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 25 LYS NZ :NH3+ -122:sc= 0.358! (180deg=-0.059) USER MOD Set 1.2: A 26 TYR OH : rot 7:sc= 0.644 USER MOD Set 1.3: B 87 ASN : amide:sc= -1.05 K(o=-0.045,f=-5.5!) USER MOD Set 2.1: A 16 HIS : no HD1:sc= -3.8 K(o=-6.4,f=-16!) USER MOD Set 2.2: B 86 ASN : amide:sc= -2.57! C(o=-6.4!,f=-9.9!) USER MOD Set 3.1: A 87 ASN : amide:sc= 0.265! K(o=0.45!,f=-2.9) USER MOD Set 3.2: B 26 TYR OH : rot 37:sc= 0.181 USER MOD Set 4.1: A 82 THR OG1 : rot 72:sc= 0.671 USER MOD Set 4.2: B 8 MET CE :methyl -136:sc= -5.55! (180deg=-7.87!) USER MOD Single : A 2 SER OG : rot 138:sc= 0.909 USER MOD Single : A 6 THR OG1 : rot 60:sc= 0.298 USER MOD Single : A 8 MET CE :methyl 149:sc= -3.05! (180deg=-5.45!) USER MOD Single : A 10 THR OG1 : rot 81:sc= 0.551 USER MOD Single : A 13 ASN : amide:sc= 0.26 K(o=0.26,f=-1) USER MOD Single : A 18 HIS : no HE2:sc= -2.57 K(o=-2.6,f=-9.5!) USER MOD Single : A 19 SER OG : rot 74:sc= 1.18 USER MOD Single : A 21 LYS NZ :NH3+ -154:sc= -0.107 (180deg=-0.759) USER MOD Single : A 27 LYS NZ :NH3+ -156:sc= 0.0552 (180deg=-1.97!) USER MOD Single : A 29 SER OG : rot -140:sc= -1.73 USER MOD Single : A 30 LYS NZ :NH3+ -119:sc= -1.54! (180deg=-8!) USER MOD Single : A 31 LYS NZ :NH3+ -159:sc= -0.12 (180deg=-0.814) USER MOD Single : A 34 LYS NZ :NH3+ 169:sc= -3.76! (180deg=-4.4!) USER MOD Single : A 38 GLN :FLIP amide:sc= -1.14 F(o=-2.2!,f=-1.1) USER MOD Single : A 39 THR OG1 : rot 67:sc= 0.683 USER MOD Single : A 42 SER OG : rot 68:sc= 1.25 USER MOD Single : A 48 GLN : amide:sc= -0.972 K(o=-0.97,f=-1.6) USER MOD Single : A 49 LYS NZ :NH3+ 159:sc= -0.0159 (180deg=-0.24) USER MOD Single : A 56 LYS NZ :NH3+ 173:sc= 0.43! (180deg=0.227!) USER MOD Single : A 58 MET CE :methyl 160:sc= -0.0631 (180deg=-0.587) USER MOD Single : A 59 LYS NZ :NH3+ -109:sc= 0.726 (180deg=-2.09!) USER MOD Single : A 64 ASN : amide:sc= -0.0404 K(o=-0.04,f=-1.1) USER MOD Single : A 72 GLN : amide:sc= -1.03 K(o=-1,f=-3.1!) USER MOD Single : A 74 TYR OH : rot -30:sc= -1.05 USER MOD Single : A 85 MET CE :methyl -146:sc= -3.39 (180deg=-7.33!) USER MOD Single : A 86 ASN : amide:sc= -2.81! C(o=-2.8!,f=-8.2!) USER MOD Single : B 2 SER OG : rot -121:sc= 0.245 USER MOD Single : B 6 THR OG1 : rot 180:sc= 0.00122 USER MOD Single : B 10 THR OG1 : rot 76:sc= 0.802 USER MOD Single : B 13 ASN : amide:sc= -0.883! X(o=-0.88!,f=-0.93) USER MOD Single : B 16 HIS : no HE2:sc= -13.1! C(o=-13!,f=-17!) USER MOD Single : B 18 HIS : no HE2:sc= -6.76! C(o=-6.8!,f=-15!) USER MOD Single : B 19 SER OG : rot -31:sc= 0.765 USER MOD Single : B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 LYS NZ :NH3+ -162:sc= -0.0134 (180deg=-1.53!) USER MOD Single : B 29 SER OG : rot 49:sc= 0.209 USER MOD Single : B 30 LYS NZ :NH3+ -150:sc= -6.78! (180deg=-8.69!) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 38 GLN : amide:sc= -1.11! X(o=-1.1!,f=-1.6) USER MOD Single : B 39 THR OG1 : rot 70:sc= 0.952 USER MOD Single : B 42 SER OG : rot -36:sc= 1.04 USER MOD Single : B 48 GLN :FLIP amide:sc= -7.81! C(o=-9.1!,f=-7.8!) USER MOD Single : B 49 LYS NZ :NH3+ 146:sc= 0.67 (180deg=-0.673!) USER MOD Single : B 56 LYS NZ :NH3+ 164:sc= 0.502 (180deg=-0.462) USER MOD Single : B 58 MET CE :methyl -110:sc= -0.425 (180deg=-3.09!) USER MOD Single : B 59 LYS NZ :NH3+ -120:sc= 0.648 (180deg=-1.02!) USER MOD Single : B 64 ASN :FLIP amide:sc= 0.516 F(o=0,f=0.52) USER MOD Single : B 72 GLN : amide:sc= -2.33 K(o=-2.3,f=-4.8!) USER MOD Single : B 74 TYR OH : rot -60:sc= -0.756 USER MOD Single : B 82 THR OG1 : rot 109:sc= 1.2 USER MOD Single : B 85 MET CE :methyl 165:sc= -0.152 (180deg=-0.567) USER MOD ----------------------------------------------------------------- ATOM 8 N SER A 2 -10.285 4.360 10.433 1.00 0.00 N ATOM 9 CA SER A 2 -9.764 3.090 10.918 1.00 0.00 C ATOM 10 C SER A 2 -8.243 3.165 11.045 1.00 0.00 C ATOM 11 O SER A 2 -7.601 4.048 10.458 1.00 0.00 O ATOM 12 CB SER A 2 -10.140 1.969 9.937 1.00 0.00 C ATOM 13 OG SER A 2 -11.480 2.151 9.491 1.00 0.00 O ATOM 0 HA SER A 2 -10.196 2.879 11.896 1.00 0.00 H new ATOM 0 HB2 SER A 2 -9.459 1.974 9.086 1.00 0.00 H new ATOM 0 HB3 SER A 2 -10.037 0.998 10.422 1.00 0.00 H new ATOM 0 HG SER A 2 -11.530 1.979 8.528 1.00 0.00 H new ATOM 19 N GLU A 3 -7.654 2.198 11.722 1.00 0.00 N ATOM 20 CA GLU A 3 -6.203 2.125 11.797 1.00 0.00 C ATOM 21 C GLU A 3 -5.632 1.929 10.415 1.00 0.00 C ATOM 22 O GLU A 3 -4.644 2.562 10.046 1.00 0.00 O ATOM 23 CB GLU A 3 -5.763 0.987 12.717 1.00 0.00 C ATOM 24 CG GLU A 3 -5.993 1.395 14.169 1.00 0.00 C ATOM 25 CD GLU A 3 -5.688 0.251 15.117 1.00 0.00 C ATOM 26 OE1 GLU A 3 -5.462 -0.850 14.655 1.00 0.00 O ATOM 27 OE2 GLU A 3 -5.669 0.496 16.299 1.00 0.00 O ATOM 0 H GLU A 3 -8.148 1.460 12.223 1.00 0.00 H new ATOM 0 HA GLU A 3 -5.828 3.060 12.212 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -6.325 0.081 12.488 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -4.710 0.759 12.554 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -5.363 2.250 14.413 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -7.027 1.713 14.300 1.00 0.00 H new ATOM 34 N LEU A 4 -6.317 1.132 9.617 1.00 0.00 N ATOM 35 CA LEU A 4 -5.904 0.920 8.242 1.00 0.00 C ATOM 36 C LEU A 4 -5.940 2.253 7.520 1.00 0.00 C ATOM 37 O LEU A 4 -4.973 2.648 6.860 1.00 0.00 O ATOM 38 CB LEU A 4 -6.891 -0.035 7.543 1.00 0.00 C ATOM 39 CG LEU A 4 -6.628 -1.508 7.928 1.00 0.00 C ATOM 40 CD1 LEU A 4 -5.197 -1.919 7.587 1.00 0.00 C ATOM 41 CD2 LEU A 4 -6.897 -1.714 9.414 1.00 0.00 C ATOM 0 H LEU A 4 -7.157 0.623 9.894 1.00 0.00 H new ATOM 0 HA LEU A 4 -4.902 0.492 8.223 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.912 0.235 7.813 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -6.806 0.080 6.462 1.00 0.00 H new ATOM 0 HG LEU A 4 -7.305 -2.138 7.351 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -5.041 -2.960 7.869 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -5.031 -1.804 6.516 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -4.497 -1.286 8.133 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -6.709 -2.755 9.677 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -6.239 -1.068 9.996 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -7.935 -1.466 9.634 1.00 0.00 H new ATOM 53 N GLU A 5 -7.013 2.993 7.758 1.00 0.00 N ATOM 54 CA GLU A 5 -7.175 4.310 7.184 1.00 0.00 C ATOM 55 C GLU A 5 -6.122 5.240 7.759 1.00 0.00 C ATOM 56 O GLU A 5 -5.447 5.964 7.029 1.00 0.00 O ATOM 57 CB GLU A 5 -8.584 4.848 7.495 1.00 0.00 C ATOM 58 CG GLU A 5 -9.630 3.977 6.777 1.00 0.00 C ATOM 59 CD GLU A 5 -11.041 4.497 7.030 1.00 0.00 C ATOM 60 OE1 GLU A 5 -11.313 4.913 8.140 1.00 0.00 O ATOM 61 OE2 GLU A 5 -11.832 4.480 6.103 1.00 0.00 O ATOM 0 H GLU A 5 -7.788 2.695 8.351 1.00 0.00 H new ATOM 0 HA GLU A 5 -7.054 4.253 6.102 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -8.761 4.837 8.570 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -8.671 5.884 7.168 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -9.428 3.969 5.706 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -9.551 2.947 7.124 1.00 0.00 H new ATOM 68 N THR A 6 -5.906 5.127 9.061 1.00 0.00 N ATOM 69 CA THR A 6 -4.881 5.911 9.719 1.00 0.00 C ATOM 70 C THR A 6 -3.525 5.561 9.119 1.00 0.00 C ATOM 71 O THR A 6 -2.739 6.446 8.760 1.00 0.00 O ATOM 72 CB THR A 6 -4.871 5.615 11.228 1.00 0.00 C ATOM 73 OG1 THR A 6 -6.208 5.614 11.731 1.00 0.00 O ATOM 74 CG2 THR A 6 -4.055 6.689 11.958 1.00 0.00 C ATOM 0 H THR A 6 -6.426 4.502 9.677 1.00 0.00 H new ATOM 0 HA THR A 6 -5.089 6.971 9.572 1.00 0.00 H new ATOM 0 HB THR A 6 -4.421 4.637 11.396 1.00 0.00 H new ATOM 0 HG1 THR A 6 -6.732 4.929 11.266 1.00 0.00 H new ATOM 0 HG21 THR A 6 -4.049 6.477 13.027 1.00 0.00 H new ATOM 0 HG22 THR A 6 -3.032 6.687 11.582 1.00 0.00 H new ATOM 0 HG23 THR A 6 -4.503 7.667 11.784 1.00 0.00 H new ATOM 82 N ALA A 7 -3.274 4.266 8.967 1.00 0.00 N ATOM 83 CA ALA A 7 -2.031 3.802 8.383 1.00 0.00 C ATOM 84 C ALA A 7 -1.856 4.390 6.997 1.00 0.00 C ATOM 85 O ALA A 7 -0.808 4.959 6.682 1.00 0.00 O ATOM 86 CB ALA A 7 -2.009 2.269 8.304 1.00 0.00 C ATOM 0 H ALA A 7 -3.917 3.523 9.241 1.00 0.00 H new ATOM 0 HA ALA A 7 -1.209 4.130 9.019 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -1.068 1.941 7.863 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -2.105 1.852 9.306 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -2.839 1.925 7.687 1.00 0.00 H new ATOM 92 N MET A 8 -2.897 4.293 6.181 1.00 0.00 N ATOM 93 CA MET A 8 -2.823 4.839 4.839 1.00 0.00 C ATOM 94 C MET A 8 -2.599 6.341 4.909 1.00 0.00 C ATOM 95 O MET A 8 -1.684 6.866 4.277 1.00 0.00 O ATOM 96 CB MET A 8 -4.099 4.527 4.045 1.00 0.00 C ATOM 97 CG MET A 8 -4.370 3.018 4.073 1.00 0.00 C ATOM 98 SD MET A 8 -4.541 2.405 2.384 1.00 0.00 S ATOM 99 CE MET A 8 -2.775 2.340 1.982 1.00 0.00 C ATOM 0 H MET A 8 -3.784 3.850 6.421 1.00 0.00 H new ATOM 0 HA MET A 8 -1.985 4.373 4.321 1.00 0.00 H new ATOM 0 HB2 MET A 8 -4.945 5.066 4.471 1.00 0.00 H new ATOM 0 HB3 MET A 8 -3.990 4.868 3.015 1.00 0.00 H new ATOM 0 HG2 MET A 8 -3.554 2.501 4.578 1.00 0.00 H new ATOM 0 HG3 MET A 8 -5.278 2.811 4.640 1.00 0.00 H new ATOM 0 HE1 MET A 8 -2.593 1.532 1.274 1.00 0.00 H new ATOM 0 HE2 MET A 8 -2.468 3.287 1.539 1.00 0.00 H new ATOM 0 HE3 MET A 8 -2.201 2.162 2.891 1.00 0.00 H new ATOM 109 N GLU A 9 -3.331 7.005 5.791 1.00 0.00 N ATOM 110 CA GLU A 9 -3.130 8.433 5.995 1.00 0.00 C ATOM 111 C GLU A 9 -1.743 8.728 6.516 1.00 0.00 C ATOM 112 O GLU A 9 -1.101 9.697 6.090 1.00 0.00 O ATOM 113 CB GLU A 9 -4.206 9.033 6.900 1.00 0.00 C ATOM 114 CG GLU A 9 -5.533 9.073 6.135 1.00 0.00 C ATOM 115 CD GLU A 9 -5.426 10.019 4.941 1.00 0.00 C ATOM 116 OE1 GLU A 9 -4.562 10.877 4.953 1.00 0.00 O ATOM 117 OE2 GLU A 9 -6.207 9.873 4.037 1.00 0.00 O ATOM 0 H GLU A 9 -4.059 6.586 6.370 1.00 0.00 H new ATOM 0 HA GLU A 9 -3.223 8.913 5.021 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -4.311 8.437 7.806 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -3.920 10.038 7.211 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -5.794 8.072 5.792 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -6.333 9.402 6.798 1.00 0.00 H new ATOM 124 N THR A 10 -1.239 7.865 7.374 1.00 0.00 N ATOM 125 CA THR A 10 0.109 8.034 7.867 1.00 0.00 C ATOM 126 C THR A 10 1.055 7.997 6.674 1.00 0.00 C ATOM 127 O THR A 10 1.874 8.902 6.477 1.00 0.00 O ATOM 128 CB THR A 10 0.459 6.909 8.865 1.00 0.00 C ATOM 129 OG1 THR A 10 -0.611 6.746 9.795 1.00 0.00 O ATOM 130 CG2 THR A 10 1.733 7.278 9.640 1.00 0.00 C ATOM 0 H THR A 10 -1.735 7.052 7.739 1.00 0.00 H new ATOM 0 HA THR A 10 0.202 8.986 8.390 1.00 0.00 H new ATOM 0 HB THR A 10 0.618 5.983 8.313 1.00 0.00 H new ATOM 0 HG1 THR A 10 -1.322 6.210 9.385 1.00 0.00 H new ATOM 0 HG21 THR A 10 1.975 6.481 10.343 1.00 0.00 H new ATOM 0 HG22 THR A 10 2.559 7.409 8.941 1.00 0.00 H new ATOM 0 HG23 THR A 10 1.570 8.207 10.187 1.00 0.00 H new ATOM 138 N LEU A 11 0.843 7.012 5.812 1.00 0.00 N ATOM 139 CA LEU A 11 1.603 6.906 4.580 1.00 0.00 C ATOM 140 C LEU A 11 1.321 8.107 3.662 1.00 0.00 C ATOM 141 O LEU A 11 2.243 8.657 3.049 1.00 0.00 O ATOM 142 CB LEU A 11 1.276 5.590 3.864 1.00 0.00 C ATOM 143 CG LEU A 11 1.812 4.390 4.676 1.00 0.00 C ATOM 144 CD1 LEU A 11 1.231 3.091 4.112 1.00 0.00 C ATOM 145 CD2 LEU A 11 3.343 4.320 4.593 1.00 0.00 C ATOM 0 H LEU A 11 0.150 6.276 5.946 1.00 0.00 H new ATOM 0 HA LEU A 11 2.664 6.911 4.828 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.198 5.497 3.734 1.00 0.00 H new ATOM 0 HB3 LEU A 11 1.718 5.590 2.868 1.00 0.00 H new ATOM 0 HG LEU A 11 1.515 4.519 5.717 1.00 0.00 H new ATOM 0 HD11 LEU A 11 1.609 2.244 4.685 1.00 0.00 H new ATOM 0 HD12 LEU A 11 0.144 3.119 4.181 1.00 0.00 H new ATOM 0 HD13 LEU A 11 1.526 2.984 3.068 1.00 0.00 H new ATOM 0 HD21 LEU A 11 3.700 3.468 5.172 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.646 4.205 3.552 1.00 0.00 H new ATOM 0 HD23 LEU A 11 3.772 5.238 4.996 1.00 0.00 H new ATOM 157 N ILE A 12 0.050 8.517 3.569 1.00 0.00 N ATOM 158 CA ILE A 12 -0.318 9.647 2.704 1.00 0.00 C ATOM 159 C ILE A 12 0.384 10.905 3.193 1.00 0.00 C ATOM 160 O ILE A 12 0.939 11.666 2.397 1.00 0.00 O ATOM 161 CB ILE A 12 -1.853 9.884 2.736 1.00 0.00 C ATOM 162 CG1 ILE A 12 -2.626 8.728 2.070 1.00 0.00 C ATOM 163 CG2 ILE A 12 -2.213 11.203 2.036 1.00 0.00 C ATOM 164 CD1 ILE A 12 -2.435 8.747 0.549 1.00 0.00 C ATOM 0 H ILE A 12 -0.729 8.093 4.072 1.00 0.00 H new ATOM 0 HA ILE A 12 -0.015 9.416 1.683 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.145 9.934 3.785 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -2.281 7.775 2.472 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.686 8.809 2.308 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -3.293 11.350 2.070 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.718 12.031 2.543 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.884 11.165 0.997 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.990 7.922 0.102 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -2.803 9.691 0.148 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.376 8.641 0.314 1.00 0.00 H new ATOM 176 N ASN A 13 0.370 11.111 4.497 1.00 0.00 N ATOM 177 CA ASN A 13 0.977 12.302 5.071 1.00 0.00 C ATOM 178 C ASN A 13 2.458 12.323 4.787 1.00 0.00 C ATOM 179 O ASN A 13 2.989 13.316 4.295 1.00 0.00 O ATOM 180 CB ASN A 13 0.745 12.327 6.581 1.00 0.00 C ATOM 181 CG ASN A 13 -0.665 12.805 6.881 1.00 0.00 C ATOM 182 OD1 ASN A 13 -0.908 14.007 6.971 1.00 0.00 O ATOM 183 ND2 ASN A 13 -1.617 11.937 7.006 1.00 0.00 N ATOM 0 H ASN A 13 -0.051 10.476 5.175 1.00 0.00 H new ATOM 0 HA ASN A 13 0.517 13.181 4.619 1.00 0.00 H new ATOM 0 HB2 ASN A 13 0.897 11.331 6.997 1.00 0.00 H new ATOM 0 HB3 ASN A 13 1.471 12.986 7.058 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -2.572 12.249 7.180 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -1.412 10.941 6.931 1.00 0.00 H new ATOM 190 N VAL A 14 3.097 11.186 4.973 1.00 0.00 N ATOM 191 CA VAL A 14 4.502 11.053 4.645 1.00 0.00 C ATOM 192 C VAL A 14 4.704 11.229 3.139 1.00 0.00 C ATOM 193 O VAL A 14 5.579 11.977 2.696 1.00 0.00 O ATOM 194 CB VAL A 14 5.033 9.695 5.131 1.00 0.00 C ATOM 195 CG1 VAL A 14 6.464 9.478 4.628 1.00 0.00 C ATOM 196 CG2 VAL A 14 5.023 9.664 6.670 1.00 0.00 C ATOM 0 H VAL A 14 2.666 10.341 5.349 1.00 0.00 H new ATOM 0 HA VAL A 14 5.069 11.832 5.154 1.00 0.00 H new ATOM 0 HB VAL A 14 4.394 8.903 4.741 1.00 0.00 H new ATOM 0 HG11 VAL A 14 6.830 8.513 4.978 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.473 9.496 3.538 1.00 0.00 H new ATOM 0 HG13 VAL A 14 7.108 10.271 5.009 1.00 0.00 H new ATOM 0 HG21 VAL A 14 5.399 8.702 7.017 1.00 0.00 H new ATOM 0 HG22 VAL A 14 5.658 10.462 7.054 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.004 9.806 7.030 1.00 0.00 H new ATOM 206 N PHE A 15 3.847 10.583 2.367 1.00 0.00 N ATOM 207 CA PHE A 15 3.891 10.680 0.915 1.00 0.00 C ATOM 208 C PHE A 15 3.718 12.137 0.490 1.00 0.00 C ATOM 209 O PHE A 15 4.469 12.657 -0.349 1.00 0.00 O ATOM 210 CB PHE A 15 2.770 9.831 0.311 1.00 0.00 C ATOM 211 CG PHE A 15 2.852 9.859 -1.193 1.00 0.00 C ATOM 212 CD1 PHE A 15 3.741 9.009 -1.858 1.00 0.00 C ATOM 213 CD2 PHE A 15 2.038 10.731 -1.923 1.00 0.00 C ATOM 214 CE1 PHE A 15 3.814 9.028 -3.251 1.00 0.00 C ATOM 215 CE2 PHE A 15 2.115 10.751 -3.318 1.00 0.00 C ATOM 216 CZ PHE A 15 3.003 9.898 -3.982 1.00 0.00 C ATOM 0 H PHE A 15 3.106 9.980 2.724 1.00 0.00 H new ATOM 0 HA PHE A 15 4.854 10.315 0.558 1.00 0.00 H new ATOM 0 HB2 PHE A 15 2.848 8.804 0.668 1.00 0.00 H new ATOM 0 HB3 PHE A 15 1.801 10.209 0.637 1.00 0.00 H new ATOM 0 HD1 PHE A 15 4.371 8.338 -1.293 1.00 0.00 H new ATOM 0 HD2 PHE A 15 1.351 11.388 -1.410 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.499 8.369 -3.764 1.00 0.00 H new ATOM 0 HE2 PHE A 15 1.489 11.425 -3.884 1.00 0.00 H new ATOM 0 HZ PHE A 15 3.061 9.913 -5.060 1.00 0.00 H new ATOM 226 N HIS A 16 2.740 12.796 1.085 1.00 0.00 N ATOM 227 CA HIS A 16 2.466 14.193 0.785 1.00 0.00 C ATOM 228 C HIS A 16 3.632 15.051 1.220 1.00 0.00 C ATOM 229 O HIS A 16 4.050 15.967 0.500 1.00 0.00 O ATOM 230 CB HIS A 16 1.210 14.651 1.525 1.00 0.00 C ATOM 231 CG HIS A 16 0.013 14.474 0.645 1.00 0.00 C ATOM 232 ND1 HIS A 16 -0.703 15.548 0.150 1.00 0.00 N ATOM 233 CD2 HIS A 16 -0.619 13.355 0.179 1.00 0.00 C ATOM 234 CE1 HIS A 16 -1.716 15.056 -0.577 1.00 0.00 C ATOM 235 NE2 HIS A 16 -1.717 13.723 -0.591 1.00 0.00 N ATOM 0 H HIS A 16 2.119 12.385 1.782 1.00 0.00 H new ATOM 0 HA HIS A 16 2.315 14.295 -0.290 1.00 0.00 H new ATOM 0 HB2 HIS A 16 1.087 14.076 2.443 1.00 0.00 H new ATOM 0 HB3 HIS A 16 1.308 15.697 1.815 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -0.312 12.339 0.379 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -2.444 15.667 -1.090 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -2.379 13.107 -1.063 1.00 0.00 H new ATOM 244 N ALA A 17 4.181 14.735 2.384 1.00 0.00 N ATOM 245 CA ALA A 17 5.306 15.483 2.905 1.00 0.00 C ATOM 246 C ALA A 17 6.397 15.540 1.860 1.00 0.00 C ATOM 247 O ALA A 17 6.888 16.618 1.520 1.00 0.00 O ATOM 248 CB ALA A 17 5.838 14.829 4.184 1.00 0.00 C ATOM 0 H ALA A 17 3.865 13.970 2.980 1.00 0.00 H new ATOM 0 HA ALA A 17 4.980 16.495 3.146 1.00 0.00 H new ATOM 0 HB1 ALA A 17 6.683 15.404 4.562 1.00 0.00 H new ATOM 0 HB2 ALA A 17 5.049 14.806 4.936 1.00 0.00 H new ATOM 0 HB3 ALA A 17 6.160 13.811 3.965 1.00 0.00 H new ATOM 254 N HIS A 18 6.733 14.384 1.309 1.00 0.00 N ATOM 255 CA HIS A 18 7.721 14.311 0.244 1.00 0.00 C ATOM 256 C HIS A 18 7.196 14.913 -1.054 1.00 0.00 C ATOM 257 O HIS A 18 7.928 15.607 -1.752 1.00 0.00 O ATOM 258 CB HIS A 18 8.226 12.880 0.033 1.00 0.00 C ATOM 259 CG HIS A 18 9.055 12.483 1.226 1.00 0.00 C ATOM 260 ND1 HIS A 18 10.389 12.863 1.374 1.00 0.00 N ATOM 261 CD2 HIS A 18 8.746 11.764 2.353 1.00 0.00 C ATOM 262 CE1 HIS A 18 10.816 12.372 2.555 1.00 0.00 C ATOM 263 NE2 HIS A 18 9.854 11.698 3.191 1.00 0.00 N ATOM 0 H HIS A 18 6.337 13.484 1.581 1.00 0.00 H new ATOM 0 HA HIS A 18 8.574 14.912 0.560 1.00 0.00 H new ATOM 0 HB2 HIS A 18 7.386 12.196 -0.088 1.00 0.00 H new ATOM 0 HB3 HIS A 18 8.821 12.819 -0.878 1.00 0.00 H new ATOM 0 HD1 HIS A 18 10.939 13.410 0.712 1.00 0.00 H new ATOM 0 HD2 HIS A 18 7.785 11.316 2.559 1.00 0.00 H new ATOM 0 HE1 HIS A 18 11.816 12.507 2.940 1.00 0.00 H new ATOM 272 N SER A 19 5.911 14.707 -1.349 1.00 0.00 N ATOM 273 CA SER A 19 5.340 15.282 -2.569 1.00 0.00 C ATOM 274 C SER A 19 5.584 16.781 -2.577 1.00 0.00 C ATOM 275 O SER A 19 6.048 17.348 -3.566 1.00 0.00 O ATOM 276 CB SER A 19 3.825 15.022 -2.639 1.00 0.00 C ATOM 277 OG SER A 19 3.565 13.620 -2.558 1.00 0.00 O ATOM 0 H SER A 19 5.262 14.163 -0.780 1.00 0.00 H new ATOM 0 HA SER A 19 5.818 14.814 -3.430 1.00 0.00 H new ATOM 0 HB2 SER A 19 3.321 15.541 -1.824 1.00 0.00 H new ATOM 0 HB3 SER A 19 3.422 15.422 -3.569 1.00 0.00 H new ATOM 0 HG SER A 19 3.708 13.313 -1.638 1.00 0.00 H new ATOM 283 N GLY A 20 5.350 17.406 -1.438 1.00 0.00 N ATOM 284 CA GLY A 20 5.560 18.833 -1.309 1.00 0.00 C ATOM 285 C GLY A 20 7.010 19.190 -1.571 1.00 0.00 C ATOM 286 O GLY A 20 7.306 20.245 -2.113 1.00 0.00 O ATOM 0 H GLY A 20 5.015 16.947 -0.591 1.00 0.00 H new ATOM 0 HA2 GLY A 20 4.917 19.365 -2.011 1.00 0.00 H new ATOM 0 HA3 GLY A 20 5.276 19.158 -0.308 1.00 0.00 H new ATOM 290 N LYS A 21 7.913 18.317 -1.161 1.00 0.00 N ATOM 291 CA LYS A 21 9.342 18.567 -1.318 1.00 0.00 C ATOM 292 C LYS A 21 9.736 18.646 -2.791 1.00 0.00 C ATOM 293 O LYS A 21 10.594 19.461 -3.168 1.00 0.00 O ATOM 294 CB LYS A 21 10.151 17.470 -0.619 1.00 0.00 C ATOM 295 CG LYS A 21 9.875 17.538 0.881 1.00 0.00 C ATOM 296 CD LYS A 21 10.637 16.433 1.616 1.00 0.00 C ATOM 297 CE LYS A 21 10.219 16.423 3.091 1.00 0.00 C ATOM 298 NZ LYS A 21 10.291 17.806 3.637 1.00 0.00 N ATOM 0 H LYS A 21 7.686 17.428 -0.716 1.00 0.00 H new ATOM 0 HA LYS A 21 9.564 19.529 -0.857 1.00 0.00 H new ATOM 0 HB2 LYS A 21 9.876 16.490 -1.010 1.00 0.00 H new ATOM 0 HB3 LYS A 21 11.215 17.603 -0.814 1.00 0.00 H new ATOM 0 HG2 LYS A 21 10.173 18.513 1.268 1.00 0.00 H new ATOM 0 HG3 LYS A 21 8.806 17.435 1.065 1.00 0.00 H new ATOM 0 HD2 LYS A 21 10.427 15.465 1.160 1.00 0.00 H new ATOM 0 HD3 LYS A 21 11.711 16.598 1.532 1.00 0.00 H new ATOM 0 HE2 LYS A 21 9.206 16.034 3.190 1.00 0.00 H new ATOM 0 HE3 LYS A 21 10.872 15.761 3.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 10.447 17.766 4.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 11.078 18.316 3.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 9.399 18.303 3.441 1.00 0.00 H new ATOM 312 N GLU A 22 9.171 17.759 -3.610 1.00 0.00 N ATOM 313 CA GLU A 22 9.533 17.702 -5.025 1.00 0.00 C ATOM 314 C GLU A 22 8.529 18.452 -5.899 1.00 0.00 C ATOM 315 O GLU A 22 8.878 18.933 -6.983 1.00 0.00 O ATOM 316 CB GLU A 22 9.695 16.249 -5.500 1.00 0.00 C ATOM 317 CG GLU A 22 10.020 15.339 -4.308 1.00 0.00 C ATOM 318 CD GLU A 22 10.396 13.969 -4.810 1.00 0.00 C ATOM 319 OE1 GLU A 22 9.511 13.253 -5.192 1.00 0.00 O ATOM 320 OE2 GLU A 22 11.560 13.670 -4.848 1.00 0.00 O ATOM 0 H GLU A 22 8.469 17.078 -3.322 1.00 0.00 H new ATOM 0 HA GLU A 22 10.496 18.202 -5.130 1.00 0.00 H new ATOM 0 HB2 GLU A 22 8.779 15.912 -5.986 1.00 0.00 H new ATOM 0 HB3 GLU A 22 10.491 16.187 -6.242 1.00 0.00 H new ATOM 0 HG2 GLU A 22 10.839 15.762 -3.726 1.00 0.00 H new ATOM 0 HG3 GLU A 22 9.159 15.271 -3.643 1.00 0.00 H new ATOM 327 N GLY A 23 7.296 18.579 -5.424 1.00 0.00 N ATOM 328 CA GLY A 23 6.276 19.325 -6.161 1.00 0.00 C ATOM 329 C GLY A 23 5.076 18.458 -6.494 1.00 0.00 C ATOM 330 O GLY A 23 4.831 17.439 -5.837 1.00 0.00 O ATOM 0 H GLY A 23 6.977 18.181 -4.541 1.00 0.00 H new ATOM 0 HA2 GLY A 23 5.953 20.181 -5.569 1.00 0.00 H new ATOM 0 HA3 GLY A 23 6.707 19.718 -7.082 1.00 0.00 H new ATOM 334 N ASP A 24 4.298 18.888 -7.487 1.00 0.00 N ATOM 335 CA ASP A 24 3.058 18.206 -7.866 1.00 0.00 C ATOM 336 C ASP A 24 2.059 18.295 -6.720 1.00 0.00 C ATOM 337 O ASP A 24 2.446 18.585 -5.578 1.00 0.00 O ATOM 338 CB ASP A 24 3.319 16.734 -8.215 1.00 0.00 C ATOM 339 CG ASP A 24 2.186 16.200 -9.044 1.00 0.00 C ATOM 340 OD1 ASP A 24 1.225 15.745 -8.476 1.00 0.00 O ATOM 341 OD2 ASP A 24 2.284 16.270 -10.249 1.00 0.00 O ATOM 0 H ASP A 24 4.506 19.713 -8.049 1.00 0.00 H new ATOM 0 HA ASP A 24 2.651 18.697 -8.750 1.00 0.00 H new ATOM 0 HB2 ASP A 24 4.257 16.641 -8.762 1.00 0.00 H new ATOM 0 HB3 ASP A 24 3.422 16.147 -7.302 1.00 0.00 H new ATOM 346 N LYS A 25 0.784 18.048 -6.995 1.00 0.00 N ATOM 347 CA LYS A 25 -0.210 18.106 -5.925 1.00 0.00 C ATOM 348 C LYS A 25 0.105 17.055 -4.893 1.00 0.00 C ATOM 349 O LYS A 25 0.313 17.364 -3.722 1.00 0.00 O ATOM 350 CB LYS A 25 -1.640 17.915 -6.447 1.00 0.00 C ATOM 351 CG LYS A 25 -1.721 16.715 -7.414 1.00 0.00 C ATOM 352 CD LYS A 25 -2.816 16.946 -8.473 1.00 0.00 C ATOM 353 CE LYS A 25 -4.092 16.171 -8.107 1.00 0.00 C ATOM 354 NZ LYS A 25 -4.928 16.995 -7.207 1.00 0.00 N ATOM 0 H LYS A 25 0.420 17.813 -7.918 1.00 0.00 H new ATOM 0 HA LYS A 25 -0.161 19.099 -5.479 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -2.319 17.757 -5.609 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -1.968 18.820 -6.957 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -0.758 16.570 -7.904 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -1.934 15.804 -6.855 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -3.039 18.010 -8.548 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -2.457 16.626 -9.451 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -4.649 15.920 -9.010 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -3.832 15.231 -7.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -5.090 16.482 -6.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -4.441 17.892 -7.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -5.841 17.192 -7.665 1.00 0.00 H new ATOM 368 N TYR A 26 0.320 15.851 -5.369 1.00 0.00 N ATOM 369 CA TYR A 26 0.798 14.772 -4.536 1.00 0.00 C ATOM 370 C TYR A 26 1.240 13.608 -5.395 1.00 0.00 C ATOM 371 O TYR A 26 0.460 12.694 -5.695 1.00 0.00 O ATOM 372 CB TYR A 26 -0.253 14.325 -3.492 1.00 0.00 C ATOM 373 CG TYR A 26 -1.636 14.741 -3.930 1.00 0.00 C ATOM 374 CD1 TYR A 26 -2.364 13.930 -4.794 1.00 0.00 C ATOM 375 CD2 TYR A 26 -2.181 15.946 -3.476 1.00 0.00 C ATOM 376 CE1 TYR A 26 -3.639 14.319 -5.202 1.00 0.00 C ATOM 377 CE2 TYR A 26 -3.454 16.341 -3.890 1.00 0.00 C ATOM 378 CZ TYR A 26 -4.185 15.531 -4.749 1.00 0.00 C ATOM 379 OH TYR A 26 -5.437 15.938 -5.167 1.00 0.00 O ATOM 0 H TYR A 26 0.169 15.592 -6.344 1.00 0.00 H new ATOM 0 HA TYR A 26 1.655 15.144 -3.975 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -0.214 13.243 -3.367 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -0.023 14.767 -2.522 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -1.942 13.001 -5.148 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -1.615 16.573 -2.803 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -4.208 13.687 -5.868 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -3.870 17.275 -3.543 1.00 0.00 H new ATOM 0 HH TYR A 26 -5.855 15.223 -5.691 1.00 0.00 H new ATOM 389 N LYS A 27 2.519 13.599 -5.679 1.00 0.00 N ATOM 390 CA LYS A 27 3.192 12.526 -6.372 1.00 0.00 C ATOM 391 C LYS A 27 4.601 12.473 -5.846 1.00 0.00 C ATOM 392 O LYS A 27 5.081 13.459 -5.273 1.00 0.00 O ATOM 393 CB LYS A 27 3.215 12.748 -7.895 1.00 0.00 C ATOM 394 CG LYS A 27 1.789 12.739 -8.482 1.00 0.00 C ATOM 395 CD LYS A 27 1.210 11.301 -8.484 1.00 0.00 C ATOM 396 CE LYS A 27 1.743 10.513 -9.693 1.00 0.00 C ATOM 397 NZ LYS A 27 1.698 11.363 -10.908 1.00 0.00 N ATOM 0 H LYS A 27 3.143 14.365 -5.425 1.00 0.00 H new ATOM 0 HA LYS A 27 2.660 11.591 -6.197 1.00 0.00 H new ATOM 0 HB2 LYS A 27 3.697 13.699 -8.119 1.00 0.00 H new ATOM 0 HB3 LYS A 27 3.811 11.969 -8.370 1.00 0.00 H new ATOM 0 HG2 LYS A 27 1.145 13.396 -7.897 1.00 0.00 H new ATOM 0 HG3 LYS A 27 1.806 13.132 -9.499 1.00 0.00 H new ATOM 0 HD2 LYS A 27 1.482 10.791 -7.560 1.00 0.00 H new ATOM 0 HD3 LYS A 27 0.121 11.340 -8.518 1.00 0.00 H new ATOM 0 HE2 LYS A 27 2.766 10.187 -9.504 1.00 0.00 H new ATOM 0 HE3 LYS A 27 1.145 9.614 -9.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 1.658 10.758 -11.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 0.854 11.970 -10.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 2.550 11.958 -10.947 1.00 0.00 H new ATOM 411 N LEU A 28 5.269 11.373 -6.037 1.00 0.00 N ATOM 412 CA LEU A 28 6.619 11.235 -5.549 1.00 0.00 C ATOM 413 C LEU A 28 7.552 10.909 -6.697 1.00 0.00 C ATOM 414 O LEU A 28 7.266 10.048 -7.521 1.00 0.00 O ATOM 415 CB LEU A 28 6.649 10.139 -4.467 1.00 0.00 C ATOM 416 CG LEU A 28 8.082 9.839 -4.011 1.00 0.00 C ATOM 417 CD1 LEU A 28 8.663 11.040 -3.263 1.00 0.00 C ATOM 418 CD2 LEU A 28 8.069 8.624 -3.087 1.00 0.00 C ATOM 0 H LEU A 28 4.905 10.556 -6.527 1.00 0.00 H new ATOM 0 HA LEU A 28 6.958 12.171 -5.105 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.052 10.455 -3.611 1.00 0.00 H new ATOM 0 HB3 LEU A 28 6.192 9.229 -4.856 1.00 0.00 H new ATOM 0 HG LEU A 28 8.700 9.636 -4.886 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.681 10.813 -2.945 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.674 11.908 -3.922 1.00 0.00 H new ATOM 0 HD13 LEU A 28 8.049 11.256 -2.388 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.085 8.405 -2.759 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.445 8.834 -2.218 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.668 7.764 -3.623 1.00 0.00 H new ATOM 430 N SER A 29 8.647 11.629 -6.777 1.00 0.00 N ATOM 431 CA SER A 29 9.635 11.399 -7.803 1.00 0.00 C ATOM 432 C SER A 29 10.757 10.530 -7.259 1.00 0.00 C ATOM 433 O SER A 29 10.705 10.078 -6.110 1.00 0.00 O ATOM 434 CB SER A 29 10.166 12.720 -8.376 1.00 0.00 C ATOM 435 OG SER A 29 9.743 13.825 -7.574 1.00 0.00 O ATOM 0 H SER A 29 8.877 12.388 -6.135 1.00 0.00 H new ATOM 0 HA SER A 29 9.161 10.867 -8.628 1.00 0.00 H new ATOM 0 HB2 SER A 29 11.255 12.692 -8.420 1.00 0.00 H new ATOM 0 HB3 SER A 29 9.809 12.848 -9.398 1.00 0.00 H new ATOM 0 HG SER A 29 9.499 14.576 -8.154 1.00 0.00 H new ATOM 441 N LYS A 30 11.731 10.229 -8.088 1.00 0.00 N ATOM 442 CA LYS A 30 12.802 9.323 -7.678 1.00 0.00 C ATOM 443 C LYS A 30 13.871 10.049 -6.864 1.00 0.00 C ATOM 444 O LYS A 30 14.979 9.551 -6.708 1.00 0.00 O ATOM 445 CB LYS A 30 13.428 8.632 -8.894 1.00 0.00 C ATOM 446 CG LYS A 30 12.325 8.010 -9.777 1.00 0.00 C ATOM 447 CD LYS A 30 11.501 6.979 -8.980 1.00 0.00 C ATOM 448 CE LYS A 30 12.097 5.570 -9.133 1.00 0.00 C ATOM 449 NZ LYS A 30 12.421 5.280 -10.563 1.00 0.00 N ATOM 0 H LYS A 30 11.812 10.588 -9.039 1.00 0.00 H new ATOM 0 HA LYS A 30 12.358 8.561 -7.038 1.00 0.00 H new ATOM 0 HB2 LYS A 30 14.006 9.352 -9.474 1.00 0.00 H new ATOM 0 HB3 LYS A 30 14.121 7.858 -8.565 1.00 0.00 H new ATOM 0 HG2 LYS A 30 11.668 8.795 -10.153 1.00 0.00 H new ATOM 0 HG3 LYS A 30 12.776 7.529 -10.645 1.00 0.00 H new ATOM 0 HD2 LYS A 30 11.481 7.258 -7.927 1.00 0.00 H new ATOM 0 HD3 LYS A 30 10.469 6.982 -9.330 1.00 0.00 H new ATOM 0 HE2 LYS A 30 12.999 5.485 -8.527 1.00 0.00 H new ATOM 0 HE3 LYS A 30 11.390 4.829 -8.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 11.867 4.461 -10.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 12.187 6.108 -11.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 13.435 5.069 -10.653 1.00 0.00 H new ATOM 463 N LYS A 31 13.550 11.236 -6.389 1.00 0.00 N ATOM 464 CA LYS A 31 14.499 12.022 -5.607 1.00 0.00 C ATOM 465 C LYS A 31 14.326 11.720 -4.121 1.00 0.00 C ATOM 466 O LYS A 31 15.182 11.097 -3.495 1.00 0.00 O ATOM 467 CB LYS A 31 14.299 13.523 -5.886 1.00 0.00 C ATOM 468 CG LYS A 31 13.565 13.663 -7.224 1.00 0.00 C ATOM 469 CD LYS A 31 13.366 15.121 -7.599 1.00 0.00 C ATOM 470 CE LYS A 31 12.603 15.177 -8.916 1.00 0.00 C ATOM 471 NZ LYS A 31 13.379 14.477 -9.973 1.00 0.00 N ATOM 0 H LYS A 31 12.643 11.681 -6.527 1.00 0.00 H new ATOM 0 HA LYS A 31 15.514 11.751 -5.898 1.00 0.00 H new ATOM 0 HB2 LYS A 31 13.723 13.986 -5.085 1.00 0.00 H new ATOM 0 HB3 LYS A 31 15.261 14.035 -5.924 1.00 0.00 H new ATOM 0 HG2 LYS A 31 14.133 13.159 -8.006 1.00 0.00 H new ATOM 0 HG3 LYS A 31 12.597 13.166 -7.163 1.00 0.00 H new ATOM 0 HD2 LYS A 31 12.813 15.642 -6.817 1.00 0.00 H new ATOM 0 HD3 LYS A 31 14.329 15.623 -7.696 1.00 0.00 H new ATOM 0 HE2 LYS A 31 11.624 14.711 -8.801 1.00 0.00 H new ATOM 0 HE3 LYS A 31 12.431 16.214 -9.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 13.065 14.804 -10.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 14.391 14.685 -9.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 13.225 13.451 -9.895 1.00 0.00 H new ATOM 485 N GLU A 32 13.184 12.123 -3.580 1.00 0.00 N ATOM 486 CA GLU A 32 12.859 11.887 -2.175 1.00 0.00 C ATOM 487 C GLU A 32 12.680 10.395 -1.886 1.00 0.00 C ATOM 488 O GLU A 32 12.894 9.950 -0.763 1.00 0.00 O ATOM 489 CB GLU A 32 11.566 12.636 -1.791 1.00 0.00 C ATOM 490 CG GLU A 32 11.780 14.158 -1.793 1.00 0.00 C ATOM 491 CD GLU A 32 12.691 14.574 -0.664 1.00 0.00 C ATOM 492 OE1 GLU A 32 12.411 14.208 0.457 1.00 0.00 O ATOM 493 OE2 GLU A 32 13.652 15.262 -0.931 1.00 0.00 O ATOM 0 H GLU A 32 12.459 12.620 -4.097 1.00 0.00 H new ATOM 0 HA GLU A 32 13.692 12.260 -1.579 1.00 0.00 H new ATOM 0 HB2 GLU A 32 10.772 12.377 -2.491 1.00 0.00 H new ATOM 0 HB3 GLU A 32 11.237 12.314 -0.803 1.00 0.00 H new ATOM 0 HG2 GLU A 32 12.210 14.468 -2.746 1.00 0.00 H new ATOM 0 HG3 GLU A 32 10.820 14.665 -1.697 1.00 0.00 H new ATOM 500 N LEU A 33 12.136 9.662 -2.857 1.00 0.00 N ATOM 501 CA LEU A 33 11.679 8.279 -2.627 1.00 0.00 C ATOM 502 C LEU A 33 12.775 7.398 -2.049 1.00 0.00 C ATOM 503 O LEU A 33 12.538 6.697 -1.057 1.00 0.00 O ATOM 504 CB LEU A 33 11.160 7.672 -3.953 1.00 0.00 C ATOM 505 CG LEU A 33 10.731 6.184 -3.808 1.00 0.00 C ATOM 506 CD1 LEU A 33 11.946 5.260 -3.943 1.00 0.00 C ATOM 507 CD2 LEU A 33 10.022 5.922 -2.468 1.00 0.00 C ATOM 0 H LEU A 33 11.998 9.996 -3.811 1.00 0.00 H new ATOM 0 HA LEU A 33 10.873 8.318 -1.894 1.00 0.00 H new ATOM 0 HB2 LEU A 33 10.311 8.257 -4.307 1.00 0.00 H new ATOM 0 HB3 LEU A 33 11.939 7.748 -4.712 1.00 0.00 H new ATOM 0 HG LEU A 33 10.024 5.971 -4.610 1.00 0.00 H new ATOM 0 HD11 LEU A 33 11.628 4.223 -3.839 1.00 0.00 H new ATOM 0 HD12 LEU A 33 12.404 5.402 -4.922 1.00 0.00 H new ATOM 0 HD13 LEU A 33 12.671 5.497 -3.165 1.00 0.00 H new ATOM 0 HD21 LEU A 33 9.738 4.871 -2.406 1.00 0.00 H new ATOM 0 HD22 LEU A 33 10.696 6.165 -1.646 1.00 0.00 H new ATOM 0 HD23 LEU A 33 9.129 6.543 -2.401 1.00 0.00 H new ATOM 519 N LYS A 34 13.975 7.457 -2.604 1.00 0.00 N ATOM 520 CA LYS A 34 15.051 6.620 -2.074 1.00 0.00 C ATOM 521 C LYS A 34 15.294 6.995 -0.641 1.00 0.00 C ATOM 522 O LYS A 34 15.414 6.142 0.241 1.00 0.00 O ATOM 523 CB LYS A 34 16.356 6.902 -2.809 1.00 0.00 C ATOM 524 CG LYS A 34 16.248 6.591 -4.293 1.00 0.00 C ATOM 525 CD LYS A 34 16.186 7.910 -5.084 1.00 0.00 C ATOM 526 CE LYS A 34 17.514 8.717 -5.003 1.00 0.00 C ATOM 527 NZ LYS A 34 18.412 8.208 -3.922 1.00 0.00 N ATOM 0 H LYS A 34 14.229 8.051 -3.393 1.00 0.00 H new ATOM 0 HA LYS A 34 14.758 5.576 -2.188 1.00 0.00 H new ATOM 0 HB2 LYS A 34 16.629 7.949 -2.676 1.00 0.00 H new ATOM 0 HB3 LYS A 34 17.156 6.306 -2.370 1.00 0.00 H new ATOM 0 HG2 LYS A 34 17.105 5.999 -4.616 1.00 0.00 H new ATOM 0 HG3 LYS A 34 15.357 5.994 -4.488 1.00 0.00 H new ATOM 0 HD2 LYS A 34 15.959 7.693 -6.128 1.00 0.00 H new ATOM 0 HD3 LYS A 34 15.369 8.522 -4.701 1.00 0.00 H new ATOM 0 HE2 LYS A 34 18.031 8.661 -5.961 1.00 0.00 H new ATOM 0 HE3 LYS A 34 17.289 9.768 -4.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 19.352 8.642 -4.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 18.012 8.453 -2.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 18.498 7.174 -4.000 1.00 0.00 H new ATOM 541 N GLU A 35 15.400 8.286 -0.431 1.00 0.00 N ATOM 542 CA GLU A 35 15.712 8.821 0.859 1.00 0.00 C ATOM 543 C GLU A 35 14.560 8.565 1.793 1.00 0.00 C ATOM 544 O GLU A 35 14.736 8.028 2.882 1.00 0.00 O ATOM 545 CB GLU A 35 16.000 10.320 0.748 1.00 0.00 C ATOM 546 CG GLU A 35 16.879 10.591 -0.499 1.00 0.00 C ATOM 547 CD GLU A 35 18.091 9.680 -0.511 1.00 0.00 C ATOM 548 OE1 GLU A 35 18.815 9.683 0.459 1.00 0.00 O ATOM 549 OE2 GLU A 35 18.286 8.989 -1.495 1.00 0.00 O ATOM 0 H GLU A 35 15.271 8.991 -1.157 1.00 0.00 H new ATOM 0 HA GLU A 35 16.603 8.333 1.255 1.00 0.00 H new ATOM 0 HB2 GLU A 35 15.065 10.875 0.674 1.00 0.00 H new ATOM 0 HB3 GLU A 35 16.508 10.670 1.646 1.00 0.00 H new ATOM 0 HG2 GLU A 35 16.292 10.435 -1.404 1.00 0.00 H new ATOM 0 HG3 GLU A 35 17.201 11.632 -0.503 1.00 0.00 H new ATOM 556 N LEU A 36 13.377 8.802 1.294 1.00 0.00 N ATOM 557 CA LEU A 36 12.159 8.538 2.022 1.00 0.00 C ATOM 558 C LEU A 36 12.051 7.066 2.378 1.00 0.00 C ATOM 559 O LEU A 36 11.795 6.713 3.534 1.00 0.00 O ATOM 560 CB LEU A 36 10.972 8.965 1.121 1.00 0.00 C ATOM 561 CG LEU A 36 9.710 8.141 1.398 1.00 0.00 C ATOM 562 CD1 LEU A 36 9.232 8.344 2.831 1.00 0.00 C ATOM 563 CD2 LEU A 36 8.608 8.561 0.421 1.00 0.00 C ATOM 0 H LEU A 36 13.227 9.188 0.362 1.00 0.00 H new ATOM 0 HA LEU A 36 12.151 9.099 2.956 1.00 0.00 H new ATOM 0 HB2 LEU A 36 10.757 10.021 1.283 1.00 0.00 H new ATOM 0 HB3 LEU A 36 11.254 8.854 0.074 1.00 0.00 H new ATOM 0 HG LEU A 36 9.944 7.085 1.262 1.00 0.00 H new ATOM 0 HD11 LEU A 36 8.335 7.749 3.003 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.014 8.031 3.523 1.00 0.00 H new ATOM 0 HD13 LEU A 36 9.005 9.398 2.993 1.00 0.00 H new ATOM 0 HD21 LEU A 36 7.708 7.977 0.615 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.389 9.620 0.554 1.00 0.00 H new ATOM 0 HD23 LEU A 36 8.942 8.385 -0.602 1.00 0.00 H new ATOM 575 N LEU A 37 12.254 6.201 1.400 1.00 0.00 N ATOM 576 CA LEU A 37 12.111 4.779 1.647 1.00 0.00 C ATOM 577 C LEU A 37 13.138 4.283 2.649 1.00 0.00 C ATOM 578 O LEU A 37 12.788 3.620 3.629 1.00 0.00 O ATOM 579 CB LEU A 37 12.173 3.972 0.329 1.00 0.00 C ATOM 580 CG LEU A 37 11.980 2.454 0.571 1.00 0.00 C ATOM 581 CD1 LEU A 37 13.296 1.805 1.014 1.00 0.00 C ATOM 582 CD2 LEU A 37 10.902 2.200 1.624 1.00 0.00 C ATOM 0 H LEU A 37 12.513 6.452 0.446 1.00 0.00 H new ATOM 0 HA LEU A 37 11.126 4.619 2.085 1.00 0.00 H new ATOM 0 HB2 LEU A 37 11.403 4.332 -0.353 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.134 4.143 -0.156 1.00 0.00 H new ATOM 0 HG LEU A 37 11.662 2.007 -0.371 1.00 0.00 H new ATOM 0 HD11 LEU A 37 13.139 0.739 1.179 1.00 0.00 H new ATOM 0 HD12 LEU A 37 14.050 1.945 0.239 1.00 0.00 H new ATOM 0 HD13 LEU A 37 13.637 2.269 1.940 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.786 1.127 1.775 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.194 2.669 2.564 1.00 0.00 H new ATOM 0 HD23 LEU A 37 9.956 2.623 1.286 1.00 0.00 H new ATOM 594 N GLN A 38 14.395 4.653 2.457 1.00 0.00 N ATOM 595 CA GLN A 38 15.414 4.225 3.398 1.00 0.00 C ATOM 596 C GLN A 38 15.182 4.851 4.754 1.00 0.00 C ATOM 597 O GLN A 38 15.378 4.217 5.786 1.00 0.00 O ATOM 598 CB GLN A 38 16.847 4.508 2.890 1.00 0.00 C ATOM 599 CG GLN A 38 17.149 6.014 2.874 1.00 0.00 C ATOM 600 CD GLN A 38 18.596 6.240 2.426 1.00 0.00 C ATOM 601 OE1 GLN A 38 18.910 7.298 1.747 1.00 0.00 O flip ATOM 602 NE2 GLN A 38 19.472 5.412 2.708 1.00 0.00 N flip ATOM 0 H GLN A 38 14.726 5.230 1.684 1.00 0.00 H new ATOM 0 HA GLN A 38 15.328 3.143 3.495 1.00 0.00 H new ATOM 0 HB2 GLN A 38 17.568 3.998 3.528 1.00 0.00 H new ATOM 0 HB3 GLN A 38 16.966 4.101 1.886 1.00 0.00 H new ATOM 0 HG2 GLN A 38 16.464 6.526 2.198 1.00 0.00 H new ATOM 0 HG3 GLN A 38 16.994 6.437 3.866 1.00 0.00 H new ATOM 0 HE21 GLN A 38 19.232 4.577 3.242 1.00 0.00 H new ATOM 0 HE22 GLN A 38 20.434 5.565 2.406 1.00 0.00 H new ATOM 611 N THR A 39 14.819 6.120 4.743 1.00 0.00 N ATOM 612 CA THR A 39 14.620 6.867 5.963 1.00 0.00 C ATOM 613 C THR A 39 13.473 6.305 6.802 1.00 0.00 C ATOM 614 O THR A 39 13.632 6.065 8.010 1.00 0.00 O ATOM 615 CB THR A 39 14.335 8.323 5.588 1.00 0.00 C ATOM 616 OG1 THR A 39 15.458 8.866 4.900 1.00 0.00 O ATOM 617 CG2 THR A 39 14.032 9.155 6.822 1.00 0.00 C ATOM 0 H THR A 39 14.655 6.656 3.891 1.00 0.00 H new ATOM 0 HA THR A 39 15.521 6.792 6.572 1.00 0.00 H new ATOM 0 HB THR A 39 13.460 8.348 4.939 1.00 0.00 H new ATOM 0 HG1 THR A 39 15.561 8.416 4.035 1.00 0.00 H new ATOM 0 HG21 THR A 39 13.833 10.185 6.526 1.00 0.00 H new ATOM 0 HG22 THR A 39 13.157 8.748 7.330 1.00 0.00 H new ATOM 0 HG23 THR A 39 14.888 9.130 7.497 1.00 0.00 H new ATOM 625 N GLU A 40 12.307 6.156 6.191 1.00 0.00 N ATOM 626 CA GLU A 40 11.129 5.734 6.936 1.00 0.00 C ATOM 627 C GLU A 40 11.176 4.256 7.303 1.00 0.00 C ATOM 628 O GLU A 40 10.782 3.868 8.406 1.00 0.00 O ATOM 629 CB GLU A 40 9.851 6.076 6.173 1.00 0.00 C ATOM 630 CG GLU A 40 9.774 7.604 5.970 1.00 0.00 C ATOM 631 CD GLU A 40 9.766 8.338 7.300 1.00 0.00 C ATOM 632 OE1 GLU A 40 8.977 7.989 8.147 1.00 0.00 O ATOM 633 OE2 GLU A 40 10.555 9.240 7.458 1.00 0.00 O ATOM 0 H GLU A 40 12.151 6.318 5.196 1.00 0.00 H new ATOM 0 HA GLU A 40 11.125 6.290 7.874 1.00 0.00 H new ATOM 0 HB2 GLU A 40 9.842 5.568 5.209 1.00 0.00 H new ATOM 0 HB3 GLU A 40 8.979 5.726 6.725 1.00 0.00 H new ATOM 0 HG2 GLU A 40 10.623 7.937 5.374 1.00 0.00 H new ATOM 0 HG3 GLU A 40 8.873 7.854 5.409 1.00 0.00 H new ATOM 640 N LEU A 41 11.644 3.433 6.376 1.00 0.00 N ATOM 641 CA LEU A 41 11.710 1.991 6.598 1.00 0.00 C ATOM 642 C LEU A 41 13.093 1.580 7.035 1.00 0.00 C ATOM 643 O LEU A 41 13.610 0.544 6.601 1.00 0.00 O ATOM 644 CB LEU A 41 11.320 1.227 5.330 1.00 0.00 C ATOM 645 CG LEU A 41 9.794 1.064 5.271 1.00 0.00 C ATOM 646 CD1 LEU A 41 9.125 2.418 5.033 1.00 0.00 C ATOM 647 CD2 LEU A 41 9.424 0.102 4.143 1.00 0.00 C ATOM 0 H LEU A 41 11.984 3.736 5.463 1.00 0.00 H new ATOM 0 HA LEU A 41 11.002 1.744 7.389 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.672 1.763 4.449 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.800 0.249 5.321 1.00 0.00 H new ATOM 0 HG LEU A 41 9.445 0.661 6.222 1.00 0.00 H new ATOM 0 HD11 LEU A 41 8.044 2.288 4.993 1.00 0.00 H new ATOM 0 HD12 LEU A 41 9.379 3.097 5.847 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.475 2.836 4.089 1.00 0.00 H new ATOM 0 HD21 LEU A 41 8.341 -0.012 4.103 1.00 0.00 H new ATOM 0 HD22 LEU A 41 9.782 0.500 3.193 1.00 0.00 H new ATOM 0 HD23 LEU A 41 9.885 -0.869 4.327 1.00 0.00 H new ATOM 659 N SER A 42 13.691 2.371 7.895 1.00 0.00 N ATOM 660 CA SER A 42 15.029 2.086 8.363 1.00 0.00 C ATOM 661 C SER A 42 15.113 0.653 8.899 1.00 0.00 C ATOM 662 O SER A 42 16.072 -0.070 8.614 1.00 0.00 O ATOM 663 CB SER A 42 15.421 3.088 9.456 1.00 0.00 C ATOM 664 OG SER A 42 15.483 4.412 8.901 1.00 0.00 O ATOM 0 H SER A 42 13.274 3.216 8.285 1.00 0.00 H new ATOM 0 HA SER A 42 15.724 2.182 7.529 1.00 0.00 H new ATOM 0 HB2 SER A 42 14.694 3.058 10.268 1.00 0.00 H new ATOM 0 HB3 SER A 42 16.387 2.816 9.882 1.00 0.00 H new ATOM 0 HG SER A 42 14.582 4.703 8.648 1.00 0.00 H new ATOM 670 N GLY A 43 14.093 0.235 9.637 1.00 0.00 N ATOM 671 CA GLY A 43 14.064 -1.111 10.195 1.00 0.00 C ATOM 672 C GLY A 43 13.883 -2.173 9.120 1.00 0.00 C ATOM 673 O GLY A 43 14.598 -3.176 9.097 1.00 0.00 O ATOM 0 H GLY A 43 13.278 0.805 9.863 1.00 0.00 H new ATOM 0 HA2 GLY A 43 14.991 -1.298 10.737 1.00 0.00 H new ATOM 0 HA3 GLY A 43 13.252 -1.186 10.918 1.00 0.00 H new ATOM 677 N PHE A 44 12.941 -1.943 8.213 1.00 0.00 N ATOM 678 CA PHE A 44 12.684 -2.897 7.143 1.00 0.00 C ATOM 679 C PHE A 44 13.828 -2.915 6.192 1.00 0.00 C ATOM 680 O PHE A 44 14.242 -3.968 5.705 1.00 0.00 O ATOM 681 CB PHE A 44 11.387 -2.584 6.395 1.00 0.00 C ATOM 682 CG PHE A 44 10.211 -2.948 7.255 1.00 0.00 C ATOM 683 CD1 PHE A 44 9.892 -4.289 7.465 1.00 0.00 C ATOM 684 CD2 PHE A 44 9.443 -1.950 7.845 1.00 0.00 C ATOM 685 CE1 PHE A 44 8.803 -4.633 8.268 1.00 0.00 C ATOM 686 CE2 PHE A 44 8.353 -2.293 8.647 1.00 0.00 C ATOM 687 CZ PHE A 44 8.034 -3.634 8.859 1.00 0.00 C ATOM 0 H PHE A 44 12.348 -1.113 8.197 1.00 0.00 H new ATOM 0 HA PHE A 44 12.571 -3.880 7.600 1.00 0.00 H new ATOM 0 HB2 PHE A 44 11.349 -1.525 6.139 1.00 0.00 H new ATOM 0 HB3 PHE A 44 11.352 -3.140 5.458 1.00 0.00 H new ATOM 0 HD1 PHE A 44 10.489 -5.063 7.006 1.00 0.00 H new ATOM 0 HD2 PHE A 44 9.689 -0.911 7.683 1.00 0.00 H new ATOM 0 HE1 PHE A 44 8.557 -5.672 8.430 1.00 0.00 H new ATOM 0 HE2 PHE A 44 7.756 -1.518 9.104 1.00 0.00 H new ATOM 0 HZ PHE A 44 7.191 -3.897 9.481 1.00 0.00 H new ATOM 697 N LEU A 45 14.345 -1.748 5.933 1.00 0.00 N ATOM 698 CA LEU A 45 15.434 -1.602 5.029 1.00 0.00 C ATOM 699 C LEU A 45 16.650 -2.367 5.532 1.00 0.00 C ATOM 700 O LEU A 45 17.321 -3.054 4.762 1.00 0.00 O ATOM 701 CB LEU A 45 15.756 -0.116 4.852 1.00 0.00 C ATOM 702 CG LEU A 45 16.996 0.017 3.987 1.00 0.00 C ATOM 703 CD1 LEU A 45 16.750 -0.626 2.618 1.00 0.00 C ATOM 704 CD2 LEU A 45 17.378 1.486 3.819 1.00 0.00 C ATOM 0 H LEU A 45 14.018 -0.874 6.346 1.00 0.00 H new ATOM 0 HA LEU A 45 15.156 -2.018 4.061 1.00 0.00 H new ATOM 0 HB2 LEU A 45 14.915 0.400 4.388 1.00 0.00 H new ATOM 0 HB3 LEU A 45 15.921 0.352 5.822 1.00 0.00 H new ATOM 0 HG LEU A 45 17.821 -0.499 4.479 1.00 0.00 H new ATOM 0 HD11 LEU A 45 17.645 -0.526 2.003 1.00 0.00 H new ATOM 0 HD12 LEU A 45 16.516 -1.682 2.749 1.00 0.00 H new ATOM 0 HD13 LEU A 45 15.915 -0.127 2.127 1.00 0.00 H new ATOM 0 HD21 LEU A 45 18.269 1.561 3.196 1.00 0.00 H new ATOM 0 HD22 LEU A 45 16.557 2.023 3.344 1.00 0.00 H new ATOM 0 HD23 LEU A 45 17.581 1.923 4.797 1.00 0.00 H new ATOM 716 N ASP A 46 16.929 -2.246 6.816 1.00 0.00 N ATOM 717 CA ASP A 46 18.106 -2.885 7.396 1.00 0.00 C ATOM 718 C ASP A 46 18.106 -4.377 7.125 1.00 0.00 C ATOM 719 O ASP A 46 19.081 -4.922 6.601 1.00 0.00 O ATOM 720 CB ASP A 46 18.120 -2.659 8.911 1.00 0.00 C ATOM 721 CG ASP A 46 19.287 -3.389 9.550 1.00 0.00 C ATOM 722 OD1 ASP A 46 20.403 -2.934 9.393 1.00 0.00 O ATOM 723 OD2 ASP A 46 19.054 -4.379 10.206 1.00 0.00 O ATOM 0 H ASP A 46 16.363 -1.715 7.478 1.00 0.00 H new ATOM 0 HA ASP A 46 18.991 -2.443 6.938 1.00 0.00 H new ATOM 0 HB2 ASP A 46 18.191 -1.592 9.124 1.00 0.00 H new ATOM 0 HB3 ASP A 46 17.183 -3.009 9.345 1.00 0.00 H new ATOM 728 N ALA A 47 17.004 -5.034 7.437 1.00 0.00 N ATOM 729 CA ALA A 47 16.897 -6.465 7.199 1.00 0.00 C ATOM 730 C ALA A 47 16.848 -6.760 5.711 1.00 0.00 C ATOM 731 O ALA A 47 17.405 -7.758 5.249 1.00 0.00 O ATOM 732 CB ALA A 47 15.656 -7.038 7.884 1.00 0.00 C ATOM 0 H ALA A 47 16.176 -4.606 7.852 1.00 0.00 H new ATOM 0 HA ALA A 47 17.781 -6.941 7.622 1.00 0.00 H new ATOM 0 HB1 ALA A 47 15.597 -8.109 7.692 1.00 0.00 H new ATOM 0 HB2 ALA A 47 15.721 -6.865 8.958 1.00 0.00 H new ATOM 0 HB3 ALA A 47 14.765 -6.549 7.491 1.00 0.00 H new ATOM 738 N GLN A 48 16.116 -5.924 4.984 1.00 0.00 N ATOM 739 CA GLN A 48 15.901 -6.117 3.552 1.00 0.00 C ATOM 740 C GLN A 48 17.162 -5.975 2.731 1.00 0.00 C ATOM 741 O GLN A 48 17.302 -6.619 1.701 1.00 0.00 O ATOM 742 CB GLN A 48 14.784 -5.213 3.024 1.00 0.00 C ATOM 743 CG GLN A 48 13.444 -5.714 3.561 1.00 0.00 C ATOM 744 CD GLN A 48 13.219 -7.123 3.059 1.00 0.00 C ATOM 745 OE1 GLN A 48 12.868 -7.322 1.903 1.00 0.00 O ATOM 746 NE2 GLN A 48 13.447 -8.119 3.850 1.00 0.00 N ATOM 0 H GLN A 48 15.657 -5.097 5.366 1.00 0.00 H new ATOM 0 HA GLN A 48 15.582 -7.153 3.435 1.00 0.00 H new ATOM 0 HB2 GLN A 48 14.954 -4.183 3.337 1.00 0.00 H new ATOM 0 HB3 GLN A 48 14.779 -5.218 1.934 1.00 0.00 H new ATOM 0 HG2 GLN A 48 13.443 -5.696 4.651 1.00 0.00 H new ATOM 0 HG3 GLN A 48 12.636 -5.061 3.230 1.00 0.00 H new ATOM 0 HE21 GLN A 48 13.739 -7.949 4.812 1.00 0.00 H new ATOM 0 HE22 GLN A 48 13.335 -9.075 3.512 1.00 0.00 H new ATOM 755 N LYS A 49 18.089 -5.173 3.195 1.00 0.00 N ATOM 756 CA LYS A 49 19.341 -5.000 2.463 1.00 0.00 C ATOM 757 C LYS A 49 20.058 -6.320 2.305 1.00 0.00 C ATOM 758 O LYS A 49 20.594 -6.615 1.243 1.00 0.00 O ATOM 759 CB LYS A 49 20.266 -3.984 3.146 1.00 0.00 C ATOM 760 CG LYS A 49 19.779 -2.551 2.892 1.00 0.00 C ATOM 761 CD LYS A 49 20.032 -2.176 1.416 1.00 0.00 C ATOM 762 CE LYS A 49 20.151 -0.654 1.276 1.00 0.00 C ATOM 763 NZ LYS A 49 21.468 -0.225 1.795 1.00 0.00 N ATOM 0 H LYS A 49 18.013 -4.635 4.058 1.00 0.00 H new ATOM 0 HA LYS A 49 19.083 -4.613 1.477 1.00 0.00 H new ATOM 0 HB2 LYS A 49 20.299 -4.178 4.218 1.00 0.00 H new ATOM 0 HB3 LYS A 49 21.283 -4.100 2.770 1.00 0.00 H new ATOM 0 HG2 LYS A 49 18.717 -2.470 3.122 1.00 0.00 H new ATOM 0 HG3 LYS A 49 20.301 -1.856 3.550 1.00 0.00 H new ATOM 0 HD2 LYS A 49 20.945 -2.655 1.062 1.00 0.00 H new ATOM 0 HD3 LYS A 49 19.217 -2.544 0.793 1.00 0.00 H new ATOM 0 HE2 LYS A 49 20.045 -0.362 0.231 1.00 0.00 H new ATOM 0 HE3 LYS A 49 19.350 -0.161 1.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 21.711 0.705 1.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 21.428 -0.159 2.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 22.192 -0.919 1.520 1.00 0.00 H new ATOM 777 N ASP A 50 20.037 -7.130 3.338 1.00 0.00 N ATOM 778 CA ASP A 50 20.657 -8.438 3.263 1.00 0.00 C ATOM 779 C ASP A 50 19.869 -9.359 2.341 1.00 0.00 C ATOM 780 O ASP A 50 20.306 -10.474 2.043 1.00 0.00 O ATOM 781 CB ASP A 50 20.802 -9.072 4.645 1.00 0.00 C ATOM 782 CG ASP A 50 21.869 -10.142 4.598 1.00 0.00 C ATOM 783 OD1 ASP A 50 22.995 -9.812 4.287 1.00 0.00 O ATOM 784 OD2 ASP A 50 21.563 -11.281 4.876 1.00 0.00 O ATOM 0 H ASP A 50 19.602 -6.912 4.234 1.00 0.00 H new ATOM 0 HA ASP A 50 21.656 -8.300 2.850 1.00 0.00 H new ATOM 0 HB2 ASP A 50 21.066 -8.312 5.380 1.00 0.00 H new ATOM 0 HB3 ASP A 50 19.852 -9.504 4.960 1.00 0.00 H new ATOM 789 N VAL A 51 18.697 -8.902 1.906 1.00 0.00 N ATOM 790 CA VAL A 51 17.821 -9.690 1.062 1.00 0.00 C ATOM 791 C VAL A 51 17.865 -9.160 -0.369 1.00 0.00 C ATOM 792 O VAL A 51 17.780 -7.959 -0.595 1.00 0.00 O ATOM 793 CB VAL A 51 16.379 -9.625 1.620 1.00 0.00 C ATOM 794 CG1 VAL A 51 15.422 -10.450 0.752 1.00 0.00 C ATOM 795 CG2 VAL A 51 16.356 -10.163 3.057 1.00 0.00 C ATOM 0 H VAL A 51 18.334 -7.976 2.132 1.00 0.00 H new ATOM 0 HA VAL A 51 18.153 -10.728 1.056 1.00 0.00 H new ATOM 0 HB VAL A 51 16.052 -8.585 1.609 1.00 0.00 H new ATOM 0 HG11 VAL A 51 14.414 -10.390 1.163 1.00 0.00 H new ATOM 0 HG12 VAL A 51 15.423 -10.057 -0.265 1.00 0.00 H new ATOM 0 HG13 VAL A 51 15.747 -11.490 0.740 1.00 0.00 H new ATOM 0 HG21 VAL A 51 15.339 -10.116 3.447 1.00 0.00 H new ATOM 0 HG22 VAL A 51 16.700 -11.197 3.064 1.00 0.00 H new ATOM 0 HG23 VAL A 51 17.013 -9.558 3.682 1.00 0.00 H new ATOM 805 N ASP A 52 18.040 -10.059 -1.322 1.00 0.00 N ATOM 806 CA ASP A 52 18.129 -9.678 -2.734 1.00 0.00 C ATOM 807 C ASP A 52 16.850 -8.999 -3.195 1.00 0.00 C ATOM 808 O ASP A 52 16.874 -8.104 -4.041 1.00 0.00 O ATOM 809 CB ASP A 52 18.373 -10.909 -3.599 1.00 0.00 C ATOM 810 CG ASP A 52 18.309 -10.525 -5.062 1.00 0.00 C ATOM 811 OD1 ASP A 52 19.204 -9.859 -5.526 1.00 0.00 O ATOM 812 OD2 ASP A 52 17.353 -10.895 -5.704 1.00 0.00 O ATOM 0 H ASP A 52 18.124 -11.061 -1.150 1.00 0.00 H new ATOM 0 HA ASP A 52 18.961 -8.982 -2.838 1.00 0.00 H new ATOM 0 HB2 ASP A 52 19.347 -11.340 -3.368 1.00 0.00 H new ATOM 0 HB3 ASP A 52 17.627 -11.673 -3.380 1.00 0.00 H new ATOM 817 N ALA A 53 15.732 -9.487 -2.696 1.00 0.00 N ATOM 818 CA ALA A 53 14.431 -9.009 -3.136 1.00 0.00 C ATOM 819 C ALA A 53 14.339 -7.491 -3.059 1.00 0.00 C ATOM 820 O ALA A 53 13.575 -6.876 -3.810 1.00 0.00 O ATOM 821 CB ALA A 53 13.311 -9.641 -2.310 1.00 0.00 C ATOM 0 H ALA A 53 15.696 -10.216 -1.984 1.00 0.00 H new ATOM 0 HA ALA A 53 14.313 -9.306 -4.178 1.00 0.00 H new ATOM 0 HB1 ALA A 53 12.348 -9.268 -2.658 1.00 0.00 H new ATOM 0 HB2 ALA A 53 13.343 -10.725 -2.423 1.00 0.00 H new ATOM 0 HB3 ALA A 53 13.443 -9.382 -1.260 1.00 0.00 H new ATOM 827 N VAL A 54 15.137 -6.882 -2.185 1.00 0.00 N ATOM 828 CA VAL A 54 15.110 -5.437 -2.060 1.00 0.00 C ATOM 829 C VAL A 54 15.474 -4.794 -3.393 1.00 0.00 C ATOM 830 O VAL A 54 14.795 -3.865 -3.855 1.00 0.00 O ATOM 831 CB VAL A 54 16.048 -4.944 -0.931 1.00 0.00 C ATOM 832 CG1 VAL A 54 17.515 -5.246 -1.264 1.00 0.00 C ATOM 833 CG2 VAL A 54 15.875 -3.433 -0.723 1.00 0.00 C ATOM 0 H VAL A 54 15.795 -7.358 -1.568 1.00 0.00 H new ATOM 0 HA VAL A 54 14.098 -5.137 -1.788 1.00 0.00 H new ATOM 0 HB VAL A 54 15.780 -5.473 -0.017 1.00 0.00 H new ATOM 0 HG11 VAL A 54 18.153 -4.890 -0.455 1.00 0.00 H new ATOM 0 HG12 VAL A 54 17.647 -6.321 -1.383 1.00 0.00 H new ATOM 0 HG13 VAL A 54 17.789 -4.742 -2.191 1.00 0.00 H new ATOM 0 HG21 VAL A 54 16.539 -3.097 0.073 1.00 0.00 H new ATOM 0 HG22 VAL A 54 16.121 -2.908 -1.646 1.00 0.00 H new ATOM 0 HG23 VAL A 54 14.842 -3.219 -0.448 1.00 0.00 H new ATOM 843 N ASP A 55 16.482 -5.351 -4.058 1.00 0.00 N ATOM 844 CA ASP A 55 16.875 -4.848 -5.373 1.00 0.00 C ATOM 845 C ASP A 55 15.715 -4.944 -6.325 1.00 0.00 C ATOM 846 O ASP A 55 15.407 -4.006 -7.067 1.00 0.00 O ATOM 847 CB ASP A 55 18.007 -5.691 -5.955 1.00 0.00 C ATOM 848 CG ASP A 55 18.375 -5.152 -7.327 1.00 0.00 C ATOM 849 OD1 ASP A 55 18.857 -4.042 -7.393 1.00 0.00 O ATOM 850 OD2 ASP A 55 18.164 -5.852 -8.296 1.00 0.00 O ATOM 0 H ASP A 55 17.034 -6.138 -3.717 1.00 0.00 H new ATOM 0 HA ASP A 55 17.197 -3.814 -5.249 1.00 0.00 H new ATOM 0 HB2 ASP A 55 18.874 -5.663 -5.295 1.00 0.00 H new ATOM 0 HB3 ASP A 55 17.698 -6.734 -6.031 1.00 0.00 H new ATOM 855 N LYS A 56 15.124 -6.110 -6.338 1.00 0.00 N ATOM 856 CA LYS A 56 14.054 -6.429 -7.246 1.00 0.00 C ATOM 857 C LYS A 56 12.820 -5.579 -7.008 1.00 0.00 C ATOM 858 O LYS A 56 12.224 -5.071 -7.963 1.00 0.00 O ATOM 859 CB LYS A 56 13.720 -7.909 -7.129 1.00 0.00 C ATOM 860 CG LYS A 56 14.868 -8.726 -7.737 1.00 0.00 C ATOM 861 CD LYS A 56 14.579 -10.212 -7.556 1.00 0.00 C ATOM 862 CE LYS A 56 15.584 -11.052 -8.349 1.00 0.00 C ATOM 863 NZ LYS A 56 16.974 -10.615 -8.057 1.00 0.00 N ATOM 0 H LYS A 56 15.375 -6.874 -5.711 1.00 0.00 H new ATOM 0 HA LYS A 56 14.393 -6.206 -8.258 1.00 0.00 H new ATOM 0 HB2 LYS A 56 13.576 -8.182 -6.084 1.00 0.00 H new ATOM 0 HB3 LYS A 56 12.786 -8.127 -7.647 1.00 0.00 H new ATOM 0 HG2 LYS A 56 14.976 -8.491 -8.796 1.00 0.00 H new ATOM 0 HG3 LYS A 56 15.810 -8.466 -7.255 1.00 0.00 H new ATOM 0 HD2 LYS A 56 14.631 -10.473 -6.499 1.00 0.00 H new ATOM 0 HD3 LYS A 56 13.566 -10.435 -7.890 1.00 0.00 H new ATOM 0 HE2 LYS A 56 15.467 -12.105 -8.095 1.00 0.00 H new ATOM 0 HE3 LYS A 56 15.384 -10.958 -9.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 17.645 -11.268 -8.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 17.122 -9.655 -8.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 17.129 -10.615 -7.029 1.00 0.00 H new ATOM 877 N VAL A 57 12.468 -5.377 -5.750 1.00 0.00 N ATOM 878 CA VAL A 57 11.318 -4.548 -5.425 1.00 0.00 C ATOM 879 C VAL A 57 11.619 -3.128 -5.819 1.00 0.00 C ATOM 880 O VAL A 57 10.843 -2.467 -6.515 1.00 0.00 O ATOM 881 CB VAL A 57 11.022 -4.619 -3.918 1.00 0.00 C ATOM 882 CG1 VAL A 57 9.922 -3.619 -3.557 1.00 0.00 C ATOM 883 CG2 VAL A 57 10.570 -6.032 -3.534 1.00 0.00 C ATOM 0 H VAL A 57 12.955 -5.770 -4.944 1.00 0.00 H new ATOM 0 HA VAL A 57 10.443 -4.907 -5.967 1.00 0.00 H new ATOM 0 HB VAL A 57 11.932 -4.373 -3.371 1.00 0.00 H new ATOM 0 HG11 VAL A 57 9.717 -3.674 -2.488 1.00 0.00 H new ATOM 0 HG12 VAL A 57 10.249 -2.611 -3.812 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.016 -3.859 -4.113 1.00 0.00 H new ATOM 0 HG21 VAL A 57 10.363 -6.070 -2.464 1.00 0.00 H new ATOM 0 HG22 VAL A 57 9.667 -6.288 -4.087 1.00 0.00 H new ATOM 0 HG23 VAL A 57 11.358 -6.745 -3.777 1.00 0.00 H new ATOM 893 N MET A 58 12.788 -2.694 -5.423 1.00 0.00 N ATOM 894 CA MET A 58 13.253 -1.377 -5.731 1.00 0.00 C ATOM 895 C MET A 58 13.374 -1.194 -7.236 1.00 0.00 C ATOM 896 O MET A 58 13.058 -0.130 -7.762 1.00 0.00 O ATOM 897 CB MET A 58 14.595 -1.124 -5.018 1.00 0.00 C ATOM 898 CG MET A 58 15.126 0.248 -5.395 1.00 0.00 C ATOM 899 SD MET A 58 16.589 0.638 -4.395 1.00 0.00 S ATOM 900 CE MET A 58 17.736 -0.546 -5.139 1.00 0.00 C ATOM 0 H MET A 58 13.443 -3.252 -4.875 1.00 0.00 H new ATOM 0 HA MET A 58 12.532 -0.643 -5.372 1.00 0.00 H new ATOM 0 HB2 MET A 58 14.462 -1.188 -3.938 1.00 0.00 H new ATOM 0 HB3 MET A 58 15.316 -1.892 -5.297 1.00 0.00 H new ATOM 0 HG2 MET A 58 15.382 0.270 -6.454 1.00 0.00 H new ATOM 0 HG3 MET A 58 14.355 1.002 -5.237 1.00 0.00 H new ATOM 0 HE1 MET A 58 18.761 -0.241 -4.929 1.00 0.00 H new ATOM 0 HE2 MET A 58 17.559 -1.536 -4.720 1.00 0.00 H new ATOM 0 HE3 MET A 58 17.580 -0.575 -6.217 1.00 0.00 H new ATOM 910 N LYS A 59 13.836 -2.228 -7.918 1.00 0.00 N ATOM 911 CA LYS A 59 14.025 -2.170 -9.355 1.00 0.00 C ATOM 912 C LYS A 59 12.708 -1.956 -10.075 1.00 0.00 C ATOM 913 O LYS A 59 12.582 -1.035 -10.878 1.00 0.00 O ATOM 914 CB LYS A 59 14.707 -3.458 -9.848 1.00 0.00 C ATOM 915 CG LYS A 59 15.005 -3.355 -11.350 1.00 0.00 C ATOM 916 CD LYS A 59 16.502 -3.619 -11.604 1.00 0.00 C ATOM 917 CE LYS A 59 16.880 -5.042 -11.154 1.00 0.00 C ATOM 918 NZ LYS A 59 18.255 -5.042 -10.585 1.00 0.00 N ATOM 0 H LYS A 59 14.088 -3.122 -7.496 1.00 0.00 H new ATOM 0 HA LYS A 59 14.668 -1.319 -9.581 1.00 0.00 H new ATOM 0 HB2 LYS A 59 15.632 -3.623 -9.296 1.00 0.00 H new ATOM 0 HB3 LYS A 59 14.063 -4.316 -9.655 1.00 0.00 H new ATOM 0 HG2 LYS A 59 14.401 -4.076 -11.900 1.00 0.00 H new ATOM 0 HG3 LYS A 59 14.733 -2.365 -11.717 1.00 0.00 H new ATOM 0 HD2 LYS A 59 16.725 -3.495 -12.664 1.00 0.00 H new ATOM 0 HD3 LYS A 59 17.104 -2.888 -11.064 1.00 0.00 H new ATOM 0 HE2 LYS A 59 16.168 -5.399 -10.409 1.00 0.00 H new ATOM 0 HE3 LYS A 59 16.827 -5.727 -12.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 18.901 -5.529 -11.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 18.574 -4.062 -10.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 18.252 -5.535 -9.669 1.00 0.00 H new ATOM 932 N GLU A 60 11.706 -2.747 -9.740 1.00 0.00 N ATOM 933 CA GLU A 60 10.410 -2.597 -10.380 1.00 0.00 C ATOM 934 C GLU A 60 9.796 -1.260 -10.043 1.00 0.00 C ATOM 935 O GLU A 60 9.350 -0.524 -10.930 1.00 0.00 O ATOM 936 CB GLU A 60 9.483 -3.729 -9.967 1.00 0.00 C ATOM 937 CG GLU A 60 9.954 -5.034 -10.609 1.00 0.00 C ATOM 938 CD GLU A 60 9.062 -6.191 -10.210 1.00 0.00 C ATOM 939 OE1 GLU A 60 8.194 -6.015 -9.375 1.00 0.00 O ATOM 940 OE2 GLU A 60 9.232 -7.245 -10.773 1.00 0.00 O ATOM 0 H GLU A 60 11.760 -3.488 -9.041 1.00 0.00 H new ATOM 0 HA GLU A 60 10.554 -2.641 -11.460 1.00 0.00 H new ATOM 0 HB2 GLU A 60 9.474 -3.828 -8.882 1.00 0.00 H new ATOM 0 HB3 GLU A 60 8.461 -3.508 -10.276 1.00 0.00 H new ATOM 0 HG2 GLU A 60 9.955 -4.929 -11.694 1.00 0.00 H new ATOM 0 HG3 GLU A 60 10.981 -5.241 -10.307 1.00 0.00 H new ATOM 947 N LEU A 61 9.890 -0.884 -8.790 1.00 0.00 N ATOM 948 CA LEU A 61 9.440 0.424 -8.383 1.00 0.00 C ATOM 949 C LEU A 61 10.261 1.490 -9.078 1.00 0.00 C ATOM 950 O LEU A 61 9.723 2.498 -9.559 1.00 0.00 O ATOM 951 CB LEU A 61 9.480 0.579 -6.858 1.00 0.00 C ATOM 952 CG LEU A 61 8.189 0.006 -6.227 1.00 0.00 C ATOM 953 CD1 LEU A 61 7.056 1.021 -6.364 1.00 0.00 C ATOM 954 CD2 LEU A 61 7.777 -1.310 -6.910 1.00 0.00 C ATOM 0 H LEU A 61 10.271 -1.461 -8.040 1.00 0.00 H new ATOM 0 HA LEU A 61 8.399 0.545 -8.683 1.00 0.00 H new ATOM 0 HB2 LEU A 61 10.351 0.061 -6.456 1.00 0.00 H new ATOM 0 HB3 LEU A 61 9.585 1.632 -6.595 1.00 0.00 H new ATOM 0 HG LEU A 61 8.385 -0.195 -5.174 1.00 0.00 H new ATOM 0 HD11 LEU A 61 6.148 0.615 -5.919 1.00 0.00 H new ATOM 0 HD12 LEU A 61 7.330 1.943 -5.852 1.00 0.00 H new ATOM 0 HD13 LEU A 61 6.880 1.230 -7.419 1.00 0.00 H new ATOM 0 HD21 LEU A 61 6.867 -1.691 -6.447 1.00 0.00 H new ATOM 0 HD22 LEU A 61 7.597 -1.129 -7.970 1.00 0.00 H new ATOM 0 HD23 LEU A 61 8.575 -2.044 -6.798 1.00 0.00 H new ATOM 966 N ASP A 62 11.560 1.245 -9.198 1.00 0.00 N ATOM 967 CA ASP A 62 12.420 2.166 -9.911 1.00 0.00 C ATOM 968 C ASP A 62 11.974 2.291 -11.354 1.00 0.00 C ATOM 969 O ASP A 62 11.811 3.404 -11.858 1.00 0.00 O ATOM 970 CB ASP A 62 13.886 1.727 -9.848 1.00 0.00 C ATOM 971 CG ASP A 62 14.796 2.796 -10.438 1.00 0.00 C ATOM 972 OD1 ASP A 62 14.450 3.963 -10.377 1.00 0.00 O ATOM 973 OD2 ASP A 62 15.829 2.437 -10.948 1.00 0.00 O ATOM 0 H ASP A 62 12.031 0.426 -8.814 1.00 0.00 H new ATOM 0 HA ASP A 62 12.340 3.139 -9.426 1.00 0.00 H new ATOM 0 HB2 ASP A 62 14.168 1.533 -8.813 1.00 0.00 H new ATOM 0 HB3 ASP A 62 14.014 0.792 -10.394 1.00 0.00 H new ATOM 978 N GLU A 63 11.683 1.159 -11.989 1.00 0.00 N ATOM 979 CA GLU A 63 11.205 1.172 -13.366 1.00 0.00 C ATOM 980 C GLU A 63 9.865 1.871 -13.430 1.00 0.00 C ATOM 981 O GLU A 63 9.612 2.680 -14.321 1.00 0.00 O ATOM 982 CB GLU A 63 11.040 -0.260 -13.884 1.00 0.00 C ATOM 983 CG GLU A 63 12.424 -0.924 -13.997 1.00 0.00 C ATOM 984 CD GLU A 63 12.312 -2.375 -14.445 1.00 0.00 C ATOM 985 OE1 GLU A 63 11.231 -2.789 -14.813 1.00 0.00 O ATOM 986 OE2 GLU A 63 13.315 -3.055 -14.418 1.00 0.00 O ATOM 0 H GLU A 63 11.769 0.230 -11.576 1.00 0.00 H new ATOM 0 HA GLU A 63 11.933 1.699 -13.983 1.00 0.00 H new ATOM 0 HB2 GLU A 63 10.404 -0.832 -13.209 1.00 0.00 H new ATOM 0 HB3 GLU A 63 10.547 -0.253 -14.856 1.00 0.00 H new ATOM 0 HG2 GLU A 63 13.038 -0.369 -14.707 1.00 0.00 H new ATOM 0 HG3 GLU A 63 12.931 -0.878 -13.033 1.00 0.00 H new ATOM 993 N ASN A 64 9.012 1.560 -12.482 1.00 0.00 N ATOM 994 CA ASN A 64 7.699 2.173 -12.426 1.00 0.00 C ATOM 995 C ASN A 64 7.857 3.655 -12.205 1.00 0.00 C ATOM 996 O ASN A 64 7.213 4.468 -12.861 1.00 0.00 O ATOM 997 CB ASN A 64 6.909 1.591 -11.274 1.00 0.00 C ATOM 998 CG ASN A 64 5.417 1.649 -11.569 1.00 0.00 C ATOM 999 OD1 ASN A 64 4.977 2.412 -12.444 1.00 0.00 O ATOM 1000 ND2 ASN A 64 4.617 0.880 -10.917 1.00 0.00 N ATOM 0 H ASN A 64 9.200 0.887 -11.739 1.00 0.00 H new ATOM 0 HA ASN A 64 7.173 1.983 -13.362 1.00 0.00 H new ATOM 0 HB2 ASN A 64 7.212 0.558 -11.102 1.00 0.00 H new ATOM 0 HB3 ASN A 64 7.127 2.143 -10.360 1.00 0.00 H new ATOM 0 HD21 ASN A 64 3.617 0.896 -11.118 1.00 0.00 H new ATOM 0 HD22 ASN A 64 4.983 0.255 -10.199 1.00 0.00 H new ATOM 1007 N GLY A 65 8.778 4.004 -11.327 1.00 0.00 N ATOM 1008 CA GLY A 65 9.096 5.394 -11.059 1.00 0.00 C ATOM 1009 C GLY A 65 9.840 5.992 -12.232 1.00 0.00 C ATOM 1010 O GLY A 65 10.820 6.719 -12.047 1.00 0.00 O ATOM 0 H GLY A 65 9.324 3.337 -10.782 1.00 0.00 H new ATOM 0 HA2 GLY A 65 8.180 5.956 -10.875 1.00 0.00 H new ATOM 0 HA3 GLY A 65 9.703 5.469 -10.157 1.00 0.00 H new ATOM 1014 N ASP A 66 9.397 5.658 -13.435 1.00 0.00 N ATOM 1015 CA ASP A 66 10.028 6.155 -14.646 1.00 0.00 C ATOM 1016 C ASP A 66 9.913 7.651 -14.695 1.00 0.00 C ATOM 1017 O ASP A 66 10.863 8.353 -15.041 1.00 0.00 O ATOM 1018 CB ASP A 66 9.366 5.556 -15.886 1.00 0.00 C ATOM 1019 CG ASP A 66 10.036 6.091 -17.132 1.00 0.00 C ATOM 1020 OD1 ASP A 66 11.200 5.812 -17.318 1.00 0.00 O ATOM 1021 OD2 ASP A 66 9.380 6.782 -17.886 1.00 0.00 O ATOM 0 H ASP A 66 8.600 5.043 -13.597 1.00 0.00 H new ATOM 0 HA ASP A 66 11.078 5.863 -14.634 1.00 0.00 H new ATOM 0 HB2 ASP A 66 9.440 4.469 -15.860 1.00 0.00 H new ATOM 0 HB3 ASP A 66 8.304 5.803 -15.898 1.00 0.00 H new ATOM 1026 N GLY A 67 8.766 8.132 -14.285 1.00 0.00 N ATOM 1027 CA GLY A 67 8.514 9.561 -14.204 1.00 0.00 C ATOM 1028 C GLY A 67 8.279 9.945 -12.765 1.00 0.00 C ATOM 1029 O GLY A 67 9.082 10.649 -12.153 1.00 0.00 O ATOM 0 H GLY A 67 7.978 7.551 -13.997 1.00 0.00 H new ATOM 0 HA2 GLY A 67 9.362 10.115 -14.606 1.00 0.00 H new ATOM 0 HA3 GLY A 67 7.646 9.824 -14.809 1.00 0.00 H new ATOM 1033 N GLU A 68 7.230 9.390 -12.201 1.00 0.00 N ATOM 1034 CA GLU A 68 6.894 9.595 -10.812 1.00 0.00 C ATOM 1035 C GLU A 68 6.522 8.273 -10.183 1.00 0.00 C ATOM 1036 O GLU A 68 5.993 7.383 -10.859 1.00 0.00 O ATOM 1037 CB GLU A 68 5.707 10.561 -10.702 1.00 0.00 C ATOM 1038 CG GLU A 68 6.139 11.968 -11.147 1.00 0.00 C ATOM 1039 CD GLU A 68 4.943 12.918 -11.177 1.00 0.00 C ATOM 1040 OE1 GLU A 68 3.842 12.474 -10.933 1.00 0.00 O ATOM 1041 OE2 GLU A 68 5.148 14.079 -11.458 1.00 0.00 O ATOM 0 H GLU A 68 6.582 8.779 -12.698 1.00 0.00 H new ATOM 0 HA GLU A 68 7.754 10.019 -10.294 1.00 0.00 H new ATOM 0 HB2 GLU A 68 4.882 10.210 -11.322 1.00 0.00 H new ATOM 0 HB3 GLU A 68 5.343 10.590 -9.675 1.00 0.00 H new ATOM 0 HG2 GLU A 68 6.898 12.353 -10.466 1.00 0.00 H new ATOM 0 HG3 GLU A 68 6.594 11.918 -12.136 1.00 0.00 H new ATOM 1048 N VAL A 69 6.637 8.210 -8.882 1.00 0.00 N ATOM 1049 CA VAL A 69 6.134 7.095 -8.132 1.00 0.00 C ATOM 1050 C VAL A 69 4.986 7.623 -7.284 1.00 0.00 C ATOM 1051 O VAL A 69 5.103 8.671 -6.645 1.00 0.00 O ATOM 1052 CB VAL A 69 7.275 6.468 -7.266 1.00 0.00 C ATOM 1053 CG1 VAL A 69 8.116 7.556 -6.594 1.00 0.00 C ATOM 1054 CG2 VAL A 69 6.708 5.538 -6.189 1.00 0.00 C ATOM 0 H VAL A 69 7.082 8.931 -8.315 1.00 0.00 H new ATOM 0 HA VAL A 69 5.774 6.297 -8.781 1.00 0.00 H new ATOM 0 HB VAL A 69 7.906 5.889 -7.941 1.00 0.00 H new ATOM 0 HG11 VAL A 69 8.902 7.092 -5.998 1.00 0.00 H new ATOM 0 HG12 VAL A 69 8.566 8.191 -7.357 1.00 0.00 H new ATOM 0 HG13 VAL A 69 7.480 8.161 -5.948 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.526 5.118 -5.604 1.00 0.00 H new ATOM 0 HG22 VAL A 69 6.045 6.102 -5.533 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.149 4.731 -6.663 1.00 0.00 H new ATOM 1064 N ASP A 70 3.837 7.010 -7.432 1.00 0.00 N ATOM 1065 CA ASP A 70 2.635 7.505 -6.794 1.00 0.00 C ATOM 1066 C ASP A 70 2.437 6.847 -5.453 1.00 0.00 C ATOM 1067 O ASP A 70 3.223 5.983 -5.045 1.00 0.00 O ATOM 1068 CB ASP A 70 1.417 7.289 -7.714 1.00 0.00 C ATOM 1069 CG ASP A 70 0.115 7.601 -7.006 1.00 0.00 C ATOM 1070 OD1 ASP A 70 0.000 8.682 -6.471 1.00 0.00 O ATOM 1071 OD2 ASP A 70 -0.749 6.750 -6.999 1.00 0.00 O ATOM 0 H ASP A 70 3.706 6.166 -7.989 1.00 0.00 H new ATOM 0 HA ASP A 70 2.742 8.576 -6.622 1.00 0.00 H new ATOM 0 HB2 ASP A 70 1.511 7.922 -8.597 1.00 0.00 H new ATOM 0 HB3 ASP A 70 1.403 6.256 -8.062 1.00 0.00 H new ATOM 1076 N PHE A 71 1.385 7.229 -4.779 1.00 0.00 N ATOM 1077 CA PHE A 71 1.085 6.687 -3.483 1.00 0.00 C ATOM 1078 C PHE A 71 0.936 5.181 -3.589 1.00 0.00 C ATOM 1079 O PHE A 71 1.461 4.429 -2.762 1.00 0.00 O ATOM 1080 CB PHE A 71 -0.197 7.306 -2.928 1.00 0.00 C ATOM 1081 CG PHE A 71 -0.394 6.834 -1.514 1.00 0.00 C ATOM 1082 CD1 PHE A 71 0.507 7.235 -0.533 1.00 0.00 C ATOM 1083 CD2 PHE A 71 -1.475 6.007 -1.178 1.00 0.00 C ATOM 1084 CE1 PHE A 71 0.339 6.817 0.781 1.00 0.00 C ATOM 1085 CE2 PHE A 71 -1.641 5.590 0.139 1.00 0.00 C ATOM 1086 CZ PHE A 71 -0.735 5.996 1.121 1.00 0.00 C ATOM 0 H PHE A 71 0.715 7.922 -5.112 1.00 0.00 H new ATOM 0 HA PHE A 71 1.902 6.923 -2.800 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -0.133 8.394 -2.957 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -1.050 7.020 -3.543 1.00 0.00 H new ATOM 0 HD1 PHE A 71 1.339 7.873 -0.794 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.176 5.695 -1.938 1.00 0.00 H new ATOM 0 HE1 PHE A 71 1.041 7.128 1.540 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -2.471 4.952 0.402 1.00 0.00 H new ATOM 0 HZ PHE A 71 -0.866 5.674 2.143 1.00 0.00 H new ATOM 1096 N GLN A 72 0.241 4.743 -4.620 1.00 0.00 N ATOM 1097 CA GLN A 72 0.049 3.324 -4.832 1.00 0.00 C ATOM 1098 C GLN A 72 1.394 2.608 -4.988 1.00 0.00 C ATOM 1099 O GLN A 72 1.637 1.590 -4.329 1.00 0.00 O ATOM 1100 CB GLN A 72 -0.840 3.087 -6.049 1.00 0.00 C ATOM 1101 CG GLN A 72 -2.277 3.496 -5.710 1.00 0.00 C ATOM 1102 CD GLN A 72 -3.168 3.314 -6.927 1.00 0.00 C ATOM 1103 OE1 GLN A 72 -3.807 4.263 -7.377 1.00 0.00 O ATOM 1104 NE2 GLN A 72 -3.245 2.153 -7.494 1.00 0.00 N ATOM 0 H GLN A 72 -0.197 5.344 -5.318 1.00 0.00 H new ATOM 0 HA GLN A 72 -0.449 2.908 -3.956 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -0.476 3.665 -6.899 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -0.807 2.037 -6.340 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -2.650 2.893 -4.882 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -2.301 4.536 -5.383 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -2.714 1.366 -7.120 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -3.836 2.025 -8.315 1.00 0.00 H new ATOM 1113 N GLU A 73 2.303 3.194 -5.757 1.00 0.00 N ATOM 1114 CA GLU A 73 3.647 2.640 -5.877 1.00 0.00 C ATOM 1115 C GLU A 73 4.375 2.746 -4.540 1.00 0.00 C ATOM 1116 O GLU A 73 5.126 1.850 -4.147 1.00 0.00 O ATOM 1117 CB GLU A 73 4.454 3.370 -6.960 1.00 0.00 C ATOM 1118 CG GLU A 73 3.857 3.097 -8.342 1.00 0.00 C ATOM 1119 CD GLU A 73 2.819 4.136 -8.661 1.00 0.00 C ATOM 1120 OE1 GLU A 73 3.183 5.152 -9.217 1.00 0.00 O ATOM 1121 OE2 GLU A 73 1.676 3.911 -8.349 1.00 0.00 O ATOM 0 H GLU A 73 2.139 4.041 -6.301 1.00 0.00 H new ATOM 0 HA GLU A 73 3.555 1.592 -6.164 1.00 0.00 H new ATOM 0 HB2 GLU A 73 4.455 4.442 -6.762 1.00 0.00 H new ATOM 0 HB3 GLU A 73 5.493 3.040 -6.933 1.00 0.00 H new ATOM 0 HG2 GLU A 73 4.643 3.111 -9.097 1.00 0.00 H new ATOM 0 HG3 GLU A 73 3.410 2.103 -8.365 1.00 0.00 H new ATOM 1128 N TYR A 74 4.162 3.857 -3.856 1.00 0.00 N ATOM 1129 CA TYR A 74 4.806 4.104 -2.575 1.00 0.00 C ATOM 1130 C TYR A 74 4.422 3.047 -1.549 1.00 0.00 C ATOM 1131 O TYR A 74 5.298 2.464 -0.899 1.00 0.00 O ATOM 1132 CB TYR A 74 4.463 5.524 -2.079 1.00 0.00 C ATOM 1133 CG TYR A 74 4.983 5.765 -0.670 1.00 0.00 C ATOM 1134 CD1 TYR A 74 6.359 5.697 -0.390 1.00 0.00 C ATOM 1135 CD2 TYR A 74 4.082 6.071 0.358 1.00 0.00 C ATOM 1136 CE1 TYR A 74 6.820 5.934 0.909 1.00 0.00 C ATOM 1137 CE2 TYR A 74 4.549 6.309 1.658 1.00 0.00 C ATOM 1138 CZ TYR A 74 5.915 6.240 1.933 1.00 0.00 C ATOM 1139 OH TYR A 74 6.373 6.470 3.211 1.00 0.00 O ATOM 0 H TYR A 74 3.545 4.607 -4.168 1.00 0.00 H new ATOM 0 HA TYR A 74 5.886 4.038 -2.710 1.00 0.00 H new ATOM 0 HB2 TYR A 74 4.893 6.261 -2.757 1.00 0.00 H new ATOM 0 HB3 TYR A 74 3.382 5.666 -2.098 1.00 0.00 H new ATOM 0 HD1 TYR A 74 7.060 5.462 -1.178 1.00 0.00 H new ATOM 0 HD2 TYR A 74 3.024 6.124 0.148 1.00 0.00 H new ATOM 0 HE1 TYR A 74 7.877 5.881 1.123 1.00 0.00 H new ATOM 0 HE2 TYR A 74 3.851 6.546 2.447 1.00 0.00 H new ATOM 0 HH TYR A 74 7.189 5.950 3.365 1.00 0.00 H new ATOM 1149 N VAL A 75 3.131 2.760 -1.430 1.00 0.00 N ATOM 1150 CA VAL A 75 2.698 1.755 -0.471 1.00 0.00 C ATOM 1151 C VAL A 75 3.224 0.363 -0.821 1.00 0.00 C ATOM 1152 O VAL A 75 3.649 -0.387 0.061 1.00 0.00 O ATOM 1153 CB VAL A 75 1.167 1.753 -0.276 1.00 0.00 C ATOM 1154 CG1 VAL A 75 0.682 3.166 0.078 1.00 0.00 C ATOM 1155 CG2 VAL A 75 0.457 1.263 -1.541 1.00 0.00 C ATOM 0 H VAL A 75 2.384 3.196 -1.971 1.00 0.00 H new ATOM 0 HA VAL A 75 3.138 2.033 0.487 1.00 0.00 H new ATOM 0 HB VAL A 75 0.927 1.072 0.541 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.399 3.156 0.214 1.00 0.00 H new ATOM 0 HG12 VAL A 75 1.161 3.495 1.000 1.00 0.00 H new ATOM 0 HG13 VAL A 75 0.940 3.852 -0.729 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -0.621 1.270 -1.379 1.00 0.00 H new ATOM 0 HG22 VAL A 75 0.703 1.921 -2.374 1.00 0.00 H new ATOM 0 HG23 VAL A 75 0.782 0.248 -1.771 1.00 0.00 H new ATOM 1165 N VAL A 76 3.192 0.005 -2.106 1.00 0.00 N ATOM 1166 CA VAL A 76 3.664 -1.308 -2.506 1.00 0.00 C ATOM 1167 C VAL A 76 5.164 -1.452 -2.255 1.00 0.00 C ATOM 1168 O VAL A 76 5.617 -2.487 -1.761 1.00 0.00 O ATOM 1169 CB VAL A 76 3.282 -1.647 -3.967 1.00 0.00 C ATOM 1170 CG1 VAL A 76 3.965 -0.691 -4.938 1.00 0.00 C ATOM 1171 CG2 VAL A 76 3.680 -3.090 -4.298 1.00 0.00 C ATOM 0 H VAL A 76 2.852 0.594 -2.866 1.00 0.00 H new ATOM 0 HA VAL A 76 3.155 -2.042 -1.881 1.00 0.00 H new ATOM 0 HB VAL A 76 2.202 -1.540 -4.070 1.00 0.00 H new ATOM 0 HG11 VAL A 76 3.683 -0.947 -5.959 1.00 0.00 H new ATOM 0 HG12 VAL A 76 3.655 0.331 -4.721 1.00 0.00 H new ATOM 0 HG13 VAL A 76 5.046 -0.773 -4.829 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.406 -3.316 -5.329 1.00 0.00 H new ATOM 0 HG22 VAL A 76 4.757 -3.208 -4.175 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.161 -3.774 -3.626 1.00 0.00 H new ATOM 1181 N LEU A 77 5.922 -0.392 -2.535 1.00 0.00 N ATOM 1182 CA LEU A 77 7.374 -0.433 -2.316 1.00 0.00 C ATOM 1183 C LEU A 77 7.678 -0.675 -0.858 1.00 0.00 C ATOM 1184 O LEU A 77 8.445 -1.578 -0.517 1.00 0.00 O ATOM 1185 CB LEU A 77 8.018 0.898 -2.752 1.00 0.00 C ATOM 1186 CG LEU A 77 9.533 0.912 -2.427 1.00 0.00 C ATOM 1187 CD1 LEU A 77 10.251 -0.267 -3.087 1.00 0.00 C ATOM 1188 CD2 LEU A 77 10.155 2.222 -2.927 1.00 0.00 C ATOM 0 H LEU A 77 5.568 0.490 -2.906 1.00 0.00 H new ATOM 0 HA LEU A 77 7.786 -1.248 -2.912 1.00 0.00 H new ATOM 0 HB2 LEU A 77 7.870 1.045 -3.822 1.00 0.00 H new ATOM 0 HB3 LEU A 77 7.526 1.728 -2.245 1.00 0.00 H new ATOM 0 HG LEU A 77 9.648 0.829 -1.346 1.00 0.00 H new ATOM 0 HD11 LEU A 77 11.312 -0.231 -2.841 1.00 0.00 H new ATOM 0 HD12 LEU A 77 9.826 -1.202 -2.722 1.00 0.00 H new ATOM 0 HD13 LEU A 77 10.127 -0.209 -4.168 1.00 0.00 H new ATOM 0 HD21 LEU A 77 11.221 2.230 -2.697 1.00 0.00 H new ATOM 0 HD22 LEU A 77 10.015 2.303 -4.005 1.00 0.00 H new ATOM 0 HD23 LEU A 77 9.672 3.066 -2.434 1.00 0.00 H new ATOM 1200 N VAL A 78 7.035 0.083 0.012 1.00 0.00 N ATOM 1201 CA VAL A 78 7.239 -0.107 1.427 1.00 0.00 C ATOM 1202 C VAL A 78 6.636 -1.432 1.890 1.00 0.00 C ATOM 1203 O VAL A 78 7.271 -2.194 2.631 1.00 0.00 O ATOM 1204 CB VAL A 78 6.719 1.098 2.238 1.00 0.00 C ATOM 1205 CG1 VAL A 78 7.345 2.386 1.690 1.00 0.00 C ATOM 1206 CG2 VAL A 78 5.200 1.207 2.129 1.00 0.00 C ATOM 0 H VAL A 78 6.378 0.823 -0.236 1.00 0.00 H new ATOM 0 HA VAL A 78 8.311 -0.163 1.614 1.00 0.00 H new ATOM 0 HB VAL A 78 6.992 0.955 3.283 1.00 0.00 H new ATOM 0 HG11 VAL A 78 6.980 3.240 2.261 1.00 0.00 H new ATOM 0 HG12 VAL A 78 8.430 2.329 1.777 1.00 0.00 H new ATOM 0 HG13 VAL A 78 7.071 2.506 0.642 1.00 0.00 H new ATOM 0 HG21 VAL A 78 4.854 2.063 2.708 1.00 0.00 H new ATOM 0 HG22 VAL A 78 4.919 1.338 1.084 1.00 0.00 H new ATOM 0 HG23 VAL A 78 4.741 0.297 2.517 1.00 0.00 H new ATOM 1216 N ALA A 79 5.437 -1.736 1.401 1.00 0.00 N ATOM 1217 CA ALA A 79 4.766 -2.980 1.763 1.00 0.00 C ATOM 1218 C ALA A 79 5.548 -4.184 1.301 1.00 0.00 C ATOM 1219 O ALA A 79 5.669 -5.166 2.032 1.00 0.00 O ATOM 1220 CB ALA A 79 3.360 -3.035 1.171 1.00 0.00 C ATOM 0 H ALA A 79 4.913 -1.143 0.758 1.00 0.00 H new ATOM 0 HA ALA A 79 4.700 -3.001 2.851 1.00 0.00 H new ATOM 0 HB1 ALA A 79 2.882 -3.972 1.456 1.00 0.00 H new ATOM 0 HB2 ALA A 79 2.773 -2.198 1.550 1.00 0.00 H new ATOM 0 HB3 ALA A 79 3.420 -2.974 0.084 1.00 0.00 H new ATOM 1226 N ALA A 80 6.068 -4.119 0.083 1.00 0.00 N ATOM 1227 CA ALA A 80 6.818 -5.232 -0.482 1.00 0.00 C ATOM 1228 C ALA A 80 7.973 -5.585 0.424 1.00 0.00 C ATOM 1229 O ALA A 80 8.125 -6.730 0.853 1.00 0.00 O ATOM 1230 CB ALA A 80 7.337 -4.864 -1.869 1.00 0.00 C ATOM 0 H ALA A 80 5.985 -3.309 -0.532 1.00 0.00 H new ATOM 0 HA ALA A 80 6.158 -6.095 -0.571 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.896 -5.703 -2.283 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.496 -4.631 -2.522 1.00 0.00 H new ATOM 0 HB3 ALA A 80 7.990 -3.994 -1.794 1.00 0.00 H new ATOM 1236 N LEU A 81 8.717 -4.568 0.804 1.00 0.00 N ATOM 1237 CA LEU A 81 9.808 -4.736 1.737 1.00 0.00 C ATOM 1238 C LEU A 81 9.258 -5.210 3.076 1.00 0.00 C ATOM 1239 O LEU A 81 9.838 -6.097 3.724 1.00 0.00 O ATOM 1240 CB LEU A 81 10.542 -3.408 1.913 1.00 0.00 C ATOM 1241 CG LEU A 81 11.268 -3.046 0.606 1.00 0.00 C ATOM 1242 CD1 LEU A 81 11.793 -1.613 0.693 1.00 0.00 C ATOM 1243 CD2 LEU A 81 12.449 -4.000 0.375 1.00 0.00 C ATOM 0 H LEU A 81 8.584 -3.611 0.478 1.00 0.00 H new ATOM 0 HA LEU A 81 10.508 -5.478 1.353 1.00 0.00 H new ATOM 0 HB2 LEU A 81 9.835 -2.622 2.179 1.00 0.00 H new ATOM 0 HB3 LEU A 81 11.259 -3.482 2.731 1.00 0.00 H new ATOM 0 HG LEU A 81 10.566 -3.135 -0.223 1.00 0.00 H new ATOM 0 HD11 LEU A 81 12.307 -1.357 -0.233 1.00 0.00 H new ATOM 0 HD12 LEU A 81 10.959 -0.928 0.846 1.00 0.00 H new ATOM 0 HD13 LEU A 81 12.488 -1.530 1.529 1.00 0.00 H new ATOM 0 HD21 LEU A 81 12.955 -3.734 -0.553 1.00 0.00 H new ATOM 0 HD22 LEU A 81 13.149 -3.920 1.206 1.00 0.00 H new ATOM 0 HD23 LEU A 81 12.082 -5.024 0.307 1.00 0.00 H new ATOM 1255 N THR A 82 8.135 -4.631 3.478 1.00 0.00 N ATOM 1256 CA THR A 82 7.512 -5.000 4.733 1.00 0.00 C ATOM 1257 C THR A 82 7.097 -6.479 4.734 1.00 0.00 C ATOM 1258 O THR A 82 7.462 -7.225 5.642 1.00 0.00 O ATOM 1259 CB THR A 82 6.285 -4.109 5.001 1.00 0.00 C ATOM 1260 OG1 THR A 82 6.638 -2.740 4.852 1.00 0.00 O ATOM 1261 CG2 THR A 82 5.757 -4.350 6.418 1.00 0.00 C ATOM 0 H THR A 82 7.642 -3.908 2.954 1.00 0.00 H new ATOM 0 HA THR A 82 8.244 -4.851 5.527 1.00 0.00 H new ATOM 0 HB THR A 82 5.506 -4.362 4.282 1.00 0.00 H new ATOM 0 HG1 THR A 82 6.768 -2.537 3.902 1.00 0.00 H new ATOM 0 HG21 THR A 82 4.889 -3.715 6.596 1.00 0.00 H new ATOM 0 HG22 THR A 82 5.469 -5.396 6.526 1.00 0.00 H new ATOM 0 HG23 THR A 82 6.536 -4.112 7.142 1.00 0.00 H new ATOM 1269 N VAL A 83 6.357 -6.906 3.701 1.00 0.00 N ATOM 1270 CA VAL A 83 5.910 -8.299 3.625 1.00 0.00 C ATOM 1271 C VAL A 83 7.096 -9.235 3.522 1.00 0.00 C ATOM 1272 O VAL A 83 7.183 -10.221 4.261 1.00 0.00 O ATOM 1273 CB VAL A 83 4.895 -8.520 2.466 1.00 0.00 C ATOM 1274 CG1 VAL A 83 5.497 -8.141 1.120 1.00 0.00 C ATOM 1275 CG2 VAL A 83 4.439 -9.980 2.403 1.00 0.00 C ATOM 0 H VAL A 83 6.061 -6.318 2.922 1.00 0.00 H new ATOM 0 HA VAL A 83 5.380 -8.531 4.549 1.00 0.00 H new ATOM 0 HB VAL A 83 4.039 -7.877 2.672 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.762 -8.307 0.333 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.783 -7.089 1.133 1.00 0.00 H new ATOM 0 HG13 VAL A 83 6.378 -8.754 0.930 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.730 -10.105 1.584 1.00 0.00 H new ATOM 0 HG22 VAL A 83 5.303 -10.624 2.237 1.00 0.00 H new ATOM 0 HG23 VAL A 83 3.959 -10.252 3.343 1.00 0.00 H new ATOM 1285 N ALA A 84 8.048 -8.883 2.671 1.00 0.00 N ATOM 1286 CA ALA A 84 9.241 -9.693 2.521 1.00 0.00 C ATOM 1287 C ALA A 84 9.942 -9.845 3.855 1.00 0.00 C ATOM 1288 O ALA A 84 10.239 -10.963 4.280 1.00 0.00 O ATOM 1289 CB ALA A 84 10.195 -9.074 1.501 1.00 0.00 C ATOM 0 H ALA A 84 8.017 -8.051 2.081 1.00 0.00 H new ATOM 0 HA ALA A 84 8.940 -10.677 2.160 1.00 0.00 H new ATOM 0 HB1 ALA A 84 11.082 -9.700 1.406 1.00 0.00 H new ATOM 0 HB2 ALA A 84 9.697 -9.002 0.534 1.00 0.00 H new ATOM 0 HB3 ALA A 84 10.487 -8.078 1.834 1.00 0.00 H new ATOM 1295 N MET A 85 10.201 -8.731 4.532 1.00 0.00 N ATOM 1296 CA MET A 85 10.864 -8.809 5.823 1.00 0.00 C ATOM 1297 C MET A 85 9.952 -9.456 6.856 1.00 0.00 C ATOM 1298 O MET A 85 10.404 -10.243 7.686 1.00 0.00 O ATOM 1299 CB MET A 85 11.307 -7.436 6.325 1.00 0.00 C ATOM 1300 CG MET A 85 12.266 -7.634 7.512 1.00 0.00 C ATOM 1301 SD MET A 85 12.796 -6.034 8.163 1.00 0.00 S ATOM 1302 CE MET A 85 11.607 -5.921 9.524 1.00 0.00 C ATOM 0 H MET A 85 9.969 -7.789 4.217 1.00 0.00 H new ATOM 0 HA MET A 85 11.754 -9.423 5.685 1.00 0.00 H new ATOM 0 HB2 MET A 85 11.802 -6.883 5.527 1.00 0.00 H new ATOM 0 HB3 MET A 85 10.442 -6.848 6.631 1.00 0.00 H new ATOM 0 HG2 MET A 85 11.772 -8.208 8.296 1.00 0.00 H new ATOM 0 HG3 MET A 85 13.135 -8.211 7.194 1.00 0.00 H new ATOM 0 HE1 MET A 85 11.323 -4.879 9.673 1.00 0.00 H new ATOM 0 HE2 MET A 85 10.721 -6.508 9.283 1.00 0.00 H new ATOM 0 HE3 MET A 85 12.061 -6.307 10.437 1.00 0.00 H new ATOM 1312 N ASN A 86 8.676 -9.070 6.846 1.00 0.00 N ATOM 1313 CA ASN A 86 7.739 -9.570 7.855 1.00 0.00 C ATOM 1314 C ASN A 86 7.833 -11.063 7.979 1.00 0.00 C ATOM 1315 O ASN A 86 7.699 -11.609 9.066 1.00 0.00 O ATOM 1316 CB ASN A 86 6.293 -9.134 7.587 1.00 0.00 C ATOM 1317 CG ASN A 86 5.809 -8.287 8.753 1.00 0.00 C ATOM 1318 OD1 ASN A 86 5.268 -8.819 9.724 1.00 0.00 O ATOM 1319 ND2 ASN A 86 5.973 -7.005 8.716 1.00 0.00 N ATOM 0 H ASN A 86 8.272 -8.426 6.166 1.00 0.00 H new ATOM 0 HA ASN A 86 8.031 -9.121 8.804 1.00 0.00 H new ATOM 0 HB2 ASN A 86 6.237 -8.565 6.659 1.00 0.00 H new ATOM 0 HB3 ASN A 86 5.653 -10.008 7.464 1.00 0.00 H new ATOM 0 HD21 ASN A 86 5.654 -6.427 9.494 1.00 0.00 H new ATOM 0 HD22 ASN A 86 6.422 -6.571 7.909 1.00 0.00 H new ATOM 1326 N ASN A 87 8.188 -11.715 6.884 1.00 0.00 N ATOM 1327 CA ASN A 87 8.395 -13.159 6.898 1.00 0.00 C ATOM 1328 C ASN A 87 9.247 -13.541 8.098 1.00 0.00 C ATOM 1329 O ASN A 87 8.981 -14.543 8.777 1.00 0.00 O ATOM 1330 CB ASN A 87 9.101 -13.604 5.614 1.00 0.00 C ATOM 1331 CG ASN A 87 9.573 -15.056 5.739 1.00 0.00 C ATOM 1332 OD1 ASN A 87 10.753 -15.304 5.990 1.00 0.00 O ATOM 1333 ND2 ASN A 87 8.735 -16.024 5.590 1.00 0.00 N ATOM 0 H ASN A 87 8.339 -11.273 5.977 1.00 0.00 H new ATOM 0 HA ASN A 87 7.425 -13.653 6.963 1.00 0.00 H new ATOM 0 HB2 ASN A 87 8.423 -13.507 4.766 1.00 0.00 H new ATOM 0 HB3 ASN A 87 9.953 -12.954 5.416 1.00 0.00 H new ATOM 0 HD21 ASN A 87 9.050 -16.990 5.680 1.00 0.00 H new ATOM 0 HD22 ASN A 87 7.757 -15.824 5.382 1.00 0.00 H new ATOM 1340 N PHE A 88 10.233 -12.704 8.390 1.00 0.00 N ATOM 1341 CA PHE A 88 11.097 -12.917 9.536 1.00 0.00 C ATOM 1342 C PHE A 88 10.308 -12.854 10.844 1.00 0.00 C ATOM 1343 O PHE A 88 10.519 -13.655 11.757 1.00 0.00 O ATOM 1344 CB PHE A 88 12.225 -11.868 9.570 1.00 0.00 C ATOM 1345 CG PHE A 88 13.263 -12.158 8.503 1.00 0.00 C ATOM 1346 CD1 PHE A 88 14.204 -13.170 8.706 1.00 0.00 C ATOM 1347 CD2 PHE A 88 13.288 -11.410 7.317 1.00 0.00 C ATOM 1348 CE1 PHE A 88 15.169 -13.440 7.730 1.00 0.00 C ATOM 1349 CE2 PHE A 88 14.256 -11.678 6.339 1.00 0.00 C ATOM 1350 CZ PHE A 88 15.198 -12.694 6.547 1.00 0.00 C ATOM 0 H PHE A 88 10.452 -11.870 7.846 1.00 0.00 H new ATOM 0 HA PHE A 88 11.531 -13.912 9.436 1.00 0.00 H new ATOM 0 HB2 PHE A 88 11.807 -10.873 9.416 1.00 0.00 H new ATOM 0 HB3 PHE A 88 12.697 -11.867 10.552 1.00 0.00 H new ATOM 0 HD1 PHE A 88 14.187 -13.746 9.619 1.00 0.00 H new ATOM 0 HD2 PHE A 88 12.561 -10.627 7.157 1.00 0.00 H new ATOM 0 HE1 PHE A 88 15.893 -14.226 7.890 1.00 0.00 H new ATOM 0 HE2 PHE A 88 14.276 -11.102 5.426 1.00 0.00 H new ATOM 0 HZ PHE A 88 15.945 -12.901 5.795 1.00 0.00 H new ATOM 1360 N PHE A 89 9.425 -11.880 10.948 1.00 0.00 N ATOM 1361 CA PHE A 89 8.664 -11.680 12.181 1.00 0.00 C ATOM 1362 C PHE A 89 7.806 -12.894 12.501 1.00 0.00 C ATOM 1363 O PHE A 89 7.777 -13.364 13.643 1.00 0.00 O ATOM 1364 CB PHE A 89 7.751 -10.446 12.047 1.00 0.00 C ATOM 1365 CG PHE A 89 8.541 -9.143 12.039 1.00 0.00 C ATOM 1366 CD1 PHE A 89 9.934 -9.124 12.256 1.00 0.00 C ATOM 1367 CD2 PHE A 89 7.862 -7.942 11.808 1.00 0.00 C ATOM 1368 CE1 PHE A 89 10.623 -7.906 12.249 1.00 0.00 C ATOM 1369 CE2 PHE A 89 8.556 -6.732 11.797 1.00 0.00 C ATOM 1370 CZ PHE A 89 9.934 -6.712 12.020 1.00 0.00 C ATOM 0 H PHE A 89 9.213 -11.216 10.204 1.00 0.00 H new ATOM 0 HA PHE A 89 9.379 -11.529 12.990 1.00 0.00 H new ATOM 0 HB2 PHE A 89 7.172 -10.523 11.127 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.039 -10.432 12.872 1.00 0.00 H new ATOM 0 HD1 PHE A 89 10.468 -10.047 12.427 1.00 0.00 H new ATOM 0 HD2 PHE A 89 6.796 -7.952 11.637 1.00 0.00 H new ATOM 0 HE1 PHE A 89 11.689 -7.889 12.421 1.00 0.00 H new ATOM 0 HE2 PHE A 89 8.026 -5.809 11.616 1.00 0.00 H new ATOM 0 HZ PHE A 89 10.468 -5.773 12.016 1.00 0.00 H new ATOM 1380 N TRP A 90 7.077 -13.370 11.511 1.00 0.00 N ATOM 1381 CA TRP A 90 6.153 -14.483 11.718 1.00 0.00 C ATOM 1382 C TRP A 90 6.823 -15.826 11.574 1.00 0.00 C ATOM 1383 O TRP A 90 6.535 -16.750 12.336 1.00 0.00 O ATOM 1384 CB TRP A 90 4.944 -14.381 10.777 1.00 0.00 C ATOM 1385 CG TRP A 90 4.373 -13.010 10.882 1.00 0.00 C ATOM 1386 CD1 TRP A 90 4.915 -11.920 10.322 1.00 0.00 C ATOM 1387 CD2 TRP A 90 3.173 -12.562 11.573 1.00 0.00 C ATOM 1388 NE1 TRP A 90 4.152 -10.828 10.630 1.00 0.00 N ATOM 1389 CE2 TRP A 90 3.059 -11.165 11.401 1.00 0.00 C ATOM 1390 CE3 TRP A 90 2.194 -13.221 12.332 1.00 0.00 C ATOM 1391 CZ2 TRP A 90 2.005 -10.443 11.954 1.00 0.00 C ATOM 1392 CZ3 TRP A 90 1.125 -12.496 12.894 1.00 0.00 C ATOM 1393 CH2 TRP A 90 1.031 -11.112 12.703 1.00 0.00 C ATOM 0 H TRP A 90 7.101 -13.010 10.557 1.00 0.00 H new ATOM 0 HA TRP A 90 5.803 -14.407 12.747 1.00 0.00 H new ATOM 0 HB2 TRP A 90 5.246 -14.587 9.750 1.00 0.00 H new ATOM 0 HB3 TRP A 90 4.193 -15.125 11.044 1.00 0.00 H new ATOM 0 HD1 TRP A 90 5.813 -11.906 9.722 1.00 0.00 H new ATOM 0 HE1 TRP A 90 4.365 -9.878 10.326 1.00 0.00 H new ATOM 0 HE3 TRP A 90 2.260 -14.288 12.486 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 1.940 -9.375 11.806 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 0.374 -13.010 13.475 1.00 0.00 H new ATOM 0 HH2 TRP A 90 0.207 -10.562 13.133 1.00 0.00 H new ATOM 1453 N SER B 2 10.078 4.359 11.702 1.00 0.00 N ATOM 1454 CA SER B 2 9.039 5.357 11.530 1.00 0.00 C ATOM 1455 C SER B 2 7.680 4.759 11.837 1.00 0.00 C ATOM 1456 O SER B 2 7.456 3.571 11.602 1.00 0.00 O ATOM 1457 CB SER B 2 9.059 5.880 10.101 1.00 0.00 C ATOM 1458 OG SER B 2 10.183 6.740 9.933 1.00 0.00 O ATOM 0 HA SER B 2 9.225 6.181 12.219 1.00 0.00 H new ATOM 0 HB2 SER B 2 9.113 5.049 9.398 1.00 0.00 H new ATOM 0 HB3 SER B 2 8.137 6.420 9.886 1.00 0.00 H new ATOM 0 HG SER B 2 9.877 7.628 9.653 1.00 0.00 H new ATOM 1464 N GLU B 3 6.743 5.599 12.268 1.00 0.00 N ATOM 1465 CA GLU B 3 5.389 5.147 12.542 1.00 0.00 C ATOM 1466 C GLU B 3 4.852 4.430 11.318 1.00 0.00 C ATOM 1467 O GLU B 3 3.942 3.603 11.414 1.00 0.00 O ATOM 1468 CB GLU B 3 4.484 6.338 12.878 1.00 0.00 C ATOM 1469 CG GLU B 3 4.991 7.039 14.147 1.00 0.00 C ATOM 1470 CD GLU B 3 6.111 8.029 13.827 1.00 0.00 C ATOM 1471 OE1 GLU B 3 6.540 8.085 12.686 1.00 0.00 O ATOM 1472 OE2 GLU B 3 6.533 8.715 14.723 1.00 0.00 O ATOM 0 H GLU B 3 6.899 6.593 12.434 1.00 0.00 H new ATOM 0 HA GLU B 3 5.403 4.470 13.396 1.00 0.00 H new ATOM 0 HB2 GLU B 3 4.469 7.041 12.045 1.00 0.00 H new ATOM 0 HB3 GLU B 3 3.459 5.997 13.025 1.00 0.00 H new ATOM 0 HG2 GLU B 3 4.166 7.564 14.629 1.00 0.00 H new ATOM 0 HG3 GLU B 3 5.353 6.294 14.856 1.00 0.00 H new ATOM 1479 N LEU B 4 5.467 4.707 10.177 1.00 0.00 N ATOM 1480 CA LEU B 4 5.092 4.059 8.951 1.00 0.00 C ATOM 1481 C LEU B 4 5.321 2.573 9.094 1.00 0.00 C ATOM 1482 O LEU B 4 4.473 1.774 8.723 1.00 0.00 O ATOM 1483 CB LEU B 4 5.924 4.571 7.779 1.00 0.00 C ATOM 1484 CG LEU B 4 5.630 6.052 7.523 1.00 0.00 C ATOM 1485 CD1 LEU B 4 6.442 6.524 6.323 1.00 0.00 C ATOM 1486 CD2 LEU B 4 4.143 6.262 7.254 1.00 0.00 C ATOM 0 H LEU B 4 6.228 5.379 10.086 1.00 0.00 H new ATOM 0 HA LEU B 4 4.042 4.275 8.754 1.00 0.00 H new ATOM 0 HB2 LEU B 4 6.985 4.435 7.991 1.00 0.00 H new ATOM 0 HB3 LEU B 4 5.701 3.989 6.885 1.00 0.00 H new ATOM 0 HG LEU B 4 5.907 6.628 8.406 1.00 0.00 H new ATOM 0 HD11 LEU B 4 6.236 7.578 6.136 1.00 0.00 H new ATOM 0 HD12 LEU B 4 7.504 6.392 6.528 1.00 0.00 H new ATOM 0 HD13 LEU B 4 6.167 5.940 5.445 1.00 0.00 H new ATOM 0 HD21 LEU B 4 3.952 7.320 7.074 1.00 0.00 H new ATOM 0 HD22 LEU B 4 3.847 5.686 6.378 1.00 0.00 H new ATOM 0 HD23 LEU B 4 3.567 5.931 8.118 1.00 0.00 H new ATOM 1498 N GLU B 5 6.436 2.206 9.717 1.00 0.00 N ATOM 1499 CA GLU B 5 6.721 0.805 9.925 1.00 0.00 C ATOM 1500 C GLU B 5 5.634 0.205 10.793 1.00 0.00 C ATOM 1501 O GLU B 5 5.030 -0.806 10.438 1.00 0.00 O ATOM 1502 CB GLU B 5 8.089 0.609 10.604 1.00 0.00 C ATOM 1503 CG GLU B 5 9.231 1.045 9.667 1.00 0.00 C ATOM 1504 CD GLU B 5 10.590 0.801 10.333 1.00 0.00 C ATOM 1505 OE1 GLU B 5 10.608 0.249 11.420 1.00 0.00 O ATOM 1506 OE2 GLU B 5 11.590 1.150 9.740 1.00 0.00 O ATOM 0 H GLU B 5 7.140 2.850 10.078 1.00 0.00 H new ATOM 0 HA GLU B 5 6.750 0.308 8.956 1.00 0.00 H new ATOM 0 HB2 GLU B 5 8.128 1.188 11.527 1.00 0.00 H new ATOM 0 HB3 GLU B 5 8.217 -0.438 10.879 1.00 0.00 H new ATOM 0 HG2 GLU B 5 9.173 0.491 8.730 1.00 0.00 H new ATOM 0 HG3 GLU B 5 9.124 2.101 9.420 1.00 0.00 H new ATOM 1513 N THR B 6 5.271 0.929 11.827 1.00 0.00 N ATOM 1514 CA THR B 6 4.169 0.532 12.671 1.00 0.00 C ATOM 1515 C THR B 6 2.885 0.483 11.843 1.00 0.00 C ATOM 1516 O THR B 6 2.116 -0.479 11.923 1.00 0.00 O ATOM 1517 CB THR B 6 4.039 1.515 13.836 1.00 0.00 C ATOM 1518 OG1 THR B 6 5.332 1.738 14.398 1.00 0.00 O ATOM 1519 CG2 THR B 6 3.111 0.937 14.913 1.00 0.00 C ATOM 0 H THR B 6 5.725 1.799 12.104 1.00 0.00 H new ATOM 0 HA THR B 6 4.350 -0.462 13.080 1.00 0.00 H new ATOM 0 HB THR B 6 3.619 2.453 13.473 1.00 0.00 H new ATOM 0 HG1 THR B 6 5.260 2.368 15.145 1.00 0.00 H new ATOM 0 HG21 THR B 6 3.026 1.645 15.738 1.00 0.00 H new ATOM 0 HG22 THR B 6 2.125 0.757 14.485 1.00 0.00 H new ATOM 0 HG23 THR B 6 3.523 -0.002 15.282 1.00 0.00 H new ATOM 1527 N ALA B 7 2.690 1.493 11.005 1.00 0.00 N ATOM 1528 CA ALA B 7 1.535 1.517 10.123 1.00 0.00 C ATOM 1529 C ALA B 7 1.556 0.307 9.210 1.00 0.00 C ATOM 1530 O ALA B 7 0.556 -0.409 9.085 1.00 0.00 O ATOM 1531 CB ALA B 7 1.535 2.801 9.288 1.00 0.00 C ATOM 0 H ALA B 7 3.311 2.298 10.919 1.00 0.00 H new ATOM 0 HA ALA B 7 0.629 1.491 10.729 1.00 0.00 H new ATOM 0 HB1 ALA B 7 0.665 2.808 8.631 1.00 0.00 H new ATOM 0 HB2 ALA B 7 1.496 3.666 9.950 1.00 0.00 H new ATOM 0 HB3 ALA B 7 2.444 2.844 8.687 1.00 0.00 H new ATOM 1537 N MET B 8 2.709 0.037 8.613 1.00 0.00 N ATOM 1538 CA MET B 8 2.853 -1.124 7.749 1.00 0.00 C ATOM 1539 C MET B 8 2.656 -2.392 8.555 1.00 0.00 C ATOM 1540 O MET B 8 1.908 -3.283 8.147 1.00 0.00 O ATOM 1541 CB MET B 8 4.227 -1.136 7.068 1.00 0.00 C ATOM 1542 CG MET B 8 4.380 0.107 6.172 1.00 0.00 C ATOM 1543 SD MET B 8 2.989 0.207 5.014 1.00 0.00 S ATOM 1544 CE MET B 8 3.407 -1.241 4.016 1.00 0.00 C ATOM 0 H MET B 8 3.552 0.603 8.711 1.00 0.00 H new ATOM 0 HA MET B 8 2.092 -1.071 6.971 1.00 0.00 H new ATOM 0 HB2 MET B 8 5.015 -1.151 7.821 1.00 0.00 H new ATOM 0 HB3 MET B 8 4.339 -2.041 6.471 1.00 0.00 H new ATOM 0 HG2 MET B 8 4.419 1.007 6.786 1.00 0.00 H new ATOM 0 HG3 MET B 8 5.320 0.056 5.622 1.00 0.00 H new ATOM 0 HE1 MET B 8 3.287 -1.002 2.959 1.00 0.00 H new ATOM 0 HE2 MET B 8 4.441 -1.529 4.208 1.00 0.00 H new ATOM 0 HE3 MET B 8 2.746 -2.067 4.278 1.00 0.00 H new ATOM 1554 N GLU B 9 3.188 -2.400 9.766 1.00 0.00 N ATOM 1555 CA GLU B 9 2.939 -3.498 10.684 1.00 0.00 C ATOM 1556 C GLU B 9 1.450 -3.590 10.976 1.00 0.00 C ATOM 1557 O GLU B 9 0.869 -4.673 10.958 1.00 0.00 O ATOM 1558 CB GLU B 9 3.705 -3.290 11.994 1.00 0.00 C ATOM 1559 CG GLU B 9 5.193 -3.543 11.783 1.00 0.00 C ATOM 1560 CD GLU B 9 5.432 -5.021 11.586 1.00 0.00 C ATOM 1561 OE1 GLU B 9 5.166 -5.762 12.503 1.00 0.00 O ATOM 1562 OE2 GLU B 9 5.843 -5.392 10.529 1.00 0.00 O ATOM 0 H GLU B 9 3.791 -1.664 10.134 1.00 0.00 H new ATOM 0 HA GLU B 9 3.282 -4.423 10.221 1.00 0.00 H new ATOM 0 HB2 GLU B 9 3.550 -2.274 12.356 1.00 0.00 H new ATOM 0 HB3 GLU B 9 3.320 -3.964 12.759 1.00 0.00 H new ATOM 0 HG2 GLU B 9 5.547 -2.988 10.914 1.00 0.00 H new ATOM 0 HG3 GLU B 9 5.759 -3.184 12.643 1.00 0.00 H new ATOM 1569 N THR B 10 0.815 -2.443 11.150 1.00 0.00 N ATOM 1570 CA THR B 10 -0.613 -2.420 11.357 1.00 0.00 C ATOM 1571 C THR B 10 -1.280 -3.032 10.130 1.00 0.00 C ATOM 1572 O THR B 10 -2.119 -3.929 10.240 1.00 0.00 O ATOM 1573 CB THR B 10 -1.110 -0.974 11.598 1.00 0.00 C ATOM 1574 OG1 THR B 10 -0.245 -0.316 12.529 1.00 0.00 O ATOM 1575 CG2 THR B 10 -2.529 -1.006 12.185 1.00 0.00 C ATOM 0 H THR B 10 1.265 -1.528 11.151 1.00 0.00 H new ATOM 0 HA THR B 10 -0.872 -2.998 12.244 1.00 0.00 H new ATOM 0 HB THR B 10 -1.112 -0.438 10.649 1.00 0.00 H new ATOM 0 HG1 THR B 10 0.587 -0.061 12.079 1.00 0.00 H new ATOM 0 HG21 THR B 10 -2.876 0.013 12.354 1.00 0.00 H new ATOM 0 HG22 THR B 10 -3.200 -1.507 11.487 1.00 0.00 H new ATOM 0 HG23 THR B 10 -2.519 -1.547 13.131 1.00 0.00 H new ATOM 1583 N LEU B 11 -0.807 -2.630 8.958 1.00 0.00 N ATOM 1584 CA LEU B 11 -1.308 -3.195 7.723 1.00 0.00 C ATOM 1585 C LEU B 11 -1.004 -4.695 7.671 1.00 0.00 C ATOM 1586 O LEU B 11 -1.877 -5.500 7.330 1.00 0.00 O ATOM 1587 CB LEU B 11 -0.672 -2.490 6.511 1.00 0.00 C ATOM 1588 CG LEU B 11 -1.166 -1.033 6.399 1.00 0.00 C ATOM 1589 CD1 LEU B 11 -0.326 -0.284 5.360 1.00 0.00 C ATOM 1590 CD2 LEU B 11 -2.639 -1.007 5.967 1.00 0.00 C ATOM 0 H LEU B 11 -0.083 -1.921 8.842 1.00 0.00 H new ATOM 0 HA LEU B 11 -2.387 -3.047 7.687 1.00 0.00 H new ATOM 0 HB2 LEU B 11 0.414 -2.504 6.606 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -0.919 -3.033 5.599 1.00 0.00 H new ATOM 0 HG LEU B 11 -1.066 -0.552 7.372 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -0.676 0.745 5.282 1.00 0.00 H new ATOM 0 HD12 LEU B 11 0.720 -0.289 5.666 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -0.423 -0.775 4.391 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -2.978 0.026 5.891 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -2.743 -1.495 4.998 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -3.244 -1.534 6.705 1.00 0.00 H new ATOM 1602 N ILE B 12 0.214 -5.077 8.061 1.00 0.00 N ATOM 1603 CA ILE B 12 0.586 -6.491 8.076 1.00 0.00 C ATOM 1604 C ILE B 12 -0.286 -7.241 9.073 1.00 0.00 C ATOM 1605 O ILE B 12 -0.807 -8.314 8.767 1.00 0.00 O ATOM 1606 CB ILE B 12 2.082 -6.668 8.457 1.00 0.00 C ATOM 1607 CG1 ILE B 12 2.998 -6.139 7.339 1.00 0.00 C ATOM 1608 CG2 ILE B 12 2.381 -8.149 8.683 1.00 0.00 C ATOM 1609 CD1 ILE B 12 3.070 -7.146 6.170 1.00 0.00 C ATOM 0 H ILE B 12 0.948 -4.438 8.366 1.00 0.00 H new ATOM 0 HA ILE B 12 0.434 -6.896 7.076 1.00 0.00 H new ATOM 0 HB ILE B 12 2.272 -6.102 9.369 1.00 0.00 H new ATOM 0 HG12 ILE B 12 2.623 -5.181 6.978 1.00 0.00 H new ATOM 0 HG13 ILE B 12 3.998 -5.962 7.735 1.00 0.00 H new ATOM 0 HG21 ILE B 12 3.431 -8.272 8.950 1.00 0.00 H new ATOM 0 HG22 ILE B 12 1.754 -8.528 9.491 1.00 0.00 H new ATOM 0 HG23 ILE B 12 2.172 -8.706 7.770 1.00 0.00 H new ATOM 0 HD11 ILE B 12 3.723 -6.753 5.391 1.00 0.00 H new ATOM 0 HD12 ILE B 12 3.467 -8.095 6.531 1.00 0.00 H new ATOM 0 HD13 ILE B 12 2.071 -7.302 5.762 1.00 0.00 H new ATOM 1621 N ASN B 13 -0.467 -6.662 10.250 1.00 0.00 N ATOM 1622 CA ASN B 13 -1.257 -7.310 11.289 1.00 0.00 C ATOM 1623 C ASN B 13 -2.680 -7.490 10.835 1.00 0.00 C ATOM 1624 O ASN B 13 -3.252 -8.577 10.972 1.00 0.00 O ATOM 1625 CB ASN B 13 -1.228 -6.486 12.574 1.00 0.00 C ATOM 1626 CG ASN B 13 0.083 -6.709 13.296 1.00 0.00 C ATOM 1627 OD1 ASN B 13 0.242 -7.704 14.007 1.00 0.00 O ATOM 1628 ND2 ASN B 13 1.042 -5.864 13.136 1.00 0.00 N ATOM 0 H ASN B 13 -0.082 -5.754 10.510 1.00 0.00 H new ATOM 0 HA ASN B 13 -0.821 -8.290 11.485 1.00 0.00 H new ATOM 0 HB2 ASN B 13 -1.350 -5.428 12.341 1.00 0.00 H new ATOM 0 HB3 ASN B 13 -2.061 -6.769 13.217 1.00 0.00 H new ATOM 0 HD21 ASN B 13 1.938 -6.016 13.598 1.00 0.00 H new ATOM 0 HD22 ASN B 13 0.905 -5.043 12.547 1.00 0.00 H new ATOM 1635 N VAL B 14 -3.230 -6.459 10.217 1.00 0.00 N ATOM 1636 CA VAL B 14 -4.566 -6.552 9.664 1.00 0.00 C ATOM 1637 C VAL B 14 -4.572 -7.574 8.543 1.00 0.00 C ATOM 1638 O VAL B 14 -5.435 -8.448 8.479 1.00 0.00 O ATOM 1639 CB VAL B 14 -5.005 -5.186 9.131 1.00 0.00 C ATOM 1640 CG1 VAL B 14 -6.394 -5.291 8.490 1.00 0.00 C ATOM 1641 CG2 VAL B 14 -5.034 -4.178 10.284 1.00 0.00 C ATOM 0 H VAL B 14 -2.775 -5.555 10.087 1.00 0.00 H new ATOM 0 HA VAL B 14 -5.262 -6.864 10.442 1.00 0.00 H new ATOM 0 HB VAL B 14 -4.297 -4.850 8.373 1.00 0.00 H new ATOM 0 HG11 VAL B 14 -6.696 -4.313 8.114 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -6.361 -6.003 7.665 1.00 0.00 H new ATOM 0 HG13 VAL B 14 -7.113 -5.632 9.235 1.00 0.00 H new ATOM 0 HG21 VAL B 14 -5.346 -3.204 9.908 1.00 0.00 H new ATOM 0 HG22 VAL B 14 -5.738 -4.516 11.045 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -4.039 -4.096 10.721 1.00 0.00 H new ATOM 1651 N PHE B 15 -3.586 -7.473 7.673 1.00 0.00 N ATOM 1652 CA PHE B 15 -3.467 -8.395 6.566 1.00 0.00 C ATOM 1653 C PHE B 15 -3.347 -9.811 7.102 1.00 0.00 C ATOM 1654 O PHE B 15 -4.097 -10.711 6.704 1.00 0.00 O ATOM 1655 CB PHE B 15 -2.227 -8.039 5.742 1.00 0.00 C ATOM 1656 CG PHE B 15 -2.111 -8.959 4.557 1.00 0.00 C ATOM 1657 CD1 PHE B 15 -2.798 -8.664 3.378 1.00 0.00 C ATOM 1658 CD2 PHE B 15 -1.319 -10.105 4.636 1.00 0.00 C ATOM 1659 CE1 PHE B 15 -2.687 -9.515 2.280 1.00 0.00 C ATOM 1660 CE2 PHE B 15 -1.213 -10.952 3.540 1.00 0.00 C ATOM 1661 CZ PHE B 15 -1.894 -10.658 2.365 1.00 0.00 C ATOM 0 H PHE B 15 -2.857 -6.761 7.713 1.00 0.00 H new ATOM 0 HA PHE B 15 -4.350 -8.327 5.931 1.00 0.00 H new ATOM 0 HB2 PHE B 15 -2.290 -7.005 5.404 1.00 0.00 H new ATOM 0 HB3 PHE B 15 -1.334 -8.118 6.362 1.00 0.00 H new ATOM 0 HD1 PHE B 15 -3.414 -7.779 3.317 1.00 0.00 H new ATOM 0 HD2 PHE B 15 -0.789 -10.333 5.549 1.00 0.00 H new ATOM 0 HE1 PHE B 15 -3.214 -9.289 1.365 1.00 0.00 H new ATOM 0 HE2 PHE B 15 -0.601 -11.840 3.601 1.00 0.00 H new ATOM 0 HZ PHE B 15 -1.808 -11.318 1.514 1.00 0.00 H new ATOM 1671 N HIS B 16 -2.473 -9.979 8.078 1.00 0.00 N ATOM 1672 CA HIS B 16 -2.289 -11.262 8.725 1.00 0.00 C ATOM 1673 C HIS B 16 -3.566 -11.720 9.377 1.00 0.00 C ATOM 1674 O HIS B 16 -3.904 -12.903 9.323 1.00 0.00 O ATOM 1675 CB HIS B 16 -1.149 -11.195 9.747 1.00 0.00 C ATOM 1676 CG HIS B 16 0.165 -11.262 9.020 1.00 0.00 C ATOM 1677 ND1 HIS B 16 1.204 -12.072 9.439 1.00 0.00 N ATOM 1678 CD2 HIS B 16 0.613 -10.634 7.889 1.00 0.00 C ATOM 1679 CE1 HIS B 16 2.217 -11.912 8.564 1.00 0.00 C ATOM 1680 NE2 HIS B 16 1.908 -11.044 7.605 1.00 0.00 N ATOM 0 H HIS B 16 -1.876 -9.236 8.441 1.00 0.00 H new ATOM 0 HA HIS B 16 -2.019 -11.992 7.962 1.00 0.00 H new ATOM 0 HB2 HIS B 16 -1.214 -10.272 10.323 1.00 0.00 H new ATOM 0 HB3 HIS B 16 -1.230 -12.019 10.456 1.00 0.00 H new ATOM 0 HD1 HIS B 16 1.204 -12.679 10.259 1.00 0.00 H new ATOM 0 HD2 HIS B 16 0.044 -9.926 7.305 1.00 0.00 H new ATOM 0 HE1 HIS B 16 3.164 -12.426 8.633 1.00 0.00 H new ATOM 1689 N ALA B 17 -4.289 -10.798 9.980 1.00 0.00 N ATOM 1690 CA ALA B 17 -5.537 -11.160 10.631 1.00 0.00 C ATOM 1691 C ALA B 17 -6.430 -11.888 9.649 1.00 0.00 C ATOM 1692 O ALA B 17 -6.851 -13.016 9.897 1.00 0.00 O ATOM 1693 CB ALA B 17 -6.264 -9.911 11.169 1.00 0.00 C ATOM 0 H ALA B 17 -4.043 -9.810 10.034 1.00 0.00 H new ATOM 0 HA ALA B 17 -5.308 -11.812 11.474 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -7.194 -10.211 11.651 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -5.627 -9.403 11.893 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -6.485 -9.235 10.343 1.00 0.00 H new ATOM 1699 N HIS B 18 -6.624 -11.289 8.487 1.00 0.00 N ATOM 1700 CA HIS B 18 -7.425 -11.908 7.441 1.00 0.00 C ATOM 1701 C HIS B 18 -6.747 -13.158 6.900 1.00 0.00 C ATOM 1702 O HIS B 18 -7.388 -14.202 6.767 1.00 0.00 O ATOM 1703 CB HIS B 18 -7.722 -10.916 6.320 1.00 0.00 C ATOM 1704 CG HIS B 18 -8.565 -9.801 6.874 1.00 0.00 C ATOM 1705 ND1 HIS B 18 -9.928 -9.942 7.134 1.00 0.00 N ATOM 1706 CD2 HIS B 18 -8.241 -8.526 7.264 1.00 0.00 C ATOM 1707 CE1 HIS B 18 -10.356 -8.772 7.656 1.00 0.00 C ATOM 1708 NE2 HIS B 18 -9.367 -7.881 7.758 1.00 0.00 N ATOM 0 H HIS B 18 -6.239 -10.376 8.243 1.00 0.00 H new ATOM 0 HA HIS B 18 -8.375 -12.209 7.882 1.00 0.00 H new ATOM 0 HB2 HIS B 18 -6.793 -10.520 5.910 1.00 0.00 H new ATOM 0 HB3 HIS B 18 -8.244 -11.414 5.503 1.00 0.00 H new ATOM 0 HD1 HIS B 18 -10.495 -10.772 6.962 1.00 0.00 H new ATOM 0 HD2 HIS B 18 -7.256 -8.089 7.197 1.00 0.00 H new ATOM 0 HE1 HIS B 18 -11.376 -8.580 7.955 1.00 0.00 H new ATOM 1717 N SER B 19 -5.419 -13.106 6.736 1.00 0.00 N ATOM 1718 CA SER B 19 -4.692 -14.309 6.351 1.00 0.00 C ATOM 1719 C SER B 19 -4.977 -15.392 7.375 1.00 0.00 C ATOM 1720 O SER B 19 -5.254 -16.539 7.025 1.00 0.00 O ATOM 1721 CB SER B 19 -3.180 -14.051 6.289 1.00 0.00 C ATOM 1722 OG SER B 19 -2.894 -12.997 5.367 1.00 0.00 O ATOM 0 H SER B 19 -4.847 -12.271 6.860 1.00 0.00 H new ATOM 0 HA SER B 19 -5.021 -14.618 5.359 1.00 0.00 H new ATOM 0 HB2 SER B 19 -2.808 -13.788 7.279 1.00 0.00 H new ATOM 0 HB3 SER B 19 -2.661 -14.960 5.985 1.00 0.00 H new ATOM 0 HG SER B 19 -3.557 -13.005 4.645 1.00 0.00 H new ATOM 1728 N GLY B 20 -4.987 -14.993 8.639 1.00 0.00 N ATOM 1729 CA GLY B 20 -5.315 -15.895 9.724 1.00 0.00 C ATOM 1730 C GLY B 20 -6.741 -16.394 9.589 1.00 0.00 C ATOM 1731 O GLY B 20 -7.016 -17.574 9.825 1.00 0.00 O ATOM 0 H GLY B 20 -4.769 -14.042 8.936 1.00 0.00 H new ATOM 0 HA2 GLY B 20 -4.626 -16.740 9.723 1.00 0.00 H new ATOM 0 HA3 GLY B 20 -5.191 -15.384 10.679 1.00 0.00 H new ATOM 1735 N LYS B 21 -7.654 -15.504 9.191 1.00 0.00 N ATOM 1736 CA LYS B 21 -9.045 -15.903 9.010 1.00 0.00 C ATOM 1737 C LYS B 21 -9.117 -16.935 7.906 1.00 0.00 C ATOM 1738 O LYS B 21 -9.755 -17.984 8.054 1.00 0.00 O ATOM 1739 CB LYS B 21 -9.905 -14.697 8.582 1.00 0.00 C ATOM 1740 CG LYS B 21 -9.897 -13.598 9.652 1.00 0.00 C ATOM 1741 CD LYS B 21 -10.543 -14.096 10.940 1.00 0.00 C ATOM 1742 CE LYS B 21 -10.496 -12.976 11.986 1.00 0.00 C ATOM 1743 NZ LYS B 21 -11.145 -13.434 13.230 1.00 0.00 N ATOM 0 H LYS B 21 -7.458 -14.523 8.992 1.00 0.00 H new ATOM 0 HA LYS B 21 -9.417 -16.302 9.953 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -9.528 -14.295 7.642 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -10.929 -15.024 8.401 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -8.872 -13.284 9.851 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -10.433 -12.722 9.285 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -11.575 -14.394 10.753 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -10.018 -14.978 11.308 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -9.462 -12.694 12.186 1.00 0.00 H new ATOM 0 HE3 LYS B 21 -11.001 -12.088 11.606 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 -11.113 -12.674 13.939 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 -12.136 -13.682 13.034 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 -10.645 -14.269 13.595 1.00 0.00 H new ATOM 1757 N GLU B 22 -8.452 -16.639 6.805 1.00 0.00 N ATOM 1758 CA GLU B 22 -8.433 -17.534 5.672 1.00 0.00 C ATOM 1759 C GLU B 22 -7.601 -18.780 5.967 1.00 0.00 C ATOM 1760 O GLU B 22 -8.031 -19.892 5.673 1.00 0.00 O ATOM 1761 CB GLU B 22 -7.950 -16.807 4.427 1.00 0.00 C ATOM 1762 CG GLU B 22 -8.977 -15.749 4.046 1.00 0.00 C ATOM 1763 CD GLU B 22 -8.468 -14.911 2.898 1.00 0.00 C ATOM 1764 OE1 GLU B 22 -7.332 -15.097 2.516 1.00 0.00 O ATOM 1765 OE2 GLU B 22 -9.220 -14.114 2.399 1.00 0.00 O ATOM 0 H GLU B 22 -7.917 -15.781 6.675 1.00 0.00 H new ATOM 0 HA GLU B 22 -9.452 -17.872 5.481 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -6.981 -16.343 4.613 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -7.813 -17.512 3.607 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -9.916 -16.228 3.767 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -9.188 -15.111 4.905 1.00 0.00 H new ATOM 1772 N GLY B 23 -6.458 -18.595 6.627 1.00 0.00 N ATOM 1773 CA GLY B 23 -5.626 -19.726 7.055 1.00 0.00 C ATOM 1774 C GLY B 23 -4.140 -19.536 6.720 1.00 0.00 C ATOM 1775 O GLY B 23 -3.275 -20.146 7.362 1.00 0.00 O ATOM 0 H GLY B 23 -6.086 -17.679 6.877 1.00 0.00 H new ATOM 0 HA2 GLY B 23 -5.736 -19.865 8.131 1.00 0.00 H new ATOM 0 HA3 GLY B 23 -5.987 -20.637 6.578 1.00 0.00 H new ATOM 1779 N ASP B 24 -3.841 -18.731 5.701 1.00 0.00 N ATOM 1780 CA ASP B 24 -2.447 -18.539 5.266 1.00 0.00 C ATOM 1781 C ASP B 24 -1.650 -17.795 6.312 1.00 0.00 C ATOM 1782 O ASP B 24 -2.198 -16.964 7.042 1.00 0.00 O ATOM 1783 CB ASP B 24 -2.366 -17.781 3.936 1.00 0.00 C ATOM 1784 CG ASP B 24 -0.950 -17.869 3.371 1.00 0.00 C ATOM 1785 OD1 ASP B 24 -0.099 -17.138 3.828 1.00 0.00 O ATOM 1786 OD2 ASP B 24 -0.736 -18.671 2.484 1.00 0.00 O ATOM 0 H ASP B 24 -4.531 -18.205 5.164 1.00 0.00 H new ATOM 0 HA ASP B 24 -2.022 -19.533 5.127 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -3.077 -18.201 3.225 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -2.643 -16.737 4.085 1.00 0.00 H new ATOM 1791 N LYS B 25 -0.348 -18.049 6.350 1.00 0.00 N ATOM 1792 CA LYS B 25 0.523 -17.341 7.266 1.00 0.00 C ATOM 1793 C LYS B 25 0.453 -15.849 6.988 1.00 0.00 C ATOM 1794 O LYS B 25 0.178 -15.050 7.896 1.00 0.00 O ATOM 1795 CB LYS B 25 1.975 -17.878 7.210 1.00 0.00 C ATOM 1796 CG LYS B 25 2.669 -17.560 5.866 1.00 0.00 C ATOM 1797 CD LYS B 25 2.685 -18.801 4.959 1.00 0.00 C ATOM 1798 CE LYS B 25 3.856 -18.695 3.966 1.00 0.00 C ATOM 1799 NZ LYS B 25 5.098 -19.198 4.603 1.00 0.00 N ATOM 0 H LYS B 25 0.121 -18.736 5.760 1.00 0.00 H new ATOM 0 HA LYS B 25 0.176 -17.516 8.284 1.00 0.00 H new ATOM 0 HB2 LYS B 25 2.552 -17.443 8.026 1.00 0.00 H new ATOM 0 HB3 LYS B 25 1.967 -18.957 7.365 1.00 0.00 H new ATOM 0 HG2 LYS B 25 2.148 -16.744 5.366 1.00 0.00 H new ATOM 0 HG3 LYS B 25 3.689 -17.223 6.048 1.00 0.00 H new ATOM 0 HD2 LYS B 25 2.786 -19.704 5.561 1.00 0.00 H new ATOM 0 HD3 LYS B 25 1.742 -18.882 4.419 1.00 0.00 H new ATOM 0 HE2 LYS B 25 3.637 -19.272 3.068 1.00 0.00 H new ATOM 0 HE3 LYS B 25 3.989 -17.659 3.655 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 5.887 -19.125 3.930 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 5.310 -18.629 5.448 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 4.969 -20.192 4.879 1.00 0.00 H new ATOM 1813 N TYR B 26 0.455 -15.511 5.711 1.00 0.00 N ATOM 1814 CA TYR B 26 0.150 -14.173 5.262 1.00 0.00 C ATOM 1815 C TYR B 26 -0.109 -14.138 3.771 1.00 0.00 C ATOM 1816 O TYR B 26 0.797 -13.867 2.967 1.00 0.00 O ATOM 1817 CB TYR B 26 1.219 -13.148 5.661 1.00 0.00 C ATOM 1818 CG TYR B 26 2.594 -13.755 5.616 1.00 0.00 C ATOM 1819 CD1 TYR B 26 3.082 -14.431 6.729 1.00 0.00 C ATOM 1820 CD2 TYR B 26 3.383 -13.627 4.470 1.00 0.00 C ATOM 1821 CE1 TYR B 26 4.359 -14.985 6.704 1.00 0.00 C ATOM 1822 CE2 TYR B 26 4.659 -14.182 4.441 1.00 0.00 C ATOM 1823 CZ TYR B 26 5.147 -14.862 5.556 1.00 0.00 C ATOM 1824 OH TYR B 26 6.406 -15.403 5.530 1.00 0.00 O ATOM 0 H TYR B 26 0.670 -16.163 4.956 1.00 0.00 H new ATOM 0 HA TYR B 26 -0.766 -13.881 5.776 1.00 0.00 H new ATOM 0 HB2 TYR B 26 1.174 -12.291 4.989 1.00 0.00 H new ATOM 0 HB3 TYR B 26 1.015 -12.777 6.665 1.00 0.00 H new ATOM 0 HD1 TYR B 26 2.470 -14.526 7.614 1.00 0.00 H new ATOM 0 HD2 TYR B 26 3.003 -13.098 3.608 1.00 0.00 H new ATOM 0 HE1 TYR B 26 4.740 -15.508 7.569 1.00 0.00 H new ATOM 0 HE2 TYR B 26 5.270 -14.086 3.556 1.00 0.00 H new ATOM 0 HH TYR B 26 6.408 -16.252 6.020 1.00 0.00 H new ATOM 1834 N LYS B 27 -1.376 -14.229 3.444 1.00 0.00 N ATOM 1835 CA LYS B 27 -1.911 -14.044 2.107 1.00 0.00 C ATOM 1836 C LYS B 27 -3.339 -13.617 2.274 1.00 0.00 C ATOM 1837 O LYS B 27 -3.943 -13.894 3.318 1.00 0.00 O ATOM 1838 CB LYS B 27 -1.876 -15.330 1.274 1.00 0.00 C ATOM 1839 CG LYS B 27 -0.437 -15.715 0.907 1.00 0.00 C ATOM 1840 CD LYS B 27 0.106 -14.778 -0.197 1.00 0.00 C ATOM 1841 CE LYS B 27 -0.462 -15.166 -1.577 1.00 0.00 C ATOM 1842 NZ LYS B 27 -0.673 -16.634 -1.651 1.00 0.00 N ATOM 0 H LYS B 27 -2.099 -14.444 4.131 1.00 0.00 H new ATOM 0 HA LYS B 27 -1.305 -13.308 1.579 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -2.341 -16.142 1.834 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -2.462 -15.194 0.365 1.00 0.00 H new ATOM 0 HG2 LYS B 27 0.199 -15.654 1.790 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -0.407 -16.749 0.563 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -0.160 -13.746 0.033 1.00 0.00 H new ATOM 0 HD3 LYS B 27 1.195 -14.829 -0.220 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -1.405 -14.647 -1.749 1.00 0.00 H new ATOM 0 HE3 LYS B 27 0.224 -14.850 -2.363 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -0.758 -16.923 -2.646 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 0.135 -17.123 -1.216 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -1.544 -16.886 -1.142 1.00 0.00 H new ATOM 1856 N LEU B 28 -3.895 -12.968 1.294 1.00 0.00 N ATOM 1857 CA LEU B 28 -5.267 -12.555 1.395 1.00 0.00 C ATOM 1858 C LEU B 28 -6.079 -13.064 0.213 1.00 0.00 C ATOM 1859 O LEU B 28 -5.722 -12.848 -0.945 1.00 0.00 O ATOM 1860 CB LEU B 28 -5.339 -11.036 1.530 1.00 0.00 C ATOM 1861 CG LEU B 28 -6.765 -10.583 1.776 1.00 0.00 C ATOM 1862 CD1 LEU B 28 -7.255 -11.126 3.116 1.00 0.00 C ATOM 1863 CD2 LEU B 28 -6.794 -9.060 1.812 1.00 0.00 C ATOM 0 H LEU B 28 -3.428 -12.714 0.424 1.00 0.00 H new ATOM 0 HA LEU B 28 -5.708 -12.995 2.289 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -4.702 -10.709 2.352 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -4.955 -10.567 0.624 1.00 0.00 H new ATOM 0 HG LEU B 28 -7.411 -10.954 0.981 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -8.280 -10.798 3.289 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -7.220 -12.215 3.102 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -6.615 -10.753 3.916 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -7.814 -8.720 1.988 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -6.148 -8.703 2.614 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -6.440 -8.667 0.859 1.00 0.00 H new ATOM 1875 N SER B 29 -7.168 -13.717 0.504 1.00 0.00 N ATOM 1876 CA SER B 29 -8.064 -14.192 -0.518 1.00 0.00 C ATOM 1877 C SER B 29 -9.189 -13.179 -0.689 1.00 0.00 C ATOM 1878 O SER B 29 -9.352 -12.273 0.143 1.00 0.00 O ATOM 1879 CB SER B 29 -8.611 -15.576 -0.171 1.00 0.00 C ATOM 1880 OG SER B 29 -7.586 -16.355 0.444 1.00 0.00 O ATOM 0 H SER B 29 -7.462 -13.936 1.456 1.00 0.00 H new ATOM 0 HA SER B 29 -7.523 -14.294 -1.459 1.00 0.00 H new ATOM 0 HB2 SER B 29 -9.464 -15.483 0.501 1.00 0.00 H new ATOM 0 HB3 SER B 29 -8.968 -16.073 -1.073 1.00 0.00 H new ATOM 0 HG SER B 29 -7.161 -15.833 1.156 1.00 0.00 H new ATOM 1886 N LYS B 30 -9.905 -13.247 -1.786 1.00 0.00 N ATOM 1887 CA LYS B 30 -10.923 -12.244 -2.050 1.00 0.00 C ATOM 1888 C LYS B 30 -12.111 -12.380 -1.116 1.00 0.00 C ATOM 1889 O LYS B 30 -12.972 -11.508 -1.083 1.00 0.00 O ATOM 1890 CB LYS B 30 -11.392 -12.294 -3.504 1.00 0.00 C ATOM 1891 CG LYS B 30 -10.193 -12.345 -4.462 1.00 0.00 C ATOM 1892 CD LYS B 30 -9.209 -11.188 -4.170 1.00 0.00 C ATOM 1893 CE LYS B 30 -9.283 -10.137 -5.280 1.00 0.00 C ATOM 1894 NZ LYS B 30 -9.023 -10.779 -6.574 1.00 0.00 N ATOM 0 H LYS B 30 -9.810 -13.969 -2.501 1.00 0.00 H new ATOM 0 HA LYS B 30 -10.459 -11.275 -1.866 1.00 0.00 H new ATOM 0 HB2 LYS B 30 -12.023 -13.169 -3.657 1.00 0.00 H new ATOM 0 HB3 LYS B 30 -12.002 -11.418 -3.724 1.00 0.00 H new ATOM 0 HG2 LYS B 30 -9.679 -13.301 -4.358 1.00 0.00 H new ATOM 0 HG3 LYS B 30 -10.542 -12.281 -5.493 1.00 0.00 H new ATOM 0 HD2 LYS B 30 -9.449 -10.731 -3.210 1.00 0.00 H new ATOM 0 HD3 LYS B 30 -8.193 -11.576 -4.094 1.00 0.00 H new ATOM 0 HE2 LYS B 30 -10.266 -9.666 -5.286 1.00 0.00 H new ATOM 0 HE3 LYS B 30 -8.553 -9.348 -5.099 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 -8.578 -10.094 -7.218 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 -8.386 -11.590 -6.438 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 -9.920 -11.108 -6.985 1.00 0.00 H new ATOM 1908 N LYS B 31 -12.132 -13.434 -0.310 1.00 0.00 N ATOM 1909 CA LYS B 31 -13.218 -13.600 0.645 1.00 0.00 C ATOM 1910 C LYS B 31 -13.116 -12.568 1.767 1.00 0.00 C ATOM 1911 O LYS B 31 -14.045 -11.786 1.984 1.00 0.00 O ATOM 1912 CB LYS B 31 -13.266 -15.047 1.189 1.00 0.00 C ATOM 1913 CG LYS B 31 -11.990 -15.376 1.982 1.00 0.00 C ATOM 1914 CD LYS B 31 -11.923 -16.891 2.259 1.00 0.00 C ATOM 1915 CE LYS B 31 -11.325 -17.630 1.053 1.00 0.00 C ATOM 1916 NZ LYS B 31 -12.143 -18.832 0.748 1.00 0.00 N ATOM 0 H LYS B 31 -11.427 -14.171 -0.297 1.00 0.00 H new ATOM 0 HA LYS B 31 -14.160 -13.424 0.127 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -14.139 -15.171 1.829 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -13.376 -15.748 0.361 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -11.111 -15.060 1.421 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -11.983 -14.825 2.922 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -11.317 -17.079 3.145 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -12.922 -17.273 2.469 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -11.295 -16.969 0.187 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -10.297 -17.922 1.266 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -11.736 -19.331 -0.069 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -12.149 -19.466 1.572 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -13.117 -18.542 0.527 1.00 0.00 H new ATOM 1930 N GLU B 32 -11.952 -12.503 2.405 1.00 0.00 N ATOM 1931 CA GLU B 32 -11.693 -11.492 3.425 1.00 0.00 C ATOM 1932 C GLU B 32 -11.477 -10.107 2.819 1.00 0.00 C ATOM 1933 O GLU B 32 -11.807 -9.108 3.435 1.00 0.00 O ATOM 1934 CB GLU B 32 -10.457 -11.876 4.251 1.00 0.00 C ATOM 1935 CG GLU B 32 -10.748 -13.089 5.146 1.00 0.00 C ATOM 1936 CD GLU B 32 -11.709 -12.741 6.271 1.00 0.00 C ATOM 1937 OE1 GLU B 32 -11.791 -11.585 6.632 1.00 0.00 O ATOM 1938 OE2 GLU B 32 -12.326 -13.645 6.786 1.00 0.00 O ATOM 0 H GLU B 32 -11.173 -13.138 2.234 1.00 0.00 H new ATOM 0 HA GLU B 32 -12.575 -11.451 4.065 1.00 0.00 H new ATOM 0 HB2 GLU B 32 -9.626 -12.103 3.584 1.00 0.00 H new ATOM 0 HB3 GLU B 32 -10.150 -11.031 4.867 1.00 0.00 H new ATOM 0 HG2 GLU B 32 -11.170 -13.893 4.543 1.00 0.00 H new ATOM 0 HG3 GLU B 32 -9.815 -13.462 5.567 1.00 0.00 H new ATOM 1945 N LEU B 33 -10.752 -10.050 1.703 1.00 0.00 N ATOM 1946 CA LEU B 33 -10.255 -8.763 1.186 1.00 0.00 C ATOM 1947 C LEU B 33 -11.368 -7.777 0.898 1.00 0.00 C ATOM 1948 O LEU B 33 -11.312 -6.629 1.356 1.00 0.00 O ATOM 1949 CB LEU B 33 -9.409 -8.996 -0.085 1.00 0.00 C ATOM 1950 CG LEU B 33 -8.940 -7.665 -0.732 1.00 0.00 C ATOM 1951 CD1 LEU B 33 -10.060 -7.068 -1.591 1.00 0.00 C ATOM 1952 CD2 LEU B 33 -8.502 -6.643 0.332 1.00 0.00 C ATOM 0 H LEU B 33 -10.495 -10.863 1.142 1.00 0.00 H new ATOM 0 HA LEU B 33 -9.636 -8.322 1.968 1.00 0.00 H new ATOM 0 HB2 LEU B 33 -8.538 -9.602 0.167 1.00 0.00 H new ATOM 0 HB3 LEU B 33 -9.994 -9.563 -0.809 1.00 0.00 H new ATOM 0 HG LEU B 33 -8.079 -7.891 -1.362 1.00 0.00 H new ATOM 0 HD11 LEU B 33 -9.717 -6.135 -2.039 1.00 0.00 H new ATOM 0 HD12 LEU B 33 -10.328 -7.771 -2.379 1.00 0.00 H new ATOM 0 HD13 LEU B 33 -10.932 -6.872 -0.967 1.00 0.00 H new ATOM 0 HD21 LEU B 33 -8.180 -5.724 -0.157 1.00 0.00 H new ATOM 0 HD22 LEU B 33 -9.339 -6.427 0.995 1.00 0.00 H new ATOM 0 HD23 LEU B 33 -7.676 -7.054 0.912 1.00 0.00 H new ATOM 1964 N LYS B 34 -12.391 -8.204 0.193 1.00 0.00 N ATOM 1965 CA LYS B 34 -13.477 -7.291 -0.098 1.00 0.00 C ATOM 1966 C LYS B 34 -14.193 -6.887 1.179 1.00 0.00 C ATOM 1967 O LYS B 34 -14.473 -5.702 1.397 1.00 0.00 O ATOM 1968 CB LYS B 34 -14.427 -7.839 -1.175 1.00 0.00 C ATOM 1969 CG LYS B 34 -15.044 -9.175 -0.757 1.00 0.00 C ATOM 1970 CD LYS B 34 -15.832 -9.738 -1.949 1.00 0.00 C ATOM 1971 CE LYS B 34 -16.406 -11.109 -1.599 1.00 0.00 C ATOM 1972 NZ LYS B 34 -17.642 -10.937 -0.798 1.00 0.00 N ATOM 0 H LYS B 34 -12.496 -9.147 -0.180 1.00 0.00 H new ATOM 0 HA LYS B 34 -13.050 -6.385 -0.527 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -15.220 -7.115 -1.364 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -13.882 -7.966 -2.110 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -14.265 -9.874 -0.453 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -15.701 -9.037 0.101 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -16.638 -9.055 -2.217 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -15.181 -9.819 -2.819 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -16.625 -11.667 -2.510 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -15.674 -11.689 -1.038 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -18.034 -11.870 -0.559 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -17.420 -10.421 0.077 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -18.341 -10.399 -1.349 1.00 0.00 H new ATOM 1986 N GLU B 35 -14.339 -7.840 2.087 1.00 0.00 N ATOM 1987 CA GLU B 35 -14.889 -7.546 3.394 1.00 0.00 C ATOM 1988 C GLU B 35 -13.937 -6.630 4.149 1.00 0.00 C ATOM 1989 O GLU B 35 -14.348 -5.612 4.713 1.00 0.00 O ATOM 1990 CB GLU B 35 -15.061 -8.844 4.189 1.00 0.00 C ATOM 1991 CG GLU B 35 -16.080 -9.759 3.497 1.00 0.00 C ATOM 1992 CD GLU B 35 -17.460 -9.129 3.496 1.00 0.00 C ATOM 1993 OE1 GLU B 35 -17.696 -8.249 4.301 1.00 0.00 O ATOM 1994 OE2 GLU B 35 -18.268 -9.534 2.687 1.00 0.00 O ATOM 0 H GLU B 35 -14.085 -8.817 1.941 1.00 0.00 H new ATOM 0 HA GLU B 35 -15.857 -7.060 3.272 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -14.102 -9.355 4.276 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -15.394 -8.617 5.202 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -15.764 -9.953 2.472 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -16.116 -10.722 4.007 1.00 0.00 H new ATOM 2001 N LEU B 36 -12.668 -6.976 4.115 1.00 0.00 N ATOM 2002 CA LEU B 36 -11.622 -6.215 4.778 1.00 0.00 C ATOM 2003 C LEU B 36 -11.527 -4.804 4.224 1.00 0.00 C ATOM 2004 O LEU B 36 -11.516 -3.830 4.987 1.00 0.00 O ATOM 2005 CB LEU B 36 -10.280 -6.985 4.620 1.00 0.00 C ATOM 2006 CG LEU B 36 -9.056 -6.055 4.628 1.00 0.00 C ATOM 2007 CD1 LEU B 36 -8.976 -5.246 5.922 1.00 0.00 C ATOM 2008 CD2 LEU B 36 -7.787 -6.900 4.484 1.00 0.00 C ATOM 0 H LEU B 36 -12.326 -7.801 3.622 1.00 0.00 H new ATOM 0 HA LEU B 36 -11.858 -6.112 5.837 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -10.185 -7.710 5.428 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -10.297 -7.548 3.687 1.00 0.00 H new ATOM 0 HG LEU B 36 -9.150 -5.357 3.796 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -8.099 -4.600 5.893 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -9.873 -4.636 6.026 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -8.899 -5.925 6.771 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -6.913 -6.248 4.489 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -7.721 -7.602 5.316 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -7.822 -7.453 3.545 1.00 0.00 H new ATOM 2020 N LEU B 37 -11.502 -4.688 2.913 1.00 0.00 N ATOM 2021 CA LEU B 37 -11.397 -3.382 2.287 1.00 0.00 C ATOM 2022 C LEU B 37 -12.611 -2.520 2.608 1.00 0.00 C ATOM 2023 O LEU B 37 -12.469 -1.380 3.051 1.00 0.00 O ATOM 2024 CB LEU B 37 -11.169 -3.529 0.762 1.00 0.00 C ATOM 2025 CG LEU B 37 -11.263 -2.179 -0.003 1.00 0.00 C ATOM 2026 CD1 LEU B 37 -12.723 -1.834 -0.305 1.00 0.00 C ATOM 2027 CD2 LEU B 37 -10.606 -1.024 0.770 1.00 0.00 C ATOM 0 H LEU B 37 -11.552 -5.473 2.263 1.00 0.00 H new ATOM 0 HA LEU B 37 -10.529 -2.867 2.699 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -10.187 -3.970 0.589 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -11.906 -4.222 0.356 1.00 0.00 H new ATOM 0 HG LEU B 37 -10.717 -2.306 -0.938 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -12.770 -0.886 -0.841 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -13.163 -2.620 -0.919 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -13.278 -1.750 0.629 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -10.698 -0.103 0.195 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -11.102 -0.902 1.733 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -9.551 -1.248 0.931 1.00 0.00 H new ATOM 2039 N GLN B 38 -13.806 -3.086 2.480 1.00 0.00 N ATOM 2040 CA GLN B 38 -15.003 -2.334 2.818 1.00 0.00 C ATOM 2041 C GLN B 38 -15.062 -2.056 4.308 1.00 0.00 C ATOM 2042 O GLN B 38 -15.416 -0.952 4.736 1.00 0.00 O ATOM 2043 CB GLN B 38 -16.288 -3.033 2.316 1.00 0.00 C ATOM 2044 CG GLN B 38 -16.676 -4.220 3.220 1.00 0.00 C ATOM 2045 CD GLN B 38 -17.983 -4.842 2.721 1.00 0.00 C ATOM 2046 OE1 GLN B 38 -18.827 -4.142 2.147 1.00 0.00 O ATOM 2047 NE2 GLN B 38 -18.221 -6.096 2.925 1.00 0.00 N ATOM 0 H GLN B 38 -13.968 -4.038 2.153 1.00 0.00 H new ATOM 0 HA GLN B 38 -14.947 -1.377 2.300 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -17.107 -2.314 2.287 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -16.137 -3.386 1.296 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -15.882 -4.967 3.217 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -16.792 -3.883 4.250 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -17.528 -6.676 3.398 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -19.102 -6.505 2.613 1.00 0.00 H new ATOM 2056 N THR B 39 -14.729 -3.063 5.089 1.00 0.00 N ATOM 2057 CA THR B 39 -14.770 -2.960 6.529 1.00 0.00 C ATOM 2058 C THR B 39 -13.803 -1.909 7.071 1.00 0.00 C ATOM 2059 O THR B 39 -14.194 -1.063 7.885 1.00 0.00 O ATOM 2060 CB THR B 39 -14.482 -4.339 7.133 1.00 0.00 C ATOM 2061 OG1 THR B 39 -15.517 -5.246 6.756 1.00 0.00 O ATOM 2062 CG2 THR B 39 -14.350 -4.271 8.649 1.00 0.00 C ATOM 0 H THR B 39 -14.423 -3.972 4.743 1.00 0.00 H new ATOM 0 HA THR B 39 -15.767 -2.628 6.820 1.00 0.00 H new ATOM 0 HB THR B 39 -13.528 -4.695 6.744 1.00 0.00 H new ATOM 0 HG1 THR B 39 -15.449 -5.440 5.798 1.00 0.00 H new ATOM 0 HG21 THR B 39 -14.146 -5.267 9.042 1.00 0.00 H new ATOM 0 HG22 THR B 39 -13.531 -3.602 8.913 1.00 0.00 H new ATOM 0 HG23 THR B 39 -15.278 -3.895 9.079 1.00 0.00 H new ATOM 2070 N GLU B 40 -12.547 -1.994 6.674 1.00 0.00 N ATOM 2071 CA GLU B 40 -11.540 -1.087 7.204 1.00 0.00 C ATOM 2072 C GLU B 40 -11.571 0.285 6.557 1.00 0.00 C ATOM 2073 O GLU B 40 -11.334 1.300 7.218 1.00 0.00 O ATOM 2074 CB GLU B 40 -10.146 -1.707 7.133 1.00 0.00 C ATOM 2075 CG GLU B 40 -10.090 -2.925 8.071 1.00 0.00 C ATOM 2076 CD GLU B 40 -10.328 -2.512 9.519 1.00 0.00 C ATOM 2077 OE1 GLU B 40 -10.140 -1.356 9.838 1.00 0.00 O ATOM 2078 OE2 GLU B 40 -10.716 -3.354 10.287 1.00 0.00 O ATOM 0 H GLU B 40 -12.200 -2.672 5.995 1.00 0.00 H new ATOM 0 HA GLU B 40 -11.791 -0.930 8.253 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -9.920 -2.009 6.110 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -9.393 -0.974 7.423 1.00 0.00 H new ATOM 0 HG2 GLU B 40 -10.841 -3.655 7.769 1.00 0.00 H new ATOM 0 HG3 GLU B 40 -9.119 -3.412 7.983 1.00 0.00 H new ATOM 2085 N LEU B 41 -11.791 0.316 5.256 1.00 0.00 N ATOM 2086 CA LEU B 41 -11.758 1.568 4.508 1.00 0.00 C ATOM 2087 C LEU B 41 -13.154 2.065 4.187 1.00 0.00 C ATOM 2088 O LEU B 41 -13.385 2.665 3.132 1.00 0.00 O ATOM 2089 CB LEU B 41 -10.940 1.398 3.221 1.00 0.00 C ATOM 2090 CG LEU B 41 -9.458 1.675 3.495 1.00 0.00 C ATOM 2091 CD1 LEU B 41 -8.823 0.475 4.204 1.00 0.00 C ATOM 2092 CD2 LEU B 41 -8.730 1.929 2.172 1.00 0.00 C ATOM 0 H LEU B 41 -11.995 -0.509 4.691 1.00 0.00 H new ATOM 0 HA LEU B 41 -11.278 2.318 5.137 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -11.063 0.386 2.834 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -11.309 2.079 2.454 1.00 0.00 H new ATOM 0 HG LEU B 41 -9.373 2.554 4.134 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -7.770 0.681 4.395 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -9.335 0.298 5.150 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -8.911 -0.409 3.573 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -7.676 2.126 2.369 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -8.822 1.052 1.532 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -9.173 2.791 1.673 1.00 0.00 H new ATOM 2104 N SER B 42 -14.092 1.811 5.082 1.00 0.00 N ATOM 2105 CA SER B 42 -15.474 2.209 4.860 1.00 0.00 C ATOM 2106 C SER B 42 -15.571 3.684 4.476 1.00 0.00 C ATOM 2107 O SER B 42 -16.348 4.051 3.586 1.00 0.00 O ATOM 2108 CB SER B 42 -16.306 1.937 6.111 1.00 0.00 C ATOM 2109 OG SER B 42 -16.260 0.539 6.421 1.00 0.00 O ATOM 0 H SER B 42 -13.925 1.333 5.967 1.00 0.00 H new ATOM 0 HA SER B 42 -15.866 1.618 4.032 1.00 0.00 H new ATOM 0 HB2 SER B 42 -15.923 2.519 6.949 1.00 0.00 H new ATOM 0 HB3 SER B 42 -17.337 2.251 5.950 1.00 0.00 H new ATOM 0 HG SER B 42 -16.245 0.020 5.590 1.00 0.00 H new ATOM 2115 N GLY B 43 -14.772 4.520 5.120 1.00 0.00 N ATOM 2116 CA GLY B 43 -14.772 5.946 4.809 1.00 0.00 C ATOM 2117 C GLY B 43 -14.277 6.189 3.388 1.00 0.00 C ATOM 2118 O GLY B 43 -14.957 6.842 2.578 1.00 0.00 O ATOM 0 H GLY B 43 -14.121 4.243 5.854 1.00 0.00 H new ATOM 0 HA2 GLY B 43 -15.779 6.348 4.922 1.00 0.00 H new ATOM 0 HA3 GLY B 43 -14.136 6.477 5.517 1.00 0.00 H new ATOM 2122 N PHE B 44 -13.137 5.583 3.056 1.00 0.00 N ATOM 2123 CA PHE B 44 -12.578 5.695 1.713 1.00 0.00 C ATOM 2124 C PHE B 44 -13.509 5.059 0.723 1.00 0.00 C ATOM 2125 O PHE B 44 -13.809 5.622 -0.332 1.00 0.00 O ATOM 2126 CB PHE B 44 -11.207 5.011 1.625 1.00 0.00 C ATOM 2127 CG PHE B 44 -10.170 5.829 2.348 1.00 0.00 C ATOM 2128 CD1 PHE B 44 -9.690 7.010 1.782 1.00 0.00 C ATOM 2129 CD2 PHE B 44 -9.681 5.401 3.578 1.00 0.00 C ATOM 2130 CE1 PHE B 44 -8.722 7.767 2.452 1.00 0.00 C ATOM 2131 CE2 PHE B 44 -8.711 6.154 4.246 1.00 0.00 C ATOM 2132 CZ PHE B 44 -8.233 7.338 3.684 1.00 0.00 C ATOM 0 H PHE B 44 -12.586 5.012 3.697 1.00 0.00 H new ATOM 0 HA PHE B 44 -12.455 6.754 1.485 1.00 0.00 H new ATOM 0 HB2 PHE B 44 -11.262 4.013 2.060 1.00 0.00 H new ATOM 0 HB3 PHE B 44 -10.920 4.888 0.581 1.00 0.00 H new ATOM 0 HD1 PHE B 44 -10.066 7.341 0.825 1.00 0.00 H new ATOM 0 HD2 PHE B 44 -10.051 4.486 4.017 1.00 0.00 H new ATOM 0 HE1 PHE B 44 -8.354 8.683 2.014 1.00 0.00 H new ATOM 0 HE2 PHE B 44 -8.331 5.818 5.199 1.00 0.00 H new ATOM 0 HZ PHE B 44 -7.486 7.920 4.203 1.00 0.00 H new ATOM 2142 N LEU B 45 -14.017 3.906 1.094 1.00 0.00 N ATOM 2143 CA LEU B 45 -14.952 3.195 0.262 1.00 0.00 C ATOM 2144 C LEU B 45 -16.199 4.022 0.030 1.00 0.00 C ATOM 2145 O LEU B 45 -16.591 4.245 -1.110 1.00 0.00 O ATOM 2146 CB LEU B 45 -15.288 1.831 0.911 1.00 0.00 C ATOM 2147 CG LEU B 45 -16.697 1.370 0.519 1.00 0.00 C ATOM 2148 CD1 LEU B 45 -16.827 1.252 -0.998 1.00 0.00 C ATOM 2149 CD2 LEU B 45 -16.988 0.014 1.158 1.00 0.00 C ATOM 0 H LEU B 45 -13.794 3.440 1.974 1.00 0.00 H new ATOM 0 HA LEU B 45 -14.500 3.012 -0.713 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -14.557 1.085 0.598 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -15.216 1.912 1.996 1.00 0.00 H new ATOM 0 HG LEU B 45 -17.413 2.110 0.875 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -17.835 0.924 -1.252 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -16.635 2.222 -1.456 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -16.104 0.526 -1.370 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -17.990 -0.312 0.879 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -16.258 -0.717 0.810 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -16.924 0.102 2.243 1.00 0.00 H new ATOM 2161 N ASP B 46 -16.750 4.578 1.093 1.00 0.00 N ATOM 2162 CA ASP B 46 -17.934 5.411 0.965 1.00 0.00 C ATOM 2163 C ASP B 46 -17.662 6.630 0.108 1.00 0.00 C ATOM 2164 O ASP B 46 -18.465 6.983 -0.762 1.00 0.00 O ATOM 2165 CB ASP B 46 -18.455 5.827 2.329 1.00 0.00 C ATOM 2166 CG ASP B 46 -19.634 6.765 2.179 1.00 0.00 C ATOM 2167 OD1 ASP B 46 -20.680 6.311 1.771 1.00 0.00 O ATOM 2168 OD2 ASP B 46 -19.476 7.928 2.478 1.00 0.00 O ATOM 0 H ASP B 46 -16.402 4.471 2.046 1.00 0.00 H new ATOM 0 HA ASP B 46 -18.701 4.816 0.470 1.00 0.00 H new ATOM 0 HB2 ASP B 46 -18.753 4.945 2.896 1.00 0.00 H new ATOM 0 HB3 ASP B 46 -17.662 6.316 2.895 1.00 0.00 H new ATOM 2173 N ALA B 47 -16.510 7.237 0.312 1.00 0.00 N ATOM 2174 CA ALA B 47 -16.112 8.389 -0.480 1.00 0.00 C ATOM 2175 C ALA B 47 -15.936 7.996 -1.935 1.00 0.00 C ATOM 2176 O ALA B 47 -16.108 8.818 -2.841 1.00 0.00 O ATOM 2177 CB ALA B 47 -14.805 8.980 0.050 1.00 0.00 C ATOM 0 H ALA B 47 -15.831 6.954 1.019 1.00 0.00 H new ATOM 0 HA ALA B 47 -16.899 9.140 -0.404 1.00 0.00 H new ATOM 0 HB1 ALA B 47 -14.523 9.841 -0.556 1.00 0.00 H new ATOM 0 HB2 ALA B 47 -14.941 9.293 1.085 1.00 0.00 H new ATOM 0 HB3 ALA B 47 -14.018 8.227 -0.001 1.00 0.00 H new ATOM 2183 N GLN B 48 -15.446 6.788 -2.139 1.00 0.00 N ATOM 2184 CA GLN B 48 -15.079 6.304 -3.465 1.00 0.00 C ATOM 2185 C GLN B 48 -16.222 5.610 -4.224 1.00 0.00 C ATOM 2186 O GLN B 48 -16.000 5.109 -5.318 1.00 0.00 O ATOM 2187 CB GLN B 48 -13.858 5.374 -3.362 1.00 0.00 C ATOM 2188 CG GLN B 48 -12.608 6.197 -3.018 1.00 0.00 C ATOM 2189 CD GLN B 48 -12.320 7.169 -4.149 1.00 0.00 C ATOM 2190 OE1 GLN B 48 -12.657 6.853 -5.358 1.00 0.00 O flip ATOM 2191 NE2 GLN B 48 -11.778 8.239 -3.924 1.00 0.00 N flip ATOM 0 H GLN B 48 -15.289 6.111 -1.392 1.00 0.00 H new ATOM 0 HA GLN B 48 -14.833 7.188 -4.054 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -14.029 4.617 -2.596 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -13.710 4.847 -4.304 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -12.762 6.741 -2.086 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -11.755 5.537 -2.865 1.00 0.00 H new ATOM 0 HE21 GLN B 48 -11.513 8.486 -2.970 1.00 0.00 H new ATOM 0 HE22 GLN B 48 -11.590 8.886 -4.690 1.00 0.00 H new ATOM 2200 N LYS B 49 -17.393 5.479 -3.616 1.00 0.00 N ATOM 2201 CA LYS B 49 -18.457 4.661 -4.243 1.00 0.00 C ATOM 2202 C LYS B 49 -18.888 5.172 -5.618 1.00 0.00 C ATOM 2203 O LYS B 49 -19.088 4.373 -6.533 1.00 0.00 O ATOM 2204 CB LYS B 49 -19.701 4.512 -3.344 1.00 0.00 C ATOM 2205 CG LYS B 49 -19.363 3.649 -2.133 1.00 0.00 C ATOM 2206 CD LYS B 49 -20.619 3.377 -1.290 1.00 0.00 C ATOM 2207 CE LYS B 49 -21.085 4.667 -0.605 1.00 0.00 C ATOM 2208 NZ LYS B 49 -21.655 4.349 0.730 1.00 0.00 N ATOM 0 H LYS B 49 -17.639 5.905 -2.723 1.00 0.00 H new ATOM 0 HA LYS B 49 -17.998 3.681 -4.376 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -20.045 5.494 -3.018 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -20.517 4.060 -3.908 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -18.929 2.705 -2.463 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -18.611 4.149 -1.523 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -21.414 2.986 -1.924 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -20.405 2.615 -0.540 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -20.247 5.356 -0.498 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -21.833 5.167 -1.220 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -21.443 5.123 1.391 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -22.686 4.235 0.649 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -21.236 3.466 1.085 1.00 0.00 H new ATOM 2222 N ASP B 50 -19.054 6.479 -5.769 1.00 0.00 N ATOM 2223 CA ASP B 50 -19.490 7.026 -7.065 1.00 0.00 C ATOM 2224 C ASP B 50 -18.309 7.277 -7.988 1.00 0.00 C ATOM 2225 O ASP B 50 -18.482 7.658 -9.148 1.00 0.00 O ATOM 2226 CB ASP B 50 -20.330 8.309 -6.898 1.00 0.00 C ATOM 2227 CG ASP B 50 -21.055 8.647 -8.205 1.00 0.00 C ATOM 2228 OD1 ASP B 50 -21.291 7.745 -8.985 1.00 0.00 O ATOM 2229 OD2 ASP B 50 -21.377 9.798 -8.402 1.00 0.00 O ATOM 0 H ASP B 50 -18.900 7.172 -5.037 1.00 0.00 H new ATOM 0 HA ASP B 50 -20.128 6.271 -7.525 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -21.056 8.174 -6.096 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -19.685 9.138 -6.608 1.00 0.00 H new ATOM 2234 N VAL B 51 -17.118 7.068 -7.477 1.00 0.00 N ATOM 2235 CA VAL B 51 -15.905 7.294 -8.246 1.00 0.00 C ATOM 2236 C VAL B 51 -15.597 6.078 -9.132 1.00 0.00 C ATOM 2237 O VAL B 51 -15.629 4.940 -8.667 1.00 0.00 O ATOM 2238 CB VAL B 51 -14.736 7.590 -7.298 1.00 0.00 C ATOM 2239 CG1 VAL B 51 -13.461 7.859 -8.099 1.00 0.00 C ATOM 2240 CG2 VAL B 51 -15.066 8.815 -6.434 1.00 0.00 C ATOM 0 H VAL B 51 -16.957 6.739 -6.525 1.00 0.00 H new ATOM 0 HA VAL B 51 -16.052 8.156 -8.897 1.00 0.00 H new ATOM 0 HB VAL B 51 -14.577 6.724 -6.656 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -12.639 8.068 -7.415 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -13.218 6.984 -8.702 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -13.616 8.718 -8.752 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -14.233 9.021 -5.762 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -15.236 9.679 -7.077 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -15.964 8.616 -5.848 1.00 0.00 H new ATOM 2250 N ASP B 52 -15.278 6.338 -10.396 1.00 0.00 N ATOM 2251 CA ASP B 52 -14.990 5.274 -11.368 1.00 0.00 C ATOM 2252 C ASP B 52 -13.846 4.394 -10.893 1.00 0.00 C ATOM 2253 O ASP B 52 -13.872 3.174 -11.070 1.00 0.00 O ATOM 2254 CB ASP B 52 -14.631 5.889 -12.725 1.00 0.00 C ATOM 2255 CG ASP B 52 -14.294 4.812 -13.735 1.00 0.00 C ATOM 2256 OD1 ASP B 52 -15.164 4.044 -14.070 1.00 0.00 O ATOM 2257 OD2 ASP B 52 -13.164 4.783 -14.183 1.00 0.00 O ATOM 0 H ASP B 52 -15.211 7.281 -10.779 1.00 0.00 H new ATOM 0 HA ASP B 52 -15.883 4.657 -11.468 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -15.466 6.487 -13.090 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -13.782 6.563 -12.610 1.00 0.00 H new ATOM 2262 N ALA B 53 -12.828 5.016 -10.323 1.00 0.00 N ATOM 2263 CA ALA B 53 -11.648 4.290 -9.881 1.00 0.00 C ATOM 2264 C ALA B 53 -12.012 3.145 -8.952 1.00 0.00 C ATOM 2265 O ALA B 53 -11.345 2.114 -8.956 1.00 0.00 O ATOM 2266 CB ALA B 53 -10.654 5.223 -9.187 1.00 0.00 C ATOM 0 H ALA B 53 -12.794 6.022 -10.155 1.00 0.00 H new ATOM 0 HA ALA B 53 -11.178 3.874 -10.772 1.00 0.00 H new ATOM 0 HB1 ALA B 53 -9.782 4.653 -8.867 1.00 0.00 H new ATOM 0 HB2 ALA B 53 -10.343 6.004 -9.881 1.00 0.00 H new ATOM 0 HB3 ALA B 53 -11.128 5.678 -8.318 1.00 0.00 H new ATOM 2272 N VAL B 54 -13.085 3.295 -8.185 1.00 0.00 N ATOM 2273 CA VAL B 54 -13.471 2.223 -7.282 1.00 0.00 C ATOM 2274 C VAL B 54 -13.751 0.956 -8.077 1.00 0.00 C ATOM 2275 O VAL B 54 -13.222 -0.114 -7.757 1.00 0.00 O ATOM 2276 CB VAL B 54 -14.677 2.625 -6.389 1.00 0.00 C ATOM 2277 CG1 VAL B 54 -16.014 2.377 -7.102 1.00 0.00 C ATOM 2278 CG2 VAL B 54 -14.654 1.821 -5.079 1.00 0.00 C ATOM 0 H VAL B 54 -13.685 4.120 -8.169 1.00 0.00 H new ATOM 0 HA VAL B 54 -12.641 2.028 -6.603 1.00 0.00 H new ATOM 0 HB VAL B 54 -14.587 3.691 -6.178 1.00 0.00 H new ATOM 0 HG11 VAL B 54 -16.835 2.670 -6.448 1.00 0.00 H new ATOM 0 HG12 VAL B 54 -16.053 2.966 -8.018 1.00 0.00 H new ATOM 0 HG13 VAL B 54 -16.105 1.319 -7.347 1.00 0.00 H new ATOM 0 HG21 VAL B 54 -15.503 2.110 -4.460 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -14.715 0.756 -5.304 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -13.728 2.026 -4.543 1.00 0.00 H new ATOM 2288 N ASP B 55 -14.478 1.098 -9.181 1.00 0.00 N ATOM 2289 CA ASP B 55 -14.725 -0.036 -10.049 1.00 0.00 C ATOM 2290 C ASP B 55 -13.425 -0.537 -10.596 1.00 0.00 C ATOM 2291 O ASP B 55 -13.174 -1.728 -10.635 1.00 0.00 O ATOM 2292 CB ASP B 55 -15.615 0.361 -11.231 1.00 0.00 C ATOM 2293 CG ASP B 55 -16.098 -0.890 -11.947 1.00 0.00 C ATOM 2294 OD1 ASP B 55 -16.907 -1.600 -11.380 1.00 0.00 O ATOM 2295 OD2 ASP B 55 -15.668 -1.120 -13.058 1.00 0.00 O ATOM 0 H ASP B 55 -14.898 1.975 -9.488 1.00 0.00 H new ATOM 0 HA ASP B 55 -15.224 -0.807 -9.462 1.00 0.00 H new ATOM 0 HB2 ASP B 55 -16.467 0.943 -10.879 1.00 0.00 H new ATOM 0 HB3 ASP B 55 -15.059 0.996 -11.921 1.00 0.00 H new ATOM 2300 N LYS B 56 -12.637 0.388 -11.101 1.00 0.00 N ATOM 2301 CA LYS B 56 -11.407 0.052 -11.783 1.00 0.00 C ATOM 2302 C LYS B 56 -10.413 -0.592 -10.826 1.00 0.00 C ATOM 2303 O LYS B 56 -9.805 -1.614 -11.145 1.00 0.00 O ATOM 2304 CB LYS B 56 -10.799 1.304 -12.420 1.00 0.00 C ATOM 2305 CG LYS B 56 -11.838 1.986 -13.334 1.00 0.00 C ATOM 2306 CD LYS B 56 -12.292 1.030 -14.438 1.00 0.00 C ATOM 2307 CE LYS B 56 -13.294 1.747 -15.365 1.00 0.00 C ATOM 2308 NZ LYS B 56 -12.724 3.041 -15.812 1.00 0.00 N ATOM 0 H LYS B 56 -12.830 1.388 -11.051 1.00 0.00 H new ATOM 0 HA LYS B 56 -11.636 -0.668 -12.568 1.00 0.00 H new ATOM 0 HB2 LYS B 56 -10.475 1.997 -11.643 1.00 0.00 H new ATOM 0 HB3 LYS B 56 -9.914 1.036 -12.997 1.00 0.00 H new ATOM 0 HG2 LYS B 56 -12.698 2.303 -12.744 1.00 0.00 H new ATOM 0 HG3 LYS B 56 -11.407 2.884 -13.777 1.00 0.00 H new ATOM 0 HD2 LYS B 56 -11.431 0.687 -15.012 1.00 0.00 H new ATOM 0 HD3 LYS B 56 -12.755 0.146 -14.000 1.00 0.00 H new ATOM 0 HE2 LYS B 56 -13.519 1.120 -16.228 1.00 0.00 H new ATOM 0 HE3 LYS B 56 -14.234 1.915 -14.840 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 -13.260 3.392 -16.631 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 -12.783 3.732 -15.037 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 -11.729 2.907 -16.082 1.00 0.00 H new ATOM 2322 N VAL B 57 -10.316 -0.043 -9.629 1.00 0.00 N ATOM 2323 CA VAL B 57 -9.445 -0.602 -8.613 1.00 0.00 C ATOM 2324 C VAL B 57 -9.995 -1.945 -8.199 1.00 0.00 C ATOM 2325 O VAL B 57 -9.282 -2.955 -8.163 1.00 0.00 O ATOM 2326 CB VAL B 57 -9.346 0.350 -7.404 1.00 0.00 C ATOM 2327 CG1 VAL B 57 -8.473 -0.277 -6.321 1.00 0.00 C ATOM 2328 CG2 VAL B 57 -8.721 1.685 -7.837 1.00 0.00 C ATOM 0 H VAL B 57 -10.829 0.789 -9.337 1.00 0.00 H new ATOM 0 HA VAL B 57 -8.439 -0.728 -9.013 1.00 0.00 H new ATOM 0 HB VAL B 57 -10.349 0.525 -7.014 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -8.407 0.400 -5.470 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -8.913 -1.221 -6.000 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -7.474 -0.459 -6.718 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -8.655 2.352 -6.977 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -7.722 1.507 -8.236 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -9.342 2.145 -8.606 1.00 0.00 H new ATOM 2338 N MET B 58 -11.295 -1.968 -8.002 1.00 0.00 N ATOM 2339 CA MET B 58 -11.991 -3.184 -7.699 1.00 0.00 C ATOM 2340 C MET B 58 -11.842 -4.170 -8.851 1.00 0.00 C ATOM 2341 O MET B 58 -11.631 -5.363 -8.634 1.00 0.00 O ATOM 2342 CB MET B 58 -13.472 -2.870 -7.428 1.00 0.00 C ATOM 2343 CG MET B 58 -14.225 -4.149 -7.117 1.00 0.00 C ATOM 2344 SD MET B 58 -15.954 -3.761 -6.733 1.00 0.00 S ATOM 2345 CE MET B 58 -16.451 -3.193 -8.380 1.00 0.00 C ATOM 0 H MET B 58 -11.892 -1.142 -8.049 1.00 0.00 H new ATOM 0 HA MET B 58 -11.563 -3.641 -6.807 1.00 0.00 H new ATOM 0 HB2 MET B 58 -13.558 -2.175 -6.592 1.00 0.00 H new ATOM 0 HB3 MET B 58 -13.913 -2.380 -8.296 1.00 0.00 H new ATOM 0 HG2 MET B 58 -14.175 -4.828 -7.968 1.00 0.00 H new ATOM 0 HG3 MET B 58 -13.761 -4.660 -6.274 1.00 0.00 H new ATOM 0 HE1 MET B 58 -16.621 -2.117 -8.358 1.00 0.00 H new ATOM 0 HE2 MET B 58 -15.662 -3.421 -9.097 1.00 0.00 H new ATOM 0 HE3 MET B 58 -17.369 -3.700 -8.678 1.00 0.00 H new ATOM 2355 N LYS B 59 -11.921 -3.661 -10.068 1.00 0.00 N ATOM 2356 CA LYS B 59 -11.794 -4.489 -11.259 1.00 0.00 C ATOM 2357 C LYS B 59 -10.436 -5.153 -11.296 1.00 0.00 C ATOM 2358 O LYS B 59 -10.326 -6.356 -11.535 1.00 0.00 O ATOM 2359 CB LYS B 59 -11.985 -3.652 -12.528 1.00 0.00 C ATOM 2360 CG LYS B 59 -12.315 -4.580 -13.700 1.00 0.00 C ATOM 2361 CD LYS B 59 -13.839 -4.761 -13.808 1.00 0.00 C ATOM 2362 CE LYS B 59 -14.433 -3.670 -14.721 1.00 0.00 C ATOM 2363 NZ LYS B 59 -15.767 -3.254 -14.211 1.00 0.00 N ATOM 0 H LYS B 59 -12.074 -2.671 -10.260 1.00 0.00 H new ATOM 0 HA LYS B 59 -12.570 -5.253 -11.220 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -12.788 -2.930 -12.384 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -11.080 -3.084 -12.743 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -11.922 -4.163 -14.628 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -11.834 -5.547 -13.556 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -14.069 -5.748 -14.209 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -14.292 -4.705 -12.818 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -13.764 -2.810 -14.758 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -14.525 -4.046 -15.740 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -16.489 -3.437 -14.937 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -15.995 -3.795 -13.353 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -15.751 -2.239 -13.986 1.00 0.00 H new ATOM 2377 N GLU B 60 -9.405 -4.379 -11.012 1.00 0.00 N ATOM 2378 CA GLU B 60 -8.062 -4.917 -10.977 1.00 0.00 C ATOM 2379 C GLU B 60 -8.000 -6.053 -9.978 1.00 0.00 C ATOM 2380 O GLU B 60 -7.574 -7.173 -10.310 1.00 0.00 O ATOM 2381 CB GLU B 60 -7.084 -3.814 -10.586 1.00 0.00 C ATOM 2382 CG GLU B 60 -6.905 -2.844 -11.756 1.00 0.00 C ATOM 2383 CD GLU B 60 -6.168 -3.535 -12.886 1.00 0.00 C ATOM 2384 OE1 GLU B 60 -5.057 -3.972 -12.653 1.00 0.00 O ATOM 2385 OE2 GLU B 60 -6.727 -3.646 -13.952 1.00 0.00 O ATOM 0 H GLU B 60 -9.473 -3.383 -10.804 1.00 0.00 H new ATOM 0 HA GLU B 60 -7.791 -5.298 -11.962 1.00 0.00 H new ATOM 0 HB2 GLU B 60 -7.455 -3.279 -9.711 1.00 0.00 H new ATOM 0 HB3 GLU B 60 -6.123 -4.248 -10.311 1.00 0.00 H new ATOM 0 HG2 GLU B 60 -7.877 -2.495 -12.103 1.00 0.00 H new ATOM 0 HG3 GLU B 60 -6.349 -1.965 -11.430 1.00 0.00 H new ATOM 2392 N LEU B 61 -8.553 -5.818 -8.802 1.00 0.00 N ATOM 2393 CA LEU B 61 -8.677 -6.876 -7.819 1.00 0.00 C ATOM 2394 C LEU B 61 -9.593 -7.973 -8.346 1.00 0.00 C ATOM 2395 O LEU B 61 -9.288 -9.158 -8.221 1.00 0.00 O ATOM 2396 CB LEU B 61 -9.216 -6.333 -6.491 1.00 0.00 C ATOM 2397 CG LEU B 61 -8.080 -5.724 -5.634 1.00 0.00 C ATOM 2398 CD1 LEU B 61 -7.299 -6.830 -4.912 1.00 0.00 C ATOM 2399 CD2 LEU B 61 -7.119 -4.896 -6.499 1.00 0.00 C ATOM 0 H LEU B 61 -8.920 -4.913 -8.507 1.00 0.00 H new ATOM 0 HA LEU B 61 -7.686 -7.292 -7.639 1.00 0.00 H new ATOM 0 HB2 LEU B 61 -9.975 -5.575 -6.686 1.00 0.00 H new ATOM 0 HB3 LEU B 61 -9.703 -7.136 -5.937 1.00 0.00 H new ATOM 0 HG LEU B 61 -8.538 -5.067 -4.895 1.00 0.00 H new ATOM 0 HD11 LEU B 61 -6.504 -6.383 -4.314 1.00 0.00 H new ATOM 0 HD12 LEU B 61 -7.974 -7.386 -4.261 1.00 0.00 H new ATOM 0 HD13 LEU B 61 -6.863 -7.507 -5.647 1.00 0.00 H new ATOM 0 HD21 LEU B 61 -6.331 -4.480 -5.871 1.00 0.00 H new ATOM 0 HD22 LEU B 61 -6.675 -5.534 -7.263 1.00 0.00 H new ATOM 0 HD23 LEU B 61 -7.668 -4.085 -6.978 1.00 0.00 H new ATOM 2411 N ASP B 62 -10.687 -7.567 -8.974 1.00 0.00 N ATOM 2412 CA ASP B 62 -11.668 -8.512 -9.511 1.00 0.00 C ATOM 2413 C ASP B 62 -10.991 -9.461 -10.472 1.00 0.00 C ATOM 2414 O ASP B 62 -11.082 -10.682 -10.334 1.00 0.00 O ATOM 2415 CB ASP B 62 -12.784 -7.754 -10.244 1.00 0.00 C ATOM 2416 CG ASP B 62 -13.916 -8.689 -10.586 1.00 0.00 C ATOM 2417 OD1 ASP B 62 -14.576 -9.142 -9.682 1.00 0.00 O ATOM 2418 OD2 ASP B 62 -14.115 -8.935 -11.753 1.00 0.00 O ATOM 0 H ASP B 62 -10.922 -6.586 -9.127 1.00 0.00 H new ATOM 0 HA ASP B 62 -12.101 -9.077 -8.685 1.00 0.00 H new ATOM 0 HB2 ASP B 62 -13.152 -6.941 -9.618 1.00 0.00 H new ATOM 0 HB3 ASP B 62 -12.389 -7.303 -11.154 1.00 0.00 H new ATOM 2423 N GLU B 63 -10.215 -8.903 -11.372 1.00 0.00 N ATOM 2424 CA GLU B 63 -9.443 -9.705 -12.296 1.00 0.00 C ATOM 2425 C GLU B 63 -8.391 -10.489 -11.543 1.00 0.00 C ATOM 2426 O GLU B 63 -8.136 -11.652 -11.838 1.00 0.00 O ATOM 2427 CB GLU B 63 -8.810 -8.821 -13.369 1.00 0.00 C ATOM 2428 CG GLU B 63 -9.940 -8.245 -14.233 1.00 0.00 C ATOM 2429 CD GLU B 63 -9.414 -7.321 -15.317 1.00 0.00 C ATOM 2430 OE1 GLU B 63 -8.220 -7.140 -15.399 1.00 0.00 O ATOM 2431 OE2 GLU B 63 -10.224 -6.812 -16.065 1.00 0.00 O ATOM 0 H GLU B 63 -10.101 -7.896 -11.485 1.00 0.00 H new ATOM 0 HA GLU B 63 -10.106 -10.412 -12.795 1.00 0.00 H new ATOM 0 HB2 GLU B 63 -8.233 -8.018 -12.910 1.00 0.00 H new ATOM 0 HB3 GLU B 63 -8.119 -9.400 -13.981 1.00 0.00 H new ATOM 0 HG2 GLU B 63 -10.497 -9.062 -14.692 1.00 0.00 H new ATOM 0 HG3 GLU B 63 -10.639 -7.699 -13.599 1.00 0.00 H new ATOM 2438 N ASN B 64 -7.824 -9.872 -10.531 1.00 0.00 N ATOM 2439 CA ASN B 64 -6.841 -10.552 -9.711 1.00 0.00 C ATOM 2440 C ASN B 64 -7.496 -11.711 -8.960 1.00 0.00 C ATOM 2441 O ASN B 64 -6.820 -12.527 -8.348 1.00 0.00 O ATOM 2442 CB ASN B 64 -6.164 -9.578 -8.739 1.00 0.00 C ATOM 2443 CG ASN B 64 -4.685 -9.942 -8.606 1.00 0.00 C ATOM 2444 OD1 ASN B 64 -3.790 -8.999 -8.588 1.00 0.00 O flip ATOM 2445 ND2 ASN B 64 -4.339 -11.121 -8.533 1.00 0.00 N flip ATOM 0 H ASN B 64 -8.022 -8.910 -10.256 1.00 0.00 H new ATOM 0 HA ASN B 64 -6.066 -10.955 -10.363 1.00 0.00 H new ATOM 0 HB2 ASN B 64 -6.267 -8.555 -9.101 1.00 0.00 H new ATOM 0 HB3 ASN B 64 -6.650 -9.622 -7.764 1.00 0.00 H new ATOM 0 HD21 ASN B 64 -5.041 -11.860 -8.547 1.00 0.00 H new ATOM 0 HD22 ASN B 64 -3.350 -11.359 -8.458 1.00 0.00 H new ATOM 2452 N GLY B 65 -8.827 -11.790 -9.034 1.00 0.00 N ATOM 2453 CA GLY B 65 -9.588 -12.879 -8.401 1.00 0.00 C ATOM 2454 C GLY B 65 -9.187 -14.235 -8.958 1.00 0.00 C ATOM 2455 O GLY B 65 -9.730 -15.273 -8.550 1.00 0.00 O ATOM 0 H GLY B 65 -9.406 -11.111 -9.528 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -9.421 -12.863 -7.324 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -10.654 -12.720 -8.561 1.00 0.00 H new ATOM 2459 N ASP B 66 -8.201 -14.241 -9.836 1.00 0.00 N ATOM 2460 CA ASP B 66 -7.689 -15.479 -10.381 1.00 0.00 C ATOM 2461 C ASP B 66 -7.152 -16.302 -9.243 1.00 0.00 C ATOM 2462 O ASP B 66 -7.373 -17.515 -9.180 1.00 0.00 O ATOM 2463 CB ASP B 66 -6.537 -15.178 -11.354 1.00 0.00 C ATOM 2464 CG ASP B 66 -7.047 -14.857 -12.754 1.00 0.00 C ATOM 2465 OD1 ASP B 66 -8.226 -14.987 -13.000 1.00 0.00 O ATOM 2466 OD2 ASP B 66 -6.234 -14.475 -13.573 1.00 0.00 O ATOM 0 H ASP B 66 -7.740 -13.401 -10.185 1.00 0.00 H new ATOM 0 HA ASP B 66 -8.481 -16.010 -10.909 1.00 0.00 H new ATOM 0 HB2 ASP B 66 -5.954 -14.337 -10.978 1.00 0.00 H new ATOM 0 HB3 ASP B 66 -5.866 -16.036 -11.399 1.00 0.00 H new ATOM 2471 N GLY B 67 -6.491 -15.631 -8.318 1.00 0.00 N ATOM 2472 CA GLY B 67 -5.934 -16.279 -7.152 1.00 0.00 C ATOM 2473 C GLY B 67 -6.096 -15.408 -5.915 1.00 0.00 C ATOM 2474 O GLY B 67 -7.143 -14.769 -5.710 1.00 0.00 O ATOM 0 H GLY B 67 -6.327 -14.625 -8.356 1.00 0.00 H new ATOM 0 HA2 GLY B 67 -6.428 -17.238 -6.993 1.00 0.00 H new ATOM 0 HA3 GLY B 67 -4.877 -16.489 -7.318 1.00 0.00 H new ATOM 2478 N GLU B 68 -5.063 -15.385 -5.098 1.00 0.00 N ATOM 2479 CA GLU B 68 -5.057 -14.627 -3.858 1.00 0.00 C ATOM 2480 C GLU B 68 -4.525 -13.224 -4.081 1.00 0.00 C ATOM 2481 O GLU B 68 -3.828 -12.950 -5.066 1.00 0.00 O ATOM 2482 CB GLU B 68 -4.187 -15.349 -2.818 1.00 0.00 C ATOM 2483 CG GLU B 68 -4.878 -16.662 -2.399 1.00 0.00 C ATOM 2484 CD GLU B 68 -3.996 -17.487 -1.474 1.00 0.00 C ATOM 2485 OE1 GLU B 68 -2.969 -17.007 -1.055 1.00 0.00 O ATOM 2486 OE2 GLU B 68 -4.359 -18.602 -1.202 1.00 0.00 O ATOM 0 H GLU B 68 -4.197 -15.894 -5.274 1.00 0.00 H new ATOM 0 HA GLU B 68 -6.082 -14.552 -3.495 1.00 0.00 H new ATOM 0 HB2 GLU B 68 -3.202 -15.560 -3.234 1.00 0.00 H new ATOM 0 HB3 GLU B 68 -4.035 -14.711 -1.948 1.00 0.00 H new ATOM 0 HG2 GLU B 68 -5.819 -16.435 -1.899 1.00 0.00 H new ATOM 0 HG3 GLU B 68 -5.121 -17.245 -3.287 1.00 0.00 H new ATOM 2493 N VAL B 69 -4.761 -12.376 -3.115 1.00 0.00 N ATOM 2494 CA VAL B 69 -4.211 -11.044 -3.100 1.00 0.00 C ATOM 2495 C VAL B 69 -3.294 -10.948 -1.893 1.00 0.00 C ATOM 2496 O VAL B 69 -3.650 -11.379 -0.802 1.00 0.00 O ATOM 2497 CB VAL B 69 -5.365 -9.990 -3.052 1.00 0.00 C ATOM 2498 CG1 VAL B 69 -6.460 -10.426 -2.073 1.00 0.00 C ATOM 2499 CG2 VAL B 69 -4.841 -8.608 -2.636 1.00 0.00 C ATOM 0 H VAL B 69 -5.346 -12.592 -2.308 1.00 0.00 H new ATOM 0 HA VAL B 69 -3.639 -10.837 -4.004 1.00 0.00 H new ATOM 0 HB VAL B 69 -5.782 -9.923 -4.057 1.00 0.00 H new ATOM 0 HG11 VAL B 69 -7.252 -9.677 -2.056 1.00 0.00 H new ATOM 0 HG12 VAL B 69 -6.872 -11.384 -2.391 1.00 0.00 H new ATOM 0 HG13 VAL B 69 -6.036 -10.528 -1.074 1.00 0.00 H new ATOM 0 HG21 VAL B 69 -5.667 -7.898 -2.612 1.00 0.00 H new ATOM 0 HG22 VAL B 69 -4.390 -8.673 -1.646 1.00 0.00 H new ATOM 0 HG23 VAL B 69 -4.094 -8.271 -3.354 1.00 0.00 H new ATOM 2509 N ASP B 70 -2.066 -10.560 -2.117 1.00 0.00 N ATOM 2510 CA ASP B 70 -1.088 -10.570 -1.053 1.00 0.00 C ATOM 2511 C ASP B 70 -0.902 -9.176 -0.463 1.00 0.00 C ATOM 2512 O ASP B 70 -1.663 -8.255 -0.781 1.00 0.00 O ATOM 2513 CB ASP B 70 0.229 -11.187 -1.538 1.00 0.00 C ATOM 2514 CG ASP B 70 1.214 -11.365 -0.401 1.00 0.00 C ATOM 2515 OD1 ASP B 70 0.787 -11.436 0.731 1.00 0.00 O ATOM 2516 OD2 ASP B 70 2.388 -11.425 -0.676 1.00 0.00 O ATOM 0 H ASP B 70 -1.718 -10.235 -3.019 1.00 0.00 H new ATOM 0 HA ASP B 70 -1.458 -11.200 -0.244 1.00 0.00 H new ATOM 0 HB2 ASP B 70 0.030 -12.153 -2.002 1.00 0.00 H new ATOM 0 HB3 ASP B 70 0.669 -10.550 -2.305 1.00 0.00 H new ATOM 2521 N PHE B 71 0.034 -9.044 0.464 1.00 0.00 N ATOM 2522 CA PHE B 71 0.207 -7.806 1.210 1.00 0.00 C ATOM 2523 C PHE B 71 0.481 -6.661 0.261 1.00 0.00 C ATOM 2524 O PHE B 71 -0.133 -5.595 0.353 1.00 0.00 O ATOM 2525 CB PHE B 71 1.361 -7.944 2.209 1.00 0.00 C ATOM 2526 CG PHE B 71 1.395 -6.735 3.117 1.00 0.00 C ATOM 2527 CD1 PHE B 71 0.320 -6.495 3.963 1.00 0.00 C ATOM 2528 CD2 PHE B 71 2.501 -5.867 3.132 1.00 0.00 C ATOM 2529 CE1 PHE B 71 0.333 -5.403 4.822 1.00 0.00 C ATOM 2530 CE2 PHE B 71 2.510 -4.768 3.997 1.00 0.00 C ATOM 2531 CZ PHE B 71 1.428 -4.541 4.842 1.00 0.00 C ATOM 0 H PHE B 71 0.689 -9.783 0.719 1.00 0.00 H new ATOM 0 HA PHE B 71 -0.711 -7.600 1.760 1.00 0.00 H new ATOM 0 HB2 PHE B 71 1.237 -8.851 2.800 1.00 0.00 H new ATOM 0 HB3 PHE B 71 2.307 -8.038 1.676 1.00 0.00 H new ATOM 0 HD1 PHE B 71 -0.530 -7.161 3.953 1.00 0.00 H new ATOM 0 HD2 PHE B 71 3.341 -6.048 2.478 1.00 0.00 H new ATOM 0 HE1 PHE B 71 -0.507 -5.222 5.476 1.00 0.00 H new ATOM 0 HE2 PHE B 71 3.356 -4.096 4.009 1.00 0.00 H new ATOM 0 HZ PHE B 71 1.437 -3.696 5.514 1.00 0.00 H new ATOM 2541 N GLN B 72 1.359 -6.903 -0.686 1.00 0.00 N ATOM 2542 CA GLN B 72 1.678 -5.905 -1.687 1.00 0.00 C ATOM 2543 C GLN B 72 0.427 -5.506 -2.467 1.00 0.00 C ATOM 2544 O GLN B 72 0.142 -4.315 -2.633 1.00 0.00 O ATOM 2545 CB GLN B 72 2.747 -6.455 -2.635 1.00 0.00 C ATOM 2546 CG GLN B 72 4.119 -6.409 -1.973 1.00 0.00 C ATOM 2547 CD GLN B 72 5.160 -7.058 -2.881 1.00 0.00 C ATOM 2548 OE1 GLN B 72 6.209 -7.482 -2.410 1.00 0.00 O ATOM 2549 NE2 GLN B 72 4.930 -7.168 -4.154 1.00 0.00 N ATOM 0 H GLN B 72 1.866 -7.782 -0.786 1.00 0.00 H new ATOM 0 HA GLN B 72 2.064 -5.015 -1.190 1.00 0.00 H new ATOM 0 HB2 GLN B 72 2.504 -7.481 -2.911 1.00 0.00 H new ATOM 0 HB3 GLN B 72 2.761 -5.872 -3.556 1.00 0.00 H new ATOM 0 HG2 GLN B 72 4.398 -5.376 -1.767 1.00 0.00 H new ATOM 0 HG3 GLN B 72 4.087 -6.927 -1.015 1.00 0.00 H new ATOM 0 HE21 GLN B 72 4.057 -6.815 -4.547 1.00 0.00 H new ATOM 0 HE22 GLN B 72 5.622 -7.607 -4.761 1.00 0.00 H new ATOM 2558 N GLU B 73 -0.361 -6.492 -2.870 1.00 0.00 N ATOM 2559 CA GLU B 73 -1.608 -6.217 -3.559 1.00 0.00 C ATOM 2560 C GLU B 73 -2.610 -5.555 -2.603 1.00 0.00 C ATOM 2561 O GLU B 73 -3.360 -4.652 -2.986 1.00 0.00 O ATOM 2562 CB GLU B 73 -2.197 -7.498 -4.160 1.00 0.00 C ATOM 2563 CG GLU B 73 -1.175 -8.153 -5.099 1.00 0.00 C ATOM 2564 CD GLU B 73 -0.338 -9.158 -4.337 1.00 0.00 C ATOM 2565 OE1 GLU B 73 0.683 -8.775 -3.798 1.00 0.00 O ATOM 2566 OE2 GLU B 73 -0.731 -10.303 -4.293 1.00 0.00 O ATOM 0 H GLU B 73 -0.159 -7.482 -2.732 1.00 0.00 H new ATOM 0 HA GLU B 73 -1.402 -5.528 -4.378 1.00 0.00 H new ATOM 0 HB2 GLU B 73 -2.469 -8.191 -3.364 1.00 0.00 H new ATOM 0 HB3 GLU B 73 -3.111 -7.266 -4.708 1.00 0.00 H new ATOM 0 HG2 GLU B 73 -1.691 -8.647 -5.922 1.00 0.00 H new ATOM 0 HG3 GLU B 73 -0.532 -7.390 -5.538 1.00 0.00 H new ATOM 2573 N TYR B 74 -2.613 -6.008 -1.356 1.00 0.00 N ATOM 2574 CA TYR B 74 -3.503 -5.464 -0.336 1.00 0.00 C ATOM 2575 C TYR B 74 -3.248 -3.984 -0.099 1.00 0.00 C ATOM 2576 O TYR B 74 -4.189 -3.188 -0.101 1.00 0.00 O ATOM 2577 CB TYR B 74 -3.372 -6.271 0.969 1.00 0.00 C ATOM 2578 CG TYR B 74 -4.095 -5.594 2.130 1.00 0.00 C ATOM 2579 CD1 TYR B 74 -5.472 -5.324 2.073 1.00 0.00 C ATOM 2580 CD2 TYR B 74 -3.368 -5.252 3.279 1.00 0.00 C ATOM 2581 CE1 TYR B 74 -6.107 -4.718 3.161 1.00 0.00 C ATOM 2582 CE2 TYR B 74 -4.009 -4.649 4.361 1.00 0.00 C ATOM 2583 CZ TYR B 74 -5.375 -4.383 4.304 1.00 0.00 C ATOM 2584 OH TYR B 74 -6.002 -3.791 5.371 1.00 0.00 O ATOM 0 H TYR B 74 -2.005 -6.756 -1.024 1.00 0.00 H new ATOM 0 HA TYR B 74 -4.527 -5.555 -0.697 1.00 0.00 H new ATOM 0 HB2 TYR B 74 -3.780 -7.271 0.820 1.00 0.00 H new ATOM 0 HB3 TYR B 74 -2.318 -6.391 1.218 1.00 0.00 H new ATOM 0 HD1 TYR B 74 -6.039 -5.584 1.191 1.00 0.00 H new ATOM 0 HD2 TYR B 74 -2.309 -5.456 3.326 1.00 0.00 H new ATOM 0 HE1 TYR B 74 -7.166 -4.508 3.118 1.00 0.00 H new ATOM 0 HE2 TYR B 74 -3.445 -4.388 5.244 1.00 0.00 H new ATOM 0 HH TYR B 74 -6.398 -2.941 5.087 1.00 0.00 H new ATOM 2594 N VAL B 75 -1.986 -3.601 0.077 1.00 0.00 N ATOM 2595 CA VAL B 75 -1.680 -2.196 0.330 1.00 0.00 C ATOM 2596 C VAL B 75 -2.067 -1.306 -0.843 1.00 0.00 C ATOM 2597 O VAL B 75 -2.601 -0.210 -0.651 1.00 0.00 O ATOM 2598 CB VAL B 75 -0.208 -1.979 0.730 1.00 0.00 C ATOM 2599 CG1 VAL B 75 0.099 -2.749 2.020 1.00 0.00 C ATOM 2600 CG2 VAL B 75 0.734 -2.444 -0.384 1.00 0.00 C ATOM 0 H VAL B 75 -1.179 -4.224 0.050 1.00 0.00 H new ATOM 0 HA VAL B 75 -2.292 -1.901 1.182 1.00 0.00 H new ATOM 0 HB VAL B 75 -0.050 -0.913 0.894 1.00 0.00 H new ATOM 0 HG11 VAL B 75 1.141 -2.592 2.298 1.00 0.00 H new ATOM 0 HG12 VAL B 75 -0.548 -2.391 2.820 1.00 0.00 H new ATOM 0 HG13 VAL B 75 -0.077 -3.813 1.860 1.00 0.00 H new ATOM 0 HG21 VAL B 75 1.767 -2.281 -0.078 1.00 0.00 H new ATOM 0 HG22 VAL B 75 0.575 -3.505 -0.575 1.00 0.00 H new ATOM 0 HG23 VAL B 75 0.531 -1.877 -1.293 1.00 0.00 H new ATOM 2610 N VAL B 76 -1.800 -1.762 -2.056 1.00 0.00 N ATOM 2611 CA VAL B 76 -2.122 -0.965 -3.221 1.00 0.00 C ATOM 2612 C VAL B 76 -3.629 -0.777 -3.349 1.00 0.00 C ATOM 2613 O VAL B 76 -4.098 0.313 -3.681 1.00 0.00 O ATOM 2614 CB VAL B 76 -1.490 -1.533 -4.507 1.00 0.00 C ATOM 2615 CG1 VAL B 76 -2.007 -2.939 -4.791 1.00 0.00 C ATOM 2616 CG2 VAL B 76 -1.807 -0.617 -5.694 1.00 0.00 C ATOM 0 H VAL B 76 -1.368 -2.665 -2.255 1.00 0.00 H new ATOM 0 HA VAL B 76 -1.680 0.021 -3.080 1.00 0.00 H new ATOM 0 HB VAL B 76 -0.411 -1.583 -4.364 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -1.547 -3.319 -5.703 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -1.755 -3.595 -3.957 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -3.089 -2.910 -4.916 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -1.357 -1.025 -6.599 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -2.887 -0.551 -5.824 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -1.403 0.377 -5.504 1.00 0.00 H new ATOM 2626 N LEU B 77 -4.387 -1.824 -3.034 1.00 0.00 N ATOM 2627 CA LEU B 77 -5.841 -1.744 -3.111 1.00 0.00 C ATOM 2628 C LEU B 77 -6.360 -0.682 -2.159 1.00 0.00 C ATOM 2629 O LEU B 77 -7.129 0.199 -2.552 1.00 0.00 O ATOM 2630 CB LEU B 77 -6.467 -3.105 -2.748 1.00 0.00 C ATOM 2631 CG LEU B 77 -8.007 -3.007 -2.745 1.00 0.00 C ATOM 2632 CD1 LEU B 77 -8.520 -2.592 -4.123 1.00 0.00 C ATOM 2633 CD2 LEU B 77 -8.617 -4.352 -2.349 1.00 0.00 C ATOM 0 H LEU B 77 -4.024 -2.726 -2.727 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.118 -1.479 -4.131 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -6.146 -3.862 -3.464 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -6.115 -3.424 -1.767 1.00 0.00 H new ATOM 0 HG LEU B 77 -8.304 -2.250 -2.018 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -9.608 -2.528 -4.102 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -8.104 -1.620 -4.388 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -8.214 -3.332 -4.863 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -9.704 -4.273 -2.350 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -8.308 -5.116 -3.063 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -8.274 -4.628 -1.352 1.00 0.00 H new ATOM 2645 N VAL B 78 -5.888 -0.719 -0.923 1.00 0.00 N ATOM 2646 CA VAL B 78 -6.288 0.287 0.036 1.00 0.00 C ATOM 2647 C VAL B 78 -5.678 1.645 -0.302 1.00 0.00 C ATOM 2648 O VAL B 78 -6.355 2.682 -0.242 1.00 0.00 O ATOM 2649 CB VAL B 78 -6.015 -0.159 1.492 1.00 0.00 C ATOM 2650 CG1 VAL B 78 -6.887 -1.379 1.817 1.00 0.00 C ATOM 2651 CG2 VAL B 78 -4.548 -0.552 1.678 1.00 0.00 C ATOM 0 H VAL B 78 -5.240 -1.422 -0.569 1.00 0.00 H new ATOM 0 HA VAL B 78 -7.369 0.407 -0.036 1.00 0.00 H new ATOM 0 HB VAL B 78 -6.248 0.674 2.155 1.00 0.00 H new ATOM 0 HG11 VAL B 78 -6.699 -1.698 2.842 1.00 0.00 H new ATOM 0 HG12 VAL B 78 -7.939 -1.114 1.706 1.00 0.00 H new ATOM 0 HG13 VAL B 78 -6.644 -2.193 1.134 1.00 0.00 H new ATOM 0 HG21 VAL B 78 -4.382 -0.862 2.710 1.00 0.00 H new ATOM 0 HG22 VAL B 78 -4.305 -1.377 1.008 1.00 0.00 H new ATOM 0 HG23 VAL B 78 -3.911 0.302 1.449 1.00 0.00 H new ATOM 2661 N ALA B 79 -4.418 1.640 -0.737 1.00 0.00 N ATOM 2662 CA ALA B 79 -3.766 2.879 -1.132 1.00 0.00 C ATOM 2663 C ALA B 79 -4.458 3.480 -2.329 1.00 0.00 C ATOM 2664 O ALA B 79 -4.632 4.695 -2.403 1.00 0.00 O ATOM 2665 CB ALA B 79 -2.297 2.647 -1.467 1.00 0.00 C ATOM 0 H ALA B 79 -3.840 0.804 -0.823 1.00 0.00 H new ATOM 0 HA ALA B 79 -3.830 3.567 -0.289 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -1.837 3.591 -1.759 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -1.783 2.248 -0.593 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -2.219 1.936 -2.290 1.00 0.00 H new ATOM 2671 N ALA B 80 -4.840 2.630 -3.272 1.00 0.00 N ATOM 2672 CA ALA B 80 -5.495 3.090 -4.482 1.00 0.00 C ATOM 2673 C ALA B 80 -6.735 3.878 -4.119 1.00 0.00 C ATOM 2674 O ALA B 80 -6.919 5.015 -4.553 1.00 0.00 O ATOM 2675 CB ALA B 80 -5.882 1.903 -5.368 1.00 0.00 C ATOM 0 H ALA B 80 -4.707 1.620 -3.220 1.00 0.00 H new ATOM 0 HA ALA B 80 -4.804 3.727 -5.034 1.00 0.00 H new ATOM 0 HB1 ALA B 80 -6.372 2.267 -6.271 1.00 0.00 H new ATOM 0 HB2 ALA B 80 -4.986 1.346 -5.641 1.00 0.00 H new ATOM 0 HB3 ALA B 80 -6.564 1.250 -4.824 1.00 0.00 H new ATOM 2681 N LEU B 81 -7.555 3.292 -3.272 1.00 0.00 N ATOM 2682 CA LEU B 81 -8.741 3.967 -2.802 1.00 0.00 C ATOM 2683 C LEU B 81 -8.366 5.199 -1.972 1.00 0.00 C ATOM 2684 O LEU B 81 -8.971 6.264 -2.121 1.00 0.00 O ATOM 2685 CB LEU B 81 -9.626 3.006 -2.006 1.00 0.00 C ATOM 2686 CG LEU B 81 -10.193 1.933 -2.961 1.00 0.00 C ATOM 2687 CD1 LEU B 81 -10.931 0.857 -2.165 1.00 0.00 C ATOM 2688 CD2 LEU B 81 -11.159 2.582 -3.965 1.00 0.00 C ATOM 0 H LEU B 81 -7.421 2.353 -2.897 1.00 0.00 H new ATOM 0 HA LEU B 81 -9.313 4.309 -3.665 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -9.049 2.534 -1.211 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -10.440 3.552 -1.528 1.00 0.00 H new ATOM 0 HG LEU B 81 -9.365 1.474 -3.501 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -11.327 0.106 -2.849 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -10.241 0.384 -1.466 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -11.752 1.313 -1.612 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -11.555 1.819 -4.635 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -11.981 3.053 -3.426 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -10.627 3.335 -4.547 1.00 0.00 H new ATOM 2700 N THR B 82 -7.345 5.056 -1.126 1.00 0.00 N ATOM 2701 CA THR B 82 -6.894 6.166 -0.305 1.00 0.00 C ATOM 2702 C THR B 82 -6.370 7.316 -1.176 1.00 0.00 C ATOM 2703 O THR B 82 -6.773 8.464 -1.003 1.00 0.00 O ATOM 2704 CB THR B 82 -5.802 5.692 0.665 1.00 0.00 C ATOM 2705 OG1 THR B 82 -6.242 4.514 1.333 1.00 0.00 O ATOM 2706 CG2 THR B 82 -5.510 6.778 1.711 1.00 0.00 C ATOM 0 H THR B 82 -6.823 4.189 -0.996 1.00 0.00 H new ATOM 0 HA THR B 82 -7.744 6.537 0.269 1.00 0.00 H new ATOM 0 HB THR B 82 -4.894 5.486 0.098 1.00 0.00 H new ATOM 0 HG1 THR B 82 -5.738 3.742 1.001 1.00 0.00 H new ATOM 0 HG21 THR B 82 -4.734 6.428 2.392 1.00 0.00 H new ATOM 0 HG22 THR B 82 -5.171 7.684 1.209 1.00 0.00 H new ATOM 0 HG23 THR B 82 -6.418 6.993 2.275 1.00 0.00 H new ATOM 2714 N VAL B 83 -5.501 7.000 -2.141 1.00 0.00 N ATOM 2715 CA VAL B 83 -4.944 8.028 -3.012 1.00 0.00 C ATOM 2716 C VAL B 83 -6.051 8.684 -3.820 1.00 0.00 C ATOM 2717 O VAL B 83 -6.123 9.913 -3.905 1.00 0.00 O ATOM 2718 CB VAL B 83 -3.835 7.448 -3.930 1.00 0.00 C ATOM 2719 CG1 VAL B 83 -4.416 6.502 -4.964 1.00 0.00 C ATOM 2720 CG2 VAL B 83 -3.058 8.562 -4.638 1.00 0.00 C ATOM 0 H VAL B 83 -5.174 6.053 -2.334 1.00 0.00 H new ATOM 0 HA VAL B 83 -4.476 8.792 -2.391 1.00 0.00 H new ATOM 0 HB VAL B 83 -3.150 6.894 -3.289 1.00 0.00 H new ATOM 0 HG11 VAL B 83 -3.615 6.112 -5.592 1.00 0.00 H new ATOM 0 HG12 VAL B 83 -4.917 5.675 -4.460 1.00 0.00 H new ATOM 0 HG13 VAL B 83 -5.135 7.038 -5.584 1.00 0.00 H new ATOM 0 HG21 VAL B 83 -2.289 8.122 -5.273 1.00 0.00 H new ATOM 0 HG22 VAL B 83 -3.742 9.150 -5.250 1.00 0.00 H new ATOM 0 HG23 VAL B 83 -2.590 9.208 -3.895 1.00 0.00 H new ATOM 2730 N ALA B 84 -6.964 7.867 -4.348 1.00 0.00 N ATOM 2731 CA ALA B 84 -8.086 8.396 -5.103 1.00 0.00 C ATOM 2732 C ALA B 84 -8.906 9.336 -4.241 1.00 0.00 C ATOM 2733 O ALA B 84 -9.114 10.499 -4.601 1.00 0.00 O ATOM 2734 CB ALA B 84 -8.974 7.259 -5.626 1.00 0.00 C ATOM 0 H ALA B 84 -6.945 6.851 -4.265 1.00 0.00 H new ATOM 0 HA ALA B 84 -7.691 8.949 -5.955 1.00 0.00 H new ATOM 0 HB1 ALA B 84 -9.808 7.678 -6.189 1.00 0.00 H new ATOM 0 HB2 ALA B 84 -8.388 6.609 -6.276 1.00 0.00 H new ATOM 0 HB3 ALA B 84 -9.357 6.681 -4.785 1.00 0.00 H new ATOM 2740 N MET B 85 -9.286 8.874 -3.059 1.00 0.00 N ATOM 2741 CA MET B 85 -10.031 9.728 -2.153 1.00 0.00 C ATOM 2742 C MET B 85 -9.160 10.882 -1.723 1.00 0.00 C ATOM 2743 O MET B 85 -9.608 12.027 -1.658 1.00 0.00 O ATOM 2744 CB MET B 85 -10.498 8.966 -0.916 1.00 0.00 C ATOM 2745 CG MET B 85 -11.384 9.892 -0.069 1.00 0.00 C ATOM 2746 SD MET B 85 -11.914 9.043 1.432 1.00 0.00 S ATOM 2747 CE MET B 85 -12.718 10.460 2.223 1.00 0.00 C ATOM 0 H MET B 85 -9.095 7.934 -2.712 1.00 0.00 H new ATOM 0 HA MET B 85 -10.912 10.091 -2.682 1.00 0.00 H new ATOM 0 HB2 MET B 85 -11.054 8.076 -1.209 1.00 0.00 H new ATOM 0 HB3 MET B 85 -9.640 8.629 -0.334 1.00 0.00 H new ATOM 0 HG2 MET B 85 -10.834 10.796 0.191 1.00 0.00 H new ATOM 0 HG3 MET B 85 -12.255 10.203 -0.647 1.00 0.00 H new ATOM 0 HE1 MET B 85 -13.347 10.111 3.042 1.00 0.00 H new ATOM 0 HE2 MET B 85 -11.959 11.138 2.612 1.00 0.00 H new ATOM 0 HE3 MET B 85 -13.332 10.985 1.491 1.00 0.00 H new ATOM 2757 N ASN B 86 -7.901 10.587 -1.442 1.00 0.00 N ATOM 2758 CA ASN B 86 -6.993 11.620 -1.005 1.00 0.00 C ATOM 2759 C ASN B 86 -6.871 12.665 -2.076 1.00 0.00 C ATOM 2760 O ASN B 86 -6.903 13.850 -1.797 1.00 0.00 O ATOM 2761 CB ASN B 86 -5.614 11.063 -0.675 1.00 0.00 C ATOM 2762 CG ASN B 86 -4.723 12.192 -0.168 1.00 0.00 C ATOM 2763 OD1 ASN B 86 -3.852 12.681 -0.896 1.00 0.00 O ATOM 2764 ND2 ASN B 86 -4.896 12.651 1.031 1.00 0.00 N ATOM 0 H ASN B 86 -7.495 9.654 -1.509 1.00 0.00 H new ATOM 0 HA ASN B 86 -7.400 12.059 -0.094 1.00 0.00 H new ATOM 0 HB2 ASN B 86 -5.696 10.282 0.081 1.00 0.00 H new ATOM 0 HB3 ASN B 86 -5.173 10.605 -1.560 1.00 0.00 H new ATOM 0 HD21 ASN B 86 -4.314 13.415 1.373 1.00 0.00 H new ATOM 0 HD22 ASN B 86 -5.615 12.248 1.633 1.00 0.00 H new ATOM 2771 N ASN B 87 -6.818 12.220 -3.317 1.00 0.00 N ATOM 2772 CA ASN B 87 -6.737 13.142 -4.438 1.00 0.00 C ATOM 2773 C ASN B 87 -7.925 14.075 -4.422 1.00 0.00 C ATOM 2774 O ASN B 87 -7.760 15.297 -4.468 1.00 0.00 O ATOM 2775 CB ASN B 87 -6.735 12.364 -5.754 1.00 0.00 C ATOM 2776 CG ASN B 87 -6.746 13.332 -6.941 1.00 0.00 C ATOM 2777 OD1 ASN B 87 -5.850 14.163 -7.079 1.00 0.00 O ATOM 2778 ND2 ASN B 87 -7.714 13.286 -7.792 1.00 0.00 N ATOM 0 H ASN B 87 -6.829 11.233 -3.575 1.00 0.00 H new ATOM 0 HA ASN B 87 -5.816 13.718 -4.351 1.00 0.00 H new ATOM 0 HB2 ASN B 87 -5.854 11.724 -5.805 1.00 0.00 H new ATOM 0 HB3 ASN B 87 -7.606 11.711 -5.800 1.00 0.00 H new ATOM 0 HD21 ASN B 87 -7.735 13.938 -8.576 1.00 0.00 H new ATOM 0 HD22 ASN B 87 -8.459 12.598 -7.681 1.00 0.00 H new ATOM 2785 N PHE B 88 -9.103 13.504 -4.222 1.00 0.00 N ATOM 2786 CA PHE B 88 -10.320 14.284 -4.099 1.00 0.00 C ATOM 2787 C PHE B 88 -10.326 15.082 -2.815 1.00 0.00 C ATOM 2788 O PHE B 88 -10.928 16.146 -2.746 1.00 0.00 O ATOM 2789 CB PHE B 88 -11.567 13.400 -4.186 1.00 0.00 C ATOM 2790 CG PHE B 88 -11.697 12.895 -5.599 1.00 0.00 C ATOM 2791 CD1 PHE B 88 -11.971 13.788 -6.638 1.00 0.00 C ATOM 2792 CD2 PHE B 88 -11.523 11.538 -5.872 1.00 0.00 C ATOM 2793 CE1 PHE B 88 -12.074 13.323 -7.948 1.00 0.00 C ATOM 2794 CE2 PHE B 88 -11.622 11.072 -7.180 1.00 0.00 C ATOM 2795 CZ PHE B 88 -11.898 11.960 -8.222 1.00 0.00 C ATOM 0 H PHE B 88 -9.240 12.496 -4.141 1.00 0.00 H new ATOM 0 HA PHE B 88 -10.344 14.980 -4.938 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -11.488 12.564 -3.491 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -12.454 13.967 -3.903 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -12.103 14.839 -6.426 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -11.311 10.849 -5.068 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -12.289 14.012 -8.751 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -11.485 10.021 -7.389 1.00 0.00 H new ATOM 0 HZ PHE B 88 -11.976 11.597 -9.236 1.00 0.00 H new ATOM 2805 N PHE B 89 -9.727 14.525 -1.781 1.00 0.00 N ATOM 2806 CA PHE B 89 -9.779 15.111 -0.459 1.00 0.00 C ATOM 2807 C PHE B 89 -9.395 16.580 -0.526 1.00 0.00 C ATOM 2808 O PHE B 89 -10.089 17.441 0.020 1.00 0.00 O ATOM 2809 CB PHE B 89 -8.777 14.379 0.428 1.00 0.00 C ATOM 2810 CG PHE B 89 -9.203 14.455 1.858 1.00 0.00 C ATOM 2811 CD1 PHE B 89 -8.935 15.592 2.620 1.00 0.00 C ATOM 2812 CD2 PHE B 89 -9.863 13.370 2.423 1.00 0.00 C ATOM 2813 CE1 PHE B 89 -9.338 15.642 3.956 1.00 0.00 C ATOM 2814 CE2 PHE B 89 -10.268 13.412 3.749 1.00 0.00 C ATOM 2815 CZ PHE B 89 -10.007 14.552 4.524 1.00 0.00 C ATOM 0 H PHE B 89 -9.193 13.657 -1.834 1.00 0.00 H new ATOM 0 HA PHE B 89 -10.789 15.024 -0.057 1.00 0.00 H new ATOM 0 HB2 PHE B 89 -8.700 13.337 0.119 1.00 0.00 H new ATOM 0 HB3 PHE B 89 -7.787 14.820 0.312 1.00 0.00 H new ATOM 0 HD1 PHE B 89 -8.418 16.431 2.178 1.00 0.00 H new ATOM 0 HD2 PHE B 89 -10.061 12.491 1.827 1.00 0.00 H new ATOM 0 HE1 PHE B 89 -9.134 16.521 4.550 1.00 0.00 H new ATOM 0 HE2 PHE B 89 -10.783 12.569 4.184 1.00 0.00 H new ATOM 0 HZ PHE B 89 -10.322 14.588 5.557 1.00 0.00 H new