USER MOD reduce.3.24.130724 H: found=0, std=0, add=844, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 856 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 75 ASN : amide:sc= -2.13 X(o=-1.2,f=-1.1!) USER MOD Set 1.2: A 121 SER OG : rot 2:sc= 0.924 USER MOD Set 2.1: A 52 ASN : amide:sc= -0.195 X(o=1.9,f=2.2) USER MOD Set 2.2: A 63 CYS SG : rot 180:sc= 0.823 USER MOD Set 2.3: A 90 CYS SG : rot -120:sc= 1.27 USER MOD Set 3.1: A 43 TYR OH : rot 15:sc= 1.12 USER MOD Set 3.2: A 46 THR OG1 : rot -170:sc= 1.06 USER MOD Set 4.1: A 32 THR OG1 : rot 180:sc= 0.932 USER MOD Set 4.2: A 50 THR OG1 : rot -65:sc= 1.03 USER MOD Single : A 26 GLN : amide:sc= 0.757 K(o=0.76,f=0) USER MOD Single : A 33 TYR OH : rot 166:sc= -0.028 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= 0.989 K(o=0.99,f=-7.6!) USER MOD Single : A 41 ASN : amide:sc=-0.00935 X(o=-0.0094,f=0) USER MOD Single : A 44 MET CE :methyl -153:sc= -0.123 (180deg=-1.31) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 1:sc= 1.18 USER MOD Single : A 58 GLN : amide:sc= -2.15! K(o=-2.2!,f=-0.31) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.0771 USER MOD Single : A 68 GLN : amide:sc= -0.0331 X(o=-0.033,f=-0.25) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 156:sc=-0.00873 (180deg=-0.604) USER MOD Single : A 76 THR OG1 : rot 100:sc= -0.383 USER MOD Single : A 78 SER OG : rot -111:sc= 0.385 USER MOD Single : A 82 MET CE :methyl -148:sc= -3.31 (180deg=-7.05!) USER MOD Single : A 83 ASN : amide:sc= -2.24! K(o=-2.2!,f=0.15) USER MOD Single : A 94 THR OG1 : rot 43:sc= 1.25 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 MET CE :methyl 159:sc= -0.554 (180deg=-1.2) USER MOD Single : A 98 GLN : amide:sc= 0.536 K(o=0.54,f=0) USER MOD Single : A 101 THR OG1 : rot 180:sc= -0.0656 USER MOD Single : A 103 HIS : no HE2:sc= 0.968 K(o=0.97,f=-3.1!) USER MOD Single : A 108 GLN : amide:sc= -0.0598 X(o=-0.06,f=0) USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 ASN : amide:sc= -0.0674 X(o=-0.067,f=-0.19) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= 0.836 K(o=0.84,f=0) USER MOD Single : A 120 MET CE :methyl 175:sc= 0 (180deg=-0.0208) USER MOD Single : A 122 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 ASN : amide:sc= -0.0333 X(o=-0.033,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 25 -5.212 -17.976 2.975 1.00 0.00 N ATOM 2 CA GLY A 25 -4.941 -19.273 3.603 1.00 0.00 C ATOM 3 C GLY A 25 -4.168 -19.095 4.893 1.00 0.00 C ATOM 4 O GLY A 25 -2.946 -19.210 4.869 1.00 0.00 O ATOM 0 HA2 GLY A 25 -5.880 -19.788 3.805 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -4.373 -19.902 2.918 1.00 0.00 H new ATOM 8 N GLN A 26 -4.872 -18.859 6.006 1.00 0.00 N ATOM 9 CA GLN A 26 -4.367 -18.474 7.328 1.00 0.00 C ATOM 10 C GLN A 26 -3.422 -17.263 7.288 1.00 0.00 C ATOM 11 O GLN A 26 -3.294 -16.597 6.266 1.00 0.00 O ATOM 12 CB GLN A 26 -3.849 -19.675 8.125 1.00 0.00 C ATOM 13 CG GLN A 26 -2.563 -20.300 7.585 1.00 0.00 C ATOM 14 CD GLN A 26 -1.802 -20.979 8.699 1.00 0.00 C ATOM 15 OE1 GLN A 26 -1.764 -22.204 8.805 1.00 0.00 O ATOM 16 NE2 GLN A 26 -1.193 -20.181 9.551 1.00 0.00 N ATOM 0 H GLN A 26 -5.889 -18.939 6.005 1.00 0.00 H new ATOM 0 HA GLN A 26 -5.221 -18.111 7.899 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -3.679 -19.363 9.155 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -4.626 -20.440 8.148 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -2.802 -21.023 6.805 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -1.941 -19.531 7.127 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -1.247 -19.170 9.430 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -0.667 -20.574 10.332 1.00 0.00 H new ATOM 25 N GLU A 27 -2.823 -16.938 8.430 1.00 0.00 N ATOM 26 CA GLU A 27 -1.905 -15.844 8.666 1.00 0.00 C ATOM 27 C GLU A 27 -0.497 -16.441 8.674 1.00 0.00 C ATOM 28 O GLU A 27 -0.301 -17.512 9.254 1.00 0.00 O ATOM 29 CB GLU A 27 -2.297 -15.205 10.019 1.00 0.00 C ATOM 30 CG GLU A 27 -1.388 -14.050 10.466 1.00 0.00 C ATOM 31 CD GLU A 27 -0.972 -14.183 11.919 1.00 0.00 C ATOM 32 OE1 GLU A 27 -1.791 -13.944 12.834 1.00 0.00 O ATOM 33 OE2 GLU A 27 0.195 -14.556 12.175 1.00 0.00 O ATOM 0 H GLU A 27 -2.985 -17.481 9.278 1.00 0.00 H new ATOM 0 HA GLU A 27 -1.940 -15.065 7.904 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -3.321 -14.839 9.950 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -2.286 -15.978 10.788 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -0.499 -14.023 9.836 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -1.909 -13.103 10.323 1.00 0.00 H new ATOM 41 N LEU A 28 0.459 -15.802 7.985 1.00 0.00 N ATOM 42 CA LEU A 28 1.825 -16.315 7.834 1.00 0.00 C ATOM 43 C LEU A 28 2.924 -15.234 7.593 1.00 0.00 C ATOM 44 O LEU A 28 3.636 -15.279 6.590 1.00 0.00 O ATOM 45 CB LEU A 28 1.836 -17.508 6.839 1.00 0.00 C ATOM 46 CG LEU A 28 1.159 -17.414 5.450 1.00 0.00 C ATOM 47 CD1 LEU A 28 -0.365 -17.369 5.425 1.00 0.00 C ATOM 48 CD2 LEU A 28 1.610 -16.183 4.699 1.00 0.00 C ATOM 0 H LEU A 28 0.304 -14.910 7.515 1.00 0.00 H new ATOM 0 HA LEU A 28 2.134 -16.701 8.806 1.00 0.00 H new ATOM 0 HB2 LEU A 28 2.881 -17.764 6.664 1.00 0.00 H new ATOM 0 HB3 LEU A 28 1.382 -18.354 7.355 1.00 0.00 H new ATOM 0 HG LEU A 28 1.474 -18.351 4.991 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -0.710 -17.304 4.393 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -0.763 -18.274 5.884 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -0.712 -16.497 5.980 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.116 -16.148 3.728 1.00 0.00 H new ATOM 0 HD22 LEU A 28 1.350 -15.292 5.271 1.00 0.00 H new ATOM 0 HD23 LEU A 28 2.690 -16.220 4.555 1.00 0.00 H new ATOM 60 N PRO A 29 3.100 -14.227 8.471 1.00 0.00 N ATOM 61 CA PRO A 29 4.004 -13.106 8.226 1.00 0.00 C ATOM 62 C PRO A 29 5.495 -13.499 8.263 1.00 0.00 C ATOM 63 O PRO A 29 5.871 -14.369 9.056 1.00 0.00 O ATOM 64 CB PRO A 29 3.702 -12.060 9.298 1.00 0.00 C ATOM 65 CG PRO A 29 2.719 -12.699 10.293 1.00 0.00 C ATOM 66 CD PRO A 29 2.332 -14.030 9.676 1.00 0.00 C ATOM 0 HA PRO A 29 3.835 -12.725 7.219 1.00 0.00 H new ATOM 0 HB2 PRO A 29 4.617 -11.753 9.805 1.00 0.00 H new ATOM 0 HB3 PRO A 29 3.270 -11.165 8.851 1.00 0.00 H new ATOM 0 HG2 PRO A 29 3.183 -12.838 11.269 1.00 0.00 H new ATOM 0 HG3 PRO A 29 1.844 -12.066 10.443 1.00 0.00 H new ATOM 0 HD2 PRO A 29 2.520 -14.841 10.380 1.00 0.00 H new ATOM 0 HD3 PRO A 29 1.266 -14.045 9.450 1.00 0.00 H new ATOM 74 N PRO A 30 6.357 -12.869 7.441 1.00 0.00 N ATOM 75 CA PRO A 30 7.810 -12.980 7.481 1.00 0.00 C ATOM 76 C PRO A 30 8.509 -11.717 8.018 1.00 0.00 C ATOM 77 O PRO A 30 9.684 -11.796 8.367 1.00 0.00 O ATOM 78 CB PRO A 30 8.187 -13.163 6.010 1.00 0.00 C ATOM 79 CG PRO A 30 7.238 -12.191 5.312 1.00 0.00 C ATOM 80 CD PRO A 30 5.975 -12.268 6.179 1.00 0.00 C ATOM 0 HA PRO A 30 8.118 -13.787 8.146 1.00 0.00 H new ATOM 0 HB2 PRO A 30 9.232 -12.916 5.824 1.00 0.00 H new ATOM 0 HB3 PRO A 30 8.037 -14.190 5.676 1.00 0.00 H new ATOM 0 HG2 PRO A 30 7.646 -11.181 5.280 1.00 0.00 H new ATOM 0 HG3 PRO A 30 7.040 -12.488 4.282 1.00 0.00 H new ATOM 0 HD2 PRO A 30 5.556 -11.274 6.337 1.00 0.00 H new ATOM 0 HD3 PRO A 30 5.206 -12.863 5.687 1.00 0.00 H new ATOM 88 N GLY A 31 7.840 -10.560 8.057 1.00 0.00 N ATOM 89 CA GLY A 31 8.436 -9.259 8.301 1.00 0.00 C ATOM 90 C GLY A 31 8.202 -8.362 7.089 1.00 0.00 C ATOM 91 O GLY A 31 7.398 -7.428 7.144 1.00 0.00 O ATOM 0 H GLY A 31 6.831 -10.511 7.913 1.00 0.00 H new ATOM 0 HA2 GLY A 31 7.999 -8.807 9.192 1.00 0.00 H new ATOM 0 HA3 GLY A 31 9.504 -9.365 8.489 1.00 0.00 H new ATOM 95 N THR A 32 8.906 -8.644 5.998 1.00 0.00 N ATOM 96 CA THR A 32 8.968 -7.855 4.778 1.00 0.00 C ATOM 97 C THR A 32 9.104 -8.839 3.614 1.00 0.00 C ATOM 98 O THR A 32 9.656 -9.934 3.767 1.00 0.00 O ATOM 99 CB THR A 32 10.150 -6.865 4.877 1.00 0.00 C ATOM 100 OG1 THR A 32 9.928 -5.937 5.925 1.00 0.00 O ATOM 101 CG2 THR A 32 10.403 -6.030 3.617 1.00 0.00 C ATOM 0 H THR A 32 9.484 -9.483 5.941 1.00 0.00 H new ATOM 0 HA THR A 32 8.073 -7.254 4.621 1.00 0.00 H new ATOM 0 HB THR A 32 11.016 -7.505 5.045 1.00 0.00 H new ATOM 0 HG1 THR A 32 10.685 -5.316 5.978 1.00 0.00 H new ATOM 0 HG21 THR A 32 11.251 -5.366 3.785 1.00 0.00 H new ATOM 0 HG22 THR A 32 10.620 -6.692 2.779 1.00 0.00 H new ATOM 0 HG23 THR A 32 9.517 -5.436 3.390 1.00 0.00 H new ATOM 109 N TYR A 33 8.556 -8.485 2.451 1.00 0.00 N ATOM 110 CA TYR A 33 8.556 -9.323 1.265 1.00 0.00 C ATOM 111 C TYR A 33 8.682 -8.407 0.035 1.00 0.00 C ATOM 112 O TYR A 33 8.002 -7.384 -0.055 1.00 0.00 O ATOM 113 CB TYR A 33 7.312 -10.234 1.287 1.00 0.00 C ATOM 114 CG TYR A 33 6.025 -9.669 0.722 1.00 0.00 C ATOM 115 CD1 TYR A 33 5.368 -8.568 1.305 1.00 0.00 C ATOM 116 CD2 TYR A 33 5.472 -10.282 -0.410 1.00 0.00 C ATOM 117 CE1 TYR A 33 4.159 -8.084 0.771 1.00 0.00 C ATOM 118 CE2 TYR A 33 4.303 -9.771 -0.980 1.00 0.00 C ATOM 119 CZ TYR A 33 3.624 -8.698 -0.377 1.00 0.00 C ATOM 120 OH TYR A 33 2.444 -8.286 -0.902 1.00 0.00 O ATOM 0 H TYR A 33 8.092 -7.588 2.311 1.00 0.00 H new ATOM 0 HA TYR A 33 9.406 -10.005 1.228 1.00 0.00 H new ATOM 0 HB2 TYR A 33 7.551 -11.144 0.736 1.00 0.00 H new ATOM 0 HB3 TYR A 33 7.127 -10.526 2.321 1.00 0.00 H new ATOM 0 HD1 TYR A 33 5.797 -8.089 2.173 1.00 0.00 H new ATOM 0 HD2 TYR A 33 5.949 -11.149 -0.842 1.00 0.00 H new ATOM 0 HE1 TYR A 33 3.649 -7.253 1.236 1.00 0.00 H new ATOM 0 HE2 TYR A 33 3.918 -10.204 -1.891 1.00 0.00 H new ATOM 0 HH TYR A 33 2.337 -8.661 -1.801 1.00 0.00 H new ATOM 130 N ARG A 34 9.619 -8.687 -0.874 1.00 0.00 N ATOM 131 CA ARG A 34 9.791 -7.956 -2.135 1.00 0.00 C ATOM 132 C ARG A 34 8.848 -8.567 -3.142 1.00 0.00 C ATOM 133 O ARG A 34 8.873 -9.792 -3.293 1.00 0.00 O ATOM 134 CB ARG A 34 11.229 -8.135 -2.631 1.00 0.00 C ATOM 135 CG ARG A 34 11.589 -7.491 -3.990 1.00 0.00 C ATOM 136 CD ARG A 34 12.210 -6.092 -3.985 1.00 0.00 C ATOM 137 NE ARG A 34 13.295 -5.949 -2.999 1.00 0.00 N ATOM 138 CZ ARG A 34 14.367 -6.722 -2.819 1.00 0.00 C ATOM 139 NH1 ARG A 34 14.802 -7.548 -3.758 1.00 0.00 N ATOM 140 NH2 ARG A 34 15.006 -6.666 -1.664 1.00 0.00 N ATOM 0 H ARG A 34 10.293 -9.443 -0.753 1.00 0.00 H new ATOM 0 HA ARG A 34 9.586 -6.894 -1.998 1.00 0.00 H new ATOM 0 HB2 ARG A 34 11.901 -7.729 -1.875 1.00 0.00 H new ATOM 0 HB3 ARG A 34 11.434 -9.204 -2.698 1.00 0.00 H new ATOM 0 HG2 ARG A 34 12.280 -8.160 -4.503 1.00 0.00 H new ATOM 0 HG3 ARG A 34 10.680 -7.450 -4.590 1.00 0.00 H new ATOM 0 HD2 ARG A 34 12.598 -5.869 -4.979 1.00 0.00 H new ATOM 0 HD3 ARG A 34 11.434 -5.356 -3.773 1.00 0.00 H new ATOM 0 HE ARG A 34 13.216 -5.151 -2.369 1.00 0.00 H new ATOM 0 HH11 ARG A 34 14.314 -7.607 -4.652 1.00 0.00 H new ATOM 0 HH12 ARG A 34 15.625 -8.125 -3.588 1.00 0.00 H new ATOM 0 HH21 ARG A 34 14.677 -6.039 -0.929 1.00 0.00 H new ATOM 0 HH22 ARG A 34 15.828 -7.249 -1.507 1.00 0.00 H new ATOM 154 N VAL A 35 8.063 -7.752 -3.842 1.00 0.00 N ATOM 155 CA VAL A 35 7.222 -8.221 -4.935 1.00 0.00 C ATOM 156 C VAL A 35 6.970 -7.097 -5.939 1.00 0.00 C ATOM 157 O VAL A 35 7.381 -5.958 -5.699 1.00 0.00 O ATOM 158 CB VAL A 35 5.871 -8.749 -4.410 1.00 0.00 C ATOM 159 CG1 VAL A 35 6.018 -10.086 -3.697 1.00 0.00 C ATOM 160 CG2 VAL A 35 5.147 -7.754 -3.494 1.00 0.00 C ATOM 0 H VAL A 35 7.993 -6.750 -3.666 1.00 0.00 H new ATOM 0 HA VAL A 35 7.750 -9.036 -5.429 1.00 0.00 H new ATOM 0 HB VAL A 35 5.257 -8.887 -5.300 1.00 0.00 H new ATOM 0 HG11 VAL A 35 5.042 -10.419 -3.344 1.00 0.00 H new ATOM 0 HG12 VAL A 35 6.426 -10.824 -4.388 1.00 0.00 H new ATOM 0 HG13 VAL A 35 6.692 -9.973 -2.848 1.00 0.00 H new ATOM 0 HG21 VAL A 35 4.204 -8.187 -3.160 1.00 0.00 H new ATOM 0 HG22 VAL A 35 5.773 -7.534 -2.629 1.00 0.00 H new ATOM 0 HG23 VAL A 35 4.949 -6.833 -4.042 1.00 0.00 H new ATOM 170 N ASP A 36 6.237 -7.396 -7.018 1.00 0.00 N ATOM 171 CA ASP A 36 5.670 -6.392 -7.905 1.00 0.00 C ATOM 172 C ASP A 36 4.378 -5.948 -7.222 1.00 0.00 C ATOM 173 O ASP A 36 3.437 -6.730 -7.048 1.00 0.00 O ATOM 174 CB ASP A 36 5.425 -6.945 -9.323 1.00 0.00 C ATOM 175 CG ASP A 36 6.656 -6.816 -10.232 1.00 0.00 C ATOM 176 OD1 ASP A 36 7.767 -7.239 -9.845 1.00 0.00 O ATOM 177 OD2 ASP A 36 6.550 -6.298 -11.365 1.00 0.00 O ATOM 0 H ASP A 36 6.023 -8.354 -7.296 1.00 0.00 H new ATOM 0 HA ASP A 36 6.350 -5.554 -8.057 1.00 0.00 H new ATOM 0 HB2 ASP A 36 5.138 -7.994 -9.254 1.00 0.00 H new ATOM 0 HB3 ASP A 36 4.587 -6.414 -9.776 1.00 0.00 H new ATOM 183 N ILE A 37 4.357 -4.709 -6.747 1.00 0.00 N ATOM 184 CA ILE A 37 3.159 -4.040 -6.282 1.00 0.00 C ATOM 185 C ILE A 37 2.257 -3.810 -7.495 1.00 0.00 C ATOM 186 O ILE A 37 2.718 -3.431 -8.577 1.00 0.00 O ATOM 187 CB ILE A 37 3.511 -2.728 -5.535 1.00 0.00 C ATOM 188 CG1 ILE A 37 4.372 -2.984 -4.270 1.00 0.00 C ATOM 189 CG2 ILE A 37 2.240 -1.966 -5.111 1.00 0.00 C ATOM 190 CD1 ILE A 37 5.871 -2.727 -4.465 1.00 0.00 C ATOM 0 H ILE A 37 5.195 -4.132 -6.675 1.00 0.00 H new ATOM 0 HA ILE A 37 2.626 -4.654 -5.556 1.00 0.00 H new ATOM 0 HB ILE A 37 4.087 -2.129 -6.240 1.00 0.00 H new ATOM 0 HG12 ILE A 37 4.008 -2.349 -3.462 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.231 -4.017 -3.951 1.00 0.00 H new ATOM 0 HG21 ILE A 37 2.521 -1.051 -4.590 1.00 0.00 H new ATOM 0 HG22 ILE A 37 1.654 -1.715 -5.995 1.00 0.00 H new ATOM 0 HG23 ILE A 37 1.644 -2.593 -4.448 1.00 0.00 H new ATOM 0 HD11 ILE A 37 6.399 -2.930 -3.533 1.00 0.00 H new ATOM 0 HD12 ILE A 37 6.253 -3.381 -5.249 1.00 0.00 H new ATOM 0 HD13 ILE A 37 6.028 -1.687 -4.752 1.00 0.00 H new ATOM 202 N TYR A 38 0.960 -4.005 -7.285 1.00 0.00 N ATOM 203 CA TYR A 38 -0.086 -3.885 -8.291 1.00 0.00 C ATOM 204 C TYR A 38 -1.247 -3.091 -7.702 1.00 0.00 C ATOM 205 O TYR A 38 -1.505 -3.182 -6.503 1.00 0.00 O ATOM 206 CB TYR A 38 -0.551 -5.292 -8.703 1.00 0.00 C ATOM 207 CG TYR A 38 -0.170 -5.667 -10.118 1.00 0.00 C ATOM 208 CD1 TYR A 38 1.120 -6.150 -10.415 1.00 0.00 C ATOM 209 CD2 TYR A 38 -1.117 -5.513 -11.144 1.00 0.00 C ATOM 210 CE1 TYR A 38 1.445 -6.524 -11.732 1.00 0.00 C ATOM 211 CE2 TYR A 38 -0.783 -5.842 -12.464 1.00 0.00 C ATOM 212 CZ TYR A 38 0.484 -6.381 -12.760 1.00 0.00 C ATOM 213 OH TYR A 38 0.739 -6.782 -14.033 1.00 0.00 O ATOM 0 H TYR A 38 0.594 -4.262 -6.368 1.00 0.00 H new ATOM 0 HA TYR A 38 0.290 -3.366 -9.173 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -0.124 -6.022 -8.015 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -1.634 -5.352 -8.600 1.00 0.00 H new ATOM 0 HD1 TYR A 38 1.859 -6.233 -9.632 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -2.104 -5.140 -10.915 1.00 0.00 H new ATOM 0 HE1 TYR A 38 2.425 -6.919 -11.957 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -1.499 -5.682 -13.257 1.00 0.00 H new ATOM 0 HH TYR A 38 -0.043 -6.602 -14.595 1.00 0.00 H new ATOM 223 N LEU A 39 -1.977 -2.342 -8.525 1.00 0.00 N ATOM 224 CA LEU A 39 -3.179 -1.627 -8.120 1.00 0.00 C ATOM 225 C LEU A 39 -4.112 -1.485 -9.309 1.00 0.00 C ATOM 226 O LEU A 39 -3.643 -1.169 -10.400 1.00 0.00 O ATOM 227 CB LEU A 39 -2.799 -0.251 -7.570 1.00 0.00 C ATOM 228 CG LEU A 39 -4.033 0.572 -7.142 1.00 0.00 C ATOM 229 CD1 LEU A 39 -3.885 1.144 -5.731 1.00 0.00 C ATOM 230 CD2 LEU A 39 -4.330 1.703 -8.131 1.00 0.00 C ATOM 0 H LEU A 39 -1.743 -2.214 -9.510 1.00 0.00 H new ATOM 0 HA LEU A 39 -3.691 -2.187 -7.337 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -2.134 -0.375 -6.715 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -2.243 0.300 -8.329 1.00 0.00 H new ATOM 0 HG LEU A 39 -4.874 -0.122 -7.141 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -4.777 1.715 -5.474 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -3.759 0.328 -5.019 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -3.013 1.797 -5.693 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -5.205 2.259 -7.795 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -3.472 2.374 -8.185 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -4.524 1.282 -9.118 1.00 0.00 H new ATOM 242 N ASN A 40 -5.418 -1.664 -9.095 1.00 0.00 N ATOM 243 CA ASN A 40 -6.484 -1.587 -10.103 1.00 0.00 C ATOM 244 C ASN A 40 -6.047 -2.292 -11.388 1.00 0.00 C ATOM 245 O ASN A 40 -5.963 -1.696 -12.467 1.00 0.00 O ATOM 246 CB ASN A 40 -6.962 -0.137 -10.319 1.00 0.00 C ATOM 247 CG ASN A 40 -7.712 0.432 -9.122 1.00 0.00 C ATOM 248 OD1 ASN A 40 -7.920 -0.249 -8.124 1.00 0.00 O ATOM 249 ND2 ASN A 40 -8.134 1.679 -9.181 1.00 0.00 N ATOM 0 H ASN A 40 -5.782 -1.878 -8.166 1.00 0.00 H new ATOM 0 HA ASN A 40 -7.360 -2.121 -9.735 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -6.100 0.495 -10.533 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -7.609 -0.101 -11.195 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -8.638 2.085 -8.392 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -7.957 2.239 -10.015 1.00 0.00 H new ATOM 256 N ASN A 41 -5.690 -3.569 -11.227 1.00 0.00 N ATOM 257 CA ASN A 41 -5.223 -4.512 -12.243 1.00 0.00 C ATOM 258 C ASN A 41 -3.999 -4.029 -13.040 1.00 0.00 C ATOM 259 O ASN A 41 -3.672 -4.644 -14.057 1.00 0.00 O ATOM 260 CB ASN A 41 -6.396 -4.937 -13.150 1.00 0.00 C ATOM 261 CG ASN A 41 -7.208 -6.111 -12.627 1.00 0.00 C ATOM 262 OD1 ASN A 41 -7.472 -7.054 -13.370 1.00 0.00 O ATOM 263 ND2 ASN A 41 -7.652 -6.108 -11.380 1.00 0.00 N ATOM 0 H ASN A 41 -5.724 -4.005 -10.305 1.00 0.00 H new ATOM 0 HA ASN A 41 -4.857 -5.392 -11.713 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -7.061 -4.084 -13.285 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -6.003 -5.194 -14.134 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -8.213 -6.888 -11.036 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -7.433 -5.326 -10.763 1.00 0.00 H new ATOM 270 N GLY A 42 -3.284 -2.988 -12.603 1.00 0.00 N ATOM 271 CA GLY A 42 -2.119 -2.461 -13.301 1.00 0.00 C ATOM 272 C GLY A 42 -0.905 -2.537 -12.394 1.00 0.00 C ATOM 273 O GLY A 42 -1.025 -2.419 -11.172 1.00 0.00 O ATOM 0 H GLY A 42 -3.505 -2.485 -11.744 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.940 -3.031 -14.213 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -2.298 -1.428 -13.600 1.00 0.00 H new ATOM 277 N TYR A 43 0.265 -2.755 -12.987 1.00 0.00 N ATOM 278 CA TYR A 43 1.525 -2.738 -12.267 1.00 0.00 C ATOM 279 C TYR A 43 1.753 -1.350 -11.679 1.00 0.00 C ATOM 280 O TYR A 43 1.325 -0.349 -12.254 1.00 0.00 O ATOM 281 CB TYR A 43 2.648 -3.097 -13.243 1.00 0.00 C ATOM 282 CG TYR A 43 4.041 -2.902 -12.688 1.00 0.00 C ATOM 283 CD1 TYR A 43 4.460 -3.668 -11.588 1.00 0.00 C ATOM 284 CD2 TYR A 43 4.892 -1.913 -13.221 1.00 0.00 C ATOM 285 CE1 TYR A 43 5.732 -3.465 -11.039 1.00 0.00 C ATOM 286 CE2 TYR A 43 6.179 -1.727 -12.688 1.00 0.00 C ATOM 287 CZ TYR A 43 6.613 -2.524 -11.608 1.00 0.00 C ATOM 288 OH TYR A 43 7.876 -2.391 -11.124 1.00 0.00 O ATOM 0 H TYR A 43 0.361 -2.949 -13.984 1.00 0.00 H new ATOM 0 HA TYR A 43 1.509 -3.462 -11.452 1.00 0.00 H new ATOM 0 HB2 TYR A 43 2.532 -4.138 -13.545 1.00 0.00 H new ATOM 0 HB3 TYR A 43 2.540 -2.491 -14.142 1.00 0.00 H new ATOM 0 HD1 TYR A 43 3.802 -4.413 -11.166 1.00 0.00 H new ATOM 0 HD2 TYR A 43 4.554 -1.297 -14.041 1.00 0.00 H new ATOM 0 HE1 TYR A 43 6.040 -4.033 -10.174 1.00 0.00 H new ATOM 0 HE2 TYR A 43 6.834 -0.976 -13.104 1.00 0.00 H new ATOM 0 HH TYR A 43 8.093 -3.162 -10.560 1.00 0.00 H new ATOM 298 N MET A 44 2.481 -1.290 -10.566 1.00 0.00 N ATOM 299 CA MET A 44 2.912 -0.052 -9.945 1.00 0.00 C ATOM 300 C MET A 44 4.433 -0.040 -9.890 1.00 0.00 C ATOM 301 O MET A 44 5.080 0.564 -10.742 1.00 0.00 O ATOM 302 CB MET A 44 2.243 0.094 -8.563 1.00 0.00 C ATOM 303 CG MET A 44 0.762 0.455 -8.692 1.00 0.00 C ATOM 304 SD MET A 44 0.578 2.079 -9.457 1.00 0.00 S ATOM 305 CE MET A 44 -0.939 1.822 -10.386 1.00 0.00 C ATOM 0 H MET A 44 2.791 -2.122 -10.064 1.00 0.00 H new ATOM 0 HA MET A 44 2.602 0.816 -10.527 1.00 0.00 H new ATOM 0 HB2 MET A 44 2.344 -0.839 -8.008 1.00 0.00 H new ATOM 0 HB3 MET A 44 2.757 0.864 -7.988 1.00 0.00 H new ATOM 0 HG2 MET A 44 0.248 -0.297 -9.291 1.00 0.00 H new ATOM 0 HG3 MET A 44 0.293 0.454 -7.708 1.00 0.00 H new ATOM 0 HE1 MET A 44 -0.953 2.486 -11.250 1.00 0.00 H new ATOM 0 HE2 MET A 44 -0.988 0.787 -10.723 1.00 0.00 H new ATOM 0 HE3 MET A 44 -1.797 2.038 -9.749 1.00 0.00 H new ATOM 315 N ALA A 45 5.005 -0.706 -8.894 1.00 0.00 N ATOM 316 CA ALA A 45 6.429 -0.662 -8.573 1.00 0.00 C ATOM 317 C ALA A 45 6.913 -2.026 -8.098 1.00 0.00 C ATOM 318 O ALA A 45 6.087 -2.877 -7.786 1.00 0.00 O ATOM 319 CB ALA A 45 6.652 0.382 -7.473 1.00 0.00 C ATOM 0 H ALA A 45 4.475 -1.311 -8.267 1.00 0.00 H new ATOM 0 HA ALA A 45 6.993 -0.392 -9.466 1.00 0.00 H new ATOM 0 HB1 ALA A 45 7.712 0.426 -7.223 1.00 0.00 H new ATOM 0 HB2 ALA A 45 6.322 1.359 -7.826 1.00 0.00 H new ATOM 0 HB3 ALA A 45 6.081 0.105 -6.587 1.00 0.00 H new ATOM 325 N THR A 46 8.221 -2.219 -7.952 1.00 0.00 N ATOM 326 CA THR A 46 8.789 -3.451 -7.418 1.00 0.00 C ATOM 327 C THR A 46 9.764 -3.084 -6.311 1.00 0.00 C ATOM 328 O THR A 46 10.895 -2.694 -6.589 1.00 0.00 O ATOM 329 CB THR A 46 9.438 -4.284 -8.535 1.00 0.00 C ATOM 330 OG1 THR A 46 8.497 -4.503 -9.568 1.00 0.00 O ATOM 331 CG2 THR A 46 9.911 -5.644 -8.029 1.00 0.00 C ATOM 0 H THR A 46 8.920 -1.520 -8.203 1.00 0.00 H new ATOM 0 HA THR A 46 8.008 -4.082 -6.995 1.00 0.00 H new ATOM 0 HB THR A 46 10.300 -3.725 -8.899 1.00 0.00 H new ATOM 0 HG1 THR A 46 8.854 -5.160 -10.201 1.00 0.00 H new ATOM 0 HG21 THR A 46 10.363 -6.200 -8.850 1.00 0.00 H new ATOM 0 HG22 THR A 46 10.647 -5.502 -7.238 1.00 0.00 H new ATOM 0 HG23 THR A 46 9.061 -6.202 -7.637 1.00 0.00 H new ATOM 339 N ARG A 47 9.313 -3.139 -5.057 1.00 0.00 N ATOM 340 CA ARG A 47 10.094 -2.889 -3.859 1.00 0.00 C ATOM 341 C ARG A 47 9.703 -3.884 -2.772 1.00 0.00 C ATOM 342 O ARG A 47 8.613 -4.454 -2.806 1.00 0.00 O ATOM 343 CB ARG A 47 9.780 -1.486 -3.330 1.00 0.00 C ATOM 344 CG ARG A 47 10.108 -0.315 -4.258 1.00 0.00 C ATOM 345 CD ARG A 47 11.616 -0.078 -4.347 1.00 0.00 C ATOM 346 NE ARG A 47 12.171 -0.401 -5.667 1.00 0.00 N ATOM 347 CZ ARG A 47 13.244 0.156 -6.237 1.00 0.00 C ATOM 348 NH1 ARG A 47 13.941 1.114 -5.636 1.00 0.00 N ATOM 349 NH2 ARG A 47 13.627 -0.238 -7.444 1.00 0.00 N ATOM 0 H ARG A 47 8.343 -3.372 -4.846 1.00 0.00 H new ATOM 0 HA ARG A 47 11.151 -2.985 -4.106 1.00 0.00 H new ATOM 0 HB2 ARG A 47 8.718 -1.443 -3.089 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.325 -1.344 -2.397 1.00 0.00 H new ATOM 0 HG2 ARG A 47 9.710 -0.515 -5.253 1.00 0.00 H new ATOM 0 HG3 ARG A 47 9.617 0.588 -3.894 1.00 0.00 H new ATOM 0 HD2 ARG A 47 11.828 0.966 -4.115 1.00 0.00 H new ATOM 0 HD3 ARG A 47 12.118 -0.681 -3.590 1.00 0.00 H new ATOM 0 HE ARG A 47 11.689 -1.123 -6.203 1.00 0.00 H new ATOM 0 HH11 ARG A 47 13.662 1.445 -4.712 1.00 0.00 H new ATOM 0 HH12 ARG A 47 14.755 1.519 -6.098 1.00 0.00 H new ATOM 0 HH21 ARG A 47 13.103 -0.963 -7.934 1.00 0.00 H new ATOM 0 HH22 ARG A 47 14.445 0.184 -7.883 1.00 0.00 H new ATOM 363 N ASP A 48 10.576 -4.043 -1.782 1.00 0.00 N ATOM 364 CA ASP A 48 10.259 -4.476 -0.415 1.00 0.00 C ATOM 365 C ASP A 48 8.980 -3.822 0.104 1.00 0.00 C ATOM 366 O ASP A 48 8.823 -2.598 0.041 1.00 0.00 O ATOM 367 CB ASP A 48 11.437 -4.214 0.527 1.00 0.00 C ATOM 368 CG ASP A 48 12.594 -5.106 0.107 1.00 0.00 C ATOM 369 OD1 ASP A 48 13.468 -4.598 -0.627 1.00 0.00 O ATOM 370 OD2 ASP A 48 12.530 -6.335 0.319 1.00 0.00 O ATOM 0 H ASP A 48 11.572 -3.866 -1.912 1.00 0.00 H new ATOM 0 HA ASP A 48 10.081 -5.551 -0.444 1.00 0.00 H new ATOM 0 HB2 ASP A 48 11.731 -3.165 0.484 1.00 0.00 H new ATOM 0 HB3 ASP A 48 11.152 -4.423 1.558 1.00 0.00 H new ATOM 376 N VAL A 49 8.073 -4.641 0.635 1.00 0.00 N ATOM 377 CA VAL A 49 6.836 -4.252 1.293 1.00 0.00 C ATOM 378 C VAL A 49 6.853 -4.907 2.677 1.00 0.00 C ATOM 379 O VAL A 49 7.008 -6.121 2.793 1.00 0.00 O ATOM 380 CB VAL A 49 5.615 -4.706 0.458 1.00 0.00 C ATOM 381 CG1 VAL A 49 4.320 -4.072 0.990 1.00 0.00 C ATOM 382 CG2 VAL A 49 5.739 -4.380 -1.038 1.00 0.00 C ATOM 0 H VAL A 49 8.194 -5.654 0.614 1.00 0.00 H new ATOM 0 HA VAL A 49 6.756 -3.169 1.390 1.00 0.00 H new ATOM 0 HB VAL A 49 5.583 -5.791 0.562 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.476 -4.407 0.386 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.167 -4.373 2.026 1.00 0.00 H new ATOM 0 HG13 VAL A 49 4.397 -2.986 0.935 1.00 0.00 H new ATOM 0 HG21 VAL A 49 4.848 -4.727 -1.561 1.00 0.00 H new ATOM 0 HG22 VAL A 49 5.840 -3.303 -1.168 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.617 -4.879 -1.448 1.00 0.00 H new ATOM 392 N THR A 50 6.733 -4.124 3.738 1.00 0.00 N ATOM 393 CA THR A 50 6.603 -4.610 5.110 1.00 0.00 C ATOM 394 C THR A 50 5.111 -4.754 5.394 1.00 0.00 C ATOM 395 O THR A 50 4.292 -3.992 4.870 1.00 0.00 O ATOM 396 CB THR A 50 7.303 -3.609 6.045 1.00 0.00 C ATOM 397 OG1 THR A 50 8.635 -3.471 5.594 1.00 0.00 O ATOM 398 CG2 THR A 50 7.353 -4.042 7.513 1.00 0.00 C ATOM 0 H THR A 50 6.723 -3.106 3.671 1.00 0.00 H new ATOM 0 HA THR A 50 7.076 -5.579 5.268 1.00 0.00 H new ATOM 0 HB THR A 50 6.727 -2.684 6.010 1.00 0.00 H new ATOM 0 HG1 THR A 50 9.107 -4.323 5.702 1.00 0.00 H new ATOM 0 HG21 THR A 50 7.863 -3.279 8.100 1.00 0.00 H new ATOM 0 HG22 THR A 50 6.338 -4.171 7.889 1.00 0.00 H new ATOM 0 HG23 THR A 50 7.893 -4.985 7.596 1.00 0.00 H new ATOM 406 N PHE A 51 4.722 -5.749 6.184 1.00 0.00 N ATOM 407 CA PHE A 51 3.365 -6.000 6.595 1.00 0.00 C ATOM 408 C PHE A 51 3.444 -6.625 7.978 1.00 0.00 C ATOM 409 O PHE A 51 4.523 -7.002 8.428 1.00 0.00 O ATOM 410 CB PHE A 51 2.633 -6.888 5.569 1.00 0.00 C ATOM 411 CG PHE A 51 3.279 -8.155 5.044 1.00 0.00 C ATOM 412 CD1 PHE A 51 4.659 -8.265 4.752 1.00 0.00 C ATOM 413 CD2 PHE A 51 2.425 -9.223 4.726 1.00 0.00 C ATOM 414 CE1 PHE A 51 5.202 -9.481 4.346 1.00 0.00 C ATOM 415 CE2 PHE A 51 2.962 -10.430 4.252 1.00 0.00 C ATOM 416 CZ PHE A 51 4.352 -10.562 4.143 1.00 0.00 C ATOM 0 H PHE A 51 5.381 -6.427 6.567 1.00 0.00 H new ATOM 0 HA PHE A 51 2.778 -5.082 6.641 1.00 0.00 H new ATOM 0 HB2 PHE A 51 1.680 -7.174 6.014 1.00 0.00 H new ATOM 0 HB3 PHE A 51 2.407 -6.262 4.706 1.00 0.00 H new ATOM 0 HD1 PHE A 51 5.297 -7.398 4.845 1.00 0.00 H new ATOM 0 HD2 PHE A 51 1.357 -9.116 4.846 1.00 0.00 H new ATOM 0 HE1 PHE A 51 6.266 -9.583 4.191 1.00 0.00 H new ATOM 0 HE2 PHE A 51 2.312 -11.246 3.975 1.00 0.00 H new ATOM 0 HZ PHE A 51 4.773 -11.525 3.896 1.00 0.00 H new ATOM 426 N ASN A 52 2.325 -6.669 8.686 1.00 0.00 N ATOM 427 CA ASN A 52 2.199 -7.197 10.041 1.00 0.00 C ATOM 428 C ASN A 52 0.716 -7.296 10.344 1.00 0.00 C ATOM 429 O ASN A 52 -0.103 -6.887 9.522 1.00 0.00 O ATOM 430 CB ASN A 52 2.887 -6.303 11.081 1.00 0.00 C ATOM 431 CG ASN A 52 2.476 -4.849 10.979 1.00 0.00 C ATOM 432 OD1 ASN A 52 1.554 -4.401 11.654 1.00 0.00 O ATOM 433 ND2 ASN A 52 3.159 -4.090 10.138 1.00 0.00 N ATOM 0 H ASN A 52 1.439 -6.323 8.317 1.00 0.00 H new ATOM 0 HA ASN A 52 2.689 -8.169 10.097 1.00 0.00 H new ATOM 0 HB2 ASN A 52 2.653 -6.671 12.080 1.00 0.00 H new ATOM 0 HB3 ASN A 52 3.967 -6.378 10.958 1.00 0.00 H new ATOM 0 HD21 ASN A 52 2.925 -3.103 10.037 1.00 0.00 H new ATOM 0 HD22 ASN A 52 3.920 -4.492 9.591 1.00 0.00 H new ATOM 440 N THR A 53 0.359 -7.925 11.456 1.00 0.00 N ATOM 441 CA THR A 53 -1.013 -8.366 11.660 1.00 0.00 C ATOM 442 C THR A 53 -1.915 -7.157 11.955 1.00 0.00 C ATOM 443 O THR A 53 -1.557 -6.284 12.752 1.00 0.00 O ATOM 444 CB THR A 53 -1.078 -9.469 12.723 1.00 0.00 C ATOM 445 OG1 THR A 53 0.067 -10.313 12.695 1.00 0.00 O ATOM 446 CG2 THR A 53 -2.262 -10.396 12.452 1.00 0.00 C ATOM 0 H THR A 53 0.995 -8.140 12.224 1.00 0.00 H new ATOM 0 HA THR A 53 -1.397 -8.820 10.747 1.00 0.00 H new ATOM 0 HB THR A 53 -1.156 -8.953 13.680 1.00 0.00 H new ATOM 0 HG1 THR A 53 -0.016 -11.000 13.389 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.296 -11.175 13.214 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.188 -9.821 12.478 1.00 0.00 H new ATOM 0 HG23 THR A 53 -2.148 -10.855 11.470 1.00 0.00 H new ATOM 454 N GLY A 54 -3.068 -7.107 11.288 1.00 0.00 N ATOM 455 CA GLY A 54 -4.088 -6.084 11.395 1.00 0.00 C ATOM 456 C GLY A 54 -5.447 -6.771 11.397 1.00 0.00 C ATOM 457 O GLY A 54 -5.827 -7.308 12.440 1.00 0.00 O ATOM 0 H GLY A 54 -3.323 -7.831 10.617 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -3.953 -5.505 12.309 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -4.016 -5.385 10.561 1.00 0.00 H new ATOM 461 N ASP A 55 -6.194 -6.735 10.292 1.00 0.00 N ATOM 462 CA ASP A 55 -7.526 -7.338 10.193 1.00 0.00 C ATOM 463 C ASP A 55 -7.812 -7.657 8.726 1.00 0.00 C ATOM 464 O ASP A 55 -8.170 -6.761 7.956 1.00 0.00 O ATOM 465 CB ASP A 55 -8.578 -6.369 10.757 1.00 0.00 C ATOM 466 CG ASP A 55 -9.933 -7.053 10.972 1.00 0.00 C ATOM 467 OD1 ASP A 55 -10.635 -6.678 11.938 1.00 0.00 O ATOM 468 OD2 ASP A 55 -10.298 -7.962 10.196 1.00 0.00 O ATOM 0 H ASP A 55 -5.888 -6.282 9.431 1.00 0.00 H new ATOM 0 HA ASP A 55 -7.568 -8.259 10.774 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -8.224 -5.961 11.704 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -8.700 -5.529 10.073 1.00 0.00 H new ATOM 474 N SER A 56 -7.577 -8.893 8.276 1.00 0.00 N ATOM 475 CA SER A 56 -7.712 -9.298 6.873 1.00 0.00 C ATOM 476 C SER A 56 -7.749 -10.825 6.731 1.00 0.00 C ATOM 477 O SER A 56 -7.570 -11.549 7.709 1.00 0.00 O ATOM 478 CB SER A 56 -6.528 -8.738 6.074 1.00 0.00 C ATOM 479 OG SER A 56 -6.629 -7.335 5.958 1.00 0.00 O ATOM 0 H SER A 56 -7.282 -9.654 8.887 1.00 0.00 H new ATOM 0 HA SER A 56 -8.652 -8.902 6.489 1.00 0.00 H new ATOM 0 HB2 SER A 56 -5.592 -9.002 6.567 1.00 0.00 H new ATOM 0 HB3 SER A 56 -6.505 -9.190 5.082 1.00 0.00 H new ATOM 0 HG SER A 56 -7.430 -7.025 6.429 1.00 0.00 H new ATOM 485 N GLU A 57 -7.893 -11.315 5.497 1.00 0.00 N ATOM 486 CA GLU A 57 -7.780 -12.715 5.098 1.00 0.00 C ATOM 487 C GLU A 57 -6.601 -13.444 5.726 1.00 0.00 C ATOM 488 O GLU A 57 -6.779 -14.533 6.266 1.00 0.00 O ATOM 489 CB GLU A 57 -7.656 -12.831 3.573 1.00 0.00 C ATOM 490 CG GLU A 57 -6.522 -12.005 2.933 1.00 0.00 C ATOM 491 CD GLU A 57 -6.723 -11.761 1.451 1.00 0.00 C ATOM 492 OE1 GLU A 57 -6.335 -12.639 0.642 1.00 0.00 O ATOM 493 OE2 GLU A 57 -7.284 -10.702 1.097 1.00 0.00 O ATOM 0 H GLU A 57 -8.104 -10.707 4.705 1.00 0.00 H new ATOM 0 HA GLU A 57 -8.693 -13.189 5.459 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -7.506 -13.880 3.317 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -8.602 -12.525 3.125 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -6.446 -11.046 3.445 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -5.575 -12.523 3.084 1.00 0.00 H new ATOM 501 N GLN A 58 -5.393 -12.896 5.592 1.00 0.00 N ATOM 502 CA GLN A 58 -4.206 -13.514 6.150 1.00 0.00 C ATOM 503 C GLN A 58 -3.878 -12.857 7.493 1.00 0.00 C ATOM 504 O GLN A 58 -2.756 -12.973 7.966 1.00 0.00 O ATOM 505 CB GLN A 58 -3.016 -13.450 5.167 1.00 0.00 C ATOM 506 CG GLN A 58 -3.228 -14.258 3.880 1.00 0.00 C ATOM 507 CD GLN A 58 -2.015 -14.199 2.951 1.00 0.00 C ATOM 508 OE1 GLN A 58 -0.916 -14.641 3.264 1.00 0.00 O ATOM 509 NE2 GLN A 58 -2.148 -13.645 1.756 1.00 0.00 N ATOM 0 H GLN A 58 -5.218 -12.021 5.098 1.00 0.00 H new ATOM 0 HA GLN A 58 -4.402 -14.573 6.320 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -2.830 -12.409 4.904 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.121 -13.816 5.671 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -3.436 -15.297 4.136 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -4.104 -13.877 3.355 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -3.050 -13.268 1.466 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -1.348 -13.595 1.125 1.00 0.00 H new ATOM 518 N GLY A 59 -4.780 -12.051 8.050 1.00 0.00 N ATOM 519 CA GLY A 59 -4.569 -11.194 9.204 1.00 0.00 C ATOM 520 C GLY A 59 -3.704 -9.985 8.855 1.00 0.00 C ATOM 521 O GLY A 59 -3.963 -8.883 9.324 1.00 0.00 O ATOM 0 H GLY A 59 -5.729 -11.978 7.684 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -5.532 -10.855 9.587 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -4.092 -11.766 10.000 1.00 0.00 H new ATOM 525 N ILE A 60 -2.669 -10.180 8.041 1.00 0.00 N ATOM 526 CA ILE A 60 -1.601 -9.229 7.801 1.00 0.00 C ATOM 527 C ILE A 60 -1.947 -8.172 6.772 1.00 0.00 C ATOM 528 O ILE A 60 -2.540 -8.457 5.727 1.00 0.00 O ATOM 529 CB ILE A 60 -0.292 -9.960 7.462 1.00 0.00 C ATOM 530 CG1 ILE A 60 -0.425 -11.067 6.390 1.00 0.00 C ATOM 531 CG2 ILE A 60 0.267 -10.537 8.760 1.00 0.00 C ATOM 532 CD1 ILE A 60 0.831 -11.933 6.232 1.00 0.00 C ATOM 0 H ILE A 60 -2.552 -11.044 7.511 1.00 0.00 H new ATOM 0 HA ILE A 60 -1.457 -8.679 8.731 1.00 0.00 H new ATOM 0 HB ILE A 60 0.383 -9.230 7.016 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -1.267 -11.709 6.648 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -0.658 -10.604 5.431 1.00 0.00 H new ATOM 0 HG21 ILE A 60 1.199 -11.064 8.553 1.00 0.00 H new ATOM 0 HG22 ILE A 60 0.457 -9.728 9.466 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -0.455 -11.232 9.190 1.00 0.00 H new ATOM 0 HD11 ILE A 60 0.660 -12.686 5.463 1.00 0.00 H new ATOM 0 HD12 ILE A 60 1.673 -11.304 5.943 1.00 0.00 H new ATOM 0 HD13 ILE A 60 1.055 -12.426 7.178 1.00 0.00 H new ATOM 544 N VAL A 61 -1.484 -6.957 7.048 1.00 0.00 N ATOM 545 CA VAL A 61 -1.817 -5.735 6.346 1.00 0.00 C ATOM 546 C VAL A 61 -0.515 -5.005 5.999 1.00 0.00 C ATOM 547 O VAL A 61 0.390 -4.953 6.838 1.00 0.00 O ATOM 548 CB VAL A 61 -2.774 -4.897 7.219 1.00 0.00 C ATOM 549 CG1 VAL A 61 -4.068 -5.684 7.456 1.00 0.00 C ATOM 550 CG2 VAL A 61 -2.214 -4.504 8.596 1.00 0.00 C ATOM 0 H VAL A 61 -0.829 -6.796 7.813 1.00 0.00 H new ATOM 0 HA VAL A 61 -2.339 -5.934 5.410 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.936 -3.975 6.661 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -4.745 -5.093 8.073 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -4.543 -5.899 6.499 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -3.837 -6.620 7.965 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -2.957 -3.918 9.137 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -1.979 -5.404 9.164 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.309 -3.911 8.465 1.00 0.00 H new ATOM 560 N PRO A 62 -0.360 -4.487 4.770 1.00 0.00 N ATOM 561 CA PRO A 62 0.894 -3.891 4.341 1.00 0.00 C ATOM 562 C PRO A 62 1.033 -2.458 4.848 1.00 0.00 C ATOM 563 O PRO A 62 0.077 -1.673 4.835 1.00 0.00 O ATOM 564 CB PRO A 62 0.888 -4.017 2.819 1.00 0.00 C ATOM 565 CG PRO A 62 -0.595 -3.882 2.478 1.00 0.00 C ATOM 566 CD PRO A 62 -1.286 -4.577 3.651 1.00 0.00 C ATOM 0 HA PRO A 62 1.767 -4.393 4.757 1.00 0.00 H new ATOM 0 HB2 PRO A 62 1.485 -3.238 2.346 1.00 0.00 H new ATOM 0 HB3 PRO A 62 1.294 -4.974 2.490 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -0.896 -2.838 2.394 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -0.835 -4.360 1.528 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -2.234 -4.093 3.888 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -1.510 -5.617 3.412 1.00 0.00 H new ATOM 574 N CYS A 63 2.247 -2.131 5.283 1.00 0.00 N ATOM 575 CA CYS A 63 2.739 -0.827 5.678 1.00 0.00 C ATOM 576 C CYS A 63 2.827 0.027 4.415 1.00 0.00 C ATOM 577 O CYS A 63 3.763 -0.110 3.626 1.00 0.00 O ATOM 578 CB CYS A 63 4.106 -1.007 6.349 1.00 0.00 C ATOM 579 SG CYS A 63 4.119 -2.182 7.727 1.00 0.00 S ATOM 0 H CYS A 63 2.973 -2.842 5.374 1.00 0.00 H new ATOM 0 HA CYS A 63 2.081 -0.332 6.393 1.00 0.00 H new ATOM 0 HB2 CYS A 63 4.824 -1.339 5.599 1.00 0.00 H new ATOM 0 HB3 CYS A 63 4.449 -0.038 6.711 1.00 0.00 H new ATOM 0 HG CYS A 63 5.320 -2.260 8.220 1.00 0.00 H new ATOM 585 N LEU A 64 1.798 0.833 4.174 1.00 0.00 N ATOM 586 CA LEU A 64 1.613 1.679 3.003 1.00 0.00 C ATOM 587 C LEU A 64 1.367 3.068 3.572 1.00 0.00 C ATOM 588 O LEU A 64 0.483 3.216 4.415 1.00 0.00 O ATOM 589 CB LEU A 64 0.402 1.210 2.164 1.00 0.00 C ATOM 590 CG LEU A 64 0.443 -0.209 1.558 1.00 0.00 C ATOM 591 CD1 LEU A 64 -0.736 -0.433 0.605 1.00 0.00 C ATOM 592 CD2 LEU A 64 1.737 -0.563 0.808 1.00 0.00 C ATOM 0 H LEU A 64 1.024 0.917 4.833 1.00 0.00 H new ATOM 0 HA LEU A 64 2.473 1.649 2.335 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.486 1.278 2.793 1.00 0.00 H new ATOM 0 HB3 LEU A 64 0.269 1.918 1.346 1.00 0.00 H new ATOM 0 HG LEU A 64 0.387 -0.866 2.426 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.684 -1.440 0.192 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.672 -0.313 1.150 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -0.692 0.294 -0.206 1.00 0.00 H new ATOM 0 HD21 LEU A 64 1.667 -1.579 0.421 1.00 0.00 H new ATOM 0 HD22 LEU A 64 1.880 0.132 -0.020 1.00 0.00 H new ATOM 0 HD23 LEU A 64 2.584 -0.493 1.491 1.00 0.00 H new ATOM 604 N THR A 65 2.156 4.068 3.176 1.00 0.00 N ATOM 605 CA THR A 65 2.003 5.415 3.719 1.00 0.00 C ATOM 606 C THR A 65 1.108 6.239 2.807 1.00 0.00 C ATOM 607 O THR A 65 0.801 5.832 1.689 1.00 0.00 O ATOM 608 CB THR A 65 3.349 6.109 3.977 1.00 0.00 C ATOM 609 OG1 THR A 65 3.929 6.609 2.784 1.00 0.00 O ATOM 610 CG2 THR A 65 4.359 5.193 4.653 1.00 0.00 C ATOM 0 H THR A 65 2.901 3.970 2.487 1.00 0.00 H new ATOM 0 HA THR A 65 1.526 5.328 4.695 1.00 0.00 H new ATOM 0 HB THR A 65 3.117 6.938 4.646 1.00 0.00 H new ATOM 0 HG1 THR A 65 4.782 7.044 2.992 1.00 0.00 H new ATOM 0 HG21 THR A 65 5.292 5.734 4.812 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.964 4.862 5.613 1.00 0.00 H new ATOM 0 HG23 THR A 65 4.546 4.326 4.019 1.00 0.00 H new ATOM 618 N ARG A 66 0.724 7.438 3.243 1.00 0.00 N ATOM 619 CA ARG A 66 -0.096 8.343 2.439 1.00 0.00 C ATOM 620 C ARG A 66 0.589 8.633 1.115 1.00 0.00 C ATOM 621 O ARG A 66 -0.022 8.491 0.061 1.00 0.00 O ATOM 622 CB ARG A 66 -0.360 9.673 3.178 1.00 0.00 C ATOM 623 CG ARG A 66 -0.403 9.570 4.704 1.00 0.00 C ATOM 624 CD ARG A 66 -0.822 10.897 5.321 1.00 0.00 C ATOM 625 NE ARG A 66 0.206 11.941 5.256 1.00 0.00 N ATOM 626 CZ ARG A 66 -0.011 13.227 5.556 1.00 0.00 C ATOM 627 NH1 ARG A 66 -1.209 13.632 5.974 1.00 0.00 N ATOM 628 NH2 ARG A 66 0.978 14.093 5.415 1.00 0.00 N ATOM 0 H ARG A 66 0.972 7.808 4.161 1.00 0.00 H new ATOM 0 HA ARG A 66 -1.052 7.850 2.261 1.00 0.00 H new ATOM 0 HB2 ARG A 66 0.416 10.386 2.899 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -1.309 10.082 2.830 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -1.102 8.788 5.001 1.00 0.00 H new ATOM 0 HG3 ARG A 66 0.578 9.281 5.082 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -1.719 11.254 4.814 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -1.090 10.731 6.364 1.00 0.00 H new ATOM 0 HE ARG A 66 1.145 11.670 4.964 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -1.970 12.960 6.068 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -1.365 14.614 6.200 1.00 0.00 H new ATOM 0 HH21 ARG A 66 1.889 13.777 5.082 1.00 0.00 H new ATOM 0 HH22 ARG A 66 0.830 15.077 5.639 1.00 0.00 H new ATOM 642 N ALA A 67 1.854 9.043 1.184 1.00 0.00 N ATOM 643 CA ALA A 67 2.627 9.381 0.011 1.00 0.00 C ATOM 644 C ALA A 67 2.748 8.179 -0.902 1.00 0.00 C ATOM 645 O ALA A 67 2.448 8.300 -2.087 1.00 0.00 O ATOM 646 CB ALA A 67 4.004 9.854 0.435 1.00 0.00 C ATOM 0 H ALA A 67 2.364 9.147 2.061 1.00 0.00 H new ATOM 0 HA ALA A 67 2.122 10.179 -0.534 1.00 0.00 H new ATOM 0 HB1 ALA A 67 4.589 10.110 -0.449 1.00 0.00 H new ATOM 0 HB2 ALA A 67 3.907 10.733 1.072 1.00 0.00 H new ATOM 0 HB3 ALA A 67 4.508 9.060 0.986 1.00 0.00 H new ATOM 652 N GLN A 68 3.156 7.027 -0.357 1.00 0.00 N ATOM 653 CA GLN A 68 3.358 5.870 -1.195 1.00 0.00 C ATOM 654 C GLN A 68 2.034 5.469 -1.835 1.00 0.00 C ATOM 655 O GLN A 68 2.006 5.242 -3.037 1.00 0.00 O ATOM 656 CB GLN A 68 4.028 4.734 -0.411 1.00 0.00 C ATOM 657 CG GLN A 68 5.034 3.996 -1.305 1.00 0.00 C ATOM 658 CD GLN A 68 6.273 4.830 -1.642 1.00 0.00 C ATOM 659 OE1 GLN A 68 6.544 5.097 -2.813 1.00 0.00 O ATOM 660 NE2 GLN A 68 7.034 5.285 -0.662 1.00 0.00 N ATOM 0 H GLN A 68 3.345 6.885 0.635 1.00 0.00 H new ATOM 0 HA GLN A 68 4.047 6.113 -2.004 1.00 0.00 H new ATOM 0 HB2 GLN A 68 4.536 5.137 0.465 1.00 0.00 H new ATOM 0 HB3 GLN A 68 3.272 4.037 -0.049 1.00 0.00 H new ATOM 0 HG2 GLN A 68 5.347 3.079 -0.807 1.00 0.00 H new ATOM 0 HG3 GLN A 68 4.539 3.703 -2.231 1.00 0.00 H new ATOM 0 HE21 GLN A 68 6.806 5.061 0.307 1.00 0.00 H new ATOM 0 HE22 GLN A 68 7.849 5.860 -0.874 1.00 0.00 H new ATOM 669 N LEU A 69 0.924 5.476 -1.080 1.00 0.00 N ATOM 670 CA LEU A 69 -0.406 5.181 -1.603 1.00 0.00 C ATOM 671 C LEU A 69 -0.753 6.122 -2.765 1.00 0.00 C ATOM 672 O LEU A 69 -1.317 5.693 -3.775 1.00 0.00 O ATOM 673 CB LEU A 69 -1.497 5.269 -0.515 1.00 0.00 C ATOM 674 CG LEU A 69 -1.580 4.140 0.530 1.00 0.00 C ATOM 675 CD1 LEU A 69 -2.615 4.504 1.609 1.00 0.00 C ATOM 676 CD2 LEU A 69 -2.005 2.816 -0.110 1.00 0.00 C ATOM 0 H LEU A 69 0.932 5.689 -0.083 1.00 0.00 H new ATOM 0 HA LEU A 69 -0.381 4.153 -1.964 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -1.357 6.208 0.021 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -2.463 5.329 -1.017 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.588 4.024 0.967 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -2.670 3.702 2.346 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -2.317 5.430 2.102 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -3.592 4.638 1.145 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.054 2.041 0.655 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -2.986 2.933 -0.571 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.279 2.530 -0.871 1.00 0.00 H new ATOM 688 N ALA A 70 -0.423 7.406 -2.639 1.00 0.00 N ATOM 689 CA ALA A 70 -0.631 8.417 -3.665 1.00 0.00 C ATOM 690 C ALA A 70 0.320 8.278 -4.861 1.00 0.00 C ATOM 691 O ALA A 70 0.082 8.904 -5.899 1.00 0.00 O ATOM 692 CB ALA A 70 -0.502 9.795 -3.033 1.00 0.00 C ATOM 0 H ALA A 70 0.009 7.779 -1.794 1.00 0.00 H new ATOM 0 HA ALA A 70 -1.634 8.275 -4.068 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -0.656 10.560 -3.794 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -1.251 9.907 -2.249 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.493 9.906 -2.603 1.00 0.00 H new ATOM 698 N SER A 71 1.354 7.441 -4.770 1.00 0.00 N ATOM 699 CA SER A 71 2.131 7.026 -5.926 1.00 0.00 C ATOM 700 C SER A 71 1.261 6.152 -6.825 1.00 0.00 C ATOM 701 O SER A 71 1.171 6.434 -8.023 1.00 0.00 O ATOM 702 CB SER A 71 3.431 6.338 -5.491 1.00 0.00 C ATOM 703 OG SER A 71 4.417 6.563 -6.477 1.00 0.00 O ATOM 0 H SER A 71 1.672 7.035 -3.890 1.00 0.00 H new ATOM 0 HA SER A 71 2.435 7.897 -6.506 1.00 0.00 H new ATOM 0 HB2 SER A 71 3.762 6.730 -4.530 1.00 0.00 H new ATOM 0 HB3 SER A 71 3.266 5.269 -5.359 1.00 0.00 H new ATOM 0 HG SER A 71 5.253 6.129 -6.208 1.00 0.00 H new ATOM 709 N MET A 72 0.551 5.161 -6.266 1.00 0.00 N ATOM 710 CA MET A 72 -0.466 4.408 -7.003 1.00 0.00 C ATOM 711 C MET A 72 -1.752 5.219 -7.207 1.00 0.00 C ATOM 712 O MET A 72 -2.693 4.742 -7.831 1.00 0.00 O ATOM 713 CB MET A 72 -0.818 3.075 -6.329 1.00 0.00 C ATOM 714 CG MET A 72 0.324 2.286 -5.683 1.00 0.00 C ATOM 715 SD MET A 72 0.693 2.774 -3.991 1.00 0.00 S ATOM 716 CE MET A 72 2.214 1.853 -3.668 1.00 0.00 C ATOM 0 H MET A 72 0.667 4.863 -5.297 1.00 0.00 H new ATOM 0 HA MET A 72 -0.018 4.199 -7.974 1.00 0.00 H new ATOM 0 HB2 MET A 72 -1.566 3.273 -5.561 1.00 0.00 H new ATOM 0 HB3 MET A 72 -1.289 2.435 -7.075 1.00 0.00 H new ATOM 0 HG2 MET A 72 0.071 1.226 -5.697 1.00 0.00 H new ATOM 0 HG3 MET A 72 1.222 2.407 -6.288 1.00 0.00 H new ATOM 0 HE1 MET A 72 2.779 2.349 -2.878 1.00 0.00 H new ATOM 0 HE2 MET A 72 1.966 0.839 -3.355 1.00 0.00 H new ATOM 0 HE3 MET A 72 2.816 1.815 -4.576 1.00 0.00 H new ATOM 726 N GLY A 73 -1.830 6.431 -6.661 1.00 0.00 N ATOM 727 CA GLY A 73 -2.828 7.401 -7.071 1.00 0.00 C ATOM 728 C GLY A 73 -4.039 7.407 -6.152 1.00 0.00 C ATOM 729 O GLY A 73 -5.139 7.701 -6.609 1.00 0.00 O ATOM 0 H GLY A 73 -1.204 6.761 -5.926 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -2.381 8.395 -7.085 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -3.149 7.181 -8.089 1.00 0.00 H new ATOM 733 N LEU A 74 -3.870 7.084 -4.871 1.00 0.00 N ATOM 734 CA LEU A 74 -4.885 7.203 -3.829 1.00 0.00 C ATOM 735 C LEU A 74 -4.954 8.633 -3.295 1.00 0.00 C ATOM 736 O LEU A 74 -3.952 9.226 -2.898 1.00 0.00 O ATOM 737 CB LEU A 74 -4.488 6.245 -2.723 1.00 0.00 C ATOM 738 CG LEU A 74 -5.306 6.204 -1.425 1.00 0.00 C ATOM 739 CD1 LEU A 74 -4.724 7.139 -0.367 1.00 0.00 C ATOM 740 CD2 LEU A 74 -6.816 6.400 -1.459 1.00 0.00 C ATOM 0 H LEU A 74 -2.986 6.718 -4.518 1.00 0.00 H new ATOM 0 HA LEU A 74 -5.872 6.962 -4.224 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -4.495 5.240 -3.144 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.457 6.470 -2.451 1.00 0.00 H new ATOM 0 HG LEU A 74 -5.199 5.146 -1.184 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -5.328 7.085 0.539 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -3.701 6.839 -0.139 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -4.727 8.162 -0.744 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -7.214 6.337 -0.446 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -7.046 7.379 -1.880 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -7.270 5.624 -2.076 1.00 0.00 H new ATOM 752 N ASN A 75 -6.165 9.178 -3.235 1.00 0.00 N ATOM 753 CA ASN A 75 -6.437 10.516 -2.755 1.00 0.00 C ATOM 754 C ASN A 75 -6.457 10.556 -1.229 1.00 0.00 C ATOM 755 O ASN A 75 -7.512 10.442 -0.605 1.00 0.00 O ATOM 756 CB ASN A 75 -7.768 11.037 -3.317 1.00 0.00 C ATOM 757 CG ASN A 75 -7.964 12.538 -3.143 1.00 0.00 C ATOM 758 OD1 ASN A 75 -9.021 13.072 -3.434 1.00 0.00 O ATOM 759 ND2 ASN A 75 -6.952 13.296 -2.766 1.00 0.00 N ATOM 0 H ASN A 75 -7.005 8.680 -3.529 1.00 0.00 H new ATOM 0 HA ASN A 75 -5.634 11.165 -3.105 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -7.824 10.793 -4.378 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -8.589 10.514 -2.826 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -7.062 14.309 -2.722 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -6.059 12.869 -2.518 1.00 0.00 H new ATOM 766 N THR A 76 -5.305 10.813 -0.617 1.00 0.00 N ATOM 767 CA THR A 76 -5.159 10.943 0.834 1.00 0.00 C ATOM 768 C THR A 76 -6.030 12.059 1.420 1.00 0.00 C ATOM 769 O THR A 76 -6.249 12.105 2.631 1.00 0.00 O ATOM 770 CB THR A 76 -3.672 11.206 1.164 1.00 0.00 C ATOM 771 OG1 THR A 76 -3.279 12.521 0.829 1.00 0.00 O ATOM 772 CG2 THR A 76 -2.724 10.294 0.389 1.00 0.00 C ATOM 0 H THR A 76 -4.428 10.940 -1.123 1.00 0.00 H new ATOM 0 HA THR A 76 -5.497 10.012 1.288 1.00 0.00 H new ATOM 0 HB THR A 76 -3.602 11.023 2.236 1.00 0.00 H new ATOM 0 HG1 THR A 76 -3.276 13.077 1.636 1.00 0.00 H new ATOM 0 HG21 THR A 76 -1.694 10.524 0.661 1.00 0.00 H new ATOM 0 HG22 THR A 76 -2.940 9.254 0.632 1.00 0.00 H new ATOM 0 HG23 THR A 76 -2.860 10.452 -0.681 1.00 0.00 H new ATOM 780 N ALA A 77 -6.485 13.000 0.586 1.00 0.00 N ATOM 781 CA ALA A 77 -7.327 14.116 0.974 1.00 0.00 C ATOM 782 C ALA A 77 -8.791 13.895 0.578 1.00 0.00 C ATOM 783 O ALA A 77 -9.630 14.771 0.813 1.00 0.00 O ATOM 784 CB ALA A 77 -6.719 15.415 0.429 1.00 0.00 C ATOM 0 H ALA A 77 -6.265 12.998 -0.410 1.00 0.00 H new ATOM 0 HA ALA A 77 -7.353 14.198 2.061 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -7.346 16.259 0.716 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -5.719 15.549 0.841 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -6.659 15.361 -0.658 1.00 0.00 H new ATOM 790 N SER A 78 -9.125 12.727 0.022 1.00 0.00 N ATOM 791 CA SER A 78 -10.502 12.287 -0.030 1.00 0.00 C ATOM 792 C SER A 78 -10.887 11.679 1.317 1.00 0.00 C ATOM 793 O SER A 78 -11.939 12.018 1.862 1.00 0.00 O ATOM 794 CB SER A 78 -10.743 11.322 -1.190 1.00 0.00 C ATOM 795 OG SER A 78 -12.109 11.301 -1.532 1.00 0.00 O ATOM 0 H SER A 78 -8.456 12.079 -0.394 1.00 0.00 H new ATOM 0 HA SER A 78 -11.145 13.147 -0.218 1.00 0.00 H new ATOM 0 HB2 SER A 78 -10.150 11.624 -2.053 1.00 0.00 H new ATOM 0 HB3 SER A 78 -10.415 10.320 -0.913 1.00 0.00 H new ATOM 0 HG SER A 78 -12.494 10.433 -1.289 1.00 0.00 H new ATOM 801 N VAL A 79 -10.046 10.803 1.882 1.00 0.00 N ATOM 802 CA VAL A 79 -10.435 10.013 3.033 1.00 0.00 C ATOM 803 C VAL A 79 -10.120 10.870 4.255 1.00 0.00 C ATOM 804 O VAL A 79 -8.961 11.245 4.493 1.00 0.00 O ATOM 805 CB VAL A 79 -9.752 8.628 3.043 1.00 0.00 C ATOM 806 CG1 VAL A 79 -10.325 7.759 1.924 1.00 0.00 C ATOM 807 CG2 VAL A 79 -8.223 8.595 2.942 1.00 0.00 C ATOM 0 H VAL A 79 -9.096 10.631 1.554 1.00 0.00 H new ATOM 0 HA VAL A 79 -11.497 9.770 3.018 1.00 0.00 H new ATOM 0 HB VAL A 79 -9.976 8.248 4.040 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.839 6.783 1.936 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.397 7.633 2.074 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.148 8.241 0.962 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -7.879 7.561 2.961 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -7.910 9.065 2.010 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -7.791 9.136 3.784 1.00 0.00 H new ATOM 817 N ALA A 80 -11.155 11.226 5.016 1.00 0.00 N ATOM 818 CA ALA A 80 -10.963 11.716 6.367 1.00 0.00 C ATOM 819 C ALA A 80 -10.108 10.695 7.114 1.00 0.00 C ATOM 820 O ALA A 80 -10.351 9.498 6.982 1.00 0.00 O ATOM 821 CB ALA A 80 -12.316 11.888 7.041 1.00 0.00 C ATOM 0 H ALA A 80 -12.129 11.182 4.715 1.00 0.00 H new ATOM 0 HA ALA A 80 -10.463 12.684 6.367 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -12.172 12.256 8.057 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -12.915 12.603 6.477 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -12.831 10.928 7.073 1.00 0.00 H new ATOM 827 N GLY A 81 -9.107 11.148 7.866 1.00 0.00 N ATOM 828 CA GLY A 81 -8.301 10.274 8.700 1.00 0.00 C ATOM 829 C GLY A 81 -6.935 9.937 8.137 1.00 0.00 C ATOM 830 O GLY A 81 -6.032 9.740 8.935 1.00 0.00 O ATOM 0 H GLY A 81 -8.836 12.130 7.911 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -8.170 10.745 9.674 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -8.849 9.346 8.865 1.00 0.00 H new ATOM 834 N MET A 82 -6.689 9.910 6.825 1.00 0.00 N ATOM 835 CA MET A 82 -5.323 9.899 6.324 1.00 0.00 C ATOM 836 C MET A 82 -4.671 11.274 6.370 1.00 0.00 C ATOM 837 O MET A 82 -3.460 11.411 6.511 1.00 0.00 O ATOM 838 CB MET A 82 -5.353 9.372 4.907 1.00 0.00 C ATOM 839 CG MET A 82 -3.930 9.098 4.434 1.00 0.00 C ATOM 840 SD MET A 82 -3.825 8.201 2.888 1.00 0.00 S ATOM 841 CE MET A 82 -4.851 6.780 3.298 1.00 0.00 C ATOM 0 H MET A 82 -7.410 9.896 6.104 1.00 0.00 H new ATOM 0 HA MET A 82 -4.718 9.258 6.965 1.00 0.00 H new ATOM 0 HB2 MET A 82 -5.945 8.458 4.861 1.00 0.00 H new ATOM 0 HB3 MET A 82 -5.833 10.096 4.249 1.00 0.00 H new ATOM 0 HG2 MET A 82 -3.407 10.048 4.325 1.00 0.00 H new ATOM 0 HG3 MET A 82 -3.406 8.532 5.205 1.00 0.00 H new ATOM 0 HE1 MET A 82 -4.484 5.901 2.768 1.00 0.00 H new ATOM 0 HE2 MET A 82 -4.810 6.599 4.372 1.00 0.00 H new ATOM 0 HE3 MET A 82 -5.881 6.978 3.002 1.00 0.00 H new ATOM 851 N ASN A 83 -5.446 12.336 6.248 1.00 0.00 N ATOM 852 CA ASN A 83 -4.906 13.675 6.043 1.00 0.00 C ATOM 853 C ASN A 83 -4.361 14.325 7.318 1.00 0.00 C ATOM 854 O ASN A 83 -4.028 15.505 7.338 1.00 0.00 O ATOM 855 CB ASN A 83 -5.968 14.520 5.354 1.00 0.00 C ATOM 856 CG ASN A 83 -7.262 14.636 6.127 1.00 0.00 C ATOM 857 OD1 ASN A 83 -7.500 15.610 6.822 1.00 0.00 O ATOM 858 ND2 ASN A 83 -8.131 13.644 5.979 1.00 0.00 N ATOM 0 H ASN A 83 -6.465 12.299 6.287 1.00 0.00 H new ATOM 0 HA ASN A 83 -4.028 13.599 5.401 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -5.568 15.520 5.184 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -6.180 14.091 4.375 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -9.033 13.681 6.455 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -7.897 12.845 5.390 1.00 0.00 H new ATOM 865 N LEU A 84 -4.234 13.524 8.369 1.00 0.00 N ATOM 866 CA LEU A 84 -3.835 13.848 9.732 1.00 0.00 C ATOM 867 C LEU A 84 -2.925 12.718 10.285 1.00 0.00 C ATOM 868 O LEU A 84 -2.451 12.797 11.421 1.00 0.00 O ATOM 869 CB LEU A 84 -5.053 14.337 10.583 1.00 0.00 C ATOM 870 CG LEU A 84 -6.335 13.504 10.398 1.00 0.00 C ATOM 871 CD1 LEU A 84 -5.843 12.093 10.510 1.00 0.00 C ATOM 872 CD2 LEU A 84 -7.500 13.641 11.371 1.00 0.00 C ATOM 0 H LEU A 84 -4.429 12.527 8.277 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.192 14.727 9.781 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -4.774 14.322 11.637 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -5.268 15.374 10.325 1.00 0.00 H new ATOM 0 HG LEU A 84 -6.779 13.852 9.465 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -6.680 11.405 10.393 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -5.105 11.902 9.731 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -5.385 11.944 11.488 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -8.306 12.972 11.070 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -7.168 13.379 12.376 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -7.860 14.670 11.365 1.00 0.00 H new ATOM 884 N LEU A 85 -2.683 11.672 9.479 1.00 0.00 N ATOM 885 CA LEU A 85 -1.653 10.657 9.650 1.00 0.00 C ATOM 886 C LEU A 85 -0.314 11.244 9.238 1.00 0.00 C ATOM 887 O LEU A 85 -0.274 12.224 8.487 1.00 0.00 O ATOM 888 CB LEU A 85 -1.975 9.444 8.759 1.00 0.00 C ATOM 889 CG LEU A 85 -2.745 8.367 9.527 1.00 0.00 C ATOM 890 CD1 LEU A 85 -3.648 7.563 8.598 1.00 0.00 C ATOM 891 CD2 LEU A 85 -1.753 7.411 10.143 1.00 0.00 C ATOM 0 H LEU A 85 -3.241 11.510 8.641 1.00 0.00 H new ATOM 0 HA LEU A 85 -1.615 10.339 10.692 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.562 9.769 7.900 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -1.048 9.022 8.370 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.356 8.859 10.283 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -4.181 6.806 9.174 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -4.367 8.230 8.122 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -3.043 7.077 7.833 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.287 6.637 10.694 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.156 6.950 9.357 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.098 7.955 10.824 1.00 0.00 H new ATOM 903 N ALA A 86 0.778 10.628 9.683 1.00 0.00 N ATOM 904 CA ALA A 86 2.101 11.048 9.272 1.00 0.00 C ATOM 905 C ALA A 86 2.395 10.669 7.830 1.00 0.00 C ATOM 906 O ALA A 86 1.762 9.809 7.217 1.00 0.00 O ATOM 907 CB ALA A 86 3.171 10.480 10.203 1.00 0.00 C ATOM 0 H ALA A 86 0.766 9.838 10.328 1.00 0.00 H new ATOM 0 HA ALA A 86 2.125 12.136 9.338 1.00 0.00 H new ATOM 0 HB1 ALA A 86 4.155 10.811 9.871 1.00 0.00 H new ATOM 0 HB2 ALA A 86 2.993 10.832 11.219 1.00 0.00 H new ATOM 0 HB3 ALA A 86 3.129 9.391 10.184 1.00 0.00 H new ATOM 913 N ASP A 87 3.431 11.328 7.341 1.00 0.00 N ATOM 914 CA ASP A 87 4.096 11.193 6.060 1.00 0.00 C ATOM 915 C ASP A 87 4.509 9.760 5.819 1.00 0.00 C ATOM 916 O ASP A 87 4.267 9.195 4.748 1.00 0.00 O ATOM 917 CB ASP A 87 5.303 12.143 6.069 1.00 0.00 C ATOM 918 CG ASP A 87 4.897 13.589 6.373 1.00 0.00 C ATOM 919 OD1 ASP A 87 4.625 13.871 7.571 1.00 0.00 O ATOM 920 OD2 ASP A 87 4.788 14.399 5.422 1.00 0.00 O ATOM 0 H ASP A 87 3.877 12.055 7.900 1.00 0.00 H new ATOM 0 HA ASP A 87 3.424 11.458 5.243 1.00 0.00 H new ATOM 0 HB2 ASP A 87 6.024 11.805 6.814 1.00 0.00 H new ATOM 0 HB3 ASP A 87 5.802 12.103 5.101 1.00 0.00 H new ATOM 926 N ASP A 88 5.069 9.165 6.864 1.00 0.00 N ATOM 927 CA ASP A 88 5.375 7.763 6.948 1.00 0.00 C ATOM 928 C ASP A 88 4.747 7.240 8.230 1.00 0.00 C ATOM 929 O ASP A 88 5.327 7.261 9.319 1.00 0.00 O ATOM 930 CB ASP A 88 6.873 7.531 6.821 1.00 0.00 C ATOM 931 CG ASP A 88 7.266 6.066 7.050 1.00 0.00 C ATOM 932 OD1 ASP A 88 6.378 5.179 7.017 1.00 0.00 O ATOM 933 OD2 ASP A 88 8.479 5.802 7.197 1.00 0.00 O ATOM 0 H ASP A 88 5.329 9.678 7.707 1.00 0.00 H new ATOM 0 HA ASP A 88 4.951 7.197 6.119 1.00 0.00 H new ATOM 0 HB2 ASP A 88 7.202 7.840 5.829 1.00 0.00 H new ATOM 0 HB3 ASP A 88 7.396 8.160 7.541 1.00 0.00 H new ATOM 939 N ALA A 89 3.487 6.858 8.075 1.00 0.00 N ATOM 940 CA ALA A 89 2.718 6.010 8.970 1.00 0.00 C ATOM 941 C ALA A 89 2.175 4.828 8.174 1.00 0.00 C ATOM 942 O ALA A 89 1.902 4.980 6.981 1.00 0.00 O ATOM 943 CB ALA A 89 1.556 6.837 9.511 1.00 0.00 C ATOM 0 H ALA A 89 2.940 7.153 7.266 1.00 0.00 H new ATOM 0 HA ALA A 89 3.335 5.643 9.790 1.00 0.00 H new ATOM 0 HB1 ALA A 89 0.959 6.226 10.188 1.00 0.00 H new ATOM 0 HB2 ALA A 89 1.944 7.701 10.050 1.00 0.00 H new ATOM 0 HB3 ALA A 89 0.933 7.175 8.683 1.00 0.00 H new ATOM 949 N CYS A 90 1.958 3.686 8.826 1.00 0.00 N ATOM 950 CA CYS A 90 1.263 2.551 8.240 1.00 0.00 C ATOM 951 C CYS A 90 -0.226 2.897 8.205 1.00 0.00 C ATOM 952 O CYS A 90 -0.910 2.765 9.220 1.00 0.00 O ATOM 953 CB CYS A 90 1.518 1.284 9.064 1.00 0.00 C ATOM 954 SG CYS A 90 3.257 0.826 9.296 1.00 0.00 S ATOM 0 H CYS A 90 2.265 3.526 9.786 1.00 0.00 H new ATOM 0 HA CYS A 90 1.625 2.353 7.231 1.00 0.00 H new ATOM 0 HB2 CYS A 90 1.063 1.415 10.046 1.00 0.00 H new ATOM 0 HB3 CYS A 90 1.004 0.452 8.583 1.00 0.00 H new ATOM 0 HG CYS A 90 3.465 -0.357 8.797 1.00 0.00 H new ATOM 960 N VAL A 91 -0.734 3.380 7.071 1.00 0.00 N ATOM 961 CA VAL A 91 -2.139 3.709 6.927 1.00 0.00 C ATOM 962 C VAL A 91 -2.804 2.478 6.302 1.00 0.00 C ATOM 963 O VAL A 91 -2.263 1.903 5.346 1.00 0.00 O ATOM 964 CB VAL A 91 -2.305 5.046 6.172 1.00 0.00 C ATOM 965 CG1 VAL A 91 -1.142 6.032 6.415 1.00 0.00 C ATOM 966 CG2 VAL A 91 -2.579 5.011 4.704 1.00 0.00 C ATOM 0 H VAL A 91 -0.179 3.551 6.233 1.00 0.00 H new ATOM 0 HA VAL A 91 -2.646 3.904 7.872 1.00 0.00 H new ATOM 0 HB VAL A 91 -3.232 5.389 6.632 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.321 6.950 5.856 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -1.076 6.262 7.478 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -0.207 5.581 6.082 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -2.669 6.030 4.326 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -1.760 4.505 4.193 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -3.509 4.473 4.520 1.00 0.00 H new ATOM 976 N PRO A 92 -3.922 1.982 6.850 1.00 0.00 N ATOM 977 CA PRO A 92 -4.559 0.809 6.288 1.00 0.00 C ATOM 978 C PRO A 92 -5.219 1.185 4.986 1.00 0.00 C ATOM 979 O PRO A 92 -5.694 2.315 4.830 1.00 0.00 O ATOM 980 CB PRO A 92 -5.631 0.386 7.260 1.00 0.00 C ATOM 981 CG PRO A 92 -5.982 1.683 7.992 1.00 0.00 C ATOM 982 CD PRO A 92 -4.710 2.534 7.938 1.00 0.00 C ATOM 0 HA PRO A 92 -3.834 0.013 6.115 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -6.497 -0.032 6.746 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -5.270 -0.378 7.948 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -6.817 2.193 7.511 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -6.280 1.485 9.022 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -4.946 3.583 7.759 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -4.165 2.487 8.881 1.00 0.00 H new ATOM 990 N LEU A 93 -5.332 0.218 4.087 1.00 0.00 N ATOM 991 CA LEU A 93 -5.994 0.441 2.833 1.00 0.00 C ATOM 992 C LEU A 93 -7.484 0.186 2.968 1.00 0.00 C ATOM 993 O LEU A 93 -8.244 1.143 2.861 1.00 0.00 O ATOM 994 CB LEU A 93 -5.301 -0.303 1.686 1.00 0.00 C ATOM 995 CG LEU A 93 -5.737 0.176 0.287 1.00 0.00 C ATOM 996 CD1 LEU A 93 -5.878 1.697 0.167 1.00 0.00 C ATOM 997 CD2 LEU A 93 -4.686 -0.285 -0.721 1.00 0.00 C ATOM 0 H LEU A 93 -4.969 -0.727 4.214 1.00 0.00 H new ATOM 0 HA LEU A 93 -5.905 1.491 2.555 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -4.222 -0.180 1.783 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -5.509 -1.369 1.777 1.00 0.00 H new ATOM 0 HG LEU A 93 -6.722 -0.250 0.097 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -6.187 1.955 -0.846 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -6.627 2.050 0.876 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -4.920 2.170 0.385 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -4.972 0.042 -1.721 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -3.719 0.146 -0.461 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -4.616 -1.373 -0.702 1.00 0.00 H new ATOM 1009 N THR A 94 -7.882 -1.044 3.288 1.00 0.00 N ATOM 1010 CA THR A 94 -9.275 -1.520 3.269 1.00 0.00 C ATOM 1011 C THR A 94 -10.178 -0.906 4.354 1.00 0.00 C ATOM 1012 O THR A 94 -11.346 -1.275 4.503 1.00 0.00 O ATOM 1013 CB THR A 94 -9.232 -3.061 3.317 1.00 0.00 C ATOM 1014 OG1 THR A 94 -10.412 -3.656 2.818 1.00 0.00 O ATOM 1015 CG2 THR A 94 -8.936 -3.627 4.710 1.00 0.00 C ATOM 0 H THR A 94 -7.224 -1.767 3.579 1.00 0.00 H new ATOM 0 HA THR A 94 -9.751 -1.180 2.349 1.00 0.00 H new ATOM 0 HB THR A 94 -8.398 -3.320 2.664 1.00 0.00 H new ATOM 0 HG1 THR A 94 -10.695 -3.189 2.004 1.00 0.00 H new ATOM 0 HG21 THR A 94 -8.922 -4.716 4.665 1.00 0.00 H new ATOM 0 HG22 THR A 94 -7.966 -3.265 5.051 1.00 0.00 H new ATOM 0 HG23 THR A 94 -9.709 -3.303 5.406 1.00 0.00 H new ATOM 1023 N THR A 95 -9.629 0.021 5.125 1.00 0.00 N ATOM 1024 CA THR A 95 -10.142 0.475 6.396 1.00 0.00 C ATOM 1025 C THR A 95 -10.259 1.995 6.330 1.00 0.00 C ATOM 1026 O THR A 95 -11.337 2.550 6.546 1.00 0.00 O ATOM 1027 CB THR A 95 -9.129 0.040 7.451 1.00 0.00 C ATOM 1028 OG1 THR A 95 -8.688 -1.291 7.260 1.00 0.00 O ATOM 1029 CG2 THR A 95 -9.571 0.241 8.896 1.00 0.00 C ATOM 0 H THR A 95 -8.767 0.498 4.861 1.00 0.00 H new ATOM 0 HA THR A 95 -11.122 0.063 6.637 1.00 0.00 H new ATOM 0 HB THR A 95 -8.293 0.722 7.293 1.00 0.00 H new ATOM 0 HG1 THR A 95 -8.040 -1.524 7.957 1.00 0.00 H new ATOM 0 HG21 THR A 95 -8.783 -0.098 9.568 1.00 0.00 H new ATOM 0 HG22 THR A 95 -9.768 1.298 9.072 1.00 0.00 H new ATOM 0 HG23 THR A 95 -10.479 -0.333 9.082 1.00 0.00 H new ATOM 1037 N MET A 96 -9.152 2.685 6.016 1.00 0.00 N ATOM 1038 CA MET A 96 -9.188 4.116 5.815 1.00 0.00 C ATOM 1039 C MET A 96 -10.032 4.412 4.581 1.00 0.00 C ATOM 1040 O MET A 96 -10.746 5.409 4.558 1.00 0.00 O ATOM 1041 CB MET A 96 -7.766 4.653 5.644 1.00 0.00 C ATOM 1042 CG MET A 96 -7.765 6.176 5.585 1.00 0.00 C ATOM 1043 SD MET A 96 -8.383 7.010 7.064 1.00 0.00 S ATOM 1044 CE MET A 96 -7.012 6.659 8.177 1.00 0.00 C ATOM 0 H MET A 96 -8.230 2.264 5.899 1.00 0.00 H new ATOM 0 HA MET A 96 -9.631 4.608 6.681 1.00 0.00 H new ATOM 0 HB2 MET A 96 -7.143 4.316 6.473 1.00 0.00 H new ATOM 0 HB3 MET A 96 -7.327 4.249 4.732 1.00 0.00 H new ATOM 0 HG2 MET A 96 -6.746 6.515 5.397 1.00 0.00 H new ATOM 0 HG3 MET A 96 -8.368 6.490 4.733 1.00 0.00 H new ATOM 0 HE1 MET A 96 -7.016 7.377 8.997 1.00 0.00 H new ATOM 0 HE2 MET A 96 -7.117 5.650 8.577 1.00 0.00 H new ATOM 0 HE3 MET A 96 -6.071 6.737 7.632 1.00 0.00 H new ATOM 1054 N VAL A 97 -9.931 3.543 3.575 1.00 0.00 N ATOM 1055 CA VAL A 97 -10.769 3.570 2.394 1.00 0.00 C ATOM 1056 C VAL A 97 -11.863 2.513 2.532 1.00 0.00 C ATOM 1057 O VAL A 97 -11.641 1.417 3.046 1.00 0.00 O ATOM 1058 CB VAL A 97 -9.939 3.328 1.125 1.00 0.00 C ATOM 1059 CG1 VAL A 97 -10.668 3.796 -0.140 1.00 0.00 C ATOM 1060 CG2 VAL A 97 -8.595 4.051 1.182 1.00 0.00 C ATOM 0 H VAL A 97 -9.246 2.787 3.566 1.00 0.00 H new ATOM 0 HA VAL A 97 -11.226 4.555 2.304 1.00 0.00 H new ATOM 0 HB VAL A 97 -9.782 2.250 1.080 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -10.043 3.605 -1.012 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -11.607 3.252 -0.241 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -10.873 4.864 -0.068 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.037 3.855 0.266 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -8.763 5.123 1.282 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.024 3.691 2.038 1.00 0.00 H new ATOM 1070 N GLN A 98 -13.033 2.852 2.020 1.00 0.00 N ATOM 1071 CA GLN A 98 -14.150 1.982 1.747 1.00 0.00 C ATOM 1072 C GLN A 98 -13.861 1.114 0.521 1.00 0.00 C ATOM 1073 O GLN A 98 -13.414 1.622 -0.510 1.00 0.00 O ATOM 1074 CB GLN A 98 -15.341 2.917 1.520 1.00 0.00 C ATOM 1075 CG GLN A 98 -16.561 2.297 0.832 1.00 0.00 C ATOM 1076 CD GLN A 98 -16.822 2.868 -0.565 1.00 0.00 C ATOM 1077 OE1 GLN A 98 -17.918 3.339 -0.869 1.00 0.00 O ATOM 1078 NE2 GLN A 98 -15.831 2.870 -1.444 1.00 0.00 N ATOM 0 H GLN A 98 -13.236 3.819 1.767 1.00 0.00 H new ATOM 0 HA GLN A 98 -14.349 1.288 2.563 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -15.656 3.313 2.486 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -15.004 3.764 0.923 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -16.418 1.219 0.756 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -17.442 2.459 1.454 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -14.924 2.479 -1.190 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -15.975 3.262 -2.374 1.00 0.00 H new ATOM 1087 N ASP A 99 -14.222 -0.164 0.601 1.00 0.00 N ATOM 1088 CA ASP A 99 -14.262 -1.204 -0.438 1.00 0.00 C ATOM 1089 C ASP A 99 -12.898 -1.610 -0.999 1.00 0.00 C ATOM 1090 O ASP A 99 -12.739 -2.737 -1.462 1.00 0.00 O ATOM 1091 CB ASP A 99 -15.226 -0.832 -1.578 1.00 0.00 C ATOM 1092 CG ASP A 99 -15.509 -2.007 -2.527 1.00 0.00 C ATOM 1093 OD1 ASP A 99 -15.582 -3.173 -2.064 1.00 0.00 O ATOM 1094 OD2 ASP A 99 -15.663 -1.763 -3.745 1.00 0.00 O ATOM 0 H ASP A 99 -14.530 -0.545 1.496 1.00 0.00 H new ATOM 0 HA ASP A 99 -14.639 -2.086 0.080 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -16.166 -0.480 -1.152 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -14.805 -0.004 -2.148 1.00 0.00 H new ATOM 1100 N ALA A 100 -11.898 -0.731 -0.928 1.00 0.00 N ATOM 1101 CA ALA A 100 -10.530 -0.982 -1.364 1.00 0.00 C ATOM 1102 C ALA A 100 -9.936 -2.206 -0.668 1.00 0.00 C ATOM 1103 O ALA A 100 -10.377 -2.593 0.415 1.00 0.00 O ATOM 1104 CB ALA A 100 -9.699 0.248 -0.994 1.00 0.00 C ATOM 0 H ALA A 100 -12.026 0.208 -0.551 1.00 0.00 H new ATOM 0 HA ALA A 100 -10.523 -1.171 -2.437 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -8.666 0.096 -1.306 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -10.105 1.126 -1.497 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -9.734 0.399 0.085 1.00 0.00 H new ATOM 1110 N THR A 101 -8.882 -2.772 -1.248 1.00 0.00 N ATOM 1111 CA THR A 101 -8.308 -4.042 -0.815 1.00 0.00 C ATOM 1112 C THR A 101 -6.789 -3.998 -0.928 1.00 0.00 C ATOM 1113 O THR A 101 -6.237 -3.171 -1.662 1.00 0.00 O ATOM 1114 CB THR A 101 -8.903 -5.194 -1.655 1.00 0.00 C ATOM 1115 OG1 THR A 101 -8.514 -5.083 -3.013 1.00 0.00 O ATOM 1116 CG2 THR A 101 -10.435 -5.237 -1.616 1.00 0.00 C ATOM 0 H THR A 101 -8.396 -2.356 -2.042 1.00 0.00 H new ATOM 0 HA THR A 101 -8.558 -4.218 0.231 1.00 0.00 H new ATOM 0 HB THR A 101 -8.513 -6.108 -1.208 1.00 0.00 H new ATOM 0 HG1 THR A 101 -8.901 -5.823 -3.526 1.00 0.00 H new ATOM 0 HG21 THR A 101 -10.791 -6.068 -2.225 1.00 0.00 H new ATOM 0 HG22 THR A 101 -10.769 -5.372 -0.587 1.00 0.00 H new ATOM 0 HG23 THR A 101 -10.835 -4.302 -2.008 1.00 0.00 H new ATOM 1124 N ALA A 102 -6.117 -4.905 -0.218 1.00 0.00 N ATOM 1125 CA ALA A 102 -4.686 -5.117 -0.238 1.00 0.00 C ATOM 1126 C ALA A 102 -4.400 -6.598 0.026 1.00 0.00 C ATOM 1127 O ALA A 102 -3.913 -6.982 1.098 1.00 0.00 O ATOM 1128 CB ALA A 102 -4.017 -4.202 0.791 1.00 0.00 C ATOM 0 H ALA A 102 -6.593 -5.543 0.420 1.00 0.00 H new ATOM 0 HA ALA A 102 -4.271 -4.864 -1.213 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -2.939 -4.363 0.775 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -4.232 -3.162 0.547 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -4.403 -4.429 1.785 1.00 0.00 H new ATOM 1134 N HIS A 103 -4.690 -7.437 -0.960 1.00 0.00 N ATOM 1135 CA HIS A 103 -4.387 -8.859 -0.940 1.00 0.00 C ATOM 1136 C HIS A 103 -2.881 -9.026 -1.210 1.00 0.00 C ATOM 1137 O HIS A 103 -2.286 -8.260 -1.967 1.00 0.00 O ATOM 1138 CB HIS A 103 -5.269 -9.530 -2.011 1.00 0.00 C ATOM 1139 CG HIS A 103 -4.863 -10.928 -2.392 1.00 0.00 C ATOM 1140 ND1 HIS A 103 -4.794 -12.024 -1.565 1.00 0.00 N ATOM 1141 CD2 HIS A 103 -4.449 -11.320 -3.632 1.00 0.00 C ATOM 1142 CE1 HIS A 103 -4.256 -13.031 -2.271 1.00 0.00 C ATOM 1143 NE2 HIS A 103 -4.041 -12.652 -3.541 1.00 0.00 N ATOM 0 H HIS A 103 -5.155 -7.138 -1.817 1.00 0.00 H new ATOM 0 HA HIS A 103 -4.602 -9.330 0.019 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -6.297 -9.553 -1.650 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -5.260 -8.909 -2.907 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -5.097 -12.065 -0.592 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -4.439 -10.710 -4.523 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -4.028 -14.009 -1.873 1.00 0.00 H new ATOM 1152 N LEU A 104 -2.234 -10.065 -0.682 1.00 0.00 N ATOM 1153 CA LEU A 104 -0.844 -10.440 -0.991 1.00 0.00 C ATOM 1154 C LEU A 104 -0.903 -11.821 -1.616 1.00 0.00 C ATOM 1155 O LEU A 104 -1.494 -12.731 -1.035 1.00 0.00 O ATOM 1156 CB LEU A 104 0.028 -10.345 0.272 1.00 0.00 C ATOM 1157 CG LEU A 104 1.220 -11.312 0.523 1.00 0.00 C ATOM 1158 CD1 LEU A 104 0.923 -12.590 1.299 1.00 0.00 C ATOM 1159 CD2 LEU A 104 1.999 -11.742 -0.710 1.00 0.00 C ATOM 0 H LEU A 104 -2.671 -10.691 -0.006 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.369 -9.761 -1.699 1.00 0.00 H new ATOM 0 HB2 LEU A 104 0.432 -9.333 0.300 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -0.643 -10.444 1.126 1.00 0.00 H new ATOM 0 HG LEU A 104 1.820 -10.645 1.142 1.00 0.00 H new ATOM 0 HD11 LEU A 104 1.838 -13.173 1.404 1.00 0.00 H new ATOM 0 HD12 LEU A 104 0.540 -12.335 2.287 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.178 -13.177 0.762 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.805 -12.414 -0.415 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.331 -12.257 -1.401 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.420 -10.864 -1.199 1.00 0.00 H new ATOM 1171 N ASP A 105 -0.345 -11.951 -2.819 1.00 0.00 N ATOM 1172 CA ASP A 105 -0.303 -13.165 -3.613 1.00 0.00 C ATOM 1173 C ASP A 105 1.098 -13.732 -3.469 1.00 0.00 C ATOM 1174 O ASP A 105 2.036 -13.285 -4.128 1.00 0.00 O ATOM 1175 CB ASP A 105 -0.597 -12.882 -5.098 1.00 0.00 C ATOM 1176 CG ASP A 105 -0.968 -14.179 -5.817 1.00 0.00 C ATOM 1177 OD1 ASP A 105 -0.305 -15.209 -5.568 1.00 0.00 O ATOM 1178 OD2 ASP A 105 -1.929 -14.171 -6.617 1.00 0.00 O ATOM 0 H ASP A 105 0.112 -11.167 -3.285 1.00 0.00 H new ATOM 0 HA ASP A 105 -1.063 -13.864 -3.265 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -1.412 -12.163 -5.185 1.00 0.00 H new ATOM 0 HB3 ASP A 105 0.276 -12.432 -5.570 1.00 0.00 H new ATOM 1184 N VAL A 106 1.300 -14.643 -2.523 1.00 0.00 N ATOM 1185 CA VAL A 106 2.628 -15.201 -2.317 1.00 0.00 C ATOM 1186 C VAL A 106 2.955 -16.125 -3.502 1.00 0.00 C ATOM 1187 O VAL A 106 4.121 -16.368 -3.810 1.00 0.00 O ATOM 1188 CB VAL A 106 2.670 -15.917 -0.957 1.00 0.00 C ATOM 1189 CG1 VAL A 106 1.968 -17.272 -0.976 1.00 0.00 C ATOM 1190 CG2 VAL A 106 4.100 -16.090 -0.435 1.00 0.00 C ATOM 0 H VAL A 106 0.577 -15.003 -1.900 1.00 0.00 H new ATOM 0 HA VAL A 106 3.393 -14.425 -2.286 1.00 0.00 H new ATOM 0 HB VAL A 106 2.125 -15.263 -0.277 1.00 0.00 H new ATOM 0 HG11 VAL A 106 2.031 -17.728 0.012 1.00 0.00 H new ATOM 0 HG12 VAL A 106 0.921 -17.136 -1.246 1.00 0.00 H new ATOM 0 HG13 VAL A 106 2.450 -17.921 -1.707 1.00 0.00 H new ATOM 0 HG21 VAL A 106 4.077 -16.601 0.528 1.00 0.00 H new ATOM 0 HG22 VAL A 106 4.678 -16.681 -1.145 1.00 0.00 H new ATOM 0 HG23 VAL A 106 4.565 -15.111 -0.315 1.00 0.00 H new ATOM 1200 N GLY A 107 1.921 -16.647 -4.174 1.00 0.00 N ATOM 1201 CA GLY A 107 2.017 -17.661 -5.198 1.00 0.00 C ATOM 1202 C GLY A 107 2.593 -17.057 -6.470 1.00 0.00 C ATOM 1203 O GLY A 107 3.525 -17.629 -7.035 1.00 0.00 O ATOM 0 H GLY A 107 0.960 -16.353 -4.002 1.00 0.00 H new ATOM 0 HA2 GLY A 107 2.650 -18.479 -4.854 1.00 0.00 H new ATOM 0 HA3 GLY A 107 1.032 -18.083 -5.398 1.00 0.00 H new ATOM 1207 N GLN A 108 2.095 -15.892 -6.885 1.00 0.00 N ATOM 1208 CA GLN A 108 2.629 -15.131 -8.010 1.00 0.00 C ATOM 1209 C GLN A 108 3.701 -14.123 -7.594 1.00 0.00 C ATOM 1210 O GLN A 108 4.315 -13.519 -8.471 1.00 0.00 O ATOM 1211 CB GLN A 108 1.501 -14.409 -8.755 1.00 0.00 C ATOM 1212 CG GLN A 108 0.421 -15.387 -9.238 1.00 0.00 C ATOM 1213 CD GLN A 108 -0.391 -14.848 -10.412 1.00 0.00 C ATOM 1214 OE1 GLN A 108 -0.796 -15.609 -11.283 1.00 0.00 O ATOM 1215 NE2 GLN A 108 -0.668 -13.557 -10.486 1.00 0.00 N ATOM 0 H GLN A 108 1.294 -15.444 -6.439 1.00 0.00 H new ATOM 0 HA GLN A 108 3.105 -15.854 -8.672 1.00 0.00 H new ATOM 0 HB2 GLN A 108 1.050 -13.664 -8.099 1.00 0.00 H new ATOM 0 HB3 GLN A 108 1.914 -13.873 -9.609 1.00 0.00 H new ATOM 0 HG2 GLN A 108 0.893 -16.325 -9.530 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -0.252 -15.613 -8.411 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -0.332 -12.921 -9.763 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -1.217 -13.197 -11.266 1.00 0.00 H new ATOM 1224 N GLN A 109 3.937 -13.940 -6.290 1.00 0.00 N ATOM 1225 CA GLN A 109 4.763 -12.877 -5.726 1.00 0.00 C ATOM 1226 C GLN A 109 4.245 -11.506 -6.171 1.00 0.00 C ATOM 1227 O GLN A 109 4.886 -10.799 -6.948 1.00 0.00 O ATOM 1228 CB GLN A 109 6.254 -13.115 -6.029 1.00 0.00 C ATOM 1229 CG GLN A 109 6.786 -14.325 -5.260 1.00 0.00 C ATOM 1230 CD GLN A 109 8.283 -14.487 -5.491 1.00 0.00 C ATOM 1231 OE1 GLN A 109 8.753 -14.925 -6.543 1.00 0.00 O ATOM 1232 NE2 GLN A 109 9.080 -14.065 -4.533 1.00 0.00 N ATOM 0 H GLN A 109 3.542 -14.552 -5.576 1.00 0.00 H new ATOM 0 HA GLN A 109 4.683 -12.892 -4.639 1.00 0.00 H new ATOM 0 HB2 GLN A 109 6.390 -13.272 -7.099 1.00 0.00 H new ATOM 0 HB3 GLN A 109 6.829 -12.228 -5.761 1.00 0.00 H new ATOM 0 HG2 GLN A 109 6.587 -14.203 -4.195 1.00 0.00 H new ATOM 0 HG3 GLN A 109 6.263 -15.226 -5.581 1.00 0.00 H new ATOM 0 HE21 GLN A 109 8.686 -13.703 -3.664 1.00 0.00 H new ATOM 0 HE22 GLN A 109 10.092 -14.099 -4.659 1.00 0.00 H new ATOM 1241 N ARG A 110 3.077 -11.114 -5.653 1.00 0.00 N ATOM 1242 CA ARG A 110 2.438 -9.838 -5.973 1.00 0.00 C ATOM 1243 C ARG A 110 1.768 -9.237 -4.755 1.00 0.00 C ATOM 1244 O ARG A 110 1.469 -9.925 -3.774 1.00 0.00 O ATOM 1245 CB ARG A 110 1.539 -10.051 -7.204 1.00 0.00 C ATOM 1246 CG ARG A 110 0.846 -8.805 -7.774 1.00 0.00 C ATOM 1247 CD ARG A 110 -0.103 -9.165 -8.920 1.00 0.00 C ATOM 1248 NE ARG A 110 0.590 -9.501 -10.175 1.00 0.00 N ATOM 1249 CZ ARG A 110 -0.026 -9.866 -11.303 1.00 0.00 C ATOM 1250 NH1 ARG A 110 -1.311 -10.207 -11.302 1.00 0.00 N ATOM 1251 NH2 ARG A 110 0.637 -9.883 -12.448 1.00 0.00 N ATOM 0 H ARG A 110 2.545 -11.681 -4.993 1.00 0.00 H new ATOM 0 HA ARG A 110 3.168 -9.077 -6.250 1.00 0.00 H new ATOM 0 HB2 ARG A 110 2.144 -10.496 -7.994 1.00 0.00 H new ATOM 0 HB3 ARG A 110 0.771 -10.779 -6.943 1.00 0.00 H new ATOM 0 HG2 ARG A 110 0.289 -8.303 -6.983 1.00 0.00 H new ATOM 0 HG3 ARG A 110 1.598 -8.100 -8.130 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -0.720 -10.011 -8.618 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -0.777 -8.327 -9.100 1.00 0.00 H new ATOM 0 HE ARG A 110 1.609 -9.452 -10.184 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -1.842 -10.192 -10.431 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -1.766 -10.483 -12.172 1.00 0.00 H new ATOM 0 HH21 ARG A 110 1.621 -9.617 -12.471 1.00 0.00 H new ATOM 0 HH22 ARG A 110 0.164 -10.162 -13.307 1.00 0.00 H new ATOM 1265 N LEU A 111 1.574 -7.922 -4.800 1.00 0.00 N ATOM 1266 CA LEU A 111 0.853 -7.163 -3.800 1.00 0.00 C ATOM 1267 C LEU A 111 -0.304 -6.503 -4.523 1.00 0.00 C ATOM 1268 O LEU A 111 -0.106 -5.474 -5.157 1.00 0.00 O ATOM 1269 CB LEU A 111 1.802 -6.166 -3.111 1.00 0.00 C ATOM 1270 CG LEU A 111 1.272 -5.448 -1.862 1.00 0.00 C ATOM 1271 CD1 LEU A 111 1.197 -3.934 -2.054 1.00 0.00 C ATOM 1272 CD2 LEU A 111 -0.040 -5.999 -1.311 1.00 0.00 C ATOM 0 H LEU A 111 1.929 -7.343 -5.561 1.00 0.00 H new ATOM 0 HA LEU A 111 0.461 -7.787 -2.996 1.00 0.00 H new ATOM 0 HB2 LEU A 111 2.711 -6.700 -2.835 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.086 -5.409 -3.842 1.00 0.00 H new ATOM 0 HG LEU A 111 2.018 -5.662 -1.097 1.00 0.00 H new ATOM 0 HD11 LEU A 111 0.817 -3.470 -1.144 1.00 0.00 H new ATOM 0 HD12 LEU A 111 2.192 -3.545 -2.271 1.00 0.00 H new ATOM 0 HD13 LEU A 111 0.529 -3.705 -2.884 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -0.333 -5.428 -0.430 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -0.817 -5.918 -2.071 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.091 -7.046 -1.037 1.00 0.00 H new ATOM 1284 N ASN A 112 -1.471 -7.144 -4.505 1.00 0.00 N ATOM 1285 CA ASN A 112 -2.628 -6.712 -5.290 1.00 0.00 C ATOM 1286 C ASN A 112 -3.433 -5.742 -4.448 1.00 0.00 C ATOM 1287 O ASN A 112 -3.998 -6.139 -3.429 1.00 0.00 O ATOM 1288 CB ASN A 112 -3.563 -7.865 -5.682 1.00 0.00 C ATOM 1289 CG ASN A 112 -3.085 -8.665 -6.882 1.00 0.00 C ATOM 1290 OD1 ASN A 112 -3.116 -8.170 -8.005 1.00 0.00 O ATOM 1291 ND2 ASN A 112 -2.686 -9.907 -6.689 1.00 0.00 N ATOM 0 H ASN A 112 -1.642 -7.979 -3.945 1.00 0.00 H new ATOM 0 HA ASN A 112 -2.245 -6.266 -6.208 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -3.672 -8.536 -4.830 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -4.552 -7.460 -5.898 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -2.395 -10.478 -7.482 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -2.669 -10.296 -5.746 1.00 0.00 H new ATOM 1298 N LEU A 113 -3.504 -4.492 -4.877 1.00 0.00 N ATOM 1299 CA LEU A 113 -4.353 -3.481 -4.277 1.00 0.00 C ATOM 1300 C LEU A 113 -5.550 -3.231 -5.205 1.00 0.00 C ATOM 1301 O LEU A 113 -5.445 -3.399 -6.423 1.00 0.00 O ATOM 1302 CB LEU A 113 -3.543 -2.190 -4.067 1.00 0.00 C ATOM 1303 CG LEU A 113 -2.161 -2.346 -3.391 1.00 0.00 C ATOM 1304 CD1 LEU A 113 -1.402 -1.013 -3.417 1.00 0.00 C ATOM 1305 CD2 LEU A 113 -2.247 -2.855 -1.954 1.00 0.00 C ATOM 0 H LEU A 113 -2.961 -4.147 -5.669 1.00 0.00 H new ATOM 0 HA LEU A 113 -4.719 -3.817 -3.307 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -3.397 -1.717 -5.038 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -4.142 -1.505 -3.466 1.00 0.00 H new ATOM 0 HG LEU A 113 -1.623 -3.099 -3.967 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.431 -1.138 -2.938 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -1.259 -0.696 -4.450 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -1.976 -0.257 -2.882 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -1.243 -2.942 -1.538 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -2.829 -2.155 -1.354 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -2.730 -3.832 -1.942 1.00 0.00 H new ATOM 1317 N THR A 114 -6.649 -2.722 -4.661 1.00 0.00 N ATOM 1318 CA THR A 114 -7.747 -2.123 -5.420 1.00 0.00 C ATOM 1319 C THR A 114 -8.176 -0.870 -4.667 1.00 0.00 C ATOM 1320 O THR A 114 -8.120 -0.871 -3.438 1.00 0.00 O ATOM 1321 CB THR A 114 -8.919 -3.108 -5.545 1.00 0.00 C ATOM 1322 OG1 THR A 114 -8.484 -4.334 -6.113 1.00 0.00 O ATOM 1323 CG2 THR A 114 -10.062 -2.543 -6.391 1.00 0.00 C ATOM 0 H THR A 114 -6.808 -2.713 -3.654 1.00 0.00 H new ATOM 0 HA THR A 114 -7.427 -1.875 -6.432 1.00 0.00 H new ATOM 0 HB THR A 114 -9.293 -3.278 -4.535 1.00 0.00 H new ATOM 0 HG1 THR A 114 -9.243 -4.949 -6.184 1.00 0.00 H new ATOM 0 HG21 THR A 114 -10.867 -3.275 -6.450 1.00 0.00 H new ATOM 0 HG22 THR A 114 -10.437 -1.628 -5.932 1.00 0.00 H new ATOM 0 HG23 THR A 114 -9.697 -2.322 -7.394 1.00 0.00 H new ATOM 1331 N ILE A 115 -8.589 0.187 -5.374 1.00 0.00 N ATOM 1332 CA ILE A 115 -9.143 1.413 -4.809 1.00 0.00 C ATOM 1333 C ILE A 115 -10.240 1.906 -5.764 1.00 0.00 C ATOM 1334 O ILE A 115 -9.965 2.043 -6.961 1.00 0.00 O ATOM 1335 CB ILE A 115 -8.038 2.482 -4.619 1.00 0.00 C ATOM 1336 CG1 ILE A 115 -6.933 1.948 -3.688 1.00 0.00 C ATOM 1337 CG2 ILE A 115 -8.612 3.784 -4.030 1.00 0.00 C ATOM 1338 CD1 ILE A 115 -5.855 2.967 -3.349 1.00 0.00 C ATOM 0 H ILE A 115 -8.543 0.209 -6.393 1.00 0.00 H new ATOM 0 HA ILE A 115 -9.565 1.223 -3.822 1.00 0.00 H new ATOM 0 HB ILE A 115 -7.619 2.699 -5.601 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -7.391 1.599 -2.762 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -6.465 1.083 -4.158 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -7.811 4.513 -3.909 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -9.369 4.185 -4.704 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -9.063 3.577 -3.060 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -5.117 2.510 -2.690 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -5.367 3.299 -4.265 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -6.308 3.823 -2.848 1.00 0.00 H new ATOM 1350 N PRO A 116 -11.458 2.200 -5.274 1.00 0.00 N ATOM 1351 CA PRO A 116 -12.470 2.850 -6.089 1.00 0.00 C ATOM 1352 C PRO A 116 -12.051 4.276 -6.454 1.00 0.00 C ATOM 1353 O PRO A 116 -11.474 4.995 -5.634 1.00 0.00 O ATOM 1354 CB PRO A 116 -13.762 2.830 -5.272 1.00 0.00 C ATOM 1355 CG PRO A 116 -13.377 2.429 -3.848 1.00 0.00 C ATOM 1356 CD PRO A 116 -11.920 1.978 -3.911 1.00 0.00 C ATOM 0 HA PRO A 116 -12.608 2.329 -7.036 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -14.241 3.809 -5.282 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -14.475 2.122 -5.694 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -13.495 3.268 -3.162 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -14.018 1.626 -3.483 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -11.312 2.541 -3.203 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -11.831 0.926 -3.641 1.00 0.00 H new ATOM 1364 N GLN A 117 -12.419 4.729 -7.656 1.00 0.00 N ATOM 1365 CA GLN A 117 -12.076 6.050 -8.179 1.00 0.00 C ATOM 1366 C GLN A 117 -12.533 7.186 -7.264 1.00 0.00 C ATOM 1367 O GLN A 117 -11.925 8.257 -7.285 1.00 0.00 O ATOM 1368 CB GLN A 117 -12.695 6.220 -9.573 1.00 0.00 C ATOM 1369 CG GLN A 117 -11.871 5.538 -10.670 1.00 0.00 C ATOM 1370 CD GLN A 117 -10.681 6.384 -11.123 1.00 0.00 C ATOM 1371 OE1 GLN A 117 -10.765 7.131 -12.097 1.00 0.00 O ATOM 1372 NE2 GLN A 117 -9.536 6.271 -10.475 1.00 0.00 N ATOM 0 H GLN A 117 -12.976 4.173 -8.305 1.00 0.00 H new ATOM 0 HA GLN A 117 -10.989 6.108 -8.235 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -13.704 5.807 -9.572 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -12.786 7.282 -9.799 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -11.510 4.577 -10.304 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -12.513 5.332 -11.527 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -9.466 5.652 -9.667 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -8.722 6.803 -10.782 1.00 0.00 H new ATOM 1381 N ALA A 118 -13.544 6.938 -6.426 1.00 0.00 N ATOM 1382 CA ALA A 118 -14.039 7.855 -5.409 1.00 0.00 C ATOM 1383 C ALA A 118 -12.911 8.443 -4.550 1.00 0.00 C ATOM 1384 O ALA A 118 -13.002 9.605 -4.162 1.00 0.00 O ATOM 1385 CB ALA A 118 -15.055 7.120 -4.524 1.00 0.00 C ATOM 0 H ALA A 118 -14.057 6.056 -6.443 1.00 0.00 H new ATOM 0 HA ALA A 118 -14.516 8.694 -5.915 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -15.431 7.800 -3.759 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -15.885 6.769 -5.137 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -14.572 6.268 -4.046 1.00 0.00 H new ATOM 1391 N PHE A 119 -11.840 7.688 -4.288 1.00 0.00 N ATOM 1392 CA PHE A 119 -10.754 8.123 -3.421 1.00 0.00 C ATOM 1393 C PHE A 119 -9.420 8.052 -4.151 1.00 0.00 C ATOM 1394 O PHE A 119 -8.439 7.614 -3.570 1.00 0.00 O ATOM 1395 CB PHE A 119 -10.723 7.305 -2.121 1.00 0.00 C ATOM 1396 CG PHE A 119 -12.056 7.206 -1.421 1.00 0.00 C ATOM 1397 CD1 PHE A 119 -12.504 8.197 -0.530 1.00 0.00 C ATOM 1398 CD2 PHE A 119 -12.850 6.079 -1.659 1.00 0.00 C ATOM 1399 CE1 PHE A 119 -13.749 8.070 0.103 1.00 0.00 C ATOM 1400 CE2 PHE A 119 -14.065 5.927 -0.989 1.00 0.00 C ATOM 1401 CZ PHE A 119 -14.539 6.939 -0.141 1.00 0.00 C ATOM 0 H PHE A 119 -11.706 6.754 -4.676 1.00 0.00 H new ATOM 0 HA PHE A 119 -10.933 9.164 -3.150 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -10.368 6.299 -2.346 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -10.000 7.753 -1.440 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -11.886 9.060 -0.332 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -12.523 5.327 -2.361 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -14.097 8.840 0.775 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -14.644 5.025 -1.124 1.00 0.00 H new ATOM 0 HZ PHE A 119 -15.510 6.847 0.322 1.00 0.00 H new ATOM 1411 N MET A 120 -9.319 8.481 -5.407 1.00 0.00 N ATOM 1412 CA MET A 120 -8.064 8.396 -6.148 1.00 0.00 C ATOM 1413 C MET A 120 -7.644 9.794 -6.618 1.00 0.00 C ATOM 1414 O MET A 120 -8.468 10.600 -7.055 1.00 0.00 O ATOM 1415 CB MET A 120 -8.235 7.430 -7.321 1.00 0.00 C ATOM 1416 CG MET A 120 -8.230 5.985 -6.812 1.00 0.00 C ATOM 1417 SD MET A 120 -8.049 4.721 -8.091 1.00 0.00 S ATOM 1418 CE MET A 120 -6.283 4.890 -8.485 1.00 0.00 C ATOM 0 H MET A 120 -10.091 8.891 -5.932 1.00 0.00 H new ATOM 0 HA MET A 120 -7.272 8.012 -5.505 1.00 0.00 H new ATOM 0 HB2 MET A 120 -9.170 7.638 -7.841 1.00 0.00 H new ATOM 0 HB3 MET A 120 -7.430 7.574 -8.042 1.00 0.00 H new ATOM 0 HG2 MET A 120 -7.418 5.872 -6.094 1.00 0.00 H new ATOM 0 HG3 MET A 120 -9.160 5.803 -6.273 1.00 0.00 H new ATOM 0 HE1 MET A 120 -5.993 4.117 -9.196 1.00 0.00 H new ATOM 0 HE2 MET A 120 -6.100 5.872 -8.922 1.00 0.00 H new ATOM 0 HE3 MET A 120 -5.695 4.783 -7.573 1.00 0.00 H new ATOM 1428 N SER A 121 -6.372 10.134 -6.416 1.00 0.00 N ATOM 1429 CA SER A 121 -5.649 11.320 -6.855 1.00 0.00 C ATOM 1430 C SER A 121 -4.158 11.064 -6.632 1.00 0.00 C ATOM 1431 O SER A 121 -3.801 10.348 -5.701 1.00 0.00 O ATOM 1432 CB SER A 121 -5.990 12.532 -6.007 1.00 0.00 C ATOM 1433 OG SER A 121 -7.356 12.859 -6.086 1.00 0.00 O ATOM 0 H SER A 121 -5.760 9.516 -5.883 1.00 0.00 H new ATOM 0 HA SER A 121 -5.912 11.510 -7.896 1.00 0.00 H new ATOM 0 HB2 SER A 121 -5.723 12.335 -4.969 1.00 0.00 H new ATOM 0 HB3 SER A 121 -5.393 13.384 -6.334 1.00 0.00 H new ATOM 0 HG SER A 121 -7.815 12.210 -6.659 1.00 0.00 H new ATOM 1439 N ASN A 122 -3.288 11.737 -7.379 1.00 0.00 N ATOM 1440 CA ASN A 122 -1.868 11.825 -7.036 1.00 0.00 C ATOM 1441 C ASN A 122 -1.643 12.805 -5.901 1.00 0.00 C ATOM 1442 O ASN A 122 -0.722 12.635 -5.106 1.00 0.00 O ATOM 1443 CB ASN A 122 -1.068 12.382 -8.207 1.00 0.00 C ATOM 1444 CG ASN A 122 -1.141 11.470 -9.417 1.00 0.00 C ATOM 1445 OD1 ASN A 122 -1.624 11.885 -10.467 1.00 0.00 O ATOM 1446 ND2 ASN A 122 -0.695 10.233 -9.284 1.00 0.00 N ATOM 0 H ASN A 122 -3.542 12.234 -8.233 1.00 0.00 H new ATOM 0 HA ASN A 122 -1.554 10.817 -6.766 1.00 0.00 H new ATOM 0 HB2 ASN A 122 -1.448 13.369 -8.471 1.00 0.00 H new ATOM 0 HB3 ASN A 122 -0.027 12.510 -7.909 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -0.745 9.585 -10.070 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -0.300 9.926 -8.395 1.00 0.00 H new ATOM 1453 N ARG A 123 -2.425 13.891 -5.880 1.00 0.00 N ATOM 1454 CA ARG A 123 -2.258 14.960 -4.911 1.00 0.00 C ATOM 1455 C ARG A 123 -2.423 14.405 -3.500 1.00 0.00 C ATOM 1456 O ARG A 123 -3.555 14.102 -3.096 1.00 0.00 O ATOM 1457 CB ARG A 123 -3.182 16.157 -5.194 1.00 0.00 C ATOM 1458 CG ARG A 123 -4.674 15.908 -5.470 1.00 0.00 C ATOM 1459 CD ARG A 123 -5.107 15.894 -6.942 1.00 0.00 C ATOM 1460 NE ARG A 123 -5.264 17.258 -7.462 1.00 0.00 N ATOM 1461 CZ ARG A 123 -6.188 17.705 -8.319 1.00 0.00 C ATOM 1462 NH1 ARG A 123 -7.037 16.875 -8.912 1.00 0.00 N ATOM 1463 NH2 ARG A 123 -6.274 19.007 -8.544 1.00 0.00 N ATOM 0 H ARG A 123 -3.189 14.045 -6.538 1.00 0.00 H new ATOM 0 HA ARG A 123 -1.246 15.355 -5.002 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -3.115 16.831 -4.340 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -2.774 16.689 -6.053 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -4.948 14.951 -5.025 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -5.249 16.676 -4.953 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -4.367 15.358 -7.536 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -6.048 15.353 -7.042 1.00 0.00 H new ATOM 0 HE ARG A 123 -4.588 17.946 -7.130 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -6.992 15.875 -8.717 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -7.734 17.237 -9.562 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -5.642 19.650 -8.067 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -6.972 19.367 -9.194 1.00 0.00 H new ATOM 1477 N ALA A 124 -1.324 14.277 -2.759 1.00 0.00 N ATOM 1478 CA ALA A 124 -1.349 13.944 -1.351 1.00 0.00 C ATOM 1479 C ALA A 124 -1.088 15.203 -0.525 1.00 0.00 C ATOM 1480 O ALA A 124 -0.816 16.289 -1.042 1.00 0.00 O ATOM 1481 CB ALA A 124 -0.336 12.828 -1.063 1.00 0.00 C ATOM 0 H ALA A 124 -0.383 14.405 -3.132 1.00 0.00 H new ATOM 0 HA ALA A 124 -2.331 13.566 -1.068 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -0.359 12.581 -0.002 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -0.593 11.944 -1.647 1.00 0.00 H new ATOM 0 HB3 ALA A 124 0.664 13.165 -1.336 1.00 0.00 H new ATOM 1487 N ARG A 125 -1.185 15.056 0.791 1.00 0.00 N ATOM 1488 CA ARG A 125 -0.549 15.967 1.725 1.00 0.00 C ATOM 1489 C ARG A 125 0.913 15.545 1.792 1.00 0.00 C ATOM 1490 O ARG A 125 1.208 14.497 2.362 1.00 0.00 O ATOM 1491 CB ARG A 125 -1.247 15.866 3.092 1.00 0.00 C ATOM 1492 CG ARG A 125 -2.298 16.967 3.284 1.00 0.00 C ATOM 1493 CD ARG A 125 -1.585 18.300 3.560 1.00 0.00 C ATOM 1494 NE ARG A 125 -2.446 19.267 4.248 1.00 0.00 N ATOM 1495 CZ ARG A 125 -2.021 20.389 4.837 1.00 0.00 C ATOM 1496 NH1 ARG A 125 -0.751 20.769 4.762 1.00 0.00 N ATOM 1497 NH2 ARG A 125 -2.896 21.134 5.496 1.00 0.00 N ATOM 0 H ARG A 125 -1.707 14.302 1.237 1.00 0.00 H new ATOM 0 HA ARG A 125 -0.622 17.009 1.414 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -1.723 14.890 3.184 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -0.502 15.934 3.885 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -2.921 17.051 2.394 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -2.959 16.715 4.113 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -0.697 18.115 4.165 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -1.245 18.728 2.617 1.00 0.00 H new ATOM 0 HE ARG A 125 -3.446 19.068 4.280 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -0.078 20.201 4.247 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -0.448 21.629 5.219 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -3.874 20.848 5.547 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -2.592 21.994 5.953 1.00 0.00 H new ATOM 1511 N GLY A 126 1.821 16.322 1.208 1.00 0.00 N ATOM 1512 CA GLY A 126 3.229 15.955 1.136 1.00 0.00 C ATOM 1513 C GLY A 126 3.464 14.877 0.090 1.00 0.00 C ATOM 1514 O GLY A 126 2.528 14.354 -0.520 1.00 0.00 O ATOM 0 H GLY A 126 1.602 17.219 0.774 1.00 0.00 H new ATOM 0 HA2 GLY A 126 3.825 16.835 0.895 1.00 0.00 H new ATOM 0 HA3 GLY A 126 3.565 15.600 2.110 1.00 0.00 H new ATOM 1518 N TYR A 127 4.732 14.565 -0.145 1.00 0.00 N ATOM 1519 CA TYR A 127 5.177 13.550 -1.087 1.00 0.00 C ATOM 1520 C TYR A 127 6.540 13.029 -0.594 1.00 0.00 C ATOM 1521 O TYR A 127 7.382 13.817 -0.152 1.00 0.00 O ATOM 1522 CB TYR A 127 5.224 14.156 -2.510 1.00 0.00 C ATOM 1523 CG TYR A 127 6.548 13.958 -3.206 1.00 0.00 C ATOM 1524 CD1 TYR A 127 6.975 12.646 -3.445 1.00 0.00 C ATOM 1525 CD2 TYR A 127 7.434 15.032 -3.424 1.00 0.00 C ATOM 1526 CE1 TYR A 127 8.299 12.391 -3.781 1.00 0.00 C ATOM 1527 CE2 TYR A 127 8.728 14.790 -3.910 1.00 0.00 C ATOM 1528 CZ TYR A 127 9.171 13.459 -4.078 1.00 0.00 C ATOM 1529 OH TYR A 127 10.432 13.234 -4.522 1.00 0.00 O ATOM 0 H TYR A 127 5.505 15.029 0.333 1.00 0.00 H new ATOM 0 HA TYR A 127 4.491 12.705 -1.141 1.00 0.00 H new ATOM 0 HB2 TYR A 127 4.435 13.707 -3.113 1.00 0.00 H new ATOM 0 HB3 TYR A 127 5.011 15.223 -2.449 1.00 0.00 H new ATOM 0 HD1 TYR A 127 6.273 11.829 -3.368 1.00 0.00 H new ATOM 0 HD2 TYR A 127 7.117 16.043 -3.217 1.00 0.00 H new ATOM 0 HE1 TYR A 127 8.661 11.374 -3.815 1.00 0.00 H new ATOM 0 HE2 TYR A 127 9.381 15.615 -4.154 1.00 0.00 H new ATOM 0 HH TYR A 127 10.883 14.091 -4.674 1.00 0.00 H new ATOM 1539 N ILE A 128 6.734 11.708 -0.610 1.00 0.00 N ATOM 1540 CA ILE A 128 7.878 11.008 -0.041 1.00 0.00 C ATOM 1541 C ILE A 128 8.243 9.928 -1.061 1.00 0.00 C ATOM 1542 O ILE A 128 7.400 9.070 -1.333 1.00 0.00 O ATOM 1543 CB ILE A 128 7.554 10.439 1.362 1.00 0.00 C ATOM 1544 CG1 ILE A 128 7.267 11.590 2.352 1.00 0.00 C ATOM 1545 CG2 ILE A 128 8.714 9.598 1.924 1.00 0.00 C ATOM 1546 CD1 ILE A 128 5.809 12.025 2.390 1.00 0.00 C ATOM 0 H ILE A 128 6.064 11.072 -1.041 1.00 0.00 H new ATOM 0 HA ILE A 128 8.725 11.673 0.128 1.00 0.00 H new ATOM 0 HB ILE A 128 6.678 9.801 1.250 1.00 0.00 H new ATOM 0 HG12 ILE A 128 7.569 11.279 3.352 1.00 0.00 H new ATOM 0 HG13 ILE A 128 7.884 12.448 2.085 1.00 0.00 H new ATOM 0 HG21 ILE A 128 8.444 9.218 2.910 1.00 0.00 H new ATOM 0 HG22 ILE A 128 8.914 8.761 1.255 1.00 0.00 H new ATOM 0 HG23 ILE A 128 9.607 10.218 2.006 1.00 0.00 H new ATOM 0 HD11 ILE A 128 5.690 12.836 3.108 1.00 0.00 H new ATOM 0 HD12 ILE A 128 5.506 12.369 1.401 1.00 0.00 H new ATOM 0 HD13 ILE A 128 5.185 11.182 2.688 1.00 0.00 H new ATOM 1558 N PRO A 129 9.431 9.997 -1.683 1.00 0.00 N ATOM 1559 CA PRO A 129 9.849 9.037 -2.690 1.00 0.00 C ATOM 1560 C PRO A 129 10.086 7.661 -2.057 1.00 0.00 C ATOM 1561 O PRO A 129 10.254 7.562 -0.839 1.00 0.00 O ATOM 1562 CB PRO A 129 11.121 9.628 -3.314 1.00 0.00 C ATOM 1563 CG PRO A 129 11.635 10.674 -2.330 1.00 0.00 C ATOM 1564 CD PRO A 129 10.474 10.957 -1.389 1.00 0.00 C ATOM 0 HA PRO A 129 9.089 8.875 -3.454 1.00 0.00 H new ATOM 0 HB2 PRO A 129 11.868 8.852 -3.482 1.00 0.00 H new ATOM 0 HB3 PRO A 129 10.906 10.078 -4.283 1.00 0.00 H new ATOM 0 HG2 PRO A 129 12.502 10.304 -1.782 1.00 0.00 H new ATOM 0 HG3 PRO A 129 11.948 11.580 -2.849 1.00 0.00 H new ATOM 0 HD2 PRO A 129 10.793 10.871 -0.350 1.00 0.00 H new ATOM 0 HD3 PRO A 129 10.108 11.975 -1.527 1.00 0.00 H new ATOM 1572 N PRO A 130 10.176 6.586 -2.857 1.00 0.00 N ATOM 1573 CA PRO A 130 10.464 5.249 -2.352 1.00 0.00 C ATOM 1574 C PRO A 130 11.904 5.107 -1.825 1.00 0.00 C ATOM 1575 O PRO A 130 12.278 4.021 -1.383 1.00 0.00 O ATOM 1576 CB PRO A 130 10.153 4.297 -3.510 1.00 0.00 C ATOM 1577 CG PRO A 130 10.429 5.155 -4.740 1.00 0.00 C ATOM 1578 CD PRO A 130 9.999 6.554 -4.302 1.00 0.00 C ATOM 0 HA PRO A 130 9.852 5.016 -1.481 1.00 0.00 H new ATOM 0 HB2 PRO A 130 10.787 3.410 -3.485 1.00 0.00 H new ATOM 0 HB3 PRO A 130 9.120 3.951 -3.482 1.00 0.00 H new ATOM 0 HG2 PRO A 130 11.482 5.128 -5.020 1.00 0.00 H new ATOM 0 HG3 PRO A 130 9.860 4.812 -5.604 1.00 0.00 H new ATOM 0 HD2 PRO A 130 10.604 7.320 -4.788 1.00 0.00 H new ATOM 0 HD3 PRO A 130 8.961 6.748 -4.574 1.00 0.00 H new ATOM 1586 N GLU A 131 12.722 6.161 -1.862 1.00 0.00 N ATOM 1587 CA GLU A 131 14.005 6.220 -1.174 1.00 0.00 C ATOM 1588 C GLU A 131 13.795 6.479 0.317 1.00 0.00 C ATOM 1589 O GLU A 131 14.286 5.753 1.174 1.00 0.00 O ATOM 1590 CB GLU A 131 14.890 7.319 -1.804 1.00 0.00 C ATOM 1591 CG GLU A 131 16.304 6.806 -2.091 1.00 0.00 C ATOM 1592 CD GLU A 131 16.327 5.946 -3.353 1.00 0.00 C ATOM 1593 OE1 GLU A 131 16.866 6.391 -4.389 1.00 0.00 O ATOM 1594 OE2 GLU A 131 15.748 4.833 -3.345 1.00 0.00 O ATOM 0 H GLU A 131 12.503 7.011 -2.382 1.00 0.00 H new ATOM 0 HA GLU A 131 14.513 5.262 -1.283 1.00 0.00 H new ATOM 0 HB2 GLU A 131 14.434 7.668 -2.730 1.00 0.00 H new ATOM 0 HB3 GLU A 131 14.942 8.175 -1.132 1.00 0.00 H new ATOM 0 HG2 GLU A 131 16.984 7.650 -2.209 1.00 0.00 H new ATOM 0 HG3 GLU A 131 16.663 6.223 -1.243 1.00 0.00 H new ATOM 1602 N LEU A 132 13.056 7.539 0.631 1.00 0.00 N ATOM 1603 CA LEU A 132 12.998 8.142 1.964 1.00 0.00 C ATOM 1604 C LEU A 132 12.132 7.365 2.955 1.00 0.00 C ATOM 1605 O LEU A 132 12.058 7.744 4.123 1.00 0.00 O ATOM 1606 CB LEU A 132 12.515 9.597 1.855 1.00 0.00 C ATOM 1607 CG LEU A 132 13.598 10.591 1.394 1.00 0.00 C ATOM 1608 CD1 LEU A 132 13.019 12.006 1.336 1.00 0.00 C ATOM 1609 CD2 LEU A 132 14.782 10.643 2.367 1.00 0.00 C ATOM 0 H LEU A 132 12.465 8.016 -0.050 1.00 0.00 H new ATOM 0 HA LEU A 132 14.011 8.110 2.365 1.00 0.00 H new ATOM 0 HB2 LEU A 132 11.679 9.639 1.157 1.00 0.00 H new ATOM 0 HB3 LEU A 132 12.136 9.915 2.826 1.00 0.00 H new ATOM 0 HG LEU A 132 13.936 10.249 0.416 1.00 0.00 H new ATOM 0 HD11 LEU A 132 13.791 12.702 1.009 1.00 0.00 H new ATOM 0 HD12 LEU A 132 12.187 12.030 0.632 1.00 0.00 H new ATOM 0 HD13 LEU A 132 12.665 12.295 2.326 1.00 0.00 H new ATOM 0 HD21 LEU A 132 15.521 11.356 2.003 1.00 0.00 H new ATOM 0 HD22 LEU A 132 14.431 10.955 3.351 1.00 0.00 H new ATOM 0 HD23 LEU A 132 15.236 9.655 2.440 1.00 0.00 H new ATOM 1621 N TRP A 133 11.493 6.291 2.513 1.00 0.00 N ATOM 1622 CA TRP A 133 10.702 5.389 3.342 1.00 0.00 C ATOM 1623 C TRP A 133 11.362 4.018 3.504 1.00 0.00 C ATOM 1624 O TRP A 133 10.769 3.181 4.177 1.00 0.00 O ATOM 1625 CB TRP A 133 9.293 5.305 2.757 1.00 0.00 C ATOM 1626 CG TRP A 133 9.023 4.226 1.755 1.00 0.00 C ATOM 1627 CD1 TRP A 133 9.831 3.798 0.760 1.00 0.00 C ATOM 1628 CD2 TRP A 133 7.872 3.349 1.724 1.00 0.00 C ATOM 1629 NE1 TRP A 133 9.223 2.755 0.084 1.00 0.00 N ATOM 1630 CE2 TRP A 133 8.001 2.441 0.640 1.00 0.00 C ATOM 1631 CE3 TRP A 133 6.729 3.253 2.533 1.00 0.00 C ATOM 1632 CZ2 TRP A 133 7.020 1.480 0.358 1.00 0.00 C ATOM 1633 CZ3 TRP A 133 5.729 2.299 2.251 1.00 0.00 C ATOM 1634 CH2 TRP A 133 5.879 1.410 1.171 1.00 0.00 C ATOM 0 H TRP A 133 11.511 6.013 1.532 1.00 0.00 H new ATOM 0 HA TRP A 133 10.640 5.787 4.355 1.00 0.00 H new ATOM 0 HB2 TRP A 133 8.593 5.180 3.583 1.00 0.00 H new ATOM 0 HB3 TRP A 133 9.066 6.263 2.289 1.00 0.00 H new ATOM 0 HD1 TRP A 133 10.803 4.208 0.528 1.00 0.00 H new ATOM 0 HE1 TRP A 133 9.627 2.279 -0.723 1.00 0.00 H new ATOM 0 HE3 TRP A 133 6.614 3.915 3.378 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 7.141 0.802 -0.474 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 4.844 2.251 2.867 1.00 0.00 H new ATOM 0 HH2 TRP A 133 5.116 0.674 0.968 1.00 0.00 H new ATOM 1645 N ASP A 134 12.525 3.792 2.870 1.00 0.00 N ATOM 1646 CA ASP A 134 13.159 2.500 2.576 1.00 0.00 C ATOM 1647 C ASP A 134 12.876 1.416 3.626 1.00 0.00 C ATOM 1648 O ASP A 134 13.557 1.370 4.655 1.00 0.00 O ATOM 1649 CB ASP A 134 14.662 2.645 2.266 1.00 0.00 C ATOM 1650 CG ASP A 134 15.565 3.173 3.380 1.00 0.00 C ATOM 1651 OD1 ASP A 134 15.230 4.164 4.064 1.00 0.00 O ATOM 1652 OD2 ASP A 134 16.678 2.619 3.532 1.00 0.00 O ATOM 0 H ASP A 134 13.088 4.569 2.524 1.00 0.00 H new ATOM 0 HA ASP A 134 12.680 2.143 1.665 1.00 0.00 H new ATOM 0 HB2 ASP A 134 15.038 1.668 1.963 1.00 0.00 H new ATOM 0 HB3 ASP A 134 14.766 3.308 1.407 1.00 0.00 H new ATOM 1658 N PRO A 135 11.847 0.568 3.413 1.00 0.00 N ATOM 1659 CA PRO A 135 11.287 -0.230 4.491 1.00 0.00 C ATOM 1660 C PRO A 135 12.027 -1.563 4.679 1.00 0.00 C ATOM 1661 O PRO A 135 11.990 -2.113 5.779 1.00 0.00 O ATOM 1662 CB PRO A 135 9.820 -0.434 4.118 1.00 0.00 C ATOM 1663 CG PRO A 135 9.866 -0.491 2.599 1.00 0.00 C ATOM 1664 CD PRO A 135 10.950 0.536 2.267 1.00 0.00 C ATOM 0 HA PRO A 135 11.391 0.273 5.452 1.00 0.00 H new ATOM 0 HB2 PRO A 135 9.417 -1.352 4.546 1.00 0.00 H new ATOM 0 HB3 PRO A 135 9.194 0.384 4.474 1.00 0.00 H new ATOM 0 HG2 PRO A 135 10.124 -1.486 2.237 1.00 0.00 H new ATOM 0 HG3 PRO A 135 8.907 -0.228 2.153 1.00 0.00 H new ATOM 0 HD2 PRO A 135 11.487 0.256 1.361 1.00 0.00 H new ATOM 0 HD3 PRO A 135 10.513 1.518 2.088 1.00 0.00 H new ATOM 1672 N GLY A 136 12.714 -2.105 3.664 1.00 0.00 N ATOM 1673 CA GLY A 136 13.783 -3.066 3.904 1.00 0.00 C ATOM 1674 C GLY A 136 14.560 -3.324 2.627 1.00 0.00 C ATOM 1675 O GLY A 136 14.591 -4.470 2.184 1.00 0.00 O ATOM 0 H GLY A 136 12.546 -1.893 2.681 1.00 0.00 H new ATOM 0 HA2 GLY A 136 14.454 -2.688 4.675 1.00 0.00 H new ATOM 0 HA3 GLY A 136 13.363 -4.000 4.277 1.00 0.00 H new ATOM 1679 N ILE A 137 15.115 -2.281 1.994 1.00 0.00 N ATOM 1680 CA ILE A 137 15.761 -2.395 0.686 1.00 0.00 C ATOM 1681 C ILE A 137 17.094 -3.122 0.862 1.00 0.00 C ATOM 1682 O ILE A 137 18.128 -2.483 1.030 1.00 0.00 O ATOM 1683 CB ILE A 137 15.953 -1.025 -0.004 1.00 0.00 C ATOM 1684 CG1 ILE A 137 14.628 -0.242 -0.134 1.00 0.00 C ATOM 1685 CG2 ILE A 137 16.559 -1.221 -1.410 1.00 0.00 C ATOM 1686 CD1 ILE A 137 14.860 1.160 -0.721 1.00 0.00 C ATOM 0 H ILE A 137 15.127 -1.336 2.377 1.00 0.00 H new ATOM 0 HA ILE A 137 15.110 -2.968 0.026 1.00 0.00 H new ATOM 0 HB ILE A 137 16.628 -0.445 0.625 1.00 0.00 H new ATOM 0 HG12 ILE A 137 13.938 -0.795 -0.771 1.00 0.00 H new ATOM 0 HG13 ILE A 137 14.158 -0.155 0.845 1.00 0.00 H new ATOM 0 HG21 ILE A 137 16.690 -0.250 -1.888 1.00 0.00 H new ATOM 0 HG22 ILE A 137 17.526 -1.717 -1.324 1.00 0.00 H new ATOM 0 HG23 ILE A 137 15.889 -1.834 -2.013 1.00 0.00 H new ATOM 0 HD11 ILE A 137 13.907 1.684 -0.799 1.00 0.00 H new ATOM 0 HD12 ILE A 137 15.530 1.721 -0.070 1.00 0.00 H new ATOM 0 HD13 ILE A 137 15.307 1.071 -1.711 1.00 0.00 H new ATOM 1698 N ASN A 138 17.057 -4.450 0.779 1.00 0.00 N ATOM 1699 CA ASN A 138 18.144 -5.406 0.978 1.00 0.00 C ATOM 1700 C ASN A 138 19.270 -4.877 1.874 1.00 0.00 C ATOM 1701 O ASN A 138 20.369 -4.577 1.397 1.00 0.00 O ATOM 1702 CB ASN A 138 18.651 -6.006 -0.337 1.00 0.00 C ATOM 1703 CG ASN A 138 19.280 -7.340 0.021 1.00 0.00 C ATOM 1704 OD1 ASN A 138 18.615 -8.365 0.001 1.00 0.00 O ATOM 1705 ND2 ASN A 138 20.534 -7.384 0.419 1.00 0.00 N ATOM 0 H ASN A 138 16.186 -4.928 0.550 1.00 0.00 H new ATOM 0 HA ASN A 138 17.706 -6.233 1.537 1.00 0.00 H new ATOM 0 HB2 ASN A 138 17.833 -6.139 -1.045 1.00 0.00 H new ATOM 0 HB3 ASN A 138 19.379 -5.347 -0.811 1.00 0.00 H new ATOM 0 HD21 ASN A 138 20.946 -8.271 0.709 1.00 0.00 H new ATOM 0 HD22 ASN A 138 21.093 -6.531 0.438 1.00 0.00 H new ATOM 1712 N ALA A 139 18.963 -4.737 3.161 1.00 0.00 N ATOM 1713 CA ALA A 139 19.782 -4.095 4.172 1.00 0.00 C ATOM 1714 C ALA A 139 19.587 -4.868 5.470 1.00 0.00 C ATOM 1715 O ALA A 139 18.611 -5.642 5.573 1.00 0.00 O ATOM 1716 CB ALA A 139 19.343 -2.629 4.299 1.00 0.00 C ATOM 0 H ALA A 139 18.085 -5.090 3.542 1.00 0.00 H new ATOM 0 HA ALA A 139 20.841 -4.100 3.914 1.00 0.00 H new ATOM 0 HB1 ALA A 139 19.950 -2.132 5.056 1.00 0.00 H new ATOM 0 HB2 ALA A 139 19.474 -2.126 3.341 1.00 0.00 H new ATOM 0 HB3 ALA A 139 18.293 -2.587 4.590 1.00 0.00 H new TER 1722 ALA A 139