USER MOD reduce.3.24.130724 H: found=0, std=0, add=1127, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1130 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 GLN : amide:sc= 0.99 K(o=2.3,f=-6.9!) USER MOD Set 1.2: B 91 LYS NZ :NH3+ -157:sc= 1.28 (180deg=0.000623) USER MOD Set 2.1: A 75 LYS NZ :NH3+ 166:sc= 2.51 (180deg=1.3) USER MOD Set 2.2: B 90 GLN : amide:sc= -2.56! C(o=-0.051!,f=-11!) USER MOD Set 3.1: A 71 MET CE :methyl 141:sc= -1.03 (180deg=-1.29) USER MOD Set 3.2: A 72 MET CE :methyl 159:sc= -3.05! (180deg=-4.48!) USER MOD Set 4.1: A 8 GLN : amide:sc= 1.01 K(o=-1.1,f=-5.4) USER MOD Set 4.2: A 76 MET CE :methyl 141:sc= -2.09 (180deg=-1.1) USER MOD Single : A 5 THR OG1 : rot 132:sc= 1.07 USER MOD Single : A 13 LYS NZ :NH3+ -160:sc= 1.23 (180deg=0.521) USER MOD Single : A 17 SER OG : rot 84:sc= 0.654 USER MOD Single : A 21 LYS NZ :NH3+ -126:sc= -0.067 (180deg=-1.18) USER MOD Single : A 26 THR OG1 : rot 180:sc=-0.00612 USER MOD Single : A 28 THR OG1 : rot -65:sc= 0.403 USER MOD Single : A 29 THR OG1 : rot 134:sc= 1.33 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 63:sc= 1.26 USER MOD Single : A 36 MET CE :methyl 178:sc= -0.66 (180deg=-0.685) USER MOD Single : A 38 SER OG : rot 83:sc= 1.26 USER MOD Single : A 42 ASN :FLIP amide:sc= -1.24 F(o=-3.6!,f=-1.2) USER MOD Single : A 44 THR OG1 : rot -73:sc= 1.18 USER MOD Single : A 49 GLN : amide:sc= -0.611 X(o=-0.61,f=-0.27) USER MOD Single : A 51 MET CE :methyl 165:sc= 0 (180deg=-0.0997) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 ASN : amide:sc= -1.01 X(o=-1,f=-0.9) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 75:sc= 0.841 USER MOD Single : A 94 LYS NZ :NH3+ 148:sc= 1.23 (180deg=1.03) USER MOD Single : A 97 ASN : amide:sc= 0.212 X(o=0.21,f=-0.14) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 107 HIS : no HD1:sc= -0.0145 X(o=-0.014,f=-0.049) USER MOD Single : A 109 MET CE :methyl -148:sc= -0.295 (180deg=-1.11) USER MOD Single : A 110 THR OG1 : rot 77:sc= 1.13 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0434) USER MOD Single : A 117 THR OG1 : rot -160:sc= 0.273 USER MOD Single : A 124 MET CE :methyl 168:sc= -1.06 (180deg=-1.49) USER MOD Single : A 135 GLN :FLIP amide:sc= 0 F(o=-0.9,f=0) USER MOD Single : A 137 ASN : amide:sc=-0.000396 X(o=-0.0004,f=-0.012) USER MOD Single : A 138 TYR OH : rot 21:sc= 1.41 USER MOD Single : A 143 GLN : amide:sc= -0.375 X(o=-0.37,f=-0.46) USER MOD Single : A 144 MET CE :methyl 141:sc= -0.199 (180deg=-0.756) USER MOD Single : A 145 MET CE :methyl 157:sc= -0.12 (180deg=-0.813) USER MOD Single : B 82 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.032) USER MOD Single : B 86 LYS NZ :NH3+ 134:sc= 0.83 (180deg=0.299) USER MOD Single : B 87 HIS : no HD1:sc= -0.0444 X(o=-0.044,f=-0.53) USER MOD Single : B 93 LYS NZ :NH3+ -165:sc= 1.18 (180deg=1.15) USER MOD ----------------------------------------------------------------- ATOM 42 N LEU A 4 -12.266 0.168 -10.835 1.00 0.00 N ATOM 43 CA LEU A 4 -12.259 -1.246 -11.112 1.00 0.00 C ATOM 44 C LEU A 4 -13.291 -1.507 -12.173 1.00 0.00 C ATOM 45 O LEU A 4 -14.481 -1.337 -11.914 1.00 0.00 O ATOM 46 CB LEU A 4 -12.633 -2.046 -9.854 1.00 0.00 C ATOM 47 CG LEU A 4 -11.623 -3.091 -9.362 1.00 0.00 C ATOM 48 CD1 LEU A 4 -10.278 -2.460 -9.093 1.00 0.00 C ATOM 49 CD2 LEU A 4 -12.137 -3.761 -8.101 1.00 0.00 C ATOM 0 HA LEU A 4 -11.264 -1.552 -11.436 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -12.809 -1.339 -9.044 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -13.578 -2.554 -10.045 1.00 0.00 H new ATOM 0 HG LEU A 4 -11.502 -3.839 -10.145 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -9.581 -3.223 -8.746 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -9.897 -2.011 -10.010 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -10.384 -1.690 -8.329 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -11.412 -4.501 -7.761 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -12.282 -3.011 -7.324 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -13.086 -4.253 -8.312 1.00 0.00 H new ATOM 61 N THR A 5 -12.872 -1.870 -13.352 1.00 0.00 N ATOM 62 CA THR A 5 -13.818 -2.162 -14.395 1.00 0.00 C ATOM 63 C THR A 5 -14.365 -3.581 -14.219 1.00 0.00 C ATOM 64 O THR A 5 -13.699 -4.430 -13.608 1.00 0.00 O ATOM 65 CB THR A 5 -13.201 -1.955 -15.794 1.00 0.00 C ATOM 66 OG1 THR A 5 -11.990 -2.732 -15.948 1.00 0.00 O ATOM 67 CG2 THR A 5 -12.895 -0.485 -16.030 1.00 0.00 C ATOM 0 H THR A 5 -11.892 -1.971 -13.615 1.00 0.00 H new ATOM 0 HA THR A 5 -14.650 -1.462 -14.316 1.00 0.00 H new ATOM 0 HB THR A 5 -13.930 -2.293 -16.531 1.00 0.00 H new ATOM 0 HG1 THR A 5 -12.022 -3.223 -16.795 1.00 0.00 H new ATOM 0 HG21 THR A 5 -12.460 -0.358 -17.022 1.00 0.00 H new ATOM 0 HG22 THR A 5 -13.816 0.094 -15.961 1.00 0.00 H new ATOM 0 HG23 THR A 5 -12.189 -0.135 -15.277 1.00 0.00 H new ATOM 75 N GLU A 6 -15.550 -3.839 -14.757 1.00 0.00 N ATOM 76 CA GLU A 6 -16.260 -5.104 -14.574 1.00 0.00 C ATOM 77 C GLU A 6 -15.422 -6.323 -15.039 1.00 0.00 C ATOM 78 O GLU A 6 -15.497 -7.391 -14.442 1.00 0.00 O ATOM 79 CB GLU A 6 -17.606 -5.020 -15.302 1.00 0.00 C ATOM 80 CG GLU A 6 -18.510 -6.234 -15.178 1.00 0.00 C ATOM 81 CD GLU A 6 -18.945 -6.545 -13.752 1.00 0.00 C ATOM 82 OE1 GLU A 6 -18.401 -7.478 -13.145 1.00 0.00 O ATOM 83 OE2 GLU A 6 -19.874 -5.893 -13.238 1.00 0.00 O ATOM 0 H GLU A 6 -16.053 -3.170 -15.340 1.00 0.00 H new ATOM 0 HA GLU A 6 -16.435 -5.262 -13.510 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -18.146 -4.151 -14.926 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -17.413 -4.843 -16.360 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -19.398 -6.076 -15.791 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -17.992 -7.102 -15.585 1.00 0.00 H new ATOM 90 N GLU A 7 -14.610 -6.133 -16.073 1.00 0.00 N ATOM 91 CA GLU A 7 -13.725 -7.192 -16.601 1.00 0.00 C ATOM 92 C GLU A 7 -12.749 -7.623 -15.511 1.00 0.00 C ATOM 93 O GLU A 7 -12.538 -8.820 -15.251 1.00 0.00 O ATOM 94 CB GLU A 7 -12.874 -6.714 -17.810 1.00 0.00 C ATOM 95 CG GLU A 7 -13.580 -5.866 -18.863 1.00 0.00 C ATOM 96 CD GLU A 7 -13.834 -4.466 -18.372 1.00 0.00 C ATOM 97 OE1 GLU A 7 -12.886 -3.658 -18.344 1.00 0.00 O ATOM 98 OE2 GLU A 7 -14.962 -4.174 -17.948 1.00 0.00 O ATOM 0 H GLU A 7 -14.539 -5.248 -16.575 1.00 0.00 H new ATOM 0 HA GLU A 7 -14.372 -8.007 -16.924 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -12.030 -6.142 -17.425 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -12.463 -7.594 -18.304 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -12.973 -5.830 -19.768 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -14.527 -6.334 -19.133 1.00 0.00 H new ATOM 105 N GLN A 8 -12.177 -6.630 -14.863 1.00 0.00 N ATOM 106 CA GLN A 8 -11.207 -6.847 -13.826 1.00 0.00 C ATOM 107 C GLN A 8 -11.896 -7.320 -12.555 1.00 0.00 C ATOM 108 O GLN A 8 -11.354 -8.120 -11.799 1.00 0.00 O ATOM 109 CB GLN A 8 -10.391 -5.579 -13.591 1.00 0.00 C ATOM 110 CG GLN A 8 -9.379 -5.708 -12.481 1.00 0.00 C ATOM 111 CD GLN A 8 -8.480 -4.514 -12.356 1.00 0.00 C ATOM 112 OE1 GLN A 8 -8.851 -3.384 -12.689 1.00 0.00 O ATOM 113 NE2 GLN A 8 -7.298 -4.744 -11.875 1.00 0.00 N ATOM 0 H GLN A 8 -12.377 -5.647 -15.046 1.00 0.00 H new ATOM 0 HA GLN A 8 -10.515 -7.629 -14.138 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -9.874 -5.314 -14.513 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -11.070 -4.758 -13.359 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -9.903 -5.860 -11.537 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -8.771 -6.596 -12.655 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -7.030 -5.692 -11.612 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -6.636 -3.977 -11.760 1.00 0.00 H new ATOM 122 N ILE A 9 -13.100 -6.842 -12.335 1.00 0.00 N ATOM 123 CA ILE A 9 -13.889 -7.289 -11.214 1.00 0.00 C ATOM 124 C ILE A 9 -14.211 -8.775 -11.369 1.00 0.00 C ATOM 125 O ILE A 9 -14.172 -9.508 -10.407 1.00 0.00 O ATOM 126 CB ILE A 9 -15.172 -6.423 -11.005 1.00 0.00 C ATOM 127 CG1 ILE A 9 -14.758 -4.985 -10.644 1.00 0.00 C ATOM 128 CG2 ILE A 9 -16.064 -7.012 -9.910 1.00 0.00 C ATOM 129 CD1 ILE A 9 -15.903 -4.021 -10.426 1.00 0.00 C ATOM 0 H ILE A 9 -13.554 -6.141 -12.921 1.00 0.00 H new ATOM 0 HA ILE A 9 -13.299 -7.158 -10.307 1.00 0.00 H new ATOM 0 HB ILE A 9 -15.747 -6.417 -11.931 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -14.152 -5.015 -9.739 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -14.123 -4.596 -11.440 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -16.949 -6.388 -9.787 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -16.367 -8.021 -10.191 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -15.512 -7.048 -8.971 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -15.507 -3.036 -10.177 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -16.499 -3.953 -11.336 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -16.529 -4.378 -9.608 1.00 0.00 H new ATOM 141 N ALA A 10 -14.463 -9.211 -12.605 1.00 0.00 N ATOM 142 CA ALA A 10 -14.683 -10.626 -12.914 1.00 0.00 C ATOM 143 C ALA A 10 -13.467 -11.458 -12.526 1.00 0.00 C ATOM 144 O ALA A 10 -13.606 -12.559 -11.969 1.00 0.00 O ATOM 145 CB ALA A 10 -14.999 -10.808 -14.374 1.00 0.00 C ATOM 0 H ALA A 10 -14.520 -8.596 -13.417 1.00 0.00 H new ATOM 0 HA ALA A 10 -15.536 -10.972 -12.331 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -15.159 -11.866 -14.583 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -15.901 -10.249 -14.624 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -14.167 -10.442 -14.975 1.00 0.00 H new ATOM 151 N GLU A 11 -12.284 -10.911 -12.805 1.00 0.00 N ATOM 152 CA GLU A 11 -11.017 -11.516 -12.399 1.00 0.00 C ATOM 153 C GLU A 11 -11.025 -11.692 -10.878 1.00 0.00 C ATOM 154 O GLU A 11 -10.814 -12.793 -10.363 1.00 0.00 O ATOM 155 CB GLU A 11 -9.844 -10.605 -12.827 1.00 0.00 C ATOM 156 CG GLU A 11 -8.452 -11.086 -12.424 1.00 0.00 C ATOM 157 CD GLU A 11 -8.069 -12.382 -13.080 1.00 0.00 C ATOM 158 OE1 GLU A 11 -8.237 -13.443 -12.469 1.00 0.00 O ATOM 159 OE2 GLU A 11 -7.608 -12.354 -14.248 1.00 0.00 O ATOM 0 H GLU A 11 -12.178 -10.036 -13.319 1.00 0.00 H new ATOM 0 HA GLU A 11 -10.893 -12.487 -12.878 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -9.871 -10.494 -13.911 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -10.003 -9.614 -12.402 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -7.719 -10.322 -12.685 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -8.414 -11.207 -11.341 1.00 0.00 H new ATOM 166 N PHE A 12 -11.352 -10.610 -10.176 1.00 0.00 N ATOM 167 CA PHE A 12 -11.418 -10.618 -8.724 1.00 0.00 C ATOM 168 C PHE A 12 -12.482 -11.573 -8.181 1.00 0.00 C ATOM 169 O PHE A 12 -12.318 -12.107 -7.114 1.00 0.00 O ATOM 170 CB PHE A 12 -11.615 -9.210 -8.142 1.00 0.00 C ATOM 171 CG PHE A 12 -10.423 -8.300 -8.280 1.00 0.00 C ATOM 172 CD1 PHE A 12 -9.189 -8.668 -7.765 1.00 0.00 C ATOM 173 CD2 PHE A 12 -10.540 -7.068 -8.894 1.00 0.00 C ATOM 174 CE1 PHE A 12 -8.101 -7.825 -7.869 1.00 0.00 C ATOM 175 CE2 PHE A 12 -9.453 -6.225 -8.999 1.00 0.00 C ATOM 176 CZ PHE A 12 -8.234 -6.603 -8.487 1.00 0.00 C ATOM 0 H PHE A 12 -11.577 -9.709 -10.598 1.00 0.00 H new ATOM 0 HA PHE A 12 -10.448 -10.989 -8.394 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -12.469 -8.745 -8.634 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -11.866 -9.300 -7.085 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -9.078 -9.625 -7.277 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -11.494 -6.761 -9.297 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -7.145 -8.125 -7.465 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -9.560 -5.266 -9.484 1.00 0.00 H new ATOM 0 HZ PHE A 12 -7.384 -5.943 -8.570 1.00 0.00 H new ATOM 186 N LYS A 13 -13.562 -11.785 -8.926 1.00 0.00 N ATOM 187 CA LYS A 13 -14.645 -12.694 -8.501 1.00 0.00 C ATOM 188 C LYS A 13 -14.123 -14.110 -8.357 1.00 0.00 C ATOM 189 O LYS A 13 -14.347 -14.783 -7.325 1.00 0.00 O ATOM 190 CB LYS A 13 -15.817 -12.678 -9.499 1.00 0.00 C ATOM 191 CG LYS A 13 -16.466 -11.325 -9.677 1.00 0.00 C ATOM 192 CD LYS A 13 -17.579 -11.342 -10.686 1.00 0.00 C ATOM 193 CE LYS A 13 -18.009 -9.926 -11.023 1.00 0.00 C ATOM 194 NZ LYS A 13 -19.117 -9.875 -11.994 1.00 0.00 N ATOM 0 H LYS A 13 -13.720 -11.343 -9.831 1.00 0.00 H new ATOM 0 HA LYS A 13 -15.008 -12.341 -7.536 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -15.458 -13.026 -10.468 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -16.573 -13.389 -9.165 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.856 -10.985 -8.718 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -15.711 -10.603 -9.988 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -17.251 -11.854 -11.590 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -18.427 -11.902 -10.292 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -18.312 -9.417 -10.108 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -17.156 -9.379 -11.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -19.146 -8.935 -12.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -18.971 -10.600 -12.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -20.017 -10.054 -11.504 1.00 0.00 H new ATOM 208 N GLU A 14 -13.405 -14.554 -9.370 1.00 0.00 N ATOM 209 CA GLU A 14 -12.839 -15.881 -9.364 1.00 0.00 C ATOM 210 C GLU A 14 -11.689 -15.952 -8.381 1.00 0.00 C ATOM 211 O GLU A 14 -11.598 -16.895 -7.590 1.00 0.00 O ATOM 212 CB GLU A 14 -12.379 -16.292 -10.757 1.00 0.00 C ATOM 213 CG GLU A 14 -13.495 -16.320 -11.786 1.00 0.00 C ATOM 214 CD GLU A 14 -14.660 -17.168 -11.342 1.00 0.00 C ATOM 215 OE1 GLU A 14 -15.741 -16.614 -11.064 1.00 0.00 O ATOM 216 OE2 GLU A 14 -14.515 -18.400 -11.219 1.00 0.00 O ATOM 0 H GLU A 14 -13.201 -14.010 -10.209 1.00 0.00 H new ATOM 0 HA GLU A 14 -13.615 -16.580 -9.052 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.605 -15.602 -11.093 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -11.923 -17.280 -10.702 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -13.839 -15.303 -11.974 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -13.107 -16.704 -12.729 1.00 0.00 H new ATOM 223 N ALA A 15 -10.849 -14.923 -8.408 1.00 0.00 N ATOM 224 CA ALA A 15 -9.688 -14.813 -7.530 1.00 0.00 C ATOM 225 C ALA A 15 -10.099 -14.921 -6.070 1.00 0.00 C ATOM 226 O ALA A 15 -9.525 -15.704 -5.311 1.00 0.00 O ATOM 227 CB ALA A 15 -8.991 -13.489 -7.771 1.00 0.00 C ATOM 0 H ALA A 15 -10.955 -14.134 -9.046 1.00 0.00 H new ATOM 0 HA ALA A 15 -9.005 -15.632 -7.755 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -8.125 -13.409 -7.114 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -8.666 -13.433 -8.810 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -9.681 -12.671 -7.562 1.00 0.00 H new ATOM 233 N PHE A 16 -11.113 -14.162 -5.709 1.00 0.00 N ATOM 234 CA PHE A 16 -11.660 -14.120 -4.364 1.00 0.00 C ATOM 235 C PHE A 16 -12.110 -15.472 -3.945 1.00 0.00 C ATOM 236 O PHE A 16 -11.648 -15.972 -2.970 1.00 0.00 O ATOM 237 CB PHE A 16 -12.845 -13.154 -4.328 1.00 0.00 C ATOM 238 CG PHE A 16 -13.526 -12.979 -3.003 1.00 0.00 C ATOM 239 CD1 PHE A 16 -14.540 -13.813 -2.610 1.00 0.00 C ATOM 240 CD2 PHE A 16 -13.166 -11.959 -2.177 1.00 0.00 C ATOM 241 CE1 PHE A 16 -15.167 -13.619 -1.413 1.00 0.00 C ATOM 242 CE2 PHE A 16 -13.784 -11.755 -0.985 1.00 0.00 C ATOM 243 CZ PHE A 16 -14.788 -12.584 -0.597 1.00 0.00 C ATOM 0 H PHE A 16 -11.594 -13.540 -6.359 1.00 0.00 H new ATOM 0 HA PHE A 16 -10.884 -13.780 -3.678 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -12.499 -12.177 -4.665 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -13.586 -13.496 -5.050 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -14.845 -14.628 -3.250 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -12.369 -11.295 -2.477 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -15.963 -14.282 -1.108 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.479 -10.938 -0.349 1.00 0.00 H new ATOM 0 HZ PHE A 16 -15.285 -12.429 0.349 1.00 0.00 H new ATOM 253 N SER A 17 -12.967 -16.074 -4.724 1.00 0.00 N ATOM 254 CA SER A 17 -13.563 -17.344 -4.365 1.00 0.00 C ATOM 255 C SER A 17 -12.527 -18.485 -4.385 1.00 0.00 C ATOM 256 O SER A 17 -12.765 -19.558 -3.846 1.00 0.00 O ATOM 257 CB SER A 17 -14.734 -17.627 -5.291 1.00 0.00 C ATOM 258 OG SER A 17 -15.616 -16.497 -5.330 1.00 0.00 O ATOM 0 H SER A 17 -13.275 -15.704 -5.624 1.00 0.00 H new ATOM 0 HA SER A 17 -13.931 -17.286 -3.341 1.00 0.00 H new ATOM 0 HB2 SER A 17 -14.369 -17.848 -6.294 1.00 0.00 H new ATOM 0 HB3 SER A 17 -15.275 -18.509 -4.947 1.00 0.00 H new ATOM 0 HG SER A 17 -15.281 -15.843 -5.978 1.00 0.00 H new ATOM 264 N LEU A 18 -11.395 -18.249 -5.035 1.00 0.00 N ATOM 265 CA LEU A 18 -10.302 -19.195 -5.033 1.00 0.00 C ATOM 266 C LEU A 18 -9.754 -19.263 -3.608 1.00 0.00 C ATOM 267 O LEU A 18 -9.500 -20.342 -3.081 1.00 0.00 O ATOM 268 CB LEU A 18 -9.200 -18.741 -6.056 1.00 0.00 C ATOM 269 CG LEU A 18 -8.005 -19.655 -6.375 1.00 0.00 C ATOM 270 CD1 LEU A 18 -7.081 -19.731 -5.235 1.00 0.00 C ATOM 271 CD2 LEU A 18 -8.459 -21.035 -6.788 1.00 0.00 C ATOM 0 H LEU A 18 -11.215 -17.401 -5.573 1.00 0.00 H new ATOM 0 HA LEU A 18 -10.637 -20.185 -5.341 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -9.704 -18.530 -6.999 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -8.794 -17.796 -5.693 1.00 0.00 H new ATOM 0 HG LEU A 18 -7.472 -19.214 -7.218 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.245 -20.384 -5.487 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.706 -18.734 -5.003 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.605 -20.132 -4.368 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -7.589 -21.654 -7.006 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -9.032 -21.487 -5.979 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -9.084 -20.961 -7.678 1.00 0.00 H new ATOM 283 N PHE A 19 -9.609 -18.111 -2.975 1.00 0.00 N ATOM 284 CA PHE A 19 -9.059 -18.092 -1.648 1.00 0.00 C ATOM 285 C PHE A 19 -10.157 -18.055 -0.571 1.00 0.00 C ATOM 286 O PHE A 19 -9.941 -18.466 0.575 1.00 0.00 O ATOM 287 CB PHE A 19 -7.971 -17.016 -1.477 1.00 0.00 C ATOM 288 CG PHE A 19 -8.371 -15.602 -1.421 1.00 0.00 C ATOM 289 CD1 PHE A 19 -8.541 -14.842 -2.552 1.00 0.00 C ATOM 290 CD2 PHE A 19 -8.501 -15.013 -0.199 1.00 0.00 C ATOM 291 CE1 PHE A 19 -8.841 -13.502 -2.452 1.00 0.00 C ATOM 292 CE2 PHE A 19 -8.805 -13.712 -0.080 1.00 0.00 C ATOM 293 CZ PHE A 19 -8.976 -12.933 -1.209 1.00 0.00 C ATOM 0 H PHE A 19 -9.861 -17.199 -3.356 1.00 0.00 H new ATOM 0 HA PHE A 19 -8.539 -19.038 -1.498 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -7.427 -17.241 -0.560 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -7.266 -17.126 -2.301 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -8.439 -15.298 -3.526 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -8.356 -15.606 0.692 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -8.969 -12.904 -3.342 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -8.916 -13.272 0.900 1.00 0.00 H new ATOM 0 HZ PHE A 19 -9.214 -11.884 -1.114 1.00 0.00 H new ATOM 303 N ASP A 20 -11.326 -17.563 -0.943 1.00 0.00 N ATOM 304 CA ASP A 20 -12.521 -17.674 -0.121 1.00 0.00 C ATOM 305 C ASP A 20 -13.048 -19.072 -0.320 1.00 0.00 C ATOM 306 O ASP A 20 -13.913 -19.333 -1.150 1.00 0.00 O ATOM 307 CB ASP A 20 -13.593 -16.583 -0.452 1.00 0.00 C ATOM 308 CG ASP A 20 -14.949 -16.807 0.250 1.00 0.00 C ATOM 309 OD1 ASP A 20 -16.002 -16.430 -0.321 1.00 0.00 O ATOM 310 OD2 ASP A 20 -14.992 -17.382 1.375 1.00 0.00 O ATOM 0 H ASP A 20 -11.475 -17.074 -1.826 1.00 0.00 H new ATOM 0 HA ASP A 20 -12.275 -17.496 0.926 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -13.204 -15.606 -0.166 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -13.752 -16.559 -1.530 1.00 0.00 H new ATOM 315 N LYS A 21 -12.435 -19.970 0.412 1.00 0.00 N ATOM 316 CA LYS A 21 -12.600 -21.396 0.263 1.00 0.00 C ATOM 317 C LYS A 21 -14.030 -21.879 0.430 1.00 0.00 C ATOM 318 O LYS A 21 -14.431 -22.852 -0.210 1.00 0.00 O ATOM 319 CB LYS A 21 -11.654 -22.127 1.184 1.00 0.00 C ATOM 320 CG LYS A 21 -10.193 -21.681 1.043 1.00 0.00 C ATOM 321 CD LYS A 21 -9.225 -22.436 1.888 1.00 0.00 C ATOM 322 CE LYS A 21 -9.350 -22.142 3.360 1.00 0.00 C ATOM 323 NZ LYS A 21 -10.367 -22.978 4.049 1.00 0.00 N ATOM 0 H LYS A 21 -11.783 -19.719 1.155 1.00 0.00 H new ATOM 0 HA LYS A 21 -12.348 -21.629 -0.772 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -11.974 -21.975 2.215 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -11.720 -23.197 0.984 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -9.897 -21.780 -0.001 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -10.125 -20.623 1.295 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -9.371 -23.504 1.726 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -8.212 -22.200 1.564 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -8.382 -22.296 3.836 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -9.606 -21.091 3.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -11.039 -22.364 4.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -10.879 -23.550 3.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -9.896 -23.606 4.731 1.00 0.00 H new ATOM 337 N ASP A 22 -14.813 -21.211 1.257 1.00 0.00 N ATOM 338 CA ASP A 22 -16.205 -21.631 1.422 1.00 0.00 C ATOM 339 C ASP A 22 -17.117 -20.975 0.403 1.00 0.00 C ATOM 340 O ASP A 22 -18.251 -21.421 0.210 1.00 0.00 O ATOM 341 CB ASP A 22 -16.754 -21.395 2.836 1.00 0.00 C ATOM 342 CG ASP A 22 -16.159 -22.277 3.899 1.00 0.00 C ATOM 343 OD1 ASP A 22 -16.412 -23.493 3.897 1.00 0.00 O ATOM 344 OD2 ASP A 22 -15.467 -21.762 4.807 1.00 0.00 O ATOM 0 H ASP A 22 -14.529 -20.402 1.810 1.00 0.00 H new ATOM 0 HA ASP A 22 -16.196 -22.708 1.254 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -16.581 -20.354 3.109 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -17.833 -21.545 2.821 1.00 0.00 H new ATOM 349 N GLY A 23 -16.608 -19.955 -0.281 1.00 0.00 N ATOM 350 CA GLY A 23 -17.385 -19.236 -1.279 1.00 0.00 C ATOM 351 C GLY A 23 -18.593 -18.541 -0.678 1.00 0.00 C ATOM 352 O GLY A 23 -19.731 -18.827 -1.051 1.00 0.00 O ATOM 0 H GLY A 23 -15.656 -19.608 -0.160 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -16.750 -18.497 -1.768 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -17.715 -19.932 -2.050 1.00 0.00 H new ATOM 356 N ASP A 24 -18.352 -17.626 0.234 1.00 0.00 N ATOM 357 CA ASP A 24 -19.446 -16.952 0.950 1.00 0.00 C ATOM 358 C ASP A 24 -19.519 -15.507 0.531 1.00 0.00 C ATOM 359 O ASP A 24 -20.521 -14.831 0.754 1.00 0.00 O ATOM 360 CB ASP A 24 -19.204 -16.952 2.470 1.00 0.00 C ATOM 361 CG ASP A 24 -18.764 -18.270 3.031 1.00 0.00 C ATOM 362 OD1 ASP A 24 -17.533 -18.455 3.183 1.00 0.00 O ATOM 363 OD2 ASP A 24 -19.615 -19.136 3.337 1.00 0.00 O ATOM 0 H ASP A 24 -17.417 -17.323 0.507 1.00 0.00 H new ATOM 0 HA ASP A 24 -20.363 -17.491 0.711 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -18.449 -16.202 2.705 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -20.123 -16.647 2.971 1.00 0.00 H new ATOM 368 N GLY A 25 -18.456 -15.028 -0.078 1.00 0.00 N ATOM 369 CA GLY A 25 -18.370 -13.629 -0.413 1.00 0.00 C ATOM 370 C GLY A 25 -17.791 -12.859 0.738 1.00 0.00 C ATOM 371 O GLY A 25 -17.872 -11.648 0.785 1.00 0.00 O ATOM 0 H GLY A 25 -17.646 -15.585 -0.349 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -17.749 -13.496 -1.299 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -19.360 -13.244 -0.657 1.00 0.00 H new ATOM 375 N THR A 26 -17.221 -13.587 1.677 1.00 0.00 N ATOM 376 CA THR A 26 -16.572 -13.016 2.822 1.00 0.00 C ATOM 377 C THR A 26 -15.344 -13.840 3.189 1.00 0.00 C ATOM 378 O THR A 26 -15.367 -15.084 3.126 1.00 0.00 O ATOM 379 CB THR A 26 -17.515 -12.928 4.044 1.00 0.00 C ATOM 380 OG1 THR A 26 -18.203 -14.174 4.217 1.00 0.00 O ATOM 381 CG2 THR A 26 -18.515 -11.771 3.925 1.00 0.00 C ATOM 0 H THR A 26 -17.200 -14.607 1.658 1.00 0.00 H new ATOM 0 HA THR A 26 -16.277 -12.002 2.554 1.00 0.00 H new ATOM 0 HB THR A 26 -16.902 -12.726 4.922 1.00 0.00 H new ATOM 0 HG1 THR A 26 -18.798 -14.114 4.993 1.00 0.00 H new ATOM 0 HG21 THR A 26 -19.155 -11.751 4.807 1.00 0.00 H new ATOM 0 HG22 THR A 26 -17.973 -10.828 3.848 1.00 0.00 H new ATOM 0 HG23 THR A 26 -19.128 -11.910 3.035 1.00 0.00 H new ATOM 389 N ILE A 27 -14.286 -13.169 3.525 1.00 0.00 N ATOM 390 CA ILE A 27 -13.066 -13.786 3.942 1.00 0.00 C ATOM 391 C ILE A 27 -12.988 -13.607 5.447 1.00 0.00 C ATOM 392 O ILE A 27 -13.181 -12.485 5.952 1.00 0.00 O ATOM 393 CB ILE A 27 -11.831 -13.073 3.334 1.00 0.00 C ATOM 394 CG1 ILE A 27 -12.092 -12.657 1.904 1.00 0.00 C ATOM 395 CG2 ILE A 27 -10.666 -14.038 3.330 1.00 0.00 C ATOM 396 CD1 ILE A 27 -11.141 -11.595 1.390 1.00 0.00 C ATOM 0 H ILE A 27 -14.247 -12.150 3.516 1.00 0.00 H new ATOM 0 HA ILE A 27 -13.060 -14.829 3.624 1.00 0.00 H new ATOM 0 HB ILE A 27 -11.617 -12.188 3.933 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -12.022 -13.535 1.262 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -13.114 -12.285 1.825 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -9.790 -13.549 2.904 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -10.448 -14.349 4.352 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -10.920 -14.913 2.731 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -11.393 -11.350 0.358 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -11.227 -10.700 2.007 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.118 -11.970 1.435 1.00 0.00 H new ATOM 408 N THR A 28 -12.781 -14.675 6.144 1.00 0.00 N ATOM 409 CA THR A 28 -12.632 -14.638 7.575 1.00 0.00 C ATOM 410 C THR A 28 -11.142 -14.671 7.942 1.00 0.00 C ATOM 411 O THR A 28 -10.291 -14.884 7.049 1.00 0.00 O ATOM 412 CB THR A 28 -13.383 -15.826 8.221 1.00 0.00 C ATOM 413 OG1 THR A 28 -12.997 -17.063 7.593 1.00 0.00 O ATOM 414 CG2 THR A 28 -14.882 -15.648 8.091 1.00 0.00 C ATOM 0 H THR A 28 -12.709 -15.609 5.740 1.00 0.00 H new ATOM 0 HA THR A 28 -13.065 -13.714 7.958 1.00 0.00 H new ATOM 0 HB THR A 28 -13.118 -15.856 9.278 1.00 0.00 H new ATOM 0 HG1 THR A 28 -13.296 -17.063 6.660 1.00 0.00 H new ATOM 0 HG21 THR A 28 -15.390 -16.495 8.552 1.00 0.00 H new ATOM 0 HG22 THR A 28 -15.184 -14.728 8.591 1.00 0.00 H new ATOM 0 HG23 THR A 28 -15.152 -15.593 7.036 1.00 0.00 H new ATOM 422 N THR A 29 -10.814 -14.468 9.230 1.00 0.00 N ATOM 423 CA THR A 29 -9.424 -14.489 9.688 1.00 0.00 C ATOM 424 C THR A 29 -8.781 -15.834 9.379 1.00 0.00 C ATOM 425 O THR A 29 -7.626 -15.902 8.936 1.00 0.00 O ATOM 426 CB THR A 29 -9.308 -14.173 11.207 1.00 0.00 C ATOM 427 OG1 THR A 29 -10.204 -15.008 11.968 1.00 0.00 O ATOM 428 CG2 THR A 29 -9.617 -12.715 11.487 1.00 0.00 C ATOM 0 H THR A 29 -11.496 -14.288 9.967 1.00 0.00 H new ATOM 0 HA THR A 29 -8.892 -13.706 9.147 1.00 0.00 H new ATOM 0 HB THR A 29 -8.281 -14.378 11.508 1.00 0.00 H new ATOM 0 HG1 THR A 29 -9.727 -15.385 12.736 1.00 0.00 H new ATOM 0 HG21 THR A 29 -9.528 -12.523 12.556 1.00 0.00 H new ATOM 0 HG22 THR A 29 -8.913 -12.083 10.945 1.00 0.00 H new ATOM 0 HG23 THR A 29 -10.632 -12.489 11.161 1.00 0.00 H new ATOM 436 N LYS A 30 -9.576 -16.887 9.566 1.00 0.00 N ATOM 437 CA LYS A 30 -9.199 -18.262 9.277 1.00 0.00 C ATOM 438 C LYS A 30 -8.638 -18.362 7.871 1.00 0.00 C ATOM 439 O LYS A 30 -7.500 -18.787 7.655 1.00 0.00 O ATOM 440 CB LYS A 30 -10.459 -19.141 9.356 1.00 0.00 C ATOM 441 CG LYS A 30 -10.243 -20.615 9.044 1.00 0.00 C ATOM 442 CD LYS A 30 -11.549 -21.383 9.146 1.00 0.00 C ATOM 443 CE LYS A 30 -11.392 -22.825 8.697 1.00 0.00 C ATOM 444 NZ LYS A 30 -12.645 -23.589 8.830 1.00 0.00 N ATOM 0 H LYS A 30 -10.524 -16.800 9.932 1.00 0.00 H new ATOM 0 HA LYS A 30 -8.447 -18.589 9.995 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -10.879 -19.056 10.358 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -11.202 -18.745 8.664 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -9.830 -20.723 8.041 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -9.513 -21.035 9.736 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -11.905 -21.360 10.176 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -12.307 -20.893 8.536 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -11.064 -22.846 7.658 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -10.612 -23.305 9.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -12.491 -24.567 8.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -12.946 -23.592 9.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -13.384 -23.148 8.246 1.00 0.00 H new ATOM 458 N GLU A 31 -9.429 -17.903 6.939 1.00 0.00 N ATOM 459 CA GLU A 31 -9.138 -18.012 5.538 1.00 0.00 C ATOM 460 C GLU A 31 -7.940 -17.180 5.149 1.00 0.00 C ATOM 461 O GLU A 31 -7.063 -17.681 4.450 1.00 0.00 O ATOM 462 CB GLU A 31 -10.370 -17.644 4.747 1.00 0.00 C ATOM 463 CG GLU A 31 -11.545 -18.514 5.128 1.00 0.00 C ATOM 464 CD GLU A 31 -12.828 -18.099 4.480 1.00 0.00 C ATOM 465 OE1 GLU A 31 -13.336 -18.805 3.585 1.00 0.00 O ATOM 466 OE2 GLU A 31 -13.407 -17.064 4.876 1.00 0.00 O ATOM 0 H GLU A 31 -10.312 -17.433 7.138 1.00 0.00 H new ATOM 0 HA GLU A 31 -8.871 -19.043 5.308 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -10.618 -16.597 4.921 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -10.166 -17.750 3.681 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -11.326 -19.546 4.855 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -11.669 -18.490 6.211 1.00 0.00 H new ATOM 473 N LEU A 32 -7.877 -15.939 5.650 1.00 0.00 N ATOM 474 CA LEU A 32 -6.747 -15.046 5.372 1.00 0.00 C ATOM 475 C LEU A 32 -5.434 -15.707 5.717 1.00 0.00 C ATOM 476 O LEU A 32 -4.525 -15.773 4.891 1.00 0.00 O ATOM 477 CB LEU A 32 -6.849 -13.733 6.150 1.00 0.00 C ATOM 478 CG LEU A 32 -7.935 -12.751 5.739 1.00 0.00 C ATOM 479 CD1 LEU A 32 -7.895 -11.556 6.657 1.00 0.00 C ATOM 480 CD2 LEU A 32 -7.730 -12.295 4.305 1.00 0.00 C ATOM 0 H LEU A 32 -8.595 -15.532 6.249 1.00 0.00 H new ATOM 0 HA LEU A 32 -6.784 -14.829 4.304 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -6.998 -13.977 7.202 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -5.889 -13.223 6.074 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.904 -13.246 5.811 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -8.672 -10.848 6.367 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -8.064 -11.880 7.684 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -6.920 -11.074 6.585 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.517 -11.593 4.030 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -6.760 -11.806 4.214 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.765 -13.158 3.640 1.00 0.00 H new ATOM 492 N GLY A 33 -5.343 -16.222 6.917 1.00 0.00 N ATOM 493 CA GLY A 33 -4.124 -16.834 7.320 1.00 0.00 C ATOM 494 C GLY A 33 -3.891 -18.159 6.657 1.00 0.00 C ATOM 495 O GLY A 33 -2.787 -18.438 6.303 1.00 0.00 O ATOM 0 H GLY A 33 -6.089 -16.226 7.613 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -3.294 -16.166 7.089 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -4.132 -16.970 8.401 1.00 0.00 H new ATOM 499 N THR A 34 -4.935 -18.956 6.442 1.00 0.00 N ATOM 500 CA THR A 34 -4.767 -20.266 5.792 1.00 0.00 C ATOM 501 C THR A 34 -4.142 -20.104 4.392 1.00 0.00 C ATOM 502 O THR A 34 -3.136 -20.764 4.050 1.00 0.00 O ATOM 503 CB THR A 34 -6.114 -21.031 5.662 1.00 0.00 C ATOM 504 OG1 THR A 34 -6.733 -21.181 6.956 1.00 0.00 O ATOM 505 CG2 THR A 34 -5.889 -22.417 5.058 1.00 0.00 C ATOM 0 H THR A 34 -5.895 -18.728 6.701 1.00 0.00 H new ATOM 0 HA THR A 34 -4.101 -20.848 6.429 1.00 0.00 H new ATOM 0 HB THR A 34 -6.766 -20.452 5.008 1.00 0.00 H new ATOM 0 HG1 THR A 34 -6.941 -20.297 7.323 1.00 0.00 H new ATOM 0 HG21 THR A 34 -6.843 -22.937 4.975 1.00 0.00 H new ATOM 0 HG22 THR A 34 -5.444 -22.315 4.068 1.00 0.00 H new ATOM 0 HG23 THR A 34 -5.219 -22.989 5.700 1.00 0.00 H new ATOM 513 N VAL A 35 -4.696 -19.187 3.614 1.00 0.00 N ATOM 514 CA VAL A 35 -4.219 -18.955 2.269 1.00 0.00 C ATOM 515 C VAL A 35 -2.797 -18.348 2.301 1.00 0.00 C ATOM 516 O VAL A 35 -1.942 -18.702 1.494 1.00 0.00 O ATOM 517 CB VAL A 35 -5.229 -18.089 1.431 1.00 0.00 C ATOM 518 CG1 VAL A 35 -6.614 -18.743 1.444 1.00 0.00 C ATOM 519 CG2 VAL A 35 -5.316 -16.646 1.923 1.00 0.00 C ATOM 0 H VAL A 35 -5.476 -18.594 3.895 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.154 -19.915 1.756 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.852 -18.050 0.409 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -7.308 -18.137 0.861 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -6.550 -19.740 1.009 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -6.972 -18.818 2.471 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -6.027 -16.094 1.309 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -5.648 -16.635 2.961 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -4.335 -16.177 1.851 1.00 0.00 H new ATOM 529 N MET A 36 -2.529 -17.516 3.306 1.00 0.00 N ATOM 530 CA MET A 36 -1.221 -16.898 3.461 1.00 0.00 C ATOM 531 C MET A 36 -0.154 -17.866 3.946 1.00 0.00 C ATOM 532 O MET A 36 0.988 -17.817 3.486 1.00 0.00 O ATOM 533 CB MET A 36 -1.279 -15.614 4.303 1.00 0.00 C ATOM 534 CG MET A 36 -1.840 -14.445 3.494 1.00 0.00 C ATOM 535 SD MET A 36 -1.722 -12.836 4.306 1.00 0.00 S ATOM 536 CE MET A 36 -2.842 -13.054 5.664 1.00 0.00 C ATOM 0 H MET A 36 -3.205 -17.256 4.025 1.00 0.00 H new ATOM 0 HA MET A 36 -0.912 -16.600 2.459 1.00 0.00 H new ATOM 0 HB2 MET A 36 -1.900 -15.781 5.183 1.00 0.00 H new ATOM 0 HB3 MET A 36 -0.280 -15.365 4.661 1.00 0.00 H new ATOM 0 HG2 MET A 36 -1.313 -14.395 2.541 1.00 0.00 H new ATOM 0 HG3 MET A 36 -2.887 -14.647 3.269 1.00 0.00 H new ATOM 0 HE1 MET A 36 -2.849 -12.154 6.278 1.00 0.00 H new ATOM 0 HE2 MET A 36 -3.846 -13.240 5.282 1.00 0.00 H new ATOM 0 HE3 MET A 36 -2.521 -13.903 6.268 1.00 0.00 H new ATOM 546 N ARG A 37 -0.522 -18.776 4.827 1.00 0.00 N ATOM 547 CA ARG A 37 0.402 -19.785 5.335 1.00 0.00 C ATOM 548 C ARG A 37 0.797 -20.720 4.223 1.00 0.00 C ATOM 549 O ARG A 37 1.909 -21.208 4.182 1.00 0.00 O ATOM 550 CB ARG A 37 -0.196 -20.563 6.513 1.00 0.00 C ATOM 551 CG ARG A 37 -0.472 -19.697 7.732 1.00 0.00 C ATOM 552 CD ARG A 37 -1.000 -20.497 8.906 1.00 0.00 C ATOM 553 NE ARG A 37 -2.225 -21.226 8.582 1.00 0.00 N ATOM 554 CZ ARG A 37 -3.399 -21.096 9.215 1.00 0.00 C ATOM 555 NH1 ARG A 37 -3.589 -20.125 10.107 1.00 0.00 N ATOM 556 NH2 ARG A 37 -4.396 -21.920 8.911 1.00 0.00 N ATOM 0 H ARG A 37 -1.464 -18.841 5.212 1.00 0.00 H new ATOM 0 HA ARG A 37 1.290 -19.275 5.707 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -1.126 -21.034 6.193 1.00 0.00 H new ATOM 0 HB3 ARG A 37 0.487 -21.365 6.793 1.00 0.00 H new ATOM 0 HG2 ARG A 37 0.446 -19.188 8.027 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -1.195 -18.925 7.469 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -0.237 -21.203 9.233 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -1.192 -19.825 9.742 1.00 0.00 H new ATOM 0 HE ARG A 37 -2.183 -21.890 7.809 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -2.836 -19.469 10.315 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -4.488 -20.037 10.582 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -4.263 -22.642 8.203 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -5.294 -21.831 9.386 1.00 0.00 H new ATOM 570 N SER A 38 -0.108 -20.904 3.289 1.00 0.00 N ATOM 571 CA SER A 38 0.144 -21.722 2.137 1.00 0.00 C ATOM 572 C SER A 38 1.128 -21.021 1.183 1.00 0.00 C ATOM 573 O SER A 38 1.936 -21.671 0.512 1.00 0.00 O ATOM 574 CB SER A 38 -1.175 -22.041 1.446 1.00 0.00 C ATOM 575 OG SER A 38 -2.076 -22.662 2.370 1.00 0.00 O ATOM 0 H SER A 38 -1.039 -20.488 3.312 1.00 0.00 H new ATOM 0 HA SER A 38 0.606 -22.659 2.448 1.00 0.00 H new ATOM 0 HB2 SER A 38 -1.619 -21.127 1.052 1.00 0.00 H new ATOM 0 HB3 SER A 38 -0.999 -22.702 0.597 1.00 0.00 H new ATOM 0 HG SER A 38 -2.523 -21.973 2.905 1.00 0.00 H new ATOM 581 N LEU A 39 1.088 -19.695 1.173 1.00 0.00 N ATOM 582 CA LEU A 39 1.971 -18.899 0.329 1.00 0.00 C ATOM 583 C LEU A 39 3.332 -18.688 1.009 1.00 0.00 C ATOM 584 O LEU A 39 4.313 -18.305 0.365 1.00 0.00 O ATOM 585 CB LEU A 39 1.309 -17.560 -0.025 1.00 0.00 C ATOM 586 CG LEU A 39 -0.016 -17.655 -0.812 1.00 0.00 C ATOM 587 CD1 LEU A 39 -0.631 -16.287 -0.990 1.00 0.00 C ATOM 588 CD2 LEU A 39 0.190 -18.319 -2.170 1.00 0.00 C ATOM 0 H LEU A 39 0.448 -19.144 1.745 1.00 0.00 H new ATOM 0 HA LEU A 39 2.148 -19.443 -0.599 1.00 0.00 H new ATOM 0 HB2 LEU A 39 1.123 -17.012 0.899 1.00 0.00 H new ATOM 0 HB3 LEU A 39 2.015 -16.970 -0.609 1.00 0.00 H new ATOM 0 HG LEU A 39 -0.699 -18.275 -0.231 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -1.564 -16.377 -1.547 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -0.833 -15.849 -0.013 1.00 0.00 H new ATOM 0 HD13 LEU A 39 0.059 -15.646 -1.539 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -0.762 -18.370 -2.698 1.00 0.00 H new ATOM 0 HD22 LEU A 39 0.899 -17.735 -2.757 1.00 0.00 H new ATOM 0 HD23 LEU A 39 0.580 -19.327 -2.027 1.00 0.00 H new ATOM 600 N GLY A 40 3.388 -18.956 2.299 1.00 0.00 N ATOM 601 CA GLY A 40 4.641 -18.875 3.016 1.00 0.00 C ATOM 602 C GLY A 40 4.740 -17.710 3.991 1.00 0.00 C ATOM 603 O GLY A 40 5.806 -17.095 4.121 1.00 0.00 O ATOM 0 H GLY A 40 2.586 -19.230 2.867 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.791 -19.805 3.565 1.00 0.00 H new ATOM 0 HA3 GLY A 40 5.453 -18.797 2.293 1.00 0.00 H new ATOM 607 N GLN A 41 3.645 -17.386 4.655 1.00 0.00 N ATOM 608 CA GLN A 41 3.659 -16.379 5.703 1.00 0.00 C ATOM 609 C GLN A 41 2.629 -16.731 6.739 1.00 0.00 C ATOM 610 O GLN A 41 1.511 -17.058 6.400 1.00 0.00 O ATOM 611 CB GLN A 41 3.401 -14.991 5.140 1.00 0.00 C ATOM 612 CG GLN A 41 3.429 -13.880 6.171 1.00 0.00 C ATOM 613 CD GLN A 41 3.482 -12.521 5.534 1.00 0.00 C ATOM 614 OE1 GLN A 41 2.464 -11.911 5.230 1.00 0.00 O ATOM 615 NE2 GLN A 41 4.668 -12.037 5.328 1.00 0.00 N ATOM 0 H GLN A 41 2.731 -17.807 4.487 1.00 0.00 H new ATOM 0 HA GLN A 41 4.647 -16.363 6.162 1.00 0.00 H new ATOM 0 HB2 GLN A 41 4.148 -14.778 4.375 1.00 0.00 H new ATOM 0 HB3 GLN A 41 2.429 -14.988 4.647 1.00 0.00 H new ATOM 0 HG2 GLN A 41 2.544 -13.950 6.803 1.00 0.00 H new ATOM 0 HG3 GLN A 41 4.295 -14.010 6.820 1.00 0.00 H new ATOM 0 HE21 GLN A 41 5.492 -12.576 5.595 1.00 0.00 H new ATOM 0 HE22 GLN A 41 4.776 -11.118 4.899 1.00 0.00 H new ATOM 624 N ASN A 42 3.004 -16.713 7.994 1.00 0.00 N ATOM 625 CA ASN A 42 2.064 -17.048 9.066 1.00 0.00 C ATOM 626 C ASN A 42 1.788 -15.841 9.975 1.00 0.00 C ATOM 627 O ASN A 42 2.432 -15.692 11.018 1.00 0.00 O ATOM 628 CB ASN A 42 2.543 -18.249 9.941 1.00 0.00 C ATOM 629 CG ASN A 42 2.591 -19.627 9.253 1.00 0.00 C ATOM 630 OD1 ASN A 42 2.926 -19.685 7.982 1.00 0.00 O flip ATOM 631 ND2 ASN A 42 2.343 -20.646 9.890 1.00 0.00 N flip ATOM 0 H ASN A 42 3.944 -16.473 8.310 1.00 0.00 H new ATOM 0 HA ASN A 42 1.143 -17.342 8.563 1.00 0.00 H new ATOM 0 HB2 ASN A 42 3.540 -18.021 10.317 1.00 0.00 H new ATOM 0 HB3 ASN A 42 1.886 -18.323 10.807 1.00 0.00 H new ATOM 0 HD21 ASN A 42 2.085 -20.582 10.875 1.00 0.00 H new ATOM 0 HD22 ASN A 42 2.395 -21.557 9.435 1.00 0.00 H new ATOM 638 N PRO A 43 0.903 -14.909 9.566 1.00 0.00 N ATOM 639 CA PRO A 43 0.510 -13.783 10.414 1.00 0.00 C ATOM 640 C PRO A 43 -0.465 -14.238 11.497 1.00 0.00 C ATOM 641 O PRO A 43 -1.178 -15.231 11.324 1.00 0.00 O ATOM 642 CB PRO A 43 -0.192 -12.808 9.447 1.00 0.00 C ATOM 643 CG PRO A 43 0.040 -13.363 8.080 1.00 0.00 C ATOM 644 CD PRO A 43 0.252 -14.837 8.256 1.00 0.00 C ATOM 0 HA PRO A 43 1.361 -13.334 10.926 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -1.257 -12.738 9.666 1.00 0.00 H new ATOM 0 HB3 PRO A 43 0.219 -11.802 9.537 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -0.813 -13.167 7.431 1.00 0.00 H new ATOM 0 HG3 PRO A 43 0.908 -12.898 7.614 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -0.689 -15.387 8.240 1.00 0.00 H new ATOM 0 HD3 PRO A 43 0.879 -15.254 7.468 1.00 0.00 H new ATOM 652 N THR A 44 -0.500 -13.527 12.586 1.00 0.00 N ATOM 653 CA THR A 44 -1.363 -13.871 13.695 1.00 0.00 C ATOM 654 C THR A 44 -2.772 -13.326 13.458 1.00 0.00 C ATOM 655 O THR A 44 -2.960 -12.430 12.613 1.00 0.00 O ATOM 656 CB THR A 44 -0.794 -13.328 15.023 1.00 0.00 C ATOM 657 OG1 THR A 44 -0.584 -11.902 14.938 1.00 0.00 O ATOM 658 CG2 THR A 44 0.516 -14.016 15.367 1.00 0.00 C ATOM 0 H THR A 44 0.066 -12.692 12.737 1.00 0.00 H new ATOM 0 HA THR A 44 -1.413 -14.958 13.765 1.00 0.00 H new ATOM 0 HB THR A 44 -1.520 -13.536 15.810 1.00 0.00 H new ATOM 0 HG1 THR A 44 0.197 -11.719 14.375 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.900 -13.619 16.307 1.00 0.00 H new ATOM 0 HG22 THR A 44 0.348 -15.088 15.468 1.00 0.00 H new ATOM 0 HG23 THR A 44 1.241 -13.836 14.573 1.00 0.00 H new ATOM 666 N GLU A 45 -3.748 -13.825 14.209 1.00 0.00 N ATOM 667 CA GLU A 45 -5.130 -13.427 14.027 1.00 0.00 C ATOM 668 C GLU A 45 -5.348 -11.964 14.393 1.00 0.00 C ATOM 669 O GLU A 45 -6.229 -11.319 13.846 1.00 0.00 O ATOM 670 CB GLU A 45 -6.099 -14.367 14.765 1.00 0.00 C ATOM 671 CG GLU A 45 -7.565 -14.011 14.576 1.00 0.00 C ATOM 672 CD GLU A 45 -8.504 -15.065 15.085 1.00 0.00 C ATOM 673 OE1 GLU A 45 -8.737 -15.142 16.313 1.00 0.00 O ATOM 674 OE2 GLU A 45 -9.049 -15.831 14.265 1.00 0.00 O ATOM 0 H GLU A 45 -3.601 -14.509 14.952 1.00 0.00 H new ATOM 0 HA GLU A 45 -5.357 -13.521 12.965 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -5.935 -15.387 14.418 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -5.865 -14.351 15.830 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -7.772 -13.072 15.089 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -7.757 -13.845 13.516 1.00 0.00 H new ATOM 681 N ALA A 46 -4.524 -11.437 15.287 1.00 0.00 N ATOM 682 CA ALA A 46 -4.588 -10.018 15.636 1.00 0.00 C ATOM 683 C ALA A 46 -4.356 -9.170 14.387 1.00 0.00 C ATOM 684 O ALA A 46 -5.102 -8.225 14.104 1.00 0.00 O ATOM 685 CB ALA A 46 -3.553 -9.679 16.693 1.00 0.00 C ATOM 0 H ALA A 46 -3.806 -11.964 15.784 1.00 0.00 H new ATOM 0 HA ALA A 46 -5.577 -9.802 16.041 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -3.617 -8.619 16.938 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -3.741 -10.271 17.589 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -2.557 -9.903 16.312 1.00 0.00 H new ATOM 691 N GLU A 47 -3.350 -9.563 13.622 1.00 0.00 N ATOM 692 CA GLU A 47 -3.001 -8.905 12.381 1.00 0.00 C ATOM 693 C GLU A 47 -4.104 -9.125 11.359 1.00 0.00 C ATOM 694 O GLU A 47 -4.590 -8.180 10.751 1.00 0.00 O ATOM 695 CB GLU A 47 -1.699 -9.484 11.854 1.00 0.00 C ATOM 696 CG GLU A 47 -0.537 -9.340 12.809 1.00 0.00 C ATOM 697 CD GLU A 47 0.666 -10.110 12.354 1.00 0.00 C ATOM 698 OE1 GLU A 47 1.448 -9.602 11.529 1.00 0.00 O ATOM 699 OE2 GLU A 47 0.854 -11.247 12.825 1.00 0.00 O ATOM 0 H GLU A 47 -2.750 -10.355 13.850 1.00 0.00 H new ATOM 0 HA GLU A 47 -2.881 -7.836 12.558 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -1.846 -10.541 11.632 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -1.448 -8.993 10.914 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -0.277 -8.286 12.906 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -0.836 -9.687 13.798 1.00 0.00 H new ATOM 706 N LEU A 48 -4.526 -10.384 11.225 1.00 0.00 N ATOM 707 CA LEU A 48 -5.561 -10.783 10.258 1.00 0.00 C ATOM 708 C LEU A 48 -6.858 -10.005 10.485 1.00 0.00 C ATOM 709 O LEU A 48 -7.502 -9.550 9.543 1.00 0.00 O ATOM 710 CB LEU A 48 -5.852 -12.288 10.373 1.00 0.00 C ATOM 711 CG LEU A 48 -4.653 -13.228 10.226 1.00 0.00 C ATOM 712 CD1 LEU A 48 -5.066 -14.676 10.414 1.00 0.00 C ATOM 713 CD2 LEU A 48 -3.990 -13.045 8.887 1.00 0.00 C ATOM 0 H LEU A 48 -4.163 -11.158 11.781 1.00 0.00 H new ATOM 0 HA LEU A 48 -5.183 -10.557 9.261 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -6.314 -12.473 11.343 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -6.588 -12.552 9.614 1.00 0.00 H new ATOM 0 HG LEU A 48 -3.936 -12.973 11.006 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -4.194 -15.320 10.304 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -5.491 -14.807 11.409 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -5.811 -14.942 9.664 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -3.141 -13.723 8.806 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -4.705 -13.263 8.094 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -3.643 -12.016 8.790 1.00 0.00 H new ATOM 725 N GLN A 49 -7.212 -9.834 11.733 1.00 0.00 N ATOM 726 CA GLN A 49 -8.422 -9.156 12.088 1.00 0.00 C ATOM 727 C GLN A 49 -8.321 -7.667 11.790 1.00 0.00 C ATOM 728 O GLN A 49 -9.301 -7.058 11.356 1.00 0.00 O ATOM 729 CB GLN A 49 -8.779 -9.415 13.554 1.00 0.00 C ATOM 730 CG GLN A 49 -10.146 -8.902 13.961 1.00 0.00 C ATOM 731 CD GLN A 49 -11.251 -9.501 13.115 1.00 0.00 C ATOM 732 OE1 GLN A 49 -11.798 -10.556 13.433 1.00 0.00 O ATOM 733 NE2 GLN A 49 -11.589 -8.841 12.042 1.00 0.00 N ATOM 0 H GLN A 49 -6.666 -10.163 12.529 1.00 0.00 H new ATOM 0 HA GLN A 49 -9.230 -9.556 11.476 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -8.735 -10.488 13.743 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -8.025 -8.948 14.188 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -10.324 -9.138 15.010 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -10.168 -7.816 13.870 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -11.114 -7.969 11.809 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -12.328 -9.197 11.436 1.00 0.00 H new ATOM 742 N ASP A 50 -7.135 -7.099 11.979 1.00 0.00 N ATOM 743 CA ASP A 50 -6.906 -5.675 11.694 1.00 0.00 C ATOM 744 C ASP A 50 -7.009 -5.450 10.203 1.00 0.00 C ATOM 745 O ASP A 50 -7.611 -4.481 9.744 1.00 0.00 O ATOM 746 CB ASP A 50 -5.530 -5.218 12.202 1.00 0.00 C ATOM 747 CG ASP A 50 -5.289 -3.730 11.991 1.00 0.00 C ATOM 748 OD1 ASP A 50 -5.743 -2.920 12.830 1.00 0.00 O ATOM 749 OD2 ASP A 50 -4.622 -3.345 11.008 1.00 0.00 O ATOM 0 H ASP A 50 -6.315 -7.596 12.327 1.00 0.00 H new ATOM 0 HA ASP A 50 -7.662 -5.087 12.214 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -5.445 -5.448 13.264 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -4.752 -5.784 11.690 1.00 0.00 H new ATOM 754 N MET A 51 -6.444 -6.390 9.455 1.00 0.00 N ATOM 755 CA MET A 51 -6.498 -6.407 7.993 1.00 0.00 C ATOM 756 C MET A 51 -7.940 -6.347 7.521 1.00 0.00 C ATOM 757 O MET A 51 -8.286 -5.563 6.632 1.00 0.00 O ATOM 758 CB MET A 51 -5.829 -7.676 7.457 1.00 0.00 C ATOM 759 CG MET A 51 -4.336 -7.761 7.715 1.00 0.00 C ATOM 760 SD MET A 51 -3.641 -9.344 7.204 1.00 0.00 S ATOM 761 CE MET A 51 -1.920 -9.108 7.648 1.00 0.00 C ATOM 0 H MET A 51 -5.927 -7.175 9.850 1.00 0.00 H new ATOM 0 HA MET A 51 -5.965 -5.535 7.614 1.00 0.00 H new ATOM 0 HB2 MET A 51 -6.312 -8.543 7.907 1.00 0.00 H new ATOM 0 HB3 MET A 51 -6.003 -7.736 6.383 1.00 0.00 H new ATOM 0 HG2 MET A 51 -3.831 -6.956 7.181 1.00 0.00 H new ATOM 0 HG3 MET A 51 -4.144 -7.609 8.777 1.00 0.00 H new ATOM 0 HE1 MET A 51 -1.409 -10.071 7.648 1.00 0.00 H new ATOM 0 HE2 MET A 51 -1.445 -8.445 6.925 1.00 0.00 H new ATOM 0 HE3 MET A 51 -1.858 -8.665 8.642 1.00 0.00 H new ATOM 771 N ILE A 52 -8.775 -7.160 8.142 1.00 0.00 N ATOM 772 CA ILE A 52 -10.189 -7.191 7.837 1.00 0.00 C ATOM 773 C ILE A 52 -10.869 -5.902 8.248 1.00 0.00 C ATOM 774 O ILE A 52 -11.491 -5.244 7.439 1.00 0.00 O ATOM 775 CB ILE A 52 -10.916 -8.353 8.561 1.00 0.00 C ATOM 776 CG1 ILE A 52 -10.404 -9.705 8.075 1.00 0.00 C ATOM 777 CG2 ILE A 52 -12.428 -8.238 8.375 1.00 0.00 C ATOM 778 CD1 ILE A 52 -11.050 -10.896 8.744 1.00 0.00 C ATOM 0 H ILE A 52 -8.490 -7.815 8.870 1.00 0.00 H new ATOM 0 HA ILE A 52 -10.256 -7.331 6.758 1.00 0.00 H new ATOM 0 HB ILE A 52 -10.699 -8.281 9.627 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -10.566 -9.776 7.000 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -9.327 -9.752 8.238 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -12.922 -9.062 8.890 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -12.775 -7.291 8.790 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -12.668 -8.278 7.313 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -10.627 -11.815 8.338 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.866 -10.855 9.818 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -12.124 -10.879 8.559 1.00 0.00 H new ATOM 790 N ASN A 53 -10.716 -5.549 9.504 1.00 0.00 N ATOM 791 CA ASN A 53 -11.448 -4.446 10.116 1.00 0.00 C ATOM 792 C ASN A 53 -11.284 -3.119 9.387 1.00 0.00 C ATOM 793 O ASN A 53 -12.225 -2.335 9.321 1.00 0.00 O ATOM 794 CB ASN A 53 -11.121 -4.325 11.611 1.00 0.00 C ATOM 795 CG ASN A 53 -11.779 -3.131 12.278 1.00 0.00 C ATOM 796 OD1 ASN A 53 -12.940 -3.197 12.697 1.00 0.00 O ATOM 797 ND2 ASN A 53 -11.036 -2.065 12.448 1.00 0.00 N ATOM 0 H ASN A 53 -10.075 -6.020 10.142 1.00 0.00 H new ATOM 0 HA ASN A 53 -12.505 -4.695 10.019 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -11.438 -5.236 12.119 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -10.041 -4.251 11.734 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -11.412 -1.254 12.940 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -10.082 -2.046 12.089 1.00 0.00 H new ATOM 804 N GLU A 54 -10.124 -2.899 8.796 1.00 0.00 N ATOM 805 CA GLU A 54 -9.842 -1.752 8.073 1.00 0.00 C ATOM 806 C GLU A 54 -10.760 -1.581 6.860 1.00 0.00 C ATOM 807 O GLU A 54 -11.175 -0.459 6.542 1.00 0.00 O ATOM 808 CB GLU A 54 -8.415 -1.851 7.683 1.00 0.00 C ATOM 809 CG GLU A 54 -7.459 -1.534 8.809 1.00 0.00 C ATOM 810 CD GLU A 54 -7.683 -0.149 9.354 1.00 0.00 C ATOM 811 OE1 GLU A 54 -7.130 0.807 8.788 1.00 0.00 O ATOM 812 OE2 GLU A 54 -8.431 0.001 10.344 1.00 0.00 O ATOM 0 H GLU A 54 -9.349 -3.561 8.829 1.00 0.00 H new ATOM 0 HA GLU A 54 -10.023 -0.863 8.678 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -8.215 -2.859 7.320 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -8.225 -1.170 6.853 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -7.583 -2.264 9.608 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -6.433 -1.623 8.452 1.00 0.00 H new ATOM 819 N VAL A 55 -11.105 -2.674 6.214 1.00 0.00 N ATOM 820 CA VAL A 55 -11.995 -2.617 5.063 1.00 0.00 C ATOM 821 C VAL A 55 -13.411 -2.956 5.481 1.00 0.00 C ATOM 822 O VAL A 55 -14.366 -2.699 4.747 1.00 0.00 O ATOM 823 CB VAL A 55 -11.558 -3.567 3.912 1.00 0.00 C ATOM 824 CG1 VAL A 55 -10.199 -3.201 3.398 1.00 0.00 C ATOM 825 CG2 VAL A 55 -11.573 -5.025 4.335 1.00 0.00 C ATOM 0 H VAL A 55 -10.787 -3.611 6.461 1.00 0.00 H new ATOM 0 HA VAL A 55 -11.945 -1.597 4.682 1.00 0.00 H new ATOM 0 HB VAL A 55 -12.288 -3.442 3.112 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -9.919 -3.882 2.594 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -10.216 -2.179 3.019 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -9.472 -3.276 4.207 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -11.261 -5.650 3.498 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -10.888 -5.168 5.171 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -12.581 -5.305 4.640 1.00 0.00 H new ATOM 835 N ASP A 56 -13.538 -3.501 6.668 1.00 0.00 N ATOM 836 CA ASP A 56 -14.808 -3.932 7.178 1.00 0.00 C ATOM 837 C ASP A 56 -15.601 -2.765 7.698 1.00 0.00 C ATOM 838 O ASP A 56 -15.315 -2.218 8.770 1.00 0.00 O ATOM 839 CB ASP A 56 -14.655 -4.972 8.278 1.00 0.00 C ATOM 840 CG ASP A 56 -15.987 -5.529 8.700 1.00 0.00 C ATOM 841 OD1 ASP A 56 -16.909 -5.606 7.863 1.00 0.00 O ATOM 842 OD2 ASP A 56 -16.134 -5.911 9.856 1.00 0.00 O ATOM 0 H ASP A 56 -12.757 -3.656 7.306 1.00 0.00 H new ATOM 0 HA ASP A 56 -15.343 -4.390 6.346 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -14.015 -5.782 7.928 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -14.158 -4.523 9.138 1.00 0.00 H new ATOM 847 N ALA A 57 -16.585 -2.390 6.945 1.00 0.00 N ATOM 848 CA ALA A 57 -17.443 -1.285 7.291 1.00 0.00 C ATOM 849 C ALA A 57 -18.590 -1.744 8.186 1.00 0.00 C ATOM 850 O ALA A 57 -19.339 -0.926 8.727 1.00 0.00 O ATOM 851 CB ALA A 57 -17.973 -0.613 6.034 1.00 0.00 C ATOM 0 H ALA A 57 -16.824 -2.842 6.062 1.00 0.00 H new ATOM 0 HA ALA A 57 -16.855 -0.557 7.850 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -18.619 0.220 6.311 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -17.138 -0.242 5.440 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -18.542 -1.335 5.448 1.00 0.00 H new ATOM 857 N ASP A 58 -18.733 -3.052 8.340 1.00 0.00 N ATOM 858 CA ASP A 58 -19.852 -3.596 9.112 1.00 0.00 C ATOM 859 C ASP A 58 -19.463 -3.819 10.555 1.00 0.00 C ATOM 860 O ASP A 58 -20.327 -4.016 11.399 1.00 0.00 O ATOM 861 CB ASP A 58 -20.293 -4.953 8.553 1.00 0.00 C ATOM 862 CG ASP A 58 -20.676 -4.941 7.106 1.00 0.00 C ATOM 863 OD1 ASP A 58 -19.778 -5.106 6.240 1.00 0.00 O ATOM 864 OD2 ASP A 58 -21.872 -4.801 6.777 1.00 0.00 O ATOM 0 H ASP A 58 -18.101 -3.751 7.949 1.00 0.00 H new ATOM 0 HA ASP A 58 -20.660 -2.868 9.043 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -19.483 -5.669 8.694 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -21.141 -5.312 9.136 1.00 0.00 H new ATOM 869 N GLY A 59 -18.172 -3.737 10.848 1.00 0.00 N ATOM 870 CA GLY A 59 -17.687 -4.012 12.196 1.00 0.00 C ATOM 871 C GLY A 59 -18.043 -5.430 12.650 1.00 0.00 C ATOM 872 O GLY A 59 -18.373 -5.660 13.814 1.00 0.00 O ATOM 0 H GLY A 59 -17.446 -3.485 10.177 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -16.605 -3.881 12.227 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -18.115 -3.290 12.891 1.00 0.00 H new ATOM 876 N ASN A 60 -17.980 -6.372 11.728 1.00 0.00 N ATOM 877 CA ASN A 60 -18.373 -7.750 12.012 1.00 0.00 C ATOM 878 C ASN A 60 -17.193 -8.688 11.910 1.00 0.00 C ATOM 879 O ASN A 60 -17.268 -9.846 12.344 1.00 0.00 O ATOM 880 CB ASN A 60 -19.498 -8.244 11.084 1.00 0.00 C ATOM 881 CG ASN A 60 -20.817 -7.491 11.222 1.00 0.00 C ATOM 882 OD1 ASN A 60 -21.575 -7.390 10.263 1.00 0.00 O ATOM 883 ND2 ASN A 60 -21.102 -6.959 12.385 1.00 0.00 N ATOM 0 H ASN A 60 -17.661 -6.213 10.772 1.00 0.00 H new ATOM 0 HA ASN A 60 -18.751 -7.752 13.034 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -19.158 -8.167 10.051 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -19.676 -9.301 11.283 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -21.974 -6.445 12.511 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -20.452 -7.059 13.165 1.00 0.00 H new ATOM 890 N GLY A 61 -16.127 -8.217 11.310 1.00 0.00 N ATOM 891 CA GLY A 61 -14.936 -9.009 11.218 1.00 0.00 C ATOM 892 C GLY A 61 -14.879 -9.866 9.971 1.00 0.00 C ATOM 893 O GLY A 61 -14.167 -10.865 9.945 1.00 0.00 O ATOM 0 H GLY A 61 -16.064 -7.293 10.882 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -14.068 -8.350 11.237 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -14.867 -9.652 12.095 1.00 0.00 H new ATOM 897 N THR A 62 -15.602 -9.483 8.940 1.00 0.00 N ATOM 898 CA THR A 62 -15.593 -10.215 7.682 1.00 0.00 C ATOM 899 C THR A 62 -15.443 -9.263 6.479 1.00 0.00 C ATOM 900 O THR A 62 -16.083 -8.188 6.435 1.00 0.00 O ATOM 901 CB THR A 62 -16.871 -11.076 7.540 1.00 0.00 C ATOM 902 OG1 THR A 62 -18.009 -10.327 7.983 1.00 0.00 O ATOM 903 CG2 THR A 62 -16.770 -12.370 8.328 1.00 0.00 C ATOM 0 H THR A 62 -16.209 -8.663 8.945 1.00 0.00 H new ATOM 0 HA THR A 62 -14.728 -10.879 7.691 1.00 0.00 H new ATOM 0 HB THR A 62 -16.983 -11.336 6.487 1.00 0.00 H new ATOM 0 HG1 THR A 62 -18.817 -10.874 7.890 1.00 0.00 H new ATOM 0 HG21 THR A 62 -17.687 -12.945 8.202 1.00 0.00 H new ATOM 0 HG22 THR A 62 -15.923 -12.952 7.964 1.00 0.00 H new ATOM 0 HG23 THR A 62 -16.627 -12.142 9.384 1.00 0.00 H new ATOM 911 N ILE A 63 -14.602 -9.640 5.520 1.00 0.00 N ATOM 912 CA ILE A 63 -14.373 -8.826 4.319 1.00 0.00 C ATOM 913 C ILE A 63 -15.337 -9.274 3.250 1.00 0.00 C ATOM 914 O ILE A 63 -15.222 -10.365 2.745 1.00 0.00 O ATOM 915 CB ILE A 63 -12.935 -9.020 3.741 1.00 0.00 C ATOM 916 CG1 ILE A 63 -11.890 -8.814 4.815 1.00 0.00 C ATOM 917 CG2 ILE A 63 -12.674 -8.041 2.576 1.00 0.00 C ATOM 918 CD1 ILE A 63 -10.485 -9.146 4.373 1.00 0.00 C ATOM 0 H ILE A 63 -14.064 -10.506 5.547 1.00 0.00 H new ATOM 0 HA ILE A 63 -14.507 -7.781 4.599 1.00 0.00 H new ATOM 0 HB ILE A 63 -12.866 -10.042 3.369 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -11.921 -7.775 5.144 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -12.144 -9.429 5.678 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -11.666 -8.195 2.190 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -13.398 -8.220 1.781 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -12.773 -7.016 2.933 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -9.794 -8.973 5.198 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -10.436 -10.192 4.072 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -10.210 -8.513 3.530 1.00 0.00 H new ATOM 930 N ASP A 64 -16.270 -8.458 2.933 1.00 0.00 N ATOM 931 CA ASP A 64 -17.230 -8.773 1.901 1.00 0.00 C ATOM 932 C ASP A 64 -16.570 -8.621 0.563 1.00 0.00 C ATOM 933 O ASP A 64 -15.588 -7.884 0.442 1.00 0.00 O ATOM 934 CB ASP A 64 -18.441 -7.844 1.968 1.00 0.00 C ATOM 935 CG ASP A 64 -19.344 -8.073 3.146 1.00 0.00 C ATOM 936 OD1 ASP A 64 -19.108 -7.464 4.227 1.00 0.00 O ATOM 937 OD2 ASP A 64 -20.334 -8.818 3.011 1.00 0.00 O ATOM 0 H ASP A 64 -16.405 -7.547 3.372 1.00 0.00 H new ATOM 0 HA ASP A 64 -17.574 -9.797 2.049 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -18.089 -6.813 1.992 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -19.023 -7.961 1.054 1.00 0.00 H new ATOM 942 N PHE A 65 -17.075 -9.319 -0.425 1.00 0.00 N ATOM 943 CA PHE A 65 -16.576 -9.214 -1.789 1.00 0.00 C ATOM 944 C PHE A 65 -16.512 -7.737 -2.264 1.00 0.00 C ATOM 945 O PHE A 65 -15.466 -7.306 -2.749 1.00 0.00 O ATOM 946 CB PHE A 65 -17.382 -10.092 -2.756 1.00 0.00 C ATOM 947 CG PHE A 65 -16.890 -10.005 -4.170 1.00 0.00 C ATOM 948 CD1 PHE A 65 -15.629 -10.459 -4.503 1.00 0.00 C ATOM 949 CD2 PHE A 65 -17.680 -9.448 -5.159 1.00 0.00 C ATOM 950 CE1 PHE A 65 -15.163 -10.357 -5.791 1.00 0.00 C ATOM 951 CE2 PHE A 65 -17.222 -9.350 -6.450 1.00 0.00 C ATOM 952 CZ PHE A 65 -15.961 -9.800 -6.764 1.00 0.00 C ATOM 0 H PHE A 65 -17.845 -9.979 -0.314 1.00 0.00 H new ATOM 0 HA PHE A 65 -15.554 -9.594 -1.790 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -17.335 -11.129 -2.423 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -18.430 -9.794 -2.722 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -15.002 -10.899 -3.742 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -18.668 -9.086 -4.914 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -14.174 -10.713 -6.039 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -17.850 -8.921 -7.216 1.00 0.00 H new ATOM 0 HZ PHE A 65 -15.596 -9.716 -7.777 1.00 0.00 H new ATOM 962 N PRO A 66 -17.624 -6.941 -2.137 1.00 0.00 N ATOM 963 CA PRO A 66 -17.604 -5.500 -2.416 1.00 0.00 C ATOM 964 C PRO A 66 -16.444 -4.778 -1.698 1.00 0.00 C ATOM 965 O PRO A 66 -15.774 -3.932 -2.295 1.00 0.00 O ATOM 966 CB PRO A 66 -18.961 -5.000 -1.873 1.00 0.00 C ATOM 967 CG PRO A 66 -19.559 -6.167 -1.158 1.00 0.00 C ATOM 968 CD PRO A 66 -18.989 -7.378 -1.813 1.00 0.00 C ATOM 0 HA PRO A 66 -17.456 -5.299 -3.477 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -18.826 -4.154 -1.199 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -19.608 -4.663 -2.683 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -19.313 -6.144 -0.096 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -20.646 -6.157 -1.233 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -18.993 -8.241 -1.147 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -19.549 -7.660 -2.705 1.00 0.00 H new ATOM 976 N GLU A 67 -16.182 -5.155 -0.441 1.00 0.00 N ATOM 977 CA GLU A 67 -15.103 -4.552 0.348 1.00 0.00 C ATOM 978 C GLU A 67 -13.744 -4.969 -0.210 1.00 0.00 C ATOM 979 O GLU A 67 -12.838 -4.156 -0.298 1.00 0.00 O ATOM 980 CB GLU A 67 -15.215 -4.931 1.827 1.00 0.00 C ATOM 981 CG GLU A 67 -16.502 -4.468 2.493 1.00 0.00 C ATOM 982 CD GLU A 67 -16.627 -4.963 3.913 1.00 0.00 C ATOM 983 OE1 GLU A 67 -16.337 -6.131 4.176 1.00 0.00 O ATOM 984 OE2 GLU A 67 -17.121 -4.241 4.801 1.00 0.00 O ATOM 0 H GLU A 67 -16.705 -5.878 0.053 1.00 0.00 H new ATOM 0 HA GLU A 67 -15.197 -3.469 0.275 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -15.140 -6.014 1.920 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -14.367 -4.506 2.365 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -16.539 -3.379 2.487 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -17.355 -4.820 1.912 1.00 0.00 H new ATOM 991 N PHE A 68 -13.625 -6.239 -0.599 1.00 0.00 N ATOM 992 CA PHE A 68 -12.423 -6.770 -1.255 1.00 0.00 C ATOM 993 C PHE A 68 -12.151 -5.984 -2.541 1.00 0.00 C ATOM 994 O PHE A 68 -11.006 -5.617 -2.829 1.00 0.00 O ATOM 995 CB PHE A 68 -12.590 -8.305 -1.497 1.00 0.00 C ATOM 996 CG PHE A 68 -11.611 -8.984 -2.457 1.00 0.00 C ATOM 997 CD1 PHE A 68 -10.264 -9.162 -2.155 1.00 0.00 C ATOM 998 CD2 PHE A 68 -12.071 -9.472 -3.665 1.00 0.00 C ATOM 999 CE1 PHE A 68 -9.423 -9.789 -3.048 1.00 0.00 C ATOM 1000 CE2 PHE A 68 -11.226 -10.100 -4.551 1.00 0.00 C ATOM 1001 CZ PHE A 68 -9.903 -10.252 -4.246 1.00 0.00 C ATOM 0 H PHE A 68 -14.361 -6.933 -0.469 1.00 0.00 H new ATOM 0 HA PHE A 68 -11.550 -6.645 -0.615 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -12.516 -8.807 -0.532 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -13.600 -8.478 -1.870 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -9.875 -8.806 -1.213 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -13.115 -9.358 -3.919 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -8.379 -9.917 -2.803 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -11.609 -10.473 -5.489 1.00 0.00 H new ATOM 0 HZ PHE A 68 -9.238 -10.735 -4.946 1.00 0.00 H new ATOM 1011 N LEU A 69 -13.218 -5.673 -3.266 1.00 0.00 N ATOM 1012 CA LEU A 69 -13.128 -4.863 -4.469 1.00 0.00 C ATOM 1013 C LEU A 69 -12.666 -3.450 -4.135 1.00 0.00 C ATOM 1014 O LEU A 69 -11.711 -2.965 -4.719 1.00 0.00 O ATOM 1015 CB LEU A 69 -14.470 -4.803 -5.195 1.00 0.00 C ATOM 1016 CG LEU A 69 -15.032 -6.124 -5.697 1.00 0.00 C ATOM 1017 CD1 LEU A 69 -16.376 -5.896 -6.358 1.00 0.00 C ATOM 1018 CD2 LEU A 69 -14.064 -6.786 -6.666 1.00 0.00 C ATOM 0 H LEU A 69 -14.165 -5.975 -3.036 1.00 0.00 H new ATOM 0 HA LEU A 69 -12.396 -5.333 -5.126 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -15.202 -4.355 -4.522 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -14.367 -4.131 -6.047 1.00 0.00 H new ATOM 0 HG LEU A 69 -15.168 -6.792 -4.847 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -16.772 -6.847 -6.715 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -17.068 -5.463 -5.636 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -16.256 -5.214 -7.200 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -14.485 -7.730 -7.013 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -13.896 -6.128 -7.519 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -13.117 -6.975 -6.161 1.00 0.00 H new ATOM 1030 N THR A 70 -13.337 -2.812 -3.176 1.00 0.00 N ATOM 1031 CA THR A 70 -13.007 -1.454 -2.747 1.00 0.00 C ATOM 1032 C THR A 70 -11.545 -1.363 -2.281 1.00 0.00 C ATOM 1033 O THR A 70 -10.808 -0.465 -2.686 1.00 0.00 O ATOM 1034 CB THR A 70 -13.958 -1.013 -1.611 1.00 0.00 C ATOM 1035 OG1 THR A 70 -15.313 -1.118 -2.073 1.00 0.00 O ATOM 1036 CG2 THR A 70 -13.689 0.425 -1.183 1.00 0.00 C ATOM 0 H THR A 70 -14.125 -3.223 -2.675 1.00 0.00 H new ATOM 0 HA THR A 70 -13.133 -0.786 -3.599 1.00 0.00 H new ATOM 0 HB THR A 70 -13.789 -1.661 -0.751 1.00 0.00 H new ATOM 0 HG1 THR A 70 -15.577 -2.061 -2.101 1.00 0.00 H new ATOM 0 HG21 THR A 70 -14.376 0.701 -0.383 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.663 0.513 -0.826 1.00 0.00 H new ATOM 0 HG23 THR A 70 -13.836 1.091 -2.033 1.00 0.00 H new ATOM 1044 N MET A 71 -11.137 -2.325 -1.476 1.00 0.00 N ATOM 1045 CA MET A 71 -9.782 -2.422 -0.967 1.00 0.00 C ATOM 1046 C MET A 71 -8.773 -2.517 -2.085 1.00 0.00 C ATOM 1047 O MET A 71 -7.751 -1.851 -2.057 1.00 0.00 O ATOM 1048 CB MET A 71 -9.652 -3.636 -0.041 1.00 0.00 C ATOM 1049 CG MET A 71 -8.215 -4.011 0.325 1.00 0.00 C ATOM 1050 SD MET A 71 -8.102 -5.319 1.569 1.00 0.00 S ATOM 1051 CE MET A 71 -9.216 -6.569 0.909 1.00 0.00 C ATOM 0 H MET A 71 -11.748 -3.074 -1.152 1.00 0.00 H new ATOM 0 HA MET A 71 -9.574 -1.512 -0.404 1.00 0.00 H new ATOM 0 HB2 MET A 71 -10.206 -3.437 0.876 1.00 0.00 H new ATOM 0 HB3 MET A 71 -10.126 -4.493 -0.520 1.00 0.00 H new ATOM 0 HG2 MET A 71 -7.691 -4.332 -0.576 1.00 0.00 H new ATOM 0 HG3 MET A 71 -7.700 -3.124 0.694 1.00 0.00 H new ATOM 0 HE1 MET A 71 -8.792 -7.559 1.076 1.00 0.00 H new ATOM 0 HE2 MET A 71 -10.181 -6.498 1.411 1.00 0.00 H new ATOM 0 HE3 MET A 71 -9.351 -6.408 -0.161 1.00 0.00 H new ATOM 1061 N MET A 72 -9.068 -3.327 -3.070 1.00 0.00 N ATOM 1062 CA MET A 72 -8.149 -3.531 -4.157 1.00 0.00 C ATOM 1063 C MET A 72 -8.131 -2.342 -5.085 1.00 0.00 C ATOM 1064 O MET A 72 -7.083 -1.952 -5.571 1.00 0.00 O ATOM 1065 CB MET A 72 -8.452 -4.821 -4.892 1.00 0.00 C ATOM 1066 CG MET A 72 -7.253 -5.744 -4.940 1.00 0.00 C ATOM 1067 SD MET A 72 -6.559 -6.071 -3.288 1.00 0.00 S ATOM 1068 CE MET A 72 -7.946 -6.857 -2.481 1.00 0.00 C ATOM 0 H MET A 72 -9.938 -3.855 -3.140 1.00 0.00 H new ATOM 0 HA MET A 72 -7.147 -3.627 -3.740 1.00 0.00 H new ATOM 0 HB2 MET A 72 -9.282 -5.331 -4.402 1.00 0.00 H new ATOM 0 HB3 MET A 72 -8.774 -4.592 -5.908 1.00 0.00 H new ATOM 0 HG2 MET A 72 -7.543 -6.688 -5.402 1.00 0.00 H new ATOM 0 HG3 MET A 72 -6.483 -5.302 -5.573 1.00 0.00 H new ATOM 0 HE1 MET A 72 -7.590 -7.438 -1.630 1.00 0.00 H new ATOM 0 HE2 MET A 72 -8.644 -6.095 -2.134 1.00 0.00 H new ATOM 0 HE3 MET A 72 -8.451 -7.517 -3.186 1.00 0.00 H new ATOM 1078 N ALA A 73 -9.285 -1.741 -5.273 1.00 0.00 N ATOM 1079 CA ALA A 73 -9.433 -0.554 -6.090 1.00 0.00 C ATOM 1080 C ALA A 73 -8.607 0.581 -5.521 1.00 0.00 C ATOM 1081 O ALA A 73 -7.812 1.203 -6.235 1.00 0.00 O ATOM 1082 CB ALA A 73 -10.891 -0.153 -6.167 1.00 0.00 C ATOM 0 H ALA A 73 -10.158 -2.066 -4.858 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.076 -0.774 -7.096 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -10.991 0.740 -6.784 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -11.469 -0.965 -6.609 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -11.265 0.055 -5.164 1.00 0.00 H new ATOM 1088 N ARG A 74 -8.748 0.796 -4.215 1.00 0.00 N ATOM 1089 CA ARG A 74 -8.023 1.835 -3.508 1.00 0.00 C ATOM 1090 C ARG A 74 -6.552 1.506 -3.401 1.00 0.00 C ATOM 1091 O ARG A 74 -5.746 2.354 -3.060 1.00 0.00 O ATOM 1092 CB ARG A 74 -8.583 2.044 -2.109 1.00 0.00 C ATOM 1093 CG ARG A 74 -9.999 2.573 -2.058 1.00 0.00 C ATOM 1094 CD ARG A 74 -10.421 2.834 -0.632 1.00 0.00 C ATOM 1095 NE ARG A 74 -9.554 3.832 0.012 1.00 0.00 N ATOM 1096 CZ ARG A 74 -9.506 4.081 1.324 1.00 0.00 C ATOM 1097 NH1 ARG A 74 -10.348 3.469 2.157 1.00 0.00 N ATOM 1098 NH2 ARG A 74 -8.638 4.964 1.794 1.00 0.00 N ATOM 0 H ARG A 74 -9.372 0.250 -3.621 1.00 0.00 H new ATOM 0 HA ARG A 74 -8.144 2.751 -4.086 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -8.547 1.095 -1.574 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -7.933 2.737 -1.574 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -10.070 3.494 -2.637 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -10.678 1.854 -2.517 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -11.454 3.182 -0.615 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -10.389 1.903 -0.066 1.00 0.00 H new ATOM 0 HE ARG A 74 -8.940 4.378 -0.592 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -11.033 2.807 1.794 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -10.307 3.663 3.158 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -8.009 5.451 1.155 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -8.598 5.157 2.795 1.00 0.00 H new ATOM 1112 N LYS A 75 -6.226 0.272 -3.629 1.00 0.00 N ATOM 1113 CA LYS A 75 -4.868 -0.198 -3.599 1.00 0.00 C ATOM 1114 C LYS A 75 -4.186 -0.063 -4.984 1.00 0.00 C ATOM 1115 O LYS A 75 -2.945 -0.100 -5.091 1.00 0.00 O ATOM 1116 CB LYS A 75 -4.882 -1.661 -3.162 1.00 0.00 C ATOM 1117 CG LYS A 75 -3.532 -2.311 -3.046 1.00 0.00 C ATOM 1118 CD LYS A 75 -3.657 -3.798 -2.862 1.00 0.00 C ATOM 1119 CE LYS A 75 -4.162 -4.199 -1.489 1.00 0.00 C ATOM 1120 NZ LYS A 75 -4.179 -5.681 -1.360 1.00 0.00 N ATOM 0 H LYS A 75 -6.908 -0.455 -3.846 1.00 0.00 H new ATOM 0 HA LYS A 75 -4.295 0.409 -2.898 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -5.384 -1.730 -2.197 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -5.481 -2.230 -3.874 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -2.946 -2.101 -3.941 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.990 -1.882 -2.203 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -4.334 -4.194 -3.619 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -2.684 -4.260 -3.031 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -3.524 -3.767 -0.718 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.165 -3.802 -1.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -4.294 -5.941 -0.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -4.971 -6.068 -1.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.284 -6.071 -1.718 1.00 0.00 H new ATOM 1134 N MET A 76 -4.971 0.123 -6.026 1.00 0.00 N ATOM 1135 CA MET A 76 -4.442 -0.017 -7.373 1.00 0.00 C ATOM 1136 C MET A 76 -4.458 1.253 -8.230 1.00 0.00 C ATOM 1137 O MET A 76 -3.389 1.773 -8.598 1.00 0.00 O ATOM 1138 CB MET A 76 -5.195 -1.123 -8.105 1.00 0.00 C ATOM 1139 CG MET A 76 -4.671 -1.413 -9.510 1.00 0.00 C ATOM 1140 SD MET A 76 -5.742 -2.508 -10.456 1.00 0.00 S ATOM 1141 CE MET A 76 -7.210 -1.490 -10.585 1.00 0.00 C ATOM 0 H MET A 76 -5.960 0.367 -5.972 1.00 0.00 H new ATOM 0 HA MET A 76 -3.388 -0.260 -7.236 1.00 0.00 H new ATOM 0 HB2 MET A 76 -5.141 -2.037 -7.513 1.00 0.00 H new ATOM 0 HB3 MET A 76 -6.248 -0.848 -8.171 1.00 0.00 H new ATOM 0 HG2 MET A 76 -4.557 -0.473 -10.049 1.00 0.00 H new ATOM 0 HG3 MET A 76 -3.680 -1.860 -9.436 1.00 0.00 H new ATOM 0 HE1 MET A 76 -7.646 -1.605 -11.577 1.00 0.00 H new ATOM 0 HE2 MET A 76 -7.935 -1.799 -9.832 1.00 0.00 H new ATOM 0 HE3 MET A 76 -6.944 -0.445 -10.425 1.00 0.00 H new ATOM 1222 N GLU A 82 0.607 10.915 -3.033 1.00 0.00 N ATOM 1223 CA GLU A 82 1.560 11.378 -2.090 1.00 0.00 C ATOM 1224 C GLU A 82 1.444 10.615 -0.768 1.00 0.00 C ATOM 1225 O GLU A 82 2.385 9.957 -0.342 1.00 0.00 O ATOM 1226 CB GLU A 82 1.351 12.860 -1.864 1.00 0.00 C ATOM 1227 CG GLU A 82 2.455 13.521 -1.102 1.00 0.00 C ATOM 1228 CD GLU A 82 3.766 13.467 -1.843 1.00 0.00 C ATOM 1229 OE1 GLU A 82 4.589 12.587 -1.555 1.00 0.00 O ATOM 1230 OE2 GLU A 82 3.997 14.303 -2.728 1.00 0.00 O ATOM 0 HA GLU A 82 2.561 11.204 -2.484 1.00 0.00 H new ATOM 0 HB2 GLU A 82 1.245 13.353 -2.830 1.00 0.00 H new ATOM 0 HB3 GLU A 82 0.414 13.007 -1.327 1.00 0.00 H new ATOM 0 HG2 GLU A 82 2.190 14.561 -0.910 1.00 0.00 H new ATOM 0 HG3 GLU A 82 2.567 13.036 -0.132 1.00 0.00 H new ATOM 1237 N GLU A 83 0.275 10.653 -0.152 1.00 0.00 N ATOM 1238 CA GLU A 83 0.112 10.070 1.178 1.00 0.00 C ATOM 1239 C GLU A 83 0.215 8.549 1.145 1.00 0.00 C ATOM 1240 O GLU A 83 0.835 7.955 2.013 1.00 0.00 O ATOM 1241 CB GLU A 83 -1.170 10.550 1.844 1.00 0.00 C ATOM 1242 CG GLU A 83 -1.295 10.147 3.300 1.00 0.00 C ATOM 1243 CD GLU A 83 -2.456 10.811 3.971 1.00 0.00 C ATOM 1244 OE1 GLU A 83 -2.294 11.941 4.475 1.00 0.00 O ATOM 1245 OE2 GLU A 83 -3.559 10.234 3.994 1.00 0.00 O ATOM 0 H GLU A 83 -0.568 11.075 -0.541 1.00 0.00 H new ATOM 0 HA GLU A 83 0.939 10.423 1.794 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -1.220 11.637 1.773 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -2.024 10.155 1.293 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -1.408 9.065 3.368 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -0.376 10.405 3.827 1.00 0.00 H new ATOM 1252 N GLU A 84 -0.337 7.938 0.103 1.00 0.00 N ATOM 1253 CA GLU A 84 -0.223 6.482 -0.110 1.00 0.00 C ATOM 1254 C GLU A 84 1.246 6.074 -0.160 1.00 0.00 C ATOM 1255 O GLU A 84 1.641 5.034 0.380 1.00 0.00 O ATOM 1256 CB GLU A 84 -0.858 6.111 -1.434 1.00 0.00 C ATOM 1257 CG GLU A 84 -2.368 6.000 -1.453 1.00 0.00 C ATOM 1258 CD GLU A 84 -2.867 4.810 -0.676 1.00 0.00 C ATOM 1259 OE1 GLU A 84 -3.531 4.991 0.347 1.00 0.00 O ATOM 1260 OE2 GLU A 84 -2.585 3.668 -1.072 1.00 0.00 O ATOM 0 H GLU A 84 -0.873 8.423 -0.617 1.00 0.00 H new ATOM 0 HA GLU A 84 -0.725 5.971 0.711 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -0.561 6.854 -2.174 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -0.442 5.156 -1.756 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -2.802 6.910 -1.037 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.711 5.926 -2.485 1.00 0.00 H new ATOM 1267 N ILE A 85 2.047 6.931 -0.780 1.00 0.00 N ATOM 1268 CA ILE A 85 3.467 6.698 -0.948 1.00 0.00 C ATOM 1269 C ILE A 85 4.116 6.773 0.410 1.00 0.00 C ATOM 1270 O ILE A 85 4.878 5.903 0.807 1.00 0.00 O ATOM 1271 CB ILE A 85 4.141 7.811 -1.810 1.00 0.00 C ATOM 1272 CG1 ILE A 85 3.313 8.191 -3.046 1.00 0.00 C ATOM 1273 CG2 ILE A 85 5.542 7.382 -2.226 1.00 0.00 C ATOM 1274 CD1 ILE A 85 3.088 7.084 -4.016 1.00 0.00 C ATOM 0 H ILE A 85 1.723 7.811 -1.181 1.00 0.00 H new ATOM 0 HA ILE A 85 3.590 5.731 -1.435 1.00 0.00 H new ATOM 0 HB ILE A 85 4.202 8.701 -1.184 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.345 8.567 -2.715 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.813 9.010 -3.562 1.00 0.00 H new ATOM 0 HG21 ILE A 85 6.000 8.168 -2.827 1.00 0.00 H new ATOM 0 HG22 ILE A 85 6.147 7.205 -1.337 1.00 0.00 H new ATOM 0 HG23 ILE A 85 5.483 6.465 -2.813 1.00 0.00 H new ATOM 0 HD11 ILE A 85 2.494 7.449 -4.854 1.00 0.00 H new ATOM 0 HD12 ILE A 85 4.048 6.721 -4.383 1.00 0.00 H new ATOM 0 HD13 ILE A 85 2.557 6.270 -3.522 1.00 0.00 H new ATOM 1286 N ARG A 86 3.749 7.804 1.126 1.00 0.00 N ATOM 1287 CA ARG A 86 4.353 8.131 2.381 1.00 0.00 C ATOM 1288 C ARG A 86 3.984 7.156 3.474 1.00 0.00 C ATOM 1289 O ARG A 86 4.761 6.944 4.371 1.00 0.00 O ATOM 1290 CB ARG A 86 4.025 9.554 2.753 1.00 0.00 C ATOM 1291 CG ARG A 86 4.983 10.157 3.751 1.00 0.00 C ATOM 1292 CD ARG A 86 4.816 11.659 3.788 1.00 0.00 C ATOM 1293 NE ARG A 86 4.999 12.256 2.445 1.00 0.00 N ATOM 1294 CZ ARG A 86 5.133 13.559 2.187 1.00 0.00 C ATOM 1295 NH1 ARG A 86 5.158 14.441 3.185 1.00 0.00 N ATOM 1296 NH2 ARG A 86 5.242 13.978 0.923 1.00 0.00 N ATOM 0 H ARG A 86 3.009 8.447 0.844 1.00 0.00 H new ATOM 0 HA ARG A 86 5.434 8.045 2.267 1.00 0.00 H new ATOM 0 HB2 ARG A 86 4.023 10.165 1.850 1.00 0.00 H new ATOM 0 HB3 ARG A 86 3.016 9.589 3.164 1.00 0.00 H new ATOM 0 HG2 ARG A 86 4.801 9.738 4.741 1.00 0.00 H new ATOM 0 HG3 ARG A 86 6.008 9.904 3.482 1.00 0.00 H new ATOM 0 HD2 ARG A 86 3.824 11.907 4.166 1.00 0.00 H new ATOM 0 HD3 ARG A 86 5.538 12.090 4.481 1.00 0.00 H new ATOM 0 HE ARG A 86 5.025 11.618 1.650 1.00 0.00 H new ATOM 0 HH11 ARG A 86 5.075 14.122 4.150 1.00 0.00 H new ATOM 0 HH12 ARG A 86 5.261 15.436 2.984 1.00 0.00 H new ATOM 0 HH21 ARG A 86 5.223 13.303 0.159 1.00 0.00 H new ATOM 0 HH22 ARG A 86 5.344 14.973 0.723 1.00 0.00 H new ATOM 1310 N GLU A 87 2.811 6.563 3.397 1.00 0.00 N ATOM 1311 CA GLU A 87 2.436 5.522 4.344 1.00 0.00 C ATOM 1312 C GLU A 87 3.297 4.287 4.114 1.00 0.00 C ATOM 1313 O GLU A 87 3.860 3.702 5.057 1.00 0.00 O ATOM 1314 CB GLU A 87 0.961 5.160 4.228 1.00 0.00 C ATOM 1315 CG GLU A 87 0.009 6.271 4.620 1.00 0.00 C ATOM 1316 CD GLU A 87 -1.415 5.797 4.672 1.00 0.00 C ATOM 1317 OE1 GLU A 87 -1.757 5.026 5.605 1.00 0.00 O ATOM 1318 OE2 GLU A 87 -2.237 6.187 3.818 1.00 0.00 O ATOM 0 H GLU A 87 2.102 6.778 2.696 1.00 0.00 H new ATOM 0 HA GLU A 87 2.603 5.905 5.351 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.752 4.866 3.200 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.763 4.291 4.855 1.00 0.00 H new ATOM 0 HG2 GLU A 87 0.295 6.667 5.594 1.00 0.00 H new ATOM 0 HG3 GLU A 87 0.093 7.090 3.906 1.00 0.00 H new ATOM 1325 N ALA A 88 3.456 3.938 2.845 1.00 0.00 N ATOM 1326 CA ALA A 88 4.260 2.794 2.449 1.00 0.00 C ATOM 1327 C ALA A 88 5.739 3.052 2.723 1.00 0.00 C ATOM 1328 O ALA A 88 6.519 2.137 2.848 1.00 0.00 O ATOM 1329 CB ALA A 88 4.037 2.472 0.980 1.00 0.00 C ATOM 0 H ALA A 88 3.032 4.439 2.064 1.00 0.00 H new ATOM 0 HA ALA A 88 3.949 1.934 3.043 1.00 0.00 H new ATOM 0 HB1 ALA A 88 4.646 1.613 0.699 1.00 0.00 H new ATOM 0 HB2 ALA A 88 2.985 2.240 0.814 1.00 0.00 H new ATOM 0 HB3 ALA A 88 4.320 3.331 0.372 1.00 0.00 H new ATOM 1335 N PHE A 89 6.107 4.304 2.769 1.00 0.00 N ATOM 1336 CA PHE A 89 7.459 4.697 3.093 1.00 0.00 C ATOM 1337 C PHE A 89 7.657 4.684 4.620 1.00 0.00 C ATOM 1338 O PHE A 89 8.679 4.220 5.125 1.00 0.00 O ATOM 1339 CB PHE A 89 7.729 6.093 2.523 1.00 0.00 C ATOM 1340 CG PHE A 89 9.165 6.519 2.565 1.00 0.00 C ATOM 1341 CD1 PHE A 89 10.028 6.134 1.561 1.00 0.00 C ATOM 1342 CD2 PHE A 89 9.647 7.315 3.587 1.00 0.00 C ATOM 1343 CE1 PHE A 89 11.341 6.525 1.571 1.00 0.00 C ATOM 1344 CE2 PHE A 89 10.968 7.708 3.601 1.00 0.00 C ATOM 1345 CZ PHE A 89 11.814 7.309 2.590 1.00 0.00 C ATOM 0 H PHE A 89 5.478 5.085 2.583 1.00 0.00 H new ATOM 0 HA PHE A 89 8.164 3.992 2.651 1.00 0.00 H new ATOM 0 HB2 PHE A 89 7.386 6.121 1.489 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.133 6.818 3.076 1.00 0.00 H new ATOM 0 HD1 PHE A 89 9.663 5.515 0.755 1.00 0.00 H new ATOM 0 HD2 PHE A 89 8.985 7.631 4.379 1.00 0.00 H new ATOM 0 HE1 PHE A 89 12.003 6.215 0.776 1.00 0.00 H new ATOM 0 HE2 PHE A 89 11.339 8.328 4.404 1.00 0.00 H new ATOM 0 HZ PHE A 89 12.850 7.614 2.601 1.00 0.00 H new ATOM 1355 N ARG A 90 6.645 5.190 5.329 1.00 0.00 N ATOM 1356 CA ARG A 90 6.627 5.334 6.799 1.00 0.00 C ATOM 1357 C ARG A 90 6.843 4.017 7.516 1.00 0.00 C ATOM 1358 O ARG A 90 7.416 3.987 8.605 1.00 0.00 O ATOM 1359 CB ARG A 90 5.288 5.934 7.255 1.00 0.00 C ATOM 1360 CG ARG A 90 5.206 6.257 8.749 1.00 0.00 C ATOM 1361 CD ARG A 90 6.226 7.314 9.137 1.00 0.00 C ATOM 1362 NE ARG A 90 5.982 8.576 8.433 1.00 0.00 N ATOM 1363 CZ ARG A 90 6.904 9.327 7.823 1.00 0.00 C ATOM 1364 NH1 ARG A 90 8.159 8.898 7.710 1.00 0.00 N ATOM 1365 NH2 ARG A 90 6.549 10.494 7.296 1.00 0.00 N ATOM 0 H ARG A 90 5.787 5.523 4.889 1.00 0.00 H new ATOM 0 HA ARG A 90 7.452 5.997 7.058 1.00 0.00 H new ATOM 0 HB2 ARG A 90 5.104 6.847 6.689 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.489 5.237 7.004 1.00 0.00 H new ATOM 0 HG2 ARG A 90 4.203 6.608 8.994 1.00 0.00 H new ATOM 0 HG3 ARG A 90 5.378 5.351 9.330 1.00 0.00 H new ATOM 0 HD2 ARG A 90 6.186 7.482 10.213 1.00 0.00 H new ATOM 0 HD3 ARG A 90 7.229 6.955 8.907 1.00 0.00 H new ATOM 0 HE ARG A 90 5.019 8.912 8.406 1.00 0.00 H new ATOM 0 HH11 ARG A 90 8.424 7.989 8.091 1.00 0.00 H new ATOM 0 HH12 ARG A 90 8.856 9.478 7.243 1.00 0.00 H new ATOM 0 HH21 ARG A 90 5.581 10.809 7.359 1.00 0.00 H new ATOM 0 HH22 ARG A 90 7.245 11.075 6.828 1.00 0.00 H new ATOM 1379 N VAL A 91 6.358 2.937 6.924 1.00 0.00 N ATOM 1380 CA VAL A 91 6.531 1.616 7.506 1.00 0.00 C ATOM 1381 C VAL A 91 8.038 1.300 7.681 1.00 0.00 C ATOM 1382 O VAL A 91 8.434 0.629 8.633 1.00 0.00 O ATOM 1383 CB VAL A 91 5.829 0.519 6.656 1.00 0.00 C ATOM 1384 CG1 VAL A 91 6.492 0.367 5.312 1.00 0.00 C ATOM 1385 CG2 VAL A 91 5.762 -0.814 7.384 1.00 0.00 C ATOM 0 H VAL A 91 5.843 2.949 6.044 1.00 0.00 H new ATOM 0 HA VAL A 91 6.058 1.617 8.488 1.00 0.00 H new ATOM 0 HB VAL A 91 4.803 0.849 6.495 1.00 0.00 H new ATOM 0 HG11 VAL A 91 5.980 -0.407 4.739 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.440 1.312 4.772 1.00 0.00 H new ATOM 0 HG13 VAL A 91 7.536 0.085 5.451 1.00 0.00 H new ATOM 0 HG21 VAL A 91 5.264 -1.549 6.752 1.00 0.00 H new ATOM 0 HG22 VAL A 91 6.772 -1.156 7.611 1.00 0.00 H new ATOM 0 HG23 VAL A 91 5.202 -0.694 8.312 1.00 0.00 H new ATOM 1395 N PHE A 92 8.858 1.847 6.789 1.00 0.00 N ATOM 1396 CA PHE A 92 10.281 1.665 6.854 1.00 0.00 C ATOM 1397 C PHE A 92 10.885 2.829 7.618 1.00 0.00 C ATOM 1398 O PHE A 92 11.485 2.650 8.666 1.00 0.00 O ATOM 1399 CB PHE A 92 10.907 1.633 5.458 1.00 0.00 C ATOM 1400 CG PHE A 92 10.325 0.637 4.494 1.00 0.00 C ATOM 1401 CD1 PHE A 92 10.566 -0.712 4.639 1.00 0.00 C ATOM 1402 CD2 PHE A 92 9.561 1.065 3.421 1.00 0.00 C ATOM 1403 CE1 PHE A 92 10.052 -1.621 3.739 1.00 0.00 C ATOM 1404 CE2 PHE A 92 9.040 0.160 2.518 1.00 0.00 C ATOM 1405 CZ PHE A 92 9.287 -1.186 2.677 1.00 0.00 C ATOM 0 H PHE A 92 8.544 2.424 6.009 1.00 0.00 H new ATOM 0 HA PHE A 92 10.481 0.715 7.349 1.00 0.00 H new ATOM 0 HB2 PHE A 92 10.818 2.627 5.019 1.00 0.00 H new ATOM 0 HB3 PHE A 92 11.972 1.426 5.564 1.00 0.00 H new ATOM 0 HD1 PHE A 92 11.165 -1.061 5.467 1.00 0.00 H new ATOM 0 HD2 PHE A 92 9.370 2.120 3.289 1.00 0.00 H new ATOM 0 HE1 PHE A 92 10.249 -2.675 3.866 1.00 0.00 H new ATOM 0 HE2 PHE A 92 8.440 0.506 1.689 1.00 0.00 H new ATOM 0 HZ PHE A 92 8.883 -1.898 1.973 1.00 0.00 H new ATOM 1415 N ASP A 93 10.695 4.028 7.088 1.00 0.00 N ATOM 1416 CA ASP A 93 11.234 5.229 7.700 1.00 0.00 C ATOM 1417 C ASP A 93 10.284 5.748 8.751 1.00 0.00 C ATOM 1418 O ASP A 93 9.373 6.555 8.485 1.00 0.00 O ATOM 1419 CB ASP A 93 11.571 6.298 6.665 1.00 0.00 C ATOM 1420 CG ASP A 93 12.063 7.587 7.284 1.00 0.00 C ATOM 1421 OD1 ASP A 93 12.948 7.554 8.156 1.00 0.00 O ATOM 1422 OD2 ASP A 93 11.604 8.668 6.878 1.00 0.00 O ATOM 0 H ASP A 93 10.168 4.193 6.230 1.00 0.00 H new ATOM 0 HA ASP A 93 12.174 4.967 8.186 1.00 0.00 H new ATOM 0 HB2 ASP A 93 12.333 5.913 5.988 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.686 6.505 6.064 1.00 0.00 H new ATOM 1427 N LYS A 94 10.468 5.221 9.912 1.00 0.00 N ATOM 1428 CA LYS A 94 9.646 5.476 11.061 1.00 0.00 C ATOM 1429 C LYS A 94 9.992 6.811 11.701 1.00 0.00 C ATOM 1430 O LYS A 94 9.106 7.563 12.103 1.00 0.00 O ATOM 1431 CB LYS A 94 9.866 4.342 12.051 1.00 0.00 C ATOM 1432 CG LYS A 94 9.582 2.968 11.463 1.00 0.00 C ATOM 1433 CD LYS A 94 10.214 1.907 12.244 1.00 0.00 C ATOM 1434 CE LYS A 94 10.050 0.546 11.600 1.00 0.00 C ATOM 1435 NZ LYS A 94 10.902 -0.470 12.248 1.00 0.00 N ATOM 0 H LYS A 94 11.229 4.569 10.103 1.00 0.00 H new ATOM 0 HA LYS A 94 8.599 5.526 10.760 1.00 0.00 H new ATOM 0 HB2 LYS A 94 10.896 4.372 12.405 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.226 4.498 12.919 1.00 0.00 H new ATOM 0 HG2 LYS A 94 8.505 2.802 11.428 1.00 0.00 H new ATOM 0 HG3 LYS A 94 9.944 2.929 10.436 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.275 2.127 12.360 1.00 0.00 H new ATOM 0 HD3 LYS A 94 9.782 1.888 13.244 1.00 0.00 H new ATOM 0 HE2 LYS A 94 9.006 0.238 11.661 1.00 0.00 H new ATOM 0 HE3 LYS A 94 10.302 0.611 10.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 10.431 -1.396 12.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 11.815 -0.524 11.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 11.061 -0.207 13.241 1.00 0.00 H new ATOM 1449 N ASP A 95 11.279 7.119 11.759 1.00 0.00 N ATOM 1450 CA ASP A 95 11.744 8.331 12.457 1.00 0.00 C ATOM 1451 C ASP A 95 11.566 9.583 11.604 1.00 0.00 C ATOM 1452 O ASP A 95 11.632 10.702 12.106 1.00 0.00 O ATOM 1453 CB ASP A 95 13.215 8.182 12.894 1.00 0.00 C ATOM 1454 CG ASP A 95 13.701 9.320 13.785 1.00 0.00 C ATOM 1455 OD1 ASP A 95 14.415 10.232 13.304 1.00 0.00 O ATOM 1456 OD2 ASP A 95 13.377 9.322 14.996 1.00 0.00 O ATOM 0 H ASP A 95 12.021 6.560 11.339 1.00 0.00 H new ATOM 0 HA ASP A 95 11.125 8.448 13.346 1.00 0.00 H new ATOM 0 HB2 ASP A 95 13.334 7.238 13.426 1.00 0.00 H new ATOM 0 HB3 ASP A 95 13.846 8.130 12.007 1.00 0.00 H new ATOM 1461 N GLY A 96 11.299 9.394 10.331 1.00 0.00 N ATOM 1462 CA GLY A 96 11.097 10.522 9.454 1.00 0.00 C ATOM 1463 C GLY A 96 12.414 11.116 9.030 1.00 0.00 C ATOM 1464 O GLY A 96 12.643 12.320 9.158 1.00 0.00 O ATOM 0 H GLY A 96 11.218 8.480 9.885 1.00 0.00 H new ATOM 0 HA2 GLY A 96 10.535 10.208 8.574 1.00 0.00 H new ATOM 0 HA3 GLY A 96 10.498 11.279 9.961 1.00 0.00 H new ATOM 1468 N ASN A 97 13.287 10.267 8.551 1.00 0.00 N ATOM 1469 CA ASN A 97 14.608 10.676 8.118 1.00 0.00 C ATOM 1470 C ASN A 97 14.622 10.860 6.615 1.00 0.00 C ATOM 1471 O ASN A 97 15.581 11.392 6.042 1.00 0.00 O ATOM 1472 CB ASN A 97 15.670 9.647 8.542 1.00 0.00 C ATOM 1473 CG ASN A 97 15.726 9.412 10.047 1.00 0.00 C ATOM 1474 OD1 ASN A 97 16.064 8.321 10.510 1.00 0.00 O ATOM 1475 ND2 ASN A 97 15.432 10.418 10.818 1.00 0.00 N ATOM 0 H ASN A 97 13.106 9.269 8.448 1.00 0.00 H new ATOM 0 HA ASN A 97 14.851 11.625 8.596 1.00 0.00 H new ATOM 0 HB2 ASN A 97 15.466 8.700 8.042 1.00 0.00 H new ATOM 0 HB3 ASN A 97 16.648 9.984 8.199 1.00 0.00 H new ATOM 0 HD21 ASN A 97 15.478 10.314 11.832 1.00 0.00 H new ATOM 0 HD22 ASN A 97 15.155 11.310 10.409 1.00 0.00 H new ATOM 1482 N GLY A 98 13.576 10.384 5.969 1.00 0.00 N ATOM 1483 CA GLY A 98 13.432 10.567 4.549 1.00 0.00 C ATOM 1484 C GLY A 98 14.272 9.610 3.746 1.00 0.00 C ATOM 1485 O GLY A 98 14.558 9.864 2.584 1.00 0.00 O ATOM 0 H GLY A 98 12.815 9.868 6.411 1.00 0.00 H new ATOM 0 HA2 GLY A 98 12.384 10.440 4.276 1.00 0.00 H new ATOM 0 HA3 GLY A 98 13.707 11.589 4.290 1.00 0.00 H new ATOM 1489 N TYR A 99 14.676 8.514 4.353 1.00 0.00 N ATOM 1490 CA TYR A 99 15.463 7.519 3.663 1.00 0.00 C ATOM 1491 C TYR A 99 15.204 6.144 4.234 1.00 0.00 C ATOM 1492 O TYR A 99 14.793 6.021 5.386 1.00 0.00 O ATOM 1493 CB TYR A 99 16.982 7.845 3.671 1.00 0.00 C ATOM 1494 CG TYR A 99 17.660 7.893 5.042 1.00 0.00 C ATOM 1495 CD1 TYR A 99 17.974 6.725 5.731 1.00 0.00 C ATOM 1496 CD2 TYR A 99 18.012 9.100 5.624 1.00 0.00 C ATOM 1497 CE1 TYR A 99 18.607 6.761 6.951 1.00 0.00 C ATOM 1498 CE2 TYR A 99 18.648 9.143 6.853 1.00 0.00 C ATOM 1499 CZ TYR A 99 18.943 7.968 7.510 1.00 0.00 C ATOM 1500 OH TYR A 99 19.584 8.000 8.735 1.00 0.00 O ATOM 0 H TYR A 99 14.470 8.291 5.327 1.00 0.00 H new ATOM 0 HA TYR A 99 15.146 7.532 2.620 1.00 0.00 H new ATOM 0 HB2 TYR A 99 17.495 7.100 3.062 1.00 0.00 H new ATOM 0 HB3 TYR A 99 17.127 8.809 3.184 1.00 0.00 H new ATOM 0 HD1 TYR A 99 17.715 5.770 5.298 1.00 0.00 H new ATOM 0 HD2 TYR A 99 17.786 10.023 5.110 1.00 0.00 H new ATOM 0 HE1 TYR A 99 18.839 5.842 7.468 1.00 0.00 H new ATOM 0 HE2 TYR A 99 18.912 10.093 7.295 1.00 0.00 H new ATOM 0 HH TYR A 99 19.753 8.931 8.991 1.00 0.00 H new ATOM 1510 N ILE A 100 15.421 5.133 3.436 1.00 0.00 N ATOM 1511 CA ILE A 100 15.259 3.766 3.864 1.00 0.00 C ATOM 1512 C ILE A 100 16.640 3.126 3.931 1.00 0.00 C ATOM 1513 O ILE A 100 17.479 3.360 3.032 1.00 0.00 O ATOM 1514 CB ILE A 100 14.408 2.941 2.859 1.00 0.00 C ATOM 1515 CG1 ILE A 100 13.257 3.787 2.275 1.00 0.00 C ATOM 1516 CG2 ILE A 100 13.875 1.691 3.538 1.00 0.00 C ATOM 1517 CD1 ILE A 100 12.356 3.056 1.303 1.00 0.00 C ATOM 0 H ILE A 100 15.717 5.233 2.465 1.00 0.00 H new ATOM 0 HA ILE A 100 14.753 3.769 4.830 1.00 0.00 H new ATOM 0 HB ILE A 100 15.046 2.643 2.027 1.00 0.00 H new ATOM 0 HG12 ILE A 100 12.649 4.164 3.098 1.00 0.00 H new ATOM 0 HG13 ILE A 100 13.683 4.654 1.770 1.00 0.00 H new ATOM 0 HG21 ILE A 100 13.279 1.117 2.828 1.00 0.00 H new ATOM 0 HG22 ILE A 100 14.709 1.083 3.887 1.00 0.00 H new ATOM 0 HG23 ILE A 100 13.253 1.975 4.387 1.00 0.00 H new ATOM 0 HD11 ILE A 100 11.579 3.733 0.948 1.00 0.00 H new ATOM 0 HD12 ILE A 100 12.945 2.703 0.456 1.00 0.00 H new ATOM 0 HD13 ILE A 100 11.895 2.205 1.804 1.00 0.00 H new ATOM 1529 N SER A 101 16.876 2.359 4.978 1.00 0.00 N ATOM 1530 CA SER A 101 18.120 1.650 5.177 1.00 0.00 C ATOM 1531 C SER A 101 17.855 0.136 5.168 1.00 0.00 C ATOM 1532 O SER A 101 16.740 -0.304 5.487 1.00 0.00 O ATOM 1533 CB SER A 101 18.711 2.066 6.510 1.00 0.00 C ATOM 1534 OG SER A 101 18.764 3.483 6.605 1.00 0.00 O ATOM 0 H SER A 101 16.197 2.210 5.724 1.00 0.00 H new ATOM 0 HA SER A 101 18.820 1.890 4.377 1.00 0.00 H new ATOM 0 HB2 SER A 101 18.109 1.662 7.324 1.00 0.00 H new ATOM 0 HB3 SER A 101 19.713 1.650 6.617 1.00 0.00 H new ATOM 0 HG SER A 101 19.146 3.739 7.471 1.00 0.00 H new ATOM 1540 N ALA A 102 18.866 -0.645 4.824 1.00 0.00 N ATOM 1541 CA ALA A 102 18.735 -2.096 4.688 1.00 0.00 C ATOM 1542 C ALA A 102 18.455 -2.797 6.023 1.00 0.00 C ATOM 1543 O ALA A 102 17.575 -3.673 6.101 1.00 0.00 O ATOM 1544 CB ALA A 102 19.977 -2.677 4.025 1.00 0.00 C ATOM 0 H ALA A 102 19.804 -0.295 4.630 1.00 0.00 H new ATOM 0 HA ALA A 102 17.868 -2.280 4.054 1.00 0.00 H new ATOM 0 HB1 ALA A 102 19.867 -3.757 3.930 1.00 0.00 H new ATOM 0 HB2 ALA A 102 20.101 -2.236 3.036 1.00 0.00 H new ATOM 0 HB3 ALA A 102 20.853 -2.454 4.634 1.00 0.00 H new ATOM 1550 N ALA A 103 19.175 -2.404 7.069 1.00 0.00 N ATOM 1551 CA ALA A 103 19.020 -3.025 8.386 1.00 0.00 C ATOM 1552 C ALA A 103 17.611 -2.806 8.930 1.00 0.00 C ATOM 1553 O ALA A 103 16.946 -3.758 9.363 1.00 0.00 O ATOM 1554 CB ALA A 103 20.073 -2.511 9.355 1.00 0.00 C ATOM 0 H ALA A 103 19.871 -1.660 7.034 1.00 0.00 H new ATOM 0 HA ALA A 103 19.168 -4.099 8.274 1.00 0.00 H new ATOM 0 HB1 ALA A 103 19.937 -2.987 10.326 1.00 0.00 H new ATOM 0 HB2 ALA A 103 21.066 -2.746 8.972 1.00 0.00 H new ATOM 0 HB3 ALA A 103 19.972 -1.431 9.463 1.00 0.00 H new ATOM 1560 N GLU A 104 17.158 -1.558 8.885 1.00 0.00 N ATOM 1561 CA GLU A 104 15.804 -1.184 9.288 1.00 0.00 C ATOM 1562 C GLU A 104 14.792 -1.987 8.524 1.00 0.00 C ATOM 1563 O GLU A 104 13.834 -2.516 9.104 1.00 0.00 O ATOM 1564 CB GLU A 104 15.527 0.268 8.945 1.00 0.00 C ATOM 1565 CG GLU A 104 14.070 0.642 9.146 1.00 0.00 C ATOM 1566 CD GLU A 104 13.754 1.054 10.570 1.00 0.00 C ATOM 1567 OE1 GLU A 104 13.320 0.191 11.371 1.00 0.00 O ATOM 1568 OE2 GLU A 104 13.952 2.223 10.934 1.00 0.00 O ATOM 0 H GLU A 104 17.723 -0.771 8.566 1.00 0.00 H new ATOM 0 HA GLU A 104 15.730 -1.360 10.361 1.00 0.00 H new ATOM 0 HB2 GLU A 104 16.153 0.911 9.564 1.00 0.00 H new ATOM 0 HB3 GLU A 104 15.807 0.453 7.908 1.00 0.00 H new ATOM 0 HG2 GLU A 104 13.814 1.460 8.472 1.00 0.00 H new ATOM 0 HG3 GLU A 104 13.442 -0.206 8.871 1.00 0.00 H new ATOM 1575 N LEU A 105 15.005 -2.064 7.222 1.00 0.00 N ATOM 1576 CA LEU A 105 14.065 -2.683 6.349 1.00 0.00 C ATOM 1577 C LEU A 105 13.866 -4.164 6.790 1.00 0.00 C ATOM 1578 O LEU A 105 12.745 -4.631 6.917 1.00 0.00 O ATOM 1579 CB LEU A 105 14.528 -2.537 4.869 1.00 0.00 C ATOM 1580 CG LEU A 105 13.494 -2.776 3.738 1.00 0.00 C ATOM 1581 CD1 LEU A 105 14.065 -2.341 2.406 1.00 0.00 C ATOM 1582 CD2 LEU A 105 13.082 -4.223 3.639 1.00 0.00 C ATOM 0 H LEU A 105 15.835 -1.696 6.757 1.00 0.00 H new ATOM 0 HA LEU A 105 13.095 -2.189 6.412 1.00 0.00 H new ATOM 0 HB2 LEU A 105 14.926 -1.530 4.745 1.00 0.00 H new ATOM 0 HB3 LEU A 105 15.356 -3.229 4.712 1.00 0.00 H new ATOM 0 HG LEU A 105 12.613 -2.184 3.986 1.00 0.00 H new ATOM 0 HD11 LEU A 105 13.329 -2.514 1.621 1.00 0.00 H new ATOM 0 HD12 LEU A 105 14.311 -1.280 2.445 1.00 0.00 H new ATOM 0 HD13 LEU A 105 14.966 -2.915 2.192 1.00 0.00 H new ATOM 0 HD21 LEU A 105 12.357 -4.341 2.833 1.00 0.00 H new ATOM 0 HD22 LEU A 105 13.958 -4.837 3.432 1.00 0.00 H new ATOM 0 HD23 LEU A 105 12.632 -4.538 4.580 1.00 0.00 H new ATOM 1594 N ARG A 106 14.969 -4.868 7.089 1.00 0.00 N ATOM 1595 CA ARG A 106 14.879 -6.245 7.622 1.00 0.00 C ATOM 1596 C ARG A 106 14.163 -6.286 8.962 1.00 0.00 C ATOM 1597 O ARG A 106 13.399 -7.213 9.246 1.00 0.00 O ATOM 1598 CB ARG A 106 16.242 -6.924 7.761 1.00 0.00 C ATOM 1599 CG ARG A 106 16.693 -7.678 6.574 1.00 0.00 C ATOM 1600 CD ARG A 106 17.931 -8.492 6.882 1.00 0.00 C ATOM 1601 NE ARG A 106 17.651 -9.550 7.864 1.00 0.00 N ATOM 1602 CZ ARG A 106 18.479 -10.547 8.197 1.00 0.00 C ATOM 1603 NH1 ARG A 106 19.703 -10.614 7.658 1.00 0.00 N ATOM 1604 NH2 ARG A 106 18.091 -11.458 9.085 1.00 0.00 N ATOM 0 H ARG A 106 15.920 -4.518 6.975 1.00 0.00 H new ATOM 0 HA ARG A 106 14.299 -6.799 6.884 1.00 0.00 H new ATOM 0 HB2 ARG A 106 16.987 -6.163 7.993 1.00 0.00 H new ATOM 0 HB3 ARG A 106 16.206 -7.604 8.612 1.00 0.00 H new ATOM 0 HG2 ARG A 106 15.895 -8.339 6.234 1.00 0.00 H new ATOM 0 HG3 ARG A 106 16.903 -6.986 5.758 1.00 0.00 H new ATOM 0 HD2 ARG A 106 18.312 -8.939 5.963 1.00 0.00 H new ATOM 0 HD3 ARG A 106 18.713 -7.836 7.265 1.00 0.00 H new ATOM 0 HE ARG A 106 16.746 -9.521 8.333 1.00 0.00 H new ATOM 0 HH11 ARG A 106 20.006 -9.904 6.992 1.00 0.00 H new ATOM 0 HH12 ARG A 106 20.332 -11.375 7.914 1.00 0.00 H new ATOM 0 HH21 ARG A 106 17.166 -11.395 9.509 1.00 0.00 H new ATOM 0 HH22 ARG A 106 18.719 -12.220 9.342 1.00 0.00 H new ATOM 1618 N HIS A 107 14.398 -5.278 9.777 1.00 0.00 N ATOM 1619 CA HIS A 107 13.764 -5.182 11.091 1.00 0.00 C ATOM 1620 C HIS A 107 12.250 -5.113 10.953 1.00 0.00 C ATOM 1621 O HIS A 107 11.525 -5.842 11.636 1.00 0.00 O ATOM 1622 CB HIS A 107 14.296 -3.980 11.905 1.00 0.00 C ATOM 1623 CG HIS A 107 15.741 -4.094 12.286 1.00 0.00 C ATOM 1624 ND1 HIS A 107 16.563 -3.007 12.471 1.00 0.00 N ATOM 1625 CD2 HIS A 107 16.513 -5.181 12.504 1.00 0.00 C ATOM 1626 CE1 HIS A 107 17.774 -3.420 12.775 1.00 0.00 C ATOM 1627 NE2 HIS A 107 17.766 -4.732 12.803 1.00 0.00 N ATOM 0 H HIS A 107 15.026 -4.505 9.557 1.00 0.00 H new ATOM 0 HA HIS A 107 14.023 -6.085 11.643 1.00 0.00 H new ATOM 0 HB2 HIS A 107 14.155 -3.069 11.323 1.00 0.00 H new ATOM 0 HB3 HIS A 107 13.699 -3.875 12.811 1.00 0.00 H new ATOM 0 HD2 HIS A 107 16.197 -6.212 12.451 1.00 0.00 H new ATOM 0 HE1 HIS A 107 18.628 -2.788 12.968 1.00 0.00 H new ATOM 0 HE2 HIS A 107 18.570 -5.323 13.015 1.00 0.00 H new ATOM 1636 N VAL A 108 11.769 -4.295 10.023 1.00 0.00 N ATOM 1637 CA VAL A 108 10.336 -4.190 9.830 1.00 0.00 C ATOM 1638 C VAL A 108 9.798 -5.446 9.151 1.00 0.00 C ATOM 1639 O VAL A 108 8.702 -5.864 9.431 1.00 0.00 O ATOM 1640 CB VAL A 108 9.882 -2.899 9.068 1.00 0.00 C ATOM 1641 CG1 VAL A 108 10.211 -2.951 7.585 1.00 0.00 C ATOM 1642 CG2 VAL A 108 8.400 -2.647 9.273 1.00 0.00 C ATOM 0 H VAL A 108 12.336 -3.711 9.408 1.00 0.00 H new ATOM 0 HA VAL A 108 9.904 -4.101 10.827 1.00 0.00 H new ATOM 0 HB VAL A 108 10.446 -2.069 9.493 1.00 0.00 H new ATOM 0 HG11 VAL A 108 9.875 -2.032 7.105 1.00 0.00 H new ATOM 0 HG12 VAL A 108 11.288 -3.055 7.455 1.00 0.00 H new ATOM 0 HG13 VAL A 108 9.706 -3.803 7.130 1.00 0.00 H new ATOM 0 HG21 VAL A 108 8.106 -1.746 8.735 1.00 0.00 H new ATOM 0 HG22 VAL A 108 7.831 -3.497 8.895 1.00 0.00 H new ATOM 0 HG23 VAL A 108 8.197 -2.518 10.336 1.00 0.00 H new ATOM 1652 N MET A 109 10.608 -6.075 8.306 1.00 0.00 N ATOM 1653 CA MET A 109 10.199 -7.306 7.629 1.00 0.00 C ATOM 1654 C MET A 109 9.976 -8.409 8.597 1.00 0.00 C ATOM 1655 O MET A 109 8.962 -9.093 8.539 1.00 0.00 O ATOM 1656 CB MET A 109 11.186 -7.724 6.567 1.00 0.00 C ATOM 1657 CG MET A 109 11.133 -6.800 5.416 1.00 0.00 C ATOM 1658 SD MET A 109 9.510 -6.803 4.657 1.00 0.00 S ATOM 1659 CE MET A 109 9.649 -5.333 3.690 1.00 0.00 C ATOM 0 H MET A 109 11.548 -5.756 8.072 1.00 0.00 H new ATOM 0 HA MET A 109 9.253 -7.090 7.133 1.00 0.00 H new ATOM 0 HB2 MET A 109 12.193 -7.737 6.984 1.00 0.00 H new ATOM 0 HB3 MET A 109 10.965 -8.739 6.236 1.00 0.00 H new ATOM 0 HG2 MET A 109 11.382 -5.791 5.745 1.00 0.00 H new ATOM 0 HG3 MET A 109 11.882 -7.089 4.679 1.00 0.00 H new ATOM 0 HE1 MET A 109 8.672 -4.856 3.610 1.00 0.00 H new ATOM 0 HE2 MET A 109 10.349 -4.648 4.168 1.00 0.00 H new ATOM 0 HE3 MET A 109 10.012 -5.586 2.694 1.00 0.00 H new ATOM 1669 N THR A 110 10.891 -8.542 9.527 1.00 0.00 N ATOM 1670 CA THR A 110 10.788 -9.527 10.571 1.00 0.00 C ATOM 1671 C THR A 110 9.516 -9.249 11.412 1.00 0.00 C ATOM 1672 O THR A 110 8.829 -10.168 11.853 1.00 0.00 O ATOM 1673 CB THR A 110 12.054 -9.490 11.460 1.00 0.00 C ATOM 1674 OG1 THR A 110 13.228 -9.543 10.611 1.00 0.00 O ATOM 1675 CG2 THR A 110 12.086 -10.678 12.410 1.00 0.00 C ATOM 0 H THR A 110 11.731 -7.966 9.579 1.00 0.00 H new ATOM 0 HA THR A 110 10.711 -10.522 10.132 1.00 0.00 H new ATOM 0 HB THR A 110 12.040 -8.571 12.045 1.00 0.00 H new ATOM 0 HG1 THR A 110 13.378 -8.664 10.204 1.00 0.00 H new ATOM 0 HG21 THR A 110 12.985 -10.629 13.024 1.00 0.00 H new ATOM 0 HG22 THR A 110 11.206 -10.654 13.053 1.00 0.00 H new ATOM 0 HG23 THR A 110 12.089 -11.604 11.835 1.00 0.00 H new ATOM 1683 N ASN A 111 9.181 -7.972 11.552 1.00 0.00 N ATOM 1684 CA ASN A 111 7.985 -7.547 12.278 1.00 0.00 C ATOM 1685 C ASN A 111 6.714 -7.803 11.443 1.00 0.00 C ATOM 1686 O ASN A 111 5.657 -8.088 11.980 1.00 0.00 O ATOM 1687 CB ASN A 111 8.092 -6.058 12.642 1.00 0.00 C ATOM 1688 CG ASN A 111 6.936 -5.565 13.507 1.00 0.00 C ATOM 1689 OD1 ASN A 111 6.965 -5.700 14.743 1.00 0.00 O ATOM 1690 ND2 ASN A 111 5.961 -4.942 12.895 1.00 0.00 N ATOM 0 H ASN A 111 9.728 -7.202 11.167 1.00 0.00 H new ATOM 0 HA ASN A 111 7.913 -8.133 13.194 1.00 0.00 H new ATOM 0 HB2 ASN A 111 9.030 -5.886 13.169 1.00 0.00 H new ATOM 0 HB3 ASN A 111 8.129 -5.469 11.726 1.00 0.00 H new ATOM 0 HD21 ASN A 111 5.190 -4.547 13.434 1.00 0.00 H new ATOM 0 HD22 ASN A 111 5.972 -4.851 11.879 1.00 0.00 H new ATOM 1697 N LEU A 112 6.844 -7.713 10.131 1.00 0.00 N ATOM 1698 CA LEU A 112 5.729 -7.924 9.203 1.00 0.00 C ATOM 1699 C LEU A 112 5.525 -9.418 8.967 1.00 0.00 C ATOM 1700 O LEU A 112 4.471 -9.862 8.511 1.00 0.00 O ATOM 1701 CB LEU A 112 6.010 -7.187 7.875 1.00 0.00 C ATOM 1702 CG LEU A 112 6.034 -5.646 7.954 1.00 0.00 C ATOM 1703 CD1 LEU A 112 6.693 -5.036 6.722 1.00 0.00 C ATOM 1704 CD2 LEU A 112 4.620 -5.101 8.099 1.00 0.00 C ATOM 0 H LEU A 112 7.726 -7.491 9.670 1.00 0.00 H new ATOM 0 HA LEU A 112 4.814 -7.519 9.635 1.00 0.00 H new ATOM 0 HB2 LEU A 112 6.971 -7.527 7.489 1.00 0.00 H new ATOM 0 HB3 LEU A 112 5.252 -7.483 7.150 1.00 0.00 H new ATOM 0 HG LEU A 112 6.621 -5.370 8.830 1.00 0.00 H new ATOM 0 HD11 LEU A 112 6.693 -3.950 6.810 1.00 0.00 H new ATOM 0 HD12 LEU A 112 7.720 -5.394 6.644 1.00 0.00 H new ATOM 0 HD13 LEU A 112 6.138 -5.328 5.830 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.653 -4.013 8.153 1.00 0.00 H new ATOM 0 HD22 LEU A 112 4.024 -5.403 7.238 1.00 0.00 H new ATOM 0 HD23 LEU A 112 4.169 -5.496 9.009 1.00 0.00 H new ATOM 1716 N GLY A 113 6.544 -10.182 9.287 1.00 0.00 N ATOM 1717 CA GLY A 113 6.495 -11.606 9.137 1.00 0.00 C ATOM 1718 C GLY A 113 6.884 -12.028 7.749 1.00 0.00 C ATOM 1719 O GLY A 113 6.521 -13.118 7.293 1.00 0.00 O ATOM 0 H GLY A 113 7.426 -9.828 9.658 1.00 0.00 H new ATOM 0 HA2 GLY A 113 7.164 -12.072 9.861 1.00 0.00 H new ATOM 0 HA3 GLY A 113 5.489 -11.962 9.358 1.00 0.00 H new ATOM 1723 N GLU A 114 7.605 -11.178 7.061 1.00 0.00 N ATOM 1724 CA GLU A 114 8.019 -11.478 5.724 1.00 0.00 C ATOM 1725 C GLU A 114 9.451 -11.912 5.763 1.00 0.00 C ATOM 1726 O GLU A 114 10.309 -11.180 6.258 1.00 0.00 O ATOM 1727 CB GLU A 114 7.874 -10.269 4.797 1.00 0.00 C ATOM 1728 CG GLU A 114 8.017 -10.625 3.336 1.00 0.00 C ATOM 1729 CD GLU A 114 6.961 -11.587 2.869 1.00 0.00 C ATOM 1730 OE1 GLU A 114 7.184 -12.812 2.935 1.00 0.00 O ATOM 1731 OE2 GLU A 114 5.902 -11.136 2.412 1.00 0.00 O ATOM 0 H GLU A 114 7.915 -10.272 7.411 1.00 0.00 H new ATOM 0 HA GLU A 114 7.381 -12.269 5.329 1.00 0.00 H new ATOM 0 HB2 GLU A 114 6.900 -9.808 4.959 1.00 0.00 H new ATOM 0 HB3 GLU A 114 8.626 -9.525 5.059 1.00 0.00 H new ATOM 0 HG2 GLU A 114 7.965 -9.715 2.738 1.00 0.00 H new ATOM 0 HG3 GLU A 114 9.001 -11.062 3.167 1.00 0.00 H new ATOM 1738 N LYS A 115 9.706 -13.090 5.282 1.00 0.00 N ATOM 1739 CA LYS A 115 11.036 -13.621 5.249 1.00 0.00 C ATOM 1740 C LYS A 115 11.772 -13.108 4.029 1.00 0.00 C ATOM 1741 O LYS A 115 11.450 -13.490 2.894 1.00 0.00 O ATOM 1742 CB LYS A 115 11.005 -15.151 5.248 1.00 0.00 C ATOM 1743 CG LYS A 115 12.387 -15.804 5.197 1.00 0.00 C ATOM 1744 CD LYS A 115 12.299 -17.324 5.232 1.00 0.00 C ATOM 1745 CE LYS A 115 11.596 -17.901 4.003 1.00 0.00 C ATOM 1746 NZ LYS A 115 12.356 -17.678 2.749 1.00 0.00 N ATOM 0 H LYS A 115 8.995 -13.714 4.899 1.00 0.00 H new ATOM 0 HA LYS A 115 11.564 -13.290 6.143 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.486 -15.494 6.143 1.00 0.00 H new ATOM 0 HB3 LYS A 115 10.422 -15.491 4.392 1.00 0.00 H new ATOM 0 HG2 LYS A 115 12.903 -15.491 4.289 1.00 0.00 H new ATOM 0 HG3 LYS A 115 12.984 -15.456 6.039 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.304 -17.741 5.300 1.00 0.00 H new ATOM 0 HD3 LYS A 115 11.764 -17.633 6.130 1.00 0.00 H new ATOM 0 HE2 LYS A 115 11.445 -18.971 4.145 1.00 0.00 H new ATOM 0 HE3 LYS A 115 10.608 -17.449 3.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 11.887 -18.175 1.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 12.391 -16.660 2.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 13.324 -18.042 2.860 1.00 0.00 H new ATOM 1760 N LEU A 116 12.712 -12.220 4.254 1.00 0.00 N ATOM 1761 CA LEU A 116 13.547 -11.699 3.202 1.00 0.00 C ATOM 1762 C LEU A 116 14.980 -11.937 3.615 1.00 0.00 C ATOM 1763 O LEU A 116 15.277 -12.013 4.815 1.00 0.00 O ATOM 1764 CB LEU A 116 13.356 -10.178 2.983 1.00 0.00 C ATOM 1765 CG LEU A 116 11.935 -9.625 2.757 1.00 0.00 C ATOM 1766 CD1 LEU A 116 12.011 -8.185 2.298 1.00 0.00 C ATOM 1767 CD2 LEU A 116 11.146 -10.439 1.756 1.00 0.00 C ATOM 0 H LEU A 116 12.918 -11.838 5.177 1.00 0.00 H new ATOM 0 HA LEU A 116 13.281 -12.199 2.271 1.00 0.00 H new ATOM 0 HB2 LEU A 116 13.773 -9.666 3.850 1.00 0.00 H new ATOM 0 HB3 LEU A 116 13.961 -9.892 2.122 1.00 0.00 H new ATOM 0 HG LEU A 116 11.410 -9.689 3.710 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.004 -7.800 2.140 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.513 -7.587 3.058 1.00 0.00 H new ATOM 0 HD13 LEU A 116 12.571 -8.130 1.365 1.00 0.00 H new ATOM 0 HD21 LEU A 116 10.153 -10.005 1.636 1.00 0.00 H new ATOM 0 HD22 LEU A 116 11.663 -10.435 0.796 1.00 0.00 H new ATOM 0 HD23 LEU A 116 11.053 -11.464 2.114 1.00 0.00 H new ATOM 1779 N THR A 117 15.851 -12.075 2.676 1.00 0.00 N ATOM 1780 CA THR A 117 17.240 -12.247 2.969 1.00 0.00 C ATOM 1781 C THR A 117 17.894 -10.878 3.105 1.00 0.00 C ATOM 1782 O THR A 117 17.251 -9.837 2.855 1.00 0.00 O ATOM 1783 CB THR A 117 17.930 -13.026 1.838 1.00 0.00 C ATOM 1784 OG1 THR A 117 17.706 -12.344 0.599 1.00 0.00 O ATOM 1785 CG2 THR A 117 17.396 -14.447 1.752 1.00 0.00 C ATOM 0 H THR A 117 15.625 -12.072 1.681 1.00 0.00 H new ATOM 0 HA THR A 117 17.342 -12.806 3.899 1.00 0.00 H new ATOM 0 HB THR A 117 18.999 -13.080 2.046 1.00 0.00 H new ATOM 0 HG1 THR A 117 17.852 -12.963 -0.146 1.00 0.00 H new ATOM 0 HG21 THR A 117 17.900 -14.977 0.944 1.00 0.00 H new ATOM 0 HG22 THR A 117 17.580 -14.963 2.695 1.00 0.00 H new ATOM 0 HG23 THR A 117 16.324 -14.422 1.556 1.00 0.00 H new ATOM 1793 N ASP A 118 19.156 -10.853 3.486 1.00 0.00 N ATOM 1794 CA ASP A 118 19.882 -9.594 3.544 1.00 0.00 C ATOM 1795 C ASP A 118 20.135 -9.146 2.118 1.00 0.00 C ATOM 1796 O ASP A 118 20.151 -7.974 1.828 1.00 0.00 O ATOM 1797 CB ASP A 118 21.220 -9.712 4.309 1.00 0.00 C ATOM 1798 CG ASP A 118 22.326 -10.399 3.520 1.00 0.00 C ATOM 1799 OD1 ASP A 118 22.322 -11.639 3.429 1.00 0.00 O ATOM 1800 OD2 ASP A 118 23.219 -9.708 2.996 1.00 0.00 O ATOM 0 H ASP A 118 19.696 -11.675 3.757 1.00 0.00 H new ATOM 0 HA ASP A 118 19.282 -8.867 4.091 1.00 0.00 H new ATOM 0 HB2 ASP A 118 21.555 -8.714 4.591 1.00 0.00 H new ATOM 0 HB3 ASP A 118 21.051 -10.264 5.234 1.00 0.00 H new ATOM 1805 N GLU A 119 20.261 -10.135 1.235 1.00 0.00 N ATOM 1806 CA GLU A 119 20.455 -9.938 -0.174 1.00 0.00 C ATOM 1807 C GLU A 119 19.265 -9.181 -0.752 1.00 0.00 C ATOM 1808 O GLU A 119 19.429 -8.170 -1.435 1.00 0.00 O ATOM 1809 CB GLU A 119 20.572 -11.310 -0.834 1.00 0.00 C ATOM 1810 CG GLU A 119 20.801 -11.271 -2.319 1.00 0.00 C ATOM 1811 CD GLU A 119 20.838 -12.643 -2.933 1.00 0.00 C ATOM 1812 OE1 GLU A 119 19.817 -13.085 -3.512 1.00 0.00 O ATOM 1813 OE2 GLU A 119 21.883 -13.318 -2.843 1.00 0.00 O ATOM 0 H GLU A 119 20.228 -11.119 1.502 1.00 0.00 H new ATOM 0 HA GLU A 119 21.359 -9.357 -0.357 1.00 0.00 H new ATOM 0 HB2 GLU A 119 21.393 -11.855 -0.367 1.00 0.00 H new ATOM 0 HB3 GLU A 119 19.661 -11.874 -0.635 1.00 0.00 H new ATOM 0 HG2 GLU A 119 20.010 -10.687 -2.790 1.00 0.00 H new ATOM 0 HG3 GLU A 119 21.741 -10.759 -2.525 1.00 0.00 H new ATOM 1820 N GLU A 120 18.074 -9.668 -0.427 1.00 0.00 N ATOM 1821 CA GLU A 120 16.831 -9.096 -0.897 1.00 0.00 C ATOM 1822 C GLU A 120 16.723 -7.619 -0.514 1.00 0.00 C ATOM 1823 O GLU A 120 16.557 -6.749 -1.383 1.00 0.00 O ATOM 1824 CB GLU A 120 15.650 -9.856 -0.296 1.00 0.00 C ATOM 1825 CG GLU A 120 14.306 -9.428 -0.843 1.00 0.00 C ATOM 1826 CD GLU A 120 14.078 -9.907 -2.256 1.00 0.00 C ATOM 1827 OE1 GLU A 120 13.294 -10.875 -2.456 1.00 0.00 O ATOM 1828 OE2 GLU A 120 14.695 -9.370 -3.173 1.00 0.00 O ATOM 0 H GLU A 120 17.949 -10.480 0.177 1.00 0.00 H new ATOM 0 HA GLU A 120 16.814 -9.178 -1.984 1.00 0.00 H new ATOM 0 HB2 GLU A 120 15.784 -10.922 -0.481 1.00 0.00 H new ATOM 0 HB3 GLU A 120 15.653 -9.717 0.785 1.00 0.00 H new ATOM 0 HG2 GLU A 120 13.516 -9.815 -0.200 1.00 0.00 H new ATOM 0 HG3 GLU A 120 14.236 -8.341 -0.816 1.00 0.00 H new ATOM 1835 N VAL A 121 16.857 -7.340 0.781 1.00 0.00 N ATOM 1836 CA VAL A 121 16.688 -5.984 1.281 1.00 0.00 C ATOM 1837 C VAL A 121 17.817 -5.070 0.805 1.00 0.00 C ATOM 1838 O VAL A 121 17.598 -3.883 0.561 1.00 0.00 O ATOM 1839 CB VAL A 121 16.567 -5.916 2.836 1.00 0.00 C ATOM 1840 CG1 VAL A 121 15.489 -6.869 3.316 1.00 0.00 C ATOM 1841 CG2 VAL A 121 17.889 -6.211 3.533 1.00 0.00 C ATOM 0 H VAL A 121 17.081 -8.032 1.496 1.00 0.00 H new ATOM 0 HA VAL A 121 15.744 -5.631 0.867 1.00 0.00 H new ATOM 0 HB VAL A 121 16.290 -4.895 3.098 1.00 0.00 H new ATOM 0 HG11 VAL A 121 15.412 -6.814 4.402 1.00 0.00 H new ATOM 0 HG12 VAL A 121 14.534 -6.592 2.870 1.00 0.00 H new ATOM 0 HG13 VAL A 121 15.745 -7.887 3.021 1.00 0.00 H new ATOM 0 HG21 VAL A 121 17.752 -6.151 4.613 1.00 0.00 H new ATOM 0 HG22 VAL A 121 18.226 -7.212 3.265 1.00 0.00 H new ATOM 0 HG23 VAL A 121 18.636 -5.481 3.221 1.00 0.00 H new ATOM 1851 N ASP A 122 19.011 -5.639 0.638 1.00 0.00 N ATOM 1852 CA ASP A 122 20.165 -4.867 0.202 1.00 0.00 C ATOM 1853 C ASP A 122 19.952 -4.416 -1.211 1.00 0.00 C ATOM 1854 O ASP A 122 20.141 -3.253 -1.516 1.00 0.00 O ATOM 1855 CB ASP A 122 21.462 -5.667 0.307 1.00 0.00 C ATOM 1856 CG ASP A 122 22.693 -4.826 0.039 1.00 0.00 C ATOM 1857 OD1 ASP A 122 23.237 -4.240 0.987 1.00 0.00 O ATOM 1858 OD2 ASP A 122 23.159 -4.760 -1.112 1.00 0.00 O ATOM 0 H ASP A 122 19.200 -6.628 0.798 1.00 0.00 H new ATOM 0 HA ASP A 122 20.264 -4.004 0.860 1.00 0.00 H new ATOM 0 HB2 ASP A 122 21.535 -6.103 1.303 1.00 0.00 H new ATOM 0 HB3 ASP A 122 21.432 -6.495 -0.402 1.00 0.00 H new ATOM 1863 N GLU A 123 19.480 -5.334 -2.061 1.00 0.00 N ATOM 1864 CA GLU A 123 19.194 -5.018 -3.448 1.00 0.00 C ATOM 1865 C GLU A 123 18.081 -3.995 -3.536 1.00 0.00 C ATOM 1866 O GLU A 123 18.151 -3.062 -4.355 1.00 0.00 O ATOM 1867 CB GLU A 123 18.829 -6.270 -4.228 1.00 0.00 C ATOM 1868 CG GLU A 123 20.006 -7.171 -4.553 1.00 0.00 C ATOM 1869 CD GLU A 123 20.978 -6.523 -5.514 1.00 0.00 C ATOM 1870 OE1 GLU A 123 21.923 -5.869 -5.076 1.00 0.00 O ATOM 1871 OE2 GLU A 123 20.810 -6.674 -6.744 1.00 0.00 O ATOM 0 H GLU A 123 19.290 -6.302 -1.803 1.00 0.00 H new ATOM 0 HA GLU A 123 20.094 -4.594 -3.893 1.00 0.00 H new ATOM 0 HB2 GLU A 123 18.098 -6.840 -3.655 1.00 0.00 H new ATOM 0 HB3 GLU A 123 18.345 -5.975 -5.159 1.00 0.00 H new ATOM 0 HG2 GLU A 123 20.528 -7.430 -3.632 1.00 0.00 H new ATOM 0 HG3 GLU A 123 19.639 -8.103 -4.984 1.00 0.00 H new ATOM 1878 N MET A 124 17.071 -4.157 -2.659 1.00 0.00 N ATOM 1879 CA MET A 124 15.954 -3.223 -2.560 1.00 0.00 C ATOM 1880 C MET A 124 16.457 -1.821 -2.389 1.00 0.00 C ATOM 1881 O MET A 124 16.120 -0.947 -3.174 1.00 0.00 O ATOM 1882 CB MET A 124 15.007 -3.558 -1.399 1.00 0.00 C ATOM 1883 CG MET A 124 14.082 -4.732 -1.633 1.00 0.00 C ATOM 1884 SD MET A 124 12.977 -5.002 -0.230 1.00 0.00 S ATOM 1885 CE MET A 124 11.947 -6.313 -0.864 1.00 0.00 C ATOM 0 H MET A 124 17.015 -4.938 -2.006 1.00 0.00 H new ATOM 0 HA MET A 124 15.393 -3.312 -3.490 1.00 0.00 H new ATOM 0 HB2 MET A 124 15.606 -3.761 -0.511 1.00 0.00 H new ATOM 0 HB3 MET A 124 14.402 -2.678 -1.181 1.00 0.00 H new ATOM 0 HG2 MET A 124 13.492 -4.557 -2.532 1.00 0.00 H new ATOM 0 HG3 MET A 124 14.673 -5.631 -1.809 1.00 0.00 H new ATOM 0 HE1 MET A 124 11.357 -6.738 -0.052 1.00 0.00 H new ATOM 0 HE2 MET A 124 11.279 -5.914 -1.627 1.00 0.00 H new ATOM 0 HE3 MET A 124 12.575 -7.090 -1.301 1.00 0.00 H new ATOM 1895 N ILE A 125 17.297 -1.625 -1.387 1.00 0.00 N ATOM 1896 CA ILE A 125 17.863 -0.321 -1.103 1.00 0.00 C ATOM 1897 C ILE A 125 18.762 0.122 -2.234 1.00 0.00 C ATOM 1898 O ILE A 125 18.527 1.127 -2.821 1.00 0.00 O ATOM 1899 CB ILE A 125 18.690 -0.312 0.214 1.00 0.00 C ATOM 1900 CG1 ILE A 125 17.829 -0.740 1.408 1.00 0.00 C ATOM 1901 CG2 ILE A 125 19.315 1.071 0.465 1.00 0.00 C ATOM 1902 CD1 ILE A 125 16.614 0.125 1.646 1.00 0.00 C ATOM 0 H ILE A 125 17.603 -2.362 -0.752 1.00 0.00 H new ATOM 0 HA ILE A 125 17.023 0.364 -0.992 1.00 0.00 H new ATOM 0 HB ILE A 125 19.498 -1.034 0.102 1.00 0.00 H new ATOM 0 HG12 ILE A 125 17.503 -1.769 1.254 1.00 0.00 H new ATOM 0 HG13 ILE A 125 18.446 -0.732 2.306 1.00 0.00 H new ATOM 0 HG21 ILE A 125 19.888 1.049 1.392 1.00 0.00 H new ATOM 0 HG22 ILE A 125 19.976 1.328 -0.363 1.00 0.00 H new ATOM 0 HG23 ILE A 125 18.525 1.818 0.544 1.00 0.00 H new ATOM 0 HD11 ILE A 125 16.064 -0.250 2.509 1.00 0.00 H new ATOM 0 HD12 ILE A 125 16.929 1.151 1.835 1.00 0.00 H new ATOM 0 HD13 ILE A 125 15.971 0.099 0.766 1.00 0.00 H new ATOM 1914 N ARG A 126 19.732 -0.699 -2.549 1.00 0.00 N ATOM 1915 CA ARG A 126 20.801 -0.415 -3.522 1.00 0.00 C ATOM 1916 C ARG A 126 20.292 0.129 -4.871 1.00 0.00 C ATOM 1917 O ARG A 126 20.819 1.124 -5.382 1.00 0.00 O ATOM 1918 CB ARG A 126 21.600 -1.697 -3.731 1.00 0.00 C ATOM 1919 CG ARG A 126 22.769 -1.622 -4.681 1.00 0.00 C ATOM 1920 CD ARG A 126 23.390 -2.998 -4.814 1.00 0.00 C ATOM 1921 NE ARG A 126 24.504 -3.028 -5.755 1.00 0.00 N ATOM 1922 CZ ARG A 126 24.795 -4.062 -6.559 1.00 0.00 C ATOM 1923 NH1 ARG A 126 24.022 -5.150 -6.575 1.00 0.00 N ATOM 1924 NH2 ARG A 126 25.859 -4.006 -7.349 1.00 0.00 N ATOM 0 H ARG A 126 19.818 -1.624 -2.128 1.00 0.00 H new ATOM 0 HA ARG A 126 21.423 0.380 -3.111 1.00 0.00 H new ATOM 0 HB2 ARG A 126 21.971 -2.028 -2.761 1.00 0.00 H new ATOM 0 HB3 ARG A 126 20.918 -2.467 -4.091 1.00 0.00 H new ATOM 0 HG2 ARG A 126 22.439 -1.263 -5.656 1.00 0.00 H new ATOM 0 HG3 ARG A 126 23.508 -0.910 -4.313 1.00 0.00 H new ATOM 0 HD2 ARG A 126 23.738 -3.330 -3.836 1.00 0.00 H new ATOM 0 HD3 ARG A 126 22.627 -3.706 -5.139 1.00 0.00 H new ATOM 0 HE ARG A 126 25.104 -2.205 -5.805 1.00 0.00 H new ATOM 0 HH11 ARG A 126 23.201 -5.201 -5.972 1.00 0.00 H new ATOM 0 HH12 ARG A 126 24.252 -5.930 -7.190 1.00 0.00 H new ATOM 0 HH21 ARG A 126 26.454 -3.178 -7.345 1.00 0.00 H new ATOM 0 HH22 ARG A 126 26.082 -4.791 -7.961 1.00 0.00 H new ATOM 1938 N GLU A 127 19.282 -0.500 -5.435 1.00 0.00 N ATOM 1939 CA GLU A 127 18.784 -0.065 -6.729 1.00 0.00 C ATOM 1940 C GLU A 127 17.808 1.114 -6.567 1.00 0.00 C ATOM 1941 O GLU A 127 17.686 1.961 -7.453 1.00 0.00 O ATOM 1942 CB GLU A 127 18.123 -1.221 -7.476 1.00 0.00 C ATOM 1943 CG GLU A 127 17.772 -0.909 -8.928 1.00 0.00 C ATOM 1944 CD GLU A 127 19.000 -0.729 -9.792 1.00 0.00 C ATOM 1945 OE1 GLU A 127 19.403 -1.700 -10.454 1.00 0.00 O ATOM 1946 OE2 GLU A 127 19.593 0.388 -9.819 1.00 0.00 O ATOM 0 H GLU A 127 18.795 -1.300 -5.030 1.00 0.00 H new ATOM 0 HA GLU A 127 19.633 0.275 -7.322 1.00 0.00 H new ATOM 0 HB2 GLU A 127 18.790 -2.083 -7.452 1.00 0.00 H new ATOM 0 HB3 GLU A 127 17.214 -1.507 -6.948 1.00 0.00 H new ATOM 0 HG2 GLU A 127 17.161 -1.716 -9.333 1.00 0.00 H new ATOM 0 HG3 GLU A 127 17.168 -0.002 -8.966 1.00 0.00 H new ATOM 1953 N ALA A 128 17.154 1.188 -5.420 1.00 0.00 N ATOM 1954 CA ALA A 128 16.214 2.276 -5.142 1.00 0.00 C ATOM 1955 C ALA A 128 16.986 3.518 -4.724 1.00 0.00 C ATOM 1956 O ALA A 128 16.489 4.650 -4.764 1.00 0.00 O ATOM 1957 CB ALA A 128 15.243 1.865 -4.054 1.00 0.00 C ATOM 0 H ALA A 128 17.252 0.511 -4.663 1.00 0.00 H new ATOM 0 HA ALA A 128 15.643 2.498 -6.044 1.00 0.00 H new ATOM 0 HB1 ALA A 128 14.550 2.683 -3.857 1.00 0.00 H new ATOM 0 HB2 ALA A 128 14.685 0.986 -4.377 1.00 0.00 H new ATOM 0 HB3 ALA A 128 15.795 1.630 -3.144 1.00 0.00 H new ATOM 1963 N ASP A 129 18.196 3.281 -4.306 1.00 0.00 N ATOM 1964 CA ASP A 129 19.146 4.288 -3.935 1.00 0.00 C ATOM 1965 C ASP A 129 19.663 4.987 -5.182 1.00 0.00 C ATOM 1966 O ASP A 129 20.748 4.720 -5.690 1.00 0.00 O ATOM 1967 CB ASP A 129 20.277 3.659 -3.084 1.00 0.00 C ATOM 1968 CG ASP A 129 21.491 4.535 -2.873 1.00 0.00 C ATOM 1969 OD1 ASP A 129 21.392 5.607 -2.269 1.00 0.00 O ATOM 1970 OD2 ASP A 129 22.594 4.125 -3.276 1.00 0.00 O ATOM 0 H ASP A 129 18.564 2.334 -4.210 1.00 0.00 H new ATOM 0 HA ASP A 129 18.669 5.047 -3.315 1.00 0.00 H new ATOM 0 HB2 ASP A 129 19.869 3.391 -2.109 1.00 0.00 H new ATOM 0 HB3 ASP A 129 20.596 2.733 -3.562 1.00 0.00 H new ATOM 1975 N ILE A 130 18.811 5.822 -5.726 1.00 0.00 N ATOM 1976 CA ILE A 130 19.114 6.623 -6.894 1.00 0.00 C ATOM 1977 C ILE A 130 20.018 7.775 -6.453 1.00 0.00 C ATOM 1978 O ILE A 130 20.698 8.421 -7.253 1.00 0.00 O ATOM 1979 CB ILE A 130 17.795 7.173 -7.539 1.00 0.00 C ATOM 1980 CG1 ILE A 130 16.823 6.011 -7.839 1.00 0.00 C ATOM 1981 CG2 ILE A 130 18.098 7.943 -8.831 1.00 0.00 C ATOM 1982 CD1 ILE A 130 15.472 6.443 -8.395 1.00 0.00 C ATOM 0 H ILE A 130 17.869 5.969 -5.364 1.00 0.00 H new ATOM 0 HA ILE A 130 19.619 6.017 -7.646 1.00 0.00 H new ATOM 0 HB ILE A 130 17.330 7.856 -6.829 1.00 0.00 H new ATOM 0 HG12 ILE A 130 17.295 5.334 -8.551 1.00 0.00 H new ATOM 0 HG13 ILE A 130 16.660 5.445 -6.922 1.00 0.00 H new ATOM 0 HG21 ILE A 130 17.167 8.315 -9.260 1.00 0.00 H new ATOM 0 HG22 ILE A 130 18.756 8.783 -8.608 1.00 0.00 H new ATOM 0 HG23 ILE A 130 18.586 7.279 -9.544 1.00 0.00 H new ATOM 0 HD11 ILE A 130 14.855 5.563 -8.576 1.00 0.00 H new ATOM 0 HD12 ILE A 130 14.974 7.094 -7.676 1.00 0.00 H new ATOM 0 HD13 ILE A 130 15.619 6.982 -9.331 1.00 0.00 H new ATOM 1994 N ASP A 131 20.066 7.969 -5.154 1.00 0.00 N ATOM 1995 CA ASP A 131 20.856 9.014 -4.550 1.00 0.00 C ATOM 1996 C ASP A 131 22.325 8.555 -4.429 1.00 0.00 C ATOM 1997 O ASP A 131 23.236 9.356 -4.157 1.00 0.00 O ATOM 1998 CB ASP A 131 20.254 9.346 -3.184 1.00 0.00 C ATOM 1999 CG ASP A 131 20.869 10.547 -2.521 1.00 0.00 C ATOM 2000 OD1 ASP A 131 20.549 11.688 -2.919 1.00 0.00 O ATOM 2001 OD2 ASP A 131 21.611 10.386 -1.556 1.00 0.00 O ATOM 0 H ASP A 131 19.552 7.399 -4.482 1.00 0.00 H new ATOM 0 HA ASP A 131 20.845 9.912 -5.167 1.00 0.00 H new ATOM 0 HB2 ASP A 131 19.184 9.517 -3.302 1.00 0.00 H new ATOM 0 HB3 ASP A 131 20.369 8.483 -2.528 1.00 0.00 H new ATOM 2006 N GLY A 132 22.536 7.257 -4.686 1.00 0.00 N ATOM 2007 CA GLY A 132 23.860 6.647 -4.721 1.00 0.00 C ATOM 2008 C GLY A 132 24.617 6.760 -3.418 1.00 0.00 C ATOM 2009 O GLY A 132 25.847 6.813 -3.408 1.00 0.00 O ATOM 0 H GLY A 132 21.780 6.599 -4.877 1.00 0.00 H new ATOM 0 HA2 GLY A 132 23.758 5.593 -4.981 1.00 0.00 H new ATOM 0 HA3 GLY A 132 24.445 7.115 -5.512 1.00 0.00 H new ATOM 2013 N ASP A 133 23.908 6.765 -2.330 1.00 0.00 N ATOM 2014 CA ASP A 133 24.512 7.003 -1.028 1.00 0.00 C ATOM 2015 C ASP A 133 24.395 5.776 -0.136 1.00 0.00 C ATOM 2016 O ASP A 133 25.059 5.665 0.902 1.00 0.00 O ATOM 2017 CB ASP A 133 23.846 8.232 -0.392 1.00 0.00 C ATOM 2018 CG ASP A 133 24.378 8.620 0.972 1.00 0.00 C ATOM 2019 OD1 ASP A 133 23.630 8.490 1.965 1.00 0.00 O ATOM 2020 OD2 ASP A 133 25.532 9.101 1.070 1.00 0.00 O ATOM 0 H ASP A 133 22.901 6.607 -2.305 1.00 0.00 H new ATOM 0 HA ASP A 133 25.577 7.198 -1.149 1.00 0.00 H new ATOM 0 HB2 ASP A 133 23.966 9.080 -1.066 1.00 0.00 H new ATOM 0 HB3 ASP A 133 22.776 8.042 -0.306 1.00 0.00 H new ATOM 2025 N GLY A 134 23.596 4.838 -0.564 1.00 0.00 N ATOM 2026 CA GLY A 134 23.351 3.654 0.219 1.00 0.00 C ATOM 2027 C GLY A 134 22.106 3.830 1.040 1.00 0.00 C ATOM 2028 O GLY A 134 21.850 3.079 1.988 1.00 0.00 O ATOM 0 H GLY A 134 23.100 4.869 -1.455 1.00 0.00 H new ATOM 0 HA2 GLY A 134 23.245 2.790 -0.437 1.00 0.00 H new ATOM 0 HA3 GLY A 134 24.202 3.457 0.871 1.00 0.00 H new ATOM 2032 N GLN A 135 21.334 4.840 0.681 1.00 0.00 N ATOM 2033 CA GLN A 135 20.108 5.173 1.352 1.00 0.00 C ATOM 2034 C GLN A 135 19.117 5.652 0.314 1.00 0.00 C ATOM 2035 O GLN A 135 19.381 6.611 -0.416 1.00 0.00 O ATOM 2036 CB GLN A 135 20.334 6.304 2.379 1.00 0.00 C ATOM 2037 CG GLN A 135 21.257 5.958 3.544 1.00 0.00 C ATOM 2038 CD GLN A 135 21.471 7.120 4.511 1.00 0.00 C ATOM 2039 OE1 GLN A 135 21.457 8.329 4.014 1.00 0.00 O flip ATOM 2040 NE2 GLN A 135 21.676 6.916 5.701 1.00 0.00 N flip ATOM 0 H GLN A 135 21.553 5.458 -0.100 1.00 0.00 H new ATOM 0 HA GLN A 135 19.737 4.293 1.878 1.00 0.00 H new ATOM 0 HB2 GLN A 135 20.745 7.168 1.857 1.00 0.00 H new ATOM 0 HB3 GLN A 135 19.367 6.605 2.781 1.00 0.00 H new ATOM 0 HG2 GLN A 135 20.840 5.112 4.090 1.00 0.00 H new ATOM 0 HG3 GLN A 135 22.222 5.639 3.151 1.00 0.00 H new ATOM 0 HE21 GLN A 135 21.681 5.962 6.061 1.00 0.00 H new ATOM 0 HE22 GLN A 135 21.842 7.700 6.332 1.00 0.00 H new ATOM 2049 N VAL A 136 17.983 5.033 0.268 1.00 0.00 N ATOM 2050 CA VAL A 136 16.972 5.434 -0.679 1.00 0.00 C ATOM 2051 C VAL A 136 16.096 6.504 -0.076 1.00 0.00 C ATOM 2052 O VAL A 136 15.396 6.268 0.895 1.00 0.00 O ATOM 2053 CB VAL A 136 16.146 4.227 -1.259 1.00 0.00 C ATOM 2054 CG1 VAL A 136 15.854 3.209 -0.201 1.00 0.00 C ATOM 2055 CG2 VAL A 136 14.826 4.700 -1.854 1.00 0.00 C ATOM 0 H VAL A 136 17.725 4.250 0.869 1.00 0.00 H new ATOM 0 HA VAL A 136 17.481 5.857 -1.545 1.00 0.00 H new ATOM 0 HB VAL A 136 16.758 3.774 -2.039 1.00 0.00 H new ATOM 0 HG11 VAL A 136 15.282 2.388 -0.634 1.00 0.00 H new ATOM 0 HG12 VAL A 136 16.791 2.825 0.203 1.00 0.00 H new ATOM 0 HG13 VAL A 136 15.276 3.671 0.599 1.00 0.00 H new ATOM 0 HG21 VAL A 136 14.277 3.844 -2.247 1.00 0.00 H new ATOM 0 HG22 VAL A 136 14.233 5.188 -1.081 1.00 0.00 H new ATOM 0 HG23 VAL A 136 15.023 5.406 -2.660 1.00 0.00 H new ATOM 2065 N ASN A 137 16.187 7.688 -0.622 1.00 0.00 N ATOM 2066 CA ASN A 137 15.424 8.813 -0.120 1.00 0.00 C ATOM 2067 C ASN A 137 14.024 8.794 -0.658 1.00 0.00 C ATOM 2068 O ASN A 137 13.752 8.147 -1.681 1.00 0.00 O ATOM 2069 CB ASN A 137 16.101 10.162 -0.420 1.00 0.00 C ATOM 2070 CG ASN A 137 17.397 10.354 0.341 1.00 0.00 C ATOM 2071 OD1 ASN A 137 17.408 10.854 1.465 1.00 0.00 O ATOM 2072 ND2 ASN A 137 18.503 9.993 -0.265 1.00 0.00 N ATOM 0 H ASN A 137 16.784 7.904 -1.420 1.00 0.00 H new ATOM 0 HA ASN A 137 15.384 8.707 0.964 1.00 0.00 H new ATOM 0 HB2 ASN A 137 16.300 10.233 -1.489 1.00 0.00 H new ATOM 0 HB3 ASN A 137 15.415 10.971 -0.169 1.00 0.00 H new ATOM 0 HD21 ASN A 137 19.403 10.124 0.196 1.00 0.00 H new ATOM 0 HD22 ASN A 137 18.463 9.581 -1.197 1.00 0.00 H new ATOM 2079 N TYR A 138 13.139 9.514 0.009 1.00 0.00 N ATOM 2080 CA TYR A 138 11.729 9.574 -0.355 1.00 0.00 C ATOM 2081 C TYR A 138 11.564 10.052 -1.791 1.00 0.00 C ATOM 2082 O TYR A 138 10.807 9.476 -2.555 1.00 0.00 O ATOM 2083 CB TYR A 138 10.985 10.484 0.620 1.00 0.00 C ATOM 2084 CG TYR A 138 9.490 10.532 0.438 1.00 0.00 C ATOM 2085 CD1 TYR A 138 8.871 11.651 -0.082 1.00 0.00 C ATOM 2086 CD2 TYR A 138 8.697 9.463 0.803 1.00 0.00 C ATOM 2087 CE1 TYR A 138 7.503 11.702 -0.221 1.00 0.00 C ATOM 2088 CE2 TYR A 138 7.338 9.504 0.655 1.00 0.00 C ATOM 2089 CZ TYR A 138 6.745 10.625 0.148 1.00 0.00 C ATOM 2090 OH TYR A 138 5.375 10.680 0.037 1.00 0.00 O ATOM 0 H TYR A 138 13.377 10.078 0.825 1.00 0.00 H new ATOM 0 HA TYR A 138 11.301 8.574 -0.292 1.00 0.00 H new ATOM 0 HB2 TYR A 138 11.201 10.155 1.636 1.00 0.00 H new ATOM 0 HB3 TYR A 138 11.380 11.495 0.522 1.00 0.00 H new ATOM 0 HD1 TYR A 138 9.469 12.498 -0.384 1.00 0.00 H new ATOM 0 HD2 TYR A 138 9.159 8.577 1.213 1.00 0.00 H new ATOM 0 HE1 TYR A 138 7.030 12.588 -0.619 1.00 0.00 H new ATOM 0 HE2 TYR A 138 6.736 8.653 0.938 1.00 0.00 H new ATOM 0 HH TYR A 138 5.127 11.378 -0.605 1.00 0.00 H new ATOM 2100 N GLU A 139 12.339 11.056 -2.158 1.00 0.00 N ATOM 2101 CA GLU A 139 12.329 11.621 -3.504 1.00 0.00 C ATOM 2102 C GLU A 139 12.745 10.613 -4.576 1.00 0.00 C ATOM 2103 O GLU A 139 12.423 10.787 -5.751 1.00 0.00 O ATOM 2104 CB GLU A 139 13.209 12.862 -3.591 1.00 0.00 C ATOM 2105 CG GLU A 139 12.602 14.136 -3.020 1.00 0.00 C ATOM 2106 CD GLU A 139 12.238 14.038 -1.576 1.00 0.00 C ATOM 2107 OE1 GLU A 139 11.043 14.128 -1.247 1.00 0.00 O ATOM 2108 OE2 GLU A 139 13.137 13.873 -0.740 1.00 0.00 O ATOM 0 H GLU A 139 13.001 11.510 -1.528 1.00 0.00 H new ATOM 0 HA GLU A 139 11.294 11.901 -3.702 1.00 0.00 H new ATOM 0 HB2 GLU A 139 14.144 12.660 -3.069 1.00 0.00 H new ATOM 0 HB3 GLU A 139 13.459 13.036 -4.638 1.00 0.00 H new ATOM 0 HG2 GLU A 139 13.310 14.955 -3.151 1.00 0.00 H new ATOM 0 HG3 GLU A 139 11.710 14.390 -3.593 1.00 0.00 H new ATOM 2115 N GLU A 140 13.448 9.581 -4.191 1.00 0.00 N ATOM 2116 CA GLU A 140 13.852 8.579 -5.144 1.00 0.00 C ATOM 2117 C GLU A 140 12.724 7.550 -5.225 1.00 0.00 C ATOM 2118 O GLU A 140 12.265 7.176 -6.306 1.00 0.00 O ATOM 2119 CB GLU A 140 15.159 7.885 -4.706 1.00 0.00 C ATOM 2120 CG GLU A 140 16.251 8.812 -4.156 1.00 0.00 C ATOM 2121 CD GLU A 140 16.603 9.985 -5.047 1.00 0.00 C ATOM 2122 OE1 GLU A 140 17.447 9.839 -5.929 1.00 0.00 O ATOM 2123 OE2 GLU A 140 16.063 11.083 -4.841 1.00 0.00 O ATOM 0 H GLU A 140 13.751 9.412 -3.232 1.00 0.00 H new ATOM 0 HA GLU A 140 14.038 9.043 -6.113 1.00 0.00 H new ATOM 0 HB2 GLU A 140 14.918 7.145 -3.943 1.00 0.00 H new ATOM 0 HB3 GLU A 140 15.565 7.342 -5.560 1.00 0.00 H new ATOM 0 HG2 GLU A 140 15.928 9.195 -3.188 1.00 0.00 H new ATOM 0 HG3 GLU A 140 17.152 8.224 -3.982 1.00 0.00 H new ATOM 2130 N PHE A 141 12.238 7.177 -4.049 1.00 0.00 N ATOM 2131 CA PHE A 141 11.192 6.178 -3.878 1.00 0.00 C ATOM 2132 C PHE A 141 9.858 6.600 -4.525 1.00 0.00 C ATOM 2133 O PHE A 141 9.165 5.767 -5.122 1.00 0.00 O ATOM 2134 CB PHE A 141 11.018 5.860 -2.380 1.00 0.00 C ATOM 2135 CG PHE A 141 9.896 4.909 -2.066 1.00 0.00 C ATOM 2136 CD1 PHE A 141 8.706 5.374 -1.523 1.00 0.00 C ATOM 2137 CD2 PHE A 141 10.026 3.557 -2.321 1.00 0.00 C ATOM 2138 CE1 PHE A 141 7.673 4.508 -1.240 1.00 0.00 C ATOM 2139 CE2 PHE A 141 8.997 2.687 -2.040 1.00 0.00 C ATOM 2140 CZ PHE A 141 7.818 3.164 -1.499 1.00 0.00 C ATOM 0 H PHE A 141 12.568 7.570 -3.167 1.00 0.00 H new ATOM 0 HA PHE A 141 11.504 5.274 -4.400 1.00 0.00 H new ATOM 0 HB2 PHE A 141 11.949 5.439 -2.001 1.00 0.00 H new ATOM 0 HB3 PHE A 141 10.847 6.792 -1.842 1.00 0.00 H new ATOM 0 HD1 PHE A 141 8.589 6.428 -1.320 1.00 0.00 H new ATOM 0 HD2 PHE A 141 10.945 3.179 -2.745 1.00 0.00 H new ATOM 0 HE1 PHE A 141 6.753 4.882 -0.816 1.00 0.00 H new ATOM 0 HE2 PHE A 141 9.111 1.632 -2.242 1.00 0.00 H new ATOM 0 HZ PHE A 141 7.010 2.482 -1.279 1.00 0.00 H new ATOM 2150 N VAL A 142 9.514 7.890 -4.429 1.00 0.00 N ATOM 2151 CA VAL A 142 8.260 8.411 -5.013 1.00 0.00 C ATOM 2152 C VAL A 142 8.170 8.135 -6.520 1.00 0.00 C ATOM 2153 O VAL A 142 7.089 7.910 -7.063 1.00 0.00 O ATOM 2154 CB VAL A 142 8.060 9.940 -4.766 1.00 0.00 C ATOM 2155 CG1 VAL A 142 7.859 10.242 -3.304 1.00 0.00 C ATOM 2156 CG2 VAL A 142 9.203 10.763 -5.330 1.00 0.00 C ATOM 0 H VAL A 142 10.080 8.594 -3.956 1.00 0.00 H new ATOM 0 HA VAL A 142 7.464 7.874 -4.497 1.00 0.00 H new ATOM 0 HB VAL A 142 7.154 10.226 -5.300 1.00 0.00 H new ATOM 0 HG11 VAL A 142 7.723 11.315 -3.169 1.00 0.00 H new ATOM 0 HG12 VAL A 142 6.976 9.716 -2.942 1.00 0.00 H new ATOM 0 HG13 VAL A 142 8.733 9.914 -2.741 1.00 0.00 H new ATOM 0 HG21 VAL A 142 9.021 11.820 -5.135 1.00 0.00 H new ATOM 0 HG22 VAL A 142 10.137 10.462 -4.855 1.00 0.00 H new ATOM 0 HG23 VAL A 142 9.273 10.599 -6.405 1.00 0.00 H new ATOM 2166 N GLN A 143 9.319 8.093 -7.168 1.00 0.00 N ATOM 2167 CA GLN A 143 9.394 7.905 -8.588 1.00 0.00 C ATOM 2168 C GLN A 143 9.213 6.436 -8.960 1.00 0.00 C ATOM 2169 O GLN A 143 8.711 6.102 -10.031 1.00 0.00 O ATOM 2170 CB GLN A 143 10.732 8.409 -9.072 1.00 0.00 C ATOM 2171 CG GLN A 143 10.804 8.531 -10.569 1.00 0.00 C ATOM 2172 CD GLN A 143 9.655 9.338 -11.144 1.00 0.00 C ATOM 2173 OE1 GLN A 143 8.611 8.796 -11.501 1.00 0.00 O ATOM 2174 NE2 GLN A 143 9.822 10.626 -11.213 1.00 0.00 N ATOM 0 H GLN A 143 10.227 8.190 -6.713 1.00 0.00 H new ATOM 0 HA GLN A 143 8.590 8.464 -9.066 1.00 0.00 H new ATOM 0 HB2 GLN A 143 10.932 9.382 -8.623 1.00 0.00 H new ATOM 0 HB3 GLN A 143 11.515 7.733 -8.729 1.00 0.00 H new ATOM 0 HG2 GLN A 143 11.748 9.000 -10.847 1.00 0.00 H new ATOM 0 HG3 GLN A 143 10.801 7.535 -11.012 1.00 0.00 H new ATOM 0 HE21 GLN A 143 10.701 11.043 -10.908 1.00 0.00 H new ATOM 0 HE22 GLN A 143 9.074 11.219 -11.572 1.00 0.00 H new ATOM 2183 N MET A 144 9.553 5.562 -8.045 1.00 0.00 N ATOM 2184 CA MET A 144 9.526 4.126 -8.312 1.00 0.00 C ATOM 2185 C MET A 144 8.128 3.559 -8.207 1.00 0.00 C ATOM 2186 O MET A 144 7.839 2.505 -8.762 1.00 0.00 O ATOM 2187 CB MET A 144 10.449 3.380 -7.361 1.00 0.00 C ATOM 2188 CG MET A 144 11.902 3.796 -7.460 1.00 0.00 C ATOM 2189 SD MET A 144 12.958 2.895 -6.322 1.00 0.00 S ATOM 2190 CE MET A 144 12.719 1.207 -6.880 1.00 0.00 C ATOM 0 H MET A 144 9.854 5.811 -7.103 1.00 0.00 H new ATOM 0 HA MET A 144 9.875 3.989 -9.336 1.00 0.00 H new ATOM 0 HB2 MET A 144 10.105 3.538 -6.339 1.00 0.00 H new ATOM 0 HB3 MET A 144 10.373 2.311 -7.561 1.00 0.00 H new ATOM 0 HG2 MET A 144 12.253 3.636 -8.479 1.00 0.00 H new ATOM 0 HG3 MET A 144 11.985 4.864 -7.258 1.00 0.00 H new ATOM 0 HE1 MET A 144 13.667 0.672 -6.836 1.00 0.00 H new ATOM 0 HE2 MET A 144 11.992 0.711 -6.237 1.00 0.00 H new ATOM 0 HE3 MET A 144 12.352 1.212 -7.906 1.00 0.00 H new ATOM 2200 N MET A 145 7.252 4.285 -7.538 1.00 0.00 N ATOM 2201 CA MET A 145 5.883 3.823 -7.287 1.00 0.00 C ATOM 2202 C MET A 145 5.078 3.627 -8.585 1.00 0.00 C ATOM 2203 O MET A 145 4.135 2.847 -8.626 1.00 0.00 O ATOM 2204 CB MET A 145 5.146 4.790 -6.359 1.00 0.00 C ATOM 2205 CG MET A 145 3.732 4.341 -6.000 1.00 0.00 C ATOM 2206 SD MET A 145 3.680 2.824 -5.017 1.00 0.00 S ATOM 2207 CE MET A 145 4.439 3.381 -3.487 1.00 0.00 C ATOM 0 H MET A 145 7.459 5.206 -7.152 1.00 0.00 H new ATOM 0 HA MET A 145 5.967 2.850 -6.804 1.00 0.00 H new ATOM 0 HB2 MET A 145 5.723 4.910 -5.442 1.00 0.00 H new ATOM 0 HB3 MET A 145 5.097 5.769 -6.835 1.00 0.00 H new ATOM 0 HG2 MET A 145 3.236 5.139 -5.447 1.00 0.00 H new ATOM 0 HG3 MET A 145 3.164 4.189 -6.918 1.00 0.00 H new ATOM 0 HE1 MET A 145 4.126 2.733 -2.669 1.00 0.00 H new ATOM 0 HE2 MET A 145 5.524 3.344 -3.585 1.00 0.00 H new ATOM 0 HE3 MET A 145 4.128 4.405 -3.278 1.00 0.00 H new ATOM 2385 N LYS B 82 10.880 -5.747 -8.558 1.00 0.00 N ATOM 2386 CA LYS B 82 9.704 -4.905 -8.563 1.00 0.00 C ATOM 2387 C LYS B 82 8.624 -5.527 -7.691 1.00 0.00 C ATOM 2388 O LYS B 82 8.075 -4.864 -6.826 1.00 0.00 O ATOM 2389 CB LYS B 82 9.211 -4.635 -10.018 1.00 0.00 C ATOM 2390 CG LYS B 82 8.070 -3.596 -10.158 1.00 0.00 C ATOM 2391 CD LYS B 82 6.703 -4.125 -9.711 1.00 0.00 C ATOM 2392 CE LYS B 82 6.117 -5.118 -10.703 1.00 0.00 C ATOM 2393 NZ LYS B 82 5.610 -4.448 -11.912 1.00 0.00 N ATOM 0 HA LYS B 82 9.957 -3.933 -8.140 1.00 0.00 H new ATOM 0 HB2 LYS B 82 10.060 -4.298 -10.613 1.00 0.00 H new ATOM 0 HB3 LYS B 82 8.874 -5.578 -10.449 1.00 0.00 H new ATOM 0 HG2 LYS B 82 8.319 -2.713 -9.569 1.00 0.00 H new ATOM 0 HG3 LYS B 82 8.005 -3.278 -11.198 1.00 0.00 H new ATOM 0 HD2 LYS B 82 6.802 -4.603 -8.737 1.00 0.00 H new ATOM 0 HD3 LYS B 82 6.015 -3.289 -9.587 1.00 0.00 H new ATOM 0 HE2 LYS B 82 6.879 -5.845 -10.983 1.00 0.00 H new ATOM 0 HE3 LYS B 82 5.307 -5.672 -10.228 1.00 0.00 H new ATOM 0 HZ1 LYS B 82 5.128 -5.143 -12.518 1.00 0.00 H new ATOM 0 HZ2 LYS B 82 4.939 -3.702 -11.640 1.00 0.00 H new ATOM 0 HZ3 LYS B 82 6.404 -4.026 -12.434 1.00 0.00 H new ATOM 2407 N GLU B 83 8.343 -6.807 -7.908 1.00 0.00 N ATOM 2408 CA GLU B 83 7.322 -7.506 -7.134 1.00 0.00 C ATOM 2409 C GLU B 83 7.726 -7.631 -5.667 1.00 0.00 C ATOM 2410 O GLU B 83 6.867 -7.708 -4.785 1.00 0.00 O ATOM 2411 CB GLU B 83 6.979 -8.856 -7.750 1.00 0.00 C ATOM 2412 CG GLU B 83 6.192 -8.755 -9.066 1.00 0.00 C ATOM 2413 CD GLU B 83 4.758 -8.231 -8.891 1.00 0.00 C ATOM 2414 OE1 GLU B 83 4.537 -7.011 -8.882 1.00 0.00 O ATOM 2415 OE2 GLU B 83 3.812 -9.052 -8.789 1.00 0.00 O ATOM 0 H GLU B 83 8.806 -7.381 -8.612 1.00 0.00 H new ATOM 0 HA GLU B 83 6.414 -6.904 -7.166 1.00 0.00 H new ATOM 0 HB2 GLU B 83 7.902 -9.407 -7.931 1.00 0.00 H new ATOM 0 HB3 GLU B 83 6.397 -9.435 -7.033 1.00 0.00 H new ATOM 0 HG2 GLU B 83 6.728 -8.097 -9.750 1.00 0.00 H new ATOM 0 HG3 GLU B 83 6.155 -9.739 -9.533 1.00 0.00 H new ATOM 2422 N ALA B 84 9.023 -7.636 -5.415 1.00 0.00 N ATOM 2423 CA ALA B 84 9.558 -7.596 -4.067 1.00 0.00 C ATOM 2424 C ALA B 84 9.081 -6.318 -3.368 1.00 0.00 C ATOM 2425 O ALA B 84 8.429 -6.380 -2.315 1.00 0.00 O ATOM 2426 CB ALA B 84 11.081 -7.661 -4.099 1.00 0.00 C ATOM 0 H ALA B 84 9.737 -7.668 -6.143 1.00 0.00 H new ATOM 0 HA ALA B 84 9.197 -8.460 -3.508 1.00 0.00 H new ATOM 0 HB1 ALA B 84 11.468 -7.630 -3.080 1.00 0.00 H new ATOM 0 HB2 ALA B 84 11.396 -8.588 -4.579 1.00 0.00 H new ATOM 0 HB3 ALA B 84 11.470 -6.812 -4.661 1.00 0.00 H new ATOM 2432 N TRP B 85 9.367 -5.162 -3.986 1.00 0.00 N ATOM 2433 CA TRP B 85 8.897 -3.873 -3.465 1.00 0.00 C ATOM 2434 C TRP B 85 7.383 -3.814 -3.434 1.00 0.00 C ATOM 2435 O TRP B 85 6.810 -3.358 -2.468 1.00 0.00 O ATOM 2436 CB TRP B 85 9.432 -2.684 -4.270 1.00 0.00 C ATOM 2437 CG TRP B 85 10.797 -2.216 -3.869 1.00 0.00 C ATOM 2438 CD1 TRP B 85 11.971 -2.412 -4.530 1.00 0.00 C ATOM 2439 CD2 TRP B 85 11.117 -1.451 -2.699 1.00 0.00 C ATOM 2440 NE1 TRP B 85 12.998 -1.798 -3.849 1.00 0.00 N ATOM 2441 CE2 TRP B 85 12.497 -1.211 -2.722 1.00 0.00 C ATOM 2442 CE3 TRP B 85 10.364 -0.946 -1.637 1.00 0.00 C ATOM 2443 CZ2 TRP B 85 13.143 -0.486 -1.725 1.00 0.00 C ATOM 2444 CZ3 TRP B 85 11.007 -0.230 -0.649 1.00 0.00 C ATOM 2445 CH2 TRP B 85 12.384 -0.006 -0.702 1.00 0.00 C ATOM 0 H TRP B 85 9.918 -5.095 -4.842 1.00 0.00 H new ATOM 0 HA TRP B 85 9.286 -3.798 -2.450 1.00 0.00 H new ATOM 0 HB2 TRP B 85 9.453 -2.958 -5.325 1.00 0.00 H new ATOM 0 HB3 TRP B 85 8.734 -1.852 -4.170 1.00 0.00 H new ATOM 0 HD1 TRP B 85 12.080 -2.966 -5.451 1.00 0.00 H new ATOM 0 HE1 TRP B 85 13.976 -1.784 -4.139 1.00 0.00 H new ATOM 0 HE3 TRP B 85 9.298 -1.113 -1.590 1.00 0.00 H new ATOM 0 HZ2 TRP B 85 14.208 -0.311 -1.762 1.00 0.00 H new ATOM 0 HZ3 TRP B 85 10.436 0.164 0.179 1.00 0.00 H new ATOM 0 HH2 TRP B 85 12.858 0.561 0.086 1.00 0.00 H new ATOM 2456 N LYS B 86 6.773 -4.306 -4.500 1.00 0.00 N ATOM 2457 CA LYS B 86 5.318 -4.372 -4.694 1.00 0.00 C ATOM 2458 C LYS B 86 4.663 -4.965 -3.480 1.00 0.00 C ATOM 2459 O LYS B 86 3.764 -4.381 -2.897 1.00 0.00 O ATOM 2460 CB LYS B 86 5.064 -5.306 -5.842 1.00 0.00 C ATOM 2461 CG LYS B 86 3.661 -5.360 -6.397 1.00 0.00 C ATOM 2462 CD LYS B 86 3.246 -4.060 -7.046 1.00 0.00 C ATOM 2463 CE LYS B 86 2.136 -4.317 -8.040 1.00 0.00 C ATOM 2464 NZ LYS B 86 2.635 -5.098 -9.205 1.00 0.00 N ATOM 0 H LYS B 86 7.292 -4.688 -5.291 1.00 0.00 H new ATOM 0 HA LYS B 86 4.922 -3.373 -4.875 1.00 0.00 H new ATOM 0 HB2 LYS B 86 5.737 -5.032 -6.654 1.00 0.00 H new ATOM 0 HB3 LYS B 86 5.340 -6.312 -5.525 1.00 0.00 H new ATOM 0 HG2 LYS B 86 3.594 -6.165 -7.128 1.00 0.00 H new ATOM 0 HG3 LYS B 86 2.965 -5.600 -5.593 1.00 0.00 H new ATOM 0 HD2 LYS B 86 2.910 -3.354 -6.286 1.00 0.00 H new ATOM 0 HD3 LYS B 86 4.099 -3.605 -7.549 1.00 0.00 H new ATOM 0 HE2 LYS B 86 1.326 -4.860 -7.554 1.00 0.00 H new ATOM 0 HE3 LYS B 86 1.723 -3.368 -8.383 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 1.969 -5.867 -9.418 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 2.718 -4.473 -10.032 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 3.567 -5.500 -8.980 1.00 0.00 H new ATOM 2478 N HIS B 87 5.124 -6.141 -3.126 1.00 0.00 N ATOM 2479 CA HIS B 87 4.619 -6.847 -1.959 1.00 0.00 C ATOM 2480 C HIS B 87 4.904 -6.081 -0.688 1.00 0.00 C ATOM 2481 O HIS B 87 4.016 -5.895 0.114 1.00 0.00 O ATOM 2482 CB HIS B 87 5.170 -8.274 -1.845 1.00 0.00 C ATOM 2483 CG HIS B 87 4.628 -9.241 -2.850 1.00 0.00 C ATOM 2484 ND1 HIS B 87 5.422 -9.958 -3.705 1.00 0.00 N ATOM 2485 CD2 HIS B 87 3.360 -9.642 -3.100 1.00 0.00 C ATOM 2486 CE1 HIS B 87 4.680 -10.748 -4.435 1.00 0.00 C ATOM 2487 NE2 HIS B 87 3.423 -10.580 -4.090 1.00 0.00 N ATOM 0 H HIS B 87 5.856 -6.639 -3.632 1.00 0.00 H new ATOM 0 HA HIS B 87 3.540 -6.922 -2.095 1.00 0.00 H new ATOM 0 HB2 HIS B 87 6.255 -8.238 -1.945 1.00 0.00 H new ATOM 0 HB3 HIS B 87 4.955 -8.652 -0.846 1.00 0.00 H new ATOM 0 HD2 HIS B 87 2.466 -9.287 -2.609 1.00 0.00 H new ATOM 0 HE1 HIS B 87 5.040 -11.426 -5.195 1.00 0.00 H new ATOM 0 HE2 HIS B 87 2.625 -11.070 -4.495 1.00 0.00 H new ATOM 2496 N ALA B 88 6.130 -5.602 -0.546 1.00 0.00 N ATOM 2497 CA ALA B 88 6.568 -4.881 0.654 1.00 0.00 C ATOM 2498 C ALA B 88 5.728 -3.624 0.920 1.00 0.00 C ATOM 2499 O ALA B 88 5.170 -3.454 2.010 1.00 0.00 O ATOM 2500 CB ALA B 88 8.041 -4.516 0.529 1.00 0.00 C ATOM 0 H ALA B 88 6.855 -5.699 -1.257 1.00 0.00 H new ATOM 0 HA ALA B 88 6.426 -5.546 1.506 1.00 0.00 H new ATOM 0 HB1 ALA B 88 8.360 -3.981 1.423 1.00 0.00 H new ATOM 0 HB2 ALA B 88 8.633 -5.425 0.419 1.00 0.00 H new ATOM 0 HB3 ALA B 88 8.186 -3.881 -0.345 1.00 0.00 H new ATOM 2506 N ILE B 89 5.605 -2.773 -0.088 1.00 0.00 N ATOM 2507 CA ILE B 89 4.879 -1.509 0.042 1.00 0.00 C ATOM 2508 C ILE B 89 3.386 -1.746 0.205 1.00 0.00 C ATOM 2509 O ILE B 89 2.683 -0.962 0.843 1.00 0.00 O ATOM 2510 CB ILE B 89 5.128 -0.556 -1.169 1.00 0.00 C ATOM 2511 CG1 ILE B 89 4.631 -1.193 -2.491 1.00 0.00 C ATOM 2512 CG2 ILE B 89 6.606 -0.205 -1.254 1.00 0.00 C ATOM 2513 CD1 ILE B 89 4.832 -0.344 -3.726 1.00 0.00 C ATOM 0 H ILE B 89 6.001 -2.933 -1.014 1.00 0.00 H new ATOM 0 HA ILE B 89 5.265 -1.025 0.939 1.00 0.00 H new ATOM 0 HB ILE B 89 4.559 0.361 -1.014 1.00 0.00 H new ATOM 0 HG12 ILE B 89 5.145 -2.143 -2.634 1.00 0.00 H new ATOM 0 HG13 ILE B 89 3.569 -1.417 -2.392 1.00 0.00 H new ATOM 0 HG21 ILE B 89 6.774 0.460 -2.101 1.00 0.00 H new ATOM 0 HG22 ILE B 89 6.915 0.293 -0.335 1.00 0.00 H new ATOM 0 HG23 ILE B 89 7.189 -1.116 -1.387 1.00 0.00 H new ATOM 0 HD11 ILE B 89 4.453 -0.876 -4.599 1.00 0.00 H new ATOM 0 HD12 ILE B 89 4.294 0.597 -3.612 1.00 0.00 H new ATOM 0 HD13 ILE B 89 5.895 -0.140 -3.859 1.00 0.00 H new ATOM 2525 N GLN B 90 2.913 -2.833 -0.361 1.00 0.00 N ATOM 2526 CA GLN B 90 1.522 -3.163 -0.299 1.00 0.00 C ATOM 2527 C GLN B 90 1.197 -3.753 1.063 1.00 0.00 C ATOM 2528 O GLN B 90 0.199 -3.377 1.660 1.00 0.00 O ATOM 2529 CB GLN B 90 1.162 -4.129 -1.406 1.00 0.00 C ATOM 2530 CG GLN B 90 -0.320 -4.356 -1.583 1.00 0.00 C ATOM 2531 CD GLN B 90 -0.634 -5.414 -2.623 1.00 0.00 C ATOM 2532 OE1 GLN B 90 -1.660 -6.094 -2.528 1.00 0.00 O ATOM 2533 NE2 GLN B 90 0.232 -5.588 -3.584 1.00 0.00 N ATOM 0 H GLN B 90 3.485 -3.505 -0.873 1.00 0.00 H new ATOM 0 HA GLN B 90 0.931 -2.258 -0.437 1.00 0.00 H new ATOM 0 HB2 GLN B 90 1.574 -3.757 -2.344 1.00 0.00 H new ATOM 0 HB3 GLN B 90 1.642 -5.087 -1.205 1.00 0.00 H new ATOM 0 HG2 GLN B 90 -0.754 -4.652 -0.628 1.00 0.00 H new ATOM 0 HG3 GLN B 90 -0.794 -3.418 -1.871 1.00 0.00 H new ATOM 0 HE21 GLN B 90 1.068 -5.006 -3.629 1.00 0.00 H new ATOM 0 HE22 GLN B 90 0.072 -6.306 -4.290 1.00 0.00 H new ATOM 2542 N LYS B 91 2.092 -4.646 1.552 1.00 0.00 N ATOM 2543 CA LYS B 91 1.982 -5.335 2.870 1.00 0.00 C ATOM 2544 C LYS B 91 1.843 -4.299 3.964 1.00 0.00 C ATOM 2545 O LYS B 91 1.099 -4.473 4.935 1.00 0.00 O ATOM 2546 CB LYS B 91 3.272 -6.152 3.142 1.00 0.00 C ATOM 2547 CG LYS B 91 3.242 -7.076 4.381 1.00 0.00 C ATOM 2548 CD LYS B 91 2.594 -8.443 4.102 1.00 0.00 C ATOM 2549 CE LYS B 91 3.445 -9.267 3.128 1.00 0.00 C ATOM 2550 NZ LYS B 91 2.898 -10.624 2.839 1.00 0.00 N ATOM 0 H LYS B 91 2.928 -4.916 1.034 1.00 0.00 H new ATOM 0 HA LYS B 91 1.115 -5.996 2.854 1.00 0.00 H new ATOM 0 HB2 LYS B 91 3.483 -6.762 2.264 1.00 0.00 H new ATOM 0 HB3 LYS B 91 4.103 -5.455 3.254 1.00 0.00 H new ATOM 0 HG2 LYS B 91 4.261 -7.230 4.736 1.00 0.00 H new ATOM 0 HG3 LYS B 91 2.696 -6.579 5.183 1.00 0.00 H new ATOM 0 HD2 LYS B 91 2.473 -8.990 5.037 1.00 0.00 H new ATOM 0 HD3 LYS B 91 1.597 -8.299 3.686 1.00 0.00 H new ATOM 0 HE2 LYS B 91 3.540 -8.718 2.191 1.00 0.00 H new ATOM 0 HE3 LYS B 91 4.449 -9.372 3.539 1.00 0.00 H new ATOM 0 HZ1 LYS B 91 3.666 -11.247 2.517 1.00 0.00 H new ATOM 0 HZ2 LYS B 91 2.472 -11.018 3.702 1.00 0.00 H new ATOM 0 HZ3 LYS B 91 2.173 -10.555 2.096 1.00 0.00 H new ATOM 2564 N ALA B 92 2.567 -3.219 3.773 1.00 0.00 N ATOM 2565 CA ALA B 92 2.592 -2.108 4.680 1.00 0.00 C ATOM 2566 C ALA B 92 1.232 -1.442 4.783 1.00 0.00 C ATOM 2567 O ALA B 92 0.871 -0.901 5.828 1.00 0.00 O ATOM 2568 CB ALA B 92 3.608 -1.112 4.202 1.00 0.00 C ATOM 0 H ALA B 92 3.168 -3.092 2.959 1.00 0.00 H new ATOM 0 HA ALA B 92 2.858 -2.476 5.671 1.00 0.00 H new ATOM 0 HB1 ALA B 92 3.635 -0.263 4.885 1.00 0.00 H new ATOM 0 HB2 ALA B 92 4.591 -1.582 4.169 1.00 0.00 H new ATOM 0 HB3 ALA B 92 3.337 -0.766 3.204 1.00 0.00 H new ATOM 2574 N LYS B 93 0.484 -1.471 3.708 1.00 0.00 N ATOM 2575 CA LYS B 93 -0.819 -0.875 3.712 1.00 0.00 C ATOM 2576 C LYS B 93 -1.822 -1.896 4.226 1.00 0.00 C ATOM 2577 O LYS B 93 -2.519 -1.653 5.212 1.00 0.00 O ATOM 2578 CB LYS B 93 -1.218 -0.413 2.294 1.00 0.00 C ATOM 2579 CG LYS B 93 -0.252 0.577 1.639 1.00 0.00 C ATOM 2580 CD LYS B 93 -0.760 1.004 0.266 1.00 0.00 C ATOM 2581 CE LYS B 93 0.196 1.969 -0.437 1.00 0.00 C ATOM 2582 NZ LYS B 93 -0.361 2.425 -1.736 1.00 0.00 N ATOM 0 H LYS B 93 0.758 -1.900 2.824 1.00 0.00 H new ATOM 0 HA LYS B 93 -0.809 0.001 4.360 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -1.304 -1.291 1.653 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -2.206 0.045 2.342 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -0.135 1.453 2.277 1.00 0.00 H new ATOM 0 HG3 LYS B 93 0.733 0.120 1.541 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -0.902 0.120 -0.356 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -1.736 1.478 0.374 1.00 0.00 H new ATOM 0 HE2 LYS B 93 0.384 2.831 0.204 1.00 0.00 H new ATOM 0 HE3 LYS B 93 1.156 1.479 -0.602 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 0.393 2.864 -2.302 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -0.751 1.610 -2.251 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -1.115 3.120 -1.565 1.00 0.00 H new