USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 759 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 92 HIS : no HD1:sc= 0.0665 K(o=-0.25,f=-2.9) USER MOD Set 1.2: A 164 ASN : amide:sc= -0.317 K(o=-0.25,f=-5.3!) USER MOD Single : A 88 LYS NZ :NH3+ 169:sc= -0.0121 (180deg=-0.196) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot -74:sc= 1.03 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 TYR OH : rot 180:sc= -1.67! USER MOD Single : A 107 THR OG1 : rot -150:sc= 0.481 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -0.444 X(o=-0.44,f=-0.31!) USER MOD Single : A 115 LYS NZ :NH3+ -127:sc= 0.214 (180deg=-0.729) USER MOD Single : A 117 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00954) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD Single : A 146 HIS : no HD1:sc= -0.852 K(o=-0.85,f=-2.1) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0918) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 GLN : amide:sc= -1.53 K(o=-1.5,f=-2.8) USER MOD Single : A 162 LYS NZ :NH3+ 156:sc= -0.062 (180deg=-0.394) USER MOD Single : A 165 ASN : amide:sc= 0 K(o=0,f=0.62) USER MOD Single : A 169 SER OG : rot 180:sc= 0 USER MOD Single : A 176 SER OG : rot -135:sc= 0.983 USER MOD Single : A 178 ASN : amide:sc= -0.369 K(o=-0.37,f=1.1) USER MOD Single : A 179 SER OG : rot 67:sc= 0.597 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 87 -5.318 -6.867 -2.413 1.00 30.33 N ATOM 2 CA GLU A 87 -4.326 -6.986 -3.475 1.00 3.20 C ATOM 3 C GLU A 87 -3.960 -5.614 -4.033 1.00 2.04 C ATOM 4 O GLU A 87 -4.782 -4.699 -4.053 1.00 23.41 O ATOM 5 CB GLU A 87 -4.853 -7.882 -4.598 1.00 73.34 C ATOM 6 CG GLU A 87 -4.675 -9.366 -4.328 1.00 75.23 C ATOM 7 CD GLU A 87 -5.699 -9.910 -3.351 1.00 0.10 C ATOM 8 OE1 GLU A 87 -6.771 -9.287 -3.208 1.00 11.21 O ATOM 9 OE2 GLU A 87 -5.427 -10.958 -2.730 1.00 71.01 O1- ATOM 0 HA GLU A 87 -3.429 -7.438 -3.051 1.00 3.20 H new ATOM 0 HB2 GLU A 87 -5.912 -7.674 -4.751 1.00 73.34 H new ATOM 0 HB3 GLU A 87 -4.341 -7.626 -5.526 1.00 73.34 H new ATOM 0 HG2 GLU A 87 -4.749 -9.913 -5.268 1.00 75.23 H new ATOM 0 HG3 GLU A 87 -3.674 -9.542 -3.934 1.00 75.23 H new ATOM 16 N LYS A 88 -2.718 -5.479 -4.488 1.00 40.53 N ATOM 17 CA LYS A 88 -2.240 -4.221 -5.048 1.00 63.05 C ATOM 18 C LYS A 88 -1.913 -4.374 -6.530 1.00 52.21 C ATOM 19 O LYS A 88 -1.030 -5.145 -6.904 1.00 53.22 O ATOM 20 CB LYS A 88 -1.002 -3.739 -4.289 1.00 43.40 C ATOM 21 CG LYS A 88 -0.569 -2.332 -4.662 1.00 73.43 C ATOM 22 CD LYS A 88 -1.238 -1.290 -3.781 1.00 72.30 C ATOM 23 CE LYS A 88 -1.247 0.078 -4.446 1.00 5.41 C ATOM 24 NZ LYS A 88 0.071 0.762 -4.327 1.00 62.21 N1+ ATOM 0 H LYS A 88 -2.024 -6.227 -4.479 1.00 40.53 H new ATOM 0 HA LYS A 88 -3.034 -3.481 -4.944 1.00 63.05 H new ATOM 0 HB2 LYS A 88 -1.205 -3.776 -3.219 1.00 43.40 H new ATOM 0 HB3 LYS A 88 -0.178 -4.426 -4.481 1.00 43.40 H new ATOM 0 HG2 LYS A 88 0.514 -2.247 -4.569 1.00 73.43 H new ATOM 0 HG3 LYS A 88 -0.816 -2.139 -5.706 1.00 73.43 H new ATOM 0 HD2 LYS A 88 -2.261 -1.597 -3.565 1.00 72.30 H new ATOM 0 HD3 LYS A 88 -0.715 -1.229 -2.827 1.00 72.30 H new ATOM 0 HE2 LYS A 88 -1.505 -0.032 -5.499 1.00 5.41 H new ATOM 0 HE3 LYS A 88 -2.020 0.698 -3.991 1.00 5.41 H new ATOM 0 HZ1 LYS A 88 0.085 1.599 -4.945 1.00 62.21 H new ATOM 0 HZ2 LYS A 88 0.221 1.057 -3.341 1.00 62.21 H new ATOM 0 HZ3 LYS A 88 0.828 0.109 -4.612 1.00 62.21 H new ATOM 38 N ALA A 89 -2.630 -3.633 -7.368 1.00 2.12 N ATOM 39 CA ALA A 89 -2.413 -3.685 -8.810 1.00 32.13 C ATOM 40 C ALA A 89 -1.150 -2.927 -9.202 1.00 63.45 C ATOM 41 O ALA A 89 -0.488 -3.268 -10.183 1.00 5.31 O ATOM 42 CB ALA A 89 -3.620 -3.121 -9.545 1.00 44.04 C ATOM 0 H ALA A 89 -3.365 -2.990 -7.075 1.00 2.12 H new ATOM 0 HA ALA A 89 -2.282 -4.729 -9.096 1.00 32.13 H new ATOM 0 HB1 ALA A 89 -3.445 -3.166 -10.620 1.00 44.04 H new ATOM 0 HB2 ALA A 89 -4.504 -3.708 -9.297 1.00 44.04 H new ATOM 0 HB3 ALA A 89 -3.777 -2.085 -9.246 1.00 44.04 H new ATOM 48 N LYS A 90 -0.820 -1.897 -8.430 1.00 51.00 N ATOM 49 CA LYS A 90 0.366 -1.091 -8.696 1.00 61.25 C ATOM 50 C LYS A 90 1.636 -1.920 -8.534 1.00 14.35 C ATOM 51 O LYS A 90 2.654 -1.641 -9.166 1.00 71.13 O ATOM 52 CB LYS A 90 0.408 0.117 -7.755 1.00 41.44 C ATOM 53 CG LYS A 90 1.404 1.182 -8.177 1.00 65.43 C ATOM 54 CD LYS A 90 2.665 1.133 -7.331 1.00 32.40 C ATOM 55 CE LYS A 90 3.279 2.515 -7.166 1.00 73.34 C ATOM 56 NZ LYS A 90 4.388 2.514 -6.172 1.00 11.23 N1+ ATOM 0 H LYS A 90 -1.357 -1.601 -7.615 1.00 51.00 H new ATOM 0 HA LYS A 90 0.313 -0.740 -9.727 1.00 61.25 H new ATOM 0 HB2 LYS A 90 -0.586 0.561 -7.703 1.00 41.44 H new ATOM 0 HB3 LYS A 90 0.658 -0.224 -6.750 1.00 41.44 H new ATOM 0 HG2 LYS A 90 1.663 1.043 -9.227 1.00 65.43 H new ATOM 0 HG3 LYS A 90 0.944 2.166 -8.090 1.00 65.43 H new ATOM 0 HD2 LYS A 90 2.431 0.718 -6.351 1.00 32.40 H new ATOM 0 HD3 LYS A 90 3.390 0.464 -7.795 1.00 32.40 H new ATOM 0 HE2 LYS A 90 3.654 2.863 -8.128 1.00 73.34 H new ATOM 0 HE3 LYS A 90 2.509 3.219 -6.851 1.00 73.34 H new ATOM 0 HZ1 LYS A 90 4.780 3.474 -6.088 1.00 11.23 H new ATOM 0 HZ2 LYS A 90 4.025 2.206 -5.247 1.00 11.23 H new ATOM 0 HZ3 LYS A 90 5.135 1.861 -6.485 1.00 11.23 H new ATOM 70 N ARG A 91 1.567 -2.939 -7.683 1.00 52.32 N ATOM 71 CA ARG A 91 2.712 -3.807 -7.438 1.00 73.43 C ATOM 72 C ARG A 91 3.206 -4.436 -8.739 1.00 12.01 C ATOM 73 O ARG A 91 4.383 -4.773 -8.870 1.00 55.01 O ATOM 74 CB ARG A 91 2.342 -4.904 -6.439 1.00 55.15 C ATOM 75 CG ARG A 91 3.391 -5.126 -5.362 1.00 43.31 C ATOM 76 CD ARG A 91 3.544 -3.903 -4.471 1.00 24.02 C ATOM 77 NE ARG A 91 4.446 -4.150 -3.351 1.00 52.32 N ATOM 78 CZ ARG A 91 4.846 -3.205 -2.507 1.00 52.22 C ATOM 79 NH1 ARG A 91 4.425 -1.957 -2.656 1.00 64.04 N1+ ATOM 80 NH2 ARG A 91 5.670 -3.509 -1.511 1.00 70.21 N ATOM 0 H ARG A 91 0.731 -3.183 -7.152 1.00 52.32 H new ATOM 0 HA ARG A 91 3.514 -3.199 -7.020 1.00 73.43 H new ATOM 0 HB2 ARG A 91 1.395 -4.647 -5.964 1.00 55.15 H new ATOM 0 HB3 ARG A 91 2.185 -5.838 -6.979 1.00 55.15 H new ATOM 0 HG2 ARG A 91 3.113 -5.987 -4.754 1.00 43.31 H new ATOM 0 HG3 ARG A 91 4.348 -5.360 -5.828 1.00 43.31 H new ATOM 0 HD2 ARG A 91 3.921 -3.069 -5.063 1.00 24.02 H new ATOM 0 HD3 ARG A 91 2.566 -3.608 -4.090 1.00 24.02 H new ATOM 0 HE ARG A 91 4.788 -5.100 -3.208 1.00 52.32 H new ATOM 0 HH11 ARG A 91 3.792 -1.720 -3.420 1.00 64.04 H new ATOM 0 HH12 ARG A 91 4.734 -1.234 -2.007 1.00 64.04 H new ATOM 0 HH21 ARG A 91 5.996 -4.468 -1.394 1.00 70.21 H new ATOM 0 HH22 ARG A 91 5.977 -2.783 -0.863 1.00 70.21 H new ATOM 94 N HIS A 92 2.298 -4.589 -9.697 1.00 20.10 N ATOM 95 CA HIS A 92 2.642 -5.176 -10.988 1.00 61.12 C ATOM 96 C HIS A 92 3.848 -4.472 -11.602 1.00 44.23 C ATOM 97 O HIS A 92 4.699 -5.107 -12.223 1.00 34.04 O ATOM 98 CB HIS A 92 1.450 -5.094 -11.943 1.00 61.10 C ATOM 99 CG HIS A 92 1.275 -6.318 -12.788 1.00 44.40 C ATOM 100 ND1 HIS A 92 0.115 -7.062 -12.806 1.00 73.45 N ATOM 101 CD2 HIS A 92 2.123 -6.925 -13.653 1.00 35.45 C ATOM 102 CE1 HIS A 92 0.256 -8.075 -13.642 1.00 42.11 C ATOM 103 NE2 HIS A 92 1.466 -8.014 -14.169 1.00 11.35 N ATOM 0 H HIS A 92 1.320 -4.315 -9.605 1.00 20.10 H new ATOM 0 HA HIS A 92 2.898 -6.223 -10.826 1.00 61.12 H new ATOM 0 HB2 HIS A 92 0.541 -4.929 -11.364 1.00 61.10 H new ATOM 0 HB3 HIS A 92 1.575 -4.228 -12.593 1.00 61.10 H new ATOM 0 HD2 HIS A 92 3.128 -6.611 -13.892 1.00 35.45 H new ATOM 0 HE1 HIS A 92 -0.490 -8.825 -13.858 1.00 42.11 H new ATOM 0 HE2 HIS A 92 1.850 -8.670 -14.849 1.00 11.35 H new ATOM 111 N GLU A 93 3.914 -3.156 -11.423 1.00 62.03 N ATOM 112 CA GLU A 93 5.016 -2.367 -11.960 1.00 22.40 C ATOM 113 C GLU A 93 6.235 -2.440 -11.045 1.00 33.12 C ATOM 114 O GLU A 93 7.373 -2.343 -11.501 1.00 63.31 O ATOM 115 CB GLU A 93 4.587 -0.910 -12.143 1.00 71.43 C ATOM 116 CG GLU A 93 3.538 -0.715 -13.224 1.00 15.43 C ATOM 117 CD GLU A 93 3.259 0.748 -13.510 1.00 43.51 C ATOM 118 OE1 GLU A 93 3.940 1.608 -12.913 1.00 60.32 O1- ATOM 119 OE2 GLU A 93 2.362 1.032 -14.329 1.00 11.33 O ATOM 0 H GLU A 93 3.218 -2.615 -10.911 1.00 62.03 H new ATOM 0 HA GLU A 93 5.288 -2.783 -12.930 1.00 22.40 H new ATOM 0 HB2 GLU A 93 4.196 -0.534 -11.198 1.00 71.43 H new ATOM 0 HB3 GLU A 93 5.464 -0.310 -12.387 1.00 71.43 H new ATOM 0 HG2 GLU A 93 3.871 -1.203 -14.140 1.00 15.43 H new ATOM 0 HG3 GLU A 93 2.613 -1.205 -12.920 1.00 15.43 H new ATOM 126 N ALA A 94 5.986 -2.610 -9.751 1.00 71.42 N ATOM 127 CA ALA A 94 7.061 -2.698 -8.771 1.00 50.12 C ATOM 128 C ALA A 94 7.807 -4.022 -8.890 1.00 2.41 C ATOM 129 O ALA A 94 8.972 -4.126 -8.505 1.00 44.00 O ATOM 130 CB ALA A 94 6.508 -2.526 -7.364 1.00 70.33 C ATOM 0 H ALA A 94 5.049 -2.690 -9.357 1.00 71.42 H new ATOM 0 HA ALA A 94 7.769 -1.894 -8.973 1.00 50.12 H new ATOM 0 HB1 ALA A 94 7.322 -2.594 -6.642 1.00 70.33 H new ATOM 0 HB2 ALA A 94 6.028 -1.551 -7.278 1.00 70.33 H new ATOM 0 HB3 ALA A 94 5.778 -3.309 -7.162 1.00 70.33 H new ATOM 136 N TRP A 95 7.130 -5.030 -9.427 1.00 33.54 N ATOM 137 CA TRP A 95 7.730 -6.348 -9.596 1.00 2.43 C ATOM 138 C TRP A 95 8.979 -6.271 -10.466 1.00 64.44 C ATOM 139 O TRP A 95 9.848 -7.142 -10.400 1.00 61.23 O ATOM 140 CB TRP A 95 6.720 -7.314 -10.218 1.00 2.15 C ATOM 141 CG TRP A 95 5.557 -7.617 -9.323 1.00 41.24 C ATOM 142 CD1 TRP A 95 5.476 -7.385 -7.979 1.00 14.00 C ATOM 143 CD2 TRP A 95 4.313 -8.211 -9.705 1.00 42.31 C ATOM 144 NE1 TRP A 95 4.255 -7.798 -7.504 1.00 71.33 N ATOM 145 CE2 TRP A 95 3.523 -8.308 -8.543 1.00 74.32 C ATOM 146 CE3 TRP A 95 3.787 -8.668 -10.916 1.00 42.51 C ATOM 147 CZ2 TRP A 95 2.238 -8.843 -8.560 1.00 53.54 C ATOM 148 CZ3 TRP A 95 2.512 -9.201 -10.932 1.00 13.11 C ATOM 149 CH2 TRP A 95 1.748 -9.284 -9.759 1.00 33.31 C ATOM 0 H TRP A 95 6.166 -4.960 -9.753 1.00 33.54 H new ATOM 0 HA TRP A 95 8.018 -6.717 -8.612 1.00 2.43 H new ATOM 0 HB2 TRP A 95 6.350 -6.890 -11.151 1.00 2.15 H new ATOM 0 HB3 TRP A 95 7.227 -8.245 -10.470 1.00 2.15 H new ATOM 0 HD1 TRP A 95 6.257 -6.942 -7.379 1.00 14.00 H new ATOM 0 HE1 TRP A 95 3.944 -7.735 -6.535 1.00 71.33 H new ATOM 0 HE3 TRP A 95 4.367 -8.606 -11.825 1.00 42.51 H new ATOM 0 HZ2 TRP A 95 1.648 -8.908 -7.658 1.00 53.54 H new ATOM 0 HZ3 TRP A 95 2.097 -9.559 -11.863 1.00 13.11 H new ATOM 0 HH2 TRP A 95 0.754 -9.704 -9.803 1.00 33.31 H new ATOM 160 N ILE A 96 9.065 -5.222 -11.279 1.00 55.12 N ATOM 161 CA ILE A 96 10.211 -5.031 -12.160 1.00 34.21 C ATOM 162 C ILE A 96 11.521 -5.130 -11.387 1.00 70.15 C ATOM 163 O ILE A 96 12.547 -5.539 -11.932 1.00 2.25 O ATOM 164 CB ILE A 96 10.149 -3.668 -12.874 1.00 32.45 C ATOM 165 CG1 ILE A 96 8.861 -3.552 -13.689 1.00 12.32 C ATOM 166 CG2 ILE A 96 11.367 -3.483 -13.767 1.00 51.44 C ATOM 167 CD1 ILE A 96 8.558 -2.141 -14.144 1.00 41.21 C ATOM 0 H ILE A 96 8.355 -4.492 -11.345 1.00 55.12 H new ATOM 0 HA ILE A 96 10.173 -5.825 -12.906 1.00 34.21 H new ATOM 0 HB ILE A 96 10.151 -2.880 -12.121 1.00 32.45 H new ATOM 0 HG12 ILE A 96 8.934 -4.199 -14.563 1.00 12.32 H new ATOM 0 HG13 ILE A 96 8.027 -3.919 -13.090 1.00 12.32 H new ATOM 0 HG21 ILE A 96 11.309 -2.515 -14.265 1.00 51.44 H new ATOM 0 HG22 ILE A 96 12.272 -3.526 -13.161 1.00 51.44 H new ATOM 0 HG23 ILE A 96 11.393 -4.275 -14.515 1.00 51.44 H new ATOM 0 HD11 ILE A 96 7.630 -2.135 -14.716 1.00 41.21 H new ATOM 0 HD12 ILE A 96 8.452 -1.493 -13.274 1.00 41.21 H new ATOM 0 HD13 ILE A 96 9.373 -1.778 -14.770 1.00 41.21 H new ATOM 179 N THR A 97 11.480 -4.753 -10.113 1.00 51.42 N ATOM 180 CA THR A 97 12.665 -4.799 -9.264 1.00 31.44 C ATOM 181 C THR A 97 13.148 -6.232 -9.073 1.00 41.10 C ATOM 182 O THR A 97 14.320 -6.538 -9.295 1.00 50.20 O ATOM 183 CB THR A 97 12.391 -4.173 -7.884 1.00 14.40 C ATOM 184 OG1 THR A 97 11.321 -4.869 -7.234 1.00 50.05 O ATOM 185 CG2 THR A 97 12.036 -2.700 -8.018 1.00 60.33 C ATOM 0 H THR A 97 10.639 -4.412 -9.646 1.00 51.42 H new ATOM 0 HA THR A 97 13.439 -4.222 -9.769 1.00 31.44 H new ATOM 0 HB THR A 97 13.297 -4.259 -7.285 1.00 14.40 H new ATOM 0 HG1 THR A 97 10.470 -4.629 -7.657 1.00 50.05 H new ATOM 0 HG21 THR A 97 11.847 -2.280 -7.030 1.00 60.33 H new ATOM 0 HG22 THR A 97 12.864 -2.167 -8.486 1.00 60.33 H new ATOM 0 HG23 THR A 97 11.143 -2.596 -8.634 1.00 60.33 H new ATOM 193 N LEU A 98 12.238 -7.109 -8.660 1.00 70.21 N ATOM 194 CA LEU A 98 12.572 -8.511 -8.440 1.00 75.55 C ATOM 195 C LEU A 98 12.823 -9.226 -9.763 1.00 22.22 C ATOM 196 O LEU A 98 13.486 -10.261 -9.805 1.00 13.11 O ATOM 197 CB LEU A 98 11.446 -9.210 -7.675 1.00 74.34 C ATOM 198 CG LEU A 98 10.222 -9.608 -8.500 1.00 35.43 C ATOM 199 CD1 LEU A 98 10.127 -11.121 -8.618 1.00 20.42 C ATOM 200 CD2 LEU A 98 8.953 -9.040 -7.878 1.00 61.11 C ATOM 0 H LEU A 98 11.264 -6.873 -8.471 1.00 70.21 H new ATOM 0 HA LEU A 98 13.486 -8.552 -7.848 1.00 75.55 H new ATOM 0 HB2 LEU A 98 11.853 -10.107 -7.209 1.00 74.34 H new ATOM 0 HB3 LEU A 98 11.118 -8.553 -6.869 1.00 74.34 H new ATOM 0 HG LEU A 98 10.331 -9.192 -9.501 1.00 35.43 H new ATOM 0 HD11 LEU A 98 9.250 -11.386 -9.208 1.00 20.42 H new ATOM 0 HD12 LEU A 98 11.023 -11.505 -9.107 1.00 20.42 H new ATOM 0 HD13 LEU A 98 10.040 -11.559 -7.624 1.00 20.42 H new ATOM 0 HD21 LEU A 98 8.091 -9.333 -8.478 1.00 61.11 H new ATOM 0 HD22 LEU A 98 8.839 -9.428 -6.866 1.00 61.11 H new ATOM 0 HD23 LEU A 98 9.019 -7.953 -7.845 1.00 61.11 H new ATOM 212 N GLU A 99 12.289 -8.664 -10.844 1.00 4.44 N ATOM 213 CA GLU A 99 12.456 -9.249 -12.169 1.00 1.33 C ATOM 214 C GLU A 99 13.933 -9.335 -12.543 1.00 35.40 C ATOM 215 O GLU A 99 14.428 -10.395 -12.926 1.00 24.30 O ATOM 216 CB GLU A 99 11.701 -8.423 -13.214 1.00 15.35 C ATOM 217 CG GLU A 99 10.780 -9.251 -14.094 1.00 32.50 C ATOM 218 CD GLU A 99 10.255 -8.471 -15.284 1.00 23.42 C ATOM 219 OE1 GLU A 99 11.079 -7.992 -16.091 1.00 23.50 O1- ATOM 220 OE2 GLU A 99 9.019 -8.341 -15.407 1.00 0.21 O ATOM 0 H GLU A 99 11.738 -7.806 -10.828 1.00 4.44 H new ATOM 0 HA GLU A 99 12.045 -10.258 -12.148 1.00 1.33 H new ATOM 0 HB2 GLU A 99 11.114 -7.659 -12.705 1.00 15.35 H new ATOM 0 HB3 GLU A 99 12.422 -7.904 -13.845 1.00 15.35 H new ATOM 0 HG2 GLU A 99 11.317 -10.131 -14.449 1.00 32.50 H new ATOM 0 HG3 GLU A 99 9.940 -9.609 -13.499 1.00 32.50 H new ATOM 227 N LYS A 100 14.632 -8.211 -12.431 1.00 11.05 N ATOM 228 CA LYS A 100 16.052 -8.157 -12.755 1.00 40.42 C ATOM 229 C LYS A 100 16.841 -9.159 -11.918 1.00 54.22 C ATOM 230 O LYS A 100 17.893 -9.640 -12.336 1.00 73.30 O ATOM 231 CB LYS A 100 16.596 -6.745 -12.526 1.00 73.52 C ATOM 232 CG LYS A 100 15.890 -5.680 -13.347 1.00 14.42 C ATOM 233 CD LYS A 100 16.255 -5.778 -14.819 1.00 74.54 C ATOM 234 CE LYS A 100 15.858 -4.520 -15.576 1.00 0.53 C ATOM 235 NZ LYS A 100 14.391 -4.461 -15.823 1.00 11.21 N1+ ATOM 0 H LYS A 100 14.237 -7.324 -12.118 1.00 11.05 H new ATOM 0 HA LYS A 100 16.168 -8.418 -13.807 1.00 40.42 H new ATOM 0 HB2 LYS A 100 16.504 -6.497 -11.469 1.00 73.52 H new ATOM 0 HB3 LYS A 100 17.659 -6.731 -12.766 1.00 73.52 H new ATOM 0 HG2 LYS A 100 14.811 -5.785 -13.231 1.00 14.42 H new ATOM 0 HG3 LYS A 100 16.156 -4.693 -12.970 1.00 14.42 H new ATOM 0 HD2 LYS A 100 17.328 -5.941 -14.919 1.00 74.54 H new ATOM 0 HD3 LYS A 100 15.759 -6.642 -15.261 1.00 74.54 H new ATOM 0 HE2 LYS A 100 16.166 -3.642 -15.008 1.00 0.53 H new ATOM 0 HE3 LYS A 100 16.388 -4.486 -16.528 1.00 0.53 H new ATOM 0 HZ1 LYS A 100 14.161 -3.589 -16.341 1.00 11.21 H new ATOM 0 HZ2 LYS A 100 14.100 -5.285 -16.386 1.00 11.21 H new ATOM 0 HZ3 LYS A 100 13.885 -4.467 -14.914 1.00 11.21 H new ATOM 249 N ALA A 101 16.323 -9.470 -10.733 1.00 55.34 N ATOM 250 CA ALA A 101 16.977 -10.418 -9.839 1.00 52.53 C ATOM 251 C ALA A 101 17.292 -11.724 -10.559 1.00 52.15 C ATOM 252 O ALA A 101 18.410 -12.235 -10.478 1.00 73.43 O ATOM 253 CB ALA A 101 16.105 -10.681 -8.621 1.00 21.20 C ATOM 0 H ALA A 101 15.453 -9.079 -10.371 1.00 55.34 H new ATOM 0 HA ALA A 101 17.919 -9.979 -9.510 1.00 52.53 H new ATOM 0 HB1 ALA A 101 16.605 -11.391 -7.962 1.00 21.20 H new ATOM 0 HB2 ALA A 101 15.935 -9.746 -8.086 1.00 21.20 H new ATOM 0 HB3 ALA A 101 15.149 -11.095 -8.941 1.00 21.20 H new ATOM 259 N TYR A 102 16.301 -12.261 -11.262 1.00 21.11 N ATOM 260 CA TYR A 102 16.472 -13.510 -11.993 1.00 31.20 C ATOM 261 C TYR A 102 17.644 -13.416 -12.966 1.00 54.12 C ATOM 262 O TYR A 102 18.339 -14.401 -13.213 1.00 14.45 O ATOM 263 CB TYR A 102 15.191 -13.859 -12.754 1.00 13.11 C ATOM 264 CG TYR A 102 14.011 -14.148 -11.853 1.00 64.12 C ATOM 265 CD1 TYR A 102 13.892 -15.369 -11.202 1.00 62.33 C ATOM 266 CD2 TYR A 102 13.017 -13.198 -11.652 1.00 0.35 C ATOM 267 CE1 TYR A 102 12.815 -15.638 -10.378 1.00 42.33 C ATOM 268 CE2 TYR A 102 11.938 -13.457 -10.828 1.00 40.03 C ATOM 269 CZ TYR A 102 11.842 -14.678 -10.195 1.00 31.20 C ATOM 270 OH TYR A 102 10.769 -14.941 -9.374 1.00 20.33 O ATOM 0 H TYR A 102 15.371 -11.850 -11.341 1.00 21.11 H new ATOM 0 HA TYR A 102 16.685 -14.298 -11.271 1.00 31.20 H new ATOM 0 HB2 TYR A 102 14.937 -13.033 -13.418 1.00 13.11 H new ATOM 0 HB3 TYR A 102 15.378 -14.729 -13.384 1.00 13.11 H new ATOM 0 HD1 TYR A 102 14.654 -16.121 -11.342 1.00 62.33 H new ATOM 0 HD2 TYR A 102 13.089 -12.241 -12.148 1.00 0.35 H new ATOM 0 HE1 TYR A 102 12.736 -16.594 -9.881 1.00 42.33 H new ATOM 0 HE2 TYR A 102 11.175 -12.707 -10.681 1.00 40.03 H new ATOM 0 HH TYR A 102 10.175 -14.162 -9.352 1.00 20.33 H new ATOM 280 N GLU A 103 17.857 -12.224 -13.513 1.00 1.02 N ATOM 281 CA GLU A 103 18.945 -12.001 -14.458 1.00 60.41 C ATOM 282 C GLU A 103 20.295 -12.293 -13.812 1.00 12.44 C ATOM 283 O GLU A 103 21.260 -12.638 -14.494 1.00 10.12 O ATOM 284 CB GLU A 103 18.914 -10.561 -14.974 1.00 65.01 C ATOM 285 CG GLU A 103 19.006 -10.454 -16.486 1.00 0.13 C ATOM 286 CD GLU A 103 19.719 -9.195 -16.941 1.00 52.23 C ATOM 287 OE1 GLU A 103 20.854 -8.958 -16.477 1.00 20.11 O1- ATOM 288 OE2 GLU A 103 19.143 -8.447 -17.758 1.00 62.03 O ATOM 0 H GLU A 103 17.291 -11.398 -13.318 1.00 1.02 H new ATOM 0 HA GLU A 103 18.809 -12.683 -15.297 1.00 60.41 H new ATOM 0 HB2 GLU A 103 17.993 -10.084 -14.640 1.00 65.01 H new ATOM 0 HB3 GLU A 103 19.740 -10.006 -14.528 1.00 65.01 H new ATOM 0 HG2 GLU A 103 19.531 -11.326 -16.877 1.00 0.13 H new ATOM 0 HG3 GLU A 103 18.002 -10.471 -16.909 1.00 0.13 H new ATOM 295 N ASP A 104 20.356 -12.153 -12.491 1.00 24.32 N ATOM 296 CA ASP A 104 21.588 -12.403 -11.752 1.00 22.21 C ATOM 297 C ASP A 104 21.518 -13.737 -11.016 1.00 53.01 C ATOM 298 O ASP A 104 22.254 -13.966 -10.056 1.00 74.24 O ATOM 299 CB ASP A 104 21.848 -11.270 -10.757 1.00 44.00 C ATOM 300 CG ASP A 104 21.994 -9.923 -11.438 1.00 42.43 C ATOM 301 OD1 ASP A 104 22.264 -9.901 -12.656 1.00 73.33 O ATOM 302 OD2 ASP A 104 21.842 -8.891 -10.750 1.00 63.21 O1- ATOM 0 H ASP A 104 19.567 -11.868 -11.911 1.00 24.32 H new ATOM 0 HA ASP A 104 22.410 -12.445 -12.466 1.00 22.21 H new ATOM 0 HB2 ASP A 104 21.028 -11.224 -10.040 1.00 44.00 H new ATOM 0 HB3 ASP A 104 22.754 -11.488 -10.191 1.00 44.00 H new ATOM 307 N ALA A 105 20.630 -14.613 -11.473 1.00 63.33 N ATOM 308 CA ALA A 105 20.466 -15.926 -10.859 1.00 75.23 C ATOM 309 C ALA A 105 20.114 -15.799 -9.380 1.00 40.43 C ATOM 310 O ALA A 105 20.907 -16.165 -8.512 1.00 42.15 O ATOM 311 CB ALA A 105 21.732 -16.753 -11.035 1.00 34.51 C ATOM 0 H ALA A 105 20.013 -14.438 -12.266 1.00 63.33 H new ATOM 0 HA ALA A 105 19.642 -16.435 -11.359 1.00 75.23 H new ATOM 0 HB1 ALA A 105 21.595 -17.730 -10.572 1.00 34.51 H new ATOM 0 HB2 ALA A 105 21.938 -16.881 -12.098 1.00 34.51 H new ATOM 0 HB3 ALA A 105 22.570 -16.241 -10.562 1.00 34.51 H new ATOM 317 N GLU A 106 18.923 -15.280 -9.102 1.00 74.03 N ATOM 318 CA GLU A 106 18.469 -15.106 -7.728 1.00 75.25 C ATOM 319 C GLU A 106 17.444 -16.173 -7.353 1.00 23.20 C ATOM 320 O GLU A 106 17.047 -16.989 -8.186 1.00 54.54 O ATOM 321 CB GLU A 106 17.864 -13.713 -7.541 1.00 21.20 C ATOM 322 CG GLU A 106 18.852 -12.685 -7.017 1.00 43.42 C ATOM 323 CD GLU A 106 19.504 -13.113 -5.717 1.00 0.21 C ATOM 324 OE1 GLU A 106 18.768 -13.435 -4.762 1.00 14.12 O1- ATOM 325 OE2 GLU A 106 20.752 -13.124 -5.654 1.00 44.33 O ATOM 0 H GLU A 106 18.255 -14.973 -9.809 1.00 74.03 H new ATOM 0 HA GLU A 106 19.332 -15.211 -7.071 1.00 75.25 H new ATOM 0 HB2 GLU A 106 17.466 -13.368 -8.495 1.00 21.20 H new ATOM 0 HB3 GLU A 106 17.023 -13.781 -6.851 1.00 21.20 H new ATOM 0 HG2 GLU A 106 19.624 -12.513 -7.767 1.00 43.42 H new ATOM 0 HG3 GLU A 106 18.337 -11.736 -6.866 1.00 43.42 H new ATOM 332 N THR A 107 17.018 -16.160 -6.093 1.00 4.24 N ATOM 333 CA THR A 107 16.043 -17.127 -5.608 1.00 44.41 C ATOM 334 C THR A 107 14.798 -16.428 -5.071 1.00 60.01 C ATOM 335 O THR A 107 14.809 -15.222 -4.822 1.00 43.33 O ATOM 336 CB THR A 107 16.636 -18.016 -4.499 1.00 43.42 C ATOM 337 OG1 THR A 107 15.706 -19.046 -4.147 1.00 2.32 O ATOM 338 CG2 THR A 107 16.978 -17.191 -3.268 1.00 72.55 C ATOM 0 H THR A 107 17.333 -15.490 -5.391 1.00 4.24 H new ATOM 0 HA THR A 107 15.769 -17.753 -6.457 1.00 44.41 H new ATOM 0 HB THR A 107 17.552 -18.469 -4.878 1.00 43.42 H new ATOM 0 HG1 THR A 107 15.824 -19.285 -3.204 1.00 2.32 H new ATOM 0 HG21 THR A 107 17.395 -17.841 -2.499 1.00 72.55 H new ATOM 0 HG22 THR A 107 17.709 -16.427 -3.533 1.00 72.55 H new ATOM 0 HG23 THR A 107 16.075 -16.713 -2.888 1.00 72.55 H new ATOM 346 N VAL A 108 13.726 -17.194 -4.891 1.00 20.54 N ATOM 347 CA VAL A 108 12.473 -16.648 -4.381 1.00 41.44 C ATOM 348 C VAL A 108 11.874 -17.555 -3.312 1.00 71.21 C ATOM 349 O VAL A 108 12.455 -18.579 -2.954 1.00 42.35 O ATOM 350 CB VAL A 108 11.445 -16.455 -5.511 1.00 65.54 C ATOM 351 CG1 VAL A 108 11.964 -15.465 -6.544 1.00 22.45 C ATOM 352 CG2 VAL A 108 11.110 -17.789 -6.161 1.00 1.14 C ATOM 0 H VAL A 108 13.700 -18.194 -5.091 1.00 20.54 H new ATOM 0 HA VAL A 108 12.705 -15.678 -3.942 1.00 41.44 H new ATOM 0 HB VAL A 108 10.531 -16.047 -5.080 1.00 65.54 H new ATOM 0 HG11 VAL A 108 11.223 -15.342 -7.334 1.00 22.45 H new ATOM 0 HG12 VAL A 108 12.147 -14.503 -6.066 1.00 22.45 H new ATOM 0 HG13 VAL A 108 12.893 -15.840 -6.973 1.00 22.45 H new ATOM 0 HG21 VAL A 108 10.382 -17.633 -6.957 1.00 1.14 H new ATOM 0 HG22 VAL A 108 12.016 -18.228 -6.579 1.00 1.14 H new ATOM 0 HG23 VAL A 108 10.691 -18.463 -5.414 1.00 1.14 H new ATOM 362 N THR A 109 10.707 -17.170 -2.806 1.00 0.35 N ATOM 363 CA THR A 109 10.028 -17.947 -1.776 1.00 72.43 C ATOM 364 C THR A 109 8.523 -17.709 -1.810 1.00 62.13 C ATOM 365 O THR A 109 8.061 -16.575 -1.695 1.00 25.51 O ATOM 366 CB THR A 109 10.558 -17.603 -0.372 1.00 21.55 C ATOM 367 OG1 THR A 109 9.802 -18.304 0.623 1.00 40.31 O ATOM 368 CG2 THR A 109 10.479 -16.106 -0.114 1.00 24.53 C ATOM 0 H THR A 109 10.212 -16.325 -3.092 1.00 0.35 H new ATOM 0 HA THR A 109 10.232 -18.997 -1.987 1.00 72.43 H new ATOM 0 HB THR A 109 11.602 -17.910 -0.318 1.00 21.55 H new ATOM 0 HG1 THR A 109 10.146 -18.081 1.513 1.00 40.31 H new ATOM 0 HG21 THR A 109 10.859 -15.888 0.884 1.00 24.53 H new ATOM 0 HG22 THR A 109 11.079 -15.577 -0.854 1.00 24.53 H new ATOM 0 HG23 THR A 109 9.442 -15.778 -0.187 1.00 24.53 H new ATOM 376 N GLY A 110 7.762 -18.787 -1.971 1.00 43.33 N ATOM 377 CA GLY A 110 6.315 -18.674 -2.017 1.00 13.05 C ATOM 378 C GLY A 110 5.620 -19.969 -1.647 1.00 3.55 C ATOM 379 O GLY A 110 6.160 -21.055 -1.860 1.00 41.25 O ATOM 0 H GLY A 110 8.121 -19.737 -2.070 1.00 43.33 H new ATOM 0 HA2 GLY A 110 5.993 -17.886 -1.337 1.00 13.05 H new ATOM 0 HA3 GLY A 110 6.009 -18.374 -3.019 1.00 13.05 H new ATOM 383 N VAL A 111 4.419 -19.856 -1.089 1.00 54.30 N ATOM 384 CA VAL A 111 3.649 -21.027 -0.688 1.00 20.01 C ATOM 385 C VAL A 111 2.442 -21.229 -1.598 1.00 45.43 C ATOM 386 O VAL A 111 1.790 -20.267 -2.004 1.00 13.55 O ATOM 387 CB VAL A 111 3.165 -20.908 0.770 1.00 12.42 C ATOM 388 CG1 VAL A 111 2.327 -19.652 0.953 1.00 14.12 C ATOM 389 CG2 VAL A 111 2.378 -22.146 1.172 1.00 40.44 C ATOM 0 H VAL A 111 3.958 -18.965 -0.904 1.00 54.30 H new ATOM 0 HA VAL A 111 4.313 -21.887 -0.774 1.00 20.01 H new ATOM 0 HB VAL A 111 4.037 -20.832 1.419 1.00 12.42 H new ATOM 0 HG11 VAL A 111 1.994 -19.585 1.989 1.00 14.12 H new ATOM 0 HG12 VAL A 111 2.926 -18.776 0.707 1.00 14.12 H new ATOM 0 HG13 VAL A 111 1.459 -19.694 0.295 1.00 14.12 H new ATOM 0 HG21 VAL A 111 2.044 -22.045 2.205 1.00 40.44 H new ATOM 0 HG22 VAL A 111 1.512 -22.254 0.519 1.00 40.44 H new ATOM 0 HG23 VAL A 111 3.014 -23.027 1.081 1.00 40.44 H new ATOM 399 N ILE A 112 2.150 -22.486 -1.912 1.00 15.31 N ATOM 400 CA ILE A 112 1.020 -22.815 -2.774 1.00 63.34 C ATOM 401 C ILE A 112 -0.304 -22.488 -2.091 1.00 32.02 C ATOM 402 O ILE A 112 -0.773 -23.237 -1.234 1.00 22.02 O ATOM 403 CB ILE A 112 1.028 -24.304 -3.168 1.00 73.40 C ATOM 404 CG1 ILE A 112 2.329 -24.655 -3.893 1.00 51.40 C ATOM 405 CG2 ILE A 112 -0.176 -24.626 -4.042 1.00 51.04 C ATOM 406 CD1 ILE A 112 3.363 -25.302 -3.000 1.00 44.52 C ATOM 0 H ILE A 112 2.679 -23.294 -1.583 1.00 15.31 H new ATOM 0 HA ILE A 112 1.122 -22.209 -3.674 1.00 63.34 H new ATOM 0 HB ILE A 112 0.966 -24.906 -2.261 1.00 73.40 H new ATOM 0 HG12 ILE A 112 2.104 -25.327 -4.721 1.00 51.40 H new ATOM 0 HG13 ILE A 112 2.751 -23.748 -4.325 1.00 51.40 H new ATOM 0 HG21 ILE A 112 -0.157 -25.682 -4.313 1.00 51.04 H new ATOM 0 HG22 ILE A 112 -1.092 -24.408 -3.493 1.00 51.04 H new ATOM 0 HG23 ILE A 112 -0.142 -24.019 -4.947 1.00 51.04 H new ATOM 0 HD11 ILE A 112 4.258 -25.523 -3.581 1.00 44.52 H new ATOM 0 HD12 ILE A 112 3.617 -24.623 -2.186 1.00 44.52 H new ATOM 0 HD13 ILE A 112 2.960 -26.227 -2.588 1.00 44.52 H new ATOM 418 N ASN A 113 -0.902 -21.367 -2.479 1.00 70.02 N ATOM 419 CA ASN A 113 -2.174 -20.942 -1.905 1.00 33.21 C ATOM 420 C ASN A 113 -3.346 -21.480 -2.720 1.00 62.31 C ATOM 421 O ASN A 113 -4.441 -21.680 -2.195 1.00 53.33 O ATOM 422 CB ASN A 113 -2.243 -19.415 -1.840 1.00 33.10 C ATOM 423 CG ASN A 113 -3.296 -18.924 -0.865 1.00 43.33 C ATOM 424 OD1 ASN A 113 -4.291 -19.604 -0.616 1.00 34.24 O ATOM 425 ND2 ASN A 113 -3.080 -17.737 -0.308 1.00 44.13 N ATOM 0 H ASN A 113 -0.527 -20.737 -3.188 1.00 70.02 H new ATOM 0 HA ASN A 113 -2.241 -21.346 -0.895 1.00 33.21 H new ATOM 0 HB2 ASN A 113 -1.269 -19.022 -1.547 1.00 33.10 H new ATOM 0 HB3 ASN A 113 -2.460 -19.021 -2.833 1.00 33.10 H new ATOM 0 HD21 ASN A 113 -3.754 -17.355 0.356 1.00 44.13 H new ATOM 0 HD22 ASN A 113 -2.241 -17.208 -0.544 1.00 44.13 H new ATOM 432 N GLY A 114 -3.107 -21.713 -4.007 1.00 13.12 N ATOM 433 CA GLY A 114 -4.151 -22.227 -4.874 1.00 74.52 C ATOM 434 C GLY A 114 -3.668 -23.365 -5.751 1.00 51.31 C ATOM 435 O GLY A 114 -2.530 -23.357 -6.221 1.00 72.15 O ATOM 0 H GLY A 114 -2.209 -21.555 -4.465 1.00 13.12 H new ATOM 0 HA2 GLY A 114 -4.988 -22.571 -4.266 1.00 74.52 H new ATOM 0 HA3 GLY A 114 -4.526 -21.420 -5.504 1.00 74.52 H new ATOM 439 N LYS A 115 -4.535 -24.347 -5.974 1.00 74.23 N ATOM 440 CA LYS A 115 -4.193 -25.498 -6.801 1.00 34.25 C ATOM 441 C LYS A 115 -5.189 -25.663 -7.944 1.00 42.21 C ATOM 442 O LYS A 115 -6.398 -25.539 -7.749 1.00 24.11 O ATOM 443 CB LYS A 115 -4.160 -26.771 -5.951 1.00 22.32 C ATOM 444 CG LYS A 115 -5.460 -27.044 -5.214 1.00 35.33 C ATOM 445 CD LYS A 115 -5.360 -28.291 -4.353 1.00 22.31 C ATOM 446 CE LYS A 115 -5.698 -29.544 -5.145 1.00 75.20 C ATOM 447 NZ LYS A 115 -4.485 -30.156 -5.758 1.00 11.23 N1+ ATOM 0 H LYS A 115 -5.481 -24.369 -5.593 1.00 74.23 H new ATOM 0 HA LYS A 115 -3.204 -25.327 -7.227 1.00 34.25 H new ATOM 0 HB2 LYS A 115 -3.931 -27.621 -6.594 1.00 22.32 H new ATOM 0 HB3 LYS A 115 -3.350 -26.693 -5.225 1.00 22.32 H new ATOM 0 HG2 LYS A 115 -5.712 -26.188 -4.588 1.00 35.33 H new ATOM 0 HG3 LYS A 115 -6.270 -27.162 -5.934 1.00 35.33 H new ATOM 0 HD2 LYS A 115 -4.351 -28.376 -3.949 1.00 22.31 H new ATOM 0 HD3 LYS A 115 -6.037 -28.203 -3.503 1.00 22.31 H new ATOM 0 HE2 LYS A 115 -6.179 -30.270 -4.489 1.00 75.20 H new ATOM 0 HE3 LYS A 115 -6.415 -29.297 -5.928 1.00 75.20 H new ATOM 0 HZ1 LYS A 115 -4.641 -30.291 -6.777 1.00 11.23 H new ATOM 0 HZ2 LYS A 115 -3.668 -29.528 -5.613 1.00 11.23 H new ATOM 0 HZ3 LYS A 115 -4.298 -31.077 -5.312 1.00 11.23 H new ATOM 461 N VAL A 116 -4.673 -25.945 -9.136 1.00 23.14 N ATOM 462 CA VAL A 116 -5.518 -26.131 -10.310 1.00 34.23 C ATOM 463 C VAL A 116 -5.371 -27.538 -10.877 1.00 0.13 C ATOM 464 O VAL A 116 -4.567 -28.334 -10.391 1.00 22.41 O ATOM 465 CB VAL A 116 -5.180 -25.109 -11.411 1.00 11.42 C ATOM 466 CG1 VAL A 116 -5.575 -23.705 -10.977 1.00 22.33 C ATOM 467 CG2 VAL A 116 -3.701 -25.171 -11.760 1.00 71.40 C ATOM 0 H VAL A 116 -3.674 -26.050 -9.314 1.00 23.14 H new ATOM 0 HA VAL A 116 -6.548 -25.979 -9.986 1.00 34.23 H new ATOM 0 HB VAL A 116 -5.752 -25.362 -12.304 1.00 11.42 H new ATOM 0 HG11 VAL A 116 -5.328 -22.997 -11.768 1.00 22.33 H new ATOM 0 HG12 VAL A 116 -6.647 -23.672 -10.782 1.00 22.33 H new ATOM 0 HG13 VAL A 116 -5.033 -23.439 -10.070 1.00 22.33 H new ATOM 0 HG21 VAL A 116 -3.480 -24.442 -12.540 1.00 71.40 H new ATOM 0 HG22 VAL A 116 -3.108 -24.945 -10.874 1.00 71.40 H new ATOM 0 HG23 VAL A 116 -3.453 -26.171 -12.117 1.00 71.40 H new ATOM 477 N LYS A 117 -6.154 -27.840 -11.908 1.00 32.33 N ATOM 478 CA LYS A 117 -6.111 -29.151 -12.543 1.00 42.33 C ATOM 479 C LYS A 117 -4.768 -29.381 -13.227 1.00 14.34 C ATOM 480 O LYS A 117 -4.548 -28.932 -14.352 1.00 60.05 O ATOM 481 CB LYS A 117 -7.244 -29.283 -13.563 1.00 61.43 C ATOM 482 CG LYS A 117 -8.623 -29.374 -12.932 1.00 62.31 C ATOM 483 CD LYS A 117 -9.208 -27.995 -12.673 1.00 13.11 C ATOM 484 CE LYS A 117 -10.720 -28.051 -12.518 1.00 34.15 C ATOM 485 NZ LYS A 117 -11.127 -28.867 -11.340 1.00 72.03 N1+ ATOM 0 H LYS A 117 -6.826 -27.194 -12.321 1.00 32.33 H new ATOM 0 HA LYS A 117 -6.238 -29.907 -11.768 1.00 42.33 H new ATOM 0 HB2 LYS A 117 -7.217 -28.426 -14.236 1.00 61.43 H new ATOM 0 HB3 LYS A 117 -7.073 -30.171 -14.171 1.00 61.43 H new ATOM 0 HG2 LYS A 117 -9.288 -29.936 -13.588 1.00 62.31 H new ATOM 0 HG3 LYS A 117 -8.560 -29.926 -11.994 1.00 62.31 H new ATOM 0 HD2 LYS A 117 -8.764 -27.574 -11.771 1.00 13.11 H new ATOM 0 HD3 LYS A 117 -8.950 -27.329 -13.496 1.00 13.11 H new ATOM 0 HE2 LYS A 117 -11.112 -27.039 -12.412 1.00 34.15 H new ATOM 0 HE3 LYS A 117 -11.162 -28.471 -13.421 1.00 34.15 H new ATOM 0 HZ1 LYS A 117 -12.160 -28.825 -11.229 1.00 72.03 H new ATOM 0 HZ2 LYS A 117 -10.834 -29.854 -11.484 1.00 72.03 H new ATOM 0 HZ3 LYS A 117 -10.671 -28.492 -10.484 1.00 72.03 H new ATOM 499 N GLY A 118 -3.871 -30.084 -12.541 1.00 2.22 N ATOM 500 CA GLY A 118 -2.561 -30.362 -13.100 1.00 23.52 C ATOM 501 C GLY A 118 -1.532 -29.319 -12.711 1.00 73.33 C ATOM 502 O GLY A 118 -0.360 -29.637 -12.511 1.00 53.41 O ATOM 0 H GLY A 118 -4.029 -30.466 -11.608 1.00 2.22 H new ATOM 0 HA2 GLY A 118 -2.226 -31.343 -12.762 1.00 23.52 H new ATOM 0 HA3 GLY A 118 -2.635 -30.407 -14.187 1.00 23.52 H new ATOM 506 N GLY A 119 -1.970 -28.069 -12.605 1.00 73.01 N ATOM 507 CA GLY A 119 -1.065 -26.994 -12.239 1.00 40.10 C ATOM 508 C GLY A 119 -1.141 -26.649 -10.765 1.00 3.33 C ATOM 509 O GLY A 119 -1.987 -27.171 -10.040 1.00 23.40 O ATOM 0 H GLY A 119 -2.935 -27.781 -12.766 1.00 73.01 H new ATOM 0 HA2 GLY A 119 -0.044 -27.282 -12.489 1.00 40.10 H new ATOM 0 HA3 GLY A 119 -1.300 -26.108 -12.829 1.00 40.10 H new ATOM 513 N PHE A 120 -0.251 -25.767 -10.319 1.00 21.13 N ATOM 514 CA PHE A 120 -0.219 -25.354 -8.920 1.00 73.13 C ATOM 515 C PHE A 120 0.200 -23.892 -8.794 1.00 33.45 C ATOM 516 O PHE A 120 1.300 -23.513 -9.198 1.00 42.12 O ATOM 517 CB PHE A 120 0.741 -26.242 -8.127 1.00 45.15 C ATOM 518 CG PHE A 120 0.079 -27.447 -7.520 1.00 10.53 C ATOM 519 CD1 PHE A 120 -0.809 -27.308 -6.466 1.00 40.45 C ATOM 520 CD2 PHE A 120 0.347 -28.717 -8.003 1.00 41.15 C ATOM 521 CE1 PHE A 120 -1.418 -28.415 -5.905 1.00 33.12 C ATOM 522 CE2 PHE A 120 -0.260 -29.828 -7.447 1.00 24.30 C ATOM 523 CZ PHE A 120 -1.144 -29.676 -6.397 1.00 54.21 C ATOM 0 H PHE A 120 0.457 -25.325 -10.906 1.00 21.13 H new ATOM 0 HA PHE A 120 -1.224 -25.462 -8.512 1.00 73.13 H new ATOM 0 HB2 PHE A 120 1.545 -26.572 -8.784 1.00 45.15 H new ATOM 0 HB3 PHE A 120 1.199 -25.651 -7.334 1.00 45.15 H new ATOM 0 HD1 PHE A 120 -1.028 -26.324 -6.078 1.00 40.45 H new ATOM 0 HD2 PHE A 120 1.038 -28.841 -8.824 1.00 41.15 H new ATOM 0 HE1 PHE A 120 -2.108 -28.294 -5.083 1.00 33.12 H new ATOM 0 HE2 PHE A 120 -0.043 -30.813 -7.833 1.00 24.30 H new ATOM 0 HZ PHE A 120 -1.620 -30.542 -5.961 1.00 54.21 H new ATOM 533 N THR A 121 -0.685 -23.075 -8.232 1.00 3.13 N ATOM 534 CA THR A 121 -0.409 -21.656 -8.055 1.00 4.13 C ATOM 535 C THR A 121 0.335 -21.399 -6.750 1.00 21.42 C ATOM 536 O THR A 121 0.177 -22.138 -5.778 1.00 71.30 O ATOM 537 CB THR A 121 -1.706 -20.825 -8.064 1.00 11.34 C ATOM 538 OG1 THR A 121 -2.651 -21.402 -8.973 1.00 20.12 O ATOM 539 CG2 THR A 121 -1.424 -19.385 -8.465 1.00 43.11 C ATOM 0 H THR A 121 -1.599 -23.373 -7.892 1.00 3.13 H new ATOM 0 HA THR A 121 0.216 -21.350 -8.894 1.00 4.13 H new ATOM 0 HB THR A 121 -2.121 -20.830 -7.056 1.00 11.34 H new ATOM 0 HG1 THR A 121 -3.473 -20.869 -8.972 1.00 20.12 H new ATOM 0 HG21 THR A 121 -2.355 -18.818 -8.464 1.00 43.11 H new ATOM 0 HG22 THR A 121 -0.727 -18.939 -7.755 1.00 43.11 H new ATOM 0 HG23 THR A 121 -0.988 -19.364 -9.464 1.00 43.11 H new ATOM 547 N VAL A 122 1.148 -20.347 -6.733 1.00 12.32 N ATOM 548 CA VAL A 122 1.915 -19.992 -5.545 1.00 62.52 C ATOM 549 C VAL A 122 1.922 -18.485 -5.325 1.00 11.44 C ATOM 550 O VAL A 122 2.179 -17.714 -6.250 1.00 22.11 O ATOM 551 CB VAL A 122 3.369 -20.492 -5.647 1.00 61.21 C ATOM 552 CG1 VAL A 122 4.097 -20.290 -4.326 1.00 4.33 C ATOM 553 CG2 VAL A 122 3.402 -21.954 -6.065 1.00 4.41 C ATOM 0 H VAL A 122 1.292 -19.726 -7.529 1.00 12.32 H new ATOM 0 HA VAL A 122 1.430 -20.477 -4.698 1.00 62.52 H new ATOM 0 HB VAL A 122 3.883 -19.908 -6.411 1.00 61.21 H new ATOM 0 HG11 VAL A 122 5.122 -20.649 -4.417 1.00 4.33 H new ATOM 0 HG12 VAL A 122 4.105 -19.230 -4.073 1.00 4.33 H new ATOM 0 HG13 VAL A 122 3.586 -20.847 -3.540 1.00 4.33 H new ATOM 0 HG21 VAL A 122 4.437 -22.290 -6.132 1.00 4.41 H new ATOM 0 HG22 VAL A 122 2.872 -22.556 -5.326 1.00 4.41 H new ATOM 0 HG23 VAL A 122 2.921 -22.066 -7.037 1.00 4.41 H new ATOM 563 N GLU A 123 1.639 -18.071 -4.094 1.00 1.41 N ATOM 564 CA GLU A 123 1.612 -16.653 -3.752 1.00 24.31 C ATOM 565 C GLU A 123 3.014 -16.144 -3.430 1.00 24.33 C ATOM 566 O GLU A 123 3.516 -16.335 -2.320 1.00 63.43 O ATOM 567 CB GLU A 123 0.682 -16.410 -2.562 1.00 10.44 C ATOM 568 CG GLU A 123 0.716 -14.981 -2.046 1.00 13.44 C ATOM 569 CD GLU A 123 -0.488 -14.642 -1.188 1.00 44.22 C ATOM 570 OE1 GLU A 123 -1.622 -14.961 -1.604 1.00 14.32 O1- ATOM 571 OE2 GLU A 123 -0.297 -14.060 -0.101 1.00 5.32 O ATOM 0 H GLU A 123 1.425 -18.697 -3.317 1.00 1.41 H new ATOM 0 HA GLU A 123 1.235 -16.104 -4.615 1.00 24.31 H new ATOM 0 HB2 GLU A 123 -0.339 -16.658 -2.853 1.00 10.44 H new ATOM 0 HB3 GLU A 123 0.957 -17.086 -1.753 1.00 10.44 H new ATOM 0 HG2 GLU A 123 1.626 -14.830 -1.465 1.00 13.44 H new ATOM 0 HG3 GLU A 123 0.760 -14.294 -2.891 1.00 13.44 H new ATOM 578 N LEU A 124 3.642 -15.497 -4.405 1.00 13.23 N ATOM 579 CA LEU A 124 4.986 -14.961 -4.227 1.00 3.34 C ATOM 580 C LEU A 124 4.941 -13.464 -3.936 1.00 14.51 C ATOM 581 O LEU A 124 5.205 -12.643 -4.814 1.00 51.32 O ATOM 582 CB LEU A 124 5.832 -15.224 -5.473 1.00 74.20 C ATOM 583 CG LEU A 124 6.393 -16.640 -5.617 1.00 25.45 C ATOM 584 CD1 LEU A 124 6.807 -16.907 -7.055 1.00 35.05 C ATOM 585 CD2 LEU A 124 7.570 -16.845 -4.674 1.00 14.43 C ATOM 0 H LEU A 124 3.241 -15.331 -5.328 1.00 13.23 H new ATOM 0 HA LEU A 124 5.441 -15.465 -3.374 1.00 3.34 H new ATOM 0 HB2 LEU A 124 5.226 -15.004 -6.352 1.00 74.20 H new ATOM 0 HB3 LEU A 124 6.666 -14.522 -5.476 1.00 74.20 H new ATOM 0 HG LEU A 124 5.610 -17.349 -5.349 1.00 25.45 H new ATOM 0 HD11 LEU A 124 7.204 -17.919 -7.138 1.00 35.05 H new ATOM 0 HD12 LEU A 124 5.941 -16.802 -7.708 1.00 35.05 H new ATOM 0 HD13 LEU A 124 7.574 -16.192 -7.352 1.00 35.05 H new ATOM 0 HD21 LEU A 124 7.957 -17.858 -4.790 1.00 14.43 H new ATOM 0 HD22 LEU A 124 8.355 -16.127 -4.911 1.00 14.43 H new ATOM 0 HD23 LEU A 124 7.242 -16.697 -3.645 1.00 14.43 H new ATOM 597 N ASN A 125 4.607 -13.117 -2.697 1.00 42.42 N ATOM 598 CA ASN A 125 4.530 -11.718 -2.290 1.00 23.03 C ATOM 599 C ASN A 125 3.647 -10.922 -3.245 1.00 71.21 C ATOM 600 O ASN A 125 4.059 -9.890 -3.774 1.00 12.11 O ATOM 601 CB ASN A 125 5.930 -11.102 -2.238 1.00 41.54 C ATOM 602 CG ASN A 125 6.950 -12.038 -1.620 1.00 2.20 C ATOM 603 OD1 ASN A 125 6.731 -12.589 -0.541 1.00 61.54 O ATOM 604 ND2 ASN A 125 8.074 -12.221 -2.303 1.00 75.40 N ATOM 0 H ASN A 125 4.386 -13.784 -1.958 1.00 42.42 H new ATOM 0 HA ASN A 125 4.086 -11.679 -1.295 1.00 23.03 H new ATOM 0 HB2 ASN A 125 6.246 -10.840 -3.248 1.00 41.54 H new ATOM 0 HB3 ASN A 125 5.896 -10.176 -1.664 1.00 41.54 H new ATOM 0 HD21 ASN A 125 8.798 -12.839 -1.937 1.00 75.40 H new ATOM 0 HD22 ASN A 125 8.213 -11.744 -3.194 1.00 75.40 H new ATOM 611 N GLY A 126 2.428 -11.409 -3.462 1.00 44.14 N ATOM 612 CA GLY A 126 1.506 -10.731 -4.353 1.00 71.51 C ATOM 613 C GLY A 126 1.570 -11.264 -5.770 1.00 14.11 C ATOM 614 O GLY A 126 0.620 -11.115 -6.540 1.00 40.40 O ATOM 0 H GLY A 126 2.064 -12.261 -3.036 1.00 44.14 H new ATOM 0 HA2 GLY A 126 0.491 -10.841 -3.972 1.00 71.51 H new ATOM 0 HA3 GLY A 126 1.730 -9.664 -4.359 1.00 71.51 H new ATOM 618 N ILE A 127 2.691 -11.886 -6.117 1.00 22.22 N ATOM 619 CA ILE A 127 2.875 -12.443 -7.451 1.00 73.32 C ATOM 620 C ILE A 127 2.241 -13.826 -7.562 1.00 14.32 C ATOM 621 O ILE A 127 2.253 -14.603 -6.608 1.00 64.31 O ATOM 622 CB ILE A 127 4.367 -12.545 -7.819 1.00 24.54 C ATOM 623 CG1 ILE A 127 5.029 -11.167 -7.738 1.00 35.23 C ATOM 624 CG2 ILE A 127 4.531 -13.136 -9.210 1.00 3.54 C ATOM 625 CD1 ILE A 127 6.540 -11.226 -7.671 1.00 1.33 C ATOM 0 H ILE A 127 3.486 -12.017 -5.492 1.00 22.22 H new ATOM 0 HA ILE A 127 2.383 -11.763 -8.146 1.00 73.32 H new ATOM 0 HB ILE A 127 4.858 -13.207 -7.105 1.00 24.54 H new ATOM 0 HG12 ILE A 127 4.734 -10.580 -8.608 1.00 35.23 H new ATOM 0 HG13 ILE A 127 4.654 -10.644 -6.858 1.00 35.23 H new ATOM 0 HG21 ILE A 127 5.591 -13.201 -9.455 1.00 3.54 H new ATOM 0 HG22 ILE A 127 4.090 -14.133 -9.236 1.00 3.54 H new ATOM 0 HG23 ILE A 127 4.029 -12.498 -9.938 1.00 3.54 H new ATOM 0 HD11 ILE A 127 6.942 -10.214 -7.615 1.00 1.33 H new ATOM 0 HD12 ILE A 127 6.843 -11.786 -6.786 1.00 1.33 H new ATOM 0 HD13 ILE A 127 6.925 -11.720 -8.563 1.00 1.33 H new ATOM 637 N ARG A 128 1.688 -14.125 -8.733 1.00 34.50 N ATOM 638 CA ARG A 128 1.049 -15.413 -8.968 1.00 4.34 C ATOM 639 C ARG A 128 1.976 -16.346 -9.742 1.00 60.24 C ATOM 640 O ARG A 128 2.232 -16.142 -10.928 1.00 55.21 O ATOM 641 CB ARG A 128 -0.259 -15.225 -9.739 1.00 35.11 C ATOM 642 CG ARG A 128 -1.171 -16.440 -9.697 1.00 21.23 C ATOM 643 CD ARG A 128 -2.447 -16.207 -10.491 1.00 73.51 C ATOM 644 NE ARG A 128 -3.204 -15.063 -9.988 1.00 62.14 N ATOM 645 CZ ARG A 128 -4.133 -14.428 -10.693 1.00 54.34 C ATOM 646 NH1 ARG A 128 -4.418 -14.824 -11.926 1.00 63.40 N1+ ATOM 647 NH2 ARG A 128 -4.779 -13.396 -10.165 1.00 13.12 N ATOM 0 H ARG A 128 1.670 -13.493 -9.533 1.00 34.50 H new ATOM 0 HA ARG A 128 0.831 -15.864 -8.000 1.00 4.34 H new ATOM 0 HB2 ARG A 128 -0.792 -14.367 -9.330 1.00 35.11 H new ATOM 0 HB3 ARG A 128 -0.028 -14.991 -10.778 1.00 35.11 H new ATOM 0 HG2 ARG A 128 -0.644 -17.306 -10.099 1.00 21.23 H new ATOM 0 HG3 ARG A 128 -1.422 -16.672 -8.662 1.00 21.23 H new ATOM 0 HD2 ARG A 128 -2.197 -16.043 -11.539 1.00 73.51 H new ATOM 0 HD3 ARG A 128 -3.069 -17.101 -10.447 1.00 73.51 H new ATOM 0 HE ARG A 128 -3.008 -14.734 -9.043 1.00 62.14 H new ATOM 0 HH11 ARG A 128 -3.923 -15.617 -12.334 1.00 63.40 H new ATOM 0 HH12 ARG A 128 -5.132 -14.335 -12.466 1.00 63.40 H new ATOM 0 HH21 ARG A 128 -4.562 -13.090 -9.217 1.00 13.12 H new ATOM 0 HH22 ARG A 128 -5.492 -12.909 -10.708 1.00 13.12 H new ATOM 661 N ALA A 129 2.478 -17.371 -9.061 1.00 23.11 N ATOM 662 CA ALA A 129 3.377 -18.336 -9.683 1.00 52.14 C ATOM 663 C ALA A 129 2.603 -19.532 -10.229 1.00 51.23 C ATOM 664 O ALA A 129 1.404 -19.673 -9.985 1.00 40.33 O ATOM 665 CB ALA A 129 4.430 -18.796 -8.686 1.00 63.52 C ATOM 0 H ALA A 129 2.277 -17.555 -8.078 1.00 23.11 H new ATOM 0 HA ALA A 129 3.876 -17.846 -10.519 1.00 52.14 H new ATOM 0 HB1 ALA A 129 5.094 -19.516 -9.164 1.00 63.52 H new ATOM 0 HB2 ALA A 129 5.010 -17.937 -8.347 1.00 63.52 H new ATOM 0 HB3 ALA A 129 3.942 -19.265 -7.831 1.00 63.52 H new ATOM 671 N PHE A 130 3.297 -20.391 -10.969 1.00 51.13 N ATOM 672 CA PHE A 130 2.674 -21.574 -11.551 1.00 11.43 C ATOM 673 C PHE A 130 3.664 -22.735 -11.613 1.00 70.34 C ATOM 674 O PHE A 130 4.785 -22.584 -12.100 1.00 70.32 O ATOM 675 CB PHE A 130 2.148 -21.263 -12.954 1.00 33.32 C ATOM 676 CG PHE A 130 0.881 -21.994 -13.294 1.00 74.44 C ATOM 677 CD1 PHE A 130 0.923 -23.292 -13.776 1.00 63.42 C ATOM 678 CD2 PHE A 130 -0.352 -21.383 -13.134 1.00 15.20 C ATOM 679 CE1 PHE A 130 -0.242 -23.966 -14.091 1.00 15.24 C ATOM 680 CE2 PHE A 130 -1.519 -22.052 -13.447 1.00 51.42 C ATOM 681 CZ PHE A 130 -1.464 -23.347 -13.926 1.00 35.35 C ATOM 0 H PHE A 130 4.290 -20.290 -11.179 1.00 51.13 H new ATOM 0 HA PHE A 130 1.839 -21.864 -10.914 1.00 11.43 H new ATOM 0 HB2 PHE A 130 1.973 -20.190 -13.038 1.00 33.32 H new ATOM 0 HB3 PHE A 130 2.914 -21.520 -13.686 1.00 33.32 H new ATOM 0 HD1 PHE A 130 1.876 -23.783 -13.907 1.00 63.42 H new ATOM 0 HD2 PHE A 130 -0.401 -20.371 -12.760 1.00 15.20 H new ATOM 0 HE1 PHE A 130 -0.196 -24.978 -14.466 1.00 15.24 H new ATOM 0 HE2 PHE A 130 -2.474 -21.564 -13.318 1.00 51.42 H new ATOM 0 HZ PHE A 130 -2.375 -23.873 -14.171 1.00 35.35 H new ATOM 691 N LEU A 131 3.242 -23.891 -11.116 1.00 42.32 N ATOM 692 CA LEU A 131 4.090 -25.079 -11.114 1.00 71.54 C ATOM 693 C LEU A 131 3.444 -26.211 -11.905 1.00 33.11 C ATOM 694 O LEU A 131 2.282 -26.561 -11.698 1.00 13.54 O ATOM 695 CB LEU A 131 4.361 -25.533 -9.679 1.00 3.45 C ATOM 696 CG LEU A 131 5.121 -24.544 -8.794 1.00 1.01 C ATOM 697 CD1 LEU A 131 4.629 -24.627 -7.357 1.00 72.14 C ATOM 698 CD2 LEU A 131 6.618 -24.807 -8.863 1.00 1.05 C ATOM 0 H LEU A 131 2.318 -24.032 -10.709 1.00 42.32 H new ATOM 0 HA LEU A 131 5.035 -24.821 -11.592 1.00 71.54 H new ATOM 0 HB2 LEU A 131 3.406 -25.756 -9.203 1.00 3.45 H new ATOM 0 HB3 LEU A 131 4.925 -26.465 -9.714 1.00 3.45 H new ATOM 0 HG LEU A 131 4.932 -23.536 -9.164 1.00 1.01 H new ATOM 0 HD11 LEU A 131 5.181 -23.916 -6.742 1.00 72.14 H new ATOM 0 HD12 LEU A 131 3.566 -24.388 -7.322 1.00 72.14 H new ATOM 0 HD13 LEU A 131 4.787 -25.636 -6.976 1.00 72.14 H new ATOM 0 HD21 LEU A 131 7.142 -24.094 -8.227 1.00 1.05 H new ATOM 0 HD22 LEU A 131 6.826 -25.820 -8.520 1.00 1.05 H new ATOM 0 HD23 LEU A 131 6.960 -24.695 -9.892 1.00 1.05 H new ATOM 710 N PRO A 132 4.214 -26.802 -12.831 1.00 44.13 N ATOM 711 CA PRO A 132 3.737 -27.906 -13.670 1.00 23.41 C ATOM 712 C PRO A 132 3.538 -29.191 -12.876 1.00 0.41 C ATOM 713 O PRO A 132 4.369 -29.555 -12.045 1.00 50.35 O ATOM 714 CB PRO A 132 4.859 -28.080 -14.697 1.00 2.04 C ATOM 715 CG PRO A 132 6.078 -27.555 -14.019 1.00 70.40 C ATOM 716 CD PRO A 132 5.608 -26.435 -13.131 1.00 11.23 C ATOM 0 HA PRO A 132 2.764 -27.692 -14.113 1.00 23.41 H new ATOM 0 HB2 PRO A 132 4.981 -29.126 -14.976 1.00 2.04 H new ATOM 0 HB3 PRO A 132 4.647 -27.528 -15.613 1.00 2.04 H new ATOM 0 HG2 PRO A 132 6.567 -28.336 -13.437 1.00 70.40 H new ATOM 0 HG3 PRO A 132 6.806 -27.197 -14.747 1.00 70.40 H new ATOM 0 HD2 PRO A 132 6.209 -26.362 -12.224 1.00 11.23 H new ATOM 0 HD3 PRO A 132 5.671 -25.470 -13.634 1.00 11.23 H new ATOM 724 N GLY A 133 2.429 -29.878 -13.138 1.00 51.13 N ATOM 725 CA GLY A 133 2.140 -31.116 -12.438 1.00 72.20 C ATOM 726 C GLY A 133 3.048 -32.251 -12.871 1.00 24.31 C ATOM 727 O GLY A 133 3.152 -33.268 -12.185 1.00 62.54 O ATOM 0 H GLY A 133 1.726 -29.599 -13.822 1.00 51.13 H new ATOM 0 HA2 GLY A 133 2.248 -30.957 -11.365 1.00 72.20 H new ATOM 0 HA3 GLY A 133 1.102 -31.397 -12.616 1.00 72.20 H new ATOM 731 N SER A 134 3.705 -32.079 -14.014 1.00 13.24 N ATOM 732 CA SER A 134 4.604 -33.099 -14.540 1.00 0.03 C ATOM 733 C SER A 134 5.670 -33.466 -13.512 1.00 14.21 C ATOM 734 O SER A 134 6.203 -34.576 -13.523 1.00 33.45 O ATOM 735 CB SER A 134 5.269 -32.607 -15.828 1.00 71.14 C ATOM 736 OG SER A 134 6.481 -33.300 -16.072 1.00 54.54 O ATOM 0 H SER A 134 3.631 -31.243 -14.593 1.00 13.24 H new ATOM 0 HA SER A 134 4.015 -33.989 -14.760 1.00 0.03 H new ATOM 0 HB2 SER A 134 4.590 -32.748 -16.669 1.00 71.14 H new ATOM 0 HB3 SER A 134 5.466 -31.538 -15.754 1.00 71.14 H new ATOM 0 HG SER A 134 6.886 -32.969 -16.901 1.00 54.54 H new ATOM 742 N LEU A 135 5.975 -32.527 -12.624 1.00 22.34 N ATOM 743 CA LEU A 135 6.977 -32.750 -11.588 1.00 71.02 C ATOM 744 C LEU A 135 6.369 -32.589 -10.198 1.00 43.52 C ATOM 745 O LEU A 135 7.072 -32.292 -9.233 1.00 62.30 O ATOM 746 CB LEU A 135 8.145 -31.778 -11.762 1.00 1.33 C ATOM 747 CG LEU A 135 8.772 -31.725 -13.156 1.00 35.31 C ATOM 748 CD1 LEU A 135 9.729 -30.548 -13.265 1.00 35.24 C ATOM 749 CD2 LEU A 135 9.490 -33.029 -13.468 1.00 24.21 C ATOM 0 H LEU A 135 5.543 -31.603 -12.600 1.00 22.34 H new ATOM 0 HA LEU A 135 7.345 -33.771 -11.687 1.00 71.02 H new ATOM 0 HB2 LEU A 135 7.800 -30.777 -11.502 1.00 1.33 H new ATOM 0 HB3 LEU A 135 8.922 -32.044 -11.046 1.00 1.33 H new ATOM 0 HG LEU A 135 7.975 -31.589 -13.887 1.00 35.31 H new ATOM 0 HD11 LEU A 135 10.166 -30.526 -14.263 1.00 35.24 H new ATOM 0 HD12 LEU A 135 9.186 -29.620 -13.086 1.00 35.24 H new ATOM 0 HD13 LEU A 135 10.522 -30.654 -12.524 1.00 35.24 H new ATOM 0 HD21 LEU A 135 9.930 -32.973 -14.464 1.00 24.21 H new ATOM 0 HD22 LEU A 135 10.277 -33.196 -12.733 1.00 24.21 H new ATOM 0 HD23 LEU A 135 8.778 -33.854 -13.432 1.00 24.21 H new ATOM 761 N VAL A 136 5.059 -32.790 -10.105 1.00 10.15 N ATOM 762 CA VAL A 136 4.356 -32.670 -8.834 1.00 65.54 C ATOM 763 C VAL A 136 3.814 -34.019 -8.375 1.00 40.25 C ATOM 764 O VAL A 136 4.016 -34.425 -7.230 1.00 34.33 O ATOM 765 CB VAL A 136 3.190 -31.667 -8.928 1.00 44.33 C ATOM 766 CG1 VAL A 136 2.428 -31.608 -7.613 1.00 72.44 C ATOM 767 CG2 VAL A 136 3.703 -30.290 -9.319 1.00 24.52 C ATOM 0 H VAL A 136 4.463 -33.037 -10.895 1.00 10.15 H new ATOM 0 HA VAL A 136 5.081 -32.306 -8.106 1.00 65.54 H new ATOM 0 HB VAL A 136 2.503 -32.007 -9.703 1.00 44.33 H new ATOM 0 HG11 VAL A 136 1.609 -30.894 -7.699 1.00 72.44 H new ATOM 0 HG12 VAL A 136 2.027 -32.595 -7.380 1.00 72.44 H new ATOM 0 HG13 VAL A 136 3.101 -31.293 -6.816 1.00 72.44 H new ATOM 0 HG21 VAL A 136 2.866 -29.594 -9.381 1.00 24.52 H new ATOM 0 HG22 VAL A 136 4.412 -29.939 -8.569 1.00 24.52 H new ATOM 0 HG23 VAL A 136 4.199 -30.348 -10.288 1.00 24.52 H new ATOM 777 N ASP A 137 3.127 -34.712 -9.276 1.00 63.00 N ATOM 778 CA ASP A 137 2.557 -36.018 -8.965 1.00 72.00 C ATOM 779 C ASP A 137 3.451 -37.139 -9.487 1.00 1.41 C ATOM 780 O ASP A 137 3.601 -37.317 -10.696 1.00 33.31 O ATOM 781 CB ASP A 137 1.157 -36.144 -9.568 1.00 42.44 C ATOM 782 CG ASP A 137 0.265 -37.077 -8.773 1.00 44.32 C ATOM 783 OD1 ASP A 137 0.563 -38.289 -8.732 1.00 53.44 O1- ATOM 784 OD2 ASP A 137 -0.729 -36.595 -8.191 1.00 15.05 O ATOM 0 H ASP A 137 2.951 -34.391 -10.228 1.00 63.00 H new ATOM 0 HA ASP A 137 2.487 -36.108 -7.881 1.00 72.00 H new ATOM 0 HB2 ASP A 137 0.695 -35.158 -9.616 1.00 42.44 H new ATOM 0 HB3 ASP A 137 1.237 -36.508 -10.592 1.00 42.44 H new ATOM 789 N VAL A 138 4.045 -37.891 -8.566 1.00 53.41 N ATOM 790 CA VAL A 138 4.925 -38.995 -8.932 1.00 15.53 C ATOM 791 C VAL A 138 4.944 -40.066 -7.847 1.00 1.43 C ATOM 792 O VAL A 138 5.527 -39.873 -6.781 1.00 34.11 O ATOM 793 CB VAL A 138 6.364 -38.507 -9.181 1.00 13.01 C ATOM 794 CG1 VAL A 138 6.458 -37.779 -10.514 1.00 11.43 C ATOM 795 CG2 VAL A 138 6.826 -37.611 -8.042 1.00 50.50 C ATOM 0 H VAL A 138 3.933 -37.756 -7.561 1.00 53.41 H new ATOM 0 HA VAL A 138 4.530 -39.422 -9.853 1.00 15.53 H new ATOM 0 HB VAL A 138 7.022 -39.375 -9.221 1.00 13.01 H new ATOM 0 HG11 VAL A 138 7.482 -37.441 -10.673 1.00 11.43 H new ATOM 0 HG12 VAL A 138 6.170 -38.455 -11.319 1.00 11.43 H new ATOM 0 HG13 VAL A 138 5.789 -36.918 -10.506 1.00 11.43 H new ATOM 0 HG21 VAL A 138 7.845 -37.275 -8.234 1.00 50.50 H new ATOM 0 HG22 VAL A 138 6.166 -36.746 -7.969 1.00 50.50 H new ATOM 0 HG23 VAL A 138 6.798 -38.169 -7.106 1.00 50.50 H new ATOM 805 N ARG A 139 4.302 -41.196 -8.127 1.00 35.25 N ATOM 806 CA ARG A 139 4.245 -42.298 -7.174 1.00 31.31 C ATOM 807 C ARG A 139 3.759 -41.814 -5.811 1.00 33.22 C ATOM 808 O ARG A 139 4.510 -41.774 -4.836 1.00 64.02 O ATOM 809 CB ARG A 139 5.621 -42.952 -7.035 1.00 30.13 C ATOM 810 CG ARG A 139 5.865 -44.077 -8.028 1.00 20.12 C ATOM 811 CD ARG A 139 5.287 -45.393 -7.532 1.00 14.14 C ATOM 812 NE ARG A 139 5.729 -46.524 -8.342 1.00 54.24 N ATOM 813 CZ ARG A 139 5.302 -46.754 -9.579 1.00 72.02 C ATOM 814 NH1 ARG A 139 4.426 -45.935 -10.144 1.00 5.33 N1+ ATOM 815 NH2 ARG A 139 5.750 -47.806 -10.253 1.00 4.43 N ATOM 0 H ARG A 139 3.814 -41.372 -9.005 1.00 35.25 H new ATOM 0 HA ARG A 139 3.537 -43.035 -7.552 1.00 31.31 H new ATOM 0 HB2 ARG A 139 6.390 -42.191 -7.165 1.00 30.13 H new ATOM 0 HB3 ARG A 139 5.727 -43.343 -6.023 1.00 30.13 H new ATOM 0 HG2 ARG A 139 5.417 -43.820 -8.988 1.00 20.12 H new ATOM 0 HG3 ARG A 139 6.936 -44.189 -8.196 1.00 20.12 H new ATOM 0 HD2 ARG A 139 5.584 -45.552 -6.495 1.00 14.14 H new ATOM 0 HD3 ARG A 139 4.198 -45.340 -7.547 1.00 14.14 H new ATOM 0 HE ARG A 139 6.403 -47.173 -7.936 1.00 54.24 H new ATOM 0 HH11 ARG A 139 4.078 -45.126 -9.629 1.00 5.33 H new ATOM 0 HH12 ARG A 139 4.100 -46.114 -11.094 1.00 5.33 H new ATOM 0 HH21 ARG A 139 6.423 -48.439 -9.821 1.00 4.43 H new ATOM 0 HH22 ARG A 139 5.421 -47.981 -11.203 1.00 4.43 H new ATOM 829 N PRO A 140 2.474 -41.436 -5.741 1.00 72.14 N ATOM 830 CA PRO A 140 1.860 -40.948 -4.502 1.00 14.50 C ATOM 831 C PRO A 140 1.695 -42.051 -3.463 1.00 3.15 C ATOM 832 O PRO A 140 1.409 -43.200 -3.801 1.00 52.42 O ATOM 833 CB PRO A 140 0.491 -40.438 -4.963 1.00 25.24 C ATOM 834 CG PRO A 140 0.195 -41.213 -6.199 1.00 34.04 C ATOM 835 CD PRO A 140 1.522 -41.458 -6.863 1.00 45.02 C ATOM 0 HA PRO A 140 2.472 -40.189 -4.015 1.00 14.50 H new ATOM 0 HB2 PRO A 140 -0.270 -40.603 -4.200 1.00 25.24 H new ATOM 0 HB3 PRO A 140 0.515 -39.367 -5.163 1.00 25.24 H new ATOM 0 HG2 PRO A 140 -0.301 -42.154 -5.960 1.00 34.04 H new ATOM 0 HG3 PRO A 140 -0.474 -40.658 -6.857 1.00 34.04 H new ATOM 0 HD2 PRO A 140 1.539 -42.414 -7.386 1.00 45.02 H new ATOM 0 HD3 PRO A 140 1.751 -40.688 -7.600 1.00 45.02 H new ATOM 843 N VAL A 141 1.877 -41.695 -2.195 1.00 14.24 N ATOM 844 CA VAL A 141 1.746 -42.654 -1.105 1.00 40.14 C ATOM 845 C VAL A 141 1.039 -42.033 0.093 1.00 51.04 C ATOM 846 O VAL A 141 1.682 -41.528 1.013 1.00 50.42 O ATOM 847 CB VAL A 141 3.121 -43.186 -0.657 1.00 61.41 C ATOM 848 CG1 VAL A 141 3.653 -44.204 -1.655 1.00 4.11 C ATOM 849 CG2 VAL A 141 4.103 -42.036 -0.481 1.00 2.25 C ATOM 0 H VAL A 141 2.116 -40.749 -1.898 1.00 14.24 H new ATOM 0 HA VAL A 141 1.149 -43.484 -1.484 1.00 40.14 H new ATOM 0 HB VAL A 141 3.003 -43.685 0.305 1.00 61.41 H new ATOM 0 HG11 VAL A 141 4.625 -44.568 -1.321 1.00 4.11 H new ATOM 0 HG12 VAL A 141 2.958 -45.040 -1.727 1.00 4.11 H new ATOM 0 HG13 VAL A 141 3.758 -43.734 -2.633 1.00 4.11 H new ATOM 0 HG21 VAL A 141 5.069 -42.428 -0.164 1.00 2.25 H new ATOM 0 HG22 VAL A 141 4.218 -41.508 -1.427 1.00 2.25 H new ATOM 0 HG23 VAL A 141 3.725 -41.348 0.275 1.00 2.25 H new ATOM 859 N ARG A 142 -0.289 -42.073 0.075 1.00 71.04 N ATOM 860 CA ARG A 142 -1.086 -41.513 1.160 1.00 53.24 C ATOM 861 C ARG A 142 -0.478 -40.205 1.661 1.00 4.13 C ATOM 862 O ARG A 142 -0.422 -39.957 2.865 1.00 5.33 O ATOM 863 CB ARG A 142 -1.191 -42.513 2.313 1.00 34.10 C ATOM 864 CG ARG A 142 0.143 -42.837 2.963 1.00 34.45 C ATOM 865 CD ARG A 142 -0.043 -43.451 4.342 1.00 41.42 C ATOM 866 NE ARG A 142 0.868 -44.570 4.570 1.00 32.52 N ATOM 867 CZ ARG A 142 0.677 -45.786 4.072 1.00 43.31 C ATOM 868 NH1 ARG A 142 -0.387 -46.039 3.322 1.00 73.12 N1+ ATOM 869 NH2 ARG A 142 1.550 -46.752 4.324 1.00 14.02 N ATOM 0 H ARG A 142 -0.836 -42.488 -0.679 1.00 71.04 H new ATOM 0 HA ARG A 142 -2.085 -41.307 0.775 1.00 53.24 H new ATOM 0 HB2 ARG A 142 -1.866 -42.113 3.069 1.00 34.10 H new ATOM 0 HB3 ARG A 142 -1.638 -43.435 1.943 1.00 34.10 H new ATOM 0 HG2 ARG A 142 0.700 -43.527 2.329 1.00 34.45 H new ATOM 0 HG3 ARG A 142 0.739 -41.928 3.046 1.00 34.45 H new ATOM 0 HD2 ARG A 142 0.121 -42.689 5.103 1.00 41.42 H new ATOM 0 HD3 ARG A 142 -1.072 -43.793 4.451 1.00 41.42 H new ATOM 0 HE ARG A 142 1.696 -44.408 5.143 1.00 32.52 H new ATOM 0 HH11 ARG A 142 -1.061 -45.299 3.127 1.00 73.12 H new ATOM 0 HH12 ARG A 142 -0.531 -46.974 2.941 1.00 73.12 H new ATOM 0 HH21 ARG A 142 2.369 -46.561 4.901 1.00 14.02 H new ATOM 0 HH22 ARG A 142 1.402 -47.686 3.941 1.00 14.02 H new ATOM 883 N ASP A 143 -0.024 -39.375 0.729 1.00 41.32 N ATOM 884 CA ASP A 143 0.578 -38.093 1.075 1.00 33.40 C ATOM 885 C ASP A 143 0.101 -36.995 0.131 1.00 60.23 C ATOM 886 O ASP A 143 0.628 -36.834 -0.970 1.00 42.31 O ATOM 887 CB ASP A 143 2.104 -38.194 1.031 1.00 30.13 C ATOM 888 CG ASP A 143 2.690 -38.697 2.335 1.00 23.42 C ATOM 889 OD1 ASP A 143 2.046 -38.505 3.387 1.00 1.43 O1- ATOM 890 OD2 ASP A 143 3.792 -39.282 2.303 1.00 65.31 O ATOM 0 H ASP A 143 -0.061 -39.567 -0.272 1.00 41.32 H new ATOM 0 HA ASP A 143 0.267 -37.836 2.088 1.00 33.40 H new ATOM 0 HB2 ASP A 143 2.397 -38.863 0.222 1.00 30.13 H new ATOM 0 HB3 ASP A 143 2.523 -37.214 0.802 1.00 30.13 H new ATOM 895 N THR A 144 -0.903 -36.240 0.568 1.00 33.51 N ATOM 896 CA THR A 144 -1.454 -35.159 -0.239 1.00 12.22 C ATOM 897 C THR A 144 -1.292 -33.814 0.460 1.00 32.31 C ATOM 898 O THR A 144 -1.461 -32.759 -0.154 1.00 31.31 O ATOM 899 CB THR A 144 -2.946 -35.389 -0.545 1.00 3.12 C ATOM 900 OG1 THR A 144 -3.283 -36.764 -0.329 1.00 2.12 O ATOM 901 CG2 THR A 144 -3.271 -35.001 -1.979 1.00 34.45 C ATOM 0 H THR A 144 -1.351 -36.358 1.477 1.00 33.51 H new ATOM 0 HA THR A 144 -0.897 -35.149 -1.176 1.00 12.22 H new ATOM 0 HB THR A 144 -3.533 -34.761 0.125 1.00 3.12 H new ATOM 0 HG1 THR A 144 -4.233 -36.902 -0.524 1.00 2.12 H new ATOM 0 HG21 THR A 144 -4.330 -35.172 -2.171 1.00 34.45 H new ATOM 0 HG22 THR A 144 -3.040 -33.947 -2.132 1.00 34.45 H new ATOM 0 HG23 THR A 144 -2.676 -35.606 -2.663 1.00 34.45 H new ATOM 909 N LEU A 145 -0.963 -33.857 1.746 1.00 25.21 N ATOM 910 CA LEU A 145 -0.777 -32.640 2.529 1.00 41.45 C ATOM 911 C LEU A 145 0.383 -31.813 1.984 1.00 44.04 C ATOM 912 O LEU A 145 0.464 -30.608 2.219 1.00 41.05 O ATOM 913 CB LEU A 145 -0.523 -32.988 3.997 1.00 72.14 C ATOM 914 CG LEU A 145 -1.766 -33.138 4.876 1.00 12.03 C ATOM 915 CD1 LEU A 145 -1.381 -33.609 6.269 1.00 10.12 C ATOM 916 CD2 LEU A 145 -2.530 -31.824 4.946 1.00 72.53 C ATOM 0 H LEU A 145 -0.819 -34.721 2.269 1.00 25.21 H new ATOM 0 HA LEU A 145 -1.689 -32.047 2.454 1.00 41.45 H new ATOM 0 HB2 LEU A 145 0.040 -33.920 4.036 1.00 72.14 H new ATOM 0 HB3 LEU A 145 0.112 -32.214 4.429 1.00 72.14 H new ATOM 0 HG LEU A 145 -2.416 -33.890 4.429 1.00 12.03 H new ATOM 0 HD11 LEU A 145 -2.278 -33.710 6.880 1.00 10.12 H new ATOM 0 HD12 LEU A 145 -0.878 -34.574 6.201 1.00 10.12 H new ATOM 0 HD13 LEU A 145 -0.710 -32.882 6.727 1.00 10.12 H new ATOM 0 HD21 LEU A 145 -3.411 -31.949 5.575 1.00 72.53 H new ATOM 0 HD22 LEU A 145 -1.888 -31.052 5.370 1.00 72.53 H new ATOM 0 HD23 LEU A 145 -2.839 -31.529 3.943 1.00 72.53 H new ATOM 928 N HIS A 146 1.278 -32.469 1.252 1.00 33.21 N ATOM 929 CA HIS A 146 2.433 -31.795 0.669 1.00 1.43 C ATOM 930 C HIS A 146 2.134 -31.337 -0.755 1.00 63.11 C ATOM 931 O HIS A 146 3.047 -31.057 -1.532 1.00 22.21 O ATOM 932 CB HIS A 146 3.649 -32.720 0.676 1.00 72.35 C ATOM 933 CG HIS A 146 3.641 -33.727 -0.434 1.00 0.24 C ATOM 934 ND1 HIS A 146 2.485 -34.297 -0.923 1.00 1.44 N ATOM 935 CD2 HIS A 146 4.656 -34.263 -1.149 1.00 32.41 C ATOM 936 CE1 HIS A 146 2.791 -35.142 -1.892 1.00 40.02 C ATOM 937 NE2 HIS A 146 4.102 -35.140 -2.049 1.00 53.34 N ATOM 0 H HIS A 146 1.226 -33.467 1.048 1.00 33.21 H new ATOM 0 HA HIS A 146 2.653 -30.916 1.275 1.00 1.43 H new ATOM 0 HB2 HIS A 146 4.554 -32.117 0.603 1.00 72.35 H new ATOM 0 HB3 HIS A 146 3.691 -33.244 1.631 1.00 72.35 H new ATOM 0 HD2 HIS A 146 5.707 -34.042 -1.034 1.00 32.41 H new ATOM 0 HE1 HIS A 146 2.088 -35.734 -2.459 1.00 40.02 H new ATOM 0 HE2 HIS A 146 4.619 -35.699 -2.728 1.00 53.34 H new ATOM 945 N LEU A 147 0.851 -31.265 -1.091 1.00 3.03 N ATOM 946 CA LEU A 147 0.431 -30.842 -2.423 1.00 14.44 C ATOM 947 C LEU A 147 -0.241 -29.474 -2.374 1.00 54.12 C ATOM 948 O LEU A 147 -0.128 -28.684 -3.309 1.00 62.14 O ATOM 949 CB LEU A 147 -0.526 -31.872 -3.027 1.00 15.31 C ATOM 950 CG LEU A 147 0.076 -33.240 -3.349 1.00 63.33 C ATOM 951 CD1 LEU A 147 -0.956 -34.133 -4.021 1.00 5.30 C ATOM 952 CD2 LEU A 147 1.306 -33.087 -4.232 1.00 24.23 C ATOM 0 H LEU A 147 0.083 -31.494 -0.460 1.00 3.03 H new ATOM 0 HA LEU A 147 1.319 -30.767 -3.051 1.00 14.44 H new ATOM 0 HB2 LEU A 147 -1.356 -32.016 -2.335 1.00 15.31 H new ATOM 0 HB3 LEU A 147 -0.944 -31.456 -3.944 1.00 15.31 H new ATOM 0 HG LEU A 147 0.380 -33.710 -2.414 1.00 63.33 H new ATOM 0 HD11 LEU A 147 -0.509 -35.102 -4.243 1.00 5.30 H new ATOM 0 HD12 LEU A 147 -1.808 -34.270 -3.355 1.00 5.30 H new ATOM 0 HD13 LEU A 147 -1.291 -33.668 -4.948 1.00 5.30 H new ATOM 0 HD21 LEU A 147 1.721 -34.071 -4.451 1.00 24.23 H new ATOM 0 HD22 LEU A 147 1.026 -32.596 -5.164 1.00 24.23 H new ATOM 0 HD23 LEU A 147 2.053 -32.485 -3.714 1.00 24.23 H new ATOM 964 N GLU A 148 -0.938 -29.202 -1.275 1.00 71.13 N ATOM 965 CA GLU A 148 -1.627 -27.928 -1.104 1.00 1.45 C ATOM 966 C GLU A 148 -1.255 -27.283 0.228 1.00 64.53 C ATOM 967 O GLU A 148 -1.321 -27.920 1.278 1.00 52.44 O ATOM 968 CB GLU A 148 -3.141 -28.127 -1.182 1.00 74.44 C ATOM 969 CG GLU A 148 -3.655 -29.244 -0.289 1.00 61.21 C ATOM 970 CD GLU A 148 -5.120 -29.078 0.069 1.00 71.04 C ATOM 971 OE1 GLU A 148 -5.565 -27.922 0.224 1.00 61.21 O1- ATOM 972 OE2 GLU A 148 -5.819 -30.105 0.193 1.00 15.42 O ATOM 0 H GLU A 148 -1.040 -29.846 -0.491 1.00 71.13 H new ATOM 0 HA GLU A 148 -1.314 -27.264 -1.910 1.00 1.45 H new ATOM 0 HB2 GLU A 148 -3.636 -27.196 -0.906 1.00 74.44 H new ATOM 0 HB3 GLU A 148 -3.418 -28.342 -2.214 1.00 74.44 H new ATOM 0 HG2 GLU A 148 -3.514 -30.200 -0.792 1.00 61.21 H new ATOM 0 HG3 GLU A 148 -3.063 -29.275 0.625 1.00 61.21 H new ATOM 979 N GLY A 149 -0.864 -26.014 0.176 1.00 54.43 N ATOM 980 CA GLY A 149 -0.487 -25.303 1.384 1.00 25.32 C ATOM 981 C GLY A 149 0.993 -25.427 1.691 1.00 34.35 C ATOM 982 O GLY A 149 1.529 -24.681 2.511 1.00 65.23 O ATOM 0 H GLY A 149 -0.801 -25.465 -0.681 1.00 54.43 H new ATOM 0 HA2 GLY A 149 -0.746 -24.250 1.278 1.00 25.32 H new ATOM 0 HA3 GLY A 149 -1.063 -25.690 2.225 1.00 25.32 H new ATOM 986 N LYS A 150 1.655 -26.374 1.036 1.00 70.04 N ATOM 987 CA LYS A 150 3.081 -26.595 1.243 1.00 31.31 C ATOM 988 C LYS A 150 3.881 -25.343 0.896 1.00 54.12 C ATOM 989 O LYS A 150 3.709 -24.762 -0.175 1.00 22.52 O ATOM 990 CB LYS A 150 3.564 -27.774 0.394 1.00 50.15 C ATOM 991 CG LYS A 150 5.074 -27.937 0.385 1.00 10.22 C ATOM 992 CD LYS A 150 5.666 -27.576 -0.967 1.00 65.53 C ATOM 993 CE LYS A 150 5.765 -28.791 -1.876 1.00 15.14 C ATOM 994 NZ LYS A 150 7.006 -29.574 -1.621 1.00 42.30 N1+ ATOM 0 H LYS A 150 1.226 -27.002 0.356 1.00 70.04 H new ATOM 0 HA LYS A 150 3.239 -26.825 2.297 1.00 31.31 H new ATOM 0 HB2 LYS A 150 3.110 -28.691 0.769 1.00 50.15 H new ATOM 0 HB3 LYS A 150 3.215 -27.641 -0.630 1.00 50.15 H new ATOM 0 HG2 LYS A 150 5.514 -27.305 1.156 1.00 10.22 H new ATOM 0 HG3 LYS A 150 5.331 -28.967 0.632 1.00 10.22 H new ATOM 0 HD2 LYS A 150 5.049 -26.814 -1.443 1.00 65.53 H new ATOM 0 HD3 LYS A 150 6.657 -27.143 -0.827 1.00 65.53 H new ATOM 0 HE2 LYS A 150 4.895 -29.430 -1.725 1.00 15.14 H new ATOM 0 HE3 LYS A 150 5.746 -28.468 -2.917 1.00 15.14 H new ATOM 0 HZ1 LYS A 150 7.037 -30.394 -2.260 1.00 42.30 H new ATOM 0 HZ2 LYS A 150 7.837 -28.972 -1.790 1.00 42.30 H new ATOM 0 HZ3 LYS A 150 7.012 -29.904 -0.635 1.00 42.30 H new ATOM 1008 N GLU A 151 4.757 -24.936 1.809 1.00 41.22 N ATOM 1009 CA GLU A 151 5.585 -23.754 1.598 1.00 55.31 C ATOM 1010 C GLU A 151 7.050 -24.140 1.414 1.00 33.43 C ATOM 1011 O GLU A 151 7.690 -24.647 2.335 1.00 74.30 O ATOM 1012 CB GLU A 151 5.445 -22.789 2.778 1.00 5.22 C ATOM 1013 CG GLU A 151 5.780 -23.417 4.121 1.00 51.44 C ATOM 1014 CD GLU A 151 5.358 -22.551 5.292 1.00 14.32 C ATOM 1015 OE1 GLU A 151 5.892 -21.431 5.425 1.00 1.24 O1- ATOM 1016 OE2 GLU A 151 4.490 -22.995 6.073 1.00 24.15 O ATOM 0 H GLU A 151 4.912 -25.406 2.701 1.00 41.22 H new ATOM 0 HA GLU A 151 5.241 -23.259 0.690 1.00 55.31 H new ATOM 0 HB2 GLU A 151 6.098 -21.931 2.615 1.00 5.22 H new ATOM 0 HB3 GLU A 151 4.423 -22.411 2.808 1.00 5.22 H new ATOM 0 HG2 GLU A 151 5.289 -24.387 4.196 1.00 51.44 H new ATOM 0 HG3 GLU A 151 6.854 -23.597 4.176 1.00 51.44 H new ATOM 1023 N LEU A 152 7.574 -23.897 0.217 1.00 4.40 N ATOM 1024 CA LEU A 152 8.962 -24.219 -0.090 1.00 14.53 C ATOM 1025 C LEU A 152 9.596 -23.131 -0.950 1.00 1.52 C ATOM 1026 O LEU A 152 8.899 -22.293 -1.520 1.00 22.54 O ATOM 1027 CB LEU A 152 9.046 -25.568 -0.808 1.00 72.43 C ATOM 1028 CG LEU A 152 8.671 -25.563 -2.290 1.00 52.41 C ATOM 1029 CD1 LEU A 152 7.374 -24.800 -2.510 1.00 52.35 C ATOM 1030 CD2 LEU A 152 9.794 -24.961 -3.123 1.00 3.13 C ATOM 0 H LEU A 152 7.058 -23.478 -0.556 1.00 4.40 H new ATOM 0 HA LEU A 152 9.512 -24.280 0.849 1.00 14.53 H new ATOM 0 HB2 LEU A 152 10.064 -25.945 -0.713 1.00 72.43 H new ATOM 0 HB3 LEU A 152 8.395 -26.273 -0.291 1.00 72.43 H new ATOM 0 HG LEU A 152 8.521 -26.594 -2.610 1.00 52.41 H new ATOM 0 HD11 LEU A 152 7.123 -24.807 -3.571 1.00 52.35 H new ATOM 0 HD12 LEU A 152 6.572 -25.275 -1.944 1.00 52.35 H new ATOM 0 HD13 LEU A 152 7.496 -23.771 -2.173 1.00 52.35 H new ATOM 0 HD21 LEU A 152 9.509 -24.966 -4.175 1.00 3.13 H new ATOM 0 HD22 LEU A 152 9.976 -23.936 -2.801 1.00 3.13 H new ATOM 0 HD23 LEU A 152 10.702 -25.550 -2.990 1.00 3.13 H new ATOM 1042 N GLU A 153 10.923 -23.153 -1.040 1.00 64.45 N ATOM 1043 CA GLU A 153 11.650 -22.169 -1.833 1.00 72.24 C ATOM 1044 C GLU A 153 12.011 -22.733 -3.204 1.00 52.22 C ATOM 1045 O GLU A 153 12.542 -23.838 -3.312 1.00 74.32 O ATOM 1046 CB GLU A 153 12.919 -21.729 -1.100 1.00 65.41 C ATOM 1047 CG GLU A 153 13.901 -20.975 -1.981 1.00 32.34 C ATOM 1048 CD GLU A 153 14.460 -19.737 -1.307 1.00 54.31 C ATOM 1049 OE1 GLU A 153 13.674 -18.999 -0.677 1.00 12.13 O1- ATOM 1050 OE2 GLU A 153 15.683 -19.508 -1.410 1.00 31.43 O ATOM 0 H GLU A 153 11.515 -23.841 -0.574 1.00 64.45 H new ATOM 0 HA GLU A 153 11.002 -21.304 -1.975 1.00 72.24 H new ATOM 0 HB2 GLU A 153 12.641 -21.097 -0.257 1.00 65.41 H new ATOM 0 HB3 GLU A 153 13.414 -22.609 -0.689 1.00 65.41 H new ATOM 0 HG2 GLU A 153 14.722 -21.638 -2.253 1.00 32.34 H new ATOM 0 HG3 GLU A 153 13.404 -20.687 -2.907 1.00 32.34 H new ATOM 1057 N PHE A 154 11.719 -21.966 -4.248 1.00 71.32 N ATOM 1058 CA PHE A 154 12.011 -22.389 -5.613 1.00 73.31 C ATOM 1059 C PHE A 154 13.328 -21.790 -6.098 1.00 21.25 C ATOM 1060 O PHE A 154 14.003 -21.068 -5.364 1.00 32.42 O ATOM 1061 CB PHE A 154 10.875 -21.976 -6.551 1.00 71.02 C ATOM 1062 CG PHE A 154 9.508 -22.274 -6.005 1.00 21.14 C ATOM 1063 CD1 PHE A 154 8.897 -23.493 -6.257 1.00 33.11 C ATOM 1064 CD2 PHE A 154 8.833 -21.337 -5.239 1.00 72.32 C ATOM 1065 CE1 PHE A 154 7.640 -23.770 -5.756 1.00 3.41 C ATOM 1066 CE2 PHE A 154 7.575 -21.608 -4.735 1.00 33.30 C ATOM 1067 CZ PHE A 154 6.978 -22.827 -4.994 1.00 31.11 C ATOM 0 H PHE A 154 11.280 -21.048 -4.176 1.00 71.32 H new ATOM 0 HA PHE A 154 12.102 -23.475 -5.619 1.00 73.31 H new ATOM 0 HB2 PHE A 154 10.952 -20.908 -6.753 1.00 71.02 H new ATOM 0 HB3 PHE A 154 10.997 -22.490 -7.504 1.00 71.02 H new ATOM 0 HD1 PHE A 154 9.410 -24.234 -6.852 1.00 33.11 H new ATOM 0 HD2 PHE A 154 9.296 -20.383 -5.033 1.00 72.32 H new ATOM 0 HE1 PHE A 154 7.175 -24.723 -5.960 1.00 3.41 H new ATOM 0 HE2 PHE A 154 7.060 -20.869 -4.140 1.00 33.30 H new ATOM 0 HZ PHE A 154 5.995 -23.042 -4.601 1.00 31.11 H new ATOM 1077 N LYS A 155 13.690 -22.099 -7.338 1.00 14.10 N ATOM 1078 CA LYS A 155 14.926 -21.593 -7.924 1.00 52.02 C ATOM 1079 C LYS A 155 14.700 -21.136 -9.361 1.00 34.24 C ATOM 1080 O LYS A 155 13.893 -21.716 -10.089 1.00 74.34 O ATOM 1081 CB LYS A 155 16.012 -22.671 -7.885 1.00 22.41 C ATOM 1082 CG LYS A 155 17.268 -22.296 -8.651 1.00 33.03 C ATOM 1083 CD LYS A 155 18.518 -22.812 -7.959 1.00 61.52 C ATOM 1084 CE LYS A 155 19.705 -21.890 -8.192 1.00 44.24 C ATOM 1085 NZ LYS A 155 19.958 -21.667 -9.642 1.00 21.03 N1+ ATOM 0 H LYS A 155 13.145 -22.698 -7.958 1.00 14.10 H new ATOM 0 HA LYS A 155 15.253 -20.735 -7.336 1.00 52.02 H new ATOM 0 HB2 LYS A 155 16.276 -22.872 -6.847 1.00 22.41 H new ATOM 0 HB3 LYS A 155 15.609 -23.596 -8.296 1.00 22.41 H new ATOM 0 HG2 LYS A 155 17.215 -22.704 -9.660 1.00 33.03 H new ATOM 0 HG3 LYS A 155 17.326 -21.212 -8.748 1.00 33.03 H new ATOM 0 HD2 LYS A 155 18.331 -22.903 -6.889 1.00 61.52 H new ATOM 0 HD3 LYS A 155 18.753 -23.810 -8.328 1.00 61.52 H new ATOM 0 HE2 LYS A 155 19.522 -20.933 -7.704 1.00 44.24 H new ATOM 0 HE3 LYS A 155 20.594 -22.319 -7.730 1.00 44.24 H new ATOM 0 HZ1 LYS A 155 20.875 -21.192 -9.765 1.00 21.03 H new ATOM 0 HZ2 LYS A 155 19.972 -22.582 -10.137 1.00 21.03 H new ATOM 0 HZ3 LYS A 155 19.204 -21.071 -10.038 1.00 21.03 H new ATOM 1099 N VAL A 156 15.418 -20.093 -9.766 1.00 14.23 N ATOM 1100 CA VAL A 156 15.297 -19.560 -11.117 1.00 74.32 C ATOM 1101 C VAL A 156 15.574 -20.637 -12.160 1.00 51.23 C ATOM 1102 O VAL A 156 16.660 -21.216 -12.196 1.00 60.42 O ATOM 1103 CB VAL A 156 16.263 -18.382 -11.344 1.00 20.45 C ATOM 1104 CG1 VAL A 156 17.691 -18.789 -11.011 1.00 14.03 C ATOM 1105 CG2 VAL A 156 16.164 -17.879 -12.776 1.00 31.34 C ATOM 0 H VAL A 156 16.090 -19.601 -9.177 1.00 14.23 H new ATOM 0 HA VAL A 156 14.272 -19.207 -11.227 1.00 74.32 H new ATOM 0 HB VAL A 156 15.978 -17.569 -10.677 1.00 20.45 H new ATOM 0 HG11 VAL A 156 18.359 -17.944 -11.178 1.00 14.03 H new ATOM 0 HG12 VAL A 156 17.748 -19.096 -9.967 1.00 14.03 H new ATOM 0 HG13 VAL A 156 17.991 -19.620 -11.650 1.00 14.03 H new ATOM 0 HG21 VAL A 156 16.854 -17.047 -12.918 1.00 31.34 H new ATOM 0 HG22 VAL A 156 16.422 -18.685 -13.463 1.00 31.34 H new ATOM 0 HG23 VAL A 156 15.146 -17.544 -12.975 1.00 31.34 H new ATOM 1115 N ILE A 157 14.584 -20.900 -13.006 1.00 64.23 N ATOM 1116 CA ILE A 157 14.721 -21.908 -14.051 1.00 1.32 C ATOM 1117 C ILE A 157 14.297 -21.355 -15.408 1.00 51.51 C ATOM 1118 O ILE A 157 14.916 -21.648 -16.431 1.00 50.24 O ATOM 1119 CB ILE A 157 13.885 -23.163 -13.737 1.00 71.04 C ATOM 1120 CG1 ILE A 157 14.006 -24.181 -14.873 1.00 51.24 C ATOM 1121 CG2 ILE A 157 12.428 -22.785 -13.511 1.00 54.14 C ATOM 1122 CD1 ILE A 157 15.430 -24.607 -15.152 1.00 30.43 C ATOM 0 H ILE A 157 13.679 -20.430 -12.989 1.00 64.23 H new ATOM 0 HA ILE A 157 15.775 -22.183 -14.087 1.00 1.32 H new ATOM 0 HB ILE A 157 14.269 -23.618 -12.824 1.00 71.04 H new ATOM 0 HG12 ILE A 157 13.413 -25.062 -14.626 1.00 51.24 H new ATOM 0 HG13 ILE A 157 13.579 -23.754 -15.780 1.00 51.24 H new ATOM 0 HG21 ILE A 157 11.849 -23.682 -13.290 1.00 54.14 H new ATOM 0 HG22 ILE A 157 12.358 -22.092 -12.672 1.00 54.14 H new ATOM 0 HG23 ILE A 157 12.032 -22.310 -14.408 1.00 54.14 H new ATOM 0 HD11 ILE A 157 15.440 -25.329 -15.968 1.00 30.43 H new ATOM 0 HD12 ILE A 157 16.023 -23.736 -15.431 1.00 30.43 H new ATOM 0 HD13 ILE A 157 15.855 -25.064 -14.258 1.00 30.43 H new ATOM 1134 N LYS A 158 13.239 -20.551 -15.408 1.00 11.20 N ATOM 1135 CA LYS A 158 12.733 -19.952 -16.637 1.00 74.04 C ATOM 1136 C LYS A 158 11.693 -18.879 -16.332 1.00 3.31 C ATOM 1137 O LYS A 158 10.854 -19.048 -15.446 1.00 5.10 O ATOM 1138 CB LYS A 158 12.123 -21.027 -17.538 1.00 24.24 C ATOM 1139 CG LYS A 158 13.028 -21.448 -18.683 1.00 25.34 C ATOM 1140 CD LYS A 158 12.232 -22.030 -19.839 1.00 75.32 C ATOM 1141 CE LYS A 158 11.919 -20.974 -20.888 1.00 1.33 C ATOM 1142 NZ LYS A 158 13.087 -20.705 -21.770 1.00 35.23 N1+ ATOM 0 H LYS A 158 12.715 -20.299 -14.570 1.00 11.20 H new ATOM 0 HA LYS A 158 13.570 -19.484 -17.155 1.00 74.04 H new ATOM 0 HB2 LYS A 158 11.884 -21.902 -16.934 1.00 24.24 H new ATOM 0 HB3 LYS A 158 11.183 -20.656 -17.947 1.00 24.24 H new ATOM 0 HG2 LYS A 158 13.600 -20.588 -19.031 1.00 25.34 H new ATOM 0 HG3 LYS A 158 13.747 -22.186 -18.327 1.00 25.34 H new ATOM 0 HD2 LYS A 158 12.795 -22.843 -20.297 1.00 75.32 H new ATOM 0 HD3 LYS A 158 11.303 -22.458 -19.463 1.00 75.32 H new ATOM 0 HE2 LYS A 158 11.075 -21.303 -21.494 1.00 1.33 H new ATOM 0 HE3 LYS A 158 11.616 -20.050 -20.394 1.00 1.33 H new ATOM 0 HZ1 LYS A 158 12.833 -19.980 -22.471 1.00 35.23 H new ATOM 0 HZ2 LYS A 158 13.885 -20.367 -21.196 1.00 35.23 H new ATOM 0 HZ3 LYS A 158 13.360 -21.580 -22.261 1.00 35.23 H new ATOM 1156 N LEU A 159 11.753 -17.776 -17.070 1.00 22.41 N ATOM 1157 CA LEU A 159 10.815 -16.676 -16.879 1.00 43.12 C ATOM 1158 C LEU A 159 10.638 -15.881 -18.169 1.00 63.43 C ATOM 1159 O LEU A 159 11.611 -15.413 -18.760 1.00 65.04 O ATOM 1160 CB LEU A 159 11.301 -15.753 -15.760 1.00 4.42 C ATOM 1161 CG LEU A 159 12.759 -15.302 -15.850 1.00 11.11 C ATOM 1162 CD1 LEU A 159 12.937 -13.937 -15.203 1.00 0.52 C ATOM 1163 CD2 LEU A 159 13.675 -16.327 -15.196 1.00 43.35 C ATOM 0 H LEU A 159 12.442 -17.620 -17.806 1.00 22.41 H new ATOM 0 HA LEU A 159 9.850 -17.099 -16.599 1.00 43.12 H new ATOM 0 HB2 LEU A 159 10.667 -14.866 -15.746 1.00 4.42 H new ATOM 0 HB3 LEU A 159 11.157 -16.263 -14.807 1.00 4.42 H new ATOM 0 HG LEU A 159 13.030 -15.220 -16.903 1.00 11.11 H new ATOM 0 HD11 LEU A 159 13.981 -13.633 -15.277 1.00 0.52 H new ATOM 0 HD12 LEU A 159 12.309 -13.207 -15.714 1.00 0.52 H new ATOM 0 HD13 LEU A 159 12.648 -13.991 -14.153 1.00 0.52 H new ATOM 0 HD21 LEU A 159 14.709 -15.990 -15.269 1.00 43.35 H new ATOM 0 HD22 LEU A 159 13.404 -16.440 -14.146 1.00 43.35 H new ATOM 0 HD23 LEU A 159 13.569 -17.286 -15.704 1.00 43.35 H new ATOM 1175 N ASP A 160 9.390 -15.731 -18.598 1.00 63.41 N ATOM 1176 CA ASP A 160 9.084 -14.989 -19.817 1.00 74.52 C ATOM 1177 C ASP A 160 8.822 -13.519 -19.507 1.00 55.45 C ATOM 1178 O ASP A 160 7.720 -13.017 -19.723 1.00 12.23 O ATOM 1179 CB ASP A 160 7.871 -15.599 -20.520 1.00 1.44 C ATOM 1180 CG ASP A 160 8.172 -16.957 -21.122 1.00 35.14 C ATOM 1181 OD1 ASP A 160 9.261 -17.115 -21.711 1.00 74.23 O1- ATOM 1182 OD2 ASP A 160 7.318 -17.861 -21.006 1.00 20.24 O ATOM 0 H ASP A 160 8.574 -16.113 -18.121 1.00 63.41 H new ATOM 0 HA ASP A 160 9.948 -15.054 -20.479 1.00 74.52 H new ATOM 0 HB2 ASP A 160 7.052 -15.694 -19.807 1.00 1.44 H new ATOM 0 HB3 ASP A 160 7.533 -14.924 -21.306 1.00 1.44 H new ATOM 1187 N GLN A 161 9.844 -12.836 -18.999 1.00 71.33 N ATOM 1188 CA GLN A 161 9.723 -11.423 -18.658 1.00 43.43 C ATOM 1189 C GLN A 161 9.251 -10.611 -19.860 1.00 43.02 C ATOM 1190 O GLN A 161 8.637 -9.555 -19.707 1.00 33.42 O ATOM 1191 CB GLN A 161 11.062 -10.882 -18.155 1.00 3.00 C ATOM 1192 CG GLN A 161 12.210 -11.102 -19.126 1.00 42.43 C ATOM 1193 CD GLN A 161 12.983 -12.374 -18.836 1.00 42.32 C ATOM 1194 OE1 GLN A 161 13.467 -12.581 -17.723 1.00 31.54 O ATOM 1195 NE2 GLN A 161 13.101 -13.236 -19.840 1.00 21.10 N ATOM 0 H GLN A 161 10.763 -13.238 -18.815 1.00 71.33 H new ATOM 0 HA GLN A 161 8.981 -11.328 -17.866 1.00 43.43 H new ATOM 0 HB2 GLN A 161 10.962 -9.814 -17.959 1.00 3.00 H new ATOM 0 HB3 GLN A 161 11.304 -11.359 -17.205 1.00 3.00 H new ATOM 0 HG2 GLN A 161 11.819 -11.143 -20.142 1.00 42.43 H new ATOM 0 HG3 GLN A 161 12.889 -10.250 -19.080 1.00 42.43 H new ATOM 0 HE21 GLN A 161 12.684 -13.024 -20.746 1.00 21.10 H new ATOM 0 HE22 GLN A 161 13.609 -14.110 -19.705 1.00 21.10 H new ATOM 1204 N LYS A 162 9.543 -11.111 -21.056 1.00 74.31 N ATOM 1205 CA LYS A 162 9.149 -10.434 -22.285 1.00 0.03 C ATOM 1206 C LYS A 162 7.638 -10.224 -22.331 1.00 53.11 C ATOM 1207 O LYS A 162 7.163 -9.153 -22.709 1.00 52.53 O ATOM 1208 CB LYS A 162 9.599 -11.242 -23.504 1.00 22.24 C ATOM 1209 CG LYS A 162 9.066 -10.704 -24.821 1.00 53.23 C ATOM 1210 CD LYS A 162 9.963 -11.091 -25.985 1.00 14.41 C ATOM 1211 CE LYS A 162 9.550 -12.424 -26.589 1.00 61.10 C ATOM 1212 NZ LYS A 162 8.232 -12.335 -27.277 1.00 71.30 N1+ ATOM 0 H LYS A 162 10.052 -11.983 -21.200 1.00 74.31 H new ATOM 0 HA LYS A 162 9.635 -9.458 -22.304 1.00 0.03 H new ATOM 0 HB2 LYS A 162 10.688 -11.253 -23.540 1.00 22.24 H new ATOM 0 HB3 LYS A 162 9.273 -12.275 -23.385 1.00 22.24 H new ATOM 0 HG2 LYS A 162 8.060 -11.088 -24.992 1.00 53.23 H new ATOM 0 HG3 LYS A 162 8.987 -9.618 -24.766 1.00 53.23 H new ATOM 0 HD2 LYS A 162 9.922 -10.316 -26.750 1.00 14.41 H new ATOM 0 HD3 LYS A 162 10.997 -11.149 -25.645 1.00 14.41 H new ATOM 0 HE2 LYS A 162 10.309 -12.752 -27.299 1.00 61.10 H new ATOM 0 HE3 LYS A 162 9.500 -13.179 -25.804 1.00 61.10 H new ATOM 0 HZ1 LYS A 162 8.164 -13.084 -27.995 1.00 71.30 H new ATOM 0 HZ2 LYS A 162 7.468 -12.452 -26.581 1.00 71.30 H new ATOM 0 HZ3 LYS A 162 8.142 -11.406 -27.736 1.00 71.30 H new ATOM 1226 N ARG A 163 6.891 -11.251 -21.943 1.00 24.25 N ATOM 1227 CA ARG A 163 5.435 -11.178 -21.939 1.00 62.53 C ATOM 1228 C ARG A 163 4.903 -10.977 -20.523 1.00 54.45 C ATOM 1229 O ARG A 163 3.765 -11.331 -20.220 1.00 65.14 O ATOM 1230 CB ARG A 163 4.838 -12.451 -22.543 1.00 3.31 C ATOM 1231 CG ARG A 163 4.999 -12.544 -24.051 1.00 22.22 C ATOM 1232 CD ARG A 163 3.785 -11.988 -24.777 1.00 13.20 C ATOM 1233 NE ARG A 163 3.681 -12.498 -26.143 1.00 12.45 N ATOM 1234 CZ ARG A 163 2.603 -12.349 -26.903 1.00 22.53 C ATOM 1235 NH1 ARG A 163 1.541 -11.709 -26.434 1.00 24.04 N1+ ATOM 1236 NH2 ARG A 163 2.585 -12.841 -28.135 1.00 20.22 N ATOM 0 H ARG A 163 7.270 -12.144 -21.627 1.00 24.25 H new ATOM 0 HA ARG A 163 5.138 -10.322 -22.545 1.00 62.53 H new ATOM 0 HB2 ARG A 163 5.311 -13.318 -22.082 1.00 3.31 H new ATOM 0 HB3 ARG A 163 3.777 -12.497 -22.296 1.00 3.31 H new ATOM 0 HG2 ARG A 163 5.890 -11.996 -24.357 1.00 22.22 H new ATOM 0 HG3 ARG A 163 5.151 -13.584 -24.338 1.00 22.22 H new ATOM 0 HD2 ARG A 163 2.882 -12.247 -24.224 1.00 13.20 H new ATOM 0 HD3 ARG A 163 3.844 -10.900 -24.800 1.00 13.20 H new ATOM 0 HE ARG A 163 4.481 -12.996 -26.534 1.00 12.45 H new ATOM 0 HH11 ARG A 163 1.551 -11.330 -25.487 1.00 24.04 H new ATOM 0 HH12 ARG A 163 0.714 -11.596 -27.020 1.00 24.04 H new ATOM 0 HH21 ARG A 163 3.400 -13.334 -28.499 1.00 20.22 H new ATOM 0 HH22 ARG A 163 1.756 -12.726 -28.718 1.00 20.22 H new ATOM 1250 N ASN A 164 5.738 -10.406 -19.660 1.00 34.44 N ATOM 1251 CA ASN A 164 5.352 -10.159 -18.275 1.00 31.41 C ATOM 1252 C ASN A 164 4.828 -11.433 -17.620 1.00 13.15 C ATOM 1253 O ASN A 164 3.939 -11.385 -16.771 1.00 31.11 O ATOM 1254 CB ASN A 164 4.287 -9.061 -18.208 1.00 35.43 C ATOM 1255 CG ASN A 164 4.372 -8.251 -16.930 1.00 23.04 C ATOM 1256 OD1 ASN A 164 3.379 -8.083 -16.221 1.00 72.53 O ATOM 1257 ND2 ASN A 164 5.562 -7.742 -16.629 1.00 42.42 N ATOM 0 H ASN A 164 6.684 -10.106 -19.895 1.00 34.44 H new ATOM 0 HA ASN A 164 6.237 -9.830 -17.731 1.00 31.41 H new ATOM 0 HB2 ASN A 164 4.400 -8.396 -19.064 1.00 35.43 H new ATOM 0 HB3 ASN A 164 3.298 -9.513 -18.283 1.00 35.43 H new ATOM 0 HD21 ASN A 164 5.680 -7.187 -15.781 1.00 42.42 H new ATOM 0 HD22 ASN A 164 6.358 -7.906 -17.246 1.00 42.42 H new ATOM 1264 N ASN A 165 5.387 -12.570 -18.020 1.00 24.24 N ATOM 1265 CA ASN A 165 4.976 -13.858 -17.473 1.00 24.21 C ATOM 1266 C ASN A 165 6.059 -14.435 -16.566 1.00 75.13 C ATOM 1267 O ASN A 165 7.239 -14.117 -16.713 1.00 12.32 O ATOM 1268 CB ASN A 165 4.664 -14.840 -18.603 1.00 52.22 C ATOM 1269 CG ASN A 165 3.214 -14.776 -19.043 1.00 64.44 C ATOM 1270 OD1 ASN A 165 2.840 -13.941 -19.866 1.00 33.43 O ATOM 1271 ND2 ASN A 165 2.390 -15.660 -18.493 1.00 51.05 N ATOM 0 H ASN A 165 6.126 -12.626 -18.721 1.00 24.24 H new ATOM 0 HA ASN A 165 4.076 -13.701 -16.879 1.00 24.21 H new ATOM 0 HB2 ASN A 165 5.309 -14.625 -19.455 1.00 52.22 H new ATOM 0 HB3 ASN A 165 4.896 -15.853 -18.274 1.00 52.22 H new ATOM 0 HD21 ASN A 165 1.403 -15.665 -18.749 1.00 51.05 H new ATOM 0 HD22 ASN A 165 2.744 -16.334 -17.815 1.00 51.05 H new ATOM 1278 N VAL A 166 5.649 -15.283 -15.629 1.00 14.54 N ATOM 1279 CA VAL A 166 6.585 -15.906 -14.700 1.00 71.02 C ATOM 1280 C VAL A 166 6.065 -17.256 -14.219 1.00 3.03 C ATOM 1281 O VAL A 166 4.964 -17.353 -13.678 1.00 35.01 O ATOM 1282 CB VAL A 166 6.846 -15.005 -13.479 1.00 45.01 C ATOM 1283 CG1 VAL A 166 5.539 -14.652 -12.785 1.00 21.30 C ATOM 1284 CG2 VAL A 166 7.805 -15.683 -12.513 1.00 20.03 C ATOM 0 H VAL A 166 4.675 -15.555 -15.493 1.00 14.54 H new ATOM 0 HA VAL A 166 7.520 -16.052 -15.242 1.00 71.02 H new ATOM 0 HB VAL A 166 7.307 -14.080 -13.825 1.00 45.01 H new ATOM 0 HG11 VAL A 166 5.744 -14.015 -11.925 1.00 21.30 H new ATOM 0 HG12 VAL A 166 4.889 -14.123 -13.481 1.00 21.30 H new ATOM 0 HG13 VAL A 166 5.046 -15.565 -12.451 1.00 21.30 H new ATOM 0 HG21 VAL A 166 7.978 -15.032 -11.656 1.00 20.03 H new ATOM 0 HG22 VAL A 166 7.374 -16.624 -12.173 1.00 20.03 H new ATOM 0 HG23 VAL A 166 8.751 -15.879 -13.017 1.00 20.03 H new ATOM 1294 N VAL A 167 6.865 -18.298 -14.422 1.00 13.11 N ATOM 1295 CA VAL A 167 6.488 -19.644 -14.008 1.00 13.14 C ATOM 1296 C VAL A 167 7.643 -20.348 -13.304 1.00 22.44 C ATOM 1297 O VAL A 167 8.810 -20.110 -13.614 1.00 43.21 O ATOM 1298 CB VAL A 167 6.039 -20.496 -15.210 1.00 34.31 C ATOM 1299 CG1 VAL A 167 4.899 -19.814 -15.951 1.00 72.33 C ATOM 1300 CG2 VAL A 167 7.211 -20.759 -16.144 1.00 20.40 C ATOM 0 H VAL A 167 7.779 -18.236 -14.871 1.00 13.11 H new ATOM 0 HA VAL A 167 5.654 -19.539 -13.314 1.00 13.14 H new ATOM 0 HB VAL A 167 5.678 -21.455 -14.839 1.00 34.31 H new ATOM 0 HG11 VAL A 167 4.595 -20.430 -16.797 1.00 72.33 H new ATOM 0 HG12 VAL A 167 4.054 -19.682 -15.276 1.00 72.33 H new ATOM 0 HG13 VAL A 167 5.231 -18.840 -16.312 1.00 72.33 H new ATOM 0 HG21 VAL A 167 6.876 -21.362 -16.988 1.00 20.40 H new ATOM 0 HG22 VAL A 167 7.605 -19.811 -16.510 1.00 20.40 H new ATOM 0 HG23 VAL A 167 7.993 -21.293 -15.605 1.00 20.40 H new ATOM 1310 N VAL A 168 7.310 -21.215 -12.354 1.00 51.55 N ATOM 1311 CA VAL A 168 8.319 -21.955 -11.606 1.00 64.01 C ATOM 1312 C VAL A 168 8.140 -23.459 -11.780 1.00 10.40 C ATOM 1313 O VAL A 168 7.150 -23.914 -12.354 1.00 41.54 O ATOM 1314 CB VAL A 168 8.269 -21.613 -10.105 1.00 22.31 C ATOM 1315 CG1 VAL A 168 8.855 -20.233 -9.851 1.00 30.42 C ATOM 1316 CG2 VAL A 168 6.840 -21.698 -9.588 1.00 74.30 C ATOM 0 H VAL A 168 6.349 -21.422 -12.084 1.00 51.55 H new ATOM 0 HA VAL A 168 9.289 -21.659 -12.006 1.00 64.01 H new ATOM 0 HB VAL A 168 8.872 -22.342 -9.564 1.00 22.31 H new ATOM 0 HG11 VAL A 168 8.811 -20.009 -8.785 1.00 30.42 H new ATOM 0 HG12 VAL A 168 9.893 -20.212 -10.183 1.00 30.42 H new ATOM 0 HG13 VAL A 168 8.282 -19.487 -10.402 1.00 30.42 H new ATOM 0 HG21 VAL A 168 6.822 -21.454 -8.526 1.00 74.30 H new ATOM 0 HG22 VAL A 168 6.213 -20.992 -10.133 1.00 74.30 H new ATOM 0 HG23 VAL A 168 6.460 -22.709 -9.734 1.00 74.30 H new ATOM 1326 N SER A 169 9.103 -24.226 -11.281 1.00 61.10 N ATOM 1327 CA SER A 169 9.053 -25.680 -11.383 1.00 42.35 C ATOM 1328 C SER A 169 9.151 -26.326 -10.004 1.00 41.01 C ATOM 1329 O SER A 169 9.889 -25.856 -9.138 1.00 55.21 O ATOM 1330 CB SER A 169 10.184 -26.188 -12.279 1.00 11.22 C ATOM 1331 OG SER A 169 9.774 -26.250 -13.633 1.00 62.55 O ATOM 0 H SER A 169 9.928 -23.865 -10.802 1.00 61.10 H new ATOM 0 HA SER A 169 8.096 -25.956 -11.826 1.00 42.35 H new ATOM 0 HB2 SER A 169 11.048 -25.530 -12.187 1.00 11.22 H new ATOM 0 HB3 SER A 169 10.500 -27.177 -11.946 1.00 11.22 H new ATOM 0 HG SER A 169 10.515 -26.576 -14.185 1.00 62.55 H new ATOM 1337 N ARG A 170 8.403 -27.406 -9.809 1.00 13.32 N ATOM 1338 CA ARG A 170 8.405 -28.117 -8.536 1.00 64.45 C ATOM 1339 C ARG A 170 9.766 -28.753 -8.270 1.00 32.44 C ATOM 1340 O ARG A 170 10.210 -28.835 -7.124 1.00 71.21 O ATOM 1341 CB ARG A 170 7.317 -29.193 -8.528 1.00 3.01 C ATOM 1342 CG ARG A 170 6.747 -29.471 -7.146 1.00 21.22 C ATOM 1343 CD ARG A 170 7.631 -30.429 -6.362 1.00 64.43 C ATOM 1344 NE ARG A 170 7.081 -31.782 -6.334 1.00 33.33 N ATOM 1345 CZ ARG A 170 7.806 -32.865 -6.075 1.00 12.34 C ATOM 1346 NH1 ARG A 170 9.103 -32.752 -5.822 1.00 3.35 N1+ ATOM 1347 NH2 ARG A 170 7.234 -34.062 -6.067 1.00 44.41 N ATOM 0 H ARG A 170 7.788 -27.808 -10.516 1.00 13.32 H new ATOM 0 HA ARG A 170 8.200 -27.396 -7.745 1.00 64.45 H new ATOM 0 HB2 ARG A 170 6.508 -28.885 -9.190 1.00 3.01 H new ATOM 0 HB3 ARG A 170 7.728 -30.117 -8.935 1.00 3.01 H new ATOM 0 HG2 ARG A 170 6.647 -28.535 -6.597 1.00 21.22 H new ATOM 0 HG3 ARG A 170 5.747 -29.893 -7.242 1.00 21.22 H new ATOM 0 HD2 ARG A 170 8.626 -30.451 -6.807 1.00 64.43 H new ATOM 0 HD3 ARG A 170 7.746 -30.063 -5.342 1.00 64.43 H new ATOM 0 HE ARG A 170 6.086 -31.902 -6.524 1.00 33.33 H new ATOM 0 HH11 ARG A 170 9.545 -31.833 -5.826 1.00 3.35 H new ATOM 0 HH12 ARG A 170 9.658 -33.584 -5.623 1.00 3.35 H new ATOM 0 HH21 ARG A 170 6.236 -34.152 -6.260 1.00 44.41 H new ATOM 0 HH22 ARG A 170 7.792 -34.892 -5.868 1.00 44.41 H new ATOM 1361 N ARG A 171 10.422 -29.201 -9.335 1.00 61.43 N ATOM 1362 CA ARG A 171 11.732 -29.831 -9.216 1.00 54.13 C ATOM 1363 C ARG A 171 12.754 -28.856 -8.639 1.00 41.13 C ATOM 1364 O ARG A 171 13.787 -29.264 -8.110 1.00 64.11 O ATOM 1365 CB ARG A 171 12.206 -30.334 -10.581 1.00 13.15 C ATOM 1366 CG ARG A 171 13.530 -31.077 -10.530 1.00 24.35 C ATOM 1367 CD ARG A 171 13.753 -31.906 -11.785 1.00 42.03 C ATOM 1368 NE ARG A 171 12.990 -33.152 -11.760 1.00 64.34 N ATOM 1369 CZ ARG A 171 13.178 -34.144 -12.623 1.00 51.24 C ATOM 1370 NH1 ARG A 171 14.098 -34.039 -13.571 1.00 23.41 N1+ ATOM 1371 NH2 ARG A 171 12.444 -35.248 -12.536 1.00 34.32 N ATOM 0 H ARG A 171 10.068 -29.140 -10.290 1.00 61.43 H new ATOM 0 HA ARG A 171 11.639 -30.678 -8.536 1.00 54.13 H new ATOM 0 HB2 ARG A 171 11.445 -30.993 -11.000 1.00 13.15 H new ATOM 0 HB3 ARG A 171 12.301 -29.485 -11.258 1.00 13.15 H new ATOM 0 HG2 ARG A 171 14.345 -30.362 -10.415 1.00 24.35 H new ATOM 0 HG3 ARG A 171 13.550 -31.727 -9.655 1.00 24.35 H new ATOM 0 HD2 ARG A 171 13.467 -31.323 -12.660 1.00 42.03 H new ATOM 0 HD3 ARG A 171 14.814 -32.133 -11.886 1.00 42.03 H new ATOM 0 HE ARG A 171 12.275 -33.266 -11.042 1.00 64.34 H new ATOM 0 HH11 ARG A 171 14.665 -33.194 -13.640 1.00 23.41 H new ATOM 0 HH12 ARG A 171 14.239 -34.803 -14.232 1.00 23.41 H new ATOM 0 HH21 ARG A 171 11.736 -35.334 -11.807 1.00 34.32 H new ATOM 0 HH22 ARG A 171 12.588 -36.010 -13.199 1.00 34.32 H new ATOM 1385 N ALA A 172 12.457 -27.564 -8.745 1.00 63.40 N ATOM 1386 CA ALA A 172 13.349 -26.531 -8.233 1.00 2.13 C ATOM 1387 C ALA A 172 13.644 -26.746 -6.752 1.00 45.02 C ATOM 1388 O ALA A 172 14.674 -26.303 -6.243 1.00 44.21 O ATOM 1389 CB ALA A 172 12.744 -25.153 -8.458 1.00 62.22 C ATOM 0 H ALA A 172 11.606 -27.209 -9.181 1.00 63.40 H new ATOM 0 HA ALA A 172 14.291 -26.596 -8.778 1.00 2.13 H new ATOM 0 HB1 ALA A 172 13.420 -24.391 -8.071 1.00 62.22 H new ATOM 0 HB2 ALA A 172 12.590 -24.993 -9.525 1.00 62.22 H new ATOM 0 HB3 ALA A 172 11.788 -25.086 -7.939 1.00 62.22 H new ATOM 1395 N VAL A 173 12.733 -27.427 -6.064 1.00 4.21 N ATOM 1396 CA VAL A 173 12.896 -27.700 -4.641 1.00 11.43 C ATOM 1397 C VAL A 173 14.255 -28.331 -4.355 1.00 14.32 C ATOM 1398 O VAL A 173 14.883 -28.037 -3.337 1.00 63.23 O ATOM 1399 CB VAL A 173 11.789 -28.635 -4.119 1.00 61.53 C ATOM 1400 CG1 VAL A 173 12.000 -28.943 -2.645 1.00 60.30 C ATOM 1401 CG2 VAL A 173 10.417 -28.017 -4.351 1.00 52.12 C ATOM 0 H VAL A 173 11.874 -27.800 -6.469 1.00 4.21 H new ATOM 0 HA VAL A 173 12.827 -26.743 -4.125 1.00 11.43 H new ATOM 0 HB VAL A 173 11.839 -29.573 -4.672 1.00 61.53 H new ATOM 0 HG11 VAL A 173 11.208 -29.605 -2.295 1.00 60.30 H new ATOM 0 HG12 VAL A 173 12.966 -29.430 -2.510 1.00 60.30 H new ATOM 0 HG13 VAL A 173 11.978 -28.016 -2.073 1.00 60.30 H new ATOM 0 HG21 VAL A 173 9.646 -28.691 -3.976 1.00 52.12 H new ATOM 0 HG22 VAL A 173 10.353 -27.065 -3.825 1.00 52.12 H new ATOM 0 HG23 VAL A 173 10.268 -27.853 -5.418 1.00 52.12 H new ATOM 1411 N ILE A 174 14.701 -29.196 -5.258 1.00 53.34 N ATOM 1412 CA ILE A 174 15.986 -29.866 -5.103 1.00 61.21 C ATOM 1413 C ILE A 174 17.110 -28.857 -4.891 1.00 61.34 C ATOM 1414 O ILE A 174 18.124 -29.167 -4.267 1.00 73.44 O ATOM 1415 CB ILE A 174 16.318 -30.738 -6.328 1.00 31.14 C ATOM 1416 CG1 ILE A 174 16.569 -29.858 -7.554 1.00 21.44 C ATOM 1417 CG2 ILE A 174 15.191 -31.724 -6.598 1.00 1.52 C ATOM 1418 CD1 ILE A 174 18.035 -29.641 -7.853 1.00 43.50 C ATOM 0 H ILE A 174 14.192 -29.450 -6.105 1.00 53.34 H new ATOM 0 HA ILE A 174 15.904 -30.505 -4.224 1.00 61.21 H new ATOM 0 HB ILE A 174 17.226 -31.304 -6.118 1.00 31.14 H new ATOM 0 HG12 ILE A 174 16.093 -30.314 -8.422 1.00 21.44 H new ATOM 0 HG13 ILE A 174 16.091 -28.891 -7.401 1.00 21.44 H new ATOM 0 HG21 ILE A 174 15.441 -32.333 -7.467 1.00 1.52 H new ATOM 0 HG22 ILE A 174 15.056 -32.369 -5.730 1.00 1.52 H new ATOM 0 HG23 ILE A 174 14.268 -31.177 -6.791 1.00 1.52 H new ATOM 0 HD11 ILE A 174 18.137 -29.008 -8.735 1.00 43.50 H new ATOM 0 HD12 ILE A 174 18.512 -29.156 -7.001 1.00 43.50 H new ATOM 0 HD13 ILE A 174 18.515 -30.602 -8.039 1.00 43.50 H new ATOM 1430 N GLU A 175 16.921 -27.651 -5.414 1.00 41.14 N ATOM 1431 CA GLU A 175 17.919 -26.595 -5.281 1.00 41.22 C ATOM 1432 C GLU A 175 17.875 -25.979 -3.886 1.00 41.13 C ATOM 1433 O GLU A 175 18.839 -26.067 -3.126 1.00 64.54 O ATOM 1434 CB GLU A 175 17.693 -25.512 -6.337 1.00 45.13 C ATOM 1435 CG GLU A 175 17.610 -26.052 -7.755 1.00 52.34 C ATOM 1436 CD GLU A 175 18.967 -26.429 -8.316 1.00 64.43 C ATOM 1437 OE1 GLU A 175 19.873 -26.743 -7.515 1.00 72.13 O ATOM 1438 OE2 GLU A 175 19.124 -26.411 -9.554 1.00 13.32 O1- ATOM 0 H GLU A 175 16.086 -27.380 -5.934 1.00 41.14 H new ATOM 0 HA GLU A 175 18.903 -27.039 -5.433 1.00 41.22 H new ATOM 0 HB2 GLU A 175 16.771 -24.978 -6.106 1.00 45.13 H new ATOM 0 HB3 GLU A 175 18.504 -24.786 -6.280 1.00 45.13 H new ATOM 0 HG2 GLU A 175 16.959 -26.926 -7.769 1.00 52.34 H new ATOM 0 HG3 GLU A 175 17.150 -25.302 -8.399 1.00 52.34 H new ATOM 1445 N SER A 176 16.750 -25.353 -3.557 1.00 33.30 N ATOM 1446 CA SER A 176 16.581 -24.716 -2.256 1.00 74.04 C ATOM 1447 C SER A 176 16.910 -25.689 -1.128 1.00 63.41 C ATOM 1448 O SER A 176 17.669 -25.364 -0.216 1.00 54.23 O ATOM 1449 CB SER A 176 15.149 -24.201 -2.098 1.00 15.31 C ATOM 1450 OG SER A 176 14.235 -25.274 -1.943 1.00 72.12 O ATOM 0 H SER A 176 15.941 -25.273 -4.174 1.00 33.30 H new ATOM 0 HA SER A 176 17.271 -23.874 -2.200 1.00 74.04 H new ATOM 0 HB2 SER A 176 15.090 -23.541 -1.233 1.00 15.31 H new ATOM 0 HB3 SER A 176 14.874 -23.608 -2.970 1.00 15.31 H new ATOM 0 HG SER A 176 13.454 -25.123 -2.515 1.00 72.12 H new ATOM 1456 N GLU A 177 16.334 -26.885 -1.200 1.00 54.35 N ATOM 1457 CA GLU A 177 16.565 -27.906 -0.184 1.00 44.40 C ATOM 1458 C GLU A 177 18.059 -28.154 0.008 1.00 62.41 C ATOM 1459 O GLU A 177 18.589 -27.996 1.106 1.00 45.33 O ATOM 1460 CB GLU A 177 15.867 -29.210 -0.573 1.00 54.14 C ATOM 1461 CG GLU A 177 14.404 -29.262 -0.165 1.00 45.50 C ATOM 1462 CD GLU A 177 14.211 -29.742 1.260 1.00 30.24 C ATOM 1463 OE1 GLU A 177 14.999 -29.328 2.137 1.00 54.53 O1- ATOM 1464 OE2 GLU A 177 13.275 -30.533 1.499 1.00 1.22 O ATOM 0 H GLU A 177 15.705 -27.171 -1.950 1.00 54.35 H new ATOM 0 HA GLU A 177 16.150 -27.546 0.757 1.00 44.40 H new ATOM 0 HB2 GLU A 177 15.939 -29.343 -1.652 1.00 54.14 H new ATOM 0 HB3 GLU A 177 16.394 -30.046 -0.113 1.00 54.14 H new ATOM 0 HG2 GLU A 177 13.966 -28.270 -0.272 1.00 45.50 H new ATOM 0 HG3 GLU A 177 13.865 -29.924 -0.843 1.00 45.50 H new ATOM 1471 N ASN A 178 18.732 -28.543 -1.071 1.00 31.53 N ATOM 1472 CA ASN A 178 20.163 -28.813 -1.022 1.00 54.34 C ATOM 1473 C ASN A 178 20.937 -27.575 -0.581 1.00 61.14 C ATOM 1474 O ASN A 178 21.413 -27.498 0.551 1.00 23.32 O ATOM 1475 CB ASN A 178 20.662 -29.280 -2.392 1.00 24.22 C ATOM 1476 CG ASN A 178 20.439 -30.763 -2.615 1.00 53.15 C ATOM 1477 OD1 ASN A 178 19.510 -31.163 -3.316 1.00 22.43 O ATOM 1478 ND2 ASN A 178 21.291 -31.586 -2.016 1.00 41.11 N ATOM 0 H ASN A 178 18.308 -28.678 -1.989 1.00 31.53 H new ATOM 0 HA ASN A 178 20.333 -29.604 -0.291 1.00 54.34 H new ATOM 0 HB2 ASN A 178 20.150 -28.717 -3.173 1.00 24.22 H new ATOM 0 HB3 ASN A 178 21.725 -29.058 -2.483 1.00 24.22 H new ATOM 0 HD21 ASN A 178 21.190 -32.595 -2.128 1.00 41.11 H new ATOM 0 HD22 ASN A 178 22.047 -31.210 -1.444 1.00 41.11 H new ATOM 1485 N SER A 179 21.057 -26.606 -1.485 1.00 21.43 N ATOM 1486 CA SER A 179 21.775 -25.371 -1.190 1.00 15.51 C ATOM 1487 C SER A 179 21.281 -24.754 0.114 1.00 64.24 C ATOM 1488 O SER A 179 21.297 -23.535 0.280 1.00 71.22 O ATOM 1489 CB SER A 179 21.606 -24.374 -2.337 1.00 21.23 C ATOM 1490 OG SER A 179 20.420 -23.614 -2.182 1.00 74.50 O ATOM 0 H SER A 179 20.667 -26.653 -2.426 1.00 21.43 H new ATOM 0 HA SER A 179 22.833 -25.611 -1.079 1.00 15.51 H new ATOM 0 HB2 SER A 179 22.467 -23.707 -2.373 1.00 21.23 H new ATOM 0 HB3 SER A 179 21.577 -24.909 -3.286 1.00 21.23 H new ATOM 0 HG SER A 179 20.502 -23.037 -1.394 1.00 74.50 H new TER 1496 SER A 179