYS A 54 -5.105 6.635 0.434 1.00 0.00 C ATOM 817 SG CYS A 54 -6.065 5.534 -0.666 1.00 0.00 S ATOM 0 H CYS A 54 -2.771 5.783 0.683 1.00 0.00 H new ATOM 0 HA CYS A 54 -4.695 6.719 2.499 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -5.729 7.485 0.709 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -4.255 7.030 -0.123 1.00 0.00 H new ATOM 822 N LEU A 55 -4.902 3.585 1.636 1.00 0.00 N ATOM 823 CA LEU A 55 -5.567 2.323 1.909 1.00 0.00 C ATOM 824 C LEU A 55 -5.802 2.190 3.415 1.00 0.00 C ATOM 825 O LEU A 55 -6.795 1.605 3.842 1.00 0.00 O ATOM 826 CB LEU A 55 -4.779 1.159 1.305 1.00 0.00 C ATOM 827 CG LEU A 55 -5.594 -0.084 0.939 1.00 0.00 C ATOM 828 CD1 LEU A 55 -5.540 -0.350 -0.568 1.00 0.00 C ATOM 829 CD2 LEU A 55 -5.138 -1.298 1.750 1.00 0.00 C ATOM 0 H LEU A 55 -4.045 3.506 1.088 1.00 0.00 H new ATOM 0 HA LEU A 55 -6.546 2.298 1.429 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.274 1.515 0.407 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.003 0.865 2.012 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.636 0.103 1.198 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.127 -1.238 -0.802 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.949 0.507 -1.104 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -4.505 -0.508 -0.873 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.733 -2.167 1.470 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -4.086 -1.498 1.546 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -5.269 -1.095 2.813 1.00 0.00 H new ATOM 841 N ALA A 56 -4.872 2.743 4.178 1.00 0.00 N ATOM 842 CA ALA A 56 -4.964 2.694 5.626 1.00 0.00 C ATOM 843 C ALA A 56 -6.031 3.683 6.099 1.00 0.00 C ATOM 844 O ALA A 56 -6.462 3.635 7.250 1.00 0.00 O ATOM 845 CB ALA A 56 -3.590 2.984 6.237 1.00 0.00 C ATOM 0 H ALA A 56 -4.049 3.228 3.820 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.265 1.700 5.957 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -3.660 2.947 7.324 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -2.874 2.237 5.894 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -3.256 3.975 5.928 1.00 0.00 H new ATOM 851 N THR A 57 -6.429 4.557 5.184 1.00 0.00 N ATOM 852 CA THR A 57 -7.438 5.555 5.493 1.00 0.00 C ATOM 853 C THR A 57 -8.226 5.149 6.740 1.00 0.00 C ATOM 854 O THR A 57 -8.246 5.878 7.730 1.00 0.00 O ATOM 855 CB THR A 57 -8.316 5.740 4.253 1.00 0.00 C ATOM 856 OG1 THR A 57 -9.507 6.335 4.757 1.00 0.00 O ATOM 857 CG2 THR A 57 -8.784 4.408 3.664 1.00 0.00 C ATOM 0 H THR A 57 -6.071 4.594 4.230 1.00 0.00 H new ATOM 0 HA THR A 57 -6.983 6.516 5.733 1.00 0.00 H new ATOM 0 HB THR A 57 -7.764 6.297 3.496 1.00 0.00 H new ATOM 0 HG1 THR A 57 -10.132 6.491 4.019 1.00 0.00 H new ATOM 0 HG21 THR A 57 -9.403 4.596 2.787 1.00 0.00 H new ATOM 0 HG22 THR A 57 -7.917 3.813 3.376 1.00 0.00 H new ATOM 0 HG23 THR A 57 -9.365 3.865 4.409 1.00 0.00 H new ATOM 865 N LYS A 58 -8.858 3.989 6.649 1.00 0.00 N ATOM 866 CA LYS A 58 -9.645 3.477 7.759 1.00 0.00 C ATOM 867 C LYS A 58 -8.970 2.227 8.325 1.00 0.00 C ATOM 868 O LYS A 58 -9.214 1.118 7.854 1.00 0.00 O ATOM 869 CB LYS A 58 -11.096 3.250 7.325 1.00 0.00 C ATOM 870 CG LYS A 58 -11.920 4.530 7.471 1.00 0.00 C ATOM 871 CD LYS A 58 -13.108 4.314 8.409 1.00 0.00 C ATOM 872 CE LYS A 58 -14.106 5.469 8.305 1.00 0.00 C ATOM 873 NZ LYS A 58 -13.487 6.733 8.766 1.00 0.00 N ATOM 0 H LYS A 58 -8.842 3.389 5.825 1.00 0.00 H new ATOM 0 HA LYS A 58 -9.687 4.209 8.566 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -11.121 2.914 6.288 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -11.540 2.457 7.928 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -11.289 5.331 7.856 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -12.278 4.849 6.492 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -13.605 3.376 8.162 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -12.754 4.226 9.436 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -14.441 5.576 7.273 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -14.989 5.250 8.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -14.202 7.489 8.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -13.113 6.606 9.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -12.711 6.993 8.125 1.00 0.00 H new ATOM 887 N LEU A 59 -8.133 2.450 9.328 1.00 0.00 N ATOM 888 CA LEU A 59 -7.420 1.354 9.964 1.00 0.00 C ATOM 889 C LEU A 59 -8.430 0.342 10.507 1.00 0.00 C ATOM 890 O LEU A 59 -8.070 -0.793 10.818 1.00 0.00 O ATOM 891 CB LEU A 59 -6.452 1.888 11.023 1.00 0.00 C ATOM 892 CG LEU A 59 -4.964 1.757 10.698 1.00 0.00 C ATOM 893 CD1 LEU A 59 -4.675 2.194 9.261 1.00 0.00 C ATOM 894 CD2 LEU A 59 -4.112 2.525 11.711 1.00 0.00 C ATOM 0 H LEU A 59 -7.933 3.372 9.716 1.00 0.00 H new ATOM 0 HA LEU A 59 -6.801 0.828 9.237 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.675 2.941 11.192 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.646 1.366 11.960 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.690 0.705 10.776 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.609 2.091 9.057 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.239 1.568 8.570 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.970 3.235 9.131 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.058 2.415 11.457 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -4.383 3.581 11.688 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -4.288 2.127 12.710 1.00 0.00 H new ATOM 906 N ASP A 60 -9.672 0.788 10.606 1.00 0.00 N ATOM 907 CA ASP A 60 -10.736 -0.065 11.106 1.00 0.00 C ATOM 908 C ASP A 60 -11.017 -1.175 10.090 1.00 0.00 C ATOM 909 O ASP A 60 -11.525 -2.236 10.448 1.00 0.00 O ATOM 910 CB ASP A 60 -12.029 0.727 11.308 1.00 0.00 C ATOM 911 CG ASP A 60 -12.255 1.247 12.730 1.00 0.00 C ATOM 912 OD1 ASP A 60 -11.386 0.960 13.583 1.00 0.00 O ATOM 913 OD2 ASP A 60 -13.289 1.919 12.933 1.00 0.00 O ATOM 0 H ASP A 60 -9.966 1.730 10.348 1.00 0.00 H new ATOM 0 HA ASP A 60 -10.413 -0.479 12.061 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -12.028 1.575 10.623 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -12.872 0.094 11.031 1.00 0.00 H new ATOM 918 N VAL A 61 -10.671 -0.890 8.843 1.00 0.00 N ATOM 919 CA VAL A 61 -10.878 -1.852 7.772 1.00 0.00 C ATOM 920 C VAL A 61 -9.753 -2.888 7.799 1.00 0.00 C ATOM 921 O VAL A 61 -10.000 -4.081 7.625 1.00 0.00 O ATOM 922 CB VAL A 61 -10.989 -1.125 6.431 1.00 0.00 C ATOM 923 CG1 VAL A 61 -11.742 0.199 6.586 1.00 0.00 C ATOM 924 CG2 VAL A 61 -9.608 -0.899 5.814 1.00 0.00 C ATOM 0 H VAL A 61 -10.249 -0.009 8.550 1.00 0.00 H new ATOM 0 HA VAL A 61 -11.817 -2.388 7.915 1.00 0.00 H new ATOM 0 HB VAL A 61 -11.560 -1.759 5.753 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -11.807 0.696 5.618 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -12.746 0.004 6.962 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -11.209 0.840 7.288 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -9.716 -0.380 4.861 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -9.002 -0.295 6.490 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -9.121 -1.860 5.651 1.00 0.00 H new ATOM 934 N VAL A 62 -8.543 -2.395 8.015 1.00 0.00 N ATOM 935 CA VAL A 62 -7.378 -3.265 8.066 1.00 0.00 C ATOM 936 C VAL A 62 -7.295 -3.917 9.447 1.00 0.00 C ATOM 937 O VAL A 62 -7.068 -5.121 9.556 1.00 0.00 O ATOM 938 CB VAL A 62 -6.120 -2.477 7.700 1.00 0.00 C ATOM 939 CG1 VAL A 62 -5.808 -2.603 6.207 1.00 0.00 C ATOM 940 CG2 VAL A 62 -6.255 -1.008 8.109 1.00 0.00 C ATOM 0 H VAL A 62 -8.343 -1.405 8.157 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.467 -4.067 7.333 1.00 0.00 H new ATOM 0 HB VAL A 62 -5.284 -2.905 8.254 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -4.909 -2.033 5.974 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.648 -3.652 5.956 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.645 -2.214 5.626 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.347 -0.470 7.838 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -7.107 -0.564 7.595 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -6.407 -0.943 9.186 1.00 0.00 H new ATOM 950 N ASP A 63 -7.483 -3.094 10.467 1.00 0.00 N ATOM 951 CA ASP A 63 -7.431 -3.576 11.837 1.00 0.00 C ATOM 952 C ASP A 63 -8.749 -3.245 12.540 1.00 0.00 C ATOM 953 O ASP A 63 -8.988 -2.098 12.913 1.00 0.00 O ATOM 954 CB ASP A 63 -6.300 -2.903 12.616 1.00 0.00 C ATOM 955 CG ASP A 63 -6.433 -1.386 12.770 1.00 0.00 C ATOM 956 OD1 ASP A 63 -5.930 -0.678 11.870 1.00 0.00 O ATOM 957 OD2 ASP A 63 -7.035 -0.970 13.784 1.00 0.00 O ATOM 0 H ASP A 63 -7.672 -2.096 10.373 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.259 -4.652 11.809 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -6.247 -3.350 13.609 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -5.356 -3.121 12.117 1.00 0.00 H new ATOM 962 N PRO A 64 -9.594 -4.299 12.702 1.00 0.00 N ATOM 963 CA PRO A 64 -10.882 -4.132 13.354 1.00 0.00 C ATOM 964 C PRO A 64 -10.717 -3.987 14.867 1.00 0.00 C ATOM 965 O PRO A 64 -11.375 -3.155 15.490 1.00 0.00 O ATOM 966 CB PRO A 64 -11.685 -5.362 12.958 1.00 0.00 C ATOM 967 CG PRO A 64 -10.668 -6.389 12.488 1.00 0.00 C ATOM 968 CD PRO A 64 -9.346 -5.672 12.272 1.00 0.00 C ATOM 0 HA PRO A 64 -11.395 -3.221 13.045 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -12.261 -5.741 13.802 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -12.396 -5.126 12.167 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -10.556 -7.181 13.228 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -11.002 -6.861 11.564 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -8.547 -6.131 12.854 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -9.041 -5.710 11.226 1.00 0.00 H new ATOM 976 N ASP A 65 -9.835 -4.809 15.415 1.00 0.00 N ATOM 977 CA ASP A 65 -9.574 -4.783 16.844 1.00 0.00 C ATOM 978 C ASP A 65 -8.154 -4.270 17.091 1.00 0.00 C ATOM 979 O ASP A 65 -7.712 -4.179 18.235 1.00 0.00 O ATOM 980 CB ASP A 65 -9.684 -6.183 17.451 1.00 0.00 C ATOM 981 CG ASP A 65 -10.801 -6.357 18.481 1.00 0.00 C ATOM 982 OD1 ASP A 65 -11.163 -5.337 19.104 1.00 0.00 O ATOM 983 OD2 ASP A 65 -11.269 -7.508 18.621 1.00 0.00 O ATOM 0 H ASP A 65 -9.292 -5.498 14.895 1.00 0.00 H new ATOM 0 HA ASP A 65 -10.313 -4.130 17.309 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -9.839 -6.900 16.645 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -8.734 -6.433 17.923 1.00 0.00 H new ATOM 988 N GLY A 66 -7.477 -3.950 15.997 1.00 0.00 N ATOM 989 CA GLY A 66 -6.116 -3.449 16.082 1.00 0.00 C ATOM 990 C GLY A 66 -5.111 -4.521 15.654 1.00 0.00 C ATOM 991 O GLY A 66 -4.045 -4.652 16.254 1.00 0.00 O ATOM 0 H GLY A 66 -7.845 -4.028 15.049 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -6.008 -2.569 15.447 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -5.904 -3.133 17.103 1.00 0.00 H new ATOM 995 N ASN A 67 -5.485 -5.261 14.621 1.00 0.00 N ATOM 996 CA ASN A 67 -4.630 -6.317 14.108 1.00 0.00 C ATOM 997 C ASN A 67 -3.244 -5.742 13.805 1.00 0.00 C ATOM 998 O ASN A 67 -2.232 -6.402 14.036 1.00 0.00 O ATOM 999 CB ASN A 67 -5.193 -6.899 12.809 1.00 0.00 C ATOM 1000 CG ASN A 67 -4.066 -7.321 11.863 1.00 0.00 C ATOM 1001 OD1 ASN A 67 -4.040 -6.976 10.694 1.00 0.00 O ATOM 1002 ND2 ASN A 67 -3.141 -8.088 12.433 1.00 0.00 N ATOM 0 H ASN A 67 -6.369 -5.150 14.125 1.00 0.00 H new ATOM 0 HA ASN A 67 -4.574 -7.102 14.862 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -5.824 -7.759 13.035 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -5.826 -6.159 12.319 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -2.349 -8.424 11.885 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -3.224 -8.340 13.418 1.00 0.00 H new ATOM 1009 N LEU A 68 -3.242 -4.520 13.295 1.00 0.00 N ATOM 1010 CA LEU A 68 -1.998 -3.850 12.959 1.00 0.00 C ATOM 1011 C LEU A 68 -2.271 -2.364 12.721 1.00 0.00 C ATOM 1012 O LEU A 68 -3.392 -1.897 12.918 1.00 0.00 O ATOM 1013 CB LEU A 68 -1.315 -4.546 11.778 1.00 0.00 C ATOM 1014 CG LEU A 68 -1.724 -4.060 10.386 1.00 0.00 C ATOM 1015 CD1 LEU A 68 -3.028 -3.261 10.446 1.00 0.00 C ATOM 1016 CD2 LEU A 68 -0.593 -3.265 9.731 1.00 0.00 C ATOM 0 H LEU A 68 -4.084 -3.976 13.106 1.00 0.00 H new ATOM 0 HA LEU A 68 -1.295 -3.917 13.789 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -0.237 -4.422 11.882 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.521 -5.614 11.843 1.00 0.00 H new ATOM 0 HG LEU A 68 -1.910 -4.932 9.759 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.297 -2.927 9.444 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.823 -3.892 10.844 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -2.894 -2.394 11.093 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.908 -2.931 8.743 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.353 -2.399 10.348 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.289 -3.898 9.635 1.00 0.00 H new ATOM 1028 N HIS A 69 -1.228 -1.662 12.304 1.00 0.00 N ATOM 1029 CA HIS A 69 -1.342 -0.238 12.037 1.00 0.00 C ATOM 1030 C HIS A 69 -0.427 0.140 10.872 1.00 0.00 C ATOM 1031 O HIS A 69 0.787 -0.049 10.944 1.00 0.00 O ATOM 1032 CB HIS A 69 -1.059 0.574 13.302 1.00 0.00 C ATOM 1033 CG HIS A 69 -2.196 0.579 14.297 1.00 0.00 C ATOM 1034 ND1 HIS A 69 -2.007 0.800 15.650 1.00 0.00 N ATOM 1035 CD2 HIS A 69 -3.534 0.389 14.120 1.00 0.00 C ATOM 1036 CE1 HIS A 69 -3.186 0.742 16.251 1.00 0.00 C ATOM 1037 NE2 HIS A 69 -4.131 0.486 15.301 1.00 0.00 N ATOM 0 H HIS A 69 -0.299 -2.053 12.144 1.00 0.00 H new ATOM 0 HA HIS A 69 -2.364 0.001 11.742 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -0.168 0.174 13.786 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -0.834 1.602 13.018 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -4.025 0.193 13.178 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -3.367 0.874 17.307 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -5.132 0.386 15.471 1.00 0.00 H new ATOM 1046 N HIS A 70 -1.043 0.670 9.825 1.00 0.00 N ATOM 1047 CA HIS A 70 -0.298 1.077 8.645 1.00 0.00 C ATOM 1048 C HIS A 70 0.953 1.847 9.069 1.00 0.00 C ATOM 1049 O HIS A 70 0.924 2.599 10.044 1.00 0.00 O ATOM 1050 CB HIS A 70 -1.190 1.874 7.689 1.00 0.00 C ATOM 1051 CG HIS A 70 -1.302 3.339 8.031 1.00 0.00 C ATOM 1052 ND1 HIS A 70 -1.078 4.345 7.107 1.00 0.00 N ATOM 1053 CD2 HIS A 70 -1.618 3.958 9.205 1.00 0.00 C ATOM 1054 CE1 HIS A 70 -1.253 5.512 7.709 1.00 0.00 C ATOM 1055 NE2 HIS A 70 -1.587 5.270 9.008 1.00 0.00 N ATOM 0 H HIS A 70 -2.049 0.827 9.769 1.00 0.00 H new ATOM 0 HA HIS A 70 0.030 0.195 8.094 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -0.798 1.777 6.677 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -2.187 1.435 7.688 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -0.822 4.211 6.129 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -1.853 3.464 10.136 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -1.149 6.484 7.251 1.00 0.00 H new ATOM 1064 N GLY A 71 2.023 1.636 8.316 1.00 0.00 N ATOM 1065 CA GLY A 71 3.282 2.301 8.602 1.00 0.00 C ATOM 1066 C GLY A 71 4.026 1.602 9.742 1.00 0.00 C ATOM 1067 O GLY A 71 5.231 1.368 9.651 1.00 0.00 O ATOM 0 H GLY A 71 2.043 1.014 7.508 1.00 0.00 H new ATOM 0 HA2 GLY A 71 3.905 2.308 7.707 1.00 0.00 H new ATOM 0 HA3 GLY A 71 3.095 3.341 8.869 1.00 0.00 H new ATOM 1071 N ASN A 72 3.278 1.286 10.788 1.00 0.00 N ATOM 1072 CA ASN A 72 3.851 0.618 11.945 1.00 0.00 C ATOM 1073 C ASN A 72 3.027 -0.631 12.266 1.00 0.00 C ATOM 1074 O ASN A 72 2.249 -0.637 13.218 1.00 0.00 O ATOM 1075 CB ASN A 72 3.829 1.527 13.174 1.00 0.00 C ATOM 1076 CG ASN A 72 4.655 0.931 14.314 1.00 0.00 C ATOM 1077 OD1 ASN A 72 5.422 -0.004 14.137 1.00 0.00 O ATOM 1078 ND2 ASN A 72 4.459 1.517 15.490 1.00 0.00 N ATOM 0 H ASN A 72 2.279 1.480 10.859 1.00 0.00 H new ATOM 0 HA ASN A 72 4.883 0.359 11.708 1.00 0.00 H new ATOM 0 HB2 ASN A 72 4.222 2.509 12.911 1.00 0.00 H new ATOM 0 HB3 ASN A 72 2.800 1.673 13.504 1.00 0.00 H new ATOM 0 HD21 ASN A 72 4.964 1.190 16.313 1.00 0.00 H new ATOM 0 HD22 ASN A 72 3.803 2.294 15.570 1.00 0.00 H new ATOM 1085 N ALA A 73 3.230 -1.659 11.455 1.00 0.00 N ATOM 1086 CA ALA A 73 2.516 -2.911 11.642 1.00 0.00 C ATOM 1087 C ALA A 73 2.920 -3.528 12.983 1.00 0.00 C ATOM 1088 O ALA A 73 4.107 -3.660 13.276 1.00 0.00 O ATOM 1089 CB ALA A 73 2.803 -3.842 10.462 1.00 0.00 C ATOM 0 H ALA A 73 3.878 -1.651 10.667 1.00 0.00 H new ATOM 0 HA ALA A 73 1.440 -2.740 11.669 1.00 0.00 H new ATOM 0 HB1 ALA A 73 2.268 -4.781 10.601 1.00 0.00 H new ATOM 0 HB2 ALA A 73 2.472 -3.370 9.537 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.874 -4.039 10.406 1.00 0.00 H new ATOM 1095 N LYS A 74 1.910 -3.890 13.759 1.00 0.00 N ATOM 1096 CA LYS A 74 2.144 -4.491 15.061 1.00 0.00 C ATOM 1097 C LYS A 74 2.911 -5.801 14.883 1.00 0.00 C ATOM 1098 O LYS A 74 3.088 -6.274 13.762 1.00 0.00 O ATOM 1099 CB LYS A 74 0.827 -4.646 15.823 1.00 0.00 C ATOM 1100 CG LYS A 74 0.555 -3.426 16.707 1.00 0.00 C ATOM 1101 CD LYS A 74 -0.550 -3.721 17.723 1.00 0.00 C ATOM 1102 CE LYS A 74 0.009 -4.456 18.944 1.00 0.00 C ATOM 1103 NZ LYS A 74 -0.409 -3.781 20.192 1.00 0.00 N ATOM 0 H LYS A 74 0.927 -3.779 13.511 1.00 0.00 H new ATOM 0 HA LYS A 74 2.766 -3.840 15.676 1.00 0.00 H new ATOM 0 HB2 LYS A 74 0.008 -4.777 15.116 1.00 0.00 H new ATOM 0 HB3 LYS A 74 0.863 -5.545 16.439 1.00 0.00 H new ATOM 0 HG2 LYS A 74 1.468 -3.140 17.230 1.00 0.00 H new ATOM 0 HG3 LYS A 74 0.265 -2.579 16.085 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -1.017 -2.788 18.038 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -1.327 -4.325 17.255 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -0.342 -5.488 18.947 1.00 0.00 H new ATOM 0 HE3 LYS A 74 1.097 -4.490 18.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -0.021 -4.293 21.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -0.053 -2.804 20.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -1.447 -3.771 20.250 1.00 0.00 H new ATOM 1117 N ASP A 75 3.346 -6.353 16.006 1.00 0.00 N ATOM 1118 CA ASP A 75 4.091 -7.601 15.989 1.00 0.00 C ATOM 1119 C ASP A 75 3.145 -8.747 15.626 1.00 0.00 C ATOM 1120 O ASP A 75 3.562 -9.904 15.565 1.00 0.00 O ATOM 1121 CB ASP A 75 4.693 -7.902 17.363 1.00 0.00 C ATOM 1122 CG ASP A 75 5.903 -7.045 17.740 1.00 0.00 C ATOM 1123 OD1 ASP A 75 6.654 -6.682 16.809 1.00 0.00 O ATOM 1124 OD2 ASP A 75 6.050 -6.771 18.951 1.00 0.00 O ATOM 0 H ASP A 75 3.197 -5.959 16.935 1.00 0.00 H new ATOM 0 HA ASP A 75 4.893 -7.506 15.257 1.00 0.00 H new ATOM 0 HB2 ASP A 75 3.920 -7.766 18.119 1.00 0.00 H new ATOM 0 HB3 ASP A 75 4.986 -8.951 17.393 1.00 0.00 H new ATOM 1129 N PHE A 76 1.892 -8.388 15.392 1.00 0.00 N ATOM 1130 CA PHE A 76 0.885 -9.373 15.035 1.00 0.00 C ATOM 1131 C PHE A 76 0.791 -9.536 13.517 1.00 0.00 C ATOM 1132 O PHE A 76 0.649 -10.650 13.016 1.00 0.00 O ATOM 1133 CB PHE A 76 -0.454 -8.855 15.565 1.00 0.00 C ATOM 1134 CG PHE A 76 -1.485 -9.954 15.827 1.00 0.00 C ATOM 1135 CD1 PHE A 76 -2.128 -10.546 14.784 1.00 0.00 C ATOM 1136 CD2 PHE A 76 -1.763 -10.337 17.101 1.00 0.00 C ATOM 1137 CE1 PHE A 76 -3.085 -11.567 15.025 1.00 0.00 C ATOM 1138 CE2 PHE A 76 -2.720 -11.357 17.343 1.00 0.00 C ATOM 1139 CZ PHE A 76 -3.362 -11.950 16.301 1.00 0.00 C ATOM 0 H PHE A 76 1.551 -7.428 15.443 1.00 0.00 H new ATOM 0 HA PHE A 76 1.144 -10.342 15.462 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -0.279 -8.306 16.491 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -0.868 -8.146 14.848 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -1.910 -10.239 13.772 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -1.256 -9.865 17.929 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -3.592 -12.039 14.197 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -2.939 -11.662 18.356 1.00 0.00 H new ATOM 0 HZ PHE A 76 -4.091 -12.725 16.486 1.00 0.00 H new ATOM 1149 N ALA A 77 0.872 -8.409 12.826 1.00 0.00 N ATOM 1150 CA ALA A 77 0.798 -8.411 11.376 1.00 0.00 C ATOM 1151 C ALA A 77 1.991 -9.185 10.809 1.00 0.00 C ATOM 1152 O ALA A 77 1.815 -10.172 10.097 1.00 0.00 O ATOM 1153 CB ALA A 77 0.742 -6.971 10.863 1.00 0.00 C ATOM 0 H ALA A 77 0.988 -7.486 13.245 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.110 -8.911 11.041 1.00 0.00 H new ATOM 0 HB1 ALA A 77 0.687 -6.974 9.774 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -0.139 -6.474 11.270 1.00 0.00 H new ATOM 0 HB3 ALA A 77 1.638 -6.437 11.179 1.00 0.00 H new ATOM 1159 N MET A 78 3.180 -8.706 11.148 1.00 0.00 N ATOM 1160 CA MET A 78 4.401 -9.341 10.683 1.00 0.00 C ATOM 1161 C MET A 78 4.753 -10.553 11.546 1.00 0.00 C ATOM 1162 O MET A 78 5.922 -10.786 11.850 1.00 0.00 O ATOM 1163 CB MET A 78 5.550 -8.330 10.729 1.00 0.00 C ATOM 1164 CG MET A 78 5.709 -7.745 12.133 1.00 0.00 C ATOM 1165 SD MET A 78 7.054 -8.552 12.983 1.00 0.00 S ATOM 1166 CE MET A 78 6.166 -9.271 14.355 1.00 0.00 C ATOM 0 H MET A 78 3.323 -7.887 11.738 1.00 0.00 H new ATOM 0 HA MET A 78 4.244 -9.682 9.660 1.00 0.00 H new ATOM 0 HB2 MET A 78 6.478 -8.815 10.426 1.00 0.00 H new ATOM 0 HB3 MET A 78 5.362 -7.527 10.016 1.00 0.00 H new ATOM 0 HG2 MET A 78 5.899 -6.674 12.070 1.00 0.00 H new ATOM 0 HG3 MET A 78 4.784 -7.872 12.696 1.00 0.00 H new ATOM 0 HE1 MET A 78 6.410 -8.731 15.270 1.00 0.00 H new ATOM 0 HE2 MET A 78 5.094 -9.204 14.170 1.00 0.00 H new ATOM 0 HE3 MET A 78 6.451 -10.317 14.464 1.00 0.00 H new ATOM 1176 N LYS A 79 3.719 -11.296 11.917 1.00 0.00 N ATOM 1177 CA LYS A 79 3.904 -12.478 12.739 1.00 0.00 C ATOM 1178 C LYS A 79 2.745 -13.447 12.500 1.00 0.00 C ATOM 1179 O LYS A 79 2.963 -14.618 12.189 1.00 0.00 O ATOM 1180 CB LYS A 79 4.086 -12.087 14.208 1.00 0.00 C ATOM 1181 CG LYS A 79 4.706 -13.234 15.008 1.00 0.00 C ATOM 1182 CD LYS A 79 3.716 -13.785 16.037 1.00 0.00 C ATOM 1183 CE LYS A 79 4.379 -14.835 16.930 1.00 0.00 C ATOM 1184 NZ LYS A 79 5.138 -14.183 18.020 1.00 0.00 N ATOM 0 H LYS A 79 2.751 -11.101 11.663 1.00 0.00 H new ATOM 0 HA LYS A 79 4.819 -12.999 12.456 1.00 0.00 H new ATOM 0 HB2 LYS A 79 4.723 -11.205 14.277 1.00 0.00 H new ATOM 0 HB3 LYS A 79 3.121 -11.818 14.639 1.00 0.00 H new ATOM 0 HG2 LYS A 79 5.012 -14.031 14.330 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.605 -12.884 15.515 1.00 0.00 H new ATOM 0 HD2 LYS A 79 3.333 -12.970 16.651 1.00 0.00 H new ATOM 0 HD3 LYS A 79 2.861 -14.226 15.524 1.00 0.00 H new ATOM 0 HE2 LYS A 79 3.620 -15.494 17.351 1.00 0.00 H new ATOM 0 HE3 LYS A 79 5.047 -15.457 16.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 5.582 -14.910 18.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 5.875 -13.572 17.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 4.492 -13.608 18.597 1.00 0.00 H new ATOM 1198 N HIS A 80 1.537 -12.924 12.653 1.00 0.00 N ATOM 1199 CA HIS A 80 0.344 -13.729 12.457 1.00 0.00 C ATOM 1200 C HIS A 80 0.244 -14.151 10.990 1.00 0.00 C ATOM 1201 O HIS A 80 -0.621 -14.946 10.625 1.00 0.00 O ATOM 1202 CB HIS A 80 -0.899 -12.983 12.945 1.00 0.00 C ATOM 1203 CG HIS A 80 -1.524 -12.083 11.904 1.00 0.00 C ATOM 1204 ND1 HIS A 80 -0.776 -11.277 11.065 1.00 0.00 N ATOM 1205 CD2 HIS A 80 -2.832 -11.873 11.577 1.00 0.00 C ATOM 1206 CE1 HIS A 80 -1.606 -10.614 10.272 1.00 0.00 C ATOM 1207 NE2 HIS A 80 -2.879 -10.985 10.592 1.00 0.00 N ATOM 0 H HIS A 80 1.359 -11.953 12.910 1.00 0.00 H new ATOM 0 HA HIS A 80 0.411 -14.637 13.056 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.641 -13.711 13.274 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -0.632 -12.384 13.816 1.00 0.00 H new ATOM 0 HD1 HIS A 80 0.241 -11.205 11.058 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -3.684 -12.348 12.041 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -1.324 -9.905 9.507 1.00 0.00 H new ATOM 1216 N GLY A 81 1.144 -13.600 10.187 1.00 0.00 N ATOM 1217 CA GLY A 81 1.168 -13.910 8.769 1.00 0.00 C ATOM 1218 C GLY A 81 2.566 -13.697 8.184 1.00 0.00 C ATOM 1219 O GLY A 81 2.715 -13.479 6.983 1.00 0.00 O ATOM 0 H GLY A 81 1.861 -12.942 10.492 1.00 0.00 H new ATOM 0 HA2 GLY A 81 0.859 -14.944 8.614 1.00 0.00 H new ATOM 0 HA3 GLY A 81 0.450 -13.280 8.243 1.00 0.00 H new ATOM 1223 N ALA A 82 3.556 -13.768 9.063 1.00 0.00 N ATOM 1224 CA ALA A 82 4.938 -13.585 8.649 1.00 0.00 C ATOM 1225 C ALA A 82 5.792 -14.714 9.227 1.00 0.00 C ATOM 1226 O ALA A 82 5.392 -15.369 10.189 1.00 0.00 O ATOM 1227 CB ALA A 82 5.423 -12.203 9.090 1.00 0.00 C ATOM 0 H ALA A 82 3.429 -13.949 10.059 1.00 0.00 H new ATOM 0 HA ALA A 82 5.023 -13.630 7.563 1.00 0.00 H new ATOM 0 HB1 ALA A 82 6.459 -12.065 8.780 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.801 -11.435 8.630 1.00 0.00 H new ATOM 0 HB3 ALA A 82 5.355 -12.123 10.175 1.00 0.00 H new ATOM 1233 N ASP A 83 6.951 -14.909 8.615 1.00 0.00 N ATOM 1234 CA ASP A 83 7.865 -15.949 9.057 1.00 0.00 C ATOM 1235 C ASP A 83 8.624 -15.462 10.293 1.00 0.00 C ATOM 1236 O ASP A 83 9.004 -14.295 10.373 1.00 0.00 O ATOM 1237 CB ASP A 83 8.891 -16.278 7.971 1.00 0.00 C ATOM 1238 CG ASP A 83 8.515 -17.451 7.062 1.00 0.00 C ATOM 1239 OD1 ASP A 83 8.331 -18.557 7.612 1.00 0.00 O ATOM 1240 OD2 ASP A 83 8.421 -17.213 5.839 1.00 0.00 O ATOM 0 H ASP A 83 7.278 -14.365 7.817 1.00 0.00 H new ATOM 0 HA ASP A 83 7.279 -16.840 9.281 1.00 0.00 H new ATOM 0 HB2 ASP A 83 9.041 -15.392 7.353 1.00 0.00 H new ATOM 0 HB3 ASP A 83 9.846 -16.499 8.449 1.00 0.00 H new ATOM 1245 N GLU A 84 8.824 -16.382 11.226 1.00 0.00 N ATOM 1246 CA GLU A 84 9.532 -16.061 12.453 1.00 0.00 C ATOM 1247 C GLU A 84 10.790 -15.247 12.143 1.00 0.00 C ATOM 1248 O GLU A 84 11.174 -14.373 12.919 1.00 0.00 O ATOM 1249 CB GLU A 84 9.880 -17.331 13.233 1.00 0.00 C ATOM 1250 CG GLU A 84 9.006 -17.464 14.482 1.00 0.00 C ATOM 1251 CD GLU A 84 9.332 -18.749 15.245 1.00 0.00 C ATOM 1252 OE1 GLU A 84 8.913 -19.821 14.757 1.00 0.00 O ATOM 1253 OE2 GLU A 84 9.994 -18.631 16.299 1.00 0.00 O ATOM 0 H GLU A 84 8.508 -17.349 11.156 1.00 0.00 H new ATOM 0 HA GLU A 84 8.877 -15.456 13.080 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.743 -18.203 12.594 1.00 0.00 H new ATOM 0 HB3 GLU A 84 10.931 -17.309 13.521 1.00 0.00 H new ATOM 0 HG2 GLU A 84 9.160 -16.602 15.131 1.00 0.00 H new ATOM 0 HG3 GLU A 84 7.954 -17.464 14.196 1.00 0.00 H new ATOM 1260 N THR A 85 11.396 -15.561 11.008 1.00 0.00 N ATOM 1261 CA THR A 85 12.601 -14.870 10.587 1.00 0.00 C ATOM 1262 C THR A 85 12.248 -13.527 9.944 1.00 0.00 C ATOM 1263 O THR A 85 12.868 -12.508 10.245 1.00 0.00 O ATOM 1264 CB THR A 85 13.382 -15.802 9.658 1.00 0.00 C ATOM 1265 OG1 THR A 85 14.658 -15.181 9.534 1.00 0.00 O ATOM 1266 CG2 THR A 85 12.828 -15.805 8.232 1.00 0.00 C ATOM 0 H THR A 85 11.074 -16.286 10.367 1.00 0.00 H new ATOM 0 HA THR A 85 13.237 -14.630 11.439 1.00 0.00 H new ATOM 0 HB THR A 85 13.359 -16.816 10.058 1.00 0.00 H new ATOM 0 HG1 THR A 85 15.229 -15.721 8.949 1.00 0.00 H new ATOM 0 HG21 THR A 85 13.418 -16.482 7.614 1.00 0.00 H new ATOM 0 HG22 THR A 85 11.790 -16.137 8.246 1.00 0.00 H new ATOM 0 HG23 THR A 85 12.881 -14.798 7.819 1.00 0.00 H new ATOM 1274 N MET A 86 11.254 -13.569 9.069 1.00 0.00 N ATOM 1275 CA MET A 86 10.812 -12.369 8.381 1.00 0.00 C ATOM 1276 C MET A 86 10.468 -11.260 9.378 1.00 0.00 C ATOM 1277 O MET A 86 10.822 -10.101 9.168 1.00 0.00 O ATOM 1278 CB MET A 86 9.580 -12.693 7.532 1.00 0.00 C ATOM 1279 CG MET A 86 8.673 -11.468 7.394 1.00 0.00 C ATOM 1280 SD MET A 86 7.886 -11.470 5.791 1.00 0.00 S ATOM 1281 CE MET A 86 7.344 -13.169 5.713 1.00 0.00 C ATOM 0 H MET A 86 10.742 -14.416 8.821 1.00 0.00 H new ATOM 0 HA MET A 86 11.623 -12.018 7.743 1.00 0.00 H new ATOM 0 HB2 MET A 86 9.893 -13.032 6.544 1.00 0.00 H new ATOM 0 HB3 MET A 86 9.024 -13.512 7.988 1.00 0.00 H new ATOM 0 HG2 MET A 86 7.917 -11.474 8.180 1.00 0.00 H new ATOM 0 HG3 MET A 86 9.257 -10.556 7.521 1.00 0.00 H new ATOM 0 HE1 MET A 86 6.536 -13.260 4.987 1.00 0.00 H new ATOM 0 HE2 MET A 86 8.177 -13.803 5.411 1.00 0.00 H new ATOM 0 HE3 MET A 86 6.987 -13.482 6.694 1.00 0.00 H new ATOM 1291 N ALA A 87 9.783 -11.656 10.440 1.00 0.00 N ATOM 1292 CA ALA A 87 9.387 -10.710 11.470 1.00 0.00 C ATOM 1293 C ALA A 87 10.620 -9.942 11.952 1.00 0.00 C ATOM 1294 O ALA A 87 10.587 -8.718 12.065 1.00 0.00 O ATOM 1295 CB ALA A 87 8.685 -11.458 12.606 1.00 0.00 C ATOM 0 H ALA A 87 9.492 -12.619 10.610 1.00 0.00 H new ATOM 0 HA ALA A 87 8.680 -9.982 11.072 1.00 0.00 H new ATOM 0 HB1 ALA A 87 8.388 -10.749 13.379 1.00 0.00 H new ATOM 0 HB2 ALA A 87 7.801 -11.963 12.217 1.00 0.00 H new ATOM 0 HB3 ALA A 87 9.366 -12.195 13.032 1.00 0.00 H new ATOM 1301 N GLN A 88 11.677 -10.693 12.221 1.00 0.00 N ATOM 1302 CA GLN A 88 12.918 -10.098 12.688 1.00 0.00 C ATOM 1303 C GLN A 88 13.656 -9.430 11.526 1.00 0.00 C ATOM 1304 O GLN A 88 14.110 -8.293 11.647 1.00 0.00 O ATOM 1305 CB GLN A 88 13.802 -11.141 13.373 1.00 0.00 C ATOM 1306 CG GLN A 88 15.207 -10.589 13.622 1.00 0.00 C ATOM 1307 CD GLN A 88 16.228 -11.244 12.687 1.00 0.00 C ATOM 1308 OE1 GLN A 88 16.767 -12.303 12.959 1.00 0.00 O ATOM 1309 NE2 GLN A 88 16.460 -10.554 11.574 1.00 0.00 N ATOM 0 H GLN A 88 11.700 -11.708 12.125 1.00 0.00 H new ATOM 0 HA GLN A 88 12.677 -9.334 13.427 1.00 0.00 H new ATOM 0 HB2 GLN A 88 13.352 -11.440 14.320 1.00 0.00 H new ATOM 0 HB3 GLN A 88 13.863 -12.035 12.753 1.00 0.00 H new ATOM 0 HG2 GLN A 88 15.210 -9.510 13.470 1.00 0.00 H new ATOM 0 HG3 GLN A 88 15.492 -10.766 14.659 1.00 0.00 H new ATOM 0 HE21 GLN A 88 15.973 -9.673 11.409 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.125 -10.906 10.885 1.00 0.00 H new ATOM 1318 N GLN A 89 13.755 -10.167 10.429 1.00 0.00 N ATOM 1319 CA GLN A 89 14.430 -9.659 9.246 1.00 0.00 C ATOM 1320 C GLN A 89 14.011 -8.213 8.975 1.00 0.00 C ATOM 1321 O GLN A 89 14.858 -7.327 8.875 1.00 0.00 O ATOM 1322 CB GLN A 89 14.150 -10.548 8.032 1.00 0.00 C ATOM 1323 CG GLN A 89 14.937 -11.858 8.118 1.00 0.00 C ATOM 1324 CD GLN A 89 16.425 -11.589 8.351 1.00 0.00 C ATOM 1325 OE1 GLN A 89 16.945 -11.731 9.446 1.00 0.00 O ATOM 1326 NE2 GLN A 89 17.080 -11.194 7.264 1.00 0.00 N ATOM 0 H GLN A 89 13.380 -11.111 10.334 1.00 0.00 H new ATOM 0 HA GLN A 89 15.504 -9.676 9.429 1.00 0.00 H new ATOM 0 HB2 GLN A 89 13.083 -10.764 7.973 1.00 0.00 H new ATOM 0 HB3 GLN A 89 14.419 -10.017 7.119 1.00 0.00 H new ATOM 0 HG2 GLN A 89 14.543 -12.471 8.929 1.00 0.00 H new ATOM 0 HG3 GLN A 89 14.806 -12.426 7.197 1.00 0.00 H new ATOM 0 HE21 GLN A 89 16.585 -11.095 6.378 1.00 0.00 H new ATOM 0 HE22 GLN A 89 18.078 -10.990 7.316 1.00 0.00 H new ATOM 1335 N LEU A 90 12.706 -8.020 8.864 1.00 0.00 N ATOM 1336 CA LEU A 90 12.166 -6.696 8.605 1.00 0.00 C ATOM 1337 C LEU A 90 12.843 -5.683 9.530 1.00 0.00 C ATOM 1338 O LEU A 90 13.257 -4.612 9.089 1.00 0.00 O ATOM 1339 CB LEU A 90 10.640 -6.708 8.720 1.00 0.00 C ATOM 1340 CG LEU A 90 9.875 -7.117 7.459 1.00 0.00 C ATOM 1341 CD1 LEU A 90 10.630 -8.201 6.688 1.00 0.00 C ATOM 1342 CD2 LEU A 90 8.446 -7.546 7.799 1.00 0.00 C ATOM 0 H LEU A 90 12.006 -8.757 8.949 1.00 0.00 H new ATOM 0 HA LEU A 90 12.384 -6.390 7.582 1.00 0.00 H new ATOM 0 HB2 LEU A 90 10.362 -7.387 9.526 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.310 -5.712 9.014 1.00 0.00 H new ATOM 0 HG LEU A 90 9.803 -6.247 6.806 1.00 0.00 H new ATOM 0 HD11 LEU A 90 10.065 -8.474 5.797 1.00 0.00 H new ATOM 0 HD12 LEU A 90 11.610 -7.824 6.395 1.00 0.00 H new ATOM 0 HD13 LEU A 90 10.754 -9.079 7.322 1.00 0.00 H new ATOM 0 HD21 LEU A 90 7.925 -7.831 6.885 1.00 0.00 H new ATOM 0 HD22 LEU A 90 8.474 -8.395 8.481 1.00 0.00 H new ATOM 0 HD23 LEU A 90 7.920 -6.717 8.273 1.00 0.00 H new ATOM 1354 N VAL A 91 12.937 -6.058 10.798 1.00 0.00 N ATOM 1355 CA VAL A 91 13.558 -5.196 11.789 1.00 0.00 C ATOM 1356 C VAL A 91 14.947 -4.784 11.302 1.00 0.00 C ATOM 1357 O VAL A 91 15.529 -3.825 11.808 1.00 0.00 O ATOM 1358 CB VAL A 91 13.585 -5.897 13.149 1.00 0.00 C ATOM 1359 CG1 VAL A 91 13.922 -4.911 14.268 1.00 0.00 C ATOM 1360 CG2 VAL A 91 12.259 -6.609 13.425 1.00 0.00 C ATOM 0 H VAL A 91 12.593 -6.947 11.161 1.00 0.00 H new ATOM 0 HA VAL A 91 12.976 -4.284 11.920 1.00 0.00 H new ATOM 0 HB VAL A 91 14.371 -6.652 13.121 1.00 0.00 H new ATOM 0 HG11 VAL A 91 13.935 -5.435 15.223 1.00 0.00 H new ATOM 0 HG12 VAL A 91 14.902 -4.471 14.083 1.00 0.00 H new ATOM 0 HG13 VAL A 91 13.170 -4.122 14.297 1.00 0.00 H new ATOM 0 HG21 VAL A 91 12.305 -7.099 14.398 1.00 0.00 H new ATOM 0 HG22 VAL A 91 11.448 -5.881 13.423 1.00 0.00 H new ATOM 0 HG23 VAL A 91 12.079 -7.355 12.651 1.00 0.00 H new ATOM 1370 N ASP A 92 15.441 -5.528 10.322 1.00 0.00 N ATOM 1371 CA ASP A 92 16.752 -5.251 9.761 1.00 0.00 C ATOM 1372 C ASP A 92 16.660 -4.037 8.833 1.00 0.00 C ATOM 1373 O ASP A 92 17.189 -2.972 9.145 1.00 0.00 O ATOM 1374 CB ASP A 92 17.260 -6.437 8.937 1.00 0.00 C ATOM 1375 CG ASP A 92 18.737 -6.366 8.543 1.00 0.00 C ATOM 1376 OD1 ASP A 92 19.440 -5.516 9.129 1.00 0.00 O ATOM 1377 OD2 ASP A 92 19.128 -7.164 7.665 1.00 0.00 O ATOM 0 H ASP A 92 14.957 -6.322 9.903 1.00 0.00 H new ATOM 0 HA ASP A 92 17.439 -5.063 10.586 1.00 0.00 H new ATOM 0 HB2 ASP A 92 17.095 -7.352 9.505 1.00 0.00 H new ATOM 0 HB3 ASP A 92 16.661 -6.513 8.030 1.00 0.00 H new ATOM 1382 N ILE A 93 15.983 -4.239 7.713 1.00 0.00 N ATOM 1383 CA ILE A 93 15.814 -3.175 6.738 1.00 0.00 C ATOM 1384 C ILE A 93 14.947 -2.070 7.343 1.00 0.00 C ATOM 1385 O ILE A 93 15.284 -0.890 7.248 1.00 0.00 O ATOM 1386 CB ILE A 93 15.269 -3.734 5.422 1.00 0.00 C ATOM 1387 CG1 ILE A 93 13.743 -3.638 5.376 1.00 0.00 C ATOM 1388 CG2 ILE A 93 15.759 -5.165 5.190 1.00 0.00 C ATOM 1389 CD1 ILE A 93 13.096 -4.769 6.177 1.00 0.00 C ATOM 0 H ILE A 93 15.545 -5.124 7.458 1.00 0.00 H new ATOM 0 HA ILE A 93 16.777 -2.727 6.491 1.00 0.00 H new ATOM 0 HB ILE A 93 15.656 -3.124 4.606 1.00 0.00 H new ATOM 0 HG12 ILE A 93 13.424 -2.676 5.776 1.00 0.00 H new ATOM 0 HG13 ILE A 93 13.404 -3.681 4.341 1.00 0.00 H new ATOM 0 HG21 ILE A 93 15.357 -5.539 4.248 1.00 0.00 H new ATOM 0 HG22 ILE A 93 16.848 -5.175 5.149 1.00 0.00 H new ATOM 0 HG23 ILE A 93 15.421 -5.802 6.007 1.00 0.00 H new ATOM 0 HD11 ILE A 93 12.011 -4.676 6.127 1.00 0.00 H new ATOM 0 HD12 ILE A 93 13.397 -5.729 5.759 1.00 0.00 H new ATOM 0 HD13 ILE A 93 13.418 -4.709 7.217 1.00 0.00 H new ATOM 1401 N ILE A 94 13.848 -2.490 7.951 1.00 0.00 N ATOM 1402 CA ILE A 94 12.928 -1.549 8.571 1.00 0.00 C ATOM 1403 C ILE A 94 13.706 -0.636 9.522 1.00 0.00 C ATOM 1404 O ILE A 94 13.276 0.482 9.803 1.00 0.00 O ATOM 1405 CB ILE A 94 11.772 -2.294 9.242 1.00 0.00 C ATOM 1406 CG1 ILE A 94 11.001 -3.138 8.225 1.00 0.00 C ATOM 1407 CG2 ILE A 94 10.858 -1.322 9.992 1.00 0.00 C ATOM 1408 CD1 ILE A 94 9.492 -3.013 8.442 1.00 0.00 C ATOM 0 H ILE A 94 13.573 -3.469 8.028 1.00 0.00 H new ATOM 0 HA ILE A 94 12.469 -0.909 7.817 1.00 0.00 H new ATOM 0 HB ILE A 94 12.188 -2.980 9.980 1.00 0.00 H new ATOM 0 HG12 ILE A 94 11.255 -2.818 7.214 1.00 0.00 H new ATOM 0 HG13 ILE A 94 11.300 -4.183 8.313 1.00 0.00 H new ATOM 0 HG21 ILE A 94 10.044 -1.876 10.460 1.00 0.00 H new ATOM 0 HG22 ILE A 94 11.431 -0.802 10.759 1.00 0.00 H new ATOM 0 HG23 ILE A 94 10.447 -0.595 9.291 1.00 0.00 H new ATOM 0 HD11 ILE A 94 8.967 -3.622 7.706 1.00 0.00 H new ATOM 0 HD12 ILE A 94 9.239 -3.357 9.445 1.00 0.00 H new ATOM 0 HD13 ILE A 94 9.193 -1.971 8.329 1.00 0.00 H new ATOM 1420 N HIS A 95 14.836 -1.145 9.989 1.00 0.00 N ATOM 1421 CA HIS A 95 15.676 -0.389 10.901 1.00 0.00 C ATOM 1422 C HIS A 95 16.460 0.669 10.121 1.00 0.00 C ATOM 1423 O HIS A 95 16.801 1.720 10.663 1.00 0.00 O ATOM 1424 CB HIS A 95 16.581 -1.323 11.706 1.00 0.00 C ATOM 1425 CG HIS A 95 16.053 -1.658 13.080 1.00 0.00 C ATOM 1426 ND1 HIS A 95 16.866 -1.732 14.197 1.00 0.00 N ATOM 1427 CD2 HIS A 95 14.788 -1.937 13.505 1.00 0.00 C ATOM 1428 CE1 HIS A 95 16.112 -2.043 15.243 1.00 0.00 C ATOM 1429 NE2 HIS A 95 14.824 -2.169 14.810 1.00 0.00 N ATOM 0 H HIS A 95 15.189 -2.072 9.753 1.00 0.00 H new ATOM 0 HA HIS A 95 15.052 0.133 11.627 1.00 0.00 H new ATOM 0 HB2 HIS A 95 16.720 -2.248 11.146 1.00 0.00 H new ATOM 0 HB3 HIS A 95 17.563 -0.861 11.808 1.00 0.00 H new ATOM 0 HD2 HIS A 95 13.905 -1.964 12.883 1.00 0.00 H new ATOM 0 HE1 HIS A 95 16.457 -2.173 16.258 1.00 0.00 H new ATOM 0 HE2 HIS A 95 14.021 -2.403 15.394 1.00 0.00 H new ATOM 1438 N GLY A 96 16.720 0.355 8.860 1.00 0.00 N ATOM 1439 CA GLY A 96 17.457 1.266 7.999 1.00 0.00 C ATOM 1440 C GLY A 96 16.503 2.182 7.229 1.00 0.00 C ATOM 1441 O GLY A 96 16.882 3.283 6.830 1.00 0.00 O ATOM 0 H GLY A 96 16.434 -0.517 8.414 1.00 0.00 H new ATOM 0 HA2 GLY A 96 18.140 1.867 8.599 1.00 0.00 H new ATOM 0 HA3 GLY A 96 18.066 0.697 7.297 1.00 0.00 H new ATOM 1445 N CYS A 97 15.288 1.693 7.040 1.00 0.00 N ATOM 1446 CA CYS A 97 14.277 2.453 6.322 1.00 0.00 C ATOM 1447 C CYS A 97 13.497 3.291 7.337 1.00 0.00 C ATOM 1448 O CYS A 97 13.552 4.520 7.306 1.00 0.00 O ATOM 1449 CB CYS A 97 13.357 1.544 5.506 1.00 0.00 C ATOM 1450 SG CYS A 97 13.970 1.142 3.829 1.00 0.00 S ATOM 0 H CYS A 97 14.979 0.779 7.371 1.00 0.00 H new ATOM 0 HA CYS A 97 14.759 3.112 5.600 1.00 0.00 H new ATOM 0 HB2 CYS A 97 13.207 0.615 6.055 1.00 0.00 H new ATOM 0 HB3 CYS A 97 12.382 2.023 5.416 1.00 0.00 H new ATOM 1455 N GLU A 98 12.789 2.594 8.214 1.00 0.00 N ATOM 1456 CA GLU A 98 11.999 3.257 9.235 1.00 0.00 C ATOM 1457 C GLU A 98 12.812 4.372 9.897 1.00 0.00 C ATOM 1458 O GLU A 98 12.258 5.385 10.318 1.00 0.00 O ATOM 1459 CB GLU A 98 11.494 2.256 10.276 1.00 0.00 C ATOM 1460 CG GLU A 98 10.275 2.804 11.020 1.00 0.00 C ATOM 1461 CD GLU A 98 10.676 3.392 12.374 1.00 0.00 C ATOM 1462 OE1 GLU A 98 11.440 4.381 12.358 1.00 0.00 O ATOM 1463 OE2 GLU A 98 10.209 2.840 13.393 1.00 0.00 O ATOM 0 H GLU A 98 12.747 1.575 8.238 1.00 0.00 H new ATOM 0 HA GLU A 98 11.128 3.704 8.756 1.00 0.00 H new ATOM 0 HB2 GLU A 98 11.234 1.318 9.786 1.00 0.00 H new ATOM 0 HB3 GLU A 98 12.289 2.034 10.988 1.00 0.00 H new ATOM 0 HG2 GLU A 98 9.791 3.571 10.416 1.00 0.00 H new ATOM 0 HG3 GLU A 98 9.546 2.007 11.167 1.00 0.00 H new ATOM 1470 N LYS A 99 14.117 4.147 9.964 1.00 0.00 N ATOM 1471 CA LYS A 99 15.013 5.120 10.566 1.00 0.00 C ATOM 1472 C LYS A 99 15.222 6.284 9.595 1.00 0.00 C ATOM 1473 O LYS A 99 15.437 7.420 10.018 1.00 0.00 O ATOM 1474 CB LYS A 99 16.315 4.447 11.009 1.00 0.00 C ATOM 1475 CG LYS A 99 17.232 4.191 9.812 1.00 0.00 C ATOM 1476 CD LYS A 99 18.679 3.979 10.266 1.00 0.00 C ATOM 1477 CE LYS A 99 19.609 5.017 9.635 1.00 0.00 C ATOM 1478 NZ LYS A 99 21.017 4.569 9.715 1.00 0.00 N ATOM 0 H LYS A 99 14.574 3.306 9.612 1.00 0.00 H new ATOM 0 HA LYS A 99 14.571 5.535 11.472 1.00 0.00 H new ATOM 0 HB2 LYS A 99 16.826 5.078 11.735 1.00 0.00 H new ATOM 0 HB3 LYS A 99 16.090 3.504 11.508 1.00 0.00 H new ATOM 0 HG2 LYS A 99 16.886 3.314 9.265 1.00 0.00 H new ATOM 0 HG3 LYS A 99 17.183 5.035 9.124 1.00 0.00 H new ATOM 0 HD2 LYS A 99 18.737 4.046 11.352 1.00 0.00 H new ATOM 0 HD3 LYS A 99 19.007 2.977 9.991 1.00 0.00 H new ATOM 0 HE2 LYS A 99 19.331 5.177 8.593 1.00 0.00 H new ATOM 0 HE3 LYS A 99 19.496 5.973 10.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 21.634 5.285 9.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 21.284 4.439 10.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 21.124 3.668 9.207 1.00 0.00 H new ATOM 1492 N SER A 100 15.152 5.962 8.312 1.00 0.00 N ATOM 1493 CA SER A 100 15.331 6.967 7.277 1.00 0.00 C ATOM 1494 C SER A 100 13.971 7.516 6.841 1.00 0.00 C ATOM 1495 O SER A 100 13.901 8.494 6.098 1.00 0.00 O ATOM 1496 CB SER A 100 16.083 6.392 6.075 1.00 0.00 C ATOM 1497 OG SER A 100 17.260 7.136 5.777 1.00 0.00 O ATOM 0 H SER A 100 14.974 5.020 7.965 1.00 0.00 H new ATOM 0 HA SER A 100 15.929 7.780 7.689 1.00 0.00 H new ATOM 0 HB2 SER A 100 16.351 5.355 6.277 1.00 0.00 H new ATOM 0 HB3 SER A 100 15.427 6.388 5.205 1.00 0.00 H new ATOM 0 HG SER A 100 17.713 6.737 5.005 1.00 0.00 H new ATOM 1503 N ALA A 101 12.922 6.862 7.319 1.00 0.00 N ATOM 1504 CA ALA A 101 11.569 7.272 6.988 1.00 0.00 C ATOM 1505 C ALA A 101 10.834 7.675 8.269 1.00 0.00 C ATOM 1506 O ALA A 101 10.052 6.895 8.809 1.00 0.00 O ATOM 1507 CB ALA A 101 10.861 6.140 6.240 1.00 0.00 C ATOM 0 H ALA A 101 12.983 6.050 7.934 1.00 0.00 H new ATOM 0 HA ALA A 101 11.581 8.140 6.329 1.00 0.00 H new ATOM 0 HB1 ALA A 101 9.845 6.448 5.991 1.00 0.00 H new ATOM 0 HB2 ALA A 101 11.406 5.913 5.324 1.00 0.00 H new ATOM 0 HB3 ALA A 101 10.827 5.252 6.871 1.00 0.00 H new ATOM 1513 N PRO A 102 11.121 8.923 8.727 1.00 0.00 N ATOM 1514 CA PRO A 102 10.496 9.438 9.932 1.00 0.00 C ATOM 1515 C PRO A 102 9.040 9.830 9.672 1.00 0.00 C ATOM 1516 O PRO A 102 8.582 9.806 8.531 1.00 0.00 O ATOM 1517 CB PRO A 102 11.362 10.615 10.351 1.00 0.00 C ATOM 1518 CG PRO A 102 12.164 11.003 9.120 1.00 0.00 C ATOM 1519 CD PRO A 102 12.043 9.873 8.110 1.00 0.00 C ATOM 0 HA PRO A 102 10.443 8.695 10.728 1.00 0.00 H new ATOM 0 HB2 PRO A 102 10.749 11.448 10.696 1.00 0.00 H new ATOM 0 HB3 PRO A 102 12.020 10.341 11.175 1.00 0.00 H new ATOM 0 HG2 PRO A 102 11.788 11.935 8.697 1.00 0.00 H new ATOM 0 HG3 PRO A 102 13.209 11.171 9.382 1.00 0.00 H new ATOM 0 HD2 PRO A 102 11.660 10.234 7.156 1.00 0.00 H new ATOM 0 HD3 PRO A 102 13.011 9.414 7.912 1.00 0.00 H new ATOM 1527 N PRO A 103 8.336 10.192 10.778 1.00 0.00 N ATOM 1528 CA PRO A 103 6.941 10.589 10.679 1.00 0.00 C ATOM 1529 C PRO A 103 6.812 11.997 10.093 1.00 0.00 C ATOM 1530 O PRO A 103 6.019 12.804 10.576 1.00 0.00 O ATOM 1531 CB PRO A 103 6.403 10.484 12.095 1.00 0.00 C ATOM 1532 CG PRO A 103 7.619 10.482 13.007 1.00 0.00 C ATOM 1533 CD PRO A 103 8.846 10.234 12.145 1.00 0.00 C ATOM 0 HA PRO A 103 6.369 9.955 10.001 1.00 0.00 H new ATOM 0 HB2 PRO A 103 5.744 11.321 12.325 1.00 0.00 H new ATOM 0 HB3 PRO A 103 5.818 9.573 12.223 1.00 0.00 H new ATOM 0 HG2 PRO A 103 7.706 11.434 13.530 1.00 0.00 H new ATOM 0 HG3 PRO A 103 7.524 9.708 13.768 1.00 0.00 H new ATOM 0 HD2 PRO A 103 9.583 11.027 12.268 1.00 0.00 H new ATOM 0 HD3 PRO A 103 9.336 9.298 12.414 1.00 0.00 H new ATOM 1541 N ASN A 104 7.603 12.249 9.061 1.00 0.00 N ATOM 1542 CA ASN A 104 7.587 13.545 8.404 1.00 0.00 C ATOM 1543 C ASN A 104 6.195 13.799 7.821 1.00 0.00 C ATOM 1544 O ASN A 104 5.491 12.859 7.457 1.00 0.00 O ATOM 1545 CB ASN A 104 8.596 13.593 7.255 1.00 0.00 C ATOM 1546 CG ASN A 104 9.078 15.024 7.008 1.00 0.00 C ATOM 1547 OD1 ASN A 104 8.476 15.791 6.275 1.00 0.00 O ATOM 1548 ND2 ASN A 104 10.193 15.339 7.661 1.00 0.00 N ATOM 0 H ASN A 104 8.260 11.577 8.663 1.00 0.00 H new ATOM 0 HA ASN A 104 7.847 14.301 9.144 1.00 0.00 H new ATOM 0 HB2 ASN A 104 9.448 12.954 7.487 1.00 0.00 H new ATOM 0 HB3 ASN A 104 8.139 13.198 6.348 1.00 0.00 H new ATOM 0 HD21 ASN A 104 10.595 16.271 7.564 1.00 0.00 H new ATOM 0 HD22 ASN A 104 10.646 14.648 8.259 1.00 0.00 H new ATOM 1555 N ASP A 105 5.841 15.073 7.752 1.00 0.00 N ATOM 1556 CA ASP A 105 4.546 15.463 7.218 1.00 0.00 C ATOM 1557 C ASP A 105 4.317 14.758 5.880 1.00 0.00 C ATOM 1558 O ASP A 105 3.178 14.486 5.504 1.00 0.00 O ATOM 1559 CB ASP A 105 4.482 16.971 6.975 1.00 0.00 C ATOM 1560 CG ASP A 105 4.832 17.838 8.188 1.00 0.00 C ATOM 1561 OD1 ASP A 105 6.029 17.858 8.544 1.00 0.00 O ATOM 1562 OD2 ASP A 105 3.893 18.460 8.729 1.00 0.00 O ATOM 0 H ASP A 105 6.428 15.850 8.057 1.00 0.00 H new ATOM 0 HA ASP A 105 3.784 15.182 7.945 1.00 0.00 H new ATOM 0 HB2 ASP A 105 5.161 17.222 6.160 1.00 0.00 H new ATOM 0 HB3 ASP A 105 3.476 17.228 6.642 1.00 0.00 H new ATOM 1567 N ASP A 106 5.418 14.481 5.198 1.00 0.00 N ATOM 1568 CA ASP A 106 5.352 13.812 3.908 1.00 0.00 C ATOM 1569 C ASP A 106 5.281 12.299 4.127 1.00 0.00 C ATOM 1570 O ASP A 106 5.719 11.525 3.278 1.00 0.00 O ATOM 1571 CB ASP A 106 6.596 14.111 3.069 1.00 0.00 C ATOM 1572 CG ASP A 106 6.488 15.346 2.172 1.00 0.00 C ATOM 1573 OD1 ASP A 106 5.353 15.633 1.736 1.00 0.00 O ATOM 1574 OD2 ASP A 106 7.544 15.973 1.943 1.00 0.00 O ATOM 0 H ASP A 106 6.361 14.707 5.513 1.00 0.00 H new ATOM 0 HA ASP A 106 4.468 14.175 3.384 1.00 0.00 H new ATOM 0 HB2 ASP A 106 7.446 14.240 3.739 1.00 0.00 H new ATOM 0 HB3 ASP A 106 6.812 13.244 2.444 1.00 0.00 H new ATOM 1579 N LYS A 107 4.725 11.924 5.270 1.00 0.00 N ATOM 1580 CA LYS A 107 4.589 10.519 5.611 1.00 0.00 C ATOM 1581 C LYS A 107 4.179 9.733 4.363 1.00 0.00 C ATOM 1582 O LYS A 107 4.513 8.557 4.228 1.00 0.00 O ATOM 1583 CB LYS A 107 3.631 10.342 6.791 1.00 0.00 C ATOM 1584 CG LYS A 107 2.263 10.955 6.482 1.00 0.00 C ATOM 1585 CD LYS A 107 1.276 10.691 7.620 1.00 0.00 C ATOM 1586 CE LYS A 107 0.035 11.577 7.487 1.00 0.00 C ATOM 1587 NZ LYS A 107 0.398 13.003 7.643 1.00 0.00 N ATOM 0 H LYS A 107 4.363 12.570 5.972 1.00 0.00 H new ATOM 0 HA LYS A 107 5.545 10.115 5.944 1.00 0.00 H new ATOM 0 HB2 LYS A 107 3.516 9.282 7.015 1.00 0.00 H new ATOM 0 HB3 LYS A 107 4.052 10.812 7.680 1.00 0.00 H new ATOM 0 HG2 LYS A 107 2.368 12.029 6.328 1.00 0.00 H new ATOM 0 HG3 LYS A 107 1.874 10.537 5.554 1.00 0.00 H new ATOM 0 HD2 LYS A 107 0.980 9.642 7.614 1.00 0.00 H new ATOM 0 HD3 LYS A 107 1.761 10.880 8.578 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -0.430 11.418 6.514 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -0.701 11.298 8.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -0.436 13.541 7.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 1.153 13.093 8.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 0.732 13.378 6.732 1.00 0.00 H new ATOM 1601 N CYS A 108 3.461 10.415 3.482 1.00 0.00 N ATOM 1602 CA CYS A 108 3.003 9.796 2.251 1.00 0.00 C ATOM 1603 C CYS A 108 4.207 9.158 1.556 1.00 0.00 C ATOM 1604 O CYS A 108 4.148 8.003 1.140 1.00 0.00 O ATOM 1605 CB CYS A 108 2.286 10.800 1.345 1.00 0.00 C ATOM 1606 SG CYS A 108 0.975 10.084 0.290 1.00 0.00 S ATOM 0 H CYS A 108 3.186 11.390 3.597 1.00 0.00 H new ATOM 0 HA CYS A 108 2.268 9.025 2.481 1.00 0.00 H new ATOM 0 HB2 CYS A 108 1.846 11.580 1.967 1.00 0.00 H new ATOM 0 HB3 CYS A 108 3.025 11.282 0.705 1.00 0.00 H new ATOM 1611 N MET A 109 5.272 9.939 1.453 1.00 0.00 N ATOM 1612 CA MET A 109 6.488 9.465 0.816 1.00 0.00 C ATOM 1613 C MET A 109 7.549 9.103 1.858 1.00 0.00 C ATOM 1614 O MET A 109 8.622 8.611 1.513 1.00 0.00 O ATOM 1615 CB MET A 109 7.036 10.552 -0.113 1.00 0.00 C ATOM 1616 CG MET A 109 7.711 9.935 -1.340 1.00 0.00 C ATOM 1617 SD MET A 109 8.248 11.224 -2.452 1.00 0.00 S ATOM 1618 CE MET A 109 10.009 10.936 -2.431 1.00 0.00 C ATOM 0 H MET A 109 5.318 10.897 1.800 1.00 0.00 H new ATOM 0 HA MET A 109 6.249 8.570 0.242 1.00 0.00 H new ATOM 0 HB2 MET A 109 6.225 11.207 -0.431 1.00 0.00 H new ATOM 0 HB3 MET A 109 7.752 11.171 0.428 1.00 0.00 H new ATOM 0 HG2 MET A 109 8.564 9.331 -1.031 1.00 0.00 H new ATOM 0 HG3 MET A 109 7.016 9.268 -1.851 1.00 0.00 H new ATOM 0 HE1 MET A 109 10.504 11.660 -3.079 1.00 0.00 H new ATOM 0 HE2 MET A 109 10.383 11.045 -1.413 1.00 0.00 H new ATOM 0 HE3 MET A 109 10.217 9.927 -2.788 1.00 0.00 H new ATOM 1628 N LYS A 110 7.211 9.359 3.113 1.00 0.00 N ATOM 1629 CA LYS A 110 8.118 9.066 4.209 1.00 0.00 C ATOM 1630 C LYS A 110 7.877 7.637 4.697 1.00 0.00 C ATOM 1631 O LYS A 110 8.621 6.723 4.344 1.00 0.00 O ATOM 1632 CB LYS A 110 7.990 10.122 5.308 1.00 0.00 C ATOM 1633 CG LYS A 110 9.367 10.611 5.762 1.00 0.00 C ATOM 1634 CD LYS A 110 9.875 11.738 4.859 1.00 0.00 C ATOM 1635 CE LYS A 110 10.680 11.177 3.686 1.00 0.00 C ATOM 1636 NZ LYS A 110 9.893 11.249 2.434 1.00 0.00 N ATOM 0 H LYS A 110 6.320 9.767 3.395 1.00 0.00 H new ATOM 0 HA LYS A 110 9.153 9.117 3.871 1.00 0.00 H new ATOM 0 HB2 LYS A 110 7.404 10.965 4.941 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.450 9.704 6.158 1.00 0.00 H new ATOM 0 HG2 LYS A 110 9.310 10.963 6.792 1.00 0.00 H new ATOM 0 HG3 LYS A 110 10.074 9.782 5.747 1.00 0.00 H new ATOM 0 HD2 LYS A 110 9.031 12.316 4.483 1.00 0.00 H new ATOM 0 HD3 LYS A 110 10.496 12.421 5.438 1.00 0.00 H new ATOM 0 HE2 LYS A 110 11.607 11.739 3.572 1.00 0.00 H new ATOM 0 HE3 LYS A 110 10.957 10.143 3.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 9.867 10.311 1.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 8.923 11.556 2.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 10.335 11.931 1.785 1.00 0.00 H new ATOM 1650 N THR A 111 6.835 7.488 5.502 1.00 0.00 N ATOM 1651 CA THR A 111 6.487 6.186 6.043 1.00 0.00 C ATOM 1652 C THR A 111 6.473 5.133 4.932 1.00 0.00 C ATOM 1653 O THR A 111 6.996 4.034 5.106 1.00 0.00 O ATOM 1654 CB THR A 111 5.147 6.318 6.770 1.00 0.00 C ATOM 1655 OG1 THR A 111 5.283 7.515 7.532 1.00 0.00 O ATOM 1656 CG2 THR A 111 4.942 5.227 7.822 1.00 0.00 C ATOM 0 H THR A 111 6.220 8.248 5.792 1.00 0.00 H new ATOM 0 HA THR A 111 7.232 5.846 6.762 1.00 0.00 H new ATOM 0 HB THR A 111 4.334 6.279 6.045 1.00 0.00 H new ATOM 0 HG1 THR A 111 4.529 7.595 8.152 1.00 0.00 H new ATOM 0 HG21 THR A 111 3.976 5.367 8.308 1.00 0.00 H new ATOM 0 HG22 THR A 111 4.968 4.249 7.342 1.00 0.00 H new ATOM 0 HG23 THR A 111 5.735 5.287 8.567 1.00 0.00 H new ATOM 1664 N ILE A 112 5.870 5.509 3.813 1.00 0.00 N ATOM 1665 CA ILE A 112 5.781 4.610 2.674 1.00 0.00 C ATOM 1666 C ILE A 112 7.153 3.984 2.416 1.00 0.00 C ATOM 1667 O ILE A 112 7.263 2.771 2.238 1.00 0.00 O ATOM 1668 CB ILE A 112 5.201 5.339 1.460 1.00 0.00 C ATOM 1669 CG1 ILE A 112 4.611 4.349 0.455 1.00 0.00 C ATOM 1670 CG2 ILE A 112 6.246 6.254 0.818 1.00 0.00 C ATOM 1671 CD1 ILE A 112 5.693 3.418 -0.096 1.00 0.00 C ATOM 0 H ILE A 112 5.439 6.422 3.671 1.00 0.00 H new ATOM 0 HA ILE A 112 5.091 3.793 2.887 1.00 0.00 H new ATOM 0 HB ILE A 112 4.384 5.974 1.802 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.829 3.760 0.935 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.142 4.893 -0.365 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.807 6.760 -0.042 1.00 0.00 H new ATOM 0 HG22 ILE A 112 6.576 6.996 1.545 1.00 0.00 H new ATOM 0 HG23 ILE A 112 7.100 5.659 0.493 1.00 0.00 H new ATOM 0 HD11 ILE A 112 5.247 2.724 -0.808 1.00 0.00 H new ATOM 0 HD12 ILE A 112 6.461 4.008 -0.596 1.00 0.00 H new ATOM 0 HD13 ILE A 112 6.143 2.858 0.724 1.00 0.00 H new ATOM 1683 N ASP A 113 8.166 4.838 2.403 1.00 0.00 N ATOM 1684 CA ASP A 113 9.526 4.383 2.170 1.00 0.00 C ATOM 1685 C ASP A 113 9.750 3.061 2.905 1.00 0.00 C ATOM 1686 O ASP A 113 10.109 2.057 2.291 1.00 0.00 O ATOM 1687 CB ASP A 113 10.543 5.396 2.699 1.00 0.00 C ATOM 1688 CG ASP A 113 11.799 5.558 1.841 1.00 0.00 C ATOM 1689 OD1 ASP A 113 12.495 4.536 1.652 1.00 0.00 O ATOM 1690 OD2 ASP A 113 12.037 6.701 1.393 1.00 0.00 O ATOM 0 H ASP A 113 8.072 5.843 2.550 1.00 0.00 H new ATOM 0 HA ASP A 113 9.662 4.262 1.095 1.00 0.00 H new ATOM 0 HB2 ASP A 113 10.054 6.366 2.788 1.00 0.00 H new ATOM 0 HB3 ASP A 113 10.843 5.097 3.703 1.00 0.00 H new ATOM 1695 N VAL A 114 9.528 3.101 4.211 1.00 0.00 N ATOM 1696 CA VAL A 114 9.701 1.919 5.037 1.00 0.00 C ATOM 1697 C VAL A 114 8.503 0.987 4.844 1.00 0.00 C ATOM 1698 O VAL A 114 8.673 -0.211 4.619 1.00 0.00 O ATOM 1699 CB VAL A 114 9.912 2.325 6.497 1.00 0.00 C ATOM 1700 CG1 VAL A 114 8.938 3.432 6.904 1.00 0.00 C ATOM 1701 CG2 VAL A 114 9.788 1.116 7.426 1.00 0.00 C ATOM 0 H VAL A 114 9.230 3.935 4.717 1.00 0.00 H new ATOM 0 HA VAL A 114 10.593 1.370 4.734 1.00 0.00 H new ATOM 0 HB VAL A 114 10.924 2.718 6.593 1.00 0.00 H new ATOM 0 HG11 VAL A 114 9.109 3.702 7.946 1.00 0.00 H new ATOM 0 HG12 VAL A 114 9.096 4.306 6.272 1.00 0.00 H new ATOM 0 HG13 VAL A 114 7.914 3.078 6.784 1.00 0.00 H new ATOM 0 HG21 VAL A 114 9.942 1.432 8.458 1.00 0.00 H new ATOM 0 HG22 VAL A 114 8.794 0.680 7.325 1.00 0.00 H new ATOM 0 HG23 VAL A 114 10.539 0.373 7.158 1.00 0.00 H new ATOM 1711 N ALA A 115 7.317 1.572 4.938 1.00 0.00 N ATOM 1712 CA ALA A 115 6.092 0.809 4.776 1.00 0.00 C ATOM 1713 C ALA A 115 6.221 -0.103 3.555 1.00 0.00 C ATOM 1714 O ALA A 115 5.567 -1.142 3.479 1.00 0.00 O ATOM 1715 CB ALA A 115 4.905 1.768 4.666 1.00 0.00 C ATOM 0 H ALA A 115 7.179 2.565 5.124 1.00 0.00 H new ATOM 0 HA ALA A 115 5.918 0.173 5.644 1.00 0.00 H new ATOM 0 HB1 ALA A 115 3.985 1.196 4.544 1.00 0.00 H new ATOM 0 HB2 ALA A 115 4.840 2.372 5.571 1.00 0.00 H new ATOM 0 HB3 ALA A 115 5.043 2.421 3.804 1.00 0.00 H new ATOM 1721 N MET A 116 7.066 0.321 2.626 1.00 0.00 N ATOM 1722 CA MET A 116 7.289 -0.444 1.412 1.00 0.00 C ATOM 1723 C MET A 116 8.618 -1.200 1.476 1.00 0.00 C ATOM 1724 O MET A 116 8.747 -2.286 0.911 1.00 0.00 O ATOM 1725 CB MET A 116 7.296 0.500 0.208 1.00 0.00 C ATOM 1726 CG MET A 116 5.953 0.466 -0.524 1.00 0.00 C ATOM 1727 SD MET A 116 5.644 -1.173 -1.157 1.00 0.00 S ATOM 1728 CE MET A 116 3.936 -0.999 -1.647 1.00 0.00 C ATOM 0 H MET A 116 7.604 1.185 2.690 1.00 0.00 H new ATOM 0 HA MET A 116 6.484 -1.171 1.310 1.00 0.00 H new ATOM 0 HB2 MET A 116 7.508 1.516 0.540 1.00 0.00 H new ATOM 0 HB3 MET A 116 8.095 0.215 -0.477 1.00 0.00 H new ATOM 0 HG2 MET A 116 5.152 0.760 0.155 1.00 0.00 H new ATOM 0 HG3 MET A 116 5.957 1.186 -1.342 1.00 0.00 H new ATOM 0 HE1 MET A 116 3.580 -1.940 -2.067 1.00 0.00 H new ATOM 0 HE2 MET A 116 3.333 -0.739 -0.777 1.00 0.00 H new ATOM 0 HE3 MET A 116 3.851 -0.212 -2.396 1.00 0.00 H new ATOM 1738 N CYS A 117 9.572 -0.597 2.168 1.00 0.00 N ATOM 1739 CA CYS A 117 10.886 -1.200 2.314 1.00 0.00 C ATOM 1740 C CYS A 117 10.702 -2.695 2.585 1.00 0.00 C ATOM 1741 O CYS A 117 11.248 -3.530 1.867 1.00 0.00 O ATOM 1742 CB CYS A 117 11.704 -0.518 3.412 1.00 0.00 C ATOM 1743 SG CYS A 117 13.501 -0.857 3.354 1.00 0.00 S ATOM 0 H CYS A 117 9.462 0.303 2.634 1.00 0.00 H new ATOM 0 HA CYS A 117 11.454 -1.066 1.393 1.00 0.00 H new ATOM 0 HB2 CYS A 117 11.549 0.559 3.345 1.00 0.00 H new ATOM 0 HB3 CYS A 117 11.320 -0.835 4.382 1.00 0.00 H new ATOM 1748 N PHE A 118 9.930 -2.985 3.621 1.00 0.00 N ATOM 1749 CA PHE A 118 9.666 -4.364 3.996 1.00 0.00 C ATOM 1750 C PHE A 118 8.848 -5.078 2.919 1.00 0.00 C ATOM 1751 O PHE A 118 9.030 -6.271 2.684 1.00 0.00 O ATOM 1752 CB PHE A 118 8.859 -4.327 5.295 1.00 0.00 C ATOM 1753 CG PHE A 118 7.882 -5.494 5.452 1.00 0.00 C ATOM 1754 CD1 PHE A 118 8.270 -6.756 5.120 1.00 0.00 C ATOM 1755 CD2 PHE A 118 6.625 -5.271 5.923 1.00 0.00 C ATOM 1756 CE1 PHE A 118 7.362 -7.839 5.266 1.00 0.00 C ATOM 1757 CE2 PHE A 118 5.719 -6.355 6.069 1.00 0.00 C ATOM 1758 CZ PHE A 118 6.107 -7.615 5.737 1.00 0.00 C ATOM 0 H PHE A 118 9.478 -2.288 4.213 1.00 0.00 H new ATOM 0 HA PHE A 118 10.605 -4.904 4.117 1.00 0.00 H new ATOM 0 HB2 PHE A 118 9.548 -4.327 6.139 1.00 0.00 H new ATOM 0 HB3 PHE A 118 8.302 -3.391 5.338 1.00 0.00 H new ATOM 0 HD1 PHE A 118 9.267 -6.934 4.746 1.00 0.00 H new ATOM 0 HD2 PHE A 118 6.316 -4.270 6.186 1.00 0.00 H new ATOM 0 HE1 PHE A 118 7.669 -8.840 5.003 1.00 0.00 H new ATOM 0 HE2 PHE A 118 4.722 -6.178 6.444 1.00 0.00 H new ATOM 0 HZ PHE A 118 5.417 -8.439 5.848 1.00 0.00 H new ATOM 1768 N LYS A 119 7.963 -4.317 2.292 1.00 0.00 N ATOM 1769 CA LYS A 119 7.114 -4.861 1.245 1.00 0.00 C ATOM 1770 C LYS A 119 7.993 -5.461 0.146 1.00 0.00 C ATOM 1771 O LYS A 119 7.592 -6.415 -0.522 1.00 0.00 O ATOM 1772 CB LYS A 119 6.138 -3.797 0.740 1.00 0.00 C ATOM 1773 CG LYS A 119 5.095 -3.460 1.808 1.00 0.00 C ATOM 1774 CD LYS A 119 3.969 -4.496 1.822 1.00 0.00 C ATOM 1775 CE LYS A 119 3.407 -4.676 3.235 1.00 0.00 C ATOM 1776 NZ LYS A 119 1.961 -4.364 3.261 1.00 0.00 N ATOM 0 H LYS A 119 7.815 -3.327 2.489 1.00 0.00 H new ATOM 0 HA LYS A 119 6.494 -5.668 1.636 1.00 0.00 H new ATOM 0 HB2 LYS A 119 6.687 -2.896 0.465 1.00 0.00 H new ATOM 0 HB3 LYS A 119 5.639 -4.154 -0.161 1.00 0.00 H new ATOM 0 HG2 LYS A 119 5.572 -3.423 2.788 1.00 0.00 H new ATOM 0 HG3 LYS A 119 4.681 -2.470 1.617 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.173 -4.182 1.147 1.00 0.00 H new ATOM 0 HD3 LYS A 119 4.343 -5.450 1.451 1.00 0.00 H new ATOM 0 HE2 LYS A 119 3.570 -5.700 3.570 1.00 0.00 H new ATOM 0 HE3 LYS A 119 3.938 -4.025 3.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 1.596 -4.491 4.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 1.813 -3.379 2.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 1.456 -5.002 2.613 1.00 0.00 H new ATOM 1790 N LYS A 120 9.171 -4.880 -0.009 1.00 0.00 N ATOM 1791 CA LYS A 120 10.110 -5.347 -1.018 1.00 0.00 C ATOM 1792 C LYS A 120 10.613 -6.739 -0.634 1.00 0.00 C ATOM 1793 O LYS A 120 10.892 -7.563 -1.503 1.00 0.00 O ATOM 1794 CB LYS A 120 11.228 -4.322 -1.224 1.00 0.00 C ATOM 1795 CG LYS A 120 10.687 -3.037 -1.853 1.00 0.00 C ATOM 1796 CD LYS A 120 11.811 -2.229 -2.504 1.00 0.00 C ATOM 1797 CE LYS A 120 12.531 -1.360 -1.472 1.00 0.00 C ATOM 1798 NZ LYS A 120 13.953 -1.748 -1.368 1.00 0.00 N ATOM 0 H LYS A 120 9.499 -4.090 0.546 1.00 0.00 H new ATOM 0 HA LYS A 120 9.616 -5.443 -1.985 1.00 0.00 H new ATOM 0 HB2 LYS A 120 11.697 -4.093 -0.267 1.00 0.00 H new ATOM 0 HB3 LYS A 120 12.001 -4.746 -1.864 1.00 0.00 H new ATOM 0 HG2 LYS A 120 9.932 -3.283 -2.600 1.00 0.00 H new ATOM 0 HG3 LYS A 120 10.196 -2.433 -1.090 1.00 0.00 H new ATOM 0 HD2 LYS A 120 12.524 -2.906 -2.976 1.00 0.00 H new ATOM 0 HD3 LYS A 120 11.400 -1.598 -3.293 1.00 0.00 H new ATOM 0 HE2 LYS A 120 12.455 -0.310 -1.755 1.00 0.00 H new ATOM 0 HE3 LYS A 120 12.048 -1.464 -0.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 14.426 -1.148 -0.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 14.021 -2.744 -1.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 14.415 -1.626 -2.292 1.00 0.00 H new ATOM 1812 N GLU A 121 10.716 -6.957 0.670 1.00 0.00 N ATOM 1813 CA GLU A 121 11.182 -8.236 1.178 1.00 0.00 C ATOM 1814 C GLU A 121 10.266 -9.364 0.697 1.00 0.00 C ATOM 1815 O GLU A 121 10.709 -10.500 0.535 1.00 0.00 O ATOM 1816 CB GLU A 121 11.273 -8.218 2.706 1.00 0.00 C ATOM 1817 CG GLU A 121 12.160 -7.069 3.188 1.00 0.00 C ATOM 1818 CD GLU A 121 13.624 -7.314 2.818 1.00 0.00 C ATOM 1819 OE1 GLU A 121 14.231 -8.201 3.457 1.00 0.00 O ATOM 1820 OE2 GLU A 121 14.103 -6.610 1.903 1.00 0.00 O ATOM 0 H GLU A 121 10.485 -6.270 1.388 1.00 0.00 H new ATOM 0 HA GLU A 121 12.184 -8.417 0.788 1.00 0.00 H new ATOM 0 HB2 GLU A 121 10.275 -8.115 3.132 1.00 0.00 H new ATOM 0 HB3 GLU A 121 11.675 -9.167 3.061 1.00 0.00 H new ATOM 0 HG2 GLU A 121 11.821 -6.133 2.745 1.00 0.00 H new ATOM 0 HG3 GLU A 121 12.067 -6.962 4.269 1.00 0.00 H new ATOM 1827 N ILE A 122 9.007 -9.011 0.485 1.00 0.00 N ATOM 1828 CA ILE A 122 8.027 -9.980 0.025 1.00 0.00 C ATOM 1829 C ILE A 122 8.423 -10.481 -1.364 1.00 0.00 C ATOM 1830 O ILE A 122 8.281 -11.667 -1.664 1.00 0.00 O ATOM 1831 CB ILE A 122 6.618 -9.385 0.087 1.00 0.00 C ATOM 1832 CG1 ILE A 122 6.436 -8.532 1.342 1.00 0.00 C ATOM 1833 CG2 ILE A 122 5.555 -10.481 -0.021 1.00 0.00 C ATOM 1834 CD1 ILE A 122 7.061 -9.212 2.562 1.00 0.00 C ATOM 0 H ILE A 122 8.643 -8.068 0.623 1.00 0.00 H new ATOM 0 HA ILE A 122 8.011 -10.849 0.683 1.00 0.00 H new ATOM 0 HB ILE A 122 6.489 -8.725 -0.771 1.00 0.00 H new ATOM 0 HG12 ILE A 122 6.894 -7.555 1.191 1.00 0.00 H new ATOM 0 HG13 ILE A 122 5.374 -8.362 1.520 1.00 0.00 H new ATOM 0 HG21 ILE A 122 4.563 -10.032 0.026 1.00 0.00 H new ATOM 0 HG22 ILE A 122 5.670 -11.008 -0.968 1.00 0.00 H new ATOM 0 HG23 ILE A 122 5.673 -11.185 0.803 1.00 0.00 H new ATOM 0 HD11 ILE A 122 6.918 -8.584 3.442 1.00 0.00 H new ATOM 0 HD12 ILE A 122 6.584 -10.178 2.724 1.00 0.00 H new ATOM 0 HD13 ILE A 122 8.127 -9.358 2.391 1.00 0.00 H new ATOM 1846 N HIS A 123 8.911 -9.556 -2.176 1.00 0.00 N ATOM 1847 CA HIS A 123 9.330 -9.889 -3.527 1.00 0.00 C ATOM 1848 C HIS A 123 10.244 -11.114 -3.493 1.00 0.00 C ATOM 1849 O HIS A 123 10.417 -11.793 -4.505 1.00 0.00 O ATOM 1850 CB HIS A 123 9.980 -8.682 -4.208 1.00 0.00 C ATOM 1851 CG HIS A 123 9.980 -8.756 -5.716 1.00 0.00 C ATOM 1852 ND1 HIS A 123 8.864 -9.119 -6.450 1.00 0.00 N ATOM 1853 CD2 HIS A 123 10.972 -8.508 -6.619 1.00 0.00 C ATOM 1854 CE1 HIS A 123 9.181 -9.089 -7.736 1.00 0.00 C ATOM 1855 NE2 HIS A 123 10.488 -8.711 -7.839 1.00 0.00 N ATOM 0 H HIS A 123 9.026 -8.574 -1.924 1.00 0.00 H new ATOM 0 HA HIS A 123 8.458 -10.146 -4.129 1.00 0.00 H new ATOM 0 HB2 HIS A 123 9.457 -7.777 -3.899 1.00 0.00 H new ATOM 0 HB3 HIS A 123 11.008 -8.591 -3.859 1.00 0.00 H new ATOM 0 HD2 HIS A 123 11.979 -8.199 -6.382 1.00 0.00 H new ATOM 0 HE1 HIS A 123 8.521 -9.323 -8.558 1.00 0.00 H new ATOM 0 HE2 HIS A 123 11.008 -8.602 -8.710 1.00 0.00 H new ATOM 1864 N LYS A 124 10.806 -11.362 -2.319 1.00 0.00 N ATOM 1865 CA LYS A 124 11.699 -12.494 -2.140 1.00 0.00 C ATOM 1866 C LYS A 124 10.921 -13.659 -1.526 1.00 0.00 C ATOM 1867 O LYS A 124 11.498 -14.505 -0.843 1.00 0.00 O ATOM 1868 CB LYS A 124 12.931 -12.082 -1.331 1.00 0.00 C ATOM 1869 CG LYS A 124 13.418 -10.691 -1.743 1.00 0.00 C ATOM 1870 CD LYS A 124 14.924 -10.546 -1.511 1.00 0.00 C ATOM 1871 CE LYS A 124 15.312 -9.078 -1.336 1.00 0.00 C ATOM 1872 NZ LYS A 124 16.255 -8.661 -2.396 1.00 0.00 N ATOM 0 H LYS A 124 10.660 -10.798 -1.482 1.00 0.00 H new ATOM 0 HA LYS A 124 12.079 -12.836 -3.103 1.00 0.00 H new ATOM 0 HB2 LYS A 124 12.691 -12.087 -0.268 1.00 0.00 H new ATOM 0 HB3 LYS A 124 13.729 -12.810 -1.481 1.00 0.00 H new ATOM 0 HG2 LYS A 124 13.190 -10.519 -2.795 1.00 0.00 H new ATOM 0 HG3 LYS A 124 12.884 -9.931 -1.173 1.00 0.00 H new ATOM 0 HD2 LYS A 124 15.215 -11.111 -0.626 1.00 0.00 H new ATOM 0 HD3 LYS A 124 15.468 -10.972 -2.354 1.00 0.00 H new ATOM 0 HE2 LYS A 124 14.419 -8.453 -1.369 1.00 0.00 H new ATOM 0 HE3 LYS A 124 15.768 -8.931 -0.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 16.508 -7.661 -2.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 17.114 -9.245 -2.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 15.807 -8.783 -3.327 1.00 0.00 H new ATOM 1886 N LEU A 125 9.622 -13.666 -1.790 1.00 0.00 N ATOM 1887 CA LEU A 125 8.760 -14.714 -1.272 1.00 0.00 C ATOM 1888 C LEU A 125 9.454 -16.068 -1.434 1.00 0.00 C ATOM 1889 O LEU A 125 10.307 -16.433 -0.626 1.00 0.00 O ATOM 1890 CB LEU A 125 7.380 -14.648 -1.931 1.00 0.00 C ATOM 1891 CG LEU A 125 7.326 -13.979 -3.306 1.00 0.00 C ATOM 1892 CD1 LEU A 125 8.464 -14.472 -4.202 1.00 0.00 C ATOM 1893 CD2 LEU A 125 5.956 -14.177 -3.958 1.00 0.00 C ATOM 0 H LEU A 125 9.147 -12.963 -2.356 1.00 0.00 H new ATOM 0 HA LEU A 125 8.586 -14.570 -0.206 1.00 0.00 H new ATOM 0 HB2 LEU A 125 6.996 -15.664 -2.027 1.00 0.00 H new ATOM 0 HB3 LEU A 125 6.705 -14.114 -1.262 1.00 0.00 H new ATOM 0 HG LEU A 125 7.466 -12.907 -3.170 1.00 0.00 H new ATOM 0 HD11 LEU A 125 8.402 -13.980 -5.173 1.00 0.00 H new ATOM 0 HD12 LEU A 125 9.421 -14.237 -3.737 1.00 0.00 H new ATOM 0 HD13 LEU A 125 8.381 -15.551 -4.335 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.944 -13.692 -4.934 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.762 -15.243 -4.080 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.185 -13.738 -3.325 1.00 0.00 H new ATOM 1905 N ASN A 126 9.063 -16.775 -2.485 1.00 0.00 N ATOM 1906 CA ASN A 126 9.637 -18.081 -2.764 1.00 0.00 C ATOM 1907 C ASN A 126 10.734 -17.935 -3.822 1.00 0.00 C ATOM 1908 O ASN A 126 11.705 -18.692 -3.821 1.00 0.00 O ATOM 1909 CB ASN A 126 8.579 -19.042 -3.309 1.00 0.00 C ATOM 1910 CG ASN A 126 9.231 -20.282 -3.924 1.00 0.00 C ATOM 1911 OD1 ASN A 126 9.836 -21.097 -3.249 1.00 0.00 O ATOM 1912 ND2 ASN A 126 9.074 -20.378 -5.242 1.00 0.00 N ATOM 0 H ASN A 126 8.356 -16.468 -3.153 1.00 0.00 H new ATOM 0 HA ASN A 126 10.040 -18.479 -1.833 1.00 0.00 H new ATOM 0 HB2 ASN A 126 7.906 -19.341 -2.506 1.00 0.00 H new ATOM 0 HB3 ASN A 126 7.974 -18.534 -4.060 1.00 0.00 H new ATOM 0 HD21 ASN A 126 9.472 -21.170 -5.747 1.00 0.00 H new ATOM 0 HD22 ASN A 126 8.555 -19.660 -5.747 1.00 0.00 H new ATOM 1919 N TRP A 127 10.543 -16.958 -4.694 1.00 0.00 N ATOM 1920 CA TRP A 127 11.504 -16.704 -5.755 1.00 0.00 C ATOM 1921 C TRP A 127 12.324 -15.472 -5.365 1.00 0.00 C ATOM 1922 O TRP A 127 11.768 -14.468 -4.921 1.00 0.00 O ATOM 1923 CB TRP A 127 10.803 -16.553 -7.106 1.00 0.00 C ATOM 1924 CG TRP A 127 9.423 -15.897 -7.021 1.00 0.00 C ATOM 1925 CD1 TRP A 127 8.233 -16.494 -6.882 1.00 0.00 C ATOM 1926 CD2 TRP A 127 9.139 -14.483 -7.075 1.00 0.00 C ATOM 1927 NE1 TRP A 127 7.205 -15.573 -6.842 1.00 0.00 N ATOM 1928 CE2 TRP A 127 7.773 -14.311 -6.964 1.00 0.00 C ATOM 1929 CE3 TRP A 127 10.005 -13.385 -7.215 1.00 0.00 C ATOM 1930 CZ2 TRP A 127 7.154 -13.056 -6.980 1.00 0.00 C ATOM 1931 CZ3 TRP A 127 9.371 -12.136 -7.228 1.00 0.00 C ATOM 1932 CH2 TRP A 127 7.999 -11.947 -7.117 1.00 0.00 C ATOM 0 H TRP A 127 9.738 -16.332 -4.689 1.00 0.00 H new ATOM 0 HA TRP A 127 12.181 -17.550 -5.873 1.00 0.00 H new ATOM 0 HB2 TRP A 127 11.435 -15.961 -7.768 1.00 0.00 H new ATOM 0 HB3 TRP A 127 10.699 -17.538 -7.562 1.00 0.00 H new ATOM 0 HD1 TRP A 127 8.094 -17.563 -6.810 1.00 0.00 H new ATOM 0 HE1 TRP A 127 6.211 -15.781 -6.741 1.00 0.00 H new ATOM 0 HE3 TRP A 127 11.076 -13.496 -7.305 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 6.083 -12.948 -6.892 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 9.992 -11.259 -7.332 1.00 0.00 H new ATOM 0 HH2 TRP A 127 7.586 -10.949 -7.136 1.00 0.00 H new ATOM 1943 N VAL A 128 13.631 -15.590 -5.544 1.00 0.00 N ATOM 1944 CA VAL A 128 14.532 -14.498 -5.217 1.00 0.00 C ATOM 1945 C VAL A 128 14.786 -13.658 -6.471 1.00 0.00 C ATOM 1946 O VAL A 128 15.393 -14.134 -7.428 1.00 0.00 O ATOM 1947 CB VAL A 128 15.817 -15.048 -4.595 1.00 0.00 C ATOM 1948 CG1 VAL A 128 16.676 -15.754 -5.647 1.00 0.00 C ATOM 1949 CG2 VAL A 128 16.607 -13.940 -3.896 1.00 0.00 C ATOM 0 H VAL A 128 14.088 -16.425 -5.911 1.00 0.00 H new ATOM 0 HA VAL A 128 14.082 -13.842 -4.472 1.00 0.00 H new ATOM 0 HB VAL A 128 15.536 -15.784 -3.842 1.00 0.00 H new ATOM 0 HG11 VAL A 128 17.583 -16.136 -5.179 1.00 0.00 H new ATOM 0 HG12 VAL A 128 16.114 -16.582 -6.079 1.00 0.00 H new ATOM 0 HG13 VAL A 128 16.943 -15.047 -6.433 1.00 0.00 H new ATOM 0 HG21 VAL A 128 17.515 -14.359 -3.463 1.00 0.00 H new ATOM 0 HG22 VAL A 128 16.872 -13.170 -4.620 1.00 0.00 H new ATOM 0 HG23 VAL A 128 15.997 -13.501 -3.106 1.00 0.00 H new ATOM 1959 N PRO A 129 14.297 -12.390 -6.422 1.00 0.00 N ATOM 1960 CA PRO A 129 14.465 -11.480 -7.541 1.00 0.00 C ATOM 1961 C PRO A 129 15.902 -10.960 -7.614 1.00 0.00 C ATOM 1962 O PRO A 129 16.126 -9.755 -7.728 1.00 0.00 O ATOM 1963 CB PRO A 129 13.446 -10.376 -7.307 1.00 0.00 C ATOM 1964 CG PRO A 129 13.069 -10.461 -5.837 1.00 0.00 C ATOM 1965 CD PRO A 129 13.575 -11.791 -5.302 1.00 0.00 C ATOM 0 HA PRO A 129 14.297 -11.962 -8.504 1.00 0.00 H new ATOM 0 HB2 PRO A 129 13.867 -9.399 -7.546 1.00 0.00 H new ATOM 0 HB3 PRO A 129 12.571 -10.511 -7.943 1.00 0.00 H new ATOM 0 HG2 PRO A 129 13.510 -9.633 -5.281 1.00 0.00 H new ATOM 0 HG3 PRO A 129 11.988 -10.387 -5.715 1.00 0.00 H new ATOM 0 HD2 PRO A 129 14.228 -11.649 -4.441 1.00 0.00 H new ATOM 0 HD3 PRO A 129 12.751 -12.426 -4.977 1.00 0.00 H new ATOM 1973 N ASN A 130 16.840 -11.893 -7.545 1.00 0.00 N ATOM 1974 CA ASN A 130 18.249 -11.544 -7.602 1.00 0.00 C ATOM 1975 C ASN A 130 18.462 -10.470 -8.670 1.00 0.00 C ATOM 1976 O ASN A 130 19.362 -9.641 -8.551 1.00 0.00 O ATOM 1977 CB ASN A 130 19.103 -12.758 -7.975 1.00 0.00 C ATOM 1978 CG ASN A 130 20.556 -12.561 -7.542 1.00 0.00 C ATOM 1979 OD1 ASN A 130 20.857 -12.279 -6.394 1.00 0.00 O ATOM 1980 ND2 ASN A 130 21.440 -12.725 -8.523 1.00 0.00 N ATOM 0 H ASN A 130 16.652 -12.891 -7.450 1.00 0.00 H new ATOM 0 HA ASN A 130 18.546 -11.183 -6.618 1.00 0.00 H new ATOM 0 HB2 ASN A 130 18.697 -13.652 -7.501 1.00 0.00 H new ATOM 0 HB3 ASN A 130 19.060 -12.920 -9.052 1.00 0.00 H new ATOM 0 HD21 ASN A 130 22.437 -12.615 -8.335 1.00 0.00 H new ATOM 0 HD22 ASN A 130 21.121 -12.961 -9.463 1.00 0.00 H new ATOM 1987 N MET A 131 17.617 -10.521 -9.690 1.00 0.00 N ATOM 1988 CA MET A 131 17.701 -9.561 -10.779 1.00 0.00 C ATOM 1989 C MET A 131 16.751 -8.386 -10.549 1.00 0.00 C ATOM 1990 O MET A 131 15.534 -8.537 -10.654 1.00 0.00 O ATOM 1991 CB MET A 131 17.348 -10.254 -12.098 1.00 0.00 C ATOM 1992 CG MET A 131 15.896 -10.737 -12.091 1.00 0.00 C ATOM 1993 SD MET A 131 15.807 -12.410 -12.707 1.00 0.00 S ATOM 1994 CE MET A 131 15.179 -13.242 -11.257 1.00 0.00 C ATOM 0 H MET A 131 16.872 -11.211 -9.785 1.00 0.00 H new ATOM 0 HA MET A 131 18.720 -9.176 -10.822 1.00 0.00 H new ATOM 0 HB2 MET A 131 17.502 -9.564 -12.928 1.00 0.00 H new ATOM 0 HB3 MET A 131 18.016 -11.100 -12.259 1.00 0.00 H new ATOM 0 HG2 MET A 131 15.494 -10.691 -11.079 1.00 0.00 H new ATOM 0 HG3 MET A 131 15.283 -10.080 -12.708 1.00 0.00 H new ATOM 0 HE1 MET A 131 15.063 -14.305 -11.469 1.00 0.00 H new ATOM 0 HE2 MET A 131 15.878 -13.111 -10.431 1.00 0.00 H new ATOM 0 HE3 MET A 131 14.212 -12.819 -10.985 1.00 0.00 H new ATOM 2004 N ASP A 132 17.341 -7.241 -10.240 1.00 0.00 N ATOM 2005 CA ASP A 132 16.562 -6.039 -9.993 1.00 0.00 C ATOM 2006 C ASP A 132 17.121 -4.893 -10.838 1.00 0.00 C ATOM 2007 O ASP A 132 18.280 -4.511 -10.683 1.00 0.00 O ATOM 2008 CB ASP A 132 16.639 -5.625 -8.522 1.00 0.00 C ATOM 2009 CG ASP A 132 17.950 -4.955 -8.107 1.00 0.00 C ATOM 2010 OD1 ASP A 132 18.081 -3.744 -8.384 1.00 0.00 O ATOM 2011 OD2 ASP A 132 18.792 -5.671 -7.522 1.00 0.00 O ATOM 0 H ASP A 132 18.350 -7.120 -10.155 1.00 0.00 H new ATOM 0 HA ASP A 132 15.525 -6.249 -10.254 1.00 0.00 H new ATOM 0 HB2 ASP A 132 15.816 -4.943 -8.309 1.00 0.00 H new ATOM 0 HB3 ASP A 132 16.488 -6.509 -7.903 1.00 0.00 H new ATOM 2016 N LEU A 133 16.270 -4.374 -11.712 1.00 0.00 N ATOM 2017 CA LEU A 133 16.665 -3.280 -12.581 1.00 0.00 C ATOM 2018 C LEU A 133 17.517 -2.287 -11.788 1.00 0.00 C ATOM 2019 O LEU A 133 17.008 -1.585 -10.914 1.00 0.00 O ATOM 2020 CB LEU A 133 15.436 -2.647 -13.238 1.00 0.00 C ATOM 2021 CG LEU A 133 14.762 -1.519 -12.453 1.00 0.00 C ATOM 2022 CD1 LEU A 133 14.473 -1.949 -11.014 1.00 0.00 C ATOM 2023 CD2 LEU A 133 15.594 -0.237 -12.513 1.00 0.00 C ATOM 0 H LEU A 133 15.309 -4.692 -11.836 1.00 0.00 H new ATOM 0 HA LEU A 133 17.282 -3.648 -13.400 1.00 0.00 H new ATOM 0 HB2 LEU A 133 15.729 -2.259 -14.213 1.00 0.00 H new ATOM 0 HB3 LEU A 133 14.699 -3.430 -13.415 1.00 0.00 H new ATOM 0 HG LEU A 133 13.802 -1.302 -12.922 1.00 0.00 H new ATOM 0 HD11 LEU A 133 13.994 -1.129 -10.478 1.00 0.00 H new ATOM 0 HD12 LEU A 133 13.811 -2.815 -11.019 1.00 0.00 H new ATOM 0 HD13 LEU A 133 15.408 -2.210 -10.518 1.00 0.00 H new ATOM 0 HD21 LEU A 133 15.093 0.549 -11.947 1.00 0.00 H new ATOM 0 HD22 LEU A 133 16.579 -0.422 -12.083 1.00 0.00 H new ATOM 0 HD23 LEU A 133 15.704 0.077 -13.551 1.00 0.00 H new ATOM 2035 N VAL A 134 18.799 -2.259 -12.120 1.00 0.00 N ATOM 2036 CA VAL A 134 19.727 -1.365 -11.450 1.00 0.00 C ATOM 2037 C VAL A 134 20.291 -0.368 -12.464 1.00 0.00 C ATOM 2038 O VAL A 134 21.022 0.551 -12.097 1.00 0.00 O ATOM 2039 CB VAL A 134 20.814 -2.173 -10.739 1.00 0.00 C ATOM 2040 CG1 VAL A 134 21.921 -2.578 -11.715 1.00 0.00 C ATOM 2041 CG2 VAL A 134 21.387 -1.398 -9.552 1.00 0.00 C ATOM 0 H VAL A 134 19.217 -2.842 -12.845 1.00 0.00 H new ATOM 0 HA VAL A 134 19.213 -0.790 -10.680 1.00 0.00 H new ATOM 0 HB VAL A 134 20.356 -3.084 -10.353 1.00 0.00 H new ATOM 0 HG11 VAL A 134 22.682 -3.151 -11.185 1.00 0.00 H new ATOM 0 HG12 VAL A 134 21.497 -3.188 -12.513 1.00 0.00 H new ATOM 0 HG13 VAL A 134 22.374 -1.684 -12.143 1.00 0.00 H new ATOM 0 HG21 VAL A 134 22.157 -1.996 -9.065 1.00 0.00 H new ATOM 0 HG22 VAL A 134 21.822 -0.463 -9.904 1.00 0.00 H new ATOM 0 HG23 VAL A 134 20.591 -1.182 -8.840 1.00 0.00 H new ATOM 2051 N ILE A 135 19.929 -0.584 -13.721 1.00 0.00 N ATOM 2052 CA ILE A 135 20.391 0.285 -14.791 1.00 0.00 C ATOM 2053 C ILE A 135 19.234 1.172 -15.257 1.00 0.00 C ATOM 2054 O ILE A 135 19.455 2.216 -15.868 1.00 0.00 O ATOM 2055 CB ILE A 135 21.024 -0.540 -15.914 1.00 0.00 C ATOM 2056 CG1 ILE A 135 20.280 -1.861 -16.111 1.00 0.00 C ATOM 2057 CG2 ILE A 135 22.518 -0.754 -15.660 1.00 0.00 C ATOM 2058 CD1 ILE A 135 20.829 -2.943 -15.178 1.00 0.00 C ATOM 0 H ILE A 135 19.322 -1.347 -14.022 1.00 0.00 H new ATOM 0 HA ILE A 135 21.177 0.949 -14.431 1.00 0.00 H new ATOM 0 HB ILE A 135 20.932 0.021 -16.844 1.00 0.00 H new ATOM 0 HG12 ILE A 135 19.217 -1.716 -15.920 1.00 0.00 H new ATOM 0 HG13 ILE A 135 20.376 -2.186 -17.147 1.00 0.00 H new ATOM 0 HG21 ILE A 135 22.944 -1.343 -16.472 1.00 0.00 H new ATOM 0 HG22 ILE A 135 23.021 0.212 -15.610 1.00 0.00 H new ATOM 0 HG23 ILE A 135 22.655 -1.284 -14.717 1.00 0.00 H new ATOM 0 HD11 ILE A 135 20.283 -3.873 -15.338 1.00 0.00 H new ATOM 0 HD12 ILE A 135 21.887 -3.103 -15.388 1.00 0.00 H new ATOM 0 HD13 ILE A 135 20.709 -2.625 -14.142 1.00 0.00 H new ATOM 2070 N GLY A 136 18.026 0.722 -14.950 1.00 0.00 N ATOM 2071 CA GLY A 136 16.834 1.462 -15.330 1.00 0.00 C ATOM 2072 C GLY A 136 16.460 1.189 -16.788 1.00 0.00 C ATOM 2073 O GLY A 136 15.788 2.001 -17.424 1.00 0.00 O ATOM 0 H GLY A 136 17.847 -0.145 -14.443 1.00 0.00 H new ATOM 0 HA2 GLY A 136 16.005 1.182 -14.680 1.00 0.00 H new ATOM 0 HA3 GLY A 136 17.004 2.529 -15.188 1.00 0.00 H new ATOM 2077 N GLU A 137 16.910 0.042 -17.276 1.00 0.00 N ATOM 2078 CA GLU A 137 16.632 -0.349 -18.647 1.00 0.00 C ATOM 2079 C GLU A 137 15.935 -1.710 -18.680 1.00 0.00 C ATOM 2080 O GLU A 137 15.787 -2.362 -17.649 1.00 0.00 O ATOM 2081 CB GLU A 137 17.913 -0.368 -19.484 1.00 0.00 C ATOM 2082 CG GLU A 137 18.005 0.872 -20.376 1.00 0.00 C ATOM 2083 CD GLU A 137 18.862 0.595 -21.613 1.00 0.00 C ATOM 2084 OE1 GLU A 137 20.044 0.242 -21.416 1.00 0.00 O ATOM 2085 OE2 GLU A 137 18.314 0.743 -22.728 1.00 0.00 O ATOM 0 H GLU A 137 17.466 -0.629 -16.746 1.00 0.00 H new ATOM 0 HA GLU A 137 15.963 0.391 -19.086 1.00 0.00 H new ATOM 0 HB2 GLU A 137 18.781 -0.412 -18.826 1.00 0.00 H new ATOM 0 HB3 GLU A 137 17.935 -1.266 -20.101 1.00 0.00 H new ATOM 0 HG2 GLU A 137 17.005 1.178 -20.683 1.00 0.00 H new ATOM 0 HG3 GLU A 137 18.433 1.700 -19.811 1.00 0.00 H new ATOM 2092 N VAL A 138 15.525 -2.101 -19.879 1.00 0.00 N ATOM 2093 CA VAL A 138 14.847 -3.373 -20.060 1.00 0.00 C ATOM 2094 C VAL A 138 15.872 -4.507 -19.984 1.00 0.00 C ATOM 2095 O VAL A 138 16.786 -4.580 -20.803 1.00 0.00 O ATOM 2096 CB VAL A 138 14.062 -3.365 -21.373 1.00 0.00 C ATOM 2097 CG1 VAL A 138 14.685 -4.323 -22.391 1.00 0.00 C ATOM 2098 CG2 VAL A 138 12.590 -3.702 -21.131 1.00 0.00 C ATOM 0 H VAL A 138 15.650 -1.559 -20.734 1.00 0.00 H new ATOM 0 HA VAL A 138 14.121 -3.536 -19.263 1.00 0.00 H new ATOM 0 HB VAL A 138 14.112 -2.358 -21.788 1.00 0.00 H new ATOM 0 HG11 VAL A 138 14.108 -4.298 -23.315 1.00 0.00 H new ATOM 0 HG12 VAL A 138 15.711 -4.019 -22.596 1.00 0.00 H new ATOM 0 HG13 VAL A 138 14.680 -5.336 -21.988 1.00 0.00 H new ATOM 0 HG21 VAL A 138 12.053 -3.690 -22.080 1.00 0.00 H new ATOM 0 HG22 VAL A 138 12.512 -4.693 -20.683 1.00 0.00 H new ATOM 0 HG23 VAL A 138 12.154 -2.964 -20.458 1.00 0.00 H new ATOM 2108 N LEU A 139 15.686 -5.364 -18.990 1.00 0.00 N ATOM 2109 CA LEU A 139 16.582 -6.490 -18.796 1.00 0.00 C ATOM 2110 C LEU A 139 16.161 -7.262 -17.543 1.00 0.00 C ATOM 2111 O LEU A 139 16.020 -8.483 -17.581 1.00 0.00 O ATOM 2112 CB LEU A 139 18.037 -6.019 -18.767 1.00 0.00 C ATOM 2113 CG LEU A 139 19.031 -6.951 -18.071 1.00 0.00 C ATOM 2114 CD1 LEU A 139 20.435 -6.794 -18.659 1.00 0.00 C ATOM 2115 CD2 LEU A 139 19.017 -6.735 -16.557 1.00 0.00 C ATOM 0 H LEU A 139 14.928 -5.300 -18.311 1.00 0.00 H new ATOM 0 HA LEU A 139 16.511 -7.181 -19.636 1.00 0.00 H new ATOM 0 HB2 LEU A 139 18.369 -5.868 -19.794 1.00 0.00 H new ATOM 0 HB3 LEU A 139 18.074 -5.048 -18.274 1.00 0.00 H new ATOM 0 HG LEU A 139 18.719 -7.979 -18.253 1.00 0.00 H new ATOM 0 HD11 LEU A 139 21.122 -7.468 -18.146 1.00 0.00 H new ATOM 0 HD12 LEU A 139 20.414 -7.037 -19.721 1.00 0.00 H new ATOM 0 HD13 LEU A 139 20.771 -5.765 -18.529 1.00 0.00 H new ATOM 0 HD21 LEU A 139 19.732 -7.410 -16.087 1.00 0.00 H new ATOM 0 HD22 LEU A 139 19.290 -5.704 -16.334 1.00 0.00 H new ATOM 0 HD23 LEU A 139 18.018 -6.938 -16.170 1.00 0.00 H new ATOM 2127 N ALA A 140 15.973 -6.516 -16.464 1.00 0.00 N ATOM 2128 CA ALA A 140 15.571 -7.116 -15.202 1.00 0.00 C ATOM 2129 C ALA A 140 14.083 -6.845 -14.966 1.00 0.00 C ATOM 2130 O ALA A 140 13.503 -5.959 -15.590 1.00 0.00 O ATOM 2131 CB ALA A 140 16.449 -6.569 -14.075 1.00 0.00 C ATOM 0 H ALA A 140 16.091 -5.503 -16.437 1.00 0.00 H new ATOM 0 HA ALA A 140 15.710 -8.197 -15.228 1.00 0.00 H new ATOM 0 HB1 ALA A 140 16.148 -7.018 -13.129 1.00 0.00 H new ATOM 0 HB2 ALA A 140 17.492 -6.811 -14.276 1.00 0.00 H new ATOM 0 HB3 ALA A 140 16.333 -5.487 -14.016 1.00 0.00 H new ATOM 2137 N GLU A 141 13.509 -7.626 -14.063 1.00 0.00 N ATOM 2138 CA GLU A 141 12.100 -7.483 -13.736 1.00 0.00 C ATOM 2139 C GLU A 141 11.868 -6.192 -12.947 1.00 0.00 C ATOM 2140 O GLU A 141 11.927 -6.191 -11.720 1.00 0.00 O ATOM 2141 CB GLU A 141 11.592 -8.700 -12.960 1.00 0.00 C ATOM 2142 CG GLU A 141 10.065 -8.791 -13.026 1.00 0.00 C ATOM 2143 CD GLU A 141 9.595 -9.099 -14.449 1.00 0.00 C ATOM 2144 OE1 GLU A 141 9.936 -10.198 -14.934 1.00 0.00 O ATOM 2145 OE2 GLU A 141 8.906 -8.225 -15.019 1.00 0.00 O ATOM 0 H GLU A 141 13.994 -8.360 -13.547 1.00 0.00 H new ATOM 0 HA GLU A 141 11.534 -7.424 -14.666 1.00 0.00 H new ATOM 0 HB2 GLU A 141 12.033 -9.608 -13.371 1.00 0.00 H new ATOM 0 HB3 GLU A 141 11.912 -8.633 -11.920 1.00 0.00 H new ATOM 0 HG2 GLU A 141 9.714 -9.568 -12.347 1.00 0.00 H new ATOM 0 HG3 GLU A 141 9.626 -7.852 -12.690 1.00 0.00 H new ATOM 2152 N VAL A 142 11.605 -5.124 -13.687 1.00 0.00 N ATOM 2153 CA VAL A 142 11.362 -3.831 -13.074 1.00 0.00 C ATOM 2154 C VAL A 142 10.176 -3.941 -12.112 1.00 0.00 C ATOM 2155 O VAL A 142 9.558 -4.999 -12.004 1.00 0.00 O ATOM 2156 CB VAL A 142 11.158 -2.768 -14.155 1.00 0.00 C ATOM 2157 CG1 VAL A 142 12.331 -2.755 -15.139 1.00 0.00 C ATOM 2158 CG2 VAL A 142 9.831 -2.978 -14.886 1.00 0.00 C ATOM 0 H VAL A 142 11.555 -5.129 -14.706 1.00 0.00 H new ATOM 0 HA VAL A 142 12.227 -3.518 -12.489 1.00 0.00 H new ATOM 0 HB VAL A 142 11.120 -1.795 -13.666 1.00 0.00 H new ATOM 0 HG11 VAL A 142 12.161 -1.991 -15.897 1.00 0.00 H new ATOM 0 HG12 VAL A 142 13.254 -2.535 -14.602 1.00 0.00 H new ATOM 0 HG13 VAL A 142 12.414 -3.730 -15.619 1.00 0.00 H new ATOM 0 HG21 VAL A 142 9.710 -2.209 -15.649 1.00 0.00 H new ATOM 0 HG22 VAL A 142 9.827 -3.961 -15.357 1.00 0.00 H new ATOM 0 HG23 VAL A 142 9.009 -2.914 -14.173 1.00 0.00 H new