USER MOD reduce.3.24.130724 H: found=0, std=0, add=525, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 525 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 41 THR OG1 : rot -63:sc= 1.42 USER MOD Set 1.2: A 45 SER OG : rot 98:sc= 0.726 USER MOD Set 2.1: A 30 SER OG : rot -63:sc= -0.435 USER MOD Set 2.2: A 33 ASN : amide:sc= -0.0206 X(o=-0.46,f=-0.7) USER MOD Set 3.1: A 15 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 THR N :NH3+ 167:sc= 0.00134 (180deg=0) USER MOD Single : A 1 THR OG1 : rot 180:sc= -0.659 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 HIS : no HD1:sc= -0.562 K(o=-0.56,f=-1.8!) USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=-0.0072) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.111) USER MOD Single : A 14 ASN :FLIP amide:sc= -1.61! F(o=-2.1,f=-1.6!) USER MOD Single : A 20 THR OG1 : rot 74:sc= 0.63 USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 25 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 29 HIS : no HD1:sc= -0.113 X(o=-0.11,f=-0.11) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.829 K(o=-0.83,f=-4.8!) USER MOD Single : A 39 SER OG : rot 78:sc= 1.26 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 42 ASN : amide:sc= -0.453 K(o=-0.45,f=-4.9!) USER MOD Single : A 46 ASN : amide:sc= -0.559 K(o=-0.56,f=-5.2!) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot -15:sc= -1.12 USER MOD Single : A 50 LYS NZ :NH3+ -152:sc= -0.148 (180deg=-1.05) USER MOD Single : A 52 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 LYS NZ :NH3+ -167:sc=-0.000515 (180deg=-0.188) USER MOD Single : A 63 ASN : amide:sc= -1.89 X(o=-1.9,f=-2.2!) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -3.349 -4.064 0.679 1.00 0.00 N ATOM 2 CA THR A 1 -1.885 -4.062 0.958 1.00 0.00 C ATOM 3 C THR A 1 -1.544 -2.852 1.829 1.00 0.00 C ATOM 4 O THR A 1 -2.321 -1.901 1.912 1.00 0.00 O ATOM 5 CB THR A 1 -1.120 -4.014 -0.381 1.00 0.00 C ATOM 6 OG1 THR A 1 -0.134 -5.051 -0.436 1.00 0.00 O ATOM 7 CG2 THR A 1 -0.434 -2.655 -0.556 1.00 0.00 C ATOM 0 H1 THR A 1 -3.557 -4.743 -0.081 1.00 0.00 H new ATOM 0 H2 THR A 1 -3.866 -4.338 1.539 1.00 0.00 H new ATOM 0 H3 THR A 1 -3.648 -3.112 0.384 1.00 0.00 H new ATOM 0 HA THR A 1 -1.595 -4.966 1.493 1.00 0.00 H new ATOM 0 HB THR A 1 -1.840 -4.162 -1.186 1.00 0.00 H new ATOM 0 HG1 THR A 1 0.340 -5.007 -1.293 1.00 0.00 H new ATOM 0 HG21 THR A 1 0.101 -2.637 -1.505 1.00 0.00 H new ATOM 0 HG22 THR A 1 -1.185 -1.865 -0.548 1.00 0.00 H new ATOM 0 HG23 THR A 1 0.270 -2.495 0.261 1.00 0.00 H new ATOM 17 N PRO A 2 -0.408 -2.873 2.479 1.00 0.00 N ATOM 18 CA PRO A 2 0.033 -1.756 3.365 1.00 0.00 C ATOM 19 C PRO A 2 0.479 -0.530 2.572 1.00 0.00 C ATOM 20 O PRO A 2 0.789 -0.625 1.385 1.00 0.00 O ATOM 21 CB PRO A 2 1.201 -2.357 4.148 1.00 0.00 C ATOM 22 CG PRO A 2 1.750 -3.434 3.274 1.00 0.00 C ATOM 23 CD PRO A 2 0.582 -3.961 2.438 1.00 0.00 C ATOM 0 HA PRO A 2 -0.774 -1.397 4.003 1.00 0.00 H new ATOM 0 HB2 PRO A 2 1.958 -1.603 4.365 1.00 0.00 H new ATOM 0 HB3 PRO A 2 0.867 -2.759 5.105 1.00 0.00 H new ATOM 0 HG2 PRO A 2 2.541 -3.046 2.632 1.00 0.00 H new ATOM 0 HG3 PRO A 2 2.188 -4.232 3.873 1.00 0.00 H new ATOM 0 HD2 PRO A 2 0.891 -4.181 1.416 1.00 0.00 H new ATOM 0 HD3 PRO A 2 0.178 -4.884 2.855 1.00 0.00 H new ATOM 31 N ILE A 3 0.507 0.620 3.238 1.00 0.00 N ATOM 32 CA ILE A 3 0.916 1.860 2.587 1.00 0.00 C ATOM 33 C ILE A 3 2.229 1.664 1.835 1.00 0.00 C ATOM 34 O ILE A 3 3.164 1.050 2.348 1.00 0.00 O ATOM 35 CB ILE A 3 1.084 2.966 3.630 1.00 0.00 C ATOM 36 CG1 ILE A 3 1.313 4.304 2.923 1.00 0.00 C ATOM 37 CG2 ILE A 3 2.287 2.650 4.521 1.00 0.00 C ATOM 38 CD1 ILE A 3 0.006 4.776 2.281 1.00 0.00 C ATOM 0 H ILE A 3 0.253 0.719 4.221 1.00 0.00 H new ATOM 0 HA ILE A 3 0.142 2.146 1.875 1.00 0.00 H new ATOM 0 HB ILE A 3 0.184 3.026 4.242 1.00 0.00 H new ATOM 0 HG12 ILE A 3 1.669 5.047 3.636 1.00 0.00 H new ATOM 0 HG13 ILE A 3 2.086 4.197 2.162 1.00 0.00 H new ATOM 0 HG21 ILE A 3 2.406 3.438 5.264 1.00 0.00 H new ATOM 0 HG22 ILE A 3 2.126 1.697 5.025 1.00 0.00 H new ATOM 0 HG23 ILE A 3 3.187 2.589 3.909 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.171 5.729 1.778 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -0.331 4.036 1.555 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.754 4.900 3.052 1.00 0.00 H new ATOM 50 N GLU A 4 2.289 2.189 0.615 1.00 0.00 N ATOM 51 CA GLU A 4 3.491 2.065 -0.201 1.00 0.00 C ATOM 52 C GLU A 4 4.617 2.926 0.363 1.00 0.00 C ATOM 53 O GLU A 4 4.395 3.755 1.246 1.00 0.00 O ATOM 54 CB GLU A 4 3.192 2.491 -1.640 1.00 0.00 C ATOM 55 CG GLU A 4 2.759 3.958 -1.658 1.00 0.00 C ATOM 56 CD GLU A 4 2.451 4.392 -3.087 1.00 0.00 C ATOM 57 OE1 GLU A 4 2.634 3.585 -3.983 1.00 0.00 O ATOM 58 OE2 GLU A 4 2.037 5.526 -3.265 1.00 0.00 O ATOM 0 H GLU A 4 1.525 2.701 0.173 1.00 0.00 H new ATOM 0 HA GLU A 4 3.808 1.022 -0.189 1.00 0.00 H new ATOM 0 HB2 GLU A 4 4.076 2.354 -2.262 1.00 0.00 H new ATOM 0 HB3 GLU A 4 2.406 1.864 -2.060 1.00 0.00 H new ATOM 0 HG2 GLU A 4 1.879 4.094 -1.030 1.00 0.00 H new ATOM 0 HG3 GLU A 4 3.548 4.584 -1.241 1.00 0.00 H new ATOM 65 N SER A 5 5.824 2.724 -0.154 1.00 0.00 N ATOM 66 CA SER A 5 6.980 3.487 0.304 1.00 0.00 C ATOM 67 C SER A 5 6.898 4.928 -0.188 1.00 0.00 C ATOM 68 O SER A 5 6.041 5.268 -1.003 1.00 0.00 O ATOM 69 CB SER A 5 8.267 2.843 -0.210 1.00 0.00 C ATOM 70 OG SER A 5 8.348 3.015 -1.619 1.00 0.00 O ATOM 0 H SER A 5 6.027 2.043 -0.886 1.00 0.00 H new ATOM 0 HA SER A 5 6.984 3.486 1.394 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.132 3.296 0.274 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.281 1.782 0.040 1.00 0.00 H new ATOM 0 HG SER A 5 9.173 2.605 -1.952 1.00 0.00 H new ATOM 76 N HIS A 6 7.795 5.772 0.313 1.00 0.00 N ATOM 77 CA HIS A 6 7.812 7.175 -0.083 1.00 0.00 C ATOM 78 C HIS A 6 7.811 7.301 -1.603 1.00 0.00 C ATOM 79 O HIS A 6 7.322 8.287 -2.153 1.00 0.00 O ATOM 80 CB HIS A 6 9.053 7.864 0.488 1.00 0.00 C ATOM 81 CG HIS A 6 10.281 7.337 -0.203 1.00 0.00 C ATOM 82 ND1 HIS A 6 10.742 7.866 -1.398 1.00 0.00 N ATOM 83 CD2 HIS A 6 11.155 6.329 0.122 1.00 0.00 C ATOM 84 CE1 HIS A 6 11.847 7.182 -1.746 1.00 0.00 C ATOM 85 NE2 HIS A 6 12.143 6.233 -0.853 1.00 0.00 N ATOM 0 H HIS A 6 8.514 5.511 0.988 1.00 0.00 H new ATOM 0 HA HIS A 6 6.917 7.656 0.311 1.00 0.00 H new ATOM 0 HB2 HIS A 6 8.979 8.943 0.350 1.00 0.00 H new ATOM 0 HB3 HIS A 6 9.121 7.684 1.561 1.00 0.00 H new ATOM 0 HD2 HIS A 6 11.086 5.705 1.001 1.00 0.00 H new ATOM 0 HE1 HIS A 6 12.424 7.376 -2.638 1.00 0.00 H new ATOM 0 HE2 HIS A 6 12.925 5.579 -0.880 1.00 0.00 H new ATOM 94 N GLN A 7 8.359 6.294 -2.275 1.00 0.00 N ATOM 95 CA GLN A 7 8.413 6.302 -3.732 1.00 0.00 C ATOM 96 C GLN A 7 7.019 6.100 -4.317 1.00 0.00 C ATOM 97 O GLN A 7 6.293 5.191 -3.916 1.00 0.00 O ATOM 98 CB GLN A 7 9.342 5.192 -4.228 1.00 0.00 C ATOM 99 CG GLN A 7 9.387 5.208 -5.757 1.00 0.00 C ATOM 100 CD GLN A 7 10.390 4.175 -6.260 1.00 0.00 C ATOM 101 OE1 GLN A 7 11.574 4.247 -5.930 1.00 0.00 O ATOM 102 NE2 GLN A 7 9.985 3.213 -7.043 1.00 0.00 N ATOM 0 H GLN A 7 8.769 5.468 -1.838 1.00 0.00 H new ATOM 0 HA GLN A 7 8.798 7.268 -4.058 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.344 5.334 -3.823 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.989 4.223 -3.874 1.00 0.00 H new ATOM 0 HG2 GLN A 7 8.398 4.993 -6.160 1.00 0.00 H new ATOM 0 HG3 GLN A 7 9.666 6.201 -6.110 1.00 0.00 H new ATOM 0 HE21 GLN A 7 9.004 3.156 -7.315 1.00 0.00 H new ATOM 0 HE22 GLN A 7 10.650 2.518 -7.383 1.00 0.00 H new ATOM 111 N VAL A 8 6.650 6.954 -5.266 1.00 0.00 N ATOM 112 CA VAL A 8 5.338 6.858 -5.895 1.00 0.00 C ATOM 113 C VAL A 8 5.450 7.052 -7.404 1.00 0.00 C ATOM 114 O VAL A 8 6.230 7.877 -7.879 1.00 0.00 O ATOM 115 CB VAL A 8 4.401 7.916 -5.312 1.00 0.00 C ATOM 116 CG1 VAL A 8 4.928 9.311 -5.654 1.00 0.00 C ATOM 117 CG2 VAL A 8 3.002 7.740 -5.906 1.00 0.00 C ATOM 0 H VAL A 8 7.235 7.714 -5.614 1.00 0.00 H new ATOM 0 HA VAL A 8 4.934 5.865 -5.697 1.00 0.00 H new ATOM 0 HB VAL A 8 4.354 7.802 -4.229 1.00 0.00 H new ATOM 0 HG11 VAL A 8 4.259 10.065 -5.238 1.00 0.00 H new ATOM 0 HG12 VAL A 8 5.925 9.437 -5.231 1.00 0.00 H new ATOM 0 HG13 VAL A 8 4.976 9.426 -6.737 1.00 0.00 H new ATOM 0 HG21 VAL A 8 2.333 8.494 -5.491 1.00 0.00 H new ATOM 0 HG22 VAL A 8 3.050 7.854 -6.989 1.00 0.00 H new ATOM 0 HG23 VAL A 8 2.625 6.747 -5.662 1.00 0.00 H new ATOM 127 N GLU A 9 4.662 6.286 -8.151 1.00 0.00 N ATOM 128 CA GLU A 9 4.676 6.380 -9.606 1.00 0.00 C ATOM 129 C GLU A 9 3.259 6.260 -10.160 1.00 0.00 C ATOM 130 O GLU A 9 2.951 5.339 -10.916 1.00 0.00 O ATOM 131 CB GLU A 9 5.561 5.278 -10.199 1.00 0.00 C ATOM 132 CG GLU A 9 5.506 4.031 -9.312 1.00 0.00 C ATOM 133 CD GLU A 9 4.057 3.609 -9.088 1.00 0.00 C ATOM 134 OE1 GLU A 9 3.474 3.054 -10.004 1.00 0.00 O ATOM 135 OE2 GLU A 9 3.552 3.847 -8.003 1.00 0.00 O ATOM 0 H GLU A 9 4.010 5.597 -7.776 1.00 0.00 H new ATOM 0 HA GLU A 9 5.083 7.352 -9.886 1.00 0.00 H new ATOM 0 HB2 GLU A 9 5.225 5.033 -11.207 1.00 0.00 H new ATOM 0 HB3 GLU A 9 6.589 5.631 -10.282 1.00 0.00 H new ATOM 0 HG2 GLU A 9 6.061 3.218 -9.780 1.00 0.00 H new ATOM 0 HG3 GLU A 9 5.985 4.235 -8.355 1.00 0.00 H new ATOM 142 N LYS A 10 2.399 7.197 -9.774 1.00 0.00 N ATOM 143 CA LYS A 10 1.015 7.187 -10.234 1.00 0.00 C ATOM 144 C LYS A 10 0.954 7.193 -11.758 1.00 0.00 C ATOM 145 O LYS A 10 1.857 7.700 -12.424 1.00 0.00 O ATOM 146 CB LYS A 10 0.274 8.408 -9.686 1.00 0.00 C ATOM 147 CG LYS A 10 0.924 9.686 -10.223 1.00 0.00 C ATOM 148 CD LYS A 10 0.199 10.906 -9.652 1.00 0.00 C ATOM 149 CE LYS A 10 0.851 12.184 -10.184 1.00 0.00 C ATOM 150 NZ LYS A 10 0.141 13.371 -9.629 1.00 0.00 N ATOM 0 H LYS A 10 2.634 7.968 -9.148 1.00 0.00 H new ATOM 0 HA LYS A 10 0.538 6.278 -9.868 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -0.775 8.371 -9.979 1.00 0.00 H new ATOM 0 HB3 LYS A 10 0.301 8.404 -8.596 1.00 0.00 H new ATOM 0 HG2 LYS A 10 1.978 9.714 -9.947 1.00 0.00 H new ATOM 0 HG3 LYS A 10 0.879 9.700 -11.312 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -0.854 10.880 -9.931 1.00 0.00 H new ATOM 0 HD3 LYS A 10 0.241 10.890 -8.563 1.00 0.00 H new ATOM 0 HE2 LYS A 10 1.904 12.212 -9.903 1.00 0.00 H new ATOM 0 HE3 LYS A 10 0.811 12.199 -11.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 0.583 14.240 -9.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -0.858 13.345 -9.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 0.201 13.357 -8.591 1.00 0.00 H new ATOM 164 N ARG A 11 -0.118 6.628 -12.302 1.00 0.00 N ATOM 165 CA ARG A 11 -0.290 6.573 -13.749 1.00 0.00 C ATOM 166 C ARG A 11 -1.763 6.721 -14.118 1.00 0.00 C ATOM 167 O ARG A 11 -2.624 6.824 -13.245 1.00 0.00 O ATOM 168 CB ARG A 11 0.263 5.255 -14.321 1.00 0.00 C ATOM 169 CG ARG A 11 -0.019 4.075 -13.374 1.00 0.00 C ATOM 170 CD ARG A 11 -1.522 3.794 -13.319 1.00 0.00 C ATOM 171 NE ARG A 11 -2.108 4.403 -12.129 1.00 0.00 N ATOM 172 CZ ARG A 11 -1.871 3.924 -10.906 1.00 0.00 C ATOM 173 NH1 ARG A 11 -1.097 2.882 -10.732 1.00 0.00 N ATOM 174 NH2 ARG A 11 -2.419 4.500 -9.871 1.00 0.00 N ATOM 0 H ARG A 11 -0.876 6.204 -11.767 1.00 0.00 H new ATOM 0 HA ARG A 11 0.270 7.401 -14.184 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -0.189 5.060 -15.294 1.00 0.00 H new ATOM 0 HB3 ARG A 11 1.337 5.347 -14.481 1.00 0.00 H new ATOM 0 HG2 ARG A 11 0.513 3.188 -13.718 1.00 0.00 H new ATOM 0 HG3 ARG A 11 0.353 4.303 -12.375 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -2.005 4.188 -14.213 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -1.698 2.718 -13.309 1.00 0.00 H new ATOM 0 HE ARG A 11 -2.715 5.216 -12.235 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -0.667 2.426 -11.537 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -0.924 2.526 -9.792 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -3.024 5.311 -10.000 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -2.242 4.139 -8.933 1.00 0.00 H new ATOM 188 N LYS A 12 -2.046 6.733 -15.417 1.00 0.00 N ATOM 189 CA LYS A 12 -3.419 6.873 -15.888 1.00 0.00 C ATOM 190 C LYS A 12 -3.778 5.737 -16.842 1.00 0.00 C ATOM 191 O LYS A 12 -2.896 5.155 -17.474 1.00 0.00 O ATOM 192 CB LYS A 12 -3.588 8.215 -16.604 1.00 0.00 C ATOM 193 CG LYS A 12 -2.687 8.252 -17.839 1.00 0.00 C ATOM 194 CD LYS A 12 -2.810 9.617 -18.521 1.00 0.00 C ATOM 195 CE LYS A 12 -1.808 9.707 -19.674 1.00 0.00 C ATOM 196 NZ LYS A 12 -2.239 8.807 -20.782 1.00 0.00 N ATOM 0 H LYS A 12 -1.349 6.648 -16.157 1.00 0.00 H new ATOM 0 HA LYS A 12 -4.086 6.832 -15.027 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -4.629 8.355 -16.896 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -3.333 9.033 -15.930 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -1.651 8.069 -17.552 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -2.970 7.460 -18.533 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -3.824 9.758 -18.895 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -2.623 10.413 -17.800 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -1.741 10.734 -20.032 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -0.814 9.424 -19.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -1.648 8.980 -21.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -2.135 7.816 -20.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -3.235 8.996 -21.015 1.00 0.00 H new ATOM 210 N CYS A 13 -5.083 5.449 -16.935 1.00 0.00 N ATOM 211 CA CYS A 13 -5.606 4.388 -17.806 1.00 0.00 C ATOM 212 C CYS A 13 -4.628 3.223 -17.947 1.00 0.00 C ATOM 213 O CYS A 13 -3.912 3.119 -18.943 1.00 0.00 O ATOM 214 CB CYS A 13 -5.909 4.962 -19.190 1.00 0.00 C ATOM 215 SG CYS A 13 -7.453 5.906 -19.125 1.00 0.00 S ATOM 0 H CYS A 13 -5.804 5.944 -16.410 1.00 0.00 H new ATOM 0 HA CYS A 13 -6.516 4.006 -17.344 1.00 0.00 H new ATOM 0 HB2 CYS A 13 -5.091 5.604 -19.517 1.00 0.00 H new ATOM 0 HB3 CYS A 13 -5.993 4.156 -19.920 1.00 0.00 H new ATOM 220 N ASN A 14 -4.605 2.351 -16.945 1.00 0.00 N ATOM 221 CA ASN A 14 -3.713 1.198 -16.968 1.00 0.00 C ATOM 222 C ASN A 14 -4.489 -0.071 -17.309 1.00 0.00 C ATOM 223 O ASN A 14 -4.135 -1.164 -16.868 1.00 0.00 O ATOM 224 CB ASN A 14 -3.037 1.032 -15.605 1.00 0.00 C ATOM 225 CG ASN A 14 -4.091 0.820 -14.524 1.00 0.00 C ATOM 226 OD1 ASN A 14 -4.197 1.681 -13.550 1.00 0.00 O flip ATOM 227 ND2 ASN A 14 -4.840 -0.156 -14.570 1.00 0.00 N flip ATOM 0 H ASN A 14 -5.190 2.420 -16.112 1.00 0.00 H new ATOM 0 HA ASN A 14 -2.954 1.365 -17.732 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -2.353 0.183 -15.630 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.441 1.915 -15.375 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -4.756 -0.828 -15.333 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -5.545 -0.292 -13.846 1.00 0.00 H new ATOM 234 N THR A 15 -5.549 0.082 -18.097 1.00 0.00 N ATOM 235 CA THR A 15 -6.367 -1.060 -18.490 1.00 0.00 C ATOM 236 C THR A 15 -6.910 -0.873 -19.904 1.00 0.00 C ATOM 237 O THR A 15 -7.139 0.252 -20.349 1.00 0.00 O ATOM 238 CB THR A 15 -7.531 -1.232 -17.510 1.00 0.00 C ATOM 239 OG1 THR A 15 -8.260 -2.404 -17.846 1.00 0.00 O ATOM 240 CG2 THR A 15 -8.453 -0.015 -17.589 1.00 0.00 C ATOM 0 H THR A 15 -5.860 0.978 -18.473 1.00 0.00 H new ATOM 0 HA THR A 15 -5.742 -1.953 -18.471 1.00 0.00 H new ATOM 0 HB THR A 15 -7.142 -1.323 -16.496 1.00 0.00 H new ATOM 0 HG1 THR A 15 -9.005 -2.517 -17.219 1.00 0.00 H new ATOM 0 HG21 THR A 15 -9.281 -0.140 -16.891 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.893 0.883 -17.331 1.00 0.00 H new ATOM 0 HG23 THR A 15 -8.844 0.080 -18.602 1.00 0.00 H new ATOM 248 N ALA A 16 -7.108 -1.984 -20.606 1.00 0.00 N ATOM 249 CA ALA A 16 -7.617 -1.942 -21.972 1.00 0.00 C ATOM 250 C ALA A 16 -9.012 -1.323 -22.023 1.00 0.00 C ATOM 251 O ALA A 16 -9.445 -0.837 -23.068 1.00 0.00 O ATOM 252 CB ALA A 16 -7.672 -3.358 -22.547 1.00 0.00 C ATOM 0 H ALA A 16 -6.924 -2.923 -20.252 1.00 0.00 H new ATOM 0 HA ALA A 16 -6.942 -1.325 -22.565 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -8.053 -3.322 -23.568 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -6.671 -3.789 -22.548 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -8.331 -3.974 -21.935 1.00 0.00 H new ATOM 258 N THR A 17 -9.714 -1.348 -20.895 1.00 0.00 N ATOM 259 CA THR A 17 -11.061 -0.791 -20.834 1.00 0.00 C ATOM 260 C THR A 17 -11.052 0.696 -21.177 1.00 0.00 C ATOM 261 O THR A 17 -11.953 1.190 -21.855 1.00 0.00 O ATOM 262 CB THR A 17 -11.646 -0.990 -19.433 1.00 0.00 C ATOM 263 OG1 THR A 17 -11.714 -2.379 -19.144 1.00 0.00 O ATOM 264 CG2 THR A 17 -13.050 -0.386 -19.375 1.00 0.00 C ATOM 0 H THR A 17 -9.377 -1.744 -20.018 1.00 0.00 H new ATOM 0 HA THR A 17 -11.678 -1.313 -21.565 1.00 0.00 H new ATOM 0 HB THR A 17 -11.010 -0.496 -18.699 1.00 0.00 H new ATOM 0 HG1 THR A 17 -12.087 -2.509 -18.247 1.00 0.00 H new ATOM 0 HG21 THR A 17 -13.466 -0.528 -18.378 1.00 0.00 H new ATOM 0 HG22 THR A 17 -12.997 0.680 -19.598 1.00 0.00 H new ATOM 0 HG23 THR A 17 -13.689 -0.879 -20.108 1.00 0.00 H new ATOM 272 N CYS A 18 -10.033 1.405 -20.704 1.00 0.00 N ATOM 273 CA CYS A 18 -9.927 2.836 -20.967 1.00 0.00 C ATOM 274 C CYS A 18 -9.879 3.108 -22.467 1.00 0.00 C ATOM 275 O CYS A 18 -10.598 3.968 -22.973 1.00 0.00 O ATOM 276 CB CYS A 18 -8.667 3.399 -20.306 1.00 0.00 C ATOM 277 SG CYS A 18 -8.547 5.171 -20.655 1.00 0.00 S ATOM 0 H CYS A 18 -9.275 1.017 -20.142 1.00 0.00 H new ATOM 0 HA CYS A 18 -10.807 3.325 -20.549 1.00 0.00 H new ATOM 0 HB2 CYS A 18 -8.701 3.230 -19.230 1.00 0.00 H new ATOM 0 HB3 CYS A 18 -7.784 2.882 -20.682 1.00 0.00 H new ATOM 282 N ALA A 19 -9.027 2.374 -23.173 1.00 0.00 N ATOM 283 CA ALA A 19 -8.899 2.553 -24.615 1.00 0.00 C ATOM 284 C ALA A 19 -10.212 2.222 -25.319 1.00 0.00 C ATOM 285 O ALA A 19 -10.640 2.936 -26.224 1.00 0.00 O ATOM 286 CB ALA A 19 -7.786 1.653 -25.156 1.00 0.00 C ATOM 0 H ALA A 19 -8.420 1.656 -22.776 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.651 3.596 -24.810 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -7.697 1.792 -26.233 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -6.842 1.914 -24.677 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.025 0.611 -24.944 1.00 0.00 H new ATOM 292 N THR A 20 -10.838 1.128 -24.904 1.00 0.00 N ATOM 293 CA THR A 20 -12.094 0.700 -25.509 1.00 0.00 C ATOM 294 C THR A 20 -13.086 1.858 -25.607 1.00 0.00 C ATOM 295 O THR A 20 -13.768 2.015 -26.619 1.00 0.00 O ATOM 296 CB THR A 20 -12.712 -0.429 -24.681 1.00 0.00 C ATOM 297 OG1 THR A 20 -11.813 -1.528 -24.637 1.00 0.00 O ATOM 298 CG2 THR A 20 -14.030 -0.870 -25.319 1.00 0.00 C ATOM 0 H THR A 20 -10.500 0.524 -24.155 1.00 0.00 H new ATOM 0 HA THR A 20 -11.877 0.346 -26.517 1.00 0.00 H new ATOM 0 HB THR A 20 -12.903 -0.075 -23.668 1.00 0.00 H new ATOM 0 HG1 THR A 20 -11.070 -1.319 -24.033 1.00 0.00 H new ATOM 0 HG21 THR A 20 -14.469 -1.674 -24.728 1.00 0.00 H new ATOM 0 HG22 THR A 20 -14.719 -0.026 -25.352 1.00 0.00 H new ATOM 0 HG23 THR A 20 -13.843 -1.225 -26.332 1.00 0.00 H new ATOM 306 N GLN A 21 -13.177 2.655 -24.548 1.00 0.00 N ATOM 307 CA GLN A 21 -14.107 3.781 -24.533 1.00 0.00 C ATOM 308 C GLN A 21 -13.522 5.011 -25.229 1.00 0.00 C ATOM 309 O GLN A 21 -14.265 5.859 -25.723 1.00 0.00 O ATOM 310 CB GLN A 21 -14.482 4.130 -23.088 1.00 0.00 C ATOM 311 CG GLN A 21 -13.619 5.293 -22.589 1.00 0.00 C ATOM 312 CD GLN A 21 -13.740 5.416 -21.074 1.00 0.00 C ATOM 313 OE1 GLN A 21 -13.219 4.577 -20.339 1.00 0.00 O ATOM 314 NE2 GLN A 21 -14.400 6.417 -20.560 1.00 0.00 N ATOM 0 H GLN A 21 -12.625 2.546 -23.697 1.00 0.00 H new ATOM 0 HA GLN A 21 -14.999 3.481 -25.083 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -15.537 4.399 -23.032 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -14.341 3.260 -22.447 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -12.578 5.130 -22.867 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -13.935 6.222 -23.064 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -14.831 7.111 -21.171 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -14.485 6.506 -19.547 1.00 0.00 H new ATOM 323 N ARG A 22 -12.196 5.119 -25.252 1.00 0.00 N ATOM 324 CA ARG A 22 -11.554 6.273 -25.878 1.00 0.00 C ATOM 325 C ARG A 22 -11.637 6.203 -27.404 1.00 0.00 C ATOM 326 O ARG A 22 -11.638 7.235 -28.076 1.00 0.00 O ATOM 327 CB ARG A 22 -10.090 6.394 -25.403 1.00 0.00 C ATOM 328 CG ARG A 22 -9.113 5.715 -26.375 1.00 0.00 C ATOM 329 CD ARG A 22 -8.658 6.718 -27.439 1.00 0.00 C ATOM 330 NE ARG A 22 -7.270 7.107 -27.206 1.00 0.00 N ATOM 331 CZ ARG A 22 -6.251 6.324 -27.565 1.00 0.00 C ATOM 332 NH1 ARG A 22 -6.464 5.168 -28.143 1.00 0.00 N ATOM 333 NH2 ARG A 22 -5.027 6.715 -27.339 1.00 0.00 N ATOM 0 H ARG A 22 -11.554 4.435 -24.852 1.00 0.00 H new ATOM 0 HA ARG A 22 -12.092 7.169 -25.569 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -9.827 7.447 -25.301 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -9.991 5.944 -24.415 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -8.250 5.333 -25.830 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -9.594 4.860 -26.850 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -8.758 6.277 -28.431 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -9.299 7.599 -27.416 1.00 0.00 H new ATOM 0 HE ARG A 22 -7.074 8.001 -26.757 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -7.418 4.856 -28.324 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -5.676 4.579 -28.412 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -4.854 7.614 -26.890 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -4.244 6.121 -27.611 1.00 0.00 H new ATOM 347 N LEU A 23 -11.708 4.993 -27.952 1.00 0.00 N ATOM 348 CA LEU A 23 -11.790 4.839 -29.400 1.00 0.00 C ATOM 349 C LEU A 23 -13.234 4.967 -29.875 1.00 0.00 C ATOM 350 O LEU A 23 -13.488 5.390 -31.002 1.00 0.00 O ATOM 351 CB LEU A 23 -11.205 3.489 -29.835 1.00 0.00 C ATOM 352 CG LEU A 23 -12.110 2.345 -29.375 1.00 0.00 C ATOM 353 CD1 LEU A 23 -12.981 1.876 -30.545 1.00 0.00 C ATOM 354 CD2 LEU A 23 -11.243 1.180 -28.893 1.00 0.00 C ATOM 0 H LEU A 23 -11.710 4.119 -27.426 1.00 0.00 H new ATOM 0 HA LEU A 23 -11.203 5.635 -29.859 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.098 3.464 -30.919 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.207 3.365 -29.414 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.749 2.691 -28.563 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -13.625 1.061 -30.215 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -13.596 2.705 -30.896 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -12.343 1.528 -31.357 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -11.883 0.362 -28.564 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -10.607 0.837 -29.709 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -10.620 1.510 -28.062 1.00 0.00 H new ATOM 366 N ALA A 24 -14.175 4.594 -29.015 1.00 0.00 N ATOM 367 CA ALA A 24 -15.587 4.668 -29.369 1.00 0.00 C ATOM 368 C ALA A 24 -15.974 6.095 -29.744 1.00 0.00 C ATOM 369 O ALA A 24 -16.583 6.326 -30.788 1.00 0.00 O ATOM 370 CB ALA A 24 -16.446 4.198 -28.193 1.00 0.00 C ATOM 0 H ALA A 24 -13.988 4.241 -28.077 1.00 0.00 H new ATOM 0 HA ALA A 24 -15.759 4.020 -30.228 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -17.500 4.256 -28.466 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -16.192 3.167 -27.946 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -16.259 4.835 -27.328 1.00 0.00 H new ATOM 376 N ASN A 25 -15.619 7.048 -28.888 1.00 0.00 N ATOM 377 CA ASN A 25 -15.938 8.448 -29.143 1.00 0.00 C ATOM 378 C ASN A 25 -15.230 8.948 -30.398 1.00 0.00 C ATOM 379 O ASN A 25 -15.817 9.663 -31.210 1.00 0.00 O ATOM 380 CB ASN A 25 -15.517 9.303 -27.946 1.00 0.00 C ATOM 381 CG ASN A 25 -16.029 10.729 -28.118 1.00 0.00 C ATOM 382 OD1 ASN A 25 -17.181 10.934 -28.502 1.00 0.00 O ATOM 383 ND2 ASN A 25 -15.238 11.732 -27.856 1.00 0.00 N ATOM 0 H ASN A 25 -15.114 6.878 -28.018 1.00 0.00 H new ATOM 0 HA ASN A 25 -17.014 8.530 -29.294 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -15.913 8.874 -27.025 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -14.431 9.306 -27.855 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -15.573 12.689 -27.969 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -14.284 11.560 -27.538 1.00 0.00 H new ATOM 390 N PHE A 26 -13.964 8.573 -30.547 1.00 0.00 N ATOM 391 CA PHE A 26 -13.184 8.996 -31.704 1.00 0.00 C ATOM 392 C PHE A 26 -13.796 8.466 -32.998 1.00 0.00 C ATOM 393 O PHE A 26 -13.817 9.158 -34.014 1.00 0.00 O ATOM 394 CB PHE A 26 -11.744 8.495 -31.574 1.00 0.00 C ATOM 395 CG PHE A 26 -10.943 8.949 -32.771 1.00 0.00 C ATOM 396 CD1 PHE A 26 -10.471 10.265 -32.839 1.00 0.00 C ATOM 397 CD2 PHE A 26 -10.672 8.053 -33.813 1.00 0.00 C ATOM 398 CE1 PHE A 26 -9.729 10.686 -33.949 1.00 0.00 C ATOM 399 CE2 PHE A 26 -9.930 8.474 -34.923 1.00 0.00 C ATOM 400 CZ PHE A 26 -9.458 9.791 -34.991 1.00 0.00 C ATOM 0 H PHE A 26 -13.459 7.982 -29.887 1.00 0.00 H new ATOM 0 HA PHE A 26 -13.190 10.085 -31.739 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -11.296 8.878 -30.657 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -11.731 7.407 -31.506 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -10.679 10.956 -32.035 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -11.035 7.037 -33.760 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -9.365 11.702 -34.002 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -9.722 7.783 -35.727 1.00 0.00 H new ATOM 0 HZ PHE A 26 -8.885 10.116 -35.847 1.00 0.00 H new ATOM 410 N LEU A 27 -14.283 7.230 -32.955 1.00 0.00 N ATOM 411 CA LEU A 27 -14.883 6.610 -34.132 1.00 0.00 C ATOM 412 C LEU A 27 -16.175 7.329 -34.517 1.00 0.00 C ATOM 413 O LEU A 27 -16.287 7.881 -35.612 1.00 0.00 O ATOM 414 CB LEU A 27 -15.158 5.122 -33.831 1.00 0.00 C ATOM 415 CG LEU A 27 -15.866 4.399 -35.000 1.00 0.00 C ATOM 416 CD1 LEU A 27 -17.391 4.564 -34.892 1.00 0.00 C ATOM 417 CD2 LEU A 27 -15.377 4.933 -36.355 1.00 0.00 C ATOM 0 H LEU A 27 -14.274 6.640 -32.123 1.00 0.00 H new ATOM 0 HA LEU A 27 -14.195 6.688 -34.974 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -14.216 4.619 -33.615 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -15.773 5.044 -32.935 1.00 0.00 H new ATOM 0 HG LEU A 27 -15.618 3.339 -34.936 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -17.872 4.049 -35.723 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -17.737 4.137 -33.951 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -17.646 5.623 -34.926 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -15.891 4.408 -37.160 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -15.590 6.000 -36.424 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -14.303 4.771 -36.444 1.00 0.00 H new ATOM 429 N VAL A 28 -17.150 7.319 -33.614 1.00 0.00 N ATOM 430 CA VAL A 28 -18.431 7.967 -33.878 1.00 0.00 C ATOM 431 C VAL A 28 -18.243 9.435 -34.252 1.00 0.00 C ATOM 432 O VAL A 28 -19.123 10.044 -34.860 1.00 0.00 O ATOM 433 CB VAL A 28 -19.331 7.869 -32.644 1.00 0.00 C ATOM 434 CG1 VAL A 28 -19.528 6.399 -32.267 1.00 0.00 C ATOM 435 CG2 VAL A 28 -18.681 8.614 -31.475 1.00 0.00 C ATOM 0 H VAL A 28 -17.080 6.873 -32.699 1.00 0.00 H new ATOM 0 HA VAL A 28 -18.898 7.453 -34.718 1.00 0.00 H new ATOM 0 HB VAL A 28 -20.299 8.318 -32.867 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -20.169 6.332 -31.388 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -19.994 5.870 -33.098 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -18.561 5.947 -32.046 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -19.323 8.544 -30.597 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -17.712 8.168 -31.253 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -18.545 9.662 -31.742 1.00 0.00 H new ATOM 445 N HIS A 29 -17.100 10.004 -33.878 1.00 0.00 N ATOM 446 CA HIS A 29 -16.829 11.406 -34.176 1.00 0.00 C ATOM 447 C HIS A 29 -15.981 11.549 -35.437 1.00 0.00 C ATOM 448 O HIS A 29 -15.971 12.604 -36.071 1.00 0.00 O ATOM 449 CB HIS A 29 -16.103 12.056 -32.996 1.00 0.00 C ATOM 450 CG HIS A 29 -15.785 13.488 -33.330 1.00 0.00 C ATOM 451 ND1 HIS A 29 -16.763 14.469 -33.382 1.00 0.00 N ATOM 452 CD2 HIS A 29 -14.604 14.119 -33.630 1.00 0.00 C ATOM 453 CE1 HIS A 29 -16.158 15.628 -33.703 1.00 0.00 C ATOM 454 NE2 HIS A 29 -14.841 15.470 -33.865 1.00 0.00 N ATOM 0 H HIS A 29 -16.355 9.522 -33.374 1.00 0.00 H new ATOM 0 HA HIS A 29 -17.783 11.906 -34.345 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -16.725 12.009 -32.102 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -15.186 11.511 -32.775 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -13.637 13.640 -33.677 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -16.674 16.570 -33.816 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -14.156 16.186 -34.109 1.00 0.00 H new ATOM 463 N SER A 30 -15.266 10.486 -35.792 1.00 0.00 N ATOM 464 CA SER A 30 -14.411 10.510 -36.974 1.00 0.00 C ATOM 465 C SER A 30 -15.114 9.890 -38.179 1.00 0.00 C ATOM 466 O SER A 30 -14.465 9.507 -39.152 1.00 0.00 O ATOM 467 CB SER A 30 -13.116 9.748 -36.693 1.00 0.00 C ATOM 468 OG SER A 30 -12.213 9.939 -37.775 1.00 0.00 O ATOM 0 H SER A 30 -15.261 9.603 -35.282 1.00 0.00 H new ATOM 0 HA SER A 30 -14.186 11.551 -37.205 1.00 0.00 H new ATOM 0 HB2 SER A 30 -12.668 10.100 -35.764 1.00 0.00 H new ATOM 0 HB3 SER A 30 -13.326 8.686 -36.563 1.00 0.00 H new ATOM 0 HG SER A 30 -12.599 9.563 -38.594 1.00 0.00 H new ATOM 474 N SER A 31 -16.440 9.797 -38.119 1.00 0.00 N ATOM 475 CA SER A 31 -17.195 9.225 -39.228 1.00 0.00 C ATOM 476 C SER A 31 -16.867 9.971 -40.517 1.00 0.00 C ATOM 477 O SER A 31 -16.499 9.367 -41.523 1.00 0.00 O ATOM 478 CB SER A 31 -18.695 9.324 -38.945 1.00 0.00 C ATOM 479 OG SER A 31 -19.417 8.818 -40.060 1.00 0.00 O ATOM 0 H SER A 31 -17.005 10.105 -37.328 1.00 0.00 H new ATOM 0 HA SER A 31 -16.920 8.176 -39.339 1.00 0.00 H new ATOM 0 HB2 SER A 31 -18.946 8.758 -38.048 1.00 0.00 H new ATOM 0 HB3 SER A 31 -18.974 10.361 -38.757 1.00 0.00 H new ATOM 0 HG SER A 31 -20.379 8.878 -39.882 1.00 0.00 H new ATOM 485 N ASN A 32 -17.007 11.292 -40.469 1.00 0.00 N ATOM 486 CA ASN A 32 -16.725 12.131 -41.630 1.00 0.00 C ATOM 487 C ASN A 32 -15.381 11.755 -42.245 1.00 0.00 C ATOM 488 O ASN A 32 -15.282 11.516 -43.449 1.00 0.00 O ATOM 489 CB ASN A 32 -16.702 13.603 -41.215 1.00 0.00 C ATOM 490 CG ASN A 32 -15.878 13.775 -39.943 1.00 0.00 C ATOM 491 OD1 ASN A 32 -16.261 13.283 -38.882 1.00 0.00 O ATOM 492 ND2 ASN A 32 -14.761 14.448 -39.987 1.00 0.00 N ATOM 0 H ASN A 32 -17.313 11.804 -39.642 1.00 0.00 H new ATOM 0 HA ASN A 32 -17.510 11.974 -42.370 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -16.279 14.208 -42.017 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -17.719 13.958 -41.050 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -14.204 14.567 -39.141 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -14.445 14.855 -40.867 1.00 0.00 H new ATOM 499 N ASN A 33 -14.352 11.703 -41.408 1.00 0.00 N ATOM 500 CA ASN A 33 -13.015 11.354 -41.873 1.00 0.00 C ATOM 501 C ASN A 33 -12.996 9.948 -42.465 1.00 0.00 C ATOM 502 O ASN A 33 -12.339 9.705 -43.477 1.00 0.00 O ATOM 503 CB ASN A 33 -12.021 11.434 -40.712 1.00 0.00 C ATOM 504 CG ASN A 33 -11.778 12.891 -40.333 1.00 0.00 C ATOM 505 OD1 ASN A 33 -12.075 13.300 -39.211 1.00 0.00 O ATOM 506 ND2 ASN A 33 -11.252 13.704 -41.209 1.00 0.00 N ATOM 0 H ASN A 33 -14.417 11.897 -40.409 1.00 0.00 H new ATOM 0 HA ASN A 33 -12.728 12.063 -42.649 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -12.408 10.886 -39.853 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -11.080 10.961 -40.995 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -11.087 14.680 -40.964 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -11.007 13.363 -42.138 1.00 0.00 H new ATOM 513 N PHE A 34 -13.710 9.024 -41.832 1.00 0.00 N ATOM 514 CA PHE A 34 -13.751 7.648 -42.315 1.00 0.00 C ATOM 515 C PHE A 34 -14.157 7.606 -43.785 1.00 0.00 C ATOM 516 O PHE A 34 -13.622 6.817 -44.564 1.00 0.00 O ATOM 517 CB PHE A 34 -14.744 6.831 -41.486 1.00 0.00 C ATOM 518 CG PHE A 34 -14.662 5.378 -41.888 1.00 0.00 C ATOM 519 CD1 PHE A 34 -13.636 4.570 -41.386 1.00 0.00 C ATOM 520 CD2 PHE A 34 -15.614 4.839 -42.762 1.00 0.00 C ATOM 521 CE1 PHE A 34 -13.560 3.222 -41.758 1.00 0.00 C ATOM 522 CE2 PHE A 34 -15.539 3.492 -43.134 1.00 0.00 C ATOM 523 CZ PHE A 34 -14.512 2.683 -42.632 1.00 0.00 C ATOM 0 H PHE A 34 -14.263 9.199 -40.993 1.00 0.00 H new ATOM 0 HA PHE A 34 -12.754 7.219 -42.213 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -14.522 6.938 -40.424 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -15.756 7.205 -41.640 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -12.902 4.986 -40.711 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -16.406 5.463 -43.149 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -12.768 2.599 -41.371 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -16.273 3.076 -43.808 1.00 0.00 H new ATOM 0 HZ PHE A 34 -14.454 1.643 -42.919 1.00 0.00 H new ATOM 533 N GLY A 35 -15.100 8.464 -44.159 1.00 0.00 N ATOM 534 CA GLY A 35 -15.563 8.518 -45.541 1.00 0.00 C ATOM 535 C GLY A 35 -14.433 8.953 -46.468 1.00 0.00 C ATOM 536 O GLY A 35 -14.243 8.388 -47.545 1.00 0.00 O ATOM 0 H GLY A 35 -15.555 9.126 -43.531 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -15.934 7.539 -45.845 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -16.397 9.214 -45.624 1.00 0.00 H new ATOM 540 N ALA A 36 -13.693 9.969 -46.037 1.00 0.00 N ATOM 541 CA ALA A 36 -12.584 10.491 -46.828 1.00 0.00 C ATOM 542 C ALA A 36 -11.546 9.404 -47.090 1.00 0.00 C ATOM 543 O ALA A 36 -11.036 9.277 -48.203 1.00 0.00 O ATOM 544 CB ALA A 36 -11.926 11.660 -46.095 1.00 0.00 C ATOM 0 H ALA A 36 -13.840 10.446 -45.148 1.00 0.00 H new ATOM 0 HA ALA A 36 -12.978 10.835 -47.784 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -11.099 12.044 -46.692 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -12.660 12.451 -45.939 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -11.550 11.319 -45.130 1.00 0.00 H new ATOM 550 N ILE A 37 -11.236 8.623 -46.061 1.00 0.00 N ATOM 551 CA ILE A 37 -10.254 7.552 -46.200 1.00 0.00 C ATOM 552 C ILE A 37 -10.766 6.463 -47.139 1.00 0.00 C ATOM 553 O ILE A 37 -10.048 6.019 -48.035 1.00 0.00 O ATOM 554 CB ILE A 37 -9.939 6.945 -44.831 1.00 0.00 C ATOM 555 CG1 ILE A 37 -9.132 7.946 -44.000 1.00 0.00 C ATOM 556 CG2 ILE A 37 -9.124 5.664 -45.016 1.00 0.00 C ATOM 557 CD1 ILE A 37 -9.069 7.470 -42.548 1.00 0.00 C ATOM 0 H ILE A 37 -11.645 8.709 -45.131 1.00 0.00 H new ATOM 0 HA ILE A 37 -9.345 7.978 -46.624 1.00 0.00 H new ATOM 0 HB ILE A 37 -10.871 6.713 -44.315 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -8.125 8.044 -44.406 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -9.593 8.932 -44.051 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -8.900 5.232 -44.041 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -9.698 4.950 -45.606 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -8.193 5.897 -45.533 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -8.494 8.183 -41.956 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -10.079 7.395 -42.146 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -8.588 6.493 -42.506 1.00 0.00 H new ATOM 569 N LEU A 38 -12.006 6.032 -46.928 1.00 0.00 N ATOM 570 CA LEU A 38 -12.590 4.989 -47.765 1.00 0.00 C ATOM 571 C LEU A 38 -12.607 5.424 -49.227 1.00 0.00 C ATOM 572 O LEU A 38 -12.248 4.656 -50.119 1.00 0.00 O ATOM 573 CB LEU A 38 -14.018 4.686 -47.298 1.00 0.00 C ATOM 574 CG LEU A 38 -14.639 3.595 -48.178 1.00 0.00 C ATOM 575 CD1 LEU A 38 -13.850 2.293 -48.020 1.00 0.00 C ATOM 576 CD2 LEU A 38 -16.089 3.363 -47.747 1.00 0.00 C ATOM 0 H LEU A 38 -12.620 6.384 -46.193 1.00 0.00 H new ATOM 0 HA LEU A 38 -11.981 4.089 -47.675 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -14.008 4.363 -46.257 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -14.624 5.591 -47.345 1.00 0.00 H new ATOM 0 HG LEU A 38 -14.610 3.911 -49.221 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -14.294 1.520 -48.647 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -12.816 2.455 -48.323 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -13.877 1.975 -46.978 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -16.534 2.588 -48.370 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -16.113 3.048 -46.704 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -16.654 4.288 -47.859 1.00 0.00 H new ATOM 588 N SER A 39 -13.033 6.659 -49.465 1.00 0.00 N ATOM 589 CA SER A 39 -13.102 7.186 -50.823 1.00 0.00 C ATOM 590 C SER A 39 -11.790 6.945 -51.563 1.00 0.00 C ATOM 591 O SER A 39 -11.774 6.794 -52.784 1.00 0.00 O ATOM 592 CB SER A 39 -13.399 8.685 -50.786 1.00 0.00 C ATOM 593 OG SER A 39 -14.670 8.897 -50.185 1.00 0.00 O ATOM 0 H SER A 39 -13.334 7.311 -48.740 1.00 0.00 H new ATOM 0 HA SER A 39 -13.903 6.668 -51.351 1.00 0.00 H new ATOM 0 HB2 SER A 39 -12.626 9.207 -50.222 1.00 0.00 H new ATOM 0 HB3 SER A 39 -13.389 9.095 -51.796 1.00 0.00 H new ATOM 0 HG SER A 39 -14.590 8.810 -49.212 1.00 0.00 H new ATOM 599 N SER A 40 -10.691 6.912 -50.815 1.00 0.00 N ATOM 600 CA SER A 40 -9.378 6.692 -51.413 1.00 0.00 C ATOM 601 C SER A 40 -9.007 5.212 -51.373 1.00 0.00 C ATOM 602 O SER A 40 -7.837 4.861 -51.219 1.00 0.00 O ATOM 603 CB SER A 40 -8.322 7.504 -50.663 1.00 0.00 C ATOM 604 OG SER A 40 -8.611 8.889 -50.800 1.00 0.00 O ATOM 0 H SER A 40 -10.682 7.034 -49.802 1.00 0.00 H new ATOM 0 HA SER A 40 -9.416 7.015 -52.453 1.00 0.00 H new ATOM 0 HB2 SER A 40 -8.313 7.225 -49.609 1.00 0.00 H new ATOM 0 HB3 SER A 40 -7.330 7.287 -51.059 1.00 0.00 H new ATOM 0 HG SER A 40 -7.937 9.413 -50.319 1.00 0.00 H new ATOM 610 N THR A 41 -10.008 4.349 -51.513 1.00 0.00 N ATOM 611 CA THR A 41 -9.769 2.910 -51.491 1.00 0.00 C ATOM 612 C THR A 41 -9.555 2.379 -52.906 1.00 0.00 C ATOM 613 O THR A 41 -9.894 1.235 -53.207 1.00 0.00 O ATOM 614 CB THR A 41 -10.959 2.191 -50.849 1.00 0.00 C ATOM 615 OG1 THR A 41 -10.646 0.815 -50.686 1.00 0.00 O ATOM 616 CG2 THR A 41 -12.191 2.335 -51.744 1.00 0.00 C ATOM 0 H THR A 41 -10.984 4.617 -51.642 1.00 0.00 H new ATOM 0 HA THR A 41 -8.870 2.720 -50.904 1.00 0.00 H new ATOM 0 HB THR A 41 -11.169 2.634 -49.876 1.00 0.00 H new ATOM 0 HG1 THR A 41 -10.497 0.407 -51.565 1.00 0.00 H new ATOM 0 HG21 THR A 41 -13.036 1.822 -51.285 1.00 0.00 H new ATOM 0 HG22 THR A 41 -12.430 3.391 -51.867 1.00 0.00 H new ATOM 0 HG23 THR A 41 -11.986 1.894 -52.719 1.00 0.00 H new ATOM 624 N ASN A 42 -8.991 3.217 -53.770 1.00 0.00 N ATOM 625 CA ASN A 42 -8.737 2.818 -55.150 1.00 0.00 C ATOM 626 C ASN A 42 -7.316 2.282 -55.305 1.00 0.00 C ATOM 627 O ASN A 42 -6.755 2.295 -56.401 1.00 0.00 O ATOM 628 CB ASN A 42 -8.938 4.013 -56.084 1.00 0.00 C ATOM 629 CG ASN A 42 -7.833 5.040 -55.863 1.00 0.00 C ATOM 630 OD1 ASN A 42 -7.147 5.005 -54.841 1.00 0.00 O ATOM 631 ND2 ASN A 42 -7.617 5.957 -56.765 1.00 0.00 N ATOM 0 H ASN A 42 -8.703 4.169 -53.542 1.00 0.00 H new ATOM 0 HA ASN A 42 -9.440 2.027 -55.413 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -8.933 3.679 -57.122 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -9.911 4.469 -55.901 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -6.879 6.647 -56.624 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -8.186 5.984 -57.611 1.00 0.00 H new ATOM 638 N VAL A 43 -6.740 1.811 -54.203 1.00 0.00 N ATOM 639 CA VAL A 43 -5.384 1.272 -54.231 1.00 0.00 C ATOM 640 C VAL A 43 -5.401 -0.225 -54.540 1.00 0.00 C ATOM 641 O VAL A 43 -4.434 -0.935 -54.266 1.00 0.00 O ATOM 642 CB VAL A 43 -4.704 1.520 -52.880 1.00 0.00 C ATOM 643 CG1 VAL A 43 -5.211 0.503 -51.852 1.00 0.00 C ATOM 644 CG2 VAL A 43 -3.184 1.385 -53.033 1.00 0.00 C ATOM 0 H VAL A 43 -7.187 1.791 -53.286 1.00 0.00 H new ATOM 0 HA VAL A 43 -4.824 1.777 -55.018 1.00 0.00 H new ATOM 0 HB VAL A 43 -4.943 2.527 -52.538 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.725 0.682 -50.893 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -6.290 0.608 -51.738 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.979 -0.506 -52.193 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -2.704 1.562 -52.070 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -2.941 0.381 -53.380 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.825 2.116 -53.757 1.00 0.00 H new ATOM 654 N GLY A 44 -6.502 -0.702 -55.116 1.00 0.00 N ATOM 655 CA GLY A 44 -6.622 -2.116 -55.454 1.00 0.00 C ATOM 656 C GLY A 44 -7.675 -2.803 -54.588 1.00 0.00 C ATOM 657 O GLY A 44 -8.164 -3.879 -54.932 1.00 0.00 O ATOM 0 H GLY A 44 -7.316 -0.136 -55.356 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -6.888 -2.220 -56.506 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -5.659 -2.608 -55.319 1.00 0.00 H new ATOM 661 N SER A 45 -8.021 -2.179 -53.465 1.00 0.00 N ATOM 662 CA SER A 45 -9.019 -2.746 -52.565 1.00 0.00 C ATOM 663 C SER A 45 -10.410 -2.220 -52.905 1.00 0.00 C ATOM 664 O SER A 45 -11.296 -2.184 -52.052 1.00 0.00 O ATOM 665 CB SER A 45 -8.676 -2.393 -51.118 1.00 0.00 C ATOM 666 OG SER A 45 -8.692 -0.980 -50.963 1.00 0.00 O ATOM 0 H SER A 45 -7.629 -1.289 -53.159 1.00 0.00 H new ATOM 0 HA SER A 45 -9.015 -3.829 -52.685 1.00 0.00 H new ATOM 0 HB2 SER A 45 -9.394 -2.853 -50.439 1.00 0.00 H new ATOM 0 HB3 SER A 45 -7.694 -2.788 -50.858 1.00 0.00 H new ATOM 0 HG SER A 45 -9.551 -0.703 -50.581 1.00 0.00 H new ATOM 672 N ASN A 46 -10.595 -1.811 -54.157 1.00 0.00 N ATOM 673 CA ASN A 46 -11.882 -1.287 -54.599 1.00 0.00 C ATOM 674 C ASN A 46 -12.702 -2.378 -55.279 1.00 0.00 C ATOM 675 O ASN A 46 -13.546 -2.095 -56.130 1.00 0.00 O ATOM 676 CB ASN A 46 -11.668 -0.127 -55.574 1.00 0.00 C ATOM 677 CG ASN A 46 -11.057 -0.643 -56.872 1.00 0.00 C ATOM 678 OD1 ASN A 46 -10.593 -1.782 -56.932 1.00 0.00 O ATOM 679 ND2 ASN A 46 -11.029 0.131 -57.922 1.00 0.00 N ATOM 0 H ASN A 46 -9.875 -1.832 -54.879 1.00 0.00 H new ATOM 0 HA ASN A 46 -12.426 -0.931 -53.724 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -12.618 0.366 -55.780 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -11.013 0.620 -55.126 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -10.622 -0.207 -58.794 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -11.414 1.074 -57.871 1.00 0.00 H new ATOM 686 N THR A 47 -12.448 -3.627 -54.900 1.00 0.00 N ATOM 687 CA THR A 47 -13.170 -4.754 -55.482 1.00 0.00 C ATOM 688 C THR A 47 -14.459 -5.038 -54.711 1.00 0.00 C ATOM 689 O THR A 47 -15.019 -6.130 -54.808 1.00 0.00 O ATOM 690 CB THR A 47 -12.284 -6.002 -55.471 1.00 0.00 C ATOM 691 OG1 THR A 47 -10.933 -5.623 -55.695 1.00 0.00 O ATOM 692 CG2 THR A 47 -12.737 -6.961 -56.572 1.00 0.00 C ATOM 0 H THR A 47 -11.754 -3.883 -54.198 1.00 0.00 H new ATOM 0 HA THR A 47 -13.430 -4.496 -56.509 1.00 0.00 H new ATOM 0 HB THR A 47 -12.367 -6.499 -54.504 1.00 0.00 H new ATOM 0 HG1 THR A 47 -10.364 -6.421 -55.687 1.00 0.00 H new ATOM 0 HG21 THR A 47 -12.105 -7.849 -56.563 1.00 0.00 H new ATOM 0 HG22 THR A 47 -13.773 -7.251 -56.398 1.00 0.00 H new ATOM 0 HG23 THR A 47 -12.656 -6.468 -57.540 1.00 0.00 H new ATOM 700 N TYR A 48 -14.929 -4.051 -53.951 1.00 0.00 N ATOM 701 CA TYR A 48 -16.154 -4.214 -53.177 1.00 0.00 C ATOM 702 C TYR A 48 -17.226 -3.238 -53.658 1.00 0.00 C ATOM 703 O TYR A 48 -18.159 -2.914 -52.923 1.00 0.00 O ATOM 704 CB TYR A 48 -15.867 -3.975 -51.692 1.00 0.00 C ATOM 705 CG TYR A 48 -15.714 -2.494 -51.434 1.00 0.00 C ATOM 706 CD1 TYR A 48 -16.723 -1.791 -50.765 1.00 0.00 C ATOM 707 CD2 TYR A 48 -14.562 -1.824 -51.865 1.00 0.00 C ATOM 708 CE1 TYR A 48 -16.582 -0.419 -50.527 1.00 0.00 C ATOM 709 CE2 TYR A 48 -14.421 -0.451 -51.626 1.00 0.00 C ATOM 710 CZ TYR A 48 -15.431 0.251 -50.957 1.00 0.00 C ATOM 711 OH TYR A 48 -15.292 1.604 -50.723 1.00 0.00 O ATOM 0 H TYR A 48 -14.484 -3.138 -53.856 1.00 0.00 H new ATOM 0 HA TYR A 48 -16.519 -5.231 -53.316 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -16.678 -4.377 -51.086 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -14.959 -4.501 -51.398 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -17.611 -2.308 -50.432 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -13.783 -2.366 -52.381 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -17.361 0.123 -50.012 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -13.533 0.066 -51.958 1.00 0.00 H new ATOM 0 HH TYR A 48 -16.160 1.984 -50.474 1.00 0.00 H new ATOM 721 N GLY A 49 -17.089 -2.775 -54.898 1.00 0.00 N ATOM 722 CA GLY A 49 -18.051 -1.837 -55.464 1.00 0.00 C ATOM 723 C GLY A 49 -19.456 -2.430 -55.467 1.00 0.00 C ATOM 724 O GLY A 49 -19.627 -3.648 -55.497 1.00 0.00 O ATOM 0 H GLY A 49 -16.327 -3.032 -55.525 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -18.044 -0.912 -54.888 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -17.758 -1.581 -56.482 1.00 0.00 H new ATOM 728 N LYS A 50 -20.457 -1.557 -55.436 1.00 0.00 N ATOM 729 CA LYS A 50 -21.846 -2.001 -55.435 1.00 0.00 C ATOM 730 C LYS A 50 -22.165 -2.775 -56.709 1.00 0.00 C ATOM 731 O LYS A 50 -22.927 -3.742 -56.685 1.00 0.00 O ATOM 732 CB LYS A 50 -22.778 -0.793 -55.322 1.00 0.00 C ATOM 733 CG LYS A 50 -22.672 -0.198 -53.916 1.00 0.00 C ATOM 734 CD LYS A 50 -23.713 0.912 -53.748 1.00 0.00 C ATOM 735 CE LYS A 50 -23.295 2.136 -54.565 1.00 0.00 C ATOM 736 NZ LYS A 50 -21.972 2.625 -54.085 1.00 0.00 N ATOM 0 H LYS A 50 -20.334 -0.545 -55.411 1.00 0.00 H new ATOM 0 HA LYS A 50 -21.996 -2.659 -54.579 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -22.511 -0.043 -56.067 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -23.806 -1.093 -55.525 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -22.831 -0.975 -53.168 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -21.671 0.201 -53.754 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -24.691 0.560 -54.076 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -23.807 1.180 -52.696 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -23.238 1.878 -55.623 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -24.043 2.923 -54.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -21.896 3.648 -54.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -21.882 2.440 -53.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -21.213 2.130 -54.595 1.00 0.00 H new ATOM 750 N ARG A 51 -21.577 -2.346 -57.822 1.00 0.00 N ATOM 751 CA ARG A 51 -21.809 -3.009 -59.101 1.00 0.00 C ATOM 752 C ARG A 51 -21.378 -4.474 -59.044 1.00 0.00 C ATOM 753 O ARG A 51 -21.746 -5.269 -59.909 1.00 0.00 O ATOM 754 CB ARG A 51 -21.036 -2.290 -60.209 1.00 0.00 C ATOM 755 CG ARG A 51 -19.537 -2.556 -60.049 1.00 0.00 C ATOM 756 CD ARG A 51 -18.755 -1.681 -61.030 1.00 0.00 C ATOM 757 NE ARG A 51 -17.329 -1.982 -60.949 1.00 0.00 N ATOM 758 CZ ARG A 51 -16.559 -1.484 -59.979 1.00 0.00 C ATOM 759 NH1 ARG A 51 -17.063 -0.704 -59.056 1.00 0.00 N ATOM 760 NH2 ARG A 51 -15.288 -1.780 -59.949 1.00 0.00 N ATOM 0 H ARG A 51 -20.942 -1.549 -57.865 1.00 0.00 H new ATOM 0 HA ARG A 51 -22.877 -2.970 -59.315 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -21.374 -2.637 -61.185 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -21.232 -1.219 -60.166 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -19.226 -2.341 -59.027 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -19.322 -3.609 -60.233 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -19.113 -1.852 -62.045 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -18.925 -0.628 -60.805 1.00 0.00 H new ATOM 0 HE ARG A 51 -16.909 -2.589 -61.653 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -18.056 -0.470 -59.072 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -16.463 -0.330 -58.321 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -14.889 -2.388 -60.664 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -14.694 -1.403 -59.211 1.00 0.00 H new ATOM 774 N ASN A 52 -20.598 -4.830 -58.027 1.00 0.00 N ATOM 775 CA ASN A 52 -20.134 -6.205 -57.882 1.00 0.00 C ATOM 776 C ASN A 52 -21.223 -7.075 -57.262 1.00 0.00 C ATOM 777 O ASN A 52 -21.356 -8.252 -57.598 1.00 0.00 O ATOM 778 CB ASN A 52 -18.882 -6.248 -57.006 1.00 0.00 C ATOM 779 CG ASN A 52 -18.349 -7.674 -56.932 1.00 0.00 C ATOM 780 OD1 ASN A 52 -17.792 -8.182 -57.905 1.00 0.00 O ATOM 781 ND2 ASN A 52 -18.491 -8.357 -55.829 1.00 0.00 N ATOM 0 H ASN A 52 -20.277 -4.192 -57.298 1.00 0.00 H new ATOM 0 HA ASN A 52 -19.894 -6.592 -58.872 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -18.119 -5.586 -57.415 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -19.115 -5.885 -56.005 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -18.140 -9.313 -55.772 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -18.953 -7.935 -55.024 1.00 0.00 H new ATOM 788 N ALA A 53 -21.998 -6.491 -56.354 1.00 0.00 N ATOM 789 CA ALA A 53 -23.070 -7.226 -55.691 1.00 0.00 C ATOM 790 C ALA A 53 -24.070 -7.761 -56.711 1.00 0.00 C ATOM 791 O ALA A 53 -24.490 -8.915 -56.634 1.00 0.00 O ATOM 792 CB ALA A 53 -23.794 -6.311 -54.702 1.00 0.00 C ATOM 0 H ALA A 53 -21.905 -5.518 -56.062 1.00 0.00 H new ATOM 0 HA ALA A 53 -22.628 -8.068 -55.157 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -24.593 -6.866 -54.211 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -23.087 -5.953 -53.953 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -24.218 -5.461 -55.236 1.00 0.00 H new ATOM 798 N VAL A 54 -24.446 -6.919 -57.667 1.00 0.00 N ATOM 799 CA VAL A 54 -25.396 -7.327 -58.696 1.00 0.00 C ATOM 800 C VAL A 54 -24.747 -8.307 -59.669 1.00 0.00 C ATOM 801 O VAL A 54 -25.412 -9.193 -60.206 1.00 0.00 O ATOM 802 CB VAL A 54 -25.917 -6.103 -59.455 1.00 0.00 C ATOM 803 CG1 VAL A 54 -24.769 -5.433 -60.210 1.00 0.00 C ATOM 804 CG2 VAL A 54 -26.992 -6.544 -60.451 1.00 0.00 C ATOM 0 H VAL A 54 -24.112 -5.959 -57.751 1.00 0.00 H new ATOM 0 HA VAL A 54 -26.235 -7.824 -58.209 1.00 0.00 H new ATOM 0 HB VAL A 54 -26.342 -5.393 -58.745 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -25.146 -4.563 -60.748 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -24.003 -5.118 -59.502 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -24.339 -6.140 -60.919 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -27.365 -5.675 -60.993 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -26.564 -7.255 -61.157 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -27.814 -7.016 -59.913 1.00 0.00 H new ATOM 814 N GLU A 55 -23.447 -8.146 -59.893 1.00 0.00 N ATOM 815 CA GLU A 55 -22.727 -9.029 -60.804 1.00 0.00 C ATOM 816 C GLU A 55 -22.764 -10.470 -60.300 1.00 0.00 C ATOM 817 O GLU A 55 -23.107 -11.388 -61.046 1.00 0.00 O ATOM 818 CB GLU A 55 -21.273 -8.571 -60.933 1.00 0.00 C ATOM 819 CG GLU A 55 -20.612 -9.291 -62.111 1.00 0.00 C ATOM 820 CD GLU A 55 -20.152 -10.682 -61.685 1.00 0.00 C ATOM 821 OE1 GLU A 55 -19.756 -10.830 -60.541 1.00 0.00 O ATOM 822 OE2 GLU A 55 -20.206 -11.579 -62.510 1.00 0.00 O ATOM 0 H GLU A 55 -22.875 -7.420 -59.461 1.00 0.00 H new ATOM 0 HA GLU A 55 -23.212 -8.985 -61.779 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -21.233 -7.492 -61.084 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -20.730 -8.785 -60.012 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -21.316 -9.370 -62.940 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -19.761 -8.712 -62.470 1.00 0.00 H new ATOM 829 N VAL A 56 -22.406 -10.662 -59.035 1.00 0.00 N ATOM 830 CA VAL A 56 -22.400 -11.998 -58.447 1.00 0.00 C ATOM 831 C VAL A 56 -23.823 -12.500 -58.220 1.00 0.00 C ATOM 832 O VAL A 56 -24.090 -13.698 -58.319 1.00 0.00 O ATOM 833 CB VAL A 56 -21.637 -11.987 -57.120 1.00 0.00 C ATOM 834 CG1 VAL A 56 -22.402 -11.152 -56.091 1.00 0.00 C ATOM 835 CG2 VAL A 56 -21.493 -13.421 -56.606 1.00 0.00 C ATOM 0 H VAL A 56 -22.118 -9.917 -58.401 1.00 0.00 H new ATOM 0 HA VAL A 56 -21.902 -12.673 -59.143 1.00 0.00 H new ATOM 0 HB VAL A 56 -20.650 -11.552 -57.275 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -21.856 -11.147 -55.148 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -22.505 -10.130 -56.456 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -23.391 -11.583 -55.935 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -20.950 -13.416 -55.661 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -22.482 -13.854 -56.454 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -20.945 -14.016 -57.336 1.00 0.00 H new ATOM 845 N LEU A 57 -24.735 -11.582 -57.917 1.00 0.00 N ATOM 846 CA LEU A 57 -26.126 -11.952 -57.681 1.00 0.00 C ATOM 847 C LEU A 57 -26.682 -12.755 -58.852 1.00 0.00 C ATOM 848 O LEU A 57 -27.338 -13.777 -58.653 1.00 0.00 O ATOM 849 CB LEU A 57 -26.978 -10.699 -57.475 1.00 0.00 C ATOM 850 CG LEU A 57 -27.549 -10.698 -56.056 1.00 0.00 C ATOM 851 CD1 LEU A 57 -26.492 -10.179 -55.079 1.00 0.00 C ATOM 852 CD2 LEU A 57 -28.780 -9.790 -56.004 1.00 0.00 C ATOM 0 H LEU A 57 -24.539 -10.585 -57.830 1.00 0.00 H new ATOM 0 HA LEU A 57 -26.162 -12.569 -56.783 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -26.375 -9.806 -57.636 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -27.788 -10.673 -58.204 1.00 0.00 H new ATOM 0 HG LEU A 57 -27.832 -11.713 -55.778 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -26.900 -10.179 -54.068 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -25.614 -10.824 -55.116 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -26.208 -9.164 -55.356 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -29.188 -9.788 -54.993 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -28.496 -8.775 -56.282 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -29.534 -10.159 -56.699 1.00 0.00 H new ATOM 864 N LYS A 58 -26.423 -12.294 -60.071 1.00 0.00 N ATOM 865 CA LYS A 58 -26.916 -12.997 -61.249 1.00 0.00 C ATOM 866 C LYS A 58 -26.213 -14.342 -61.398 1.00 0.00 C ATOM 867 O LYS A 58 -26.837 -15.347 -61.739 1.00 0.00 O ATOM 868 CB LYS A 58 -26.690 -12.152 -62.504 1.00 0.00 C ATOM 869 CG LYS A 58 -27.650 -10.960 -62.499 1.00 0.00 C ATOM 870 CD LYS A 58 -29.038 -11.420 -62.948 1.00 0.00 C ATOM 871 CE LYS A 58 -29.976 -10.214 -63.026 1.00 0.00 C ATOM 872 NZ LYS A 58 -30.259 -9.715 -61.651 1.00 0.00 N ATOM 0 H LYS A 58 -25.884 -11.451 -60.268 1.00 0.00 H new ATOM 0 HA LYS A 58 -27.985 -13.169 -61.125 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -25.659 -11.801 -62.538 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -26.850 -12.757 -63.396 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -27.704 -10.528 -61.500 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -27.281 -10.180 -63.165 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -28.974 -11.908 -63.921 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -29.433 -12.156 -62.248 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -29.522 -9.424 -63.625 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -30.906 -10.494 -63.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -31.056 -9.048 -61.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -30.501 -10.516 -61.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -29.417 -9.232 -61.277 1.00 0.00 H new ATOM 886 N ARG A 59 -24.910 -14.352 -61.135 1.00 0.00 N ATOM 887 CA ARG A 59 -24.127 -15.578 -61.238 1.00 0.00 C ATOM 888 C ARG A 59 -24.610 -16.611 -60.224 1.00 0.00 C ATOM 889 O ARG A 59 -24.425 -17.813 -60.412 1.00 0.00 O ATOM 890 CB ARG A 59 -22.647 -15.274 -60.996 1.00 0.00 C ATOM 891 CG ARG A 59 -21.794 -16.424 -61.535 1.00 0.00 C ATOM 892 CD ARG A 59 -21.322 -17.299 -60.373 1.00 0.00 C ATOM 893 NE ARG A 59 -20.495 -18.394 -60.870 1.00 0.00 N ATOM 894 CZ ARG A 59 -19.857 -19.224 -60.042 1.00 0.00 C ATOM 895 NH1 ARG A 59 -19.954 -19.082 -58.744 1.00 0.00 N ATOM 896 NH2 ARG A 59 -19.129 -20.190 -60.532 1.00 0.00 N ATOM 0 H ARG A 59 -24.377 -13.530 -60.851 1.00 0.00 H new ATOM 0 HA ARG A 59 -24.255 -15.985 -62.241 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -22.371 -14.341 -61.488 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -22.462 -15.139 -59.930 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -22.373 -17.020 -62.241 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -20.936 -16.030 -62.079 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -20.754 -16.698 -59.663 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -22.182 -17.698 -59.836 1.00 0.00 H new ATOM 0 HE ARG A 59 -20.402 -18.529 -61.877 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -20.522 -18.330 -58.354 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -19.461 -19.723 -58.123 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -19.050 -20.307 -61.542 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -18.639 -20.828 -59.905 1.00 0.00 H new ATOM 910 N GLU A 60 -25.229 -16.134 -59.148 1.00 0.00 N ATOM 911 CA GLU A 60 -25.734 -17.025 -58.110 1.00 0.00 C ATOM 912 C GLU A 60 -27.261 -17.083 -58.153 1.00 0.00 C ATOM 913 O GLU A 60 -27.934 -16.428 -57.359 1.00 0.00 O ATOM 914 CB GLU A 60 -25.285 -16.525 -56.736 1.00 0.00 C ATOM 915 CG GLU A 60 -23.763 -16.631 -56.626 1.00 0.00 C ATOM 916 CD GLU A 60 -23.339 -18.095 -56.658 1.00 0.00 C ATOM 917 OE1 GLU A 60 -24.162 -18.937 -56.339 1.00 0.00 O ATOM 918 OE2 GLU A 60 -22.197 -18.353 -57.002 1.00 0.00 O ATOM 0 H GLU A 60 -25.392 -15.142 -58.973 1.00 0.00 H new ATOM 0 HA GLU A 60 -25.335 -18.024 -58.286 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -25.599 -15.491 -56.593 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -25.759 -17.114 -55.950 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -23.292 -16.089 -57.446 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -23.424 -16.166 -55.701 1.00 0.00 H new ATOM 925 N PRO A 61 -27.817 -17.848 -59.059 1.00 0.00 N ATOM 926 CA PRO A 61 -29.299 -17.980 -59.194 1.00 0.00 C ATOM 927 C PRO A 61 -29.945 -18.625 -57.968 1.00 0.00 C ATOM 928 O PRO A 61 -31.171 -18.669 -57.859 1.00 0.00 O ATOM 929 CB PRO A 61 -29.486 -18.856 -60.437 1.00 0.00 C ATOM 930 CG PRO A 61 -28.191 -19.573 -60.625 1.00 0.00 C ATOM 931 CD PRO A 61 -27.104 -18.668 -60.052 1.00 0.00 C ATOM 0 HA PRO A 61 -29.780 -17.006 -59.281 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -30.307 -19.560 -60.300 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -29.728 -18.250 -61.310 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -28.203 -20.535 -60.113 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -28.010 -19.775 -61.681 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -26.303 -19.247 -59.592 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -26.648 -18.051 -60.826 1.00 0.00 H new ATOM 939 N LEU A 62 -29.124 -19.116 -57.043 1.00 0.00 N ATOM 940 CA LEU A 62 -29.648 -19.742 -55.836 1.00 0.00 C ATOM 941 C LEU A 62 -30.416 -18.720 -55.005 1.00 0.00 C ATOM 942 O LEU A 62 -31.493 -19.013 -54.485 1.00 0.00 O ATOM 943 CB LEU A 62 -28.502 -20.327 -55.007 1.00 0.00 C ATOM 944 CG LEU A 62 -29.066 -21.298 -53.970 1.00 0.00 C ATOM 945 CD1 LEU A 62 -28.116 -22.487 -53.813 1.00 0.00 C ATOM 946 CD2 LEU A 62 -29.210 -20.582 -52.625 1.00 0.00 C ATOM 0 H LEU A 62 -28.106 -19.093 -57.106 1.00 0.00 H new ATOM 0 HA LEU A 62 -30.325 -20.546 -56.125 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -27.795 -20.843 -55.657 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -27.953 -19.527 -54.511 1.00 0.00 H new ATOM 0 HG LEU A 62 -30.042 -21.653 -54.300 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -28.519 -23.179 -53.073 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -28.012 -22.998 -54.770 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -27.140 -22.132 -53.484 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -29.612 -21.274 -51.885 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -28.234 -20.226 -52.296 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -29.887 -19.735 -52.735 1.00 0.00 H new ATOM 958 N ASN A 63 -29.861 -17.517 -54.891 1.00 0.00 N ATOM 959 CA ASN A 63 -30.512 -16.457 -54.128 1.00 0.00 C ATOM 960 C ASN A 63 -31.576 -15.750 -54.971 1.00 0.00 C ATOM 961 O ASN A 63 -32.302 -14.891 -54.471 1.00 0.00 O ATOM 962 CB ASN A 63 -29.472 -15.438 -53.655 1.00 0.00 C ATOM 963 CG ASN A 63 -28.975 -14.608 -54.833 1.00 0.00 C ATOM 964 OD1 ASN A 63 -27.908 -14.884 -55.380 1.00 0.00 O ATOM 965 ND2 ASN A 63 -29.687 -13.600 -55.257 1.00 0.00 N ATOM 0 H ASN A 63 -28.971 -17.253 -55.313 1.00 0.00 H new ATOM 0 HA ASN A 63 -30.998 -16.910 -53.264 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -29.909 -14.785 -52.899 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -28.635 -15.954 -53.185 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -29.359 -13.039 -56.043 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -30.571 -13.373 -54.802 1.00 0.00 H new ATOM 972 N TYR A 64 -31.668 -16.116 -56.251 1.00 0.00 N ATOM 973 CA TYR A 64 -32.648 -15.510 -57.143 1.00 0.00 C ATOM 974 C TYR A 64 -34.045 -16.040 -56.840 1.00 0.00 C ATOM 975 O TYR A 64 -35.032 -15.312 -56.944 1.00 0.00 O ATOM 976 CB TYR A 64 -32.289 -15.824 -58.597 1.00 0.00 C ATOM 977 CG TYR A 64 -33.148 -14.992 -59.518 1.00 0.00 C ATOM 978 CD1 TYR A 64 -32.838 -13.644 -59.736 1.00 0.00 C ATOM 979 CD2 TYR A 64 -34.255 -15.567 -60.153 1.00 0.00 C ATOM 980 CE1 TYR A 64 -33.634 -12.872 -60.590 1.00 0.00 C ATOM 981 CE2 TYR A 64 -35.051 -14.795 -61.007 1.00 0.00 C ATOM 982 CZ TYR A 64 -34.741 -13.447 -61.226 1.00 0.00 C ATOM 983 OH TYR A 64 -35.526 -12.686 -62.068 1.00 0.00 O ATOM 0 H TYR A 64 -31.078 -16.825 -56.687 1.00 0.00 H new ATOM 0 HA TYR A 64 -32.638 -14.431 -56.988 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -31.235 -15.613 -58.776 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -32.441 -16.884 -58.800 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -31.985 -13.200 -59.245 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -34.495 -16.606 -59.984 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -33.394 -11.832 -60.758 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -35.905 -15.239 -61.497 1.00 0.00 H new ATOM 0 HH TYR A 64 -36.251 -13.239 -62.427 1.00 0.00 H new ATOM 993 N LEU A 65 -34.120 -17.312 -56.464 1.00 0.00 N ATOM 994 CA LEU A 65 -35.401 -17.930 -56.147 1.00 0.00 C ATOM 995 C LEU A 65 -35.737 -17.726 -54.669 1.00 0.00 C ATOM 996 O LEU A 65 -34.848 -17.469 -53.857 1.00 0.00 O ATOM 997 CB LEU A 65 -35.345 -19.427 -56.462 1.00 0.00 C ATOM 998 CG LEU A 65 -35.151 -19.628 -57.967 1.00 0.00 C ATOM 999 CD1 LEU A 65 -34.857 -21.103 -58.249 1.00 0.00 C ATOM 1000 CD2 LEU A 65 -36.426 -19.212 -58.708 1.00 0.00 C ATOM 0 H LEU A 65 -33.315 -17.931 -56.372 1.00 0.00 H new ATOM 0 HA LEU A 65 -36.177 -17.461 -56.752 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -34.527 -19.894 -55.914 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -36.265 -19.912 -56.136 1.00 0.00 H new ATOM 0 HG LEU A 65 -34.316 -19.017 -58.310 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -34.719 -21.248 -59.320 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -33.950 -21.400 -57.722 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -35.693 -21.713 -57.905 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -36.287 -19.355 -59.780 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -37.262 -19.822 -58.365 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -36.638 -18.162 -58.507 1.00 0.00 H new ATOM 1012 N PRO A 66 -36.992 -17.835 -54.303 1.00 0.00 N ATOM 1013 CA PRO A 66 -37.429 -17.656 -52.886 1.00 0.00 C ATOM 1014 C PRO A 66 -36.649 -18.552 -51.927 1.00 0.00 C ATOM 1015 O PRO A 66 -36.361 -19.707 -52.238 1.00 0.00 O ATOM 1016 CB PRO A 66 -38.911 -18.041 -52.904 1.00 0.00 C ATOM 1017 CG PRO A 66 -39.352 -17.861 -54.318 1.00 0.00 C ATOM 1018 CD PRO A 66 -38.129 -18.136 -55.190 1.00 0.00 C ATOM 0 HA PRO A 66 -37.255 -16.639 -52.533 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -39.053 -19.071 -52.577 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -39.489 -17.409 -52.229 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -40.164 -18.546 -54.561 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -39.727 -16.851 -54.482 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -38.106 -19.170 -55.533 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -38.121 -17.505 -56.079 1.00 0.00 H new ATOM 1026 N LEU A 67 -36.312 -18.010 -50.761 1.00 0.00 N ATOM 1027 CA LEU A 67 -35.566 -18.770 -49.764 1.00 0.00 C ATOM 1028 C LEU A 67 -36.243 -18.675 -48.400 1.00 0.00 C ATOM 1029 O LEU A 67 -37.381 -18.237 -48.355 1.00 0.00 O ATOM 1030 CB LEU A 67 -34.136 -18.237 -49.664 1.00 0.00 C ATOM 1031 CG LEU A 67 -33.148 -19.371 -49.941 1.00 0.00 C ATOM 1032 CD1 LEU A 67 -31.754 -18.788 -50.182 1.00 0.00 C ATOM 1033 CD2 LEU A 67 -33.103 -20.313 -48.736 1.00 0.00 C ATOM 0 H LEU A 67 -36.541 -17.055 -50.485 1.00 0.00 H new ATOM 0 HA LEU A 67 -35.543 -19.815 -50.073 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -33.987 -17.428 -50.379 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -33.960 -17.821 -48.672 1.00 0.00 H new ATOM 0 HG LEU A 67 -33.469 -19.923 -50.824 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -31.050 -19.597 -50.379 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -31.784 -18.116 -51.040 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -31.433 -18.235 -49.299 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -32.399 -21.122 -48.932 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -32.783 -19.760 -47.853 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -34.095 -20.730 -48.563 1.00 0.00 H new TER 1045 LEU A 67