USER MOD reduce.3.24.130724 H: found=0, std=0, add=1368, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1370 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 82 THR OG1 : rot 78:sc= 0.555 USER MOD Set 1.2: B 8 MET CE :methyl -135:sc= -4.81! (180deg=-6.93!) USER MOD Set 2.1: A 25 LYS NZ :NH3+ 152:sc= 0.507 (180deg=0) USER MOD Set 2.2: A 26 TYR OH : rot 166:sc= 0.146! USER MOD Set 3.1: A 8 MET CE :methyl -165:sc= -4.53! (180deg=-5.59) USER MOD Set 3.2: B 82 THR OG1 : rot 59:sc= 0.342 USER MOD Single : A 2 SER OG : rot 37:sc= 1.51 USER MOD Single : A 6 THR OG1 : rot 79:sc= 0.418 USER MOD Single : A 10 THR OG1 : rot 82:sc= 1.22 USER MOD Single : A 13 ASN : amide:sc= -0.0717 X(o=-0.072,f=-0.25) USER MOD Single : A 16 HIS : no HD1:sc= -0.271 X(o=-0.27,f=-0.26) USER MOD Single : A 18 HIS : no HE2:sc= -2.49! C(o=-2.5!,f=-11!) USER MOD Single : A 19 SER OG : rot 99:sc= 1.15 USER MOD Single : A 21 LYS NZ :NH3+ -168:sc= -1.02! (180deg=-1.7!) USER MOD Single : A 27 LYS NZ :NH3+ -155:sc= 0.489 (180deg=-1.5!) USER MOD Single : A 29 SER OG : rot 15:sc= -0.917 USER MOD Single : A 30 LYS NZ :NH3+ -169:sc= -2.85! (180deg=-5.98!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 132:sc= 0.894 (180deg=-4.44!) USER MOD Single : A 38 GLN : amide:sc= -0.144 K(o=-0.14,f=-1.6!) USER MOD Single : A 39 THR OG1 : rot 74:sc= 0.716 USER MOD Single : A 42 SER OG : rot -36:sc= 0.797 USER MOD Single : A 48 GLN : amide:sc= -0.51 K(o=-0.51,f=-4!) USER MOD Single : A 49 LYS NZ :NH3+ 154:sc= -1.04 (180deg=-2.25!) USER MOD Single : A 56 LYS NZ :NH3+ 157:sc= -0.207 (180deg=-2.13!) USER MOD Single : A 58 MET CE :methyl -125:sc= -0.0887 (180deg=-0.666) USER MOD Single : A 59 LYS NZ :NH3+ -105:sc= -1.71! (180deg=-1.86!) USER MOD Single : A 64 ASN : amide:sc=-0.000768 K(o=-0.00077,f=-1.1) USER MOD Single : A 72 GLN : amide:sc= -1.41 K(o=-1.4,f=-2.9!) USER MOD Single : A 74 TYR OH : rot 180:sc= -0.0284 USER MOD Single : A 85 MET CE :methyl -146:sc= -4.43 (180deg=-9.23!) USER MOD Single : A 86 ASN : amide:sc= -4.8! C(o=-4.8!,f=-7.8!) USER MOD Single : A 87 ASN : amide:sc= -1.39 K(o=-1.4,f=-2.8!) USER MOD Single : B 2 SER OG : rot -165:sc= 0.892 USER MOD Single : B 6 THR OG1 : rot 180:sc= 0.00563 USER MOD Single : B 10 THR OG1 : rot 81:sc= 0.946 USER MOD Single : B 13 ASN : amide:sc= 0.209 K(o=0.21,f=-0.52) USER MOD Single : B 16 HIS : no HD1:sc= 0.662 K(o=0.66,f=-13!) USER MOD Single : B 18 HIS : no HE2:sc= -0.676 K(o=-0.68,f=-10!) USER MOD Single : B 19 SER OG : rot -22:sc= 1.1 USER MOD Single : B 21 LYS NZ :NH3+ 163:sc= 0.788 (180deg=-0.127) USER MOD Single : B 25 LYS NZ :NH3+ -159:sc= 0.848 (180deg=-0.215) USER MOD Single : B 26 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 LYS NZ :NH3+ -104:sc= 0.293 (180deg=-0.839!) USER MOD Single : B 29 SER OG : rot -125:sc= -0.698! USER MOD Single : B 30 LYS NZ :NH3+ 160:sc= -6.97! (180deg=-9.38!) USER MOD Single : B 31 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.389) USER MOD Single : B 34 LYS NZ :NH3+ 137:sc= 0.917 (180deg=-1.37) USER MOD Single : B 38 GLN : amide:sc= -0.0883 K(o=-0.088,f=-1.3!) USER MOD Single : B 39 THR OG1 : rot 104:sc= 0.847 USER MOD Single : B 42 SER OG : rot 52:sc= 0.94 USER MOD Single : B 48 GLN :FLIP amide:sc= -10.8! C(o=-12!,f=-11!) USER MOD Single : B 49 LYS NZ :NH3+ -163:sc= -1.43 (180deg=-2.61) USER MOD Single : B 56 LYS NZ :NH3+ 166:sc= 0.965! (180deg=-0.156!) USER MOD Single : B 58 MET CE :methyl -168:sc= 0 (180deg=-0.154) USER MOD Single : B 59 LYS NZ :NH3+ 177:sc= -2.18! (180deg=-2.37!) USER MOD Single : B 64 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 72 GLN : amide:sc= -1.95! C(o=-1.9!,f=-6.5!) USER MOD Single : B 74 TYR OH : rot 0:sc= -1.2 USER MOD Single : B 85 MET CE :methyl 168:sc= -3.92 (180deg=-4.52!) USER MOD Single : B 86 ASN : amide:sc= -0.714 K(o=-0.71,f=-4!) USER MOD Single : B 87 ASN : amide:sc= -0.102 X(o=-0.1,f=0.024) USER MOD ----------------------------------------------------------------- ATOM 8 N SER A 2 -10.714 4.202 9.982 1.00 0.00 N ATOM 9 CA SER A 2 -10.153 3.187 10.879 1.00 0.00 C ATOM 10 C SER A 2 -8.617 3.324 10.984 1.00 0.00 C ATOM 11 O SER A 2 -8.003 4.151 10.286 1.00 0.00 O ATOM 12 CB SER A 2 -10.526 1.792 10.364 1.00 0.00 C ATOM 13 OG SER A 2 -11.747 1.867 9.607 1.00 0.00 O ATOM 0 HA SER A 2 -10.570 3.333 11.876 1.00 0.00 H new ATOM 0 HB2 SER A 2 -9.724 1.397 9.741 1.00 0.00 H new ATOM 0 HB3 SER A 2 -10.647 1.105 11.201 1.00 0.00 H new ATOM 0 HG SER A 2 -11.766 2.705 9.099 1.00 0.00 H new ATOM 19 N GLU A 3 -7.989 2.491 11.811 1.00 0.00 N ATOM 20 CA GLU A 3 -6.530 2.513 11.926 1.00 0.00 C ATOM 21 C GLU A 3 -5.894 2.264 10.582 1.00 0.00 C ATOM 22 O GLU A 3 -4.924 2.916 10.218 1.00 0.00 O ATOM 23 CB GLU A 3 -6.030 1.439 12.898 1.00 0.00 C ATOM 24 CG GLU A 3 -6.203 1.895 14.343 1.00 0.00 C ATOM 25 CD GLU A 3 -7.611 1.639 14.854 1.00 0.00 C ATOM 26 OE1 GLU A 3 -8.457 1.225 14.080 1.00 0.00 O ATOM 27 OE2 GLU A 3 -7.830 1.852 16.019 1.00 0.00 O ATOM 0 H GLU A 3 -8.456 1.803 12.402 1.00 0.00 H new ATOM 0 HA GLU A 3 -6.252 3.498 12.301 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -6.579 0.511 12.736 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -4.979 1.226 12.702 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -5.486 1.373 14.977 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -5.978 2.959 14.417 1.00 0.00 H new ATOM 34 N LEU A 4 -6.455 1.342 9.836 1.00 0.00 N ATOM 35 CA LEU A 4 -5.921 1.020 8.530 1.00 0.00 C ATOM 36 C LEU A 4 -5.985 2.251 7.653 1.00 0.00 C ATOM 37 O LEU A 4 -5.003 2.624 7.016 1.00 0.00 O ATOM 38 CB LEU A 4 -6.725 -0.125 7.902 1.00 0.00 C ATOM 39 CG LEU A 4 -6.259 -1.498 8.461 1.00 0.00 C ATOM 40 CD1 LEU A 4 -5.128 -2.062 7.620 1.00 0.00 C ATOM 41 CD2 LEU A 4 -5.808 -1.386 9.928 1.00 0.00 C ATOM 0 H LEU A 4 -7.277 0.803 10.107 1.00 0.00 H new ATOM 0 HA LEU A 4 -4.884 0.699 8.626 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.786 0.015 8.107 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -6.605 -0.108 6.819 1.00 0.00 H new ATOM 0 HG LEU A 4 -7.113 -2.174 8.415 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -4.816 -3.023 8.028 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -5.470 -2.197 6.594 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -4.285 -1.371 7.634 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -5.489 -2.365 10.286 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -4.977 -0.684 10.001 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -6.638 -1.030 10.538 1.00 0.00 H new ATOM 53 N GLU A 5 -7.094 2.957 7.741 1.00 0.00 N ATOM 54 CA GLU A 5 -7.250 4.208 7.031 1.00 0.00 C ATOM 55 C GLU A 5 -6.238 5.202 7.575 1.00 0.00 C ATOM 56 O GLU A 5 -5.525 5.865 6.824 1.00 0.00 O ATOM 57 CB GLU A 5 -8.674 4.734 7.254 1.00 0.00 C ATOM 58 CG GLU A 5 -9.668 3.758 6.620 1.00 0.00 C ATOM 59 CD GLU A 5 -11.095 4.225 6.847 1.00 0.00 C ATOM 60 OE1 GLU A 5 -11.474 5.205 6.253 1.00 0.00 O ATOM 61 OE2 GLU A 5 -11.797 3.587 7.607 1.00 0.00 O ATOM 0 H GLU A 5 -7.903 2.684 8.299 1.00 0.00 H new ATOM 0 HA GLU A 5 -7.084 4.066 5.963 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -8.875 4.837 8.320 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -8.784 5.724 6.812 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -9.473 3.675 5.551 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -9.533 2.764 7.047 1.00 0.00 H new ATOM 68 N THR A 6 -6.100 5.204 8.886 1.00 0.00 N ATOM 69 CA THR A 6 -5.133 6.051 9.552 1.00 0.00 C ATOM 70 C THR A 6 -3.717 5.678 9.089 1.00 0.00 C ATOM 71 O THR A 6 -2.892 6.552 8.767 1.00 0.00 O ATOM 72 CB THR A 6 -5.263 5.868 11.073 1.00 0.00 C ATOM 73 OG1 THR A 6 -6.648 5.896 11.431 1.00 0.00 O ATOM 74 CG2 THR A 6 -4.551 7.019 11.789 1.00 0.00 C ATOM 0 H THR A 6 -6.652 4.622 9.516 1.00 0.00 H new ATOM 0 HA THR A 6 -5.320 7.095 9.301 1.00 0.00 H new ATOM 0 HB THR A 6 -4.816 4.917 11.363 1.00 0.00 H new ATOM 0 HG1 THR A 6 -7.054 5.026 11.234 1.00 0.00 H new ATOM 0 HG21 THR A 6 -4.643 6.889 12.867 1.00 0.00 H new ATOM 0 HG22 THR A 6 -3.497 7.023 11.513 1.00 0.00 H new ATOM 0 HG23 THR A 6 -5.006 7.966 11.497 1.00 0.00 H new ATOM 82 N ALA A 7 -3.447 4.380 9.038 1.00 0.00 N ATOM 83 CA ALA A 7 -2.161 3.888 8.586 1.00 0.00 C ATOM 84 C ALA A 7 -1.893 4.377 7.176 1.00 0.00 C ATOM 85 O ALA A 7 -0.824 4.924 6.889 1.00 0.00 O ATOM 86 CB ALA A 7 -2.136 2.353 8.617 1.00 0.00 C ATOM 0 H ALA A 7 -4.107 3.650 9.306 1.00 0.00 H new ATOM 0 HA ALA A 7 -1.386 4.265 9.253 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -1.164 1.998 8.275 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -2.311 2.007 9.636 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -2.916 1.963 7.962 1.00 0.00 H new ATOM 92 N MET A 8 -2.887 4.230 6.313 1.00 0.00 N ATOM 93 CA MET A 8 -2.747 4.679 4.935 1.00 0.00 C ATOM 94 C MET A 8 -2.597 6.195 4.883 1.00 0.00 C ATOM 95 O MET A 8 -1.721 6.720 4.184 1.00 0.00 O ATOM 96 CB MET A 8 -3.953 4.239 4.094 1.00 0.00 C ATOM 97 CG MET A 8 -4.021 2.703 4.040 1.00 0.00 C ATOM 98 SD MET A 8 -2.426 2.036 3.493 1.00 0.00 S ATOM 99 CE MET A 8 -2.429 2.772 1.849 1.00 0.00 C ATOM 0 H MET A 8 -3.789 3.809 6.538 1.00 0.00 H new ATOM 0 HA MET A 8 -1.850 4.222 4.518 1.00 0.00 H new ATOM 0 HB2 MET A 8 -4.872 4.638 4.524 1.00 0.00 H new ATOM 0 HB3 MET A 8 -3.871 4.644 3.085 1.00 0.00 H new ATOM 0 HG2 MET A 8 -4.273 2.306 5.023 1.00 0.00 H new ATOM 0 HG3 MET A 8 -4.810 2.389 3.357 1.00 0.00 H new ATOM 0 HE1 MET A 8 -1.673 2.287 1.232 1.00 0.00 H new ATOM 0 HE2 MET A 8 -3.410 2.639 1.393 1.00 0.00 H new ATOM 0 HE3 MET A 8 -2.206 3.836 1.926 1.00 0.00 H new ATOM 109 N GLU A 9 -3.376 6.890 5.697 1.00 0.00 N ATOM 110 CA GLU A 9 -3.272 8.343 5.785 1.00 0.00 C ATOM 111 C GLU A 9 -1.896 8.760 6.273 1.00 0.00 C ATOM 112 O GLU A 9 -1.334 9.756 5.799 1.00 0.00 O ATOM 113 CB GLU A 9 -4.375 8.922 6.682 1.00 0.00 C ATOM 114 CG GLU A 9 -5.711 8.818 5.943 1.00 0.00 C ATOM 115 CD GLU A 9 -5.683 9.728 4.731 1.00 0.00 C ATOM 116 OE1 GLU A 9 -5.586 10.925 4.924 1.00 0.00 O ATOM 117 OE2 GLU A 9 -5.755 9.228 3.640 1.00 0.00 O ATOM 0 H GLU A 9 -4.084 6.477 6.304 1.00 0.00 H new ATOM 0 HA GLU A 9 -3.410 8.750 4.783 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -4.421 8.377 7.625 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -4.157 9.962 6.925 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -5.891 7.788 5.635 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -6.529 9.100 6.605 1.00 0.00 H new ATOM 124 N THR A 10 -1.331 7.979 7.166 1.00 0.00 N ATOM 125 CA THR A 10 0.007 8.249 7.654 1.00 0.00 C ATOM 126 C THR A 10 0.990 8.221 6.476 1.00 0.00 C ATOM 127 O THR A 10 1.805 9.136 6.300 1.00 0.00 O ATOM 128 CB THR A 10 0.391 7.227 8.746 1.00 0.00 C ATOM 129 OG1 THR A 10 -0.673 7.130 9.702 1.00 0.00 O ATOM 130 CG2 THR A 10 1.668 7.669 9.475 1.00 0.00 C ATOM 0 H THR A 10 -1.774 7.153 7.570 1.00 0.00 H new ATOM 0 HA THR A 10 0.046 9.239 8.108 1.00 0.00 H new ATOM 0 HB THR A 10 0.565 6.262 8.271 1.00 0.00 H new ATOM 0 HG1 THR A 10 -1.366 6.528 9.360 1.00 0.00 H new ATOM 0 HG21 THR A 10 1.922 6.936 10.241 1.00 0.00 H new ATOM 0 HG22 THR A 10 2.487 7.746 8.760 1.00 0.00 H new ATOM 0 HG23 THR A 10 1.503 8.640 9.943 1.00 0.00 H new ATOM 138 N LEU A 11 0.832 7.230 5.611 1.00 0.00 N ATOM 139 CA LEU A 11 1.642 7.138 4.399 1.00 0.00 C ATOM 140 C LEU A 11 1.379 8.343 3.482 1.00 0.00 C ATOM 141 O LEU A 11 2.304 8.885 2.868 1.00 0.00 O ATOM 142 CB LEU A 11 1.367 5.814 3.654 1.00 0.00 C ATOM 143 CG LEU A 11 1.895 4.613 4.472 1.00 0.00 C ATOM 144 CD1 LEU A 11 1.390 3.310 3.852 1.00 0.00 C ATOM 145 CD2 LEU A 11 3.433 4.591 4.469 1.00 0.00 C ATOM 0 H LEU A 11 0.152 6.478 5.723 1.00 0.00 H new ATOM 0 HA LEU A 11 2.693 7.150 4.689 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.296 5.702 3.482 1.00 0.00 H new ATOM 0 HB3 LEU A 11 1.847 5.834 2.675 1.00 0.00 H new ATOM 0 HG LEU A 11 1.536 4.711 5.497 1.00 0.00 H new ATOM 0 HD11 LEU A 11 1.763 2.464 4.429 1.00 0.00 H new ATOM 0 HD12 LEU A 11 0.300 3.302 3.859 1.00 0.00 H new ATOM 0 HD13 LEU A 11 1.747 3.234 2.825 1.00 0.00 H new ATOM 0 HD21 LEU A 11 3.786 3.739 5.050 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.794 4.506 3.444 1.00 0.00 H new ATOM 0 HD23 LEU A 11 3.811 5.513 4.911 1.00 0.00 H new ATOM 157 N ILE A 12 0.118 8.758 3.392 1.00 0.00 N ATOM 158 CA ILE A 12 -0.253 9.890 2.533 1.00 0.00 C ATOM 159 C ILE A 12 0.457 11.153 3.015 1.00 0.00 C ATOM 160 O ILE A 12 0.999 11.924 2.213 1.00 0.00 O ATOM 161 CB ILE A 12 -1.779 10.119 2.579 1.00 0.00 C ATOM 162 CG1 ILE A 12 -2.539 8.951 1.924 1.00 0.00 C ATOM 163 CG2 ILE A 12 -2.136 11.421 1.854 1.00 0.00 C ATOM 164 CD1 ILE A 12 -2.346 8.961 0.399 1.00 0.00 C ATOM 0 H ILE A 12 -0.661 8.335 3.896 1.00 0.00 H new ATOM 0 HA ILE A 12 0.045 9.665 1.509 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.074 10.184 3.626 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -2.184 8.005 2.334 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.600 9.023 2.161 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -3.215 11.574 1.891 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.633 12.257 2.340 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.814 11.359 0.814 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.892 8.127 -0.042 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -2.723 9.898 -0.009 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.286 8.865 0.166 1.00 0.00 H new ATOM 176 N ASN A 13 0.473 11.349 4.318 1.00 0.00 N ATOM 177 CA ASN A 13 1.108 12.532 4.891 1.00 0.00 C ATOM 178 C ASN A 13 2.574 12.548 4.520 1.00 0.00 C ATOM 179 O ASN A 13 3.110 13.574 4.096 1.00 0.00 O ATOM 180 CB ASN A 13 0.989 12.502 6.413 1.00 0.00 C ATOM 181 CG ASN A 13 -0.425 12.847 6.835 1.00 0.00 C ATOM 182 OD1 ASN A 13 -0.978 13.870 6.407 1.00 0.00 O ATOM 183 ND2 ASN A 13 -1.055 12.052 7.634 1.00 0.00 N ATOM 0 H ASN A 13 0.059 10.714 5.000 1.00 0.00 H new ATOM 0 HA ASN A 13 0.613 13.421 4.501 1.00 0.00 H new ATOM 0 HB2 ASN A 13 1.257 11.514 6.786 1.00 0.00 H new ATOM 0 HB3 ASN A 13 1.691 13.210 6.854 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -2.012 12.265 7.915 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.596 11.211 7.984 1.00 0.00 H new ATOM 190 N VAL A 14 3.197 11.388 4.595 1.00 0.00 N ATOM 191 CA VAL A 14 4.585 11.252 4.203 1.00 0.00 C ATOM 192 C VAL A 14 4.732 11.563 2.715 1.00 0.00 C ATOM 193 O VAL A 14 5.633 12.304 2.298 1.00 0.00 O ATOM 194 CB VAL A 14 5.071 9.823 4.495 1.00 0.00 C ATOM 195 CG1 VAL A 14 6.515 9.659 4.029 1.00 0.00 C ATOM 196 CG2 VAL A 14 4.983 9.541 5.997 1.00 0.00 C ATOM 0 H VAL A 14 2.763 10.526 4.924 1.00 0.00 H new ATOM 0 HA VAL A 14 5.192 11.955 4.774 1.00 0.00 H new ATOM 0 HB VAL A 14 4.438 9.117 3.957 1.00 0.00 H new ATOM 0 HG11 VAL A 14 6.852 8.644 4.239 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.575 9.846 2.957 1.00 0.00 H new ATOM 0 HG13 VAL A 14 7.151 10.369 4.558 1.00 0.00 H new ATOM 0 HG21 VAL A 14 5.329 8.527 6.198 1.00 0.00 H new ATOM 0 HG22 VAL A 14 5.608 10.251 6.538 1.00 0.00 H new ATOM 0 HG23 VAL A 14 3.949 9.644 6.327 1.00 0.00 H new ATOM 206 N PHE A 15 3.835 11.005 1.927 1.00 0.00 N ATOM 207 CA PHE A 15 3.854 11.205 0.492 1.00 0.00 C ATOM 208 C PHE A 15 3.737 12.689 0.181 1.00 0.00 C ATOM 209 O PHE A 15 4.526 13.239 -0.601 1.00 0.00 O ATOM 210 CB PHE A 15 2.697 10.440 -0.153 1.00 0.00 C ATOM 211 CG PHE A 15 2.805 10.501 -1.663 1.00 0.00 C ATOM 212 CD1 PHE A 15 3.618 9.586 -2.336 1.00 0.00 C ATOM 213 CD2 PHE A 15 2.092 11.463 -2.388 1.00 0.00 C ATOM 214 CE1 PHE A 15 3.718 9.627 -3.729 1.00 0.00 C ATOM 215 CE2 PHE A 15 2.197 11.505 -3.782 1.00 0.00 C ATOM 216 CZ PHE A 15 3.008 10.584 -4.452 1.00 0.00 C ATOM 0 H PHE A 15 3.079 10.406 2.259 1.00 0.00 H new ATOM 0 HA PHE A 15 4.794 10.830 0.088 1.00 0.00 H new ATOM 0 HB2 PHE A 15 2.709 9.401 0.178 1.00 0.00 H new ATOM 0 HB3 PHE A 15 1.746 10.866 0.168 1.00 0.00 H new ATOM 0 HD1 PHE A 15 4.171 8.845 -1.778 1.00 0.00 H new ATOM 0 HD2 PHE A 15 1.462 12.172 -1.872 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.346 8.917 -4.246 1.00 0.00 H new ATOM 0 HE2 PHE A 15 1.651 12.250 -4.342 1.00 0.00 H new ATOM 0 HZ PHE A 15 3.084 10.614 -5.529 1.00 0.00 H new ATOM 226 N HIS A 16 2.798 13.352 0.855 1.00 0.00 N ATOM 227 CA HIS A 16 2.620 14.796 0.685 1.00 0.00 C ATOM 228 C HIS A 16 3.907 15.524 0.994 1.00 0.00 C ATOM 229 O HIS A 16 4.302 16.449 0.277 1.00 0.00 O ATOM 230 CB HIS A 16 1.551 15.326 1.646 1.00 0.00 C ATOM 231 CG HIS A 16 0.206 15.350 0.995 1.00 0.00 C ATOM 232 ND1 HIS A 16 -0.027 16.021 -0.196 1.00 0.00 N ATOM 233 CD2 HIS A 16 -0.994 14.828 1.376 1.00 0.00 C ATOM 234 CE1 HIS A 16 -1.331 15.884 -0.480 1.00 0.00 C ATOM 235 NE2 HIS A 16 -1.964 15.165 0.451 1.00 0.00 N ATOM 0 H HIS A 16 2.154 12.919 1.517 1.00 0.00 H new ATOM 0 HA HIS A 16 2.319 14.968 -0.348 1.00 0.00 H new ATOM 0 HB2 HIS A 16 1.516 14.699 2.537 1.00 0.00 H new ATOM 0 HB3 HIS A 16 1.818 16.331 1.973 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -1.162 14.240 2.266 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -1.810 16.303 -1.353 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -2.953 14.917 0.474 1.00 0.00 H new ATOM 244 N ALA A 17 4.524 15.150 2.102 1.00 0.00 N ATOM 245 CA ALA A 17 5.705 15.841 2.562 1.00 0.00 C ATOM 246 C ALA A 17 6.791 15.829 1.506 1.00 0.00 C ATOM 247 O ALA A 17 7.322 16.872 1.147 1.00 0.00 O ATOM 248 CB ALA A 17 6.220 15.219 3.859 1.00 0.00 C ATOM 0 H ALA A 17 4.225 14.375 2.694 1.00 0.00 H new ATOM 0 HA ALA A 17 5.431 16.878 2.756 1.00 0.00 H new ATOM 0 HB1 ALA A 17 7.111 15.753 4.190 1.00 0.00 H new ATOM 0 HB2 ALA A 17 5.449 15.288 4.627 1.00 0.00 H new ATOM 0 HB3 ALA A 17 6.468 14.172 3.687 1.00 0.00 H new ATOM 254 N HIS A 18 7.104 14.654 1.001 1.00 0.00 N ATOM 255 CA HIS A 18 8.143 14.515 -0.015 1.00 0.00 C ATOM 256 C HIS A 18 7.728 15.139 -1.338 1.00 0.00 C ATOM 257 O HIS A 18 8.548 15.769 -2.017 1.00 0.00 O ATOM 258 CB HIS A 18 8.543 13.059 -0.190 1.00 0.00 C ATOM 259 CG HIS A 18 9.299 12.621 1.033 1.00 0.00 C ATOM 260 ND1 HIS A 18 10.650 12.903 1.217 1.00 0.00 N ATOM 261 CD2 HIS A 18 8.899 11.945 2.153 1.00 0.00 C ATOM 262 CE1 HIS A 18 11.002 12.396 2.415 1.00 0.00 C ATOM 263 NE2 HIS A 18 9.973 11.804 3.026 1.00 0.00 N ATOM 0 H HIS A 18 6.658 13.778 1.273 1.00 0.00 H new ATOM 0 HA HIS A 18 9.017 15.063 0.336 1.00 0.00 H new ATOM 0 HB2 HIS A 18 7.659 12.438 -0.331 1.00 0.00 H new ATOM 0 HB3 HIS A 18 9.161 12.940 -1.080 1.00 0.00 H new ATOM 0 HD1 HIS A 18 11.259 13.400 0.567 1.00 0.00 H new ATOM 0 HD2 HIS A 18 7.900 11.576 2.332 1.00 0.00 H new ATOM 0 HE1 HIS A 18 11.997 12.461 2.831 1.00 0.00 H new ATOM 272 N SER A 19 6.449 15.011 -1.684 1.00 0.00 N ATOM 273 CA SER A 19 5.944 15.613 -2.915 1.00 0.00 C ATOM 274 C SER A 19 6.297 17.093 -2.918 1.00 0.00 C ATOM 275 O SER A 19 6.792 17.637 -3.911 1.00 0.00 O ATOM 276 CB SER A 19 4.419 15.454 -2.992 1.00 0.00 C ATOM 277 OG SER A 19 4.070 14.070 -2.906 1.00 0.00 O ATOM 0 H SER A 19 5.752 14.504 -1.138 1.00 0.00 H new ATOM 0 HA SER A 19 6.395 15.117 -3.774 1.00 0.00 H new ATOM 0 HB2 SER A 19 3.945 16.009 -2.182 1.00 0.00 H new ATOM 0 HB3 SER A 19 4.047 15.875 -3.926 1.00 0.00 H new ATOM 0 HG SER A 19 3.802 13.857 -1.988 1.00 0.00 H new ATOM 283 N GLY A 20 6.133 17.710 -1.764 1.00 0.00 N ATOM 284 CA GLY A 20 6.502 19.096 -1.590 1.00 0.00 C ATOM 285 C GLY A 20 8.004 19.281 -1.736 1.00 0.00 C ATOM 286 O GLY A 20 8.463 20.282 -2.294 1.00 0.00 O ATOM 0 H GLY A 20 5.744 17.268 -0.931 1.00 0.00 H new ATOM 0 HA2 GLY A 20 5.983 19.710 -2.326 1.00 0.00 H new ATOM 0 HA3 GLY A 20 6.183 19.440 -0.606 1.00 0.00 H new ATOM 290 N LYS A 21 8.779 18.340 -1.198 1.00 0.00 N ATOM 291 CA LYS A 21 10.232 18.482 -1.211 1.00 0.00 C ATOM 292 C LYS A 21 10.749 18.469 -2.627 1.00 0.00 C ATOM 293 O LYS A 21 11.613 19.274 -2.985 1.00 0.00 O ATOM 294 CB LYS A 21 10.915 17.354 -0.420 1.00 0.00 C ATOM 295 CG LYS A 21 10.414 17.347 1.022 1.00 0.00 C ATOM 296 CD LYS A 21 10.719 18.672 1.726 1.00 0.00 C ATOM 297 CE LYS A 21 9.883 18.750 3.005 1.00 0.00 C ATOM 298 NZ LYS A 21 8.463 18.463 2.673 1.00 0.00 N ATOM 0 H LYS A 21 8.433 17.488 -0.756 1.00 0.00 H new ATOM 0 HA LYS A 21 10.468 19.435 -0.739 1.00 0.00 H new ATOM 0 HB2 LYS A 21 10.708 16.393 -0.890 1.00 0.00 H new ATOM 0 HB3 LYS A 21 11.996 17.490 -0.437 1.00 0.00 H new ATOM 0 HG2 LYS A 21 9.339 17.166 1.034 1.00 0.00 H new ATOM 0 HG3 LYS A 21 10.882 16.527 1.567 1.00 0.00 H new ATOM 0 HD2 LYS A 21 11.781 18.738 1.964 1.00 0.00 H new ATOM 0 HD3 LYS A 21 10.486 19.511 1.070 1.00 0.00 H new ATOM 0 HE2 LYS A 21 10.250 18.033 3.739 1.00 0.00 H new ATOM 0 HE3 LYS A 21 9.972 19.739 3.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 7.860 18.710 3.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 8.179 19.026 1.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 8.355 17.452 2.457 1.00 0.00 H new ATOM 312 N GLU A 22 10.254 17.537 -3.430 1.00 0.00 N ATOM 313 CA GLU A 22 10.711 17.441 -4.803 1.00 0.00 C ATOM 314 C GLU A 22 10.182 18.589 -5.652 1.00 0.00 C ATOM 315 O GLU A 22 10.936 19.211 -6.394 1.00 0.00 O ATOM 316 CB GLU A 22 10.405 16.072 -5.420 1.00 0.00 C ATOM 317 CG GLU A 22 8.897 15.826 -5.501 1.00 0.00 C ATOM 318 CD GLU A 22 8.520 15.543 -6.937 1.00 0.00 C ATOM 319 OE1 GLU A 22 8.313 16.494 -7.666 1.00 0.00 O ATOM 320 OE2 GLU A 22 8.480 14.394 -7.302 1.00 0.00 O ATOM 0 H GLU A 22 9.550 16.851 -3.159 1.00 0.00 H new ATOM 0 HA GLU A 22 11.797 17.533 -4.786 1.00 0.00 H new ATOM 0 HB2 GLU A 22 10.840 16.015 -6.418 1.00 0.00 H new ATOM 0 HB3 GLU A 22 10.872 15.289 -4.823 1.00 0.00 H new ATOM 0 HG2 GLU A 22 8.618 14.985 -4.866 1.00 0.00 H new ATOM 0 HG3 GLU A 22 8.353 16.697 -5.134 1.00 0.00 H new ATOM 327 N GLY A 23 8.915 18.948 -5.455 1.00 0.00 N ATOM 328 CA GLY A 23 8.349 20.101 -6.151 1.00 0.00 C ATOM 329 C GLY A 23 6.954 19.836 -6.703 1.00 0.00 C ATOM 330 O GLY A 23 6.299 20.763 -7.200 1.00 0.00 O ATOM 0 H GLY A 23 8.270 18.466 -4.829 1.00 0.00 H new ATOM 0 HA2 GLY A 23 8.308 20.948 -5.466 1.00 0.00 H new ATOM 0 HA3 GLY A 23 9.010 20.385 -6.970 1.00 0.00 H new ATOM 334 N ASP A 24 6.501 18.587 -6.653 1.00 0.00 N ATOM 335 CA ASP A 24 5.180 18.263 -7.189 1.00 0.00 C ATOM 336 C ASP A 24 4.094 18.618 -6.205 1.00 0.00 C ATOM 337 O ASP A 24 4.271 18.463 -4.993 1.00 0.00 O ATOM 338 CB ASP A 24 5.043 16.788 -7.547 1.00 0.00 C ATOM 339 CG ASP A 24 3.936 16.640 -8.568 1.00 0.00 C ATOM 340 OD1 ASP A 24 2.789 16.611 -8.180 1.00 0.00 O ATOM 341 OD2 ASP A 24 4.246 16.579 -9.733 1.00 0.00 O ATOM 0 H ASP A 24 7.013 17.799 -6.257 1.00 0.00 H new ATOM 0 HA ASP A 24 5.072 18.855 -8.098 1.00 0.00 H new ATOM 0 HB2 ASP A 24 5.982 16.408 -7.949 1.00 0.00 H new ATOM 0 HB3 ASP A 24 4.817 16.202 -6.656 1.00 0.00 H new ATOM 346 N LYS A 25 2.931 18.963 -6.722 1.00 0.00 N ATOM 347 CA LYS A 25 1.773 19.162 -5.873 1.00 0.00 C ATOM 348 C LYS A 25 1.407 17.832 -5.222 1.00 0.00 C ATOM 349 O LYS A 25 1.204 17.758 -4.004 1.00 0.00 O ATOM 350 CB LYS A 25 0.587 19.720 -6.666 1.00 0.00 C ATOM 351 CG LYS A 25 0.331 18.850 -7.902 1.00 0.00 C ATOM 352 CD LYS A 25 -0.902 19.357 -8.647 1.00 0.00 C ATOM 353 CE LYS A 25 -1.172 18.432 -9.835 1.00 0.00 C ATOM 354 NZ LYS A 25 -2.518 18.705 -10.398 1.00 0.00 N ATOM 0 H LYS A 25 2.763 19.110 -7.717 1.00 0.00 H new ATOM 0 HA LYS A 25 2.018 19.895 -5.104 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -0.303 19.745 -6.037 1.00 0.00 H new ATOM 0 HB3 LYS A 25 0.792 20.747 -6.969 1.00 0.00 H new ATOM 0 HG2 LYS A 25 1.200 18.873 -8.560 1.00 0.00 H new ATOM 0 HG3 LYS A 25 0.185 17.812 -7.603 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -1.764 19.378 -7.981 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -0.742 20.378 -8.992 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -0.412 18.580 -10.602 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -1.106 17.391 -9.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -2.526 18.466 -11.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -3.226 18.128 -9.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -2.746 19.713 -10.279 1.00 0.00 H new ATOM 368 N TYR A 26 1.516 16.761 -6.007 1.00 0.00 N ATOM 369 CA TYR A 26 1.409 15.406 -5.490 1.00 0.00 C ATOM 370 C TYR A 26 1.984 14.388 -6.480 1.00 0.00 C ATOM 371 O TYR A 26 1.248 13.744 -7.239 1.00 0.00 O ATOM 372 CB TYR A 26 -0.053 15.052 -5.126 1.00 0.00 C ATOM 373 CG TYR A 26 -1.034 15.633 -6.144 1.00 0.00 C ATOM 374 CD1 TYR A 26 -1.346 14.927 -7.313 1.00 0.00 C ATOM 375 CD2 TYR A 26 -1.634 16.874 -5.902 1.00 0.00 C ATOM 376 CE1 TYR A 26 -2.250 15.463 -8.237 1.00 0.00 C ATOM 377 CE2 TYR A 26 -2.536 17.412 -6.826 1.00 0.00 C ATOM 378 CZ TYR A 26 -2.846 16.708 -7.995 1.00 0.00 C ATOM 379 OH TYR A 26 -3.728 17.246 -8.921 1.00 0.00 O ATOM 0 H TYR A 26 1.680 16.812 -7.012 1.00 0.00 H new ATOM 0 HA TYR A 26 2.000 15.360 -4.576 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -0.168 13.969 -5.084 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -0.286 15.436 -4.133 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -0.888 13.967 -7.501 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -1.400 17.418 -4.999 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -2.489 14.917 -9.138 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -2.994 18.372 -6.637 1.00 0.00 H new ATOM 0 HH TYR A 26 -4.221 17.987 -8.511 1.00 0.00 H new ATOM 389 N LYS A 27 3.253 14.103 -6.289 1.00 0.00 N ATOM 390 CA LYS A 27 3.999 13.036 -6.955 1.00 0.00 C ATOM 391 C LYS A 27 5.249 12.833 -6.144 1.00 0.00 C ATOM 392 O LYS A 27 5.622 13.716 -5.370 1.00 0.00 O ATOM 393 CB LYS A 27 4.410 13.379 -8.407 1.00 0.00 C ATOM 394 CG LYS A 27 3.195 13.502 -9.349 1.00 0.00 C ATOM 395 CD LYS A 27 2.481 12.142 -9.509 1.00 0.00 C ATOM 396 CE LYS A 27 3.191 11.288 -10.568 1.00 0.00 C ATOM 397 NZ LYS A 27 3.235 12.011 -11.863 1.00 0.00 N ATOM 0 H LYS A 27 3.830 14.631 -5.634 1.00 0.00 H new ATOM 0 HA LYS A 27 3.364 12.152 -7.016 1.00 0.00 H new ATOM 0 HB2 LYS A 27 4.967 14.316 -8.412 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.081 12.607 -8.783 1.00 0.00 H new ATOM 0 HG2 LYS A 27 2.497 14.239 -8.954 1.00 0.00 H new ATOM 0 HG3 LYS A 27 3.521 13.863 -10.324 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.470 11.615 -8.555 1.00 0.00 H new ATOM 0 HD3 LYS A 27 1.442 12.301 -9.797 1.00 0.00 H new ATOM 0 HE2 LYS A 27 4.204 11.055 -10.239 1.00 0.00 H new ATOM 0 HE3 LYS A 27 2.669 10.339 -10.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 3.311 11.325 -12.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 2.366 12.571 -11.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 4.059 12.645 -11.879 1.00 0.00 H new ATOM 411 N LEU A 28 5.913 11.721 -6.326 1.00 0.00 N ATOM 412 CA LEU A 28 7.136 11.490 -5.610 1.00 0.00 C ATOM 413 C LEU A 28 8.268 11.203 -6.584 1.00 0.00 C ATOM 414 O LEU A 28 8.131 10.387 -7.502 1.00 0.00 O ATOM 415 CB LEU A 28 6.947 10.344 -4.610 1.00 0.00 C ATOM 416 CG LEU A 28 8.248 10.060 -3.865 1.00 0.00 C ATOM 417 CD1 LEU A 28 8.561 11.219 -2.922 1.00 0.00 C ATOM 418 CD2 LEU A 28 8.084 8.777 -3.060 1.00 0.00 C ATOM 0 H LEU A 28 5.630 10.971 -6.956 1.00 0.00 H new ATOM 0 HA LEU A 28 7.402 12.385 -5.048 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.163 10.601 -3.898 1.00 0.00 H new ATOM 0 HB3 LEU A 28 6.619 9.447 -5.135 1.00 0.00 H new ATOM 0 HG LEU A 28 9.066 9.948 -4.577 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.490 11.015 -2.391 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.667 12.138 -3.498 1.00 0.00 H new ATOM 0 HD13 LEU A 28 7.749 11.333 -2.203 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.008 8.564 -2.523 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.269 8.897 -2.346 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.857 7.951 -3.734 1.00 0.00 H new ATOM 430 N SER A 29 9.362 11.914 -6.420 1.00 0.00 N ATOM 431 CA SER A 29 10.517 11.742 -7.274 1.00 0.00 C ATOM 432 C SER A 29 11.330 10.555 -6.810 1.00 0.00 C ATOM 433 O SER A 29 11.201 10.106 -5.659 1.00 0.00 O ATOM 434 CB SER A 29 11.368 13.006 -7.262 1.00 0.00 C ATOM 435 OG SER A 29 11.585 13.404 -5.910 1.00 0.00 O ATOM 0 H SER A 29 9.476 12.623 -5.696 1.00 0.00 H new ATOM 0 HA SER A 29 10.181 11.558 -8.295 1.00 0.00 H new ATOM 0 HB2 SER A 29 12.321 12.824 -7.759 1.00 0.00 H new ATOM 0 HB3 SER A 29 10.868 13.802 -7.814 1.00 0.00 H new ATOM 0 HG SER A 29 11.351 12.665 -5.310 1.00 0.00 H new ATOM 441 N LYS A 30 12.210 10.072 -7.658 1.00 0.00 N ATOM 442 CA LYS A 30 13.073 8.980 -7.265 1.00 0.00 C ATOM 443 C LYS A 30 14.169 9.492 -6.353 1.00 0.00 C ATOM 444 O LYS A 30 14.966 8.706 -5.828 1.00 0.00 O ATOM 445 CB LYS A 30 13.662 8.258 -8.479 1.00 0.00 C ATOM 446 CG LYS A 30 12.567 7.967 -9.539 1.00 0.00 C ATOM 447 CD LYS A 30 11.252 7.475 -8.875 1.00 0.00 C ATOM 448 CE LYS A 30 11.331 5.974 -8.545 1.00 0.00 C ATOM 449 NZ LYS A 30 11.710 5.212 -9.751 1.00 0.00 N ATOM 0 H LYS A 30 12.347 10.411 -8.610 1.00 0.00 H new ATOM 0 HA LYS A 30 12.472 8.251 -6.721 1.00 0.00 H new ATOM 0 HB2 LYS A 30 14.449 8.868 -8.922 1.00 0.00 H new ATOM 0 HB3 LYS A 30 14.124 7.323 -8.162 1.00 0.00 H new ATOM 0 HG2 LYS A 30 12.369 8.870 -10.117 1.00 0.00 H new ATOM 0 HG3 LYS A 30 12.927 7.213 -10.239 1.00 0.00 H new ATOM 0 HD2 LYS A 30 11.066 8.042 -7.963 1.00 0.00 H new ATOM 0 HD3 LYS A 30 10.411 7.661 -9.543 1.00 0.00 H new ATOM 0 HE2 LYS A 30 12.061 5.805 -7.754 1.00 0.00 H new ATOM 0 HE3 LYS A 30 10.369 5.624 -8.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 11.581 4.195 -9.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 11.110 5.503 -10.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 12.707 5.400 -9.981 1.00 0.00 H new ATOM 463 N LYS A 31 14.187 10.817 -6.163 1.00 0.00 N ATOM 464 CA LYS A 31 15.133 11.468 -5.269 1.00 0.00 C ATOM 465 C LYS A 31 14.687 11.196 -3.842 1.00 0.00 C ATOM 466 O LYS A 31 15.375 10.550 -3.055 1.00 0.00 O ATOM 467 CB LYS A 31 15.074 13.004 -5.461 1.00 0.00 C ATOM 468 CG LYS A 31 15.061 13.389 -6.937 1.00 0.00 C ATOM 469 CD LYS A 31 14.763 14.892 -7.052 1.00 0.00 C ATOM 470 CE LYS A 31 14.624 15.280 -8.527 1.00 0.00 C ATOM 471 NZ LYS A 31 15.970 15.377 -9.151 1.00 0.00 N ATOM 0 H LYS A 31 13.545 11.460 -6.626 1.00 0.00 H new ATOM 0 HA LYS A 31 16.136 11.095 -5.474 1.00 0.00 H new ATOM 0 HB2 LYS A 31 14.181 13.397 -4.975 1.00 0.00 H new ATOM 0 HB3 LYS A 31 15.932 13.465 -4.972 1.00 0.00 H new ATOM 0 HG2 LYS A 31 16.022 13.158 -7.396 1.00 0.00 H new ATOM 0 HG3 LYS A 31 14.306 12.812 -7.471 1.00 0.00 H new ATOM 0 HD2 LYS A 31 13.846 15.133 -6.515 1.00 0.00 H new ATOM 0 HD3 LYS A 31 15.564 15.468 -6.589 1.00 0.00 H new ATOM 0 HE2 LYS A 31 14.022 14.539 -9.052 1.00 0.00 H new ATOM 0 HE3 LYS A 31 14.103 16.233 -8.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 15.870 15.641 -10.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 16.531 16.100 -8.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 16.452 14.458 -9.081 1.00 0.00 H new ATOM 485 N GLU A 32 13.502 11.710 -3.539 1.00 0.00 N ATOM 486 CA GLU A 32 12.911 11.626 -2.226 1.00 0.00 C ATOM 487 C GLU A 32 12.552 10.208 -1.865 1.00 0.00 C ATOM 488 O GLU A 32 12.658 9.820 -0.718 1.00 0.00 O ATOM 489 CB GLU A 32 11.664 12.503 -2.177 1.00 0.00 C ATOM 490 CG GLU A 32 12.062 13.982 -2.295 1.00 0.00 C ATOM 491 CD GLU A 32 12.865 14.411 -1.083 1.00 0.00 C ATOM 492 OE1 GLU A 32 12.414 14.176 0.017 1.00 0.00 O ATOM 493 OE2 GLU A 32 13.927 14.962 -1.271 1.00 0.00 O ATOM 0 H GLU A 32 12.921 12.204 -4.216 1.00 0.00 H new ATOM 0 HA GLU A 32 13.645 11.976 -1.500 1.00 0.00 H new ATOM 0 HB2 GLU A 32 10.987 12.234 -2.988 1.00 0.00 H new ATOM 0 HB3 GLU A 32 11.127 12.335 -1.244 1.00 0.00 H new ATOM 0 HG2 GLU A 32 12.648 14.136 -3.201 1.00 0.00 H new ATOM 0 HG3 GLU A 32 11.168 14.600 -2.384 1.00 0.00 H new ATOM 500 N LEU A 33 12.081 9.447 -2.837 1.00 0.00 N ATOM 501 CA LEU A 33 11.615 8.096 -2.558 1.00 0.00 C ATOM 502 C LEU A 33 12.736 7.271 -1.948 1.00 0.00 C ATOM 503 O LEU A 33 12.531 6.584 -0.946 1.00 0.00 O ATOM 504 CB LEU A 33 11.111 7.438 -3.854 1.00 0.00 C ATOM 505 CG LEU A 33 10.631 5.980 -3.623 1.00 0.00 C ATOM 506 CD1 LEU A 33 11.829 5.019 -3.594 1.00 0.00 C ATOM 507 CD2 LEU A 33 9.827 5.856 -2.315 1.00 0.00 C ATOM 0 H LEU A 33 12.010 9.734 -3.813 1.00 0.00 H new ATOM 0 HA LEU A 33 10.792 8.144 -1.845 1.00 0.00 H new ATOM 0 HB2 LEU A 33 10.291 8.028 -4.264 1.00 0.00 H new ATOM 0 HB3 LEU A 33 11.909 7.443 -4.596 1.00 0.00 H new ATOM 0 HG LEU A 33 9.977 5.711 -4.452 1.00 0.00 H new ATOM 0 HD11 LEU A 33 11.475 4.001 -3.431 1.00 0.00 H new ATOM 0 HD12 LEU A 33 12.360 5.071 -4.544 1.00 0.00 H new ATOM 0 HD13 LEU A 33 12.503 5.302 -2.786 1.00 0.00 H new ATOM 0 HD21 LEU A 33 9.505 4.823 -2.182 1.00 0.00 H new ATOM 0 HD22 LEU A 33 10.453 6.152 -1.473 1.00 0.00 H new ATOM 0 HD23 LEU A 33 8.953 6.505 -2.362 1.00 0.00 H new ATOM 519 N LYS A 34 13.937 7.389 -2.496 1.00 0.00 N ATOM 520 CA LYS A 34 15.063 6.641 -1.947 1.00 0.00 C ATOM 521 C LYS A 34 15.324 7.084 -0.523 1.00 0.00 C ATOM 522 O LYS A 34 15.425 6.264 0.395 1.00 0.00 O ATOM 523 CB LYS A 34 16.326 6.926 -2.758 1.00 0.00 C ATOM 524 CG LYS A 34 16.212 6.353 -4.167 1.00 0.00 C ATOM 525 CD LYS A 34 17.491 6.696 -4.945 1.00 0.00 C ATOM 526 CE LYS A 34 17.418 6.103 -6.346 1.00 0.00 C ATOM 527 NZ LYS A 34 16.259 6.694 -7.054 1.00 0.00 N ATOM 0 H LYS A 34 14.156 7.979 -3.299 1.00 0.00 H new ATOM 0 HA LYS A 34 14.820 5.579 -1.983 1.00 0.00 H new ATOM 0 HB2 LYS A 34 16.493 8.002 -2.812 1.00 0.00 H new ATOM 0 HB3 LYS A 34 17.191 6.494 -2.255 1.00 0.00 H new ATOM 0 HG2 LYS A 34 16.074 5.273 -4.125 1.00 0.00 H new ATOM 0 HG3 LYS A 34 15.340 6.766 -4.673 1.00 0.00 H new ATOM 0 HD2 LYS A 34 17.613 7.778 -5.004 1.00 0.00 H new ATOM 0 HD3 LYS A 34 18.363 6.305 -4.420 1.00 0.00 H new ATOM 0 HE2 LYS A 34 18.339 6.309 -6.892 1.00 0.00 H new ATOM 0 HE3 LYS A 34 17.315 5.019 -6.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 16.554 7.010 -8.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 15.508 5.981 -7.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 15.900 7.507 -6.514 1.00 0.00 H new ATOM 541 N GLU A 35 15.349 8.386 -0.342 1.00 0.00 N ATOM 542 CA GLU A 35 15.562 8.985 0.952 1.00 0.00 C ATOM 543 C GLU A 35 14.404 8.653 1.861 1.00 0.00 C ATOM 544 O GLU A 35 14.584 8.221 2.997 1.00 0.00 O ATOM 545 CB GLU A 35 15.675 10.495 0.766 1.00 0.00 C ATOM 546 CG GLU A 35 15.996 11.185 2.093 1.00 0.00 C ATOM 547 CD GLU A 35 16.274 12.652 1.853 1.00 0.00 C ATOM 548 OE1 GLU A 35 16.666 12.998 0.756 1.00 0.00 O ATOM 549 OE2 GLU A 35 16.073 13.415 2.754 1.00 0.00 O ATOM 0 H GLU A 35 15.221 9.061 -1.095 1.00 0.00 H new ATOM 0 HA GLU A 35 16.476 8.600 1.405 1.00 0.00 H new ATOM 0 HB2 GLU A 35 16.454 10.719 0.037 1.00 0.00 H new ATOM 0 HB3 GLU A 35 14.741 10.887 0.364 1.00 0.00 H new ATOM 0 HG2 GLU A 35 15.160 11.072 2.784 1.00 0.00 H new ATOM 0 HG3 GLU A 35 16.861 10.713 2.559 1.00 0.00 H new ATOM 556 N LEU A 36 13.232 8.776 1.317 1.00 0.00 N ATOM 557 CA LEU A 36 12.005 8.469 2.002 1.00 0.00 C ATOM 558 C LEU A 36 11.944 7.023 2.426 1.00 0.00 C ATOM 559 O LEU A 36 11.624 6.717 3.581 1.00 0.00 O ATOM 560 CB LEU A 36 10.859 8.789 1.034 1.00 0.00 C ATOM 561 CG LEU A 36 9.539 8.178 1.480 1.00 0.00 C ATOM 562 CD1 LEU A 36 9.163 8.635 2.882 1.00 0.00 C ATOM 563 CD2 LEU A 36 8.449 8.597 0.494 1.00 0.00 C ATOM 0 H LEU A 36 13.095 9.101 0.360 1.00 0.00 H new ATOM 0 HA LEU A 36 11.933 9.062 2.914 1.00 0.00 H new ATOM 0 HB2 LEU A 36 10.747 9.870 0.952 1.00 0.00 H new ATOM 0 HB3 LEU A 36 11.111 8.418 0.041 1.00 0.00 H new ATOM 0 HG LEU A 36 9.642 7.093 1.499 1.00 0.00 H new ATOM 0 HD11 LEU A 36 8.215 8.181 3.171 1.00 0.00 H new ATOM 0 HD12 LEU A 36 9.940 8.332 3.584 1.00 0.00 H new ATOM 0 HD13 LEU A 36 9.064 9.720 2.897 1.00 0.00 H new ATOM 0 HD21 LEU A 36 7.496 8.166 0.801 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.369 9.684 0.481 1.00 0.00 H new ATOM 0 HD23 LEU A 36 8.704 8.240 -0.504 1.00 0.00 H new ATOM 575 N LEU A 37 12.241 6.139 1.511 1.00 0.00 N ATOM 576 CA LEU A 37 12.152 4.732 1.800 1.00 0.00 C ATOM 577 C LEU A 37 13.147 4.341 2.893 1.00 0.00 C ATOM 578 O LEU A 37 12.774 3.718 3.892 1.00 0.00 O ATOM 579 CB LEU A 37 12.337 3.905 0.505 1.00 0.00 C ATOM 580 CG LEU A 37 12.175 2.389 0.749 1.00 0.00 C ATOM 581 CD1 LEU A 37 13.494 1.780 1.218 1.00 0.00 C ATOM 582 CD2 LEU A 37 11.080 2.115 1.783 1.00 0.00 C ATOM 0 H LEU A 37 12.545 6.366 0.564 1.00 0.00 H new ATOM 0 HA LEU A 37 11.157 4.508 2.186 1.00 0.00 H new ATOM 0 HB2 LEU A 37 11.609 4.231 -0.238 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.326 4.100 0.090 1.00 0.00 H new ATOM 0 HG LEU A 37 11.885 1.927 -0.195 1.00 0.00 H new ATOM 0 HD11 LEU A 37 13.362 0.711 1.385 1.00 0.00 H new ATOM 0 HD12 LEU A 37 14.258 1.937 0.457 1.00 0.00 H new ATOM 0 HD13 LEU A 37 13.805 2.257 2.147 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.986 1.040 1.937 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.342 2.595 2.726 1.00 0.00 H new ATOM 0 HD23 LEU A 37 10.132 2.515 1.423 1.00 0.00 H new ATOM 594 N GLN A 38 14.379 4.815 2.775 1.00 0.00 N ATOM 595 CA GLN A 38 15.364 4.556 3.813 1.00 0.00 C ATOM 596 C GLN A 38 15.011 5.297 5.092 1.00 0.00 C ATOM 597 O GLN A 38 15.152 4.763 6.194 1.00 0.00 O ATOM 598 CB GLN A 38 16.789 4.902 3.348 1.00 0.00 C ATOM 599 CG GLN A 38 16.935 6.414 3.150 1.00 0.00 C ATOM 600 CD GLN A 38 18.340 6.748 2.678 1.00 0.00 C ATOM 601 OE1 GLN A 38 18.520 7.264 1.574 1.00 0.00 O ATOM 602 NE2 GLN A 38 19.355 6.482 3.444 1.00 0.00 N ATOM 0 H GLN A 38 14.715 5.370 1.988 1.00 0.00 H new ATOM 0 HA GLN A 38 15.344 3.487 4.022 1.00 0.00 H new ATOM 0 HB2 GLN A 38 17.513 4.554 4.085 1.00 0.00 H new ATOM 0 HB3 GLN A 38 17.009 4.384 2.415 1.00 0.00 H new ATOM 0 HG2 GLN A 38 16.205 6.765 2.420 1.00 0.00 H new ATOM 0 HG3 GLN A 38 16.725 6.933 4.085 1.00 0.00 H new ATOM 0 HE21 GLN A 38 19.206 6.055 4.358 1.00 0.00 H new ATOM 0 HE22 GLN A 38 20.301 6.700 3.131 1.00 0.00 H new ATOM 611 N THR A 39 14.571 6.533 4.940 1.00 0.00 N ATOM 612 CA THR A 39 14.235 7.361 6.072 1.00 0.00 C ATOM 613 C THR A 39 13.091 6.769 6.896 1.00 0.00 C ATOM 614 O THR A 39 13.176 6.700 8.124 1.00 0.00 O ATOM 615 CB THR A 39 13.881 8.775 5.588 1.00 0.00 C ATOM 616 OG1 THR A 39 15.018 9.373 4.966 1.00 0.00 O ATOM 617 CG2 THR A 39 13.404 9.645 6.742 1.00 0.00 C ATOM 0 H THR A 39 14.439 6.983 4.034 1.00 0.00 H new ATOM 0 HA THR A 39 15.105 7.408 6.727 1.00 0.00 H new ATOM 0 HB THR A 39 13.070 8.695 4.864 1.00 0.00 H new ATOM 0 HG1 THR A 39 15.163 8.964 4.087 1.00 0.00 H new ATOM 0 HG21 THR A 39 13.160 10.640 6.371 1.00 0.00 H new ATOM 0 HG22 THR A 39 12.517 9.198 7.192 1.00 0.00 H new ATOM 0 HG23 THR A 39 14.192 9.720 7.491 1.00 0.00 H new ATOM 625 N GLU A 40 11.997 6.419 6.243 1.00 0.00 N ATOM 626 CA GLU A 40 10.828 5.954 6.971 1.00 0.00 C ATOM 627 C GLU A 40 10.889 4.459 7.318 1.00 0.00 C ATOM 628 O GLU A 40 10.409 4.046 8.379 1.00 0.00 O ATOM 629 CB GLU A 40 9.534 6.327 6.234 1.00 0.00 C ATOM 630 CG GLU A 40 9.438 7.871 6.120 1.00 0.00 C ATOM 631 CD GLU A 40 9.372 8.537 7.489 1.00 0.00 C ATOM 632 OE1 GLU A 40 9.037 7.877 8.440 1.00 0.00 O ATOM 633 OE2 GLU A 40 9.667 9.709 7.567 1.00 0.00 O ATOM 0 H GLU A 40 11.892 6.446 5.229 1.00 0.00 H new ATOM 0 HA GLU A 40 10.827 6.475 7.929 1.00 0.00 H new ATOM 0 HB2 GLU A 40 9.524 5.876 5.242 1.00 0.00 H new ATOM 0 HB3 GLU A 40 8.670 5.936 6.771 1.00 0.00 H new ATOM 0 HG2 GLU A 40 10.302 8.249 5.573 1.00 0.00 H new ATOM 0 HG3 GLU A 40 8.553 8.138 5.543 1.00 0.00 H new ATOM 640 N LEU A 41 11.458 3.652 6.424 1.00 0.00 N ATOM 641 CA LEU A 41 11.547 2.197 6.647 1.00 0.00 C ATOM 642 C LEU A 41 12.960 1.781 7.009 1.00 0.00 C ATOM 643 O LEU A 41 13.434 0.720 6.580 1.00 0.00 O ATOM 644 CB LEU A 41 11.101 1.415 5.411 1.00 0.00 C ATOM 645 CG LEU A 41 9.577 1.254 5.400 1.00 0.00 C ATOM 646 CD1 LEU A 41 8.901 2.607 5.168 1.00 0.00 C ATOM 647 CD2 LEU A 41 9.177 0.278 4.292 1.00 0.00 C ATOM 0 H LEU A 41 11.863 3.970 5.544 1.00 0.00 H new ATOM 0 HA LEU A 41 10.880 1.966 7.477 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.424 1.934 4.509 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.576 0.434 5.403 1.00 0.00 H new ATOM 0 HG LEU A 41 9.254 0.864 6.365 1.00 0.00 H new ATOM 0 HD11 LEU A 41 7.819 2.477 5.163 1.00 0.00 H new ATOM 0 HD12 LEU A 41 9.180 3.295 5.966 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.222 3.015 4.209 1.00 0.00 H new ATOM 0 HD21 LEU A 41 8.093 0.162 4.283 1.00 0.00 H new ATOM 0 HD22 LEU A 41 9.509 0.665 3.329 1.00 0.00 H new ATOM 0 HD23 LEU A 41 9.644 -0.690 4.474 1.00 0.00 H new ATOM 659 N SER A 42 13.641 2.600 7.782 1.00 0.00 N ATOM 660 CA SER A 42 15.004 2.295 8.157 1.00 0.00 C ATOM 661 C SER A 42 15.048 0.927 8.828 1.00 0.00 C ATOM 662 O SER A 42 15.927 0.116 8.551 1.00 0.00 O ATOM 663 CB SER A 42 15.530 3.360 9.119 1.00 0.00 C ATOM 664 OG SER A 42 15.311 4.658 8.558 1.00 0.00 O ATOM 0 H SER A 42 13.277 3.475 8.160 1.00 0.00 H new ATOM 0 HA SER A 42 15.631 2.284 7.265 1.00 0.00 H new ATOM 0 HB2 SER A 42 15.025 3.278 10.081 1.00 0.00 H new ATOM 0 HB3 SER A 42 16.593 3.206 9.303 1.00 0.00 H new ATOM 0 HG SER A 42 15.437 4.620 7.587 1.00 0.00 H new ATOM 670 N GLY A 43 14.041 0.648 9.642 1.00 0.00 N ATOM 671 CA GLY A 43 13.934 -0.635 10.315 1.00 0.00 C ATOM 672 C GLY A 43 13.801 -1.781 9.325 1.00 0.00 C ATOM 673 O GLY A 43 14.575 -2.741 9.379 1.00 0.00 O ATOM 0 H GLY A 43 13.283 1.298 9.852 1.00 0.00 H new ATOM 0 HA2 GLY A 43 14.814 -0.793 10.938 1.00 0.00 H new ATOM 0 HA3 GLY A 43 13.070 -0.626 10.979 1.00 0.00 H new ATOM 677 N PHE A 44 12.873 -1.656 8.375 1.00 0.00 N ATOM 678 CA PHE A 44 12.722 -2.691 7.353 1.00 0.00 C ATOM 679 C PHE A 44 13.925 -2.706 6.458 1.00 0.00 C ATOM 680 O PHE A 44 14.443 -3.764 6.094 1.00 0.00 O ATOM 681 CB PHE A 44 11.445 -2.511 6.502 1.00 0.00 C ATOM 682 CG PHE A 44 10.224 -3.013 7.246 1.00 0.00 C ATOM 683 CD1 PHE A 44 10.120 -4.363 7.591 1.00 0.00 C ATOM 684 CD2 PHE A 44 9.203 -2.134 7.589 1.00 0.00 C ATOM 685 CE1 PHE A 44 8.995 -4.834 8.278 1.00 0.00 C ATOM 686 CE2 PHE A 44 8.075 -2.599 8.278 1.00 0.00 C ATOM 687 CZ PHE A 44 7.971 -3.950 8.623 1.00 0.00 C ATOM 0 H PHE A 44 12.230 -0.869 8.292 1.00 0.00 H new ATOM 0 HA PHE A 44 12.630 -3.642 7.877 1.00 0.00 H new ATOM 0 HB2 PHE A 44 11.316 -1.458 6.251 1.00 0.00 H new ATOM 0 HB3 PHE A 44 11.551 -3.052 5.562 1.00 0.00 H new ATOM 0 HD1 PHE A 44 10.912 -5.047 7.326 1.00 0.00 H new ATOM 0 HD2 PHE A 44 9.279 -1.090 7.324 1.00 0.00 H new ATOM 0 HE1 PHE A 44 8.919 -5.879 8.541 1.00 0.00 H new ATOM 0 HE2 PHE A 44 7.284 -1.913 8.543 1.00 0.00 H new ATOM 0 HZ PHE A 44 7.102 -4.308 9.154 1.00 0.00 H new ATOM 697 N LEU A 45 14.371 -1.526 6.106 1.00 0.00 N ATOM 698 CA LEU A 45 15.509 -1.383 5.248 1.00 0.00 C ATOM 699 C LEU A 45 16.766 -1.950 5.887 1.00 0.00 C ATOM 700 O LEU A 45 17.497 -2.700 5.257 1.00 0.00 O ATOM 701 CB LEU A 45 15.703 0.096 4.892 1.00 0.00 C ATOM 702 CG LEU A 45 17.003 0.267 4.117 1.00 0.00 C ATOM 703 CD1 LEU A 45 16.980 -0.576 2.837 1.00 0.00 C ATOM 704 CD2 LEU A 45 17.215 1.733 3.768 1.00 0.00 C ATOM 0 H LEU A 45 13.955 -0.645 6.407 1.00 0.00 H new ATOM 0 HA LEU A 45 15.325 -1.952 4.337 1.00 0.00 H new ATOM 0 HB2 LEU A 45 14.862 0.450 4.295 1.00 0.00 H new ATOM 0 HB3 LEU A 45 15.726 0.699 5.800 1.00 0.00 H new ATOM 0 HG LEU A 45 17.827 -0.073 4.745 1.00 0.00 H new ATOM 0 HD11 LEU A 45 17.917 -0.442 2.296 1.00 0.00 H new ATOM 0 HD12 LEU A 45 16.858 -1.628 3.096 1.00 0.00 H new ATOM 0 HD13 LEU A 45 16.149 -0.259 2.207 1.00 0.00 H new ATOM 0 HD21 LEU A 45 18.147 1.844 3.214 1.00 0.00 H new ATOM 0 HD22 LEU A 45 16.385 2.085 3.156 1.00 0.00 H new ATOM 0 HD23 LEU A 45 17.265 2.322 4.684 1.00 0.00 H new ATOM 716 N ASP A 46 17.023 -1.589 7.134 1.00 0.00 N ATOM 717 CA ASP A 46 18.228 -2.059 7.805 1.00 0.00 C ATOM 718 C ASP A 46 18.170 -3.538 8.138 1.00 0.00 C ATOM 719 O ASP A 46 19.184 -4.245 8.053 1.00 0.00 O ATOM 720 CB ASP A 46 18.536 -1.249 9.055 1.00 0.00 C ATOM 721 CG ASP A 46 19.799 -1.771 9.682 1.00 0.00 C ATOM 722 OD1 ASP A 46 20.827 -1.641 9.066 1.00 0.00 O ATOM 723 OD2 ASP A 46 19.730 -2.303 10.762 1.00 0.00 O ATOM 0 H ASP A 46 16.426 -0.982 7.696 1.00 0.00 H new ATOM 0 HA ASP A 46 19.040 -1.912 7.093 1.00 0.00 H new ATOM 0 HB2 ASP A 46 18.650 -0.195 8.801 1.00 0.00 H new ATOM 0 HB3 ASP A 46 17.709 -1.319 9.761 1.00 0.00 H new ATOM 728 N ALA A 47 17.017 -3.995 8.598 1.00 0.00 N ATOM 729 CA ALA A 47 16.884 -5.377 9.036 1.00 0.00 C ATOM 730 C ALA A 47 17.285 -6.320 7.928 1.00 0.00 C ATOM 731 O ALA A 47 18.063 -7.244 8.148 1.00 0.00 O ATOM 732 CB ALA A 47 15.456 -5.679 9.482 1.00 0.00 C ATOM 0 H ALA A 47 16.167 -3.437 8.678 1.00 0.00 H new ATOM 0 HA ALA A 47 17.548 -5.522 9.888 1.00 0.00 H new ATOM 0 HB1 ALA A 47 15.387 -6.718 9.803 1.00 0.00 H new ATOM 0 HB2 ALA A 47 15.188 -5.024 10.311 1.00 0.00 H new ATOM 0 HB3 ALA A 47 14.772 -5.511 8.650 1.00 0.00 H new ATOM 738 N GLN A 48 16.820 -6.036 6.723 1.00 0.00 N ATOM 739 CA GLN A 48 17.200 -6.819 5.561 1.00 0.00 C ATOM 740 C GLN A 48 17.889 -5.935 4.531 1.00 0.00 C ATOM 741 O GLN A 48 17.502 -5.894 3.366 1.00 0.00 O ATOM 742 CB GLN A 48 15.987 -7.554 4.951 1.00 0.00 C ATOM 743 CG GLN A 48 14.748 -6.656 4.947 1.00 0.00 C ATOM 744 CD GLN A 48 14.693 -5.866 3.654 1.00 0.00 C ATOM 745 OE1 GLN A 48 14.446 -6.437 2.589 1.00 0.00 O ATOM 746 NE2 GLN A 48 14.924 -4.595 3.671 1.00 0.00 N ATOM 0 H GLN A 48 16.178 -5.268 6.525 1.00 0.00 H new ATOM 0 HA GLN A 48 17.906 -7.584 5.883 1.00 0.00 H new ATOM 0 HB2 GLN A 48 16.219 -7.864 3.932 1.00 0.00 H new ATOM 0 HB3 GLN A 48 15.782 -8.460 5.521 1.00 0.00 H new ATOM 0 HG2 GLN A 48 13.848 -7.262 5.053 1.00 0.00 H new ATOM 0 HG3 GLN A 48 14.777 -5.976 5.799 1.00 0.00 H new ATOM 0 HE21 GLN A 48 15.128 -4.125 4.553 1.00 0.00 H new ATOM 0 HE22 GLN A 48 14.902 -4.061 2.802 1.00 0.00 H new ATOM 755 N LYS A 49 18.896 -5.215 4.981 1.00 0.00 N ATOM 756 CA LYS A 49 19.600 -4.254 4.139 1.00 0.00 C ATOM 757 C LYS A 49 20.220 -4.937 2.920 1.00 0.00 C ATOM 758 O LYS A 49 20.273 -4.356 1.829 1.00 0.00 O ATOM 759 CB LYS A 49 20.709 -3.565 4.956 1.00 0.00 C ATOM 760 CG LYS A 49 21.098 -2.232 4.293 1.00 0.00 C ATOM 761 CD LYS A 49 22.424 -1.702 4.879 1.00 0.00 C ATOM 762 CE LYS A 49 22.362 -1.611 6.412 1.00 0.00 C ATOM 763 NZ LYS A 49 21.224 -0.760 6.837 1.00 0.00 N ATOM 0 H LYS A 49 19.252 -5.275 5.935 1.00 0.00 H new ATOM 0 HA LYS A 49 18.878 -3.515 3.791 1.00 0.00 H new ATOM 0 HB2 LYS A 49 20.365 -3.387 5.975 1.00 0.00 H new ATOM 0 HB3 LYS A 49 21.581 -4.216 5.023 1.00 0.00 H new ATOM 0 HG2 LYS A 49 21.199 -2.371 3.217 1.00 0.00 H new ATOM 0 HG3 LYS A 49 20.307 -1.498 4.447 1.00 0.00 H new ATOM 0 HD2 LYS A 49 23.242 -2.359 4.585 1.00 0.00 H new ATOM 0 HD3 LYS A 49 22.640 -0.718 4.463 1.00 0.00 H new ATOM 0 HE2 LYS A 49 22.256 -2.609 6.837 1.00 0.00 H new ATOM 0 HE3 LYS A 49 23.295 -1.199 6.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 20.918 -1.040 7.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 21.521 0.237 6.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 20.434 -0.879 6.171 1.00 0.00 H new ATOM 777 N ASP A 50 20.798 -6.104 3.140 1.00 0.00 N ATOM 778 CA ASP A 50 21.540 -6.797 2.086 1.00 0.00 C ATOM 779 C ASP A 50 20.848 -8.074 1.621 1.00 0.00 C ATOM 780 O ASP A 50 21.458 -8.915 0.971 1.00 0.00 O ATOM 781 CB ASP A 50 22.970 -7.099 2.548 1.00 0.00 C ATOM 782 CG ASP A 50 23.782 -7.659 1.404 1.00 0.00 C ATOM 783 OD1 ASP A 50 23.883 -6.997 0.392 1.00 0.00 O ATOM 784 OD2 ASP A 50 24.298 -8.743 1.547 1.00 0.00 O ATOM 0 H ASP A 50 20.772 -6.596 4.033 1.00 0.00 H new ATOM 0 HA ASP A 50 21.573 -6.126 1.228 1.00 0.00 H new ATOM 0 HB2 ASP A 50 23.438 -6.189 2.924 1.00 0.00 H new ATOM 0 HB3 ASP A 50 22.950 -7.812 3.372 1.00 0.00 H new ATOM 789 N VAL A 51 19.574 -8.208 1.932 1.00 0.00 N ATOM 790 CA VAL A 51 18.816 -9.397 1.537 1.00 0.00 C ATOM 791 C VAL A 51 18.481 -9.388 0.035 1.00 0.00 C ATOM 792 O VAL A 51 17.608 -10.132 -0.417 1.00 0.00 O ATOM 793 CB VAL A 51 17.557 -9.531 2.409 1.00 0.00 C ATOM 794 CG1 VAL A 51 16.821 -10.846 2.110 1.00 0.00 C ATOM 795 CG2 VAL A 51 17.988 -9.534 3.871 1.00 0.00 C ATOM 0 H VAL A 51 19.036 -7.516 2.454 1.00 0.00 H new ATOM 0 HA VAL A 51 19.440 -10.275 1.704 1.00 0.00 H new ATOM 0 HB VAL A 51 16.885 -8.699 2.196 1.00 0.00 H new ATOM 0 HG11 VAL A 51 15.934 -10.918 2.739 1.00 0.00 H new ATOM 0 HG12 VAL A 51 16.525 -10.867 1.061 1.00 0.00 H new ATOM 0 HG13 VAL A 51 17.482 -11.688 2.317 1.00 0.00 H new ATOM 0 HG21 VAL A 51 17.109 -9.628 4.509 1.00 0.00 H new ATOM 0 HG22 VAL A 51 18.659 -10.374 4.051 1.00 0.00 H new ATOM 0 HG23 VAL A 51 18.504 -8.602 4.100 1.00 0.00 H new ATOM 805 N ASP A 52 19.247 -8.619 -0.738 1.00 0.00 N ATOM 806 CA ASP A 52 19.127 -8.587 -2.209 1.00 0.00 C ATOM 807 C ASP A 52 17.738 -8.162 -2.680 1.00 0.00 C ATOM 808 O ASP A 52 17.607 -7.321 -3.568 1.00 0.00 O ATOM 809 CB ASP A 52 19.498 -9.951 -2.806 1.00 0.00 C ATOM 810 CG ASP A 52 19.742 -9.856 -4.299 1.00 0.00 C ATOM 811 OD1 ASP A 52 19.929 -8.761 -4.795 1.00 0.00 O ATOM 812 OD2 ASP A 52 19.756 -10.884 -4.932 1.00 0.00 O ATOM 0 H ASP A 52 19.969 -7.999 -0.371 1.00 0.00 H new ATOM 0 HA ASP A 52 19.827 -7.832 -2.566 1.00 0.00 H new ATOM 0 HB2 ASP A 52 20.392 -10.334 -2.314 1.00 0.00 H new ATOM 0 HB3 ASP A 52 18.697 -10.664 -2.612 1.00 0.00 H new ATOM 817 N ALA A 53 16.707 -8.757 -2.104 1.00 0.00 N ATOM 818 CA ALA A 53 15.341 -8.450 -2.499 1.00 0.00 C ATOM 819 C ALA A 53 15.054 -6.966 -2.311 1.00 0.00 C ATOM 820 O ALA A 53 14.373 -6.350 -3.124 1.00 0.00 O ATOM 821 CB ALA A 53 14.341 -9.289 -1.688 1.00 0.00 C ATOM 0 H ALA A 53 16.788 -9.454 -1.363 1.00 0.00 H new ATOM 0 HA ALA A 53 15.227 -8.699 -3.554 1.00 0.00 H new ATOM 0 HB1 ALA A 53 13.325 -9.045 -1.998 1.00 0.00 H new ATOM 0 HB2 ALA A 53 14.529 -10.348 -1.863 1.00 0.00 H new ATOM 0 HB3 ALA A 53 14.459 -9.070 -0.627 1.00 0.00 H new ATOM 827 N VAL A 54 15.615 -6.388 -1.255 1.00 0.00 N ATOM 828 CA VAL A 54 15.420 -4.969 -0.978 1.00 0.00 C ATOM 829 C VAL A 54 15.911 -4.127 -2.151 1.00 0.00 C ATOM 830 O VAL A 54 15.167 -3.299 -2.686 1.00 0.00 O ATOM 831 CB VAL A 54 16.145 -4.567 0.339 1.00 0.00 C ATOM 832 CG1 VAL A 54 17.646 -4.885 0.256 1.00 0.00 C ATOM 833 CG2 VAL A 54 15.957 -3.066 0.629 1.00 0.00 C ATOM 0 H VAL A 54 16.205 -6.876 -0.581 1.00 0.00 H new ATOM 0 HA VAL A 54 14.354 -4.781 -0.848 1.00 0.00 H new ATOM 0 HB VAL A 54 15.702 -5.146 1.149 1.00 0.00 H new ATOM 0 HG11 VAL A 54 18.131 -4.595 1.188 1.00 0.00 H new ATOM 0 HG12 VAL A 54 17.783 -5.954 0.093 1.00 0.00 H new ATOM 0 HG13 VAL A 54 18.090 -4.332 -0.572 1.00 0.00 H new ATOM 0 HG21 VAL A 54 16.472 -2.807 1.554 1.00 0.00 H new ATOM 0 HG22 VAL A 54 16.371 -2.482 -0.193 1.00 0.00 H new ATOM 0 HG23 VAL A 54 14.894 -2.845 0.731 1.00 0.00 H new ATOM 843 N ASP A 55 17.109 -4.431 -2.628 1.00 0.00 N ATOM 844 CA ASP A 55 17.650 -3.753 -3.794 1.00 0.00 C ATOM 845 C ASP A 55 16.743 -3.962 -4.964 1.00 0.00 C ATOM 846 O ASP A 55 16.400 -3.033 -5.666 1.00 0.00 O ATOM 847 CB ASP A 55 19.018 -4.332 -4.151 1.00 0.00 C ATOM 848 CG ASP A 55 19.518 -3.715 -5.447 1.00 0.00 C ATOM 849 OD1 ASP A 55 19.765 -2.532 -5.467 1.00 0.00 O ATOM 850 OD2 ASP A 55 19.652 -4.448 -6.410 1.00 0.00 O ATOM 0 H ASP A 55 17.722 -5.140 -2.227 1.00 0.00 H new ATOM 0 HA ASP A 55 17.740 -2.691 -3.564 1.00 0.00 H new ATOM 0 HB2 ASP A 55 19.727 -4.135 -3.347 1.00 0.00 H new ATOM 0 HB3 ASP A 55 18.948 -5.415 -4.257 1.00 0.00 H new ATOM 855 N LYS A 56 16.376 -5.203 -5.177 1.00 0.00 N ATOM 856 CA LYS A 56 15.555 -5.574 -6.308 1.00 0.00 C ATOM 857 C LYS A 56 14.186 -4.913 -6.254 1.00 0.00 C ATOM 858 O LYS A 56 13.746 -4.315 -7.242 1.00 0.00 O ATOM 859 CB LYS A 56 15.458 -7.092 -6.375 1.00 0.00 C ATOM 860 CG LYS A 56 16.838 -7.633 -6.786 1.00 0.00 C ATOM 861 CD LYS A 56 16.840 -9.157 -6.755 1.00 0.00 C ATOM 862 CE LYS A 56 18.103 -9.685 -7.446 1.00 0.00 C ATOM 863 NZ LYS A 56 19.267 -8.834 -7.099 1.00 0.00 N ATOM 0 H LYS A 56 16.636 -5.983 -4.574 1.00 0.00 H new ATOM 0 HA LYS A 56 16.023 -5.212 -7.223 1.00 0.00 H new ATOM 0 HB2 LYS A 56 15.160 -7.499 -5.409 1.00 0.00 H new ATOM 0 HB3 LYS A 56 14.699 -7.395 -7.096 1.00 0.00 H new ATOM 0 HG2 LYS A 56 17.090 -7.283 -7.787 1.00 0.00 H new ATOM 0 HG3 LYS A 56 17.603 -7.248 -6.111 1.00 0.00 H new ATOM 0 HD2 LYS A 56 16.803 -9.510 -5.724 1.00 0.00 H new ATOM 0 HD3 LYS A 56 15.952 -9.542 -7.256 1.00 0.00 H new ATOM 0 HE2 LYS A 56 18.291 -10.714 -7.140 1.00 0.00 H new ATOM 0 HE3 LYS A 56 17.959 -9.695 -8.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 20.144 -9.378 -7.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 19.285 -8.000 -7.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 19.189 -8.527 -6.108 1.00 0.00 H new ATOM 877 N VAL A 57 13.591 -4.871 -5.074 1.00 0.00 N ATOM 878 CA VAL A 57 12.341 -4.149 -4.911 1.00 0.00 C ATOM 879 C VAL A 57 12.582 -2.673 -5.220 1.00 0.00 C ATOM 880 O VAL A 57 11.868 -2.065 -6.021 1.00 0.00 O ATOM 881 CB VAL A 57 11.790 -4.320 -3.480 1.00 0.00 C ATOM 882 CG1 VAL A 57 10.526 -3.479 -3.310 1.00 0.00 C ATOM 883 CG2 VAL A 57 11.447 -5.793 -3.219 1.00 0.00 C ATOM 0 H VAL A 57 13.945 -5.319 -4.229 1.00 0.00 H new ATOM 0 HA VAL A 57 11.598 -4.552 -5.600 1.00 0.00 H new ATOM 0 HB VAL A 57 12.551 -3.993 -2.771 1.00 0.00 H new ATOM 0 HG11 VAL A 57 10.140 -3.603 -2.298 1.00 0.00 H new ATOM 0 HG12 VAL A 57 10.762 -2.429 -3.483 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.773 -3.805 -4.028 1.00 0.00 H new ATOM 0 HG21 VAL A 57 11.059 -5.902 -2.206 1.00 0.00 H new ATOM 0 HG22 VAL A 57 10.693 -6.123 -3.934 1.00 0.00 H new ATOM 0 HG23 VAL A 57 12.345 -6.401 -3.331 1.00 0.00 H new ATOM 893 N MET A 58 13.663 -2.138 -4.673 1.00 0.00 N ATOM 894 CA MET A 58 14.068 -0.765 -4.955 1.00 0.00 C ATOM 895 C MET A 58 14.368 -0.627 -6.429 1.00 0.00 C ATOM 896 O MET A 58 14.071 0.396 -7.057 1.00 0.00 O ATOM 897 CB MET A 58 15.343 -0.446 -4.166 1.00 0.00 C ATOM 898 CG MET A 58 15.067 -0.549 -2.671 1.00 0.00 C ATOM 899 SD MET A 58 14.787 1.108 -2.003 1.00 0.00 S ATOM 900 CE MET A 58 16.512 1.659 -2.080 1.00 0.00 C ATOM 0 H MET A 58 14.279 -2.634 -4.029 1.00 0.00 H new ATOM 0 HA MET A 58 13.267 -0.083 -4.670 1.00 0.00 H new ATOM 0 HB2 MET A 58 16.137 -1.138 -4.447 1.00 0.00 H new ATOM 0 HB3 MET A 58 15.692 0.557 -4.412 1.00 0.00 H new ATOM 0 HG2 MET A 58 14.195 -1.178 -2.492 1.00 0.00 H new ATOM 0 HG3 MET A 58 15.909 -1.021 -2.165 1.00 0.00 H new ATOM 0 HE1 MET A 58 16.829 2.000 -1.095 1.00 0.00 H new ATOM 0 HE2 MET A 58 17.145 0.831 -2.398 1.00 0.00 H new ATOM 0 HE3 MET A 58 16.601 2.478 -2.793 1.00 0.00 H new ATOM 910 N LYS A 59 15.005 -1.648 -6.958 1.00 0.00 N ATOM 911 CA LYS A 59 15.434 -1.655 -8.323 1.00 0.00 C ATOM 912 C LYS A 59 14.237 -1.531 -9.220 1.00 0.00 C ATOM 913 O LYS A 59 14.203 -0.683 -10.102 1.00 0.00 O ATOM 914 CB LYS A 59 16.154 -2.977 -8.621 1.00 0.00 C ATOM 915 CG LYS A 59 17.069 -2.814 -9.832 1.00 0.00 C ATOM 916 CD LYS A 59 18.370 -2.113 -9.393 1.00 0.00 C ATOM 917 CE LYS A 59 19.532 -3.124 -9.355 1.00 0.00 C ATOM 918 NZ LYS A 59 19.073 -4.409 -8.746 1.00 0.00 N ATOM 0 H LYS A 59 15.237 -2.498 -6.443 1.00 0.00 H new ATOM 0 HA LYS A 59 16.112 -0.820 -8.498 1.00 0.00 H new ATOM 0 HB2 LYS A 59 16.737 -3.286 -7.754 1.00 0.00 H new ATOM 0 HB3 LYS A 59 15.423 -3.763 -8.811 1.00 0.00 H new ATOM 0 HG2 LYS A 59 17.295 -3.788 -10.266 1.00 0.00 H new ATOM 0 HG3 LYS A 59 16.569 -2.229 -10.604 1.00 0.00 H new ATOM 0 HD2 LYS A 59 18.606 -1.303 -10.083 1.00 0.00 H new ATOM 0 HD3 LYS A 59 18.236 -1.665 -8.409 1.00 0.00 H new ATOM 0 HE2 LYS A 59 19.902 -3.303 -10.364 1.00 0.00 H new ATOM 0 HE3 LYS A 59 20.362 -2.715 -8.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 19.447 -4.488 -7.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 18.034 -4.428 -8.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 19.419 -5.207 -9.317 1.00 0.00 H new ATOM 932 N GLU A 60 13.216 -2.319 -8.935 1.00 0.00 N ATOM 933 CA GLU A 60 12.003 -2.284 -9.720 1.00 0.00 C ATOM 934 C GLU A 60 11.359 -0.911 -9.628 1.00 0.00 C ATOM 935 O GLU A 60 10.933 -0.343 -10.642 1.00 0.00 O ATOM 936 CB GLU A 60 11.028 -3.348 -9.239 1.00 0.00 C ATOM 937 CG GLU A 60 11.561 -4.752 -9.571 1.00 0.00 C ATOM 938 CD GLU A 60 10.593 -5.818 -9.085 1.00 0.00 C ATOM 939 OE1 GLU A 60 9.501 -5.469 -8.691 1.00 0.00 O ATOM 940 OE2 GLU A 60 10.952 -6.976 -9.130 1.00 0.00 O ATOM 0 H GLU A 60 13.206 -2.989 -8.166 1.00 0.00 H new ATOM 0 HA GLU A 60 12.258 -2.488 -10.760 1.00 0.00 H new ATOM 0 HB2 GLU A 60 10.878 -3.254 -8.163 1.00 0.00 H new ATOM 0 HB3 GLU A 60 10.056 -3.200 -9.710 1.00 0.00 H new ATOM 0 HG2 GLU A 60 11.706 -4.847 -10.647 1.00 0.00 H new ATOM 0 HG3 GLU A 60 12.535 -4.897 -9.104 1.00 0.00 H new ATOM 947 N LEU A 61 11.380 -0.330 -8.442 1.00 0.00 N ATOM 948 CA LEU A 61 10.859 1.016 -8.276 1.00 0.00 C ATOM 949 C LEU A 61 11.648 1.987 -9.119 1.00 0.00 C ATOM 950 O LEU A 61 11.078 2.906 -9.720 1.00 0.00 O ATOM 951 CB LEU A 61 10.844 1.452 -6.804 1.00 0.00 C ATOM 952 CG LEU A 61 9.520 1.037 -6.131 1.00 0.00 C ATOM 953 CD1 LEU A 61 8.389 1.970 -6.580 1.00 0.00 C ATOM 954 CD2 LEU A 61 9.156 -0.417 -6.468 1.00 0.00 C ATOM 0 H LEU A 61 11.746 -0.760 -7.592 1.00 0.00 H new ATOM 0 HA LEU A 61 9.823 1.015 -8.615 1.00 0.00 H new ATOM 0 HB2 LEU A 61 11.684 1.000 -6.276 1.00 0.00 H new ATOM 0 HB3 LEU A 61 10.969 2.533 -6.737 1.00 0.00 H new ATOM 0 HG LEU A 61 9.652 1.115 -5.052 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.458 1.670 -6.100 1.00 0.00 H new ATOM 0 HD12 LEU A 61 8.629 2.995 -6.297 1.00 0.00 H new ATOM 0 HD13 LEU A 61 8.275 1.909 -7.662 1.00 0.00 H new ATOM 0 HD21 LEU A 61 8.218 -0.680 -5.979 1.00 0.00 H new ATOM 0 HD22 LEU A 61 9.045 -0.524 -7.547 1.00 0.00 H new ATOM 0 HD23 LEU A 61 9.946 -1.081 -6.117 1.00 0.00 H new ATOM 966 N ASP A 62 12.956 1.807 -9.175 1.00 0.00 N ATOM 967 CA ASP A 62 13.782 2.654 -10.024 1.00 0.00 C ATOM 968 C ASP A 62 13.894 2.215 -11.469 1.00 0.00 C ATOM 969 O ASP A 62 14.175 3.040 -12.337 1.00 0.00 O ATOM 970 CB ASP A 62 15.068 3.152 -9.392 1.00 0.00 C ATOM 971 CG ASP A 62 14.778 4.471 -8.688 1.00 0.00 C ATOM 972 OD1 ASP A 62 14.147 5.321 -9.300 1.00 0.00 O ATOM 973 OD2 ASP A 62 15.163 4.622 -7.554 1.00 0.00 O ATOM 0 H ASP A 62 13.465 1.094 -8.652 1.00 0.00 H new ATOM 0 HA ASP A 62 13.188 3.565 -10.100 1.00 0.00 H new ATOM 0 HB2 ASP A 62 15.450 2.419 -8.682 1.00 0.00 H new ATOM 0 HB3 ASP A 62 15.836 3.289 -10.153 1.00 0.00 H new ATOM 978 N GLU A 63 13.433 1.012 -11.765 1.00 0.00 N ATOM 979 CA GLU A 63 13.186 0.669 -13.162 1.00 0.00 C ATOM 980 C GLU A 63 12.087 1.587 -13.611 1.00 0.00 C ATOM 981 O GLU A 63 12.185 2.249 -14.648 1.00 0.00 O ATOM 982 CB GLU A 63 12.751 -0.788 -13.319 1.00 0.00 C ATOM 983 CG GLU A 63 13.931 -1.712 -13.009 1.00 0.00 C ATOM 984 CD GLU A 63 13.524 -3.168 -13.111 1.00 0.00 C ATOM 985 OE1 GLU A 63 12.382 -3.432 -13.389 1.00 0.00 O ATOM 986 OE2 GLU A 63 14.368 -4.003 -12.909 1.00 0.00 O ATOM 0 H GLU A 63 13.227 0.278 -11.088 1.00 0.00 H new ATOM 0 HA GLU A 63 14.093 0.783 -13.756 1.00 0.00 H new ATOM 0 HB2 GLU A 63 11.920 -1.004 -12.647 1.00 0.00 H new ATOM 0 HB3 GLU A 63 12.395 -0.964 -14.334 1.00 0.00 H new ATOM 0 HG2 GLU A 63 14.747 -1.510 -13.702 1.00 0.00 H new ATOM 0 HG3 GLU A 63 14.306 -1.505 -12.007 1.00 0.00 H new ATOM 993 N ASN A 64 11.184 1.823 -12.679 1.00 0.00 N ATOM 994 CA ASN A 64 10.196 2.864 -12.805 1.00 0.00 C ATOM 995 C ASN A 64 10.848 4.209 -12.454 1.00 0.00 C ATOM 996 O ASN A 64 10.264 5.063 -11.777 1.00 0.00 O ATOM 997 CB ASN A 64 9.004 2.582 -11.891 1.00 0.00 C ATOM 998 CG ASN A 64 7.752 3.220 -12.476 1.00 0.00 C ATOM 999 OD1 ASN A 64 7.821 4.301 -13.065 1.00 0.00 O ATOM 1000 ND2 ASN A 64 6.616 2.617 -12.355 1.00 0.00 N ATOM 0 H ASN A 64 11.119 1.292 -11.810 1.00 0.00 H new ATOM 0 HA ASN A 64 9.826 2.899 -13.830 1.00 0.00 H new ATOM 0 HB2 ASN A 64 8.861 1.507 -11.784 1.00 0.00 H new ATOM 0 HB3 ASN A 64 9.195 2.979 -10.894 1.00 0.00 H new ATOM 0 HD21 ASN A 64 5.772 3.035 -12.747 1.00 0.00 H new ATOM 0 HD22 ASN A 64 6.563 1.723 -11.867 1.00 0.00 H new ATOM 1007 N GLY A 65 12.099 4.357 -12.861 1.00 0.00 N ATOM 1008 CA GLY A 65 12.861 5.583 -12.647 1.00 0.00 C ATOM 1009 C GLY A 65 12.680 6.470 -13.850 1.00 0.00 C ATOM 1010 O GLY A 65 13.472 7.379 -14.109 1.00 0.00 O ATOM 0 H GLY A 65 12.619 3.629 -13.351 1.00 0.00 H new ATOM 0 HA2 GLY A 65 12.517 6.091 -11.746 1.00 0.00 H new ATOM 0 HA3 GLY A 65 13.916 5.353 -12.500 1.00 0.00 H new ATOM 1014 N ASP A 66 11.640 6.162 -14.598 1.00 0.00 N ATOM 1015 CA ASP A 66 11.316 6.848 -15.817 1.00 0.00 C ATOM 1016 C ASP A 66 11.064 8.318 -15.557 1.00 0.00 C ATOM 1017 O ASP A 66 11.544 9.180 -16.300 1.00 0.00 O ATOM 1018 CB ASP A 66 10.076 6.198 -16.423 1.00 0.00 C ATOM 1019 CG ASP A 66 9.814 6.741 -17.809 1.00 0.00 C ATOM 1020 OD1 ASP A 66 10.652 6.562 -18.660 1.00 0.00 O ATOM 1021 OD2 ASP A 66 8.772 7.319 -18.007 1.00 0.00 O ATOM 0 H ASP A 66 10.988 5.413 -14.365 1.00 0.00 H new ATOM 0 HA ASP A 66 12.154 6.773 -16.510 1.00 0.00 H new ATOM 0 HB2 ASP A 66 10.211 5.117 -16.470 1.00 0.00 H new ATOM 0 HB3 ASP A 66 9.212 6.384 -15.784 1.00 0.00 H new ATOM 1026 N GLY A 67 10.334 8.605 -14.496 1.00 0.00 N ATOM 1027 CA GLY A 67 10.032 9.981 -14.136 1.00 0.00 C ATOM 1028 C GLY A 67 9.717 10.113 -12.657 1.00 0.00 C ATOM 1029 O GLY A 67 10.579 10.493 -11.858 1.00 0.00 O ATOM 0 H GLY A 67 9.939 7.906 -13.868 1.00 0.00 H new ATOM 0 HA2 GLY A 67 10.880 10.618 -14.387 1.00 0.00 H new ATOM 0 HA3 GLY A 67 9.184 10.334 -14.723 1.00 0.00 H new ATOM 1033 N GLU A 68 8.479 9.825 -12.299 1.00 0.00 N ATOM 1034 CA GLU A 68 8.023 9.969 -10.918 1.00 0.00 C ATOM 1035 C GLU A 68 7.523 8.654 -10.373 1.00 0.00 C ATOM 1036 O GLU A 68 7.098 7.780 -11.134 1.00 0.00 O ATOM 1037 CB GLU A 68 6.876 10.983 -10.849 1.00 0.00 C ATOM 1038 CG GLU A 68 7.359 12.370 -11.284 1.00 0.00 C ATOM 1039 CD GLU A 68 6.535 12.844 -12.459 1.00 0.00 C ATOM 1040 OE1 GLU A 68 5.371 13.141 -12.265 1.00 0.00 O ATOM 1041 OE2 GLU A 68 7.064 12.903 -13.541 1.00 0.00 O ATOM 0 H GLU A 68 7.765 9.488 -12.944 1.00 0.00 H new ATOM 0 HA GLU A 68 8.871 10.310 -10.323 1.00 0.00 H new ATOM 0 HB2 GLU A 68 6.057 10.659 -11.491 1.00 0.00 H new ATOM 0 HB3 GLU A 68 6.485 11.030 -9.833 1.00 0.00 H new ATOM 0 HG2 GLU A 68 7.271 13.074 -10.456 1.00 0.00 H new ATOM 0 HG3 GLU A 68 8.413 12.331 -11.558 1.00 0.00 H new ATOM 1048 N VAL A 69 7.385 8.602 -9.065 1.00 0.00 N ATOM 1049 CA VAL A 69 6.726 7.501 -8.398 1.00 0.00 C ATOM 1050 C VAL A 69 5.548 8.069 -7.623 1.00 0.00 C ATOM 1051 O VAL A 69 5.675 9.100 -6.970 1.00 0.00 O ATOM 1052 CB VAL A 69 7.730 6.752 -7.473 1.00 0.00 C ATOM 1053 CG1 VAL A 69 8.580 7.748 -6.685 1.00 0.00 C ATOM 1054 CG2 VAL A 69 6.996 5.830 -6.485 1.00 0.00 C ATOM 0 H VAL A 69 7.728 9.325 -8.433 1.00 0.00 H new ATOM 0 HA VAL A 69 6.361 6.768 -9.118 1.00 0.00 H new ATOM 0 HB VAL A 69 8.372 6.147 -8.113 1.00 0.00 H new ATOM 0 HG11 VAL A 69 9.275 7.206 -6.044 1.00 0.00 H new ATOM 0 HG12 VAL A 69 9.139 8.377 -7.378 1.00 0.00 H new ATOM 0 HG13 VAL A 69 7.932 8.373 -6.070 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.724 5.321 -5.853 1.00 0.00 H new ATOM 0 HG22 VAL A 69 6.327 6.423 -5.862 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.417 5.091 -7.039 1.00 0.00 H new ATOM 1064 N ASP A 70 4.384 7.492 -7.810 1.00 0.00 N ATOM 1065 CA ASP A 70 3.189 8.019 -7.183 1.00 0.00 C ATOM 1066 C ASP A 70 2.906 7.290 -5.867 1.00 0.00 C ATOM 1067 O ASP A 70 3.683 6.425 -5.444 1.00 0.00 O ATOM 1068 CB ASP A 70 2.000 7.969 -8.170 1.00 0.00 C ATOM 1069 CG ASP A 70 0.670 7.952 -7.445 1.00 0.00 C ATOM 1070 OD1 ASP A 70 0.301 8.979 -6.919 1.00 0.00 O ATOM 1071 OD2 ASP A 70 0.039 6.916 -7.414 1.00 0.00 O ATOM 0 H ASP A 70 4.236 6.663 -8.386 1.00 0.00 H new ATOM 0 HA ASP A 70 3.344 9.068 -6.929 1.00 0.00 H new ATOM 0 HB2 ASP A 70 2.042 8.833 -8.834 1.00 0.00 H new ATOM 0 HB3 ASP A 70 2.084 7.081 -8.797 1.00 0.00 H new ATOM 1076 N PHE A 71 1.836 7.669 -5.198 1.00 0.00 N ATOM 1077 CA PHE A 71 1.504 7.102 -3.904 1.00 0.00 C ATOM 1078 C PHE A 71 1.346 5.599 -4.033 1.00 0.00 C ATOM 1079 O PHE A 71 1.833 4.838 -3.193 1.00 0.00 O ATOM 1080 CB PHE A 71 0.208 7.723 -3.358 1.00 0.00 C ATOM 1081 CG PHE A 71 -0.059 7.232 -1.948 1.00 0.00 C ATOM 1082 CD1 PHE A 71 0.772 7.644 -0.908 1.00 0.00 C ATOM 1083 CD2 PHE A 71 -1.148 6.387 -1.678 1.00 0.00 C ATOM 1084 CE1 PHE A 71 0.527 7.219 0.397 1.00 0.00 C ATOM 1085 CE2 PHE A 71 -1.390 5.956 -0.363 1.00 0.00 C ATOM 1086 CZ PHE A 71 -0.553 6.373 0.672 1.00 0.00 C ATOM 0 H PHE A 71 1.176 8.372 -5.531 1.00 0.00 H new ATOM 0 HA PHE A 71 2.311 7.323 -3.206 1.00 0.00 H new ATOM 0 HB2 PHE A 71 0.288 8.810 -3.363 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -0.629 7.462 -4.006 1.00 0.00 H new ATOM 0 HD1 PHE A 71 1.609 8.295 -1.114 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -1.798 6.069 -2.480 1.00 0.00 H new ATOM 0 HE1 PHE A 71 1.173 7.544 1.199 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -2.224 5.302 -0.154 1.00 0.00 H new ATOM 0 HZ PHE A 71 -0.738 6.043 1.684 1.00 0.00 H new ATOM 1096 N GLN A 72 0.677 5.176 -5.096 1.00 0.00 N ATOM 1097 CA GLN A 72 0.439 3.762 -5.333 1.00 0.00 C ATOM 1098 C GLN A 72 1.767 3.005 -5.439 1.00 0.00 C ATOM 1099 O GLN A 72 1.935 1.939 -4.844 1.00 0.00 O ATOM 1100 CB GLN A 72 -0.371 3.590 -6.620 1.00 0.00 C ATOM 1101 CG GLN A 72 -1.783 4.158 -6.412 1.00 0.00 C ATOM 1102 CD GLN A 72 -2.592 4.081 -7.705 1.00 0.00 C ATOM 1103 OE1 GLN A 72 -3.768 4.461 -7.724 1.00 0.00 O ATOM 1104 NE2 GLN A 72 -2.043 3.621 -8.786 1.00 0.00 N ATOM 0 H GLN A 72 0.289 5.794 -5.809 1.00 0.00 H new ATOM 0 HA GLN A 72 -0.123 3.351 -4.495 1.00 0.00 H new ATOM 0 HB2 GLN A 72 0.122 4.104 -7.445 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -0.427 2.535 -6.890 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -2.292 3.601 -5.625 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -1.718 5.194 -6.079 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -1.073 3.307 -8.771 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -2.582 3.573 -9.651 1.00 0.00 H new ATOM 1113 N GLU A 73 2.713 3.569 -6.162 1.00 0.00 N ATOM 1114 CA GLU A 73 4.037 2.983 -6.269 1.00 0.00 C ATOM 1115 C GLU A 73 4.772 3.104 -4.933 1.00 0.00 C ATOM 1116 O GLU A 73 5.453 2.177 -4.491 1.00 0.00 O ATOM 1117 CB GLU A 73 4.829 3.663 -7.382 1.00 0.00 C ATOM 1118 CG GLU A 73 4.208 3.320 -8.753 1.00 0.00 C ATOM 1119 CD GLU A 73 3.004 4.207 -9.064 1.00 0.00 C ATOM 1120 OE1 GLU A 73 2.594 4.952 -8.213 1.00 0.00 O ATOM 1121 OE2 GLU A 73 2.514 4.125 -10.168 1.00 0.00 O ATOM 0 H GLU A 73 2.591 4.435 -6.686 1.00 0.00 H new ATOM 0 HA GLU A 73 3.937 1.926 -6.517 1.00 0.00 H new ATOM 0 HB2 GLU A 73 4.829 4.743 -7.233 1.00 0.00 H new ATOM 0 HB3 GLU A 73 5.869 3.337 -7.352 1.00 0.00 H new ATOM 0 HG2 GLU A 73 4.960 3.439 -9.533 1.00 0.00 H new ATOM 0 HG3 GLU A 73 3.902 2.274 -8.763 1.00 0.00 H new ATOM 1128 N TYR A 74 4.590 4.240 -4.278 1.00 0.00 N ATOM 1129 CA TYR A 74 5.193 4.476 -2.970 1.00 0.00 C ATOM 1130 C TYR A 74 4.715 3.462 -1.933 1.00 0.00 C ATOM 1131 O TYR A 74 5.533 2.842 -1.243 1.00 0.00 O ATOM 1132 CB TYR A 74 4.894 5.916 -2.515 1.00 0.00 C ATOM 1133 CG TYR A 74 5.187 6.097 -1.036 1.00 0.00 C ATOM 1134 CD1 TYR A 74 6.477 5.900 -0.528 1.00 0.00 C ATOM 1135 CD2 TYR A 74 4.150 6.477 -0.172 1.00 0.00 C ATOM 1136 CE1 TYR A 74 6.721 6.080 0.839 1.00 0.00 C ATOM 1137 CE2 TYR A 74 4.399 6.656 1.189 1.00 0.00 C ATOM 1138 CZ TYR A 74 5.683 6.459 1.695 1.00 0.00 C ATOM 1139 OH TYR A 74 5.929 6.639 3.036 1.00 0.00 O ATOM 0 H TYR A 74 4.029 5.016 -4.629 1.00 0.00 H new ATOM 0 HA TYR A 74 6.271 4.347 -3.062 1.00 0.00 H new ATOM 0 HB2 TYR A 74 5.495 6.616 -3.096 1.00 0.00 H new ATOM 0 HB3 TYR A 74 3.849 6.153 -2.713 1.00 0.00 H new ATOM 0 HD1 TYR A 74 7.281 5.610 -1.188 1.00 0.00 H new ATOM 0 HD2 TYR A 74 3.155 6.632 -0.562 1.00 0.00 H new ATOM 0 HE1 TYR A 74 7.715 5.925 1.233 1.00 0.00 H new ATOM 0 HE2 TYR A 74 3.597 6.947 1.851 1.00 0.00 H new ATOM 0 HH TYR A 74 5.100 6.902 3.488 1.00 0.00 H new ATOM 1149 N VAL A 75 3.406 3.273 -1.838 1.00 0.00 N ATOM 1150 CA VAL A 75 2.871 2.336 -0.857 1.00 0.00 C ATOM 1151 C VAL A 75 3.312 0.898 -1.136 1.00 0.00 C ATOM 1152 O VAL A 75 3.690 0.170 -0.214 1.00 0.00 O ATOM 1153 CB VAL A 75 1.340 2.433 -0.745 1.00 0.00 C ATOM 1154 CG1 VAL A 75 0.953 3.793 -0.165 1.00 0.00 C ATOM 1155 CG2 VAL A 75 0.695 2.269 -2.120 1.00 0.00 C ATOM 0 H VAL A 75 2.708 3.744 -2.413 1.00 0.00 H new ATOM 0 HA VAL A 75 3.290 2.625 0.107 1.00 0.00 H new ATOM 0 HB VAL A 75 0.986 1.638 -0.089 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.132 3.860 -0.087 1.00 0.00 H new ATOM 0 HG12 VAL A 75 1.396 3.906 0.824 1.00 0.00 H new ATOM 0 HG13 VAL A 75 1.319 4.585 -0.819 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -0.388 2.340 -2.024 1.00 0.00 H new ATOM 0 HG22 VAL A 75 1.053 3.054 -2.786 1.00 0.00 H new ATOM 0 HG23 VAL A 75 0.960 1.295 -2.532 1.00 0.00 H new ATOM 1165 N VAL A 76 3.272 0.484 -2.400 1.00 0.00 N ATOM 1166 CA VAL A 76 3.658 -0.875 -2.740 1.00 0.00 C ATOM 1167 C VAL A 76 5.137 -1.104 -2.448 1.00 0.00 C ATOM 1168 O VAL A 76 5.515 -2.162 -1.949 1.00 0.00 O ATOM 1169 CB VAL A 76 3.294 -1.228 -4.201 1.00 0.00 C ATOM 1170 CG1 VAL A 76 4.078 -0.355 -5.174 1.00 0.00 C ATOM 1171 CG2 VAL A 76 3.593 -2.707 -4.482 1.00 0.00 C ATOM 0 H VAL A 76 2.981 1.060 -3.190 1.00 0.00 H new ATOM 0 HA VAL A 76 3.086 -1.554 -2.107 1.00 0.00 H new ATOM 0 HB VAL A 76 2.229 -1.045 -4.340 1.00 0.00 H new ATOM 0 HG11 VAL A 76 3.809 -0.618 -6.197 1.00 0.00 H new ATOM 0 HG12 VAL A 76 3.841 0.694 -4.994 1.00 0.00 H new ATOM 0 HG13 VAL A 76 5.146 -0.516 -5.027 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.332 -2.941 -5.514 1.00 0.00 H new ATOM 0 HG22 VAL A 76 4.654 -2.900 -4.323 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.006 -3.331 -3.809 1.00 0.00 H new ATOM 1181 N LEU A 77 5.963 -0.094 -2.716 1.00 0.00 N ATOM 1182 CA LEU A 77 7.394 -0.212 -2.458 1.00 0.00 C ATOM 1183 C LEU A 77 7.656 -0.454 -0.993 1.00 0.00 C ATOM 1184 O LEU A 77 8.333 -1.416 -0.623 1.00 0.00 O ATOM 1185 CB LEU A 77 8.111 1.077 -2.883 1.00 0.00 C ATOM 1186 CG LEU A 77 9.603 1.029 -2.467 1.00 0.00 C ATOM 1187 CD1 LEU A 77 10.313 -0.169 -3.101 1.00 0.00 C ATOM 1188 CD2 LEU A 77 10.297 2.331 -2.881 1.00 0.00 C ATOM 0 H LEU A 77 5.670 0.802 -3.106 1.00 0.00 H new ATOM 0 HA LEU A 77 7.772 -1.057 -3.034 1.00 0.00 H new ATOM 0 HB2 LEU A 77 8.032 1.205 -3.963 1.00 0.00 H new ATOM 0 HB3 LEU A 77 7.626 1.938 -2.423 1.00 0.00 H new ATOM 0 HG LEU A 77 9.655 0.918 -1.384 1.00 0.00 H new ATOM 0 HD11 LEU A 77 11.358 -0.178 -2.792 1.00 0.00 H new ATOM 0 HD12 LEU A 77 9.831 -1.091 -2.776 1.00 0.00 H new ATOM 0 HD13 LEU A 77 10.256 -0.093 -4.187 1.00 0.00 H new ATOM 0 HD21 LEU A 77 11.346 2.294 -2.587 1.00 0.00 H new ATOM 0 HD22 LEU A 77 10.227 2.453 -3.962 1.00 0.00 H new ATOM 0 HD23 LEU A 77 9.812 3.174 -2.389 1.00 0.00 H new ATOM 1200 N VAL A 78 7.059 0.355 -0.150 1.00 0.00 N ATOM 1201 CA VAL A 78 7.222 0.152 1.271 1.00 0.00 C ATOM 1202 C VAL A 78 6.565 -1.155 1.692 1.00 0.00 C ATOM 1203 O VAL A 78 7.142 -1.946 2.452 1.00 0.00 O ATOM 1204 CB VAL A 78 6.695 1.361 2.080 1.00 0.00 C ATOM 1205 CG1 VAL A 78 7.421 2.639 1.623 1.00 0.00 C ATOM 1206 CG2 VAL A 78 5.193 1.542 1.851 1.00 0.00 C ATOM 0 H VAL A 78 6.468 1.143 -0.414 1.00 0.00 H new ATOM 0 HA VAL A 78 8.287 0.076 1.493 1.00 0.00 H new ATOM 0 HB VAL A 78 6.880 1.178 3.139 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.050 3.491 2.192 1.00 0.00 H new ATOM 0 HG12 VAL A 78 8.492 2.529 1.791 1.00 0.00 H new ATOM 0 HG13 VAL A 78 7.235 2.803 0.562 1.00 0.00 H new ATOM 0 HG21 VAL A 78 4.838 2.396 2.427 1.00 0.00 H new ATOM 0 HG22 VAL A 78 5.005 1.715 0.791 1.00 0.00 H new ATOM 0 HG23 VAL A 78 4.665 0.644 2.171 1.00 0.00 H new ATOM 1216 N ALA A 79 5.381 -1.415 1.151 1.00 0.00 N ATOM 1217 CA ALA A 79 4.672 -2.640 1.463 1.00 0.00 C ATOM 1218 C ALA A 79 5.451 -3.851 1.009 1.00 0.00 C ATOM 1219 O ALA A 79 5.554 -4.831 1.742 1.00 0.00 O ATOM 1220 CB ALA A 79 3.292 -2.651 0.823 1.00 0.00 C ATOM 0 H ALA A 79 4.898 -0.796 0.499 1.00 0.00 H new ATOM 0 HA ALA A 79 4.559 -2.681 2.546 1.00 0.00 H new ATOM 0 HB1 ALA A 79 2.782 -3.581 1.073 1.00 0.00 H new ATOM 0 HB2 ALA A 79 2.711 -1.807 1.196 1.00 0.00 H new ATOM 0 HB3 ALA A 79 3.392 -2.572 -0.260 1.00 0.00 H new ATOM 1226 N ALA A 80 6.017 -3.773 -0.189 1.00 0.00 N ATOM 1227 CA ALA A 80 6.794 -4.875 -0.741 1.00 0.00 C ATOM 1228 C ALA A 80 7.924 -5.230 0.202 1.00 0.00 C ATOM 1229 O ALA A 80 8.086 -6.383 0.603 1.00 0.00 O ATOM 1230 CB ALA A 80 7.368 -4.481 -2.101 1.00 0.00 C ATOM 0 H ALA A 80 5.952 -2.957 -0.797 1.00 0.00 H new ATOM 0 HA ALA A 80 6.141 -5.739 -0.865 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.947 -5.311 -2.506 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.553 -4.240 -2.784 1.00 0.00 H new ATOM 0 HB3 ALA A 80 8.014 -3.610 -1.985 1.00 0.00 H new ATOM 1236 N LEU A 81 8.646 -4.215 0.629 1.00 0.00 N ATOM 1237 CA LEU A 81 9.709 -4.400 1.594 1.00 0.00 C ATOM 1238 C LEU A 81 9.119 -4.918 2.891 1.00 0.00 C ATOM 1239 O LEU A 81 9.677 -5.820 3.531 1.00 0.00 O ATOM 1240 CB LEU A 81 10.434 -3.073 1.836 1.00 0.00 C ATOM 1241 CG LEU A 81 11.217 -2.678 0.570 1.00 0.00 C ATOM 1242 CD1 LEU A 81 11.733 -1.247 0.703 1.00 0.00 C ATOM 1243 CD2 LEU A 81 12.407 -3.620 0.378 1.00 0.00 C ATOM 0 H LEU A 81 8.515 -3.251 0.322 1.00 0.00 H new ATOM 0 HA LEU A 81 10.429 -5.123 1.210 1.00 0.00 H new ATOM 0 HB2 LEU A 81 9.715 -2.294 2.090 1.00 0.00 H new ATOM 0 HB3 LEU A 81 11.114 -3.167 2.683 1.00 0.00 H new ATOM 0 HG LEU A 81 10.551 -2.749 -0.290 1.00 0.00 H new ATOM 0 HD11 LEU A 81 12.286 -0.975 -0.196 1.00 0.00 H new ATOM 0 HD12 LEU A 81 10.891 -0.567 0.831 1.00 0.00 H new ATOM 0 HD13 LEU A 81 12.391 -1.177 1.569 1.00 0.00 H new ATOM 0 HD21 LEU A 81 12.956 -3.334 -0.519 1.00 0.00 H new ATOM 0 HD22 LEU A 81 13.067 -3.554 1.243 1.00 0.00 H new ATOM 0 HD23 LEU A 81 12.047 -4.644 0.273 1.00 0.00 H new ATOM 1255 N THR A 82 7.968 -4.364 3.266 1.00 0.00 N ATOM 1256 CA THR A 82 7.303 -4.788 4.478 1.00 0.00 C ATOM 1257 C THR A 82 6.913 -6.256 4.380 1.00 0.00 C ATOM 1258 O THR A 82 7.312 -7.055 5.221 1.00 0.00 O ATOM 1259 CB THR A 82 6.049 -3.934 4.724 1.00 0.00 C ATOM 1260 OG1 THR A 82 6.376 -2.558 4.594 1.00 0.00 O ATOM 1261 CG2 THR A 82 5.512 -4.188 6.141 1.00 0.00 C ATOM 0 H THR A 82 7.487 -3.628 2.748 1.00 0.00 H new ATOM 0 HA THR A 82 7.991 -4.658 5.313 1.00 0.00 H new ATOM 0 HB THR A 82 5.288 -4.205 3.992 1.00 0.00 H new ATOM 0 HG1 THR A 82 6.438 -2.325 3.644 1.00 0.00 H new ATOM 0 HG21 THR A 82 4.623 -3.579 6.308 1.00 0.00 H new ATOM 0 HG22 THR A 82 5.256 -5.242 6.249 1.00 0.00 H new ATOM 0 HG23 THR A 82 6.276 -3.923 6.872 1.00 0.00 H new ATOM 1269 N VAL A 83 6.228 -6.642 3.299 1.00 0.00 N ATOM 1270 CA VAL A 83 5.854 -8.039 3.138 1.00 0.00 C ATOM 1271 C VAL A 83 7.078 -8.925 3.024 1.00 0.00 C ATOM 1272 O VAL A 83 7.165 -9.957 3.690 1.00 0.00 O ATOM 1273 CB VAL A 83 4.842 -8.268 1.977 1.00 0.00 C ATOM 1274 CG1 VAL A 83 5.341 -7.689 0.657 1.00 0.00 C ATOM 1275 CG2 VAL A 83 4.579 -9.764 1.786 1.00 0.00 C ATOM 0 H VAL A 83 5.931 -6.022 2.545 1.00 0.00 H new ATOM 0 HA VAL A 83 5.324 -8.331 4.045 1.00 0.00 H new ATOM 0 HB VAL A 83 3.922 -7.754 2.256 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.602 -7.873 -0.123 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.495 -6.615 0.766 1.00 0.00 H new ATOM 0 HG13 VAL A 83 6.283 -8.165 0.384 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.870 -9.908 0.971 1.00 0.00 H new ATOM 0 HG22 VAL A 83 5.514 -10.270 1.547 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.166 -10.181 2.704 1.00 0.00 H new ATOM 1285 N ALA A 84 8.058 -8.488 2.249 1.00 0.00 N ATOM 1286 CA ALA A 84 9.271 -9.262 2.106 1.00 0.00 C ATOM 1287 C ALA A 84 9.913 -9.509 3.467 1.00 0.00 C ATOM 1288 O ALA A 84 10.208 -10.650 3.826 1.00 0.00 O ATOM 1289 CB ALA A 84 10.262 -8.558 1.171 1.00 0.00 C ATOM 0 H ALA A 84 8.035 -7.616 1.720 1.00 0.00 H new ATOM 0 HA ALA A 84 9.007 -10.223 1.665 1.00 0.00 H new ATOM 0 HB1 ALA A 84 11.166 -9.160 1.080 1.00 0.00 H new ATOM 0 HB2 ALA A 84 9.808 -8.433 0.188 1.00 0.00 H new ATOM 0 HB3 ALA A 84 10.517 -7.580 1.580 1.00 0.00 H new ATOM 1295 N MET A 85 10.129 -8.449 4.229 1.00 0.00 N ATOM 1296 CA MET A 85 10.757 -8.610 5.530 1.00 0.00 C ATOM 1297 C MET A 85 9.783 -9.182 6.552 1.00 0.00 C ATOM 1298 O MET A 85 10.143 -10.037 7.355 1.00 0.00 O ATOM 1299 CB MET A 85 11.343 -7.304 6.047 1.00 0.00 C ATOM 1300 CG MET A 85 12.355 -7.629 7.158 1.00 0.00 C ATOM 1301 SD MET A 85 13.028 -6.103 7.848 1.00 0.00 S ATOM 1302 CE MET A 85 11.999 -6.036 9.339 1.00 0.00 C ATOM 0 H MET A 85 9.886 -7.491 3.978 1.00 0.00 H new ATOM 0 HA MET A 85 11.575 -9.317 5.392 1.00 0.00 H new ATOM 0 HB2 MET A 85 11.831 -6.761 5.237 1.00 0.00 H new ATOM 0 HB3 MET A 85 10.552 -6.660 6.432 1.00 0.00 H new ATOM 0 HG2 MET A 85 11.871 -8.210 7.943 1.00 0.00 H new ATOM 0 HG3 MET A 85 13.162 -8.243 6.758 1.00 0.00 H new ATOM 0 HE1 MET A 85 11.783 -4.996 9.586 1.00 0.00 H new ATOM 0 HE2 MET A 85 11.065 -6.568 9.160 1.00 0.00 H new ATOM 0 HE3 MET A 85 12.530 -6.503 10.169 1.00 0.00 H new ATOM 1312 N ASN A 86 8.556 -8.695 6.543 1.00 0.00 N ATOM 1313 CA ASN A 86 7.573 -9.169 7.512 1.00 0.00 C ATOM 1314 C ASN A 86 7.319 -10.645 7.275 1.00 0.00 C ATOM 1315 O ASN A 86 7.197 -11.418 8.212 1.00 0.00 O ATOM 1316 CB ASN A 86 6.266 -8.363 7.469 1.00 0.00 C ATOM 1317 CG ASN A 86 5.657 -8.281 8.871 1.00 0.00 C ATOM 1318 OD1 ASN A 86 4.955 -9.188 9.306 1.00 0.00 O ATOM 1319 ND2 ASN A 86 5.894 -7.239 9.613 1.00 0.00 N ATOM 0 H ASN A 86 8.217 -7.987 5.892 1.00 0.00 H new ATOM 0 HA ASN A 86 7.980 -9.023 8.513 1.00 0.00 H new ATOM 0 HB2 ASN A 86 6.460 -7.360 7.088 1.00 0.00 H new ATOM 0 HB3 ASN A 86 5.561 -8.834 6.784 1.00 0.00 H new ATOM 0 HD21 ASN A 86 5.497 -7.180 10.551 1.00 0.00 H new ATOM 0 HD22 ASN A 86 6.477 -6.481 9.257 1.00 0.00 H new ATOM 1326 N ASN A 87 7.376 -11.055 6.015 1.00 0.00 N ATOM 1327 CA ASN A 87 7.252 -12.468 5.694 1.00 0.00 C ATOM 1328 C ASN A 87 8.323 -13.251 6.422 1.00 0.00 C ATOM 1329 O ASN A 87 8.037 -14.281 7.037 1.00 0.00 O ATOM 1330 CB ASN A 87 7.326 -12.724 4.192 1.00 0.00 C ATOM 1331 CG ASN A 87 7.259 -14.221 3.939 1.00 0.00 C ATOM 1332 OD1 ASN A 87 8.214 -14.935 4.222 1.00 0.00 O ATOM 1333 ND2 ASN A 87 6.185 -14.744 3.436 1.00 0.00 N ATOM 0 H ASN A 87 7.505 -10.440 5.211 1.00 0.00 H new ATOM 0 HA ASN A 87 6.269 -12.803 6.024 1.00 0.00 H new ATOM 0 HB2 ASN A 87 6.504 -12.220 3.684 1.00 0.00 H new ATOM 0 HB3 ASN A 87 8.251 -12.315 3.786 1.00 0.00 H new ATOM 0 HD21 ASN A 87 6.135 -15.750 3.276 1.00 0.00 H new ATOM 0 HD22 ASN A 87 5.390 -14.150 3.201 1.00 0.00 H new ATOM 1340 N PHE A 88 9.508 -12.670 6.512 1.00 0.00 N ATOM 1341 CA PHE A 88 10.549 -13.259 7.329 1.00 0.00 C ATOM 1342 C PHE A 88 10.055 -13.360 8.759 1.00 0.00 C ATOM 1343 O PHE A 88 10.168 -14.406 9.380 1.00 0.00 O ATOM 1344 CB PHE A 88 11.866 -12.476 7.252 1.00 0.00 C ATOM 1345 CG PHE A 88 12.881 -13.129 8.163 1.00 0.00 C ATOM 1346 CD1 PHE A 88 13.491 -14.331 7.786 1.00 0.00 C ATOM 1347 CD2 PHE A 88 13.205 -12.536 9.387 1.00 0.00 C ATOM 1348 CE1 PHE A 88 14.420 -14.941 8.631 1.00 0.00 C ATOM 1349 CE2 PHE A 88 14.136 -13.147 10.230 1.00 0.00 C ATOM 1350 CZ PHE A 88 14.742 -14.349 9.853 1.00 0.00 C ATOM 0 H PHE A 88 9.768 -11.806 6.037 1.00 0.00 H new ATOM 0 HA PHE A 88 10.767 -14.255 6.944 1.00 0.00 H new ATOM 0 HB2 PHE A 88 12.235 -12.461 6.227 1.00 0.00 H new ATOM 0 HB3 PHE A 88 11.706 -11.439 7.549 1.00 0.00 H new ATOM 0 HD1 PHE A 88 13.242 -14.788 6.839 1.00 0.00 H new ATOM 0 HD2 PHE A 88 12.737 -11.608 9.680 1.00 0.00 H new ATOM 0 HE1 PHE A 88 14.889 -15.869 8.339 1.00 0.00 H new ATOM 0 HE2 PHE A 88 14.388 -12.690 11.175 1.00 0.00 H new ATOM 0 HZ PHE A 88 15.460 -14.820 10.508 1.00 0.00 H new ATOM 1360 N PHE A 89 9.397 -12.308 9.243 1.00 0.00 N ATOM 1361 CA PHE A 89 8.782 -12.369 10.567 1.00 0.00 C ATOM 1362 C PHE A 89 7.770 -13.509 10.606 1.00 0.00 C ATOM 1363 O PHE A 89 7.712 -14.258 11.583 1.00 0.00 O ATOM 1364 CB PHE A 89 8.060 -11.056 10.937 1.00 0.00 C ATOM 1365 CG PHE A 89 9.023 -9.899 11.158 1.00 0.00 C ATOM 1366 CD1 PHE A 89 10.407 -10.108 11.317 1.00 0.00 C ATOM 1367 CD2 PHE A 89 8.510 -8.600 11.215 1.00 0.00 C ATOM 1368 CE1 PHE A 89 11.255 -9.015 11.531 1.00 0.00 C ATOM 1369 CE2 PHE A 89 9.358 -7.515 11.424 1.00 0.00 C ATOM 1370 CZ PHE A 89 10.728 -7.718 11.583 1.00 0.00 C ATOM 0 H PHE A 89 9.277 -11.422 8.751 1.00 0.00 H new ATOM 0 HA PHE A 89 9.582 -12.532 11.289 1.00 0.00 H new ATOM 0 HB2 PHE A 89 7.360 -10.795 10.143 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.472 -11.212 11.841 1.00 0.00 H new ATOM 0 HD1 PHE A 89 10.812 -11.108 11.274 1.00 0.00 H new ATOM 0 HD2 PHE A 89 7.449 -8.437 11.096 1.00 0.00 H new ATOM 0 HE1 PHE A 89 12.316 -9.172 11.656 1.00 0.00 H new ATOM 0 HE2 PHE A 89 8.953 -6.514 11.463 1.00 0.00 H new ATOM 0 HZ PHE A 89 11.383 -6.875 11.746 1.00 0.00 H new ATOM 1380 N TRP A 90 6.975 -13.643 9.547 1.00 0.00 N ATOM 1381 CA TRP A 90 5.974 -14.716 9.487 1.00 0.00 C ATOM 1382 C TRP A 90 6.665 -16.048 9.510 1.00 0.00 C ATOM 1383 O TRP A 90 6.350 -16.922 10.318 1.00 0.00 O ATOM 1384 CB TRP A 90 5.156 -14.626 8.183 1.00 0.00 C ATOM 1385 CG TRP A 90 4.676 -13.237 7.967 1.00 0.00 C ATOM 1386 CD1 TRP A 90 4.618 -12.294 8.912 1.00 0.00 C ATOM 1387 CD2 TRP A 90 4.188 -12.618 6.740 1.00 0.00 C ATOM 1388 NE1 TRP A 90 4.130 -11.151 8.353 1.00 0.00 N ATOM 1389 CE2 TRP A 90 3.849 -11.291 7.020 1.00 0.00 C ATOM 1390 CE3 TRP A 90 4.012 -13.079 5.432 1.00 0.00 C ATOM 1391 CZ2 TRP A 90 3.347 -10.441 6.045 1.00 0.00 C ATOM 1392 CZ3 TRP A 90 3.509 -12.228 4.439 1.00 0.00 C ATOM 1393 CH2 TRP A 90 3.175 -10.910 4.748 1.00 0.00 C ATOM 0 H TRP A 90 6.999 -13.035 8.729 1.00 0.00 H new ATOM 0 HA TRP A 90 5.310 -14.609 10.345 1.00 0.00 H new ATOM 0 HB2 TRP A 90 5.770 -14.941 7.339 1.00 0.00 H new ATOM 0 HB3 TRP A 90 4.307 -15.308 8.231 1.00 0.00 H new ATOM 0 HD1 TRP A 90 4.909 -12.417 9.945 1.00 0.00 H new ATOM 0 HE1 TRP A 90 3.989 -10.284 8.872 1.00 0.00 H new ATOM 0 HE3 TRP A 90 4.266 -14.099 5.185 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 3.091 -9.421 6.292 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 3.380 -12.594 3.431 1.00 0.00 H new ATOM 0 HH2 TRP A 90 2.784 -10.256 3.982 1.00 0.00 H new ATOM 1453 N SER B 2 10.024 4.125 11.406 1.00 0.00 N ATOM 1454 CA SER B 2 9.017 5.135 11.716 1.00 0.00 C ATOM 1455 C SER B 2 7.654 4.498 11.992 1.00 0.00 C ATOM 1456 O SER B 2 7.442 3.309 11.716 1.00 0.00 O ATOM 1457 CB SER B 2 8.903 6.116 10.561 1.00 0.00 C ATOM 1458 OG SER B 2 10.193 6.637 10.242 1.00 0.00 O ATOM 0 HA SER B 2 9.331 5.662 12.617 1.00 0.00 H new ATOM 0 HB2 SER B 2 8.476 5.619 9.690 1.00 0.00 H new ATOM 0 HB3 SER B 2 8.228 6.929 10.827 1.00 0.00 H new ATOM 0 HG SER B 2 10.094 7.431 9.676 1.00 0.00 H new ATOM 1464 N GLU B 3 6.694 5.332 12.387 1.00 0.00 N ATOM 1465 CA GLU B 3 5.323 4.893 12.596 1.00 0.00 C ATOM 1466 C GLU B 3 4.822 4.245 11.324 1.00 0.00 C ATOM 1467 O GLU B 3 3.881 3.455 11.333 1.00 0.00 O ATOM 1468 CB GLU B 3 4.425 6.093 12.898 1.00 0.00 C ATOM 1469 CG GLU B 3 4.919 6.845 14.143 1.00 0.00 C ATOM 1470 CD GLU B 3 5.981 7.871 13.775 1.00 0.00 C ATOM 1471 OE1 GLU B 3 6.460 7.847 12.661 1.00 0.00 O ATOM 1472 OE2 GLU B 3 6.317 8.660 14.620 1.00 0.00 O ATOM 0 H GLU B 3 6.847 6.324 12.569 1.00 0.00 H new ATOM 0 HA GLU B 3 5.298 4.194 13.432 1.00 0.00 H new ATOM 0 HB2 GLU B 3 4.412 6.767 12.042 1.00 0.00 H new ATOM 0 HB3 GLU B 3 3.400 5.756 13.054 1.00 0.00 H new ATOM 0 HG2 GLU B 3 4.080 7.343 14.628 1.00 0.00 H new ATOM 0 HG3 GLU B 3 5.328 6.135 14.862 1.00 0.00 H new ATOM 1479 N LEU B 4 5.446 4.606 10.226 1.00 0.00 N ATOM 1480 CA LEU B 4 5.059 4.086 8.942 1.00 0.00 C ATOM 1481 C LEU B 4 5.238 2.586 8.950 1.00 0.00 C ATOM 1482 O LEU B 4 4.350 1.848 8.526 1.00 0.00 O ATOM 1483 CB LEU B 4 5.891 4.723 7.817 1.00 0.00 C ATOM 1484 CG LEU B 4 5.368 6.139 7.477 1.00 0.00 C ATOM 1485 CD1 LEU B 4 3.839 6.146 7.331 1.00 0.00 C ATOM 1486 CD2 LEU B 4 5.778 7.129 8.575 1.00 0.00 C ATOM 0 H LEU B 4 6.227 5.261 10.201 1.00 0.00 H new ATOM 0 HA LEU B 4 4.013 4.330 8.755 1.00 0.00 H new ATOM 0 HB2 LEU B 4 6.936 4.780 8.120 1.00 0.00 H new ATOM 0 HB3 LEU B 4 5.851 4.093 6.928 1.00 0.00 H new ATOM 0 HG LEU B 4 5.809 6.439 6.527 1.00 0.00 H new ATOM 0 HD11 LEU B 4 3.501 7.154 7.092 1.00 0.00 H new ATOM 0 HD12 LEU B 4 3.547 5.466 6.531 1.00 0.00 H new ATOM 0 HD13 LEU B 4 3.383 5.822 8.267 1.00 0.00 H new ATOM 0 HD21 LEU B 4 5.405 8.123 8.327 1.00 0.00 H new ATOM 0 HD22 LEU B 4 5.356 6.811 9.528 1.00 0.00 H new ATOM 0 HD23 LEU B 4 6.865 7.158 8.652 1.00 0.00 H new ATOM 1498 N GLU B 5 6.321 2.126 9.567 1.00 0.00 N ATOM 1499 CA GLU B 5 6.518 0.701 9.709 1.00 0.00 C ATOM 1500 C GLU B 5 5.384 0.117 10.533 1.00 0.00 C ATOM 1501 O GLU B 5 4.776 -0.878 10.148 1.00 0.00 O ATOM 1502 CB GLU B 5 7.872 0.376 10.365 1.00 0.00 C ATOM 1503 CG GLU B 5 9.018 0.744 9.416 1.00 0.00 C ATOM 1504 CD GLU B 5 10.364 0.310 9.991 1.00 0.00 C ATOM 1505 OE1 GLU B 5 10.387 -0.205 11.099 1.00 0.00 O ATOM 1506 OE2 GLU B 5 11.351 0.490 9.317 1.00 0.00 O ATOM 0 H GLU B 5 7.057 2.709 9.966 1.00 0.00 H new ATOM 0 HA GLU B 5 6.522 0.255 8.714 1.00 0.00 H new ATOM 0 HB2 GLU B 5 7.973 0.926 11.301 1.00 0.00 H new ATOM 0 HB3 GLU B 5 7.920 -0.685 10.612 1.00 0.00 H new ATOM 0 HG2 GLU B 5 8.861 0.267 8.448 1.00 0.00 H new ATOM 0 HG3 GLU B 5 9.022 1.820 9.244 1.00 0.00 H new ATOM 1513 N THR B 6 4.997 0.828 11.576 1.00 0.00 N ATOM 1514 CA THR B 6 3.852 0.431 12.373 1.00 0.00 C ATOM 1515 C THR B 6 2.588 0.458 11.514 1.00 0.00 C ATOM 1516 O THR B 6 1.804 -0.502 11.497 1.00 0.00 O ATOM 1517 CB THR B 6 3.710 1.377 13.561 1.00 0.00 C ATOM 1518 OG1 THR B 6 4.991 1.557 14.156 1.00 0.00 O ATOM 1519 CG2 THR B 6 2.748 0.779 14.596 1.00 0.00 C ATOM 0 H THR B 6 5.458 1.682 11.890 1.00 0.00 H new ATOM 0 HA THR B 6 3.997 -0.584 12.743 1.00 0.00 H new ATOM 0 HB THR B 6 3.314 2.334 13.221 1.00 0.00 H new ATOM 0 HG1 THR B 6 4.914 2.165 14.921 1.00 0.00 H new ATOM 0 HG21 THR B 6 2.653 1.461 15.441 1.00 0.00 H new ATOM 0 HG22 THR B 6 1.770 0.628 14.139 1.00 0.00 H new ATOM 0 HG23 THR B 6 3.137 -0.178 14.944 1.00 0.00 H new ATOM 1527 N ALA B 7 2.425 1.525 10.755 1.00 0.00 N ATOM 1528 CA ALA B 7 1.289 1.640 9.869 1.00 0.00 C ATOM 1529 C ALA B 7 1.278 0.472 8.906 1.00 0.00 C ATOM 1530 O ALA B 7 0.267 -0.222 8.768 1.00 0.00 O ATOM 1531 CB ALA B 7 1.354 2.957 9.092 1.00 0.00 C ATOM 0 H ALA B 7 3.064 2.320 10.736 1.00 0.00 H new ATOM 0 HA ALA B 7 0.374 1.630 10.461 1.00 0.00 H new ATOM 0 HB1 ALA B 7 0.492 3.031 8.428 1.00 0.00 H new ATOM 0 HB2 ALA B 7 1.346 3.793 9.791 1.00 0.00 H new ATOM 0 HB3 ALA B 7 2.270 2.987 8.502 1.00 0.00 H new ATOM 1537 N MET B 8 2.433 0.194 8.310 1.00 0.00 N ATOM 1538 CA MET B 8 2.548 -0.935 7.398 1.00 0.00 C ATOM 1539 C MET B 8 2.308 -2.243 8.142 1.00 0.00 C ATOM 1540 O MET B 8 1.580 -3.118 7.670 1.00 0.00 O ATOM 1541 CB MET B 8 3.925 -0.959 6.721 1.00 0.00 C ATOM 1542 CG MET B 8 4.109 0.312 5.876 1.00 0.00 C ATOM 1543 SD MET B 8 2.741 0.467 4.703 1.00 0.00 S ATOM 1544 CE MET B 8 3.154 -0.952 3.671 1.00 0.00 C ATOM 0 H MET B 8 3.292 0.728 8.440 1.00 0.00 H new ATOM 0 HA MET B 8 1.789 -0.822 6.624 1.00 0.00 H new ATOM 0 HB2 MET B 8 4.710 -1.023 7.474 1.00 0.00 H new ATOM 0 HB3 MET B 8 4.015 -1.843 6.090 1.00 0.00 H new ATOM 0 HG2 MET B 8 4.147 1.188 6.523 1.00 0.00 H new ATOM 0 HG3 MET B 8 5.057 0.270 5.340 1.00 0.00 H new ATOM 0 HE1 MET B 8 3.071 -0.674 2.620 1.00 0.00 H new ATOM 0 HE2 MET B 8 4.174 -1.271 3.883 1.00 0.00 H new ATOM 0 HE3 MET B 8 2.466 -1.770 3.885 1.00 0.00 H new ATOM 1554 N GLU B 9 2.860 -2.354 9.338 1.00 0.00 N ATOM 1555 CA GLU B 9 2.641 -3.538 10.146 1.00 0.00 C ATOM 1556 C GLU B 9 1.189 -3.651 10.588 1.00 0.00 C ATOM 1557 O GLU B 9 0.621 -4.751 10.612 1.00 0.00 O ATOM 1558 CB GLU B 9 3.614 -3.633 11.318 1.00 0.00 C ATOM 1559 CG GLU B 9 5.018 -3.931 10.764 1.00 0.00 C ATOM 1560 CD GLU B 9 6.022 -4.046 11.891 1.00 0.00 C ATOM 1561 OE1 GLU B 9 5.968 -3.243 12.787 1.00 0.00 O ATOM 1562 OE2 GLU B 9 6.822 -4.955 11.849 1.00 0.00 O ATOM 0 H GLU B 9 3.457 -1.646 9.766 1.00 0.00 H new ATOM 0 HA GLU B 9 2.851 -4.399 9.511 1.00 0.00 H new ATOM 0 HB2 GLU B 9 3.620 -2.700 11.882 1.00 0.00 H new ATOM 0 HB3 GLU B 9 3.303 -4.420 12.006 1.00 0.00 H new ATOM 0 HG2 GLU B 9 4.999 -4.858 10.190 1.00 0.00 H new ATOM 0 HG3 GLU B 9 5.321 -3.138 10.080 1.00 0.00 H new ATOM 1569 N THR B 10 0.555 -2.517 10.842 1.00 0.00 N ATOM 1570 CA THR B 10 -0.858 -2.530 11.166 1.00 0.00 C ATOM 1571 C THR B 10 -1.598 -3.182 9.997 1.00 0.00 C ATOM 1572 O THR B 10 -2.392 -4.103 10.188 1.00 0.00 O ATOM 1573 CB THR B 10 -1.386 -1.098 11.421 1.00 0.00 C ATOM 1574 OG1 THR B 10 -0.483 -0.404 12.279 1.00 0.00 O ATOM 1575 CG2 THR B 10 -2.761 -1.169 12.107 1.00 0.00 C ATOM 0 H THR B 10 0.988 -1.594 10.830 1.00 0.00 H new ATOM 0 HA THR B 10 -1.025 -3.096 12.083 1.00 0.00 H new ATOM 0 HB THR B 10 -1.473 -0.575 10.469 1.00 0.00 H new ATOM 0 HG1 THR B 10 0.275 -0.070 11.755 1.00 0.00 H new ATOM 0 HG21 THR B 10 -3.131 -0.159 12.286 1.00 0.00 H new ATOM 0 HG22 THR B 10 -3.461 -1.704 11.465 1.00 0.00 H new ATOM 0 HG23 THR B 10 -2.667 -1.694 13.057 1.00 0.00 H new ATOM 1583 N LEU B 11 -1.207 -2.805 8.782 1.00 0.00 N ATOM 1584 CA LEU B 11 -1.752 -3.418 7.576 1.00 0.00 C ATOM 1585 C LEU B 11 -1.412 -4.917 7.558 1.00 0.00 C ATOM 1586 O LEU B 11 -2.248 -5.750 7.192 1.00 0.00 O ATOM 1587 CB LEU B 11 -1.144 -2.746 6.324 1.00 0.00 C ATOM 1588 CG LEU B 11 -1.640 -1.295 6.178 1.00 0.00 C ATOM 1589 CD1 LEU B 11 -0.755 -0.557 5.165 1.00 0.00 C ATOM 1590 CD2 LEU B 11 -3.075 -1.292 5.648 1.00 0.00 C ATOM 0 H LEU B 11 -0.514 -2.077 8.608 1.00 0.00 H new ATOM 0 HA LEU B 11 -2.834 -3.287 7.570 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -0.056 -2.757 6.394 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -1.412 -3.317 5.435 1.00 0.00 H new ATOM 0 HG LEU B 11 -1.598 -0.805 7.151 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -1.103 0.471 5.059 1.00 0.00 H new ATOM 0 HD12 LEU B 11 0.277 -0.556 5.516 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -0.810 -1.060 4.200 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -3.423 -0.264 5.546 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -3.105 -1.784 4.676 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -3.721 -1.826 6.344 1.00 0.00 H new ATOM 1602 N ILE B 12 -0.178 -5.253 7.937 1.00 0.00 N ATOM 1603 CA ILE B 12 0.263 -6.654 7.927 1.00 0.00 C ATOM 1604 C ILE B 12 -0.575 -7.467 8.912 1.00 0.00 C ATOM 1605 O ILE B 12 -0.983 -8.597 8.623 1.00 0.00 O ATOM 1606 CB ILE B 12 1.749 -6.753 8.351 1.00 0.00 C ATOM 1607 CG1 ILE B 12 2.677 -6.110 7.299 1.00 0.00 C ATOM 1608 CG2 ILE B 12 2.134 -8.229 8.535 1.00 0.00 C ATOM 1609 CD1 ILE B 12 2.752 -6.978 6.038 1.00 0.00 C ATOM 0 H ILE B 12 0.527 -4.587 8.251 1.00 0.00 H new ATOM 0 HA ILE B 12 0.142 -7.045 6.917 1.00 0.00 H new ATOM 0 HB ILE B 12 1.870 -6.213 9.290 1.00 0.00 H new ATOM 0 HG12 ILE B 12 2.309 -5.117 7.041 1.00 0.00 H new ATOM 0 HG13 ILE B 12 3.675 -5.981 7.718 1.00 0.00 H new ATOM 0 HG21 ILE B 12 3.180 -8.298 8.833 1.00 0.00 H new ATOM 0 HG22 ILE B 12 1.507 -8.675 9.307 1.00 0.00 H new ATOM 0 HG23 ILE B 12 1.989 -8.763 7.596 1.00 0.00 H new ATOM 0 HD11 ILE B 12 3.411 -6.506 5.310 1.00 0.00 H new ATOM 0 HD12 ILE B 12 3.142 -7.962 6.297 1.00 0.00 H new ATOM 0 HD13 ILE B 12 1.755 -7.084 5.610 1.00 0.00 H new ATOM 1621 N ASN B 13 -0.786 -6.905 10.087 1.00 0.00 N ATOM 1622 CA ASN B 13 -1.493 -7.606 11.147 1.00 0.00 C ATOM 1623 C ASN B 13 -2.912 -7.919 10.727 1.00 0.00 C ATOM 1624 O ASN B 13 -3.393 -9.036 10.912 1.00 0.00 O ATOM 1625 CB ASN B 13 -1.498 -6.769 12.420 1.00 0.00 C ATOM 1626 CG ASN B 13 -0.139 -6.857 13.099 1.00 0.00 C ATOM 1627 OD1 ASN B 13 0.134 -7.817 13.814 1.00 0.00 O ATOM 1628 ND2 ASN B 13 0.741 -5.928 12.895 1.00 0.00 N ATOM 0 H ASN B 13 -0.478 -5.964 10.334 1.00 0.00 H new ATOM 0 HA ASN B 13 -0.975 -8.545 11.342 1.00 0.00 H new ATOM 0 HB2 ASN B 13 -1.730 -5.731 12.183 1.00 0.00 H new ATOM 0 HB3 ASN B 13 -2.276 -7.123 13.096 1.00 0.00 H new ATOM 0 HD21 ASN B 13 1.662 -5.994 13.329 1.00 0.00 H new ATOM 0 HD22 ASN B 13 0.513 -5.131 12.301 1.00 0.00 H new ATOM 1635 N VAL B 14 -3.545 -6.963 10.080 1.00 0.00 N ATOM 1636 CA VAL B 14 -4.884 -7.164 9.562 1.00 0.00 C ATOM 1637 C VAL B 14 -4.856 -8.265 8.514 1.00 0.00 C ATOM 1638 O VAL B 14 -5.690 -9.176 8.521 1.00 0.00 O ATOM 1639 CB VAL B 14 -5.400 -5.860 8.946 1.00 0.00 C ATOM 1640 CG1 VAL B 14 -6.799 -6.062 8.362 1.00 0.00 C ATOM 1641 CG2 VAL B 14 -5.447 -4.776 10.020 1.00 0.00 C ATOM 0 H VAL B 14 -3.155 -6.038 9.900 1.00 0.00 H new ATOM 0 HA VAL B 14 -5.552 -7.457 10.372 1.00 0.00 H new ATOM 0 HB VAL B 14 -4.726 -5.557 8.145 1.00 0.00 H new ATOM 0 HG11 VAL B 14 -7.151 -5.126 7.928 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -6.763 -6.829 7.589 1.00 0.00 H new ATOM 0 HG13 VAL B 14 -7.481 -6.375 9.152 1.00 0.00 H new ATOM 0 HG21 VAL B 14 -5.814 -3.847 9.584 1.00 0.00 H new ATOM 0 HG22 VAL B 14 -6.115 -5.088 10.823 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -4.446 -4.618 10.421 1.00 0.00 H new ATOM 1651 N PHE B 15 -3.858 -8.201 7.646 1.00 0.00 N ATOM 1652 CA PHE B 15 -3.685 -9.203 6.610 1.00 0.00 C ATOM 1653 C PHE B 15 -3.563 -10.575 7.273 1.00 0.00 C ATOM 1654 O PHE B 15 -4.309 -11.503 6.953 1.00 0.00 O ATOM 1655 CB PHE B 15 -2.408 -8.877 5.817 1.00 0.00 C ATOM 1656 CG PHE B 15 -2.226 -9.814 4.645 1.00 0.00 C ATOM 1657 CD1 PHE B 15 -2.875 -9.550 3.431 1.00 0.00 C ATOM 1658 CD2 PHE B 15 -1.393 -10.936 4.764 1.00 0.00 C ATOM 1659 CE1 PHE B 15 -2.687 -10.406 2.341 1.00 0.00 C ATOM 1660 CE2 PHE B 15 -1.212 -11.791 3.673 1.00 0.00 C ATOM 1661 CZ PHE B 15 -1.856 -11.524 2.463 1.00 0.00 C ATOM 0 H PHE B 15 -3.154 -7.463 7.640 1.00 0.00 H new ATOM 0 HA PHE B 15 -4.537 -9.208 5.930 1.00 0.00 H new ATOM 0 HB2 PHE B 15 -2.455 -7.849 5.458 1.00 0.00 H new ATOM 0 HB3 PHE B 15 -1.542 -8.945 6.476 1.00 0.00 H new ATOM 0 HD1 PHE B 15 -3.519 -8.688 3.338 1.00 0.00 H new ATOM 0 HD2 PHE B 15 -0.891 -11.139 5.699 1.00 0.00 H new ATOM 0 HE1 PHE B 15 -3.184 -10.203 1.404 1.00 0.00 H new ATOM 0 HE2 PHE B 15 -0.574 -12.658 3.766 1.00 0.00 H new ATOM 0 HZ PHE B 15 -1.712 -12.183 1.619 1.00 0.00 H new ATOM 1671 N HIS B 16 -2.731 -10.646 8.308 1.00 0.00 N ATOM 1672 CA HIS B 16 -2.595 -11.879 9.097 1.00 0.00 C ATOM 1673 C HIS B 16 -3.917 -12.279 9.723 1.00 0.00 C ATOM 1674 O HIS B 16 -4.313 -13.452 9.672 1.00 0.00 O ATOM 1675 CB HIS B 16 -1.548 -11.707 10.201 1.00 0.00 C ATOM 1676 CG HIS B 16 -0.224 -12.192 9.707 1.00 0.00 C ATOM 1677 ND1 HIS B 16 0.431 -13.265 10.294 1.00 0.00 N ATOM 1678 CD2 HIS B 16 0.579 -11.770 8.682 1.00 0.00 C ATOM 1679 CE1 HIS B 16 1.579 -13.448 9.621 1.00 0.00 C ATOM 1680 NE2 HIS B 16 1.717 -12.564 8.629 1.00 0.00 N ATOM 0 H HIS B 16 -2.143 -9.874 8.623 1.00 0.00 H new ATOM 0 HA HIS B 16 -2.274 -12.665 8.414 1.00 0.00 H new ATOM 0 HB2 HIS B 16 -1.479 -10.659 10.492 1.00 0.00 H new ATOM 0 HB3 HIS B 16 -1.844 -12.265 11.089 1.00 0.00 H new ATOM 0 HD2 HIS B 16 0.361 -10.947 8.017 1.00 0.00 H new ATOM 0 HE1 HIS B 16 2.302 -14.216 9.853 1.00 0.00 H new ATOM 0 HE2 HIS B 16 2.494 -12.488 7.972 1.00 0.00 H new ATOM 1689 N ALA B 17 -4.608 -11.304 10.303 1.00 0.00 N ATOM 1690 CA ALA B 17 -5.876 -11.571 10.963 1.00 0.00 C ATOM 1691 C ALA B 17 -6.812 -12.294 10.015 1.00 0.00 C ATOM 1692 O ALA B 17 -7.620 -13.126 10.444 1.00 0.00 O ATOM 1693 CB ALA B 17 -6.519 -10.270 11.449 1.00 0.00 C ATOM 0 H ALA B 17 -4.312 -10.328 10.329 1.00 0.00 H new ATOM 0 HA ALA B 17 -5.687 -12.204 11.830 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -7.466 -10.493 11.940 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -5.852 -9.776 12.156 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -6.697 -9.612 10.598 1.00 0.00 H new ATOM 1699 N HIS B 18 -6.716 -11.956 8.731 1.00 0.00 N ATOM 1700 CA HIS B 18 -7.538 -12.592 7.704 1.00 0.00 C ATOM 1701 C HIS B 18 -6.892 -13.853 7.135 1.00 0.00 C ATOM 1702 O HIS B 18 -7.581 -14.834 6.867 1.00 0.00 O ATOM 1703 CB HIS B 18 -7.888 -11.603 6.595 1.00 0.00 C ATOM 1704 CG HIS B 18 -8.914 -10.649 7.128 1.00 0.00 C ATOM 1705 ND1 HIS B 18 -10.254 -10.976 7.175 1.00 0.00 N ATOM 1706 CD2 HIS B 18 -8.809 -9.397 7.676 1.00 0.00 C ATOM 1707 CE1 HIS B 18 -10.904 -9.940 7.740 1.00 0.00 C ATOM 1708 NE2 HIS B 18 -10.069 -8.951 8.065 1.00 0.00 N ATOM 0 H HIS B 18 -6.077 -11.245 8.377 1.00 0.00 H new ATOM 0 HA HIS B 18 -8.463 -12.906 8.188 1.00 0.00 H new ATOM 0 HB2 HIS B 18 -6.998 -11.063 6.272 1.00 0.00 H new ATOM 0 HB3 HIS B 18 -8.275 -12.130 5.723 1.00 0.00 H new ATOM 0 HD1 HIS B 18 -10.675 -11.843 6.843 1.00 0.00 H new ATOM 0 HD2 HIS B 18 -7.890 -8.842 7.789 1.00 0.00 H new ATOM 0 HE1 HIS B 18 -11.970 -9.913 7.909 1.00 0.00 H new ATOM 1717 N SER B 19 -5.568 -13.851 6.989 1.00 0.00 N ATOM 1718 CA SER B 19 -4.880 -15.035 6.458 1.00 0.00 C ATOM 1719 C SER B 19 -5.179 -16.242 7.321 1.00 0.00 C ATOM 1720 O SER B 19 -5.500 -17.326 6.813 1.00 0.00 O ATOM 1721 CB SER B 19 -3.369 -14.812 6.411 1.00 0.00 C ATOM 1722 OG SER B 19 -3.069 -13.772 5.491 1.00 0.00 O ATOM 0 H SER B 19 -4.960 -13.066 7.223 1.00 0.00 H new ATOM 0 HA SER B 19 -5.243 -15.209 5.445 1.00 0.00 H new ATOM 0 HB2 SER B 19 -2.999 -14.552 7.403 1.00 0.00 H new ATOM 0 HB3 SER B 19 -2.865 -15.731 6.113 1.00 0.00 H new ATOM 0 HG SER B 19 -3.810 -13.671 4.858 1.00 0.00 H new ATOM 1728 N GLY B 20 -5.152 -16.034 8.626 1.00 0.00 N ATOM 1729 CA GLY B 20 -5.473 -17.097 9.553 1.00 0.00 C ATOM 1730 C GLY B 20 -6.865 -17.620 9.259 1.00 0.00 C ATOM 1731 O GLY B 20 -7.111 -18.828 9.299 1.00 0.00 O ATOM 0 H GLY B 20 -4.912 -15.144 9.062 1.00 0.00 H new ATOM 0 HA2 GLY B 20 -4.744 -17.903 9.466 1.00 0.00 H new ATOM 0 HA3 GLY B 20 -5.420 -16.729 10.578 1.00 0.00 H new ATOM 1735 N LYS B 21 -7.773 -16.707 8.956 1.00 0.00 N ATOM 1736 CA LYS B 21 -9.144 -17.062 8.627 1.00 0.00 C ATOM 1737 C LYS B 21 -9.192 -17.722 7.256 1.00 0.00 C ATOM 1738 O LYS B 21 -9.889 -18.721 7.053 1.00 0.00 O ATOM 1739 CB LYS B 21 -9.993 -15.793 8.560 1.00 0.00 C ATOM 1740 CG LYS B 21 -9.813 -14.985 9.837 1.00 0.00 C ATOM 1741 CD LYS B 21 -10.367 -15.734 11.043 1.00 0.00 C ATOM 1742 CE LYS B 21 -9.819 -15.088 12.326 1.00 0.00 C ATOM 1743 NZ LYS B 21 -9.534 -13.640 12.097 1.00 0.00 N ATOM 0 H LYS B 21 -7.583 -15.705 8.931 1.00 0.00 H new ATOM 0 HA LYS B 21 -9.522 -17.743 9.390 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -9.702 -15.195 7.696 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -11.043 -16.053 8.428 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -8.755 -14.774 9.991 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -10.319 -14.025 9.738 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -11.456 -15.700 11.040 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -10.081 -16.785 10.998 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -10.541 -15.200 13.135 1.00 0.00 H new ATOM 0 HE3 LYS B 21 -8.909 -15.600 12.639 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 -9.445 -13.155 13.013 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 -8.646 -13.541 11.565 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 -10.312 -13.215 11.554 1.00 0.00 H new ATOM 1757 N GLU B 22 -8.532 -17.079 6.294 1.00 0.00 N ATOM 1758 CA GLU B 22 -8.629 -17.471 4.896 1.00 0.00 C ATOM 1759 C GLU B 22 -8.036 -18.834 4.592 1.00 0.00 C ATOM 1760 O GLU B 22 -8.681 -19.653 3.924 1.00 0.00 O ATOM 1761 CB GLU B 22 -8.088 -16.362 3.964 1.00 0.00 C ATOM 1762 CG GLU B 22 -6.635 -16.641 3.515 1.00 0.00 C ATOM 1763 CD GLU B 22 -6.594 -17.683 2.409 1.00 0.00 C ATOM 1764 OE1 GLU B 22 -7.500 -17.698 1.602 1.00 0.00 O ATOM 1765 OE2 GLU B 22 -5.653 -18.454 2.382 1.00 0.00 O ATOM 0 H GLU B 22 -7.921 -16.280 6.463 1.00 0.00 H new ATOM 0 HA GLU B 22 -9.693 -17.587 4.688 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -8.729 -16.281 3.086 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -8.130 -15.403 4.479 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -6.175 -15.717 3.165 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -6.048 -16.986 4.366 1.00 0.00 H new ATOM 1772 N GLY B 23 -6.846 -19.114 5.097 1.00 0.00 N ATOM 1773 CA GLY B 23 -6.244 -20.416 4.827 1.00 0.00 C ATOM 1774 C GLY B 23 -4.754 -20.445 5.103 1.00 0.00 C ATOM 1775 O GLY B 23 -4.298 -21.155 6.009 1.00 0.00 O ATOM 0 H GLY B 23 -6.291 -18.485 5.677 1.00 0.00 H new ATOM 0 HA2 GLY B 23 -6.736 -21.172 5.438 1.00 0.00 H new ATOM 0 HA3 GLY B 23 -6.421 -20.684 3.785 1.00 0.00 H new ATOM 1779 N ASP B 24 -3.979 -19.752 4.284 1.00 0.00 N ATOM 1780 CA ASP B 24 -2.521 -19.800 4.423 1.00 0.00 C ATOM 1781 C ASP B 24 -2.043 -19.072 5.655 1.00 0.00 C ATOM 1782 O ASP B 24 -2.721 -18.188 6.181 1.00 0.00 O ATOM 1783 CB ASP B 24 -1.786 -19.264 3.186 1.00 0.00 C ATOM 1784 CG ASP B 24 -0.277 -19.456 3.348 1.00 0.00 C ATOM 1785 OD1 ASP B 24 0.155 -20.596 3.466 1.00 0.00 O ATOM 1786 OD2 ASP B 24 0.427 -18.473 3.364 1.00 0.00 O ATOM 0 H ASP B 24 -4.320 -19.159 3.528 1.00 0.00 H new ATOM 0 HA ASP B 24 -2.277 -20.857 4.526 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -2.133 -19.784 2.293 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -2.013 -18.207 3.048 1.00 0.00 H new ATOM 1791 N LYS B 25 -0.831 -19.394 6.048 1.00 0.00 N ATOM 1792 CA LYS B 25 -0.153 -18.734 7.159 1.00 0.00 C ATOM 1793 C LYS B 25 -0.118 -17.236 6.897 1.00 0.00 C ATOM 1794 O LYS B 25 -0.431 -16.435 7.784 1.00 0.00 O ATOM 1795 CB LYS B 25 1.282 -19.286 7.301 1.00 0.00 C ATOM 1796 CG LYS B 25 1.762 -19.742 5.930 1.00 0.00 C ATOM 1797 CD LYS B 25 3.151 -20.321 5.994 1.00 0.00 C ATOM 1798 CE LYS B 25 3.571 -20.638 4.569 1.00 0.00 C ATOM 1799 NZ LYS B 25 2.507 -21.446 3.903 1.00 0.00 N ATOM 0 H LYS B 25 -0.277 -20.127 5.606 1.00 0.00 H new ATOM 0 HA LYS B 25 -0.691 -18.927 8.087 1.00 0.00 H new ATOM 0 HB2 LYS B 25 1.946 -18.518 7.699 1.00 0.00 H new ATOM 0 HB3 LYS B 25 1.300 -20.118 8.005 1.00 0.00 H new ATOM 0 HG2 LYS B 25 1.074 -20.488 5.532 1.00 0.00 H new ATOM 0 HG3 LYS B 25 1.750 -18.898 5.240 1.00 0.00 H new ATOM 0 HD2 LYS B 25 3.842 -19.613 6.450 1.00 0.00 H new ATOM 0 HD3 LYS B 25 3.165 -21.221 6.609 1.00 0.00 H new ATOM 0 HE2 LYS B 25 3.741 -19.715 4.015 1.00 0.00 H new ATOM 0 HE3 LYS B 25 4.512 -21.187 4.570 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 2.914 -21.956 3.093 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 2.115 -22.130 4.581 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 1.750 -20.816 3.570 1.00 0.00 H new ATOM 1813 N TYR B 26 0.128 -16.868 5.644 1.00 0.00 N ATOM 1814 CA TYR B 26 0.026 -15.480 5.237 1.00 0.00 C ATOM 1815 C TYR B 26 -0.404 -15.362 3.779 1.00 0.00 C ATOM 1816 O TYR B 26 0.427 -15.187 2.884 1.00 0.00 O ATOM 1817 CB TYR B 26 1.348 -14.745 5.459 1.00 0.00 C ATOM 1818 CG TYR B 26 2.510 -15.683 5.246 1.00 0.00 C ATOM 1819 CD1 TYR B 26 3.034 -15.892 3.961 1.00 0.00 C ATOM 1820 CD2 TYR B 26 3.067 -16.330 6.341 1.00 0.00 C ATOM 1821 CE1 TYR B 26 4.117 -16.755 3.782 1.00 0.00 C ATOM 1822 CE2 TYR B 26 4.154 -17.195 6.168 1.00 0.00 C ATOM 1823 CZ TYR B 26 4.680 -17.406 4.885 1.00 0.00 C ATOM 1824 OH TYR B 26 5.746 -18.263 4.709 1.00 0.00 O ATOM 0 H TYR B 26 0.398 -17.511 4.900 1.00 0.00 H new ATOM 0 HA TYR B 26 -0.738 -15.013 5.858 1.00 0.00 H new ATOM 0 HB2 TYR B 26 1.422 -13.901 4.773 1.00 0.00 H new ATOM 0 HB3 TYR B 26 1.381 -14.338 6.470 1.00 0.00 H new ATOM 0 HD1 TYR B 26 2.600 -15.386 3.111 1.00 0.00 H new ATOM 0 HD2 TYR B 26 2.661 -16.166 7.328 1.00 0.00 H new ATOM 0 HE1 TYR B 26 4.520 -16.920 2.793 1.00 0.00 H new ATOM 0 HE2 TYR B 26 4.586 -17.698 7.020 1.00 0.00 H new ATOM 0 HH TYR B 26 6.017 -18.631 5.576 1.00 0.00 H new ATOM 1834 N LYS B 27 -1.694 -15.229 3.589 1.00 0.00 N ATOM 1835 CA LYS B 27 -2.295 -14.919 2.298 1.00 0.00 C ATOM 1836 C LYS B 27 -3.657 -14.362 2.535 1.00 0.00 C ATOM 1837 O LYS B 27 -4.270 -14.639 3.560 1.00 0.00 O ATOM 1838 CB LYS B 27 -2.430 -16.148 1.378 1.00 0.00 C ATOM 1839 CG LYS B 27 -1.063 -16.618 0.851 1.00 0.00 C ATOM 1840 CD LYS B 27 -0.485 -15.572 -0.130 1.00 0.00 C ATOM 1841 CE LYS B 27 -0.973 -15.849 -1.558 1.00 0.00 C ATOM 1842 NZ LYS B 27 -0.403 -17.115 -2.058 1.00 0.00 N ATOM 0 H LYS B 27 -2.377 -15.334 4.339 1.00 0.00 H new ATOM 0 HA LYS B 27 -1.637 -14.208 1.798 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -2.908 -16.961 1.925 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -3.080 -15.904 0.537 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -0.375 -16.767 1.683 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -1.169 -17.580 0.349 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -0.788 -14.571 0.176 1.00 0.00 H new ATOM 0 HD3 LYS B 27 0.604 -15.599 -0.100 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -2.062 -15.901 -1.574 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -0.684 -15.028 -2.214 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 0.365 -16.909 -2.729 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -0.027 -17.666 -1.260 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -1.144 -17.664 -2.538 1.00 0.00 H new ATOM 1856 N LEU B 28 -4.170 -13.649 1.577 1.00 0.00 N ATOM 1857 CA LEU B 28 -5.523 -13.198 1.663 1.00 0.00 C ATOM 1858 C LEU B 28 -6.278 -13.636 0.429 1.00 0.00 C ATOM 1859 O LEU B 28 -5.892 -13.308 -0.696 1.00 0.00 O ATOM 1860 CB LEU B 28 -5.575 -11.677 1.828 1.00 0.00 C ATOM 1861 CG LEU B 28 -7.031 -11.210 1.873 1.00 0.00 C ATOM 1862 CD1 LEU B 28 -7.695 -11.705 3.161 1.00 0.00 C ATOM 1863 CD2 LEU B 28 -7.073 -9.691 1.838 1.00 0.00 C ATOM 0 H LEU B 28 -3.673 -13.369 0.731 1.00 0.00 H new ATOM 0 HA LEU B 28 -5.995 -13.641 2.540 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -5.061 -11.384 2.743 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -5.054 -11.194 1.001 1.00 0.00 H new ATOM 0 HG LEU B 28 -7.566 -11.614 1.013 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -8.732 -11.370 3.188 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -7.665 -12.794 3.190 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -7.161 -11.304 4.023 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -8.109 -9.355 1.870 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -6.536 -9.292 2.698 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -6.604 -9.335 0.921 1.00 0.00 H new ATOM 1875 N SER B 29 -7.386 -14.304 0.629 1.00 0.00 N ATOM 1876 CA SER B 29 -8.254 -14.610 -0.470 1.00 0.00 C ATOM 1877 C SER B 29 -9.236 -13.478 -0.664 1.00 0.00 C ATOM 1878 O SER B 29 -9.441 -12.649 0.234 1.00 0.00 O ATOM 1879 CB SER B 29 -8.937 -15.962 -0.284 1.00 0.00 C ATOM 1880 OG SER B 29 -9.400 -16.088 1.047 1.00 0.00 O ATOM 0 H SER B 29 -7.703 -14.643 1.537 1.00 0.00 H new ATOM 0 HA SER B 29 -7.664 -14.702 -1.382 1.00 0.00 H new ATOM 0 HB2 SER B 29 -9.771 -16.057 -0.979 1.00 0.00 H new ATOM 0 HB3 SER B 29 -8.238 -16.767 -0.513 1.00 0.00 H new ATOM 0 HG SER B 29 -9.038 -16.908 1.443 1.00 0.00 H new ATOM 1886 N LYS B 30 -9.833 -13.415 -1.817 1.00 0.00 N ATOM 1887 CA LYS B 30 -10.762 -12.340 -2.101 1.00 0.00 C ATOM 1888 C LYS B 30 -12.021 -12.497 -1.269 1.00 0.00 C ATOM 1889 O LYS B 30 -12.905 -11.639 -1.287 1.00 0.00 O ATOM 1890 CB LYS B 30 -11.076 -12.285 -3.596 1.00 0.00 C ATOM 1891 CG LYS B 30 -9.760 -12.299 -4.401 1.00 0.00 C ATOM 1892 CD LYS B 30 -8.914 -11.044 -4.097 1.00 0.00 C ATOM 1893 CE LYS B 30 -9.597 -9.779 -4.635 1.00 0.00 C ATOM 1894 NZ LYS B 30 -10.098 -10.019 -6.001 1.00 0.00 N ATOM 0 H LYS B 30 -9.701 -14.084 -2.576 1.00 0.00 H new ATOM 0 HA LYS B 30 -10.300 -11.391 -1.827 1.00 0.00 H new ATOM 0 HB2 LYS B 30 -11.697 -13.135 -3.879 1.00 0.00 H new ATOM 0 HB3 LYS B 30 -11.645 -11.384 -3.826 1.00 0.00 H new ATOM 0 HG2 LYS B 30 -9.189 -13.195 -4.157 1.00 0.00 H new ATOM 0 HG3 LYS B 30 -9.982 -12.343 -5.467 1.00 0.00 H new ATOM 0 HD2 LYS B 30 -8.766 -10.952 -3.021 1.00 0.00 H new ATOM 0 HD3 LYS B 30 -7.927 -11.148 -4.547 1.00 0.00 H new ATOM 0 HE2 LYS B 30 -10.421 -9.495 -3.981 1.00 0.00 H new ATOM 0 HE3 LYS B 30 -8.892 -8.948 -4.638 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 -10.831 -9.318 -6.230 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 -9.314 -9.934 -6.678 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 -10.503 -10.975 -6.059 1.00 0.00 H new ATOM 1908 N LYS B 31 -12.073 -13.601 -0.538 1.00 0.00 N ATOM 1909 CA LYS B 31 -13.213 -13.953 0.287 1.00 0.00 C ATOM 1910 C LYS B 31 -13.410 -12.890 1.339 1.00 0.00 C ATOM 1911 O LYS B 31 -14.531 -12.435 1.594 1.00 0.00 O ATOM 1912 CB LYS B 31 -12.851 -15.225 1.045 1.00 0.00 C ATOM 1913 CG LYS B 31 -12.535 -16.345 0.073 1.00 0.00 C ATOM 1914 CD LYS B 31 -12.081 -17.573 0.859 1.00 0.00 C ATOM 1915 CE LYS B 31 -11.326 -18.498 -0.081 1.00 0.00 C ATOM 1916 NZ LYS B 31 -12.193 -18.846 -1.237 1.00 0.00 N ATOM 0 H LYS B 31 -11.315 -14.283 -0.503 1.00 0.00 H new ATOM 0 HA LYS B 31 -14.101 -14.065 -0.335 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -11.992 -15.040 1.689 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -13.677 -15.518 1.692 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -13.415 -16.585 -0.524 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -11.754 -16.032 -0.621 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -11.442 -17.275 1.691 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -12.941 -18.088 1.286 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -10.414 -18.014 -0.430 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -11.025 -19.403 0.447 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -11.817 -19.692 -1.710 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -13.159 -19.037 -0.902 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -12.211 -18.052 -1.909 1.00 0.00 H new ATOM 1930 N GLU B 32 -12.310 -12.530 1.978 1.00 0.00 N ATOM 1931 CA GLU B 32 -12.333 -11.589 3.074 1.00 0.00 C ATOM 1932 C GLU B 32 -11.887 -10.225 2.622 1.00 0.00 C ATOM 1933 O GLU B 32 -12.204 -9.234 3.245 1.00 0.00 O ATOM 1934 CB GLU B 32 -11.440 -12.080 4.212 1.00 0.00 C ATOM 1935 CG GLU B 32 -11.559 -13.610 4.346 1.00 0.00 C ATOM 1936 CD GLU B 32 -11.417 -14.041 5.802 1.00 0.00 C ATOM 1937 OE1 GLU B 32 -11.099 -13.208 6.631 1.00 0.00 O ATOM 1938 OE2 GLU B 32 -11.634 -15.197 6.071 1.00 0.00 O ATOM 0 H GLU B 32 -11.381 -12.883 1.749 1.00 0.00 H new ATOM 0 HA GLU B 32 -13.359 -11.513 3.433 1.00 0.00 H new ATOM 0 HB2 GLU B 32 -10.404 -11.802 4.019 1.00 0.00 H new ATOM 0 HB3 GLU B 32 -11.730 -11.600 5.147 1.00 0.00 H new ATOM 0 HG2 GLU B 32 -12.523 -13.939 3.957 1.00 0.00 H new ATOM 0 HG3 GLU B 32 -10.790 -14.093 3.743 1.00 0.00 H new ATOM 1945 N LEU B 33 -11.149 -10.180 1.530 1.00 0.00 N ATOM 1946 CA LEU B 33 -10.622 -8.923 1.029 1.00 0.00 C ATOM 1947 C LEU B 33 -11.769 -7.969 0.778 1.00 0.00 C ATOM 1948 O LEU B 33 -11.705 -6.800 1.156 1.00 0.00 O ATOM 1949 CB LEU B 33 -9.848 -9.176 -0.279 1.00 0.00 C ATOM 1950 CG LEU B 33 -9.255 -7.874 -0.880 1.00 0.00 C ATOM 1951 CD1 LEU B 33 -10.323 -7.114 -1.672 1.00 0.00 C ATOM 1952 CD2 LEU B 33 -8.673 -6.964 0.213 1.00 0.00 C ATOM 0 H LEU B 33 -10.900 -10.997 0.973 1.00 0.00 H new ATOM 0 HA LEU B 33 -9.944 -8.486 1.762 1.00 0.00 H new ATOM 0 HB2 LEU B 33 -9.042 -9.885 -0.089 1.00 0.00 H new ATOM 0 HB3 LEU B 33 -10.514 -9.638 -1.008 1.00 0.00 H new ATOM 0 HG LEU B 33 -8.446 -8.162 -1.551 1.00 0.00 H new ATOM 0 HD11 LEU B 33 -9.890 -6.204 -2.086 1.00 0.00 H new ATOM 0 HD12 LEU B 33 -10.691 -7.743 -2.483 1.00 0.00 H new ATOM 0 HD13 LEU B 33 -11.150 -6.854 -1.011 1.00 0.00 H new ATOM 0 HD21 LEU B 33 -8.266 -6.062 -0.243 1.00 0.00 H new ATOM 0 HD22 LEU B 33 -9.460 -6.692 0.917 1.00 0.00 H new ATOM 0 HD23 LEU B 33 -7.880 -7.492 0.742 1.00 0.00 H new ATOM 1964 N LYS B 34 -12.848 -8.477 0.197 1.00 0.00 N ATOM 1965 CA LYS B 34 -13.997 -7.628 -0.052 1.00 0.00 C ATOM 1966 C LYS B 34 -14.564 -7.111 1.269 1.00 0.00 C ATOM 1967 O LYS B 34 -14.787 -5.913 1.428 1.00 0.00 O ATOM 1968 CB LYS B 34 -15.093 -8.404 -0.798 1.00 0.00 C ATOM 1969 CG LYS B 34 -14.668 -8.739 -2.241 1.00 0.00 C ATOM 1970 CD LYS B 34 -15.811 -9.532 -2.910 1.00 0.00 C ATOM 1971 CE LYS B 34 -15.550 -9.727 -4.415 1.00 0.00 C ATOM 1972 NZ LYS B 34 -14.313 -10.527 -4.641 1.00 0.00 N ATOM 0 H LYS B 34 -12.949 -9.447 -0.103 1.00 0.00 H new ATOM 0 HA LYS B 34 -13.671 -6.789 -0.666 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -15.317 -9.326 -0.261 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -16.010 -7.814 -0.816 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -14.463 -7.825 -2.798 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -13.749 -9.325 -2.240 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -15.913 -10.504 -2.427 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -16.754 -9.005 -2.768 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -16.402 -10.229 -4.874 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -15.454 -8.756 -4.900 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -14.484 -11.226 -5.392 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -13.538 -9.895 -4.926 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -14.053 -11.020 -3.763 1.00 0.00 H new ATOM 1986 N GLU B 35 -14.696 -8.010 2.237 1.00 0.00 N ATOM 1987 CA GLU B 35 -15.179 -7.656 3.570 1.00 0.00 C ATOM 1988 C GLU B 35 -14.151 -6.790 4.278 1.00 0.00 C ATOM 1989 O GLU B 35 -14.471 -5.762 4.881 1.00 0.00 O ATOM 1990 CB GLU B 35 -15.399 -8.938 4.368 1.00 0.00 C ATOM 1991 CG GLU B 35 -16.581 -9.723 3.773 1.00 0.00 C ATOM 1992 CD GLU B 35 -16.724 -11.073 4.454 1.00 0.00 C ATOM 1993 OE1 GLU B 35 -15.853 -11.435 5.208 1.00 0.00 O ATOM 1994 OE2 GLU B 35 -17.710 -11.727 4.225 1.00 0.00 O ATOM 0 H GLU B 35 -14.473 -8.999 2.124 1.00 0.00 H new ATOM 0 HA GLU B 35 -16.114 -7.101 3.487 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -14.497 -9.550 4.348 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -15.598 -8.698 5.412 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -17.501 -9.151 3.892 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -16.429 -9.864 2.703 1.00 0.00 H new ATOM 2001 N LEU B 36 -12.919 -7.199 4.156 1.00 0.00 N ATOM 2002 CA LEU B 36 -11.784 -6.519 4.731 1.00 0.00 C ATOM 2003 C LEU B 36 -11.633 -5.118 4.192 1.00 0.00 C ATOM 2004 O LEU B 36 -11.433 -4.175 4.959 1.00 0.00 O ATOM 2005 CB LEU B 36 -10.536 -7.350 4.394 1.00 0.00 C ATOM 2006 CG LEU B 36 -9.247 -6.578 4.642 1.00 0.00 C ATOM 2007 CD1 LEU B 36 -9.129 -6.146 6.095 1.00 0.00 C ATOM 2008 CD2 LEU B 36 -8.067 -7.463 4.277 1.00 0.00 C ATOM 0 H LEU B 36 -12.666 -8.041 3.638 1.00 0.00 H new ATOM 0 HA LEU B 36 -11.923 -6.427 5.808 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -10.534 -8.260 4.995 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -10.578 -7.658 3.349 1.00 0.00 H new ATOM 0 HG LEU B 36 -9.256 -5.679 4.025 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -8.198 -5.598 6.237 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -9.971 -5.504 6.353 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -9.133 -7.026 6.738 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -7.138 -6.920 4.451 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -8.082 -8.362 4.893 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -8.133 -7.742 3.225 1.00 0.00 H new ATOM 2020 N LEU B 37 -11.699 -4.977 2.885 1.00 0.00 N ATOM 2021 CA LEU B 37 -11.493 -3.674 2.281 1.00 0.00 C ATOM 2022 C LEU B 37 -12.569 -2.694 2.751 1.00 0.00 C ATOM 2023 O LEU B 37 -12.253 -1.622 3.276 1.00 0.00 O ATOM 2024 CB LEU B 37 -11.466 -3.799 0.740 1.00 0.00 C ATOM 2025 CG LEU B 37 -10.761 -2.596 0.065 1.00 0.00 C ATOM 2026 CD1 LEU B 37 -11.257 -2.460 -1.377 1.00 0.00 C ATOM 2027 CD2 LEU B 37 -11.038 -1.294 0.818 1.00 0.00 C ATOM 0 H LEU B 37 -11.890 -5.733 2.228 1.00 0.00 H new ATOM 0 HA LEU B 37 -10.528 -3.280 2.599 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -10.954 -4.720 0.461 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -12.487 -3.876 0.366 1.00 0.00 H new ATOM 0 HG LEU B 37 -9.687 -2.779 0.080 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -10.762 -1.614 -1.854 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -11.028 -3.372 -1.928 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -12.335 -2.297 -1.377 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -10.529 -0.470 0.319 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -12.111 -1.103 0.832 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -10.672 -1.380 1.841 1.00 0.00 H new ATOM 2039 N GLN B 38 -13.827 -3.118 2.705 1.00 0.00 N ATOM 2040 CA GLN B 38 -14.908 -2.273 3.205 1.00 0.00 C ATOM 2041 C GLN B 38 -14.778 -2.052 4.704 1.00 0.00 C ATOM 2042 O GLN B 38 -14.992 -0.947 5.209 1.00 0.00 O ATOM 2043 CB GLN B 38 -16.298 -2.857 2.859 1.00 0.00 C ATOM 2044 CG GLN B 38 -16.487 -4.246 3.490 1.00 0.00 C ATOM 2045 CD GLN B 38 -17.873 -4.793 3.148 1.00 0.00 C ATOM 2046 OE1 GLN B 38 -18.535 -4.287 2.239 1.00 0.00 O ATOM 2047 NE2 GLN B 38 -18.360 -5.790 3.826 1.00 0.00 N ATOM 0 H GLN B 38 -14.121 -4.022 2.335 1.00 0.00 H new ATOM 0 HA GLN B 38 -14.821 -1.308 2.706 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -17.078 -2.183 3.215 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -16.407 -2.928 1.777 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -15.718 -4.927 3.126 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -16.369 -4.182 4.572 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -17.814 -6.210 4.578 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -19.288 -6.152 3.605 1.00 0.00 H new ATOM 2056 N THR B 39 -14.474 -3.114 5.412 1.00 0.00 N ATOM 2057 CA THR B 39 -14.384 -3.052 6.848 1.00 0.00 C ATOM 2058 C THR B 39 -13.273 -2.102 7.303 1.00 0.00 C ATOM 2059 O THR B 39 -13.512 -1.201 8.113 1.00 0.00 O ATOM 2060 CB THR B 39 -14.136 -4.470 7.381 1.00 0.00 C ATOM 2061 OG1 THR B 39 -15.250 -5.305 7.065 1.00 0.00 O ATOM 2062 CG2 THR B 39 -13.908 -4.454 8.883 1.00 0.00 C ATOM 0 H THR B 39 -14.285 -4.034 5.013 1.00 0.00 H new ATOM 0 HA THR B 39 -15.319 -2.659 7.248 1.00 0.00 H new ATOM 0 HB THR B 39 -13.239 -4.866 6.905 1.00 0.00 H new ATOM 0 HG1 THR B 39 -15.015 -5.895 6.319 1.00 0.00 H new ATOM 0 HG21 THR B 39 -13.735 -5.471 9.236 1.00 0.00 H new ATOM 0 HG22 THR B 39 -13.039 -3.837 9.113 1.00 0.00 H new ATOM 0 HG23 THR B 39 -14.786 -4.042 9.380 1.00 0.00 H new ATOM 2070 N GLU B 40 -12.068 -2.303 6.800 1.00 0.00 N ATOM 2071 CA GLU B 40 -10.948 -1.485 7.240 1.00 0.00 C ATOM 2072 C GLU B 40 -10.972 -0.073 6.693 1.00 0.00 C ATOM 2073 O GLU B 40 -10.714 0.876 7.424 1.00 0.00 O ATOM 2074 CB GLU B 40 -9.614 -2.184 7.020 1.00 0.00 C ATOM 2075 CG GLU B 40 -9.576 -3.411 7.942 1.00 0.00 C ATOM 2076 CD GLU B 40 -9.706 -2.969 9.391 1.00 0.00 C ATOM 2077 OE1 GLU B 40 -8.861 -2.245 9.848 1.00 0.00 O ATOM 2078 OE2 GLU B 40 -10.673 -3.330 10.010 1.00 0.00 O ATOM 0 H GLU B 40 -11.840 -3.010 6.101 1.00 0.00 H new ATOM 0 HA GLU B 40 -11.069 -1.366 8.317 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -9.506 -2.485 5.978 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -8.787 -1.510 7.245 1.00 0.00 H new ATOM 0 HG2 GLU B 40 -10.385 -4.095 7.687 1.00 0.00 H new ATOM 0 HG3 GLU B 40 -8.642 -3.955 7.800 1.00 0.00 H new ATOM 2085 N LEU B 41 -11.360 0.076 5.439 1.00 0.00 N ATOM 2086 CA LEU B 41 -11.479 1.404 4.843 1.00 0.00 C ATOM 2087 C LEU B 41 -12.889 1.929 4.997 1.00 0.00 C ATOM 2088 O LEU B 41 -13.484 2.429 4.042 1.00 0.00 O ATOM 2089 CB LEU B 41 -11.058 1.403 3.366 1.00 0.00 C ATOM 2090 CG LEU B 41 -9.537 1.614 3.275 1.00 0.00 C ATOM 2091 CD1 LEU B 41 -8.807 0.418 3.891 1.00 0.00 C ATOM 2092 CD2 LEU B 41 -9.119 1.771 1.810 1.00 0.00 C ATOM 0 H LEU B 41 -11.597 -0.695 4.815 1.00 0.00 H new ATOM 0 HA LEU B 41 -10.799 2.068 5.376 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -11.335 0.459 2.897 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -11.580 2.193 2.826 1.00 0.00 H new ATOM 0 HG LEU B 41 -9.272 2.518 3.823 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -7.730 0.574 3.823 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -9.094 0.317 4.938 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -9.076 -0.490 3.352 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -8.041 1.920 1.753 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -9.391 0.873 1.256 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -9.628 2.632 1.377 1.00 0.00 H new ATOM 2104 N SER B 42 -13.435 1.769 6.186 1.00 0.00 N ATOM 2105 CA SER B 42 -14.813 2.134 6.450 1.00 0.00 C ATOM 2106 C SER B 42 -15.105 3.584 6.049 1.00 0.00 C ATOM 2107 O SER B 42 -16.131 3.862 5.416 1.00 0.00 O ATOM 2108 CB SER B 42 -15.130 1.926 7.940 1.00 0.00 C ATOM 2109 OG SER B 42 -15.166 0.523 8.244 1.00 0.00 O ATOM 0 H SER B 42 -12.940 1.385 6.991 1.00 0.00 H new ATOM 0 HA SER B 42 -15.451 1.490 5.845 1.00 0.00 H new ATOM 0 HB2 SER B 42 -14.376 2.420 8.553 1.00 0.00 H new ATOM 0 HB3 SER B 42 -16.089 2.384 8.184 1.00 0.00 H new ATOM 0 HG SER B 42 -14.346 0.096 7.917 1.00 0.00 H new ATOM 2115 N GLY B 43 -14.214 4.496 6.388 1.00 0.00 N ATOM 2116 CA GLY B 43 -14.419 5.899 6.046 1.00 0.00 C ATOM 2117 C GLY B 43 -14.363 6.114 4.547 1.00 0.00 C ATOM 2118 O GLY B 43 -15.269 6.721 3.952 1.00 0.00 O ATOM 0 H GLY B 43 -13.350 4.299 6.894 1.00 0.00 H new ATOM 0 HA2 GLY B 43 -15.385 6.231 6.427 1.00 0.00 H new ATOM 0 HA3 GLY B 43 -13.657 6.509 6.532 1.00 0.00 H new ATOM 2122 N PHE B 44 -13.311 5.598 3.930 1.00 0.00 N ATOM 2123 CA PHE B 44 -13.126 5.730 2.490 1.00 0.00 C ATOM 2124 C PHE B 44 -14.205 4.955 1.751 1.00 0.00 C ATOM 2125 O PHE B 44 -14.798 5.445 0.780 1.00 0.00 O ATOM 2126 CB PHE B 44 -11.734 5.219 2.073 1.00 0.00 C ATOM 2127 CG PHE B 44 -10.648 6.158 2.567 1.00 0.00 C ATOM 2128 CD1 PHE B 44 -10.383 7.351 1.886 1.00 0.00 C ATOM 2129 CD2 PHE B 44 -9.908 5.831 3.706 1.00 0.00 C ATOM 2130 CE1 PHE B 44 -9.382 8.212 2.343 1.00 0.00 C ATOM 2131 CE2 PHE B 44 -8.906 6.694 4.161 1.00 0.00 C ATOM 2132 CZ PHE B 44 -8.647 7.882 3.481 1.00 0.00 C ATOM 0 H PHE B 44 -12.570 5.082 4.404 1.00 0.00 H new ATOM 0 HA PHE B 44 -13.202 6.785 2.229 1.00 0.00 H new ATOM 0 HB2 PHE B 44 -11.571 4.221 2.479 1.00 0.00 H new ATOM 0 HB3 PHE B 44 -11.682 5.134 0.988 1.00 0.00 H new ATOM 0 HD1 PHE B 44 -10.953 7.607 1.005 1.00 0.00 H new ATOM 0 HD2 PHE B 44 -10.110 4.911 4.235 1.00 0.00 H new ATOM 0 HE1 PHE B 44 -9.178 9.132 1.815 1.00 0.00 H new ATOM 0 HE2 PHE B 44 -8.333 6.439 5.040 1.00 0.00 H new ATOM 0 HZ PHE B 44 -7.875 8.549 3.836 1.00 0.00 H new ATOM 2142 N LEU B 45 -14.505 3.765 2.259 1.00 0.00 N ATOM 2143 CA LEU B 45 -15.508 2.893 1.665 1.00 0.00 C ATOM 2144 C LEU B 45 -16.773 3.653 1.373 1.00 0.00 C ATOM 2145 O LEU B 45 -17.302 3.606 0.263 1.00 0.00 O ATOM 2146 CB LEU B 45 -15.807 1.729 2.645 1.00 0.00 C ATOM 2147 CG LEU B 45 -17.270 1.278 2.525 1.00 0.00 C ATOM 2148 CD1 LEU B 45 -17.541 0.706 1.139 1.00 0.00 C ATOM 2149 CD2 LEU B 45 -17.587 0.228 3.593 1.00 0.00 C ATOM 0 H LEU B 45 -14.060 3.380 3.092 1.00 0.00 H new ATOM 0 HA LEU B 45 -15.124 2.500 0.724 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -15.144 0.890 2.433 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -15.602 2.047 3.667 1.00 0.00 H new ATOM 0 HG LEU B 45 -17.912 2.146 2.676 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -18.583 0.392 1.072 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -17.343 1.469 0.386 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -16.891 -0.152 0.966 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -18.627 -0.085 3.499 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -16.935 -0.635 3.459 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -17.425 0.655 4.583 1.00 0.00 H new ATOM 2161 N ASP B 46 -17.254 4.341 2.366 1.00 0.00 N ATOM 2162 CA ASP B 46 -18.487 5.075 2.255 1.00 0.00 C ATOM 2163 C ASP B 46 -18.401 6.175 1.207 1.00 0.00 C ATOM 2164 O ASP B 46 -19.353 6.419 0.465 1.00 0.00 O ATOM 2165 CB ASP B 46 -18.828 5.666 3.617 1.00 0.00 C ATOM 2166 CG ASP B 46 -20.093 6.480 3.531 1.00 0.00 C ATOM 2167 OD1 ASP B 46 -21.097 5.929 3.162 1.00 0.00 O ATOM 2168 OD2 ASP B 46 -20.038 7.654 3.830 1.00 0.00 O ATOM 0 H ASP B 46 -16.804 4.411 3.279 1.00 0.00 H new ATOM 0 HA ASP B 46 -19.272 4.391 1.933 1.00 0.00 H new ATOM 0 HB2 ASP B 46 -18.951 4.867 4.348 1.00 0.00 H new ATOM 0 HB3 ASP B 46 -18.007 6.293 3.965 1.00 0.00 H new ATOM 2173 N ALA B 47 -17.290 6.875 1.197 1.00 0.00 N ATOM 2174 CA ALA B 47 -17.102 8.014 0.308 1.00 0.00 C ATOM 2175 C ALA B 47 -16.948 7.598 -1.152 1.00 0.00 C ATOM 2176 O ALA B 47 -17.363 8.320 -2.062 1.00 0.00 O ATOM 2177 CB ALA B 47 -15.882 8.812 0.751 1.00 0.00 C ATOM 0 H ALA B 47 -16.491 6.678 1.799 1.00 0.00 H new ATOM 0 HA ALA B 47 -17.999 8.630 0.373 1.00 0.00 H new ATOM 0 HB1 ALA B 47 -15.743 9.664 0.085 1.00 0.00 H new ATOM 0 HB2 ALA B 47 -16.031 9.169 1.770 1.00 0.00 H new ATOM 0 HB3 ALA B 47 -14.998 8.175 0.715 1.00 0.00 H new ATOM 2183 N GLN B 48 -16.208 6.536 -1.374 1.00 0.00 N ATOM 2184 CA GLN B 48 -15.830 6.141 -2.734 1.00 0.00 C ATOM 2185 C GLN B 48 -16.999 5.593 -3.534 1.00 0.00 C ATOM 2186 O GLN B 48 -16.899 5.448 -4.758 1.00 0.00 O ATOM 2187 CB GLN B 48 -14.741 5.108 -2.699 1.00 0.00 C ATOM 2188 CG GLN B 48 -13.588 5.582 -1.827 1.00 0.00 C ATOM 2189 CD GLN B 48 -13.003 4.386 -1.135 1.00 0.00 C ATOM 2190 OE1 GLN B 48 -13.805 3.525 -0.601 1.00 0.00 O flip ATOM 2191 NE2 GLN B 48 -11.805 4.228 -1.081 1.00 0.00 N flip ATOM 0 H GLN B 48 -15.851 5.924 -0.640 1.00 0.00 H new ATOM 0 HA GLN B 48 -15.479 7.047 -3.227 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -15.135 4.168 -2.313 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -14.384 4.912 -3.710 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -12.831 6.078 -2.434 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -13.938 6.311 -1.096 1.00 0.00 H new ATOM 0 HE21 GLN B 48 -11.181 4.914 -1.506 1.00 0.00 H new ATOM 0 HE22 GLN B 48 -11.419 3.409 -0.611 1.00 0.00 H new ATOM 2200 N LYS B 49 -18.075 5.225 -2.861 1.00 0.00 N ATOM 2201 CA LYS B 49 -19.202 4.619 -3.563 1.00 0.00 C ATOM 2202 C LYS B 49 -19.688 5.571 -4.615 1.00 0.00 C ATOM 2203 O LYS B 49 -19.961 5.179 -5.749 1.00 0.00 O ATOM 2204 CB LYS B 49 -20.352 4.346 -2.593 1.00 0.00 C ATOM 2205 CG LYS B 49 -19.975 3.235 -1.626 1.00 0.00 C ATOM 2206 CD LYS B 49 -21.155 2.988 -0.683 1.00 0.00 C ATOM 2207 CE LYS B 49 -20.803 1.871 0.288 1.00 0.00 C ATOM 2208 NZ LYS B 49 -20.321 0.696 -0.479 1.00 0.00 N ATOM 0 H LYS B 49 -18.196 5.330 -1.854 1.00 0.00 H new ATOM 0 HA LYS B 49 -18.874 3.680 -4.009 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -20.592 5.253 -2.039 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -21.247 4.065 -3.149 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -19.730 2.324 -2.173 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -19.088 3.513 -1.057 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -21.393 3.899 -0.135 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -22.042 2.720 -1.256 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -20.035 2.206 0.985 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -21.676 1.600 0.882 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -20.352 -0.150 0.125 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -20.929 0.551 -1.310 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -19.343 0.862 -0.791 1.00 0.00 H new ATOM 2222 N ASP B 50 -19.721 6.828 -4.253 1.00 0.00 N ATOM 2223 CA ASP B 50 -20.129 7.881 -5.170 1.00 0.00 C ATOM 2224 C ASP B 50 -19.122 8.024 -6.304 1.00 0.00 C ATOM 2225 O ASP B 50 -19.474 8.408 -7.424 1.00 0.00 O ATOM 2226 CB ASP B 50 -20.222 9.205 -4.416 1.00 0.00 C ATOM 2227 CG ASP B 50 -20.966 10.226 -5.242 1.00 0.00 C ATOM 2228 OD1 ASP B 50 -22.141 10.043 -5.451 1.00 0.00 O ATOM 2229 OD2 ASP B 50 -20.364 11.185 -5.643 1.00 0.00 O ATOM 0 H ASP B 50 -19.469 7.157 -3.321 1.00 0.00 H new ATOM 0 HA ASP B 50 -21.101 7.619 -5.589 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -20.733 9.055 -3.465 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -19.222 9.572 -4.186 1.00 0.00 H new ATOM 2234 N VAL B 51 -17.869 7.730 -5.995 1.00 0.00 N ATOM 2235 CA VAL B 51 -16.788 7.848 -6.952 1.00 0.00 C ATOM 2236 C VAL B 51 -16.936 6.782 -8.031 1.00 0.00 C ATOM 2237 O VAL B 51 -16.635 7.017 -9.205 1.00 0.00 O ATOM 2238 CB VAL B 51 -15.428 7.741 -6.235 1.00 0.00 C ATOM 2239 CG1 VAL B 51 -14.287 7.917 -7.237 1.00 0.00 C ATOM 2240 CG2 VAL B 51 -15.324 8.831 -5.160 1.00 0.00 C ATOM 0 H VAL B 51 -17.576 7.404 -5.074 1.00 0.00 H new ATOM 0 HA VAL B 51 -16.833 8.825 -7.432 1.00 0.00 H new ATOM 0 HB VAL B 51 -15.353 6.757 -5.773 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -13.332 7.839 -6.718 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -14.350 7.141 -8.000 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -14.365 8.897 -7.709 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -14.361 8.753 -4.655 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -15.410 9.812 -5.627 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -16.127 8.703 -4.434 1.00 0.00 H new ATOM 2250 N ASP B 52 -17.296 5.579 -7.588 1.00 0.00 N ATOM 2251 CA ASP B 52 -17.428 4.402 -8.459 1.00 0.00 C ATOM 2252 C ASP B 52 -16.077 3.870 -8.882 1.00 0.00 C ATOM 2253 O ASP B 52 -15.986 2.787 -9.466 1.00 0.00 O ATOM 2254 CB ASP B 52 -18.290 4.692 -9.690 1.00 0.00 C ATOM 2255 CG ASP B 52 -19.249 3.544 -9.945 1.00 0.00 C ATOM 2256 OD1 ASP B 52 -19.990 3.199 -9.047 1.00 0.00 O ATOM 2257 OD2 ASP B 52 -19.238 3.024 -11.040 1.00 0.00 O ATOM 0 H ASP B 52 -17.507 5.387 -6.609 1.00 0.00 H new ATOM 0 HA ASP B 52 -17.932 3.636 -7.869 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -18.849 5.616 -9.541 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -17.653 4.842 -10.561 1.00 0.00 H new ATOM 2262 N ALA B 53 -15.031 4.600 -8.546 1.00 0.00 N ATOM 2263 CA ALA B 53 -13.680 4.138 -8.801 1.00 0.00 C ATOM 2264 C ALA B 53 -13.371 2.960 -7.892 1.00 0.00 C ATOM 2265 O ALA B 53 -12.765 1.981 -8.310 1.00 0.00 O ATOM 2266 CB ALA B 53 -12.663 5.257 -8.585 1.00 0.00 C ATOM 0 H ALA B 53 -15.090 5.514 -8.097 1.00 0.00 H new ATOM 0 HA ALA B 53 -13.609 3.824 -9.842 1.00 0.00 H new ATOM 0 HB1 ALA B 53 -11.660 4.880 -8.784 1.00 0.00 H new ATOM 0 HB2 ALA B 53 -12.881 6.083 -9.262 1.00 0.00 H new ATOM 0 HB3 ALA B 53 -12.721 5.608 -7.555 1.00 0.00 H new ATOM 2272 N VAL B 54 -13.869 3.032 -6.654 1.00 0.00 N ATOM 2273 CA VAL B 54 -13.660 1.951 -5.688 1.00 0.00 C ATOM 2274 C VAL B 54 -14.188 0.650 -6.253 1.00 0.00 C ATOM 2275 O VAL B 54 -13.497 -0.373 -6.241 1.00 0.00 O ATOM 2276 CB VAL B 54 -14.331 2.281 -4.328 1.00 0.00 C ATOM 2277 CG1 VAL B 54 -15.834 2.554 -4.505 1.00 0.00 C ATOM 2278 CG2 VAL B 54 -14.147 1.115 -3.340 1.00 0.00 C ATOM 0 H VAL B 54 -14.414 3.819 -6.300 1.00 0.00 H new ATOM 0 HA VAL B 54 -12.590 1.846 -5.507 1.00 0.00 H new ATOM 0 HB VAL B 54 -13.850 3.176 -3.933 1.00 0.00 H new ATOM 0 HG11 VAL B 54 -16.279 2.782 -3.536 1.00 0.00 H new ATOM 0 HG12 VAL B 54 -15.973 3.401 -5.177 1.00 0.00 H new ATOM 0 HG13 VAL B 54 -16.317 1.673 -4.927 1.00 0.00 H new ATOM 0 HG21 VAL B 54 -14.623 1.363 -2.392 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -14.604 0.214 -3.751 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -13.083 0.941 -3.177 1.00 0.00 H new ATOM 2288 N ASP B 55 -15.351 0.728 -6.868 1.00 0.00 N ATOM 2289 CA ASP B 55 -15.931 -0.427 -7.531 1.00 0.00 C ATOM 2290 C ASP B 55 -14.930 -1.017 -8.502 1.00 0.00 C ATOM 2291 O ASP B 55 -14.612 -2.204 -8.454 1.00 0.00 O ATOM 2292 CB ASP B 55 -17.168 0.044 -8.321 1.00 0.00 C ATOM 2293 CG ASP B 55 -17.522 -0.928 -9.433 1.00 0.00 C ATOM 2294 OD1 ASP B 55 -17.669 -2.103 -9.157 1.00 0.00 O ATOM 2295 OD2 ASP B 55 -17.640 -0.480 -10.554 1.00 0.00 O ATOM 0 H ASP B 55 -15.914 1.577 -6.924 1.00 0.00 H new ATOM 0 HA ASP B 55 -16.204 -1.180 -6.792 1.00 0.00 H new ATOM 0 HB2 ASP B 55 -18.016 0.148 -7.644 1.00 0.00 H new ATOM 0 HB3 ASP B 55 -16.976 1.030 -8.745 1.00 0.00 H new ATOM 2300 N LYS B 56 -14.436 -0.169 -9.352 1.00 0.00 N ATOM 2301 CA LYS B 56 -13.483 -0.533 -10.379 1.00 0.00 C ATOM 2302 C LYS B 56 -12.155 -0.974 -9.773 1.00 0.00 C ATOM 2303 O LYS B 56 -11.589 -1.999 -10.170 1.00 0.00 O ATOM 2304 CB LYS B 56 -13.334 0.664 -11.300 1.00 0.00 C ATOM 2305 CG LYS B 56 -14.720 0.888 -11.920 1.00 0.00 C ATOM 2306 CD LYS B 56 -14.796 2.228 -12.643 1.00 0.00 C ATOM 2307 CE LYS B 56 -16.277 2.610 -12.828 1.00 0.00 C ATOM 2308 NZ LYS B 56 -17.067 2.150 -11.638 1.00 0.00 N ATOM 0 H LYS B 56 -14.684 0.820 -9.358 1.00 0.00 H new ATOM 0 HA LYS B 56 -13.838 -1.391 -10.950 1.00 0.00 H new ATOM 0 HB2 LYS B 56 -13.006 1.544 -10.747 1.00 0.00 H new ATOM 0 HB3 LYS B 56 -12.587 0.474 -12.071 1.00 0.00 H new ATOM 0 HG2 LYS B 56 -14.942 0.082 -12.620 1.00 0.00 H new ATOM 0 HG3 LYS B 56 -15.480 0.850 -11.139 1.00 0.00 H new ATOM 0 HD2 LYS B 56 -14.277 2.996 -12.069 1.00 0.00 H new ATOM 0 HD3 LYS B 56 -14.299 2.163 -13.611 1.00 0.00 H new ATOM 0 HE2 LYS B 56 -16.373 3.689 -12.946 1.00 0.00 H new ATOM 0 HE3 LYS B 56 -16.670 2.154 -13.737 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 -18.002 2.605 -11.645 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 -17.184 1.117 -11.677 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 -16.563 2.408 -10.766 1.00 0.00 H new ATOM 2322 N VAL B 57 -11.711 -0.270 -8.735 1.00 0.00 N ATOM 2323 CA VAL B 57 -10.488 -0.646 -8.047 1.00 0.00 C ATOM 2324 C VAL B 57 -10.659 -2.036 -7.441 1.00 0.00 C ATOM 2325 O VAL B 57 -9.818 -2.921 -7.629 1.00 0.00 O ATOM 2326 CB VAL B 57 -10.138 0.377 -6.948 1.00 0.00 C ATOM 2327 CG1 VAL B 57 -8.829 -0.030 -6.256 1.00 0.00 C ATOM 2328 CG2 VAL B 57 -9.965 1.772 -7.563 1.00 0.00 C ATOM 0 H VAL B 57 -12.177 0.555 -8.358 1.00 0.00 H new ATOM 0 HA VAL B 57 -9.668 -0.659 -8.765 1.00 0.00 H new ATOM 0 HB VAL B 57 -10.949 0.398 -6.220 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -8.586 0.696 -5.480 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -8.947 -1.016 -5.806 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -8.024 -0.060 -6.990 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -9.718 2.487 -6.779 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -9.161 1.748 -8.299 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -10.893 2.073 -8.049 1.00 0.00 H new ATOM 2338 N MET B 58 -11.794 -2.252 -6.791 1.00 0.00 N ATOM 2339 CA MET B 58 -12.081 -3.557 -6.225 1.00 0.00 C ATOM 2340 C MET B 58 -12.135 -4.565 -7.335 1.00 0.00 C ATOM 2341 O MET B 58 -11.657 -5.696 -7.203 1.00 0.00 O ATOM 2342 CB MET B 58 -13.442 -3.552 -5.522 1.00 0.00 C ATOM 2343 CG MET B 58 -13.428 -2.564 -4.370 1.00 0.00 C ATOM 2344 SD MET B 58 -14.089 -3.363 -2.885 1.00 0.00 S ATOM 2345 CE MET B 58 -15.800 -3.536 -3.449 1.00 0.00 C ATOM 0 H MET B 58 -12.520 -1.550 -6.645 1.00 0.00 H new ATOM 0 HA MET B 58 -11.301 -3.805 -5.505 1.00 0.00 H new ATOM 0 HB2 MET B 58 -14.226 -3.285 -6.231 1.00 0.00 H new ATOM 0 HB3 MET B 58 -13.673 -4.551 -5.152 1.00 0.00 H new ATOM 0 HG2 MET B 58 -12.411 -2.216 -4.187 1.00 0.00 H new ATOM 0 HG3 MET B 58 -14.025 -1.687 -4.621 1.00 0.00 H new ATOM 0 HE1 MET B 58 -16.434 -3.814 -2.607 1.00 0.00 H new ATOM 0 HE2 MET B 58 -16.143 -2.589 -3.865 1.00 0.00 H new ATOM 0 HE3 MET B 58 -15.854 -4.310 -4.215 1.00 0.00 H new ATOM 2355 N LYS B 59 -12.763 -4.164 -8.406 1.00 0.00 N ATOM 2356 CA LYS B 59 -12.950 -5.014 -9.548 1.00 0.00 C ATOM 2357 C LYS B 59 -11.601 -5.394 -10.134 1.00 0.00 C ATOM 2358 O LYS B 59 -11.351 -6.560 -10.422 1.00 0.00 O ATOM 2359 CB LYS B 59 -13.810 -4.295 -10.577 1.00 0.00 C ATOM 2360 CG LYS B 59 -14.512 -5.321 -11.489 1.00 0.00 C ATOM 2361 CD LYS B 59 -15.626 -6.070 -10.717 1.00 0.00 C ATOM 2362 CE LYS B 59 -16.521 -5.084 -9.929 1.00 0.00 C ATOM 2363 NZ LYS B 59 -16.741 -3.841 -10.712 1.00 0.00 N ATOM 0 H LYS B 59 -13.162 -3.231 -8.511 1.00 0.00 H new ATOM 0 HA LYS B 59 -13.460 -5.930 -9.248 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -14.553 -3.676 -10.073 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -13.192 -3.627 -11.176 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -14.940 -4.813 -12.353 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -13.782 -6.036 -11.869 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -16.237 -6.640 -11.417 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -15.177 -6.787 -10.029 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -17.479 -5.553 -9.704 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -16.053 -4.842 -8.975 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -17.385 -3.212 -10.191 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -15.831 -3.359 -10.861 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -17.161 -4.080 -11.633 1.00 0.00 H new ATOM 2377 N GLU B 60 -10.698 -4.423 -10.220 1.00 0.00 N ATOM 2378 CA GLU B 60 -9.355 -4.699 -10.707 1.00 0.00 C ATOM 2379 C GLU B 60 -8.705 -5.736 -9.811 1.00 0.00 C ATOM 2380 O GLU B 60 -8.181 -6.737 -10.289 1.00 0.00 O ATOM 2381 CB GLU B 60 -8.509 -3.417 -10.741 1.00 0.00 C ATOM 2382 CG GLU B 60 -7.111 -3.732 -11.305 1.00 0.00 C ATOM 2383 CD GLU B 60 -6.305 -2.462 -11.436 1.00 0.00 C ATOM 2384 OE1 GLU B 60 -6.215 -1.735 -10.471 1.00 0.00 O ATOM 2385 OE2 GLU B 60 -5.776 -2.237 -12.495 1.00 0.00 O ATOM 0 H GLU B 60 -10.870 -3.451 -9.962 1.00 0.00 H new ATOM 0 HA GLU B 60 -9.418 -5.083 -11.725 1.00 0.00 H new ATOM 0 HB2 GLU B 60 -8.999 -2.663 -11.357 1.00 0.00 H new ATOM 0 HB3 GLU B 60 -8.421 -3.001 -9.737 1.00 0.00 H new ATOM 0 HG2 GLU B 60 -6.595 -4.433 -10.649 1.00 0.00 H new ATOM 0 HG3 GLU B 60 -7.203 -4.215 -12.278 1.00 0.00 H new ATOM 2392 N LEU B 61 -8.891 -5.581 -8.510 1.00 0.00 N ATOM 2393 CA LEU B 61 -8.439 -6.597 -7.572 1.00 0.00 C ATOM 2394 C LEU B 61 -9.166 -7.897 -7.832 1.00 0.00 C ATOM 2395 O LEU B 61 -8.593 -8.978 -7.712 1.00 0.00 O ATOM 2396 CB LEU B 61 -8.616 -6.156 -6.116 1.00 0.00 C ATOM 2397 CG LEU B 61 -7.402 -5.322 -5.655 1.00 0.00 C ATOM 2398 CD1 LEU B 61 -6.243 -6.247 -5.262 1.00 0.00 C ATOM 2399 CD2 LEU B 61 -6.935 -4.363 -6.759 1.00 0.00 C ATOM 0 H LEU B 61 -9.345 -4.774 -8.083 1.00 0.00 H new ATOM 0 HA LEU B 61 -7.371 -6.746 -7.730 1.00 0.00 H new ATOM 0 HB2 LEU B 61 -9.528 -5.568 -6.016 1.00 0.00 H new ATOM 0 HB3 LEU B 61 -8.729 -7.031 -5.476 1.00 0.00 H new ATOM 0 HG LEU B 61 -7.712 -4.734 -4.791 1.00 0.00 H new ATOM 0 HD11 LEU B 61 -5.392 -5.647 -4.939 1.00 0.00 H new ATOM 0 HD12 LEU B 61 -6.558 -6.899 -4.447 1.00 0.00 H new ATOM 0 HD13 LEU B 61 -5.954 -6.853 -6.121 1.00 0.00 H new ATOM 0 HD21 LEU B 61 -6.079 -3.789 -6.404 1.00 0.00 H new ATOM 0 HD22 LEU B 61 -6.648 -4.936 -7.641 1.00 0.00 H new ATOM 0 HD23 LEU B 61 -7.746 -3.682 -7.017 1.00 0.00 H new ATOM 2411 N ASP B 62 -10.442 -7.809 -8.142 1.00 0.00 N ATOM 2412 CA ASP B 62 -11.201 -9.009 -8.482 1.00 0.00 C ATOM 2413 C ASP B 62 -10.705 -9.618 -9.787 1.00 0.00 C ATOM 2414 O ASP B 62 -10.473 -10.825 -9.861 1.00 0.00 O ATOM 2415 CB ASP B 62 -12.708 -8.748 -8.483 1.00 0.00 C ATOM 2416 CG ASP B 62 -13.260 -8.874 -7.058 1.00 0.00 C ATOM 2417 OD1 ASP B 62 -12.516 -9.281 -6.154 1.00 0.00 O ATOM 2418 OD2 ASP B 62 -14.407 -8.562 -6.871 1.00 0.00 O ATOM 0 H ASP B 62 -10.974 -6.939 -8.168 1.00 0.00 H new ATOM 0 HA ASP B 62 -11.026 -9.750 -7.702 1.00 0.00 H new ATOM 0 HB2 ASP B 62 -12.913 -7.752 -8.875 1.00 0.00 H new ATOM 0 HB3 ASP B 62 -13.209 -9.459 -9.141 1.00 0.00 H new ATOM 2423 N GLU B 63 -10.379 -8.770 -10.750 1.00 0.00 N ATOM 2424 CA GLU B 63 -9.745 -9.224 -11.986 1.00 0.00 C ATOM 2425 C GLU B 63 -8.369 -9.764 -11.654 1.00 0.00 C ATOM 2426 O GLU B 63 -7.980 -10.844 -12.100 1.00 0.00 O ATOM 2427 CB GLU B 63 -9.610 -8.058 -12.964 1.00 0.00 C ATOM 2428 CG GLU B 63 -11.001 -7.620 -13.428 1.00 0.00 C ATOM 2429 CD GLU B 63 -10.917 -6.393 -14.325 1.00 0.00 C ATOM 2430 OE1 GLU B 63 -9.848 -5.827 -14.450 1.00 0.00 O ATOM 2431 OE2 GLU B 63 -11.916 -6.043 -14.891 1.00 0.00 O ATOM 0 H GLU B 63 -10.541 -7.764 -10.703 1.00 0.00 H new ATOM 0 HA GLU B 63 -10.355 -10.001 -12.446 1.00 0.00 H new ATOM 0 HB2 GLU B 63 -9.095 -7.225 -12.485 1.00 0.00 H new ATOM 0 HB3 GLU B 63 -9.006 -8.356 -13.821 1.00 0.00 H new ATOM 0 HG2 GLU B 63 -11.482 -8.436 -13.967 1.00 0.00 H new ATOM 0 HG3 GLU B 63 -11.624 -7.399 -12.561 1.00 0.00 H new ATOM 2438 N ASN B 64 -7.689 -9.053 -10.778 1.00 0.00 N ATOM 2439 CA ASN B 64 -6.396 -9.476 -10.276 1.00 0.00 C ATOM 2440 C ASN B 64 -6.576 -10.586 -9.267 1.00 0.00 C ATOM 2441 O ASN B 64 -5.608 -11.178 -8.793 1.00 0.00 O ATOM 2442 CB ASN B 64 -5.648 -8.298 -9.643 1.00 0.00 C ATOM 2443 CG ASN B 64 -4.646 -7.712 -10.631 1.00 0.00 C ATOM 2444 OD1 ASN B 64 -3.450 -7.997 -10.537 1.00 0.00 O ATOM 2445 ND2 ASN B 64 -5.052 -6.916 -11.576 1.00 0.00 N ATOM 0 H ASN B 64 -8.016 -8.166 -10.394 1.00 0.00 H new ATOM 0 HA ASN B 64 -5.802 -9.846 -11.111 1.00 0.00 H new ATOM 0 HB2 ASN B 64 -6.358 -7.530 -9.337 1.00 0.00 H new ATOM 0 HB3 ASN B 64 -5.130 -8.629 -8.743 1.00 0.00 H new ATOM 0 HD21 ASN B 64 -4.381 -6.528 -12.239 1.00 0.00 H new ATOM 0 HD22 ASN B 64 -6.041 -6.680 -11.654 1.00 0.00 H new ATOM 2452 N GLY B 65 -7.825 -10.937 -9.007 1.00 0.00 N ATOM 2453 CA GLY B 65 -8.135 -12.055 -8.139 1.00 0.00 C ATOM 2454 C GLY B 65 -7.860 -13.337 -8.883 1.00 0.00 C ATOM 2455 O GLY B 65 -8.700 -14.242 -8.934 1.00 0.00 O ATOM 0 H GLY B 65 -8.642 -10.460 -9.388 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -7.532 -12.008 -7.232 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -9.179 -12.015 -7.830 1.00 0.00 H new ATOM 2459 N ASP B 66 -6.729 -13.358 -9.560 1.00 0.00 N ATOM 2460 CA ASP B 66 -6.357 -14.477 -10.390 1.00 0.00 C ATOM 2461 C ASP B 66 -6.164 -15.711 -9.543 1.00 0.00 C ATOM 2462 O ASP B 66 -6.550 -16.810 -9.932 1.00 0.00 O ATOM 2463 CB ASP B 66 -5.073 -14.163 -11.146 1.00 0.00 C ATOM 2464 CG ASP B 66 -4.892 -15.155 -12.263 1.00 0.00 C ATOM 2465 OD1 ASP B 66 -5.633 -15.077 -13.212 1.00 0.00 O ATOM 2466 OD2 ASP B 66 -4.028 -15.990 -12.153 1.00 0.00 O ATOM 0 H ASP B 66 -6.046 -12.600 -9.548 1.00 0.00 H new ATOM 0 HA ASP B 66 -7.156 -14.661 -11.108 1.00 0.00 H new ATOM 0 HB2 ASP B 66 -5.113 -13.151 -11.548 1.00 0.00 H new ATOM 0 HB3 ASP B 66 -4.220 -14.203 -10.468 1.00 0.00 H new ATOM 2471 N GLY B 67 -5.577 -15.516 -8.379 1.00 0.00 N ATOM 2472 CA GLY B 67 -5.344 -16.592 -7.429 1.00 0.00 C ATOM 2473 C GLY B 67 -5.656 -16.118 -6.025 1.00 0.00 C ATOM 2474 O GLY B 67 -6.737 -16.391 -5.488 1.00 0.00 O ATOM 0 H GLY B 67 -5.246 -14.605 -8.062 1.00 0.00 H new ATOM 0 HA2 GLY B 67 -5.967 -17.451 -7.679 1.00 0.00 H new ATOM 0 HA3 GLY B 67 -4.307 -16.923 -7.488 1.00 0.00 H new ATOM 2478 N GLU B 68 -4.740 -15.365 -5.456 1.00 0.00 N ATOM 2479 CA GLU B 68 -4.901 -14.810 -4.120 1.00 0.00 C ATOM 2480 C GLU B 68 -4.514 -13.349 -4.136 1.00 0.00 C ATOM 2481 O GLU B 68 -3.768 -12.923 -5.014 1.00 0.00 O ATOM 2482 CB GLU B 68 -3.990 -15.550 -3.132 1.00 0.00 C ATOM 2483 CG GLU B 68 -4.171 -17.067 -3.275 1.00 0.00 C ATOM 2484 CD GLU B 68 -3.053 -17.650 -4.108 1.00 0.00 C ATOM 2485 OE1 GLU B 68 -3.201 -17.711 -5.300 1.00 0.00 O ATOM 2486 OE2 GLU B 68 -2.059 -18.033 -3.540 1.00 0.00 O ATOM 0 H GLU B 68 -3.858 -15.117 -5.904 1.00 0.00 H new ATOM 0 HA GLU B 68 -5.941 -14.921 -3.812 1.00 0.00 H new ATOM 0 HB2 GLU B 68 -2.949 -15.282 -3.315 1.00 0.00 H new ATOM 0 HB3 GLU B 68 -4.223 -15.244 -2.112 1.00 0.00 H new ATOM 0 HG2 GLU B 68 -4.182 -17.534 -2.290 1.00 0.00 H new ATOM 0 HG3 GLU B 68 -5.132 -17.284 -3.741 1.00 0.00 H new ATOM 2493 N VAL B 69 -4.857 -12.630 -3.081 1.00 0.00 N ATOM 2494 CA VAL B 69 -4.385 -11.272 -2.929 1.00 0.00 C ATOM 2495 C VAL B 69 -3.394 -11.240 -1.786 1.00 0.00 C ATOM 2496 O VAL B 69 -3.681 -11.722 -0.689 1.00 0.00 O ATOM 2497 CB VAL B 69 -5.575 -10.288 -2.698 1.00 0.00 C ATOM 2498 CG1 VAL B 69 -6.571 -10.850 -1.681 1.00 0.00 C ATOM 2499 CG2 VAL B 69 -5.077 -8.918 -2.205 1.00 0.00 C ATOM 0 H VAL B 69 -5.455 -12.963 -2.325 1.00 0.00 H new ATOM 0 HA VAL B 69 -3.889 -10.943 -3.842 1.00 0.00 H new ATOM 0 HB VAL B 69 -6.074 -10.165 -3.659 1.00 0.00 H new ATOM 0 HG11 VAL B 69 -7.388 -10.142 -1.542 1.00 0.00 H new ATOM 0 HG12 VAL B 69 -6.970 -11.796 -2.047 1.00 0.00 H new ATOM 0 HG13 VAL B 69 -6.066 -11.013 -0.729 1.00 0.00 H new ATOM 0 HG21 VAL B 69 -5.928 -8.254 -2.053 1.00 0.00 H new ATOM 0 HG22 VAL B 69 -4.542 -9.043 -1.264 1.00 0.00 H new ATOM 0 HG23 VAL B 69 -4.408 -8.485 -2.948 1.00 0.00 H new ATOM 2509 N ASP B 70 -2.206 -10.741 -2.056 1.00 0.00 N ATOM 2510 CA ASP B 70 -1.173 -10.701 -1.044 1.00 0.00 C ATOM 2511 C ASP B 70 -1.142 -9.352 -0.377 1.00 0.00 C ATOM 2512 O ASP B 70 -1.974 -8.481 -0.659 1.00 0.00 O ATOM 2513 CB ASP B 70 0.207 -11.054 -1.620 1.00 0.00 C ATOM 2514 CG ASP B 70 0.928 -9.806 -2.078 1.00 0.00 C ATOM 2515 OD1 ASP B 70 0.534 -9.261 -3.083 1.00 0.00 O ATOM 2516 OD2 ASP B 70 1.863 -9.414 -1.414 1.00 0.00 O ATOM 0 H ASP B 70 -1.933 -10.360 -2.962 1.00 0.00 H new ATOM 0 HA ASP B 70 -1.415 -11.457 -0.297 1.00 0.00 H new ATOM 0 HB2 ASP B 70 0.802 -11.568 -0.865 1.00 0.00 H new ATOM 0 HB3 ASP B 70 0.092 -11.742 -2.457 1.00 0.00 H new ATOM 2521 N PHE B 71 -0.162 -9.162 0.469 1.00 0.00 N ATOM 2522 CA PHE B 71 -0.006 -7.911 1.166 1.00 0.00 C ATOM 2523 C PHE B 71 0.188 -6.791 0.162 1.00 0.00 C ATOM 2524 O PHE B 71 -0.475 -5.754 0.233 1.00 0.00 O ATOM 2525 CB PHE B 71 1.191 -7.975 2.106 1.00 0.00 C ATOM 2526 CG PHE B 71 1.230 -6.721 2.939 1.00 0.00 C ATOM 2527 CD1 PHE B 71 0.257 -6.519 3.916 1.00 0.00 C ATOM 2528 CD2 PHE B 71 2.235 -5.765 2.744 1.00 0.00 C ATOM 2529 CE1 PHE B 71 0.282 -5.369 4.699 1.00 0.00 C ATOM 2530 CE2 PHE B 71 2.259 -4.609 3.531 1.00 0.00 C ATOM 2531 CZ PHE B 71 1.283 -4.412 4.509 1.00 0.00 C ATOM 0 H PHE B 71 0.544 -9.863 0.693 1.00 0.00 H new ATOM 0 HA PHE B 71 -0.903 -7.720 1.755 1.00 0.00 H new ATOM 0 HB2 PHE B 71 1.118 -8.852 2.749 1.00 0.00 H new ATOM 0 HB3 PHE B 71 2.113 -8.076 1.534 1.00 0.00 H new ATOM 0 HD1 PHE B 71 -0.518 -7.256 4.066 1.00 0.00 H new ATOM 0 HD2 PHE B 71 2.990 -5.920 1.987 1.00 0.00 H new ATOM 0 HE1 PHE B 71 -0.474 -5.215 5.455 1.00 0.00 H new ATOM 0 HE2 PHE B 71 3.032 -3.870 3.382 1.00 0.00 H new ATOM 0 HZ PHE B 71 1.301 -3.521 5.119 1.00 0.00 H new ATOM 2541 N GLN B 72 1.032 -7.041 -0.827 1.00 0.00 N ATOM 2542 CA GLN B 72 1.266 -6.073 -1.879 1.00 0.00 C ATOM 2543 C GLN B 72 -0.033 -5.742 -2.614 1.00 0.00 C ATOM 2544 O GLN B 72 -0.325 -4.571 -2.866 1.00 0.00 O ATOM 2545 CB GLN B 72 2.334 -6.588 -2.856 1.00 0.00 C ATOM 2546 CG GLN B 72 3.711 -6.537 -2.200 1.00 0.00 C ATOM 2547 CD GLN B 72 4.763 -7.102 -3.148 1.00 0.00 C ATOM 2548 OE1 GLN B 72 5.959 -6.933 -2.923 1.00 0.00 O ATOM 2549 NE2 GLN B 72 4.393 -7.771 -4.196 1.00 0.00 N ATOM 0 H GLN B 72 1.564 -7.906 -0.920 1.00 0.00 H new ATOM 0 HA GLN B 72 1.635 -5.154 -1.423 1.00 0.00 H new ATOM 0 HB2 GLN B 72 2.102 -7.610 -3.155 1.00 0.00 H new ATOM 0 HB3 GLN B 72 2.331 -5.983 -3.762 1.00 0.00 H new ATOM 0 HG2 GLN B 72 3.960 -5.509 -1.939 1.00 0.00 H new ATOM 0 HG3 GLN B 72 3.702 -7.108 -1.272 1.00 0.00 H new ATOM 0 HE21 GLN B 72 3.401 -7.913 -4.386 1.00 0.00 H new ATOM 0 HE22 GLN B 72 5.094 -8.155 -4.830 1.00 0.00 H new ATOM 2558 N GLU B 73 -0.844 -6.754 -2.896 1.00 0.00 N ATOM 2559 CA GLU B 73 -2.139 -6.496 -3.506 1.00 0.00 C ATOM 2560 C GLU B 73 -3.083 -5.807 -2.509 1.00 0.00 C ATOM 2561 O GLU B 73 -3.808 -4.863 -2.856 1.00 0.00 O ATOM 2562 CB GLU B 73 -2.767 -7.778 -4.056 1.00 0.00 C ATOM 2563 CG GLU B 73 -1.950 -8.283 -5.244 1.00 0.00 C ATOM 2564 CD GLU B 73 -2.630 -9.490 -5.853 1.00 0.00 C ATOM 2565 OE1 GLU B 73 -3.660 -9.313 -6.467 1.00 0.00 O ATOM 2566 OE2 GLU B 73 -2.107 -10.566 -5.719 1.00 0.00 O ATOM 0 H GLU B 73 -0.635 -7.736 -2.717 1.00 0.00 H new ATOM 0 HA GLU B 73 -1.979 -5.823 -4.348 1.00 0.00 H new ATOM 0 HB2 GLU B 73 -2.803 -8.540 -3.277 1.00 0.00 H new ATOM 0 HB3 GLU B 73 -3.795 -7.588 -4.364 1.00 0.00 H new ATOM 0 HG2 GLU B 73 -1.850 -7.495 -5.990 1.00 0.00 H new ATOM 0 HG3 GLU B 73 -0.943 -8.546 -4.920 1.00 0.00 H new ATOM 2573 N TYR B 74 -3.050 -6.266 -1.264 1.00 0.00 N ATOM 2574 CA TYR B 74 -3.871 -5.689 -0.203 1.00 0.00 C ATOM 2575 C TYR B 74 -3.530 -4.217 0.025 1.00 0.00 C ATOM 2576 O TYR B 74 -4.427 -3.368 0.062 1.00 0.00 O ATOM 2577 CB TYR B 74 -3.696 -6.512 1.091 1.00 0.00 C ATOM 2578 CG TYR B 74 -4.360 -5.843 2.285 1.00 0.00 C ATOM 2579 CD1 TYR B 74 -5.730 -5.531 2.272 1.00 0.00 C ATOM 2580 CD2 TYR B 74 -3.591 -5.549 3.423 1.00 0.00 C ATOM 2581 CE1 TYR B 74 -6.321 -4.933 3.389 1.00 0.00 C ATOM 2582 CE2 TYR B 74 -4.183 -4.952 4.537 1.00 0.00 C ATOM 2583 CZ TYR B 74 -5.545 -4.645 4.524 1.00 0.00 C ATOM 2584 OH TYR B 74 -6.123 -4.063 5.628 1.00 0.00 O ATOM 0 H TYR B 74 -2.460 -7.041 -0.962 1.00 0.00 H new ATOM 0 HA TYR B 74 -4.917 -5.730 -0.507 1.00 0.00 H new ATOM 0 HB2 TYR B 74 -4.121 -7.506 0.949 1.00 0.00 H new ATOM 0 HB3 TYR B 74 -2.634 -6.646 1.295 1.00 0.00 H new ATOM 0 HD1 TYR B 74 -6.326 -5.753 1.399 1.00 0.00 H new ATOM 0 HD2 TYR B 74 -2.537 -5.786 3.436 1.00 0.00 H new ATOM 0 HE1 TYR B 74 -7.374 -4.693 3.379 1.00 0.00 H new ATOM 0 HE2 TYR B 74 -3.587 -4.727 5.409 1.00 0.00 H new ATOM 0 HH TYR B 74 -7.078 -3.920 5.460 1.00 0.00 H new ATOM 2594 N VAL B 75 -2.244 -3.906 0.152 1.00 0.00 N ATOM 2595 CA VAL B 75 -1.842 -2.525 0.381 1.00 0.00 C ATOM 2596 C VAL B 75 -2.177 -1.613 -0.803 1.00 0.00 C ATOM 2597 O VAL B 75 -2.656 -0.493 -0.609 1.00 0.00 O ATOM 2598 CB VAL B 75 -0.354 -2.409 0.763 1.00 0.00 C ATOM 2599 CG1 VAL B 75 -0.107 -3.108 2.102 1.00 0.00 C ATOM 2600 CG2 VAL B 75 0.525 -3.043 -0.311 1.00 0.00 C ATOM 0 H VAL B 75 -1.477 -4.577 0.101 1.00 0.00 H new ATOM 0 HA VAL B 75 -2.429 -2.179 1.232 1.00 0.00 H new ATOM 0 HB VAL B 75 -0.099 -1.353 0.849 1.00 0.00 H new ATOM 0 HG11 VAL B 75 0.947 -3.023 2.368 1.00 0.00 H new ATOM 0 HG12 VAL B 75 -0.715 -2.638 2.875 1.00 0.00 H new ATOM 0 HG13 VAL B 75 -0.376 -4.161 2.018 1.00 0.00 H new ATOM 0 HG21 VAL B 75 1.573 -2.952 -0.024 1.00 0.00 H new ATOM 0 HG22 VAL B 75 0.268 -4.097 -0.416 1.00 0.00 H new ATOM 0 HG23 VAL B 75 0.363 -2.534 -1.261 1.00 0.00 H new ATOM 2610 N VAL B 76 -1.926 -2.079 -2.028 1.00 0.00 N ATOM 2611 CA VAL B 76 -2.197 -1.258 -3.193 1.00 0.00 C ATOM 2612 C VAL B 76 -3.683 -0.993 -3.315 1.00 0.00 C ATOM 2613 O VAL B 76 -4.100 0.122 -3.631 1.00 0.00 O ATOM 2614 CB VAL B 76 -1.620 -1.880 -4.486 1.00 0.00 C ATOM 2615 CG1 VAL B 76 -2.321 -3.197 -4.816 1.00 0.00 C ATOM 2616 CG2 VAL B 76 -1.788 -0.908 -5.659 1.00 0.00 C ATOM 0 H VAL B 76 -1.543 -3.003 -2.230 1.00 0.00 H new ATOM 0 HA VAL B 76 -1.690 -0.303 -3.056 1.00 0.00 H new ATOM 0 HB VAL B 76 -0.560 -2.076 -4.323 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -1.898 -3.615 -5.729 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -2.179 -3.900 -3.995 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -3.386 -3.016 -4.959 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -1.378 -1.356 -6.564 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -2.847 -0.695 -5.806 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -1.258 0.020 -5.442 1.00 0.00 H new ATOM 2626 N LEU B 77 -4.483 -2.011 -3.028 1.00 0.00 N ATOM 2627 CA LEU B 77 -5.924 -1.873 -3.122 1.00 0.00 C ATOM 2628 C LEU B 77 -6.419 -0.803 -2.172 1.00 0.00 C ATOM 2629 O LEU B 77 -7.113 0.124 -2.587 1.00 0.00 O ATOM 2630 CB LEU B 77 -6.603 -3.213 -2.799 1.00 0.00 C ATOM 2631 CG LEU B 77 -8.135 -3.052 -2.788 1.00 0.00 C ATOM 2632 CD1 LEU B 77 -8.632 -2.527 -4.138 1.00 0.00 C ATOM 2633 CD2 LEU B 77 -8.798 -4.400 -2.476 1.00 0.00 C ATOM 0 H LEU B 77 -4.160 -2.932 -2.731 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.177 -1.579 -4.141 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -6.315 -3.961 -3.538 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -6.262 -3.576 -1.829 1.00 0.00 H new ATOM 0 HG LEU B 77 -8.403 -2.331 -2.016 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -9.716 -2.420 -4.110 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -8.177 -1.558 -4.341 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -8.357 -3.229 -4.925 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -9.881 -4.280 -2.470 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -8.518 -5.128 -3.237 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -8.466 -4.751 -1.499 1.00 0.00 H new ATOM 2645 N VAL B 78 -5.973 -0.855 -0.930 1.00 0.00 N ATOM 2646 CA VAL B 78 -6.335 0.186 0.007 1.00 0.00 C ATOM 2647 C VAL B 78 -5.691 1.512 -0.393 1.00 0.00 C ATOM 2648 O VAL B 78 -6.325 2.569 -0.347 1.00 0.00 O ATOM 2649 CB VAL B 78 -5.995 -0.204 1.463 1.00 0.00 C ATOM 2650 CG1 VAL B 78 -6.702 -1.516 1.824 1.00 0.00 C ATOM 2651 CG2 VAL B 78 -4.490 -0.390 1.640 1.00 0.00 C ATOM 0 H VAL B 78 -5.373 -1.590 -0.555 1.00 0.00 H new ATOM 0 HA VAL B 78 -7.417 0.312 -0.033 1.00 0.00 H new ATOM 0 HB VAL B 78 -6.333 0.599 2.118 1.00 0.00 H new ATOM 0 HG11 VAL B 78 -6.460 -1.789 2.851 1.00 0.00 H new ATOM 0 HG12 VAL B 78 -7.780 -1.387 1.727 1.00 0.00 H new ATOM 0 HG13 VAL B 78 -6.369 -2.306 1.151 1.00 0.00 H new ATOM 0 HG21 VAL B 78 -4.276 -0.664 2.673 1.00 0.00 H new ATOM 0 HG22 VAL B 78 -4.140 -1.180 0.975 1.00 0.00 H new ATOM 0 HG23 VAL B 78 -3.977 0.541 1.398 1.00 0.00 H new ATOM 2661 N ALA B 79 -4.428 1.452 -0.797 1.00 0.00 N ATOM 2662 CA ALA B 79 -3.697 2.650 -1.185 1.00 0.00 C ATOM 2663 C ALA B 79 -4.300 3.302 -2.410 1.00 0.00 C ATOM 2664 O ALA B 79 -4.426 4.524 -2.460 1.00 0.00 O ATOM 2665 CB ALA B 79 -2.238 2.330 -1.441 1.00 0.00 C ATOM 0 H ALA B 79 -3.890 0.588 -0.864 1.00 0.00 H new ATOM 0 HA ALA B 79 -3.769 3.353 -0.355 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -1.711 3.240 -1.729 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -1.790 1.923 -0.534 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -2.162 1.597 -2.244 1.00 0.00 H new ATOM 2671 N ALA B 80 -4.699 2.499 -3.386 1.00 0.00 N ATOM 2672 CA ALA B 80 -5.330 3.048 -4.576 1.00 0.00 C ATOM 2673 C ALA B 80 -6.590 3.778 -4.159 1.00 0.00 C ATOM 2674 O ALA B 80 -6.828 4.928 -4.530 1.00 0.00 O ATOM 2675 CB ALA B 80 -5.679 1.932 -5.568 1.00 0.00 C ATOM 0 H ALA B 80 -4.600 1.484 -3.379 1.00 0.00 H new ATOM 0 HA ALA B 80 -4.641 3.735 -5.068 1.00 0.00 H new ATOM 0 HB1 ALA B 80 -6.150 2.364 -6.451 1.00 0.00 H new ATOM 0 HB2 ALA B 80 -4.769 1.409 -5.862 1.00 0.00 H new ATOM 0 HB3 ALA B 80 -6.366 1.229 -5.098 1.00 0.00 H new ATOM 2681 N LEU B 81 -7.333 3.141 -3.295 1.00 0.00 N ATOM 2682 CA LEU B 81 -8.511 3.748 -2.728 1.00 0.00 C ATOM 2683 C LEU B 81 -8.124 4.968 -1.911 1.00 0.00 C ATOM 2684 O LEU B 81 -8.735 6.033 -2.033 1.00 0.00 O ATOM 2685 CB LEU B 81 -9.248 2.729 -1.871 1.00 0.00 C ATOM 2686 CG LEU B 81 -9.823 1.636 -2.778 1.00 0.00 C ATOM 2687 CD1 LEU B 81 -10.414 0.523 -1.931 1.00 0.00 C ATOM 2688 CD2 LEU B 81 -10.914 2.212 -3.678 1.00 0.00 C ATOM 0 H LEU B 81 -7.143 2.195 -2.965 1.00 0.00 H new ATOM 0 HA LEU B 81 -9.176 4.073 -3.528 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -8.569 2.292 -1.139 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -10.049 3.215 -1.313 1.00 0.00 H new ATOM 0 HG LEU B 81 -9.018 1.241 -3.397 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -10.821 -0.252 -2.581 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -9.636 0.094 -1.299 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -11.209 0.926 -1.304 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -11.313 1.424 -4.316 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -11.715 2.621 -3.062 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -10.494 3.003 -4.298 1.00 0.00 H new ATOM 2700 N THR B 82 -7.048 4.840 -1.154 1.00 0.00 N ATOM 2701 CA THR B 82 -6.545 5.954 -0.380 1.00 0.00 C ATOM 2702 C THR B 82 -6.142 7.097 -1.315 1.00 0.00 C ATOM 2703 O THR B 82 -6.554 8.245 -1.122 1.00 0.00 O ATOM 2704 CB THR B 82 -5.328 5.511 0.449 1.00 0.00 C ATOM 2705 OG1 THR B 82 -5.626 4.303 1.144 1.00 0.00 O ATOM 2706 CG2 THR B 82 -4.968 6.605 1.462 1.00 0.00 C ATOM 0 H THR B 82 -6.510 3.978 -1.061 1.00 0.00 H new ATOM 0 HA THR B 82 -7.330 6.300 0.293 1.00 0.00 H new ATOM 0 HB THR B 82 -4.485 5.342 -0.221 1.00 0.00 H new ATOM 0 HG1 THR B 82 -5.863 3.605 0.499 1.00 0.00 H new ATOM 0 HG21 THR B 82 -4.105 6.288 2.048 1.00 0.00 H new ATOM 0 HG22 THR B 82 -4.728 7.527 0.932 1.00 0.00 H new ATOM 0 HG23 THR B 82 -5.814 6.778 2.127 1.00 0.00 H new ATOM 2714 N VAL B 83 -5.368 6.773 -2.353 1.00 0.00 N ATOM 2715 CA VAL B 83 -4.932 7.777 -3.307 1.00 0.00 C ATOM 2716 C VAL B 83 -6.125 8.361 -4.041 1.00 0.00 C ATOM 2717 O VAL B 83 -6.198 9.569 -4.247 1.00 0.00 O ATOM 2718 CB VAL B 83 -3.861 7.213 -4.290 1.00 0.00 C ATOM 2719 CG1 VAL B 83 -4.495 6.646 -5.556 1.00 0.00 C ATOM 2720 CG2 VAL B 83 -2.866 8.308 -4.679 1.00 0.00 C ATOM 0 H VAL B 83 -5.036 5.828 -2.548 1.00 0.00 H new ATOM 0 HA VAL B 83 -4.450 8.584 -2.755 1.00 0.00 H new ATOM 0 HB VAL B 83 -3.344 6.406 -3.771 1.00 0.00 H new ATOM 0 HG11 VAL B 83 -3.715 6.264 -6.214 1.00 0.00 H new ATOM 0 HG12 VAL B 83 -5.175 5.837 -5.291 1.00 0.00 H new ATOM 0 HG13 VAL B 83 -5.049 7.432 -6.069 1.00 0.00 H new ATOM 0 HG21 VAL B 83 -2.125 7.899 -5.365 1.00 0.00 H new ATOM 0 HG22 VAL B 83 -3.397 9.127 -5.164 1.00 0.00 H new ATOM 0 HG23 VAL B 83 -2.366 8.680 -3.785 1.00 0.00 H new ATOM 2730 N ALA B 84 -7.066 7.503 -4.431 1.00 0.00 N ATOM 2731 CA ALA B 84 -8.238 7.962 -5.159 1.00 0.00 C ATOM 2732 C ALA B 84 -8.898 9.117 -4.427 1.00 0.00 C ATOM 2733 O ALA B 84 -8.954 10.242 -4.942 1.00 0.00 O ATOM 2734 CB ALA B 84 -9.243 6.821 -5.342 1.00 0.00 C ATOM 0 H ALA B 84 -7.038 6.499 -4.256 1.00 0.00 H new ATOM 0 HA ALA B 84 -7.914 8.304 -6.142 1.00 0.00 H new ATOM 0 HB1 ALA B 84 -10.112 7.186 -5.889 1.00 0.00 H new ATOM 0 HB2 ALA B 84 -8.776 6.011 -5.902 1.00 0.00 H new ATOM 0 HB3 ALA B 84 -9.557 6.453 -4.365 1.00 0.00 H new ATOM 2740 N MET B 85 -9.340 8.865 -3.204 1.00 0.00 N ATOM 2741 CA MET B 85 -9.923 9.925 -2.394 1.00 0.00 C ATOM 2742 C MET B 85 -8.902 10.983 -2.021 1.00 0.00 C ATOM 2743 O MET B 85 -9.194 12.176 -2.066 1.00 0.00 O ATOM 2744 CB MET B 85 -10.608 9.380 -1.147 1.00 0.00 C ATOM 2745 CG MET B 85 -11.952 8.742 -1.534 1.00 0.00 C ATOM 2746 SD MET B 85 -12.764 8.104 -0.049 1.00 0.00 S ATOM 2747 CE MET B 85 -12.956 9.691 0.806 1.00 0.00 C ATOM 0 H MET B 85 -9.308 7.950 -2.755 1.00 0.00 H new ATOM 0 HA MET B 85 -10.684 10.399 -3.014 1.00 0.00 H new ATOM 0 HB2 MET B 85 -9.969 8.641 -0.662 1.00 0.00 H new ATOM 0 HB3 MET B 85 -10.769 10.183 -0.428 1.00 0.00 H new ATOM 0 HG2 MET B 85 -12.590 9.479 -2.022 1.00 0.00 H new ATOM 0 HG3 MET B 85 -11.792 7.935 -2.249 1.00 0.00 H new ATOM 0 HE1 MET B 85 -13.626 9.567 1.656 1.00 0.00 H new ATOM 0 HE2 MET B 85 -11.983 10.035 1.158 1.00 0.00 H new ATOM 0 HE3 MET B 85 -13.374 10.426 0.119 1.00 0.00 H new ATOM 2757 N ASN B 86 -7.700 10.557 -1.665 1.00 0.00 N ATOM 2758 CA ASN B 86 -6.676 11.516 -1.282 1.00 0.00 C ATOM 2759 C ASN B 86 -6.331 12.437 -2.411 1.00 0.00 C ATOM 2760 O ASN B 86 -6.267 13.646 -2.220 1.00 0.00 O ATOM 2761 CB ASN B 86 -5.432 10.854 -0.710 1.00 0.00 C ATOM 2762 CG ASN B 86 -5.636 10.599 0.769 1.00 0.00 C ATOM 2763 OD1 ASN B 86 -5.446 11.511 1.579 1.00 0.00 O ATOM 2764 ND2 ASN B 86 -6.039 9.448 1.172 1.00 0.00 N ATOM 0 H ASN B 86 -7.414 9.578 -1.633 1.00 0.00 H new ATOM 0 HA ASN B 86 -7.106 12.116 -0.480 1.00 0.00 H new ATOM 0 HB2 ASN B 86 -5.234 9.916 -1.229 1.00 0.00 H new ATOM 0 HB3 ASN B 86 -4.562 11.493 -0.864 1.00 0.00 H new ATOM 0 HD21 ASN B 86 -6.204 9.284 2.165 1.00 0.00 H new ATOM 0 HD22 ASN B 86 -6.195 8.698 0.499 1.00 0.00 H new ATOM 2771 N ASN B 87 -6.253 11.899 -3.612 1.00 0.00 N ATOM 2772 CA ASN B 87 -6.018 12.736 -4.764 1.00 0.00 C ATOM 2773 C ASN B 87 -7.130 13.759 -4.847 1.00 0.00 C ATOM 2774 O ASN B 87 -6.870 14.960 -4.951 1.00 0.00 O ATOM 2775 CB ASN B 87 -5.956 11.909 -6.050 1.00 0.00 C ATOM 2776 CG ASN B 87 -5.417 12.774 -7.180 1.00 0.00 C ATOM 2777 OD1 ASN B 87 -4.218 12.748 -7.464 1.00 0.00 O ATOM 2778 ND2 ASN B 87 -6.223 13.542 -7.836 1.00 0.00 N ATOM 0 H ASN B 87 -6.347 10.903 -3.811 1.00 0.00 H new ATOM 0 HA ASN B 87 -5.055 13.235 -4.655 1.00 0.00 H new ATOM 0 HB2 ASN B 87 -5.316 11.039 -5.906 1.00 0.00 H new ATOM 0 HB3 ASN B 87 -6.948 11.536 -6.304 1.00 0.00 H new ATOM 0 HD21 ASN B 87 -5.867 14.129 -8.591 1.00 0.00 H new ATOM 0 HD22 ASN B 87 -7.215 13.562 -7.599 1.00 0.00 H new ATOM 2785 N PHE B 88 -8.355 13.310 -4.572 1.00 0.00 N ATOM 2786 CA PHE B 88 -9.453 14.244 -4.414 1.00 0.00 C ATOM 2787 C PHE B 88 -9.180 15.191 -3.257 1.00 0.00 C ATOM 2788 O PHE B 88 -9.353 16.383 -3.393 1.00 0.00 O ATOM 2789 CB PHE B 88 -10.820 13.556 -4.249 1.00 0.00 C ATOM 2790 CG PHE B 88 -11.842 14.624 -3.913 1.00 0.00 C ATOM 2791 CD1 PHE B 88 -12.168 15.605 -4.859 1.00 0.00 C ATOM 2792 CD2 PHE B 88 -12.444 14.648 -2.646 1.00 0.00 C ATOM 2793 CE1 PHE B 88 -13.091 16.605 -4.541 1.00 0.00 C ATOM 2794 CE2 PHE B 88 -13.371 15.648 -2.330 1.00 0.00 C ATOM 2795 CZ PHE B 88 -13.693 16.628 -3.276 1.00 0.00 C ATOM 0 H PHE B 88 -8.602 12.327 -4.457 1.00 0.00 H new ATOM 0 HA PHE B 88 -9.512 14.815 -5.341 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -11.099 13.036 -5.166 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -10.777 12.807 -3.458 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -11.706 15.588 -5.835 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -12.192 13.895 -1.914 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -13.341 17.361 -5.271 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -13.838 15.663 -1.356 1.00 0.00 H new ATOM 0 HZ PHE B 88 -14.405 17.402 -3.031 1.00 0.00 H new ATOM 2805 N PHE B 89 -8.722 14.666 -2.129 1.00 0.00 N ATOM 2806 CA PHE B 89 -8.419 15.531 -0.987 1.00 0.00 C ATOM 2807 C PHE B 89 -7.396 16.582 -1.396 1.00 0.00 C ATOM 2808 O PHE B 89 -7.546 17.759 -1.070 1.00 0.00 O ATOM 2809 CB PHE B 89 -7.854 14.731 0.195 1.00 0.00 C ATOM 2810 CG PHE B 89 -8.900 13.824 0.842 1.00 0.00 C ATOM 2811 CD1 PHE B 89 -10.279 14.002 0.607 1.00 0.00 C ATOM 2812 CD2 PHE B 89 -8.474 12.804 1.698 1.00 0.00 C ATOM 2813 CE1 PHE B 89 -11.206 13.159 1.230 1.00 0.00 C ATOM 2814 CE2 PHE B 89 -9.403 11.968 2.312 1.00 0.00 C ATOM 2815 CZ PHE B 89 -10.767 12.144 2.080 1.00 0.00 C ATOM 0 H PHE B 89 -8.554 13.672 -1.977 1.00 0.00 H new ATOM 0 HA PHE B 89 -9.351 16.003 -0.675 1.00 0.00 H new ATOM 0 HB2 PHE B 89 -7.015 14.125 -0.148 1.00 0.00 H new ATOM 0 HB3 PHE B 89 -7.464 15.421 0.943 1.00 0.00 H new ATOM 0 HD1 PHE B 89 -10.619 14.787 -0.052 1.00 0.00 H new ATOM 0 HD2 PHE B 89 -7.419 12.664 1.884 1.00 0.00 H new ATOM 0 HE1 PHE B 89 -12.263 13.294 1.052 1.00 0.00 H new ATOM 0 HE2 PHE B 89 -9.066 11.181 2.970 1.00 0.00 H new ATOM 0 HZ PHE B 89 -11.484 11.494 2.559 1.00 0.00 H new