USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 913 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 56 THR OG1 : rot 170:sc= -1.49 USER MOD Set 1.2: A 58 ASN : amide:sc= -3.42 K(o=-5.4,f=-9.6!) USER MOD Set 1.3: A 89 GLN : amide:sc= -0.532 K(o=-5.4,f=-7.7) USER MOD Set 2.1: A 13 THR OG1 : rot 180:sc= -0.0527 USER MOD Set 2.2: A 70 MET CE :methyl -176:sc= -0.0251 (180deg=-0.0455) USER MOD Single : A 1 MET CE :methyl 165:sc=-0.00328 (180deg=-0.164) USER MOD Single : A 1 MET N :NH3+ 169:sc= 0.464 (180deg=0.182) USER MOD Single : A 2 THR OG1 : rot 79:sc= 1.06 USER MOD Single : A 3 MET CE :methyl -147:sc= -0.364 (180deg=-2.12!) USER MOD Single : A 4 ASN : amide:sc= -0.0385 X(o=-0.039,f=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot -126:sc= -2.04! USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= -1.99 K(o=-2,f=-2.9) USER MOD Single : A 10 MET CE :methyl -166:sc= 0 (180deg=-0.145) USER MOD Single : A 18 GLN : amide:sc= -0.318 X(o=-0.32,f=0) USER MOD Single : A 19 HIS : no HD1:sc= -6.89! C(o=-6.9!,f=-6.9!) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -1.68 X(o=-1.7,f=-2!) USER MOD Single : A 32 THR OG1 : rot 180:sc= -0.538 USER MOD Single : A 33 HIS : no HD1:sc= -0.905 X(o=-0.91,f=-0.56) USER MOD Single : A 36 ASN : amide:sc=-0.00896 X(o=-0.009,f=-0.22) USER MOD Single : A 38 HIS : no HD1:sc= 0 X(o=0,f=-0.0065) USER MOD Single : A 42 SER OG : rot -170:sc= -1.48! USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= -0.142 X(o=-0.14,f=-0.026) USER MOD Single : A 53 THR OG1 : rot 11:sc= -0.489 USER MOD Single : A 55 ASN : amide:sc= -0.433 X(o=-0.43,f=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 156:sc= -0.265 (180deg=-1.06) USER MOD Single : A 67 HIS :FLIP no HD1:sc= -1.32 F(o=-2.2!,f=-1.3) USER MOD Single : A 71 TYR OH : rot 180:sc= -0.26 USER MOD Single : A 72 THR OG1 : rot -99:sc= -3.43! USER MOD Single : A 75 ASN : amide:sc= 1.08 K(o=1.1,f=-1.4) USER MOD Single : A 79 ASN : amide:sc= -0.267 X(o=-0.27,f=-0.53) USER MOD Single : A 80 LYS NZ :NH3+ -138:sc= -1.64 (180deg=-2.98!) USER MOD Single : A 84 GLN :FLIP amide:sc=-0.00288 F(o=-1.3,f=-0.0029) USER MOD Single : A 86 ASN : amide:sc= -3.06 X(o=-3.1,f=-3.2!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 HIS : no HD1:sc= -6.52! C(o=-6.5!,f=-9.6!) USER MOD Single : A 91 LYS NZ :NH3+ -121:sc= -0.455 (180deg=-1.47!) USER MOD Single : A 99 THR OG1 : rot 43:sc= 0.117 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ -146:sc= -0.149 (180deg=-0.919) USER MOD Single : A 105 ASN : amide:sc= -0.0206 K(o=-0.021,f=-0.55) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 186.093 0.177 -6.326 1.00 0.00 N ATOM 2 CA MET A 1 185.882 0.411 -7.778 1.00 0.00 C ATOM 3 C MET A 1 184.697 -0.393 -8.304 1.00 0.00 C ATOM 4 O MET A 1 183.798 0.156 -8.940 1.00 0.00 O ATOM 5 CB MET A 1 187.158 0.017 -8.525 1.00 0.00 C ATOM 6 CG MET A 1 187.388 0.817 -9.798 1.00 0.00 C ATOM 7 SD MET A 1 188.228 2.383 -9.492 1.00 0.00 S ATOM 8 CE MET A 1 189.904 1.818 -9.211 1.00 0.00 C ATOM 0 H1 MET A 1 187.006 0.584 -6.038 1.00 0.00 H new ATOM 0 H2 MET A 1 185.327 0.629 -5.787 1.00 0.00 H new ATOM 0 H3 MET A 1 186.094 -0.845 -6.136 1.00 0.00 H new ATOM 0 HA MET A 1 185.659 1.466 -7.940 1.00 0.00 H new ATOM 0 HB2 MET A 1 188.013 0.150 -7.862 1.00 0.00 H new ATOM 0 HB3 MET A 1 187.110 -1.043 -8.775 1.00 0.00 H new ATOM 0 HG2 MET A 1 187.979 0.222 -10.494 1.00 0.00 H new ATOM 0 HG3 MET A 1 186.429 1.011 -10.279 1.00 0.00 H new ATOM 0 HE1 MET A 1 190.588 2.664 -9.272 1.00 0.00 H new ATOM 0 HE2 MET A 1 189.974 1.365 -8.222 1.00 0.00 H new ATOM 0 HE3 MET A 1 190.171 1.080 -9.968 1.00 0.00 H new ATOM 20 N THR A 2 184.700 -1.693 -8.031 1.00 0.00 N ATOM 21 CA THR A 2 183.621 -2.569 -8.477 1.00 0.00 C ATOM 22 C THR A 2 182.295 -2.167 -7.837 1.00 0.00 C ATOM 23 O THR A 2 182.172 -1.077 -7.277 1.00 0.00 O ATOM 24 CB THR A 2 183.947 -4.026 -8.141 1.00 0.00 C ATOM 25 OG1 THR A 2 185.337 -4.192 -7.918 1.00 0.00 O ATOM 26 CG2 THR A 2 183.540 -4.996 -9.231 1.00 0.00 C ATOM 0 H THR A 2 185.436 -2.164 -7.504 1.00 0.00 H new ATOM 0 HA THR A 2 183.525 -2.468 -9.558 1.00 0.00 H new ATOM 0 HB THR A 2 183.373 -4.250 -7.242 1.00 0.00 H new ATOM 0 HG1 THR A 2 185.564 -3.877 -7.018 1.00 0.00 H new ATOM 0 HG21 THR A 2 183.799 -6.011 -8.930 1.00 0.00 H new ATOM 0 HG22 THR A 2 182.464 -4.929 -9.394 1.00 0.00 H new ATOM 0 HG23 THR A 2 184.063 -4.747 -10.154 1.00 0.00 H new ATOM 34 N MET A 3 181.309 -3.052 -7.922 1.00 0.00 N ATOM 35 CA MET A 3 179.993 -2.789 -7.352 1.00 0.00 C ATOM 36 C MET A 3 179.351 -4.083 -6.859 1.00 0.00 C ATOM 37 O MET A 3 178.415 -4.597 -7.472 1.00 0.00 O ATOM 38 CB MET A 3 179.089 -2.116 -8.385 1.00 0.00 C ATOM 39 CG MET A 3 177.698 -1.796 -7.862 1.00 0.00 C ATOM 40 SD MET A 3 177.654 -0.279 -6.888 1.00 0.00 S ATOM 41 CE MET A 3 176.488 -0.733 -5.607 1.00 0.00 C ATOM 0 H MET A 3 181.396 -3.959 -8.381 1.00 0.00 H new ATOM 0 HA MET A 3 180.118 -2.117 -6.503 1.00 0.00 H new ATOM 0 HB2 MET A 3 179.562 -1.194 -8.723 1.00 0.00 H new ATOM 0 HB3 MET A 3 179.000 -2.766 -9.255 1.00 0.00 H new ATOM 0 HG2 MET A 3 177.010 -1.703 -8.703 1.00 0.00 H new ATOM 0 HG3 MET A 3 177.344 -2.626 -7.251 1.00 0.00 H new ATOM 0 HE1 MET A 3 175.917 0.145 -5.307 1.00 0.00 H new ATOM 0 HE2 MET A 3 175.808 -1.496 -5.987 1.00 0.00 H new ATOM 0 HE3 MET A 3 177.028 -1.126 -4.746 1.00 0.00 H new ATOM 51 N ASN A 4 179.863 -4.605 -5.750 1.00 0.00 N ATOM 52 CA ASN A 4 179.343 -5.842 -5.178 1.00 0.00 C ATOM 53 C ASN A 4 178.373 -5.553 -4.038 1.00 0.00 C ATOM 54 O ASN A 4 178.687 -4.799 -3.118 1.00 0.00 O ATOM 55 CB ASN A 4 180.492 -6.718 -4.670 1.00 0.00 C ATOM 56 CG ASN A 4 181.640 -6.799 -5.657 1.00 0.00 C ATOM 57 OD1 ASN A 4 182.805 -6.645 -5.287 1.00 0.00 O ATOM 58 ND2 ASN A 4 181.319 -7.040 -6.922 1.00 0.00 N ATOM 0 H ASN A 4 180.637 -4.192 -5.230 1.00 0.00 H new ATOM 0 HA ASN A 4 178.806 -6.374 -5.963 1.00 0.00 H new ATOM 0 HB2 ASN A 4 180.858 -6.319 -3.724 1.00 0.00 H new ATOM 0 HB3 ASN A 4 180.118 -7.722 -4.469 1.00 0.00 H new ATOM 0 HD21 ASN A 4 182.050 -7.104 -7.630 1.00 0.00 H new ATOM 0 HD22 ASN A 4 180.341 -7.161 -7.186 1.00 0.00 H new ATOM 65 N ILE A 5 177.195 -6.162 -4.103 1.00 0.00 N ATOM 66 CA ILE A 5 176.181 -5.974 -3.072 1.00 0.00 C ATOM 67 C ILE A 5 175.365 -7.253 -2.880 1.00 0.00 C ATOM 68 O ILE A 5 174.784 -7.779 -3.830 1.00 0.00 O ATOM 69 CB ILE A 5 175.249 -4.776 -3.394 1.00 0.00 C ATOM 70 CG1 ILE A 5 174.107 -5.184 -4.326 1.00 0.00 C ATOM 71 CG2 ILE A 5 176.044 -3.636 -4.015 1.00 0.00 C ATOM 72 CD1 ILE A 5 174.574 -5.705 -5.668 1.00 0.00 C ATOM 0 H ILE A 5 176.918 -6.790 -4.858 1.00 0.00 H new ATOM 0 HA ILE A 5 176.699 -5.746 -2.141 1.00 0.00 H new ATOM 0 HB ILE A 5 174.812 -4.439 -2.454 1.00 0.00 H new ATOM 0 HG12 ILE A 5 173.507 -5.952 -3.837 1.00 0.00 H new ATOM 0 HG13 ILE A 5 173.456 -4.325 -4.486 1.00 0.00 H new ATOM 0 HG21 ILE A 5 175.375 -2.804 -4.235 1.00 0.00 H new ATOM 0 HG22 ILE A 5 176.815 -3.308 -3.318 1.00 0.00 H new ATOM 0 HG23 ILE A 5 176.512 -3.979 -4.938 1.00 0.00 H new ATOM 0 HD11 ILE A 5 173.709 -5.974 -6.275 1.00 0.00 H new ATOM 0 HD12 ILE A 5 175.149 -4.932 -6.178 1.00 0.00 H new ATOM 0 HD13 ILE A 5 175.201 -6.584 -5.519 1.00 0.00 H new ATOM 84 N THR A 6 175.339 -7.758 -1.650 1.00 0.00 N ATOM 85 CA THR A 6 174.609 -8.984 -1.340 1.00 0.00 C ATOM 86 C THR A 6 173.742 -8.805 -0.097 1.00 0.00 C ATOM 87 O THR A 6 174.246 -8.764 1.025 1.00 0.00 O ATOM 88 CB THR A 6 175.595 -10.143 -1.144 1.00 0.00 C ATOM 89 OG1 THR A 6 176.064 -10.617 -2.394 1.00 0.00 O ATOM 90 CG2 THR A 6 175.010 -11.327 -0.400 1.00 0.00 C ATOM 0 H THR A 6 175.815 -7.338 -0.852 1.00 0.00 H new ATOM 0 HA THR A 6 173.950 -9.215 -2.177 1.00 0.00 H new ATOM 0 HB THR A 6 176.403 -9.726 -0.543 1.00 0.00 H new ATOM 0 HG1 THR A 6 176.693 -11.355 -2.249 1.00 0.00 H new ATOM 0 HG21 THR A 6 175.767 -12.105 -0.301 1.00 0.00 H new ATOM 0 HG22 THR A 6 174.684 -11.009 0.591 1.00 0.00 H new ATOM 0 HG23 THR A 6 174.157 -11.719 -0.954 1.00 0.00 H new ATOM 98 N SER A 7 172.434 -8.698 -0.306 1.00 0.00 N ATOM 99 CA SER A 7 171.490 -8.521 0.792 1.00 0.00 C ATOM 100 C SER A 7 170.914 -9.852 1.251 1.00 0.00 C ATOM 101 O SER A 7 170.983 -10.851 0.536 1.00 0.00 O ATOM 102 CB SER A 7 170.345 -7.606 0.361 1.00 0.00 C ATOM 103 OG SER A 7 170.778 -6.262 0.256 1.00 0.00 O ATOM 0 H SER A 7 172.002 -8.731 -1.229 1.00 0.00 H new ATOM 0 HA SER A 7 172.035 -8.071 1.622 1.00 0.00 H new ATOM 0 HB2 SER A 7 169.950 -7.940 -0.598 1.00 0.00 H new ATOM 0 HB3 SER A 7 169.530 -7.674 1.082 1.00 0.00 H new ATOM 0 HG SER A 7 170.200 -5.689 0.802 1.00 0.00 H new ATOM 109 N LYS A 8 170.320 -9.849 2.439 1.00 0.00 N ATOM 110 CA LYS A 8 169.703 -11.050 2.979 1.00 0.00 C ATOM 111 C LYS A 8 168.472 -11.413 2.144 1.00 0.00 C ATOM 112 O LYS A 8 168.454 -11.185 0.934 1.00 0.00 O ATOM 113 CB LYS A 8 169.331 -10.827 4.451 1.00 0.00 C ATOM 114 CG LYS A 8 169.796 -11.940 5.377 1.00 0.00 C ATOM 115 CD LYS A 8 170.107 -11.408 6.767 1.00 0.00 C ATOM 116 CE LYS A 8 170.144 -12.526 7.798 1.00 0.00 C ATOM 117 NZ LYS A 8 170.431 -12.010 9.165 1.00 0.00 N ATOM 0 H LYS A 8 170.254 -9.030 3.043 1.00 0.00 H new ATOM 0 HA LYS A 8 170.407 -11.881 2.931 1.00 0.00 H new ATOM 0 HB2 LYS A 8 169.763 -9.884 4.786 1.00 0.00 H new ATOM 0 HB3 LYS A 8 168.248 -10.729 4.532 1.00 0.00 H new ATOM 0 HG2 LYS A 8 169.025 -12.707 5.443 1.00 0.00 H new ATOM 0 HG3 LYS A 8 170.684 -12.416 4.960 1.00 0.00 H new ATOM 0 HD2 LYS A 8 171.067 -10.892 6.754 1.00 0.00 H new ATOM 0 HD3 LYS A 8 169.355 -10.673 7.053 1.00 0.00 H new ATOM 0 HE2 LYS A 8 169.188 -13.049 7.801 1.00 0.00 H new ATOM 0 HE3 LYS A 8 170.905 -13.254 7.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 170.448 -12.802 9.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 171.355 -11.532 9.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 169.691 -11.334 9.444 1.00 0.00 H new ATOM 131 N GLN A 9 167.444 -11.970 2.779 1.00 0.00 N ATOM 132 CA GLN A 9 166.223 -12.348 2.074 1.00 0.00 C ATOM 133 C GLN A 9 165.699 -11.191 1.223 1.00 0.00 C ATOM 134 O GLN A 9 165.035 -11.405 0.208 1.00 0.00 O ATOM 135 CB GLN A 9 165.149 -12.798 3.070 1.00 0.00 C ATOM 136 CG GLN A 9 164.560 -11.663 3.896 1.00 0.00 C ATOM 137 CD GLN A 9 165.585 -11.005 4.799 1.00 0.00 C ATOM 138 OE1 GLN A 9 166.262 -11.673 5.581 1.00 0.00 O ATOM 139 NE2 GLN A 9 165.702 -9.686 4.698 1.00 0.00 N ATOM 0 H GLN A 9 167.432 -12.169 3.779 1.00 0.00 H new ATOM 0 HA GLN A 9 166.461 -13.179 1.410 1.00 0.00 H new ATOM 0 HB2 GLN A 9 164.345 -13.292 2.524 1.00 0.00 H new ATOM 0 HB3 GLN A 9 165.580 -13.539 3.743 1.00 0.00 H new ATOM 0 HG2 GLN A 9 164.137 -10.914 3.227 1.00 0.00 H new ATOM 0 HG3 GLN A 9 163.741 -12.048 4.503 1.00 0.00 H new ATOM 0 HE21 GLN A 9 165.121 -9.172 4.036 1.00 0.00 H new ATOM 0 HE22 GLN A 9 166.373 -9.187 5.282 1.00 0.00 H new ATOM 148 N MET A 10 166.004 -9.967 1.644 1.00 0.00 N ATOM 149 CA MET A 10 165.568 -8.777 0.922 1.00 0.00 C ATOM 150 C MET A 10 166.411 -8.564 -0.332 1.00 0.00 C ATOM 151 O MET A 10 167.626 -8.767 -0.319 1.00 0.00 O ATOM 152 CB MET A 10 165.652 -7.545 1.832 1.00 0.00 C ATOM 153 CG MET A 10 165.402 -6.222 1.115 1.00 0.00 C ATOM 154 SD MET A 10 163.861 -5.430 1.618 1.00 0.00 S ATOM 155 CE MET A 10 162.670 -6.692 1.175 1.00 0.00 C ATOM 0 H MET A 10 166.552 -9.774 2.482 1.00 0.00 H new ATOM 0 HA MET A 10 164.532 -8.922 0.617 1.00 0.00 H new ATOM 0 HB2 MET A 10 164.926 -7.652 2.638 1.00 0.00 H new ATOM 0 HB3 MET A 10 166.639 -7.515 2.294 1.00 0.00 H new ATOM 0 HG2 MET A 10 166.233 -5.545 1.312 1.00 0.00 H new ATOM 0 HG3 MET A 10 165.381 -6.396 0.039 1.00 0.00 H new ATOM 0 HE1 MET A 10 161.667 -6.266 1.189 1.00 0.00 H new ATOM 0 HE2 MET A 10 162.891 -7.066 0.175 1.00 0.00 H new ATOM 0 HE3 MET A 10 162.726 -7.513 1.890 1.00 0.00 H new ATOM 165 N GLU A 11 165.758 -8.148 -1.412 1.00 0.00 N ATOM 166 CA GLU A 11 166.445 -7.900 -2.674 1.00 0.00 C ATOM 167 C GLU A 11 166.658 -6.404 -2.881 1.00 0.00 C ATOM 168 O GLU A 11 165.819 -5.589 -2.496 1.00 0.00 O ATOM 169 CB GLU A 11 165.642 -8.480 -3.842 1.00 0.00 C ATOM 170 CG GLU A 11 165.027 -9.839 -3.547 1.00 0.00 C ATOM 171 CD GLU A 11 163.946 -10.219 -4.540 1.00 0.00 C ATOM 172 OE1 GLU A 11 162.876 -9.576 -4.527 1.00 0.00 O ATOM 173 OE2 GLU A 11 164.173 -11.156 -5.334 1.00 0.00 O ATOM 0 H GLU A 11 164.753 -7.975 -1.438 1.00 0.00 H new ATOM 0 HA GLU A 11 167.417 -8.391 -2.637 1.00 0.00 H new ATOM 0 HB2 GLU A 11 164.848 -7.782 -4.107 1.00 0.00 H new ATOM 0 HB3 GLU A 11 166.294 -8.567 -4.711 1.00 0.00 H new ATOM 0 HG2 GLU A 11 165.809 -10.598 -3.559 1.00 0.00 H new ATOM 0 HG3 GLU A 11 164.605 -9.832 -2.542 1.00 0.00 H new ATOM 180 N ILE A 12 167.781 -6.047 -3.493 1.00 0.00 N ATOM 181 CA ILE A 12 168.096 -4.646 -3.749 1.00 0.00 C ATOM 182 C ILE A 12 167.094 -4.027 -4.716 1.00 0.00 C ATOM 183 O ILE A 12 167.138 -4.281 -5.919 1.00 0.00 O ATOM 184 CB ILE A 12 169.517 -4.478 -4.322 1.00 0.00 C ATOM 185 CG1 ILE A 12 170.535 -5.226 -3.461 1.00 0.00 C ATOM 186 CG2 ILE A 12 169.878 -3.002 -4.415 1.00 0.00 C ATOM 187 CD1 ILE A 12 170.566 -4.758 -2.021 1.00 0.00 C ATOM 0 H ILE A 12 168.487 -6.706 -3.821 1.00 0.00 H new ATOM 0 HA ILE A 12 168.040 -4.132 -2.790 1.00 0.00 H new ATOM 0 HB ILE A 12 169.539 -4.904 -5.325 1.00 0.00 H new ATOM 0 HG12 ILE A 12 170.306 -6.291 -3.484 1.00 0.00 H new ATOM 0 HG13 ILE A 12 171.527 -5.104 -3.896 1.00 0.00 H new ATOM 0 HG21 ILE A 12 170.884 -2.898 -4.821 1.00 0.00 H new ATOM 0 HG22 ILE A 12 169.169 -2.494 -5.069 1.00 0.00 H new ATOM 0 HG23 ILE A 12 169.840 -2.555 -3.422 1.00 0.00 H new ATOM 0 HD11 ILE A 12 171.310 -5.331 -1.468 1.00 0.00 H new ATOM 0 HD12 ILE A 12 170.825 -3.700 -1.988 1.00 0.00 H new ATOM 0 HD13 ILE A 12 169.585 -4.906 -1.569 1.00 0.00 H new ATOM 199 N THR A 13 166.193 -3.210 -4.181 1.00 0.00 N ATOM 200 CA THR A 13 165.181 -2.551 -4.998 1.00 0.00 C ATOM 201 C THR A 13 165.813 -1.455 -5.851 1.00 0.00 C ATOM 202 O THR A 13 166.865 -0.919 -5.507 1.00 0.00 O ATOM 203 CB THR A 13 164.088 -1.956 -4.108 1.00 0.00 C ATOM 204 OG1 THR A 13 164.545 -0.776 -3.470 1.00 0.00 O ATOM 205 CG2 THR A 13 163.614 -2.905 -3.027 1.00 0.00 C ATOM 0 H THR A 13 166.143 -2.989 -3.187 1.00 0.00 H new ATOM 0 HA THR A 13 164.734 -3.294 -5.659 1.00 0.00 H new ATOM 0 HB THR A 13 163.255 -1.746 -4.778 1.00 0.00 H new ATOM 0 HG1 THR A 13 163.831 -0.411 -2.907 1.00 0.00 H new ATOM 0 HG21 THR A 13 162.839 -2.421 -2.432 1.00 0.00 H new ATOM 0 HG22 THR A 13 163.209 -3.806 -3.486 1.00 0.00 H new ATOM 0 HG23 THR A 13 164.452 -3.171 -2.383 1.00 0.00 H new ATOM 213 N PRO A 14 165.176 -1.100 -6.981 1.00 0.00 N ATOM 214 CA PRO A 14 165.683 -0.061 -7.880 1.00 0.00 C ATOM 215 C PRO A 14 165.978 1.240 -7.141 1.00 0.00 C ATOM 216 O PRO A 14 166.928 1.950 -7.470 1.00 0.00 O ATOM 217 CB PRO A 14 164.548 0.141 -8.897 1.00 0.00 C ATOM 218 CG PRO A 14 163.365 -0.571 -8.325 1.00 0.00 C ATOM 219 CD PRO A 14 163.917 -1.675 -7.473 1.00 0.00 C ATOM 0 HA PRO A 14 166.626 -0.352 -8.342 1.00 0.00 H new ATOM 0 HB2 PRO A 14 164.336 1.200 -9.042 1.00 0.00 H new ATOM 0 HB3 PRO A 14 164.817 -0.267 -9.871 1.00 0.00 H new ATOM 0 HG2 PRO A 14 162.750 0.107 -7.734 1.00 0.00 H new ATOM 0 HG3 PRO A 14 162.730 -0.969 -9.116 1.00 0.00 H new ATOM 0 HD2 PRO A 14 163.243 -1.933 -6.656 1.00 0.00 H new ATOM 0 HD3 PRO A 14 164.084 -2.586 -8.048 1.00 0.00 H new ATOM 227 N ALA A 15 165.160 1.543 -6.140 1.00 0.00 N ATOM 228 CA ALA A 15 165.337 2.756 -5.352 1.00 0.00 C ATOM 229 C ALA A 15 166.600 2.675 -4.503 1.00 0.00 C ATOM 230 O ALA A 15 167.356 3.641 -4.403 1.00 0.00 O ATOM 231 CB ALA A 15 164.119 2.994 -4.470 1.00 0.00 C ATOM 0 H ALA A 15 164.369 0.966 -5.855 1.00 0.00 H new ATOM 0 HA ALA A 15 165.444 3.596 -6.038 1.00 0.00 H new ATOM 0 HB1 ALA A 15 164.264 3.903 -3.887 1.00 0.00 H new ATOM 0 HB2 ALA A 15 163.233 3.102 -5.095 1.00 0.00 H new ATOM 0 HB3 ALA A 15 163.987 2.148 -3.796 1.00 0.00 H new ATOM 237 N ILE A 16 166.824 1.515 -3.892 1.00 0.00 N ATOM 238 CA ILE A 16 167.996 1.307 -3.053 1.00 0.00 C ATOM 239 C ILE A 16 169.268 1.249 -3.895 1.00 0.00 C ATOM 240 O ILE A 16 170.219 1.990 -3.647 1.00 0.00 O ATOM 241 CB ILE A 16 167.870 0.013 -2.219 1.00 0.00 C ATOM 242 CG1 ILE A 16 166.681 0.117 -1.265 1.00 0.00 C ATOM 243 CG2 ILE A 16 169.153 -0.255 -1.441 1.00 0.00 C ATOM 244 CD1 ILE A 16 166.295 -1.202 -0.632 1.00 0.00 C ATOM 0 H ILE A 16 166.208 0.705 -3.963 1.00 0.00 H new ATOM 0 HA ILE A 16 168.058 2.156 -2.372 1.00 0.00 H new ATOM 0 HB ILE A 16 167.704 -0.822 -2.900 1.00 0.00 H new ATOM 0 HG12 ILE A 16 166.919 0.832 -0.478 1.00 0.00 H new ATOM 0 HG13 ILE A 16 165.824 0.514 -1.808 1.00 0.00 H new ATOM 0 HG21 ILE A 16 169.042 -1.171 -0.861 1.00 0.00 H new ATOM 0 HG22 ILE A 16 169.984 -0.365 -2.137 1.00 0.00 H new ATOM 0 HG23 ILE A 16 169.351 0.579 -0.768 1.00 0.00 H new ATOM 0 HD11 ILE A 16 165.444 -1.051 0.033 1.00 0.00 H new ATOM 0 HD12 ILE A 16 166.025 -1.914 -1.411 1.00 0.00 H new ATOM 0 HD13 ILE A 16 167.137 -1.592 -0.060 1.00 0.00 H new ATOM 256 N ARG A 17 169.281 0.365 -4.888 1.00 0.00 N ATOM 257 CA ARG A 17 170.442 0.218 -5.760 1.00 0.00 C ATOM 258 C ARG A 17 170.828 1.562 -6.380 1.00 0.00 C ATOM 259 O ARG A 17 171.999 1.811 -6.663 1.00 0.00 O ATOM 260 CB ARG A 17 170.166 -0.835 -6.846 1.00 0.00 C ATOM 261 CG ARG A 17 169.753 -0.267 -8.201 1.00 0.00 C ATOM 262 CD ARG A 17 169.689 -1.350 -9.269 1.00 0.00 C ATOM 263 NE ARG A 17 169.241 -2.636 -8.732 1.00 0.00 N ATOM 264 CZ ARG A 17 170.062 -3.568 -8.247 1.00 0.00 C ATOM 265 NH1 ARG A 17 171.374 -3.363 -8.217 1.00 0.00 N ATOM 266 NH2 ARG A 17 169.568 -4.708 -7.786 1.00 0.00 N ATOM 0 H ARG A 17 168.504 -0.258 -5.109 1.00 0.00 H new ATOM 0 HA ARG A 17 171.285 -0.126 -5.160 1.00 0.00 H new ATOM 0 HB2 ARG A 17 171.062 -1.441 -6.980 1.00 0.00 H new ATOM 0 HB3 ARG A 17 169.380 -1.502 -6.493 1.00 0.00 H new ATOM 0 HG2 ARG A 17 168.779 0.215 -8.112 1.00 0.00 H new ATOM 0 HG3 ARG A 17 170.463 0.502 -8.505 1.00 0.00 H new ATOM 0 HD2 ARG A 17 169.012 -1.035 -10.063 1.00 0.00 H new ATOM 0 HD3 ARG A 17 170.674 -1.471 -9.720 1.00 0.00 H new ATOM 0 HE ARG A 17 168.240 -2.831 -8.729 1.00 0.00 H new ATOM 0 HH11 ARG A 17 171.761 -2.487 -8.567 1.00 0.00 H new ATOM 0 HH12 ARG A 17 171.994 -4.082 -7.844 1.00 0.00 H new ATOM 0 HH21 ARG A 17 168.561 -4.871 -7.803 1.00 0.00 H new ATOM 0 HH22 ARG A 17 170.194 -5.422 -7.415 1.00 0.00 H new ATOM 280 N GLN A 18 169.835 2.423 -6.579 1.00 0.00 N ATOM 281 CA GLN A 18 170.070 3.740 -7.157 1.00 0.00 C ATOM 282 C GLN A 18 170.697 4.676 -6.128 1.00 0.00 C ATOM 283 O GLN A 18 171.556 5.494 -6.457 1.00 0.00 O ATOM 284 CB GLN A 18 168.760 4.337 -7.675 1.00 0.00 C ATOM 285 CG GLN A 18 168.517 4.080 -9.153 1.00 0.00 C ATOM 286 CD GLN A 18 168.919 5.256 -10.023 1.00 0.00 C ATOM 287 OE1 GLN A 18 168.217 5.611 -10.970 1.00 0.00 O ATOM 288 NE2 GLN A 18 170.054 5.867 -9.704 1.00 0.00 N ATOM 0 H GLN A 18 168.860 2.232 -6.348 1.00 0.00 H new ATOM 0 HA GLN A 18 170.761 3.626 -7.992 1.00 0.00 H new ATOM 0 HB2 GLN A 18 167.930 3.924 -7.102 1.00 0.00 H new ATOM 0 HB3 GLN A 18 168.765 5.412 -7.498 1.00 0.00 H new ATOM 0 HG2 GLN A 18 169.076 3.197 -9.461 1.00 0.00 H new ATOM 0 HG3 GLN A 18 167.461 3.860 -9.311 1.00 0.00 H new ATOM 0 HE21 GLN A 18 170.604 5.539 -8.910 1.00 0.00 H new ATOM 0 HE22 GLN A 18 170.375 6.665 -10.253 1.00 0.00 H new ATOM 297 N HIS A 19 170.261 4.547 -4.878 1.00 0.00 N ATOM 298 CA HIS A 19 170.778 5.378 -3.798 1.00 0.00 C ATOM 299 C HIS A 19 172.266 5.120 -3.582 1.00 0.00 C ATOM 300 O HIS A 19 173.087 6.033 -3.687 1.00 0.00 O ATOM 301 CB HIS A 19 170.006 5.111 -2.503 1.00 0.00 C ATOM 302 CG HIS A 19 169.183 6.274 -2.046 1.00 0.00 C ATOM 303 ND1 HIS A 19 168.279 6.923 -2.859 1.00 0.00 N ATOM 304 CD2 HIS A 19 169.131 6.906 -0.849 1.00 0.00 C ATOM 305 CE1 HIS A 19 167.706 7.904 -2.183 1.00 0.00 C ATOM 306 NE2 HIS A 19 168.204 7.914 -0.961 1.00 0.00 N ATOM 0 H HIS A 19 169.551 3.874 -4.589 1.00 0.00 H new ATOM 0 HA HIS A 19 170.645 6.423 -4.080 1.00 0.00 H new ATOM 0 HB2 HIS A 19 169.354 4.250 -2.650 1.00 0.00 H new ATOM 0 HB3 HIS A 19 170.713 4.845 -1.717 1.00 0.00 H new ATOM 0 HD2 HIS A 19 169.710 6.663 0.030 1.00 0.00 H new ATOM 0 HE1 HIS A 19 166.958 8.582 -2.566 1.00 0.00 H new ATOM 0 HE2 HIS A 19 167.943 8.564 -0.220 1.00 0.00 H new ATOM 315 N VAL A 20 172.607 3.871 -3.283 1.00 0.00 N ATOM 316 CA VAL A 20 173.996 3.492 -3.055 1.00 0.00 C ATOM 317 C VAL A 20 174.832 3.692 -4.314 1.00 0.00 C ATOM 318 O VAL A 20 176.009 4.045 -4.240 1.00 0.00 O ATOM 319 CB VAL A 20 174.114 2.025 -2.601 1.00 0.00 C ATOM 320 CG1 VAL A 20 175.533 1.715 -2.153 1.00 0.00 C ATOM 321 CG2 VAL A 20 173.120 1.727 -1.489 1.00 0.00 C ATOM 0 H VAL A 20 171.940 3.104 -3.193 1.00 0.00 H new ATOM 0 HA VAL A 20 174.374 4.139 -2.263 1.00 0.00 H new ATOM 0 HB VAL A 20 173.878 1.383 -3.450 1.00 0.00 H new ATOM 0 HG11 VAL A 20 175.595 0.674 -1.836 1.00 0.00 H new ATOM 0 HG12 VAL A 20 176.221 1.884 -2.981 1.00 0.00 H new ATOM 0 HG13 VAL A 20 175.802 2.364 -1.320 1.00 0.00 H new ATOM 0 HG21 VAL A 20 173.219 0.686 -1.182 1.00 0.00 H new ATOM 0 HG22 VAL A 20 173.321 2.377 -0.637 1.00 0.00 H new ATOM 0 HG23 VAL A 20 172.107 1.904 -1.850 1.00 0.00 H new ATOM 331 N ALA A 21 174.216 3.464 -5.469 1.00 0.00 N ATOM 332 CA ALA A 21 174.902 3.620 -6.746 1.00 0.00 C ATOM 333 C ALA A 21 175.398 5.049 -6.926 1.00 0.00 C ATOM 334 O ALA A 21 176.567 5.276 -7.242 1.00 0.00 O ATOM 335 CB ALA A 21 173.980 3.231 -7.891 1.00 0.00 C ATOM 0 H ALA A 21 173.242 3.170 -5.547 1.00 0.00 H new ATOM 0 HA ALA A 21 175.767 2.957 -6.751 1.00 0.00 H new ATOM 0 HB1 ALA A 21 174.505 3.352 -8.838 1.00 0.00 H new ATOM 0 HB2 ALA A 21 173.675 2.191 -7.776 1.00 0.00 H new ATOM 0 HB3 ALA A 21 173.097 3.871 -7.881 1.00 0.00 H new ATOM 341 N ASP A 22 174.505 6.010 -6.722 1.00 0.00 N ATOM 342 CA ASP A 22 174.853 7.421 -6.860 1.00 0.00 C ATOM 343 C ASP A 22 175.963 7.801 -5.887 1.00 0.00 C ATOM 344 O ASP A 22 176.911 8.496 -6.251 1.00 0.00 O ATOM 345 CB ASP A 22 173.625 8.298 -6.619 1.00 0.00 C ATOM 346 CG ASP A 22 173.912 9.769 -6.842 1.00 0.00 C ATOM 347 OD1 ASP A 22 174.291 10.134 -7.976 1.00 0.00 O ATOM 348 OD2 ASP A 22 173.759 10.556 -5.885 1.00 0.00 O ATOM 0 H ASP A 22 173.534 5.839 -6.460 1.00 0.00 H new ATOM 0 HA ASP A 22 175.211 7.585 -7.876 1.00 0.00 H new ATOM 0 HB2 ASP A 22 172.821 7.983 -7.284 1.00 0.00 H new ATOM 0 HB3 ASP A 22 173.271 8.150 -5.599 1.00 0.00 H new ATOM 353 N ARG A 23 175.840 7.337 -4.647 1.00 0.00 N ATOM 354 CA ARG A 23 176.834 7.627 -3.621 1.00 0.00 C ATOM 355 C ARG A 23 178.185 7.025 -3.992 1.00 0.00 C ATOM 356 O ARG A 23 179.222 7.673 -3.854 1.00 0.00 O ATOM 357 CB ARG A 23 176.374 7.082 -2.267 1.00 0.00 C ATOM 358 CG ARG A 23 175.247 7.884 -1.638 1.00 0.00 C ATOM 359 CD ARG A 23 175.621 9.351 -1.492 1.00 0.00 C ATOM 360 NE ARG A 23 175.109 9.925 -0.251 1.00 0.00 N ATOM 361 CZ ARG A 23 173.833 10.247 -0.053 1.00 0.00 C ATOM 362 NH1 ARG A 23 172.935 10.051 -1.011 1.00 0.00 N ATOM 363 NH2 ARG A 23 173.453 10.765 1.107 1.00 0.00 N ATOM 0 H ARG A 23 175.062 6.759 -4.329 1.00 0.00 H new ATOM 0 HA ARG A 23 176.944 8.709 -3.550 1.00 0.00 H new ATOM 0 HB2 ARG A 23 176.048 6.050 -2.393 1.00 0.00 H new ATOM 0 HB3 ARG A 23 177.223 7.067 -1.584 1.00 0.00 H new ATOM 0 HG2 ARG A 23 174.350 7.795 -2.251 1.00 0.00 H new ATOM 0 HG3 ARG A 23 175.006 7.470 -0.659 1.00 0.00 H new ATOM 0 HD2 ARG A 23 176.706 9.453 -1.518 1.00 0.00 H new ATOM 0 HD3 ARG A 23 175.228 9.912 -2.340 1.00 0.00 H new ATOM 0 HE ARG A 23 175.769 10.089 0.510 1.00 0.00 H new ATOM 0 HH11 ARG A 23 173.222 9.652 -1.905 1.00 0.00 H new ATOM 0 HH12 ARG A 23 171.958 10.300 -0.853 1.00 0.00 H new ATOM 0 HH21 ARG A 23 174.139 10.916 1.847 1.00 0.00 H new ATOM 0 HH22 ARG A 23 172.475 11.012 1.259 1.00 0.00 H new ATOM 377 N LEU A 24 178.165 5.782 -4.463 1.00 0.00 N ATOM 378 CA LEU A 24 179.388 5.093 -4.854 1.00 0.00 C ATOM 379 C LEU A 24 180.111 5.855 -5.959 1.00 0.00 C ATOM 380 O LEU A 24 181.340 5.845 -6.033 1.00 0.00 O ATOM 381 CB LEU A 24 179.071 3.669 -5.321 1.00 0.00 C ATOM 382 CG LEU A 24 180.258 2.702 -5.302 1.00 0.00 C ATOM 383 CD1 LEU A 24 180.212 1.824 -4.060 1.00 0.00 C ATOM 384 CD2 LEU A 24 180.272 1.846 -6.561 1.00 0.00 C ATOM 0 H LEU A 24 177.314 5.232 -4.583 1.00 0.00 H new ATOM 0 HA LEU A 24 180.042 5.044 -3.983 1.00 0.00 H new ATOM 0 HB2 LEU A 24 178.281 3.263 -4.689 1.00 0.00 H new ATOM 0 HB3 LEU A 24 178.676 3.715 -6.336 1.00 0.00 H new ATOM 0 HG LEU A 24 181.177 3.288 -5.275 1.00 0.00 H new ATOM 0 HD11 LEU A 24 181.063 1.143 -4.064 1.00 0.00 H new ATOM 0 HD12 LEU A 24 180.253 2.451 -3.169 1.00 0.00 H new ATOM 0 HD13 LEU A 24 179.287 1.248 -4.056 1.00 0.00 H new ATOM 0 HD21 LEU A 24 181.123 1.165 -6.529 1.00 0.00 H new ATOM 0 HD22 LEU A 24 179.349 1.270 -6.620 1.00 0.00 H new ATOM 0 HD23 LEU A 24 180.355 2.489 -7.437 1.00 0.00 H new ATOM 396 N ALA A 25 179.340 6.516 -6.818 1.00 0.00 N ATOM 397 CA ALA A 25 179.909 7.285 -7.917 1.00 0.00 C ATOM 398 C ALA A 25 180.575 8.557 -7.405 1.00 0.00 C ATOM 399 O ALA A 25 181.720 8.852 -7.747 1.00 0.00 O ATOM 400 CB ALA A 25 178.834 7.624 -8.938 1.00 0.00 C ATOM 0 H ALA A 25 178.321 6.534 -6.773 1.00 0.00 H new ATOM 0 HA ALA A 25 180.671 6.674 -8.400 1.00 0.00 H new ATOM 0 HB1 ALA A 25 179.274 8.199 -9.753 1.00 0.00 H new ATOM 0 HB2 ALA A 25 178.405 6.704 -9.334 1.00 0.00 H new ATOM 0 HB3 ALA A 25 178.051 8.213 -8.460 1.00 0.00 H new ATOM 406 N LYS A 26 179.850 9.305 -6.580 1.00 0.00 N ATOM 407 CA LYS A 26 180.370 10.546 -6.016 1.00 0.00 C ATOM 408 C LYS A 26 181.510 10.266 -5.040 1.00 0.00 C ATOM 409 O LYS A 26 182.350 11.130 -4.788 1.00 0.00 O ATOM 410 CB LYS A 26 179.254 11.316 -5.307 1.00 0.00 C ATOM 411 CG LYS A 26 179.670 12.701 -4.842 1.00 0.00 C ATOM 412 CD LYS A 26 178.940 13.105 -3.569 1.00 0.00 C ATOM 413 CE LYS A 26 177.908 14.187 -3.838 1.00 0.00 C ATOM 414 NZ LYS A 26 177.014 14.406 -2.668 1.00 0.00 N ATOM 0 H LYS A 26 178.901 9.074 -6.287 1.00 0.00 H new ATOM 0 HA LYS A 26 180.758 11.153 -6.834 1.00 0.00 H new ATOM 0 HB2 LYS A 26 178.403 11.409 -5.982 1.00 0.00 H new ATOM 0 HB3 LYS A 26 178.917 10.739 -4.446 1.00 0.00 H new ATOM 0 HG2 LYS A 26 180.746 12.719 -4.667 1.00 0.00 H new ATOM 0 HG3 LYS A 26 179.462 13.427 -5.628 1.00 0.00 H new ATOM 0 HD2 LYS A 26 178.450 12.233 -3.137 1.00 0.00 H new ATOM 0 HD3 LYS A 26 179.660 13.463 -2.833 1.00 0.00 H new ATOM 0 HE2 LYS A 26 178.416 15.119 -4.086 1.00 0.00 H new ATOM 0 HE3 LYS A 26 177.309 13.910 -4.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 176.325 15.152 -2.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 176.510 13.524 -2.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 177.582 14.696 -1.846 1.00 0.00 H new ATOM 428 N LEU A 27 181.534 9.054 -4.493 1.00 0.00 N ATOM 429 CA LEU A 27 182.571 8.661 -3.543 1.00 0.00 C ATOM 430 C LEU A 27 183.939 8.568 -4.222 1.00 0.00 C ATOM 431 O LEU A 27 184.966 8.481 -3.552 1.00 0.00 O ATOM 432 CB LEU A 27 182.214 7.320 -2.895 1.00 0.00 C ATOM 433 CG LEU A 27 182.088 7.353 -1.370 1.00 0.00 C ATOM 434 CD1 LEU A 27 180.891 6.531 -0.914 1.00 0.00 C ATOM 435 CD2 LEU A 27 183.365 6.844 -0.719 1.00 0.00 C ATOM 0 H LEU A 27 180.847 8.327 -4.691 1.00 0.00 H new ATOM 0 HA LEU A 27 182.628 9.428 -2.771 1.00 0.00 H new ATOM 0 HB2 LEU A 27 181.271 6.970 -3.315 1.00 0.00 H new ATOM 0 HB3 LEU A 27 182.975 6.588 -3.166 1.00 0.00 H new ATOM 0 HG LEU A 27 181.932 8.386 -1.060 1.00 0.00 H new ATOM 0 HD11 LEU A 27 180.818 6.567 0.173 1.00 0.00 H new ATOM 0 HD12 LEU A 27 179.981 6.940 -1.352 1.00 0.00 H new ATOM 0 HD13 LEU A 27 181.016 5.497 -1.236 1.00 0.00 H new ATOM 0 HD21 LEU A 27 183.258 6.874 0.365 1.00 0.00 H new ATOM 0 HD22 LEU A 27 183.551 5.818 -1.037 1.00 0.00 H new ATOM 0 HD23 LEU A 27 184.202 7.474 -1.019 1.00 0.00 H new ATOM 447 N GLU A 28 183.949 8.587 -5.552 1.00 0.00 N ATOM 448 CA GLU A 28 185.196 8.503 -6.303 1.00 0.00 C ATOM 449 C GLU A 28 186.098 9.703 -6.012 1.00 0.00 C ATOM 450 O GLU A 28 187.300 9.662 -6.275 1.00 0.00 O ATOM 451 CB GLU A 28 184.906 8.420 -7.805 1.00 0.00 C ATOM 452 CG GLU A 28 184.299 9.689 -8.381 1.00 0.00 C ATOM 453 CD GLU A 28 185.293 10.495 -9.195 1.00 0.00 C ATOM 454 OE1 GLU A 28 186.187 11.122 -8.588 1.00 0.00 O ATOM 455 OE2 GLU A 28 185.180 10.498 -10.439 1.00 0.00 O ATOM 0 H GLU A 28 183.111 8.660 -6.129 1.00 0.00 H new ATOM 0 HA GLU A 28 185.717 7.599 -5.988 1.00 0.00 H new ATOM 0 HB2 GLU A 28 185.833 8.199 -8.333 1.00 0.00 H new ATOM 0 HB3 GLU A 28 184.228 7.587 -7.990 1.00 0.00 H new ATOM 0 HG2 GLU A 28 183.448 9.427 -9.010 1.00 0.00 H new ATOM 0 HG3 GLU A 28 183.916 10.306 -7.568 1.00 0.00 H new ATOM 462 N LYS A 29 185.514 10.769 -5.469 1.00 0.00 N ATOM 463 CA LYS A 29 186.271 11.972 -5.151 1.00 0.00 C ATOM 464 C LYS A 29 186.660 12.009 -3.676 1.00 0.00 C ATOM 465 O LYS A 29 186.831 13.082 -3.096 1.00 0.00 O ATOM 466 CB LYS A 29 185.455 13.219 -5.504 1.00 0.00 C ATOM 467 CG LYS A 29 186.230 14.519 -5.345 1.00 0.00 C ATOM 468 CD LYS A 29 186.388 15.244 -6.672 1.00 0.00 C ATOM 469 CE LYS A 29 187.639 14.790 -7.409 1.00 0.00 C ATOM 470 NZ LYS A 29 188.748 15.773 -7.279 1.00 0.00 N ATOM 0 H LYS A 29 184.521 10.822 -5.241 1.00 0.00 H new ATOM 0 HA LYS A 29 187.185 11.958 -5.744 1.00 0.00 H new ATOM 0 HB2 LYS A 29 185.108 13.136 -6.534 1.00 0.00 H new ATOM 0 HB3 LYS A 29 184.569 13.254 -4.871 1.00 0.00 H new ATOM 0 HG2 LYS A 29 185.714 15.166 -4.636 1.00 0.00 H new ATOM 0 HG3 LYS A 29 187.214 14.308 -4.926 1.00 0.00 H new ATOM 0 HD2 LYS A 29 185.512 15.062 -7.294 1.00 0.00 H new ATOM 0 HD3 LYS A 29 186.437 16.319 -6.497 1.00 0.00 H new ATOM 0 HE2 LYS A 29 187.961 13.825 -7.017 1.00 0.00 H new ATOM 0 HE3 LYS A 29 187.406 14.643 -8.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 189.582 15.426 -7.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 188.450 16.687 -7.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 188.989 15.894 -6.274 1.00 0.00 H new ATOM 484 N TRP A 30 186.803 10.832 -3.073 1.00 0.00 N ATOM 485 CA TRP A 30 187.178 10.741 -1.664 1.00 0.00 C ATOM 486 C TRP A 30 188.626 10.281 -1.506 1.00 0.00 C ATOM 487 O TRP A 30 189.025 9.829 -0.435 1.00 0.00 O ATOM 488 CB TRP A 30 186.244 9.780 -0.927 1.00 0.00 C ATOM 489 CG TRP A 30 185.284 10.471 -0.010 1.00 0.00 C ATOM 490 CD1 TRP A 30 183.933 10.585 -0.169 1.00 0.00 C ATOM 491 CD2 TRP A 30 185.602 11.149 1.209 1.00 0.00 C ATOM 492 NE1 TRP A 30 183.393 11.291 0.877 1.00 0.00 N ATOM 493 CE2 TRP A 30 184.398 11.647 1.738 1.00 0.00 C ATOM 494 CE3 TRP A 30 186.792 11.378 1.908 1.00 0.00 C ATOM 495 CZ2 TRP A 30 184.347 12.364 2.932 1.00 0.00 C ATOM 496 CZ3 TRP A 30 186.741 12.091 3.091 1.00 0.00 C ATOM 497 CH2 TRP A 30 185.527 12.575 3.593 1.00 0.00 C ATOM 0 H TRP A 30 186.666 9.933 -3.534 1.00 0.00 H new ATOM 0 HA TRP A 30 187.086 11.736 -1.229 1.00 0.00 H new ATOM 0 HB2 TRP A 30 185.682 9.199 -1.658 1.00 0.00 H new ATOM 0 HB3 TRP A 30 186.842 9.074 -0.350 1.00 0.00 H new ATOM 0 HD1 TRP A 30 183.371 10.179 -0.997 1.00 0.00 H new ATOM 0 HE1 TRP A 30 182.405 11.514 0.994 1.00 0.00 H new ATOM 0 HE3 TRP A 30 187.733 11.005 1.530 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 183.412 12.739 3.321 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 187.654 12.278 3.638 1.00 0.00 H new ATOM 0 HH2 TRP A 30 185.521 13.127 4.522 1.00 0.00 H new ATOM 508 N GLN A 31 189.408 10.392 -2.579 1.00 0.00 N ATOM 509 CA GLN A 31 190.813 9.988 -2.561 1.00 0.00 C ATOM 510 C GLN A 31 190.993 8.536 -2.109 1.00 0.00 C ATOM 511 O GLN A 31 192.116 8.079 -1.897 1.00 0.00 O ATOM 512 CB GLN A 31 191.615 10.939 -1.664 1.00 0.00 C ATOM 513 CG GLN A 31 191.788 10.475 -0.220 1.00 0.00 C ATOM 514 CD GLN A 31 191.498 11.576 0.781 1.00 0.00 C ATOM 515 OE1 GLN A 31 190.688 12.466 0.524 1.00 0.00 O ATOM 516 NE2 GLN A 31 192.161 11.520 1.931 1.00 0.00 N ATOM 0 H GLN A 31 189.090 10.760 -3.476 1.00 0.00 H new ATOM 0 HA GLN A 31 191.190 10.049 -3.582 1.00 0.00 H new ATOM 0 HB2 GLN A 31 192.602 11.083 -2.104 1.00 0.00 H new ATOM 0 HB3 GLN A 31 191.123 11.912 -1.660 1.00 0.00 H new ATOM 0 HG2 GLN A 31 191.124 9.632 -0.031 1.00 0.00 H new ATOM 0 HG3 GLN A 31 192.807 10.117 -0.076 1.00 0.00 H new ATOM 0 HE21 GLN A 31 192.824 10.763 2.101 1.00 0.00 H new ATOM 0 HE22 GLN A 31 192.007 12.234 2.644 1.00 0.00 H new ATOM 525 N THR A 32 189.886 7.820 -1.964 1.00 0.00 N ATOM 526 CA THR A 32 189.925 6.425 -1.538 1.00 0.00 C ATOM 527 C THR A 32 190.309 5.513 -2.697 1.00 0.00 C ATOM 528 O THR A 32 190.056 5.829 -3.860 1.00 0.00 O ATOM 529 CB THR A 32 188.568 6.007 -0.971 1.00 0.00 C ATOM 530 OG1 THR A 32 187.992 7.061 -0.220 1.00 0.00 O ATOM 531 CG2 THR A 32 188.644 4.792 -0.071 1.00 0.00 C ATOM 0 H THR A 32 188.948 8.182 -2.135 1.00 0.00 H new ATOM 0 HA THR A 32 190.682 6.329 -0.759 1.00 0.00 H new ATOM 0 HB THR A 32 187.957 5.760 -1.839 1.00 0.00 H new ATOM 0 HG1 THR A 32 187.124 6.775 0.133 1.00 0.00 H new ATOM 0 HG21 THR A 32 187.647 4.549 0.297 1.00 0.00 H new ATOM 0 HG22 THR A 32 189.039 3.946 -0.634 1.00 0.00 H new ATOM 0 HG23 THR A 32 189.301 5.005 0.773 1.00 0.00 H new ATOM 539 N HIS A 33 190.919 4.379 -2.372 1.00 0.00 N ATOM 540 CA HIS A 33 191.340 3.416 -3.384 1.00 0.00 C ATOM 541 C HIS A 33 190.489 2.146 -3.334 1.00 0.00 C ATOM 542 O HIS A 33 190.761 1.186 -4.056 1.00 0.00 O ATOM 543 CB HIS A 33 192.818 3.063 -3.203 1.00 0.00 C ATOM 544 CG HIS A 33 193.727 4.251 -3.246 1.00 0.00 C ATOM 545 ND1 HIS A 33 194.861 4.304 -4.030 1.00 0.00 N ATOM 546 CD2 HIS A 33 193.666 5.437 -2.595 1.00 0.00 C ATOM 547 CE1 HIS A 33 195.457 5.470 -3.859 1.00 0.00 C ATOM 548 NE2 HIS A 33 194.752 6.175 -2.994 1.00 0.00 N ATOM 0 H HIS A 33 191.134 4.103 -1.414 1.00 0.00 H new ATOM 0 HA HIS A 33 191.200 3.880 -4.361 1.00 0.00 H new ATOM 0 HB2 HIS A 33 192.947 2.552 -2.249 1.00 0.00 H new ATOM 0 HB3 HIS A 33 193.114 2.361 -3.983 1.00 0.00 H new ATOM 0 HD2 HIS A 33 192.905 5.744 -1.893 1.00 0.00 H new ATOM 0 HE1 HIS A 33 196.367 5.792 -4.344 1.00 0.00 H new ATOM 0 HE2 HIS A 33 194.978 7.117 -2.674 1.00 0.00 H new ATOM 557 N LEU A 34 189.459 2.147 -2.481 1.00 0.00 N ATOM 558 CA LEU A 34 188.562 0.999 -2.335 1.00 0.00 C ATOM 559 C LEU A 34 188.331 0.281 -3.665 1.00 0.00 C ATOM 560 O LEU A 34 188.015 0.905 -4.676 1.00 0.00 O ATOM 561 CB LEU A 34 187.225 1.450 -1.732 1.00 0.00 C ATOM 562 CG LEU A 34 186.384 2.422 -2.575 1.00 0.00 C ATOM 563 CD1 LEU A 34 185.429 3.186 -1.678 1.00 0.00 C ATOM 564 CD2 LEU A 34 187.254 3.403 -3.351 1.00 0.00 C ATOM 0 H LEU A 34 189.226 2.936 -1.878 1.00 0.00 H new ATOM 0 HA LEU A 34 189.041 0.288 -1.661 1.00 0.00 H new ATOM 0 HB2 LEU A 34 186.624 0.563 -1.534 1.00 0.00 H new ATOM 0 HB3 LEU A 34 187.426 1.920 -0.769 1.00 0.00 H new ATOM 0 HG LEU A 34 185.823 1.831 -3.299 1.00 0.00 H new ATOM 0 HD11 LEU A 34 184.835 3.874 -2.280 1.00 0.00 H new ATOM 0 HD12 LEU A 34 184.767 2.485 -1.170 1.00 0.00 H new ATOM 0 HD13 LEU A 34 185.997 3.750 -0.938 1.00 0.00 H new ATOM 0 HD21 LEU A 34 186.619 4.071 -3.933 1.00 0.00 H new ATOM 0 HD22 LEU A 34 187.853 3.988 -2.654 1.00 0.00 H new ATOM 0 HD23 LEU A 34 187.913 2.853 -4.022 1.00 0.00 H new ATOM 576 N ILE A 35 188.512 -1.037 -3.659 1.00 0.00 N ATOM 577 CA ILE A 35 188.342 -1.829 -4.876 1.00 0.00 C ATOM 578 C ILE A 35 187.207 -2.842 -4.759 1.00 0.00 C ATOM 579 O ILE A 35 186.502 -3.102 -5.734 1.00 0.00 O ATOM 580 CB ILE A 35 189.638 -2.580 -5.246 1.00 0.00 C ATOM 581 CG1 ILE A 35 190.316 -3.148 -3.990 1.00 0.00 C ATOM 582 CG2 ILE A 35 190.585 -1.665 -6.011 1.00 0.00 C ATOM 583 CD1 ILE A 35 191.162 -2.141 -3.235 1.00 0.00 C ATOM 0 H ILE A 35 188.774 -1.576 -2.834 1.00 0.00 H new ATOM 0 HA ILE A 35 188.093 -1.115 -5.661 1.00 0.00 H new ATOM 0 HB ILE A 35 189.378 -3.417 -5.893 1.00 0.00 H new ATOM 0 HG12 ILE A 35 189.549 -3.537 -3.320 1.00 0.00 H new ATOM 0 HG13 ILE A 35 190.944 -3.991 -4.279 1.00 0.00 H new ATOM 0 HG21 ILE A 35 191.494 -2.211 -6.264 1.00 0.00 H new ATOM 0 HG22 ILE A 35 190.101 -1.323 -6.926 1.00 0.00 H new ATOM 0 HG23 ILE A 35 190.839 -0.805 -5.392 1.00 0.00 H new ATOM 0 HD11 ILE A 35 191.606 -2.620 -2.362 1.00 0.00 H new ATOM 0 HD12 ILE A 35 191.953 -1.769 -3.886 1.00 0.00 H new ATOM 0 HD13 ILE A 35 190.536 -1.309 -2.913 1.00 0.00 H new ATOM 595 N ASN A 36 187.043 -3.429 -3.578 1.00 0.00 N ATOM 596 CA ASN A 36 185.999 -4.430 -3.368 1.00 0.00 C ATOM 597 C ASN A 36 184.885 -3.915 -2.456 1.00 0.00 C ATOM 598 O ASN A 36 184.878 -4.192 -1.255 1.00 0.00 O ATOM 599 CB ASN A 36 186.604 -5.706 -2.780 1.00 0.00 C ATOM 600 CG ASN A 36 186.820 -6.779 -3.830 1.00 0.00 C ATOM 601 OD1 ASN A 36 187.154 -6.482 -4.977 1.00 0.00 O ATOM 602 ND2 ASN A 36 186.627 -8.033 -3.441 1.00 0.00 N ATOM 0 H ASN A 36 187.614 -3.232 -2.756 1.00 0.00 H new ATOM 0 HA ASN A 36 185.556 -4.648 -4.340 1.00 0.00 H new ATOM 0 HB2 ASN A 36 187.556 -5.469 -2.306 1.00 0.00 H new ATOM 0 HB3 ASN A 36 185.947 -6.091 -2.000 1.00 0.00 H new ATOM 0 HD21 ASN A 36 186.755 -8.798 -4.103 1.00 0.00 H new ATOM 0 HD22 ASN A 36 186.351 -8.232 -2.480 1.00 0.00 H new ATOM 609 N PRO A 37 183.920 -3.167 -3.018 1.00 0.00 N ATOM 610 CA PRO A 37 182.794 -2.627 -2.261 1.00 0.00 C ATOM 611 C PRO A 37 181.682 -3.654 -2.086 1.00 0.00 C ATOM 612 O PRO A 37 181.031 -4.049 -3.052 1.00 0.00 O ATOM 613 CB PRO A 37 182.322 -1.472 -3.135 1.00 0.00 C ATOM 614 CG PRO A 37 182.619 -1.918 -4.526 1.00 0.00 C ATOM 615 CD PRO A 37 183.845 -2.794 -4.443 1.00 0.00 C ATOM 0 HA PRO A 37 183.072 -2.331 -1.249 1.00 0.00 H new ATOM 0 HB2 PRO A 37 181.258 -1.278 -2.998 1.00 0.00 H new ATOM 0 HB3 PRO A 37 182.848 -0.549 -2.892 1.00 0.00 H new ATOM 0 HG2 PRO A 37 181.777 -2.468 -4.945 1.00 0.00 H new ATOM 0 HG3 PRO A 37 182.797 -1.063 -5.178 1.00 0.00 H new ATOM 0 HD2 PRO A 37 183.752 -3.673 -5.081 1.00 0.00 H new ATOM 0 HD3 PRO A 37 184.740 -2.260 -4.764 1.00 0.00 H new ATOM 623 N HIS A 38 181.476 -4.087 -0.849 1.00 0.00 N ATOM 624 CA HIS A 38 180.445 -5.077 -0.543 1.00 0.00 C ATOM 625 C HIS A 38 179.296 -4.450 0.244 1.00 0.00 C ATOM 626 O HIS A 38 179.437 -4.145 1.427 1.00 0.00 O ATOM 627 CB HIS A 38 181.049 -6.239 0.248 1.00 0.00 C ATOM 628 CG HIS A 38 180.665 -7.587 -0.278 1.00 0.00 C ATOM 629 ND1 HIS A 38 181.554 -8.429 -0.913 1.00 0.00 N ATOM 630 CD2 HIS A 38 179.480 -8.240 -0.259 1.00 0.00 C ATOM 631 CE1 HIS A 38 180.932 -9.541 -1.264 1.00 0.00 C ATOM 632 NE2 HIS A 38 179.672 -9.452 -0.878 1.00 0.00 N ATOM 0 H HIS A 38 182.008 -3.769 -0.039 1.00 0.00 H new ATOM 0 HA HIS A 38 180.047 -5.453 -1.485 1.00 0.00 H new ATOM 0 HB2 HIS A 38 182.135 -6.150 0.236 1.00 0.00 H new ATOM 0 HB3 HIS A 38 180.734 -6.161 1.289 1.00 0.00 H new ATOM 0 HD2 HIS A 38 178.555 -7.876 0.164 1.00 0.00 H new ATOM 0 HE1 HIS A 38 181.378 -10.379 -1.779 1.00 0.00 H new ATOM 0 HE2 HIS A 38 178.958 -10.167 -1.017 1.00 0.00 H new ATOM 641 N ILE A 39 178.158 -4.265 -0.418 1.00 0.00 N ATOM 642 CA ILE A 39 176.988 -3.676 0.225 1.00 0.00 C ATOM 643 C ILE A 39 176.000 -4.756 0.657 1.00 0.00 C ATOM 644 O ILE A 39 175.447 -5.474 -0.177 1.00 0.00 O ATOM 645 CB ILE A 39 176.270 -2.677 -0.709 1.00 0.00 C ATOM 646 CG1 ILE A 39 177.171 -1.471 -0.997 1.00 0.00 C ATOM 647 CG2 ILE A 39 174.953 -2.215 -0.096 1.00 0.00 C ATOM 648 CD1 ILE A 39 178.431 -1.816 -1.760 1.00 0.00 C ATOM 0 H ILE A 39 178.021 -4.514 -1.398 1.00 0.00 H new ATOM 0 HA ILE A 39 177.346 -3.140 1.104 1.00 0.00 H new ATOM 0 HB ILE A 39 176.053 -3.185 -1.649 1.00 0.00 H new ATOM 0 HG12 ILE A 39 176.604 -0.734 -1.565 1.00 0.00 H new ATOM 0 HG13 ILE A 39 177.447 -1.002 -0.052 1.00 0.00 H new ATOM 0 HG21 ILE A 39 174.464 -1.512 -0.771 1.00 0.00 H new ATOM 0 HG22 ILE A 39 174.304 -3.076 0.063 1.00 0.00 H new ATOM 0 HG23 ILE A 39 175.148 -1.726 0.859 1.00 0.00 H new ATOM 0 HD11 ILE A 39 179.016 -0.911 -1.925 1.00 0.00 H new ATOM 0 HD12 ILE A 39 179.021 -2.529 -1.184 1.00 0.00 H new ATOM 0 HD13 ILE A 39 178.165 -2.257 -2.721 1.00 0.00 H new ATOM 660 N ILE A 40 175.777 -4.864 1.963 1.00 0.00 N ATOM 661 CA ILE A 40 174.850 -5.851 2.499 1.00 0.00 C ATOM 662 C ILE A 40 173.644 -5.177 3.145 1.00 0.00 C ATOM 663 O ILE A 40 173.632 -4.928 4.352 1.00 0.00 O ATOM 664 CB ILE A 40 175.534 -6.767 3.534 1.00 0.00 C ATOM 665 CG1 ILE A 40 176.774 -7.424 2.927 1.00 0.00 C ATOM 666 CG2 ILE A 40 174.562 -7.828 4.037 1.00 0.00 C ATOM 667 CD1 ILE A 40 178.046 -6.636 3.148 1.00 0.00 C ATOM 0 H ILE A 40 176.226 -4.280 2.668 1.00 0.00 H new ATOM 0 HA ILE A 40 174.515 -6.459 1.659 1.00 0.00 H new ATOM 0 HB ILE A 40 175.844 -6.156 4.382 1.00 0.00 H new ATOM 0 HG12 ILE A 40 176.894 -8.419 3.355 1.00 0.00 H new ATOM 0 HG13 ILE A 40 176.619 -7.554 1.856 1.00 0.00 H new ATOM 0 HG21 ILE A 40 175.063 -8.464 4.766 1.00 0.00 H new ATOM 0 HG22 ILE A 40 173.705 -7.344 4.506 1.00 0.00 H new ATOM 0 HG23 ILE A 40 174.221 -8.436 3.199 1.00 0.00 H new ATOM 0 HD11 ILE A 40 178.884 -7.162 2.691 1.00 0.00 H new ATOM 0 HD12 ILE A 40 177.946 -5.649 2.695 1.00 0.00 H new ATOM 0 HD13 ILE A 40 178.226 -6.528 4.218 1.00 0.00 H new ATOM 679 N LEU A 41 172.629 -4.882 2.338 1.00 0.00 N ATOM 680 CA LEU A 41 171.419 -4.238 2.838 1.00 0.00 C ATOM 681 C LEU A 41 170.354 -5.279 3.172 1.00 0.00 C ATOM 682 O LEU A 41 169.662 -5.780 2.289 1.00 0.00 O ATOM 683 CB LEU A 41 170.881 -3.244 1.803 1.00 0.00 C ATOM 684 CG LEU A 41 169.465 -2.719 2.073 1.00 0.00 C ATOM 685 CD1 LEU A 41 169.450 -1.198 2.092 1.00 0.00 C ATOM 686 CD2 LEU A 41 168.493 -3.253 1.032 1.00 0.00 C ATOM 0 H LEU A 41 172.620 -5.078 1.337 1.00 0.00 H new ATOM 0 HA LEU A 41 171.670 -3.696 3.750 1.00 0.00 H new ATOM 0 HB2 LEU A 41 171.562 -2.394 1.751 1.00 0.00 H new ATOM 0 HB3 LEU A 41 170.893 -3.722 0.824 1.00 0.00 H new ATOM 0 HG LEU A 41 169.148 -3.074 3.054 1.00 0.00 H new ATOM 0 HD11 LEU A 41 168.436 -0.847 2.285 1.00 0.00 H new ATOM 0 HD12 LEU A 41 170.115 -0.837 2.877 1.00 0.00 H new ATOM 0 HD13 LEU A 41 169.788 -0.819 1.128 1.00 0.00 H new ATOM 0 HD21 LEU A 41 167.493 -2.871 1.238 1.00 0.00 H new ATOM 0 HD22 LEU A 41 168.808 -2.929 0.040 1.00 0.00 H new ATOM 0 HD23 LEU A 41 168.480 -4.342 1.071 1.00 0.00 H new ATOM 698 N SER A 42 170.232 -5.600 4.452 1.00 0.00 N ATOM 699 CA SER A 42 169.254 -6.586 4.896 1.00 0.00 C ATOM 700 C SER A 42 168.120 -5.926 5.673 1.00 0.00 C ATOM 701 O SER A 42 168.354 -5.092 6.549 1.00 0.00 O ATOM 702 CB SER A 42 169.941 -7.647 5.753 1.00 0.00 C ATOM 703 OG SER A 42 171.017 -8.245 5.049 1.00 0.00 O ATOM 0 H SER A 42 170.795 -5.195 5.200 1.00 0.00 H new ATOM 0 HA SER A 42 168.821 -7.062 4.016 1.00 0.00 H new ATOM 0 HB2 SER A 42 170.310 -7.194 6.673 1.00 0.00 H new ATOM 0 HB3 SER A 42 169.219 -8.412 6.041 1.00 0.00 H new ATOM 0 HG SER A 42 171.342 -9.024 5.548 1.00 0.00 H new ATOM 709 N LYS A 43 166.891 -6.305 5.339 1.00 0.00 N ATOM 710 CA LYS A 43 165.713 -5.753 5.995 1.00 0.00 C ATOM 711 C LYS A 43 165.443 -6.457 7.319 1.00 0.00 C ATOM 712 O LYS A 43 164.915 -7.569 7.347 1.00 0.00 O ATOM 713 CB LYS A 43 164.495 -5.878 5.080 1.00 0.00 C ATOM 714 CG LYS A 43 163.305 -5.042 5.525 1.00 0.00 C ATOM 715 CD LYS A 43 162.249 -5.895 6.209 1.00 0.00 C ATOM 716 CE LYS A 43 161.542 -6.807 5.219 1.00 0.00 C ATOM 717 NZ LYS A 43 160.375 -7.497 5.834 1.00 0.00 N ATOM 0 H LYS A 43 166.685 -6.994 4.616 1.00 0.00 H new ATOM 0 HA LYS A 43 165.902 -4.699 6.200 1.00 0.00 H new ATOM 0 HB2 LYS A 43 164.779 -5.581 4.070 1.00 0.00 H new ATOM 0 HB3 LYS A 43 164.194 -6.925 5.032 1.00 0.00 H new ATOM 0 HG2 LYS A 43 163.642 -4.262 6.208 1.00 0.00 H new ATOM 0 HG3 LYS A 43 162.867 -4.542 4.661 1.00 0.00 H new ATOM 0 HD2 LYS A 43 162.715 -6.496 6.990 1.00 0.00 H new ATOM 0 HD3 LYS A 43 161.518 -5.250 6.697 1.00 0.00 H new ATOM 0 HE2 LYS A 43 161.208 -6.222 4.362 1.00 0.00 H new ATOM 0 HE3 LYS A 43 162.246 -7.550 4.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 159.921 -8.109 5.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 160.697 -8.075 6.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 159.691 -6.789 6.170 1.00 0.00 H new ATOM 731 N GLU A 44 165.802 -5.799 8.416 1.00 0.00 N ATOM 732 CA GLU A 44 165.593 -6.359 9.745 1.00 0.00 C ATOM 733 C GLU A 44 164.267 -5.876 10.330 1.00 0.00 C ATOM 734 O GLU A 44 163.885 -4.722 10.146 1.00 0.00 O ATOM 735 CB GLU A 44 166.751 -5.970 10.668 1.00 0.00 C ATOM 736 CG GLU A 44 166.636 -6.547 12.071 1.00 0.00 C ATOM 737 CD GLU A 44 167.583 -5.883 13.051 1.00 0.00 C ATOM 738 OE1 GLU A 44 168.812 -6.017 12.874 1.00 0.00 O ATOM 739 OE2 GLU A 44 167.096 -5.229 13.997 1.00 0.00 O ATOM 0 H GLU A 44 166.239 -4.877 8.410 1.00 0.00 H new ATOM 0 HA GLU A 44 165.557 -7.445 9.661 1.00 0.00 H new ATOM 0 HB2 GLU A 44 167.687 -6.306 10.222 1.00 0.00 H new ATOM 0 HB3 GLU A 44 166.801 -4.883 10.735 1.00 0.00 H new ATOM 0 HG2 GLU A 44 165.612 -6.431 12.425 1.00 0.00 H new ATOM 0 HG3 GLU A 44 166.843 -7.617 12.039 1.00 0.00 H new ATOM 746 N PRO A 45 163.542 -6.759 11.042 1.00 0.00 N ATOM 747 CA PRO A 45 162.253 -6.421 11.651 1.00 0.00 C ATOM 748 C PRO A 45 162.234 -5.033 12.281 1.00 0.00 C ATOM 749 O PRO A 45 161.245 -4.307 12.178 1.00 0.00 O ATOM 750 CB PRO A 45 162.108 -7.492 12.726 1.00 0.00 C ATOM 751 CG PRO A 45 162.774 -8.688 12.141 1.00 0.00 C ATOM 752 CD PRO A 45 163.919 -8.164 11.311 1.00 0.00 C ATOM 0 HA PRO A 45 161.447 -6.397 10.917 1.00 0.00 H new ATOM 0 HB2 PRO A 45 162.583 -7.187 13.658 1.00 0.00 H new ATOM 0 HB3 PRO A 45 161.060 -7.690 12.952 1.00 0.00 H new ATOM 0 HG2 PRO A 45 163.134 -9.356 12.924 1.00 0.00 H new ATOM 0 HG3 PRO A 45 162.078 -9.261 11.528 1.00 0.00 H new ATOM 0 HD2 PRO A 45 164.865 -8.229 11.848 1.00 0.00 H new ATOM 0 HD3 PRO A 45 164.037 -8.731 10.388 1.00 0.00 H new ATOM 760 N GLN A 46 163.324 -4.678 12.950 1.00 0.00 N ATOM 761 CA GLN A 46 163.423 -3.386 13.614 1.00 0.00 C ATOM 762 C GLN A 46 164.230 -2.384 12.787 1.00 0.00 C ATOM 763 O GLN A 46 165.130 -1.724 13.303 1.00 0.00 O ATOM 764 CB GLN A 46 164.058 -3.561 14.994 1.00 0.00 C ATOM 765 CG GLN A 46 163.507 -2.605 16.041 1.00 0.00 C ATOM 766 CD GLN A 46 162.921 -3.326 17.240 1.00 0.00 C ATOM 767 OE1 GLN A 46 163.228 -3.001 18.386 1.00 0.00 O ATOM 768 NE2 GLN A 46 162.070 -4.312 16.978 1.00 0.00 N ATOM 0 H GLN A 46 164.151 -5.267 13.047 1.00 0.00 H new ATOM 0 HA GLN A 46 162.415 -2.986 13.723 1.00 0.00 H new ATOM 0 HB2 GLN A 46 163.900 -4.586 15.330 1.00 0.00 H new ATOM 0 HB3 GLN A 46 165.135 -3.415 14.911 1.00 0.00 H new ATOM 0 HG2 GLN A 46 164.303 -1.940 16.375 1.00 0.00 H new ATOM 0 HG3 GLN A 46 162.739 -1.979 15.587 1.00 0.00 H new ATOM 0 HE21 GLN A 46 161.844 -4.547 16.012 1.00 0.00 H new ATOM 0 HE22 GLN A 46 161.642 -4.834 17.743 1.00 0.00 H new ATOM 777 N GLY A 47 163.893 -2.266 11.504 1.00 0.00 N ATOM 778 CA GLY A 47 164.589 -1.330 10.640 1.00 0.00 C ATOM 779 C GLY A 47 165.536 -2.005 9.663 1.00 0.00 C ATOM 780 O GLY A 47 165.776 -3.208 9.748 1.00 0.00 O ATOM 0 H GLY A 47 163.153 -2.801 11.050 1.00 0.00 H new ATOM 0 HA2 GLY A 47 163.856 -0.748 10.082 1.00 0.00 H new ATOM 0 HA3 GLY A 47 165.152 -0.628 11.255 1.00 0.00 H new ATOM 784 N PHE A 48 166.073 -1.217 8.736 1.00 0.00 N ATOM 785 CA PHE A 48 167.001 -1.725 7.733 1.00 0.00 C ATOM 786 C PHE A 48 168.422 -1.790 8.288 1.00 0.00 C ATOM 787 O PHE A 48 168.892 -0.846 8.925 1.00 0.00 O ATOM 788 CB PHE A 48 166.978 -0.826 6.494 1.00 0.00 C ATOM 789 CG PHE A 48 166.183 -1.384 5.348 1.00 0.00 C ATOM 790 CD1 PHE A 48 166.546 -2.579 4.750 1.00 0.00 C ATOM 791 CD2 PHE A 48 165.080 -0.704 4.864 1.00 0.00 C ATOM 792 CE1 PHE A 48 165.818 -3.087 3.690 1.00 0.00 C ATOM 793 CE2 PHE A 48 164.348 -1.205 3.806 1.00 0.00 C ATOM 794 CZ PHE A 48 164.718 -2.397 3.217 1.00 0.00 C ATOM 0 H PHE A 48 165.879 -0.218 8.659 1.00 0.00 H new ATOM 0 HA PHE A 48 166.686 -2.732 7.460 1.00 0.00 H new ATOM 0 HB2 PHE A 48 166.566 0.145 6.770 1.00 0.00 H new ATOM 0 HB3 PHE A 48 168.002 -0.655 6.163 1.00 0.00 H new ATOM 0 HD1 PHE A 48 167.407 -3.120 5.115 1.00 0.00 H new ATOM 0 HD2 PHE A 48 164.788 0.231 5.319 1.00 0.00 H new ATOM 0 HE1 PHE A 48 166.108 -4.021 3.233 1.00 0.00 H new ATOM 0 HE2 PHE A 48 163.487 -0.665 3.440 1.00 0.00 H new ATOM 0 HZ PHE A 48 164.149 -2.790 2.388 1.00 0.00 H new ATOM 804 N VAL A 49 169.098 -2.906 8.034 1.00 0.00 N ATOM 805 CA VAL A 49 170.470 -3.097 8.496 1.00 0.00 C ATOM 806 C VAL A 49 171.443 -3.076 7.324 1.00 0.00 C ATOM 807 O VAL A 49 171.864 -4.124 6.833 1.00 0.00 O ATOM 808 CB VAL A 49 170.628 -4.427 9.259 1.00 0.00 C ATOM 809 CG1 VAL A 49 172.044 -4.572 9.798 1.00 0.00 C ATOM 810 CG2 VAL A 49 169.612 -4.516 10.384 1.00 0.00 C ATOM 0 H VAL A 49 168.718 -3.694 7.510 1.00 0.00 H new ATOM 0 HA VAL A 49 170.697 -2.274 9.173 1.00 0.00 H new ATOM 0 HB VAL A 49 170.444 -5.247 8.565 1.00 0.00 H new ATOM 0 HG11 VAL A 49 172.135 -5.517 10.333 1.00 0.00 H new ATOM 0 HG12 VAL A 49 172.752 -4.555 8.970 1.00 0.00 H new ATOM 0 HG13 VAL A 49 172.261 -3.748 10.478 1.00 0.00 H new ATOM 0 HG21 VAL A 49 169.737 -5.461 10.913 1.00 0.00 H new ATOM 0 HG22 VAL A 49 169.764 -3.689 11.078 1.00 0.00 H new ATOM 0 HG23 VAL A 49 168.605 -4.462 9.970 1.00 0.00 H new ATOM 820 N ALA A 50 171.790 -1.877 6.874 1.00 0.00 N ATOM 821 CA ALA A 50 172.708 -1.717 5.753 1.00 0.00 C ATOM 822 C ALA A 50 174.158 -1.828 6.207 1.00 0.00 C ATOM 823 O ALA A 50 174.736 -0.867 6.713 1.00 0.00 O ATOM 824 CB ALA A 50 172.469 -0.383 5.065 1.00 0.00 C ATOM 0 H ALA A 50 171.449 -1.000 7.268 1.00 0.00 H new ATOM 0 HA ALA A 50 172.517 -2.521 5.042 1.00 0.00 H new ATOM 0 HB1 ALA A 50 173.161 -0.275 4.230 1.00 0.00 H new ATOM 0 HB2 ALA A 50 171.444 -0.343 4.695 1.00 0.00 H new ATOM 0 HB3 ALA A 50 172.630 0.427 5.776 1.00 0.00 H new ATOM 830 N ASP A 51 174.744 -3.006 6.020 1.00 0.00 N ATOM 831 CA ASP A 51 176.129 -3.240 6.410 1.00 0.00 C ATOM 832 C ASP A 51 177.027 -3.358 5.182 1.00 0.00 C ATOM 833 O ASP A 51 177.135 -4.425 4.580 1.00 0.00 O ATOM 834 CB ASP A 51 176.235 -4.509 7.259 1.00 0.00 C ATOM 835 CG ASP A 51 176.571 -4.210 8.706 1.00 0.00 C ATOM 836 OD1 ASP A 51 175.893 -3.352 9.308 1.00 0.00 O ATOM 837 OD2 ASP A 51 177.513 -4.832 9.238 1.00 0.00 O ATOM 0 H ASP A 51 174.281 -3.813 5.601 1.00 0.00 H new ATOM 0 HA ASP A 51 176.463 -2.388 7.001 1.00 0.00 H new ATOM 0 HB2 ASP A 51 175.292 -5.053 7.213 1.00 0.00 H new ATOM 0 HB3 ASP A 51 177.000 -5.161 6.838 1.00 0.00 H new ATOM 842 N ALA A 52 177.669 -2.256 4.815 1.00 0.00 N ATOM 843 CA ALA A 52 178.557 -2.243 3.660 1.00 0.00 C ATOM 844 C ALA A 52 180.009 -2.437 4.079 1.00 0.00 C ATOM 845 O ALA A 52 180.383 -2.141 5.212 1.00 0.00 O ATOM 846 CB ALA A 52 178.392 -0.943 2.883 1.00 0.00 C ATOM 0 H ALA A 52 177.592 -1.362 5.299 1.00 0.00 H new ATOM 0 HA ALA A 52 178.284 -3.076 3.012 1.00 0.00 H new ATOM 0 HB1 ALA A 52 179.061 -0.946 2.023 1.00 0.00 H new ATOM 0 HB2 ALA A 52 177.361 -0.852 2.541 1.00 0.00 H new ATOM 0 HB3 ALA A 52 178.636 -0.100 3.529 1.00 0.00 H new ATOM 852 N THR A 53 180.820 -2.937 3.154 1.00 0.00 N ATOM 853 CA THR A 53 182.234 -3.177 3.413 1.00 0.00 C ATOM 854 C THR A 53 183.063 -2.864 2.172 1.00 0.00 C ATOM 855 O THR A 53 183.030 -3.604 1.189 1.00 0.00 O ATOM 856 CB THR A 53 182.458 -4.629 3.839 1.00 0.00 C ATOM 857 OG1 THR A 53 182.381 -5.497 2.721 1.00 0.00 O ATOM 858 CG2 THR A 53 181.455 -5.114 4.864 1.00 0.00 C ATOM 0 H THR A 53 180.519 -3.185 2.212 1.00 0.00 H new ATOM 0 HA THR A 53 182.552 -2.520 4.222 1.00 0.00 H new ATOM 0 HB THR A 53 183.451 -4.648 4.288 1.00 0.00 H new ATOM 0 HG1 THR A 53 182.377 -4.968 1.896 1.00 0.00 H new ATOM 0 HG21 THR A 53 181.671 -6.151 5.122 1.00 0.00 H new ATOM 0 HG22 THR A 53 181.522 -4.496 5.759 1.00 0.00 H new ATOM 0 HG23 THR A 53 180.449 -5.045 4.450 1.00 0.00 H new ATOM 866 N ILE A 54 183.797 -1.759 2.221 1.00 0.00 N ATOM 867 CA ILE A 54 184.627 -1.345 1.094 1.00 0.00 C ATOM 868 C ILE A 54 186.103 -1.600 1.375 1.00 0.00 C ATOM 869 O ILE A 54 186.674 -1.035 2.307 1.00 0.00 O ATOM 870 CB ILE A 54 184.429 0.153 0.745 1.00 0.00 C ATOM 871 CG1 ILE A 54 183.462 0.826 1.726 1.00 0.00 C ATOM 872 CG2 ILE A 54 183.920 0.298 -0.683 1.00 0.00 C ATOM 873 CD1 ILE A 54 183.200 2.283 1.419 1.00 0.00 C ATOM 0 H ILE A 54 183.835 -1.134 3.026 1.00 0.00 H new ATOM 0 HA ILE A 54 184.310 -1.945 0.241 1.00 0.00 H new ATOM 0 HB ILE A 54 185.395 0.651 0.829 1.00 0.00 H new ATOM 0 HG12 ILE A 54 182.515 0.286 1.717 1.00 0.00 H new ATOM 0 HG13 ILE A 54 183.866 0.744 2.735 1.00 0.00 H new ATOM 0 HG21 ILE A 54 183.785 1.354 -0.916 1.00 0.00 H new ATOM 0 HG22 ILE A 54 184.644 -0.136 -1.373 1.00 0.00 H new ATOM 0 HG23 ILE A 54 182.966 -0.220 -0.784 1.00 0.00 H new ATOM 0 HD11 ILE A 54 182.507 2.691 2.155 1.00 0.00 H new ATOM 0 HD12 ILE A 54 184.138 2.837 1.457 1.00 0.00 H new ATOM 0 HD13 ILE A 54 182.766 2.373 0.423 1.00 0.00 H new ATOM 885 N ASN A 55 186.715 -2.455 0.561 1.00 0.00 N ATOM 886 CA ASN A 55 188.126 -2.786 0.722 1.00 0.00 C ATOM 887 C ASN A 55 189.010 -1.589 0.392 1.00 0.00 C ATOM 888 O ASN A 55 189.660 -1.553 -0.655 1.00 0.00 O ATOM 889 CB ASN A 55 188.498 -3.972 -0.173 1.00 0.00 C ATOM 890 CG ASN A 55 189.581 -4.840 0.441 1.00 0.00 C ATOM 891 OD1 ASN A 55 189.381 -6.033 0.668 1.00 0.00 O ATOM 892 ND2 ASN A 55 190.736 -4.243 0.716 1.00 0.00 N ATOM 0 H ASN A 55 186.256 -2.931 -0.216 1.00 0.00 H new ATOM 0 HA ASN A 55 188.292 -3.058 1.764 1.00 0.00 H new ATOM 0 HB2 ASN A 55 187.611 -4.578 -0.357 1.00 0.00 H new ATOM 0 HB3 ASN A 55 188.837 -3.602 -1.140 1.00 0.00 H new ATOM 0 HD21 ASN A 55 191.500 -4.776 1.132 1.00 0.00 H new ATOM 0 HD22 ASN A 55 190.859 -3.251 0.511 1.00 0.00 H new ATOM 899 N THR A 56 189.018 -0.605 1.286 1.00 0.00 N ATOM 900 CA THR A 56 189.818 0.603 1.091 1.00 0.00 C ATOM 901 C THR A 56 191.186 0.470 1.761 1.00 0.00 C ATOM 902 O THR A 56 191.359 -0.319 2.692 1.00 0.00 O ATOM 903 CB THR A 56 189.083 1.845 1.623 1.00 0.00 C ATOM 904 OG1 THR A 56 189.997 2.787 2.156 1.00 0.00 O ATOM 905 CG2 THR A 56 188.063 1.545 2.701 1.00 0.00 C ATOM 0 H THR A 56 188.480 -0.619 2.153 1.00 0.00 H new ATOM 0 HA THR A 56 189.970 0.727 0.019 1.00 0.00 H new ATOM 0 HB THR A 56 188.558 2.243 0.755 1.00 0.00 H new ATOM 0 HG1 THR A 56 189.530 3.629 2.339 1.00 0.00 H new ATOM 0 HG21 THR A 56 187.590 2.473 3.022 1.00 0.00 H new ATOM 0 HG22 THR A 56 187.305 0.868 2.306 1.00 0.00 H new ATOM 0 HG23 THR A 56 188.559 1.077 3.551 1.00 0.00 H new ATOM 913 N PRO A 57 192.178 1.247 1.292 1.00 0.00 N ATOM 914 CA PRO A 57 193.540 1.221 1.838 1.00 0.00 C ATOM 915 C PRO A 57 193.568 1.414 3.350 1.00 0.00 C ATOM 916 O PRO A 57 194.492 0.963 4.025 1.00 0.00 O ATOM 917 CB PRO A 57 194.244 2.392 1.136 1.00 0.00 C ATOM 918 CG PRO A 57 193.159 3.181 0.481 1.00 0.00 C ATOM 919 CD PRO A 57 192.055 2.208 0.192 1.00 0.00 C ATOM 0 HA PRO A 57 194.020 0.258 1.665 1.00 0.00 H new ATOM 0 HB2 PRO A 57 194.795 3.003 1.851 1.00 0.00 H new ATOM 0 HB3 PRO A 57 194.965 2.032 0.402 1.00 0.00 H new ATOM 0 HG2 PRO A 57 192.812 3.982 1.133 1.00 0.00 H new ATOM 0 HG3 PRO A 57 193.516 3.649 -0.436 1.00 0.00 H new ATOM 0 HD2 PRO A 57 191.079 2.693 0.185 1.00 0.00 H new ATOM 0 HD3 PRO A 57 192.180 1.730 -0.780 1.00 0.00 H new ATOM 927 N ASN A 58 192.552 2.086 3.878 1.00 0.00 N ATOM 928 CA ASN A 58 192.468 2.334 5.314 1.00 0.00 C ATOM 929 C ASN A 58 191.622 1.269 6.003 1.00 0.00 C ATOM 930 O ASN A 58 190.879 1.562 6.939 1.00 0.00 O ATOM 931 CB ASN A 58 191.892 3.727 5.598 1.00 0.00 C ATOM 932 CG ASN A 58 190.805 4.130 4.618 1.00 0.00 C ATOM 933 OD1 ASN A 58 189.647 3.736 4.762 1.00 0.00 O ATOM 934 ND2 ASN A 58 191.175 4.918 3.617 1.00 0.00 N ATOM 0 H ASN A 58 191.777 2.468 3.336 1.00 0.00 H new ATOM 0 HA ASN A 58 193.480 2.288 5.716 1.00 0.00 H new ATOM 0 HB2 ASN A 58 191.487 3.747 6.610 1.00 0.00 H new ATOM 0 HB3 ASN A 58 192.697 4.461 5.562 1.00 0.00 H new ATOM 0 HD21 ASN A 58 190.488 5.222 2.927 1.00 0.00 H new ATOM 0 HD22 ASN A 58 192.146 5.220 3.538 1.00 0.00 H new ATOM 941 N GLY A 59 191.743 0.030 5.534 1.00 0.00 N ATOM 942 CA GLY A 59 190.984 -1.058 6.117 1.00 0.00 C ATOM 943 C GLY A 59 189.555 -1.093 5.622 1.00 0.00 C ATOM 944 O GLY A 59 188.945 -0.048 5.396 1.00 0.00 O ATOM 0 H GLY A 59 192.353 -0.238 4.761 1.00 0.00 H new ATOM 0 HA2 GLY A 59 191.471 -2.004 5.881 1.00 0.00 H new ATOM 0 HA3 GLY A 59 190.988 -0.959 7.203 1.00 0.00 H new ATOM 948 N VAL A 60 189.016 -2.295 5.451 1.00 0.00 N ATOM 949 CA VAL A 60 187.647 -2.459 4.976 1.00 0.00 C ATOM 950 C VAL A 60 186.677 -1.585 5.767 1.00 0.00 C ATOM 951 O VAL A 60 186.275 -1.934 6.876 1.00 0.00 O ATOM 952 CB VAL A 60 187.192 -3.927 5.074 1.00 0.00 C ATOM 953 CG1 VAL A 60 185.845 -4.117 4.393 1.00 0.00 C ATOM 954 CG2 VAL A 60 188.238 -4.852 4.468 1.00 0.00 C ATOM 0 H VAL A 60 189.506 -3.170 5.634 1.00 0.00 H new ATOM 0 HA VAL A 60 187.638 -2.150 3.931 1.00 0.00 H new ATOM 0 HB VAL A 60 187.079 -4.183 6.128 1.00 0.00 H new ATOM 0 HG11 VAL A 60 185.541 -5.161 4.473 1.00 0.00 H new ATOM 0 HG12 VAL A 60 185.101 -3.484 4.876 1.00 0.00 H new ATOM 0 HG13 VAL A 60 185.927 -3.843 3.341 1.00 0.00 H new ATOM 0 HG21 VAL A 60 187.899 -5.885 4.546 1.00 0.00 H new ATOM 0 HG22 VAL A 60 188.385 -4.597 3.419 1.00 0.00 H new ATOM 0 HG23 VAL A 60 189.180 -4.737 5.005 1.00 0.00 H new ATOM 964 N LEU A 61 186.302 -0.449 5.185 1.00 0.00 N ATOM 965 CA LEU A 61 185.375 0.471 5.835 1.00 0.00 C ATOM 966 C LEU A 61 183.985 -0.152 5.920 1.00 0.00 C ATOM 967 O LEU A 61 183.385 -0.495 4.900 1.00 0.00 O ATOM 968 CB LEU A 61 185.325 1.799 5.074 1.00 0.00 C ATOM 969 CG LEU A 61 186.255 2.901 5.602 1.00 0.00 C ATOM 970 CD1 LEU A 61 185.622 3.617 6.783 1.00 0.00 C ATOM 971 CD2 LEU A 61 187.612 2.330 5.996 1.00 0.00 C ATOM 0 H LEU A 61 186.625 -0.145 4.267 1.00 0.00 H new ATOM 0 HA LEU A 61 185.727 0.667 6.848 1.00 0.00 H new ATOM 0 HB2 LEU A 61 185.573 1.608 4.030 1.00 0.00 H new ATOM 0 HB3 LEU A 61 184.301 2.171 5.096 1.00 0.00 H new ATOM 0 HG LEU A 61 186.408 3.622 4.799 1.00 0.00 H new ATOM 0 HD11 LEU A 61 186.297 4.394 7.142 1.00 0.00 H new ATOM 0 HD12 LEU A 61 184.681 4.070 6.472 1.00 0.00 H new ATOM 0 HD13 LEU A 61 185.434 2.902 7.584 1.00 0.00 H new ATOM 0 HD21 LEU A 61 188.251 3.132 6.366 1.00 0.00 H new ATOM 0 HD22 LEU A 61 187.479 1.582 6.777 1.00 0.00 H new ATOM 0 HD23 LEU A 61 188.078 1.867 5.126 1.00 0.00 H new ATOM 983 N VAL A 62 183.488 -0.316 7.142 1.00 0.00 N ATOM 984 CA VAL A 62 182.180 -0.922 7.360 1.00 0.00 C ATOM 985 C VAL A 62 181.079 0.131 7.458 1.00 0.00 C ATOM 986 O VAL A 62 181.030 0.908 8.412 1.00 0.00 O ATOM 987 CB VAL A 62 182.179 -1.791 8.636 1.00 0.00 C ATOM 988 CG1 VAL A 62 180.768 -2.253 8.984 1.00 0.00 C ATOM 989 CG2 VAL A 62 183.104 -2.985 8.459 1.00 0.00 C ATOM 0 H VAL A 62 183.971 -0.038 7.996 1.00 0.00 H new ATOM 0 HA VAL A 62 181.976 -1.554 6.496 1.00 0.00 H new ATOM 0 HB VAL A 62 182.545 -1.183 9.463 1.00 0.00 H new ATOM 0 HG11 VAL A 62 180.797 -2.863 9.887 1.00 0.00 H new ATOM 0 HG12 VAL A 62 180.132 -1.384 9.154 1.00 0.00 H new ATOM 0 HG13 VAL A 62 180.365 -2.843 8.161 1.00 0.00 H new ATOM 0 HG21 VAL A 62 183.095 -3.590 9.366 1.00 0.00 H new ATOM 0 HG22 VAL A 62 182.763 -3.588 7.617 1.00 0.00 H new ATOM 0 HG23 VAL A 62 184.118 -2.634 8.267 1.00 0.00 H new ATOM 999 N ALA A 63 180.198 0.146 6.463 1.00 0.00 N ATOM 1000 CA ALA A 63 179.095 1.096 6.432 1.00 0.00 C ATOM 1001 C ALA A 63 177.835 0.495 7.045 1.00 0.00 C ATOM 1002 O ALA A 63 177.112 -0.254 6.389 1.00 0.00 O ATOM 1003 CB ALA A 63 178.829 1.540 5.001 1.00 0.00 C ATOM 0 H ALA A 63 180.228 -0.491 5.667 1.00 0.00 H new ATOM 0 HA ALA A 63 179.376 1.965 7.027 1.00 0.00 H new ATOM 0 HB1 ALA A 63 178.002 2.250 4.988 1.00 0.00 H new ATOM 0 HB2 ALA A 63 179.722 2.015 4.596 1.00 0.00 H new ATOM 0 HB3 ALA A 63 178.572 0.673 4.393 1.00 0.00 H new ATOM 1009 N SER A 64 177.577 0.830 8.303 1.00 0.00 N ATOM 1010 CA SER A 64 176.402 0.323 9.000 1.00 0.00 C ATOM 1011 C SER A 64 175.278 1.354 8.987 1.00 0.00 C ATOM 1012 O SER A 64 175.419 2.445 9.538 1.00 0.00 O ATOM 1013 CB SER A 64 176.758 -0.051 10.440 1.00 0.00 C ATOM 1014 OG SER A 64 178.161 -0.167 10.606 1.00 0.00 O ATOM 0 H SER A 64 178.165 1.450 8.861 1.00 0.00 H new ATOM 0 HA SER A 64 176.056 -0.570 8.479 1.00 0.00 H new ATOM 0 HB2 SER A 64 176.369 0.705 11.122 1.00 0.00 H new ATOM 0 HB3 SER A 64 176.279 -0.994 10.703 1.00 0.00 H new ATOM 0 HG SER A 64 178.362 -0.405 11.535 1.00 0.00 H new ATOM 1020 N GLY A 65 174.165 1.000 8.355 1.00 0.00 N ATOM 1021 CA GLY A 65 173.033 1.905 8.280 1.00 0.00 C ATOM 1022 C GLY A 65 171.788 1.334 8.931 1.00 0.00 C ATOM 1023 O GLY A 65 171.014 0.625 8.291 1.00 0.00 O ATOM 0 H GLY A 65 174.026 0.101 7.893 1.00 0.00 H new ATOM 0 HA2 GLY A 65 173.292 2.847 8.764 1.00 0.00 H new ATOM 0 HA3 GLY A 65 172.821 2.131 7.235 1.00 0.00 H new ATOM 1027 N LYS A 66 171.597 1.647 10.208 1.00 0.00 N ATOM 1028 CA LYS A 66 170.438 1.165 10.949 1.00 0.00 C ATOM 1029 C LYS A 66 169.366 2.244 11.035 1.00 0.00 C ATOM 1030 O LYS A 66 169.541 3.253 11.720 1.00 0.00 O ATOM 1031 CB LYS A 66 170.855 0.722 12.356 1.00 0.00 C ATOM 1032 CG LYS A 66 169.685 0.365 13.262 1.00 0.00 C ATOM 1033 CD LYS A 66 168.782 -0.678 12.626 1.00 0.00 C ATOM 1034 CE LYS A 66 169.405 -2.063 12.686 1.00 0.00 C ATOM 1035 NZ LYS A 66 169.914 -2.387 14.046 1.00 0.00 N ATOM 0 H LYS A 66 172.231 2.233 10.752 1.00 0.00 H new ATOM 0 HA LYS A 66 170.023 0.309 10.417 1.00 0.00 H new ATOM 0 HB2 LYS A 66 171.515 -0.142 12.274 1.00 0.00 H new ATOM 0 HB3 LYS A 66 171.432 1.521 12.822 1.00 0.00 H new ATOM 0 HG2 LYS A 66 170.062 -0.011 14.213 1.00 0.00 H new ATOM 0 HG3 LYS A 66 169.107 1.263 13.481 1.00 0.00 H new ATOM 0 HD2 LYS A 66 167.819 -0.688 13.137 1.00 0.00 H new ATOM 0 HD3 LYS A 66 168.589 -0.409 11.588 1.00 0.00 H new ATOM 0 HE2 LYS A 66 168.665 -2.806 12.389 1.00 0.00 H new ATOM 0 HE3 LYS A 66 170.223 -2.124 11.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 169.950 -3.419 14.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 170.869 -1.991 14.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 169.279 -1.977 14.761 1.00 0.00 H new ATOM 1049 N HIS A 67 168.254 2.028 10.339 1.00 0.00 N ATOM 1050 CA HIS A 67 167.154 2.989 10.347 1.00 0.00 C ATOM 1051 C HIS A 67 165.833 2.314 9.997 1.00 0.00 C ATOM 1052 O HIS A 67 165.813 1.214 9.449 1.00 0.00 O ATOM 1053 CB HIS A 67 167.440 4.133 9.371 1.00 0.00 C ATOM 1054 CG HIS A 67 167.430 5.482 10.018 1.00 0.00 C ATOM 1055 ND1 HIS A 67 168.093 6.621 9.706 1.00 0.00 N flip ATOM 1056 CD2 HIS A 67 166.669 5.776 11.130 1.00 0.00 C flip ATOM 1057 CE1 HIS A 67 167.724 7.570 10.626 1.00 0.00 C flip ATOM 1058 NE2 HIS A 67 166.865 7.037 11.473 1.00 0.00 N flip ATOM 0 H HIS A 67 168.090 1.201 9.765 1.00 0.00 H new ATOM 0 HA HIS A 67 167.069 3.397 11.354 1.00 0.00 H new ATOM 0 HB2 HIS A 67 168.412 3.969 8.905 1.00 0.00 H new ATOM 0 HB3 HIS A 67 166.697 4.115 8.574 1.00 0.00 H new ATOM 0 HD2 HIS A 67 166.015 5.084 11.640 1.00 0.00 H new ATOM 0 HE1 HIS A 67 168.080 8.589 10.652 1.00 0.00 H new ATOM 0 HE2 HIS A 67 166.426 7.517 12.259 1.00 0.00 H new ATOM 1067 N GLU A 68 164.731 2.976 10.330 1.00 0.00 N ATOM 1068 CA GLU A 68 163.402 2.438 10.063 1.00 0.00 C ATOM 1069 C GLU A 68 163.060 2.503 8.577 1.00 0.00 C ATOM 1070 O GLU A 68 162.486 1.566 8.024 1.00 0.00 O ATOM 1071 CB GLU A 68 162.350 3.199 10.870 1.00 0.00 C ATOM 1072 CG GLU A 68 162.753 3.444 12.315 1.00 0.00 C ATOM 1073 CD GLU A 68 161.562 3.708 13.220 1.00 0.00 C ATOM 1074 OE1 GLU A 68 160.423 3.746 12.707 1.00 0.00 O ATOM 1075 OE2 GLU A 68 161.768 3.877 14.440 1.00 0.00 O ATOM 0 H GLU A 68 164.732 3.888 10.786 1.00 0.00 H new ATOM 0 HA GLU A 68 163.403 1.391 10.366 1.00 0.00 H new ATOM 0 HB2 GLU A 68 162.157 4.157 10.388 1.00 0.00 H new ATOM 0 HB3 GLU A 68 161.415 2.639 10.852 1.00 0.00 H new ATOM 0 HG2 GLU A 68 163.301 2.578 12.687 1.00 0.00 H new ATOM 0 HG3 GLU A 68 163.433 4.295 12.359 1.00 0.00 H new ATOM 1082 N ASP A 69 163.405 3.615 7.935 1.00 0.00 N ATOM 1083 CA ASP A 69 163.118 3.788 6.514 1.00 0.00 C ATOM 1084 C ASP A 69 164.290 3.321 5.653 1.00 0.00 C ATOM 1085 O ASP A 69 165.436 3.284 6.103 1.00 0.00 O ATOM 1086 CB ASP A 69 162.784 5.251 6.212 1.00 0.00 C ATOM 1087 CG ASP A 69 161.315 5.452 5.892 1.00 0.00 C ATOM 1088 OD1 ASP A 69 160.822 4.817 4.935 1.00 0.00 O ATOM 1089 OD2 ASP A 69 160.655 6.244 6.597 1.00 0.00 O ATOM 0 H ASP A 69 163.880 4.405 8.372 1.00 0.00 H new ATOM 0 HA ASP A 69 162.253 3.172 6.268 1.00 0.00 H new ATOM 0 HB2 ASP A 69 163.054 5.867 7.069 1.00 0.00 H new ATOM 0 HB3 ASP A 69 163.387 5.593 5.371 1.00 0.00 H new ATOM 1094 N MET A 70 163.983 2.953 4.414 1.00 0.00 N ATOM 1095 CA MET A 70 164.991 2.468 3.478 1.00 0.00 C ATOM 1096 C MET A 70 166.013 3.552 3.134 1.00 0.00 C ATOM 1097 O MET A 70 167.197 3.422 3.447 1.00 0.00 O ATOM 1098 CB MET A 70 164.304 1.953 2.205 1.00 0.00 C ATOM 1099 CG MET A 70 165.244 1.717 1.031 1.00 0.00 C ATOM 1100 SD MET A 70 164.793 2.677 -0.428 1.00 0.00 S ATOM 1101 CE MET A 70 163.223 1.927 -0.858 1.00 0.00 C ATOM 0 H MET A 70 163.037 2.982 4.033 1.00 0.00 H new ATOM 0 HA MET A 70 165.534 1.652 3.954 1.00 0.00 H new ATOM 0 HB2 MET A 70 163.791 1.020 2.437 1.00 0.00 H new ATOM 0 HB3 MET A 70 163.540 2.670 1.904 1.00 0.00 H new ATOM 0 HG2 MET A 70 166.261 1.972 1.328 1.00 0.00 H new ATOM 0 HG3 MET A 70 165.243 0.657 0.778 1.00 0.00 H new ATOM 0 HE1 MET A 70 162.851 2.366 -1.784 1.00 0.00 H new ATOM 0 HE2 MET A 70 163.357 0.854 -0.994 1.00 0.00 H new ATOM 0 HE3 MET A 70 162.504 2.104 -0.058 1.00 0.00 H new ATOM 1111 N TYR A 71 165.554 4.611 2.475 1.00 0.00 N ATOM 1112 CA TYR A 71 166.436 5.706 2.071 1.00 0.00 C ATOM 1113 C TYR A 71 167.245 6.249 3.245 1.00 0.00 C ATOM 1114 O TYR A 71 168.436 6.528 3.106 1.00 0.00 O ATOM 1115 CB TYR A 71 165.628 6.830 1.416 1.00 0.00 C ATOM 1116 CG TYR A 71 165.413 6.660 -0.077 1.00 0.00 C ATOM 1117 CD1 TYR A 71 166.063 5.658 -0.797 1.00 0.00 C ATOM 1118 CD2 TYR A 71 164.558 7.507 -0.771 1.00 0.00 C ATOM 1119 CE1 TYR A 71 165.866 5.510 -2.155 1.00 0.00 C ATOM 1120 CE2 TYR A 71 164.356 7.363 -2.132 1.00 0.00 C ATOM 1121 CZ TYR A 71 165.011 6.364 -2.818 1.00 0.00 C ATOM 1122 OH TYR A 71 164.814 6.218 -4.172 1.00 0.00 O ATOM 0 H TYR A 71 164.577 4.736 2.208 1.00 0.00 H new ATOM 0 HA TYR A 71 167.142 5.304 1.344 1.00 0.00 H new ATOM 0 HB2 TYR A 71 164.656 6.895 1.906 1.00 0.00 H new ATOM 0 HB3 TYR A 71 166.138 7.777 1.592 1.00 0.00 H new ATOM 0 HD1 TYR A 71 166.733 4.985 -0.282 1.00 0.00 H new ATOM 0 HD2 TYR A 71 164.042 8.292 -0.238 1.00 0.00 H new ATOM 0 HE1 TYR A 71 166.379 4.729 -2.696 1.00 0.00 H new ATOM 0 HE2 TYR A 71 163.687 8.031 -2.655 1.00 0.00 H new ATOM 0 HH TYR A 71 164.182 6.898 -4.486 1.00 0.00 H new ATOM 1132 N THR A 72 166.608 6.394 4.398 1.00 0.00 N ATOM 1133 CA THR A 72 167.305 6.898 5.577 1.00 0.00 C ATOM 1134 C THR A 72 168.421 5.941 5.978 1.00 0.00 C ATOM 1135 O THR A 72 169.464 6.360 6.480 1.00 0.00 O ATOM 1136 CB THR A 72 166.331 7.094 6.739 1.00 0.00 C ATOM 1137 OG1 THR A 72 165.109 6.435 6.484 1.00 0.00 O ATOM 1138 CG2 THR A 72 166.019 8.548 7.019 1.00 0.00 C ATOM 0 H THR A 72 165.623 6.174 4.544 1.00 0.00 H new ATOM 0 HA THR A 72 167.743 7.865 5.331 1.00 0.00 H new ATOM 0 HB THR A 72 166.832 6.672 7.610 1.00 0.00 H new ATOM 0 HG1 THR A 72 164.451 7.082 6.155 1.00 0.00 H new ATOM 0 HG21 THR A 72 165.323 8.616 7.855 1.00 0.00 H new ATOM 0 HG22 THR A 72 166.939 9.076 7.269 1.00 0.00 H new ATOM 0 HG23 THR A 72 165.570 9.001 6.135 1.00 0.00 H new ATOM 1146 N ALA A 73 168.195 4.650 5.744 1.00 0.00 N ATOM 1147 CA ALA A 73 169.182 3.630 6.073 1.00 0.00 C ATOM 1148 C ALA A 73 170.470 3.834 5.279 1.00 0.00 C ATOM 1149 O ALA A 73 171.535 4.051 5.856 1.00 0.00 O ATOM 1150 CB ALA A 73 168.613 2.244 5.815 1.00 0.00 C ATOM 0 H ALA A 73 167.337 4.288 5.328 1.00 0.00 H new ATOM 0 HA ALA A 73 169.423 3.720 7.132 1.00 0.00 H new ATOM 0 HB1 ALA A 73 169.361 1.491 6.065 1.00 0.00 H new ATOM 0 HB2 ALA A 73 167.727 2.094 6.432 1.00 0.00 H new ATOM 0 HB3 ALA A 73 168.343 2.152 4.763 1.00 0.00 H new ATOM 1156 N ILE A 74 170.366 3.761 3.955 1.00 0.00 N ATOM 1157 CA ILE A 74 171.534 3.935 3.089 1.00 0.00 C ATOM 1158 C ILE A 74 172.199 5.290 3.326 1.00 0.00 C ATOM 1159 O ILE A 74 173.397 5.453 3.091 1.00 0.00 O ATOM 1160 CB ILE A 74 171.196 3.794 1.583 1.00 0.00 C ATOM 1161 CG1 ILE A 74 169.740 4.197 1.289 1.00 0.00 C ATOM 1162 CG2 ILE A 74 171.474 2.371 1.111 1.00 0.00 C ATOM 1163 CD1 ILE A 74 168.767 3.034 1.249 1.00 0.00 C ATOM 0 H ILE A 74 169.493 3.584 3.459 1.00 0.00 H new ATOM 0 HA ILE A 74 172.222 3.133 3.356 1.00 0.00 H new ATOM 0 HB ILE A 74 171.839 4.478 1.028 1.00 0.00 H new ATOM 0 HG12 ILE A 74 169.411 4.905 2.049 1.00 0.00 H new ATOM 0 HG13 ILE A 74 169.705 4.718 0.332 1.00 0.00 H new ATOM 0 HG21 ILE A 74 171.232 2.285 0.052 1.00 0.00 H new ATOM 0 HG22 ILE A 74 172.528 2.137 1.263 1.00 0.00 H new ATOM 0 HG23 ILE A 74 170.861 1.672 1.681 1.00 0.00 H new ATOM 0 HD11 ILE A 74 167.765 3.405 1.036 1.00 0.00 H new ATOM 0 HD12 ILE A 74 169.068 2.335 0.469 1.00 0.00 H new ATOM 0 HD13 ILE A 74 168.768 2.525 2.213 1.00 0.00 H new ATOM 1175 N ASN A 75 171.424 6.257 3.800 1.00 0.00 N ATOM 1176 CA ASN A 75 171.956 7.584 4.075 1.00 0.00 C ATOM 1177 C ASN A 75 172.773 7.571 5.362 1.00 0.00 C ATOM 1178 O ASN A 75 173.748 8.313 5.504 1.00 0.00 O ATOM 1179 CB ASN A 75 170.818 8.603 4.185 1.00 0.00 C ATOM 1180 CG ASN A 75 170.464 9.220 2.846 1.00 0.00 C ATOM 1181 OD1 ASN A 75 170.821 10.363 2.563 1.00 0.00 O ATOM 1182 ND2 ASN A 75 169.757 8.465 2.014 1.00 0.00 N ATOM 0 H ASN A 75 170.430 6.148 4.001 1.00 0.00 H new ATOM 0 HA ASN A 75 172.606 7.873 3.249 1.00 0.00 H new ATOM 0 HB2 ASN A 75 169.937 8.116 4.602 1.00 0.00 H new ATOM 0 HB3 ASN A 75 171.106 9.391 4.881 1.00 0.00 H new ATOM 0 HD21 ASN A 75 169.489 8.828 1.099 1.00 0.00 H new ATOM 0 HD22 ASN A 75 169.482 7.522 2.290 1.00 0.00 H new ATOM 1189 N GLU A 76 172.370 6.716 6.296 1.00 0.00 N ATOM 1190 CA GLU A 76 173.060 6.596 7.573 1.00 0.00 C ATOM 1191 C GLU A 76 174.399 5.882 7.410 1.00 0.00 C ATOM 1192 O GLU A 76 175.395 6.275 8.015 1.00 0.00 O ATOM 1193 CB GLU A 76 172.183 5.844 8.577 1.00 0.00 C ATOM 1194 CG GLU A 76 171.461 6.756 9.557 1.00 0.00 C ATOM 1195 CD GLU A 76 172.409 7.676 10.301 1.00 0.00 C ATOM 1196 OE1 GLU A 76 172.900 7.279 11.378 1.00 0.00 O ATOM 1197 OE2 GLU A 76 172.660 8.795 9.806 1.00 0.00 O ATOM 0 H GLU A 76 171.567 6.095 6.191 1.00 0.00 H new ATOM 0 HA GLU A 76 173.254 7.601 7.948 1.00 0.00 H new ATOM 0 HB2 GLU A 76 171.446 5.254 8.032 1.00 0.00 H new ATOM 0 HB3 GLU A 76 172.803 5.143 9.135 1.00 0.00 H new ATOM 0 HG2 GLU A 76 170.727 7.355 9.018 1.00 0.00 H new ATOM 0 HG3 GLU A 76 170.911 6.149 10.276 1.00 0.00 H new ATOM 1204 N LEU A 77 174.419 4.832 6.591 1.00 0.00 N ATOM 1205 CA LEU A 77 175.644 4.076 6.365 1.00 0.00 C ATOM 1206 C LEU A 77 176.692 4.935 5.663 1.00 0.00 C ATOM 1207 O LEU A 77 177.867 4.913 6.026 1.00 0.00 O ATOM 1208 CB LEU A 77 175.365 2.803 5.553 1.00 0.00 C ATOM 1209 CG LEU A 77 175.096 3.013 4.061 1.00 0.00 C ATOM 1210 CD1 LEU A 77 176.397 3.196 3.292 1.00 0.00 C ATOM 1211 CD2 LEU A 77 174.303 1.843 3.499 1.00 0.00 C ATOM 0 H LEU A 77 173.607 4.489 6.078 1.00 0.00 H new ATOM 0 HA LEU A 77 176.036 3.781 7.338 1.00 0.00 H new ATOM 0 HB2 LEU A 77 176.218 2.133 5.659 1.00 0.00 H new ATOM 0 HB3 LEU A 77 174.505 2.296 5.991 1.00 0.00 H new ATOM 0 HG LEU A 77 174.507 3.923 3.945 1.00 0.00 H new ATOM 0 HD11 LEU A 77 176.177 3.343 2.235 1.00 0.00 H new ATOM 0 HD12 LEU A 77 176.928 4.067 3.677 1.00 0.00 H new ATOM 0 HD13 LEU A 77 177.019 2.309 3.413 1.00 0.00 H new ATOM 0 HD21 LEU A 77 174.119 2.005 2.437 1.00 0.00 H new ATOM 0 HD22 LEU A 77 174.870 0.922 3.632 1.00 0.00 H new ATOM 0 HD23 LEU A 77 173.351 1.763 4.024 1.00 0.00 H new ATOM 1223 N ILE A 78 176.260 5.692 4.657 1.00 0.00 N ATOM 1224 CA ILE A 78 177.173 6.555 3.914 1.00 0.00 C ATOM 1225 C ILE A 78 177.756 7.642 4.815 1.00 0.00 C ATOM 1226 O ILE A 78 178.923 8.006 4.684 1.00 0.00 O ATOM 1227 CB ILE A 78 176.473 7.204 2.700 1.00 0.00 C ATOM 1228 CG1 ILE A 78 177.492 7.950 1.824 1.00 0.00 C ATOM 1229 CG2 ILE A 78 175.354 8.134 3.150 1.00 0.00 C ATOM 1230 CD1 ILE A 78 177.938 9.287 2.383 1.00 0.00 C ATOM 0 H ILE A 78 175.291 5.725 4.340 1.00 0.00 H new ATOM 0 HA ILE A 78 177.985 5.925 3.550 1.00 0.00 H new ATOM 0 HB ILE A 78 176.026 6.412 2.100 1.00 0.00 H new ATOM 0 HG12 ILE A 78 178.368 7.316 1.688 1.00 0.00 H new ATOM 0 HG13 ILE A 78 177.057 8.109 0.837 1.00 0.00 H new ATOM 0 HG21 ILE A 78 174.877 8.578 2.277 1.00 0.00 H new ATOM 0 HG22 ILE A 78 174.616 7.567 3.718 1.00 0.00 H new ATOM 0 HG23 ILE A 78 175.767 8.923 3.778 1.00 0.00 H new ATOM 0 HD11 ILE A 78 178.656 9.745 1.702 1.00 0.00 H new ATOM 0 HD12 ILE A 78 177.074 9.942 2.493 1.00 0.00 H new ATOM 0 HD13 ILE A 78 178.405 9.137 3.356 1.00 0.00 H new ATOM 1242 N ASN A 79 176.936 8.158 5.728 1.00 0.00 N ATOM 1243 CA ASN A 79 177.378 9.202 6.648 1.00 0.00 C ATOM 1244 C ASN A 79 178.400 8.656 7.646 1.00 0.00 C ATOM 1245 O ASN A 79 179.494 9.206 7.801 1.00 0.00 O ATOM 1246 CB ASN A 79 176.164 9.808 7.374 1.00 0.00 C ATOM 1247 CG ASN A 79 176.275 9.760 8.889 1.00 0.00 C ATOM 1248 OD1 ASN A 79 176.952 10.587 9.500 1.00 0.00 O ATOM 1249 ND2 ASN A 79 175.607 8.787 9.501 1.00 0.00 N ATOM 0 H ASN A 79 175.965 7.871 5.850 1.00 0.00 H new ATOM 0 HA ASN A 79 177.869 9.989 6.075 1.00 0.00 H new ATOM 0 HB2 ASN A 79 176.043 10.845 7.060 1.00 0.00 H new ATOM 0 HB3 ASN A 79 175.264 9.275 7.067 1.00 0.00 H new ATOM 0 HD21 ASN A 79 175.643 8.704 10.517 1.00 0.00 H new ATOM 0 HD22 ASN A 79 175.058 8.123 8.955 1.00 0.00 H new ATOM 1256 N LYS A 80 178.035 7.572 8.326 1.00 0.00 N ATOM 1257 CA LYS A 80 178.913 6.952 9.312 1.00 0.00 C ATOM 1258 C LYS A 80 180.294 6.676 8.724 1.00 0.00 C ATOM 1259 O LYS A 80 181.313 6.994 9.336 1.00 0.00 O ATOM 1260 CB LYS A 80 178.295 5.654 9.836 1.00 0.00 C ATOM 1261 CG LYS A 80 177.508 5.835 11.124 1.00 0.00 C ATOM 1262 CD LYS A 80 176.951 4.513 11.630 1.00 0.00 C ATOM 1263 CE LYS A 80 175.430 4.490 11.576 1.00 0.00 C ATOM 1264 NZ LYS A 80 174.912 4.883 10.236 1.00 0.00 N ATOM 0 H LYS A 80 177.136 7.105 8.211 1.00 0.00 H new ATOM 0 HA LYS A 80 179.030 7.649 10.142 1.00 0.00 H new ATOM 0 HB2 LYS A 80 177.637 5.240 9.072 1.00 0.00 H new ATOM 0 HB3 LYS A 80 179.088 4.925 10.003 1.00 0.00 H new ATOM 0 HG2 LYS A 80 178.152 6.275 11.886 1.00 0.00 H new ATOM 0 HG3 LYS A 80 176.689 6.535 10.956 1.00 0.00 H new ATOM 0 HD2 LYS A 80 177.350 3.696 11.029 1.00 0.00 H new ATOM 0 HD3 LYS A 80 177.282 4.346 12.655 1.00 0.00 H new ATOM 0 HE2 LYS A 80 175.074 3.490 11.823 1.00 0.00 H new ATOM 0 HE3 LYS A 80 175.030 5.166 12.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 174.092 5.512 10.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 175.658 5.379 9.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 174.624 4.032 9.712 1.00 0.00 H new ATOM 1278 N LEU A 81 180.323 6.087 7.532 1.00 0.00 N ATOM 1279 CA LEU A 81 181.585 5.777 6.870 1.00 0.00 C ATOM 1280 C LEU A 81 182.371 7.052 6.589 1.00 0.00 C ATOM 1281 O LEU A 81 183.594 7.072 6.692 1.00 0.00 O ATOM 1282 CB LEU A 81 181.344 5.024 5.558 1.00 0.00 C ATOM 1283 CG LEU A 81 181.338 3.494 5.658 1.00 0.00 C ATOM 1284 CD1 LEU A 81 181.566 2.873 4.288 1.00 0.00 C ATOM 1285 CD2 LEU A 81 182.391 3.000 6.641 1.00 0.00 C ATOM 0 H LEU A 81 179.491 5.816 7.007 1.00 0.00 H new ATOM 0 HA LEU A 81 182.163 5.141 7.540 1.00 0.00 H new ATOM 0 HB2 LEU A 81 180.387 5.346 5.147 1.00 0.00 H new ATOM 0 HB3 LEU A 81 182.113 5.320 4.845 1.00 0.00 H new ATOM 0 HG LEU A 81 180.360 3.187 6.029 1.00 0.00 H new ATOM 0 HD11 LEU A 81 181.559 1.787 4.375 1.00 0.00 H new ATOM 0 HD12 LEU A 81 180.773 3.188 3.609 1.00 0.00 H new ATOM 0 HD13 LEU A 81 182.529 3.199 3.896 1.00 0.00 H new ATOM 0 HD21 LEU A 81 182.361 1.911 6.689 1.00 0.00 H new ATOM 0 HD22 LEU A 81 183.378 3.322 6.309 1.00 0.00 H new ATOM 0 HD23 LEU A 81 182.188 3.413 7.629 1.00 0.00 H new ATOM 1297 N GLU A 82 181.658 8.119 6.236 1.00 0.00 N ATOM 1298 CA GLU A 82 182.292 9.399 5.943 1.00 0.00 C ATOM 1299 C GLU A 82 183.224 9.811 7.077 1.00 0.00 C ATOM 1300 O GLU A 82 184.417 10.039 6.865 1.00 0.00 O ATOM 1301 CB GLU A 82 181.234 10.479 5.717 1.00 0.00 C ATOM 1302 CG GLU A 82 181.809 11.805 5.244 1.00 0.00 C ATOM 1303 CD GLU A 82 180.995 12.994 5.714 1.00 0.00 C ATOM 1304 OE1 GLU A 82 180.791 13.127 6.939 1.00 0.00 O ATOM 1305 OE2 GLU A 82 180.559 13.791 4.856 1.00 0.00 O ATOM 0 H GLU A 82 180.642 8.121 6.146 1.00 0.00 H new ATOM 0 HA GLU A 82 182.881 9.286 5.033 1.00 0.00 H new ATOM 0 HB2 GLU A 82 180.514 10.122 4.981 1.00 0.00 H new ATOM 0 HB3 GLU A 82 180.687 10.640 6.646 1.00 0.00 H new ATOM 0 HG2 GLU A 82 182.832 11.903 5.607 1.00 0.00 H new ATOM 0 HG3 GLU A 82 181.856 11.809 4.155 1.00 0.00 H new ATOM 1312 N ARG A 83 182.672 9.900 8.283 1.00 0.00 N ATOM 1313 CA ARG A 83 183.458 10.281 9.452 1.00 0.00 C ATOM 1314 C ARG A 83 184.593 9.289 9.692 1.00 0.00 C ATOM 1315 O ARG A 83 185.755 9.677 9.823 1.00 0.00 O ATOM 1316 CB ARG A 83 182.564 10.362 10.691 1.00 0.00 C ATOM 1317 CG ARG A 83 181.725 11.629 10.757 1.00 0.00 C ATOM 1318 CD ARG A 83 182.485 12.770 11.415 1.00 0.00 C ATOM 1319 NE ARG A 83 183.705 13.113 10.686 1.00 0.00 N ATOM 1320 CZ ARG A 83 184.921 12.673 11.010 1.00 0.00 C ATOM 1321 NH1 ARG A 83 185.091 11.863 12.051 1.00 0.00 N ATOM 1322 NH2 ARG A 83 185.971 13.040 10.290 1.00 0.00 N ATOM 0 H ARG A 83 181.688 9.714 8.476 1.00 0.00 H new ATOM 0 HA ARG A 83 183.892 11.263 9.262 1.00 0.00 H new ATOM 0 HB2 ARG A 83 181.901 9.497 10.707 1.00 0.00 H new ATOM 0 HB3 ARG A 83 183.188 10.303 11.583 1.00 0.00 H new ATOM 0 HG2 ARG A 83 181.428 11.922 9.750 1.00 0.00 H new ATOM 0 HG3 ARG A 83 180.810 11.431 11.315 1.00 0.00 H new ATOM 0 HD2 ARG A 83 181.841 13.647 11.475 1.00 0.00 H new ATOM 0 HD3 ARG A 83 182.741 12.492 12.438 1.00 0.00 H new ATOM 0 HE ARG A 83 183.620 13.729 9.877 1.00 0.00 H new ATOM 0 HH11 ARG A 83 184.287 11.574 12.609 1.00 0.00 H new ATOM 0 HH12 ARG A 83 186.025 11.531 12.292 1.00 0.00 H new ATOM 0 HH21 ARG A 83 185.849 13.659 9.488 1.00 0.00 H new ATOM 0 HH22 ARG A 83 186.902 12.704 10.537 1.00 0.00 H new ATOM 1336 N GLN A 84 184.249 8.005 9.745 1.00 0.00 N ATOM 1337 CA GLN A 84 185.239 6.955 9.967 1.00 0.00 C ATOM 1338 C GLN A 84 186.338 7.011 8.912 1.00 0.00 C ATOM 1339 O GLN A 84 187.520 6.861 9.222 1.00 0.00 O ATOM 1340 CB GLN A 84 184.571 5.579 9.941 1.00 0.00 C ATOM 1341 CG GLN A 84 183.534 5.379 11.034 1.00 0.00 C ATOM 1342 CD GLN A 84 183.100 3.932 11.171 1.00 0.00 C ATOM 1343 OE1 GLN A 84 183.000 3.229 10.046 1.00 0.00 O flip ATOM 1344 NE2 GLN A 84 182.854 3.449 12.277 1.00 0.00 N flip ATOM 0 H GLN A 84 183.293 7.667 9.637 1.00 0.00 H new ATOM 0 HA GLN A 84 185.687 7.118 10.947 1.00 0.00 H new ATOM 0 HB2 GLN A 84 184.095 5.435 8.971 1.00 0.00 H new ATOM 0 HB3 GLN A 84 185.339 4.811 10.037 1.00 0.00 H new ATOM 0 HG2 GLN A 84 183.943 5.723 11.984 1.00 0.00 H new ATOM 0 HG3 GLN A 84 182.662 5.997 10.819 1.00 0.00 H new ATOM 0 HE21 GLN A 84 182.943 4.023 13.115 1.00 0.00 H new ATOM 0 HE22 GLN A 84 182.561 2.475 12.354 1.00 0.00 H new ATOM 1353 N LEU A 85 185.939 7.228 7.662 1.00 0.00 N ATOM 1354 CA LEU A 85 186.884 7.301 6.553 1.00 0.00 C ATOM 1355 C LEU A 85 188.015 8.274 6.865 1.00 0.00 C ATOM 1356 O LEU A 85 189.182 7.886 6.914 1.00 0.00 O ATOM 1357 CB LEU A 85 186.163 7.725 5.269 1.00 0.00 C ATOM 1358 CG LEU A 85 185.968 6.608 4.240 1.00 0.00 C ATOM 1359 CD1 LEU A 85 184.525 6.569 3.756 1.00 0.00 C ATOM 1360 CD2 LEU A 85 186.919 6.790 3.067 1.00 0.00 C ATOM 0 H LEU A 85 184.964 7.357 7.392 1.00 0.00 H new ATOM 0 HA LEU A 85 187.315 6.310 6.408 1.00 0.00 H new ATOM 0 HB2 LEU A 85 185.186 8.129 5.535 1.00 0.00 H new ATOM 0 HB3 LEU A 85 186.726 8.534 4.803 1.00 0.00 H new ATOM 0 HG LEU A 85 186.193 5.657 4.722 1.00 0.00 H new ATOM 0 HD11 LEU A 85 184.408 5.769 3.026 1.00 0.00 H new ATOM 0 HD12 LEU A 85 183.862 6.388 4.602 1.00 0.00 H new ATOM 0 HD13 LEU A 85 184.271 7.523 3.293 1.00 0.00 H new ATOM 0 HD21 LEU A 85 186.766 5.987 2.346 1.00 0.00 H new ATOM 0 HD22 LEU A 85 186.726 7.750 2.587 1.00 0.00 H new ATOM 0 HD23 LEU A 85 187.948 6.764 3.425 1.00 0.00 H new ATOM 1372 N ASN A 86 187.665 9.540 7.077 1.00 0.00 N ATOM 1373 CA ASN A 86 188.656 10.568 7.385 1.00 0.00 C ATOM 1374 C ASN A 86 189.612 10.101 8.480 1.00 0.00 C ATOM 1375 O ASN A 86 190.835 10.125 8.307 1.00 0.00 O ATOM 1376 CB ASN A 86 187.962 11.860 7.826 1.00 0.00 C ATOM 1377 CG ASN A 86 187.005 12.394 6.779 1.00 0.00 C ATOM 1378 OD1 ASN A 86 187.425 12.918 5.749 1.00 0.00 O ATOM 1379 ND2 ASN A 86 185.709 12.265 7.042 1.00 0.00 N ATOM 0 H ASN A 86 186.704 9.879 7.041 1.00 0.00 H new ATOM 0 HA ASN A 86 189.232 10.757 6.479 1.00 0.00 H new ATOM 0 HB2 ASN A 86 187.417 11.677 8.752 1.00 0.00 H new ATOM 0 HB3 ASN A 86 188.716 12.617 8.044 1.00 0.00 H new ATOM 0 HD21 ASN A 86 185.017 12.608 6.376 1.00 0.00 H new ATOM 0 HD22 ASN A 86 185.406 11.823 7.910 1.00 0.00 H new ATOM 1386 N LYS A 87 189.050 9.681 9.608 1.00 0.00 N ATOM 1387 CA LYS A 87 189.856 9.218 10.732 1.00 0.00 C ATOM 1388 C LYS A 87 190.706 8.025 10.336 1.00 0.00 C ATOM 1389 O LYS A 87 191.890 7.970 10.651 1.00 0.00 O ATOM 1390 CB LYS A 87 188.957 8.873 11.921 1.00 0.00 C ATOM 1391 CG LYS A 87 188.049 10.020 12.352 1.00 0.00 C ATOM 1392 CD LYS A 87 188.650 11.381 12.016 1.00 0.00 C ATOM 1393 CE LYS A 87 189.837 11.702 12.912 1.00 0.00 C ATOM 1394 NZ LYS A 87 190.774 12.663 12.267 1.00 0.00 N ATOM 0 H LYS A 87 188.043 9.651 9.768 1.00 0.00 H new ATOM 0 HA LYS A 87 190.529 10.023 11.027 1.00 0.00 H new ATOM 0 HB2 LYS A 87 188.342 8.011 11.663 1.00 0.00 H new ATOM 0 HB3 LYS A 87 189.581 8.578 12.764 1.00 0.00 H new ATOM 0 HG2 LYS A 87 187.081 9.920 11.861 1.00 0.00 H new ATOM 0 HG3 LYS A 87 187.870 9.957 13.425 1.00 0.00 H new ATOM 0 HD2 LYS A 87 188.966 11.393 10.973 1.00 0.00 H new ATOM 0 HD3 LYS A 87 187.889 12.154 12.127 1.00 0.00 H new ATOM 0 HE2 LYS A 87 189.479 12.120 13.853 1.00 0.00 H new ATOM 0 HE3 LYS A 87 190.369 10.782 13.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 191.569 12.856 12.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 191.135 12.254 11.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 190.273 13.550 12.060 1.00 0.00 H new ATOM 1408 N LEU A 88 190.109 7.082 9.624 1.00 0.00 N ATOM 1409 CA LEU A 88 190.843 5.912 9.169 1.00 0.00 C ATOM 1410 C LEU A 88 191.793 6.297 8.036 1.00 0.00 C ATOM 1411 O LEU A 88 192.640 5.502 7.627 1.00 0.00 O ATOM 1412 CB LEU A 88 189.879 4.815 8.702 1.00 0.00 C ATOM 1413 CG LEU A 88 190.132 3.422 9.290 1.00 0.00 C ATOM 1414 CD1 LEU A 88 191.623 3.118 9.345 1.00 0.00 C ATOM 1415 CD2 LEU A 88 189.514 3.306 10.673 1.00 0.00 C ATOM 0 H LEU A 88 189.127 7.103 9.351 1.00 0.00 H new ATOM 0 HA LEU A 88 191.426 5.524 10.004 1.00 0.00 H new ATOM 0 HB2 LEU A 88 188.862 5.117 8.953 1.00 0.00 H new ATOM 0 HB3 LEU A 88 189.932 4.747 7.615 1.00 0.00 H new ATOM 0 HG LEU A 88 189.659 2.688 8.637 1.00 0.00 H new ATOM 0 HD11 LEU A 88 191.776 2.124 9.766 1.00 0.00 H new ATOM 0 HD12 LEU A 88 192.039 3.154 8.338 1.00 0.00 H new ATOM 0 HD13 LEU A 88 192.122 3.858 9.970 1.00 0.00 H new ATOM 0 HD21 LEU A 88 189.704 2.310 11.074 1.00 0.00 H new ATOM 0 HD22 LEU A 88 189.955 4.053 11.333 1.00 0.00 H new ATOM 0 HD23 LEU A 88 188.439 3.471 10.606 1.00 0.00 H new ATOM 1427 N GLN A 89 191.635 7.520 7.522 1.00 0.00 N ATOM 1428 CA GLN A 89 192.469 8.001 6.426 1.00 0.00 C ATOM 1429 C GLN A 89 193.727 8.699 6.940 1.00 0.00 C ATOM 1430 O GLN A 89 194.709 8.834 6.211 1.00 0.00 O ATOM 1431 CB GLN A 89 191.675 8.964 5.542 1.00 0.00 C ATOM 1432 CG GLN A 89 192.226 9.091 4.131 1.00 0.00 C ATOM 1433 CD GLN A 89 191.784 7.953 3.230 1.00 0.00 C ATOM 1434 OE1 GLN A 89 190.598 7.635 3.149 1.00 0.00 O ATOM 1435 NE2 GLN A 89 192.740 7.334 2.547 1.00 0.00 N ATOM 0 H GLN A 89 190.939 8.190 7.848 1.00 0.00 H new ATOM 0 HA GLN A 89 192.776 7.133 5.842 1.00 0.00 H new ATOM 0 HB2 GLN A 89 190.640 8.626 5.490 1.00 0.00 H new ATOM 0 HB3 GLN A 89 191.666 9.949 6.009 1.00 0.00 H new ATOM 0 HG2 GLN A 89 191.900 10.038 3.701 1.00 0.00 H new ATOM 0 HG3 GLN A 89 193.315 9.117 4.171 1.00 0.00 H new ATOM 0 HE21 GLN A 89 193.711 7.631 2.645 1.00 0.00 H new ATOM 0 HE22 GLN A 89 192.503 6.561 1.925 1.00 0.00 H new ATOM 1444 N HIS A 90 193.684 9.154 8.190 1.00 0.00 N ATOM 1445 CA HIS A 90 194.818 9.853 8.796 1.00 0.00 C ATOM 1446 C HIS A 90 196.053 8.952 8.895 1.00 0.00 C ATOM 1447 O HIS A 90 196.488 8.591 9.988 1.00 0.00 O ATOM 1448 CB HIS A 90 194.428 10.390 10.179 1.00 0.00 C ATOM 1449 CG HIS A 90 194.252 9.331 11.231 1.00 0.00 C ATOM 1450 ND1 HIS A 90 194.305 7.977 10.965 1.00 0.00 N ATOM 1451 CD2 HIS A 90 194.030 9.440 12.562 1.00 0.00 C ATOM 1452 CE1 HIS A 90 194.121 7.304 12.085 1.00 0.00 C ATOM 1453 NE2 HIS A 90 193.952 8.167 13.069 1.00 0.00 N ATOM 0 H HIS A 90 192.876 9.052 8.804 1.00 0.00 H new ATOM 0 HA HIS A 90 195.079 10.691 8.150 1.00 0.00 H new ATOM 0 HB2 HIS A 90 195.193 11.091 10.512 1.00 0.00 H new ATOM 0 HB3 HIS A 90 193.499 10.952 10.088 1.00 0.00 H new ATOM 0 HD2 HIS A 90 193.932 10.359 13.121 1.00 0.00 H new ATOM 0 HE1 HIS A 90 194.110 6.228 12.180 1.00 0.00 H new ATOM 0 HE2 HIS A 90 193.790 7.927 14.047 1.00 0.00 H new ATOM 1462 N LYS A 91 196.618 8.598 7.746 1.00 0.00 N ATOM 1463 CA LYS A 91 197.801 7.742 7.702 1.00 0.00 C ATOM 1464 C LYS A 91 197.477 6.345 8.221 1.00 0.00 C ATOM 1465 O LYS A 91 197.911 5.957 9.305 1.00 0.00 O ATOM 1466 CB LYS A 91 198.941 8.357 8.521 1.00 0.00 C ATOM 1467 CG LYS A 91 200.220 7.537 8.497 1.00 0.00 C ATOM 1468 CD LYS A 91 200.704 7.299 7.076 1.00 0.00 C ATOM 1469 CE LYS A 91 202.043 6.579 7.058 1.00 0.00 C ATOM 1470 NZ LYS A 91 202.268 5.850 5.779 1.00 0.00 N ATOM 0 H LYS A 91 196.276 8.890 6.831 1.00 0.00 H new ATOM 0 HA LYS A 91 198.121 7.660 6.663 1.00 0.00 H new ATOM 0 HB2 LYS A 91 199.153 9.356 8.140 1.00 0.00 H new ATOM 0 HB3 LYS A 91 198.613 8.473 9.554 1.00 0.00 H new ATOM 0 HG2 LYS A 91 200.995 8.053 9.064 1.00 0.00 H new ATOM 0 HG3 LYS A 91 200.049 6.580 8.989 1.00 0.00 H new ATOM 0 HD2 LYS A 91 199.965 6.710 6.533 1.00 0.00 H new ATOM 0 HD3 LYS A 91 200.795 8.253 6.557 1.00 0.00 H new ATOM 0 HE2 LYS A 91 202.845 7.301 7.209 1.00 0.00 H new ATOM 0 HE3 LYS A 91 202.087 5.875 7.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 202.406 4.838 5.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 201.442 5.973 5.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 203.114 6.229 5.307 1.00 0.00 H new ATOM 1484 N GLY A 92 196.710 5.593 7.436 1.00 0.00 N ATOM 1485 CA GLY A 92 196.337 4.248 7.830 1.00 0.00 C ATOM 1486 C GLY A 92 197.536 3.335 7.992 1.00 0.00 C ATOM 1487 O GLY A 92 198.108 3.238 9.078 1.00 0.00 O ATOM 0 H GLY A 92 196.341 5.893 6.534 1.00 0.00 H new ATOM 0 HA2 GLY A 92 195.786 4.288 8.770 1.00 0.00 H new ATOM 0 HA3 GLY A 92 195.663 3.828 7.083 1.00 0.00 H new ATOM 1491 N GLU A 93 197.917 2.662 6.911 1.00 0.00 N ATOM 1492 CA GLU A 93 199.058 1.751 6.940 1.00 0.00 C ATOM 1493 C GLU A 93 200.264 2.370 6.237 1.00 0.00 C ATOM 1494 O GLU A 93 201.182 2.870 6.885 1.00 0.00 O ATOM 1495 CB GLU A 93 198.705 0.402 6.292 1.00 0.00 C ATOM 1496 CG GLU A 93 197.301 0.332 5.708 1.00 0.00 C ATOM 1497 CD GLU A 93 197.205 0.974 4.338 1.00 0.00 C ATOM 1498 OE1 GLU A 93 197.535 2.172 4.220 1.00 0.00 O ATOM 1499 OE2 GLU A 93 196.799 0.278 3.383 1.00 0.00 O ATOM 0 H GLU A 93 197.454 2.729 6.005 1.00 0.00 H new ATOM 0 HA GLU A 93 199.314 1.575 7.985 1.00 0.00 H new ATOM 0 HB2 GLU A 93 199.425 0.194 5.501 1.00 0.00 H new ATOM 0 HB3 GLU A 93 198.815 -0.385 7.038 1.00 0.00 H new ATOM 0 HG2 GLU A 93 196.992 -0.711 5.638 1.00 0.00 H new ATOM 0 HG3 GLU A 93 196.605 0.826 6.386 1.00 0.00 H new ATOM 1506 N ALA A 94 200.254 2.331 4.908 1.00 0.00 N ATOM 1507 CA ALA A 94 201.347 2.888 4.120 1.00 0.00 C ATOM 1508 C ALA A 94 201.048 2.802 2.628 1.00 0.00 C ATOM 1509 O ALA A 94 200.791 3.816 1.978 1.00 0.00 O ATOM 1510 CB ALA A 94 202.648 2.168 4.441 1.00 0.00 C ATOM 0 H ALA A 94 199.502 1.920 4.355 1.00 0.00 H new ATOM 0 HA ALA A 94 201.452 3.941 4.383 1.00 0.00 H new ATOM 0 HB1 ALA A 94 203.456 2.594 3.846 1.00 0.00 H new ATOM 0 HB2 ALA A 94 202.877 2.285 5.500 1.00 0.00 H new ATOM 0 HB3 ALA A 94 202.545 1.108 4.207 1.00 0.00 H new ATOM 1516 N ARG A 95 201.083 1.589 2.091 1.00 0.00 N ATOM 1517 CA ARG A 95 200.816 1.372 0.672 1.00 0.00 C ATOM 1518 C ARG A 95 200.156 0.017 0.445 1.00 0.00 C ATOM 1519 O ARG A 95 200.692 -1.021 0.837 1.00 0.00 O ATOM 1520 CB ARG A 95 202.114 1.462 -0.133 1.00 0.00 C ATOM 1521 CG ARG A 95 203.025 2.598 0.304 1.00 0.00 C ATOM 1522 CD ARG A 95 204.073 2.908 -0.753 1.00 0.00 C ATOM 1523 NE ARG A 95 204.986 1.785 -0.964 1.00 0.00 N ATOM 1524 CZ ARG A 95 205.198 1.202 -2.145 1.00 0.00 C ATOM 1525 NH1 ARG A 95 204.571 1.628 -3.235 1.00 0.00 N ATOM 1526 NH2 ARG A 95 206.046 0.187 -2.234 1.00 0.00 N ATOM 0 H ARG A 95 201.293 0.740 2.615 1.00 0.00 H new ATOM 0 HA ARG A 95 200.133 2.151 0.333 1.00 0.00 H new ATOM 0 HB2 ARG A 95 202.654 0.519 -0.042 1.00 0.00 H new ATOM 0 HB3 ARG A 95 201.869 1.589 -1.188 1.00 0.00 H new ATOM 0 HG2 ARG A 95 202.429 3.489 0.500 1.00 0.00 H new ATOM 0 HG3 ARG A 95 203.517 2.332 1.239 1.00 0.00 H new ATOM 0 HD2 ARG A 95 203.579 3.155 -1.693 1.00 0.00 H new ATOM 0 HD3 ARG A 95 204.643 3.787 -0.452 1.00 0.00 H new ATOM 0 HE ARG A 95 205.493 1.424 -0.156 1.00 0.00 H new ATOM 0 HH11 ARG A 95 203.918 2.410 -3.175 1.00 0.00 H new ATOM 0 HH12 ARG A 95 204.742 1.174 -4.132 1.00 0.00 H new ATOM 0 HH21 ARG A 95 206.533 -0.145 -1.402 1.00 0.00 H new ATOM 0 HH22 ARG A 95 206.211 -0.262 -3.135 1.00 0.00 H new ATOM 1540 N ARG A 96 198.990 0.031 -0.193 1.00 0.00 N ATOM 1541 CA ARG A 96 198.258 -1.199 -0.472 1.00 0.00 C ATOM 1542 C ARG A 96 198.648 -1.770 -1.833 1.00 0.00 C ATOM 1543 O ARG A 96 199.018 -1.029 -2.745 1.00 0.00 O ATOM 1544 CB ARG A 96 196.746 -0.947 -0.415 1.00 0.00 C ATOM 1545 CG ARG A 96 196.195 -0.171 -1.606 1.00 0.00 C ATOM 1546 CD ARG A 96 196.404 1.326 -1.447 1.00 0.00 C ATOM 1547 NE ARG A 96 197.405 1.842 -2.378 1.00 0.00 N ATOM 1548 CZ ARG A 96 197.248 1.860 -3.699 1.00 0.00 C ATOM 1549 NH1 ARG A 96 196.132 1.393 -4.248 1.00 0.00 N ATOM 1550 NH2 ARG A 96 198.208 2.346 -4.473 1.00 0.00 N ATOM 0 H ARG A 96 198.532 0.880 -0.526 1.00 0.00 H new ATOM 0 HA ARG A 96 198.521 -1.930 0.293 1.00 0.00 H new ATOM 0 HB2 ARG A 96 196.232 -1.906 -0.351 1.00 0.00 H new ATOM 0 HB3 ARG A 96 196.515 -0.400 0.499 1.00 0.00 H new ATOM 0 HG2 ARG A 96 196.683 -0.512 -2.519 1.00 0.00 H new ATOM 0 HG3 ARG A 96 195.131 -0.380 -1.716 1.00 0.00 H new ATOM 0 HD2 ARG A 96 195.458 1.843 -1.609 1.00 0.00 H new ATOM 0 HD3 ARG A 96 196.715 1.542 -0.425 1.00 0.00 H new ATOM 0 HE ARG A 96 198.275 2.210 -1.993 1.00 0.00 H new ATOM 0 HH11 ARG A 96 195.391 1.018 -3.656 1.00 0.00 H new ATOM 0 HH12 ARG A 96 196.017 1.409 -5.261 1.00 0.00 H new ATOM 0 HH21 ARG A 96 199.066 2.706 -4.056 1.00 0.00 H new ATOM 0 HH22 ARG A 96 198.088 2.360 -5.486 1.00 0.00 H new ATOM 1564 N ALA A 97 198.560 -3.090 -1.964 1.00 0.00 N ATOM 1565 CA ALA A 97 198.903 -3.757 -3.214 1.00 0.00 C ATOM 1566 C ALA A 97 197.685 -3.870 -4.124 1.00 0.00 C ATOM 1567 O ALA A 97 196.560 -3.588 -3.710 1.00 0.00 O ATOM 1568 CB ALA A 97 199.485 -5.135 -2.934 1.00 0.00 C ATOM 0 H ALA A 97 198.254 -3.718 -1.220 1.00 0.00 H new ATOM 0 HA ALA A 97 199.654 -3.156 -3.726 1.00 0.00 H new ATOM 0 HB1 ALA A 97 199.737 -5.622 -3.876 1.00 0.00 H new ATOM 0 HB2 ALA A 97 200.384 -5.034 -2.326 1.00 0.00 H new ATOM 0 HB3 ALA A 97 198.751 -5.738 -2.399 1.00 0.00 H new ATOM 1574 N ALA A 98 197.916 -4.284 -5.366 1.00 0.00 N ATOM 1575 CA ALA A 98 196.836 -4.433 -6.334 1.00 0.00 C ATOM 1576 C ALA A 98 196.355 -5.877 -6.402 1.00 0.00 C ATOM 1577 O ALA A 98 196.893 -6.754 -5.725 1.00 0.00 O ATOM 1578 CB ALA A 98 197.291 -3.961 -7.707 1.00 0.00 C ATOM 0 H ALA A 98 198.841 -4.522 -5.725 1.00 0.00 H new ATOM 0 HA ALA A 98 196.000 -3.815 -6.007 1.00 0.00 H new ATOM 0 HB1 ALA A 98 196.475 -4.078 -8.421 1.00 0.00 H new ATOM 0 HB2 ALA A 98 197.579 -2.911 -7.654 1.00 0.00 H new ATOM 0 HB3 ALA A 98 198.145 -4.556 -8.032 1.00 0.00 H new ATOM 1584 N THR A 99 195.338 -6.120 -7.223 1.00 0.00 N ATOM 1585 CA THR A 99 194.785 -7.459 -7.378 1.00 0.00 C ATOM 1586 C THR A 99 195.704 -8.334 -8.226 1.00 0.00 C ATOM 1587 O THR A 99 196.837 -7.956 -8.522 1.00 0.00 O ATOM 1588 CB THR A 99 193.396 -7.389 -8.016 1.00 0.00 C ATOM 1589 OG1 THR A 99 192.808 -8.676 -8.083 1.00 0.00 O ATOM 1590 CG2 THR A 99 193.408 -6.817 -9.417 1.00 0.00 C ATOM 0 H THR A 99 194.881 -5.406 -7.791 1.00 0.00 H new ATOM 0 HA THR A 99 194.700 -7.907 -6.388 1.00 0.00 H new ATOM 0 HB THR A 99 192.818 -6.724 -7.374 1.00 0.00 H new ATOM 0 HG1 THR A 99 192.966 -9.152 -7.241 1.00 0.00 H new ATOM 0 HG21 THR A 99 192.392 -6.796 -9.810 1.00 0.00 H new ATOM 0 HG22 THR A 99 193.809 -5.804 -9.393 1.00 0.00 H new ATOM 0 HG23 THR A 99 194.032 -7.439 -10.059 1.00 0.00 H new ATOM 1598 N SER A 100 195.207 -9.503 -8.616 1.00 0.00 N ATOM 1599 CA SER A 100 195.983 -10.430 -9.430 1.00 0.00 C ATOM 1600 C SER A 100 196.186 -9.882 -10.838 1.00 0.00 C ATOM 1601 O SER A 100 195.378 -10.132 -11.733 1.00 0.00 O ATOM 1602 CB SER A 100 195.287 -11.791 -9.495 1.00 0.00 C ATOM 1603 OG SER A 100 195.568 -12.564 -8.340 1.00 0.00 O ATOM 0 H SER A 100 194.270 -9.831 -8.381 1.00 0.00 H new ATOM 0 HA SER A 100 196.961 -10.551 -8.964 1.00 0.00 H new ATOM 0 HB2 SER A 100 194.210 -11.648 -9.588 1.00 0.00 H new ATOM 0 HB3 SER A 100 195.615 -12.329 -10.385 1.00 0.00 H new ATOM 0 HG SER A 100 195.110 -13.428 -8.405 1.00 0.00 H new ATOM 1609 N VAL A 101 197.268 -9.133 -11.029 1.00 0.00 N ATOM 1610 CA VAL A 101 197.570 -8.550 -12.333 1.00 0.00 C ATOM 1611 C VAL A 101 198.552 -9.430 -13.117 1.00 0.00 C ATOM 1612 O VAL A 101 198.157 -10.111 -14.064 1.00 0.00 O ATOM 1613 CB VAL A 101 198.116 -7.100 -12.210 1.00 0.00 C ATOM 1614 CG1 VAL A 101 199.010 -6.930 -10.986 1.00 0.00 C ATOM 1615 CG2 VAL A 101 198.851 -6.679 -13.480 1.00 0.00 C ATOM 0 H VAL A 101 197.948 -8.916 -10.301 1.00 0.00 H new ATOM 0 HA VAL A 101 196.631 -8.502 -12.885 1.00 0.00 H new ATOM 0 HB VAL A 101 197.255 -6.444 -12.080 1.00 0.00 H new ATOM 0 HG11 VAL A 101 199.370 -5.902 -10.938 1.00 0.00 H new ATOM 0 HG12 VAL A 101 198.440 -7.157 -10.085 1.00 0.00 H new ATOM 0 HG13 VAL A 101 199.860 -7.609 -11.059 1.00 0.00 H new ATOM 0 HG21 VAL A 101 199.222 -5.661 -13.365 1.00 0.00 H new ATOM 0 HG22 VAL A 101 199.690 -7.353 -13.655 1.00 0.00 H new ATOM 0 HG23 VAL A 101 198.167 -6.723 -14.328 1.00 0.00 H new ATOM 1625 N LYS A 102 199.823 -9.414 -12.725 1.00 0.00 N ATOM 1626 CA LYS A 102 200.838 -10.213 -13.402 1.00 0.00 C ATOM 1627 C LYS A 102 200.998 -11.578 -12.737 1.00 0.00 C ATOM 1628 O LYS A 102 201.478 -12.528 -13.358 1.00 0.00 O ATOM 1629 CB LYS A 102 202.179 -9.472 -13.409 1.00 0.00 C ATOM 1630 CG LYS A 102 202.612 -9.010 -14.792 1.00 0.00 C ATOM 1631 CD LYS A 102 202.634 -10.163 -15.786 1.00 0.00 C ATOM 1632 CE LYS A 102 204.046 -10.457 -16.271 1.00 0.00 C ATOM 1633 NZ LYS A 102 204.704 -9.248 -16.841 1.00 0.00 N ATOM 0 H LYS A 102 200.173 -8.858 -11.945 1.00 0.00 H new ATOM 0 HA LYS A 102 200.512 -10.371 -14.430 1.00 0.00 H new ATOM 0 HB2 LYS A 102 202.109 -8.606 -12.751 1.00 0.00 H new ATOM 0 HB3 LYS A 102 202.948 -10.125 -12.996 1.00 0.00 H new ATOM 0 HG2 LYS A 102 201.932 -8.236 -15.147 1.00 0.00 H new ATOM 0 HG3 LYS A 102 203.603 -8.561 -14.733 1.00 0.00 H new ATOM 0 HD2 LYS A 102 202.216 -11.055 -15.319 1.00 0.00 H new ATOM 0 HD3 LYS A 102 201.999 -9.922 -16.638 1.00 0.00 H new ATOM 0 HE2 LYS A 102 204.642 -10.837 -15.442 1.00 0.00 H new ATOM 0 HE3 LYS A 102 204.014 -11.242 -17.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 205.329 -9.529 -17.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 203.979 -8.593 -17.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 205.265 -8.777 -16.102 1.00 0.00 H new ATOM 1647 N ASP A 103 200.598 -11.672 -11.471 1.00 0.00 N ATOM 1648 CA ASP A 103 200.702 -12.922 -10.723 1.00 0.00 C ATOM 1649 C ASP A 103 200.061 -14.075 -11.489 1.00 0.00 C ATOM 1650 O ASP A 103 200.731 -15.045 -11.844 1.00 0.00 O ATOM 1651 CB ASP A 103 200.037 -12.775 -9.352 1.00 0.00 C ATOM 1652 CG ASP A 103 200.574 -13.768 -8.341 1.00 0.00 C ATOM 1653 OD1 ASP A 103 200.096 -14.922 -8.330 1.00 0.00 O ATOM 1654 OD2 ASP A 103 201.473 -13.392 -7.559 1.00 0.00 O ATOM 0 H ASP A 103 200.199 -10.897 -10.942 1.00 0.00 H new ATOM 0 HA ASP A 103 201.760 -13.146 -10.587 1.00 0.00 H new ATOM 0 HB2 ASP A 103 200.194 -11.762 -8.981 1.00 0.00 H new ATOM 0 HB3 ASP A 103 198.961 -12.913 -9.456 1.00 0.00 H new ATOM 1659 N ALA A 104 198.760 -13.965 -11.740 1.00 0.00 N ATOM 1660 CA ALA A 104 198.031 -15.000 -12.463 1.00 0.00 C ATOM 1661 C ALA A 104 198.552 -15.141 -13.890 1.00 0.00 C ATOM 1662 O ALA A 104 199.138 -14.211 -14.442 1.00 0.00 O ATOM 1663 CB ALA A 104 196.543 -14.687 -12.471 1.00 0.00 C ATOM 0 H ALA A 104 198.190 -13.170 -11.453 1.00 0.00 H new ATOM 0 HA ALA A 104 198.189 -15.949 -11.951 1.00 0.00 H new ATOM 0 HB1 ALA A 104 196.010 -15.467 -13.014 1.00 0.00 H new ATOM 0 HB2 ALA A 104 196.175 -14.642 -11.446 1.00 0.00 H new ATOM 0 HB3 ALA A 104 196.376 -13.727 -12.959 1.00 0.00 H new ATOM 1669 N ASN A 105 198.332 -16.312 -14.482 1.00 0.00 N ATOM 1670 CA ASN A 105 198.778 -16.575 -15.844 1.00 0.00 C ATOM 1671 C ASN A 105 197.700 -16.188 -16.852 1.00 0.00 C ATOM 1672 O ASN A 105 196.894 -17.022 -17.265 1.00 0.00 O ATOM 1673 CB ASN A 105 199.142 -18.052 -16.009 1.00 0.00 C ATOM 1674 CG ASN A 105 200.514 -18.374 -15.452 1.00 0.00 C ATOM 1675 OD1 ASN A 105 201.474 -17.635 -15.668 1.00 0.00 O ATOM 1676 ND2 ASN A 105 200.614 -19.484 -14.728 1.00 0.00 N ATOM 0 H ASN A 105 197.848 -17.093 -14.039 1.00 0.00 H new ATOM 0 HA ASN A 105 199.663 -15.968 -16.034 1.00 0.00 H new ATOM 0 HB2 ASN A 105 198.395 -18.666 -15.506 1.00 0.00 H new ATOM 0 HB3 ASN A 105 199.111 -18.315 -17.066 1.00 0.00 H new ATOM 0 HD21 ASN A 105 201.513 -19.752 -14.327 1.00 0.00 H new ATOM 0 HD22 ASN A 105 199.792 -20.068 -14.574 1.00 0.00 H new ATOM 1683 N PHE A 106 197.692 -14.919 -17.242 1.00 0.00 N ATOM 1684 CA PHE A 106 196.713 -14.419 -18.199 1.00 0.00 C ATOM 1685 C PHE A 106 197.098 -14.802 -19.624 1.00 0.00 C ATOM 1686 O PHE A 106 198.181 -14.458 -20.098 1.00 0.00 O ATOM 1687 CB PHE A 106 196.587 -12.896 -18.082 1.00 0.00 C ATOM 1688 CG PHE A 106 195.830 -12.431 -16.863 1.00 0.00 C ATOM 1689 CD1 PHE A 106 195.579 -13.292 -15.803 1.00 0.00 C ATOM 1690 CD2 PHE A 106 195.374 -11.125 -16.779 1.00 0.00 C ATOM 1691 CE1 PHE A 106 194.887 -12.858 -14.688 1.00 0.00 C ATOM 1692 CE2 PHE A 106 194.681 -10.687 -15.667 1.00 0.00 C ATOM 1693 CZ PHE A 106 194.438 -11.555 -14.621 1.00 0.00 C ATOM 0 H PHE A 106 198.353 -14.217 -16.910 1.00 0.00 H new ATOM 0 HA PHE A 106 195.750 -14.876 -17.969 1.00 0.00 H new ATOM 0 HB2 PHE A 106 197.586 -12.460 -18.064 1.00 0.00 H new ATOM 0 HB3 PHE A 106 196.089 -12.514 -18.973 1.00 0.00 H new ATOM 0 HD1 PHE A 106 195.929 -14.313 -15.850 1.00 0.00 H new ATOM 0 HD2 PHE A 106 195.563 -10.441 -17.593 1.00 0.00 H new ATOM 0 HE1 PHE A 106 194.698 -13.538 -13.870 1.00 0.00 H new ATOM 0 HE2 PHE A 106 194.330 -9.667 -15.616 1.00 0.00 H new ATOM 0 HZ PHE A 106 193.897 -11.214 -13.751 1.00 0.00 H new ATOM 1703 N VAL A 107 196.204 -15.515 -20.300 1.00 0.00 N ATOM 1704 CA VAL A 107 196.449 -15.948 -21.671 1.00 0.00 C ATOM 1705 C VAL A 107 196.042 -14.867 -22.668 1.00 0.00 C ATOM 1706 O VAL A 107 195.251 -13.979 -22.346 1.00 0.00 O ATOM 1707 CB VAL A 107 195.686 -17.246 -21.996 1.00 0.00 C ATOM 1708 CG1 VAL A 107 196.074 -17.768 -23.371 1.00 0.00 C ATOM 1709 CG2 VAL A 107 195.942 -18.299 -20.928 1.00 0.00 C ATOM 0 H VAL A 107 195.303 -15.806 -19.921 1.00 0.00 H new ATOM 0 HA VAL A 107 197.519 -16.135 -21.758 1.00 0.00 H new ATOM 0 HB VAL A 107 194.619 -17.022 -22.006 1.00 0.00 H new ATOM 0 HG11 VAL A 107 195.524 -18.685 -23.581 1.00 0.00 H new ATOM 0 HG12 VAL A 107 195.833 -17.020 -24.126 1.00 0.00 H new ATOM 0 HG13 VAL A 107 197.144 -17.974 -23.393 1.00 0.00 H new ATOM 0 HG21 VAL A 107 195.395 -19.209 -21.175 1.00 0.00 H new ATOM 0 HG22 VAL A 107 197.009 -18.519 -20.882 1.00 0.00 H new ATOM 0 HG23 VAL A 107 195.606 -17.925 -19.961 1.00 0.00 H new ATOM 1719 N GLU A 108 196.587 -14.946 -23.876 1.00 0.00 N ATOM 1720 CA GLU A 108 196.280 -13.974 -24.920 1.00 0.00 C ATOM 1721 C GLU A 108 194.792 -14.027 -25.292 1.00 0.00 C ATOM 1722 O GLU A 108 193.931 -13.847 -24.430 1.00 0.00 O ATOM 1723 CB GLU A 108 197.166 -14.226 -26.145 1.00 0.00 C ATOM 1724 CG GLU A 108 198.653 -14.209 -25.834 1.00 0.00 C ATOM 1725 CD GLU A 108 199.397 -15.373 -26.461 1.00 0.00 C ATOM 1726 OE1 GLU A 108 198.863 -15.968 -27.420 1.00 0.00 O ATOM 1727 OE2 GLU A 108 200.508 -15.690 -25.990 1.00 0.00 O ATOM 0 H GLU A 108 197.244 -15.673 -24.158 1.00 0.00 H new ATOM 0 HA GLU A 108 196.490 -12.973 -24.543 1.00 0.00 H new ATOM 0 HB2 GLU A 108 196.905 -15.191 -26.579 1.00 0.00 H new ATOM 0 HB3 GLU A 108 196.952 -13.469 -26.899 1.00 0.00 H new ATOM 0 HG2 GLU A 108 199.084 -13.274 -26.191 1.00 0.00 H new ATOM 0 HG3 GLU A 108 198.794 -14.233 -24.753 1.00 0.00 H new ATOM 1734 N GLU A 109 194.486 -14.273 -26.568 1.00 0.00 N ATOM 1735 CA GLU A 109 193.100 -14.342 -27.017 1.00 0.00 C ATOM 1736 C GLU A 109 192.331 -15.411 -26.250 1.00 0.00 C ATOM 1737 O GLU A 109 192.889 -16.440 -25.868 1.00 0.00 O ATOM 1738 CB GLU A 109 193.043 -14.633 -28.518 1.00 0.00 C ATOM 1739 CG GLU A 109 191.806 -14.071 -29.200 1.00 0.00 C ATOM 1740 CD GLU A 109 191.794 -12.556 -29.228 1.00 0.00 C ATOM 1741 OE1 GLU A 109 192.874 -11.957 -29.423 1.00 0.00 O ATOM 1742 OE2 GLU A 109 190.707 -11.966 -29.055 1.00 0.00 O ATOM 0 H GLU A 109 195.177 -14.426 -27.302 1.00 0.00 H new ATOM 0 HA GLU A 109 192.633 -13.376 -26.823 1.00 0.00 H new ATOM 0 HB2 GLU A 109 193.931 -14.217 -28.994 1.00 0.00 H new ATOM 0 HB3 GLU A 109 193.074 -15.712 -28.672 1.00 0.00 H new ATOM 0 HG2 GLU A 109 191.754 -14.450 -30.221 1.00 0.00 H new ATOM 0 HG3 GLU A 109 190.916 -14.428 -28.682 1.00 0.00 H new ATOM 1749 N VAL A 110 191.044 -15.162 -26.028 1.00 0.00 N ATOM 1750 CA VAL A 110 190.197 -16.103 -25.308 1.00 0.00 C ATOM 1751 C VAL A 110 188.726 -15.945 -25.727 1.00 0.00 C ATOM 1752 O VAL A 110 188.392 -16.184 -26.888 1.00 0.00 O ATOM 1753 CB VAL A 110 190.382 -15.945 -23.778 1.00 0.00 C ATOM 1754 CG1 VAL A 110 190.095 -14.516 -23.337 1.00 0.00 C ATOM 1755 CG2 VAL A 110 189.521 -16.947 -23.019 1.00 0.00 C ATOM 0 H VAL A 110 190.566 -14.316 -26.337 1.00 0.00 H new ATOM 0 HA VAL A 110 190.501 -17.116 -25.571 1.00 0.00 H new ATOM 0 HB VAL A 110 191.424 -16.158 -23.539 1.00 0.00 H new ATOM 0 HG11 VAL A 110 190.232 -14.433 -22.259 1.00 0.00 H new ATOM 0 HG12 VAL A 110 190.779 -13.835 -23.843 1.00 0.00 H new ATOM 0 HG13 VAL A 110 189.068 -14.256 -23.593 1.00 0.00 H new ATOM 0 HG21 VAL A 110 189.669 -16.815 -21.947 1.00 0.00 H new ATOM 0 HG22 VAL A 110 188.471 -16.783 -23.263 1.00 0.00 H new ATOM 0 HG23 VAL A 110 189.806 -17.960 -23.303 1.00 0.00 H new ATOM 1765 N GLU A 111 187.849 -15.551 -24.807 1.00 0.00 N ATOM 1766 CA GLU A 111 186.436 -15.382 -25.128 1.00 0.00 C ATOM 1767 C GLU A 111 186.124 -13.922 -25.451 1.00 0.00 C ATOM 1768 O GLU A 111 185.087 -13.394 -25.046 1.00 0.00 O ATOM 1769 CB GLU A 111 185.567 -15.859 -23.963 1.00 0.00 C ATOM 1770 CG GLU A 111 184.446 -16.796 -24.386 1.00 0.00 C ATOM 1771 CD GLU A 111 184.087 -17.800 -23.307 1.00 0.00 C ATOM 1772 OE1 GLU A 111 185.011 -18.296 -22.628 1.00 0.00 O ATOM 1773 OE2 GLU A 111 182.884 -18.089 -23.143 1.00 0.00 O ATOM 0 H GLU A 111 188.091 -15.344 -23.838 1.00 0.00 H new ATOM 0 HA GLU A 111 186.212 -15.985 -26.008 1.00 0.00 H new ATOM 0 HB2 GLU A 111 186.198 -16.366 -23.233 1.00 0.00 H new ATOM 0 HB3 GLU A 111 185.136 -14.992 -23.463 1.00 0.00 H new ATOM 0 HG2 GLU A 111 183.563 -16.209 -24.639 1.00 0.00 H new ATOM 0 HG3 GLU A 111 184.744 -17.329 -25.289 1.00 0.00 H new ATOM 1780 N GLU A 112 187.024 -13.277 -26.185 1.00 0.00 N ATOM 1781 CA GLU A 112 186.843 -11.879 -26.562 1.00 0.00 C ATOM 1782 C GLU A 112 186.478 -11.759 -28.039 1.00 0.00 C ATOM 1783 O GLU A 112 185.589 -10.992 -28.410 1.00 0.00 O ATOM 1784 CB GLU A 112 188.115 -11.080 -26.265 1.00 0.00 C ATOM 1785 CG GLU A 112 187.938 -10.044 -25.167 1.00 0.00 C ATOM 1786 CD GLU A 112 187.665 -10.672 -23.814 1.00 0.00 C ATOM 1787 OE1 GLU A 112 186.596 -11.295 -23.653 1.00 0.00 O ATOM 1788 OE2 GLU A 112 188.523 -10.540 -22.915 1.00 0.00 O ATOM 0 H GLU A 112 187.886 -13.699 -26.531 1.00 0.00 H new ATOM 0 HA GLU A 112 186.023 -11.469 -25.972 1.00 0.00 H new ATOM 0 HB2 GLU A 112 188.909 -11.770 -25.978 1.00 0.00 H new ATOM 0 HB3 GLU A 112 188.441 -10.579 -27.177 1.00 0.00 H new ATOM 0 HG2 GLU A 112 188.836 -9.429 -25.104 1.00 0.00 H new ATOM 0 HG3 GLU A 112 187.114 -9.380 -25.428 1.00 0.00 H new ATOM 1795 N GLU A 113 187.171 -12.522 -28.878 1.00 0.00 N ATOM 1796 CA GLU A 113 186.921 -12.502 -30.315 1.00 0.00 C ATOM 1797 C GLU A 113 185.685 -13.325 -30.664 1.00 0.00 C ATOM 1798 O GLU A 113 185.528 -14.426 -30.094 1.00 0.00 O ATOM 1799 CB GLU A 113 188.137 -13.038 -31.074 1.00 0.00 C ATOM 1800 CG GLU A 113 188.595 -14.408 -30.599 1.00 0.00 C ATOM 1801 CD GLU A 113 189.336 -15.177 -31.674 1.00 0.00 C ATOM 1802 OE1 GLU A 113 188.984 -15.029 -32.862 1.00 0.00 O ATOM 1803 OE2 GLU A 113 190.272 -15.931 -31.327 1.00 0.00 O ATOM 1804 OXT GLU A 113 184.885 -12.863 -31.504 1.00 0.00 O ATOM 0 H GLU A 113 187.910 -13.162 -28.588 1.00 0.00 H new ATOM 0 HA GLU A 113 186.743 -11.469 -30.613 1.00 0.00 H new ATOM 0 HB2 GLU A 113 187.897 -13.092 -32.136 1.00 0.00 H new ATOM 0 HB3 GLU A 113 188.961 -12.332 -30.969 1.00 0.00 H new ATOM 0 HG2 GLU A 113 189.242 -14.290 -29.730 1.00 0.00 H new ATOM 0 HG3 GLU A 113 187.729 -14.985 -30.276 1.00 0.00 H new TER 1811 GLU A 113