USER MOD reduce.3.24.130724 H: found=0, std=0, add=573, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 576 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 133 THR OG1 : rot -89:sc= -0.284 USER MOD Set 1.2: A 172 GLN : amide:sc= -0.385 X(o=-0.67,f=-1) USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 GLN : amide:sc= -0.0005 K(o=-0.0005,f=-0.85) USER MOD Single : A 140 ASN : amide:sc= 0.0941 K(o=0.094,f=-1.3) USER MOD Single : A 144 ASN : amide:sc= -0.248 K(o=-0.25,f=-0.78) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 ASN : amide:sc= -0.0878 X(o=-0.088,f=-0.088) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 THR OG1 : rot -150:sc= -0.585 USER MOD Single : A 152 SER OG : rot -96:sc= 1.22 USER MOD Single : A 154 MET CE :methyl -160:sc= -1.11 (180deg=-2.38!) USER MOD Single : A 155 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 GLN : amide:sc= -0.228 X(o=-0.23,f=-0.54) USER MOD Single : A 163 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0295) USER MOD Single : A 167 TYR OH : rot 60:sc= -1.89 USER MOD Single : A 168 LYS NZ :NH3+ -114:sc= -0.608 (180deg=-0.916) USER MOD Single : A 169 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 170 ASN : amide:sc= 0 X(o=0,f=-0.082) USER MOD Single : A 176 GLN : amide:sc= -0.109 X(o=-0.11,f=-0.4) USER MOD Single : A 180 THR OG1 : rot -45:sc= 1.18 USER MOD Single : A 185 MET CE :methyl -150:sc= -1.9 (180deg=-2.86!) USER MOD Single : A 186 THR OG1 : rot 180:sc= 0 USER MOD Single : A 188 MET CE :methyl -103:sc= -6.77! (180deg=-15.6!) USER MOD Single : A 190 THR OG1 : rot 37:sc= 0.962 USER MOD Single : A 192 MET CE :methyl -135:sc= -0.284 (180deg=-1.88!) USER MOD Single : A 197 ASN : amide:sc= 0 K(o=0,f=-0.61) USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 127 72.162 -4.346 2.781 1.00 0.00 N ATOM 2 CA GLN A 127 72.470 -3.830 4.153 1.00 0.00 C ATOM 3 C GLN A 127 71.723 -2.511 4.409 1.00 0.00 C ATOM 4 O GLN A 127 70.947 -2.421 5.362 1.00 0.00 O ATOM 5 CB GLN A 127 73.984 -3.617 4.303 1.00 0.00 C ATOM 6 CG GLN A 127 74.637 -4.898 4.830 1.00 0.00 C ATOM 7 CD GLN A 127 75.952 -4.567 5.529 1.00 0.00 C ATOM 8 OE1 GLN A 127 76.167 -4.972 6.671 1.00 0.00 O ATOM 9 NE2 GLN A 127 76.847 -3.851 4.907 1.00 0.00 N ATOM 0 HA GLN A 127 72.139 -4.565 4.887 1.00 0.00 H new ATOM 0 HB2 GLN A 127 74.419 -3.345 3.342 1.00 0.00 H new ATOM 0 HB3 GLN A 127 74.179 -2.791 4.987 1.00 0.00 H new ATOM 0 HG2 GLN A 127 73.963 -5.400 5.525 1.00 0.00 H new ATOM 0 HG3 GLN A 127 74.818 -5.589 4.006 1.00 0.00 H new ATOM 0 HE21 GLN A 127 76.665 -3.517 3.960 1.00 0.00 H new ATOM 0 HE22 GLN A 127 77.729 -3.625 5.367 1.00 0.00 H new ATOM 20 N PRO A 128 71.927 -1.499 3.585 1.00 0.00 N ATOM 21 CA PRO A 128 71.367 -0.143 3.869 1.00 0.00 C ATOM 22 C PRO A 128 69.845 -0.109 3.725 1.00 0.00 C ATOM 23 O PRO A 128 69.135 0.256 4.665 1.00 0.00 O ATOM 24 CB PRO A 128 72.042 0.769 2.843 1.00 0.00 C ATOM 25 CG PRO A 128 72.445 -0.118 1.713 1.00 0.00 C ATOM 26 CD PRO A 128 72.628 -1.525 2.284 1.00 0.00 C ATOM 0 HA PRO A 128 71.560 0.168 4.896 1.00 0.00 H new ATOM 0 HB2 PRO A 128 71.360 1.548 2.504 1.00 0.00 H new ATOM 0 HB3 PRO A 128 72.908 1.270 3.275 1.00 0.00 H new ATOM 0 HG2 PRO A 128 71.684 -0.116 0.932 1.00 0.00 H new ATOM 0 HG3 PRO A 128 73.370 0.236 1.258 1.00 0.00 H new ATOM 0 HD2 PRO A 128 72.204 -2.279 1.621 1.00 0.00 H new ATOM 0 HD3 PRO A 128 73.683 -1.767 2.408 1.00 0.00 H new ATOM 34 N ASP A 129 69.352 -0.486 2.547 1.00 0.00 N ATOM 35 CA ASP A 129 67.912 -0.532 2.299 1.00 0.00 C ATOM 36 C ASP A 129 67.340 -1.862 2.806 1.00 0.00 C ATOM 37 O ASP A 129 68.000 -2.566 3.570 1.00 0.00 O ATOM 38 CB ASP A 129 67.652 -0.378 0.792 1.00 0.00 C ATOM 39 CG ASP A 129 68.277 0.916 0.276 1.00 0.00 C ATOM 40 OD1 ASP A 129 68.169 1.920 0.964 1.00 0.00 O ATOM 41 OD2 ASP A 129 68.854 0.885 -0.798 1.00 0.00 O ATOM 0 H ASP A 129 69.926 -0.763 1.751 1.00 0.00 H new ATOM 0 HA ASP A 129 67.421 0.283 2.831 1.00 0.00 H new ATOM 0 HB2 ASP A 129 68.069 -1.230 0.255 1.00 0.00 H new ATOM 0 HB3 ASP A 129 66.579 -0.374 0.600 1.00 0.00 H new ATOM 46 N LEU A 130 66.131 -2.215 2.361 1.00 0.00 N ATOM 47 CA LEU A 130 65.544 -3.520 2.674 1.00 0.00 C ATOM 48 C LEU A 130 64.749 -3.986 1.451 1.00 0.00 C ATOM 49 O LEU A 130 63.723 -3.404 1.125 1.00 0.00 O ATOM 50 CB LEU A 130 64.591 -3.430 3.883 1.00 0.00 C ATOM 51 CG LEU A 130 65.202 -2.609 5.025 1.00 0.00 C ATOM 52 CD1 LEU A 130 64.122 -2.339 6.086 1.00 0.00 C ATOM 53 CD2 LEU A 130 66.351 -3.397 5.665 1.00 0.00 C ATOM 0 H LEU A 130 65.541 -1.616 1.784 1.00 0.00 H new ATOM 0 HA LEU A 130 66.343 -4.219 2.922 1.00 0.00 H new ATOM 0 HB2 LEU A 130 63.650 -2.977 3.572 1.00 0.00 H new ATOM 0 HB3 LEU A 130 64.359 -4.434 4.240 1.00 0.00 H new ATOM 0 HG LEU A 130 65.581 -1.665 4.633 1.00 0.00 H new ATOM 0 HD11 LEU A 130 64.550 -1.755 6.901 1.00 0.00 H new ATOM 0 HD12 LEU A 130 63.300 -1.783 5.635 1.00 0.00 H new ATOM 0 HD13 LEU A 130 63.749 -3.287 6.475 1.00 0.00 H new ATOM 0 HD21 LEU A 130 66.785 -2.813 6.477 1.00 0.00 H new ATOM 0 HD22 LEU A 130 65.971 -4.339 6.059 1.00 0.00 H new ATOM 0 HD23 LEU A 130 67.115 -3.600 4.915 1.00 0.00 H new ATOM 65 N GLY A 131 65.232 -5.011 0.755 1.00 0.00 N ATOM 66 CA GLY A 131 64.662 -5.354 -0.551 1.00 0.00 C ATOM 67 C GLY A 131 65.005 -4.274 -1.578 1.00 0.00 C ATOM 68 O GLY A 131 66.178 -4.111 -1.900 1.00 0.00 O ATOM 0 H GLY A 131 65.999 -5.609 1.061 1.00 0.00 H new ATOM 0 HA2 GLY A 131 65.049 -6.317 -0.883 1.00 0.00 H new ATOM 0 HA3 GLY A 131 63.580 -5.456 -0.468 1.00 0.00 H new ATOM 72 N LEU A 132 63.959 -3.691 -2.214 1.00 0.00 N ATOM 73 CA LEU A 132 64.050 -2.384 -2.926 1.00 0.00 C ATOM 74 C LEU A 132 62.855 -2.175 -3.903 1.00 0.00 C ATOM 75 O LEU A 132 61.756 -2.709 -3.685 1.00 0.00 O ATOM 76 CB LEU A 132 65.417 -2.223 -3.651 1.00 0.00 C ATOM 77 CG LEU A 132 66.429 -1.544 -2.710 1.00 0.00 C ATOM 78 CD1 LEU A 132 67.827 -1.610 -3.322 1.00 0.00 C ATOM 79 CD2 LEU A 132 66.032 -0.076 -2.528 1.00 0.00 C ATOM 0 H LEU A 132 63.029 -4.109 -2.250 1.00 0.00 H new ATOM 0 HA LEU A 132 63.988 -1.600 -2.171 1.00 0.00 H new ATOM 0 HB2 LEU A 132 65.792 -3.198 -3.961 1.00 0.00 H new ATOM 0 HB3 LEU A 132 65.292 -1.628 -4.556 1.00 0.00 H new ATOM 0 HG LEU A 132 66.430 -2.055 -1.747 1.00 0.00 H new ATOM 0 HD11 LEU A 132 68.540 -1.128 -2.653 1.00 0.00 H new ATOM 0 HD12 LEU A 132 68.112 -2.652 -3.467 1.00 0.00 H new ATOM 0 HD13 LEU A 132 67.828 -1.097 -4.284 1.00 0.00 H new ATOM 0 HD21 LEU A 132 66.743 0.413 -1.863 1.00 0.00 H new ATOM 0 HD22 LEU A 132 66.037 0.425 -3.496 1.00 0.00 H new ATOM 0 HD23 LEU A 132 65.033 -0.020 -2.095 1.00 0.00 H new ATOM 91 N THR A 133 63.050 -1.339 -4.942 1.00 0.00 N ATOM 92 CA THR A 133 61.979 -0.974 -5.871 1.00 0.00 C ATOM 93 C THR A 133 61.278 -2.196 -6.435 1.00 0.00 C ATOM 94 O THR A 133 60.074 -2.170 -6.634 1.00 0.00 O ATOM 95 CB THR A 133 62.547 -0.141 -7.019 1.00 0.00 C ATOM 96 OG1 THR A 133 63.600 -0.855 -7.658 1.00 0.00 O ATOM 97 CG2 THR A 133 63.070 1.180 -6.461 1.00 0.00 C ATOM 0 H THR A 133 63.948 -0.905 -5.154 1.00 0.00 H new ATOM 0 HA THR A 133 61.246 -0.392 -5.313 1.00 0.00 H new ATOM 0 HB THR A 133 61.766 0.058 -7.753 1.00 0.00 H new ATOM 0 HG1 THR A 133 64.450 -0.648 -7.217 1.00 0.00 H new ATOM 0 HG21 THR A 133 63.478 1.782 -7.273 1.00 0.00 H new ATOM 0 HG22 THR A 133 62.254 1.721 -5.982 1.00 0.00 H new ATOM 0 HG23 THR A 133 63.852 0.981 -5.729 1.00 0.00 H new ATOM 105 N GLN A 134 62.019 -3.282 -6.633 1.00 0.00 N ATOM 106 CA GLN A 134 61.448 -4.485 -7.243 1.00 0.00 C ATOM 107 C GLN A 134 60.198 -4.947 -6.490 1.00 0.00 C ATOM 108 O GLN A 134 59.176 -5.254 -7.107 1.00 0.00 O ATOM 109 CB GLN A 134 62.486 -5.610 -7.261 1.00 0.00 C ATOM 110 CG GLN A 134 63.637 -5.229 -8.194 1.00 0.00 C ATOM 111 CD GLN A 134 64.703 -6.320 -8.183 1.00 0.00 C ATOM 112 OE1 GLN A 134 64.943 -6.947 -7.150 1.00 0.00 O ATOM 113 NE2 GLN A 134 65.361 -6.586 -9.277 1.00 0.00 N ATOM 0 H GLN A 134 63.005 -3.357 -6.384 1.00 0.00 H new ATOM 0 HA GLN A 134 61.161 -4.239 -8.266 1.00 0.00 H new ATOM 0 HB2 GLN A 134 62.864 -5.787 -6.254 1.00 0.00 H new ATOM 0 HB3 GLN A 134 62.025 -6.539 -7.596 1.00 0.00 H new ATOM 0 HG2 GLN A 134 63.262 -5.086 -9.207 1.00 0.00 H new ATOM 0 HG3 GLN A 134 64.073 -4.281 -7.879 1.00 0.00 H new ATOM 0 HE21 GLN A 134 65.161 -6.066 -10.131 1.00 0.00 H new ATOM 0 HE22 GLN A 134 66.075 -7.314 -9.278 1.00 0.00 H new ATOM 122 N LEU A 135 60.251 -4.900 -5.159 1.00 0.00 N ATOM 123 CA LEU A 135 59.135 -5.381 -4.349 1.00 0.00 C ATOM 124 C LEU A 135 57.864 -4.569 -4.594 1.00 0.00 C ATOM 125 O LEU A 135 56.834 -5.127 -4.978 1.00 0.00 O ATOM 126 CB LEU A 135 59.494 -5.277 -2.874 1.00 0.00 C ATOM 127 CG LEU A 135 60.700 -6.152 -2.562 1.00 0.00 C ATOM 128 CD1 LEU A 135 61.182 -5.835 -1.148 1.00 0.00 C ATOM 129 CD2 LEU A 135 60.293 -7.623 -2.648 1.00 0.00 C ATOM 0 H LEU A 135 61.043 -4.539 -4.626 1.00 0.00 H new ATOM 0 HA LEU A 135 58.947 -6.417 -4.633 1.00 0.00 H new ATOM 0 HB2 LEU A 135 59.712 -4.240 -2.618 1.00 0.00 H new ATOM 0 HB3 LEU A 135 58.645 -5.584 -2.263 1.00 0.00 H new ATOM 0 HG LEU A 135 61.499 -5.958 -3.277 1.00 0.00 H new ATOM 0 HD11 LEU A 135 62.046 -6.455 -0.911 1.00 0.00 H new ATOM 0 HD12 LEU A 135 61.462 -4.783 -1.086 1.00 0.00 H new ATOM 0 HD13 LEU A 135 60.382 -6.040 -0.436 1.00 0.00 H new ATOM 0 HD21 LEU A 135 61.154 -8.253 -2.425 1.00 0.00 H new ATOM 0 HD22 LEU A 135 59.500 -7.824 -1.927 1.00 0.00 H new ATOM 0 HD23 LEU A 135 59.933 -7.843 -3.653 1.00 0.00 H new ATOM 141 N PHE A 136 57.948 -3.247 -4.407 1.00 0.00 N ATOM 142 CA PHE A 136 56.813 -2.376 -4.719 1.00 0.00 C ATOM 143 C PHE A 136 56.627 -2.056 -6.202 1.00 0.00 C ATOM 144 O PHE A 136 55.490 -1.890 -6.647 1.00 0.00 O ATOM 145 CB PHE A 136 56.709 -1.141 -3.808 1.00 0.00 C ATOM 146 CG PHE A 136 57.981 -0.595 -3.220 1.00 0.00 C ATOM 147 CD1 PHE A 136 58.969 0.048 -4.002 1.00 0.00 C ATOM 148 CD2 PHE A 136 58.138 -0.689 -1.821 1.00 0.00 C ATOM 149 CE1 PHE A 136 60.118 0.586 -3.367 1.00 0.00 C ATOM 150 CE2 PHE A 136 59.280 -0.154 -1.194 1.00 0.00 C ATOM 151 CZ PHE A 136 60.272 0.485 -1.966 1.00 0.00 C ATOM 0 H PHE A 136 58.773 -2.766 -4.049 1.00 0.00 H new ATOM 0 HA PHE A 136 55.948 -2.993 -4.475 1.00 0.00 H new ATOM 0 HB2 PHE A 136 56.234 -0.343 -4.379 1.00 0.00 H new ATOM 0 HB3 PHE A 136 56.038 -1.387 -2.985 1.00 0.00 H new ATOM 0 HD1 PHE A 136 58.850 0.129 -5.072 1.00 0.00 H new ATOM 0 HD2 PHE A 136 57.378 -1.174 -1.227 1.00 0.00 H new ATOM 0 HE1 PHE A 136 60.879 1.075 -3.957 1.00 0.00 H new ATOM 0 HE2 PHE A 136 59.396 -0.233 -0.123 1.00 0.00 H new ATOM 0 HZ PHE A 136 61.148 0.897 -1.487 1.00 0.00 H new ATOM 161 N ALA A 137 57.697 -2.073 -6.985 1.00 0.00 N ATOM 162 CA ALA A 137 57.565 -1.837 -8.430 1.00 0.00 C ATOM 163 C ALA A 137 56.657 -2.897 -9.073 1.00 0.00 C ATOM 164 O ALA A 137 56.042 -2.650 -10.112 1.00 0.00 O ATOM 165 CB ALA A 137 58.936 -1.861 -9.109 1.00 0.00 C ATOM 0 H ALA A 137 58.649 -2.243 -6.661 1.00 0.00 H new ATOM 0 HA ALA A 137 57.116 -0.853 -8.567 1.00 0.00 H new ATOM 0 HB1 ALA A 137 58.816 -1.684 -10.178 1.00 0.00 H new ATOM 0 HB2 ALA A 137 59.568 -1.082 -8.681 1.00 0.00 H new ATOM 0 HB3 ALA A 137 59.403 -2.833 -8.952 1.00 0.00 H new ATOM 171 N ASP A 138 56.582 -4.076 -8.443 1.00 0.00 N ATOM 172 CA ASP A 138 55.646 -5.126 -8.866 1.00 0.00 C ATOM 173 C ASP A 138 54.199 -4.598 -8.752 1.00 0.00 C ATOM 174 O ASP A 138 53.928 -3.740 -7.909 1.00 0.00 O ATOM 175 CB ASP A 138 55.820 -6.339 -7.934 1.00 0.00 C ATOM 176 CG ASP A 138 55.522 -7.666 -8.641 1.00 0.00 C ATOM 177 OD1 ASP A 138 55.381 -7.666 -9.849 1.00 0.00 O ATOM 178 OD2 ASP A 138 55.440 -8.668 -7.950 1.00 0.00 O ATOM 0 H ASP A 138 57.158 -4.327 -7.639 1.00 0.00 H new ATOM 0 HA ASP A 138 55.845 -5.413 -9.899 1.00 0.00 H new ATOM 0 HB2 ASP A 138 56.840 -6.356 -7.550 1.00 0.00 H new ATOM 0 HB3 ASP A 138 55.158 -6.232 -7.075 1.00 0.00 H new ATOM 183 N PRO A 139 53.276 -5.072 -9.566 1.00 0.00 N ATOM 184 CA PRO A 139 51.829 -4.706 -9.425 1.00 0.00 C ATOM 185 C PRO A 139 51.236 -5.217 -8.117 1.00 0.00 C ATOM 186 O PRO A 139 51.815 -6.092 -7.472 1.00 0.00 O ATOM 187 CB PRO A 139 51.141 -5.354 -10.632 1.00 0.00 C ATOM 188 CG PRO A 139 52.238 -5.672 -11.585 1.00 0.00 C ATOM 189 CD PRO A 139 53.467 -5.946 -10.734 1.00 0.00 C ATOM 0 HA PRO A 139 51.692 -3.625 -9.400 1.00 0.00 H new ATOM 0 HB2 PRO A 139 50.600 -6.254 -10.340 1.00 0.00 H new ATOM 0 HB3 PRO A 139 50.414 -4.677 -11.081 1.00 0.00 H new ATOM 0 HG2 PRO A 139 51.985 -6.539 -12.196 1.00 0.00 H new ATOM 0 HG3 PRO A 139 52.414 -4.841 -12.268 1.00 0.00 H new ATOM 0 HD2 PRO A 139 53.529 -6.995 -10.445 1.00 0.00 H new ATOM 0 HD3 PRO A 139 54.387 -5.707 -11.268 1.00 0.00 H new ATOM 197 N ASN A 140 50.043 -4.709 -7.779 1.00 0.00 N ATOM 198 CA ASN A 140 49.412 -4.882 -6.446 1.00 0.00 C ATOM 199 C ASN A 140 50.335 -5.464 -5.364 1.00 0.00 C ATOM 200 O ASN A 140 50.250 -6.653 -5.041 1.00 0.00 O ATOM 201 CB ASN A 140 48.181 -5.798 -6.585 1.00 0.00 C ATOM 202 CG ASN A 140 47.320 -5.378 -7.778 1.00 0.00 C ATOM 203 OD1 ASN A 140 47.279 -4.199 -8.132 1.00 0.00 O ATOM 204 ND2 ASN A 140 46.656 -6.283 -8.442 1.00 0.00 N ATOM 0 H ASN A 140 49.476 -4.159 -8.424 1.00 0.00 H new ATOM 0 HA ASN A 140 49.147 -3.878 -6.114 1.00 0.00 H new ATOM 0 HB2 ASN A 140 48.504 -6.831 -6.710 1.00 0.00 H new ATOM 0 HB3 ASN A 140 47.588 -5.758 -5.671 1.00 0.00 H new ATOM 0 HD21 ASN A 140 46.102 -6.015 -9.255 1.00 0.00 H new ATOM 0 HD22 ASN A 140 46.691 -7.259 -8.148 1.00 0.00 H new ATOM 211 N LEU A 141 51.234 -4.642 -4.828 1.00 0.00 N ATOM 212 CA LEU A 141 51.879 -4.981 -3.561 1.00 0.00 C ATOM 213 C LEU A 141 51.375 -4.074 -2.425 1.00 0.00 C ATOM 214 O LEU A 141 51.487 -4.430 -1.252 1.00 0.00 O ATOM 215 CB LEU A 141 53.400 -4.842 -3.706 1.00 0.00 C ATOM 216 CG LEU A 141 54.103 -5.375 -2.450 1.00 0.00 C ATOM 217 CD1 LEU A 141 53.971 -6.903 -2.376 1.00 0.00 C ATOM 218 CD2 LEU A 141 55.582 -4.986 -2.488 1.00 0.00 C ATOM 0 H LEU A 141 51.528 -3.756 -5.239 1.00 0.00 H new ATOM 0 HA LEU A 141 51.628 -6.011 -3.309 1.00 0.00 H new ATOM 0 HB2 LEU A 141 53.741 -5.392 -4.583 1.00 0.00 H new ATOM 0 HB3 LEU A 141 53.664 -3.796 -3.863 1.00 0.00 H new ATOM 0 HG LEU A 141 53.634 -4.938 -1.568 1.00 0.00 H new ATOM 0 HD11 LEU A 141 54.474 -7.269 -1.481 1.00 0.00 H new ATOM 0 HD12 LEU A 141 52.916 -7.176 -2.337 1.00 0.00 H new ATOM 0 HD13 LEU A 141 54.429 -7.351 -3.258 1.00 0.00 H new ATOM 0 HD21 LEU A 141 56.081 -5.365 -1.596 1.00 0.00 H new ATOM 0 HD22 LEU A 141 56.049 -5.416 -3.375 1.00 0.00 H new ATOM 0 HD23 LEU A 141 55.672 -3.900 -2.521 1.00 0.00 H new ATOM 230 N ILE A 142 50.705 -2.967 -2.775 1.00 0.00 N ATOM 231 CA ILE A 142 50.149 -2.079 -1.756 1.00 0.00 C ATOM 232 C ILE A 142 49.027 -2.771 -0.973 1.00 0.00 C ATOM 233 O ILE A 142 48.831 -2.474 0.202 1.00 0.00 O ATOM 234 CB ILE A 142 49.672 -0.746 -2.391 1.00 0.00 C ATOM 235 CG1 ILE A 142 50.900 0.147 -2.670 1.00 0.00 C ATOM 236 CG2 ILE A 142 48.720 0.005 -1.436 1.00 0.00 C ATOM 237 CD1 ILE A 142 50.472 1.413 -3.430 1.00 0.00 C ATOM 0 H ILE A 142 50.539 -2.673 -3.737 1.00 0.00 H new ATOM 0 HA ILE A 142 50.938 -1.840 -1.043 1.00 0.00 H new ATOM 0 HB ILE A 142 49.141 -0.971 -3.316 1.00 0.00 H new ATOM 0 HG12 ILE A 142 51.380 0.422 -1.731 1.00 0.00 H new ATOM 0 HG13 ILE A 142 51.636 -0.406 -3.254 1.00 0.00 H new ATOM 0 HG21 ILE A 142 48.398 0.937 -1.901 1.00 0.00 H new ATOM 0 HG22 ILE A 142 47.849 -0.616 -1.227 1.00 0.00 H new ATOM 0 HG23 ILE A 142 49.240 0.226 -0.504 1.00 0.00 H new ATOM 0 HD11 ILE A 142 51.346 2.035 -3.621 1.00 0.00 H new ATOM 0 HD12 ILE A 142 50.013 1.131 -4.377 1.00 0.00 H new ATOM 0 HD13 ILE A 142 49.753 1.972 -2.831 1.00 0.00 H new ATOM 249 N GLU A 143 48.313 -3.716 -1.594 1.00 0.00 N ATOM 250 CA GLU A 143 47.153 -4.323 -0.930 1.00 0.00 C ATOM 251 C GLU A 143 47.579 -5.100 0.317 1.00 0.00 C ATOM 252 O GLU A 143 47.082 -4.857 1.416 1.00 0.00 O ATOM 253 CB GLU A 143 46.456 -5.284 -1.894 1.00 0.00 C ATOM 254 CG GLU A 143 45.774 -4.483 -3.004 1.00 0.00 C ATOM 255 CD GLU A 143 44.999 -5.414 -3.933 1.00 0.00 C ATOM 256 OE1 GLU A 143 45.465 -6.520 -4.163 1.00 0.00 O ATOM 257 OE2 GLU A 143 43.947 -5.009 -4.400 1.00 0.00 O ATOM 0 H GLU A 143 48.509 -4.070 -2.530 1.00 0.00 H new ATOM 0 HA GLU A 143 46.475 -3.523 -0.634 1.00 0.00 H new ATOM 0 HB2 GLU A 143 47.181 -5.976 -2.322 1.00 0.00 H new ATOM 0 HB3 GLU A 143 45.720 -5.884 -1.358 1.00 0.00 H new ATOM 0 HG2 GLU A 143 45.097 -3.748 -2.568 1.00 0.00 H new ATOM 0 HG3 GLU A 143 46.521 -3.930 -3.573 1.00 0.00 H new ATOM 264 N ASN A 144 48.595 -5.945 0.167 1.00 0.00 N ATOM 265 CA ASN A 144 49.206 -6.621 1.317 1.00 0.00 C ATOM 266 C ASN A 144 49.685 -5.593 2.345 1.00 0.00 C ATOM 267 O ASN A 144 49.539 -5.778 3.553 1.00 0.00 O ATOM 268 CB ASN A 144 50.398 -7.455 0.835 1.00 0.00 C ATOM 269 CG ASN A 144 49.958 -8.442 -0.246 1.00 0.00 C ATOM 270 OD1 ASN A 144 48.814 -8.900 -0.244 1.00 0.00 O ATOM 271 ND2 ASN A 144 50.786 -8.756 -1.205 1.00 0.00 N ATOM 0 H ASN A 144 49.014 -6.180 -0.733 1.00 0.00 H new ATOM 0 HA ASN A 144 48.465 -7.268 1.786 1.00 0.00 H new ATOM 0 HB2 ASN A 144 51.174 -6.798 0.442 1.00 0.00 H new ATOM 0 HB3 ASN A 144 50.834 -7.996 1.675 1.00 0.00 H new ATOM 0 HD21 ASN A 144 50.486 -9.381 -1.953 1.00 0.00 H new ATOM 0 HD22 ASN A 144 51.733 -8.376 -1.206 1.00 0.00 H new ATOM 278 N LEU A 145 50.255 -4.514 1.829 1.00 0.00 N ATOM 279 CA LEU A 145 50.715 -3.403 2.656 1.00 0.00 C ATOM 280 C LEU A 145 49.560 -2.707 3.382 1.00 0.00 C ATOM 281 O LEU A 145 49.784 -2.011 4.370 1.00 0.00 O ATOM 282 CB LEU A 145 51.507 -2.415 1.795 1.00 0.00 C ATOM 283 CG LEU A 145 52.714 -3.148 1.197 1.00 0.00 C ATOM 284 CD1 LEU A 145 53.383 -2.268 0.138 1.00 0.00 C ATOM 285 CD2 LEU A 145 53.720 -3.472 2.311 1.00 0.00 C ATOM 0 H LEU A 145 50.412 -4.382 0.830 1.00 0.00 H new ATOM 0 HA LEU A 145 51.368 -3.803 3.431 1.00 0.00 H new ATOM 0 HB2 LEU A 145 50.876 -2.014 1.002 1.00 0.00 H new ATOM 0 HB3 LEU A 145 51.838 -1.569 2.397 1.00 0.00 H new ATOM 0 HG LEU A 145 52.378 -4.074 0.731 1.00 0.00 H new ATOM 0 HD11 LEU A 145 54.240 -2.794 -0.283 1.00 0.00 H new ATOM 0 HD12 LEU A 145 52.668 -2.045 -0.654 1.00 0.00 H new ATOM 0 HD13 LEU A 145 53.718 -1.338 0.597 1.00 0.00 H new ATOM 0 HD21 LEU A 145 54.578 -3.993 1.886 1.00 0.00 H new ATOM 0 HD22 LEU A 145 54.053 -2.547 2.781 1.00 0.00 H new ATOM 0 HD23 LEU A 145 53.244 -4.107 3.058 1.00 0.00 H new ATOM 297 N LYS A 146 48.348 -2.781 2.827 1.00 0.00 N ATOM 298 CA LYS A 146 47.179 -2.221 3.509 1.00 0.00 C ATOM 299 C LYS A 146 46.921 -2.935 4.842 1.00 0.00 C ATOM 300 O LYS A 146 46.718 -2.290 5.871 1.00 0.00 O ATOM 301 CB LYS A 146 45.925 -2.338 2.633 1.00 0.00 C ATOM 302 CG LYS A 146 46.019 -1.358 1.463 1.00 0.00 C ATOM 303 CD LYS A 146 44.795 -1.523 0.558 1.00 0.00 C ATOM 304 CE LYS A 146 43.562 -0.944 1.255 1.00 0.00 C ATOM 305 NZ LYS A 146 42.367 -1.127 0.381 1.00 0.00 N ATOM 0 H LYS A 146 48.152 -3.214 1.925 1.00 0.00 H new ATOM 0 HA LYS A 146 47.392 -1.169 3.700 1.00 0.00 H new ATOM 0 HB2 LYS A 146 45.825 -3.357 2.259 1.00 0.00 H new ATOM 0 HB3 LYS A 146 45.035 -2.127 3.226 1.00 0.00 H new ATOM 0 HG2 LYS A 146 46.074 -0.335 1.835 1.00 0.00 H new ATOM 0 HG3 LYS A 146 46.931 -1.540 0.895 1.00 0.00 H new ATOM 0 HD2 LYS A 146 44.961 -1.015 -0.392 1.00 0.00 H new ATOM 0 HD3 LYS A 146 44.636 -2.577 0.332 1.00 0.00 H new ATOM 0 HE2 LYS A 146 43.405 -1.440 2.213 1.00 0.00 H new ATOM 0 HE3 LYS A 146 43.713 0.115 1.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 41.528 -0.734 0.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 42.519 -0.634 -0.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 42.220 -2.141 0.202 1.00 0.00 H new ATOM 319 N LYS A 147 46.889 -4.271 4.808 1.00 0.00 N ATOM 320 CA LYS A 147 46.331 -5.025 5.937 1.00 0.00 C ATOM 321 C LYS A 147 47.316 -5.270 7.096 1.00 0.00 C ATOM 322 O LYS A 147 46.944 -5.069 8.255 1.00 0.00 O ATOM 323 CB LYS A 147 45.814 -6.374 5.435 1.00 0.00 C ATOM 324 CG LYS A 147 44.637 -6.149 4.483 1.00 0.00 C ATOM 325 CD LYS A 147 44.045 -7.499 4.075 1.00 0.00 C ATOM 326 CE LYS A 147 42.944 -7.281 3.035 1.00 0.00 C ATOM 327 NZ LYS A 147 42.697 -8.552 2.297 1.00 0.00 N ATOM 0 H LYS A 147 47.232 -4.841 4.035 1.00 0.00 H new ATOM 0 HA LYS A 147 45.531 -4.406 6.342 1.00 0.00 H new ATOM 0 HB2 LYS A 147 46.611 -6.913 4.923 1.00 0.00 H new ATOM 0 HB3 LYS A 147 45.501 -6.991 6.277 1.00 0.00 H new ATOM 0 HG2 LYS A 147 43.876 -5.538 4.967 1.00 0.00 H new ATOM 0 HG3 LYS A 147 44.969 -5.604 3.600 1.00 0.00 H new ATOM 0 HD2 LYS A 147 44.825 -8.141 3.665 1.00 0.00 H new ATOM 0 HD3 LYS A 147 43.639 -8.009 4.949 1.00 0.00 H new ATOM 0 HE2 LYS A 147 42.028 -6.948 3.524 1.00 0.00 H new ATOM 0 HE3 LYS A 147 43.237 -6.495 2.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 41.949 -8.403 1.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 43.571 -8.851 1.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 42.399 -9.290 2.967 1.00 0.00 H new ATOM 341 N ASN A 148 48.560 -5.687 6.809 1.00 0.00 N ATOM 342 CA ASN A 148 49.417 -6.194 7.901 1.00 0.00 C ATOM 343 C ASN A 148 50.470 -5.197 8.431 1.00 0.00 C ATOM 344 O ASN A 148 50.972 -5.392 9.540 1.00 0.00 O ATOM 345 CB ASN A 148 50.144 -7.449 7.399 1.00 0.00 C ATOM 346 CG ASN A 148 50.846 -8.165 8.551 1.00 0.00 C ATOM 347 OD1 ASN A 148 50.203 -8.870 9.329 1.00 0.00 O ATOM 348 ND2 ASN A 148 52.133 -8.021 8.706 1.00 0.00 N ATOM 0 H ASN A 148 48.982 -5.687 5.880 1.00 0.00 H new ATOM 0 HA ASN A 148 48.749 -6.392 8.739 1.00 0.00 H new ATOM 0 HB2 ASN A 148 49.430 -8.124 6.926 1.00 0.00 H new ATOM 0 HB3 ASN A 148 50.874 -7.172 6.638 1.00 0.00 H new ATOM 0 HD21 ASN A 148 52.610 -8.493 9.474 1.00 0.00 H new ATOM 0 HD22 ASN A 148 52.662 -7.436 8.059 1.00 0.00 H new ATOM 355 N PRO A 149 50.818 -4.160 7.705 1.00 0.00 N ATOM 356 CA PRO A 149 51.824 -3.178 8.199 1.00 0.00 C ATOM 357 C PRO A 149 51.219 -1.826 8.564 1.00 0.00 C ATOM 358 O PRO A 149 50.263 -1.370 7.937 1.00 0.00 O ATOM 359 CB PRO A 149 52.781 -3.048 7.021 1.00 0.00 C ATOM 360 CG PRO A 149 51.947 -3.287 5.805 1.00 0.00 C ATOM 361 CD PRO A 149 50.657 -3.996 6.256 1.00 0.00 C ATOM 0 HA PRO A 149 52.297 -3.512 9.123 1.00 0.00 H new ATOM 0 HB2 PRO A 149 53.240 -2.060 6.995 1.00 0.00 H new ATOM 0 HB3 PRO A 149 53.591 -3.774 7.091 1.00 0.00 H new ATOM 0 HG2 PRO A 149 51.713 -2.344 5.310 1.00 0.00 H new ATOM 0 HG3 PRO A 149 52.488 -3.900 5.084 1.00 0.00 H new ATOM 0 HD2 PRO A 149 49.774 -3.403 6.019 1.00 0.00 H new ATOM 0 HD3 PRO A 149 50.538 -4.958 5.758 1.00 0.00 H new ATOM 369 N LYS A 150 51.839 -1.155 9.539 1.00 0.00 N ATOM 370 CA LYS A 150 51.437 0.210 9.914 1.00 0.00 C ATOM 371 C LYS A 150 51.532 1.162 8.711 1.00 0.00 C ATOM 372 O LYS A 150 50.880 2.205 8.684 1.00 0.00 O ATOM 373 CB LYS A 150 52.335 0.751 11.036 1.00 0.00 C ATOM 374 CG LYS A 150 52.451 -0.271 12.172 1.00 0.00 C ATOM 375 CD LYS A 150 53.135 0.381 13.375 1.00 0.00 C ATOM 376 CE LYS A 150 53.376 -0.672 14.457 1.00 0.00 C ATOM 377 NZ LYS A 150 52.108 -0.925 15.197 1.00 0.00 N ATOM 0 H LYS A 150 52.617 -1.529 10.082 1.00 0.00 H new ATOM 0 HA LYS A 150 50.404 0.160 10.259 1.00 0.00 H new ATOM 0 HB2 LYS A 150 53.325 0.977 10.640 1.00 0.00 H new ATOM 0 HB3 LYS A 150 51.924 1.685 11.420 1.00 0.00 H new ATOM 0 HG2 LYS A 150 51.462 -0.632 12.454 1.00 0.00 H new ATOM 0 HG3 LYS A 150 53.023 -1.137 11.840 1.00 0.00 H new ATOM 0 HD2 LYS A 150 54.081 0.828 13.071 1.00 0.00 H new ATOM 0 HD3 LYS A 150 52.514 1.186 13.768 1.00 0.00 H new ATOM 0 HE2 LYS A 150 53.736 -1.596 14.006 1.00 0.00 H new ATOM 0 HE3 LYS A 150 54.149 -0.331 15.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 52.272 -1.641 15.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 51.782 -0.042 15.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 51.383 -1.268 14.536 1.00 0.00 H new ATOM 391 N THR A 151 52.309 0.769 7.700 1.00 0.00 N ATOM 392 CA THR A 151 52.536 1.604 6.520 1.00 0.00 C ATOM 393 C THR A 151 51.214 1.934 5.798 1.00 0.00 C ATOM 394 O THR A 151 51.103 2.941 5.082 1.00 0.00 O ATOM 395 CB THR A 151 53.477 0.859 5.565 1.00 0.00 C ATOM 396 OG1 THR A 151 52.844 -0.330 5.115 1.00 0.00 O ATOM 397 CG2 THR A 151 54.784 0.499 6.283 1.00 0.00 C ATOM 0 H THR A 151 52.794 -0.128 7.676 1.00 0.00 H new ATOM 0 HA THR A 151 52.982 2.546 6.838 1.00 0.00 H new ATOM 0 HB THR A 151 53.705 1.503 4.715 1.00 0.00 H new ATOM 0 HG1 THR A 151 53.523 -1.011 4.928 1.00 0.00 H new ATOM 0 HG21 THR A 151 55.444 -0.029 5.595 1.00 0.00 H new ATOM 0 HG22 THR A 151 55.273 1.410 6.627 1.00 0.00 H new ATOM 0 HG23 THR A 151 54.565 -0.140 7.138 1.00 0.00 H new ATOM 405 N SER A 152 50.182 1.133 6.058 1.00 0.00 N ATOM 406 CA SER A 152 48.894 1.311 5.391 1.00 0.00 C ATOM 407 C SER A 152 48.253 2.664 5.703 1.00 0.00 C ATOM 408 O SER A 152 47.347 3.102 4.986 1.00 0.00 O ATOM 409 CB SER A 152 47.953 0.198 5.828 1.00 0.00 C ATOM 410 OG SER A 152 48.129 -0.051 7.214 1.00 0.00 O ATOM 0 H SER A 152 50.212 0.359 6.722 1.00 0.00 H new ATOM 0 HA SER A 152 49.071 1.275 4.316 1.00 0.00 H new ATOM 0 HB2 SER A 152 46.920 0.480 5.626 1.00 0.00 H new ATOM 0 HB3 SER A 152 48.153 -0.708 5.256 1.00 0.00 H new ATOM 0 HG SER A 152 48.754 -0.796 7.336 1.00 0.00 H new ATOM 416 N GLU A 153 48.752 3.360 6.729 1.00 0.00 N ATOM 417 CA GLU A 153 48.243 4.690 7.045 1.00 0.00 C ATOM 418 C GLU A 153 48.365 5.608 5.829 1.00 0.00 C ATOM 419 O GLU A 153 47.363 6.151 5.350 1.00 0.00 O ATOM 420 CB GLU A 153 49.021 5.277 8.224 1.00 0.00 C ATOM 421 CG GLU A 153 48.577 4.592 9.519 1.00 0.00 C ATOM 422 CD GLU A 153 49.181 5.302 10.729 1.00 0.00 C ATOM 423 OE1 GLU A 153 50.330 5.707 10.649 1.00 0.00 O ATOM 424 OE2 GLU A 153 48.484 5.429 11.722 1.00 0.00 O ATOM 0 H GLU A 153 49.495 3.028 7.344 1.00 0.00 H new ATOM 0 HA GLU A 153 47.190 4.609 7.316 1.00 0.00 H new ATOM 0 HB2 GLU A 153 50.091 5.136 8.074 1.00 0.00 H new ATOM 0 HB3 GLU A 153 48.847 6.351 8.290 1.00 0.00 H new ATOM 0 HG2 GLU A 153 47.489 4.602 9.589 1.00 0.00 H new ATOM 0 HG3 GLU A 153 48.887 3.547 9.510 1.00 0.00 H new ATOM 431 N MET A 154 49.546 5.605 5.205 1.00 0.00 N ATOM 432 CA MET A 154 49.793 6.518 4.093 1.00 0.00 C ATOM 433 C MET A 154 48.912 6.165 2.907 1.00 0.00 C ATOM 434 O MET A 154 48.611 7.028 2.081 1.00 0.00 O ATOM 435 CB MET A 154 51.242 6.473 3.624 1.00 0.00 C ATOM 436 CG MET A 154 52.175 6.893 4.756 1.00 0.00 C ATOM 437 SD MET A 154 53.865 7.049 4.117 1.00 0.00 S ATOM 438 CE MET A 154 54.044 5.359 3.490 1.00 0.00 C ATOM 0 H MET A 154 50.327 4.995 5.445 1.00 0.00 H new ATOM 0 HA MET A 154 49.566 7.518 4.461 1.00 0.00 H new ATOM 0 HB2 MET A 154 51.493 5.466 3.291 1.00 0.00 H new ATOM 0 HB3 MET A 154 51.376 7.135 2.768 1.00 0.00 H new ATOM 0 HG2 MET A 154 51.846 7.842 5.180 1.00 0.00 H new ATOM 0 HG3 MET A 154 52.145 6.157 5.559 1.00 0.00 H new ATOM 0 HE1 MET A 154 55.102 5.123 3.377 1.00 0.00 H new ATOM 0 HE2 MET A 154 53.589 4.660 4.192 1.00 0.00 H new ATOM 0 HE3 MET A 154 53.549 5.275 2.523 1.00 0.00 H new ATOM 448 N MET A 155 48.561 4.881 2.762 1.00 0.00 N ATOM 449 CA MET A 155 47.790 4.448 1.598 1.00 0.00 C ATOM 450 C MET A 155 46.377 5.039 1.616 1.00 0.00 C ATOM 451 O MET A 155 45.857 5.447 0.577 1.00 0.00 O ATOM 452 CB MET A 155 47.692 2.918 1.574 1.00 0.00 C ATOM 453 CG MET A 155 49.098 2.302 1.561 1.00 0.00 C ATOM 454 SD MET A 155 49.916 2.663 -0.016 1.00 0.00 S ATOM 455 CE MET A 155 51.599 2.240 0.500 1.00 0.00 C ATOM 0 H MET A 155 48.794 4.140 3.423 1.00 0.00 H new ATOM 0 HA MET A 155 48.306 4.803 0.706 1.00 0.00 H new ATOM 0 HB2 MET A 155 47.140 2.567 2.446 1.00 0.00 H new ATOM 0 HB3 MET A 155 47.136 2.595 0.694 1.00 0.00 H new ATOM 0 HG2 MET A 155 49.687 2.702 2.386 1.00 0.00 H new ATOM 0 HG3 MET A 155 49.033 1.224 1.709 1.00 0.00 H new ATOM 0 HE1 MET A 155 52.284 2.391 -0.334 1.00 0.00 H new ATOM 0 HE2 MET A 155 51.895 2.877 1.333 1.00 0.00 H new ATOM 0 HE3 MET A 155 51.632 1.196 0.812 1.00 0.00 H new ATOM 465 N LYS A 156 45.762 5.076 2.800 1.00 0.00 N ATOM 466 CA LYS A 156 44.331 5.362 2.894 1.00 0.00 C ATOM 467 C LYS A 156 44.037 6.864 2.979 1.00 0.00 C ATOM 468 O LYS A 156 42.905 7.287 2.737 1.00 0.00 O ATOM 469 CB LYS A 156 43.770 4.677 4.138 1.00 0.00 C ATOM 470 CG LYS A 156 43.804 3.158 3.945 1.00 0.00 C ATOM 471 CD LYS A 156 43.140 2.477 5.143 1.00 0.00 C ATOM 472 CE LYS A 156 43.276 0.958 5.007 1.00 0.00 C ATOM 473 NZ LYS A 156 42.459 0.290 6.058 1.00 0.00 N ATOM 0 H LYS A 156 46.225 4.914 3.694 1.00 0.00 H new ATOM 0 HA LYS A 156 43.859 4.984 1.987 1.00 0.00 H new ATOM 0 HB2 LYS A 156 44.355 4.956 5.014 1.00 0.00 H new ATOM 0 HB3 LYS A 156 42.747 5.008 4.319 1.00 0.00 H new ATOM 0 HG2 LYS A 156 43.286 2.886 3.025 1.00 0.00 H new ATOM 0 HG3 LYS A 156 44.834 2.816 3.844 1.00 0.00 H new ATOM 0 HD2 LYS A 156 43.605 2.813 6.070 1.00 0.00 H new ATOM 0 HD3 LYS A 156 42.087 2.755 5.196 1.00 0.00 H new ATOM 0 HE2 LYS A 156 42.946 0.640 4.018 1.00 0.00 H new ATOM 0 HE3 LYS A 156 44.322 0.666 5.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 42.551 -0.742 5.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 42.794 0.585 6.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 41.461 0.560 5.946 1.00 0.00 H new ATOM 487 N ASP A 157 45.052 7.664 3.322 1.00 0.00 N ATOM 488 CA ASP A 157 44.866 9.117 3.388 1.00 0.00 C ATOM 489 C ASP A 157 45.741 9.857 2.360 1.00 0.00 C ATOM 490 O ASP A 157 45.244 10.258 1.306 1.00 0.00 O ATOM 491 CB ASP A 157 45.143 9.618 4.815 1.00 0.00 C ATOM 492 CG ASP A 157 43.835 9.788 5.585 1.00 0.00 C ATOM 493 OD1 ASP A 157 43.354 8.805 6.122 1.00 0.00 O ATOM 494 OD2 ASP A 157 43.335 10.900 5.624 1.00 0.00 O ATOM 0 H ASP A 157 45.991 7.340 3.554 1.00 0.00 H new ATOM 0 HA ASP A 157 43.829 9.335 3.133 1.00 0.00 H new ATOM 0 HB2 ASP A 157 45.789 8.912 5.336 1.00 0.00 H new ATOM 0 HB3 ASP A 157 45.675 10.568 4.776 1.00 0.00 H new ATOM 499 N PRO A 158 47.015 10.039 2.625 1.00 0.00 N ATOM 500 CA PRO A 158 47.828 11.089 1.928 1.00 0.00 C ATOM 501 C PRO A 158 47.994 10.856 0.424 1.00 0.00 C ATOM 502 O PRO A 158 48.014 9.722 -0.054 1.00 0.00 O ATOM 503 CB PRO A 158 49.189 11.044 2.633 1.00 0.00 C ATOM 504 CG PRO A 158 49.261 9.695 3.252 1.00 0.00 C ATOM 505 CD PRO A 158 47.830 9.339 3.636 1.00 0.00 C ATOM 0 HA PRO A 158 47.330 12.056 1.992 1.00 0.00 H new ATOM 0 HB2 PRO A 158 50.004 11.197 1.926 1.00 0.00 H new ATOM 0 HB3 PRO A 158 49.269 11.828 3.386 1.00 0.00 H new ATOM 0 HG2 PRO A 158 49.672 8.966 2.554 1.00 0.00 H new ATOM 0 HG3 PRO A 158 49.911 9.700 4.127 1.00 0.00 H new ATOM 0 HD2 PRO A 158 47.664 8.262 3.609 1.00 0.00 H new ATOM 0 HD3 PRO A 158 47.591 9.673 4.645 1.00 0.00 H new ATOM 513 N GLN A 159 48.260 11.954 -0.288 1.00 0.00 N ATOM 514 CA GLN A 159 48.553 11.910 -1.726 1.00 0.00 C ATOM 515 C GLN A 159 49.793 11.053 -2.028 1.00 0.00 C ATOM 516 O GLN A 159 49.989 10.612 -3.165 1.00 0.00 O ATOM 517 CB GLN A 159 48.773 13.324 -2.261 1.00 0.00 C ATOM 518 CG GLN A 159 47.421 14.004 -2.497 1.00 0.00 C ATOM 519 CD GLN A 159 46.708 13.359 -3.683 1.00 0.00 C ATOM 520 OE1 GLN A 159 47.309 13.169 -4.741 1.00 0.00 O ATOM 521 NE2 GLN A 159 45.455 13.011 -3.569 1.00 0.00 N ATOM 0 H GLN A 159 48.279 12.893 0.111 1.00 0.00 H new ATOM 0 HA GLN A 159 47.695 11.455 -2.221 1.00 0.00 H new ATOM 0 HB2 GLN A 159 49.363 13.904 -1.551 1.00 0.00 H new ATOM 0 HB3 GLN A 159 49.339 13.287 -3.192 1.00 0.00 H new ATOM 0 HG2 GLN A 159 46.803 13.922 -1.603 1.00 0.00 H new ATOM 0 HG3 GLN A 159 47.568 15.067 -2.686 1.00 0.00 H new ATOM 0 HE21 GLN A 159 44.959 13.169 -2.692 1.00 0.00 H new ATOM 0 HE22 GLN A 159 44.971 12.581 -4.357 1.00 0.00 H new ATOM 530 N LEU A 160 50.602 10.785 -0.996 1.00 0.00 N ATOM 531 CA LEU A 160 51.911 10.165 -1.197 1.00 0.00 C ATOM 532 C LEU A 160 51.778 8.845 -1.966 1.00 0.00 C ATOM 533 O LEU A 160 52.720 8.413 -2.626 1.00 0.00 O ATOM 534 CB LEU A 160 52.571 9.898 0.161 1.00 0.00 C ATOM 535 CG LEU A 160 54.052 9.552 -0.037 1.00 0.00 C ATOM 536 CD1 LEU A 160 54.833 10.797 -0.486 1.00 0.00 C ATOM 537 CD2 LEU A 160 54.628 9.030 1.283 1.00 0.00 C ATOM 0 H LEU A 160 50.373 10.987 -0.023 1.00 0.00 H new ATOM 0 HA LEU A 160 52.528 10.848 -1.781 1.00 0.00 H new ATOM 0 HB2 LEU A 160 52.476 10.776 0.800 1.00 0.00 H new ATOM 0 HB3 LEU A 160 52.062 9.078 0.668 1.00 0.00 H new ATOM 0 HG LEU A 160 54.142 8.786 -0.807 1.00 0.00 H new ATOM 0 HD11 LEU A 160 55.883 10.538 -0.623 1.00 0.00 H new ATOM 0 HD12 LEU A 160 54.424 11.163 -1.427 1.00 0.00 H new ATOM 0 HD13 LEU A 160 54.747 11.574 0.274 1.00 0.00 H new ATOM 0 HD21 LEU A 160 55.681 8.782 1.148 1.00 0.00 H new ATOM 0 HD22 LEU A 160 54.531 9.797 2.051 1.00 0.00 H new ATOM 0 HD23 LEU A 160 54.082 8.138 1.591 1.00 0.00 H new ATOM 549 N VAL A 161 50.594 8.218 -1.895 1.00 0.00 N ATOM 550 CA VAL A 161 50.343 6.960 -2.609 1.00 0.00 C ATOM 551 C VAL A 161 50.584 7.132 -4.109 1.00 0.00 C ATOM 552 O VAL A 161 51.426 6.454 -4.693 1.00 0.00 O ATOM 553 CB VAL A 161 48.892 6.502 -2.396 1.00 0.00 C ATOM 554 CG1 VAL A 161 48.740 5.050 -2.864 1.00 0.00 C ATOM 555 CG2 VAL A 161 48.508 6.592 -0.914 1.00 0.00 C ATOM 0 H VAL A 161 49.800 8.560 -1.353 1.00 0.00 H new ATOM 0 HA VAL A 161 51.029 6.212 -2.212 1.00 0.00 H new ATOM 0 HB VAL A 161 48.235 7.154 -2.973 1.00 0.00 H new ATOM 0 HG11 VAL A 161 47.711 4.725 -2.713 1.00 0.00 H new ATOM 0 HG12 VAL A 161 48.991 4.981 -3.922 1.00 0.00 H new ATOM 0 HG13 VAL A 161 49.410 4.411 -2.290 1.00 0.00 H new ATOM 0 HG21 VAL A 161 47.477 6.263 -0.785 1.00 0.00 H new ATOM 0 HG22 VAL A 161 49.169 5.953 -0.328 1.00 0.00 H new ATOM 0 HG23 VAL A 161 48.605 7.623 -0.575 1.00 0.00 H new ATOM 565 N ALA A 162 49.887 8.100 -4.711 1.00 0.00 N ATOM 566 CA ALA A 162 49.960 8.302 -6.159 1.00 0.00 C ATOM 567 C ALA A 162 51.398 8.602 -6.567 1.00 0.00 C ATOM 568 O ALA A 162 51.982 7.911 -7.406 1.00 0.00 O ATOM 569 CB ALA A 162 49.067 9.479 -6.562 1.00 0.00 C ATOM 0 H ALA A 162 49.271 8.750 -4.223 1.00 0.00 H new ATOM 0 HA ALA A 162 49.620 7.396 -6.661 1.00 0.00 H new ATOM 0 HB1 ALA A 162 49.124 9.626 -7.640 1.00 0.00 H new ATOM 0 HB2 ALA A 162 48.036 9.267 -6.279 1.00 0.00 H new ATOM 0 HB3 ALA A 162 49.405 10.382 -6.054 1.00 0.00 H new ATOM 575 N LYS A 163 52.010 9.525 -5.822 1.00 0.00 N ATOM 576 CA LYS A 163 53.382 9.946 -6.104 1.00 0.00 C ATOM 577 C LYS A 163 54.315 8.732 -6.138 1.00 0.00 C ATOM 578 O LYS A 163 54.934 8.445 -7.165 1.00 0.00 O ATOM 579 CB LYS A 163 53.860 10.929 -5.030 1.00 0.00 C ATOM 580 CG LYS A 163 52.972 12.176 -5.037 1.00 0.00 C ATOM 581 CD LYS A 163 53.231 12.987 -6.310 1.00 0.00 C ATOM 582 CE LYS A 163 52.496 14.326 -6.221 1.00 0.00 C ATOM 583 NZ LYS A 163 51.034 14.103 -6.401 1.00 0.00 N ATOM 0 H LYS A 163 51.580 9.992 -5.024 1.00 0.00 H new ATOM 0 HA LYS A 163 53.401 10.436 -7.077 1.00 0.00 H new ATOM 0 HB2 LYS A 163 53.828 10.454 -4.049 1.00 0.00 H new ATOM 0 HB3 LYS A 163 54.897 11.209 -5.215 1.00 0.00 H new ATOM 0 HG2 LYS A 163 51.922 11.887 -4.986 1.00 0.00 H new ATOM 0 HG3 LYS A 163 53.178 12.786 -4.157 1.00 0.00 H new ATOM 0 HD2 LYS A 163 54.301 13.155 -6.435 1.00 0.00 H new ATOM 0 HD3 LYS A 163 52.891 12.431 -7.184 1.00 0.00 H new ATOM 0 HE2 LYS A 163 52.687 14.794 -5.256 1.00 0.00 H new ATOM 0 HE3 LYS A 163 52.867 15.008 -6.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 50.541 15.019 -6.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 50.866 13.612 -7.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 50.672 13.522 -5.618 1.00 0.00 H new ATOM 597 N LEU A 164 54.245 7.917 -5.087 1.00 0.00 N ATOM 598 CA LEU A 164 55.107 6.745 -4.962 1.00 0.00 C ATOM 599 C LEU A 164 54.885 5.761 -6.111 1.00 0.00 C ATOM 600 O LEU A 164 55.834 5.181 -6.620 1.00 0.00 O ATOM 601 CB LEU A 164 54.825 6.040 -3.633 1.00 0.00 C ATOM 602 CG LEU A 164 55.326 6.905 -2.474 1.00 0.00 C ATOM 603 CD1 LEU A 164 54.824 6.323 -1.150 1.00 0.00 C ATOM 604 CD2 LEU A 164 56.858 6.921 -2.468 1.00 0.00 C ATOM 0 H LEU A 164 53.599 8.048 -4.309 1.00 0.00 H new ATOM 0 HA LEU A 164 56.142 7.084 -4.997 1.00 0.00 H new ATOM 0 HB2 LEU A 164 53.756 5.857 -3.527 1.00 0.00 H new ATOM 0 HB3 LEU A 164 55.318 5.068 -3.614 1.00 0.00 H new ATOM 0 HG LEU A 164 54.951 7.921 -2.595 1.00 0.00 H new ATOM 0 HD11 LEU A 164 55.180 6.938 -0.324 1.00 0.00 H new ATOM 0 HD12 LEU A 164 53.734 6.309 -1.149 1.00 0.00 H new ATOM 0 HD13 LEU A 164 55.200 5.306 -1.034 1.00 0.00 H new ATOM 0 HD21 LEU A 164 57.212 7.538 -1.642 1.00 0.00 H new ATOM 0 HD22 LEU A 164 57.232 5.904 -2.348 1.00 0.00 H new ATOM 0 HD23 LEU A 164 57.221 7.333 -3.410 1.00 0.00 H new ATOM 616 N ILE A 165 53.633 5.617 -6.546 1.00 0.00 N ATOM 617 CA ILE A 165 53.285 4.585 -7.525 1.00 0.00 C ATOM 618 C ILE A 165 54.038 4.816 -8.839 1.00 0.00 C ATOM 619 O ILE A 165 54.560 3.869 -9.436 1.00 0.00 O ATOM 620 CB ILE A 165 51.756 4.552 -7.731 1.00 0.00 C ATOM 621 CG1 ILE A 165 51.128 3.920 -6.482 1.00 0.00 C ATOM 622 CG2 ILE A 165 51.384 3.707 -8.962 1.00 0.00 C ATOM 623 CD1 ILE A 165 49.607 4.081 -6.512 1.00 0.00 C ATOM 0 H ILE A 165 52.850 6.195 -6.240 1.00 0.00 H new ATOM 0 HA ILE A 165 53.591 3.609 -7.148 1.00 0.00 H new ATOM 0 HB ILE A 165 51.389 5.566 -7.890 1.00 0.00 H new ATOM 0 HG12 ILE A 165 51.387 2.863 -6.432 1.00 0.00 H new ATOM 0 HG13 ILE A 165 51.533 4.390 -5.586 1.00 0.00 H new ATOM 0 HG21 ILE A 165 50.301 3.700 -9.085 1.00 0.00 H new ATOM 0 HG22 ILE A 165 51.847 4.135 -9.851 1.00 0.00 H new ATOM 0 HG23 ILE A 165 51.740 2.686 -8.824 1.00 0.00 H new ATOM 0 HD11 ILE A 165 49.175 3.628 -5.620 1.00 0.00 H new ATOM 0 HD12 ILE A 165 49.354 5.141 -6.539 1.00 0.00 H new ATOM 0 HD13 ILE A 165 49.206 3.589 -7.399 1.00 0.00 H new ATOM 635 N GLY A 166 54.189 6.080 -9.233 1.00 0.00 N ATOM 636 CA GLY A 166 54.992 6.395 -10.410 1.00 0.00 C ATOM 637 C GLY A 166 56.464 6.168 -10.087 1.00 0.00 C ATOM 638 O GLY A 166 57.184 5.473 -10.811 1.00 0.00 O ATOM 0 H GLY A 166 53.775 6.886 -8.765 1.00 0.00 H new ATOM 0 HA2 GLY A 166 54.691 5.768 -11.249 1.00 0.00 H new ATOM 0 HA3 GLY A 166 54.829 7.430 -10.710 1.00 0.00 H new ATOM 642 N TYR A 167 56.884 6.751 -8.968 1.00 0.00 N ATOM 643 CA TYR A 167 58.238 6.572 -8.444 1.00 0.00 C ATOM 644 C TYR A 167 58.543 5.103 -8.110 1.00 0.00 C ATOM 645 O TYR A 167 59.696 4.740 -7.896 1.00 0.00 O ATOM 646 CB TYR A 167 58.378 7.464 -7.201 1.00 0.00 C ATOM 647 CG TYR A 167 59.744 7.524 -6.573 1.00 0.00 C ATOM 648 CD1 TYR A 167 60.805 8.175 -7.246 1.00 0.00 C ATOM 649 CD2 TYR A 167 59.942 6.992 -5.278 1.00 0.00 C ATOM 650 CE1 TYR A 167 62.072 8.283 -6.627 1.00 0.00 C ATOM 651 CE2 TYR A 167 61.207 7.097 -4.658 1.00 0.00 C ATOM 652 CZ TYR A 167 62.277 7.743 -5.334 1.00 0.00 C ATOM 653 OH TYR A 167 63.518 7.846 -4.735 1.00 0.00 O ATOM 0 H TYR A 167 56.297 7.361 -8.398 1.00 0.00 H new ATOM 0 HA TYR A 167 58.963 6.860 -9.205 1.00 0.00 H new ATOM 0 HB2 TYR A 167 58.081 8.477 -7.472 1.00 0.00 H new ATOM 0 HB3 TYR A 167 57.671 7.115 -6.448 1.00 0.00 H new ATOM 0 HD1 TYR A 167 60.647 8.589 -8.231 1.00 0.00 H new ATOM 0 HD2 TYR A 167 59.127 6.506 -4.763 1.00 0.00 H new ATOM 0 HE1 TYR A 167 62.883 8.777 -7.140 1.00 0.00 H new ATOM 0 HE2 TYR A 167 61.361 6.687 -3.671 1.00 0.00 H new ATOM 0 HH TYR A 167 63.758 8.791 -4.639 1.00 0.00 H new ATOM 663 N LYS A 168 57.497 4.285 -7.996 1.00 0.00 N ATOM 664 CA LYS A 168 57.668 2.846 -7.776 1.00 0.00 C ATOM 665 C LYS A 168 58.063 2.114 -9.062 1.00 0.00 C ATOM 666 O LYS A 168 58.981 1.292 -9.058 1.00 0.00 O ATOM 667 CB LYS A 168 56.361 2.263 -7.229 1.00 0.00 C ATOM 668 CG LYS A 168 56.324 2.428 -5.699 1.00 0.00 C ATOM 669 CD LYS A 168 54.927 2.091 -5.140 1.00 0.00 C ATOM 670 CE LYS A 168 54.407 0.766 -5.710 1.00 0.00 C ATOM 671 NZ LYS A 168 53.622 0.047 -4.666 1.00 0.00 N ATOM 0 H LYS A 168 56.526 4.591 -8.052 1.00 0.00 H new ATOM 0 HA LYS A 168 58.476 2.706 -7.058 1.00 0.00 H new ATOM 0 HB2 LYS A 168 55.508 2.769 -7.680 1.00 0.00 H new ATOM 0 HB3 LYS A 168 56.282 1.208 -7.493 1.00 0.00 H new ATOM 0 HG2 LYS A 168 57.069 1.777 -5.241 1.00 0.00 H new ATOM 0 HG3 LYS A 168 56.589 3.452 -5.434 1.00 0.00 H new ATOM 0 HD2 LYS A 168 54.973 2.029 -4.053 1.00 0.00 H new ATOM 0 HD3 LYS A 168 54.231 2.893 -5.385 1.00 0.00 H new ATOM 0 HE2 LYS A 168 53.783 0.954 -6.584 1.00 0.00 H new ATOM 0 HE3 LYS A 168 55.242 0.148 -6.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 54.116 -0.829 -4.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 53.522 0.654 -3.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 52.679 -0.186 -5.039 1.00 0.00 H new ATOM 685 N GLN A 169 57.369 2.423 -10.156 1.00 0.00 N ATOM 686 CA GLN A 169 57.474 1.610 -11.370 1.00 0.00 C ATOM 687 C GLN A 169 58.807 1.820 -12.102 1.00 0.00 C ATOM 688 O GLN A 169 59.489 0.853 -12.447 1.00 0.00 O ATOM 689 CB GLN A 169 56.321 1.947 -12.317 1.00 0.00 C ATOM 690 CG GLN A 169 55.000 1.486 -11.700 1.00 0.00 C ATOM 691 CD GLN A 169 53.853 1.746 -12.669 1.00 0.00 C ATOM 692 OE1 GLN A 169 53.656 0.987 -13.618 1.00 0.00 O ATOM 693 NE2 GLN A 169 53.077 2.780 -12.487 1.00 0.00 N ATOM 0 H GLN A 169 56.736 3.219 -10.229 1.00 0.00 H new ATOM 0 HA GLN A 169 57.425 0.565 -11.064 1.00 0.00 H new ATOM 0 HB2 GLN A 169 56.292 3.021 -12.504 1.00 0.00 H new ATOM 0 HB3 GLN A 169 56.474 1.460 -13.280 1.00 0.00 H new ATOM 0 HG2 GLN A 169 55.052 0.424 -11.462 1.00 0.00 H new ATOM 0 HG3 GLN A 169 54.823 2.015 -10.763 1.00 0.00 H new ATOM 0 HE21 GLN A 169 53.241 3.408 -11.700 1.00 0.00 H new ATOM 0 HE22 GLN A 169 52.307 2.959 -13.131 1.00 0.00 H new ATOM 702 N ASN A 170 59.173 3.083 -12.331 1.00 0.00 N ATOM 703 CA ASN A 170 60.289 3.393 -13.245 1.00 0.00 C ATOM 704 C ASN A 170 61.629 3.682 -12.533 1.00 0.00 C ATOM 705 O ASN A 170 62.677 3.243 -13.011 1.00 0.00 O ATOM 706 CB ASN A 170 59.914 4.603 -14.103 1.00 0.00 C ATOM 707 CG ASN A 170 60.818 4.671 -15.330 1.00 0.00 C ATOM 708 OD1 ASN A 170 60.897 3.712 -16.098 1.00 0.00 O ATOM 709 ND2 ASN A 170 61.508 5.754 -15.562 1.00 0.00 N ATOM 0 H ASN A 170 58.727 3.897 -11.909 1.00 0.00 H new ATOM 0 HA ASN A 170 60.445 2.500 -13.850 1.00 0.00 H new ATOM 0 HB2 ASN A 170 58.871 4.531 -14.412 1.00 0.00 H new ATOM 0 HB3 ASN A 170 60.010 5.518 -13.518 1.00 0.00 H new ATOM 0 HD21 ASN A 170 62.114 5.807 -16.381 1.00 0.00 H new ATOM 0 HD22 ASN A 170 61.441 6.548 -14.925 1.00 0.00 H new ATOM 716 N PRO A 171 61.631 4.381 -11.418 1.00 0.00 N ATOM 717 CA PRO A 171 62.882 4.980 -10.866 1.00 0.00 C ATOM 718 C PRO A 171 63.497 4.197 -9.706 1.00 0.00 C ATOM 719 O PRO A 171 63.123 4.378 -8.548 1.00 0.00 O ATOM 720 CB PRO A 171 62.461 6.374 -10.429 1.00 0.00 C ATOM 721 CG PRO A 171 61.022 6.261 -10.080 1.00 0.00 C ATOM 722 CD PRO A 171 60.467 4.999 -10.759 1.00 0.00 C ATOM 0 HA PRO A 171 63.673 4.976 -11.616 1.00 0.00 H new ATOM 0 HB2 PRO A 171 63.047 6.711 -9.574 1.00 0.00 H new ATOM 0 HB3 PRO A 171 62.616 7.099 -11.228 1.00 0.00 H new ATOM 0 HG2 PRO A 171 60.896 6.199 -8.999 1.00 0.00 H new ATOM 0 HG3 PRO A 171 60.478 7.144 -10.415 1.00 0.00 H new ATOM 0 HD2 PRO A 171 60.020 4.322 -10.031 1.00 0.00 H new ATOM 0 HD3 PRO A 171 59.690 5.248 -11.482 1.00 0.00 H new ATOM 730 N GLN A 172 64.490 3.359 -10.022 1.00 0.00 N ATOM 731 CA GLN A 172 65.270 2.639 -8.991 1.00 0.00 C ATOM 732 C GLN A 172 65.745 3.560 -7.839 1.00 0.00 C ATOM 733 O GLN A 172 66.125 3.076 -6.767 1.00 0.00 O ATOM 734 CB GLN A 172 66.490 1.974 -9.636 1.00 0.00 C ATOM 735 CG GLN A 172 66.029 0.958 -10.684 1.00 0.00 C ATOM 736 CD GLN A 172 65.378 -0.241 -10.002 1.00 0.00 C ATOM 737 OE1 GLN A 172 65.937 -0.798 -9.056 1.00 0.00 O ATOM 738 NE2 GLN A 172 64.224 -0.675 -10.427 1.00 0.00 N ATOM 0 H GLN A 172 64.778 3.158 -10.980 1.00 0.00 H new ATOM 0 HA GLN A 172 64.605 1.892 -8.559 1.00 0.00 H new ATOM 0 HB2 GLN A 172 67.124 2.729 -10.101 1.00 0.00 H new ATOM 0 HB3 GLN A 172 67.091 1.478 -8.874 1.00 0.00 H new ATOM 0 HG2 GLN A 172 65.321 1.426 -11.368 1.00 0.00 H new ATOM 0 HG3 GLN A 172 66.879 0.629 -11.281 1.00 0.00 H new ATOM 0 HE21 GLN A 172 63.762 -0.213 -11.210 1.00 0.00 H new ATOM 0 HE22 GLN A 172 63.783 -1.477 -9.976 1.00 0.00 H new ATOM 747 N ALA A 173 65.647 4.881 -8.033 1.00 0.00 N ATOM 748 CA ALA A 173 66.154 5.850 -7.064 1.00 0.00 C ATOM 749 C ALA A 173 65.486 5.707 -5.682 1.00 0.00 C ATOM 750 O ALA A 173 65.943 6.317 -4.716 1.00 0.00 O ATOM 751 CB ALA A 173 65.885 7.260 -7.589 1.00 0.00 C ATOM 0 H ALA A 173 65.218 5.301 -8.858 1.00 0.00 H new ATOM 0 HA ALA A 173 67.221 5.664 -6.941 1.00 0.00 H new ATOM 0 HB1 ALA A 173 66.259 7.992 -6.874 1.00 0.00 H new ATOM 0 HB2 ALA A 173 66.391 7.395 -8.545 1.00 0.00 H new ATOM 0 HB3 ALA A 173 64.812 7.400 -7.723 1.00 0.00 H new ATOM 757 N ILE A 174 64.439 4.867 -5.570 1.00 0.00 N ATOM 758 CA ILE A 174 63.661 4.787 -4.326 1.00 0.00 C ATOM 759 C ILE A 174 64.562 4.427 -3.143 1.00 0.00 C ATOM 760 O ILE A 174 64.332 4.882 -2.024 1.00 0.00 O ATOM 761 CB ILE A 174 62.545 3.737 -4.446 1.00 0.00 C ATOM 762 CG1 ILE A 174 61.740 3.985 -5.749 1.00 0.00 C ATOM 763 CG2 ILE A 174 61.623 3.834 -3.217 1.00 0.00 C ATOM 764 CD1 ILE A 174 60.465 3.131 -5.804 1.00 0.00 C ATOM 0 H ILE A 174 64.119 4.246 -6.313 1.00 0.00 H new ATOM 0 HA ILE A 174 63.216 5.767 -4.154 1.00 0.00 H new ATOM 0 HB ILE A 174 62.977 2.737 -4.486 1.00 0.00 H new ATOM 0 HG12 ILE A 174 61.474 5.040 -5.816 1.00 0.00 H new ATOM 0 HG13 ILE A 174 62.366 3.759 -6.612 1.00 0.00 H new ATOM 0 HG21 ILE A 174 60.830 3.091 -3.298 1.00 0.00 H new ATOM 0 HG22 ILE A 174 62.202 3.650 -2.312 1.00 0.00 H new ATOM 0 HG23 ILE A 174 61.183 4.830 -3.170 1.00 0.00 H new ATOM 0 HD11 ILE A 174 59.930 3.335 -6.732 1.00 0.00 H new ATOM 0 HD12 ILE A 174 60.732 2.075 -5.763 1.00 0.00 H new ATOM 0 HD13 ILE A 174 59.826 3.376 -4.956 1.00 0.00 H new ATOM 776 N GLY A 175 65.610 3.642 -3.409 1.00 0.00 N ATOM 777 CA GLY A 175 66.480 3.141 -2.345 1.00 0.00 C ATOM 778 C GLY A 175 67.058 4.283 -1.501 1.00 0.00 C ATOM 779 O GLY A 175 67.368 4.096 -0.322 1.00 0.00 O ATOM 0 H GLY A 175 65.874 3.342 -4.347 1.00 0.00 H new ATOM 0 HA2 GLY A 175 65.917 2.463 -1.703 1.00 0.00 H new ATOM 0 HA3 GLY A 175 67.294 2.563 -2.782 1.00 0.00 H new ATOM 783 N GLN A 176 67.198 5.460 -2.112 1.00 0.00 N ATOM 784 CA GLN A 176 67.743 6.621 -1.417 1.00 0.00 C ATOM 785 C GLN A 176 66.647 7.392 -0.684 1.00 0.00 C ATOM 786 O GLN A 176 66.901 8.011 0.351 1.00 0.00 O ATOM 787 CB GLN A 176 68.432 7.550 -2.422 1.00 0.00 C ATOM 788 CG GLN A 176 69.591 6.810 -3.096 1.00 0.00 C ATOM 789 CD GLN A 176 70.725 6.591 -2.099 1.00 0.00 C ATOM 790 OE1 GLN A 176 71.144 7.528 -1.419 1.00 0.00 O ATOM 791 NE2 GLN A 176 71.248 5.402 -1.970 1.00 0.00 N ATOM 0 H GLN A 176 66.942 5.632 -3.084 1.00 0.00 H new ATOM 0 HA GLN A 176 68.466 6.266 -0.682 1.00 0.00 H new ATOM 0 HB2 GLN A 176 67.716 7.885 -3.172 1.00 0.00 H new ATOM 0 HB3 GLN A 176 68.802 8.441 -1.914 1.00 0.00 H new ATOM 0 HG2 GLN A 176 69.245 5.851 -3.481 1.00 0.00 H new ATOM 0 HG3 GLN A 176 69.952 7.385 -3.949 1.00 0.00 H new ATOM 0 HE21 GLN A 176 70.899 4.627 -2.534 1.00 0.00 H new ATOM 0 HE22 GLN A 176 72.006 5.248 -1.305 1.00 0.00 H new ATOM 800 N ASP A 177 65.431 7.348 -1.229 1.00 0.00 N ATOM 801 CA ASP A 177 64.330 8.115 -0.662 1.00 0.00 C ATOM 802 C ASP A 177 63.788 7.450 0.602 1.00 0.00 C ATOM 803 O ASP A 177 63.123 8.109 1.401 1.00 0.00 O ATOM 804 CB ASP A 177 63.201 8.307 -1.688 1.00 0.00 C ATOM 805 CG ASP A 177 63.409 9.591 -2.504 1.00 0.00 C ATOM 806 OD1 ASP A 177 64.279 10.376 -2.153 1.00 0.00 O ATOM 807 OD2 ASP A 177 62.673 9.786 -3.456 1.00 0.00 O ATOM 0 H ASP A 177 65.189 6.796 -2.052 1.00 0.00 H new ATOM 0 HA ASP A 177 64.721 9.096 -0.393 1.00 0.00 H new ATOM 0 HB2 ASP A 177 63.164 7.448 -2.358 1.00 0.00 H new ATOM 0 HB3 ASP A 177 62.241 8.351 -1.173 1.00 0.00 H new ATOM 812 N LEU A 178 64.059 6.149 0.790 1.00 0.00 N ATOM 813 CA LEU A 178 63.688 5.480 2.044 1.00 0.00 C ATOM 814 C LEU A 178 64.293 6.245 3.234 1.00 0.00 C ATOM 815 O LEU A 178 63.640 6.462 4.254 1.00 0.00 O ATOM 816 CB LEU A 178 64.208 4.028 2.080 1.00 0.00 C ATOM 817 CG LEU A 178 63.888 3.246 0.792 1.00 0.00 C ATOM 818 CD1 LEU A 178 64.654 1.924 0.826 1.00 0.00 C ATOM 819 CD2 LEU A 178 62.389 2.937 0.706 1.00 0.00 C ATOM 0 H LEU A 178 64.523 5.552 0.106 1.00 0.00 H new ATOM 0 HA LEU A 178 62.600 5.467 2.107 1.00 0.00 H new ATOM 0 HB2 LEU A 178 65.287 4.037 2.235 1.00 0.00 H new ATOM 0 HB3 LEU A 178 63.768 3.511 2.932 1.00 0.00 H new ATOM 0 HG LEU A 178 64.177 3.847 -0.070 1.00 0.00 H new ATOM 0 HD11 LEU A 178 64.440 1.356 -0.079 1.00 0.00 H new ATOM 0 HD12 LEU A 178 65.724 2.125 0.884 1.00 0.00 H new ATOM 0 HD13 LEU A 178 64.346 1.347 1.698 1.00 0.00 H new ATOM 0 HD21 LEU A 178 62.183 2.384 -0.211 1.00 0.00 H new ATOM 0 HD22 LEU A 178 62.091 2.337 1.566 1.00 0.00 H new ATOM 0 HD23 LEU A 178 61.825 3.870 0.702 1.00 0.00 H new ATOM 831 N PHE A 179 65.558 6.638 3.070 1.00 0.00 N ATOM 832 CA PHE A 179 66.265 7.448 4.066 1.00 0.00 C ATOM 833 C PHE A 179 65.479 8.716 4.429 1.00 0.00 C ATOM 834 O PHE A 179 65.491 9.154 5.581 1.00 0.00 O ATOM 835 CB PHE A 179 67.638 7.838 3.523 1.00 0.00 C ATOM 836 CG PHE A 179 68.594 6.675 3.407 1.00 0.00 C ATOM 837 CD1 PHE A 179 69.361 6.274 4.529 1.00 0.00 C ATOM 838 CD2 PHE A 179 68.723 5.983 2.179 1.00 0.00 C ATOM 839 CE1 PHE A 179 70.257 5.183 4.421 1.00 0.00 C ATOM 840 CE2 PHE A 179 69.619 4.892 2.071 1.00 0.00 C ATOM 841 CZ PHE A 179 70.386 4.491 3.193 1.00 0.00 C ATOM 0 H PHE A 179 66.118 6.406 2.250 1.00 0.00 H new ATOM 0 HA PHE A 179 66.373 6.849 4.971 1.00 0.00 H new ATOM 0 HB2 PHE A 179 67.515 8.296 2.541 1.00 0.00 H new ATOM 0 HB3 PHE A 179 68.076 8.594 4.175 1.00 0.00 H new ATOM 0 HD1 PHE A 179 69.262 6.801 5.467 1.00 0.00 H new ATOM 0 HD2 PHE A 179 68.138 6.287 1.324 1.00 0.00 H new ATOM 0 HE1 PHE A 179 70.842 4.879 5.276 1.00 0.00 H new ATOM 0 HE2 PHE A 179 69.718 4.365 1.133 1.00 0.00 H new ATOM 0 HZ PHE A 179 71.068 3.658 3.111 1.00 0.00 H new ATOM 851 N THR A 180 64.801 9.293 3.438 1.00 0.00 N ATOM 852 CA THR A 180 64.008 10.510 3.661 1.00 0.00 C ATOM 853 C THR A 180 62.566 10.168 4.060 1.00 0.00 C ATOM 854 O THR A 180 61.888 10.968 4.708 1.00 0.00 O ATOM 855 CB THR A 180 63.997 11.379 2.397 1.00 0.00 C ATOM 856 OG1 THR A 180 63.228 10.737 1.388 1.00 0.00 O ATOM 857 CG2 THR A 180 65.428 11.593 1.894 1.00 0.00 C ATOM 0 H THR A 180 64.782 8.944 2.480 1.00 0.00 H new ATOM 0 HA THR A 180 64.472 11.063 4.478 1.00 0.00 H new ATOM 0 HB THR A 180 63.556 12.347 2.633 1.00 0.00 H new ATOM 0 HG1 THR A 180 63.472 9.789 1.344 1.00 0.00 H new ATOM 0 HG21 THR A 180 65.410 12.211 0.996 1.00 0.00 H new ATOM 0 HG22 THR A 180 66.014 12.092 2.666 1.00 0.00 H new ATOM 0 HG23 THR A 180 65.880 10.629 1.661 1.00 0.00 H new ATOM 865 N ASP A 181 62.107 8.977 3.668 1.00 0.00 N ATOM 866 CA ASP A 181 60.736 8.554 3.945 1.00 0.00 C ATOM 867 C ASP A 181 60.713 7.463 5.022 1.00 0.00 C ATOM 868 O ASP A 181 61.161 6.342 4.770 1.00 0.00 O ATOM 869 CB ASP A 181 60.085 8.025 2.667 1.00 0.00 C ATOM 870 CG ASP A 181 58.563 8.197 2.718 1.00 0.00 C ATOM 871 OD1 ASP A 181 58.047 8.530 3.775 1.00 0.00 O ATOM 872 OD2 ASP A 181 57.934 7.995 1.693 1.00 0.00 O ATOM 0 H ASP A 181 62.665 8.291 3.159 1.00 0.00 H new ATOM 0 HA ASP A 181 60.177 9.417 4.308 1.00 0.00 H new ATOM 0 HB2 ASP A 181 60.486 8.555 1.803 1.00 0.00 H new ATOM 0 HB3 ASP A 181 60.332 6.971 2.537 1.00 0.00 H new ATOM 877 N PRO A 182 60.176 7.742 6.194 1.00 0.00 N ATOM 878 CA PRO A 182 60.222 6.765 7.327 1.00 0.00 C ATOM 879 C PRO A 182 59.425 5.491 7.032 1.00 0.00 C ATOM 880 O PRO A 182 59.967 4.387 7.094 1.00 0.00 O ATOM 881 CB PRO A 182 59.619 7.527 8.513 1.00 0.00 C ATOM 882 CG PRO A 182 58.793 8.610 7.911 1.00 0.00 C ATOM 883 CD PRO A 182 59.457 8.973 6.586 1.00 0.00 C ATOM 0 HA PRO A 182 61.239 6.423 7.517 1.00 0.00 H new ATOM 0 HB2 PRO A 182 59.011 6.869 9.134 1.00 0.00 H new ATOM 0 HB3 PRO A 182 60.400 7.938 9.153 1.00 0.00 H new ATOM 0 HG2 PRO A 182 57.768 8.274 7.753 1.00 0.00 H new ATOM 0 HG3 PRO A 182 58.746 9.476 8.572 1.00 0.00 H new ATOM 0 HD2 PRO A 182 58.720 9.260 5.836 1.00 0.00 H new ATOM 0 HD3 PRO A 182 60.140 9.815 6.700 1.00 0.00 H new ATOM 891 N ARG A 183 58.141 5.654 6.709 1.00 0.00 N ATOM 892 CA ARG A 183 57.247 4.502 6.563 1.00 0.00 C ATOM 893 C ARG A 183 57.665 3.598 5.406 1.00 0.00 C ATOM 894 O ARG A 183 57.562 2.378 5.520 1.00 0.00 O ATOM 895 CB ARG A 183 55.799 4.952 6.359 1.00 0.00 C ATOM 896 CG ARG A 183 55.362 5.821 7.543 1.00 0.00 C ATOM 897 CD ARG A 183 53.881 6.172 7.397 1.00 0.00 C ATOM 898 NE ARG A 183 53.262 6.354 8.711 1.00 0.00 N ATOM 899 CZ ARG A 183 53.521 7.416 9.488 1.00 0.00 C ATOM 900 NH1 ARG A 183 54.369 8.345 9.119 1.00 0.00 N ATOM 901 NH2 ARG A 183 52.908 7.527 10.635 1.00 0.00 N ATOM 0 H ARG A 183 57.700 6.559 6.545 1.00 0.00 H new ATOM 0 HA ARG A 183 57.320 3.931 7.489 1.00 0.00 H new ATOM 0 HB2 ARG A 183 55.709 5.514 5.429 1.00 0.00 H new ATOM 0 HB3 ARG A 183 55.146 4.084 6.271 1.00 0.00 H new ATOM 0 HG2 ARG A 183 55.530 5.290 8.480 1.00 0.00 H new ATOM 0 HG3 ARG A 183 55.961 6.731 7.581 1.00 0.00 H new ATOM 0 HD2 ARG A 183 53.774 7.084 6.809 1.00 0.00 H new ATOM 0 HD3 ARG A 183 53.366 5.380 6.853 1.00 0.00 H new ATOM 0 HE ARG A 183 52.609 5.647 9.048 1.00 0.00 H new ATOM 0 HH11 ARG A 183 54.849 8.270 8.222 1.00 0.00 H new ATOM 0 HH12 ARG A 183 54.548 9.143 9.728 1.00 0.00 H new ATOM 0 HH21 ARG A 183 52.243 6.812 10.929 1.00 0.00 H new ATOM 0 HH22 ARG A 183 53.094 8.329 11.237 1.00 0.00 H new ATOM 915 N LEU A 184 58.192 4.181 4.317 1.00 0.00 N ATOM 916 CA LEU A 184 58.583 3.385 3.136 1.00 0.00 C ATOM 917 C LEU A 184 59.469 2.207 3.549 1.00 0.00 C ATOM 918 O LEU A 184 59.333 1.100 3.025 1.00 0.00 O ATOM 919 CB LEU A 184 59.342 4.254 2.116 1.00 0.00 C ATOM 920 CG LEU A 184 58.362 4.896 1.121 1.00 0.00 C ATOM 921 CD1 LEU A 184 59.117 5.891 0.231 1.00 0.00 C ATOM 922 CD2 LEU A 184 57.733 3.813 0.234 1.00 0.00 C ATOM 0 H LEU A 184 58.356 5.184 4.227 1.00 0.00 H new ATOM 0 HA LEU A 184 57.670 3.007 2.675 1.00 0.00 H new ATOM 0 HB2 LEU A 184 59.902 5.031 2.637 1.00 0.00 H new ATOM 0 HB3 LEU A 184 60.068 3.644 1.578 1.00 0.00 H new ATOM 0 HG LEU A 184 57.579 5.412 1.677 1.00 0.00 H new ATOM 0 HD11 LEU A 184 58.423 6.347 -0.475 1.00 0.00 H new ATOM 0 HD12 LEU A 184 59.565 6.667 0.852 1.00 0.00 H new ATOM 0 HD13 LEU A 184 59.900 5.367 -0.317 1.00 0.00 H new ATOM 0 HD21 LEU A 184 57.040 4.275 -0.469 1.00 0.00 H new ATOM 0 HD22 LEU A 184 58.517 3.294 -0.318 1.00 0.00 H new ATOM 0 HD23 LEU A 184 57.195 3.099 0.858 1.00 0.00 H new ATOM 934 N MET A 185 60.321 2.437 4.547 1.00 0.00 N ATOM 935 CA MET A 185 61.204 1.386 5.045 1.00 0.00 C ATOM 936 C MET A 185 60.396 0.259 5.693 1.00 0.00 C ATOM 937 O MET A 185 60.571 -0.903 5.351 1.00 0.00 O ATOM 938 CB MET A 185 62.196 1.965 6.053 1.00 0.00 C ATOM 939 CG MET A 185 63.225 2.822 5.314 1.00 0.00 C ATOM 940 SD MET A 185 64.544 3.300 6.457 1.00 0.00 S ATOM 941 CE MET A 185 65.733 3.845 5.206 1.00 0.00 C ATOM 0 H MET A 185 60.418 3.334 5.023 1.00 0.00 H new ATOM 0 HA MET A 185 61.755 0.973 4.200 1.00 0.00 H new ATOM 0 HB2 MET A 185 61.670 2.566 6.794 1.00 0.00 H new ATOM 0 HB3 MET A 185 62.696 1.160 6.592 1.00 0.00 H new ATOM 0 HG2 MET A 185 63.641 2.266 4.474 1.00 0.00 H new ATOM 0 HG3 MET A 185 62.746 3.710 4.903 1.00 0.00 H new ATOM 0 HE1 MET A 185 66.747 3.683 5.572 1.00 0.00 H new ATOM 0 HE2 MET A 185 65.583 3.275 4.289 1.00 0.00 H new ATOM 0 HE3 MET A 185 65.586 4.906 5.002 1.00 0.00 H new ATOM 951 N THR A 186 59.416 0.619 6.521 1.00 0.00 N ATOM 952 CA THR A 186 58.609 -0.379 7.235 1.00 0.00 C ATOM 953 C THR A 186 57.870 -1.284 6.237 1.00 0.00 C ATOM 954 O THR A 186 57.733 -2.489 6.453 1.00 0.00 O ATOM 955 CB THR A 186 57.600 0.338 8.152 1.00 0.00 C ATOM 956 OG1 THR A 186 58.307 1.197 9.037 1.00 0.00 O ATOM 957 CG2 THR A 186 56.790 -0.676 8.972 1.00 0.00 C ATOM 0 H THR A 186 59.160 1.587 6.716 1.00 0.00 H new ATOM 0 HA THR A 186 59.267 -1.002 7.841 1.00 0.00 H new ATOM 0 HB THR A 186 56.911 0.913 7.533 1.00 0.00 H new ATOM 0 HG1 THR A 186 57.671 1.658 9.623 1.00 0.00 H new ATOM 0 HG21 THR A 186 56.084 -0.146 9.612 1.00 0.00 H new ATOM 0 HG22 THR A 186 56.244 -1.336 8.298 1.00 0.00 H new ATOM 0 HG23 THR A 186 57.466 -1.267 9.590 1.00 0.00 H new ATOM 965 N ILE A 187 57.425 -0.687 5.128 1.00 0.00 N ATOM 966 CA ILE A 187 56.846 -1.451 4.012 1.00 0.00 C ATOM 967 C ILE A 187 57.845 -2.513 3.548 1.00 0.00 C ATOM 968 O ILE A 187 57.506 -3.683 3.357 1.00 0.00 O ATOM 969 CB ILE A 187 56.541 -0.506 2.828 1.00 0.00 C ATOM 970 CG1 ILE A 187 55.632 0.644 3.278 1.00 0.00 C ATOM 971 CG2 ILE A 187 55.830 -1.275 1.712 1.00 0.00 C ATOM 972 CD1 ILE A 187 55.544 1.700 2.169 1.00 0.00 C ATOM 0 H ILE A 187 57.453 0.321 4.976 1.00 0.00 H new ATOM 0 HA ILE A 187 55.924 -1.925 4.349 1.00 0.00 H new ATOM 0 HB ILE A 187 57.487 -0.105 2.464 1.00 0.00 H new ATOM 0 HG12 ILE A 187 54.637 0.264 3.511 1.00 0.00 H new ATOM 0 HG13 ILE A 187 56.023 1.093 4.191 1.00 0.00 H new ATOM 0 HG21 ILE A 187 55.619 -0.600 0.882 1.00 0.00 H new ATOM 0 HG22 ILE A 187 56.469 -2.087 1.366 1.00 0.00 H new ATOM 0 HG23 ILE A 187 54.895 -1.686 2.092 1.00 0.00 H new ATOM 0 HD11 ILE A 187 54.897 2.515 2.493 1.00 0.00 H new ATOM 0 HD12 ILE A 187 56.540 2.089 1.957 1.00 0.00 H new ATOM 0 HD13 ILE A 187 55.132 1.247 1.267 1.00 0.00 H new ATOM 984 N MET A 188 59.085 -2.077 3.402 1.00 0.00 N ATOM 985 CA MET A 188 60.157 -2.948 2.948 1.00 0.00 C ATOM 986 C MET A 188 60.369 -4.105 3.927 1.00 0.00 C ATOM 987 O MET A 188 60.597 -5.241 3.523 1.00 0.00 O ATOM 988 CB MET A 188 61.445 -2.143 2.823 1.00 0.00 C ATOM 989 CG MET A 188 61.215 -0.909 1.927 1.00 0.00 C ATOM 990 SD MET A 188 62.496 -0.792 0.649 1.00 0.00 S ATOM 991 CE MET A 188 61.709 -1.874 -0.573 1.00 0.00 C ATOM 0 H MET A 188 59.376 -1.118 3.593 1.00 0.00 H new ATOM 0 HA MET A 188 59.882 -3.362 1.978 1.00 0.00 H new ATOM 0 HB2 MET A 188 61.783 -1.827 3.810 1.00 0.00 H new ATOM 0 HB3 MET A 188 62.233 -2.767 2.401 1.00 0.00 H new ATOM 0 HG2 MET A 188 60.233 -0.972 1.459 1.00 0.00 H new ATOM 0 HG3 MET A 188 61.220 -0.005 2.537 1.00 0.00 H new ATOM 0 HE1 MET A 188 62.198 -2.848 -0.565 1.00 0.00 H new ATOM 0 HE2 MET A 188 60.654 -1.995 -0.326 1.00 0.00 H new ATOM 0 HE3 MET A 188 61.801 -1.431 -1.564 1.00 0.00 H new ATOM 1001 N ALA A 189 60.290 -3.791 5.216 1.00 0.00 N ATOM 1002 CA ALA A 189 60.428 -4.794 6.284 1.00 0.00 C ATOM 1003 C ALA A 189 59.452 -5.967 6.115 1.00 0.00 C ATOM 1004 O ALA A 189 59.872 -7.121 6.069 1.00 0.00 O ATOM 1005 CB ALA A 189 60.187 -4.137 7.644 1.00 0.00 C ATOM 0 H ALA A 189 60.130 -2.843 5.556 1.00 0.00 H new ATOM 0 HA ALA A 189 61.441 -5.191 6.223 1.00 0.00 H new ATOM 0 HB1 ALA A 189 60.290 -4.883 8.432 1.00 0.00 H new ATOM 0 HB2 ALA A 189 60.917 -3.343 7.799 1.00 0.00 H new ATOM 0 HB3 ALA A 189 59.182 -3.716 7.672 1.00 0.00 H new ATOM 1011 N THR A 190 58.153 -5.669 5.987 1.00 0.00 N ATOM 1012 CA THR A 190 57.138 -6.727 5.815 1.00 0.00 C ATOM 1013 C THR A 190 57.493 -7.631 4.627 1.00 0.00 C ATOM 1014 O THR A 190 57.403 -8.856 4.713 1.00 0.00 O ATOM 1015 CB THR A 190 55.753 -6.100 5.560 1.00 0.00 C ATOM 1016 OG1 THR A 190 55.909 -4.854 4.899 1.00 0.00 O ATOM 1017 CG2 THR A 190 55.004 -5.888 6.876 1.00 0.00 C ATOM 0 H THR A 190 57.779 -4.720 5.998 1.00 0.00 H new ATOM 0 HA THR A 190 57.115 -7.320 6.729 1.00 0.00 H new ATOM 0 HB THR A 190 55.175 -6.780 4.935 1.00 0.00 H new ATOM 0 HG1 THR A 190 56.657 -4.910 4.268 1.00 0.00 H new ATOM 0 HG21 THR A 190 54.029 -5.445 6.673 1.00 0.00 H new ATOM 0 HG22 THR A 190 54.869 -6.847 7.376 1.00 0.00 H new ATOM 0 HG23 THR A 190 55.579 -5.221 7.519 1.00 0.00 H new ATOM 1025 N LEU A 191 57.892 -7.002 3.529 1.00 0.00 N ATOM 1026 CA LEU A 191 58.285 -7.733 2.321 1.00 0.00 C ATOM 1027 C LEU A 191 59.489 -8.645 2.582 1.00 0.00 C ATOM 1028 O LEU A 191 59.433 -9.850 2.329 1.00 0.00 O ATOM 1029 CB LEU A 191 58.629 -6.735 1.219 1.00 0.00 C ATOM 1030 CG LEU A 191 57.344 -6.064 0.722 1.00 0.00 C ATOM 1031 CD1 LEU A 191 57.657 -4.642 0.238 1.00 0.00 C ATOM 1032 CD2 LEU A 191 56.754 -6.892 -0.425 1.00 0.00 C ATOM 0 H LEU A 191 57.954 -5.987 3.445 1.00 0.00 H new ATOM 0 HA LEU A 191 57.449 -8.361 2.014 1.00 0.00 H new ATOM 0 HB2 LEU A 191 59.322 -5.984 1.597 1.00 0.00 H new ATOM 0 HB3 LEU A 191 59.129 -7.244 0.395 1.00 0.00 H new ATOM 0 HG LEU A 191 56.621 -6.008 1.535 1.00 0.00 H new ATOM 0 HD11 LEU A 191 56.741 -4.168 -0.115 1.00 0.00 H new ATOM 0 HD12 LEU A 191 58.073 -4.061 1.061 1.00 0.00 H new ATOM 0 HD13 LEU A 191 58.380 -4.686 -0.577 1.00 0.00 H new ATOM 0 HD21 LEU A 191 55.839 -6.419 -0.782 1.00 0.00 H new ATOM 0 HD22 LEU A 191 57.475 -6.950 -1.240 1.00 0.00 H new ATOM 0 HD23 LEU A 191 56.527 -7.897 -0.069 1.00 0.00 H new ATOM 1044 N MET A 192 60.568 -8.057 3.090 1.00 0.00 N ATOM 1045 CA MET A 192 61.819 -8.784 3.302 1.00 0.00 C ATOM 1046 C MET A 192 61.727 -9.765 4.472 1.00 0.00 C ATOM 1047 O MET A 192 62.478 -10.740 4.529 1.00 0.00 O ATOM 1048 CB MET A 192 62.939 -7.793 3.578 1.00 0.00 C ATOM 1049 CG MET A 192 63.267 -7.025 2.297 1.00 0.00 C ATOM 1050 SD MET A 192 64.247 -8.076 1.195 1.00 0.00 S ATOM 1051 CE MET A 192 65.730 -8.182 2.228 1.00 0.00 C ATOM 0 H MET A 192 60.603 -7.075 3.364 1.00 0.00 H new ATOM 0 HA MET A 192 62.021 -9.357 2.397 1.00 0.00 H new ATOM 0 HB2 MET A 192 62.640 -7.100 4.364 1.00 0.00 H new ATOM 0 HB3 MET A 192 63.824 -8.319 3.936 1.00 0.00 H new ATOM 0 HG2 MET A 192 62.347 -6.717 1.800 1.00 0.00 H new ATOM 0 HG3 MET A 192 63.820 -6.117 2.537 1.00 0.00 H new ATOM 0 HE1 MET A 192 66.615 -8.031 1.610 1.00 0.00 H new ATOM 0 HE2 MET A 192 65.691 -7.414 3.000 1.00 0.00 H new ATOM 0 HE3 MET A 192 65.778 -9.165 2.697 1.00 0.00 H new ATOM 1061 N GLY A 193 60.806 -9.507 5.399 1.00 0.00 N ATOM 1062 CA GLY A 193 60.749 -10.255 6.648 1.00 0.00 C ATOM 1063 C GLY A 193 59.939 -11.541 6.483 1.00 0.00 C ATOM 1064 O GLY A 193 59.837 -12.341 7.413 1.00 0.00 O ATOM 0 H GLY A 193 60.091 -8.786 5.306 1.00 0.00 H new ATOM 0 HA2 GLY A 193 61.760 -10.498 6.977 1.00 0.00 H new ATOM 0 HA3 GLY A 193 60.301 -9.637 7.426 1.00 0.00 H new ATOM 1068 N VAL A 194 59.355 -11.730 5.288 1.00 0.00 N ATOM 1069 CA VAL A 194 58.402 -12.822 5.050 1.00 0.00 C ATOM 1070 C VAL A 194 57.090 -12.611 5.830 1.00 0.00 C ATOM 1071 O VAL A 194 56.266 -13.522 5.918 1.00 0.00 O ATOM 1072 CB VAL A 194 59.029 -14.177 5.426 1.00 0.00 C ATOM 1073 CG1 VAL A 194 58.179 -15.311 4.850 1.00 0.00 C ATOM 1074 CG2 VAL A 194 60.451 -14.269 4.847 1.00 0.00 C ATOM 0 H VAL A 194 59.527 -11.140 4.474 1.00 0.00 H new ATOM 0 HA VAL A 194 58.164 -12.822 3.986 1.00 0.00 H new ATOM 0 HB VAL A 194 59.071 -14.263 6.512 1.00 0.00 H new ATOM 0 HG11 VAL A 194 58.623 -16.270 5.116 1.00 0.00 H new ATOM 0 HG12 VAL A 194 57.170 -15.253 5.258 1.00 0.00 H new ATOM 0 HG13 VAL A 194 58.137 -15.219 3.765 1.00 0.00 H new ATOM 0 HG21 VAL A 194 60.892 -15.229 5.115 1.00 0.00 H new ATOM 0 HG22 VAL A 194 60.408 -14.180 3.761 1.00 0.00 H new ATOM 0 HG23 VAL A 194 61.062 -13.463 5.254 1.00 0.00 H new ATOM 1084 N ASP A 195 56.901 -11.406 6.393 1.00 0.00 N ATOM 1085 CA ASP A 195 55.650 -11.045 7.057 1.00 0.00 C ATOM 1086 C ASP A 195 55.281 -12.066 8.143 1.00 0.00 C ATOM 1087 O ASP A 195 54.188 -12.636 8.133 1.00 0.00 O ATOM 1088 CB ASP A 195 54.531 -10.940 6.015 1.00 0.00 C ATOM 1089 CG ASP A 195 54.482 -9.530 5.432 1.00 0.00 C ATOM 1090 OD1 ASP A 195 54.607 -8.588 6.198 1.00 0.00 O ATOM 1091 OD2 ASP A 195 54.320 -9.413 4.229 1.00 0.00 O ATOM 0 H ASP A 195 57.605 -10.668 6.398 1.00 0.00 H new ATOM 0 HA ASP A 195 55.781 -10.080 7.546 1.00 0.00 H new ATOM 0 HB2 ASP A 195 54.697 -11.665 5.218 1.00 0.00 H new ATOM 0 HB3 ASP A 195 53.573 -11.185 6.474 1.00 0.00 H new ATOM 1096 N LEU A 196 56.207 -12.279 9.083 1.00 0.00 N ATOM 1097 CA LEU A 196 55.998 -13.213 10.192 1.00 0.00 C ATOM 1098 C LEU A 196 55.922 -14.654 9.688 1.00 0.00 C ATOM 1099 O LEU A 196 56.862 -15.428 9.875 1.00 0.00 O ATOM 1100 CB LEU A 196 54.730 -12.853 10.981 1.00 0.00 C ATOM 1101 CG LEU A 196 54.824 -11.409 11.481 1.00 0.00 C ATOM 1102 CD1 LEU A 196 53.468 -10.972 12.038 1.00 0.00 C ATOM 1103 CD2 LEU A 196 55.878 -11.318 12.587 1.00 0.00 C ATOM 0 H LEU A 196 57.114 -11.813 9.097 1.00 0.00 H new ATOM 0 HA LEU A 196 56.854 -13.130 10.862 1.00 0.00 H new ATOM 0 HB2 LEU A 196 53.851 -12.972 10.348 1.00 0.00 H new ATOM 0 HB3 LEU A 196 54.610 -13.533 11.825 1.00 0.00 H new ATOM 0 HG LEU A 196 55.106 -10.758 10.654 1.00 0.00 H new ATOM 0 HD11 LEU A 196 53.535 -9.944 12.394 1.00 0.00 H new ATOM 0 HD12 LEU A 196 52.715 -11.036 11.253 1.00 0.00 H new ATOM 0 HD13 LEU A 196 53.187 -11.625 12.865 1.00 0.00 H new ATOM 0 HD21 LEU A 196 55.944 -10.290 12.943 1.00 0.00 H new ATOM 0 HD22 LEU A 196 55.595 -11.970 13.413 1.00 0.00 H new ATOM 0 HD23 LEU A 196 56.846 -11.629 12.194 1.00 0.00 H new ATOM 1115 N ASN A 197 54.807 -15.009 9.055 1.00 0.00 N ATOM 1116 CA ASN A 197 54.634 -16.360 8.527 1.00 0.00 C ATOM 1117 C ASN A 197 55.246 -16.474 7.136 1.00 0.00 C ATOM 1118 O ASN A 197 56.262 -17.137 7.010 1.00 0.00 O ATOM 1119 CB ASN A 197 53.145 -16.707 8.462 1.00 0.00 C ATOM 1120 CG ASN A 197 52.535 -16.654 9.858 1.00 0.00 C ATOM 1121 OD1 ASN A 197 53.173 -17.056 10.832 1.00 0.00 O ATOM 1122 ND2 ASN A 197 51.329 -16.180 10.016 1.00 0.00 N ATOM 1123 OXT ASN A 197 54.691 -15.897 6.216 1.00 0.00 O ATOM 0 H ASN A 197 54.015 -14.386 8.896 1.00 0.00 H new ATOM 0 HA ASN A 197 55.142 -17.058 9.192 1.00 0.00 H new ATOM 0 HB2 ASN A 197 52.629 -16.008 7.804 1.00 0.00 H new ATOM 0 HB3 ASN A 197 53.013 -17.702 8.036 1.00 0.00 H new ATOM 0 HD21 ASN A 197 50.914 -16.142 10.947 1.00 0.00 H new ATOM 0 HD22 ASN A 197 50.802 -15.847 9.209 1.00 0.00 H new TER 1130 ASN A 197