USER MOD reduce.3.24.130724 H: found=0, std=0, add=941, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 937 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 86 TYR OH : rot 164:sc= 0.0235 USER MOD Set 1.2: A 124 SER OG : rot -109:sc= 1.29 USER MOD Set 2.1: A 46 SER OG : rot 170:sc= 1.86 USER MOD Set 2.2: A 50 GLN : amide:sc= 0.354 K(o=2.2,f=-1.6!) USER MOD Set 3.1: A 36 GLN : amide:sc= 1.47 K(o=2.1,f=-3.2!) USER MOD Set 3.2: A 81 SER OG : rot 160:sc= 0.679 USER MOD Set 4.1: A 16 MET CE :methyl -147:sc= -3.3! (180deg=-4.09!) USER MOD Set 4.2: A 19 THR OG1 : rot 77:sc= 0.916 USER MOD Single : A 1 GLY N :NH3+ -127:sc= 0.0715 (180deg=0) USER MOD Single : A 2 SER OG : rot -56:sc= 0.0479 USER MOD Single : A 4 ASN : amide:sc= -0.614 K(o=-0.61,f=-6.8!) USER MOD Single : A 5 SER OG : rot 57:sc= 0.0308 USER MOD Single : A 6 GLN :FLIP amide:sc= -0.449 F(o=-3.2!,f=-0.45) USER MOD Single : A 10 THR OG1 : rot -80:sc= 1.17 USER MOD Single : A 11 ASN : amide:sc= -0.131 K(o=-0.13,f=-3.3!) USER MOD Single : A 13 ASN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 17 THR OG1 : rot 74:sc= 1.24 USER MOD Single : A 18 MET CE :methyl -123:sc= 0 (180deg=-1.53!) USER MOD Single : A 20 ASN : amide:sc= 1.21 K(o=1.2,f=-0.054) USER MOD Single : A 21 ASN : amide:sc= -0.0208 K(o=-0.021,f=-1.1) USER MOD Single : A 24 GLN : amide:sc= -0.734 K(o=-0.73,f=-1.9!) USER MOD Single : A 27 SER OG : rot 85:sc= 1.3 USER MOD Single : A 29 SER OG : rot -85:sc= 1.44 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0.202 USER MOD Single : A 37 MET CE :methyl 179:sc= -3.8 (180deg=-3.86) USER MOD Single : A 40 MET CE :methyl 168:sc= -0.62 (180deg=-0.758) USER MOD Single : A 42 MET CE :methyl 135:sc= -0.196 (180deg=-1.51) USER MOD Single : A 43 MET CE :methyl -145:sc= -0.322 (180deg=-1.55) USER MOD Single : A 48 ASN : amide:sc= 0.0284 K(o=0.028,f=-8.8!) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 MET CE :methyl 157:sc= -1.39 (180deg=-3.59!) USER MOD Single : A 52 GLN : amide:sc= 0.13 X(o=0.13,f=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 MET CE :methyl -179:sc= -0.669 (180deg=-0.702) USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 GLN : amide:sc= -0.874 K(o=-0.87,f=-6.2!) USER MOD Single : A 61 HIS : no HD1:sc= -0.198 X(o=-0.2,f=-0.01) USER MOD Single : A 66 MET CE :methyl -135:sc= -0.169 (180deg=-1.58) USER MOD Single : A 67 ASN : amide:sc= -0.0413 K(o=-0.041,f=-5!) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0.00217 USER MOD Single : A 70 MET CE :methyl -178:sc= 0 (180deg=-0.00977) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot -116:sc= 1.26 USER MOD Single : A 91 ASN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 92 THR OG1 : rot 87:sc= 1.25 USER MOD Single : A 100 SER OG : rot -96:sc= 0.966 USER MOD Single : A 101 MET CE :methyl 166:sc= -0.307 (180deg=-0.534) USER MOD Single : A 102 MET CE :methyl -158:sc= -0.483 (180deg=-1.6!) USER MOD Single : A 103 GLN : amide:sc= -0.49 K(o=-0.49,f=-1.2) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 ASN : amide:sc=-7.57e-05 X(o=-7.6e-05,f=-0.044) USER MOD Single : A 113 THR OG1 : rot -83:sc= 1.01 USER MOD Single : A 114 ASN : amide:sc=-0.00381 X(o=-0.0038,f=0) USER MOD Single : A 117 MET CE :methyl 167:sc= -0.892 (180deg=-1.82) USER MOD Single : A 118 GLN : amide:sc= -0.0178 K(o=-0.018,f=-1.1) USER MOD Single : A 121 LYS NZ :NH3+ -144:sc= -0.902 (180deg=-1.13) USER MOD Single : A 122 MET CE :methyl -168:sc= -2.58 (180deg=-2.8) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 ASN : amide:sc= -0.155 X(o=-0.15,f=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 THR OG1 : rot 180:sc= -0.0354 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.929 -7.424 -0.191 1.00 0.00 N ATOM 2 CA GLY A 1 8.695 -6.057 -0.710 1.00 0.00 C ATOM 3 C GLY A 1 9.925 -5.193 -0.568 1.00 0.00 C ATOM 4 O GLY A 1 11.035 -5.717 -0.490 1.00 0.00 O ATOM 0 H1 GLY A 1 8.672 -8.121 -0.919 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.933 -7.535 0.055 1.00 0.00 H new ATOM 0 H3 GLY A 1 8.346 -7.578 0.656 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.405 -6.110 -1.759 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.864 -5.600 -0.173 1.00 0.00 H new ATOM 7 N SER A 2 9.728 -3.874 -0.526 1.00 0.00 N ATOM 8 CA SER A 2 10.830 -2.924 -0.397 1.00 0.00 C ATOM 9 C SER A 2 11.802 -3.103 -1.563 1.00 0.00 C ATOM 10 O SER A 2 13.014 -3.229 -1.377 1.00 0.00 O ATOM 11 CB SER A 2 11.541 -3.111 0.952 1.00 0.00 C ATOM 12 OG SER A 2 12.427 -2.038 1.235 1.00 0.00 O ATOM 0 H SER A 2 8.807 -3.439 -0.580 1.00 0.00 H new ATOM 0 HA SER A 2 10.437 -1.908 -0.428 1.00 0.00 H new ATOM 0 HB2 SER A 2 10.799 -3.188 1.746 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.097 -4.049 0.943 1.00 0.00 H new ATOM 0 HG SER A 2 13.073 -1.946 0.504 1.00 0.00 H new ATOM 18 N GLY A 3 11.251 -3.125 -2.771 1.00 0.00 N ATOM 19 CA GLY A 3 12.065 -3.304 -3.954 1.00 0.00 C ATOM 20 C GLY A 3 11.307 -2.985 -5.224 1.00 0.00 C ATOM 21 O GLY A 3 11.275 -3.789 -6.159 1.00 0.00 O ATOM 0 H GLY A 3 10.252 -3.022 -2.950 1.00 0.00 H new ATOM 0 HA2 GLY A 3 12.945 -2.664 -3.888 1.00 0.00 H new ATOM 0 HA3 GLY A 3 12.422 -4.333 -3.995 1.00 0.00 H new ATOM 25 N ASN A 4 10.692 -1.814 -5.260 1.00 0.00 N ATOM 26 CA ASN A 4 9.935 -1.382 -6.426 1.00 0.00 C ATOM 27 C ASN A 4 10.222 0.089 -6.688 1.00 0.00 C ATOM 28 O ASN A 4 10.304 0.881 -5.750 1.00 0.00 O ATOM 29 CB ASN A 4 8.432 -1.601 -6.197 1.00 0.00 C ATOM 30 CG ASN A 4 7.602 -1.459 -7.467 1.00 0.00 C ATOM 31 OD1 ASN A 4 7.949 -0.715 -8.383 1.00 0.00 O ATOM 32 ND2 ASN A 4 6.495 -2.178 -7.531 1.00 0.00 N ATOM 0 H ASN A 4 10.702 -1.142 -4.492 1.00 0.00 H new ATOM 0 HA ASN A 4 10.236 -1.970 -7.293 1.00 0.00 H new ATOM 0 HB2 ASN A 4 8.276 -2.595 -5.779 1.00 0.00 H new ATOM 0 HB3 ASN A 4 8.076 -0.885 -5.457 1.00 0.00 H new ATOM 0 HD21 ASN A 4 5.900 -2.126 -8.358 1.00 0.00 H new ATOM 0 HD22 ASN A 4 6.236 -2.785 -6.754 1.00 0.00 H new ATOM 39 N SER A 5 10.387 0.448 -7.950 1.00 0.00 N ATOM 40 CA SER A 5 10.689 1.819 -8.317 1.00 0.00 C ATOM 41 C SER A 5 9.445 2.703 -8.253 1.00 0.00 C ATOM 42 O SER A 5 8.916 3.137 -9.278 1.00 0.00 O ATOM 43 CB SER A 5 11.310 1.851 -9.711 1.00 0.00 C ATOM 44 OG SER A 5 10.566 1.048 -10.617 1.00 0.00 O ATOM 0 H SER A 5 10.316 -0.194 -8.739 1.00 0.00 H new ATOM 0 HA SER A 5 11.404 2.220 -7.599 1.00 0.00 H new ATOM 0 HB2 SER A 5 11.345 2.878 -10.074 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.339 1.494 -9.663 1.00 0.00 H new ATOM 0 HG SER A 5 9.635 1.354 -10.636 1.00 0.00 H new ATOM 50 N GLN A 6 8.972 2.938 -7.042 1.00 0.00 N ATOM 51 CA GLN A 6 7.868 3.842 -6.802 1.00 0.00 C ATOM 52 C GLN A 6 8.303 4.874 -5.767 1.00 0.00 C ATOM 53 O GLN A 6 7.989 4.757 -4.582 1.00 0.00 O ATOM 54 CB GLN A 6 6.632 3.070 -6.320 1.00 0.00 C ATOM 55 CG GLN A 6 5.373 3.920 -6.175 1.00 0.00 C ATOM 56 CD GLN A 6 4.605 4.116 -7.476 1.00 0.00 C ATOM 57 OE1 GLN A 6 5.299 4.098 -8.604 1.00 0.00 O flip ATOM 58 NE2 GLN A 6 3.382 4.276 -7.465 1.00 0.00 N flip ATOM 0 H GLN A 6 9.345 2.505 -6.197 1.00 0.00 H new ATOM 0 HA GLN A 6 7.596 4.347 -7.729 1.00 0.00 H new ATOM 0 HB2 GLN A 6 6.429 2.259 -7.020 1.00 0.00 H new ATOM 0 HB3 GLN A 6 6.858 2.611 -5.358 1.00 0.00 H new ATOM 0 HG2 GLN A 6 4.714 3.453 -5.443 1.00 0.00 H new ATOM 0 HG3 GLN A 6 5.650 4.897 -5.778 1.00 0.00 H new ATOM 0 HE21 GLN A 6 2.877 4.285 -6.579 1.00 0.00 H new ATOM 0 HE22 GLN A 6 2.876 4.399 -8.342 1.00 0.00 H new ATOM 67 N PRO A 7 9.085 5.873 -6.202 1.00 0.00 N ATOM 68 CA PRO A 7 9.699 6.853 -5.305 1.00 0.00 C ATOM 69 C PRO A 7 8.700 7.842 -4.709 1.00 0.00 C ATOM 70 O PRO A 7 7.531 7.892 -5.096 1.00 0.00 O ATOM 71 CB PRO A 7 10.706 7.594 -6.200 1.00 0.00 C ATOM 72 CG PRO A 7 10.778 6.807 -7.466 1.00 0.00 C ATOM 73 CD PRO A 7 9.448 6.126 -7.599 1.00 0.00 C ATOM 0 HA PRO A 7 10.148 6.360 -4.443 1.00 0.00 H new ATOM 0 HB2 PRO A 7 10.380 8.616 -6.393 1.00 0.00 H new ATOM 0 HB3 PRO A 7 11.683 7.656 -5.721 1.00 0.00 H new ATOM 0 HG2 PRO A 7 10.972 7.456 -8.320 1.00 0.00 H new ATOM 0 HG3 PRO A 7 11.588 6.079 -7.428 1.00 0.00 H new ATOM 0 HD2 PRO A 7 8.716 6.758 -8.101 1.00 0.00 H new ATOM 0 HD3 PRO A 7 9.520 5.203 -8.174 1.00 0.00 H new ATOM 81 N ILE A 8 9.207 8.654 -3.790 1.00 0.00 N ATOM 82 CA ILE A 8 8.412 9.635 -3.051 1.00 0.00 C ATOM 83 C ILE A 8 7.834 10.720 -3.976 1.00 0.00 C ATOM 84 O ILE A 8 6.928 11.459 -3.595 1.00 0.00 O ATOM 85 CB ILE A 8 9.296 10.284 -1.955 1.00 0.00 C ATOM 86 CG1 ILE A 8 8.501 11.253 -1.078 1.00 0.00 C ATOM 87 CG2 ILE A 8 10.486 10.991 -2.580 1.00 0.00 C ATOM 88 CD1 ILE A 8 7.620 10.571 -0.062 1.00 0.00 C ATOM 0 H ILE A 8 10.194 8.652 -3.531 1.00 0.00 H new ATOM 0 HA ILE A 8 7.569 9.117 -2.594 1.00 0.00 H new ATOM 0 HB ILE A 8 9.657 9.481 -1.312 1.00 0.00 H new ATOM 0 HG12 ILE A 8 9.196 11.912 -0.558 1.00 0.00 H new ATOM 0 HG13 ILE A 8 7.882 11.883 -1.717 1.00 0.00 H new ATOM 0 HG21 ILE A 8 11.095 11.441 -1.796 1.00 0.00 H new ATOM 0 HG22 ILE A 8 11.085 10.271 -3.137 1.00 0.00 H new ATOM 0 HG23 ILE A 8 10.133 11.770 -3.256 1.00 0.00 H new ATOM 0 HD11 ILE A 8 7.089 11.323 0.522 1.00 0.00 H new ATOM 0 HD12 ILE A 8 6.900 9.933 -0.575 1.00 0.00 H new ATOM 0 HD13 ILE A 8 8.234 9.963 0.602 1.00 0.00 H new ATOM 100 N TRP A 9 8.334 10.780 -5.206 1.00 0.00 N ATOM 101 CA TRP A 9 7.939 11.824 -6.152 1.00 0.00 C ATOM 102 C TRP A 9 6.573 11.541 -6.782 1.00 0.00 C ATOM 103 O TRP A 9 6.131 12.273 -7.665 1.00 0.00 O ATOM 104 CB TRP A 9 8.983 11.950 -7.264 1.00 0.00 C ATOM 105 CG TRP A 9 10.365 12.272 -6.784 1.00 0.00 C ATOM 106 CD1 TRP A 9 11.461 11.464 -6.858 1.00 0.00 C ATOM 107 CD2 TRP A 9 10.803 13.485 -6.160 1.00 0.00 C ATOM 108 NE1 TRP A 9 12.555 12.101 -6.327 1.00 0.00 N ATOM 109 CE2 TRP A 9 12.176 13.344 -5.891 1.00 0.00 C ATOM 110 CE3 TRP A 9 10.165 14.678 -5.809 1.00 0.00 C ATOM 111 CZ2 TRP A 9 12.924 14.350 -5.280 1.00 0.00 C ATOM 112 CZ3 TRP A 9 10.907 15.675 -5.204 1.00 0.00 C ATOM 113 CH2 TRP A 9 12.274 15.507 -4.948 1.00 0.00 C ATOM 0 H TRP A 9 9.016 10.117 -5.574 1.00 0.00 H new ATOM 0 HA TRP A 9 7.871 12.756 -5.591 1.00 0.00 H new ATOM 0 HB2 TRP A 9 9.015 11.015 -7.823 1.00 0.00 H new ATOM 0 HB3 TRP A 9 8.663 12.726 -7.959 1.00 0.00 H new ATOM 0 HD1 TRP A 9 11.467 10.467 -7.274 1.00 0.00 H new ATOM 0 HE1 TRP A 9 13.496 11.713 -6.267 1.00 0.00 H new ATOM 0 HE3 TRP A 9 9.113 14.818 -6.007 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 13.977 14.221 -5.077 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 10.424 16.600 -4.924 1.00 0.00 H new ATOM 0 HH2 TRP A 9 12.826 16.308 -4.479 1.00 0.00 H new ATOM 124 N THR A 10 5.903 10.485 -6.333 1.00 0.00 N ATOM 125 CA THR A 10 4.610 10.115 -6.895 1.00 0.00 C ATOM 126 C THR A 10 3.468 10.901 -6.252 1.00 0.00 C ATOM 127 O THR A 10 2.305 10.757 -6.642 1.00 0.00 O ATOM 128 CB THR A 10 4.351 8.603 -6.756 1.00 0.00 C ATOM 129 OG1 THR A 10 4.838 8.135 -5.490 1.00 0.00 O ATOM 130 CG2 THR A 10 5.015 7.838 -7.891 1.00 0.00 C ATOM 0 H THR A 10 6.232 9.874 -5.586 1.00 0.00 H new ATOM 0 HA THR A 10 4.644 10.367 -7.955 1.00 0.00 H new ATOM 0 HB THR A 10 3.276 8.429 -6.808 1.00 0.00 H new ATOM 0 HG1 THR A 10 5.807 7.996 -5.543 1.00 0.00 H new ATOM 0 HG21 THR A 10 4.820 6.772 -7.774 1.00 0.00 H new ATOM 0 HG22 THR A 10 4.611 8.178 -8.844 1.00 0.00 H new ATOM 0 HG23 THR A 10 6.090 8.015 -7.869 1.00 0.00 H new ATOM 138 N ASN A 11 3.806 11.729 -5.273 1.00 0.00 N ATOM 139 CA ASN A 11 2.832 12.595 -4.627 1.00 0.00 C ATOM 140 C ASN A 11 3.500 13.876 -4.152 1.00 0.00 C ATOM 141 O ASN A 11 4.351 13.849 -3.260 1.00 0.00 O ATOM 142 CB ASN A 11 2.158 11.881 -3.451 1.00 0.00 C ATOM 143 CG ASN A 11 1.208 12.787 -2.681 1.00 0.00 C ATOM 144 OD1 ASN A 11 0.662 13.747 -3.221 1.00 0.00 O ATOM 145 ND2 ASN A 11 0.993 12.477 -1.413 1.00 0.00 N ATOM 0 H ASN A 11 4.754 11.819 -4.908 1.00 0.00 H new ATOM 0 HA ASN A 11 2.063 12.847 -5.358 1.00 0.00 H new ATOM 0 HB2 ASN A 11 1.608 11.017 -3.823 1.00 0.00 H new ATOM 0 HB3 ASN A 11 2.924 11.504 -2.773 1.00 0.00 H new ATOM 0 HD21 ASN A 11 0.357 13.042 -0.851 1.00 0.00 H new ATOM 0 HD22 ASN A 11 1.464 11.673 -0.998 1.00 0.00 H new ATOM 152 N PRO A 12 3.121 15.011 -4.760 1.00 0.00 N ATOM 153 CA PRO A 12 3.672 16.325 -4.425 1.00 0.00 C ATOM 154 C PRO A 12 3.628 16.626 -2.930 1.00 0.00 C ATOM 155 O PRO A 12 4.600 17.122 -2.361 1.00 0.00 O ATOM 156 CB PRO A 12 2.769 17.295 -5.189 1.00 0.00 C ATOM 157 CG PRO A 12 2.260 16.507 -6.343 1.00 0.00 C ATOM 158 CD PRO A 12 2.129 15.093 -5.850 1.00 0.00 C ATOM 0 HA PRO A 12 4.727 16.395 -4.692 1.00 0.00 H new ATOM 0 HB2 PRO A 12 1.952 17.653 -4.562 1.00 0.00 H new ATOM 0 HB3 PRO A 12 3.323 18.173 -5.522 1.00 0.00 H new ATOM 0 HG2 PRO A 12 1.299 16.892 -6.686 1.00 0.00 H new ATOM 0 HG3 PRO A 12 2.946 16.564 -7.188 1.00 0.00 H new ATOM 0 HD2 PRO A 12 1.121 14.886 -5.491 1.00 0.00 H new ATOM 0 HD3 PRO A 12 2.341 14.372 -6.640 1.00 0.00 H new ATOM 166 N ASN A 13 2.504 16.310 -2.296 1.00 0.00 N ATOM 167 CA ASN A 13 2.329 16.573 -0.870 1.00 0.00 C ATOM 168 C ASN A 13 3.344 15.781 -0.049 1.00 0.00 C ATOM 169 O ASN A 13 3.935 16.294 0.902 1.00 0.00 O ATOM 170 CB ASN A 13 0.901 16.217 -0.431 1.00 0.00 C ATOM 171 CG ASN A 13 0.648 16.521 1.035 1.00 0.00 C ATOM 172 OD1 ASN A 13 1.216 17.458 1.594 1.00 0.00 O ATOM 173 ND2 ASN A 13 -0.207 15.732 1.668 1.00 0.00 N ATOM 0 H ASN A 13 1.700 15.872 -2.746 1.00 0.00 H new ATOM 0 HA ASN A 13 2.495 17.636 -0.695 1.00 0.00 H new ATOM 0 HB2 ASN A 13 0.188 16.771 -1.041 1.00 0.00 H new ATOM 0 HB3 ASN A 13 0.722 15.158 -0.615 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -0.414 15.892 2.654 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.658 14.965 1.170 1.00 0.00 H new ATOM 180 N ALA A 14 3.571 14.541 -0.450 1.00 0.00 N ATOM 181 CA ALA A 14 4.472 13.657 0.271 1.00 0.00 C ATOM 182 C ALA A 14 5.918 14.090 0.086 1.00 0.00 C ATOM 183 O ALA A 14 6.690 14.151 1.047 1.00 0.00 O ATOM 184 CB ALA A 14 4.284 12.223 -0.194 1.00 0.00 C ATOM 0 H ALA A 14 3.141 14.122 -1.275 1.00 0.00 H new ATOM 0 HA ALA A 14 4.234 13.716 1.333 1.00 0.00 H new ATOM 0 HB1 ALA A 14 4.964 11.571 0.353 1.00 0.00 H new ATOM 0 HB2 ALA A 14 3.256 11.912 -0.009 1.00 0.00 H new ATOM 0 HB3 ALA A 14 4.497 12.156 -1.261 1.00 0.00 H new ATOM 190 N ALA A 15 6.275 14.402 -1.152 1.00 0.00 N ATOM 191 CA ALA A 15 7.628 14.823 -1.478 1.00 0.00 C ATOM 192 C ALA A 15 7.963 16.149 -0.807 1.00 0.00 C ATOM 193 O ALA A 15 9.014 16.291 -0.186 1.00 0.00 O ATOM 194 CB ALA A 15 7.801 14.929 -2.983 1.00 0.00 C ATOM 0 H ALA A 15 5.641 14.371 -1.951 1.00 0.00 H new ATOM 0 HA ALA A 15 8.319 14.069 -1.100 1.00 0.00 H new ATOM 0 HB1 ALA A 15 8.819 15.245 -3.211 1.00 0.00 H new ATOM 0 HB2 ALA A 15 7.612 13.958 -3.440 1.00 0.00 H new ATOM 0 HB3 ALA A 15 7.097 15.660 -3.380 1.00 0.00 H new ATOM 200 N MET A 16 7.050 17.110 -0.909 1.00 0.00 N ATOM 201 CA MET A 16 7.260 18.431 -0.333 1.00 0.00 C ATOM 202 C MET A 16 7.402 18.357 1.184 1.00 0.00 C ATOM 203 O MET A 16 8.140 19.139 1.785 1.00 0.00 O ATOM 204 CB MET A 16 6.113 19.364 -0.714 1.00 0.00 C ATOM 205 CG MET A 16 6.517 20.496 -1.643 1.00 0.00 C ATOM 206 SD MET A 16 7.700 21.648 -0.906 1.00 0.00 S ATOM 207 CE MET A 16 9.252 21.064 -1.595 1.00 0.00 C ATOM 0 H MET A 16 6.156 16.997 -1.387 1.00 0.00 H new ATOM 0 HA MET A 16 8.190 18.830 -0.738 1.00 0.00 H new ATOM 0 HB2 MET A 16 5.327 18.779 -1.192 1.00 0.00 H new ATOM 0 HB3 MET A 16 5.687 19.789 0.195 1.00 0.00 H new ATOM 0 HG2 MET A 16 6.950 20.074 -2.550 1.00 0.00 H new ATOM 0 HG3 MET A 16 5.625 21.046 -1.942 1.00 0.00 H new ATOM 0 HE1 MET A 16 10.052 21.219 -0.872 1.00 0.00 H new ATOM 0 HE2 MET A 16 9.171 20.002 -1.825 1.00 0.00 H new ATOM 0 HE3 MET A 16 9.476 21.616 -2.508 1.00 0.00 H new ATOM 217 N THR A 17 6.710 17.400 1.793 1.00 0.00 N ATOM 218 CA THR A 17 6.786 17.196 3.233 1.00 0.00 C ATOM 219 C THR A 17 8.218 16.888 3.675 1.00 0.00 C ATOM 220 O THR A 17 8.749 17.539 4.575 1.00 0.00 O ATOM 221 CB THR A 17 5.840 16.062 3.688 1.00 0.00 C ATOM 222 OG1 THR A 17 4.477 16.474 3.522 1.00 0.00 O ATOM 223 CG2 THR A 17 6.084 15.681 5.146 1.00 0.00 C ATOM 0 H THR A 17 6.089 16.752 1.309 1.00 0.00 H new ATOM 0 HA THR A 17 6.469 18.125 3.707 1.00 0.00 H new ATOM 0 HB THR A 17 6.043 15.187 3.070 1.00 0.00 H new ATOM 0 HG1 THR A 17 4.243 16.456 2.570 1.00 0.00 H new ATOM 0 HG21 THR A 17 5.401 14.881 5.432 1.00 0.00 H new ATOM 0 HG22 THR A 17 7.113 15.341 5.266 1.00 0.00 H new ATOM 0 HG23 THR A 17 5.912 16.549 5.783 1.00 0.00 H new ATOM 231 N MET A 18 8.854 15.917 3.025 1.00 0.00 N ATOM 232 CA MET A 18 10.202 15.516 3.417 1.00 0.00 C ATOM 233 C MET A 18 11.225 16.597 3.074 1.00 0.00 C ATOM 234 O MET A 18 12.217 16.766 3.781 1.00 0.00 O ATOM 235 CB MET A 18 10.585 14.155 2.810 1.00 0.00 C ATOM 236 CG MET A 18 10.490 14.055 1.293 1.00 0.00 C ATOM 237 SD MET A 18 11.879 14.817 0.431 1.00 0.00 S ATOM 238 CE MET A 18 11.530 14.314 -1.251 1.00 0.00 C ATOM 0 H MET A 18 8.465 15.400 2.236 1.00 0.00 H new ATOM 0 HA MET A 18 10.208 15.397 4.500 1.00 0.00 H new ATOM 0 HB2 MET A 18 11.607 13.921 3.107 1.00 0.00 H new ATOM 0 HB3 MET A 18 9.943 13.390 3.247 1.00 0.00 H new ATOM 0 HG2 MET A 18 10.430 13.004 1.010 1.00 0.00 H new ATOM 0 HG3 MET A 18 9.565 14.528 0.963 1.00 0.00 H new ATOM 0 HE1 MET A 18 12.383 13.765 -1.651 1.00 0.00 H new ATOM 0 HE2 MET A 18 10.648 13.674 -1.264 1.00 0.00 H new ATOM 0 HE3 MET A 18 11.347 15.196 -1.864 1.00 0.00 H new ATOM 248 N THR A 19 10.957 17.357 2.016 1.00 0.00 N ATOM 249 CA THR A 19 11.831 18.450 1.625 1.00 0.00 C ATOM 250 C THR A 19 11.839 19.543 2.698 1.00 0.00 C ATOM 251 O THR A 19 12.898 20.030 3.099 1.00 0.00 O ATOM 252 CB THR A 19 11.382 19.046 0.279 1.00 0.00 C ATOM 253 OG1 THR A 19 11.223 18.000 -0.686 1.00 0.00 O ATOM 254 CG2 THR A 19 12.390 20.058 -0.238 1.00 0.00 C ATOM 0 H THR A 19 10.141 17.233 1.417 1.00 0.00 H new ATOM 0 HA THR A 19 12.841 18.054 1.517 1.00 0.00 H new ATOM 0 HB THR A 19 10.431 19.555 0.436 1.00 0.00 H new ATOM 0 HG1 THR A 19 10.385 17.521 -0.515 1.00 0.00 H new ATOM 0 HG21 THR A 19 12.045 20.461 -1.190 1.00 0.00 H new ATOM 0 HG22 THR A 19 12.494 20.869 0.483 1.00 0.00 H new ATOM 0 HG23 THR A 19 13.355 19.571 -0.379 1.00 0.00 H new ATOM 262 N ASN A 20 10.652 19.903 3.182 1.00 0.00 N ATOM 263 CA ASN A 20 10.528 20.928 4.213 1.00 0.00 C ATOM 264 C ASN A 20 11.117 20.443 5.532 1.00 0.00 C ATOM 265 O ASN A 20 11.751 21.209 6.257 1.00 0.00 O ATOM 266 CB ASN A 20 9.064 21.335 4.410 1.00 0.00 C ATOM 267 CG ASN A 20 8.586 22.326 3.363 1.00 0.00 C ATOM 268 OD1 ASN A 20 8.699 23.539 3.535 1.00 0.00 O ATOM 269 ND2 ASN A 20 8.040 21.817 2.273 1.00 0.00 N ATOM 0 H ASN A 20 9.766 19.501 2.877 1.00 0.00 H new ATOM 0 HA ASN A 20 11.088 21.802 3.880 1.00 0.00 H new ATOM 0 HB2 ASN A 20 8.436 20.445 4.376 1.00 0.00 H new ATOM 0 HB3 ASN A 20 8.943 21.773 5.401 1.00 0.00 H new ATOM 0 HD21 ASN A 20 7.695 22.435 1.539 1.00 0.00 H new ATOM 0 HD22 ASN A 20 7.963 20.806 2.166 1.00 0.00 H new ATOM 276 N ASN A 21 10.926 19.162 5.832 1.00 0.00 N ATOM 277 CA ASN A 21 11.459 18.582 7.056 1.00 0.00 C ATOM 278 C ASN A 21 12.980 18.566 7.037 1.00 0.00 C ATOM 279 O ASN A 21 13.620 18.700 8.077 1.00 0.00 O ATOM 280 CB ASN A 21 10.942 17.165 7.264 1.00 0.00 C ATOM 281 CG ASN A 21 9.479 17.118 7.642 1.00 0.00 C ATOM 282 OD1 ASN A 21 8.946 18.052 8.236 1.00 0.00 O ATOM 283 ND2 ASN A 21 8.828 16.016 7.311 1.00 0.00 N ATOM 0 H ASN A 21 10.407 18.509 5.245 1.00 0.00 H new ATOM 0 HA ASN A 21 11.120 19.207 7.882 1.00 0.00 H new ATOM 0 HB2 ASN A 21 11.094 16.591 6.350 1.00 0.00 H new ATOM 0 HB3 ASN A 21 11.529 16.681 8.045 1.00 0.00 H new ATOM 0 HD21 ASN A 21 7.841 15.916 7.549 1.00 0.00 H new ATOM 0 HD22 ASN A 21 9.313 15.266 6.818 1.00 0.00 H new ATOM 290 N LEU A 22 13.552 18.393 5.853 1.00 0.00 N ATOM 291 CA LEU A 22 15.000 18.430 5.687 1.00 0.00 C ATOM 292 C LEU A 22 15.518 19.812 6.059 1.00 0.00 C ATOM 293 O LEU A 22 16.513 19.952 6.774 1.00 0.00 O ATOM 294 CB LEU A 22 15.379 18.093 4.239 1.00 0.00 C ATOM 295 CG LEU A 22 16.872 18.176 3.908 1.00 0.00 C ATOM 296 CD1 LEU A 22 17.661 17.160 4.716 1.00 0.00 C ATOM 297 CD2 LEU A 22 17.095 17.966 2.417 1.00 0.00 C ATOM 0 H LEU A 22 13.034 18.225 4.990 1.00 0.00 H new ATOM 0 HA LEU A 22 15.455 17.687 6.343 1.00 0.00 H new ATOM 0 HB2 LEU A 22 15.032 17.084 4.017 1.00 0.00 H new ATOM 0 HB3 LEU A 22 14.840 18.769 3.575 1.00 0.00 H new ATOM 0 HG LEU A 22 17.229 19.171 4.175 1.00 0.00 H new ATOM 0 HD11 LEU A 22 18.719 17.237 4.464 1.00 0.00 H new ATOM 0 HD12 LEU A 22 17.526 17.357 5.780 1.00 0.00 H new ATOM 0 HD13 LEU A 22 17.305 16.156 4.485 1.00 0.00 H new ATOM 0 HD21 LEU A 22 18.161 18.028 2.196 1.00 0.00 H new ATOM 0 HD22 LEU A 22 16.721 16.984 2.128 1.00 0.00 H new ATOM 0 HD23 LEU A 22 16.563 18.736 1.858 1.00 0.00 H new ATOM 309 N VAL A 23 14.812 20.829 5.579 1.00 0.00 N ATOM 310 CA VAL A 23 15.151 22.214 5.871 1.00 0.00 C ATOM 311 C VAL A 23 15.020 22.500 7.361 1.00 0.00 C ATOM 312 O VAL A 23 15.953 22.997 7.986 1.00 0.00 O ATOM 313 CB VAL A 23 14.249 23.195 5.092 1.00 0.00 C ATOM 314 CG1 VAL A 23 14.630 24.637 5.391 1.00 0.00 C ATOM 315 CG2 VAL A 23 14.328 22.917 3.602 1.00 0.00 C ATOM 0 H VAL A 23 13.994 20.717 4.980 1.00 0.00 H new ATOM 0 HA VAL A 23 16.185 22.361 5.558 1.00 0.00 H new ATOM 0 HB VAL A 23 13.220 23.045 5.418 1.00 0.00 H new ATOM 0 HG11 VAL A 23 13.980 25.309 4.830 1.00 0.00 H new ATOM 0 HG12 VAL A 23 14.517 24.829 6.458 1.00 0.00 H new ATOM 0 HG13 VAL A 23 15.666 24.807 5.099 1.00 0.00 H new ATOM 0 HG21 VAL A 23 13.686 23.617 3.067 1.00 0.00 H new ATOM 0 HG22 VAL A 23 15.357 23.037 3.264 1.00 0.00 H new ATOM 0 HG23 VAL A 23 13.997 21.897 3.404 1.00 0.00 H new ATOM 325 N GLN A 24 13.867 22.159 7.931 1.00 0.00 N ATOM 326 CA GLN A 24 13.596 22.470 9.331 1.00 0.00 C ATOM 327 C GLN A 24 14.566 21.727 10.246 1.00 0.00 C ATOM 328 O GLN A 24 14.948 22.228 11.296 1.00 0.00 O ATOM 329 CB GLN A 24 12.130 22.155 9.690 1.00 0.00 C ATOM 330 CG GLN A 24 11.795 20.670 9.788 1.00 0.00 C ATOM 331 CD GLN A 24 12.043 20.093 11.170 1.00 0.00 C ATOM 332 OE1 GLN A 24 11.908 20.783 12.179 1.00 0.00 O ATOM 333 NE2 GLN A 24 12.420 18.826 11.224 1.00 0.00 N ATOM 0 H GLN A 24 13.111 21.671 7.450 1.00 0.00 H new ATOM 0 HA GLN A 24 13.749 23.539 9.481 1.00 0.00 H new ATOM 0 HB2 GLN A 24 11.895 22.629 10.643 1.00 0.00 H new ATOM 0 HB3 GLN A 24 11.482 22.609 8.940 1.00 0.00 H new ATOM 0 HG2 GLN A 24 10.749 20.521 9.521 1.00 0.00 H new ATOM 0 HG3 GLN A 24 12.391 20.120 9.059 1.00 0.00 H new ATOM 0 HE21 GLN A 24 12.521 18.287 10.364 1.00 0.00 H new ATOM 0 HE22 GLN A 24 12.610 18.388 12.126 1.00 0.00 H new ATOM 342 N CYS A 25 14.979 20.539 9.821 1.00 0.00 N ATOM 343 CA CYS A 25 15.913 19.730 10.590 1.00 0.00 C ATOM 344 C CYS A 25 17.280 20.400 10.633 1.00 0.00 C ATOM 345 O CYS A 25 17.852 20.604 11.704 1.00 0.00 O ATOM 346 CB CYS A 25 16.024 18.333 9.978 1.00 0.00 C ATOM 347 SG CYS A 25 17.082 17.177 10.909 1.00 0.00 S ATOM 0 H CYS A 25 14.679 20.114 8.943 1.00 0.00 H new ATOM 0 HA CYS A 25 15.541 19.637 11.610 1.00 0.00 H new ATOM 0 HB2 CYS A 25 15.025 17.906 9.898 1.00 0.00 H new ATOM 0 HB3 CYS A 25 16.414 18.425 8.964 1.00 0.00 H new ATOM 352 N ALA A 26 17.788 20.773 9.462 1.00 0.00 N ATOM 353 CA ALA A 26 19.083 21.430 9.369 1.00 0.00 C ATOM 354 C ALA A 26 19.042 22.793 10.046 1.00 0.00 C ATOM 355 O ALA A 26 20.040 23.248 10.603 1.00 0.00 O ATOM 356 CB ALA A 26 19.508 21.562 7.916 1.00 0.00 C ATOM 0 H ALA A 26 17.321 20.631 8.566 1.00 0.00 H new ATOM 0 HA ALA A 26 19.820 20.816 9.887 1.00 0.00 H new ATOM 0 HB1 ALA A 26 20.479 22.055 7.864 1.00 0.00 H new ATOM 0 HB2 ALA A 26 19.580 20.572 7.467 1.00 0.00 H new ATOM 0 HB3 ALA A 26 18.771 22.154 7.374 1.00 0.00 H new ATOM 362 N SER A 27 17.874 23.422 10.025 1.00 0.00 N ATOM 363 CA SER A 27 17.683 24.719 10.662 1.00 0.00 C ATOM 364 C SER A 27 17.776 24.615 12.181 1.00 0.00 C ATOM 365 O SER A 27 17.920 25.620 12.877 1.00 0.00 O ATOM 366 CB SER A 27 16.326 25.297 10.273 1.00 0.00 C ATOM 367 OG SER A 27 16.247 25.512 8.876 1.00 0.00 O ATOM 0 H SER A 27 17.039 23.052 9.570 1.00 0.00 H new ATOM 0 HA SER A 27 18.478 25.379 10.316 1.00 0.00 H new ATOM 0 HB2 SER A 27 15.534 24.616 10.585 1.00 0.00 H new ATOM 0 HB3 SER A 27 16.163 26.238 10.799 1.00 0.00 H new ATOM 0 HG SER A 27 15.979 24.681 8.432 1.00 0.00 H new ATOM 373 N ARG A 28 17.694 23.397 12.689 1.00 0.00 N ATOM 374 CA ARG A 28 17.720 23.163 14.122 1.00 0.00 C ATOM 375 C ARG A 28 18.977 22.397 14.517 1.00 0.00 C ATOM 376 O ARG A 28 19.121 21.975 15.663 1.00 0.00 O ATOM 377 CB ARG A 28 16.470 22.384 14.533 1.00 0.00 C ATOM 378 CG ARG A 28 15.174 23.125 14.252 1.00 0.00 C ATOM 379 CD ARG A 28 14.986 24.306 15.187 1.00 0.00 C ATOM 380 NE ARG A 28 14.751 23.872 16.562 1.00 0.00 N ATOM 381 CZ ARG A 28 13.540 23.762 17.107 1.00 0.00 C ATOM 382 NH1 ARG A 28 12.463 24.125 16.419 1.00 0.00 N ATOM 383 NH2 ARG A 28 13.407 23.306 18.346 1.00 0.00 N ATOM 0 H ARG A 28 17.608 22.551 12.126 1.00 0.00 H new ATOM 0 HA ARG A 28 17.732 24.122 14.639 1.00 0.00 H new ATOM 0 HB2 ARG A 28 16.456 21.431 14.005 1.00 0.00 H new ATOM 0 HB3 ARG A 28 16.526 22.158 15.598 1.00 0.00 H new ATOM 0 HG2 ARG A 28 15.172 23.475 13.220 1.00 0.00 H new ATOM 0 HG3 ARG A 28 14.333 22.440 14.358 1.00 0.00 H new ATOM 0 HD2 ARG A 28 15.870 24.943 15.152 1.00 0.00 H new ATOM 0 HD3 ARG A 28 14.145 24.910 14.847 1.00 0.00 H new ATOM 0 HE ARG A 28 15.560 23.640 17.138 1.00 0.00 H new ATOM 0 HH11 ARG A 28 12.562 24.489 15.471 1.00 0.00 H new ATOM 0 HH12 ARG A 28 11.537 24.040 16.839 1.00 0.00 H new ATOM 0 HH21 ARG A 28 14.232 23.039 18.883 1.00 0.00 H new ATOM 0 HH22 ARG A 28 12.479 23.222 18.762 1.00 0.00 H new ATOM 397 N SER A 29 19.893 22.235 13.565 1.00 0.00 N ATOM 398 CA SER A 29 21.115 21.478 13.806 1.00 0.00 C ATOM 399 C SER A 29 22.062 22.249 14.722 1.00 0.00 C ATOM 400 O SER A 29 22.603 21.702 15.686 1.00 0.00 O ATOM 401 CB SER A 29 21.820 21.164 12.480 1.00 0.00 C ATOM 402 OG SER A 29 22.209 22.357 11.810 1.00 0.00 O ATOM 0 H SER A 29 19.811 22.617 12.623 1.00 0.00 H new ATOM 0 HA SER A 29 20.840 20.544 14.296 1.00 0.00 H new ATOM 0 HB2 SER A 29 22.698 20.547 12.669 1.00 0.00 H new ATOM 0 HB3 SER A 29 21.155 20.584 11.840 1.00 0.00 H new ATOM 0 HG SER A 29 21.459 22.691 11.275 1.00 0.00 H new ATOM 408 N GLY A 30 22.249 23.527 14.415 1.00 0.00 N ATOM 409 CA GLY A 30 23.209 24.336 15.137 1.00 0.00 C ATOM 410 C GLY A 30 24.578 24.271 14.494 1.00 0.00 C ATOM 411 O GLY A 30 25.547 24.825 15.008 1.00 0.00 O ATOM 0 H GLY A 30 21.749 24.019 13.674 1.00 0.00 H new ATOM 0 HA2 GLY A 30 22.867 25.371 15.166 1.00 0.00 H new ATOM 0 HA3 GLY A 30 23.273 23.993 16.170 1.00 0.00 H new ATOM 415 N VAL A 31 24.652 23.579 13.366 1.00 0.00 N ATOM 416 CA VAL A 31 25.903 23.436 12.630 1.00 0.00 C ATOM 417 C VAL A 31 25.965 24.447 11.490 1.00 0.00 C ATOM 418 O VAL A 31 27.001 25.067 11.239 1.00 0.00 O ATOM 419 CB VAL A 31 26.044 22.011 12.047 1.00 0.00 C ATOM 420 CG1 VAL A 31 27.379 21.837 11.337 1.00 0.00 C ATOM 421 CG2 VAL A 31 25.873 20.957 13.133 1.00 0.00 C ATOM 0 H VAL A 31 23.857 23.105 12.938 1.00 0.00 H new ATOM 0 HA VAL A 31 26.720 23.617 13.328 1.00 0.00 H new ATOM 0 HB VAL A 31 25.250 21.875 11.312 1.00 0.00 H new ATOM 0 HG11 VAL A 31 27.449 20.825 10.937 1.00 0.00 H new ATOM 0 HG12 VAL A 31 27.453 22.556 10.521 1.00 0.00 H new ATOM 0 HG13 VAL A 31 28.192 22.005 12.044 1.00 0.00 H new ATOM 0 HG21 VAL A 31 25.977 19.964 12.696 1.00 0.00 H new ATOM 0 HG22 VAL A 31 26.635 21.097 13.900 1.00 0.00 H new ATOM 0 HG23 VAL A 31 24.885 21.054 13.582 1.00 0.00 H new ATOM 431 N LEU A 32 24.842 24.599 10.806 1.00 0.00 N ATOM 432 CA LEU A 32 24.738 25.516 9.684 1.00 0.00 C ATOM 433 C LEU A 32 24.391 26.915 10.184 1.00 0.00 C ATOM 434 O LEU A 32 23.847 27.073 11.279 1.00 0.00 O ATOM 435 CB LEU A 32 23.668 25.031 8.692 1.00 0.00 C ATOM 436 CG LEU A 32 24.006 23.773 7.871 1.00 0.00 C ATOM 437 CD1 LEU A 32 24.032 22.526 8.745 1.00 0.00 C ATOM 438 CD2 LEU A 32 23.005 23.602 6.738 1.00 0.00 C ATOM 0 H LEU A 32 23.981 24.092 11.012 1.00 0.00 H new ATOM 0 HA LEU A 32 25.699 25.549 9.171 1.00 0.00 H new ATOM 0 HB2 LEU A 32 22.751 24.838 9.248 1.00 0.00 H new ATOM 0 HB3 LEU A 32 23.455 25.843 7.997 1.00 0.00 H new ATOM 0 HG LEU A 32 25.003 23.905 7.451 1.00 0.00 H new ATOM 0 HD11 LEU A 32 24.274 21.657 8.132 1.00 0.00 H new ATOM 0 HD12 LEU A 32 24.786 22.643 9.523 1.00 0.00 H new ATOM 0 HD13 LEU A 32 23.054 22.384 9.206 1.00 0.00 H new ATOM 0 HD21 LEU A 32 23.254 22.709 6.164 1.00 0.00 H new ATOM 0 HD22 LEU A 32 22.002 23.500 7.151 1.00 0.00 H new ATOM 0 HD23 LEU A 32 23.041 24.474 6.086 1.00 0.00 H new ATOM 450 N THR A 33 24.701 27.925 9.380 1.00 0.00 N ATOM 451 CA THR A 33 24.441 29.307 9.763 1.00 0.00 C ATOM 452 C THR A 33 22.982 29.670 9.514 1.00 0.00 C ATOM 453 O THR A 33 22.281 28.967 8.784 1.00 0.00 O ATOM 454 CB THR A 33 25.341 30.287 8.983 1.00 0.00 C ATOM 455 OG1 THR A 33 25.040 30.227 7.584 1.00 0.00 O ATOM 456 CG2 THR A 33 26.809 29.961 9.193 1.00 0.00 C ATOM 0 H THR A 33 25.131 27.814 8.462 1.00 0.00 H new ATOM 0 HA THR A 33 24.664 29.392 10.827 1.00 0.00 H new ATOM 0 HB THR A 33 25.146 31.292 9.358 1.00 0.00 H new ATOM 0 HG1 THR A 33 25.616 30.854 7.098 1.00 0.00 H new ATOM 0 HG21 THR A 33 27.422 30.667 8.632 1.00 0.00 H new ATOM 0 HG22 THR A 33 27.050 30.034 10.254 1.00 0.00 H new ATOM 0 HG23 THR A 33 27.010 28.948 8.844 1.00 0.00 H new ATOM 464 N ALA A 34 22.530 30.777 10.100 1.00 0.00 N ATOM 465 CA ALA A 34 21.154 31.229 9.922 1.00 0.00 C ATOM 466 C ALA A 34 20.872 31.529 8.456 1.00 0.00 C ATOM 467 O ALA A 34 19.736 31.423 7.993 1.00 0.00 O ATOM 468 CB ALA A 34 20.875 32.453 10.780 1.00 0.00 C ATOM 0 H ALA A 34 23.096 31.376 10.701 1.00 0.00 H new ATOM 0 HA ALA A 34 20.489 30.427 10.242 1.00 0.00 H new ATOM 0 HB1 ALA A 34 19.844 32.774 10.632 1.00 0.00 H new ATOM 0 HB2 ALA A 34 21.031 32.205 11.830 1.00 0.00 H new ATOM 0 HB3 ALA A 34 21.550 33.259 10.494 1.00 0.00 H new ATOM 474 N ASP A 35 21.919 31.884 7.728 1.00 0.00 N ATOM 475 CA ASP A 35 21.798 32.177 6.308 1.00 0.00 C ATOM 476 C ASP A 35 21.751 30.882 5.518 1.00 0.00 C ATOM 477 O ASP A 35 20.917 30.704 4.634 1.00 0.00 O ATOM 478 CB ASP A 35 22.979 33.025 5.832 1.00 0.00 C ATOM 479 CG ASP A 35 23.066 34.356 6.544 1.00 0.00 C ATOM 480 OD1 ASP A 35 23.728 34.427 7.603 1.00 0.00 O ATOM 481 OD2 ASP A 35 22.482 35.341 6.046 1.00 0.00 O ATOM 0 H ASP A 35 22.865 31.976 8.098 1.00 0.00 H new ATOM 0 HA ASP A 35 20.877 32.736 6.147 1.00 0.00 H new ATOM 0 HB2 ASP A 35 23.905 32.472 5.990 1.00 0.00 H new ATOM 0 HB3 ASP A 35 22.889 33.197 4.759 1.00 0.00 H new ATOM 486 N GLN A 36 22.643 29.971 5.878 1.00 0.00 N ATOM 487 CA GLN A 36 22.788 28.695 5.196 1.00 0.00 C ATOM 488 C GLN A 36 21.530 27.841 5.357 1.00 0.00 C ATOM 489 O GLN A 36 21.074 27.204 4.408 1.00 0.00 O ATOM 490 CB GLN A 36 24.009 27.982 5.773 1.00 0.00 C ATOM 491 CG GLN A 36 24.435 26.730 5.036 1.00 0.00 C ATOM 492 CD GLN A 36 25.705 26.153 5.623 1.00 0.00 C ATOM 493 OE1 GLN A 36 25.981 26.312 6.810 1.00 0.00 O ATOM 494 NE2 GLN A 36 26.487 25.486 4.797 1.00 0.00 N ATOM 0 H GLN A 36 23.290 30.098 6.656 1.00 0.00 H new ATOM 0 HA GLN A 36 22.926 28.861 4.128 1.00 0.00 H new ATOM 0 HB2 GLN A 36 24.846 28.680 5.783 1.00 0.00 H new ATOM 0 HB3 GLN A 36 23.800 27.720 6.810 1.00 0.00 H new ATOM 0 HG2 GLN A 36 23.639 25.987 5.085 1.00 0.00 H new ATOM 0 HG3 GLN A 36 24.591 26.961 3.982 1.00 0.00 H new ATOM 0 HE21 GLN A 36 26.221 25.377 3.818 1.00 0.00 H new ATOM 0 HE22 GLN A 36 27.358 25.079 5.137 1.00 0.00 H new ATOM 503 N MET A 37 20.961 27.852 6.557 1.00 0.00 N ATOM 504 CA MET A 37 19.759 27.074 6.846 1.00 0.00 C ATOM 505 C MET A 37 18.545 27.666 6.136 1.00 0.00 C ATOM 506 O MET A 37 17.705 26.938 5.605 1.00 0.00 O ATOM 507 CB MET A 37 19.508 27.022 8.355 1.00 0.00 C ATOM 508 CG MET A 37 20.630 26.354 9.136 1.00 0.00 C ATOM 509 SD MET A 37 20.381 26.390 10.924 1.00 0.00 S ATOM 510 CE MET A 37 20.277 28.150 11.234 1.00 0.00 C ATOM 0 H MET A 37 21.313 28.392 7.348 1.00 0.00 H new ATOM 0 HA MET A 37 19.915 26.060 6.477 1.00 0.00 H new ATOM 0 HB2 MET A 37 19.372 28.037 8.727 1.00 0.00 H new ATOM 0 HB3 MET A 37 18.577 26.486 8.542 1.00 0.00 H new ATOM 0 HG2 MET A 37 20.722 25.318 8.810 1.00 0.00 H new ATOM 0 HG3 MET A 37 21.572 26.848 8.898 1.00 0.00 H new ATOM 0 HE1 MET A 37 20.106 28.323 12.296 1.00 0.00 H new ATOM 0 HE2 MET A 37 21.210 28.628 10.934 1.00 0.00 H new ATOM 0 HE3 MET A 37 19.452 28.572 10.660 1.00 0.00 H new ATOM 520 N ASP A 38 18.470 28.990 6.116 1.00 0.00 N ATOM 521 CA ASP A 38 17.340 29.682 5.502 1.00 0.00 C ATOM 522 C ASP A 38 17.392 29.563 3.985 1.00 0.00 C ATOM 523 O ASP A 38 16.355 29.505 3.323 1.00 0.00 O ATOM 524 CB ASP A 38 17.328 31.153 5.911 1.00 0.00 C ATOM 525 CG ASP A 38 16.107 31.885 5.392 1.00 0.00 C ATOM 526 OD1 ASP A 38 14.990 31.599 5.875 1.00 0.00 O ATOM 527 OD2 ASP A 38 16.260 32.759 4.515 1.00 0.00 O ATOM 0 H ASP A 38 19.176 29.607 6.517 1.00 0.00 H new ATOM 0 HA ASP A 38 16.423 29.210 5.855 1.00 0.00 H new ATOM 0 HB2 ASP A 38 17.357 31.226 6.998 1.00 0.00 H new ATOM 0 HB3 ASP A 38 18.228 31.640 5.535 1.00 0.00 H new ATOM 532 N ASP A 39 18.602 29.508 3.441 1.00 0.00 N ATOM 533 CA ASP A 39 18.790 29.326 2.004 1.00 0.00 C ATOM 534 C ASP A 39 18.191 27.994 1.566 1.00 0.00 C ATOM 535 O ASP A 39 17.663 27.866 0.465 1.00 0.00 O ATOM 536 CB ASP A 39 20.276 29.388 1.637 1.00 0.00 C ATOM 537 CG ASP A 39 20.500 29.377 0.137 1.00 0.00 C ATOM 538 OD1 ASP A 39 20.502 30.468 -0.479 1.00 0.00 O ATOM 539 OD2 ASP A 39 20.677 28.285 -0.436 1.00 0.00 O ATOM 0 H ASP A 39 19.469 29.587 3.972 1.00 0.00 H new ATOM 0 HA ASP A 39 18.278 30.135 1.482 1.00 0.00 H new ATOM 0 HB2 ASP A 39 20.715 30.291 2.061 1.00 0.00 H new ATOM 0 HB3 ASP A 39 20.794 28.541 2.086 1.00 0.00 H new ATOM 544 N MET A 40 18.243 27.009 2.458 1.00 0.00 N ATOM 545 CA MET A 40 17.627 25.713 2.200 1.00 0.00 C ATOM 546 C MET A 40 16.110 25.856 2.092 1.00 0.00 C ATOM 547 O MET A 40 15.452 25.098 1.378 1.00 0.00 O ATOM 548 CB MET A 40 17.976 24.711 3.301 1.00 0.00 C ATOM 549 CG MET A 40 19.458 24.386 3.390 1.00 0.00 C ATOM 550 SD MET A 40 19.831 23.188 4.684 1.00 0.00 S ATOM 551 CE MET A 40 18.893 21.768 4.123 1.00 0.00 C ATOM 0 H MET A 40 18.705 27.084 3.364 1.00 0.00 H new ATOM 0 HA MET A 40 18.019 25.339 1.254 1.00 0.00 H new ATOM 0 HB2 MET A 40 17.643 25.109 4.260 1.00 0.00 H new ATOM 0 HB3 MET A 40 17.421 23.789 3.129 1.00 0.00 H new ATOM 0 HG2 MET A 40 19.799 23.996 2.431 1.00 0.00 H new ATOM 0 HG3 MET A 40 20.016 25.303 3.578 1.00 0.00 H new ATOM 0 HE1 MET A 40 19.188 20.888 4.695 1.00 0.00 H new ATOM 0 HE2 MET A 40 17.829 21.955 4.267 1.00 0.00 H new ATOM 0 HE3 MET A 40 19.091 21.596 3.065 1.00 0.00 H new ATOM 561 N GLY A 41 15.565 26.843 2.794 1.00 0.00 N ATOM 562 CA GLY A 41 14.137 27.093 2.751 1.00 0.00 C ATOM 563 C GLY A 41 13.683 27.564 1.387 1.00 0.00 C ATOM 564 O GLY A 41 12.648 27.129 0.883 1.00 0.00 O ATOM 0 H GLY A 41 16.090 27.478 3.395 1.00 0.00 H new ATOM 0 HA2 GLY A 41 13.602 26.181 3.016 1.00 0.00 H new ATOM 0 HA3 GLY A 41 13.878 27.843 3.498 1.00 0.00 H new ATOM 568 N MET A 42 14.463 28.447 0.780 1.00 0.00 N ATOM 569 CA MET A 42 14.160 28.938 -0.556 1.00 0.00 C ATOM 570 C MET A 42 14.619 27.929 -1.603 1.00 0.00 C ATOM 571 O MET A 42 14.193 27.970 -2.758 1.00 0.00 O ATOM 572 CB MET A 42 14.811 30.300 -0.789 1.00 0.00 C ATOM 573 CG MET A 42 16.325 30.259 -0.839 1.00 0.00 C ATOM 574 SD MET A 42 17.065 31.898 -0.790 1.00 0.00 S ATOM 575 CE MET A 42 16.568 32.434 0.846 1.00 0.00 C ATOM 0 H MET A 42 15.310 28.838 1.192 1.00 0.00 H new ATOM 0 HA MET A 42 13.081 29.062 -0.647 1.00 0.00 H new ATOM 0 HB2 MET A 42 14.438 30.714 -1.726 1.00 0.00 H new ATOM 0 HB3 MET A 42 14.502 30.980 0.005 1.00 0.00 H new ATOM 0 HG2 MET A 42 16.697 29.672 0.001 1.00 0.00 H new ATOM 0 HG3 MET A 42 16.641 29.749 -1.749 1.00 0.00 H new ATOM 0 HE1 MET A 42 17.417 32.893 1.352 1.00 0.00 H new ATOM 0 HE2 MET A 42 15.760 33.161 0.761 1.00 0.00 H new ATOM 0 HE3 MET A 42 16.223 31.575 1.421 1.00 0.00 H new ATOM 585 N MET A 43 15.495 27.021 -1.186 1.00 0.00 N ATOM 586 CA MET A 43 15.892 25.897 -2.022 1.00 0.00 C ATOM 587 C MET A 43 14.696 24.974 -2.226 1.00 0.00 C ATOM 588 O MET A 43 14.512 24.399 -3.300 1.00 0.00 O ATOM 589 CB MET A 43 17.069 25.152 -1.374 1.00 0.00 C ATOM 590 CG MET A 43 17.539 23.915 -2.129 1.00 0.00 C ATOM 591 SD MET A 43 16.557 22.437 -1.774 1.00 0.00 S ATOM 592 CE MET A 43 16.829 22.252 -0.012 1.00 0.00 C ATOM 0 H MET A 43 15.944 27.043 -0.271 1.00 0.00 H new ATOM 0 HA MET A 43 16.221 26.257 -2.997 1.00 0.00 H new ATOM 0 HB2 MET A 43 17.908 25.841 -1.278 1.00 0.00 H new ATOM 0 HB3 MET A 43 16.782 24.857 -0.365 1.00 0.00 H new ATOM 0 HG2 MET A 43 17.503 24.117 -3.200 1.00 0.00 H new ATOM 0 HG3 MET A 43 18.581 23.719 -1.876 1.00 0.00 H new ATOM 0 HE1 MET A 43 16.864 21.192 0.242 1.00 0.00 H new ATOM 0 HE2 MET A 43 17.774 22.722 0.262 1.00 0.00 H new ATOM 0 HE3 MET A 43 16.015 22.729 0.534 1.00 0.00 H new ATOM 602 N ALA A 44 13.865 24.862 -1.195 1.00 0.00 N ATOM 603 CA ALA A 44 12.637 24.086 -1.279 1.00 0.00 C ATOM 604 C ALA A 44 11.710 24.668 -2.344 1.00 0.00 C ATOM 605 O ALA A 44 11.011 23.928 -3.038 1.00 0.00 O ATOM 606 CB ALA A 44 11.942 24.041 0.073 1.00 0.00 C ATOM 0 H ALA A 44 14.022 25.302 -0.288 1.00 0.00 H new ATOM 0 HA ALA A 44 12.891 23.066 -1.567 1.00 0.00 H new ATOM 0 HB1 ALA A 44 11.025 23.457 -0.008 1.00 0.00 H new ATOM 0 HB2 ALA A 44 12.603 23.579 0.807 1.00 0.00 H new ATOM 0 HB3 ALA A 44 11.699 25.055 0.391 1.00 0.00 H new ATOM 612 N ASP A 45 11.737 25.996 -2.483 1.00 0.00 N ATOM 613 CA ASP A 45 10.943 26.692 -3.501 1.00 0.00 C ATOM 614 C ASP A 45 11.379 26.289 -4.902 1.00 0.00 C ATOM 615 O ASP A 45 10.635 26.448 -5.868 1.00 0.00 O ATOM 616 CB ASP A 45 11.075 28.209 -3.362 1.00 0.00 C ATOM 617 CG ASP A 45 10.383 28.758 -2.136 1.00 0.00 C ATOM 618 OD1 ASP A 45 9.139 28.852 -2.144 1.00 0.00 O ATOM 619 OD2 ASP A 45 11.078 29.117 -1.170 1.00 0.00 O ATOM 0 H ASP A 45 12.303 26.614 -1.901 1.00 0.00 H new ATOM 0 HA ASP A 45 9.903 26.405 -3.347 1.00 0.00 H new ATOM 0 HB2 ASP A 45 12.132 28.473 -3.323 1.00 0.00 H new ATOM 0 HB3 ASP A 45 10.660 28.686 -4.250 1.00 0.00 H new ATOM 624 N SER A 46 12.600 25.801 -5.011 1.00 0.00 N ATOM 625 CA SER A 46 13.100 25.289 -6.269 1.00 0.00 C ATOM 626 C SER A 46 12.557 23.883 -6.491 1.00 0.00 C ATOM 627 O SER A 46 12.035 23.569 -7.559 1.00 0.00 O ATOM 628 CB SER A 46 14.633 25.290 -6.256 1.00 0.00 C ATOM 629 OG SER A 46 15.171 24.817 -7.478 1.00 0.00 O ATOM 0 H SER A 46 13.265 25.749 -4.239 1.00 0.00 H new ATOM 0 HA SER A 46 12.766 25.925 -7.089 1.00 0.00 H new ATOM 0 HB2 SER A 46 14.994 26.301 -6.067 1.00 0.00 H new ATOM 0 HB3 SER A 46 14.990 24.666 -5.436 1.00 0.00 H new ATOM 0 HG SER A 46 16.137 24.981 -7.495 1.00 0.00 H new ATOM 635 N VAL A 47 12.640 23.058 -5.450 1.00 0.00 N ATOM 636 CA VAL A 47 12.201 21.667 -5.525 1.00 0.00 C ATOM 637 C VAL A 47 10.727 21.566 -5.907 1.00 0.00 C ATOM 638 O VAL A 47 10.376 20.871 -6.862 1.00 0.00 O ATOM 639 CB VAL A 47 12.426 20.923 -4.190 1.00 0.00 C ATOM 640 CG1 VAL A 47 11.993 19.466 -4.300 1.00 0.00 C ATOM 641 CG2 VAL A 47 13.882 21.022 -3.765 1.00 0.00 C ATOM 0 H VAL A 47 13.010 23.331 -4.539 1.00 0.00 H new ATOM 0 HA VAL A 47 12.806 21.196 -6.300 1.00 0.00 H new ATOM 0 HB VAL A 47 11.812 21.399 -3.426 1.00 0.00 H new ATOM 0 HG11 VAL A 47 12.161 18.964 -3.347 1.00 0.00 H new ATOM 0 HG12 VAL A 47 10.934 19.419 -4.553 1.00 0.00 H new ATOM 0 HG13 VAL A 47 12.574 18.972 -5.079 1.00 0.00 H new ATOM 0 HG21 VAL A 47 14.023 20.493 -2.823 1.00 0.00 H new ATOM 0 HG22 VAL A 47 14.516 20.575 -4.531 1.00 0.00 H new ATOM 0 HG23 VAL A 47 14.153 22.070 -3.636 1.00 0.00 H new ATOM 651 N ASN A 48 9.863 22.273 -5.181 1.00 0.00 N ATOM 652 CA ASN A 48 8.430 22.188 -5.423 1.00 0.00 C ATOM 653 C ASN A 48 8.053 22.819 -6.756 1.00 0.00 C ATOM 654 O ASN A 48 7.104 22.383 -7.403 1.00 0.00 O ATOM 655 CB ASN A 48 7.622 22.805 -4.269 1.00 0.00 C ATOM 656 CG ASN A 48 8.086 24.189 -3.850 1.00 0.00 C ATOM 657 OD1 ASN A 48 8.518 24.991 -4.668 1.00 0.00 O ATOM 658 ND2 ASN A 48 8.011 24.465 -2.556 1.00 0.00 N ATOM 0 H ASN A 48 10.130 22.906 -4.427 1.00 0.00 H new ATOM 0 HA ASN A 48 8.174 21.130 -5.473 1.00 0.00 H new ATOM 0 HB2 ASN A 48 6.574 22.860 -4.564 1.00 0.00 H new ATOM 0 HB3 ASN A 48 7.676 22.140 -3.407 1.00 0.00 H new ATOM 0 HD21 ASN A 48 8.320 25.373 -2.210 1.00 0.00 H new ATOM 0 HD22 ASN A 48 7.645 23.769 -1.906 1.00 0.00 H new ATOM 665 N SER A 49 8.810 23.823 -7.180 1.00 0.00 N ATOM 666 CA SER A 49 8.591 24.437 -8.482 1.00 0.00 C ATOM 667 C SER A 49 8.844 23.417 -9.591 1.00 0.00 C ATOM 668 O SER A 49 8.040 23.273 -10.517 1.00 0.00 O ATOM 669 CB SER A 49 9.503 25.655 -8.663 1.00 0.00 C ATOM 670 OG SER A 49 9.294 26.275 -9.922 1.00 0.00 O ATOM 0 H SER A 49 9.578 24.228 -6.644 1.00 0.00 H new ATOM 0 HA SER A 49 7.555 24.772 -8.539 1.00 0.00 H new ATOM 0 HB2 SER A 49 9.315 26.374 -7.866 1.00 0.00 H new ATOM 0 HB3 SER A 49 10.545 25.348 -8.576 1.00 0.00 H new ATOM 0 HG SER A 49 9.888 27.049 -10.008 1.00 0.00 H new ATOM 676 N GLN A 50 9.952 22.693 -9.482 1.00 0.00 N ATOM 677 CA GLN A 50 10.314 21.703 -10.485 1.00 0.00 C ATOM 678 C GLN A 50 9.381 20.499 -10.407 1.00 0.00 C ATOM 679 O GLN A 50 9.012 19.922 -11.424 1.00 0.00 O ATOM 680 CB GLN A 50 11.764 21.254 -10.307 1.00 0.00 C ATOM 681 CG GLN A 50 12.747 22.408 -10.199 1.00 0.00 C ATOM 682 CD GLN A 50 14.186 21.945 -10.098 1.00 0.00 C ATOM 683 OE1 GLN A 50 14.573 20.945 -10.701 1.00 0.00 O ATOM 684 NE2 GLN A 50 14.980 22.644 -9.304 1.00 0.00 N ATOM 0 H GLN A 50 10.613 22.774 -8.710 1.00 0.00 H new ATOM 0 HA GLN A 50 10.213 22.165 -11.467 1.00 0.00 H new ATOM 0 HB2 GLN A 50 11.838 20.639 -9.410 1.00 0.00 H new ATOM 0 HB3 GLN A 50 12.047 20.624 -11.150 1.00 0.00 H new ATOM 0 HG2 GLN A 50 12.638 23.055 -11.070 1.00 0.00 H new ATOM 0 HG3 GLN A 50 12.501 23.008 -9.323 1.00 0.00 H new ATOM 0 HE21 GLN A 50 14.621 23.468 -8.821 1.00 0.00 H new ATOM 0 HE22 GLN A 50 15.951 22.359 -9.175 1.00 0.00 H new ATOM 693 N MET A 51 8.996 20.140 -9.189 1.00 0.00 N ATOM 694 CA MET A 51 8.085 19.023 -8.964 1.00 0.00 C ATOM 695 C MET A 51 6.727 19.281 -9.614 1.00 0.00 C ATOM 696 O MET A 51 6.125 18.379 -10.194 1.00 0.00 O ATOM 697 CB MET A 51 7.912 18.780 -7.462 1.00 0.00 C ATOM 698 CG MET A 51 7.005 17.608 -7.125 1.00 0.00 C ATOM 699 SD MET A 51 6.854 17.329 -5.348 1.00 0.00 S ATOM 700 CE MET A 51 6.163 18.889 -4.798 1.00 0.00 C ATOM 0 H MET A 51 9.302 20.609 -8.336 1.00 0.00 H new ATOM 0 HA MET A 51 8.517 18.134 -9.423 1.00 0.00 H new ATOM 0 HB2 MET A 51 8.892 18.607 -7.017 1.00 0.00 H new ATOM 0 HB3 MET A 51 7.508 19.682 -7.003 1.00 0.00 H new ATOM 0 HG2 MET A 51 6.015 17.788 -7.545 1.00 0.00 H new ATOM 0 HG3 MET A 51 7.393 16.706 -7.598 1.00 0.00 H new ATOM 0 HE1 MET A 51 5.646 18.744 -3.850 1.00 0.00 H new ATOM 0 HE2 MET A 51 6.965 19.616 -4.667 1.00 0.00 H new ATOM 0 HE3 MET A 51 5.458 19.257 -5.543 1.00 0.00 H new ATOM 710 N GLN A 52 6.258 20.519 -9.538 1.00 0.00 N ATOM 711 CA GLN A 52 4.947 20.863 -10.074 1.00 0.00 C ATOM 712 C GLN A 52 4.972 20.972 -11.595 1.00 0.00 C ATOM 713 O GLN A 52 3.961 20.727 -12.250 1.00 0.00 O ATOM 714 CB GLN A 52 4.432 22.157 -9.449 1.00 0.00 C ATOM 715 CG GLN A 52 4.132 22.017 -7.965 1.00 0.00 C ATOM 716 CD GLN A 52 3.638 23.302 -7.338 1.00 0.00 C ATOM 717 OE1 GLN A 52 2.437 23.566 -7.301 1.00 0.00 O ATOM 718 NE2 GLN A 52 4.558 24.106 -6.835 1.00 0.00 N ATOM 0 H GLN A 52 6.762 21.298 -9.113 1.00 0.00 H new ATOM 0 HA GLN A 52 4.263 20.055 -9.814 1.00 0.00 H new ATOM 0 HB2 GLN A 52 5.172 22.944 -9.592 1.00 0.00 H new ATOM 0 HB3 GLN A 52 3.527 22.472 -9.970 1.00 0.00 H new ATOM 0 HG2 GLN A 52 3.382 21.238 -7.823 1.00 0.00 H new ATOM 0 HG3 GLN A 52 5.033 21.690 -7.447 1.00 0.00 H new ATOM 0 HE21 GLN A 52 5.544 23.849 -6.887 1.00 0.00 H new ATOM 0 HE22 GLN A 52 4.283 24.984 -6.395 1.00 0.00 H new ATOM 727 N LYS A 53 6.123 21.327 -12.164 1.00 0.00 N ATOM 728 CA LYS A 53 6.256 21.362 -13.616 1.00 0.00 C ATOM 729 C LYS A 53 6.533 19.957 -14.143 1.00 0.00 C ATOM 730 O LYS A 53 6.466 19.700 -15.345 1.00 0.00 O ATOM 731 CB LYS A 53 7.360 22.326 -14.048 1.00 0.00 C ATOM 732 CG LYS A 53 8.768 21.818 -13.815 1.00 0.00 C ATOM 733 CD LYS A 53 9.785 22.887 -14.156 1.00 0.00 C ATOM 734 CE LYS A 53 11.214 22.395 -13.982 1.00 0.00 C ATOM 735 NZ LYS A 53 12.207 23.491 -14.140 1.00 0.00 N ATOM 0 H LYS A 53 6.964 21.590 -11.650 1.00 0.00 H new ATOM 0 HA LYS A 53 5.319 21.724 -14.040 1.00 0.00 H new ATOM 0 HB2 LYS A 53 7.238 22.545 -15.109 1.00 0.00 H new ATOM 0 HB3 LYS A 53 7.234 23.266 -13.511 1.00 0.00 H new ATOM 0 HG2 LYS A 53 8.884 21.517 -12.774 1.00 0.00 H new ATOM 0 HG3 LYS A 53 8.946 20.932 -14.424 1.00 0.00 H new ATOM 0 HD2 LYS A 53 9.637 23.212 -15.186 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.622 23.757 -13.521 1.00 0.00 H new ATOM 0 HE2 LYS A 53 11.325 21.946 -12.995 1.00 0.00 H new ATOM 0 HE3 LYS A 53 11.419 21.613 -14.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 13.167 23.111 -14.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 12.121 23.903 -15.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 12.029 24.226 -13.426 1.00 0.00 H new ATOM 749 N MET A 54 6.860 19.057 -13.220 1.00 0.00 N ATOM 750 CA MET A 54 7.031 17.649 -13.541 1.00 0.00 C ATOM 751 C MET A 54 5.664 16.984 -13.651 1.00 0.00 C ATOM 752 O MET A 54 5.462 16.072 -14.459 1.00 0.00 O ATOM 753 CB MET A 54 7.883 16.960 -12.468 1.00 0.00 C ATOM 754 CG MET A 54 8.088 15.478 -12.720 1.00 0.00 C ATOM 755 SD MET A 54 9.294 14.724 -11.607 1.00 0.00 S ATOM 756 CE MET A 54 8.470 14.868 -10.025 1.00 0.00 C ATOM 0 H MET A 54 7.012 19.283 -12.237 1.00 0.00 H new ATOM 0 HA MET A 54 7.548 17.556 -14.496 1.00 0.00 H new ATOM 0 HB2 MET A 54 8.855 17.450 -12.417 1.00 0.00 H new ATOM 0 HB3 MET A 54 7.407 17.093 -11.496 1.00 0.00 H new ATOM 0 HG2 MET A 54 7.133 14.963 -12.613 1.00 0.00 H new ATOM 0 HG3 MET A 54 8.414 15.333 -13.750 1.00 0.00 H new ATOM 0 HE1 MET A 54 9.109 14.458 -9.243 1.00 0.00 H new ATOM 0 HE2 MET A 54 8.267 15.918 -9.815 1.00 0.00 H new ATOM 0 HE3 MET A 54 7.531 14.316 -10.052 1.00 0.00 H new ATOM 766 N GLY A 55 4.731 17.457 -12.837 1.00 0.00 N ATOM 767 CA GLY A 55 3.366 16.987 -12.912 1.00 0.00 C ATOM 768 C GLY A 55 2.981 16.103 -11.743 1.00 0.00 C ATOM 769 O GLY A 55 3.810 15.356 -11.228 1.00 0.00 O ATOM 0 H GLY A 55 4.899 18.164 -12.121 1.00 0.00 H new ATOM 0 HA2 GLY A 55 2.694 17.844 -12.950 1.00 0.00 H new ATOM 0 HA3 GLY A 55 3.228 16.433 -13.841 1.00 0.00 H new ATOM 773 N PRO A 56 1.713 16.165 -11.306 1.00 0.00 N ATOM 774 CA PRO A 56 1.201 15.316 -10.225 1.00 0.00 C ATOM 775 C PRO A 56 0.869 13.909 -10.714 1.00 0.00 C ATOM 776 O PRO A 56 0.114 13.166 -10.078 1.00 0.00 O ATOM 777 CB PRO A 56 -0.066 16.048 -9.794 1.00 0.00 C ATOM 778 CG PRO A 56 -0.551 16.713 -11.036 1.00 0.00 C ATOM 779 CD PRO A 56 0.677 17.079 -11.827 1.00 0.00 C ATOM 0 HA PRO A 56 1.925 15.174 -9.423 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -0.809 15.356 -9.398 1.00 0.00 H new ATOM 0 HB3 PRO A 56 0.143 16.775 -9.009 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -1.197 16.046 -11.607 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -1.139 17.600 -10.798 1.00 0.00 H new ATOM 0 HD2 PRO A 56 0.521 16.939 -12.897 1.00 0.00 H new ATOM 0 HD3 PRO A 56 0.953 18.123 -11.679 1.00 0.00 H new ATOM 787 N ASN A 57 1.448 13.561 -11.850 1.00 0.00 N ATOM 788 CA ASN A 57 1.243 12.270 -12.486 1.00 0.00 C ATOM 789 C ASN A 57 2.312 12.105 -13.566 1.00 0.00 C ATOM 790 O ASN A 57 2.008 12.002 -14.755 1.00 0.00 O ATOM 791 CB ASN A 57 -0.159 12.216 -13.102 1.00 0.00 C ATOM 792 CG ASN A 57 -0.746 10.819 -13.121 1.00 0.00 C ATOM 793 OD1 ASN A 57 -0.494 10.034 -14.033 1.00 0.00 O ATOM 794 ND2 ASN A 57 -1.560 10.514 -12.122 1.00 0.00 N ATOM 0 H ASN A 57 2.081 14.174 -12.363 1.00 0.00 H new ATOM 0 HA ASN A 57 1.324 11.462 -11.758 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -0.822 12.875 -12.541 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -0.117 12.600 -14.121 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -2.006 9.597 -12.089 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -1.741 11.196 -11.385 1.00 0.00 H new ATOM 801 N PRO A 58 3.590 12.108 -13.153 1.00 0.00 N ATOM 802 CA PRO A 58 4.722 12.257 -14.060 1.00 0.00 C ATOM 803 C PRO A 58 5.288 10.935 -14.590 1.00 0.00 C ATOM 804 O PRO A 58 5.034 9.866 -14.033 1.00 0.00 O ATOM 805 CB PRO A 58 5.744 12.950 -13.164 1.00 0.00 C ATOM 806 CG PRO A 58 5.479 12.424 -11.787 1.00 0.00 C ATOM 807 CD PRO A 58 4.044 11.953 -11.758 1.00 0.00 C ATOM 0 HA PRO A 58 4.446 12.794 -14.968 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.762 12.726 -13.482 1.00 0.00 H new ATOM 0 HB3 PRO A 58 5.629 14.033 -13.201 1.00 0.00 H new ATOM 0 HG2 PRO A 58 6.158 11.605 -11.551 1.00 0.00 H new ATOM 0 HG3 PRO A 58 5.644 13.200 -11.040 1.00 0.00 H new ATOM 0 HD2 PRO A 58 3.970 10.917 -11.427 1.00 0.00 H new ATOM 0 HD3 PRO A 58 3.442 12.550 -11.073 1.00 0.00 H new ATOM 815 N PRO A 59 6.064 11.003 -15.690 1.00 0.00 N ATOM 816 CA PRO A 59 6.756 9.842 -16.254 1.00 0.00 C ATOM 817 C PRO A 59 7.976 9.452 -15.425 1.00 0.00 C ATOM 818 O PRO A 59 8.598 10.300 -14.781 1.00 0.00 O ATOM 819 CB PRO A 59 7.191 10.305 -17.654 1.00 0.00 C ATOM 820 CG PRO A 59 6.584 11.656 -17.850 1.00 0.00 C ATOM 821 CD PRO A 59 6.317 12.209 -16.482 1.00 0.00 C ATOM 0 HA PRO A 59 6.115 8.961 -16.273 1.00 0.00 H new ATOM 0 HB2 PRO A 59 8.277 10.351 -17.729 1.00 0.00 H new ATOM 0 HB3 PRO A 59 6.848 9.609 -18.419 1.00 0.00 H new ATOM 0 HG2 PRO A 59 7.259 12.307 -18.406 1.00 0.00 H new ATOM 0 HG3 PRO A 59 5.662 11.586 -18.426 1.00 0.00 H new ATOM 0 HD2 PRO A 59 7.168 12.773 -16.100 1.00 0.00 H new ATOM 0 HD3 PRO A 59 5.460 12.883 -16.478 1.00 0.00 H new ATOM 829 N GLN A 60 8.334 8.176 -15.482 1.00 0.00 N ATOM 830 CA GLN A 60 9.370 7.607 -14.625 1.00 0.00 C ATOM 831 C GLN A 60 10.726 8.300 -14.800 1.00 0.00 C ATOM 832 O GLN A 60 11.483 8.443 -13.837 1.00 0.00 O ATOM 833 CB GLN A 60 9.506 6.110 -14.916 1.00 0.00 C ATOM 834 CG GLN A 60 10.337 5.347 -13.895 1.00 0.00 C ATOM 835 CD GLN A 60 9.680 5.280 -12.524 1.00 0.00 C ATOM 836 OE1 GLN A 60 8.973 6.195 -12.106 1.00 0.00 O ATOM 837 NE2 GLN A 60 9.900 4.180 -11.821 1.00 0.00 N ATOM 0 H GLN A 60 7.914 7.504 -16.124 1.00 0.00 H new ATOM 0 HA GLN A 60 9.064 7.765 -13.591 1.00 0.00 H new ATOM 0 HB2 GLN A 60 8.510 5.668 -14.960 1.00 0.00 H new ATOM 0 HB3 GLN A 60 9.955 5.982 -15.901 1.00 0.00 H new ATOM 0 HG2 GLN A 60 10.509 4.334 -14.259 1.00 0.00 H new ATOM 0 HG3 GLN A 60 11.313 5.822 -13.801 1.00 0.00 H new ATOM 0 HE21 GLN A 60 10.493 3.442 -12.201 1.00 0.00 H new ATOM 0 HE22 GLN A 60 9.477 4.071 -10.899 1.00 0.00 H new ATOM 846 N HIS A 61 11.027 8.744 -16.021 1.00 0.00 N ATOM 847 CA HIS A 61 12.328 9.357 -16.306 1.00 0.00 C ATOM 848 C HIS A 61 12.500 10.671 -15.549 1.00 0.00 C ATOM 849 O HIS A 61 13.621 11.108 -15.300 1.00 0.00 O ATOM 850 CB HIS A 61 12.542 9.570 -17.822 1.00 0.00 C ATOM 851 CG HIS A 61 11.604 10.546 -18.485 1.00 0.00 C ATOM 852 ND1 HIS A 61 10.663 10.165 -19.418 1.00 0.00 N ATOM 853 CD2 HIS A 61 11.490 11.893 -18.377 1.00 0.00 C ATOM 854 CE1 HIS A 61 10.014 11.228 -19.852 1.00 0.00 C ATOM 855 NE2 HIS A 61 10.496 12.288 -19.236 1.00 0.00 N ATOM 0 H HIS A 61 10.397 8.693 -16.821 1.00 0.00 H new ATOM 0 HA HIS A 61 13.091 8.661 -15.958 1.00 0.00 H new ATOM 0 HB2 HIS A 61 13.565 9.912 -17.981 1.00 0.00 H new ATOM 0 HB3 HIS A 61 12.447 8.606 -18.322 1.00 0.00 H new ATOM 0 HD2 HIS A 61 12.073 12.535 -17.734 1.00 0.00 H new ATOM 0 HE1 HIS A 61 9.223 11.229 -20.587 1.00 0.00 H new ATOM 0 HE2 HIS A 61 10.181 13.248 -19.375 1.00 0.00 H new ATOM 863 N ARG A 62 11.386 11.287 -15.177 1.00 0.00 N ATOM 864 CA ARG A 62 11.426 12.541 -14.439 1.00 0.00 C ATOM 865 C ARG A 62 11.915 12.319 -13.015 1.00 0.00 C ATOM 866 O ARG A 62 12.760 13.061 -12.516 1.00 0.00 O ATOM 867 CB ARG A 62 10.041 13.181 -14.406 1.00 0.00 C ATOM 868 CG ARG A 62 9.643 13.882 -15.692 1.00 0.00 C ATOM 869 CD ARG A 62 10.513 15.100 -15.957 1.00 0.00 C ATOM 870 NE ARG A 62 9.918 15.978 -16.959 1.00 0.00 N ATOM 871 CZ ARG A 62 10.452 17.137 -17.347 1.00 0.00 C ATOM 872 NH1 ARG A 62 11.640 17.516 -16.890 1.00 0.00 N ATOM 873 NH2 ARG A 62 9.802 17.908 -18.209 1.00 0.00 N ATOM 0 H ARG A 62 10.447 10.940 -15.373 1.00 0.00 H new ATOM 0 HA ARG A 62 12.121 13.207 -14.949 1.00 0.00 H new ATOM 0 HB2 ARG A 62 9.303 12.410 -14.183 1.00 0.00 H new ATOM 0 HB3 ARG A 62 10.006 13.901 -13.588 1.00 0.00 H new ATOM 0 HG2 ARG A 62 9.726 13.186 -16.527 1.00 0.00 H new ATOM 0 HG3 ARG A 62 8.598 14.186 -15.633 1.00 0.00 H new ATOM 0 HD2 ARG A 62 10.659 15.653 -15.029 1.00 0.00 H new ATOM 0 HD3 ARG A 62 11.498 14.778 -16.294 1.00 0.00 H new ATOM 0 HE ARG A 62 9.040 15.688 -17.389 1.00 0.00 H new ATOM 0 HH11 ARG A 62 12.150 16.919 -16.238 1.00 0.00 H new ATOM 0 HH12 ARG A 62 12.043 18.404 -17.191 1.00 0.00 H new ATOM 0 HH21 ARG A 62 8.896 17.614 -18.574 1.00 0.00 H new ATOM 0 HH22 ARG A 62 10.208 18.795 -18.507 1.00 0.00 H new ATOM 887 N LEU A 63 11.398 11.277 -12.380 1.00 0.00 N ATOM 888 CA LEU A 63 11.694 11.003 -10.979 1.00 0.00 C ATOM 889 C LEU A 63 13.177 10.718 -10.775 1.00 0.00 C ATOM 890 O LEU A 63 13.763 11.135 -9.780 1.00 0.00 O ATOM 891 CB LEU A 63 10.852 9.823 -10.471 1.00 0.00 C ATOM 892 CG LEU A 63 9.347 10.096 -10.298 1.00 0.00 C ATOM 893 CD1 LEU A 63 8.655 10.281 -11.637 1.00 0.00 C ATOM 894 CD2 LEU A 63 8.685 8.975 -9.514 1.00 0.00 C ATOM 0 H LEU A 63 10.768 10.603 -12.815 1.00 0.00 H new ATOM 0 HA LEU A 63 11.437 11.892 -10.404 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.973 8.990 -11.164 1.00 0.00 H new ATOM 0 HB3 LEU A 63 11.256 9.500 -9.511 1.00 0.00 H new ATOM 0 HG LEU A 63 9.246 11.025 -9.738 1.00 0.00 H new ATOM 0 HD11 LEU A 63 7.594 10.472 -11.475 1.00 0.00 H new ATOM 0 HD12 LEU A 63 9.100 11.126 -12.163 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.774 9.378 -12.236 1.00 0.00 H new ATOM 0 HD21 LEU A 63 7.622 9.187 -9.403 1.00 0.00 H new ATOM 0 HD22 LEU A 63 8.813 8.033 -10.047 1.00 0.00 H new ATOM 0 HD23 LEU A 63 9.145 8.899 -8.529 1.00 0.00 H new ATOM 906 N ARG A 64 13.786 10.038 -11.737 1.00 0.00 N ATOM 907 CA ARG A 64 15.201 9.693 -11.644 1.00 0.00 C ATOM 908 C ARG A 64 16.088 10.930 -11.743 1.00 0.00 C ATOM 909 O ARG A 64 17.257 10.895 -11.357 1.00 0.00 O ATOM 910 CB ARG A 64 15.593 8.699 -12.741 1.00 0.00 C ATOM 911 CG ARG A 64 15.838 7.287 -12.231 1.00 0.00 C ATOM 912 CD ARG A 64 14.560 6.629 -11.741 1.00 0.00 C ATOM 913 NE ARG A 64 14.812 5.300 -11.179 1.00 0.00 N ATOM 914 CZ ARG A 64 14.244 4.177 -11.621 1.00 0.00 C ATOM 915 NH1 ARG A 64 13.417 4.205 -12.660 1.00 0.00 N ATOM 916 NH2 ARG A 64 14.514 3.019 -11.028 1.00 0.00 N ATOM 0 H ARG A 64 13.326 9.715 -12.588 1.00 0.00 H new ATOM 0 HA ARG A 64 15.354 9.233 -10.668 1.00 0.00 H new ATOM 0 HB2 ARG A 64 14.804 8.672 -13.493 1.00 0.00 H new ATOM 0 HB3 ARG A 64 16.495 9.057 -13.238 1.00 0.00 H new ATOM 0 HG2 ARG A 64 16.274 6.684 -13.028 1.00 0.00 H new ATOM 0 HG3 ARG A 64 16.565 7.316 -11.419 1.00 0.00 H new ATOM 0 HD2 ARG A 64 14.093 7.260 -10.985 1.00 0.00 H new ATOM 0 HD3 ARG A 64 13.854 6.546 -12.567 1.00 0.00 H new ATOM 0 HE ARG A 64 15.465 5.229 -10.398 1.00 0.00 H new ATOM 0 HH11 ARG A 64 13.213 5.089 -13.125 1.00 0.00 H new ATOM 0 HH12 ARG A 64 12.986 3.342 -12.992 1.00 0.00 H new ATOM 0 HH21 ARG A 64 15.155 2.989 -10.235 1.00 0.00 H new ATOM 0 HH22 ARG A 64 14.080 2.160 -11.365 1.00 0.00 H new ATOM 930 N ALA A 65 15.539 12.021 -12.258 1.00 0.00 N ATOM 931 CA ALA A 65 16.320 13.229 -12.451 1.00 0.00 C ATOM 932 C ALA A 65 16.049 14.262 -11.362 1.00 0.00 C ATOM 933 O ALA A 65 16.830 15.201 -11.184 1.00 0.00 O ATOM 934 CB ALA A 65 16.049 13.818 -13.826 1.00 0.00 C ATOM 0 H ALA A 65 14.563 12.092 -12.547 1.00 0.00 H new ATOM 0 HA ALA A 65 17.373 12.955 -12.383 1.00 0.00 H new ATOM 0 HB1 ALA A 65 16.641 14.724 -13.957 1.00 0.00 H new ATOM 0 HB2 ALA A 65 16.321 13.092 -14.593 1.00 0.00 H new ATOM 0 HB3 ALA A 65 14.990 14.061 -13.916 1.00 0.00 H new ATOM 940 N MET A 66 14.957 14.086 -10.620 1.00 0.00 N ATOM 941 CA MET A 66 14.606 15.025 -9.556 1.00 0.00 C ATOM 942 C MET A 66 15.551 14.861 -8.379 1.00 0.00 C ATOM 943 O MET A 66 15.798 15.799 -7.620 1.00 0.00 O ATOM 944 CB MET A 66 13.160 14.824 -9.104 1.00 0.00 C ATOM 945 CG MET A 66 12.138 15.368 -10.083 1.00 0.00 C ATOM 946 SD MET A 66 12.254 17.157 -10.294 1.00 0.00 S ATOM 947 CE MET A 66 11.859 17.727 -8.639 1.00 0.00 C ATOM 0 H MET A 66 14.305 13.310 -10.734 1.00 0.00 H new ATOM 0 HA MET A 66 14.702 16.037 -9.950 1.00 0.00 H new ATOM 0 HB2 MET A 66 12.979 13.759 -8.956 1.00 0.00 H new ATOM 0 HB3 MET A 66 13.019 15.308 -8.138 1.00 0.00 H new ATOM 0 HG2 MET A 66 12.274 14.883 -11.050 1.00 0.00 H new ATOM 0 HG3 MET A 66 11.137 15.112 -9.736 1.00 0.00 H new ATOM 0 HE1 MET A 66 11.154 18.556 -8.698 1.00 0.00 H new ATOM 0 HE2 MET A 66 11.413 16.911 -8.070 1.00 0.00 H new ATOM 0 HE3 MET A 66 12.770 18.061 -8.142 1.00 0.00 H new ATOM 957 N ASN A 67 16.075 13.654 -8.246 1.00 0.00 N ATOM 958 CA ASN A 67 17.065 13.339 -7.227 1.00 0.00 C ATOM 959 C ASN A 67 18.293 14.219 -7.425 1.00 0.00 C ATOM 960 O ASN A 67 18.760 14.889 -6.504 1.00 0.00 O ATOM 961 CB ASN A 67 17.465 11.868 -7.342 1.00 0.00 C ATOM 962 CG ASN A 67 16.266 10.963 -7.553 1.00 0.00 C ATOM 963 OD1 ASN A 67 15.202 11.161 -6.964 1.00 0.00 O ATOM 964 ND2 ASN A 67 16.414 9.995 -8.439 1.00 0.00 N ATOM 0 H ASN A 67 15.827 12.864 -8.841 1.00 0.00 H new ATOM 0 HA ASN A 67 16.642 13.523 -6.239 1.00 0.00 H new ATOM 0 HB2 ASN A 67 18.161 11.746 -8.172 1.00 0.00 H new ATOM 0 HB3 ASN A 67 17.992 11.565 -6.437 1.00 0.00 H new ATOM 0 HD21 ASN A 67 15.631 9.379 -8.657 1.00 0.00 H new ATOM 0 HD22 ASN A 67 17.311 9.863 -8.906 1.00 0.00 H new ATOM 971 N THR A 68 18.789 14.216 -8.655 1.00 0.00 N ATOM 972 CA THR A 68 19.928 15.030 -9.041 1.00 0.00 C ATOM 973 C THR A 68 19.599 16.514 -8.916 1.00 0.00 C ATOM 974 O THR A 68 20.428 17.307 -8.469 1.00 0.00 O ATOM 975 CB THR A 68 20.335 14.724 -10.492 1.00 0.00 C ATOM 976 OG1 THR A 68 20.343 13.306 -10.700 1.00 0.00 O ATOM 977 CG2 THR A 68 21.708 15.300 -10.807 1.00 0.00 C ATOM 0 H THR A 68 18.411 13.647 -9.413 1.00 0.00 H new ATOM 0 HA THR A 68 20.754 14.790 -8.372 1.00 0.00 H new ATOM 0 HB THR A 68 19.609 15.189 -11.159 1.00 0.00 H new ATOM 0 HG1 THR A 68 20.601 13.113 -11.625 1.00 0.00 H new ATOM 0 HG21 THR A 68 21.971 15.069 -11.839 1.00 0.00 H new ATOM 0 HG22 THR A 68 21.689 16.381 -10.670 1.00 0.00 H new ATOM 0 HG23 THR A 68 22.448 14.863 -10.137 1.00 0.00 H new ATOM 985 N ALA A 69 18.378 16.877 -9.302 1.00 0.00 N ATOM 986 CA ALA A 69 17.941 18.265 -9.253 1.00 0.00 C ATOM 987 C ALA A 69 18.026 18.815 -7.832 1.00 0.00 C ATOM 988 O ALA A 69 18.548 19.910 -7.615 1.00 0.00 O ATOM 989 CB ALA A 69 16.524 18.397 -9.795 1.00 0.00 C ATOM 0 H ALA A 69 17.675 16.226 -9.652 1.00 0.00 H new ATOM 0 HA ALA A 69 18.609 18.853 -9.882 1.00 0.00 H new ATOM 0 HB1 ALA A 69 16.213 19.441 -9.751 1.00 0.00 H new ATOM 0 HB2 ALA A 69 16.497 18.054 -10.829 1.00 0.00 H new ATOM 0 HB3 ALA A 69 15.846 17.791 -9.193 1.00 0.00 H new ATOM 995 N MET A 70 17.527 18.045 -6.866 1.00 0.00 N ATOM 996 CA MET A 70 17.603 18.441 -5.463 1.00 0.00 C ATOM 997 C MET A 70 19.057 18.507 -5.023 1.00 0.00 C ATOM 998 O MET A 70 19.496 19.483 -4.415 1.00 0.00 O ATOM 999 CB MET A 70 16.867 17.441 -4.570 1.00 0.00 C ATOM 1000 CG MET A 70 16.908 17.815 -3.096 1.00 0.00 C ATOM 1001 SD MET A 70 16.768 16.394 -1.994 1.00 0.00 S ATOM 1002 CE MET A 70 15.137 15.779 -2.403 1.00 0.00 C ATOM 0 H MET A 70 17.068 17.149 -7.029 1.00 0.00 H new ATOM 0 HA MET A 70 17.133 19.420 -5.365 1.00 0.00 H new ATOM 0 HB2 MET A 70 15.828 17.371 -4.892 1.00 0.00 H new ATOM 0 HB3 MET A 70 17.308 16.453 -4.700 1.00 0.00 H new ATOM 0 HG2 MET A 70 17.842 18.337 -2.887 1.00 0.00 H new ATOM 0 HG3 MET A 70 16.098 18.512 -2.883 1.00 0.00 H new ATOM 0 HE1 MET A 70 14.903 14.922 -1.772 1.00 0.00 H new ATOM 0 HE2 MET A 70 14.400 16.564 -2.237 1.00 0.00 H new ATOM 0 HE3 MET A 70 15.114 15.476 -3.450 1.00 0.00 H new ATOM 1012 N ALA A 71 19.793 17.453 -5.350 1.00 0.00 N ATOM 1013 CA ALA A 71 21.184 17.313 -4.944 1.00 0.00 C ATOM 1014 C ALA A 71 22.030 18.504 -5.382 1.00 0.00 C ATOM 1015 O ALA A 71 22.861 18.993 -4.622 1.00 0.00 O ATOM 1016 CB ALA A 71 21.760 16.027 -5.509 1.00 0.00 C ATOM 0 H ALA A 71 19.442 16.672 -5.904 1.00 0.00 H new ATOM 0 HA ALA A 71 21.209 17.278 -3.855 1.00 0.00 H new ATOM 0 HB1 ALA A 71 22.801 15.929 -5.201 1.00 0.00 H new ATOM 0 HB2 ALA A 71 21.189 15.177 -5.135 1.00 0.00 H new ATOM 0 HB3 ALA A 71 21.704 16.051 -6.597 1.00 0.00 H new ATOM 1022 N ALA A 72 21.807 18.971 -6.606 1.00 0.00 N ATOM 1023 CA ALA A 72 22.564 20.096 -7.143 1.00 0.00 C ATOM 1024 C ALA A 72 22.279 21.377 -6.363 1.00 0.00 C ATOM 1025 O ALA A 72 23.159 22.220 -6.195 1.00 0.00 O ATOM 1026 CB ALA A 72 22.252 20.291 -8.618 1.00 0.00 C ATOM 0 H ALA A 72 21.109 18.588 -7.244 1.00 0.00 H new ATOM 0 HA ALA A 72 23.625 19.868 -7.037 1.00 0.00 H new ATOM 0 HB1 ALA A 72 22.825 21.134 -9.003 1.00 0.00 H new ATOM 0 HB2 ALA A 72 22.519 19.389 -9.169 1.00 0.00 H new ATOM 0 HB3 ALA A 72 21.187 20.489 -8.742 1.00 0.00 H new ATOM 1032 N GLU A 73 21.052 21.511 -5.876 1.00 0.00 N ATOM 1033 CA GLU A 73 20.669 22.679 -5.093 1.00 0.00 C ATOM 1034 C GLU A 73 21.293 22.600 -3.700 1.00 0.00 C ATOM 1035 O GLU A 73 21.805 23.587 -3.175 1.00 0.00 O ATOM 1036 CB GLU A 73 19.145 22.774 -4.970 1.00 0.00 C ATOM 1037 CG GLU A 73 18.404 22.791 -6.299 1.00 0.00 C ATOM 1038 CD GLU A 73 18.658 24.041 -7.118 1.00 0.00 C ATOM 1039 OE1 GLU A 73 19.674 24.093 -7.838 1.00 0.00 O ATOM 1040 OE2 GLU A 73 17.820 24.966 -7.077 1.00 0.00 O ATOM 0 H GLU A 73 20.307 20.827 -6.009 1.00 0.00 H new ATOM 0 HA GLU A 73 21.034 23.570 -5.605 1.00 0.00 H new ATOM 0 HB2 GLU A 73 18.788 21.930 -4.380 1.00 0.00 H new ATOM 0 HB3 GLU A 73 18.894 23.679 -4.417 1.00 0.00 H new ATOM 0 HG2 GLU A 73 18.699 21.918 -6.882 1.00 0.00 H new ATOM 0 HG3 GLU A 73 17.334 22.701 -6.110 1.00 0.00 H new ATOM 1047 N VAL A 74 21.259 21.405 -3.116 1.00 0.00 N ATOM 1048 CA VAL A 74 21.797 21.184 -1.776 1.00 0.00 C ATOM 1049 C VAL A 74 23.326 21.250 -1.783 1.00 0.00 C ATOM 1050 O VAL A 74 23.949 21.627 -0.790 1.00 0.00 O ATOM 1051 CB VAL A 74 21.340 19.822 -1.199 1.00 0.00 C ATOM 1052 CG1 VAL A 74 21.850 19.631 0.223 1.00 0.00 C ATOM 1053 CG2 VAL A 74 19.823 19.710 -1.232 1.00 0.00 C ATOM 0 H VAL A 74 20.863 20.572 -3.551 1.00 0.00 H new ATOM 0 HA VAL A 74 21.408 21.979 -1.139 1.00 0.00 H new ATOM 0 HB VAL A 74 21.764 19.035 -1.823 1.00 0.00 H new ATOM 0 HG11 VAL A 74 21.514 18.666 0.603 1.00 0.00 H new ATOM 0 HG12 VAL A 74 22.940 19.663 0.226 1.00 0.00 H new ATOM 0 HG13 VAL A 74 21.462 20.427 0.859 1.00 0.00 H new ATOM 0 HG21 VAL A 74 19.520 18.746 -0.823 1.00 0.00 H new ATOM 0 HG22 VAL A 74 19.386 20.511 -0.636 1.00 0.00 H new ATOM 0 HG23 VAL A 74 19.474 19.792 -2.261 1.00 0.00 H new ATOM 1063 N ALA A 75 23.926 20.895 -2.913 1.00 0.00 N ATOM 1064 CA ALA A 75 25.377 20.933 -3.056 1.00 0.00 C ATOM 1065 C ALA A 75 25.916 22.343 -2.833 1.00 0.00 C ATOM 1066 O ALA A 75 27.024 22.515 -2.329 1.00 0.00 O ATOM 1067 CB ALA A 75 25.789 20.412 -4.425 1.00 0.00 C ATOM 0 H ALA A 75 23.429 20.577 -3.745 1.00 0.00 H new ATOM 0 HA ALA A 75 25.809 20.286 -2.293 1.00 0.00 H new ATOM 0 HB1 ALA A 75 26.875 20.447 -4.516 1.00 0.00 H new ATOM 0 HB2 ALA A 75 25.448 19.383 -4.540 1.00 0.00 H new ATOM 0 HB3 ALA A 75 25.340 21.032 -5.201 1.00 0.00 H new ATOM 1073 N GLU A 76 25.114 23.343 -3.187 1.00 0.00 N ATOM 1074 CA GLU A 76 25.501 24.740 -3.025 1.00 0.00 C ATOM 1075 C GLU A 76 25.764 25.075 -1.561 1.00 0.00 C ATOM 1076 O GLU A 76 26.838 25.564 -1.207 1.00 0.00 O ATOM 1077 CB GLU A 76 24.415 25.662 -3.583 1.00 0.00 C ATOM 1078 CG GLU A 76 24.276 25.599 -5.094 1.00 0.00 C ATOM 1079 CD GLU A 76 25.538 26.035 -5.806 1.00 0.00 C ATOM 1080 OE1 GLU A 76 25.791 27.252 -5.890 1.00 0.00 O ATOM 1081 OE2 GLU A 76 26.284 25.162 -6.291 1.00 0.00 O ATOM 0 H GLU A 76 24.187 23.210 -3.590 1.00 0.00 H new ATOM 0 HA GLU A 76 26.425 24.896 -3.582 1.00 0.00 H new ATOM 0 HB2 GLU A 76 23.460 25.400 -3.128 1.00 0.00 H new ATOM 0 HB3 GLU A 76 24.637 26.688 -3.290 1.00 0.00 H new ATOM 0 HG2 GLU A 76 24.027 24.580 -5.391 1.00 0.00 H new ATOM 0 HG3 GLU A 76 23.447 26.234 -5.407 1.00 0.00 H new ATOM 1088 N VAL A 77 24.788 24.788 -0.704 1.00 0.00 N ATOM 1089 CA VAL A 77 24.918 25.103 0.712 1.00 0.00 C ATOM 1090 C VAL A 77 25.994 24.243 1.366 1.00 0.00 C ATOM 1091 O VAL A 77 26.651 24.673 2.305 1.00 0.00 O ATOM 1092 CB VAL A 77 23.584 24.951 1.484 1.00 0.00 C ATOM 1093 CG1 VAL A 77 22.538 25.902 0.932 1.00 0.00 C ATOM 1094 CG2 VAL A 77 23.075 23.519 1.447 1.00 0.00 C ATOM 0 H VAL A 77 23.908 24.342 -0.963 1.00 0.00 H new ATOM 0 HA VAL A 77 25.210 26.152 0.766 1.00 0.00 H new ATOM 0 HB VAL A 77 23.775 25.206 2.526 1.00 0.00 H new ATOM 0 HG11 VAL A 77 21.607 25.781 1.487 1.00 0.00 H new ATOM 0 HG12 VAL A 77 22.890 26.929 1.033 1.00 0.00 H new ATOM 0 HG13 VAL A 77 22.364 25.680 -0.121 1.00 0.00 H new ATOM 0 HG21 VAL A 77 22.138 23.452 1.999 1.00 0.00 H new ATOM 0 HG22 VAL A 77 22.909 23.218 0.412 1.00 0.00 H new ATOM 0 HG23 VAL A 77 23.813 22.859 1.903 1.00 0.00 H new ATOM 1104 N VAL A 78 26.192 23.038 0.854 1.00 0.00 N ATOM 1105 CA VAL A 78 27.215 22.156 1.394 1.00 0.00 C ATOM 1106 C VAL A 78 28.612 22.648 1.014 1.00 0.00 C ATOM 1107 O VAL A 78 29.512 22.685 1.853 1.00 0.00 O ATOM 1108 CB VAL A 78 27.021 20.699 0.923 1.00 0.00 C ATOM 1109 CG1 VAL A 78 28.178 19.823 1.376 1.00 0.00 C ATOM 1110 CG2 VAL A 78 25.707 20.139 1.448 1.00 0.00 C ATOM 0 H VAL A 78 25.663 22.651 0.072 1.00 0.00 H new ATOM 0 HA VAL A 78 27.116 22.175 2.479 1.00 0.00 H new ATOM 0 HB VAL A 78 26.994 20.699 -0.167 1.00 0.00 H new ATOM 0 HG11 VAL A 78 28.017 18.801 1.032 1.00 0.00 H new ATOM 0 HG12 VAL A 78 29.109 20.205 0.957 1.00 0.00 H new ATOM 0 HG13 VAL A 78 28.238 19.834 2.464 1.00 0.00 H new ATOM 0 HG21 VAL A 78 25.587 19.111 1.106 1.00 0.00 H new ATOM 0 HG22 VAL A 78 25.712 20.161 2.538 1.00 0.00 H new ATOM 0 HG23 VAL A 78 24.880 20.744 1.077 1.00 0.00 H new ATOM 1120 N ALA A 79 28.778 23.055 -0.242 1.00 0.00 N ATOM 1121 CA ALA A 79 30.068 23.526 -0.738 1.00 0.00 C ATOM 1122 C ALA A 79 30.540 24.788 -0.014 1.00 0.00 C ATOM 1123 O ALA A 79 31.733 25.087 0.005 1.00 0.00 O ATOM 1124 CB ALA A 79 29.989 23.783 -2.236 1.00 0.00 C ATOM 0 H ALA A 79 28.032 23.068 -0.937 1.00 0.00 H new ATOM 0 HA ALA A 79 30.799 22.743 -0.538 1.00 0.00 H new ATOM 0 HB1 ALA A 79 30.956 24.134 -2.596 1.00 0.00 H new ATOM 0 HB2 ALA A 79 29.724 22.859 -2.750 1.00 0.00 H new ATOM 0 HB3 ALA A 79 29.231 24.540 -2.436 1.00 0.00 H new ATOM 1130 N THR A 80 29.608 25.523 0.585 1.00 0.00 N ATOM 1131 CA THR A 80 29.943 26.769 1.266 1.00 0.00 C ATOM 1132 C THR A 80 30.533 26.498 2.656 1.00 0.00 C ATOM 1133 O THR A 80 30.994 27.416 3.339 1.00 0.00 O ATOM 1134 CB THR A 80 28.700 27.687 1.384 1.00 0.00 C ATOM 1135 OG1 THR A 80 29.094 29.063 1.352 1.00 0.00 O ATOM 1136 CG2 THR A 80 27.929 27.428 2.668 1.00 0.00 C ATOM 0 H THR A 80 28.618 25.278 0.613 1.00 0.00 H new ATOM 0 HA THR A 80 30.696 27.279 0.666 1.00 0.00 H new ATOM 0 HB THR A 80 28.053 27.462 0.536 1.00 0.00 H new ATOM 0 HG1 THR A 80 28.300 29.632 1.426 1.00 0.00 H new ATOM 0 HG21 THR A 80 27.065 28.091 2.714 1.00 0.00 H new ATOM 0 HG22 THR A 80 27.592 26.391 2.688 1.00 0.00 H new ATOM 0 HG23 THR A 80 28.576 27.616 3.525 1.00 0.00 H new ATOM 1144 N SER A 81 30.531 25.233 3.059 1.00 0.00 N ATOM 1145 CA SER A 81 31.000 24.854 4.381 1.00 0.00 C ATOM 1146 C SER A 81 32.492 24.523 4.356 1.00 0.00 C ATOM 1147 O SER A 81 32.949 23.750 3.512 1.00 0.00 O ATOM 1148 CB SER A 81 30.206 23.647 4.883 1.00 0.00 C ATOM 1149 OG SER A 81 28.811 23.878 4.774 1.00 0.00 O ATOM 0 H SER A 81 30.209 24.453 2.486 1.00 0.00 H new ATOM 0 HA SER A 81 30.848 25.696 5.057 1.00 0.00 H new ATOM 0 HB2 SER A 81 30.478 22.763 4.307 1.00 0.00 H new ATOM 0 HB3 SER A 81 30.465 23.443 5.922 1.00 0.00 H new ATOM 0 HG SER A 81 28.336 23.021 4.787 1.00 0.00 H new ATOM 1155 N PRO A 82 33.275 25.128 5.263 1.00 0.00 N ATOM 1156 CA PRO A 82 34.691 24.789 5.434 1.00 0.00 C ATOM 1157 C PRO A 82 34.862 23.352 5.925 1.00 0.00 C ATOM 1158 O PRO A 82 33.998 22.833 6.635 1.00 0.00 O ATOM 1159 CB PRO A 82 35.183 25.779 6.501 1.00 0.00 C ATOM 1160 CG PRO A 82 34.154 26.856 6.547 1.00 0.00 C ATOM 1161 CD PRO A 82 32.855 26.202 6.176 1.00 0.00 C ATOM 0 HA PRO A 82 35.246 24.856 4.499 1.00 0.00 H new ATOM 0 HB2 PRO A 82 35.286 25.292 7.471 1.00 0.00 H new ATOM 0 HB3 PRO A 82 36.162 26.182 6.241 1.00 0.00 H new ATOM 0 HG2 PRO A 82 34.098 27.300 7.541 1.00 0.00 H new ATOM 0 HG3 PRO A 82 34.399 27.660 5.852 1.00 0.00 H new ATOM 0 HD2 PRO A 82 32.337 25.809 7.051 1.00 0.00 H new ATOM 0 HD3 PRO A 82 32.175 26.902 5.690 1.00 0.00 H new ATOM 1169 N PRO A 83 35.983 22.697 5.568 1.00 0.00 N ATOM 1170 CA PRO A 83 36.239 21.290 5.918 1.00 0.00 C ATOM 1171 C PRO A 83 36.115 21.023 7.418 1.00 0.00 C ATOM 1172 O PRO A 83 35.742 19.927 7.830 1.00 0.00 O ATOM 1173 CB PRO A 83 37.682 21.047 5.447 1.00 0.00 C ATOM 1174 CG PRO A 83 38.252 22.402 5.186 1.00 0.00 C ATOM 1175 CD PRO A 83 37.092 23.268 4.790 1.00 0.00 C ATOM 0 HA PRO A 83 35.511 20.626 5.452 1.00 0.00 H new ATOM 0 HB2 PRO A 83 38.259 20.519 6.206 1.00 0.00 H new ATOM 0 HB3 PRO A 83 37.702 20.433 4.547 1.00 0.00 H new ATOM 0 HG2 PRO A 83 38.747 22.795 6.074 1.00 0.00 H new ATOM 0 HG3 PRO A 83 39.000 22.365 4.394 1.00 0.00 H new ATOM 0 HD2 PRO A 83 37.265 24.315 5.039 1.00 0.00 H new ATOM 0 HD3 PRO A 83 36.900 23.223 3.718 1.00 0.00 H new ATOM 1183 N GLN A 84 36.399 22.046 8.216 1.00 0.00 N ATOM 1184 CA GLN A 84 36.360 21.941 9.673 1.00 0.00 C ATOM 1185 C GLN A 84 34.962 21.578 10.180 1.00 0.00 C ATOM 1186 O GLN A 84 34.819 20.949 11.229 1.00 0.00 O ATOM 1187 CB GLN A 84 36.815 23.264 10.292 1.00 0.00 C ATOM 1188 CG GLN A 84 38.246 23.638 9.938 1.00 0.00 C ATOM 1189 CD GLN A 84 38.617 25.040 10.376 1.00 0.00 C ATOM 1190 OE1 GLN A 84 38.086 25.564 11.356 1.00 0.00 O ATOM 1191 NE2 GLN A 84 39.530 25.661 9.646 1.00 0.00 N ATOM 0 H GLN A 84 36.662 22.970 7.874 1.00 0.00 H new ATOM 0 HA GLN A 84 37.035 21.139 9.972 1.00 0.00 H new ATOM 0 HB2 GLN A 84 36.147 24.060 9.961 1.00 0.00 H new ATOM 0 HB3 GLN A 84 36.722 23.200 11.376 1.00 0.00 H new ATOM 0 HG2 GLN A 84 38.928 22.926 10.403 1.00 0.00 H new ATOM 0 HG3 GLN A 84 38.382 23.552 8.860 1.00 0.00 H new ATOM 0 HE21 GLN A 84 39.946 25.191 8.842 1.00 0.00 H new ATOM 0 HE22 GLN A 84 39.818 26.609 9.888 1.00 0.00 H new ATOM 1200 N SER A 85 33.935 21.969 9.436 1.00 0.00 N ATOM 1201 CA SER A 85 32.561 21.702 9.839 1.00 0.00 C ATOM 1202 C SER A 85 31.828 20.894 8.768 1.00 0.00 C ATOM 1203 O SER A 85 30.668 20.518 8.942 1.00 0.00 O ATOM 1204 CB SER A 85 31.827 23.023 10.085 1.00 0.00 C ATOM 1205 OG SER A 85 32.581 23.876 10.930 1.00 0.00 O ATOM 0 H SER A 85 34.027 22.471 8.553 1.00 0.00 H new ATOM 0 HA SER A 85 32.579 21.119 10.760 1.00 0.00 H new ATOM 0 HB2 SER A 85 31.640 23.521 9.134 1.00 0.00 H new ATOM 0 HB3 SER A 85 30.855 22.824 10.537 1.00 0.00 H new ATOM 0 HG SER A 85 32.092 24.713 11.070 1.00 0.00 H new ATOM 1211 N TYR A 86 32.528 20.609 7.675 1.00 0.00 N ATOM 1212 CA TYR A 86 31.928 19.969 6.508 1.00 0.00 C ATOM 1213 C TYR A 86 31.391 18.578 6.850 1.00 0.00 C ATOM 1214 O TYR A 86 30.268 18.228 6.478 1.00 0.00 O ATOM 1215 CB TYR A 86 32.964 19.880 5.382 1.00 0.00 C ATOM 1216 CG TYR A 86 32.406 19.411 4.060 1.00 0.00 C ATOM 1217 CD1 TYR A 86 32.188 18.064 3.820 1.00 0.00 C ATOM 1218 CD2 TYR A 86 32.103 20.315 3.049 1.00 0.00 C ATOM 1219 CE1 TYR A 86 31.678 17.628 2.614 1.00 0.00 C ATOM 1220 CE2 TYR A 86 31.590 19.886 1.840 1.00 0.00 C ATOM 1221 CZ TYR A 86 31.382 18.540 1.629 1.00 0.00 C ATOM 1222 OH TYR A 86 30.861 18.103 0.432 1.00 0.00 O ATOM 0 H TYR A 86 33.522 20.813 7.572 1.00 0.00 H new ATOM 0 HA TYR A 86 31.085 20.575 6.178 1.00 0.00 H new ATOM 0 HB2 TYR A 86 33.418 20.861 5.244 1.00 0.00 H new ATOM 0 HB3 TYR A 86 33.759 19.201 5.689 1.00 0.00 H new ATOM 0 HD1 TYR A 86 32.421 17.343 4.590 1.00 0.00 H new ATOM 0 HD2 TYR A 86 32.271 21.369 3.211 1.00 0.00 H new ATOM 0 HE1 TYR A 86 31.512 16.574 2.445 1.00 0.00 H new ATOM 0 HE2 TYR A 86 31.354 20.601 1.065 1.00 0.00 H new ATOM 0 HH TYR A 86 30.472 18.861 -0.052 1.00 0.00 H new ATOM 1232 N SER A 87 32.194 17.796 7.561 1.00 0.00 N ATOM 1233 CA SER A 87 31.820 16.438 7.942 1.00 0.00 C ATOM 1234 C SER A 87 30.563 16.426 8.820 1.00 0.00 C ATOM 1235 O SER A 87 29.780 15.476 8.790 1.00 0.00 O ATOM 1236 CB SER A 87 32.984 15.785 8.678 1.00 0.00 C ATOM 1237 OG SER A 87 34.206 16.070 8.017 1.00 0.00 O ATOM 0 H SER A 87 33.117 18.082 7.888 1.00 0.00 H new ATOM 0 HA SER A 87 31.592 15.875 7.037 1.00 0.00 H new ATOM 0 HB2 SER A 87 33.024 16.149 9.705 1.00 0.00 H new ATOM 0 HB3 SER A 87 32.833 14.707 8.728 1.00 0.00 H new ATOM 0 HG SER A 87 34.599 15.237 7.683 1.00 0.00 H new ATOM 1243 N ALA A 88 30.366 17.495 9.584 1.00 0.00 N ATOM 1244 CA ALA A 88 29.198 17.604 10.448 1.00 0.00 C ATOM 1245 C ALA A 88 27.958 17.879 9.609 1.00 0.00 C ATOM 1246 O ALA A 88 26.873 17.368 9.888 1.00 0.00 O ATOM 1247 CB ALA A 88 29.402 18.697 11.491 1.00 0.00 C ATOM 0 H ALA A 88 30.998 18.295 9.622 1.00 0.00 H new ATOM 0 HA ALA A 88 29.059 16.660 10.976 1.00 0.00 H new ATOM 0 HB1 ALA A 88 28.519 18.763 12.126 1.00 0.00 H new ATOM 0 HB2 ALA A 88 30.272 18.458 12.103 1.00 0.00 H new ATOM 0 HB3 ALA A 88 29.561 19.652 10.991 1.00 0.00 H new ATOM 1253 N VAL A 89 28.142 18.668 8.559 1.00 0.00 N ATOM 1254 CA VAL A 89 27.067 18.984 7.631 1.00 0.00 C ATOM 1255 C VAL A 89 26.686 17.739 6.834 1.00 0.00 C ATOM 1256 O VAL A 89 25.516 17.515 6.523 1.00 0.00 O ATOM 1257 CB VAL A 89 27.485 20.118 6.665 1.00 0.00 C ATOM 1258 CG1 VAL A 89 26.371 20.443 5.683 1.00 0.00 C ATOM 1259 CG2 VAL A 89 27.890 21.360 7.442 1.00 0.00 C ATOM 0 H VAL A 89 29.035 19.104 8.328 1.00 0.00 H new ATOM 0 HA VAL A 89 26.206 19.324 8.207 1.00 0.00 H new ATOM 0 HB VAL A 89 28.345 19.770 6.093 1.00 0.00 H new ATOM 0 HG11 VAL A 89 26.695 21.243 5.018 1.00 0.00 H new ATOM 0 HG12 VAL A 89 26.134 19.556 5.095 1.00 0.00 H new ATOM 0 HG13 VAL A 89 25.485 20.763 6.231 1.00 0.00 H new ATOM 0 HG21 VAL A 89 28.181 22.146 6.745 1.00 0.00 H new ATOM 0 HG22 VAL A 89 27.049 21.702 8.045 1.00 0.00 H new ATOM 0 HG23 VAL A 89 28.731 21.123 8.094 1.00 0.00 H new ATOM 1269 N LEU A 90 27.695 16.928 6.524 1.00 0.00 N ATOM 1270 CA LEU A 90 27.502 15.665 5.831 1.00 0.00 C ATOM 1271 C LEU A 90 26.459 14.817 6.546 1.00 0.00 C ATOM 1272 O LEU A 90 25.433 14.450 5.967 1.00 0.00 O ATOM 1273 CB LEU A 90 28.828 14.901 5.816 1.00 0.00 C ATOM 1274 CG LEU A 90 29.180 14.161 4.529 1.00 0.00 C ATOM 1275 CD1 LEU A 90 28.007 13.351 3.995 1.00 0.00 C ATOM 1276 CD2 LEU A 90 29.686 15.139 3.493 1.00 0.00 C ATOM 0 H LEU A 90 28.669 17.132 6.748 1.00 0.00 H new ATOM 0 HA LEU A 90 27.161 15.868 4.816 1.00 0.00 H new ATOM 0 HB2 LEU A 90 29.630 15.607 6.032 1.00 0.00 H new ATOM 0 HB3 LEU A 90 28.813 14.177 6.631 1.00 0.00 H new ATOM 0 HG LEU A 90 29.972 13.448 4.758 1.00 0.00 H new ATOM 0 HD11 LEU A 90 28.304 12.842 3.078 1.00 0.00 H new ATOM 0 HD12 LEU A 90 27.706 12.613 4.739 1.00 0.00 H new ATOM 0 HD13 LEU A 90 27.170 14.017 3.785 1.00 0.00 H new ATOM 0 HD21 LEU A 90 29.935 14.603 2.577 1.00 0.00 H new ATOM 0 HD22 LEU A 90 28.913 15.878 3.282 1.00 0.00 H new ATOM 0 HD23 LEU A 90 30.575 15.643 3.872 1.00 0.00 H new ATOM 1288 N ASN A 91 26.732 14.533 7.812 1.00 0.00 N ATOM 1289 CA ASN A 91 25.891 13.642 8.604 1.00 0.00 C ATOM 1290 C ASN A 91 24.520 14.252 8.844 1.00 0.00 C ATOM 1291 O ASN A 91 23.513 13.547 8.850 1.00 0.00 O ATOM 1292 CB ASN A 91 26.564 13.313 9.940 1.00 0.00 C ATOM 1293 CG ASN A 91 27.797 12.443 9.775 1.00 0.00 C ATOM 1294 OD1 ASN A 91 27.873 11.614 8.867 1.00 0.00 O ATOM 1295 ND2 ASN A 91 28.775 12.630 10.647 1.00 0.00 N ATOM 0 H ASN A 91 27.535 14.909 8.317 1.00 0.00 H new ATOM 0 HA ASN A 91 25.759 12.719 8.040 1.00 0.00 H new ATOM 0 HB2 ASN A 91 26.843 14.241 10.440 1.00 0.00 H new ATOM 0 HB3 ASN A 91 25.849 12.804 10.587 1.00 0.00 H new ATOM 0 HD21 ASN A 91 29.630 12.077 10.581 1.00 0.00 H new ATOM 0 HD22 ASN A 91 28.674 13.327 11.385 1.00 0.00 H new ATOM 1302 N THR A 92 24.484 15.566 9.029 1.00 0.00 N ATOM 1303 CA THR A 92 23.229 16.273 9.238 1.00 0.00 C ATOM 1304 C THR A 92 22.305 16.097 8.033 1.00 0.00 C ATOM 1305 O THR A 92 21.147 15.702 8.176 1.00 0.00 O ATOM 1306 CB THR A 92 23.475 17.777 9.492 1.00 0.00 C ATOM 1307 OG1 THR A 92 24.350 17.948 10.615 1.00 0.00 O ATOM 1308 CG2 THR A 92 22.168 18.511 9.752 1.00 0.00 C ATOM 0 H THR A 92 25.311 16.163 9.038 1.00 0.00 H new ATOM 0 HA THR A 92 22.750 15.845 10.119 1.00 0.00 H new ATOM 0 HB THR A 92 23.937 18.198 8.599 1.00 0.00 H new ATOM 0 HG1 THR A 92 25.281 17.908 10.313 1.00 0.00 H new ATOM 0 HG21 THR A 92 22.373 19.567 9.927 1.00 0.00 H new ATOM 0 HG22 THR A 92 21.514 18.407 8.886 1.00 0.00 H new ATOM 0 HG23 THR A 92 21.680 18.085 10.629 1.00 0.00 H new ATOM 1316 N ILE A 93 22.834 16.370 6.844 1.00 0.00 N ATOM 1317 CA ILE A 93 22.073 16.223 5.606 1.00 0.00 C ATOM 1318 C ILE A 93 21.547 14.799 5.449 1.00 0.00 C ATOM 1319 O ILE A 93 20.359 14.587 5.192 1.00 0.00 O ATOM 1320 CB ILE A 93 22.940 16.594 4.379 1.00 0.00 C ATOM 1321 CG1 ILE A 93 23.335 18.075 4.431 1.00 0.00 C ATOM 1322 CG2 ILE A 93 22.218 16.281 3.075 1.00 0.00 C ATOM 1323 CD1 ILE A 93 22.154 19.024 4.445 1.00 0.00 C ATOM 0 H ILE A 93 23.791 16.696 6.711 1.00 0.00 H new ATOM 0 HA ILE A 93 21.225 16.905 5.661 1.00 0.00 H new ATOM 0 HB ILE A 93 23.845 15.988 4.413 1.00 0.00 H new ATOM 0 HG12 ILE A 93 23.939 18.249 5.321 1.00 0.00 H new ATOM 0 HG13 ILE A 93 23.963 18.304 3.570 1.00 0.00 H new ATOM 0 HG21 ILE A 93 22.854 16.553 2.233 1.00 0.00 H new ATOM 0 HG22 ILE A 93 21.993 15.215 3.030 1.00 0.00 H new ATOM 0 HG23 ILE A 93 21.290 16.850 3.027 1.00 0.00 H new ATOM 0 HD11 ILE A 93 22.514 20.052 4.482 1.00 0.00 H new ATOM 0 HD12 ILE A 93 21.561 18.880 3.542 1.00 0.00 H new ATOM 0 HD13 ILE A 93 21.537 18.824 5.321 1.00 0.00 H new ATOM 1335 N GLY A 94 22.437 13.832 5.623 1.00 0.00 N ATOM 1336 CA GLY A 94 22.069 12.437 5.461 1.00 0.00 C ATOM 1337 C GLY A 94 21.017 11.984 6.450 1.00 0.00 C ATOM 1338 O GLY A 94 20.044 11.324 6.078 1.00 0.00 O ATOM 0 H GLY A 94 23.413 13.989 5.875 1.00 0.00 H new ATOM 0 HA2 GLY A 94 21.699 12.280 4.448 1.00 0.00 H new ATOM 0 HA3 GLY A 94 22.958 11.817 5.575 1.00 0.00 H new ATOM 1342 N ALA A 95 21.197 12.359 7.703 1.00 0.00 N ATOM 1343 CA ALA A 95 20.296 11.938 8.768 1.00 0.00 C ATOM 1344 C ALA A 95 18.914 12.546 8.587 1.00 0.00 C ATOM 1345 O ALA A 95 17.910 11.835 8.590 1.00 0.00 O ATOM 1346 CB ALA A 95 20.856 12.317 10.129 1.00 0.00 C ATOM 0 H ALA A 95 21.963 12.958 8.013 1.00 0.00 H new ATOM 0 HA ALA A 95 20.206 10.853 8.715 1.00 0.00 H new ATOM 0 HB1 ALA A 95 20.167 11.993 10.909 1.00 0.00 H new ATOM 0 HB2 ALA A 95 21.821 11.832 10.273 1.00 0.00 H new ATOM 0 HB3 ALA A 95 20.982 13.398 10.182 1.00 0.00 H new ATOM 1352 N CYS A 96 18.869 13.861 8.413 1.00 0.00 N ATOM 1353 CA CYS A 96 17.605 14.580 8.308 1.00 0.00 C ATOM 1354 C CYS A 96 16.770 14.092 7.128 1.00 0.00 C ATOM 1355 O CYS A 96 15.549 13.985 7.232 1.00 0.00 O ATOM 1356 CB CYS A 96 17.855 16.083 8.186 1.00 0.00 C ATOM 1357 SG CYS A 96 18.640 16.824 9.655 1.00 0.00 S ATOM 0 H CYS A 96 19.696 14.453 8.341 1.00 0.00 H new ATOM 0 HA CYS A 96 17.041 14.381 9.219 1.00 0.00 H new ATOM 0 HB2 CYS A 96 18.487 16.267 7.317 1.00 0.00 H new ATOM 0 HB3 CYS A 96 16.905 16.585 8.001 1.00 0.00 H new ATOM 1362 N LEU A 97 17.427 13.783 6.013 1.00 0.00 N ATOM 1363 CA LEU A 97 16.724 13.344 4.812 1.00 0.00 C ATOM 1364 C LEU A 97 16.200 11.919 4.992 1.00 0.00 C ATOM 1365 O LEU A 97 15.084 11.602 4.586 1.00 0.00 O ATOM 1366 CB LEU A 97 17.651 13.438 3.594 1.00 0.00 C ATOM 1367 CG LEU A 97 16.949 13.458 2.229 1.00 0.00 C ATOM 1368 CD1 LEU A 97 17.818 14.167 1.205 1.00 0.00 C ATOM 1369 CD2 LEU A 97 16.641 12.045 1.756 1.00 0.00 C ATOM 0 H LEU A 97 18.441 13.828 5.917 1.00 0.00 H new ATOM 0 HA LEU A 97 15.869 13.999 4.644 1.00 0.00 H new ATOM 0 HB2 LEU A 97 18.253 14.342 3.687 1.00 0.00 H new ATOM 0 HB3 LEU A 97 18.339 12.593 3.617 1.00 0.00 H new ATOM 0 HG LEU A 97 16.008 13.998 2.338 1.00 0.00 H new ATOM 0 HD11 LEU A 97 17.310 14.175 0.240 1.00 0.00 H new ATOM 0 HD12 LEU A 97 17.999 15.192 1.529 1.00 0.00 H new ATOM 0 HD13 LEU A 97 18.769 13.643 1.110 1.00 0.00 H new ATOM 0 HD21 LEU A 97 16.144 12.086 0.787 1.00 0.00 H new ATOM 0 HD22 LEU A 97 17.570 11.482 1.664 1.00 0.00 H new ATOM 0 HD23 LEU A 97 15.989 11.554 2.478 1.00 0.00 H new ATOM 1381 N ARG A 98 17.001 11.074 5.631 1.00 0.00 N ATOM 1382 CA ARG A 98 16.642 9.682 5.844 1.00 0.00 C ATOM 1383 C ARG A 98 15.414 9.561 6.752 1.00 0.00 C ATOM 1384 O ARG A 98 14.573 8.678 6.569 1.00 0.00 O ATOM 1385 CB ARG A 98 17.847 8.949 6.437 1.00 0.00 C ATOM 1386 CG ARG A 98 17.540 7.572 6.985 1.00 0.00 C ATOM 1387 CD ARG A 98 17.910 7.500 8.454 1.00 0.00 C ATOM 1388 NE ARG A 98 19.342 7.705 8.672 1.00 0.00 N ATOM 1389 CZ ARG A 98 19.862 8.206 9.793 1.00 0.00 C ATOM 1390 NH1 ARG A 98 19.068 8.581 10.791 1.00 0.00 N ATOM 1391 NH2 ARG A 98 21.179 8.343 9.915 1.00 0.00 N ATOM 0 H ARG A 98 17.910 11.334 6.012 1.00 0.00 H new ATOM 0 HA ARG A 98 16.376 9.225 4.891 1.00 0.00 H new ATOM 0 HB2 ARG A 98 18.614 8.857 5.668 1.00 0.00 H new ATOM 0 HB3 ARG A 98 18.269 9.558 7.237 1.00 0.00 H new ATOM 0 HG2 ARG A 98 16.481 7.350 6.858 1.00 0.00 H new ATOM 0 HG3 ARG A 98 18.093 6.818 6.425 1.00 0.00 H new ATOM 0 HD2 ARG A 98 17.348 8.253 9.006 1.00 0.00 H new ATOM 0 HD3 ARG A 98 17.618 6.529 8.854 1.00 0.00 H new ATOM 0 HE ARG A 98 19.982 7.449 7.920 1.00 0.00 H new ATOM 0 HH11 ARG A 98 18.056 8.486 10.701 1.00 0.00 H new ATOM 0 HH12 ARG A 98 19.470 8.964 11.647 1.00 0.00 H new ATOM 0 HH21 ARG A 98 21.794 8.065 9.150 1.00 0.00 H new ATOM 0 HH22 ARG A 98 21.575 8.727 10.773 1.00 0.00 H new ATOM 1405 N GLU A 99 15.309 10.455 7.725 1.00 0.00 N ATOM 1406 CA GLU A 99 14.157 10.474 8.619 1.00 0.00 C ATOM 1407 C GLU A 99 12.943 11.048 7.904 1.00 0.00 C ATOM 1408 O GLU A 99 11.909 10.388 7.776 1.00 0.00 O ATOM 1409 CB GLU A 99 14.449 11.322 9.861 1.00 0.00 C ATOM 1410 CG GLU A 99 15.710 10.930 10.610 1.00 0.00 C ATOM 1411 CD GLU A 99 15.611 9.570 11.269 1.00 0.00 C ATOM 1412 OE1 GLU A 99 14.883 9.440 12.275 1.00 0.00 O ATOM 1413 OE2 GLU A 99 16.268 8.623 10.789 1.00 0.00 O ATOM 0 H GLU A 99 16.005 11.176 7.916 1.00 0.00 H new ATOM 0 HA GLU A 99 13.953 9.448 8.924 1.00 0.00 H new ATOM 0 HB2 GLU A 99 14.530 12.367 9.561 1.00 0.00 H new ATOM 0 HB3 GLU A 99 13.601 11.251 10.542 1.00 0.00 H new ATOM 0 HG2 GLU A 99 16.552 10.931 9.918 1.00 0.00 H new ATOM 0 HG3 GLU A 99 15.922 11.681 11.371 1.00 0.00 H new ATOM 1420 N SER A 100 13.093 12.279 7.423 1.00 0.00 N ATOM 1421 CA SER A 100 11.988 13.026 6.832 1.00 0.00 C ATOM 1422 C SER A 100 11.307 12.262 5.699 1.00 0.00 C ATOM 1423 O SER A 100 10.089 12.357 5.531 1.00 0.00 O ATOM 1424 CB SER A 100 12.479 14.378 6.323 1.00 0.00 C ATOM 1425 OG SER A 100 13.596 14.230 5.476 1.00 0.00 O ATOM 0 H SER A 100 13.979 12.784 7.432 1.00 0.00 H new ATOM 0 HA SER A 100 11.247 13.174 7.617 1.00 0.00 H new ATOM 0 HB2 SER A 100 11.675 14.880 5.785 1.00 0.00 H new ATOM 0 HB3 SER A 100 12.742 15.014 7.168 1.00 0.00 H new ATOM 0 HG SER A 100 14.418 14.368 5.991 1.00 0.00 H new ATOM 1431 N MET A 101 12.090 11.506 4.934 1.00 0.00 N ATOM 1432 CA MET A 101 11.559 10.738 3.824 1.00 0.00 C ATOM 1433 C MET A 101 10.454 9.793 4.286 1.00 0.00 C ATOM 1434 O MET A 101 9.371 9.755 3.694 1.00 0.00 O ATOM 1435 CB MET A 101 12.664 9.948 3.136 1.00 0.00 C ATOM 1436 CG MET A 101 12.185 9.348 1.854 1.00 0.00 C ATOM 1437 SD MET A 101 13.439 8.421 0.978 1.00 0.00 S ATOM 1438 CE MET A 101 12.464 8.042 -0.456 1.00 0.00 C ATOM 0 H MET A 101 13.097 11.412 5.067 1.00 0.00 H new ATOM 0 HA MET A 101 11.133 11.443 3.110 1.00 0.00 H new ATOM 0 HB2 MET A 101 13.513 10.602 2.939 1.00 0.00 H new ATOM 0 HB3 MET A 101 13.017 9.159 3.800 1.00 0.00 H new ATOM 0 HG2 MET A 101 11.341 8.691 2.064 1.00 0.00 H new ATOM 0 HG3 MET A 101 11.816 10.144 1.207 1.00 0.00 H new ATOM 0 HE1 MET A 101 13.114 7.679 -1.252 1.00 0.00 H new ATOM 0 HE2 MET A 101 11.732 7.274 -0.206 1.00 0.00 H new ATOM 0 HE3 MET A 101 11.946 8.940 -0.792 1.00 0.00 H new ATOM 1448 N MET A 102 10.702 9.056 5.366 1.00 0.00 N ATOM 1449 CA MET A 102 9.718 8.095 5.849 1.00 0.00 C ATOM 1450 C MET A 102 8.720 8.771 6.781 1.00 0.00 C ATOM 1451 O MET A 102 7.676 8.205 7.102 1.00 0.00 O ATOM 1452 CB MET A 102 10.389 6.917 6.555 1.00 0.00 C ATOM 1453 CG MET A 102 10.998 7.250 7.905 1.00 0.00 C ATOM 1454 SD MET A 102 11.715 5.798 8.698 1.00 0.00 S ATOM 1455 CE MET A 102 10.334 4.658 8.596 1.00 0.00 C ATOM 0 H MET A 102 11.561 9.105 5.914 1.00 0.00 H new ATOM 0 HA MET A 102 9.182 7.707 4.983 1.00 0.00 H new ATOM 0 HB2 MET A 102 9.653 6.124 6.689 1.00 0.00 H new ATOM 0 HB3 MET A 102 11.170 6.520 5.907 1.00 0.00 H new ATOM 0 HG2 MET A 102 11.768 8.011 7.778 1.00 0.00 H new ATOM 0 HG3 MET A 102 10.232 7.676 8.553 1.00 0.00 H new ATOM 0 HE1 MET A 102 10.446 3.882 9.353 1.00 0.00 H new ATOM 0 HE2 MET A 102 9.403 5.198 8.766 1.00 0.00 H new ATOM 0 HE3 MET A 102 10.312 4.200 7.607 1.00 0.00 H new ATOM 1465 N GLN A 103 9.054 9.980 7.218 1.00 0.00 N ATOM 1466 CA GLN A 103 8.127 10.788 8.010 1.00 0.00 C ATOM 1467 C GLN A 103 6.932 11.216 7.169 1.00 0.00 C ATOM 1468 O GLN A 103 5.850 11.472 7.697 1.00 0.00 O ATOM 1469 CB GLN A 103 8.810 12.036 8.575 1.00 0.00 C ATOM 1470 CG GLN A 103 9.047 11.988 10.076 1.00 0.00 C ATOM 1471 CD GLN A 103 10.021 10.906 10.494 1.00 0.00 C ATOM 1472 OE1 GLN A 103 11.226 11.140 10.578 1.00 0.00 O ATOM 1473 NE2 GLN A 103 9.506 9.722 10.770 1.00 0.00 N ATOM 0 H GLN A 103 9.955 10.423 7.040 1.00 0.00 H new ATOM 0 HA GLN A 103 7.789 10.166 8.839 1.00 0.00 H new ATOM 0 HB2 GLN A 103 9.767 12.173 8.071 1.00 0.00 H new ATOM 0 HB3 GLN A 103 8.199 12.908 8.342 1.00 0.00 H new ATOM 0 HG2 GLN A 103 9.424 12.955 10.408 1.00 0.00 H new ATOM 0 HG3 GLN A 103 8.095 11.826 10.582 1.00 0.00 H new ATOM 0 HE21 GLN A 103 8.501 9.571 10.687 1.00 0.00 H new ATOM 0 HE22 GLN A 103 10.114 8.958 11.066 1.00 0.00 H new ATOM 1482 N ALA A 104 7.140 11.304 5.861 1.00 0.00 N ATOM 1483 CA ALA A 104 6.084 11.704 4.952 1.00 0.00 C ATOM 1484 C ALA A 104 5.033 10.608 4.840 1.00 0.00 C ATOM 1485 O ALA A 104 3.923 10.752 5.357 1.00 0.00 O ATOM 1486 CB ALA A 104 6.663 12.040 3.583 1.00 0.00 C ATOM 0 H ALA A 104 8.032 11.103 5.410 1.00 0.00 H new ATOM 0 HA ALA A 104 5.602 12.597 5.349 1.00 0.00 H new ATOM 0 HB1 ALA A 104 5.858 12.339 2.911 1.00 0.00 H new ATOM 0 HB2 ALA A 104 7.377 12.858 3.681 1.00 0.00 H new ATOM 0 HB3 ALA A 104 7.169 11.164 3.177 1.00 0.00 H new ATOM 1492 N THR A 105 5.408 9.501 4.196 1.00 0.00 N ATOM 1493 CA THR A 105 4.488 8.397 3.930 1.00 0.00 C ATOM 1494 C THR A 105 5.064 7.463 2.860 1.00 0.00 C ATOM 1495 O THR A 105 4.652 6.308 2.739 1.00 0.00 O ATOM 1496 CB THR A 105 3.097 8.903 3.466 1.00 0.00 C ATOM 1497 OG1 THR A 105 2.166 7.817 3.384 1.00 0.00 O ATOM 1498 CG2 THR A 105 3.190 9.600 2.114 1.00 0.00 C ATOM 0 H THR A 105 6.354 9.346 3.846 1.00 0.00 H new ATOM 0 HA THR A 105 4.363 7.854 4.867 1.00 0.00 H new ATOM 0 HB THR A 105 2.744 9.622 4.206 1.00 0.00 H new ATOM 0 HG1 THR A 105 1.294 8.155 3.091 1.00 0.00 H new ATOM 0 HG21 THR A 105 2.200 9.944 1.813 1.00 0.00 H new ATOM 0 HG22 THR A 105 3.864 10.454 2.190 1.00 0.00 H new ATOM 0 HG23 THR A 105 3.573 8.901 1.370 1.00 0.00 H new ATOM 1506 N GLY A 106 6.029 7.966 2.094 1.00 0.00 N ATOM 1507 CA GLY A 106 6.592 7.199 0.997 1.00 0.00 C ATOM 1508 C GLY A 106 7.742 6.303 1.415 1.00 0.00 C ATOM 1509 O GLY A 106 8.496 5.833 0.562 1.00 0.00 O ATOM 0 H GLY A 106 6.432 8.895 2.215 1.00 0.00 H new ATOM 0 HA2 GLY A 106 5.808 6.587 0.552 1.00 0.00 H new ATOM 0 HA3 GLY A 106 6.938 7.885 0.224 1.00 0.00 H new ATOM 1513 N SER A 107 7.879 6.067 2.726 1.00 0.00 N ATOM 1514 CA SER A 107 8.969 5.267 3.266 1.00 0.00 C ATOM 1515 C SER A 107 10.320 5.913 2.969 1.00 0.00 C ATOM 1516 O SER A 107 10.392 6.983 2.368 1.00 0.00 O ATOM 1517 CB SER A 107 8.916 3.849 2.699 1.00 0.00 C ATOM 1518 OG SER A 107 7.695 3.210 3.037 1.00 0.00 O ATOM 0 H SER A 107 7.238 6.426 3.433 1.00 0.00 H new ATOM 0 HA SER A 107 8.852 5.215 4.348 1.00 0.00 H new ATOM 0 HB2 SER A 107 9.025 3.883 1.615 1.00 0.00 H new ATOM 0 HB3 SER A 107 9.753 3.268 3.085 1.00 0.00 H new ATOM 0 HG SER A 107 7.685 2.305 2.661 1.00 0.00 H new ATOM 1524 N VAL A 108 11.385 5.276 3.414 1.00 0.00 N ATOM 1525 CA VAL A 108 12.719 5.759 3.142 1.00 0.00 C ATOM 1526 C VAL A 108 13.475 4.736 2.296 1.00 0.00 C ATOM 1527 O VAL A 108 13.912 3.692 2.781 1.00 0.00 O ATOM 1528 CB VAL A 108 13.472 6.100 4.452 1.00 0.00 C ATOM 1529 CG1 VAL A 108 13.403 4.955 5.449 1.00 0.00 C ATOM 1530 CG2 VAL A 108 14.914 6.488 4.168 1.00 0.00 C ATOM 0 H VAL A 108 11.349 4.420 3.967 1.00 0.00 H new ATOM 0 HA VAL A 108 12.651 6.687 2.574 1.00 0.00 H new ATOM 0 HB VAL A 108 12.973 6.958 4.902 1.00 0.00 H new ATOM 0 HG11 VAL A 108 13.942 5.229 6.356 1.00 0.00 H new ATOM 0 HG12 VAL A 108 12.361 4.748 5.694 1.00 0.00 H new ATOM 0 HG13 VAL A 108 13.856 4.065 5.013 1.00 0.00 H new ATOM 0 HG21 VAL A 108 15.419 6.722 5.105 1.00 0.00 H new ATOM 0 HG22 VAL A 108 15.424 5.659 3.678 1.00 0.00 H new ATOM 0 HG23 VAL A 108 14.934 7.362 3.517 1.00 0.00 H new ATOM 1540 N ASP A 109 13.570 5.035 1.009 1.00 0.00 N ATOM 1541 CA ASP A 109 14.157 4.119 0.038 1.00 0.00 C ATOM 1542 C ASP A 109 15.672 4.047 0.193 1.00 0.00 C ATOM 1543 O ASP A 109 16.330 5.046 0.509 1.00 0.00 O ATOM 1544 CB ASP A 109 13.785 4.551 -1.385 1.00 0.00 C ATOM 1545 CG ASP A 109 14.412 3.673 -2.450 1.00 0.00 C ATOM 1546 OD1 ASP A 109 13.896 2.564 -2.705 1.00 0.00 O ATOM 1547 OD2 ASP A 109 15.422 4.099 -3.043 1.00 0.00 O ATOM 0 H ASP A 109 13.245 5.915 0.608 1.00 0.00 H new ATOM 0 HA ASP A 109 13.755 3.123 0.224 1.00 0.00 H new ATOM 0 HB2 ASP A 109 12.701 4.529 -1.495 1.00 0.00 H new ATOM 0 HB3 ASP A 109 14.100 5.583 -1.540 1.00 0.00 H new ATOM 1552 N ASN A 110 16.215 2.861 -0.043 1.00 0.00 N ATOM 1553 CA ASN A 110 17.630 2.596 0.182 1.00 0.00 C ATOM 1554 C ASN A 110 18.501 3.210 -0.914 1.00 0.00 C ATOM 1555 O ASN A 110 19.680 3.483 -0.696 1.00 0.00 O ATOM 1556 CB ASN A 110 17.888 1.082 0.262 1.00 0.00 C ATOM 1557 CG ASN A 110 17.791 0.389 -1.091 1.00 0.00 C ATOM 1558 OD1 ASN A 110 18.785 0.260 -1.807 1.00 0.00 O ATOM 1559 ND2 ASN A 110 16.599 -0.069 -1.444 1.00 0.00 N ATOM 0 H ASN A 110 15.691 2.059 -0.394 1.00 0.00 H new ATOM 0 HA ASN A 110 17.900 3.060 1.130 1.00 0.00 H new ATOM 0 HB2 ASN A 110 18.879 0.910 0.682 1.00 0.00 H new ATOM 0 HB3 ASN A 110 17.169 0.632 0.947 1.00 0.00 H new ATOM 0 HD21 ASN A 110 16.481 -0.548 -2.337 1.00 0.00 H new ATOM 0 HD22 ASN A 110 15.800 0.058 -0.823 1.00 0.00 H new ATOM 1566 N ALA A 111 17.923 3.432 -2.084 1.00 0.00 N ATOM 1567 CA ALA A 111 18.677 3.951 -3.212 1.00 0.00 C ATOM 1568 C ALA A 111 18.575 5.465 -3.278 1.00 0.00 C ATOM 1569 O ALA A 111 19.574 6.143 -3.482 1.00 0.00 O ATOM 1570 CB ALA A 111 18.185 3.330 -4.512 1.00 0.00 C ATOM 0 H ALA A 111 16.936 3.261 -2.276 1.00 0.00 H new ATOM 0 HA ALA A 111 19.725 3.684 -3.073 1.00 0.00 H new ATOM 0 HB1 ALA A 111 18.761 3.730 -5.347 1.00 0.00 H new ATOM 0 HB2 ALA A 111 18.311 2.248 -4.469 1.00 0.00 H new ATOM 0 HB3 ALA A 111 17.130 3.567 -4.652 1.00 0.00 H new ATOM 1576 N PHE A 112 17.363 5.979 -3.091 1.00 0.00 N ATOM 1577 CA PHE A 112 17.109 7.418 -3.144 1.00 0.00 C ATOM 1578 C PHE A 112 18.029 8.173 -2.191 1.00 0.00 C ATOM 1579 O PHE A 112 18.778 9.056 -2.611 1.00 0.00 O ATOM 1580 CB PHE A 112 15.645 7.711 -2.802 1.00 0.00 C ATOM 1581 CG PHE A 112 15.303 9.178 -2.781 1.00 0.00 C ATOM 1582 CD1 PHE A 112 15.087 9.869 -3.960 1.00 0.00 C ATOM 1583 CD2 PHE A 112 15.190 9.864 -1.581 1.00 0.00 C ATOM 1584 CE1 PHE A 112 14.766 11.213 -3.942 1.00 0.00 C ATOM 1585 CE2 PHE A 112 14.868 11.207 -1.559 1.00 0.00 C ATOM 1586 CZ PHE A 112 14.657 11.881 -2.743 1.00 0.00 C ATOM 0 H PHE A 112 16.534 5.416 -2.900 1.00 0.00 H new ATOM 0 HA PHE A 112 17.314 7.759 -4.159 1.00 0.00 H new ATOM 0 HB2 PHE A 112 15.005 7.210 -3.528 1.00 0.00 H new ATOM 0 HB3 PHE A 112 15.417 7.281 -1.827 1.00 0.00 H new ATOM 0 HD1 PHE A 112 15.170 9.352 -4.905 1.00 0.00 H new ATOM 0 HD2 PHE A 112 15.356 9.341 -0.651 1.00 0.00 H new ATOM 0 HE1 PHE A 112 14.600 11.740 -4.870 1.00 0.00 H new ATOM 0 HE2 PHE A 112 14.782 11.728 -0.617 1.00 0.00 H new ATOM 0 HZ PHE A 112 14.407 12.931 -2.730 1.00 0.00 H new ATOM 1596 N THR A 113 17.976 7.813 -0.913 1.00 0.00 N ATOM 1597 CA THR A 113 18.783 8.474 0.105 1.00 0.00 C ATOM 1598 C THR A 113 20.269 8.366 -0.225 1.00 0.00 C ATOM 1599 O THR A 113 21.022 9.333 -0.103 1.00 0.00 O ATOM 1600 CB THR A 113 18.511 7.872 1.498 1.00 0.00 C ATOM 1601 OG1 THR A 113 18.582 6.437 1.439 1.00 0.00 O ATOM 1602 CG2 THR A 113 17.141 8.297 2.013 1.00 0.00 C ATOM 0 H THR A 113 17.381 7.065 -0.557 1.00 0.00 H new ATOM 0 HA THR A 113 18.502 9.527 0.118 1.00 0.00 H new ATOM 0 HB THR A 113 19.272 8.244 2.184 1.00 0.00 H new ATOM 0 HG1 THR A 113 17.723 6.079 1.131 1.00 0.00 H new ATOM 0 HG21 THR A 113 16.971 7.860 2.997 1.00 0.00 H new ATOM 0 HG22 THR A 113 17.101 9.384 2.086 1.00 0.00 H new ATOM 0 HG23 THR A 113 16.370 7.951 1.324 1.00 0.00 H new ATOM 1610 N ASN A 114 20.665 7.187 -0.677 1.00 0.00 N ATOM 1611 CA ASN A 114 22.046 6.909 -1.045 1.00 0.00 C ATOM 1612 C ASN A 114 22.484 7.747 -2.249 1.00 0.00 C ATOM 1613 O ASN A 114 23.552 8.360 -2.230 1.00 0.00 O ATOM 1614 CB ASN A 114 22.195 5.414 -1.346 1.00 0.00 C ATOM 1615 CG ASN A 114 23.502 5.062 -2.023 1.00 0.00 C ATOM 1616 OD1 ASN A 114 24.521 4.859 -1.363 1.00 0.00 O ATOM 1617 ND2 ASN A 114 23.473 4.955 -3.343 1.00 0.00 N ATOM 0 H ASN A 114 20.037 6.393 -0.800 1.00 0.00 H new ATOM 0 HA ASN A 114 22.692 7.180 -0.210 1.00 0.00 H new ATOM 0 HB2 ASN A 114 22.115 4.854 -0.414 1.00 0.00 H new ATOM 0 HB3 ASN A 114 21.369 5.095 -1.981 1.00 0.00 H new ATOM 0 HD21 ASN A 114 24.318 4.695 -3.852 1.00 0.00 H new ATOM 0 HD22 ASN A 114 22.606 5.132 -3.850 1.00 0.00 H new ATOM 1624 N GLU A 115 21.644 7.779 -3.281 1.00 0.00 N ATOM 1625 CA GLU A 115 21.938 8.477 -4.503 1.00 0.00 C ATOM 1626 C GLU A 115 22.107 9.973 -4.247 1.00 0.00 C ATOM 1627 O GLU A 115 23.106 10.570 -4.651 1.00 0.00 O ATOM 1628 CB GLU A 115 20.803 8.215 -5.484 1.00 0.00 C ATOM 1629 CG GLU A 115 21.129 8.624 -6.888 1.00 0.00 C ATOM 1630 CD GLU A 115 20.033 8.280 -7.877 1.00 0.00 C ATOM 1631 OE1 GLU A 115 19.844 7.076 -8.165 1.00 0.00 O ATOM 1632 OE2 GLU A 115 19.359 9.204 -8.379 1.00 0.00 O ATOM 0 H GLU A 115 20.736 7.314 -3.280 1.00 0.00 H new ATOM 0 HA GLU A 115 22.878 8.116 -4.921 1.00 0.00 H new ATOM 0 HB2 GLU A 115 20.557 7.153 -5.470 1.00 0.00 H new ATOM 0 HB3 GLU A 115 19.914 8.752 -5.153 1.00 0.00 H new ATOM 0 HG2 GLU A 115 21.310 9.699 -6.914 1.00 0.00 H new ATOM 0 HG3 GLU A 115 22.054 8.137 -7.196 1.00 0.00 H new ATOM 1639 N VAL A 116 21.139 10.565 -3.555 1.00 0.00 N ATOM 1640 CA VAL A 116 21.192 11.987 -3.227 1.00 0.00 C ATOM 1641 C VAL A 116 22.434 12.307 -2.393 1.00 0.00 C ATOM 1642 O VAL A 116 23.128 13.289 -2.653 1.00 0.00 O ATOM 1643 CB VAL A 116 19.924 12.442 -2.467 1.00 0.00 C ATOM 1644 CG1 VAL A 116 20.012 13.915 -2.093 1.00 0.00 C ATOM 1645 CG2 VAL A 116 18.678 12.184 -3.303 1.00 0.00 C ATOM 0 H VAL A 116 20.309 10.083 -3.210 1.00 0.00 H new ATOM 0 HA VAL A 116 21.243 12.533 -4.169 1.00 0.00 H new ATOM 0 HB VAL A 116 19.856 11.859 -1.548 1.00 0.00 H new ATOM 0 HG11 VAL A 116 19.108 14.210 -1.560 1.00 0.00 H new ATOM 0 HG12 VAL A 116 20.880 14.077 -1.453 1.00 0.00 H new ATOM 0 HG13 VAL A 116 20.111 14.515 -2.998 1.00 0.00 H new ATOM 0 HG21 VAL A 116 17.796 12.510 -2.752 1.00 0.00 H new ATOM 0 HG22 VAL A 116 18.747 12.738 -4.239 1.00 0.00 H new ATOM 0 HG23 VAL A 116 18.598 11.118 -3.517 1.00 0.00 H new ATOM 1655 N MET A 117 22.720 11.455 -1.410 1.00 0.00 N ATOM 1656 CA MET A 117 23.888 11.631 -0.547 1.00 0.00 C ATOM 1657 C MET A 117 25.173 11.734 -1.363 1.00 0.00 C ATOM 1658 O MET A 117 25.963 12.666 -1.178 1.00 0.00 O ATOM 1659 CB MET A 117 24.000 10.477 0.454 1.00 0.00 C ATOM 1660 CG MET A 117 23.271 10.716 1.770 1.00 0.00 C ATOM 1661 SD MET A 117 24.311 11.495 3.031 1.00 0.00 S ATOM 1662 CE MET A 117 24.534 13.146 2.377 1.00 0.00 C ATOM 0 H MET A 117 22.157 10.633 -1.190 1.00 0.00 H new ATOM 0 HA MET A 117 23.753 12.565 -0.001 1.00 0.00 H new ATOM 0 HB2 MET A 117 23.605 9.572 -0.007 1.00 0.00 H new ATOM 0 HB3 MET A 117 25.054 10.294 0.664 1.00 0.00 H new ATOM 0 HG2 MET A 117 22.401 11.346 1.586 1.00 0.00 H new ATOM 0 HG3 MET A 117 22.901 9.764 2.151 1.00 0.00 H new ATOM 0 HE1 MET A 117 24.951 13.790 3.151 1.00 0.00 H new ATOM 0 HE2 MET A 117 25.215 13.112 1.527 1.00 0.00 H new ATOM 0 HE3 MET A 117 23.571 13.543 2.055 1.00 0.00 H new ATOM 1672 N GLN A 118 25.370 10.784 -2.268 1.00 0.00 N ATOM 1673 CA GLN A 118 26.569 10.755 -3.095 1.00 0.00 C ATOM 1674 C GLN A 118 26.585 11.930 -4.067 1.00 0.00 C ATOM 1675 O GLN A 118 27.616 12.570 -4.259 1.00 0.00 O ATOM 1676 CB GLN A 118 26.666 9.425 -3.850 1.00 0.00 C ATOM 1677 CG GLN A 118 27.882 9.322 -4.763 1.00 0.00 C ATOM 1678 CD GLN A 118 28.119 7.907 -5.259 1.00 0.00 C ATOM 1679 OE1 GLN A 118 27.816 6.938 -4.565 1.00 0.00 O ATOM 1680 NE2 GLN A 118 28.668 7.777 -6.457 1.00 0.00 N ATOM 0 H GLN A 118 24.715 10.023 -2.448 1.00 0.00 H new ATOM 0 HA GLN A 118 27.438 10.845 -2.443 1.00 0.00 H new ATOM 0 HB2 GLN A 118 26.696 8.609 -3.128 1.00 0.00 H new ATOM 0 HB3 GLN A 118 25.764 9.290 -4.446 1.00 0.00 H new ATOM 0 HG2 GLN A 118 27.748 9.985 -5.618 1.00 0.00 H new ATOM 0 HG3 GLN A 118 28.765 9.668 -4.226 1.00 0.00 H new ATOM 0 HE21 GLN A 118 28.905 8.606 -7.002 1.00 0.00 H new ATOM 0 HE22 GLN A 118 28.854 6.848 -6.835 1.00 0.00 H new ATOM 1689 N LEU A 119 25.434 12.220 -4.661 1.00 0.00 N ATOM 1690 CA LEU A 119 25.311 13.320 -5.608 1.00 0.00 C ATOM 1691 C LEU A 119 25.678 14.655 -4.972 1.00 0.00 C ATOM 1692 O LEU A 119 26.491 15.396 -5.519 1.00 0.00 O ATOM 1693 CB LEU A 119 23.893 13.379 -6.170 1.00 0.00 C ATOM 1694 CG LEU A 119 23.610 12.414 -7.322 1.00 0.00 C ATOM 1695 CD1 LEU A 119 22.115 12.182 -7.467 1.00 0.00 C ATOM 1696 CD2 LEU A 119 24.182 12.962 -8.619 1.00 0.00 C ATOM 0 H LEU A 119 24.568 11.705 -4.502 1.00 0.00 H new ATOM 0 HA LEU A 119 26.013 13.134 -6.421 1.00 0.00 H new ATOM 0 HB2 LEU A 119 23.190 13.172 -5.363 1.00 0.00 H new ATOM 0 HB3 LEU A 119 23.696 14.395 -6.511 1.00 0.00 H new ATOM 0 HG LEU A 119 24.090 11.461 -7.100 1.00 0.00 H new ATOM 0 HD11 LEU A 119 21.932 11.493 -8.291 1.00 0.00 H new ATOM 0 HD12 LEU A 119 21.722 11.756 -6.544 1.00 0.00 H new ATOM 0 HD13 LEU A 119 21.618 13.130 -7.670 1.00 0.00 H new ATOM 0 HD21 LEU A 119 23.974 12.266 -9.431 1.00 0.00 H new ATOM 0 HD22 LEU A 119 23.723 13.926 -8.841 1.00 0.00 H new ATOM 0 HD23 LEU A 119 25.260 13.088 -8.517 1.00 0.00 H new ATOM 1708 N VAL A 120 25.096 14.954 -3.813 1.00 0.00 N ATOM 1709 CA VAL A 120 25.367 16.218 -3.130 1.00 0.00 C ATOM 1710 C VAL A 120 26.863 16.387 -2.872 1.00 0.00 C ATOM 1711 O VAL A 120 27.413 17.469 -3.054 1.00 0.00 O ATOM 1712 CB VAL A 120 24.603 16.336 -1.790 1.00 0.00 C ATOM 1713 CG1 VAL A 120 24.945 17.641 -1.085 1.00 0.00 C ATOM 1714 CG2 VAL A 120 23.102 16.240 -2.013 1.00 0.00 C ATOM 0 H VAL A 120 24.438 14.343 -3.329 1.00 0.00 H new ATOM 0 HA VAL A 120 25.017 17.009 -3.793 1.00 0.00 H new ATOM 0 HB VAL A 120 24.913 15.506 -1.155 1.00 0.00 H new ATOM 0 HG11 VAL A 120 24.396 17.702 -0.145 1.00 0.00 H new ATOM 0 HG12 VAL A 120 26.016 17.676 -0.883 1.00 0.00 H new ATOM 0 HG13 VAL A 120 24.669 18.482 -1.721 1.00 0.00 H new ATOM 0 HG21 VAL A 120 22.586 16.326 -1.057 1.00 0.00 H new ATOM 0 HG22 VAL A 120 22.780 17.046 -2.673 1.00 0.00 H new ATOM 0 HG23 VAL A 120 22.863 15.280 -2.470 1.00 0.00 H new ATOM 1724 N LYS A 121 27.515 15.310 -2.448 1.00 0.00 N ATOM 1725 CA LYS A 121 28.953 15.333 -2.192 1.00 0.00 C ATOM 1726 C LYS A 121 29.748 15.507 -3.479 1.00 0.00 C ATOM 1727 O LYS A 121 30.601 16.382 -3.574 1.00 0.00 O ATOM 1728 CB LYS A 121 29.381 14.048 -1.485 1.00 0.00 C ATOM 1729 CG LYS A 121 29.337 14.113 0.038 1.00 0.00 C ATOM 1730 CD LYS A 121 27.995 14.588 0.584 1.00 0.00 C ATOM 1731 CE LYS A 121 27.941 16.104 0.719 1.00 0.00 C ATOM 1732 NZ LYS A 121 26.777 16.546 1.528 1.00 0.00 N ATOM 0 H LYS A 121 27.071 14.408 -2.274 1.00 0.00 H new ATOM 0 HA LYS A 121 29.163 16.188 -1.550 1.00 0.00 H new ATOM 0 HB2 LYS A 121 28.737 13.234 -1.819 1.00 0.00 H new ATOM 0 HB3 LYS A 121 30.396 13.800 -1.795 1.00 0.00 H new ATOM 0 HG2 LYS A 121 29.557 13.125 0.443 1.00 0.00 H new ATOM 0 HG3 LYS A 121 30.122 14.783 0.389 1.00 0.00 H new ATOM 0 HD2 LYS A 121 27.195 14.254 -0.077 1.00 0.00 H new ATOM 0 HD3 LYS A 121 27.816 14.130 1.557 1.00 0.00 H new ATOM 0 HE2 LYS A 121 28.861 16.460 1.182 1.00 0.00 H new ATOM 0 HE3 LYS A 121 27.887 16.555 -0.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 26.404 17.436 1.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 26.036 15.817 1.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 27.075 16.694 2.513 1.00 0.00 H new ATOM 1746 N MET A 122 29.447 14.686 -4.469 1.00 0.00 N ATOM 1747 CA MET A 122 30.173 14.698 -5.733 1.00 0.00 C ATOM 1748 C MET A 122 30.006 16.031 -6.472 1.00 0.00 C ATOM 1749 O MET A 122 30.867 16.427 -7.260 1.00 0.00 O ATOM 1750 CB MET A 122 29.703 13.517 -6.594 1.00 0.00 C ATOM 1751 CG MET A 122 30.176 13.555 -8.038 1.00 0.00 C ATOM 1752 SD MET A 122 28.906 14.167 -9.162 1.00 0.00 S ATOM 1753 CE MET A 122 27.689 12.854 -9.048 1.00 0.00 C ATOM 0 H MET A 122 28.698 13.995 -4.424 1.00 0.00 H new ATOM 0 HA MET A 122 31.238 14.591 -5.528 1.00 0.00 H new ATOM 0 HB2 MET A 122 30.050 12.591 -6.137 1.00 0.00 H new ATOM 0 HB3 MET A 122 28.613 13.488 -6.584 1.00 0.00 H new ATOM 0 HG2 MET A 122 31.059 14.190 -8.112 1.00 0.00 H new ATOM 0 HG3 MET A 122 30.477 12.553 -8.345 1.00 0.00 H new ATOM 0 HE1 MET A 122 26.948 12.976 -9.838 1.00 0.00 H new ATOM 0 HE2 MET A 122 28.183 11.889 -9.160 1.00 0.00 H new ATOM 0 HE3 MET A 122 27.196 12.899 -8.077 1.00 0.00 H new ATOM 1763 N LEU A 123 28.917 16.730 -6.189 1.00 0.00 N ATOM 1764 CA LEU A 123 28.642 18.010 -6.829 1.00 0.00 C ATOM 1765 C LEU A 123 29.169 19.184 -5.996 1.00 0.00 C ATOM 1766 O LEU A 123 28.945 20.342 -6.343 1.00 0.00 O ATOM 1767 CB LEU A 123 27.136 18.166 -7.063 1.00 0.00 C ATOM 1768 CG LEU A 123 26.517 17.140 -8.016 1.00 0.00 C ATOM 1769 CD1 LEU A 123 25.000 17.230 -7.987 1.00 0.00 C ATOM 1770 CD2 LEU A 123 27.036 17.341 -9.432 1.00 0.00 C ATOM 0 H LEU A 123 28.207 16.433 -5.519 1.00 0.00 H new ATOM 0 HA LEU A 123 29.162 18.022 -7.787 1.00 0.00 H new ATOM 0 HB2 LEU A 123 26.626 18.100 -6.102 1.00 0.00 H new ATOM 0 HB3 LEU A 123 26.947 19.165 -7.456 1.00 0.00 H new ATOM 0 HG LEU A 123 26.809 16.144 -7.682 1.00 0.00 H new ATOM 0 HD11 LEU A 123 24.579 16.493 -8.671 1.00 0.00 H new ATOM 0 HD12 LEU A 123 24.643 17.033 -6.976 1.00 0.00 H new ATOM 0 HD13 LEU A 123 24.689 18.229 -8.293 1.00 0.00 H new ATOM 0 HD21 LEU A 123 26.584 16.602 -10.094 1.00 0.00 H new ATOM 0 HD22 LEU A 123 26.777 18.342 -9.776 1.00 0.00 H new ATOM 0 HD23 LEU A 123 28.120 17.223 -9.443 1.00 0.00 H new ATOM 1782 N SER A 124 29.874 18.890 -4.910 1.00 0.00 N ATOM 1783 CA SER A 124 30.415 19.942 -4.049 1.00 0.00 C ATOM 1784 C SER A 124 31.886 19.686 -3.735 1.00 0.00 C ATOM 1785 O SER A 124 32.753 20.498 -4.057 1.00 0.00 O ATOM 1786 CB SER A 124 29.599 20.056 -2.755 1.00 0.00 C ATOM 1787 OG SER A 124 29.446 18.798 -2.124 1.00 0.00 O ATOM 0 H SER A 124 30.085 17.940 -4.604 1.00 0.00 H new ATOM 0 HA SER A 124 30.342 20.888 -4.586 1.00 0.00 H new ATOM 0 HB2 SER A 124 30.092 20.749 -2.073 1.00 0.00 H new ATOM 0 HB3 SER A 124 28.617 20.474 -2.979 1.00 0.00 H new ATOM 0 HG SER A 124 28.517 18.499 -2.212 1.00 0.00 H new ATOM 1793 N ALA A 125 32.160 18.544 -3.124 1.00 0.00 N ATOM 1794 CA ALA A 125 33.512 18.162 -2.756 1.00 0.00 C ATOM 1795 C ALA A 125 33.597 16.647 -2.609 1.00 0.00 C ATOM 1796 O ALA A 125 33.043 16.072 -1.674 1.00 0.00 O ATOM 1797 CB ALA A 125 33.926 18.857 -1.470 1.00 0.00 C ATOM 0 H ALA A 125 31.451 17.857 -2.870 1.00 0.00 H new ATOM 0 HA ALA A 125 34.199 18.474 -3.542 1.00 0.00 H new ATOM 0 HB1 ALA A 125 34.941 18.561 -1.207 1.00 0.00 H new ATOM 0 HB2 ALA A 125 33.888 19.937 -1.612 1.00 0.00 H new ATOM 0 HB3 ALA A 125 33.246 18.572 -0.667 1.00 0.00 H new ATOM 1803 N ASP A 126 34.299 16.011 -3.537 1.00 0.00 N ATOM 1804 CA ASP A 126 34.311 14.550 -3.640 1.00 0.00 C ATOM 1805 C ASP A 126 35.207 13.912 -2.587 1.00 0.00 C ATOM 1806 O ASP A 126 35.049 12.741 -2.237 1.00 0.00 O ATOM 1807 CB ASP A 126 34.758 14.142 -5.053 1.00 0.00 C ATOM 1808 CG ASP A 126 34.834 12.640 -5.259 1.00 0.00 C ATOM 1809 OD1 ASP A 126 33.821 12.040 -5.671 1.00 0.00 O ATOM 1810 OD2 ASP A 126 35.923 12.057 -5.049 1.00 0.00 O ATOM 0 H ASP A 126 34.873 16.484 -4.236 1.00 0.00 H new ATOM 0 HA ASP A 126 33.300 14.187 -3.457 1.00 0.00 H new ATOM 0 HB2 ASP A 126 34.065 14.565 -5.780 1.00 0.00 H new ATOM 0 HB3 ASP A 126 35.737 14.578 -5.255 1.00 0.00 H new ATOM 1815 N SER A 127 36.116 14.696 -2.060 1.00 0.00 N ATOM 1816 CA SER A 127 37.106 14.187 -1.120 1.00 0.00 C ATOM 1817 C SER A 127 36.966 14.834 0.255 1.00 0.00 C ATOM 1818 O SER A 127 37.804 14.633 1.136 1.00 0.00 O ATOM 1819 CB SER A 127 38.510 14.426 -1.678 1.00 0.00 C ATOM 1820 OG SER A 127 38.650 13.836 -2.963 1.00 0.00 O ATOM 0 H SER A 127 36.197 15.693 -2.262 1.00 0.00 H new ATOM 0 HA SER A 127 36.937 13.117 -0.995 1.00 0.00 H new ATOM 0 HB2 SER A 127 38.703 15.497 -1.742 1.00 0.00 H new ATOM 0 HB3 SER A 127 39.252 14.008 -0.998 1.00 0.00 H new ATOM 0 HG SER A 127 39.554 14.002 -3.302 1.00 0.00 H new ATOM 1826 N ALA A 128 35.899 15.594 0.450 1.00 0.00 N ATOM 1827 CA ALA A 128 35.696 16.274 1.714 1.00 0.00 C ATOM 1828 C ALA A 128 34.914 15.399 2.684 1.00 0.00 C ATOM 1829 O ALA A 128 33.691 15.299 2.615 1.00 0.00 O ATOM 1830 CB ALA A 128 35.001 17.609 1.504 1.00 0.00 C ATOM 0 H ALA A 128 35.169 15.753 -0.244 1.00 0.00 H new ATOM 0 HA ALA A 128 36.674 16.469 2.153 1.00 0.00 H new ATOM 0 HB1 ALA A 128 34.859 18.101 2.466 1.00 0.00 H new ATOM 0 HB2 ALA A 128 35.613 18.241 0.860 1.00 0.00 H new ATOM 0 HB3 ALA A 128 34.031 17.444 1.035 1.00 0.00 H new ATOM 1836 N ASN A 129 35.645 14.733 3.562 1.00 0.00 N ATOM 1837 CA ASN A 129 35.046 13.926 4.621 1.00 0.00 C ATOM 1838 C ASN A 129 35.981 13.882 5.814 1.00 0.00 C ATOM 1839 O ASN A 129 35.544 13.911 6.965 1.00 0.00 O ATOM 1840 CB ASN A 129 34.762 12.498 4.133 1.00 0.00 C ATOM 1841 CG ASN A 129 34.188 11.608 5.228 1.00 0.00 C ATOM 1842 OD1 ASN A 129 32.974 11.524 5.405 1.00 0.00 O ATOM 1843 ND2 ASN A 129 35.060 10.934 5.966 1.00 0.00 N ATOM 0 H ASN A 129 36.665 14.734 3.565 1.00 0.00 H new ATOM 0 HA ASN A 129 34.099 14.383 4.909 1.00 0.00 H new ATOM 0 HB2 ASN A 129 34.063 12.536 3.297 1.00 0.00 H new ATOM 0 HB3 ASN A 129 35.685 12.056 3.757 1.00 0.00 H new ATOM 0 HD21 ASN A 129 34.731 10.320 6.711 1.00 0.00 H new ATOM 0 HD22 ASN A 129 36.060 11.030 5.789 1.00 0.00 H new ATOM 1850 N GLU A 130 37.274 13.829 5.505 1.00 0.00 N ATOM 1851 CA GLU A 130 38.339 13.717 6.496 1.00 0.00 C ATOM 1852 C GLU A 130 38.315 12.351 7.176 1.00 0.00 C ATOM 1853 O GLU A 130 37.499 12.086 8.062 1.00 0.00 O ATOM 1854 CB GLU A 130 38.273 14.841 7.533 1.00 0.00 C ATOM 1855 CG GLU A 130 39.428 14.815 8.523 1.00 0.00 C ATOM 1856 CD GLU A 130 40.781 14.936 7.845 1.00 0.00 C ATOM 1857 OE1 GLU A 130 41.201 13.975 7.159 1.00 0.00 O ATOM 1858 OE2 GLU A 130 41.431 15.985 7.997 1.00 0.00 O ATOM 0 H GLU A 130 37.616 13.863 4.545 1.00 0.00 H new ATOM 0 HA GLU A 130 39.285 13.818 5.964 1.00 0.00 H new ATOM 0 HB2 GLU A 130 38.267 15.801 7.018 1.00 0.00 H new ATOM 0 HB3 GLU A 130 37.333 14.767 8.080 1.00 0.00 H new ATOM 0 HG2 GLU A 130 39.309 15.631 9.236 1.00 0.00 H new ATOM 0 HG3 GLU A 130 39.393 13.886 9.092 1.00 0.00 H new ATOM 1865 N VAL A 131 39.205 11.482 6.728 1.00 0.00 N ATOM 1866 CA VAL A 131 39.336 10.148 7.279 1.00 0.00 C ATOM 1867 C VAL A 131 40.675 9.557 6.852 1.00 0.00 C ATOM 1868 O VAL A 131 41.100 9.725 5.704 1.00 0.00 O ATOM 1869 CB VAL A 131 38.165 9.236 6.836 1.00 0.00 C ATOM 1870 CG1 VAL A 131 38.136 9.062 5.323 1.00 0.00 C ATOM 1871 CG2 VAL A 131 38.232 7.888 7.539 1.00 0.00 C ATOM 0 H VAL A 131 39.857 11.684 5.970 1.00 0.00 H new ATOM 0 HA VAL A 131 39.299 10.212 8.366 1.00 0.00 H new ATOM 0 HB VAL A 131 37.236 9.725 7.128 1.00 0.00 H new ATOM 0 HG11 VAL A 131 37.302 8.417 5.047 1.00 0.00 H new ATOM 0 HG12 VAL A 131 38.015 10.035 4.847 1.00 0.00 H new ATOM 0 HG13 VAL A 131 39.070 8.610 4.991 1.00 0.00 H new ATOM 0 HG21 VAL A 131 37.399 7.265 7.212 1.00 0.00 H new ATOM 0 HG22 VAL A 131 39.173 7.395 7.292 1.00 0.00 H new ATOM 0 HG23 VAL A 131 38.172 8.037 8.617 1.00 0.00 H new ATOM 1881 N SER A 132 41.352 8.895 7.777 1.00 0.00 N ATOM 1882 CA SER A 132 42.678 8.359 7.513 1.00 0.00 C ATOM 1883 C SER A 132 42.601 7.022 6.776 1.00 0.00 C ATOM 1884 O SER A 132 42.954 5.972 7.315 1.00 0.00 O ATOM 1885 CB SER A 132 43.451 8.220 8.822 1.00 0.00 C ATOM 1886 OG SER A 132 43.478 9.460 9.511 1.00 0.00 O ATOM 0 H SER A 132 41.004 8.716 8.719 1.00 0.00 H new ATOM 0 HA SER A 132 43.209 9.055 6.864 1.00 0.00 H new ATOM 0 HB2 SER A 132 42.986 7.458 9.448 1.00 0.00 H new ATOM 0 HB3 SER A 132 44.469 7.887 8.618 1.00 0.00 H new ATOM 0 HG SER A 132 43.975 9.358 10.349 1.00 0.00 H new ATOM 1892 N THR A 133 42.105 7.082 5.549 1.00 0.00 N ATOM 1893 CA THR A 133 42.053 5.936 4.661 1.00 0.00 C ATOM 1894 C THR A 133 42.331 6.387 3.230 1.00 0.00 C ATOM 1895 O THR A 133 43.491 6.272 2.787 1.00 0.00 O ATOM 1896 CB THR A 133 40.686 5.219 4.735 1.00 0.00 C ATOM 1897 OG1 THR A 133 39.640 6.166 5.001 1.00 0.00 O ATOM 1898 CG2 THR A 133 40.690 4.144 5.811 1.00 0.00 C ATOM 0 H THR A 133 41.725 7.936 5.141 1.00 0.00 H new ATOM 0 HA THR A 133 42.816 5.225 4.979 1.00 0.00 H new ATOM 0 HB THR A 133 40.505 4.744 3.771 1.00 0.00 H new ATOM 0 HG1 THR A 133 38.779 5.699 5.044 1.00 0.00 H new ATOM 0 HG21 THR A 133 39.716 3.656 5.841 1.00 0.00 H new ATOM 0 HG22 THR A 133 41.459 3.406 5.585 1.00 0.00 H new ATOM 0 HG23 THR A 133 40.898 4.599 6.779 1.00 0.00 H new TER 1906 THR A 133