USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=19 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= -0.0161 X(o=-0.24,f=-0.13) USER MOD Set 1.2: A 164 ASN : amide:sc= -0.228 X(o=-0.24,f=-0.13) USER MOD Set 2.1: A 107 THR OG1 : rot 180:sc= -0.184 USER MOD Set 2.2: A 176 SER OG : rot -125:sc= -0.162 USER MOD Single : A 88 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0125) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0373) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 180:sc= -0.328 USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 115 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00611) USER MOD Single : A 117 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0365) USER MOD Single : A 121 THR OG1 : rot 75:sc= 0.0525 USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=-0.0057) 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 HE2:sc= 0.0564 K(o=0.056,f=-0.81) USER MOD Single : A 150 LYS NZ :NH3+ -112:sc= -0.28 (180deg=-1.72!) USER MOD Single : A 155 LYS NZ :NH3+ -175:sc= 0.967 (180deg=0.945) USER MOD Single : A 158 LYS NZ :NH3+ 162:sc= -0.0519 (180deg=-0.386) USER MOD Single : A 161 GLN : amide:sc= -0.0904 K(o=-0.09,f=-2.1!) USER MOD Single : A 162 LYS NZ :NH3+ -151:sc=-0.00102 (180deg=-0.552) USER MOD Single : A 165 ASN : amide:sc= -0.317 X(o=-0.32,f=-0.025) USER MOD Single : A 169 SER OG : rot -171:sc= -4.16! USER MOD Single : A 178 ASN : amide:sc= -0.228 K(o=-0.23,f=-2.6!) USER MOD Single : A 179 SER OG : rot 180:sc= 0.0018 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 87 -2.994 -9.510 -2.374 1.00 30.33 N ATOM 2 CA GLU A 87 -3.655 -8.612 -3.313 1.00 3.20 C ATOM 3 C GLU A 87 -2.867 -7.315 -3.472 1.00 2.04 C ATOM 4 O GLU A 87 -3.445 -6.239 -3.627 1.00 23.41 O ATOM 5 CB GLU A 87 -5.077 -8.304 -2.842 1.00 73.34 C ATOM 6 CG GLU A 87 -5.978 -9.525 -2.782 1.00 75.23 C ATOM 7 CD GLU A 87 -5.900 -10.370 -4.040 1.00 0.10 C ATOM 8 OE1 GLU A 87 -6.105 -9.816 -5.139 1.00 71.01 O1- ATOM 9 OE2 GLU A 87 -5.632 -11.584 -3.923 1.00 11.21 O ATOM 0 HA GLU A 87 -3.701 -9.109 -4.282 1.00 3.20 H new ATOM 0 HB2 GLU A 87 -5.032 -7.848 -1.853 1.00 73.34 H new ATOM 0 HB3 GLU A 87 -5.521 -7.568 -3.513 1.00 73.34 H new ATOM 0 HG2 GLU A 87 -5.701 -10.134 -1.922 1.00 75.23 H new ATOM 0 HG3 GLU A 87 -7.008 -9.205 -2.627 1.00 75.23 H new ATOM 16 N LYS A 88 -1.544 -7.425 -3.435 1.00 40.53 N ATOM 17 CA LYS A 88 -0.675 -6.263 -3.576 1.00 63.05 C ATOM 18 C LYS A 88 -0.337 -6.011 -5.042 1.00 52.21 C ATOM 19 O LYS A 88 0.614 -6.582 -5.576 1.00 53.22 O ATOM 20 CB LYS A 88 0.612 -6.462 -2.771 1.00 43.40 C ATOM 21 CG LYS A 88 0.375 -6.968 -1.359 1.00 73.43 C ATOM 22 CD LYS A 88 -0.324 -5.925 -0.504 1.00 72.30 C ATOM 23 CE LYS A 88 -0.891 -6.537 0.768 1.00 5.41 C ATOM 24 NZ LYS A 88 0.179 -7.086 1.646 1.00 62.21 N1+ ATOM 0 H LYS A 88 -1.049 -8.308 -3.308 1.00 40.53 H new ATOM 0 HA LYS A 88 -1.207 -5.394 -3.190 1.00 63.05 H new ATOM 0 HB2 LYS A 88 1.254 -7.168 -3.298 1.00 43.40 H new ATOM 0 HB3 LYS A 88 1.150 -5.515 -2.723 1.00 43.40 H new ATOM 0 HG2 LYS A 88 -0.228 -7.876 -1.393 1.00 73.43 H new ATOM 0 HG3 LYS A 88 1.328 -7.235 -0.902 1.00 73.43 H new ATOM 0 HD2 LYS A 88 0.379 -5.133 -0.246 1.00 72.30 H new ATOM 0 HD3 LYS A 88 -1.128 -5.463 -1.077 1.00 72.30 H new ATOM 0 HE2 LYS A 88 -1.456 -5.781 1.314 1.00 5.41 H new ATOM 0 HE3 LYS A 88 -1.590 -7.332 0.508 1.00 5.41 H new ATOM 0 HZ1 LYS A 88 -0.240 -7.417 2.538 1.00 62.21 H new ATOM 0 HZ2 LYS A 88 0.647 -7.882 1.167 1.00 62.21 H new ATOM 0 HZ3 LYS A 88 0.879 -6.343 1.847 1.00 62.21 H new ATOM 38 N ALA A 89 -1.120 -5.152 -5.686 1.00 2.12 N ATOM 39 CA ALA A 89 -0.901 -4.823 -7.088 1.00 32.13 C ATOM 40 C ALA A 89 0.257 -3.844 -7.248 1.00 63.45 C ATOM 41 O ALA A 89 0.908 -3.801 -8.292 1.00 5.31 O ATOM 42 CB ALA A 89 -2.171 -4.246 -7.699 1.00 44.04 C ATOM 0 H ALA A 89 -1.912 -4.672 -5.259 1.00 2.12 H new ATOM 0 HA ALA A 89 -0.641 -5.741 -7.615 1.00 32.13 H new ATOM 0 HB1 ALA A 89 -1.993 -4.004 -8.747 1.00 44.04 H new ATOM 0 HB2 ALA A 89 -2.975 -4.979 -7.627 1.00 44.04 H new ATOM 0 HB3 ALA A 89 -2.455 -3.341 -7.161 1.00 44.04 H new ATOM 48 N LYS A 90 0.509 -3.058 -6.206 1.00 51.00 N ATOM 49 CA LYS A 90 1.588 -2.078 -6.230 1.00 61.25 C ATOM 50 C LYS A 90 2.913 -2.738 -6.602 1.00 14.35 C ATOM 51 O LYS A 90 3.800 -2.097 -7.165 1.00 71.13 O ATOM 52 CB LYS A 90 1.713 -1.393 -4.867 1.00 41.44 C ATOM 53 CG LYS A 90 2.246 -2.303 -3.774 1.00 65.43 C ATOM 54 CD LYS A 90 1.906 -1.774 -2.392 1.00 32.40 C ATOM 55 CE LYS A 90 2.645 -2.540 -1.305 1.00 73.34 C ATOM 56 NZ LYS A 90 2.920 -1.686 -0.115 1.00 11.23 N1+ ATOM 0 H LYS A 90 -0.020 -3.081 -5.334 1.00 51.00 H new ATOM 0 HA LYS A 90 1.349 -1.329 -6.986 1.00 61.25 H new ATOM 0 HB2 LYS A 90 2.372 -0.530 -4.963 1.00 41.44 H new ATOM 0 HB3 LYS A 90 0.735 -1.016 -4.569 1.00 41.44 H new ATOM 0 HG2 LYS A 90 1.827 -3.302 -3.895 1.00 65.43 H new ATOM 0 HG3 LYS A 90 3.327 -2.397 -3.873 1.00 65.43 H new ATOM 0 HD2 LYS A 90 2.163 -0.716 -2.333 1.00 32.40 H new ATOM 0 HD3 LYS A 90 0.831 -1.850 -2.226 1.00 32.40 H new ATOM 0 HE2 LYS A 90 2.053 -3.404 -1.003 1.00 73.34 H new ATOM 0 HE3 LYS A 90 3.585 -2.921 -1.704 1.00 73.34 H new ATOM 0 HZ1 LYS A 90 3.425 -2.244 0.603 1.00 11.23 H new ATOM 0 HZ2 LYS A 90 3.506 -0.875 -0.398 1.00 11.23 H new ATOM 0 HZ3 LYS A 90 2.022 -1.343 0.281 1.00 11.23 H new ATOM 70 N ARG A 91 3.039 -4.022 -6.284 1.00 52.32 N ATOM 71 CA ARG A 91 4.255 -4.768 -6.584 1.00 73.43 C ATOM 72 C ARG A 91 4.532 -4.772 -8.086 1.00 12.01 C ATOM 73 O ARG A 91 5.678 -4.915 -8.515 1.00 55.01 O ATOM 74 CB ARG A 91 4.137 -6.205 -6.072 1.00 55.15 C ATOM 75 CG ARG A 91 4.696 -6.400 -4.672 1.00 43.31 C ATOM 76 CD ARG A 91 3.982 -5.517 -3.660 1.00 24.02 C ATOM 77 NE ARG A 91 4.451 -5.758 -2.298 1.00 52.32 N ATOM 78 CZ ARG A 91 4.196 -6.870 -1.618 1.00 52.22 C ATOM 79 NH1 ARG A 91 3.480 -7.839 -2.170 1.00 64.04 N1+ ATOM 80 NH2 ARG A 91 4.657 -7.013 -0.382 1.00 70.21 N ATOM 0 H ARG A 91 2.314 -4.568 -5.819 1.00 52.32 H new ATOM 0 HA ARG A 91 5.087 -4.278 -6.079 1.00 73.43 H new ATOM 0 HB2 ARG A 91 3.088 -6.499 -6.079 1.00 55.15 H new ATOM 0 HB3 ARG A 91 4.660 -6.871 -6.759 1.00 55.15 H new ATOM 0 HG2 ARG A 91 4.594 -7.445 -4.381 1.00 43.31 H new ATOM 0 HG3 ARG A 91 5.762 -6.171 -4.669 1.00 43.31 H new ATOM 0 HD2 ARG A 91 4.139 -4.470 -3.918 1.00 24.02 H new ATOM 0 HD3 ARG A 91 2.909 -5.700 -3.712 1.00 24.02 H new ATOM 0 HE ARG A 91 5.005 -5.032 -1.844 1.00 52.32 H new ATOM 0 HH11 ARG A 91 3.123 -7.732 -3.120 1.00 64.04 H new ATOM 0 HH12 ARG A 91 3.286 -8.692 -1.645 1.00 64.04 H new ATOM 0 HH21 ARG A 91 5.207 -6.269 0.046 1.00 70.21 H new ATOM 0 HH22 ARG A 91 4.461 -7.867 0.140 1.00 70.21 H new ATOM 94 N HIS A 92 3.477 -4.616 -8.877 1.00 20.10 N ATOM 95 CA HIS A 92 3.606 -4.602 -10.330 1.00 61.12 C ATOM 96 C HIS A 92 4.668 -3.599 -10.772 1.00 44.23 C ATOM 97 O HIS A 92 5.412 -3.845 -11.720 1.00 34.04 O ATOM 98 CB HIS A 92 2.265 -4.262 -10.981 1.00 61.10 C ATOM 99 CG HIS A 92 2.238 -4.501 -12.458 1.00 44.40 C ATOM 100 ND1 HIS A 92 1.803 -5.682 -13.022 1.00 73.45 N ATOM 101 CD2 HIS A 92 2.594 -3.702 -13.491 1.00 35.45 C ATOM 102 CE1 HIS A 92 1.893 -5.600 -14.337 1.00 42.11 C ATOM 103 NE2 HIS A 92 2.370 -4.407 -14.648 1.00 11.35 N ATOM 0 H HIS A 92 2.523 -4.497 -8.537 1.00 20.10 H new ATOM 0 HA HIS A 92 3.914 -5.597 -10.651 1.00 61.12 H new ATOM 0 HB2 HIS A 92 1.481 -4.856 -10.511 1.00 61.10 H new ATOM 0 HB3 HIS A 92 2.031 -3.215 -10.786 1.00 61.10 H new ATOM 0 HD2 HIS A 92 2.982 -2.697 -13.419 1.00 35.45 H new ATOM 0 HE1 HIS A 92 1.623 -6.375 -15.039 1.00 42.11 H new ATOM 0 HE2 HIS A 92 2.543 -4.066 -15.593 1.00 11.35 H new ATOM 111 N GLU A 93 4.730 -2.467 -10.076 1.00 62.03 N ATOM 112 CA GLU A 93 5.700 -1.427 -10.399 1.00 22.40 C ATOM 113 C GLU A 93 7.081 -1.784 -9.859 1.00 33.12 C ATOM 114 O GLU A 93 8.098 -1.509 -10.495 1.00 63.31 O ATOM 115 CB GLU A 93 5.247 -0.082 -9.824 1.00 71.43 C ATOM 116 CG GLU A 93 6.138 1.082 -10.227 1.00 15.43 C ATOM 117 CD GLU A 93 5.474 2.428 -10.006 1.00 43.51 C ATOM 118 OE1 GLU A 93 4.233 2.504 -10.124 1.00 60.32 O1- ATOM 119 OE2 GLU A 93 6.196 3.404 -9.713 1.00 11.33 O ATOM 0 H GLU A 93 4.122 -2.248 -9.287 1.00 62.03 H new ATOM 0 HA GLU A 93 5.763 -1.348 -11.484 1.00 22.40 H new ATOM 0 HB2 GLU A 93 4.228 0.120 -10.154 1.00 71.43 H new ATOM 0 HB3 GLU A 93 5.223 -0.151 -8.736 1.00 71.43 H new ATOM 0 HG2 GLU A 93 7.065 1.040 -9.655 1.00 15.43 H new ATOM 0 HG3 GLU A 93 6.407 0.982 -11.279 1.00 15.43 H new ATOM 126 N ALA A 94 7.109 -2.398 -8.680 1.00 71.42 N ATOM 127 CA ALA A 94 8.364 -2.795 -8.055 1.00 50.12 C ATOM 128 C ALA A 94 9.016 -3.948 -8.813 1.00 2.41 C ATOM 129 O ALA A 94 10.209 -4.209 -8.658 1.00 44.00 O ATOM 130 CB ALA A 94 8.131 -3.181 -6.602 1.00 70.33 C ATOM 0 H ALA A 94 6.276 -2.631 -8.139 1.00 71.42 H new ATOM 0 HA ALA A 94 9.043 -1.943 -8.089 1.00 50.12 H new ATOM 0 HB1 ALA A 94 9.077 -3.475 -6.148 1.00 70.33 H new ATOM 0 HB2 ALA A 94 7.718 -2.330 -6.061 1.00 70.33 H new ATOM 0 HB3 ALA A 94 7.431 -4.015 -6.555 1.00 70.33 H new ATOM 136 N TRP A 95 8.225 -4.634 -9.630 1.00 33.54 N ATOM 137 CA TRP A 95 8.725 -5.759 -10.411 1.00 2.43 C ATOM 138 C TRP A 95 9.901 -5.336 -11.283 1.00 64.44 C ATOM 139 O TRP A 95 10.735 -6.160 -11.660 1.00 61.23 O ATOM 140 CB TRP A 95 7.609 -6.337 -11.283 1.00 2.15 C ATOM 141 CG TRP A 95 6.639 -7.189 -10.521 1.00 41.24 C ATOM 142 CD1 TRP A 95 6.734 -7.566 -9.211 1.00 14.00 C ATOM 143 CD2 TRP A 95 5.432 -7.770 -11.022 1.00 42.31 C ATOM 144 NE1 TRP A 95 5.656 -8.347 -8.869 1.00 71.33 N ATOM 145 CE2 TRP A 95 4.843 -8.487 -9.962 1.00 74.32 C ATOM 146 CE3 TRP A 95 4.788 -7.753 -12.262 1.00 42.51 C ATOM 147 CZ2 TRP A 95 3.644 -9.179 -10.106 1.00 53.54 C ATOM 148 CZ3 TRP A 95 3.599 -8.442 -12.405 1.00 13.11 C ATOM 149 CH2 TRP A 95 3.036 -9.146 -11.332 1.00 33.31 C ATOM 0 H TRP A 95 7.235 -4.431 -9.769 1.00 33.54 H new ATOM 0 HA TRP A 95 9.069 -6.526 -9.718 1.00 2.43 H new ATOM 0 HB2 TRP A 95 7.068 -5.518 -11.757 1.00 2.15 H new ATOM 0 HB3 TRP A 95 8.053 -6.931 -12.082 1.00 2.15 H new ATOM 0 HD1 TRP A 95 7.537 -7.291 -8.543 1.00 14.00 H new ATOM 0 HE1 TRP A 95 5.489 -8.756 -7.950 1.00 71.33 H new ATOM 0 HE3 TRP A 95 5.212 -7.211 -13.094 1.00 42.51 H new ATOM 0 HZ2 TRP A 95 3.209 -9.722 -9.280 1.00 53.54 H new ATOM 0 HZ3 TRP A 95 3.095 -8.438 -13.360 1.00 13.11 H new ATOM 0 HH2 TRP A 95 2.104 -9.673 -11.475 1.00 33.31 H new ATOM 160 N ILE A 96 9.963 -4.047 -11.600 1.00 55.12 N ATOM 161 CA ILE A 96 11.040 -3.515 -12.428 1.00 34.21 C ATOM 162 C ILE A 96 12.405 -3.856 -11.839 1.00 70.15 C ATOM 163 O ILE A 96 13.401 -3.941 -12.559 1.00 2.25 O ATOM 164 CB ILE A 96 10.928 -1.987 -12.584 1.00 32.45 C ATOM 165 CG1 ILE A 96 11.153 -1.296 -11.237 1.00 12.32 C ATOM 166 CG2 ILE A 96 9.569 -1.612 -13.157 1.00 51.44 C ATOM 167 CD1 ILE A 96 11.098 0.213 -11.316 1.00 41.21 C ATOM 0 H ILE A 96 9.281 -3.352 -11.297 1.00 55.12 H new ATOM 0 HA ILE A 96 10.943 -3.980 -13.409 1.00 34.21 H new ATOM 0 HB ILE A 96 11.699 -1.650 -13.277 1.00 32.45 H new ATOM 0 HG12 ILE A 96 10.400 -1.642 -10.530 1.00 12.32 H new ATOM 0 HG13 ILE A 96 12.123 -1.596 -10.841 1.00 12.32 H new ATOM 0 HG21 ILE A 96 9.505 -0.529 -13.262 1.00 51.44 H new ATOM 0 HG22 ILE A 96 9.445 -2.079 -14.134 1.00 51.44 H new ATOM 0 HG23 ILE A 96 8.783 -1.959 -12.486 1.00 51.44 H new ATOM 0 HD11 ILE A 96 11.266 0.636 -10.325 1.00 41.21 H new ATOM 0 HD12 ILE A 96 11.870 0.570 -11.998 1.00 41.21 H new ATOM 0 HD13 ILE A 96 10.119 0.523 -11.682 1.00 41.21 H new ATOM 179 N THR A 97 12.445 -4.052 -10.525 1.00 51.42 N ATOM 180 CA THR A 97 13.687 -4.384 -9.839 1.00 31.44 C ATOM 181 C THR A 97 14.041 -5.855 -10.024 1.00 41.10 C ATOM 182 O THR A 97 15.213 -6.232 -9.982 1.00 50.20 O ATOM 183 CB THR A 97 13.597 -4.075 -8.332 1.00 14.40 C ATOM 184 OG1 THR A 97 13.235 -2.704 -8.134 1.00 50.05 O ATOM 185 CG2 THR A 97 14.920 -4.362 -7.641 1.00 60.33 C ATOM 0 H THR A 97 11.631 -3.986 -9.914 1.00 51.42 H new ATOM 0 HA THR A 97 14.468 -3.766 -10.283 1.00 31.44 H new ATOM 0 HB THR A 97 12.832 -4.718 -7.896 1.00 14.40 H new ATOM 0 HG1 THR A 97 13.178 -2.516 -7.174 1.00 50.05 H new ATOM 0 HG21 THR A 97 14.832 -4.136 -6.578 1.00 60.33 H new ATOM 0 HG22 THR A 97 15.177 -5.414 -7.769 1.00 60.33 H new ATOM 0 HG23 THR A 97 15.702 -3.742 -8.080 1.00 60.33 H new ATOM 193 N LEU A 98 13.022 -6.682 -10.230 1.00 70.21 N ATOM 194 CA LEU A 98 13.227 -8.114 -10.424 1.00 75.55 C ATOM 195 C LEU A 98 13.968 -8.387 -11.729 1.00 22.22 C ATOM 196 O LEU A 98 14.628 -9.415 -11.874 1.00 13.11 O ATOM 197 CB LEU A 98 11.883 -8.845 -10.424 1.00 74.34 C ATOM 198 CG LEU A 98 10.912 -8.466 -9.305 1.00 35.43 C ATOM 199 CD1 LEU A 98 9.539 -9.069 -9.563 1.00 20.42 C ATOM 200 CD2 LEU A 98 11.450 -8.918 -7.956 1.00 61.11 C ATOM 0 H LEU A 98 12.046 -6.386 -10.267 1.00 70.21 H new ATOM 0 HA LEU A 98 13.836 -8.484 -9.599 1.00 75.55 H new ATOM 0 HB2 LEU A 98 11.393 -8.662 -11.380 1.00 74.34 H new ATOM 0 HB3 LEU A 98 12.075 -9.916 -10.364 1.00 74.34 H new ATOM 0 HG LEU A 98 10.812 -7.381 -9.288 1.00 35.43 H new ATOM 0 HD11 LEU A 98 8.861 -8.789 -8.757 1.00 20.42 H new ATOM 0 HD12 LEU A 98 9.150 -8.696 -10.510 1.00 20.42 H new ATOM 0 HD13 LEU A 98 9.621 -10.155 -9.607 1.00 20.42 H new ATOM 0 HD21 LEU A 98 10.746 -8.640 -7.172 1.00 61.11 H new ATOM 0 HD22 LEU A 98 11.580 -10.000 -7.960 1.00 61.11 H new ATOM 0 HD23 LEU A 98 12.411 -8.438 -7.768 1.00 61.11 H new ATOM 212 N GLU A 99 13.854 -7.459 -12.674 1.00 4.44 N ATOM 213 CA GLU A 99 14.514 -7.600 -13.966 1.00 1.33 C ATOM 214 C GLU A 99 15.999 -7.903 -13.788 1.00 35.40 C ATOM 215 O GLU A 99 16.591 -8.645 -14.572 1.00 24.30 O ATOM 216 CB GLU A 99 14.339 -6.325 -14.795 1.00 15.35 C ATOM 217 CG GLU A 99 12.888 -5.993 -15.102 1.00 32.50 C ATOM 218 CD GLU A 99 12.735 -4.682 -15.846 1.00 23.42 C ATOM 219 OE1 GLU A 99 13.661 -3.846 -15.775 1.00 23.50 O1- ATOM 220 OE2 GLU A 99 11.688 -4.489 -16.500 1.00 0.21 O ATOM 0 H GLU A 99 13.311 -6.602 -12.569 1.00 4.44 H new ATOM 0 HA GLU A 99 14.051 -8.434 -14.493 1.00 1.33 H new ATOM 0 HB2 GLU A 99 14.789 -5.489 -14.260 1.00 15.35 H new ATOM 0 HB3 GLU A 99 14.884 -6.434 -15.733 1.00 15.35 H new ATOM 0 HG2 GLU A 99 12.453 -6.797 -15.696 1.00 32.50 H new ATOM 0 HG3 GLU A 99 12.325 -5.945 -14.170 1.00 32.50 H new ATOM 227 N LYS A 100 16.594 -7.324 -12.751 1.00 11.05 N ATOM 228 CA LYS A 100 18.010 -7.532 -12.467 1.00 40.42 C ATOM 229 C LYS A 100 18.222 -8.817 -11.673 1.00 54.22 C ATOM 230 O LYS A 100 19.288 -9.428 -11.738 1.00 73.30 O ATOM 231 CB LYS A 100 18.576 -6.340 -11.692 1.00 73.52 C ATOM 232 CG LYS A 100 18.878 -5.136 -12.565 1.00 14.42 C ATOM 233 CD LYS A 100 18.963 -3.859 -11.744 1.00 74.54 C ATOM 234 CE LYS A 100 19.174 -2.640 -12.629 1.00 0.53 C ATOM 235 NZ LYS A 100 17.943 -2.286 -13.388 1.00 11.21 N1+ ATOM 0 H LYS A 100 16.118 -6.707 -12.093 1.00 11.05 H new ATOM 0 HA LYS A 100 18.537 -7.622 -13.417 1.00 40.42 H new ATOM 0 HB2 LYS A 100 17.864 -6.049 -10.919 1.00 73.52 H new ATOM 0 HB3 LYS A 100 19.490 -6.648 -11.184 1.00 73.52 H new ATOM 0 HG2 LYS A 100 19.819 -5.294 -13.092 1.00 14.42 H new ATOM 0 HG3 LYS A 100 18.102 -5.031 -13.323 1.00 14.42 H new ATOM 0 HD2 LYS A 100 18.048 -3.736 -11.165 1.00 74.54 H new ATOM 0 HD3 LYS A 100 19.783 -3.938 -11.030 1.00 74.54 H new ATOM 0 HE2 LYS A 100 19.478 -1.793 -12.014 1.00 0.53 H new ATOM 0 HE3 LYS A 100 19.988 -2.835 -13.327 1.00 0.53 H new ATOM 0 HZ1 LYS A 100 18.095 -1.394 -13.900 1.00 11.21 H new ATOM 0 HZ2 LYS A 100 17.725 -3.042 -14.068 1.00 11.21 H new ATOM 0 HZ3 LYS A 100 17.148 -2.174 -12.727 1.00 11.21 H new ATOM 249 N ALA A 101 17.200 -9.221 -10.926 1.00 55.34 N ATOM 250 CA ALA A 101 17.275 -10.434 -10.122 1.00 52.53 C ATOM 251 C ALA A 101 17.695 -11.629 -10.970 1.00 52.15 C ATOM 252 O ALA A 101 18.705 -12.278 -10.691 1.00 73.43 O ATOM 253 CB ALA A 101 15.937 -10.706 -9.450 1.00 21.20 C ATOM 0 H ALA A 101 16.311 -8.726 -10.861 1.00 55.34 H new ATOM 0 HA ALA A 101 18.032 -10.284 -9.352 1.00 52.53 H new ATOM 0 HB1 ALA A 101 16.008 -11.615 -8.853 1.00 21.20 H new ATOM 0 HB2 ALA A 101 15.677 -9.867 -8.804 1.00 21.20 H new ATOM 0 HB3 ALA A 101 15.166 -10.831 -10.211 1.00 21.20 H new ATOM 259 N TYR A 102 16.915 -11.918 -12.006 1.00 21.11 N ATOM 260 CA TYR A 102 17.205 -13.037 -12.893 1.00 31.20 C ATOM 261 C TYR A 102 18.639 -12.967 -13.409 1.00 54.12 C ATOM 262 O TYR A 102 19.259 -13.992 -13.693 1.00 14.45 O ATOM 263 CB TYR A 102 16.228 -13.049 -14.070 1.00 13.11 C ATOM 264 CG TYR A 102 16.583 -14.054 -15.142 1.00 64.12 C ATOM 265 CD1 TYR A 102 16.895 -15.368 -14.813 1.00 0.35 C ATOM 266 CD2 TYR A 102 16.608 -13.691 -16.483 1.00 62.33 C ATOM 267 CE1 TYR A 102 17.221 -16.290 -15.790 1.00 40.03 C ATOM 268 CE2 TYR A 102 16.931 -14.606 -17.465 1.00 42.33 C ATOM 269 CZ TYR A 102 17.237 -15.905 -17.113 1.00 31.20 C ATOM 270 OH TYR A 102 17.561 -16.819 -18.090 1.00 20.33 O ATOM 0 H TYR A 102 16.076 -11.392 -12.252 1.00 21.11 H new ATOM 0 HA TYR A 102 17.088 -13.958 -12.323 1.00 31.20 H new ATOM 0 HB2 TYR A 102 15.227 -13.266 -13.698 1.00 13.11 H new ATOM 0 HB3 TYR A 102 16.195 -12.054 -14.514 1.00 13.11 H new ATOM 0 HD1 TYR A 102 16.883 -15.674 -13.777 1.00 0.35 H new ATOM 0 HD2 TYR A 102 16.371 -12.675 -16.762 1.00 62.33 H new ATOM 0 HE1 TYR A 102 17.462 -17.307 -15.518 1.00 40.03 H new ATOM 0 HE2 TYR A 102 16.944 -14.307 -18.503 1.00 42.33 H new ATOM 0 HH TYR A 102 17.524 -16.386 -18.968 1.00 20.33 H new ATOM 280 N GLU A 103 19.159 -11.750 -13.527 1.00 1.02 N ATOM 281 CA GLU A 103 20.520 -11.545 -14.007 1.00 60.41 C ATOM 282 C GLU A 103 21.531 -12.217 -13.084 1.00 12.44 C ATOM 283 O GLU A 103 22.546 -12.747 -13.537 1.00 10.12 O ATOM 284 CB GLU A 103 20.827 -10.050 -14.115 1.00 65.01 C ATOM 285 CG GLU A 103 21.443 -9.648 -15.446 1.00 0.13 C ATOM 286 CD GLU A 103 22.320 -8.416 -15.335 1.00 52.23 C ATOM 287 OE1 GLU A 103 21.767 -7.303 -15.219 1.00 62.03 O ATOM 288 OE2 GLU A 103 23.559 -8.566 -15.363 1.00 20.11 O1- ATOM 0 H GLU A 103 18.659 -10.891 -13.297 1.00 1.02 H new ATOM 0 HA GLU A 103 20.600 -11.998 -14.995 1.00 60.41 H new ATOM 0 HB2 GLU A 103 19.906 -9.487 -13.966 1.00 65.01 H new ATOM 0 HB3 GLU A 103 21.506 -9.768 -13.310 1.00 65.01 H new ATOM 0 HG2 GLU A 103 22.035 -10.477 -15.833 1.00 0.13 H new ATOM 0 HG3 GLU A 103 20.648 -9.460 -16.168 1.00 0.13 H new ATOM 295 N ASP A 104 21.247 -12.192 -11.787 1.00 24.32 N ATOM 296 CA ASP A 104 22.130 -12.799 -10.798 1.00 22.21 C ATOM 297 C ASP A 104 21.510 -14.068 -10.221 1.00 53.01 C ATOM 298 O ASP A 104 21.884 -14.516 -9.138 1.00 74.24 O ATOM 299 CB ASP A 104 22.430 -11.807 -9.673 1.00 44.00 C ATOM 300 CG ASP A 104 22.607 -10.390 -10.183 1.00 42.43 C ATOM 301 OD1 ASP A 104 23.268 -10.213 -11.228 1.00 73.33 O ATOM 302 OD2 ASP A 104 22.085 -9.457 -9.537 1.00 63.21 O1- ATOM 0 H ASP A 104 20.411 -11.757 -11.395 1.00 24.32 H new ATOM 0 HA ASP A 104 23.062 -13.065 -11.296 1.00 22.21 H new ATOM 0 HB2 ASP A 104 21.618 -11.830 -8.946 1.00 44.00 H new ATOM 0 HB3 ASP A 104 23.335 -12.118 -9.150 1.00 44.00 H new ATOM 307 N ALA A 105 20.559 -14.641 -10.953 1.00 63.33 N ATOM 308 CA ALA A 105 19.887 -15.858 -10.514 1.00 75.23 C ATOM 309 C ALA A 105 19.355 -15.709 -9.094 1.00 40.43 C ATOM 310 O ALA A 105 19.768 -16.433 -8.188 1.00 42.15 O ATOM 311 CB ALA A 105 20.836 -17.045 -10.604 1.00 34.51 C ATOM 0 H ALA A 105 20.237 -14.282 -11.852 1.00 63.33 H new ATOM 0 HA ALA A 105 19.038 -16.035 -11.174 1.00 75.23 H new ATOM 0 HB1 ALA A 105 20.322 -17.948 -10.273 1.00 34.51 H new ATOM 0 HB2 ALA A 105 21.164 -17.171 -11.636 1.00 34.51 H new ATOM 0 HB3 ALA A 105 21.703 -16.867 -9.967 1.00 34.51 H new ATOM 317 N GLU A 106 18.436 -14.767 -8.906 1.00 74.03 N ATOM 318 CA GLU A 106 17.848 -14.525 -7.594 1.00 75.25 C ATOM 319 C GLU A 106 16.912 -15.663 -7.198 1.00 23.20 C ATOM 320 O GLU A 106 16.374 -16.368 -8.053 1.00 54.54 O ATOM 321 CB GLU A 106 17.085 -13.198 -7.590 1.00 21.20 C ATOM 322 CG GLU A 106 17.255 -12.402 -6.306 1.00 43.42 C ATOM 323 CD GLU A 106 18.225 -11.248 -6.459 1.00 0.21 C ATOM 324 OE1 GLU A 106 17.828 -10.209 -7.026 1.00 14.12 O1- ATOM 325 OE2 GLU A 106 19.384 -11.384 -6.011 1.00 44.33 O ATOM 0 H GLU A 106 18.083 -14.159 -9.645 1.00 74.03 H new ATOM 0 HA GLU A 106 18.657 -14.474 -6.866 1.00 75.25 H new ATOM 0 HB2 GLU A 106 17.423 -12.592 -8.431 1.00 21.20 H new ATOM 0 HB3 GLU A 106 16.025 -13.398 -7.746 1.00 21.20 H new ATOM 0 HG2 GLU A 106 16.285 -12.017 -5.991 1.00 43.42 H new ATOM 0 HG3 GLU A 106 17.607 -13.065 -5.516 1.00 43.42 H new ATOM 332 N THR A 107 16.721 -15.838 -5.894 1.00 4.24 N ATOM 333 CA THR A 107 15.853 -16.891 -5.383 1.00 44.41 C ATOM 334 C THR A 107 14.521 -16.323 -4.907 1.00 60.01 C ATOM 335 O THR A 107 14.337 -15.106 -4.854 1.00 43.33 O ATOM 336 CB THR A 107 16.517 -17.652 -4.221 1.00 43.42 C ATOM 337 OG1 THR A 107 15.740 -18.807 -3.883 1.00 2.32 O ATOM 338 CG2 THR A 107 16.661 -16.757 -2.999 1.00 72.55 C ATOM 0 H THR A 107 17.156 -15.263 -5.172 1.00 4.24 H new ATOM 0 HA THR A 107 15.677 -17.582 -6.207 1.00 44.41 H new ATOM 0 HB THR A 107 17.511 -17.964 -4.542 1.00 43.42 H new ATOM 0 HG1 THR A 107 16.170 -19.286 -3.144 1.00 2.32 H new ATOM 0 HG21 THR A 107 17.133 -17.317 -2.191 1.00 72.55 H new ATOM 0 HG22 THR A 107 17.278 -15.894 -3.251 1.00 72.55 H new ATOM 0 HG23 THR A 107 15.676 -16.418 -2.678 1.00 72.55 H new ATOM 346 N VAL A 108 13.593 -17.210 -4.561 1.00 20.54 N ATOM 347 CA VAL A 108 12.278 -16.795 -4.088 1.00 41.44 C ATOM 348 C VAL A 108 11.740 -17.766 -3.042 1.00 71.21 C ATOM 349 O VAL A 108 12.371 -18.777 -2.733 1.00 42.35 O ATOM 350 CB VAL A 108 11.270 -16.695 -5.248 1.00 65.54 C ATOM 351 CG1 VAL A 108 11.621 -15.532 -6.162 1.00 22.45 C ATOM 352 CG2 VAL A 108 11.224 -18.002 -6.026 1.00 1.14 C ATOM 0 H VAL A 108 13.728 -18.220 -4.600 1.00 20.54 H new ATOM 0 HA VAL A 108 12.399 -15.810 -3.637 1.00 41.44 H new ATOM 0 HB VAL A 108 10.279 -16.511 -4.832 1.00 65.54 H new ATOM 0 HG11 VAL A 108 10.898 -15.477 -6.976 1.00 22.45 H new ATOM 0 HG12 VAL A 108 11.598 -14.602 -5.593 1.00 22.45 H new ATOM 0 HG13 VAL A 108 12.619 -15.681 -6.574 1.00 22.45 H new ATOM 0 HG21 VAL A 108 10.507 -17.915 -6.842 1.00 1.14 H new ATOM 0 HG22 VAL A 108 12.212 -18.218 -6.433 1.00 1.14 H new ATOM 0 HG23 VAL A 108 10.920 -18.811 -5.361 1.00 1.14 H new ATOM 362 N THR A 109 10.566 -17.453 -2.501 1.00 0.35 N ATOM 363 CA THR A 109 9.942 -18.297 -1.489 1.00 72.43 C ATOM 364 C THR A 109 8.457 -17.982 -1.352 1.00 62.13 C ATOM 365 O THR A 109 8.072 -16.830 -1.160 1.00 25.51 O ATOM 366 CB THR A 109 10.621 -18.124 -0.117 1.00 21.55 C ATOM 367 OG1 THR A 109 9.872 -18.814 0.890 1.00 40.31 O ATOM 368 CG2 THR A 109 10.736 -16.652 0.249 1.00 24.53 C ATOM 0 H THR A 109 10.029 -16.622 -2.747 1.00 0.35 H new ATOM 0 HA THR A 109 10.063 -19.329 -1.818 1.00 72.43 H new ATOM 0 HB THR A 109 11.624 -18.546 -0.177 1.00 21.55 H new ATOM 0 HG1 THR A 109 10.311 -18.701 1.759 1.00 40.31 H new ATOM 0 HG21 THR A 109 11.219 -16.556 1.222 1.00 24.53 H new ATOM 0 HG22 THR A 109 11.331 -16.135 -0.504 1.00 24.53 H new ATOM 0 HG23 THR A 109 9.741 -16.209 0.292 1.00 24.53 H new ATOM 376 N GLY A 110 7.626 -19.015 -1.451 1.00 43.33 N ATOM 377 CA GLY A 110 6.192 -18.828 -1.334 1.00 13.05 C ATOM 378 C GLY A 110 5.451 -20.135 -1.130 1.00 3.55 C ATOM 379 O GLY A 110 5.927 -21.196 -1.533 1.00 41.25 O ATOM 0 H GLY A 110 7.921 -19.978 -1.610 1.00 43.33 H new ATOM 0 HA2 GLY A 110 5.983 -18.161 -0.498 1.00 13.05 H new ATOM 0 HA3 GLY A 110 5.818 -18.339 -2.233 1.00 13.05 H new ATOM 383 N VAL A 111 4.284 -20.059 -0.499 1.00 54.30 N ATOM 384 CA VAL A 111 3.476 -21.245 -0.240 1.00 20.01 C ATOM 385 C VAL A 111 2.311 -21.341 -1.218 1.00 45.43 C ATOM 386 O VAL A 111 1.649 -20.344 -1.511 1.00 13.55 O ATOM 387 CB VAL A 111 2.926 -21.247 1.198 1.00 12.42 C ATOM 388 CG1 VAL A 111 2.000 -20.059 1.418 1.00 14.12 C ATOM 389 CG2 VAL A 111 2.206 -22.554 1.492 1.00 40.44 C ATOM 0 H VAL A 111 3.877 -19.188 -0.158 1.00 54.30 H new ATOM 0 HA VAL A 111 4.129 -22.107 -0.372 1.00 20.01 H new ATOM 0 HB VAL A 111 3.765 -21.157 1.888 1.00 12.42 H new ATOM 0 HG11 VAL A 111 1.621 -20.077 2.440 1.00 14.12 H new ATOM 0 HG12 VAL A 111 2.550 -19.133 1.252 1.00 14.12 H new ATOM 0 HG13 VAL A 111 1.164 -20.115 0.720 1.00 14.12 H new ATOM 0 HG21 VAL A 111 1.824 -22.537 2.513 1.00 40.44 H new ATOM 0 HG22 VAL A 111 1.376 -22.677 0.796 1.00 40.44 H new ATOM 0 HG23 VAL A 111 2.901 -23.386 1.378 1.00 40.44 H new ATOM 399 N ILE A 112 2.064 -22.545 -1.721 1.00 15.31 N ATOM 400 CA ILE A 112 0.978 -22.772 -2.666 1.00 63.34 C ATOM 401 C ILE A 112 -0.349 -22.267 -2.108 1.00 32.02 C ATOM 402 O ILE A 112 -0.931 -22.880 -1.214 1.00 22.02 O ATOM 403 CB ILE A 112 0.839 -24.264 -3.018 1.00 73.40 C ATOM 404 CG1 ILE A 112 2.131 -24.782 -3.657 1.00 51.40 C ATOM 405 CG2 ILE A 112 -0.342 -24.480 -3.952 1.00 51.04 C ATOM 406 CD1 ILE A 112 3.045 -25.488 -2.681 1.00 44.52 C ATOM 0 H ILE A 112 2.602 -23.380 -1.490 1.00 15.31 H new ATOM 0 HA ILE A 112 1.226 -22.216 -3.571 1.00 63.34 H new ATOM 0 HB ILE A 112 0.659 -24.823 -2.100 1.00 73.40 H new ATOM 0 HG12 ILE A 112 1.878 -25.467 -4.466 1.00 51.40 H new ATOM 0 HG13 ILE A 112 2.667 -23.945 -4.104 1.00 51.40 H new ATOM 0 HG21 ILE A 112 -0.427 -25.540 -4.192 1.00 51.04 H new ATOM 0 HG22 ILE A 112 -1.257 -24.143 -3.465 1.00 51.04 H new ATOM 0 HG23 ILE A 112 -0.189 -23.912 -4.869 1.00 51.04 H new ATOM 0 HD11 ILE A 112 3.940 -25.828 -3.202 1.00 44.52 H new ATOM 0 HD12 ILE A 112 3.328 -24.800 -1.885 1.00 44.52 H new ATOM 0 HD13 ILE A 112 2.527 -26.346 -2.252 1.00 44.52 H new ATOM 418 N ASN A 113 -0.823 -21.147 -2.643 1.00 70.02 N ATOM 419 CA ASN A 113 -2.082 -20.561 -2.200 1.00 33.21 C ATOM 420 C ASN A 113 -3.231 -20.991 -3.107 1.00 62.31 C ATOM 421 O ASN A 113 -4.333 -21.272 -2.638 1.00 53.33 O ATOM 422 CB ASN A 113 -1.979 -19.034 -2.179 1.00 33.10 C ATOM 423 CG ASN A 113 -2.877 -18.408 -1.131 1.00 43.33 C ATOM 424 OD1 ASN A 113 -3.872 -19.002 -0.715 1.00 34.24 O ATOM 425 ND2 ASN A 113 -2.530 -17.201 -0.699 1.00 44.13 N ATOM 0 H ASN A 113 -0.354 -20.627 -3.384 1.00 70.02 H new ATOM 0 HA ASN A 113 -2.285 -20.919 -1.191 1.00 33.21 H new ATOM 0 HB2 ASN A 113 -0.946 -18.745 -1.987 1.00 33.10 H new ATOM 0 HB3 ASN A 113 -2.243 -18.641 -3.161 1.00 33.10 H new ATOM 0 HD21 ASN A 113 -3.097 -16.729 0.006 1.00 44.13 H new ATOM 0 HD22 ASN A 113 -1.697 -16.746 -1.072 1.00 44.13 H new ATOM 432 N GLY A 114 -2.965 -21.042 -4.408 1.00 13.12 N ATOM 433 CA GLY A 114 -3.986 -21.440 -5.360 1.00 74.52 C ATOM 434 C GLY A 114 -3.584 -22.658 -6.165 1.00 51.31 C ATOM 435 O GLY A 114 -2.421 -22.808 -6.542 1.00 72.15 O ATOM 0 H GLY A 114 -2.060 -20.815 -4.820 1.00 13.12 H new ATOM 0 HA2 GLY A 114 -4.913 -21.650 -4.827 1.00 74.52 H new ATOM 0 HA3 GLY A 114 -4.189 -20.611 -6.038 1.00 74.52 H new ATOM 439 N LYS A 115 -4.547 -23.535 -6.431 1.00 74.23 N ATOM 440 CA LYS A 115 -4.289 -24.748 -7.197 1.00 34.25 C ATOM 441 C LYS A 115 -5.218 -24.838 -8.404 1.00 42.21 C ATOM 442 O LYS A 115 -6.361 -24.382 -8.355 1.00 24.11 O ATOM 443 CB LYS A 115 -4.465 -25.983 -6.311 1.00 22.32 C ATOM 444 CG LYS A 115 -5.888 -26.177 -5.815 1.00 35.33 C ATOM 445 CD LYS A 115 -5.958 -27.229 -4.721 1.00 22.31 C ATOM 446 CE LYS A 115 -7.397 -27.606 -4.401 1.00 75.20 C ATOM 447 NZ LYS A 115 -7.975 -28.511 -5.433 1.00 11.23 N1+ ATOM 0 H LYS A 115 -5.515 -23.427 -6.127 1.00 74.23 H new ATOM 0 HA LYS A 115 -3.260 -24.709 -7.555 1.00 34.25 H new ATOM 0 HB2 LYS A 115 -4.160 -26.868 -6.870 1.00 22.32 H new ATOM 0 HB3 LYS A 115 -3.798 -25.903 -5.453 1.00 22.32 H new ATOM 0 HG2 LYS A 115 -6.275 -25.231 -5.437 1.00 35.33 H new ATOM 0 HG3 LYS A 115 -6.527 -26.473 -6.647 1.00 35.33 H new ATOM 0 HD2 LYS A 115 -5.409 -28.117 -5.033 1.00 22.31 H new ATOM 0 HD3 LYS A 115 -5.471 -26.853 -3.821 1.00 22.31 H new ATOM 0 HE2 LYS A 115 -7.437 -28.093 -3.427 1.00 75.20 H new ATOM 0 HE3 LYS A 115 -8.002 -26.702 -4.330 1.00 75.20 H new ATOM 0 HZ1 LYS A 115 -8.932 -28.799 -5.145 1.00 11.23 H new ATOM 0 HZ2 LYS A 115 -8.023 -28.012 -6.344 1.00 11.23 H new ATOM 0 HZ3 LYS A 115 -7.374 -29.354 -5.531 1.00 11.23 H new ATOM 461 N VAL A 116 -4.720 -25.429 -9.485 1.00 23.14 N ATOM 462 CA VAL A 116 -5.507 -25.581 -10.703 1.00 34.23 C ATOM 463 C VAL A 116 -5.709 -27.052 -11.047 1.00 0.13 C ATOM 464 O VAL A 116 -5.193 -27.937 -10.365 1.00 22.41 O ATOM 465 CB VAL A 116 -4.837 -24.873 -11.896 1.00 11.42 C ATOM 466 CG1 VAL A 116 -4.806 -23.369 -11.676 1.00 22.33 C ATOM 467 CG2 VAL A 116 -3.433 -25.417 -12.117 1.00 71.40 C ATOM 0 H VAL A 116 -3.776 -25.810 -9.542 1.00 23.14 H new ATOM 0 HA VAL A 116 -6.476 -25.119 -10.513 1.00 34.23 H new ATOM 0 HB VAL A 116 -5.425 -25.072 -12.792 1.00 11.42 H new ATOM 0 HG11 VAL A 116 -4.329 -22.886 -12.529 1.00 22.33 H new ATOM 0 HG12 VAL A 116 -5.825 -22.996 -11.570 1.00 22.33 H new ATOM 0 HG13 VAL A 116 -4.242 -23.145 -10.771 1.00 22.33 H new ATOM 0 HG21 VAL A 116 -2.974 -24.906 -12.963 1.00 71.40 H new ATOM 0 HG22 VAL A 116 -2.833 -25.249 -11.223 1.00 71.40 H new ATOM 0 HG23 VAL A 116 -3.485 -26.486 -12.323 1.00 71.40 H new ATOM 477 N LYS A 117 -6.463 -27.307 -12.111 1.00 32.33 N ATOM 478 CA LYS A 117 -6.733 -28.672 -12.549 1.00 42.33 C ATOM 479 C LYS A 117 -5.439 -29.391 -12.918 1.00 14.34 C ATOM 480 O LYS A 117 -4.945 -29.265 -14.037 1.00 60.05 O ATOM 481 CB LYS A 117 -7.685 -28.666 -13.747 1.00 61.43 C ATOM 482 CG LYS A 117 -8.463 -29.961 -13.912 1.00 62.31 C ATOM 483 CD LYS A 117 -7.602 -31.054 -14.520 1.00 13.11 C ATOM 484 CE LYS A 117 -8.450 -32.130 -15.181 1.00 34.15 C ATOM 485 NZ LYS A 117 -8.995 -31.680 -16.492 1.00 72.03 N1+ ATOM 0 H LYS A 117 -6.898 -26.586 -12.686 1.00 32.33 H new ATOM 0 HA LYS A 117 -7.202 -29.206 -11.723 1.00 42.33 H new ATOM 0 HB2 LYS A 117 -8.389 -27.841 -13.637 1.00 61.43 H new ATOM 0 HB3 LYS A 117 -7.112 -28.478 -14.655 1.00 61.43 H new ATOM 0 HG2 LYS A 117 -8.837 -30.288 -12.942 1.00 62.31 H new ATOM 0 HG3 LYS A 117 -9.332 -29.786 -14.546 1.00 62.31 H new ATOM 0 HD2 LYS A 117 -6.926 -30.619 -15.256 1.00 13.11 H new ATOM 0 HD3 LYS A 117 -6.982 -31.504 -13.745 1.00 13.11 H new ATOM 0 HE2 LYS A 117 -7.849 -33.028 -15.327 1.00 34.15 H new ATOM 0 HE3 LYS A 117 -9.273 -32.401 -14.520 1.00 34.15 H new ATOM 0 HZ1 LYS A 117 -9.452 -32.482 -16.972 1.00 72.03 H new ATOM 0 HZ2 LYS A 117 -9.694 -30.926 -16.337 1.00 72.03 H new ATOM 0 HZ3 LYS A 117 -8.220 -31.318 -17.084 1.00 72.03 H new ATOM 499 N GLY A 118 -4.896 -30.147 -11.969 1.00 2.22 N ATOM 500 CA GLY A 118 -3.665 -30.876 -12.215 1.00 23.52 C ATOM 501 C GLY A 118 -2.433 -30.069 -11.858 1.00 73.33 C ATOM 502 O GLY A 118 -1.448 -30.614 -11.363 1.00 53.41 O ATOM 0 H GLY A 118 -5.286 -30.268 -11.034 1.00 2.22 H new ATOM 0 HA2 GLY A 118 -3.671 -31.799 -11.636 1.00 23.52 H new ATOM 0 HA3 GLY A 118 -3.618 -31.159 -13.266 1.00 23.52 H new ATOM 506 N GLY A 119 -2.486 -28.766 -12.113 1.00 73.01 N ATOM 507 CA GLY A 119 -1.358 -27.904 -11.811 1.00 40.10 C ATOM 508 C GLY A 119 -1.523 -27.174 -10.493 1.00 3.33 C ATOM 509 O GLY A 119 -2.577 -27.249 -9.861 1.00 23.40 O ATOM 0 H GLY A 119 -3.290 -28.291 -12.523 1.00 73.01 H new ATOM 0 HA2 GLY A 119 -0.446 -28.501 -11.781 1.00 40.10 H new ATOM 0 HA3 GLY A 119 -1.236 -27.176 -12.613 1.00 40.10 H new ATOM 513 N PHE A 120 -0.478 -26.467 -10.076 1.00 21.13 N ATOM 514 CA PHE A 120 -0.510 -25.722 -8.822 1.00 73.13 C ATOM 515 C PHE A 120 0.012 -24.302 -9.020 1.00 33.45 C ATOM 516 O PHE A 120 0.650 -23.996 -10.028 1.00 42.12 O ATOM 517 CB PHE A 120 0.321 -26.439 -7.756 1.00 45.15 C ATOM 518 CG PHE A 120 -0.474 -27.404 -6.925 1.00 10.53 C ATOM 519 CD1 PHE A 120 -1.372 -26.944 -5.974 1.00 40.45 C ATOM 520 CD2 PHE A 120 -0.324 -28.772 -7.092 1.00 41.15 C ATOM 521 CE1 PHE A 120 -2.105 -27.829 -5.208 1.00 33.12 C ATOM 522 CE2 PHE A 120 -1.055 -29.662 -6.327 1.00 24.30 C ATOM 523 CZ PHE A 120 -1.947 -29.189 -5.384 1.00 54.21 C ATOM 0 H PHE A 120 0.401 -26.394 -10.588 1.00 21.13 H new ATOM 0 HA PHE A 120 -1.546 -25.666 -8.488 1.00 73.13 H new ATOM 0 HB2 PHE A 120 1.136 -26.976 -8.242 1.00 45.15 H new ATOM 0 HB3 PHE A 120 0.775 -25.696 -7.101 1.00 45.15 H new ATOM 0 HD1 PHE A 120 -1.500 -25.881 -5.831 1.00 40.45 H new ATOM 0 HD2 PHE A 120 0.372 -29.147 -7.828 1.00 41.15 H new ATOM 0 HE1 PHE A 120 -2.802 -27.457 -4.471 1.00 33.12 H new ATOM 0 HE2 PHE A 120 -0.929 -30.726 -6.466 1.00 24.30 H new ATOM 0 HZ PHE A 120 -2.520 -29.882 -4.786 1.00 54.21 H new ATOM 533 N THR A 121 -0.266 -23.435 -8.049 1.00 3.13 N ATOM 534 CA THR A 121 0.173 -22.048 -8.116 1.00 4.13 C ATOM 535 C THR A 121 0.751 -21.589 -6.783 1.00 21.42 C ATOM 536 O THR A 121 0.360 -22.079 -5.723 1.00 71.30 O ATOM 537 CB THR A 121 -0.984 -21.111 -8.510 1.00 11.34 C ATOM 538 OG1 THR A 121 -1.921 -21.810 -9.337 1.00 20.12 O ATOM 539 CG2 THR A 121 -0.463 -19.887 -9.249 1.00 43.11 C ATOM 0 H THR A 121 -0.793 -23.671 -7.208 1.00 3.13 H new ATOM 0 HA THR A 121 0.948 -21.999 -8.881 1.00 4.13 H new ATOM 0 HB THR A 121 -1.480 -20.781 -7.598 1.00 11.34 H new ATOM 0 HG1 THR A 121 -2.449 -22.425 -8.786 1.00 20.12 H new ATOM 0 HG21 THR A 121 -1.299 -19.241 -9.517 1.00 43.11 H new ATOM 0 HG22 THR A 121 0.227 -19.340 -8.606 1.00 43.11 H new ATOM 0 HG23 THR A 121 0.056 -20.202 -10.154 1.00 43.11 H new ATOM 547 N VAL A 122 1.686 -20.645 -6.841 1.00 12.32 N ATOM 548 CA VAL A 122 2.316 -20.119 -5.636 1.00 62.52 C ATOM 549 C VAL A 122 2.438 -18.600 -5.698 1.00 11.44 C ATOM 550 O VAL A 122 2.447 -18.013 -6.779 1.00 22.11 O ATOM 551 CB VAL A 122 3.715 -20.726 -5.424 1.00 61.21 C ATOM 552 CG1 VAL A 122 4.208 -20.454 -4.011 1.00 4.33 C ATOM 553 CG2 VAL A 122 3.696 -22.220 -5.713 1.00 4.41 C ATOM 0 H VAL A 122 2.023 -20.229 -7.709 1.00 12.32 H new ATOM 0 HA VAL A 122 1.677 -20.396 -4.798 1.00 62.52 H new ATOM 0 HB VAL A 122 4.407 -20.253 -6.121 1.00 61.21 H new ATOM 0 HG11 VAL A 122 5.198 -20.891 -3.881 1.00 4.33 H new ATOM 0 HG12 VAL A 122 4.261 -19.378 -3.845 1.00 4.33 H new ATOM 0 HG13 VAL A 122 3.518 -20.898 -3.293 1.00 4.33 H new ATOM 0 HG21 VAL A 122 4.693 -22.633 -5.558 1.00 4.41 H new ATOM 0 HG22 VAL A 122 2.991 -22.711 -5.042 1.00 4.41 H new ATOM 0 HG23 VAL A 122 3.390 -22.387 -6.746 1.00 4.41 H new ATOM 563 N GLU A 123 2.532 -17.971 -4.531 1.00 1.41 N ATOM 564 CA GLU A 123 2.653 -16.521 -4.453 1.00 24.31 C ATOM 565 C GLU A 123 4.012 -16.117 -3.888 1.00 24.33 C ATOM 566 O GLU A 123 4.279 -16.291 -2.698 1.00 63.43 O ATOM 567 CB GLU A 123 1.534 -15.939 -3.586 1.00 10.44 C ATOM 568 CG GLU A 123 1.563 -14.423 -3.493 1.00 13.44 C ATOM 569 CD GLU A 123 0.426 -13.868 -2.655 1.00 44.22 C ATOM 570 OE1 GLU A 123 -0.683 -13.692 -3.201 1.00 14.32 O1- ATOM 571 OE2 GLU A 123 0.647 -13.611 -1.453 1.00 5.32 O ATOM 0 H GLU A 123 2.527 -18.443 -3.627 1.00 1.41 H new ATOM 0 HA GLU A 123 2.566 -16.121 -5.463 1.00 24.31 H new ATOM 0 HB2 GLU A 123 0.572 -16.251 -3.991 1.00 10.44 H new ATOM 0 HB3 GLU A 123 1.608 -16.358 -2.582 1.00 10.44 H new ATOM 0 HG2 GLU A 123 2.514 -14.107 -3.064 1.00 13.44 H new ATOM 0 HG3 GLU A 123 1.510 -14.000 -4.496 1.00 13.44 H new ATOM 578 N LEU A 124 4.868 -15.577 -4.749 1.00 13.23 N ATOM 579 CA LEU A 124 6.200 -15.150 -4.336 1.00 3.34 C ATOM 580 C LEU A 124 6.306 -13.628 -4.333 1.00 14.51 C ATOM 581 O LEU A 124 6.760 -13.026 -5.306 1.00 51.32 O ATOM 582 CB LEU A 124 7.259 -15.743 -5.267 1.00 74.20 C ATOM 583 CG LEU A 124 7.112 -17.232 -5.586 1.00 25.45 C ATOM 584 CD1 LEU A 124 8.083 -17.641 -6.683 1.00 35.05 C ATOM 585 CD2 LEU A 124 7.333 -18.070 -4.336 1.00 14.43 C ATOM 0 H LEU A 124 4.663 -15.425 -5.737 1.00 13.23 H new ATOM 0 HA LEU A 124 6.373 -15.511 -3.322 1.00 3.34 H new ATOM 0 HB2 LEU A 124 7.242 -15.187 -6.205 1.00 74.20 H new ATOM 0 HB3 LEU A 124 8.240 -15.583 -4.819 1.00 74.20 H new ATOM 0 HG LEU A 124 6.097 -17.409 -5.943 1.00 25.45 H new ATOM 0 HD11 LEU A 124 7.964 -18.703 -6.897 1.00 35.05 H new ATOM 0 HD12 LEU A 124 7.877 -17.064 -7.585 1.00 35.05 H new ATOM 0 HD13 LEU A 124 9.105 -17.449 -6.355 1.00 35.05 H new ATOM 0 HD21 LEU A 124 7.224 -19.126 -4.582 1.00 14.43 H new ATOM 0 HD22 LEU A 124 8.336 -17.889 -3.949 1.00 14.43 H new ATOM 0 HD23 LEU A 124 6.597 -17.796 -3.580 1.00 14.43 H new ATOM 597 N ASN A 125 5.887 -13.013 -3.232 1.00 42.42 N ATOM 598 CA ASN A 125 5.937 -11.561 -3.102 1.00 23.03 C ATOM 599 C ASN A 125 5.278 -10.884 -4.300 1.00 71.21 C ATOM 600 O ASN A 125 5.896 -10.069 -4.983 1.00 12.11 O ATOM 601 CB ASN A 125 7.386 -11.089 -2.968 1.00 41.54 C ATOM 602 CG ASN A 125 8.195 -11.965 -2.031 1.00 2.20 C ATOM 603 OD1 ASN A 125 7.756 -12.283 -0.926 1.00 61.54 O ATOM 604 ND2 ASN A 125 9.385 -12.359 -2.469 1.00 75.40 N ATOM 0 H ASN A 125 5.509 -13.497 -2.417 1.00 42.42 H new ATOM 0 HA ASN A 125 5.387 -11.283 -2.203 1.00 23.03 H new ATOM 0 HB2 ASN A 125 7.856 -11.083 -3.952 1.00 41.54 H new ATOM 0 HB3 ASN A 125 7.398 -10.062 -2.602 1.00 41.54 H new ATOM 0 HD21 ASN A 125 9.975 -12.949 -1.882 1.00 75.40 H new ATOM 0 HD22 ASN A 125 9.709 -12.072 -3.392 1.00 75.40 H new ATOM 611 N GLY A 126 4.018 -11.228 -4.548 1.00 44.14 N ATOM 612 CA GLY A 126 3.295 -10.645 -5.663 1.00 71.51 C ATOM 613 C GLY A 126 3.365 -11.502 -6.911 1.00 14.11 C ATOM 614 O GLY A 126 2.405 -11.570 -7.679 1.00 40.40 O ATOM 0 H GLY A 126 3.485 -11.900 -3.996 1.00 44.14 H new ATOM 0 HA2 GLY A 126 2.252 -10.503 -5.381 1.00 71.51 H new ATOM 0 HA3 GLY A 126 3.703 -9.658 -5.880 1.00 71.51 H new ATOM 618 N ILE A 127 4.502 -12.156 -7.115 1.00 22.22 N ATOM 619 CA ILE A 127 4.693 -13.012 -8.279 1.00 73.32 C ATOM 620 C ILE A 127 3.854 -14.281 -8.171 1.00 14.32 C ATOM 621 O ILE A 127 3.578 -14.764 -7.073 1.00 64.31 O ATOM 622 CB ILE A 127 6.173 -13.402 -8.455 1.00 24.54 C ATOM 623 CG1 ILE A 127 7.064 -12.163 -8.359 1.00 35.23 C ATOM 624 CG2 ILE A 127 6.380 -14.108 -9.787 1.00 3.54 C ATOM 625 CD1 ILE A 127 6.812 -11.150 -9.452 1.00 1.33 C ATOM 0 H ILE A 127 5.306 -12.110 -6.489 1.00 22.22 H new ATOM 0 HA ILE A 127 4.371 -12.439 -9.148 1.00 73.32 H new ATOM 0 HB ILE A 127 6.450 -14.089 -7.655 1.00 24.54 H new ATOM 0 HG12 ILE A 127 6.907 -11.687 -7.391 1.00 35.23 H new ATOM 0 HG13 ILE A 127 8.108 -12.473 -8.396 1.00 35.23 H new ATOM 0 HG21 ILE A 127 7.431 -14.377 -9.897 1.00 3.54 H new ATOM 0 HG22 ILE A 127 5.769 -15.010 -9.820 1.00 3.54 H new ATOM 0 HG23 ILE A 127 6.089 -13.443 -10.600 1.00 3.54 H new ATOM 0 HD11 ILE A 127 7.480 -10.299 -9.320 1.00 1.33 H new ATOM 0 HD12 ILE A 127 6.997 -11.609 -10.423 1.00 1.33 H new ATOM 0 HD13 ILE A 127 5.777 -10.811 -9.402 1.00 1.33 H new ATOM 637 N ARG A 128 3.452 -14.817 -9.319 1.00 34.50 N ATOM 638 CA ARG A 128 2.645 -16.030 -9.354 1.00 4.34 C ATOM 639 C ARG A 128 3.390 -17.159 -10.062 1.00 60.24 C ATOM 640 O ARG A 128 3.657 -17.084 -11.261 1.00 55.21 O ATOM 641 CB ARG A 128 1.314 -15.763 -10.061 1.00 35.11 C ATOM 642 CG ARG A 128 0.255 -15.157 -9.154 1.00 21.23 C ATOM 643 CD ARG A 128 0.308 -13.638 -9.172 1.00 73.51 C ATOM 644 NE ARG A 128 -0.850 -13.041 -8.512 1.00 62.14 N ATOM 645 CZ ARG A 128 -2.033 -12.890 -9.096 1.00 54.34 C ATOM 646 NH1 ARG A 128 -2.214 -13.290 -10.347 1.00 63.40 N1+ ATOM 647 NH2 ARG A 128 -3.038 -12.338 -8.429 1.00 13.12 N ATOM 0 H ARG A 128 3.672 -14.430 -10.237 1.00 34.50 H new ATOM 0 HA ARG A 128 2.449 -16.335 -8.326 1.00 4.34 H new ATOM 0 HB2 ARG A 128 1.487 -15.092 -10.902 1.00 35.11 H new ATOM 0 HB3 ARG A 128 0.936 -16.699 -10.472 1.00 35.11 H new ATOM 0 HG2 ARG A 128 -0.732 -15.491 -9.472 1.00 21.23 H new ATOM 0 HG3 ARG A 128 0.400 -15.515 -8.135 1.00 21.23 H new ATOM 0 HD2 ARG A 128 1.220 -13.301 -8.678 1.00 73.51 H new ATOM 0 HD3 ARG A 128 0.357 -13.289 -10.204 1.00 73.51 H new ATOM 0 HE ARG A 128 -0.744 -12.722 -7.549 1.00 62.14 H new ATOM 0 HH11 ARG A 128 -1.444 -13.715 -10.863 1.00 63.40 H new ATOM 0 HH12 ARG A 128 -3.124 -13.173 -10.793 1.00 63.40 H new ATOM 0 HH21 ARG A 128 -2.903 -12.029 -7.466 1.00 13.12 H new ATOM 0 HH22 ARG A 128 -3.946 -12.223 -8.879 1.00 13.12 H new ATOM 661 N ALA A 129 3.722 -18.203 -9.310 1.00 23.11 N ATOM 662 CA ALA A 129 4.434 -19.348 -9.865 1.00 52.14 C ATOM 663 C ALA A 129 3.462 -20.428 -10.328 1.00 51.23 C ATOM 664 O ALA A 129 2.300 -20.447 -9.921 1.00 40.33 O ATOM 665 CB ALA A 129 5.405 -19.913 -8.840 1.00 63.52 C ATOM 0 H ALA A 129 3.510 -18.280 -8.315 1.00 23.11 H new ATOM 0 HA ALA A 129 4.998 -19.007 -10.734 1.00 52.14 H new ATOM 0 HB1 ALA A 129 5.930 -20.767 -9.268 1.00 63.52 H new ATOM 0 HB2 ALA A 129 6.128 -19.146 -8.562 1.00 63.52 H new ATOM 0 HB3 ALA A 129 4.855 -20.231 -7.955 1.00 63.52 H new ATOM 671 N PHE A 130 3.944 -21.325 -11.181 1.00 51.13 N ATOM 672 CA PHE A 130 3.117 -22.408 -11.700 1.00 11.43 C ATOM 673 C PHE A 130 3.880 -23.730 -11.686 1.00 70.34 C ATOM 674 O PHE A 130 4.854 -23.906 -12.420 1.00 70.32 O ATOM 675 CB PHE A 130 2.655 -22.088 -13.124 1.00 33.32 C ATOM 676 CG PHE A 130 1.411 -22.825 -13.530 1.00 74.44 C ATOM 677 CD1 PHE A 130 1.409 -24.207 -13.629 1.00 63.42 C ATOM 678 CD2 PHE A 130 0.243 -22.135 -13.813 1.00 15.20 C ATOM 679 CE1 PHE A 130 0.267 -24.888 -14.003 1.00 15.24 C ATOM 680 CE2 PHE A 130 -0.903 -22.812 -14.187 1.00 51.42 C ATOM 681 CZ PHE A 130 -0.891 -24.189 -14.282 1.00 35.35 C ATOM 0 H PHE A 130 4.903 -21.324 -11.528 1.00 51.13 H new ATOM 0 HA PHE A 130 2.244 -22.506 -11.055 1.00 11.43 H new ATOM 0 HB2 PHE A 130 2.476 -21.016 -13.207 1.00 33.32 H new ATOM 0 HB3 PHE A 130 3.456 -22.332 -13.821 1.00 33.32 H new ATOM 0 HD1 PHE A 130 2.312 -24.759 -13.411 1.00 63.42 H new ATOM 0 HD2 PHE A 130 0.228 -21.058 -13.741 1.00 15.20 H new ATOM 0 HE1 PHE A 130 0.280 -25.965 -14.077 1.00 15.24 H new ATOM 0 HE2 PHE A 130 -1.807 -22.263 -14.405 1.00 51.42 H new ATOM 0 HZ PHE A 130 -1.786 -24.719 -14.574 1.00 35.35 H new ATOM 691 N LEU A 131 3.431 -24.656 -10.847 1.00 42.32 N ATOM 692 CA LEU A 131 4.070 -25.962 -10.736 1.00 71.54 C ATOM 693 C LEU A 131 3.508 -26.934 -11.769 1.00 33.11 C ATOM 694 O LEU A 131 2.296 -27.095 -11.910 1.00 13.54 O ATOM 695 CB LEU A 131 3.877 -26.529 -9.329 1.00 3.45 C ATOM 696 CG LEU A 131 4.336 -25.635 -8.176 1.00 1.01 C ATOM 697 CD1 LEU A 131 5.647 -24.947 -8.524 1.00 72.14 C ATOM 698 CD2 LEU A 131 3.265 -24.607 -7.839 1.00 1.05 C ATOM 0 H LEU A 131 2.627 -24.527 -10.233 1.00 42.32 H new ATOM 0 HA LEU A 131 5.136 -25.834 -10.927 1.00 71.54 H new ATOM 0 HB2 LEU A 131 2.819 -26.752 -9.191 1.00 3.45 H new ATOM 0 HB3 LEU A 131 4.413 -27.476 -9.264 1.00 3.45 H new ATOM 0 HG LEU A 131 4.499 -26.261 -7.299 1.00 1.01 H new ATOM 0 HD11 LEU A 131 5.958 -24.315 -7.692 1.00 72.14 H new ATOM 0 HD12 LEU A 131 6.413 -25.699 -8.715 1.00 72.14 H new ATOM 0 HD13 LEU A 131 5.511 -24.333 -9.415 1.00 72.14 H new ATOM 0 HD21 LEU A 131 3.609 -23.980 -7.017 1.00 1.05 H new ATOM 0 HD22 LEU A 131 3.070 -23.985 -8.713 1.00 1.05 H new ATOM 0 HD23 LEU A 131 2.348 -25.119 -7.546 1.00 1.05 H new ATOM 710 N PRO A 132 4.408 -27.599 -12.508 1.00 44.13 N ATOM 711 CA PRO A 132 4.025 -28.567 -13.539 1.00 23.41 C ATOM 712 C PRO A 132 3.427 -29.839 -12.947 1.00 0.41 C ATOM 713 O PRO A 132 4.019 -30.464 -12.068 1.00 50.35 O ATOM 714 CB PRO A 132 5.348 -28.877 -14.244 1.00 2.04 C ATOM 715 CG PRO A 132 6.396 -28.594 -13.224 1.00 70.40 C ATOM 716 CD PRO A 132 5.870 -27.456 -12.393 1.00 11.23 C ATOM 0 HA PRO A 132 3.255 -28.172 -14.202 1.00 23.41 H new ATOM 0 HB2 PRO A 132 5.387 -29.915 -14.574 1.00 2.04 H new ATOM 0 HB3 PRO A 132 5.480 -28.256 -15.130 1.00 2.04 H new ATOM 0 HG2 PRO A 132 6.587 -29.472 -12.607 1.00 70.40 H new ATOM 0 HG3 PRO A 132 7.340 -28.327 -13.699 1.00 70.40 H new ATOM 0 HD2 PRO A 132 6.201 -27.528 -11.357 1.00 11.23 H new ATOM 0 HD3 PRO A 132 6.211 -26.492 -12.770 1.00 11.23 H new ATOM 724 N GLY A 133 2.249 -30.218 -13.434 1.00 51.13 N ATOM 725 CA GLY A 133 1.592 -31.413 -12.940 1.00 72.20 C ATOM 726 C GLY A 133 2.501 -32.625 -12.962 1.00 24.31 C ATOM 727 O GLY A 133 2.341 -33.544 -12.159 1.00 62.54 O ATOM 0 H GLY A 133 1.738 -29.718 -14.162 1.00 51.13 H new ATOM 0 HA2 GLY A 133 1.248 -31.239 -11.921 1.00 72.20 H new ATOM 0 HA3 GLY A 133 0.708 -31.615 -13.545 1.00 72.20 H new ATOM 731 N SER A 134 3.456 -32.631 -13.886 1.00 13.24 N ATOM 732 CA SER A 134 4.391 -33.743 -14.013 1.00 0.03 C ATOM 733 C SER A 134 5.124 -33.989 -12.698 1.00 14.21 C ATOM 734 O SER A 134 5.588 -35.098 -12.429 1.00 33.45 O ATOM 735 CB SER A 134 5.401 -33.463 -15.128 1.00 71.14 C ATOM 736 OG SER A 134 4.766 -33.430 -16.394 1.00 54.54 O ATOM 0 H SER A 134 3.603 -31.878 -14.558 1.00 13.24 H new ATOM 0 HA SER A 134 3.821 -34.638 -14.265 1.00 0.03 H new ATOM 0 HB2 SER A 134 5.898 -32.511 -14.942 1.00 71.14 H new ATOM 0 HB3 SER A 134 6.173 -34.232 -15.125 1.00 71.14 H new ATOM 0 HG SER A 134 5.432 -33.248 -17.089 1.00 54.54 H new ATOM 742 N LEU A 135 5.225 -32.947 -11.881 1.00 22.34 N ATOM 743 CA LEU A 135 5.901 -33.048 -10.591 1.00 71.02 C ATOM 744 C LEU A 135 4.928 -33.474 -9.498 1.00 43.52 C ATOM 745 O LEU A 135 5.300 -34.184 -8.563 1.00 62.30 O ATOM 746 CB LEU A 135 6.544 -31.709 -10.224 1.00 1.33 C ATOM 747 CG LEU A 135 8.071 -31.700 -10.137 1.00 35.31 C ATOM 748 CD1 LEU A 135 8.571 -30.339 -9.678 1.00 35.24 C ATOM 749 CD2 LEU A 135 8.558 -32.793 -9.199 1.00 24.21 C ATOM 0 H LEU A 135 4.848 -32.022 -12.088 1.00 22.34 H new ATOM 0 HA LEU A 135 6.679 -33.807 -10.675 1.00 71.02 H new ATOM 0 HB2 LEU A 135 6.238 -30.967 -10.961 1.00 1.33 H new ATOM 0 HB3 LEU A 135 6.143 -31.387 -9.263 1.00 1.33 H new ATOM 0 HG LEU A 135 8.474 -31.896 -11.131 1.00 35.31 H new ATOM 0 HD11 LEU A 135 9.659 -30.351 -9.622 1.00 35.24 H new ATOM 0 HD12 LEU A 135 8.253 -29.576 -10.388 1.00 35.24 H new ATOM 0 HD13 LEU A 135 8.160 -30.113 -8.694 1.00 35.24 H new ATOM 0 HD21 LEU A 135 9.647 -32.772 -9.149 1.00 24.21 H new ATOM 0 HD22 LEU A 135 8.146 -32.628 -8.203 1.00 24.21 H new ATOM 0 HD23 LEU A 135 8.231 -33.764 -9.571 1.00 24.21 H new ATOM 761 N VAL A 136 3.678 -33.039 -9.622 1.00 10.15 N ATOM 762 CA VAL A 136 2.650 -33.378 -8.646 1.00 65.54 C ATOM 763 C VAL A 136 2.556 -34.888 -8.449 1.00 40.25 C ATOM 764 O VAL A 136 2.160 -35.361 -7.383 1.00 34.33 O ATOM 765 CB VAL A 136 1.271 -32.841 -9.073 1.00 44.33 C ATOM 766 CG1 VAL A 136 0.208 -33.228 -8.057 1.00 72.44 C ATOM 767 CG2 VAL A 136 1.322 -31.332 -9.256 1.00 24.52 C ATOM 0 H VAL A 136 3.353 -32.451 -10.389 1.00 10.15 H new ATOM 0 HA VAL A 136 2.939 -32.908 -7.706 1.00 65.54 H new ATOM 0 HB VAL A 136 1.005 -33.292 -10.029 1.00 44.33 H new ATOM 0 HG11 VAL A 136 -0.759 -32.840 -8.376 1.00 72.44 H new ATOM 0 HG12 VAL A 136 0.156 -34.314 -7.981 1.00 72.44 H new ATOM 0 HG13 VAL A 136 0.464 -32.808 -7.084 1.00 72.44 H new ATOM 0 HG21 VAL A 136 0.340 -30.969 -9.558 1.00 24.52 H new ATOM 0 HG22 VAL A 136 1.610 -30.861 -8.316 1.00 24.52 H new ATOM 0 HG23 VAL A 136 2.053 -31.083 -10.025 1.00 24.52 H new ATOM 777 N ASP A 137 2.922 -35.637 -9.482 1.00 63.00 N ATOM 778 CA ASP A 137 2.881 -37.094 -9.422 1.00 72.00 C ATOM 779 C ASP A 137 4.277 -37.684 -9.584 1.00 1.41 C ATOM 780 O ASP A 137 4.884 -37.589 -10.652 1.00 33.31 O ATOM 781 CB ASP A 137 1.953 -37.644 -10.507 1.00 42.44 C ATOM 782 CG ASP A 137 2.083 -36.892 -11.817 1.00 44.32 C ATOM 783 OD1 ASP A 137 3.032 -37.182 -12.575 1.00 15.05 O ATOM 784 OD2 ASP A 137 1.237 -36.013 -12.084 1.00 53.44 O1- ATOM 0 H ASP A 137 3.250 -35.260 -10.371 1.00 63.00 H new ATOM 0 HA ASP A 137 2.496 -37.382 -8.444 1.00 72.00 H new ATOM 0 HB2 ASP A 137 2.177 -38.698 -10.673 1.00 42.44 H new ATOM 0 HB3 ASP A 137 0.921 -37.588 -10.161 1.00 42.44 H new ATOM 789 N VAL A 138 4.784 -38.294 -8.517 1.00 53.41 N ATOM 790 CA VAL A 138 6.111 -38.899 -8.540 1.00 15.53 C ATOM 791 C VAL A 138 6.388 -39.664 -7.250 1.00 1.43 C ATOM 792 O VAL A 138 6.315 -39.104 -6.157 1.00 34.11 O ATOM 793 CB VAL A 138 7.209 -37.839 -8.741 1.00 13.01 C ATOM 794 CG1 VAL A 138 7.115 -36.763 -7.669 1.00 11.43 C ATOM 795 CG2 VAL A 138 8.585 -38.488 -8.737 1.00 50.50 C ATOM 0 H VAL A 138 4.296 -38.382 -7.626 1.00 53.41 H new ATOM 0 HA VAL A 138 6.128 -39.592 -9.381 1.00 15.53 H new ATOM 0 HB VAL A 138 7.059 -37.366 -9.712 1.00 13.01 H new ATOM 0 HG11 VAL A 138 7.899 -36.022 -7.827 1.00 11.43 H new ATOM 0 HG12 VAL A 138 6.141 -36.278 -7.725 1.00 11.43 H new ATOM 0 HG13 VAL A 138 7.238 -37.217 -6.686 1.00 11.43 H new ATOM 0 HG21 VAL A 138 9.348 -37.723 -8.880 1.00 50.50 H new ATOM 0 HG22 VAL A 138 8.748 -38.989 -7.783 1.00 50.50 H new ATOM 0 HG23 VAL A 138 8.646 -39.217 -9.545 1.00 50.50 H new ATOM 805 N ARG A 139 6.706 -40.947 -7.387 1.00 35.25 N ATOM 806 CA ARG A 139 6.994 -41.790 -6.233 1.00 31.31 C ATOM 807 C ARG A 139 5.770 -41.913 -5.330 1.00 33.22 C ATOM 808 O ARG A 139 4.844 -41.102 -5.385 1.00 64.02 O ATOM 809 CB ARG A 139 8.171 -41.220 -5.439 1.00 30.13 C ATOM 810 CG ARG A 139 9.485 -41.938 -5.698 1.00 20.12 C ATOM 811 CD ARG A 139 10.632 -41.295 -4.934 1.00 14.14 C ATOM 812 NE ARG A 139 11.931 -41.806 -5.363 1.00 54.24 N ATOM 813 CZ ARG A 139 13.076 -41.165 -5.160 1.00 72.02 C ATOM 814 NH1 ARG A 139 13.083 -39.993 -4.538 1.00 5.33 N1+ ATOM 815 NH2 ARG A 139 14.217 -41.694 -5.581 1.00 4.43 N ATOM 0 H ARG A 139 6.771 -41.425 -8.286 1.00 35.25 H new ATOM 0 HA ARG A 139 7.257 -42.783 -6.597 1.00 31.31 H new ATOM 0 HB2 ARG A 139 8.288 -40.165 -5.686 1.00 30.13 H new ATOM 0 HB3 ARG A 139 7.941 -41.274 -4.375 1.00 30.13 H new ATOM 0 HG2 ARG A 139 9.393 -42.984 -5.406 1.00 20.12 H new ATOM 0 HG3 ARG A 139 9.704 -41.924 -6.766 1.00 20.12 H new ATOM 0 HD2 ARG A 139 10.602 -40.215 -5.077 1.00 14.14 H new ATOM 0 HD3 ARG A 139 10.505 -41.479 -3.867 1.00 14.14 H new ATOM 0 HE ARG A 139 11.960 -42.704 -5.845 1.00 54.24 H new ATOM 0 HH11 ARG A 139 12.207 -39.582 -4.214 1.00 5.33 H new ATOM 0 HH12 ARG A 139 13.964 -39.503 -4.383 1.00 5.33 H new ATOM 0 HH21 ARG A 139 14.215 -42.594 -6.061 1.00 4.43 H new ATOM 0 HH22 ARG A 139 15.096 -41.201 -5.425 1.00 4.43 H new ATOM 829 N PRO A 140 5.763 -42.949 -4.480 1.00 72.14 N ATOM 830 CA PRO A 140 4.659 -43.203 -3.549 1.00 14.50 C ATOM 831 C PRO A 140 4.588 -42.163 -2.436 1.00 3.15 C ATOM 832 O PRO A 140 5.608 -41.604 -2.030 1.00 52.42 O ATOM 833 CB PRO A 140 4.989 -44.582 -2.973 1.00 25.24 C ATOM 834 CG PRO A 140 6.468 -44.704 -3.109 1.00 34.04 C ATOM 835 CD PRO A 140 6.832 -43.954 -4.360 1.00 45.02 C ATOM 0 HA PRO A 140 3.689 -43.155 -4.045 1.00 14.50 H new ATOM 0 HB2 PRO A 140 4.679 -44.660 -1.931 1.00 25.24 H new ATOM 0 HB3 PRO A 140 4.474 -45.373 -3.519 1.00 25.24 H new ATOM 0 HG2 PRO A 140 6.976 -44.284 -2.241 1.00 34.04 H new ATOM 0 HG3 PRO A 140 6.769 -45.749 -3.179 1.00 34.04 H new ATOM 0 HD2 PRO A 140 7.814 -43.488 -4.277 1.00 45.02 H new ATOM 0 HD3 PRO A 140 6.864 -44.612 -5.228 1.00 45.02 H new ATOM 843 N VAL A 141 3.380 -41.908 -1.945 1.00 14.24 N ATOM 844 CA VAL A 141 3.177 -40.937 -0.877 1.00 40.14 C ATOM 845 C VAL A 141 1.976 -41.310 -0.015 1.00 51.04 C ATOM 846 O VAL A 141 1.104 -42.067 -0.442 1.00 50.42 O ATOM 847 CB VAL A 141 2.969 -39.519 -1.441 1.00 61.41 C ATOM 848 CG1 VAL A 141 4.198 -39.065 -2.214 1.00 4.11 C ATOM 849 CG2 VAL A 141 1.729 -39.472 -2.321 1.00 2.25 C ATOM 0 H VAL A 141 2.526 -42.361 -2.270 1.00 14.24 H new ATOM 0 HA VAL A 141 4.078 -40.948 -0.264 1.00 40.14 H new ATOM 0 HB VAL A 141 2.821 -38.834 -0.606 1.00 61.41 H new ATOM 0 HG11 VAL A 141 4.032 -38.061 -2.605 1.00 4.11 H new ATOM 0 HG12 VAL A 141 5.063 -39.058 -1.551 1.00 4.11 H new ATOM 0 HG13 VAL A 141 4.381 -39.751 -3.041 1.00 4.11 H new ATOM 0 HG21 VAL A 141 1.598 -38.463 -2.711 1.00 2.25 H new ATOM 0 HG22 VAL A 141 1.845 -40.169 -3.151 1.00 2.25 H new ATOM 0 HG23 VAL A 141 0.855 -39.750 -1.733 1.00 2.25 H new ATOM 859 N ARG A 142 1.938 -40.773 1.200 1.00 71.04 N ATOM 860 CA ARG A 142 0.844 -41.050 2.123 1.00 53.24 C ATOM 861 C ARG A 142 -0.029 -39.814 2.319 1.00 4.13 C ATOM 862 O ARG A 142 -1.146 -39.744 1.805 1.00 5.33 O ATOM 863 CB ARG A 142 1.394 -41.519 3.472 1.00 34.10 C ATOM 864 CG ARG A 142 2.174 -42.821 3.393 1.00 34.45 C ATOM 865 CD ARG A 142 2.566 -43.319 4.775 1.00 41.42 C ATOM 866 NE ARG A 142 1.455 -43.980 5.454 1.00 32.52 N ATOM 867 CZ ARG A 142 1.585 -44.653 6.593 1.00 43.31 C ATOM 868 NH1 ARG A 142 2.772 -44.753 7.176 1.00 73.12 N1+ ATOM 869 NH2 ARG A 142 0.527 -45.226 7.150 1.00 14.02 N ATOM 0 H ARG A 142 2.652 -40.144 1.568 1.00 71.04 H new ATOM 0 HA ARG A 142 0.230 -41.842 1.693 1.00 53.24 H new ATOM 0 HB2 ARG A 142 2.040 -40.742 3.881 1.00 34.10 H new ATOM 0 HB3 ARG A 142 0.565 -41.644 4.169 1.00 34.10 H new ATOM 0 HG2 ARG A 142 1.572 -43.577 2.890 1.00 34.45 H new ATOM 0 HG3 ARG A 142 3.070 -42.674 2.790 1.00 34.45 H new ATOM 0 HD2 ARG A 142 3.402 -44.013 4.687 1.00 41.42 H new ATOM 0 HD3 ARG A 142 2.912 -42.480 5.378 1.00 41.42 H new ATOM 0 HE ARG A 142 0.529 -43.922 5.031 1.00 32.52 H new ATOM 0 HH11 ARG A 142 3.588 -44.313 6.750 1.00 73.12 H new ATOM 0 HH12 ARG A 142 2.869 -45.270 8.050 1.00 73.12 H new ATOM 0 HH21 ARG A 142 -0.387 -45.151 6.705 1.00 14.02 H new ATOM 0 HH22 ARG A 142 0.628 -45.742 8.024 1.00 14.02 H new ATOM 883 N ASP A 143 0.487 -38.844 3.065 1.00 41.32 N ATOM 884 CA ASP A 143 -0.245 -37.610 3.327 1.00 33.40 C ATOM 885 C ASP A 143 -0.479 -36.832 2.036 1.00 60.23 C ATOM 886 O ASP A 143 0.360 -36.835 1.135 1.00 42.31 O ATOM 887 CB ASP A 143 0.519 -36.743 4.329 1.00 30.13 C ATOM 888 CG ASP A 143 1.996 -36.645 4.003 1.00 23.42 C ATOM 889 OD1 ASP A 143 2.375 -35.741 3.229 1.00 65.31 O ATOM 890 OD2 ASP A 143 2.774 -37.474 4.521 1.00 1.43 O1- ATOM 0 H ASP A 143 1.409 -38.888 3.499 1.00 41.32 H new ATOM 0 HA ASP A 143 -1.214 -37.874 3.751 1.00 33.40 H new ATOM 0 HB2 ASP A 143 0.086 -35.743 4.343 1.00 30.13 H new ATOM 0 HB3 ASP A 143 0.398 -37.157 5.330 1.00 30.13 H new ATOM 895 N THR A 144 -1.627 -36.166 1.953 1.00 33.51 N ATOM 896 CA THR A 144 -1.974 -35.386 0.773 1.00 12.22 C ATOM 897 C THR A 144 -1.904 -33.891 1.062 1.00 32.31 C ATOM 898 O THR A 144 -2.547 -33.086 0.386 1.00 31.31 O ATOM 899 CB THR A 144 -3.387 -35.733 0.264 1.00 3.12 C ATOM 900 OG1 THR A 144 -3.781 -37.018 0.756 1.00 2.12 O ATOM 901 CG2 THR A 144 -3.430 -35.729 -1.257 1.00 34.45 C ATOM 0 H THR A 144 -2.332 -36.152 2.690 1.00 33.51 H new ATOM 0 HA THR A 144 -1.246 -35.639 0.002 1.00 12.22 H new ATOM 0 HB THR A 144 -4.080 -34.976 0.632 1.00 3.12 H new ATOM 0 HG1 THR A 144 -4.680 -37.231 0.430 1.00 2.12 H new ATOM 0 HG21 THR A 144 -4.437 -35.977 -1.593 1.00 34.45 H new ATOM 0 HG22 THR A 144 -3.157 -34.740 -1.626 1.00 34.45 H new ATOM 0 HG23 THR A 144 -2.727 -36.467 -1.643 1.00 34.45 H new ATOM 909 N LEU A 145 -1.120 -33.524 2.070 1.00 25.21 N ATOM 910 CA LEU A 145 -0.965 -32.124 2.448 1.00 41.45 C ATOM 911 C LEU A 145 0.149 -31.463 1.643 1.00 44.04 C ATOM 912 O LEU A 145 0.177 -30.241 1.488 1.00 41.05 O ATOM 913 CB LEU A 145 -0.666 -32.010 3.943 1.00 72.14 C ATOM 914 CG LEU A 145 -1.879 -32.015 4.873 1.00 12.03 C ATOM 915 CD1 LEU A 145 -2.383 -33.434 5.085 1.00 10.12 C ATOM 916 CD2 LEU A 145 -1.534 -31.365 6.206 1.00 72.53 C ATOM 0 H LEU A 145 -0.582 -34.177 2.640 1.00 25.21 H new ATOM 0 HA LEU A 145 -1.900 -31.608 2.230 1.00 41.45 H new ATOM 0 HB2 LEU A 145 -0.013 -32.835 4.226 1.00 72.14 H new ATOM 0 HB3 LEU A 145 -0.108 -31.089 4.112 1.00 72.14 H new ATOM 0 HG LEU A 145 -2.674 -31.435 4.404 1.00 12.03 H new ATOM 0 HD11 LEU A 145 -3.247 -33.418 5.750 1.00 10.12 H new ATOM 0 HD12 LEU A 145 -2.671 -33.865 4.126 1.00 10.12 H new ATOM 0 HD13 LEU A 145 -1.593 -34.038 5.531 1.00 10.12 H new ATOM 0 HD21 LEU A 145 -2.410 -31.378 6.855 1.00 72.53 H new ATOM 0 HD22 LEU A 145 -0.723 -31.917 6.681 1.00 72.53 H new ATOM 0 HD23 LEU A 145 -1.222 -30.334 6.038 1.00 72.53 H new ATOM 928 N HIS A 146 1.066 -32.277 1.130 1.00 33.21 N ATOM 929 CA HIS A 146 2.182 -31.771 0.338 1.00 1.43 C ATOM 930 C HIS A 146 1.688 -31.178 -0.978 1.00 63.11 C ATOM 931 O HIS A 146 2.342 -30.316 -1.567 1.00 22.21 O ATOM 932 CB HIS A 146 3.187 -32.889 0.061 1.00 72.35 C ATOM 933 CG HIS A 146 2.693 -33.910 -0.918 1.00 0.24 C ATOM 934 ND1 HIS A 146 1.756 -34.868 -0.597 1.00 1.44 N ATOM 935 CD2 HIS A 146 3.012 -34.117 -2.216 1.00 32.41 C ATOM 936 CE1 HIS A 146 1.520 -35.622 -1.656 1.00 40.02 C ATOM 937 NE2 HIS A 146 2.270 -35.186 -2.653 1.00 53.34 N ATOM 0 H HIS A 146 1.058 -33.290 1.248 1.00 33.21 H new ATOM 0 HA HIS A 146 2.674 -30.984 0.910 1.00 1.43 H new ATOM 0 HB2 HIS A 146 4.110 -32.451 -0.318 1.00 72.35 H new ATOM 0 HB3 HIS A 146 3.432 -33.386 0.999 1.00 72.35 H new ATOM 0 HD1 HIS A 146 1.314 -34.978 0.316 1.00 1.44 H new ATOM 0 HD2 HIS A 146 3.719 -33.547 -2.800 1.00 32.41 H new ATOM 0 HE1 HIS A 146 0.832 -36.453 -1.699 1.00 40.02 H new ATOM 945 N LEU A 147 0.531 -31.645 -1.435 1.00 3.03 N ATOM 946 CA LEU A 147 -0.050 -31.161 -2.682 1.00 14.44 C ATOM 947 C LEU A 147 -0.401 -29.679 -2.582 1.00 54.12 C ATOM 948 O LEU A 147 0.099 -28.861 -3.352 1.00 62.14 O ATOM 949 CB LEU A 147 -1.301 -31.970 -3.033 1.00 15.31 C ATOM 950 CG LEU A 147 -1.074 -33.444 -3.370 1.00 63.33 C ATOM 951 CD1 LEU A 147 -2.377 -34.100 -3.798 1.00 5.30 C ATOM 952 CD2 LEU A 147 -0.019 -33.586 -4.458 1.00 24.23 C ATOM 0 H LEU A 147 -0.023 -32.358 -0.961 1.00 3.03 H new ATOM 0 HA LEU A 147 0.691 -31.287 -3.471 1.00 14.44 H new ATOM 0 HB2 LEU A 147 -1.994 -31.912 -2.194 1.00 15.31 H new ATOM 0 HB3 LEU A 147 -1.790 -31.495 -3.883 1.00 15.31 H new ATOM 0 HG LEU A 147 -0.714 -33.951 -2.475 1.00 63.33 H new ATOM 0 HD11 LEU A 147 -2.196 -35.149 -4.034 1.00 5.30 H new ATOM 0 HD12 LEU A 147 -3.103 -34.030 -2.988 1.00 5.30 H new ATOM 0 HD13 LEU A 147 -2.768 -33.592 -4.680 1.00 5.30 H new ATOM 0 HD21 LEU A 147 0.130 -34.642 -4.685 1.00 24.23 H new ATOM 0 HD22 LEU A 147 -0.350 -33.065 -5.356 1.00 24.23 H new ATOM 0 HD23 LEU A 147 0.920 -33.153 -4.113 1.00 24.23 H new ATOM 964 N GLU A 148 -1.262 -29.344 -1.626 1.00 71.13 N ATOM 965 CA GLU A 148 -1.677 -27.961 -1.424 1.00 1.45 C ATOM 966 C GLU A 148 -1.299 -27.478 -0.027 1.00 64.53 C ATOM 967 O GLU A 148 -1.382 -28.229 0.945 1.00 52.44 O ATOM 968 CB GLU A 148 -3.186 -27.823 -1.634 1.00 74.44 C ATOM 969 CG GLU A 148 -4.014 -28.526 -0.571 1.00 61.21 C ATOM 970 CD GLU A 148 -5.506 -28.393 -0.813 1.00 71.04 C ATOM 971 OE1 GLU A 148 -6.010 -29.011 -1.773 1.00 15.42 O ATOM 972 OE2 GLU A 148 -6.170 -27.671 -0.039 1.00 61.21 O1- ATOM 0 H GLU A 148 -1.685 -30.011 -0.980 1.00 71.13 H new ATOM 0 HA GLU A 148 -1.158 -27.342 -2.155 1.00 1.45 H new ATOM 0 HB2 GLU A 148 -3.448 -26.765 -1.646 1.00 74.44 H new ATOM 0 HB3 GLU A 148 -3.447 -28.227 -2.612 1.00 74.44 H new ATOM 0 HG2 GLU A 148 -3.746 -29.582 -0.546 1.00 61.21 H new ATOM 0 HG3 GLU A 148 -3.770 -28.112 0.407 1.00 61.21 H new ATOM 979 N GLY A 149 -0.884 -26.218 0.066 1.00 54.43 N ATOM 980 CA GLY A 149 -0.500 -25.656 1.347 1.00 25.32 C ATOM 981 C GLY A 149 0.980 -25.821 1.632 1.00 34.35 C ATOM 982 O GLY A 149 1.522 -25.182 2.534 1.00 65.23 O ATOM 0 H GLY A 149 -0.807 -25.577 -0.723 1.00 54.43 H new ATOM 0 HA2 GLY A 149 -0.755 -24.596 1.366 1.00 25.32 H new ATOM 0 HA3 GLY A 149 -1.075 -26.137 2.138 1.00 25.32 H new ATOM 986 N LYS A 150 1.636 -26.683 0.863 1.00 70.04 N ATOM 987 CA LYS A 150 3.062 -26.931 1.036 1.00 31.31 C ATOM 988 C LYS A 150 3.852 -25.627 0.989 1.00 54.12 C ATOM 989 O LYS A 150 3.698 -24.831 0.064 1.00 22.52 O ATOM 990 CB LYS A 150 3.571 -27.886 -0.047 1.00 50.15 C ATOM 991 CG LYS A 150 5.062 -28.159 0.033 1.00 10.22 C ATOM 992 CD LYS A 150 5.789 -27.655 -1.202 1.00 65.53 C ATOM 993 CE LYS A 150 5.632 -28.615 -2.371 1.00 15.14 C ATOM 994 NZ LYS A 150 6.520 -29.803 -2.236 1.00 42.30 N1+ ATOM 0 H LYS A 150 1.202 -27.222 0.113 1.00 70.04 H new ATOM 0 HA LYS A 150 3.208 -27.389 2.014 1.00 31.31 H new ATOM 0 HB2 LYS A 150 3.033 -28.831 0.032 1.00 50.15 H new ATOM 0 HB3 LYS A 150 3.339 -27.468 -1.026 1.00 50.15 H new ATOM 0 HG2 LYS A 150 5.474 -27.678 0.920 1.00 10.22 H new ATOM 0 HG3 LYS A 150 5.231 -29.230 0.144 1.00 10.22 H new ATOM 0 HD2 LYS A 150 5.401 -26.675 -1.480 1.00 65.53 H new ATOM 0 HD3 LYS A 150 6.847 -27.526 -0.975 1.00 65.53 H new ATOM 0 HE2 LYS A 150 4.594 -28.943 -2.435 1.00 15.14 H new ATOM 0 HE3 LYS A 150 5.860 -28.095 -3.301 1.00 15.14 H new ATOM 0 HZ1 LYS A 150 7.255 -29.772 -2.971 1.00 42.30 H new ATOM 0 HZ2 LYS A 150 6.968 -29.796 -1.298 1.00 42.30 H new ATOM 0 HZ3 LYS A 150 5.958 -30.671 -2.345 1.00 42.30 H new ATOM 1008 N GLU A 151 4.698 -25.416 1.993 1.00 41.22 N ATOM 1009 CA GLU A 151 5.511 -24.208 2.064 1.00 55.31 C ATOM 1010 C GLU A 151 6.964 -24.508 1.710 1.00 33.43 C ATOM 1011 O GLU A 151 7.702 -25.091 2.507 1.00 74.30 O ATOM 1012 CB GLU A 151 5.433 -23.595 3.464 1.00 5.22 C ATOM 1013 CG GLU A 151 5.738 -24.582 4.578 1.00 51.44 C ATOM 1014 CD GLU A 151 4.570 -24.771 5.527 1.00 14.32 C ATOM 1015 OE1 GLU A 151 4.081 -23.760 6.074 1.00 1.24 O1- ATOM 1016 OE2 GLU A 151 4.146 -25.929 5.722 1.00 24.15 O ATOM 0 H GLU A 151 4.838 -26.065 2.767 1.00 41.22 H new ATOM 0 HA GLU A 151 5.118 -23.494 1.340 1.00 55.31 H new ATOM 0 HB2 GLU A 151 6.133 -22.762 3.526 1.00 5.22 H new ATOM 0 HB3 GLU A 151 4.435 -23.185 3.617 1.00 5.22 H new ATOM 0 HG2 GLU A 151 6.006 -25.544 4.142 1.00 51.44 H new ATOM 0 HG3 GLU A 151 6.605 -24.234 5.140 1.00 51.44 H new ATOM 1023 N LEU A 152 7.370 -24.109 0.510 1.00 4.40 N ATOM 1024 CA LEU A 152 8.735 -24.335 0.048 1.00 14.53 C ATOM 1025 C LEU A 152 9.268 -23.115 -0.696 1.00 1.52 C ATOM 1026 O LEU A 152 8.568 -22.114 -0.846 1.00 22.54 O ATOM 1027 CB LEU A 152 8.789 -25.565 -0.861 1.00 72.43 C ATOM 1028 CG LEU A 152 9.392 -26.828 -0.246 1.00 52.41 C ATOM 1029 CD1 LEU A 152 9.386 -27.968 -1.252 1.00 52.35 C ATOM 1030 CD2 LEU A 152 10.805 -26.558 0.250 1.00 3.13 C ATOM 0 H LEU A 152 6.773 -23.627 -0.162 1.00 4.40 H new ATOM 0 HA LEU A 152 9.364 -24.508 0.921 1.00 14.53 H new ATOM 0 HB2 LEU A 152 7.775 -25.794 -1.190 1.00 72.43 H new ATOM 0 HB3 LEU A 152 9.363 -25.309 -1.752 1.00 72.43 H new ATOM 0 HG LEU A 152 8.779 -27.121 0.607 1.00 52.41 H new ATOM 0 HD11 LEU A 152 9.819 -28.858 -0.796 1.00 52.35 H new ATOM 0 HD12 LEU A 152 8.361 -28.179 -1.557 1.00 52.35 H new ATOM 0 HD13 LEU A 152 9.974 -27.686 -2.125 1.00 52.35 H new ATOM 0 HD21 LEU A 152 11.218 -27.468 0.685 1.00 3.13 H new ATOM 0 HD22 LEU A 152 11.429 -26.239 -0.585 1.00 3.13 H new ATOM 0 HD23 LEU A 152 10.781 -25.773 1.006 1.00 3.13 H new ATOM 1042 N GLU A 153 10.509 -23.207 -1.161 1.00 64.45 N ATOM 1043 CA GLU A 153 11.135 -22.111 -1.890 1.00 72.24 C ATOM 1044 C GLU A 153 11.439 -22.518 -3.329 1.00 52.22 C ATOM 1045 O GLU A 153 11.636 -23.697 -3.625 1.00 74.32 O ATOM 1046 CB GLU A 153 12.423 -21.671 -1.190 1.00 65.41 C ATOM 1047 CG GLU A 153 12.201 -21.143 0.217 1.00 32.34 C ATOM 1048 CD GLU A 153 12.265 -22.235 1.266 1.00 54.31 C ATOM 1049 OE1 GLU A 153 13.387 -22.662 1.609 1.00 31.43 O ATOM 1050 OE2 GLU A 153 11.194 -22.662 1.746 1.00 12.13 O1- ATOM 0 H GLU A 153 11.101 -24.030 -1.046 1.00 64.45 H new ATOM 0 HA GLU A 153 10.436 -21.275 -1.907 1.00 72.24 H new ATOM 0 HB2 GLU A 153 13.110 -22.516 -1.148 1.00 65.41 H new ATOM 0 HB3 GLU A 153 12.905 -20.897 -1.787 1.00 65.41 H new ATOM 0 HG2 GLU A 153 12.953 -20.386 0.440 1.00 32.34 H new ATOM 0 HG3 GLU A 153 11.229 -20.652 0.268 1.00 32.34 H new ATOM 1057 N PHE A 154 11.474 -21.534 -4.222 1.00 71.32 N ATOM 1058 CA PHE A 154 11.752 -21.789 -5.631 1.00 73.31 C ATOM 1059 C PHE A 154 12.903 -20.917 -6.124 1.00 21.25 C ATOM 1060 O PHE A 154 13.450 -20.108 -5.375 1.00 32.42 O ATOM 1061 CB PHE A 154 10.502 -21.529 -6.474 1.00 71.02 C ATOM 1062 CG PHE A 154 9.250 -22.110 -5.885 1.00 21.14 C ATOM 1063 CD1 PHE A 154 8.521 -21.405 -4.940 1.00 72.32 C ATOM 1064 CD2 PHE A 154 8.801 -23.362 -6.274 1.00 33.11 C ATOM 1065 CE1 PHE A 154 7.367 -21.936 -4.396 1.00 33.30 C ATOM 1066 CE2 PHE A 154 7.648 -23.899 -5.733 1.00 3.41 C ATOM 1067 CZ PHE A 154 6.930 -23.185 -4.792 1.00 31.11 C ATOM 0 H PHE A 154 11.313 -20.553 -3.995 1.00 71.32 H new ATOM 0 HA PHE A 154 12.041 -22.835 -5.736 1.00 73.31 H new ATOM 0 HB2 PHE A 154 10.372 -20.453 -6.594 1.00 71.02 H new ATOM 0 HB3 PHE A 154 10.652 -21.945 -7.470 1.00 71.02 H new ATOM 0 HD1 PHE A 154 8.859 -20.429 -4.625 1.00 72.32 H new ATOM 0 HD2 PHE A 154 9.358 -23.925 -7.008 1.00 33.11 H new ATOM 0 HE1 PHE A 154 6.807 -21.375 -3.662 1.00 33.30 H new ATOM 0 HE2 PHE A 154 7.308 -24.876 -6.045 1.00 3.41 H new ATOM 0 HZ PHE A 154 6.029 -23.603 -4.367 1.00 31.11 H new ATOM 1077 N LYS A 155 13.267 -21.089 -7.391 1.00 14.10 N ATOM 1078 CA LYS A 155 14.352 -20.319 -7.987 1.00 52.02 C ATOM 1079 C LYS A 155 13.928 -19.731 -9.330 1.00 34.24 C ATOM 1080 O LYS A 155 12.971 -20.198 -9.948 1.00 74.34 O ATOM 1081 CB LYS A 155 15.589 -21.200 -8.172 1.00 22.41 C ATOM 1082 CG LYS A 155 16.900 -20.445 -8.035 1.00 33.03 C ATOM 1083 CD LYS A 155 18.084 -21.304 -8.447 1.00 61.52 C ATOM 1084 CE LYS A 155 19.311 -20.456 -8.744 1.00 44.24 C ATOM 1085 NZ LYS A 155 20.214 -21.113 -9.728 1.00 21.03 N1+ ATOM 0 H LYS A 155 12.826 -21.755 -8.025 1.00 14.10 H new ATOM 0 HA LYS A 155 14.596 -19.499 -7.311 1.00 52.02 H new ATOM 0 HB2 LYS A 155 15.565 -22.005 -7.437 1.00 22.41 H new ATOM 0 HB3 LYS A 155 15.549 -21.666 -9.157 1.00 22.41 H new ATOM 0 HG2 LYS A 155 16.869 -19.546 -8.651 1.00 33.03 H new ATOM 0 HG3 LYS A 155 17.027 -20.119 -7.003 1.00 33.03 H new ATOM 0 HD2 LYS A 155 18.314 -22.013 -7.652 1.00 61.52 H new ATOM 0 HD3 LYS A 155 17.822 -21.888 -9.329 1.00 61.52 H new ATOM 0 HE2 LYS A 155 18.997 -19.486 -9.130 1.00 44.24 H new ATOM 0 HE3 LYS A 155 19.856 -20.270 -7.819 1.00 44.24 H new ATOM 0 HZ1 LYS A 155 21.078 -20.545 -9.840 1.00 21.03 H new ATOM 0 HZ2 LYS A 155 20.466 -22.063 -9.388 1.00 21.03 H new ATOM 0 HZ3 LYS A 155 19.730 -21.191 -10.645 1.00 21.03 H new ATOM 1099 N VAL A 156 14.647 -18.706 -9.775 1.00 14.23 N ATOM 1100 CA VAL A 156 14.347 -18.057 -11.045 1.00 74.32 C ATOM 1101 C VAL A 156 14.835 -18.897 -12.221 1.00 51.23 C ATOM 1102 O VAL A 156 15.999 -19.298 -12.269 1.00 60.42 O ATOM 1103 CB VAL A 156 14.989 -16.659 -11.127 1.00 20.45 C ATOM 1104 CG1 VAL A 156 16.499 -16.755 -10.974 1.00 14.03 C ATOM 1105 CG2 VAL A 156 14.619 -15.979 -12.436 1.00 31.34 C ATOM 0 H VAL A 156 15.441 -18.307 -9.275 1.00 14.23 H new ATOM 0 HA VAL A 156 13.263 -17.955 -11.099 1.00 74.32 H new ATOM 0 HB VAL A 156 14.603 -16.052 -10.308 1.00 20.45 H new ATOM 0 HG11 VAL A 156 16.935 -15.758 -11.035 1.00 14.03 H new ATOM 0 HG12 VAL A 156 16.739 -17.198 -10.008 1.00 14.03 H new ATOM 0 HG13 VAL A 156 16.906 -17.378 -11.770 1.00 14.03 H new ATOM 0 HG21 VAL A 156 15.081 -14.993 -12.477 1.00 31.34 H new ATOM 0 HG22 VAL A 156 14.975 -16.581 -13.272 1.00 31.34 H new ATOM 0 HG23 VAL A 156 13.536 -15.875 -12.499 1.00 31.34 H new ATOM 1115 N ILE A 157 13.939 -19.160 -13.165 1.00 64.23 N ATOM 1116 CA ILE A 157 14.278 -19.952 -14.341 1.00 1.32 C ATOM 1117 C ILE A 157 13.887 -19.225 -15.624 1.00 51.51 C ATOM 1118 O ILE A 157 14.604 -19.277 -16.624 1.00 50.24 O ATOM 1119 CB ILE A 157 13.588 -21.328 -14.312 1.00 71.04 C ATOM 1120 CG1 ILE A 157 13.929 -22.120 -15.577 1.00 51.24 C ATOM 1121 CG2 ILE A 157 12.082 -21.163 -14.174 1.00 54.14 C ATOM 1122 CD1 ILE A 157 15.411 -22.367 -15.753 1.00 30.43 C ATOM 0 H ILE A 157 12.972 -18.836 -13.139 1.00 64.23 H new ATOM 0 HA ILE A 157 15.358 -20.097 -14.323 1.00 1.32 H new ATOM 0 HB ILE A 157 13.953 -21.883 -13.448 1.00 71.04 H new ATOM 0 HG12 ILE A 157 13.410 -23.078 -15.547 1.00 51.24 H new ATOM 0 HG13 ILE A 157 13.553 -21.581 -16.446 1.00 51.24 H new ATOM 0 HG21 ILE A 157 11.609 -22.145 -14.155 1.00 54.14 H new ATOM 0 HG22 ILE A 157 11.857 -20.634 -13.248 1.00 54.14 H new ATOM 0 HG23 ILE A 157 11.699 -20.592 -15.020 1.00 54.14 H new ATOM 0 HD11 ILE A 157 15.579 -22.933 -16.669 1.00 30.43 H new ATOM 0 HD12 ILE A 157 15.934 -21.413 -15.815 1.00 30.43 H new ATOM 0 HD13 ILE A 157 15.789 -22.933 -14.902 1.00 30.43 H new ATOM 1134 N LYS A 158 12.745 -18.548 -15.588 1.00 11.20 N ATOM 1135 CA LYS A 158 12.258 -17.808 -16.746 1.00 74.04 C ATOM 1136 C LYS A 158 11.000 -17.018 -16.397 1.00 3.31 C ATOM 1137 O LYS A 158 10.072 -17.546 -15.784 1.00 5.10 O ATOM 1138 CB LYS A 158 11.965 -18.766 -17.904 1.00 24.24 C ATOM 1139 CG LYS A 158 11.305 -18.095 -19.096 1.00 25.34 C ATOM 1140 CD LYS A 158 11.470 -18.921 -20.361 1.00 75.32 C ATOM 1141 CE LYS A 158 10.622 -20.183 -20.318 1.00 1.33 C ATOM 1142 NZ LYS A 158 9.167 -19.872 -20.250 1.00 35.23 N1+ ATOM 0 H LYS A 158 12.139 -18.496 -14.769 1.00 11.20 H new ATOM 0 HA LYS A 158 13.035 -17.107 -17.050 1.00 74.04 H new ATOM 0 HB2 LYS A 158 12.898 -19.227 -18.228 1.00 24.24 H new ATOM 0 HB3 LYS A 158 11.320 -19.569 -17.546 1.00 24.24 H new ATOM 0 HG2 LYS A 158 10.244 -17.949 -18.891 1.00 25.34 H new ATOM 0 HG3 LYS A 158 11.740 -17.107 -19.246 1.00 25.34 H new ATOM 0 HD2 LYS A 158 11.189 -18.322 -21.227 1.00 75.32 H new ATOM 0 HD3 LYS A 158 12.519 -19.190 -20.487 1.00 75.32 H new ATOM 0 HE2 LYS A 158 10.823 -20.786 -21.203 1.00 1.33 H new ATOM 0 HE3 LYS A 158 10.906 -20.782 -19.453 1.00 1.33 H new ATOM 0 HZ1 LYS A 158 8.619 -20.712 -20.525 1.00 35.23 H new ATOM 0 HZ2 LYS A 158 8.916 -19.598 -19.279 1.00 35.23 H new ATOM 0 HZ3 LYS A 158 8.949 -19.089 -20.898 1.00 35.23 H new ATOM 1156 N LEU A 159 10.976 -15.749 -16.793 1.00 22.41 N ATOM 1157 CA LEU A 159 9.831 -14.886 -16.523 1.00 43.12 C ATOM 1158 C LEU A 159 9.793 -13.712 -17.496 1.00 63.43 C ATOM 1159 O LEU A 159 10.817 -13.083 -17.765 1.00 65.04 O ATOM 1160 CB LEU A 159 9.884 -14.370 -15.085 1.00 4.42 C ATOM 1161 CG LEU A 159 11.099 -13.514 -14.723 1.00 11.11 C ATOM 1162 CD1 LEU A 159 10.784 -12.037 -14.903 1.00 0.52 C ATOM 1163 CD2 LEU A 159 11.545 -13.796 -13.296 1.00 43.35 C ATOM 0 H LEU A 159 11.735 -15.296 -17.301 1.00 22.41 H new ATOM 0 HA LEU A 159 8.924 -15.475 -16.657 1.00 43.12 H new ATOM 0 HB2 LEU A 159 8.984 -13.785 -14.897 1.00 4.42 H new ATOM 0 HB3 LEU A 159 9.854 -15.227 -14.412 1.00 4.42 H new ATOM 0 HG LEU A 159 11.916 -13.775 -15.396 1.00 11.11 H new ATOM 0 HD11 LEU A 159 11.660 -11.444 -14.641 1.00 0.52 H new ATOM 0 HD12 LEU A 159 10.514 -11.846 -15.942 1.00 0.52 H new ATOM 0 HD13 LEU A 159 9.952 -11.761 -14.256 1.00 0.52 H new ATOM 0 HD21 LEU A 159 12.410 -13.178 -13.056 1.00 43.35 H new ATOM 0 HD22 LEU A 159 10.732 -13.564 -12.608 1.00 43.35 H new ATOM 0 HD23 LEU A 159 11.813 -14.848 -13.200 1.00 43.35 H new ATOM 1175 N ASP A 160 8.607 -13.422 -18.018 1.00 63.41 N ATOM 1176 CA ASP A 160 8.435 -12.320 -18.959 1.00 74.52 C ATOM 1177 C ASP A 160 7.504 -11.256 -18.385 1.00 55.45 C ATOM 1178 O ASP A 160 6.380 -11.555 -17.981 1.00 12.23 O ATOM 1179 CB ASP A 160 7.882 -12.838 -20.287 1.00 1.44 C ATOM 1180 CG ASP A 160 8.185 -11.905 -21.444 1.00 35.14 C ATOM 1181 OD1 ASP A 160 8.454 -10.712 -21.189 1.00 74.23 O1- ATOM 1182 OD2 ASP A 160 8.154 -12.369 -22.602 1.00 20.24 O ATOM 0 H ASP A 160 7.750 -13.934 -17.806 1.00 63.41 H new ATOM 0 HA ASP A 160 9.411 -11.867 -19.133 1.00 74.52 H new ATOM 0 HB2 ASP A 160 8.306 -13.820 -20.495 1.00 1.44 H new ATOM 0 HB3 ASP A 160 6.803 -12.968 -20.202 1.00 1.44 H new ATOM 1187 N GLN A 161 7.979 -10.016 -18.355 1.00 71.33 N ATOM 1188 CA GLN A 161 7.189 -8.908 -17.829 1.00 43.43 C ATOM 1189 C GLN A 161 6.190 -8.410 -18.868 1.00 43.02 C ATOM 1190 O GLN A 161 5.147 -7.854 -18.526 1.00 33.42 O ATOM 1191 CB GLN A 161 8.104 -7.762 -17.394 1.00 3.00 C ATOM 1192 CG GLN A 161 9.066 -7.306 -18.480 1.00 42.43 C ATOM 1193 CD GLN A 161 9.501 -5.864 -18.306 1.00 42.32 C ATOM 1194 OE1 GLN A 161 9.162 -5.216 -17.316 1.00 31.54 O ATOM 1195 NE2 GLN A 161 10.258 -5.354 -19.270 1.00 21.10 N ATOM 0 H GLN A 161 8.906 -9.752 -18.688 1.00 71.33 H new ATOM 0 HA GLN A 161 6.635 -9.270 -16.963 1.00 43.43 H new ATOM 0 HB2 GLN A 161 7.491 -6.916 -17.085 1.00 3.00 H new ATOM 0 HB3 GLN A 161 8.677 -8.076 -16.521 1.00 3.00 H new ATOM 0 HG2 GLN A 161 9.945 -7.950 -18.475 1.00 42.43 H new ATOM 0 HG3 GLN A 161 8.591 -7.423 -19.454 1.00 42.43 H new ATOM 0 HE21 GLN A 161 10.515 -5.927 -20.073 1.00 21.10 H new ATOM 0 HE22 GLN A 161 10.582 -4.389 -19.207 1.00 21.10 H new ATOM 1204 N LYS A 162 6.516 -8.615 -20.141 1.00 74.31 N ATOM 1205 CA LYS A 162 5.647 -8.189 -21.231 1.00 0.03 C ATOM 1206 C LYS A 162 4.421 -9.089 -21.335 1.00 53.11 C ATOM 1207 O LYS A 162 3.306 -8.614 -21.551 1.00 52.53 O ATOM 1208 CB LYS A 162 6.415 -8.200 -22.555 1.00 22.24 C ATOM 1209 CG LYS A 162 7.710 -7.408 -22.515 1.00 53.23 C ATOM 1210 CD LYS A 162 8.574 -7.689 -23.733 1.00 14.41 C ATOM 1211 CE LYS A 162 8.181 -6.810 -24.910 1.00 61.10 C ATOM 1212 NZ LYS A 162 7.121 -7.440 -25.744 1.00 71.30 N1+ ATOM 0 H LYS A 162 7.376 -9.074 -20.442 1.00 74.31 H new ATOM 0 HA LYS A 162 5.312 -7.174 -21.019 1.00 0.03 H new ATOM 0 HB2 LYS A 162 6.638 -9.232 -22.827 1.00 22.24 H new ATOM 0 HB3 LYS A 162 5.776 -7.795 -23.339 1.00 22.24 H new ATOM 0 HG2 LYS A 162 7.485 -6.343 -22.466 1.00 53.23 H new ATOM 0 HG3 LYS A 162 8.263 -7.659 -21.610 1.00 53.23 H new ATOM 0 HD2 LYS A 162 9.622 -7.519 -23.484 1.00 14.41 H new ATOM 0 HD3 LYS A 162 8.479 -8.738 -24.013 1.00 14.41 H new ATOM 0 HE2 LYS A 162 7.828 -5.847 -24.542 1.00 61.10 H new ATOM 0 HE3 LYS A 162 9.059 -6.614 -25.526 1.00 61.10 H new ATOM 0 HZ1 LYS A 162 7.214 -7.115 -26.728 1.00 71.30 H new ATOM 0 HZ2 LYS A 162 7.222 -8.475 -25.710 1.00 71.30 H new ATOM 0 HZ3 LYS A 162 6.185 -7.171 -25.378 1.00 71.30 H new ATOM 1226 N ARG A 163 4.634 -10.392 -21.176 1.00 24.25 N ATOM 1227 CA ARG A 163 3.546 -11.359 -21.251 1.00 62.53 C ATOM 1228 C ARG A 163 2.811 -11.456 -19.917 1.00 54.45 C ATOM 1229 O ARG A 163 1.706 -11.992 -19.843 1.00 65.14 O ATOM 1230 CB ARG A 163 4.083 -12.734 -21.652 1.00 3.31 C ATOM 1231 CG ARG A 163 4.510 -12.821 -23.108 1.00 22.22 C ATOM 1232 CD ARG A 163 3.310 -12.819 -24.041 1.00 13.20 C ATOM 1233 NE ARG A 163 3.701 -12.626 -25.435 1.00 12.45 N ATOM 1234 CZ ARG A 163 2.855 -12.719 -26.455 1.00 22.53 C ATOM 1235 NH1 ARG A 163 1.578 -13.003 -26.239 1.00 24.04 N1+ ATOM 1236 NH2 ARG A 163 3.287 -12.530 -27.696 1.00 20.22 N ATOM 0 H ARG A 163 5.550 -10.802 -20.994 1.00 24.25 H new ATOM 0 HA ARG A 163 2.842 -11.017 -22.009 1.00 62.53 H new ATOM 0 HB2 ARG A 163 4.934 -12.981 -21.017 1.00 3.31 H new ATOM 0 HB3 ARG A 163 3.315 -13.484 -21.462 1.00 3.31 H new ATOM 0 HG2 ARG A 163 5.161 -11.980 -23.348 1.00 22.22 H new ATOM 0 HG3 ARG A 163 5.092 -13.729 -23.264 1.00 22.22 H new ATOM 0 HD2 ARG A 163 2.773 -13.762 -23.942 1.00 13.20 H new ATOM 0 HD3 ARG A 163 2.622 -12.028 -23.745 1.00 13.20 H new ATOM 0 HE ARG A 163 4.677 -12.408 -25.636 1.00 12.45 H new ATOM 0 HH11 ARG A 163 1.242 -13.151 -25.287 1.00 24.04 H new ATOM 0 HH12 ARG A 163 0.931 -13.074 -27.025 1.00 24.04 H new ATOM 0 HH21 ARG A 163 4.269 -12.313 -27.867 1.00 20.22 H new ATOM 0 HH22 ARG A 163 2.637 -12.602 -28.479 1.00 20.22 H new ATOM 1250 N ASN A 164 3.435 -10.934 -18.866 1.00 34.44 N ATOM 1251 CA ASN A 164 2.842 -10.963 -17.534 1.00 31.41 C ATOM 1252 C ASN A 164 2.632 -12.399 -17.063 1.00 13.15 C ATOM 1253 O ASN A 164 1.597 -12.728 -16.486 1.00 31.11 O ATOM 1254 CB ASN A 164 1.508 -10.214 -17.531 1.00 35.43 C ATOM 1255 CG ASN A 164 1.313 -9.385 -16.275 1.00 23.04 C ATOM 1256 OD1 ASN A 164 0.932 -8.216 -16.343 1.00 72.53 O ATOM 1257 ND2 ASN A 164 1.576 -9.988 -15.122 1.00 42.42 N ATOM 0 H ASN A 164 4.350 -10.486 -18.911 1.00 34.44 H new ATOM 0 HA ASN A 164 3.530 -10.471 -16.847 1.00 31.41 H new ATOM 0 HB2 ASN A 164 1.458 -9.563 -18.404 1.00 35.43 H new ATOM 0 HB3 ASN A 164 0.692 -10.931 -17.620 1.00 35.43 H new ATOM 0 HD21 ASN A 164 1.465 -9.481 -14.244 1.00 42.42 H new ATOM 0 HD22 ASN A 164 1.889 -10.959 -15.114 1.00 42.42 H new ATOM 1264 N ASN A 165 3.623 -13.249 -17.313 1.00 24.24 N ATOM 1265 CA ASN A 165 3.547 -14.650 -16.916 1.00 24.21 C ATOM 1266 C ASN A 165 4.903 -15.150 -16.425 1.00 75.13 C ATOM 1267 O ASN A 165 5.943 -14.805 -16.984 1.00 12.32 O ATOM 1268 CB ASN A 165 3.068 -15.509 -18.087 1.00 52.22 C ATOM 1269 CG ASN A 165 3.085 -16.991 -17.763 1.00 64.44 C ATOM 1270 OD1 ASN A 165 2.095 -17.544 -17.285 1.00 33.43 O ATOM 1271 ND2 ASN A 165 4.216 -17.640 -18.020 1.00 51.05 N ATOM 0 H ASN A 165 4.488 -12.992 -17.789 1.00 24.24 H new ATOM 0 HA ASN A 165 2.831 -14.732 -16.098 1.00 24.21 H new ATOM 0 HB2 ASN A 165 2.056 -15.212 -18.362 1.00 52.22 H new ATOM 0 HB3 ASN A 165 3.702 -15.322 -18.954 1.00 52.22 H new ATOM 0 HD21 ASN A 165 4.288 -18.638 -17.821 1.00 51.05 H new ATOM 0 HD22 ASN A 165 5.012 -17.140 -18.417 1.00 51.05 H new ATOM 1278 N VAL A 166 4.882 -15.964 -15.374 1.00 14.54 N ATOM 1279 CA VAL A 166 6.108 -16.513 -14.808 1.00 71.02 C ATOM 1280 C VAL A 166 5.882 -17.920 -14.268 1.00 3.03 C ATOM 1281 O VAL A 166 4.840 -18.213 -13.682 1.00 35.01 O ATOM 1282 CB VAL A 166 6.651 -15.622 -13.675 1.00 45.01 C ATOM 1283 CG1 VAL A 166 5.586 -15.399 -12.612 1.00 21.30 C ATOM 1284 CG2 VAL A 166 7.903 -16.238 -13.067 1.00 20.03 C ATOM 0 H VAL A 166 4.029 -16.258 -14.898 1.00 14.54 H new ATOM 0 HA VAL A 166 6.840 -16.550 -15.615 1.00 71.02 H new ATOM 0 HB VAL A 166 6.918 -14.652 -14.095 1.00 45.01 H new ATOM 0 HG11 VAL A 166 5.989 -14.767 -11.820 1.00 21.30 H new ATOM 0 HG12 VAL A 166 4.721 -14.911 -13.061 1.00 21.30 H new ATOM 0 HG13 VAL A 166 5.284 -16.359 -12.192 1.00 21.30 H new ATOM 0 HG21 VAL A 166 8.273 -15.596 -12.268 1.00 20.03 H new ATOM 0 HG22 VAL A 166 7.664 -17.221 -12.661 1.00 20.03 H new ATOM 0 HG23 VAL A 166 8.669 -16.339 -13.836 1.00 20.03 H new ATOM 1294 N VAL A 167 6.867 -18.791 -14.470 1.00 13.11 N ATOM 1295 CA VAL A 167 6.776 -20.169 -14.003 1.00 13.14 C ATOM 1296 C VAL A 167 8.071 -20.606 -13.327 1.00 22.44 C ATOM 1297 O VAL A 167 9.095 -19.929 -13.426 1.00 43.21 O ATOM 1298 CB VAL A 167 6.463 -21.135 -15.160 1.00 34.31 C ATOM 1299 CG1 VAL A 167 5.183 -20.721 -15.870 1.00 72.33 C ATOM 1300 CG2 VAL A 167 7.629 -21.193 -16.137 1.00 20.40 C ATOM 0 H VAL A 167 7.736 -18.566 -14.954 1.00 13.11 H new ATOM 0 HA VAL A 167 5.961 -20.205 -13.280 1.00 13.14 H new ATOM 0 HB VAL A 167 6.315 -22.133 -14.747 1.00 34.31 H new ATOM 0 HG11 VAL A 167 4.978 -21.415 -16.685 1.00 72.33 H new ATOM 0 HG12 VAL A 167 4.354 -20.736 -15.163 1.00 72.33 H new ATOM 0 HG13 VAL A 167 5.299 -19.714 -16.272 1.00 72.33 H new ATOM 0 HG21 VAL A 167 7.390 -21.881 -16.948 1.00 20.40 H new ATOM 0 HG22 VAL A 167 7.811 -20.199 -16.546 1.00 20.40 H new ATOM 0 HG23 VAL A 167 8.522 -21.541 -15.618 1.00 20.40 H new ATOM 1310 N VAL A 168 8.020 -21.743 -12.639 1.00 51.55 N ATOM 1311 CA VAL A 168 9.189 -22.272 -11.948 1.00 64.01 C ATOM 1312 C VAL A 168 9.554 -23.658 -12.468 1.00 10.40 C ATOM 1313 O VAL A 168 8.686 -24.424 -12.886 1.00 41.54 O ATOM 1314 CB VAL A 168 8.953 -22.350 -10.428 1.00 22.31 C ATOM 1315 CG1 VAL A 168 8.978 -20.960 -9.810 1.00 30.42 C ATOM 1316 CG2 VAL A 168 7.638 -23.053 -10.128 1.00 74.30 C ATOM 0 H VAL A 168 7.181 -22.315 -12.546 1.00 51.55 H new ATOM 0 HA VAL A 168 10.012 -21.586 -12.145 1.00 64.01 H new ATOM 0 HB VAL A 168 9.760 -22.933 -9.983 1.00 22.31 H new ATOM 0 HG11 VAL A 168 8.809 -21.036 -8.736 1.00 30.42 H new ATOM 0 HG12 VAL A 168 9.948 -20.498 -9.993 1.00 30.42 H new ATOM 0 HG13 VAL A 168 8.194 -20.349 -10.258 1.00 30.42 H new ATOM 0 HG21 VAL A 168 7.488 -23.099 -9.049 1.00 74.30 H new ATOM 0 HG22 VAL A 168 6.817 -22.500 -10.585 1.00 74.30 H new ATOM 0 HG23 VAL A 168 7.665 -24.064 -10.534 1.00 74.30 H new ATOM 1326 N SER A 169 10.844 -23.974 -12.437 1.00 61.10 N ATOM 1327 CA SER A 169 11.326 -25.267 -12.908 1.00 42.35 C ATOM 1328 C SER A 169 11.220 -26.319 -11.808 1.00 41.01 C ATOM 1329 O SER A 169 11.222 -25.994 -10.620 1.00 55.21 O ATOM 1330 CB SER A 169 12.776 -25.154 -13.383 1.00 11.22 C ATOM 1331 OG SER A 169 13.407 -24.014 -12.826 1.00 62.55 O ATOM 0 H SER A 169 11.575 -23.352 -12.091 1.00 61.10 H new ATOM 0 HA SER A 169 10.701 -25.577 -13.745 1.00 42.35 H new ATOM 0 HB2 SER A 169 13.326 -26.052 -13.101 1.00 11.22 H new ATOM 0 HB3 SER A 169 12.802 -25.093 -14.471 1.00 11.22 H new ATOM 0 HG SER A 169 14.280 -23.883 -13.251 1.00 62.55 H new ATOM 1337 N ARG A 170 11.130 -27.582 -12.213 1.00 13.32 N ATOM 1338 CA ARG A 170 11.023 -28.682 -11.263 1.00 64.45 C ATOM 1339 C ARG A 170 12.282 -28.788 -10.407 1.00 32.44 C ATOM 1340 O ARG A 170 12.210 -29.069 -9.211 1.00 71.21 O ATOM 1341 CB ARG A 170 10.785 -30.001 -12.003 1.00 3.01 C ATOM 1342 CG ARG A 170 9.632 -29.944 -12.992 1.00 21.22 C ATOM 1343 CD ARG A 170 9.466 -31.265 -13.729 1.00 64.43 C ATOM 1344 NE ARG A 170 8.729 -31.103 -14.979 1.00 33.33 N ATOM 1345 CZ ARG A 170 9.217 -30.480 -16.045 1.00 12.34 C ATOM 1346 NH1 ARG A 170 10.437 -29.961 -16.013 1.00 3.35 N1+ ATOM 1347 NH2 ARG A 170 8.485 -30.374 -17.147 1.00 44.41 N ATOM 0 H ARG A 170 11.129 -27.868 -13.192 1.00 13.32 H new ATOM 0 HA ARG A 170 10.175 -28.481 -10.608 1.00 64.45 H new ATOM 0 HB2 ARG A 170 11.695 -30.279 -12.534 1.00 3.01 H new ATOM 0 HB3 ARG A 170 10.589 -30.787 -11.274 1.00 3.01 H new ATOM 0 HG2 ARG A 170 8.710 -29.702 -12.464 1.00 21.22 H new ATOM 0 HG3 ARG A 170 9.807 -29.144 -13.711 1.00 21.22 H new ATOM 0 HD2 ARG A 170 10.448 -31.689 -13.939 1.00 64.43 H new ATOM 0 HD3 ARG A 170 8.942 -31.975 -13.088 1.00 64.43 H new ATOM 0 HE ARG A 170 7.787 -31.490 -15.036 1.00 33.33 H new ATOM 0 HH11 ARG A 170 11.003 -30.040 -15.168 1.00 3.35 H new ATOM 0 HH12 ARG A 170 10.810 -29.483 -16.833 1.00 3.35 H new ATOM 0 HH21 ARG A 170 7.546 -30.771 -17.176 1.00 44.41 H new ATOM 0 HH22 ARG A 170 8.861 -29.895 -17.965 1.00 44.41 H new ATOM 1361 N ARG A 171 13.434 -28.560 -11.029 1.00 61.43 N ATOM 1362 CA ARG A 171 14.709 -28.630 -10.326 1.00 54.13 C ATOM 1363 C ARG A 171 14.968 -27.348 -9.540 1.00 41.13 C ATOM 1364 O ARG A 171 15.731 -27.343 -8.574 1.00 64.11 O ATOM 1365 CB ARG A 171 15.850 -28.873 -11.315 1.00 13.15 C ATOM 1366 CG ARG A 171 16.056 -30.340 -11.659 1.00 24.35 C ATOM 1367 CD ARG A 171 16.986 -30.507 -12.850 1.00 42.03 C ATOM 1368 NE ARG A 171 18.361 -30.139 -12.528 1.00 64.34 N ATOM 1369 CZ ARG A 171 19.288 -29.880 -13.444 1.00 51.24 C ATOM 1370 NH1 ARG A 171 18.986 -29.947 -14.734 1.00 23.41 N1+ ATOM 1371 NH2 ARG A 171 20.518 -29.550 -13.072 1.00 34.32 N ATOM 0 H ARG A 171 13.510 -28.325 -12.019 1.00 61.43 H new ATOM 0 HA ARG A 171 14.662 -29.463 -9.625 1.00 54.13 H new ATOM 0 HB2 ARG A 171 15.649 -28.318 -12.232 1.00 13.15 H new ATOM 0 HB3 ARG A 171 16.774 -28.473 -10.896 1.00 13.15 H new ATOM 0 HG2 ARG A 171 16.470 -30.862 -10.797 1.00 24.35 H new ATOM 0 HG3 ARG A 171 15.094 -30.802 -11.880 1.00 24.35 H new ATOM 0 HD2 ARG A 171 16.958 -31.543 -13.189 1.00 42.03 H new ATOM 0 HD3 ARG A 171 16.630 -29.892 -13.676 1.00 42.03 H new ATOM 0 HE ARG A 171 18.625 -30.077 -11.545 1.00 64.34 H new ATOM 0 HH11 ARG A 171 18.041 -30.198 -15.024 1.00 23.41 H new ATOM 0 HH12 ARG A 171 19.699 -29.748 -15.436 1.00 23.41 H new ATOM 0 HH21 ARG A 171 20.754 -29.495 -12.081 1.00 34.32 H new ATOM 0 HH22 ARG A 171 21.228 -29.352 -13.777 1.00 34.32 H new ATOM 1385 N ALA A 172 14.327 -26.263 -9.961 1.00 63.40 N ATOM 1386 CA ALA A 172 14.487 -24.975 -9.296 1.00 2.13 C ATOM 1387 C ALA A 172 14.203 -25.089 -7.803 1.00 45.02 C ATOM 1388 O ALA A 172 14.912 -24.512 -6.980 1.00 44.21 O ATOM 1389 CB ALA A 172 13.574 -23.937 -9.932 1.00 62.22 C ATOM 0 H ALA A 172 13.692 -26.250 -10.759 1.00 63.40 H new ATOM 0 HA ALA A 172 15.522 -24.656 -9.418 1.00 2.13 H new ATOM 0 HB1 ALA A 172 13.703 -22.980 -9.426 1.00 62.22 H new ATOM 0 HB2 ALA A 172 13.827 -23.827 -10.987 1.00 62.22 H new ATOM 0 HB3 ALA A 172 12.537 -24.259 -9.839 1.00 62.22 H new ATOM 1395 N VAL A 173 13.160 -25.838 -7.459 1.00 4.21 N ATOM 1396 CA VAL A 173 12.782 -26.029 -6.064 1.00 11.43 C ATOM 1397 C VAL A 173 13.852 -26.809 -5.307 1.00 14.32 C ATOM 1398 O VAL A 173 13.933 -26.738 -4.079 1.00 63.23 O ATOM 1399 CB VAL A 173 11.438 -26.772 -5.942 1.00 61.53 C ATOM 1400 CG1 VAL A 173 11.544 -28.168 -6.538 1.00 60.30 C ATOM 1401 CG2 VAL A 173 10.995 -26.837 -4.488 1.00 52.12 C ATOM 0 H VAL A 173 12.562 -26.323 -8.128 1.00 4.21 H new ATOM 0 HA VAL A 173 12.680 -25.036 -5.625 1.00 11.43 H new ATOM 0 HB VAL A 173 10.685 -26.219 -6.503 1.00 61.53 H new ATOM 0 HG11 VAL A 173 10.585 -28.678 -6.443 1.00 60.30 H new ATOM 0 HG12 VAL A 173 11.813 -28.094 -7.592 1.00 60.30 H new ATOM 0 HG13 VAL A 173 12.310 -28.733 -6.007 1.00 60.30 H new ATOM 0 HG21 VAL A 173 10.044 -27.365 -4.421 1.00 52.12 H new ATOM 0 HG22 VAL A 173 11.746 -27.366 -3.902 1.00 52.12 H new ATOM 0 HG23 VAL A 173 10.877 -25.826 -4.098 1.00 52.12 H new ATOM 1411 N ILE A 174 14.669 -27.551 -6.045 1.00 53.34 N ATOM 1412 CA ILE A 174 15.735 -28.343 -5.443 1.00 61.21 C ATOM 1413 C ILE A 174 16.841 -27.449 -4.893 1.00 61.34 C ATOM 1414 O ILE A 174 17.207 -27.547 -3.722 1.00 73.44 O ATOM 1415 CB ILE A 174 16.344 -29.329 -6.456 1.00 31.14 C ATOM 1416 CG1 ILE A 174 15.238 -30.097 -7.183 1.00 21.44 C ATOM 1417 CG2 ILE A 174 17.291 -30.292 -5.755 1.00 1.52 C ATOM 1418 CD1 ILE A 174 14.493 -31.068 -6.296 1.00 43.50 C ATOM 0 H ILE A 174 14.614 -27.621 -7.061 1.00 53.34 H new ATOM 0 HA ILE A 174 15.286 -28.906 -4.625 1.00 61.21 H new ATOM 0 HB ILE A 174 16.913 -28.763 -7.194 1.00 31.14 H new ATOM 0 HG12 ILE A 174 14.529 -29.385 -7.604 1.00 21.44 H new ATOM 0 HG13 ILE A 174 15.675 -30.643 -8.019 1.00 21.44 H new ATOM 0 HG21 ILE A 174 17.713 -30.983 -6.485 1.00 1.52 H new ATOM 0 HG22 ILE A 174 18.095 -29.730 -5.279 1.00 1.52 H new ATOM 0 HG23 ILE A 174 16.744 -30.854 -4.998 1.00 1.52 H new ATOM 0 HD11 ILE A 174 13.724 -31.576 -6.878 1.00 43.50 H new ATOM 0 HD12 ILE A 174 15.191 -31.803 -5.895 1.00 43.50 H new ATOM 0 HD13 ILE A 174 14.026 -30.525 -5.474 1.00 43.50 H new ATOM 1430 N GLU A 175 17.366 -26.575 -5.745 1.00 41.14 N ATOM 1431 CA GLU A 175 18.430 -25.661 -5.343 1.00 41.22 C ATOM 1432 C GLU A 175 18.010 -24.839 -4.128 1.00 41.13 C ATOM 1433 O GLU A 175 18.759 -24.719 -3.159 1.00 64.54 O ATOM 1434 CB GLU A 175 18.797 -24.730 -6.501 1.00 45.13 C ATOM 1435 CG GLU A 175 19.168 -25.465 -7.778 1.00 52.34 C ATOM 1436 CD GLU A 175 20.007 -24.617 -8.716 1.00 64.43 C ATOM 1437 OE1 GLU A 175 20.488 -23.551 -8.280 1.00 72.13 O ATOM 1438 OE2 GLU A 175 20.182 -25.021 -9.884 1.00 13.32 O1- ATOM 0 H GLU A 175 17.073 -26.480 -6.717 1.00 41.14 H new ATOM 0 HA GLU A 175 19.303 -26.255 -5.074 1.00 41.22 H new ATOM 0 HB2 GLU A 175 17.956 -24.068 -6.704 1.00 45.13 H new ATOM 0 HB3 GLU A 175 19.633 -24.100 -6.198 1.00 45.13 H new ATOM 0 HG2 GLU A 175 19.717 -26.372 -7.525 1.00 52.34 H new ATOM 0 HG3 GLU A 175 18.258 -25.776 -8.291 1.00 52.34 H new ATOM 1445 N SER A 176 16.808 -24.275 -4.189 1.00 33.30 N ATOM 1446 CA SER A 176 16.290 -23.460 -3.097 1.00 74.04 C ATOM 1447 C SER A 176 16.283 -24.247 -1.788 1.00 63.41 C ATOM 1448 O SER A 176 16.640 -23.722 -0.735 1.00 54.23 O ATOM 1449 CB SER A 176 14.876 -22.975 -3.421 1.00 15.31 C ATOM 1450 OG SER A 176 14.877 -22.121 -4.551 1.00 72.12 O ATOM 0 H SER A 176 16.175 -24.368 -4.983 1.00 33.30 H new ATOM 0 HA SER A 176 16.944 -22.596 -2.978 1.00 74.04 H new ATOM 0 HB2 SER A 176 14.228 -23.831 -3.609 1.00 15.31 H new ATOM 0 HB3 SER A 176 14.464 -22.446 -2.562 1.00 15.31 H new ATOM 0 HG SER A 176 14.454 -21.268 -4.317 1.00 72.12 H new ATOM 1456 N GLU A 177 15.872 -25.509 -1.867 1.00 54.35 N ATOM 1457 CA GLU A 177 15.816 -26.368 -0.689 1.00 44.40 C ATOM 1458 C GLU A 177 17.214 -26.610 -0.126 1.00 62.41 C ATOM 1459 O GLU A 177 17.458 -26.416 1.063 1.00 45.33 O ATOM 1460 CB GLU A 177 15.155 -27.703 -1.036 1.00 54.14 C ATOM 1461 CG GLU A 177 13.637 -27.658 -0.999 1.00 45.50 C ATOM 1462 CD GLU A 177 13.018 -29.020 -0.748 1.00 30.24 C ATOM 1463 OE1 GLU A 177 13.127 -29.520 0.391 1.00 54.53 O1- ATOM 1464 OE2 GLU A 177 12.426 -29.584 -1.691 1.00 1.22 O ATOM 0 H GLU A 177 15.573 -25.959 -2.732 1.00 54.35 H new ATOM 0 HA GLU A 177 15.220 -25.863 0.071 1.00 44.40 H new ATOM 0 HB2 GLU A 177 15.477 -28.010 -2.031 1.00 54.14 H new ATOM 0 HB3 GLU A 177 15.505 -28.464 -0.339 1.00 54.14 H new ATOM 0 HG2 GLU A 177 13.317 -26.968 -0.218 1.00 45.50 H new ATOM 0 HG3 GLU A 177 13.266 -27.263 -1.945 1.00 45.50 H new ATOM 1471 N ASN A 178 18.128 -27.036 -0.993 1.00 31.53 N ATOM 1472 CA ASN A 178 19.501 -27.307 -0.583 1.00 54.34 C ATOM 1473 C ASN A 178 20.378 -26.072 -0.769 1.00 61.14 C ATOM 1474 O ASN A 178 21.416 -26.129 -1.427 1.00 23.32 O ATOM 1475 CB ASN A 178 20.073 -28.478 -1.385 1.00 24.22 C ATOM 1476 CG ASN A 178 21.309 -29.073 -0.738 1.00 53.15 C ATOM 1477 OD1 ASN A 178 22.025 -28.395 -0.001 1.00 22.43 O ATOM 1478 ND2 ASN A 178 21.565 -30.347 -1.011 1.00 41.11 N ATOM 0 H ASN A 178 17.943 -27.201 -1.982 1.00 31.53 H new ATOM 0 HA ASN A 178 19.493 -27.569 0.475 1.00 54.34 H new ATOM 0 HB2 ASN A 178 19.312 -29.251 -1.487 1.00 24.22 H new ATOM 0 HB3 ASN A 178 20.320 -28.139 -2.391 1.00 24.22 H new ATOM 0 HD21 ASN A 178 22.383 -30.801 -0.604 1.00 41.11 H new ATOM 0 HD22 ASN A 178 20.944 -30.871 -1.628 1.00 41.11 H new ATOM 1485 N SER A 179 19.953 -24.957 -0.184 1.00 21.43 N ATOM 1486 CA SER A 179 20.697 -23.708 -0.287 1.00 15.51 C ATOM 1487 C SER A 179 22.161 -23.914 0.088 1.00 64.24 C ATOM 1488 O SER A 179 23.052 -23.288 -0.482 1.00 71.22 O ATOM 1489 CB SER A 179 20.073 -22.642 0.616 1.00 21.23 C ATOM 1490 OG SER A 179 19.695 -23.190 1.866 1.00 74.50 O ATOM 0 H SER A 179 19.097 -24.893 0.367 1.00 21.43 H new ATOM 0 HA SER A 179 20.650 -23.371 -1.322 1.00 15.51 H new ATOM 0 HB2 SER A 179 20.784 -21.831 0.771 1.00 21.23 H new ATOM 0 HB3 SER A 179 19.200 -22.211 0.126 1.00 21.23 H new ATOM 0 HG SER A 179 19.301 -22.488 2.425 1.00 74.50 H new TER 1496 SER A 179