USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 761 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 138 THR OG1 : rot -81:sc= -0.695! USER MOD Set 1.2: A 140 SER OG : rot 153:sc= -1.38 USER MOD Set 2.1: A 56 TYR OH : rot 88:sc= -2.1! USER MOD Set 2.2: A 118 HIS : no HE2:sc= -5.45! C(o=-7.5!,f=-13!) USER MOD Single : A 41 GLN : amide:sc= -0.142 K(o=-0.14,f=-1.9!) USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.0382 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot -110:sc= 0.528 USER MOD Single : A 51 SER OG : rot 79:sc= 1.09 USER MOD Single : A 55 ASN : amide:sc= -0.613 X(o=-0.61,f=-0.52) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -17:sc= 0.44 USER MOD Single : A 82 ASN : amide:sc= -4.6! C(o=-4.6!,f=-3.1!) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 ASN : amide:sc= -2.93 K(o=-2.9,f=-5.3!) USER MOD Single : A 87 ASN : amide:sc= -0.575 X(o=-0.58,f=-0.088) USER MOD Single : A 89 MET CE :methyl 163:sc= -0.0747 (180deg=-0.507) USER MOD Single : A 90 MET CE :methyl 178:sc= -10.1! (180deg=-10.2!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HD1:sc= -5.11! C(o=-5.1!,f=-6.7!) USER MOD Single : A 96 THR OG1 : rot 78:sc= 1.2 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 129:sc= 0.112 USER MOD Single : A 102 THR OG1 : rot -34:sc= 0.342 USER MOD Single : A 106 ASN : amide:sc= -2.03 K(o=-2,f=-0.69) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 TYR OH : rot 100:sc= -3.44 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot -63:sc= 0.648 USER MOD Single : A 125 GLN : amide:sc= 0.803 K(o=0.8,f=-2.4!) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 ASN : amide:sc= -0.694 K(o=-0.69,f=-0.035) USER MOD Single : A 131 ASN : amide:sc= -4.63! C(o=-4.6!,f=-13!) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 HIS : no HE2:sc= -3.14 K(o=-3.1,f=-1.9) USER MOD Single : A 146 SER OG : rot 130:sc= -3.12 USER MOD Single : A 148 ASN : amide:sc= -2.3! C(o=-2.3!,f=-1.9!) USER MOD Single : A 150 HIS : no HD1:sc= -12.6! C(o=-13!,f=-13!) USER MOD Single : A 151 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 13 N PHE A 37 6.602 -10.156 7.010 1.00 0.00 N ATOM 14 CA PHE A 37 7.613 -9.471 6.215 1.00 0.00 C ATOM 15 C PHE A 37 9.014 -9.917 6.619 1.00 0.00 C ATOM 16 O PHE A 37 9.968 -9.141 6.554 1.00 0.00 O ATOM 17 CB PHE A 37 7.481 -7.954 6.379 1.00 0.00 C ATOM 18 CG PHE A 37 6.059 -7.465 6.360 1.00 0.00 C ATOM 19 CD1 PHE A 37 5.205 -7.823 5.329 1.00 0.00 C ATOM 20 CD2 PHE A 37 5.578 -6.648 7.371 1.00 0.00 C ATOM 21 CE1 PHE A 37 3.897 -7.374 5.307 1.00 0.00 C ATOM 22 CE2 PHE A 37 4.271 -6.196 7.353 1.00 0.00 C ATOM 23 CZ PHE A 37 3.430 -6.560 6.319 1.00 0.00 C ATOM 0 HA PHE A 37 7.455 -9.731 5.168 1.00 0.00 H new ATOM 0 HB2 PHE A 37 7.945 -7.657 7.320 1.00 0.00 H new ATOM 0 HB3 PHE A 37 8.036 -7.462 5.580 1.00 0.00 H new ATOM 0 HD1 PHE A 37 5.565 -8.459 4.534 1.00 0.00 H new ATOM 0 HD2 PHE A 37 6.231 -6.361 8.182 1.00 0.00 H new ATOM 0 HE1 PHE A 37 3.241 -7.660 4.498 1.00 0.00 H new ATOM 0 HE2 PHE A 37 3.908 -5.559 8.146 1.00 0.00 H new ATOM 0 HZ PHE A 37 2.409 -6.208 6.303 1.00 0.00 H new ATOM 33 N ALA A 38 9.131 -11.173 7.040 1.00 0.00 N ATOM 34 CA ALA A 38 10.415 -11.725 7.460 1.00 0.00 C ATOM 35 C ALA A 38 11.307 -12.024 6.261 1.00 0.00 C ATOM 36 O ALA A 38 12.450 -11.573 6.195 1.00 0.00 O ATOM 37 CB ALA A 38 10.202 -12.981 8.290 1.00 0.00 C ATOM 0 H ALA A 38 8.352 -11.828 7.099 1.00 0.00 H new ATOM 0 HA ALA A 38 10.919 -10.978 8.073 1.00 0.00 H new ATOM 0 HB1 ALA A 38 11.168 -13.383 8.597 1.00 0.00 H new ATOM 0 HB2 ALA A 38 9.613 -12.737 9.174 1.00 0.00 H new ATOM 0 HB3 ALA A 38 9.672 -13.725 7.695 1.00 0.00 H new ATOM 43 N ASP A 39 10.774 -12.788 5.319 1.00 0.00 N ATOM 44 CA ASP A 39 11.516 -13.153 4.117 1.00 0.00 C ATOM 45 C ASP A 39 11.263 -12.155 2.987 1.00 0.00 C ATOM 46 O ASP A 39 11.710 -12.359 1.857 1.00 0.00 O ATOM 47 CB ASP A 39 11.123 -14.559 3.662 1.00 0.00 C ATOM 48 CG ASP A 39 11.204 -15.575 4.784 1.00 0.00 C ATOM 49 OD1 ASP A 39 10.242 -15.659 5.578 1.00 0.00 O ATOM 50 OD2 ASP A 39 12.228 -16.285 4.871 1.00 0.00 O ATOM 0 H ASP A 39 9.829 -13.169 5.362 1.00 0.00 H new ATOM 0 HA ASP A 39 12.578 -13.134 4.360 1.00 0.00 H new ATOM 0 HB2 ASP A 39 10.107 -14.539 3.267 1.00 0.00 H new ATOM 0 HB3 ASP A 39 11.776 -14.870 2.847 1.00 0.00 H new ATOM 55 N ALA A 40 10.546 -11.079 3.296 1.00 0.00 N ATOM 56 CA ALA A 40 10.235 -10.055 2.306 1.00 0.00 C ATOM 57 C ALA A 40 11.480 -9.260 1.925 1.00 0.00 C ATOM 58 O ALA A 40 12.227 -8.806 2.792 1.00 0.00 O ATOM 59 CB ALA A 40 9.158 -9.123 2.841 1.00 0.00 C ATOM 0 H ALA A 40 10.169 -10.894 4.226 1.00 0.00 H new ATOM 0 HA ALA A 40 9.865 -10.551 1.408 1.00 0.00 H new ATOM 0 HB1 ALA A 40 8.932 -8.361 2.095 1.00 0.00 H new ATOM 0 HB2 ALA A 40 8.257 -9.696 3.059 1.00 0.00 H new ATOM 0 HB3 ALA A 40 9.512 -8.643 3.753 1.00 0.00 H new ATOM 65 N GLN A 41 11.694 -9.088 0.624 1.00 0.00 N ATOM 66 CA GLN A 41 12.845 -8.337 0.136 1.00 0.00 C ATOM 67 C GLN A 41 12.707 -6.866 0.504 1.00 0.00 C ATOM 68 O GLN A 41 11.669 -6.444 1.014 1.00 0.00 O ATOM 69 CB GLN A 41 12.977 -8.489 -1.382 1.00 0.00 C ATOM 70 CG GLN A 41 14.395 -8.291 -1.892 1.00 0.00 C ATOM 71 CD GLN A 41 14.632 -8.964 -3.230 1.00 0.00 C ATOM 72 OE1 GLN A 41 13.934 -9.911 -3.592 1.00 0.00 O ATOM 73 NE2 GLN A 41 15.619 -8.477 -3.972 1.00 0.00 N ATOM 0 H GLN A 41 11.088 -9.457 -0.109 1.00 0.00 H new ATOM 0 HA GLN A 41 13.744 -8.736 0.606 1.00 0.00 H new ATOM 0 HB2 GLN A 41 12.631 -9.481 -1.671 1.00 0.00 H new ATOM 0 HB3 GLN A 41 12.320 -7.768 -1.869 1.00 0.00 H new ATOM 0 HG2 GLN A 41 14.598 -7.224 -1.985 1.00 0.00 H new ATOM 0 HG3 GLN A 41 15.099 -8.687 -1.160 1.00 0.00 H new ATOM 0 HE21 GLN A 41 16.172 -7.690 -3.632 1.00 0.00 H new ATOM 0 HE22 GLN A 41 15.824 -8.889 -4.882 1.00 0.00 H new ATOM 82 N THR A 42 13.751 -6.084 0.253 1.00 0.00 N ATOM 83 CA THR A 42 13.714 -4.663 0.576 1.00 0.00 C ATOM 84 C THR A 42 14.641 -3.852 -0.325 1.00 0.00 C ATOM 85 O THR A 42 15.600 -4.376 -0.890 1.00 0.00 O ATOM 86 CB THR A 42 14.090 -4.441 2.045 1.00 0.00 C ATOM 87 OG1 THR A 42 14.404 -5.670 2.679 1.00 0.00 O ATOM 88 CG2 THR A 42 12.991 -3.780 2.850 1.00 0.00 C ATOM 0 H THR A 42 14.623 -6.405 -0.168 1.00 0.00 H new ATOM 0 HA THR A 42 12.695 -4.316 0.406 1.00 0.00 H new ATOM 0 HB THR A 42 14.955 -3.778 2.022 1.00 0.00 H new ATOM 0 HG1 THR A 42 14.642 -5.504 3.615 1.00 0.00 H new ATOM 0 HG21 THR A 42 13.322 -3.652 3.881 1.00 0.00 H new ATOM 0 HG22 THR A 42 12.760 -2.806 2.419 1.00 0.00 H new ATOM 0 HG23 THR A 42 12.099 -4.406 2.830 1.00 0.00 H new ATOM 96 N ARG A 43 14.340 -2.562 -0.437 1.00 0.00 N ATOM 97 CA ARG A 43 15.129 -1.646 -1.251 1.00 0.00 C ATOM 98 C ARG A 43 14.744 -0.205 -0.931 1.00 0.00 C ATOM 99 O ARG A 43 13.715 0.040 -0.303 1.00 0.00 O ATOM 100 CB ARG A 43 14.925 -1.932 -2.742 1.00 0.00 C ATOM 101 CG ARG A 43 13.528 -1.608 -3.247 1.00 0.00 C ATOM 102 CD ARG A 43 13.499 -1.474 -4.761 1.00 0.00 C ATOM 103 NE ARG A 43 12.712 -0.320 -5.194 1.00 0.00 N ATOM 104 CZ ARG A 43 12.358 -0.097 -6.457 1.00 0.00 C ATOM 105 NH1 ARG A 43 12.718 -0.944 -7.415 1.00 0.00 N ATOM 106 NH2 ARG A 43 11.641 0.976 -6.765 1.00 0.00 N ATOM 0 H ARG A 43 13.546 -2.125 0.032 1.00 0.00 H new ATOM 0 HA ARG A 43 16.184 -1.793 -1.018 1.00 0.00 H new ATOM 0 HB2 ARG A 43 15.651 -1.355 -3.315 1.00 0.00 H new ATOM 0 HB3 ARG A 43 15.134 -2.985 -2.932 1.00 0.00 H new ATOM 0 HG2 ARG A 43 12.837 -2.392 -2.937 1.00 0.00 H new ATOM 0 HG3 ARG A 43 13.182 -0.680 -2.792 1.00 0.00 H new ATOM 0 HD2 ARG A 43 14.518 -1.379 -5.136 1.00 0.00 H new ATOM 0 HD3 ARG A 43 13.082 -2.382 -5.197 1.00 0.00 H new ATOM 0 HE ARG A 43 12.417 0.353 -4.487 1.00 0.00 H new ATOM 0 HH11 ARG A 43 13.269 -1.771 -7.184 1.00 0.00 H new ATOM 0 HH12 ARG A 43 12.443 -0.768 -8.381 1.00 0.00 H new ATOM 0 HH21 ARG A 43 11.361 1.630 -6.034 1.00 0.00 H new ATOM 0 HH22 ARG A 43 11.369 1.147 -7.733 1.00 0.00 H new ATOM 120 N LYS A 44 15.569 0.745 -1.350 1.00 0.00 N ATOM 121 CA LYS A 44 15.293 2.149 -1.083 1.00 0.00 C ATOM 122 C LYS A 44 14.306 2.729 -2.088 1.00 0.00 C ATOM 123 O LYS A 44 14.386 2.462 -3.287 1.00 0.00 O ATOM 124 CB LYS A 44 16.589 2.959 -1.090 1.00 0.00 C ATOM 125 CG LYS A 44 16.866 3.634 0.239 1.00 0.00 C ATOM 126 CD LYS A 44 17.924 4.717 0.108 1.00 0.00 C ATOM 127 CE LYS A 44 19.302 4.199 0.486 1.00 0.00 C ATOM 128 NZ LYS A 44 20.320 5.286 0.502 1.00 0.00 N ATOM 0 H LYS A 44 16.428 0.571 -1.872 1.00 0.00 H new ATOM 0 HA LYS A 44 14.838 2.212 -0.094 1.00 0.00 H new ATOM 0 HB2 LYS A 44 17.422 2.301 -1.339 1.00 0.00 H new ATOM 0 HB3 LYS A 44 16.535 3.716 -1.873 1.00 0.00 H new ATOM 0 HG2 LYS A 44 15.945 4.070 0.625 1.00 0.00 H new ATOM 0 HG3 LYS A 44 17.195 2.890 0.964 1.00 0.00 H new ATOM 0 HD2 LYS A 44 17.942 5.087 -0.917 1.00 0.00 H new ATOM 0 HD3 LYS A 44 17.663 5.561 0.747 1.00 0.00 H new ATOM 0 HE2 LYS A 44 19.256 3.730 1.469 1.00 0.00 H new ATOM 0 HE3 LYS A 44 19.606 3.427 -0.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 21.246 4.891 0.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 20.383 5.717 -0.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 20.044 6.010 1.195 1.00 0.00 H new ATOM 142 N LEU A 45 13.374 3.525 -1.578 1.00 0.00 N ATOM 143 CA LEU A 45 12.354 4.157 -2.408 1.00 0.00 C ATOM 144 C LEU A 45 12.904 5.410 -3.086 1.00 0.00 C ATOM 145 O LEU A 45 13.630 6.193 -2.473 1.00 0.00 O ATOM 146 CB LEU A 45 11.133 4.513 -1.554 1.00 0.00 C ATOM 147 CG LEU A 45 9.864 4.874 -2.333 1.00 0.00 C ATOM 148 CD1 LEU A 45 9.645 3.907 -3.486 1.00 0.00 C ATOM 149 CD2 LEU A 45 8.654 4.880 -1.407 1.00 0.00 C ATOM 0 H LEU A 45 13.303 3.750 -0.586 1.00 0.00 H new ATOM 0 HA LEU A 45 12.056 3.452 -3.184 1.00 0.00 H new ATOM 0 HB2 LEU A 45 10.910 3.669 -0.901 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.394 5.353 -0.910 1.00 0.00 H new ATOM 0 HG LEU A 45 9.991 5.875 -2.746 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.738 4.183 -4.025 1.00 0.00 H new ATOM 0 HD12 LEU A 45 10.497 3.950 -4.164 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.542 2.894 -3.097 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.761 5.138 -1.977 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.529 3.891 -0.965 1.00 0.00 H new ATOM 0 HD23 LEU A 45 8.805 5.615 -0.616 1.00 0.00 H new ATOM 161 N THR A 46 12.555 5.591 -4.356 1.00 0.00 N ATOM 162 CA THR A 46 13.015 6.747 -5.121 1.00 0.00 C ATOM 163 C THR A 46 12.224 7.999 -4.752 1.00 0.00 C ATOM 164 O THR A 46 11.082 7.910 -4.301 1.00 0.00 O ATOM 165 CB THR A 46 12.874 6.481 -6.621 1.00 0.00 C ATOM 166 OG1 THR A 46 11.518 6.590 -7.021 1.00 0.00 O ATOM 167 CG2 THR A 46 13.372 5.114 -7.040 1.00 0.00 C ATOM 0 H THR A 46 11.955 4.952 -4.878 1.00 0.00 H new ATOM 0 HA THR A 46 14.065 6.911 -4.877 1.00 0.00 H new ATOM 0 HB THR A 46 13.493 7.235 -7.108 1.00 0.00 H new ATOM 0 HG1 THR A 46 11.172 5.702 -7.251 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.242 4.993 -8.115 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.429 5.019 -6.789 1.00 0.00 H new ATOM 0 HG23 THR A 46 12.805 4.344 -6.517 1.00 0.00 H new ATOM 175 N PRO A 47 12.818 9.190 -4.953 1.00 0.00 N ATOM 176 CA PRO A 47 12.153 10.460 -4.651 1.00 0.00 C ATOM 177 C PRO A 47 10.855 10.608 -5.433 1.00 0.00 C ATOM 178 O PRO A 47 9.845 11.074 -4.902 1.00 0.00 O ATOM 179 CB PRO A 47 13.171 11.523 -5.083 1.00 0.00 C ATOM 180 CG PRO A 47 14.123 10.813 -5.984 1.00 0.00 C ATOM 181 CD PRO A 47 14.169 9.393 -5.499 1.00 0.00 C ATOM 0 HA PRO A 47 11.875 10.540 -3.600 1.00 0.00 H new ATOM 0 HB2 PRO A 47 12.682 12.349 -5.600 1.00 0.00 H new ATOM 0 HB3 PRO A 47 13.687 11.947 -4.221 1.00 0.00 H new ATOM 0 HG2 PRO A 47 13.789 10.861 -7.020 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.112 11.271 -5.946 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.387 8.696 -6.308 1.00 0.00 H new ATOM 0 HD3 PRO A 47 14.938 9.250 -4.740 1.00 0.00 H new ATOM 189 N GLU A 48 10.885 10.196 -6.697 1.00 0.00 N ATOM 190 CA GLU A 48 9.707 10.267 -7.552 1.00 0.00 C ATOM 191 C GLU A 48 8.616 9.348 -7.020 1.00 0.00 C ATOM 192 O GLU A 48 7.432 9.681 -7.064 1.00 0.00 O ATOM 193 CB GLU A 48 10.070 9.886 -8.990 1.00 0.00 C ATOM 194 CG GLU A 48 9.586 10.889 -10.024 1.00 0.00 C ATOM 195 CD GLU A 48 10.563 12.030 -10.231 1.00 0.00 C ATOM 196 OE1 GLU A 48 11.783 11.766 -10.273 1.00 0.00 O ATOM 197 OE2 GLU A 48 10.108 13.187 -10.352 1.00 0.00 O ATOM 0 H GLU A 48 11.713 9.810 -7.151 1.00 0.00 H new ATOM 0 HA GLU A 48 9.333 11.291 -7.549 1.00 0.00 H new ATOM 0 HB2 GLU A 48 11.153 9.788 -9.069 1.00 0.00 H new ATOM 0 HB3 GLU A 48 9.644 8.908 -9.217 1.00 0.00 H new ATOM 0 HG2 GLU A 48 9.424 10.378 -10.973 1.00 0.00 H new ATOM 0 HG3 GLU A 48 8.623 11.292 -9.711 1.00 0.00 H new ATOM 204 N GLU A 49 9.025 8.189 -6.510 1.00 0.00 N ATOM 205 CA GLU A 49 8.081 7.224 -5.962 1.00 0.00 C ATOM 206 C GLU A 49 7.464 7.747 -4.668 1.00 0.00 C ATOM 207 O GLU A 49 6.253 7.652 -4.460 1.00 0.00 O ATOM 208 CB GLU A 49 8.769 5.883 -5.713 1.00 0.00 C ATOM 209 CG GLU A 49 8.765 4.968 -6.926 1.00 0.00 C ATOM 210 CD GLU A 49 9.763 3.834 -6.804 1.00 0.00 C ATOM 211 OE1 GLU A 49 10.922 4.101 -6.423 1.00 0.00 O ATOM 212 OE2 GLU A 49 9.386 2.678 -7.088 1.00 0.00 O ATOM 0 H GLU A 49 10.001 7.898 -6.466 1.00 0.00 H new ATOM 0 HA GLU A 49 7.284 7.078 -6.691 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.799 6.063 -5.407 1.00 0.00 H new ATOM 0 HB3 GLU A 49 8.274 5.377 -4.884 1.00 0.00 H new ATOM 0 HG2 GLU A 49 7.766 4.555 -7.061 1.00 0.00 H new ATOM 0 HG3 GLU A 49 8.992 5.552 -7.818 1.00 0.00 H new ATOM 219 N ARG A 50 8.308 8.303 -3.807 1.00 0.00 N ATOM 220 CA ARG A 50 7.853 8.847 -2.533 1.00 0.00 C ATOM 221 C ARG A 50 7.061 10.134 -2.742 1.00 0.00 C ATOM 222 O ARG A 50 6.177 10.464 -1.953 1.00 0.00 O ATOM 223 CB ARG A 50 9.047 9.109 -1.611 1.00 0.00 C ATOM 224 CG ARG A 50 8.688 9.098 -0.134 1.00 0.00 C ATOM 225 CD ARG A 50 9.556 8.124 0.651 1.00 0.00 C ATOM 226 NE ARG A 50 10.980 8.312 0.380 1.00 0.00 N ATOM 227 CZ ARG A 50 11.677 9.375 0.774 1.00 0.00 C ATOM 228 NH1 ARG A 50 11.091 10.342 1.471 1.00 0.00 N ATOM 229 NH2 ARG A 50 12.966 9.469 0.477 1.00 0.00 N ATOM 0 H ARG A 50 9.312 8.389 -3.968 1.00 0.00 H new ATOM 0 HA ARG A 50 7.197 8.112 -2.065 1.00 0.00 H new ATOM 0 HB2 ARG A 50 9.811 8.354 -1.796 1.00 0.00 H new ATOM 0 HB3 ARG A 50 9.485 10.075 -1.863 1.00 0.00 H new ATOM 0 HG2 ARG A 50 8.805 10.101 0.276 1.00 0.00 H new ATOM 0 HG3 ARG A 50 7.639 8.826 -0.017 1.00 0.00 H new ATOM 0 HD2 ARG A 50 9.371 8.253 1.717 1.00 0.00 H new ATOM 0 HD3 ARG A 50 9.272 7.102 0.399 1.00 0.00 H new ATOM 0 HE ARG A 50 11.469 7.585 -0.142 1.00 0.00 H new ATOM 0 HH11 ARG A 50 10.101 10.272 1.707 1.00 0.00 H new ATOM 0 HH12 ARG A 50 11.631 11.154 1.770 1.00 0.00 H new ATOM 0 HH21 ARG A 50 13.423 8.727 -0.053 1.00 0.00 H new ATOM 0 HH22 ARG A 50 13.501 10.283 0.779 1.00 0.00 H new ATOM 243 N SER A 51 7.383 10.856 -3.812 1.00 0.00 N ATOM 244 CA SER A 51 6.698 12.105 -4.125 1.00 0.00 C ATOM 245 C SER A 51 5.259 11.841 -4.548 1.00 0.00 C ATOM 246 O SER A 51 4.316 12.380 -3.966 1.00 0.00 O ATOM 247 CB SER A 51 7.440 12.855 -5.233 1.00 0.00 C ATOM 248 OG SER A 51 8.614 13.472 -4.734 1.00 0.00 O ATOM 0 H SER A 51 8.113 10.597 -4.476 1.00 0.00 H new ATOM 0 HA SER A 51 6.687 12.721 -3.226 1.00 0.00 H new ATOM 0 HB2 SER A 51 7.701 12.162 -6.033 1.00 0.00 H new ATOM 0 HB3 SER A 51 6.785 13.610 -5.667 1.00 0.00 H new ATOM 0 HG SER A 51 9.325 12.803 -4.650 1.00 0.00 H new ATOM 254 N ALA A 52 5.096 11.001 -5.558 1.00 0.00 N ATOM 255 CA ALA A 52 3.771 10.657 -6.055 1.00 0.00 C ATOM 256 C ALA A 52 2.945 10.012 -4.964 1.00 0.00 C ATOM 257 O ALA A 52 1.806 10.396 -4.728 1.00 0.00 O ATOM 258 CB ALA A 52 3.876 9.728 -7.244 1.00 0.00 C ATOM 0 H ALA A 52 5.864 10.544 -6.050 1.00 0.00 H new ATOM 0 HA ALA A 52 3.276 11.576 -6.371 1.00 0.00 H new ATOM 0 HB1 ALA A 52 2.877 9.481 -7.602 1.00 0.00 H new ATOM 0 HB2 ALA A 52 4.436 10.218 -8.040 1.00 0.00 H new ATOM 0 HB3 ALA A 52 4.391 8.814 -6.947 1.00 0.00 H new ATOM 264 N VAL A 53 3.535 9.033 -4.291 1.00 0.00 N ATOM 265 CA VAL A 53 2.854 8.344 -3.209 1.00 0.00 C ATOM 266 C VAL A 53 2.315 9.358 -2.213 1.00 0.00 C ATOM 267 O VAL A 53 1.127 9.364 -1.895 1.00 0.00 O ATOM 268 CB VAL A 53 3.798 7.359 -2.488 1.00 0.00 C ATOM 269 CG1 VAL A 53 3.168 6.832 -1.205 1.00 0.00 C ATOM 270 CG2 VAL A 53 4.166 6.211 -3.411 1.00 0.00 C ATOM 0 H VAL A 53 4.481 8.701 -4.476 1.00 0.00 H new ATOM 0 HA VAL A 53 2.030 7.773 -3.637 1.00 0.00 H new ATOM 0 HB VAL A 53 4.707 7.897 -2.218 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.856 6.140 -0.719 1.00 0.00 H new ATOM 0 HG12 VAL A 53 2.957 7.665 -0.534 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.239 6.313 -1.442 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.832 5.524 -2.889 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.262 5.682 -3.712 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.668 6.602 -4.296 1.00 0.00 H new ATOM 280 N GLU A 54 3.200 10.225 -1.744 1.00 0.00 N ATOM 281 CA GLU A 54 2.822 11.261 -0.791 1.00 0.00 C ATOM 282 C GLU A 54 1.664 12.096 -1.337 1.00 0.00 C ATOM 283 O GLU A 54 0.786 12.524 -0.588 1.00 0.00 O ATOM 284 CB GLU A 54 4.037 12.138 -0.443 1.00 0.00 C ATOM 285 CG GLU A 54 4.316 13.277 -1.419 1.00 0.00 C ATOM 286 CD GLU A 54 4.443 14.618 -0.726 1.00 0.00 C ATOM 287 OE1 GLU A 54 5.210 14.708 0.257 1.00 0.00 O ATOM 288 OE2 GLU A 54 3.777 15.579 -1.165 1.00 0.00 O ATOM 0 H GLU A 54 4.185 10.233 -2.007 1.00 0.00 H new ATOM 0 HA GLU A 54 2.480 10.786 0.129 1.00 0.00 H new ATOM 0 HB2 GLU A 54 3.887 12.561 0.551 1.00 0.00 H new ATOM 0 HB3 GLU A 54 4.921 11.502 -0.389 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.235 13.066 -1.965 1.00 0.00 H new ATOM 0 HG3 GLU A 54 3.512 13.326 -2.154 1.00 0.00 H new ATOM 295 N ASN A 55 1.660 12.302 -2.651 1.00 0.00 N ATOM 296 CA ASN A 55 0.601 13.064 -3.305 1.00 0.00 C ATOM 297 C ASN A 55 -0.668 12.222 -3.398 1.00 0.00 C ATOM 298 O ASN A 55 -1.783 12.743 -3.357 1.00 0.00 O ATOM 299 CB ASN A 55 1.047 13.493 -4.705 1.00 0.00 C ATOM 300 CG ASN A 55 2.207 14.468 -4.668 1.00 0.00 C ATOM 301 OD1 ASN A 55 2.258 15.360 -3.822 1.00 0.00 O ATOM 302 ND2 ASN A 55 3.149 14.301 -5.590 1.00 0.00 N ATOM 0 H ASN A 55 2.379 11.952 -3.284 1.00 0.00 H new ATOM 0 HA ASN A 55 0.393 13.955 -2.713 1.00 0.00 H new ATOM 0 HB2 ASN A 55 1.335 12.611 -5.278 1.00 0.00 H new ATOM 0 HB3 ASN A 55 0.207 13.952 -5.227 1.00 0.00 H new ATOM 0 HD21 ASN A 55 3.955 14.926 -5.615 1.00 0.00 H new ATOM 0 HD22 ASN A 55 3.067 13.548 -6.273 1.00 0.00 H new ATOM 309 N TYR A 56 -0.475 10.915 -3.524 1.00 0.00 N ATOM 310 CA TYR A 56 -1.570 9.966 -3.624 1.00 0.00 C ATOM 311 C TYR A 56 -2.276 9.831 -2.273 1.00 0.00 C ATOM 312 O TYR A 56 -3.507 9.817 -2.200 1.00 0.00 O ATOM 313 CB TYR A 56 -1.012 8.622 -4.124 1.00 0.00 C ATOM 314 CG TYR A 56 -1.801 7.399 -3.720 1.00 0.00 C ATOM 315 CD1 TYR A 56 -1.205 6.383 -2.983 1.00 0.00 C ATOM 316 CD2 TYR A 56 -3.135 7.256 -4.076 1.00 0.00 C ATOM 317 CE1 TYR A 56 -1.917 5.263 -2.609 1.00 0.00 C ATOM 318 CE2 TYR A 56 -3.855 6.135 -3.708 1.00 0.00 C ATOM 319 CZ TYR A 56 -3.239 5.142 -2.973 1.00 0.00 C ATOM 320 OH TYR A 56 -3.951 4.031 -2.594 1.00 0.00 O ATOM 0 H TYR A 56 0.449 10.485 -3.560 1.00 0.00 H new ATOM 0 HA TYR A 56 -2.316 10.317 -4.337 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -0.957 8.654 -5.212 1.00 0.00 H new ATOM 0 HB3 TYR A 56 0.008 8.513 -3.756 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -0.167 6.472 -2.698 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -3.618 8.033 -4.650 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -1.440 4.484 -2.033 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -4.892 6.037 -3.993 1.00 0.00 H new ATOM 0 HH TYR A 56 -4.351 4.184 -1.712 1.00 0.00 H new ATOM 330 N LEU A 57 -1.488 9.761 -1.202 1.00 0.00 N ATOM 331 CA LEU A 57 -2.040 9.656 0.145 1.00 0.00 C ATOM 332 C LEU A 57 -2.673 10.979 0.562 1.00 0.00 C ATOM 333 O LEU A 57 -3.697 11.002 1.247 1.00 0.00 O ATOM 334 CB LEU A 57 -0.947 9.272 1.148 1.00 0.00 C ATOM 335 CG LEU A 57 0.077 8.253 0.644 1.00 0.00 C ATOM 336 CD1 LEU A 57 0.973 7.788 1.781 1.00 0.00 C ATOM 337 CD2 LEU A 57 -0.623 7.073 -0.008 1.00 0.00 C ATOM 0 H LEU A 57 -0.469 9.775 -1.241 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.804 8.878 0.139 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.417 10.177 1.447 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.423 8.871 2.043 1.00 0.00 H new ATOM 0 HG LEU A 57 0.703 8.735 -0.106 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.694 7.064 1.403 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.503 8.643 2.200 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.365 7.323 2.557 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.121 6.358 -0.361 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.275 6.589 0.720 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.218 7.424 -0.851 1.00 0.00 H new ATOM 349 N GLU A 58 -2.057 12.083 0.143 1.00 0.00 N ATOM 350 CA GLU A 58 -2.561 13.411 0.474 1.00 0.00 C ATOM 351 C GLU A 58 -3.941 13.625 -0.132 1.00 0.00 C ATOM 352 O GLU A 58 -4.876 14.039 0.554 1.00 0.00 O ATOM 353 CB GLU A 58 -1.600 14.492 -0.023 1.00 0.00 C ATOM 354 CG GLU A 58 -1.694 15.795 0.753 1.00 0.00 C ATOM 355 CD GLU A 58 -3.109 16.335 0.818 1.00 0.00 C ATOM 356 OE1 GLU A 58 -3.845 15.962 1.755 1.00 0.00 O ATOM 357 OE2 GLU A 58 -3.482 17.130 -0.071 1.00 0.00 O ATOM 0 H GLU A 58 -1.210 12.083 -0.425 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.638 13.483 1.559 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.579 14.115 0.039 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.803 14.690 -1.075 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -1.322 15.638 1.766 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -1.047 16.538 0.287 1.00 0.00 H new ATOM 364 N SER A 59 -4.065 13.321 -1.418 1.00 0.00 N ATOM 365 CA SER A 59 -5.338 13.462 -2.109 1.00 0.00 C ATOM 366 C SER A 59 -6.346 12.486 -1.521 1.00 0.00 C ATOM 367 O SER A 59 -7.536 12.783 -1.416 1.00 0.00 O ATOM 368 CB SER A 59 -5.169 13.207 -3.609 1.00 0.00 C ATOM 369 OG SER A 59 -6.426 13.080 -4.250 1.00 0.00 O ATOM 0 H SER A 59 -3.302 12.977 -2.001 1.00 0.00 H new ATOM 0 HA SER A 59 -5.701 14.481 -1.976 1.00 0.00 H new ATOM 0 HB2 SER A 59 -4.609 14.026 -4.059 1.00 0.00 H new ATOM 0 HB3 SER A 59 -4.585 12.299 -3.763 1.00 0.00 H new ATOM 0 HG SER A 59 -6.290 12.919 -5.207 1.00 0.00 H new ATOM 623 N SER A 78 -5.212 7.839 6.507 1.00 0.00 N ATOM 624 CA SER A 78 -4.105 8.195 5.628 1.00 0.00 C ATOM 625 C SER A 78 -2.774 7.989 6.341 1.00 0.00 C ATOM 626 O SER A 78 -2.491 8.633 7.350 1.00 0.00 O ATOM 627 CB SER A 78 -4.235 9.645 5.160 1.00 0.00 C ATOM 628 OG SER A 78 -4.769 10.467 6.182 1.00 0.00 O ATOM 0 HA SER A 78 -4.138 7.545 4.754 1.00 0.00 H new ATOM 0 HB2 SER A 78 -3.257 10.022 4.860 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.877 9.690 4.281 1.00 0.00 H new ATOM 0 HG SER A 78 -5.194 9.906 6.864 1.00 0.00 H new ATOM 634 N LEU A 79 -1.966 7.077 5.813 1.00 0.00 N ATOM 635 CA LEU A 79 -0.663 6.776 6.412 1.00 0.00 C ATOM 636 C LEU A 79 0.236 8.011 6.416 1.00 0.00 C ATOM 637 O LEU A 79 0.303 8.748 5.433 1.00 0.00 O ATOM 638 CB LEU A 79 0.057 5.612 5.697 1.00 0.00 C ATOM 639 CG LEU A 79 -0.691 4.928 4.550 1.00 0.00 C ATOM 640 CD1 LEU A 79 -1.999 4.331 5.047 1.00 0.00 C ATOM 641 CD2 LEU A 79 -0.927 5.901 3.401 1.00 0.00 C ATOM 0 H LEU A 79 -2.184 6.534 4.977 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.859 6.469 7.439 1.00 0.00 H new ATOM 0 HB2 LEU A 79 1.003 5.988 5.307 1.00 0.00 H new ATOM 0 HB3 LEU A 79 0.298 4.854 6.443 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.073 4.114 4.172 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -2.517 3.849 4.218 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.791 3.594 5.823 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.627 5.122 5.457 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.460 5.393 2.597 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.521 6.744 3.754 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.031 6.263 3.028 1.00 0.00 H new ATOM 653 N ALA A 80 0.934 8.219 7.530 1.00 0.00 N ATOM 654 CA ALA A 80 1.842 9.353 7.670 1.00 0.00 C ATOM 655 C ALA A 80 3.261 8.943 7.294 1.00 0.00 C ATOM 656 O ALA A 80 3.698 7.843 7.617 1.00 0.00 O ATOM 657 CB ALA A 80 1.803 9.892 9.093 1.00 0.00 C ATOM 0 H ALA A 80 0.887 7.615 8.350 1.00 0.00 H new ATOM 0 HA ALA A 80 1.518 10.144 6.993 1.00 0.00 H new ATOM 0 HB1 ALA A 80 2.486 10.737 9.181 1.00 0.00 H new ATOM 0 HB2 ALA A 80 0.790 10.217 9.331 1.00 0.00 H new ATOM 0 HB3 ALA A 80 2.105 9.108 9.787 1.00 0.00 H new ATOM 663 N LEU A 81 3.973 9.820 6.600 1.00 0.00 N ATOM 664 CA LEU A 81 5.334 9.516 6.171 1.00 0.00 C ATOM 665 C LEU A 81 6.284 9.372 7.356 1.00 0.00 C ATOM 666 O LEU A 81 6.258 10.169 8.295 1.00 0.00 O ATOM 667 CB LEU A 81 5.848 10.600 5.222 1.00 0.00 C ATOM 668 CG LEU A 81 4.902 10.967 4.078 1.00 0.00 C ATOM 669 CD1 LEU A 81 5.450 12.147 3.291 1.00 0.00 C ATOM 670 CD2 LEU A 81 4.681 9.770 3.166 1.00 0.00 C ATOM 0 H LEU A 81 3.635 10.742 6.323 1.00 0.00 H new ATOM 0 HA LEU A 81 5.304 8.560 5.648 1.00 0.00 H new ATOM 0 HB2 LEU A 81 6.056 11.499 5.802 1.00 0.00 H new ATOM 0 HB3 LEU A 81 6.795 10.268 4.797 1.00 0.00 H new ATOM 0 HG LEU A 81 3.941 11.256 4.503 1.00 0.00 H new ATOM 0 HD11 LEU A 81 4.764 12.394 2.481 1.00 0.00 H new ATOM 0 HD12 LEU A 81 5.556 13.007 3.952 1.00 0.00 H new ATOM 0 HD13 LEU A 81 6.423 11.887 2.875 1.00 0.00 H new ATOM 0 HD21 LEU A 81 4.005 10.049 2.357 1.00 0.00 H new ATOM 0 HD22 LEU A 81 5.635 9.450 2.748 1.00 0.00 H new ATOM 0 HD23 LEU A 81 4.244 8.952 3.739 1.00 0.00 H new ATOM 682 N ASN A 82 7.129 8.344 7.292 1.00 0.00 N ATOM 683 CA ASN A 82 8.107 8.071 8.337 1.00 0.00 C ATOM 684 C ASN A 82 9.431 7.627 7.725 1.00 0.00 C ATOM 685 O ASN A 82 9.575 7.580 6.503 1.00 0.00 O ATOM 686 CB ASN A 82 7.593 6.999 9.300 1.00 0.00 C ATOM 687 CG ASN A 82 6.872 7.593 10.493 1.00 0.00 C ATOM 688 OD1 ASN A 82 6.356 8.709 10.428 1.00 0.00 O ATOM 689 ND2 ASN A 82 6.836 6.849 11.593 1.00 0.00 N ATOM 0 H ASN A 82 7.153 7.681 6.517 1.00 0.00 H new ATOM 0 HA ASN A 82 8.266 8.992 8.897 1.00 0.00 H new ATOM 0 HB2 ASN A 82 6.918 6.329 8.767 1.00 0.00 H new ATOM 0 HB3 ASN A 82 8.431 6.396 9.649 1.00 0.00 H new ATOM 0 HD21 ASN A 82 6.367 7.197 12.429 1.00 0.00 H new ATOM 0 HD22 ASN A 82 7.277 5.929 11.601 1.00 0.00 H new ATOM 696 N ALA A 83 10.395 7.310 8.578 1.00 0.00 N ATOM 697 CA ALA A 83 11.710 6.879 8.114 1.00 0.00 C ATOM 698 C ALA A 83 11.639 5.542 7.379 1.00 0.00 C ATOM 699 O ALA A 83 12.458 5.268 6.502 1.00 0.00 O ATOM 700 CB ALA A 83 12.685 6.792 9.276 1.00 0.00 C ATOM 0 H ALA A 83 10.294 7.342 9.592 1.00 0.00 H new ATOM 0 HA ALA A 83 12.069 7.627 7.408 1.00 0.00 H new ATOM 0 HB1 ALA A 83 13.660 6.469 8.910 1.00 0.00 H new ATOM 0 HB2 ALA A 83 12.780 7.771 9.745 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.316 6.073 10.008 1.00 0.00 H new ATOM 706 N GLU A 84 10.655 4.716 7.726 1.00 0.00 N ATOM 707 CA GLU A 84 10.491 3.424 7.081 1.00 0.00 C ATOM 708 C GLU A 84 9.774 3.590 5.745 1.00 0.00 C ATOM 709 O GLU A 84 9.869 2.732 4.869 1.00 0.00 O ATOM 710 CB GLU A 84 9.722 2.466 7.991 1.00 0.00 C ATOM 711 CG GLU A 84 10.368 1.096 8.114 1.00 0.00 C ATOM 712 CD GLU A 84 10.202 0.259 6.861 1.00 0.00 C ATOM 713 OE1 GLU A 84 9.364 0.626 6.010 1.00 0.00 O ATOM 714 OE2 GLU A 84 10.908 -0.762 6.731 1.00 0.00 O ATOM 0 H GLU A 84 9.964 4.921 8.448 1.00 0.00 H new ATOM 0 HA GLU A 84 11.477 2.999 6.894 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.637 2.909 8.983 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.709 2.348 7.607 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.430 1.217 8.328 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.931 0.567 8.961 1.00 0.00 H new ATOM 721 N SER A 85 9.070 4.713 5.592 1.00 0.00 N ATOM 722 CA SER A 85 8.349 5.013 4.359 1.00 0.00 C ATOM 723 C SER A 85 9.298 5.027 3.161 1.00 0.00 C ATOM 724 O SER A 85 8.860 4.978 2.013 1.00 0.00 O ATOM 725 CB SER A 85 7.628 6.356 4.471 1.00 0.00 C ATOM 726 OG SER A 85 6.991 6.696 3.252 1.00 0.00 O ATOM 0 H SER A 85 8.985 5.431 6.312 1.00 0.00 H new ATOM 0 HA SER A 85 7.609 4.228 4.205 1.00 0.00 H new ATOM 0 HB2 SER A 85 6.889 6.310 5.271 1.00 0.00 H new ATOM 0 HB3 SER A 85 8.342 7.134 4.741 1.00 0.00 H new ATOM 0 HG SER A 85 6.536 7.558 3.350 1.00 0.00 H new ATOM 732 N ASN A 86 10.598 5.105 3.436 1.00 0.00 N ATOM 733 CA ASN A 86 11.602 5.123 2.382 1.00 0.00 C ATOM 734 C ASN A 86 12.016 3.701 2.012 1.00 0.00 C ATOM 735 O ASN A 86 12.219 3.387 0.841 1.00 0.00 O ATOM 736 CB ASN A 86 12.826 5.920 2.832 1.00 0.00 C ATOM 737 CG ASN A 86 12.455 7.254 3.449 1.00 0.00 C ATOM 738 OD1 ASN A 86 11.551 7.340 4.279 1.00 0.00 O ATOM 739 ND2 ASN A 86 13.157 8.304 3.044 1.00 0.00 N ATOM 0 H ASN A 86 10.978 5.157 4.381 1.00 0.00 H new ATOM 0 HA ASN A 86 11.169 5.601 1.503 1.00 0.00 H new ATOM 0 HB2 ASN A 86 13.392 5.333 3.556 1.00 0.00 H new ATOM 0 HB3 ASN A 86 13.481 6.088 1.977 1.00 0.00 H new ATOM 0 HD21 ASN A 86 12.956 9.229 3.423 1.00 0.00 H new ATOM 0 HD22 ASN A 86 13.898 8.186 2.353 1.00 0.00 H new ATOM 746 N ASN A 87 12.139 2.844 3.022 1.00 0.00 N ATOM 747 CA ASN A 87 12.529 1.453 2.806 1.00 0.00 C ATOM 748 C ASN A 87 11.350 0.630 2.300 1.00 0.00 C ATOM 749 O ASN A 87 10.428 0.321 3.055 1.00 0.00 O ATOM 750 CB ASN A 87 13.062 0.844 4.105 1.00 0.00 C ATOM 751 CG ASN A 87 13.976 1.789 4.862 1.00 0.00 C ATOM 752 OD1 ASN A 87 14.951 2.302 4.314 1.00 0.00 O ATOM 753 ND2 ASN A 87 13.664 2.020 6.132 1.00 0.00 N ATOM 0 H ASN A 87 11.974 3.088 3.999 1.00 0.00 H new ATOM 0 HA ASN A 87 13.315 1.437 2.051 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.223 0.568 4.743 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.604 -0.074 3.876 1.00 0.00 H new ATOM 0 HD21 ASN A 87 14.243 2.645 6.694 1.00 0.00 H new ATOM 0 HD22 ASN A 87 12.846 1.573 6.546 1.00 0.00 H new ATOM 760 N VAL A 88 11.385 0.278 1.017 1.00 0.00 N ATOM 761 CA VAL A 88 10.314 -0.507 0.406 1.00 0.00 C ATOM 762 C VAL A 88 10.473 -1.992 0.707 1.00 0.00 C ATOM 763 O VAL A 88 11.569 -2.542 0.622 1.00 0.00 O ATOM 764 CB VAL A 88 10.276 -0.311 -1.123 1.00 0.00 C ATOM 765 CG1 VAL A 88 9.054 -0.994 -1.719 1.00 0.00 C ATOM 766 CG2 VAL A 88 10.294 1.170 -1.474 1.00 0.00 C ATOM 0 H VAL A 88 12.143 0.524 0.380 1.00 0.00 H new ATOM 0 HA VAL A 88 9.379 -0.150 0.839 1.00 0.00 H new ATOM 0 HB VAL A 88 11.166 -0.772 -1.552 1.00 0.00 H new ATOM 0 HG11 VAL A 88 9.044 -0.845 -2.799 1.00 0.00 H new ATOM 0 HG12 VAL A 88 9.091 -2.061 -1.500 1.00 0.00 H new ATOM 0 HG13 VAL A 88 8.150 -0.566 -1.285 1.00 0.00 H new ATOM 0 HG21 VAL A 88 10.267 1.288 -2.557 1.00 0.00 H new ATOM 0 HG22 VAL A 88 9.425 1.659 -1.034 1.00 0.00 H new ATOM 0 HG23 VAL A 88 11.203 1.626 -1.082 1.00 0.00 H new ATOM 776 N MET A 89 9.362 -2.628 1.064 1.00 0.00 N ATOM 777 CA MET A 89 9.352 -4.050 1.387 1.00 0.00 C ATOM 778 C MET A 89 8.566 -4.835 0.338 1.00 0.00 C ATOM 779 O MET A 89 7.423 -4.500 0.028 1.00 0.00 O ATOM 780 CB MET A 89 8.747 -4.270 2.778 1.00 0.00 C ATOM 781 CG MET A 89 9.780 -4.595 3.844 1.00 0.00 C ATOM 782 SD MET A 89 10.429 -3.122 4.655 1.00 0.00 S ATOM 783 CE MET A 89 11.448 -3.859 5.930 1.00 0.00 C ATOM 0 H MET A 89 8.450 -2.177 1.137 1.00 0.00 H new ATOM 0 HA MET A 89 10.380 -4.412 1.388 1.00 0.00 H new ATOM 0 HB2 MET A 89 8.201 -3.374 3.074 1.00 0.00 H new ATOM 0 HB3 MET A 89 8.022 -5.083 2.726 1.00 0.00 H new ATOM 0 HG2 MET A 89 9.331 -5.249 4.592 1.00 0.00 H new ATOM 0 HG3 MET A 89 10.603 -5.148 3.390 1.00 0.00 H new ATOM 0 HE1 MET A 89 12.142 -3.113 6.317 1.00 0.00 H new ATOM 0 HE2 MET A 89 10.814 -4.219 6.740 1.00 0.00 H new ATOM 0 HE3 MET A 89 12.009 -4.694 5.510 1.00 0.00 H new ATOM 793 N MET A 90 9.189 -5.875 -0.210 1.00 0.00 N ATOM 794 CA MET A 90 8.551 -6.700 -1.231 1.00 0.00 C ATOM 795 C MET A 90 8.165 -8.065 -0.668 1.00 0.00 C ATOM 796 O MET A 90 8.974 -8.731 -0.023 1.00 0.00 O ATOM 797 CB MET A 90 9.489 -6.876 -2.426 1.00 0.00 C ATOM 798 CG MET A 90 9.683 -5.604 -3.237 1.00 0.00 C ATOM 799 SD MET A 90 11.357 -4.944 -3.113 1.00 0.00 S ATOM 800 CE MET A 90 11.153 -3.747 -1.798 1.00 0.00 C ATOM 0 H MET A 90 10.135 -6.166 0.036 1.00 0.00 H new ATOM 0 HA MET A 90 7.643 -6.194 -1.558 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.459 -7.221 -2.069 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.093 -7.656 -3.077 1.00 0.00 H new ATOM 0 HG2 MET A 90 9.454 -5.807 -4.283 1.00 0.00 H new ATOM 0 HG3 MET A 90 8.974 -4.850 -2.896 1.00 0.00 H new ATOM 0 HE1 MET A 90 12.113 -3.279 -1.580 1.00 0.00 H new ATOM 0 HE2 MET A 90 10.439 -2.984 -2.108 1.00 0.00 H new ATOM 0 HE3 MET A 90 10.783 -4.248 -0.904 1.00 0.00 H new ATOM 810 N LEU A 91 6.922 -8.474 -0.909 1.00 0.00 N ATOM 811 CA LEU A 91 6.436 -9.759 -0.413 1.00 0.00 C ATOM 812 C LEU A 91 5.255 -10.272 -1.222 1.00 0.00 C ATOM 813 O LEU A 91 4.432 -9.494 -1.701 1.00 0.00 O ATOM 814 CB LEU A 91 5.987 -9.625 1.043 1.00 0.00 C ATOM 815 CG LEU A 91 4.857 -8.617 1.266 1.00 0.00 C ATOM 816 CD1 LEU A 91 3.730 -9.244 2.071 1.00 0.00 C ATOM 817 CD2 LEU A 91 5.376 -7.364 1.955 1.00 0.00 C ATOM 0 H LEU A 91 6.236 -7.938 -1.441 1.00 0.00 H new ATOM 0 HA LEU A 91 7.262 -10.465 -0.503 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.662 -10.602 1.402 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.844 -9.332 1.649 1.00 0.00 H new ATOM 0 HG LEU A 91 4.463 -8.329 0.291 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.937 -8.511 2.219 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.333 -10.105 1.532 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.111 -9.566 3.040 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.554 -6.663 2.102 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.803 -7.631 2.922 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.143 -6.899 1.335 1.00 0.00 H new ATOM 829 N THR A 92 5.146 -11.591 -1.313 1.00 0.00 N ATOM 830 CA THR A 92 4.021 -12.209 -1.993 1.00 0.00 C ATOM 831 C THR A 92 2.968 -12.506 -0.939 1.00 0.00 C ATOM 832 O THR A 92 3.202 -13.308 -0.035 1.00 0.00 O ATOM 833 CB THR A 92 4.451 -13.494 -2.706 1.00 0.00 C ATOM 834 OG1 THR A 92 3.367 -14.052 -3.428 1.00 0.00 O ATOM 835 CG2 THR A 92 4.971 -14.558 -1.764 1.00 0.00 C ATOM 0 H THR A 92 5.822 -12.250 -0.925 1.00 0.00 H new ATOM 0 HA THR A 92 3.624 -11.541 -2.757 1.00 0.00 H new ATOM 0 HB THR A 92 5.260 -13.197 -3.373 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.661 -14.871 -3.878 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.258 -15.441 -2.335 1.00 0.00 H new ATOM 0 HG22 THR A 92 5.839 -14.176 -1.227 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.191 -14.825 -1.051 1.00 0.00 H new ATOM 843 N HIS A 93 1.837 -11.820 -1.010 1.00 0.00 N ATOM 844 CA HIS A 93 0.806 -11.996 0.000 1.00 0.00 C ATOM 845 C HIS A 93 -0.564 -11.538 -0.490 1.00 0.00 C ATOM 846 O HIS A 93 -0.669 -10.673 -1.359 1.00 0.00 O ATOM 847 CB HIS A 93 1.215 -11.197 1.238 1.00 0.00 C ATOM 848 CG HIS A 93 1.048 -11.925 2.532 1.00 0.00 C ATOM 849 ND1 HIS A 93 -0.177 -12.320 3.027 1.00 0.00 N ATOM 850 CD2 HIS A 93 1.966 -12.312 3.447 1.00 0.00 C ATOM 851 CE1 HIS A 93 -0.006 -12.916 4.192 1.00 0.00 C ATOM 852 NE2 HIS A 93 1.286 -12.926 4.471 1.00 0.00 N ATOM 0 H HIS A 93 1.612 -11.148 -1.743 1.00 0.00 H new ATOM 0 HA HIS A 93 0.718 -13.057 0.232 1.00 0.00 H new ATOM 0 HB2 HIS A 93 2.259 -10.901 1.135 1.00 0.00 H new ATOM 0 HB3 HIS A 93 0.626 -10.280 1.273 1.00 0.00 H new ATOM 0 HD2 HIS A 93 3.034 -12.166 3.384 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.789 -13.326 4.812 1.00 0.00 H new ATOM 0 HE2 HIS A 93 1.709 -13.324 5.309 1.00 0.00 H new ATOM 861 N ALA A 94 -1.609 -12.121 0.089 1.00 0.00 N ATOM 862 CA ALA A 94 -2.978 -11.772 -0.268 1.00 0.00 C ATOM 863 C ALA A 94 -3.439 -10.549 0.515 1.00 0.00 C ATOM 864 O ALA A 94 -3.365 -10.524 1.743 1.00 0.00 O ATOM 865 CB ALA A 94 -3.907 -12.948 -0.007 1.00 0.00 C ATOM 0 H ALA A 94 -1.532 -12.839 0.809 1.00 0.00 H new ATOM 0 HA ALA A 94 -3.008 -11.532 -1.331 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.926 -12.673 -0.278 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -3.590 -13.802 -0.605 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -3.871 -13.212 1.050 1.00 0.00 H new ATOM 871 N ILE A 95 -3.909 -9.535 -0.200 1.00 0.00 N ATOM 872 CA ILE A 95 -4.373 -8.308 0.438 1.00 0.00 C ATOM 873 C ILE A 95 -5.850 -8.398 0.802 1.00 0.00 C ATOM 874 O ILE A 95 -6.696 -8.664 -0.051 1.00 0.00 O ATOM 875 CB ILE A 95 -4.158 -7.078 -0.465 1.00 0.00 C ATOM 876 CG1 ILE A 95 -2.835 -7.193 -1.226 1.00 0.00 C ATOM 877 CG2 ILE A 95 -4.190 -5.803 0.366 1.00 0.00 C ATOM 878 CD1 ILE A 95 -1.616 -7.154 -0.330 1.00 0.00 C ATOM 0 H ILE A 95 -3.979 -9.537 -1.218 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.781 -8.190 1.346 1.00 0.00 H new ATOM 0 HB ILE A 95 -4.967 -7.037 -1.194 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -2.830 -8.125 -1.791 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.770 -6.381 -1.950 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -4.037 -4.941 -0.284 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -5.157 -5.716 0.862 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -3.399 -5.837 1.116 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -0.715 -7.240 -0.937 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -1.596 -6.211 0.216 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -1.658 -7.982 0.377 1.00 0.00 H new ATOM 890 N THR A 96 -6.153 -8.163 2.074 1.00 0.00 N ATOM 891 CA THR A 96 -7.529 -8.204 2.552 1.00 0.00 C ATOM 892 C THR A 96 -8.177 -6.835 2.397 1.00 0.00 C ATOM 893 O THR A 96 -7.492 -5.815 2.410 1.00 0.00 O ATOM 894 CB THR A 96 -7.576 -8.647 4.017 1.00 0.00 C ATOM 895 OG1 THR A 96 -6.334 -9.201 4.416 1.00 0.00 O ATOM 896 CG2 THR A 96 -8.649 -9.677 4.297 1.00 0.00 C ATOM 0 H THR A 96 -5.463 -7.942 2.792 1.00 0.00 H new ATOM 0 HA THR A 96 -8.083 -8.928 1.954 1.00 0.00 H new ATOM 0 HB THR A 96 -7.805 -7.744 4.583 1.00 0.00 H new ATOM 0 HG1 THR A 96 -5.693 -8.479 4.584 1.00 0.00 H new ATOM 0 HG21 THR A 96 -8.627 -9.947 5.353 1.00 0.00 H new ATOM 0 HG22 THR A 96 -9.626 -9.262 4.049 1.00 0.00 H new ATOM 0 HG23 THR A 96 -8.468 -10.565 3.692 1.00 0.00 H new ATOM 904 N ARG A 97 -9.497 -6.814 2.244 1.00 0.00 N ATOM 905 CA ARG A 97 -10.219 -5.558 2.081 1.00 0.00 C ATOM 906 C ARG A 97 -11.201 -5.332 3.224 1.00 0.00 C ATOM 907 O ARG A 97 -12.196 -6.046 3.353 1.00 0.00 O ATOM 908 CB ARG A 97 -10.961 -5.540 0.743 1.00 0.00 C ATOM 909 CG ARG A 97 -10.486 -4.443 -0.198 1.00 0.00 C ATOM 910 CD ARG A 97 -11.640 -3.586 -0.695 1.00 0.00 C ATOM 911 NE ARG A 97 -11.209 -2.225 -1.010 1.00 0.00 N ATOM 912 CZ ARG A 97 -11.769 -1.464 -1.949 1.00 0.00 C ATOM 913 NH1 ARG A 97 -12.804 -1.910 -2.650 1.00 0.00 N ATOM 914 NH2 ARG A 97 -11.293 -0.248 -2.184 1.00 0.00 N ATOM 0 H ARG A 97 -10.085 -7.647 2.230 1.00 0.00 H new ATOM 0 HA ARG A 97 -9.488 -4.750 2.095 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -10.837 -6.506 0.254 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -12.027 -5.412 0.929 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -9.760 -3.813 0.316 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -9.973 -4.891 -1.049 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -12.077 -4.044 -1.583 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -12.422 -3.553 0.064 1.00 0.00 H new ATOM 0 HE ARG A 97 -10.432 -1.834 -0.478 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -13.177 -2.842 -2.472 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -13.226 -1.320 -3.367 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -10.500 0.102 -1.646 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -11.720 0.337 -2.902 1.00 0.00 H new ATOM 928 N TYR A 98 -10.915 -4.330 4.047 1.00 0.00 N ATOM 929 CA TYR A 98 -11.773 -3.999 5.176 1.00 0.00 C ATOM 930 C TYR A 98 -12.423 -2.635 4.976 1.00 0.00 C ATOM 931 O TYR A 98 -11.811 -1.598 5.243 1.00 0.00 O ATOM 932 CB TYR A 98 -10.965 -4.008 6.475 1.00 0.00 C ATOM 933 CG TYR A 98 -10.667 -5.395 6.996 1.00 0.00 C ATOM 934 CD1 TYR A 98 -9.668 -6.172 6.422 1.00 0.00 C ATOM 935 CD2 TYR A 98 -11.382 -5.927 8.061 1.00 0.00 C ATOM 936 CE1 TYR A 98 -9.391 -7.440 6.895 1.00 0.00 C ATOM 937 CE2 TYR A 98 -11.111 -7.195 8.540 1.00 0.00 C ATOM 938 CZ TYR A 98 -10.115 -7.947 7.954 1.00 0.00 C ATOM 939 OH TYR A 98 -9.841 -9.210 8.429 1.00 0.00 O ATOM 0 H TYR A 98 -10.094 -3.732 3.953 1.00 0.00 H new ATOM 0 HA TYR A 98 -12.559 -4.752 5.241 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -10.025 -3.481 6.311 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -11.513 -3.453 7.237 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -9.099 -5.778 5.593 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -12.163 -5.340 8.523 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -8.611 -8.031 6.438 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -11.676 -7.595 9.369 1.00 0.00 H new ATOM 0 HH TYR A 98 -10.440 -9.415 9.177 1.00 0.00 H new ATOM 949 N GLY A 99 -13.666 -2.639 4.505 1.00 0.00 N ATOM 950 CA GLY A 99 -14.375 -1.395 4.280 1.00 0.00 C ATOM 951 C GLY A 99 -14.915 -0.797 5.562 1.00 0.00 C ATOM 952 O GLY A 99 -15.696 -1.432 6.271 1.00 0.00 O ATOM 0 H GLY A 99 -14.194 -3.481 4.276 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -13.705 -0.680 3.803 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -15.199 -1.570 3.589 1.00 0.00 H new ATOM 956 N ILE A 100 -14.496 0.427 5.858 1.00 0.00 N ATOM 957 CA ILE A 100 -14.942 1.114 7.067 1.00 0.00 C ATOM 958 C ILE A 100 -15.291 2.574 6.789 1.00 0.00 C ATOM 959 O ILE A 100 -15.446 3.369 7.716 1.00 0.00 O ATOM 960 CB ILE A 100 -13.872 1.058 8.174 1.00 0.00 C ATOM 961 CG1 ILE A 100 -12.569 1.693 7.687 1.00 0.00 C ATOM 962 CG2 ILE A 100 -13.637 -0.379 8.615 1.00 0.00 C ATOM 963 CD1 ILE A 100 -12.438 3.155 8.055 1.00 0.00 C ATOM 0 H ILE A 100 -13.850 0.965 5.280 1.00 0.00 H new ATOM 0 HA ILE A 100 -15.837 0.592 7.405 1.00 0.00 H new ATOM 0 HB ILE A 100 -14.231 1.625 9.033 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -11.727 1.143 8.107 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -12.507 1.592 6.603 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -12.878 -0.400 9.397 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -14.567 -0.798 9.000 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -13.297 -0.970 7.764 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -11.491 3.541 7.679 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -13.261 3.717 7.612 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -12.468 3.261 9.139 1.00 0.00 H new ATOM 975 N SER A 101 -15.415 2.924 5.513 1.00 0.00 N ATOM 976 CA SER A 101 -15.745 4.291 5.124 1.00 0.00 C ATOM 977 C SER A 101 -17.108 4.355 4.439 1.00 0.00 C ATOM 978 O SER A 101 -17.780 5.384 4.471 1.00 0.00 O ATOM 979 CB SER A 101 -14.672 4.848 4.188 1.00 0.00 C ATOM 980 OG SER A 101 -13.372 4.536 4.658 1.00 0.00 O ATOM 0 H SER A 101 -15.292 2.281 4.731 1.00 0.00 H new ATOM 0 HA SER A 101 -15.785 4.896 6.030 1.00 0.00 H new ATOM 0 HB2 SER A 101 -14.809 4.437 3.188 1.00 0.00 H new ATOM 0 HB3 SER A 101 -14.782 5.929 4.106 1.00 0.00 H new ATOM 0 HG SER A 101 -12.851 4.129 3.934 1.00 0.00 H new ATOM 986 N THR A 102 -17.502 3.249 3.817 1.00 0.00 N ATOM 987 CA THR A 102 -18.778 3.174 3.115 1.00 0.00 C ATOM 988 C THR A 102 -19.126 1.726 2.785 1.00 0.00 C ATOM 989 O THR A 102 -18.278 0.838 2.876 1.00 0.00 O ATOM 990 CB THR A 102 -18.720 3.998 1.826 1.00 0.00 C ATOM 991 OG1 THR A 102 -18.214 5.297 2.081 1.00 0.00 O ATOM 992 CG2 THR A 102 -20.064 4.156 1.150 1.00 0.00 C ATOM 0 H THR A 102 -16.954 2.389 3.785 1.00 0.00 H new ATOM 0 HA THR A 102 -19.552 3.580 3.767 1.00 0.00 H new ATOM 0 HB THR A 102 -18.061 3.439 1.161 1.00 0.00 H new ATOM 0 HG1 THR A 102 -18.501 5.591 2.971 1.00 0.00 H new ATOM 0 HG21 THR A 102 -19.948 4.750 0.244 1.00 0.00 H new ATOM 0 HG22 THR A 102 -20.459 3.174 0.891 1.00 0.00 H new ATOM 0 HG23 THR A 102 -20.755 4.658 1.827 1.00 0.00 H new ATOM 1000 N ASP A 103 -20.377 1.492 2.399 1.00 0.00 N ATOM 1001 CA ASP A 103 -20.830 0.150 2.054 1.00 0.00 C ATOM 1002 C ASP A 103 -20.842 -0.056 0.541 1.00 0.00 C ATOM 1003 O ASP A 103 -21.534 -0.937 0.032 1.00 0.00 O ATOM 1004 CB ASP A 103 -22.226 -0.098 2.619 1.00 0.00 C ATOM 1005 CG ASP A 103 -22.191 -0.577 4.057 1.00 0.00 C ATOM 1006 OD1 ASP A 103 -21.257 -0.190 4.790 1.00 0.00 O ATOM 1007 OD2 ASP A 103 -23.100 -1.337 4.451 1.00 0.00 O ATOM 0 H ASP A 103 -21.093 2.214 2.318 1.00 0.00 H new ATOM 0 HA ASP A 103 -20.131 -0.562 2.493 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -22.808 0.822 2.559 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -22.737 -0.839 2.004 1.00 0.00 H new ATOM 1012 N ASP A 104 -20.071 0.759 -0.173 1.00 0.00 N ATOM 1013 CA ASP A 104 -19.992 0.661 -1.625 1.00 0.00 C ATOM 1014 C ASP A 104 -18.537 0.720 -2.081 1.00 0.00 C ATOM 1015 O ASP A 104 -17.768 1.542 -1.587 1.00 0.00 O ATOM 1016 CB ASP A 104 -20.792 1.789 -2.280 1.00 0.00 C ATOM 1017 CG ASP A 104 -21.613 1.306 -3.459 1.00 0.00 C ATOM 1018 OD1 ASP A 104 -22.710 0.753 -3.233 1.00 0.00 O ATOM 1019 OD2 ASP A 104 -21.159 1.480 -4.610 1.00 0.00 O ATOM 0 H ASP A 104 -19.492 1.495 0.232 1.00 0.00 H new ATOM 0 HA ASP A 104 -20.419 -0.294 -1.930 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -21.454 2.239 -1.540 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -20.108 2.570 -2.612 1.00 0.00 H new ATOM 1024 N PRO A 105 -18.139 -0.151 -3.033 1.00 0.00 N ATOM 1025 CA PRO A 105 -16.772 -0.204 -3.559 1.00 0.00 C ATOM 1026 C PRO A 105 -16.096 1.162 -3.622 1.00 0.00 C ATOM 1027 O PRO A 105 -16.136 1.841 -4.647 1.00 0.00 O ATOM 1028 CB PRO A 105 -16.990 -0.768 -4.955 1.00 0.00 C ATOM 1029 CG PRO A 105 -18.123 -1.722 -4.783 1.00 0.00 C ATOM 1030 CD PRO A 105 -18.998 -1.160 -3.685 1.00 0.00 C ATOM 0 HA PRO A 105 -16.107 -0.794 -2.928 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -17.234 0.018 -5.670 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -16.097 -1.271 -5.327 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -18.685 -1.827 -5.711 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -17.757 -2.714 -4.518 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -19.907 -0.712 -4.087 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -19.308 -1.935 -2.984 1.00 0.00 H new ATOM 1038 N ASN A 106 -15.483 1.554 -2.512 1.00 0.00 N ATOM 1039 CA ASN A 106 -14.804 2.840 -2.429 1.00 0.00 C ATOM 1040 C ASN A 106 -13.634 2.796 -1.446 1.00 0.00 C ATOM 1041 O ASN A 106 -13.277 1.736 -0.934 1.00 0.00 O ATOM 1042 CB ASN A 106 -15.793 3.932 -2.019 1.00 0.00 C ATOM 1043 CG ASN A 106 -16.614 4.431 -3.191 1.00 0.00 C ATOM 1044 OD1 ASN A 106 -16.328 5.482 -3.764 1.00 0.00 O ATOM 1045 ND2 ASN A 106 -17.642 3.674 -3.552 1.00 0.00 N ATOM 0 H ASN A 106 -15.442 0.999 -1.657 1.00 0.00 H new ATOM 0 HA ASN A 106 -14.402 3.068 -3.416 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.460 3.545 -1.249 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.248 4.767 -1.578 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.233 3.956 -4.334 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.841 2.810 -3.047 1.00 0.00 H new ATOM 1052 N LYS A 107 -13.041 3.963 -1.200 1.00 0.00 N ATOM 1053 CA LYS A 107 -11.902 4.090 -0.291 1.00 0.00 C ATOM 1054 C LYS A 107 -12.105 3.271 0.985 1.00 0.00 C ATOM 1055 O LYS A 107 -12.973 3.576 1.801 1.00 0.00 O ATOM 1056 CB LYS A 107 -11.669 5.573 0.041 1.00 0.00 C ATOM 1057 CG LYS A 107 -11.134 5.842 1.445 1.00 0.00 C ATOM 1058 CD LYS A 107 -12.208 6.425 2.350 1.00 0.00 C ATOM 1059 CE LYS A 107 -12.744 7.739 1.805 1.00 0.00 C ATOM 1060 NZ LYS A 107 -12.937 8.750 2.881 1.00 0.00 N ATOM 0 H LYS A 107 -13.334 4.844 -1.623 1.00 0.00 H new ATOM 0 HA LYS A 107 -11.018 3.692 -0.790 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -10.968 5.987 -0.684 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -12.610 6.110 -0.082 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -10.758 4.914 1.876 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -10.291 6.531 1.388 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -13.026 5.712 2.452 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -11.798 6.584 3.347 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -12.053 8.131 1.059 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -13.693 7.562 1.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -13.303 9.631 2.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -13.616 8.387 3.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -12.027 8.939 3.347 1.00 0.00 H new ATOM 1074 N TRP A 108 -11.285 2.237 1.138 1.00 0.00 N ATOM 1075 CA TRP A 108 -11.347 1.359 2.298 1.00 0.00 C ATOM 1076 C TRP A 108 -9.944 0.968 2.755 1.00 0.00 C ATOM 1077 O TRP A 108 -8.951 1.353 2.138 1.00 0.00 O ATOM 1078 CB TRP A 108 -12.162 0.115 1.970 1.00 0.00 C ATOM 1079 CG TRP A 108 -13.611 0.410 1.755 1.00 0.00 C ATOM 1080 CD1 TRP A 108 -14.354 1.377 2.365 1.00 0.00 C ATOM 1081 CD2 TRP A 108 -14.493 -0.273 0.868 1.00 0.00 C ATOM 1082 NE1 TRP A 108 -15.644 1.340 1.903 1.00 0.00 N ATOM 1083 CE2 TRP A 108 -15.758 0.329 0.987 1.00 0.00 C ATOM 1084 CE3 TRP A 108 -14.331 -1.335 -0.014 1.00 0.00 C ATOM 1085 CZ2 TRP A 108 -16.859 -0.101 0.252 1.00 0.00 C ATOM 1086 CZ3 TRP A 108 -15.422 -1.763 -0.746 1.00 0.00 C ATOM 1087 CH2 TRP A 108 -16.673 -1.148 -0.609 1.00 0.00 C ATOM 0 H TRP A 108 -10.562 1.986 0.464 1.00 0.00 H new ATOM 0 HA TRP A 108 -11.834 1.896 3.112 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -11.755 -0.354 1.074 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -12.059 -0.605 2.782 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -13.981 2.071 3.104 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -16.396 1.964 2.194 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -13.371 -1.816 -0.125 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -17.823 0.374 0.357 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -15.308 -2.586 -1.436 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -17.507 -1.507 -1.194 1.00 0.00 H new ATOM 1098 N ARG A 109 -9.868 0.212 3.845 1.00 0.00 N ATOM 1099 CA ARG A 109 -8.582 -0.217 4.389 1.00 0.00 C ATOM 1100 C ARG A 109 -8.254 -1.635 3.947 1.00 0.00 C ATOM 1101 O ARG A 109 -9.142 -2.479 3.838 1.00 0.00 O ATOM 1102 CB ARG A 109 -8.616 -0.163 5.918 1.00 0.00 C ATOM 1103 CG ARG A 109 -8.082 1.131 6.501 1.00 0.00 C ATOM 1104 CD ARG A 109 -8.706 2.342 5.827 1.00 0.00 C ATOM 1105 NE ARG A 109 -7.849 2.882 4.774 1.00 0.00 N ATOM 1106 CZ ARG A 109 -8.188 3.904 3.991 1.00 0.00 C ATOM 1107 NH1 ARG A 109 -9.364 4.501 4.141 1.00 0.00 N ATOM 1108 NH2 ARG A 109 -7.350 4.331 3.057 1.00 0.00 N ATOM 0 H ARG A 109 -10.679 -0.116 4.369 1.00 0.00 H new ATOM 0 HA ARG A 109 -7.813 0.458 4.013 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -9.643 -0.304 6.254 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -8.034 -0.995 6.314 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -8.288 1.162 7.571 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -6.999 1.165 6.384 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -9.671 2.064 5.403 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -8.896 3.114 6.572 1.00 0.00 H new ATOM 0 HE ARG A 109 -6.936 2.450 4.630 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -10.012 4.177 4.859 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -9.619 5.284 3.539 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -6.445 3.877 2.938 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -7.610 5.114 2.458 1.00 0.00 H new ATOM 1122 N TYR A 110 -6.973 -1.900 3.705 1.00 0.00 N ATOM 1123 CA TYR A 110 -6.547 -3.225 3.294 1.00 0.00 C ATOM 1124 C TYR A 110 -5.708 -3.856 4.388 1.00 0.00 C ATOM 1125 O TYR A 110 -5.271 -3.167 5.308 1.00 0.00 O ATOM 1126 CB TYR A 110 -5.771 -3.160 1.983 1.00 0.00 C ATOM 1127 CG TYR A 110 -6.659 -2.961 0.778 1.00 0.00 C ATOM 1128 CD1 TYR A 110 -7.205 -1.714 0.494 1.00 0.00 C ATOM 1129 CD2 TYR A 110 -6.948 -4.015 -0.081 1.00 0.00 C ATOM 1130 CE1 TYR A 110 -8.011 -1.523 -0.612 1.00 0.00 C ATOM 1131 CE2 TYR A 110 -7.753 -3.831 -1.188 1.00 0.00 C ATOM 1132 CZ TYR A 110 -8.282 -2.585 -1.449 1.00 0.00 C ATOM 1133 OH TYR A 110 -9.082 -2.398 -2.551 1.00 0.00 O ATOM 0 H TYR A 110 -6.220 -1.217 3.787 1.00 0.00 H new ATOM 0 HA TYR A 110 -7.429 -3.844 3.128 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -5.050 -2.344 2.034 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -5.201 -4.081 1.859 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -6.996 -0.881 1.149 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -6.537 -4.993 0.120 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -8.426 -0.548 -0.820 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -7.967 -4.660 -1.846 1.00 0.00 H new ATOM 0 HH TYR A 110 -8.522 -2.302 -3.349 1.00 0.00 H new ATOM 1143 N TYR A 111 -5.506 -5.163 4.314 1.00 0.00 N ATOM 1144 CA TYR A 111 -4.738 -5.846 5.344 1.00 0.00 C ATOM 1145 C TYR A 111 -3.821 -6.919 4.776 1.00 0.00 C ATOM 1146 O TYR A 111 -4.256 -7.815 4.051 1.00 0.00 O ATOM 1147 CB TYR A 111 -5.684 -6.457 6.375 1.00 0.00 C ATOM 1148 CG TYR A 111 -6.168 -5.456 7.401 1.00 0.00 C ATOM 1149 CD1 TYR A 111 -7.026 -4.420 7.042 1.00 0.00 C ATOM 1150 CD2 TYR A 111 -5.752 -5.536 8.723 1.00 0.00 C ATOM 1151 CE1 TYR A 111 -7.455 -3.492 7.971 1.00 0.00 C ATOM 1152 CE2 TYR A 111 -6.181 -4.615 9.661 1.00 0.00 C ATOM 1153 CZ TYR A 111 -7.032 -3.596 9.281 1.00 0.00 C ATOM 1154 OH TYR A 111 -7.456 -2.676 10.211 1.00 0.00 O ATOM 0 H TYR A 111 -5.856 -5.763 3.567 1.00 0.00 H new ATOM 0 HA TYR A 111 -4.100 -5.101 5.819 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -6.544 -6.887 5.861 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -5.176 -7.275 6.886 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -7.362 -4.340 6.019 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -5.083 -6.329 9.023 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -8.116 -2.691 7.675 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -5.852 -4.692 10.687 1.00 0.00 H new ATOM 0 HH TYR A 111 -7.068 -2.892 11.085 1.00 0.00 H new ATOM 1164 N LEU A 112 -2.549 -6.825 5.140 1.00 0.00 N ATOM 1165 CA LEU A 112 -1.545 -7.785 4.710 1.00 0.00 C ATOM 1166 C LEU A 112 -1.288 -8.777 5.834 1.00 0.00 C ATOM 1167 O LEU A 112 -0.614 -8.455 6.813 1.00 0.00 O ATOM 1168 CB LEU A 112 -0.249 -7.061 4.338 1.00 0.00 C ATOM 1169 CG LEU A 112 0.683 -7.825 3.398 1.00 0.00 C ATOM 1170 CD1 LEU A 112 0.868 -9.259 3.871 1.00 0.00 C ATOM 1171 CD2 LEU A 112 0.141 -7.791 1.978 1.00 0.00 C ATOM 0 H LEU A 112 -2.187 -6.084 5.739 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.906 -8.319 3.831 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -0.505 -6.109 3.873 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.295 -6.832 5.254 1.00 0.00 H new ATOM 0 HG LEU A 112 1.659 -7.339 3.407 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.535 -9.784 3.187 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.300 -9.259 4.872 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.099 -9.762 3.893 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.814 -8.339 1.318 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -0.846 -8.253 1.954 1.00 0.00 H new ATOM 0 HD23 LEU A 112 0.066 -6.757 1.642 1.00 0.00 H new ATOM 1183 N ASP A 113 -1.848 -9.975 5.711 1.00 0.00 N ATOM 1184 CA ASP A 113 -1.690 -10.987 6.742 1.00 0.00 C ATOM 1185 C ASP A 113 -2.408 -10.527 8.021 1.00 0.00 C ATOM 1186 O ASP A 113 -3.604 -10.240 7.985 1.00 0.00 O ATOM 1187 CB ASP A 113 -0.200 -11.258 6.993 1.00 0.00 C ATOM 1188 CG ASP A 113 0.039 -12.558 7.737 1.00 0.00 C ATOM 1189 OD1 ASP A 113 0.783 -13.413 7.212 1.00 0.00 O ATOM 1190 OD2 ASP A 113 -0.518 -12.721 8.844 1.00 0.00 O ATOM 0 H ASP A 113 -2.412 -10.266 4.912 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.141 -11.924 6.415 1.00 0.00 H new ATOM 0 HB2 ASP A 113 0.326 -11.288 6.039 1.00 0.00 H new ATOM 0 HB3 ASP A 113 0.224 -10.433 7.565 1.00 0.00 H new ATOM 1195 N SER A 114 -1.690 -10.440 9.140 1.00 0.00 N ATOM 1196 CA SER A 114 -2.286 -9.995 10.392 1.00 0.00 C ATOM 1197 C SER A 114 -2.014 -8.511 10.634 1.00 0.00 C ATOM 1198 O SER A 114 -2.185 -8.016 11.748 1.00 0.00 O ATOM 1199 CB SER A 114 -1.744 -10.820 11.561 1.00 0.00 C ATOM 1200 OG SER A 114 -0.444 -11.310 11.279 1.00 0.00 O ATOM 0 H SER A 114 -0.699 -10.672 9.202 1.00 0.00 H new ATOM 0 HA SER A 114 -3.364 -10.140 10.320 1.00 0.00 H new ATOM 0 HB2 SER A 114 -1.718 -10.207 12.462 1.00 0.00 H new ATOM 0 HB3 SER A 114 -2.415 -11.655 11.763 1.00 0.00 H new ATOM 0 HG SER A 114 -0.484 -11.922 10.515 1.00 0.00 H new ATOM 1206 N VAL A 115 -1.580 -7.803 9.591 1.00 0.00 N ATOM 1207 CA VAL A 115 -1.278 -6.381 9.709 1.00 0.00 C ATOM 1208 C VAL A 115 -2.121 -5.548 8.749 1.00 0.00 C ATOM 1209 O VAL A 115 -2.577 -6.039 7.718 1.00 0.00 O ATOM 1210 CB VAL A 115 0.213 -6.102 9.438 1.00 0.00 C ATOM 1211 CG1 VAL A 115 0.552 -4.651 9.742 1.00 0.00 C ATOM 1212 CG2 VAL A 115 1.088 -7.042 10.252 1.00 0.00 C ATOM 0 H VAL A 115 -1.431 -8.191 8.660 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.518 -6.095 10.733 1.00 0.00 H new ATOM 0 HB VAL A 115 0.409 -6.282 8.381 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.609 -4.475 9.544 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.049 -3.997 9.110 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.339 -4.439 10.790 1.00 0.00 H new ATOM 0 HG21 VAL A 115 2.138 -6.830 10.048 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.888 -6.897 11.314 1.00 0.00 H new ATOM 0 HG23 VAL A 115 0.866 -8.074 9.979 1.00 0.00 H new ATOM 1222 N GLU A 116 -2.321 -4.280 9.099 1.00 0.00 N ATOM 1223 CA GLU A 116 -3.106 -3.370 8.273 1.00 0.00 C ATOM 1224 C GLU A 116 -2.220 -2.665 7.251 1.00 0.00 C ATOM 1225 O GLU A 116 -1.113 -2.231 7.572 1.00 0.00 O ATOM 1226 CB GLU A 116 -3.812 -2.334 9.149 1.00 0.00 C ATOM 1227 CG GLU A 116 -2.861 -1.492 9.984 1.00 0.00 C ATOM 1228 CD GLU A 116 -2.727 -2.001 11.406 1.00 0.00 C ATOM 1229 OE1 GLU A 116 -1.591 -2.304 11.824 1.00 0.00 O ATOM 1230 OE2 GLU A 116 -3.760 -2.095 12.102 1.00 0.00 O ATOM 0 H GLU A 116 -1.949 -3.860 9.951 1.00 0.00 H new ATOM 0 HA GLU A 116 -3.854 -3.956 7.739 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -4.404 -1.676 8.513 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.509 -2.846 9.813 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -1.879 -1.483 9.511 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -3.215 -0.461 10.003 1.00 0.00 H new ATOM 1237 N VAL A 117 -2.709 -2.555 6.021 1.00 0.00 N ATOM 1238 CA VAL A 117 -1.954 -1.901 4.961 1.00 0.00 C ATOM 1239 C VAL A 117 -2.856 -1.078 4.047 1.00 0.00 C ATOM 1240 O VAL A 117 -4.089 -1.211 4.061 1.00 0.00 O ATOM 1241 CB VAL A 117 -1.178 -2.924 4.109 1.00 0.00 C ATOM 1242 CG1 VAL A 117 -0.014 -3.503 4.898 1.00 0.00 C ATOM 1243 CG2 VAL A 117 -2.106 -4.027 3.622 1.00 0.00 C ATOM 0 H VAL A 117 -3.622 -2.909 5.735 1.00 0.00 H new ATOM 0 HA VAL A 117 -1.248 -1.233 5.455 1.00 0.00 H new ATOM 0 HB VAL A 117 -0.774 -2.411 3.236 1.00 0.00 H new ATOM 0 HG11 VAL A 117 0.522 -4.223 4.280 1.00 0.00 H new ATOM 0 HG12 VAL A 117 0.663 -2.700 5.190 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -0.392 -4.001 5.791 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -1.540 -4.740 3.022 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -2.543 -4.540 4.479 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -2.901 -3.593 3.016 1.00 0.00 H new ATOM 1253 N HIS A 118 -2.222 -0.215 3.262 1.00 0.00 N ATOM 1254 CA HIS A 118 -2.930 0.657 2.337 1.00 0.00 C ATOM 1255 C HIS A 118 -2.751 0.202 0.890 1.00 0.00 C ATOM 1256 O HIS A 118 -1.651 0.261 0.339 1.00 0.00 O ATOM 1257 CB HIS A 118 -2.420 2.087 2.490 1.00 0.00 C ATOM 1258 CG HIS A 118 -3.180 3.096 1.683 1.00 0.00 C ATOM 1259 ND1 HIS A 118 -4.055 3.998 2.244 1.00 0.00 N ATOM 1260 CD2 HIS A 118 -3.189 3.352 0.349 1.00 0.00 C ATOM 1261 CE1 HIS A 118 -4.566 4.760 1.298 1.00 0.00 C ATOM 1262 NE2 HIS A 118 -4.060 4.387 0.136 1.00 0.00 N ATOM 0 H HIS A 118 -1.208 -0.101 3.250 1.00 0.00 H new ATOM 0 HA HIS A 118 -3.992 0.612 2.576 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -2.468 2.368 3.542 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -1.370 2.120 2.199 1.00 0.00 H new ATOM 0 HD1 HIS A 118 -4.274 4.066 3.238 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -2.615 2.834 -0.405 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -5.280 5.557 1.448 1.00 0.00 H new ATOM 1271 N LEU A 119 -3.846 -0.232 0.277 1.00 0.00 N ATOM 1272 CA LEU A 119 -3.833 -0.677 -1.111 1.00 0.00 C ATOM 1273 C LEU A 119 -4.763 0.205 -1.941 1.00 0.00 C ATOM 1274 O LEU A 119 -5.965 0.259 -1.682 1.00 0.00 O ATOM 1275 CB LEU A 119 -4.269 -2.138 -1.201 1.00 0.00 C ATOM 1276 CG LEU A 119 -4.188 -2.748 -2.594 1.00 0.00 C ATOM 1277 CD1 LEU A 119 -4.055 -4.260 -2.515 1.00 0.00 C ATOM 1278 CD2 LEU A 119 -5.404 -2.353 -3.406 1.00 0.00 C ATOM 0 H LEU A 119 -4.761 -0.285 0.724 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.819 -0.594 -1.503 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.650 -2.729 -0.525 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -5.296 -2.218 -0.845 1.00 0.00 H new ATOM 0 HG LEU A 119 -3.299 -2.362 -3.092 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -3.999 -4.673 -3.522 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -3.149 -4.517 -1.966 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -4.921 -4.675 -2.000 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -5.336 -2.794 -4.400 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.305 -2.713 -2.910 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.446 -1.267 -3.493 1.00 0.00 H new ATOM 1290 N PRO A 120 -4.225 0.928 -2.941 1.00 0.00 N ATOM 1291 CA PRO A 120 -5.027 1.821 -3.781 1.00 0.00 C ATOM 1292 C PRO A 120 -6.230 1.118 -4.408 1.00 0.00 C ATOM 1293 O PRO A 120 -6.137 -0.024 -4.854 1.00 0.00 O ATOM 1294 CB PRO A 120 -4.046 2.306 -4.858 1.00 0.00 C ATOM 1295 CG PRO A 120 -2.857 1.415 -4.750 1.00 0.00 C ATOM 1296 CD PRO A 120 -2.807 0.951 -3.323 1.00 0.00 C ATOM 0 HA PRO A 120 -5.458 2.636 -3.199 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.492 2.245 -5.851 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -3.770 3.348 -4.696 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -2.942 0.569 -5.431 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -1.945 1.949 -5.017 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -2.347 -0.033 -3.233 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -2.230 1.631 -2.696 1.00 0.00 H new ATOM 1304 N PRO A 121 -7.387 1.799 -4.443 1.00 0.00 N ATOM 1305 CA PRO A 121 -8.632 1.251 -5.001 1.00 0.00 C ATOM 1306 C PRO A 121 -8.503 0.740 -6.436 1.00 0.00 C ATOM 1307 O PRO A 121 -9.412 0.080 -6.940 1.00 0.00 O ATOM 1308 CB PRO A 121 -9.608 2.436 -4.951 1.00 0.00 C ATOM 1309 CG PRO A 121 -8.759 3.640 -4.729 1.00 0.00 C ATOM 1310 CD PRO A 121 -7.588 3.163 -3.927 1.00 0.00 C ATOM 0 HA PRO A 121 -8.951 0.377 -4.433 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -10.172 2.519 -5.880 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.334 2.313 -4.147 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.436 4.072 -5.676 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -9.310 4.415 -4.196 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -6.709 3.789 -4.080 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.799 3.166 -2.858 1.00 0.00 H new ATOM 1318 N PHE A 122 -7.394 1.048 -7.104 1.00 0.00 N ATOM 1319 CA PHE A 122 -7.212 0.605 -8.485 1.00 0.00 C ATOM 1320 C PHE A 122 -6.621 -0.801 -8.565 1.00 0.00 C ATOM 1321 O PHE A 122 -6.552 -1.384 -9.648 1.00 0.00 O ATOM 1322 CB PHE A 122 -6.337 1.576 -9.298 1.00 0.00 C ATOM 1323 CG PHE A 122 -5.541 2.570 -8.495 1.00 0.00 C ATOM 1324 CD1 PHE A 122 -6.165 3.520 -7.695 1.00 0.00 C ATOM 1325 CD2 PHE A 122 -4.158 2.560 -8.556 1.00 0.00 C ATOM 1326 CE1 PHE A 122 -5.420 4.434 -6.974 1.00 0.00 C ATOM 1327 CE2 PHE A 122 -3.410 3.469 -7.837 1.00 0.00 C ATOM 1328 CZ PHE A 122 -4.041 4.408 -7.045 1.00 0.00 C ATOM 0 H PHE A 122 -6.621 1.592 -6.721 1.00 0.00 H new ATOM 0 HA PHE A 122 -8.210 0.589 -8.923 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -5.646 0.991 -9.905 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -6.980 2.125 -9.986 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -7.243 3.544 -7.636 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -3.658 1.830 -9.175 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -5.916 5.168 -6.356 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -2.332 3.446 -7.893 1.00 0.00 H new ATOM 0 HZ PHE A 122 -3.457 5.121 -6.482 1.00 0.00 H new ATOM 1338 N TRP A 123 -6.195 -1.353 -7.433 1.00 0.00 N ATOM 1339 CA TRP A 123 -5.619 -2.692 -7.426 1.00 0.00 C ATOM 1340 C TRP A 123 -6.603 -3.722 -6.874 1.00 0.00 C ATOM 1341 O TRP A 123 -6.309 -4.916 -6.858 1.00 0.00 O ATOM 1342 CB TRP A 123 -4.330 -2.704 -6.613 1.00 0.00 C ATOM 1343 CG TRP A 123 -3.277 -1.792 -7.153 1.00 0.00 C ATOM 1344 CD1 TRP A 123 -3.205 -1.252 -8.404 1.00 0.00 C ATOM 1345 CD2 TRP A 123 -2.145 -1.309 -6.441 1.00 0.00 C ATOM 1346 NE1 TRP A 123 -2.087 -0.452 -8.506 1.00 0.00 N ATOM 1347 CE2 TRP A 123 -1.423 -0.472 -7.309 1.00 0.00 C ATOM 1348 CE3 TRP A 123 -1.677 -1.504 -5.147 1.00 0.00 C ATOM 1349 CZ2 TRP A 123 -0.254 0.171 -6.913 1.00 0.00 C ATOM 1350 CZ3 TRP A 123 -0.523 -0.869 -4.757 1.00 0.00 C ATOM 1351 CH2 TRP A 123 0.175 -0.042 -5.634 1.00 0.00 C ATOM 0 H TRP A 123 -6.237 -0.900 -6.520 1.00 0.00 H new ATOM 0 HA TRP A 123 -5.395 -2.966 -8.457 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -4.555 -2.418 -5.585 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -3.938 -3.721 -6.583 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -3.918 -1.426 -9.196 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -1.802 0.068 -9.336 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -2.211 -2.144 -4.460 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 0.292 0.812 -7.589 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -0.151 -1.013 -3.754 1.00 0.00 H new ATOM 0 HH2 TRP A 123 1.078 0.443 -5.294 1.00 0.00 H new ATOM 1362 N GLU A 124 -7.775 -3.266 -6.431 1.00 0.00 N ATOM 1363 CA GLU A 124 -8.789 -4.169 -5.898 1.00 0.00 C ATOM 1364 C GLU A 124 -9.046 -5.314 -6.871 1.00 0.00 C ATOM 1365 O GLU A 124 -9.308 -6.446 -6.466 1.00 0.00 O ATOM 1366 CB GLU A 124 -10.088 -3.409 -5.628 1.00 0.00 C ATOM 1367 CG GLU A 124 -10.700 -3.725 -4.279 1.00 0.00 C ATOM 1368 CD GLU A 124 -11.987 -4.519 -4.389 1.00 0.00 C ATOM 1369 OE1 GLU A 124 -12.944 -4.014 -5.012 1.00 0.00 O ATOM 1370 OE2 GLU A 124 -12.037 -5.647 -3.854 1.00 0.00 O ATOM 0 H GLU A 124 -8.042 -2.282 -6.431 1.00 0.00 H new ATOM 0 HA GLU A 124 -8.422 -4.583 -4.959 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -9.893 -2.338 -5.689 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -10.809 -3.647 -6.410 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -9.982 -4.287 -3.682 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -10.897 -2.794 -3.748 1.00 0.00 H new ATOM 1377 N GLN A 125 -8.955 -5.004 -8.159 1.00 0.00 N ATOM 1378 CA GLN A 125 -9.160 -5.996 -9.205 1.00 0.00 C ATOM 1379 C GLN A 125 -7.852 -6.713 -9.524 1.00 0.00 C ATOM 1380 O GLN A 125 -7.853 -7.851 -9.993 1.00 0.00 O ATOM 1381 CB GLN A 125 -9.708 -5.327 -10.466 1.00 0.00 C ATOM 1382 CG GLN A 125 -8.920 -4.098 -10.894 1.00 0.00 C ATOM 1383 CD GLN A 125 -9.708 -2.812 -10.735 1.00 0.00 C ATOM 1384 OE1 GLN A 125 -10.938 -2.824 -10.699 1.00 0.00 O ATOM 1385 NE2 GLN A 125 -9.000 -1.692 -10.639 1.00 0.00 N ATOM 0 H GLN A 125 -8.739 -4.069 -8.504 1.00 0.00 H new ATOM 0 HA GLN A 125 -9.883 -6.729 -8.848 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -9.707 -6.051 -11.281 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -10.746 -5.041 -10.294 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -8.006 -4.034 -10.304 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -8.620 -4.209 -11.936 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -7.981 -1.728 -10.674 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -9.475 -0.796 -10.531 1.00 0.00 H new ATOM 1394 N TYR A 126 -6.737 -6.035 -9.267 1.00 0.00 N ATOM 1395 CA TYR A 126 -5.418 -6.597 -9.523 1.00 0.00 C ATOM 1396 C TYR A 126 -4.967 -7.513 -8.385 1.00 0.00 C ATOM 1397 O TYR A 126 -3.961 -8.212 -8.507 1.00 0.00 O ATOM 1398 CB TYR A 126 -4.395 -5.478 -9.718 1.00 0.00 C ATOM 1399 CG TYR A 126 -4.826 -4.409 -10.703 1.00 0.00 C ATOM 1400 CD1 TYR A 126 -5.890 -4.613 -11.575 1.00 0.00 C ATOM 1401 CD2 TYR A 126 -4.159 -3.193 -10.761 1.00 0.00 C ATOM 1402 CE1 TYR A 126 -6.277 -3.635 -12.471 1.00 0.00 C ATOM 1403 CE2 TYR A 126 -4.539 -2.210 -11.654 1.00 0.00 C ATOM 1404 CZ TYR A 126 -5.598 -2.436 -12.508 1.00 0.00 C ATOM 1405 OH TYR A 126 -5.979 -1.460 -13.400 1.00 0.00 O ATOM 0 H TYR A 126 -6.723 -5.091 -8.880 1.00 0.00 H new ATOM 0 HA TYR A 126 -5.485 -7.193 -10.433 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -4.197 -5.010 -8.754 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -3.456 -5.914 -10.060 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -6.423 -5.552 -11.551 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -3.328 -3.012 -10.096 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -7.107 -3.809 -13.139 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -4.009 -1.269 -11.683 1.00 0.00 H new ATOM 0 HH TYR A 126 -5.399 -0.677 -13.296 1.00 0.00 H new ATOM 1415 N ILE A 127 -5.704 -7.499 -7.277 1.00 0.00 N ATOM 1416 CA ILE A 127 -5.361 -8.324 -6.125 1.00 0.00 C ATOM 1417 C ILE A 127 -5.982 -9.716 -6.222 1.00 0.00 C ATOM 1418 O ILE A 127 -7.198 -9.876 -6.128 1.00 0.00 O ATOM 1419 CB ILE A 127 -5.798 -7.659 -4.803 1.00 0.00 C ATOM 1420 CG1 ILE A 127 -7.294 -7.335 -4.824 1.00 0.00 C ATOM 1421 CG2 ILE A 127 -4.990 -6.396 -4.551 1.00 0.00 C ATOM 1422 CD1 ILE A 127 -7.998 -7.671 -3.528 1.00 0.00 C ATOM 0 H ILE A 127 -6.540 -6.927 -7.154 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.276 -8.424 -6.129 1.00 0.00 H new ATOM 0 HB ILE A 127 -5.611 -8.363 -3.992 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -7.426 -6.274 -5.036 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -7.766 -7.884 -5.639 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -5.311 -5.940 -3.615 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -3.931 -6.648 -4.488 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -5.148 -5.694 -5.370 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -9.055 -7.417 -3.611 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -7.896 -8.737 -3.325 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -7.551 -7.102 -2.713 1.00 0.00 H new ATOM 1434 N ASN A 128 -5.131 -10.719 -6.410 1.00 0.00 N ATOM 1435 CA ASN A 128 -5.583 -12.104 -6.518 1.00 0.00 C ATOM 1436 C ASN A 128 -5.307 -12.864 -5.222 1.00 0.00 C ATOM 1437 O ASN A 128 -4.918 -12.267 -4.218 1.00 0.00 O ATOM 1438 CB ASN A 128 -4.879 -12.796 -7.689 1.00 0.00 C ATOM 1439 CG ASN A 128 -4.825 -11.927 -8.931 1.00 0.00 C ATOM 1440 OD1 ASN A 128 -5.619 -12.099 -9.856 1.00 0.00 O ATOM 1441 ND2 ASN A 128 -3.885 -10.987 -8.961 1.00 0.00 N ATOM 0 H ASN A 128 -4.121 -10.599 -6.491 1.00 0.00 H new ATOM 0 HA ASN A 128 -6.658 -12.103 -6.697 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -3.865 -13.063 -7.392 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.398 -13.726 -7.922 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -3.802 -10.375 -9.772 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -3.247 -10.878 -8.173 1.00 0.00 H new ATOM 1448 N ASP A 129 -5.498 -14.184 -5.248 1.00 0.00 N ATOM 1449 CA ASP A 129 -5.253 -15.015 -4.068 1.00 0.00 C ATOM 1450 C ASP A 129 -3.880 -14.696 -3.483 1.00 0.00 C ATOM 1451 O ASP A 129 -3.758 -14.315 -2.320 1.00 0.00 O ATOM 1452 CB ASP A 129 -5.342 -16.498 -4.431 1.00 0.00 C ATOM 1453 CG ASP A 129 -6.573 -17.165 -3.846 1.00 0.00 C ATOM 1454 OD1 ASP A 129 -7.624 -17.166 -4.520 1.00 0.00 O ATOM 1455 OD2 ASP A 129 -6.485 -17.684 -2.714 1.00 0.00 O ATOM 0 H ASP A 129 -5.820 -14.698 -6.068 1.00 0.00 H new ATOM 0 HA ASP A 129 -6.016 -14.797 -3.321 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -5.356 -16.603 -5.516 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -4.449 -17.011 -4.073 1.00 0.00 H new ATOM 1460 N GLU A 130 -2.858 -14.822 -4.319 1.00 0.00 N ATOM 1461 CA GLU A 130 -1.491 -14.515 -3.924 1.00 0.00 C ATOM 1462 C GLU A 130 -0.939 -13.471 -4.883 1.00 0.00 C ATOM 1463 O GLU A 130 -1.005 -13.651 -6.098 1.00 0.00 O ATOM 1464 CB GLU A 130 -0.624 -15.778 -3.949 1.00 0.00 C ATOM 1465 CG GLU A 130 0.165 -15.999 -2.668 1.00 0.00 C ATOM 1466 CD GLU A 130 -0.587 -16.844 -1.659 1.00 0.00 C ATOM 1467 OE1 GLU A 130 -1.729 -16.478 -1.311 1.00 0.00 O ATOM 1468 OE2 GLU A 130 -0.034 -17.873 -1.216 1.00 0.00 O ATOM 0 H GLU A 130 -2.953 -15.138 -5.284 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.479 -14.128 -2.905 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -1.262 -16.644 -4.127 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.070 -15.716 -4.787 1.00 0.00 H new ATOM 0 HG2 GLU A 130 1.112 -16.483 -2.908 1.00 0.00 H new ATOM 0 HG3 GLU A 130 0.404 -15.034 -2.222 1.00 0.00 H new ATOM 1475 N ASN A 131 -0.434 -12.361 -4.354 1.00 0.00 N ATOM 1476 CA ASN A 131 0.069 -11.301 -5.216 1.00 0.00 C ATOM 1477 C ASN A 131 1.401 -10.743 -4.750 1.00 0.00 C ATOM 1478 O ASN A 131 1.681 -10.665 -3.555 1.00 0.00 O ATOM 1479 CB ASN A 131 -0.943 -10.152 -5.298 1.00 0.00 C ATOM 1480 CG ASN A 131 -2.357 -10.578 -4.954 1.00 0.00 C ATOM 1481 OD1 ASN A 131 -2.823 -11.631 -5.389 1.00 0.00 O ATOM 1482 ND2 ASN A 131 -3.048 -9.757 -4.173 1.00 0.00 N ATOM 0 H ASN A 131 -0.363 -12.175 -3.354 1.00 0.00 H new ATOM 0 HA ASN A 131 0.217 -11.752 -6.197 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -0.635 -9.356 -4.620 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -0.930 -9.736 -6.305 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -4.006 -9.989 -3.910 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -2.621 -8.894 -3.835 1.00 0.00 H new ATOM 1489 N THR A 132 2.191 -10.308 -5.721 1.00 0.00 N ATOM 1490 CA THR A 132 3.476 -9.691 -5.446 1.00 0.00 C ATOM 1491 C THR A 132 3.223 -8.254 -5.025 1.00 0.00 C ATOM 1492 O THR A 132 2.789 -7.429 -5.837 1.00 0.00 O ATOM 1493 CB THR A 132 4.374 -9.736 -6.684 1.00 0.00 C ATOM 1494 OG1 THR A 132 4.460 -11.054 -7.195 1.00 0.00 O ATOM 1495 CG2 THR A 132 5.784 -9.253 -6.420 1.00 0.00 C ATOM 0 H THR A 132 1.960 -10.373 -6.712 1.00 0.00 H new ATOM 0 HA THR A 132 3.988 -10.233 -4.651 1.00 0.00 H new ATOM 0 HB THR A 132 3.906 -9.064 -7.403 1.00 0.00 H new ATOM 0 HG1 THR A 132 5.037 -11.061 -7.987 1.00 0.00 H new ATOM 0 HG21 THR A 132 6.367 -9.311 -7.339 1.00 0.00 H new ATOM 0 HG22 THR A 132 5.756 -8.220 -6.073 1.00 0.00 H new ATOM 0 HG23 THR A 132 6.246 -9.879 -5.657 1.00 0.00 H new ATOM 1503 N VAL A 133 3.437 -7.970 -3.747 1.00 0.00 N ATOM 1504 CA VAL A 133 3.176 -6.639 -3.216 1.00 0.00 C ATOM 1505 C VAL A 133 4.423 -5.970 -2.658 1.00 0.00 C ATOM 1506 O VAL A 133 5.195 -6.574 -1.912 1.00 0.00 O ATOM 1507 CB VAL A 133 2.098 -6.675 -2.106 1.00 0.00 C ATOM 1508 CG1 VAL A 133 0.784 -6.124 -2.625 1.00 0.00 C ATOM 1509 CG2 VAL A 133 1.903 -8.086 -1.561 1.00 0.00 C ATOM 0 H VAL A 133 3.789 -8.639 -3.062 1.00 0.00 H new ATOM 0 HA VAL A 133 2.820 -6.053 -4.063 1.00 0.00 H new ATOM 0 HB VAL A 133 2.446 -6.046 -1.286 1.00 0.00 H new ATOM 0 HG11 VAL A 133 0.037 -6.157 -1.832 1.00 0.00 H new ATOM 0 HG12 VAL A 133 0.924 -5.093 -2.949 1.00 0.00 H new ATOM 0 HG13 VAL A 133 0.445 -6.726 -3.468 1.00 0.00 H new ATOM 0 HG21 VAL A 133 1.139 -8.073 -0.784 1.00 0.00 H new ATOM 0 HG22 VAL A 133 1.589 -8.748 -2.368 1.00 0.00 H new ATOM 0 HG23 VAL A 133 2.842 -8.447 -1.141 1.00 0.00 H new ATOM 1519 N GLU A 134 4.581 -4.697 -3.000 1.00 0.00 N ATOM 1520 CA GLU A 134 5.693 -3.896 -2.519 1.00 0.00 C ATOM 1521 C GLU A 134 5.140 -2.705 -1.751 1.00 0.00 C ATOM 1522 O GLU A 134 4.419 -1.878 -2.313 1.00 0.00 O ATOM 1523 CB GLU A 134 6.571 -3.418 -3.674 1.00 0.00 C ATOM 1524 CG GLU A 134 6.963 -4.523 -4.641 1.00 0.00 C ATOM 1525 CD GLU A 134 8.019 -4.079 -5.635 1.00 0.00 C ATOM 1526 OE1 GLU A 134 8.724 -3.088 -5.349 1.00 0.00 O ATOM 1527 OE2 GLU A 134 8.139 -4.721 -6.700 1.00 0.00 O ATOM 0 H GLU A 134 3.942 -4.195 -3.617 1.00 0.00 H new ATOM 0 HA GLU A 134 6.315 -4.507 -1.865 1.00 0.00 H new ATOM 0 HB2 GLU A 134 6.042 -2.638 -4.222 1.00 0.00 H new ATOM 0 HB3 GLU A 134 7.475 -2.965 -3.268 1.00 0.00 H new ATOM 0 HG2 GLU A 134 7.336 -5.378 -4.078 1.00 0.00 H new ATOM 0 HG3 GLU A 134 6.078 -4.859 -5.182 1.00 0.00 H new ATOM 1534 N LEU A 135 5.446 -2.639 -0.464 1.00 0.00 N ATOM 1535 CA LEU A 135 4.934 -1.563 0.376 1.00 0.00 C ATOM 1536 C LEU A 135 6.002 -0.978 1.291 1.00 0.00 C ATOM 1537 O LEU A 135 6.908 -1.677 1.742 1.00 0.00 O ATOM 1538 CB LEU A 135 3.772 -2.084 1.226 1.00 0.00 C ATOM 1539 CG LEU A 135 4.008 -3.449 1.881 1.00 0.00 C ATOM 1540 CD1 LEU A 135 4.831 -3.302 3.152 1.00 0.00 C ATOM 1541 CD2 LEU A 135 2.683 -4.138 2.178 1.00 0.00 C ATOM 0 H LEU A 135 6.041 -3.311 0.020 1.00 0.00 H new ATOM 0 HA LEU A 135 4.598 -0.767 -0.289 1.00 0.00 H new ATOM 0 HB2 LEU A 135 3.558 -1.355 2.008 1.00 0.00 H new ATOM 0 HB3 LEU A 135 2.883 -2.148 0.598 1.00 0.00 H new ATOM 0 HG LEU A 135 4.568 -4.069 1.182 1.00 0.00 H new ATOM 0 HD11 LEU A 135 4.986 -4.283 3.600 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.796 -2.856 2.911 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.301 -2.661 3.857 1.00 0.00 H new ATOM 0 HD21 LEU A 135 2.872 -5.106 2.643 1.00 0.00 H new ATOM 0 HD22 LEU A 135 2.095 -3.519 2.855 1.00 0.00 H new ATOM 0 HD23 LEU A 135 2.132 -4.283 1.249 1.00 0.00 H new ATOM 1553 N ILE A 136 5.852 0.309 1.593 1.00 0.00 N ATOM 1554 CA ILE A 136 6.765 1.005 2.491 1.00 0.00 C ATOM 1555 C ILE A 136 6.028 1.288 3.795 1.00 0.00 C ATOM 1556 O ILE A 136 4.884 1.730 3.775 1.00 0.00 O ATOM 1557 CB ILE A 136 7.305 2.333 1.898 1.00 0.00 C ATOM 1558 CG1 ILE A 136 6.818 2.557 0.461 1.00 0.00 C ATOM 1559 CG2 ILE A 136 8.821 2.335 1.930 1.00 0.00 C ATOM 1560 CD1 ILE A 136 5.710 3.581 0.355 1.00 0.00 C ATOM 0 H ILE A 136 5.101 0.893 1.225 1.00 0.00 H new ATOM 0 HA ILE A 136 7.631 0.364 2.653 1.00 0.00 H new ATOM 0 HB ILE A 136 6.921 3.148 2.512 1.00 0.00 H new ATOM 0 HG12 ILE A 136 7.659 2.878 -0.154 1.00 0.00 H new ATOM 0 HG13 ILE A 136 6.467 1.609 0.052 1.00 0.00 H new ATOM 0 HG21 ILE A 136 9.193 3.271 1.512 1.00 0.00 H new ATOM 0 HG22 ILE A 136 9.163 2.237 2.960 1.00 0.00 H new ATOM 0 HG23 ILE A 136 9.198 1.499 1.341 1.00 0.00 H new ATOM 0 HD11 ILE A 136 5.414 3.690 -0.688 1.00 0.00 H new ATOM 0 HD12 ILE A 136 4.853 3.252 0.943 1.00 0.00 H new ATOM 0 HD13 ILE A 136 6.063 4.540 0.734 1.00 0.00 H new ATOM 1572 N HIS A 137 6.664 1.008 4.926 1.00 0.00 N ATOM 1573 CA HIS A 137 6.019 1.204 6.216 1.00 0.00 C ATOM 1574 C HIS A 137 5.998 2.671 6.621 1.00 0.00 C ATOM 1575 O HIS A 137 7.041 3.298 6.799 1.00 0.00 O ATOM 1576 CB HIS A 137 6.707 0.345 7.276 1.00 0.00 C ATOM 1577 CG HIS A 137 6.864 -1.085 6.847 1.00 0.00 C ATOM 1578 ND1 HIS A 137 6.146 -2.127 7.400 1.00 0.00 N ATOM 1579 CD2 HIS A 137 7.646 -1.640 5.890 1.00 0.00 C ATOM 1580 CE1 HIS A 137 6.482 -3.258 6.799 1.00 0.00 C ATOM 1581 NE2 HIS A 137 7.389 -2.987 5.882 1.00 0.00 N ATOM 0 H HIS A 137 7.617 0.648 4.976 1.00 0.00 H new ATOM 0 HA HIS A 137 4.979 0.888 6.129 1.00 0.00 H new ATOM 0 HB2 HIS A 137 7.689 0.764 7.497 1.00 0.00 H new ATOM 0 HB3 HIS A 137 6.129 0.382 8.200 1.00 0.00 H new ATOM 0 HD1 HIS A 137 5.464 -2.039 8.153 1.00 0.00 H new ATOM 0 HD2 HIS A 137 8.343 -1.118 5.251 1.00 0.00 H new ATOM 0 HE1 HIS A 137 6.081 -4.236 7.022 1.00 0.00 H new ATOM 1590 N THR A 138 4.791 3.214 6.763 1.00 0.00 N ATOM 1591 CA THR A 138 4.623 4.608 7.145 1.00 0.00 C ATOM 1592 C THR A 138 4.552 4.732 8.664 1.00 0.00 C ATOM 1593 O THR A 138 4.931 3.810 9.388 1.00 0.00 O ATOM 1594 CB THR A 138 3.351 5.190 6.509 1.00 0.00 C ATOM 1595 OG1 THR A 138 2.232 4.990 7.356 1.00 0.00 O ATOM 1596 CG2 THR A 138 3.009 4.597 5.157 1.00 0.00 C ATOM 0 H THR A 138 3.917 2.708 6.619 1.00 0.00 H new ATOM 0 HA THR A 138 5.483 5.172 6.783 1.00 0.00 H new ATOM 0 HB THR A 138 3.569 6.249 6.370 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.897 4.076 7.246 1.00 0.00 H new ATOM 0 HG21 THR A 138 2.099 5.060 4.776 1.00 0.00 H new ATOM 0 HG22 THR A 138 3.828 4.780 4.462 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.854 3.523 5.260 1.00 0.00 H new ATOM 1604 N ASP A 139 4.047 5.863 9.143 1.00 0.00 N ATOM 1605 CA ASP A 139 3.909 6.088 10.574 1.00 0.00 C ATOM 1606 C ASP A 139 2.776 5.233 11.127 1.00 0.00 C ATOM 1607 O ASP A 139 2.729 4.934 12.321 1.00 0.00 O ATOM 1608 CB ASP A 139 3.637 7.566 10.859 1.00 0.00 C ATOM 1609 CG ASP A 139 3.991 7.955 12.281 1.00 0.00 C ATOM 1610 OD1 ASP A 139 3.344 7.440 13.216 1.00 0.00 O ATOM 1611 OD2 ASP A 139 4.916 8.776 12.458 1.00 0.00 O ATOM 0 H ASP A 139 3.727 6.637 8.561 1.00 0.00 H new ATOM 0 HA ASP A 139 4.841 5.806 11.063 1.00 0.00 H new ATOM 0 HB2 ASP A 139 4.211 8.179 10.164 1.00 0.00 H new ATOM 0 HB3 ASP A 139 2.584 7.780 10.678 1.00 0.00 H new ATOM 1616 N SER A 140 1.865 4.843 10.242 1.00 0.00 N ATOM 1617 CA SER A 140 0.724 4.020 10.621 1.00 0.00 C ATOM 1618 C SER A 140 0.873 2.604 10.073 1.00 0.00 C ATOM 1619 O SER A 140 1.196 1.670 10.807 1.00 0.00 O ATOM 1620 CB SER A 140 -0.570 4.648 10.102 1.00 0.00 C ATOM 1621 OG SER A 140 -0.570 4.719 8.684 1.00 0.00 O ATOM 0 H SER A 140 1.896 5.086 9.252 1.00 0.00 H new ATOM 0 HA SER A 140 0.685 3.966 11.709 1.00 0.00 H new ATOM 0 HB2 SER A 140 -1.424 4.061 10.440 1.00 0.00 H new ATOM 0 HB3 SER A 140 -0.686 5.648 10.519 1.00 0.00 H new ATOM 0 HG SER A 140 -1.493 4.700 8.356 1.00 0.00 H new ATOM 1627 N LEU A 141 0.632 2.459 8.777 1.00 0.00 N ATOM 1628 CA LEU A 141 0.733 1.168 8.111 1.00 0.00 C ATOM 1629 C LEU A 141 1.541 1.291 6.824 1.00 0.00 C ATOM 1630 O LEU A 141 1.849 2.396 6.376 1.00 0.00 O ATOM 1631 CB LEU A 141 -0.664 0.622 7.802 1.00 0.00 C ATOM 1632 CG LEU A 141 -1.688 1.675 7.370 1.00 0.00 C ATOM 1633 CD1 LEU A 141 -2.625 1.109 6.314 1.00 0.00 C ATOM 1634 CD2 LEU A 141 -2.476 2.172 8.572 1.00 0.00 C ATOM 0 H LEU A 141 0.363 3.227 8.162 1.00 0.00 H new ATOM 0 HA LEU A 141 1.245 0.475 8.779 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -0.579 -0.126 7.014 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -1.042 0.111 8.687 1.00 0.00 H new ATOM 0 HG LEU A 141 -1.152 2.519 6.935 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -3.345 1.872 6.020 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -2.047 0.800 5.443 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -3.155 0.248 6.722 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.200 2.920 8.249 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -3.000 1.336 9.034 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -1.793 2.617 9.296 1.00 0.00 H new ATOM 1646 N PRO A 142 1.919 0.156 6.220 1.00 0.00 N ATOM 1647 CA PRO A 142 2.706 0.138 4.991 1.00 0.00 C ATOM 1648 C PRO A 142 1.880 0.469 3.755 1.00 0.00 C ATOM 1649 O PRO A 142 0.859 -0.165 3.482 1.00 0.00 O ATOM 1650 CB PRO A 142 3.226 -1.306 4.906 1.00 0.00 C ATOM 1651 CG PRO A 142 2.855 -1.942 6.203 1.00 0.00 C ATOM 1652 CD PRO A 142 1.645 -1.201 6.692 1.00 0.00 C ATOM 0 HA PRO A 142 3.494 0.891 5.017 1.00 0.00 H new ATOM 0 HB2 PRO A 142 2.776 -1.836 4.067 1.00 0.00 H new ATOM 0 HB3 PRO A 142 4.305 -1.326 4.754 1.00 0.00 H new ATOM 0 HG2 PRO A 142 2.637 -3.002 6.070 1.00 0.00 H new ATOM 0 HG3 PRO A 142 3.673 -1.872 6.921 1.00 0.00 H new ATOM 0 HD2 PRO A 142 0.722 -1.602 6.273 1.00 0.00 H new ATOM 0 HD3 PRO A 142 1.548 -1.246 7.777 1.00 0.00 H new ATOM 1660 N LEU A 143 2.346 1.455 3.001 1.00 0.00 N ATOM 1661 CA LEU A 143 1.679 1.869 1.772 1.00 0.00 C ATOM 1662 C LEU A 143 2.172 1.021 0.610 1.00 0.00 C ATOM 1663 O LEU A 143 3.362 1.017 0.295 1.00 0.00 O ATOM 1664 CB LEU A 143 1.944 3.349 1.483 1.00 0.00 C ATOM 1665 CG LEU A 143 1.014 3.999 0.449 1.00 0.00 C ATOM 1666 CD1 LEU A 143 1.183 3.374 -0.927 1.00 0.00 C ATOM 1667 CD2 LEU A 143 -0.426 3.883 0.885 1.00 0.00 C ATOM 0 H LEU A 143 3.189 1.987 3.220 1.00 0.00 H new ATOM 0 HA LEU A 143 0.605 1.728 1.896 1.00 0.00 H new ATOM 0 HB2 LEU A 143 1.863 3.904 2.418 1.00 0.00 H new ATOM 0 HB3 LEU A 143 2.972 3.455 1.138 1.00 0.00 H new ATOM 0 HG LEU A 143 1.288 5.052 0.382 1.00 0.00 H new ATOM 0 HD11 LEU A 143 0.509 3.860 -1.632 1.00 0.00 H new ATOM 0 HD12 LEU A 143 2.212 3.503 -1.261 1.00 0.00 H new ATOM 0 HD13 LEU A 143 0.949 2.311 -0.875 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -1.070 4.349 0.140 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.692 2.831 0.987 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -0.558 4.385 1.844 1.00 0.00 H new ATOM 1679 N VAL A 144 1.259 0.303 -0.021 1.00 0.00 N ATOM 1680 CA VAL A 144 1.615 -0.549 -1.145 1.00 0.00 C ATOM 1681 C VAL A 144 1.897 0.292 -2.385 1.00 0.00 C ATOM 1682 O VAL A 144 0.978 0.747 -3.065 1.00 0.00 O ATOM 1683 CB VAL A 144 0.507 -1.577 -1.445 1.00 0.00 C ATOM 1684 CG1 VAL A 144 1.001 -2.618 -2.436 1.00 0.00 C ATOM 1685 CG2 VAL A 144 0.027 -2.240 -0.160 1.00 0.00 C ATOM 0 H VAL A 144 0.269 0.292 0.224 1.00 0.00 H new ATOM 0 HA VAL A 144 2.518 -1.094 -0.872 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.337 -1.052 -1.892 1.00 0.00 H new ATOM 0 HG11 VAL A 144 0.206 -3.336 -2.636 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.290 -2.127 -3.366 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.863 -3.138 -2.018 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -0.755 -2.962 -0.393 1.00 0.00 H new ATOM 0 HG22 VAL A 144 0.862 -2.751 0.319 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -0.369 -1.481 0.515 1.00 0.00 H new ATOM 1695 N ILE A 145 3.182 0.508 -2.661 1.00 0.00 N ATOM 1696 CA ILE A 145 3.597 1.310 -3.805 1.00 0.00 C ATOM 1697 C ILE A 145 3.469 0.545 -5.115 1.00 0.00 C ATOM 1698 O ILE A 145 3.349 1.150 -6.180 1.00 0.00 O ATOM 1699 CB ILE A 145 5.051 1.801 -3.655 1.00 0.00 C ATOM 1700 CG1 ILE A 145 6.015 0.613 -3.572 1.00 0.00 C ATOM 1701 CG2 ILE A 145 5.185 2.688 -2.428 1.00 0.00 C ATOM 1702 CD1 ILE A 145 6.910 0.477 -4.785 1.00 0.00 C ATOM 0 H ILE A 145 3.953 0.137 -2.106 1.00 0.00 H new ATOM 0 HA ILE A 145 2.926 2.168 -3.830 1.00 0.00 H new ATOM 0 HB ILE A 145 5.311 2.389 -4.535 1.00 0.00 H new ATOM 0 HG12 ILE A 145 6.636 0.720 -2.682 1.00 0.00 H new ATOM 0 HG13 ILE A 145 5.439 -0.304 -3.450 1.00 0.00 H new ATOM 0 HG21 ILE A 145 6.217 3.027 -2.335 1.00 0.00 H new ATOM 0 HG22 ILE A 145 4.527 3.551 -2.529 1.00 0.00 H new ATOM 0 HG23 ILE A 145 4.907 2.123 -1.538 1.00 0.00 H new ATOM 0 HD11 ILE A 145 7.566 -0.384 -4.658 1.00 0.00 H new ATOM 0 HD12 ILE A 145 6.297 0.338 -5.676 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.512 1.379 -4.896 1.00 0.00 H new ATOM 1714 N SER A 146 3.500 -0.782 -5.046 1.00 0.00 N ATOM 1715 CA SER A 146 3.389 -1.588 -6.255 1.00 0.00 C ATOM 1716 C SER A 146 2.655 -2.902 -6.010 1.00 0.00 C ATOM 1717 O SER A 146 2.519 -3.359 -4.874 1.00 0.00 O ATOM 1718 CB SER A 146 4.775 -1.864 -6.838 1.00 0.00 C ATOM 1719 OG SER A 146 5.340 -3.041 -6.290 1.00 0.00 O ATOM 0 H SER A 146 3.599 -1.314 -4.181 1.00 0.00 H new ATOM 0 HA SER A 146 2.800 -1.014 -6.970 1.00 0.00 H new ATOM 0 HB2 SER A 146 4.703 -1.963 -7.921 1.00 0.00 H new ATOM 0 HB3 SER A 146 5.431 -1.017 -6.639 1.00 0.00 H new ATOM 0 HG SER A 146 5.660 -3.618 -7.014 1.00 0.00 H new ATOM 1725 N LEU A 147 2.197 -3.500 -7.104 1.00 0.00 N ATOM 1726 CA LEU A 147 1.481 -4.765 -7.073 1.00 0.00 C ATOM 1727 C LEU A 147 1.816 -5.567 -8.325 1.00 0.00 C ATOM 1728 O LEU A 147 2.249 -5.002 -9.326 1.00 0.00 O ATOM 1729 CB LEU A 147 -0.029 -4.518 -6.994 1.00 0.00 C ATOM 1730 CG LEU A 147 -0.782 -5.414 -6.011 1.00 0.00 C ATOM 1731 CD1 LEU A 147 -0.896 -4.741 -4.655 1.00 0.00 C ATOM 1732 CD2 LEU A 147 -2.161 -5.758 -6.547 1.00 0.00 C ATOM 0 H LEU A 147 2.314 -3.116 -8.042 1.00 0.00 H new ATOM 0 HA LEU A 147 1.786 -5.328 -6.191 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.197 -3.478 -6.715 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -0.456 -4.655 -7.987 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.217 -6.339 -5.893 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -1.435 -5.394 -3.969 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.101 -4.545 -4.261 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -1.436 -3.800 -4.760 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -2.680 -6.396 -5.832 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -2.732 -4.842 -6.697 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -2.062 -6.283 -7.497 1.00 0.00 H new ATOM 1744 N ASN A 148 1.639 -6.881 -8.267 1.00 0.00 N ATOM 1745 CA ASN A 148 1.950 -7.738 -9.411 1.00 0.00 C ATOM 1746 C ASN A 148 1.393 -7.178 -10.730 1.00 0.00 C ATOM 1747 O ASN A 148 0.214 -7.336 -11.042 1.00 0.00 O ATOM 1748 CB ASN A 148 1.433 -9.165 -9.164 1.00 0.00 C ATOM 1749 CG ASN A 148 -0.024 -9.365 -9.551 1.00 0.00 C ATOM 1750 OD1 ASN A 148 -0.326 -9.847 -10.643 1.00 0.00 O ATOM 1751 ND2 ASN A 148 -0.935 -8.993 -8.659 1.00 0.00 N ATOM 0 H ASN A 148 1.285 -7.376 -7.449 1.00 0.00 H new ATOM 0 HA ASN A 148 3.035 -7.764 -9.512 1.00 0.00 H new ATOM 0 HB2 ASN A 148 2.048 -9.867 -9.727 1.00 0.00 H new ATOM 0 HB3 ASN A 148 1.556 -9.408 -8.109 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -1.927 -9.103 -8.868 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -0.642 -8.598 -7.765 1.00 0.00 H new ATOM 1758 N GLY A 149 2.264 -6.545 -11.513 1.00 0.00 N ATOM 1759 CA GLY A 149 1.857 -5.999 -12.801 1.00 0.00 C ATOM 1760 C GLY A 149 1.170 -4.645 -12.714 1.00 0.00 C ATOM 1761 O GLY A 149 0.439 -4.262 -13.627 1.00 0.00 O ATOM 0 H GLY A 149 3.246 -6.399 -11.279 1.00 0.00 H new ATOM 0 HA2 GLY A 149 2.736 -5.908 -13.439 1.00 0.00 H new ATOM 0 HA3 GLY A 149 1.183 -6.705 -13.286 1.00 0.00 H new ATOM 1765 N HIS A 150 1.403 -3.915 -11.629 1.00 0.00 N ATOM 1766 CA HIS A 150 0.799 -2.593 -11.450 1.00 0.00 C ATOM 1767 C HIS A 150 1.580 -1.782 -10.430 1.00 0.00 C ATOM 1768 O HIS A 150 2.222 -2.342 -9.546 1.00 0.00 O ATOM 1769 CB HIS A 150 -0.658 -2.708 -10.996 1.00 0.00 C ATOM 1770 CG HIS A 150 -1.388 -3.870 -11.589 1.00 0.00 C ATOM 1771 ND1 HIS A 150 -2.186 -3.774 -12.709 1.00 0.00 N ATOM 1772 CD2 HIS A 150 -1.430 -5.165 -11.208 1.00 0.00 C ATOM 1773 CE1 HIS A 150 -2.690 -4.962 -12.991 1.00 0.00 C ATOM 1774 NE2 HIS A 150 -2.246 -5.825 -12.095 1.00 0.00 N ATOM 0 H HIS A 150 2.004 -4.212 -10.860 1.00 0.00 H new ATOM 0 HA HIS A 150 0.828 -2.086 -12.415 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -0.684 -2.791 -9.910 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -1.183 -1.790 -11.258 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -0.917 -5.601 -10.363 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -3.352 -5.189 -13.814 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -2.472 -6.819 -12.066 1.00 0.00 H new ATOM 1783 N THR A 151 1.526 -0.463 -10.555 1.00 0.00 N ATOM 1784 CA THR A 151 2.235 0.409 -9.630 1.00 0.00 C ATOM 1785 C THR A 151 1.462 1.698 -9.374 1.00 0.00 C ATOM 1786 O THR A 151 0.517 2.023 -10.093 1.00 0.00 O ATOM 1787 CB THR A 151 3.623 0.733 -10.173 1.00 0.00 C ATOM 1788 OG1 THR A 151 3.549 1.175 -11.515 1.00 0.00 O ATOM 1789 CG2 THR A 151 4.571 -0.447 -10.129 1.00 0.00 C ATOM 0 H THR A 151 1.002 0.024 -11.283 1.00 0.00 H new ATOM 0 HA THR A 151 2.332 -0.119 -8.682 1.00 0.00 H new ATOM 0 HB THR A 151 4.011 1.517 -9.523 1.00 0.00 H new ATOM 0 HG1 THR A 151 4.450 1.379 -11.842 1.00 0.00 H new ATOM 0 HG21 THR A 151 5.540 -0.150 -10.529 1.00 0.00 H new ATOM 0 HG22 THR A 151 4.691 -0.779 -9.098 1.00 0.00 H new ATOM 0 HG23 THR A 151 4.165 -1.262 -10.728 1.00 0.00 H new ATOM 1797 N LEU A 152 1.885 2.435 -8.352 1.00 0.00 N ATOM 1798 CA LEU A 152 1.260 3.698 -8.000 1.00 0.00 C ATOM 1799 C LEU A 152 1.966 4.822 -8.735 1.00 0.00 C ATOM 1800 O LEU A 152 1.381 5.865 -9.031 1.00 0.00 O ATOM 1801 CB LEU A 152 1.354 3.921 -6.489 1.00 0.00 C ATOM 1802 CG LEU A 152 0.145 3.453 -5.683 1.00 0.00 C ATOM 1803 CD1 LEU A 152 0.451 3.495 -4.194 1.00 0.00 C ATOM 1804 CD2 LEU A 152 -1.066 4.312 -6.004 1.00 0.00 C ATOM 0 H LEU A 152 2.666 2.173 -7.750 1.00 0.00 H new ATOM 0 HA LEU A 152 0.208 3.679 -8.286 1.00 0.00 H new ATOM 0 HB2 LEU A 152 2.239 3.406 -6.117 1.00 0.00 H new ATOM 0 HB3 LEU A 152 1.503 4.985 -6.304 1.00 0.00 H new ATOM 0 HG LEU A 152 -0.080 2.422 -5.958 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -0.421 3.158 -3.634 1.00 0.00 H new ATOM 0 HD12 LEU A 152 1.296 2.841 -3.978 1.00 0.00 H new ATOM 0 HD13 LEU A 152 0.698 4.516 -3.902 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -1.921 3.967 -5.422 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -0.852 5.351 -5.754 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -1.295 4.235 -7.067 1.00 0.00 H new