USER MOD reduce.3.24.130724 H: found=0, std=0, add=1225, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1222 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 8 THR OG1 : rot 180:sc= -0.803 USER MOD Set 1.2: A 151 MET CE :methyl 146:sc= -0.119 (180deg=-0.268) USER MOD Set 2.1: A 35 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00507) USER MOD Set 2.2: A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 128 LYS NZ :NH3+ -166:sc= -0.118 (180deg=-0.305) USER MOD Set 3.2: A 134 LYS NZ :NH3+ -127:sc= -0.649 (180deg=-1.18) USER MOD Set 4.1: A 98 THR OG1 : rot 18:sc= 0.139 USER MOD Set 4.2: A 101 CYS SG : rot -23:sc= 0.364! USER MOD Set 5.1: A 59 HIS : no HD1:sc= 0.00944 X(o=0.021,f=-0.28) USER MOD Set 5.2: A 78 SER OG : rot 180:sc= 0.0112 USER MOD Set 6.1: A 34 CYS SG : rot -106:sc= 0.229 USER MOD Set 6.2: A 36 ASN : amide:sc= -3.17! C(o=-2.9!,f=-7.8!) USER MOD Set 7.1: A 25 HIS : no HD1:sc= 0.149 K(o=0.15,f=-1.5) USER MOD Set 7.2: A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -132:sc= 0.115 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 140:sc= -1.08 USER MOD Single : A 18 SER OG : rot 66:sc= 0.0979 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 154:sc= 0.906 (180deg=0.356) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 HIS : no HD1:sc= -2.14! C(o=-2.1!,f=-4.9!) USER MOD Single : A 55 LYS NZ :NH3+ -161:sc= -0.0584 (180deg=-0.473) USER MOD Single : A 56 SER OG : rot 180:sc= -0.292 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= -2.43 (180deg=-2.43) USER MOD Single : A 63 GLN :FLIP amide:sc= -0.144 F(o=-1.1,f=-0.14) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=-0.056) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN :FLIP amide:sc= -0.95 F(o=-2.8!,f=-0.95) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 MET CE :methyl 153:sc= 0 (180deg=-0.767) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot -4:sc= 0.697 USER MOD Single : A 110 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 ASN : amide:sc= -2.23! C(o=-2.2!,f=-5.4!) USER MOD Single : A 112 TYR OH : rot 180:sc= -0.391 USER MOD Single : A 113 ASN :FLIP amide:sc= -2.39! C(o=-4.9!,f=-2.4!) USER MOD Single : A 114 THR OG1 : rot 32:sc= 0.351 USER MOD Single : A 115 TYR OH : rot 47:sc= 0.0588 USER MOD Single : A 117 SER OG : rot 90:sc= -0.0421 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 TYR OH : rot 31:sc= -1.61! USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot 6:sc= 1 USER MOD Single : A 132 GLN : amide:sc= -0.571 X(o=-0.57,f=-0.25) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 148:sc= -3.97! USER MOD Single : A 138 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.594) USER MOD Single : A 139 THR OG1 : rot 170:sc= -0.0917 USER MOD Single : A 143 GLN : amide:sc= -0.0786 K(o=-0.079,f=-1.2) USER MOD Single : A 152 SER OG : rot 180:sc= -0.03 USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 21.807 18.538 -2.552 1.00 0.00 N ATOM 2 CA MET A 1 20.637 17.896 -3.216 1.00 0.00 C ATOM 3 C MET A 1 19.394 18.070 -2.339 1.00 0.00 C ATOM 4 O MET A 1 19.431 18.727 -1.318 1.00 0.00 O ATOM 5 CB MET A 1 20.917 16.404 -3.411 1.00 0.00 C ATOM 6 CG MET A 1 21.737 16.202 -4.686 1.00 0.00 C ATOM 7 SD MET A 1 22.543 14.582 -4.634 1.00 0.00 S ATOM 8 CE MET A 1 23.547 14.780 -6.127 1.00 0.00 C ATOM 0 H1 MET A 1 22.311 19.135 -3.238 1.00 0.00 H new ATOM 0 H2 MET A 1 21.477 19.124 -1.759 1.00 0.00 H new ATOM 0 H3 MET A 1 22.450 17.803 -2.195 1.00 0.00 H new ATOM 0 HA MET A 1 20.467 18.364 -4.185 1.00 0.00 H new ATOM 0 HB2 MET A 1 21.458 16.009 -2.551 1.00 0.00 H new ATOM 0 HB3 MET A 1 19.979 15.853 -3.478 1.00 0.00 H new ATOM 0 HG2 MET A 1 21.091 16.271 -5.561 1.00 0.00 H new ATOM 0 HG3 MET A 1 22.485 16.989 -4.779 1.00 0.00 H new ATOM 0 HE1 MET A 1 24.138 13.879 -6.290 1.00 0.00 H new ATOM 0 HE2 MET A 1 22.895 14.947 -6.984 1.00 0.00 H new ATOM 0 HE3 MET A 1 24.214 15.634 -6.007 1.00 0.00 H new ATOM 20 N ALA A 2 18.294 17.488 -2.732 1.00 0.00 N ATOM 21 CA ALA A 2 17.050 17.621 -1.922 1.00 0.00 C ATOM 22 C ALA A 2 15.943 16.768 -2.543 1.00 0.00 C ATOM 23 O ALA A 2 15.852 15.580 -2.304 1.00 0.00 O ATOM 24 CB ALA A 2 16.611 19.086 -1.896 1.00 0.00 C ATOM 0 H ALA A 2 18.203 16.926 -3.579 1.00 0.00 H new ATOM 0 HA ALA A 2 17.242 17.282 -0.904 1.00 0.00 H new ATOM 0 HB1 ALA A 2 15.701 19.183 -1.304 1.00 0.00 H new ATOM 0 HB2 ALA A 2 17.399 19.694 -1.452 1.00 0.00 H new ATOM 0 HB3 ALA A 2 16.419 19.426 -2.914 1.00 0.00 H new ATOM 30 N GLU A 3 15.099 17.365 -3.340 1.00 0.00 N ATOM 31 CA GLU A 3 13.998 16.589 -3.978 1.00 0.00 C ATOM 32 C GLU A 3 13.240 15.803 -2.906 1.00 0.00 C ATOM 33 O GLU A 3 12.775 16.357 -1.929 1.00 0.00 O ATOM 34 CB GLU A 3 14.587 15.616 -5.002 1.00 0.00 C ATOM 35 CG GLU A 3 15.301 16.403 -6.102 1.00 0.00 C ATOM 36 CD GLU A 3 15.950 15.428 -7.087 1.00 0.00 C ATOM 37 OE1 GLU A 3 16.831 14.695 -6.672 1.00 0.00 O ATOM 38 OE2 GLU A 3 15.553 15.433 -8.241 1.00 0.00 O ATOM 0 H GLU A 3 15.124 18.357 -3.577 1.00 0.00 H new ATOM 0 HA GLU A 3 13.314 17.274 -4.479 1.00 0.00 H new ATOM 0 HB2 GLU A 3 15.286 14.937 -4.514 1.00 0.00 H new ATOM 0 HB3 GLU A 3 13.796 15.003 -5.434 1.00 0.00 H new ATOM 0 HG2 GLU A 3 14.591 17.045 -6.624 1.00 0.00 H new ATOM 0 HG3 GLU A 3 16.059 17.054 -5.665 1.00 0.00 H new ATOM 45 N GLY A 4 13.109 14.517 -3.081 1.00 0.00 N ATOM 46 CA GLY A 4 12.380 13.697 -2.072 1.00 0.00 C ATOM 47 C GLY A 4 13.357 13.214 -0.998 1.00 0.00 C ATOM 48 O GLY A 4 14.526 13.545 -1.016 1.00 0.00 O ATOM 0 H GLY A 4 13.475 13.998 -3.879 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.585 14.287 -1.616 1.00 0.00 H new ATOM 0 HA3 GLY A 4 11.906 12.843 -2.557 1.00 0.00 H new ATOM 52 N GLU A 5 12.888 12.434 -0.063 1.00 0.00 N ATOM 53 CA GLU A 5 13.790 11.931 1.010 1.00 0.00 C ATOM 54 C GLU A 5 14.840 11.001 0.400 1.00 0.00 C ATOM 55 O GLU A 5 15.726 11.432 -0.311 1.00 0.00 O ATOM 56 CB GLU A 5 12.969 11.161 2.048 1.00 0.00 C ATOM 57 CG GLU A 5 12.238 12.152 2.958 1.00 0.00 C ATOM 58 CD GLU A 5 10.993 11.485 3.544 1.00 0.00 C ATOM 59 OE1 GLU A 5 9.952 11.562 2.913 1.00 0.00 O ATOM 60 OE2 GLU A 5 11.102 10.908 4.613 1.00 0.00 O ATOM 0 H GLU A 5 11.919 12.123 0.004 1.00 0.00 H new ATOM 0 HA GLU A 5 14.286 12.774 1.491 1.00 0.00 H new ATOM 0 HB2 GLU A 5 12.250 10.511 1.549 1.00 0.00 H new ATOM 0 HB3 GLU A 5 13.622 10.520 2.641 1.00 0.00 H new ATOM 0 HG2 GLU A 5 12.899 12.481 3.760 1.00 0.00 H new ATOM 0 HG3 GLU A 5 11.956 13.040 2.393 1.00 0.00 H new ATOM 67 N ILE A 6 14.748 9.728 0.672 1.00 0.00 N ATOM 68 CA ILE A 6 15.741 8.772 0.107 1.00 0.00 C ATOM 69 C ILE A 6 15.469 8.573 -1.385 1.00 0.00 C ATOM 70 O ILE A 6 14.335 8.495 -1.813 1.00 0.00 O ATOM 71 CB ILE A 6 15.624 7.429 0.832 1.00 0.00 C ATOM 72 CG1 ILE A 6 15.916 7.628 2.321 1.00 0.00 C ATOM 73 CG2 ILE A 6 16.633 6.441 0.243 1.00 0.00 C ATOM 74 CD1 ILE A 6 15.421 6.412 3.105 1.00 0.00 C ATOM 0 H ILE A 6 14.028 9.309 1.261 1.00 0.00 H new ATOM 0 HA ILE A 6 16.746 9.171 0.241 1.00 0.00 H new ATOM 0 HB ILE A 6 14.615 7.035 0.707 1.00 0.00 H new ATOM 0 HG12 ILE A 6 16.986 7.764 2.478 1.00 0.00 H new ATOM 0 HG13 ILE A 6 15.424 8.531 2.681 1.00 0.00 H new ATOM 0 HG21 ILE A 6 16.550 5.485 0.759 1.00 0.00 H new ATOM 0 HG22 ILE A 6 16.427 6.300 -0.818 1.00 0.00 H new ATOM 0 HG23 ILE A 6 17.642 6.834 0.368 1.00 0.00 H new ATOM 0 HD11 ILE A 6 15.629 6.554 4.166 1.00 0.00 H new ATOM 0 HD12 ILE A 6 14.347 6.297 2.958 1.00 0.00 H new ATOM 0 HD13 ILE A 6 15.934 5.518 2.751 1.00 0.00 H new ATOM 86 N THR A 7 16.501 8.489 -2.179 1.00 0.00 N ATOM 87 CA THR A 7 16.300 8.295 -3.643 1.00 0.00 C ATOM 88 C THR A 7 15.475 7.029 -3.884 1.00 0.00 C ATOM 89 O THR A 7 15.315 6.206 -3.005 1.00 0.00 O ATOM 90 CB THR A 7 17.661 8.155 -4.330 1.00 0.00 C ATOM 91 OG1 THR A 7 17.471 7.718 -5.669 1.00 0.00 O ATOM 92 CG2 THR A 7 18.515 7.137 -3.573 1.00 0.00 C ATOM 0 H THR A 7 17.474 8.546 -1.878 1.00 0.00 H new ATOM 0 HA THR A 7 15.771 9.155 -4.053 1.00 0.00 H new ATOM 0 HB THR A 7 18.169 9.119 -4.332 1.00 0.00 H new ATOM 0 HG1 THR A 7 18.094 8.192 -6.259 1.00 0.00 H new ATOM 0 HG21 THR A 7 19.484 7.038 -4.063 1.00 0.00 H new ATOM 0 HG22 THR A 7 18.660 7.475 -2.547 1.00 0.00 H new ATOM 0 HG23 THR A 7 18.011 6.171 -3.568 1.00 0.00 H new ATOM 100 N THR A 8 14.951 6.868 -5.069 1.00 0.00 N ATOM 101 CA THR A 8 14.135 5.656 -5.369 1.00 0.00 C ATOM 102 C THR A 8 15.023 4.587 -6.012 1.00 0.00 C ATOM 103 O THR A 8 15.483 3.676 -5.353 1.00 0.00 O ATOM 104 CB THR A 8 12.995 6.033 -6.322 1.00 0.00 C ATOM 105 OG1 THR A 8 12.664 4.912 -7.126 1.00 0.00 O ATOM 106 CG2 THR A 8 13.428 7.198 -7.215 1.00 0.00 C ATOM 0 H THR A 8 15.053 7.524 -5.843 1.00 0.00 H new ATOM 0 HA THR A 8 13.714 5.260 -4.445 1.00 0.00 H new ATOM 0 HB THR A 8 12.123 6.335 -5.741 1.00 0.00 H new ATOM 0 HG1 THR A 8 11.934 5.150 -7.735 1.00 0.00 H new ATOM 0 HG21 THR A 8 12.614 7.461 -7.890 1.00 0.00 H new ATOM 0 HG22 THR A 8 13.678 8.059 -6.595 1.00 0.00 H new ATOM 0 HG23 THR A 8 14.302 6.905 -7.797 1.00 0.00 H new ATOM 114 N LEU A 9 15.270 4.688 -7.289 1.00 0.00 N ATOM 115 CA LEU A 9 16.134 3.678 -7.968 1.00 0.00 C ATOM 116 C LEU A 9 15.625 2.263 -7.650 1.00 0.00 C ATOM 117 O LEU A 9 16.206 1.578 -6.832 1.00 0.00 O ATOM 118 CB LEU A 9 17.570 3.819 -7.458 1.00 0.00 C ATOM 119 CG LEU A 9 18.101 5.211 -7.800 1.00 0.00 C ATOM 120 CD1 LEU A 9 19.126 5.640 -6.750 1.00 0.00 C ATOM 121 CD2 LEU A 9 18.770 5.177 -9.177 1.00 0.00 C ATOM 0 H LEU A 9 14.911 5.427 -7.893 1.00 0.00 H new ATOM 0 HA LEU A 9 16.103 3.842 -9.045 1.00 0.00 H new ATOM 0 HB2 LEU A 9 17.601 3.662 -6.380 1.00 0.00 H new ATOM 0 HB3 LEU A 9 18.204 3.056 -7.910 1.00 0.00 H new ATOM 0 HG LEU A 9 17.274 5.921 -7.812 1.00 0.00 H new ATOM 0 HD11 LEU A 9 19.504 6.633 -6.995 1.00 0.00 H new ATOM 0 HD12 LEU A 9 18.653 5.664 -5.768 1.00 0.00 H new ATOM 0 HD13 LEU A 9 19.953 4.930 -6.737 1.00 0.00 H new ATOM 0 HD21 LEU A 9 19.149 6.169 -9.422 1.00 0.00 H new ATOM 0 HD22 LEU A 9 19.596 4.466 -9.163 1.00 0.00 H new ATOM 0 HD23 LEU A 9 18.042 4.871 -9.928 1.00 0.00 H new ATOM 133 N PRO A 10 14.551 1.862 -8.293 1.00 0.00 N ATOM 134 CA PRO A 10 13.964 0.529 -8.065 1.00 0.00 C ATOM 135 C PRO A 10 14.925 -0.561 -8.546 1.00 0.00 C ATOM 136 O PRO A 10 16.036 -0.287 -8.954 1.00 0.00 O ATOM 137 CB PRO A 10 12.675 0.518 -8.897 1.00 0.00 C ATOM 138 CG PRO A 10 12.571 1.882 -9.623 1.00 0.00 C ATOM 139 CD PRO A 10 13.836 2.688 -9.286 1.00 0.00 C ATOM 0 HA PRO A 10 13.770 0.336 -7.010 1.00 0.00 H new ATOM 0 HB2 PRO A 10 12.693 -0.299 -9.619 1.00 0.00 H new ATOM 0 HB3 PRO A 10 11.808 0.359 -8.256 1.00 0.00 H new ATOM 0 HG2 PRO A 10 12.486 1.737 -10.700 1.00 0.00 H new ATOM 0 HG3 PRO A 10 11.678 2.419 -9.302 1.00 0.00 H new ATOM 0 HD2 PRO A 10 14.446 2.858 -10.173 1.00 0.00 H new ATOM 0 HD3 PRO A 10 13.585 3.668 -8.880 1.00 0.00 H new ATOM 147 N ALA A 11 14.506 -1.797 -8.500 1.00 0.00 N ATOM 148 CA ALA A 11 15.397 -2.903 -8.953 1.00 0.00 C ATOM 149 C ALA A 11 16.715 -2.845 -8.178 1.00 0.00 C ATOM 150 O ALA A 11 17.718 -2.375 -8.677 1.00 0.00 O ATOM 151 CB ALA A 11 15.677 -2.753 -10.450 1.00 0.00 C ATOM 0 H ALA A 11 13.586 -2.088 -8.169 1.00 0.00 H new ATOM 0 HA ALA A 11 14.910 -3.861 -8.770 1.00 0.00 H new ATOM 0 HB1 ALA A 11 16.329 -3.562 -10.781 1.00 0.00 H new ATOM 0 HB2 ALA A 11 14.738 -2.795 -11.002 1.00 0.00 H new ATOM 0 HB3 ALA A 11 16.164 -1.796 -10.635 1.00 0.00 H new ATOM 157 N LEU A 12 16.721 -3.322 -6.963 1.00 0.00 N ATOM 158 CA LEU A 12 17.971 -3.300 -6.153 1.00 0.00 C ATOM 159 C LEU A 12 17.722 -3.898 -4.755 1.00 0.00 C ATOM 160 O LEU A 12 18.474 -4.753 -4.332 1.00 0.00 O ATOM 161 CB LEU A 12 18.494 -1.866 -6.020 1.00 0.00 C ATOM 162 CG LEU A 12 19.877 -1.760 -6.666 1.00 0.00 C ATOM 163 CD1 LEU A 12 20.338 -0.302 -6.652 1.00 0.00 C ATOM 164 CD2 LEU A 12 20.872 -2.615 -5.877 1.00 0.00 C ATOM 0 H LEU A 12 15.910 -3.727 -6.495 1.00 0.00 H new ATOM 0 HA LEU A 12 18.720 -3.905 -6.664 1.00 0.00 H new ATOM 0 HB2 LEU A 12 17.804 -1.171 -6.499 1.00 0.00 H new ATOM 0 HB3 LEU A 12 18.551 -1.585 -4.968 1.00 0.00 H new ATOM 0 HG LEU A 12 19.825 -2.114 -7.696 1.00 0.00 H new ATOM 0 HD11 LEU A 12 21.323 -0.227 -7.112 1.00 0.00 H new ATOM 0 HD12 LEU A 12 19.629 0.309 -7.211 1.00 0.00 H new ATOM 0 HD13 LEU A 12 20.391 0.053 -5.623 1.00 0.00 H new ATOM 0 HD21 LEU A 12 21.858 -2.541 -6.335 1.00 0.00 H new ATOM 0 HD22 LEU A 12 20.922 -2.259 -4.848 1.00 0.00 H new ATOM 0 HD23 LEU A 12 20.545 -3.655 -5.885 1.00 0.00 H new ATOM 176 N PRO A 13 16.692 -3.445 -4.055 1.00 0.00 N ATOM 177 CA PRO A 13 16.405 -3.970 -2.705 1.00 0.00 C ATOM 178 C PRO A 13 16.014 -5.449 -2.782 1.00 0.00 C ATOM 179 O PRO A 13 15.055 -5.815 -3.432 1.00 0.00 O ATOM 180 CB PRO A 13 15.230 -3.129 -2.191 1.00 0.00 C ATOM 181 CG PRO A 13 14.838 -2.132 -3.307 1.00 0.00 C ATOM 182 CD PRO A 13 15.744 -2.403 -4.519 1.00 0.00 C ATOM 0 HA PRO A 13 17.271 -3.905 -2.046 1.00 0.00 H new ATOM 0 HB2 PRO A 13 14.385 -3.769 -1.936 1.00 0.00 H new ATOM 0 HB3 PRO A 13 15.511 -2.595 -1.283 1.00 0.00 H new ATOM 0 HG2 PRO A 13 13.790 -2.256 -3.579 1.00 0.00 H new ATOM 0 HG3 PRO A 13 14.959 -1.105 -2.962 1.00 0.00 H new ATOM 0 HD2 PRO A 13 15.166 -2.747 -5.376 1.00 0.00 H new ATOM 0 HD3 PRO A 13 16.269 -1.500 -4.830 1.00 0.00 H new ATOM 190 N GLU A 14 16.749 -6.302 -2.121 1.00 0.00 N ATOM 191 CA GLU A 14 16.419 -7.754 -2.153 1.00 0.00 C ATOM 192 C GLU A 14 16.198 -8.195 -3.601 1.00 0.00 C ATOM 193 O GLU A 14 15.095 -8.168 -4.108 1.00 0.00 O ATOM 194 CB GLU A 14 15.145 -8.006 -1.344 1.00 0.00 C ATOM 195 CG GLU A 14 15.056 -9.488 -0.979 1.00 0.00 C ATOM 196 CD GLU A 14 15.841 -9.748 0.308 1.00 0.00 C ATOM 197 OE1 GLU A 14 17.032 -9.485 0.315 1.00 0.00 O ATOM 198 OE2 GLU A 14 15.237 -10.206 1.265 1.00 0.00 O ATOM 0 H GLU A 14 17.564 -6.055 -1.560 1.00 0.00 H new ATOM 0 HA GLU A 14 17.242 -8.323 -1.721 1.00 0.00 H new ATOM 0 HB2 GLU A 14 15.150 -7.398 -0.440 1.00 0.00 H new ATOM 0 HB3 GLU A 14 14.270 -7.710 -1.923 1.00 0.00 H new ATOM 0 HG2 GLU A 14 14.014 -9.778 -0.846 1.00 0.00 H new ATOM 0 HG3 GLU A 14 15.455 -10.097 -1.790 1.00 0.00 H new ATOM 205 N ASP A 15 17.243 -8.601 -4.270 1.00 0.00 N ATOM 206 CA ASP A 15 17.097 -9.041 -5.687 1.00 0.00 C ATOM 207 C ASP A 15 16.910 -10.560 -5.735 1.00 0.00 C ATOM 208 O ASP A 15 17.862 -11.311 -5.799 1.00 0.00 O ATOM 209 CB ASP A 15 18.354 -8.660 -6.471 1.00 0.00 C ATOM 210 CG ASP A 15 18.665 -7.179 -6.251 1.00 0.00 C ATOM 211 OD1 ASP A 15 17.743 -6.383 -6.329 1.00 0.00 O ATOM 212 OD2 ASP A 15 19.818 -6.865 -6.007 1.00 0.00 O ATOM 0 H ASP A 15 18.191 -8.647 -3.897 1.00 0.00 H new ATOM 0 HA ASP A 15 16.228 -8.553 -6.130 1.00 0.00 H new ATOM 0 HB2 ASP A 15 19.196 -9.271 -6.147 1.00 0.00 H new ATOM 0 HB3 ASP A 15 18.207 -8.857 -7.533 1.00 0.00 H new ATOM 217 N GLY A 16 15.688 -11.017 -5.707 1.00 0.00 N ATOM 218 CA GLY A 16 15.439 -12.487 -5.754 1.00 0.00 C ATOM 219 C GLY A 16 15.326 -13.036 -4.331 1.00 0.00 C ATOM 220 O GLY A 16 15.888 -14.063 -4.006 1.00 0.00 O ATOM 0 H GLY A 16 14.851 -10.437 -5.654 1.00 0.00 H new ATOM 0 HA2 GLY A 16 14.523 -12.693 -6.307 1.00 0.00 H new ATOM 0 HA3 GLY A 16 16.250 -12.986 -6.284 1.00 0.00 H new ATOM 224 N GLY A 17 14.603 -12.362 -3.480 1.00 0.00 N ATOM 225 CA GLY A 17 14.454 -12.849 -2.079 1.00 0.00 C ATOM 226 C GLY A 17 13.106 -12.395 -1.519 1.00 0.00 C ATOM 227 O GLY A 17 13.024 -11.858 -0.433 1.00 0.00 O ATOM 0 H GLY A 17 14.109 -11.496 -3.694 1.00 0.00 H new ATOM 0 HA2 GLY A 17 14.523 -13.936 -2.052 1.00 0.00 H new ATOM 0 HA3 GLY A 17 15.265 -12.463 -1.461 1.00 0.00 H new ATOM 231 N SER A 18 12.046 -12.604 -2.253 1.00 0.00 N ATOM 232 CA SER A 18 10.704 -12.182 -1.762 1.00 0.00 C ATOM 233 C SER A 18 9.644 -13.171 -2.251 1.00 0.00 C ATOM 234 O SER A 18 8.752 -12.819 -2.997 1.00 0.00 O ATOM 235 CB SER A 18 10.382 -10.785 -2.295 1.00 0.00 C ATOM 236 OG SER A 18 10.606 -10.757 -3.699 1.00 0.00 O ATOM 0 H SER A 18 12.052 -13.049 -3.171 1.00 0.00 H new ATOM 0 HA SER A 18 10.707 -12.164 -0.672 1.00 0.00 H new ATOM 0 HB2 SER A 18 9.346 -10.529 -2.075 1.00 0.00 H new ATOM 0 HB3 SER A 18 11.006 -10.041 -1.800 1.00 0.00 H new ATOM 0 HG SER A 18 9.961 -11.344 -4.145 1.00 0.00 H new ATOM 242 N GLY A 19 9.731 -14.405 -1.834 1.00 0.00 N ATOM 243 CA GLY A 19 8.724 -15.412 -2.274 1.00 0.00 C ATOM 244 C GLY A 19 7.470 -15.286 -1.407 1.00 0.00 C ATOM 245 O GLY A 19 6.651 -14.410 -1.607 1.00 0.00 O ATOM 0 H GLY A 19 10.455 -14.759 -1.209 1.00 0.00 H new ATOM 0 HA2 GLY A 19 8.472 -15.257 -3.323 1.00 0.00 H new ATOM 0 HA3 GLY A 19 9.138 -16.417 -2.191 1.00 0.00 H new ATOM 249 N ALA A 20 7.313 -16.150 -0.441 1.00 0.00 N ATOM 250 CA ALA A 20 6.114 -16.072 0.440 1.00 0.00 C ATOM 251 C ALA A 20 6.287 -14.913 1.423 1.00 0.00 C ATOM 252 O ALA A 20 5.688 -14.884 2.478 1.00 0.00 O ATOM 253 CB ALA A 20 5.964 -17.381 1.215 1.00 0.00 C ATOM 0 H ALA A 20 7.963 -16.906 -0.224 1.00 0.00 H new ATOM 0 HA ALA A 20 5.223 -15.908 -0.167 1.00 0.00 H new ATOM 0 HB1 ALA A 20 5.087 -17.324 1.859 1.00 0.00 H new ATOM 0 HB2 ALA A 20 5.846 -18.207 0.514 1.00 0.00 H new ATOM 0 HB3 ALA A 20 6.852 -17.547 1.825 1.00 0.00 H new ATOM 259 N PHE A 21 7.108 -13.959 1.081 1.00 0.00 N ATOM 260 CA PHE A 21 7.333 -12.799 1.987 1.00 0.00 C ATOM 261 C PHE A 21 7.735 -13.292 3.386 1.00 0.00 C ATOM 262 O PHE A 21 7.026 -13.054 4.344 1.00 0.00 O ATOM 263 CB PHE A 21 6.038 -11.985 2.091 1.00 0.00 C ATOM 264 CG PHE A 21 5.357 -11.947 0.745 1.00 0.00 C ATOM 265 CD1 PHE A 21 5.739 -10.995 -0.207 1.00 0.00 C ATOM 266 CD2 PHE A 21 4.340 -12.863 0.450 1.00 0.00 C ATOM 267 CE1 PHE A 21 5.106 -10.958 -1.455 1.00 0.00 C ATOM 268 CE2 PHE A 21 3.706 -12.826 -0.796 1.00 0.00 C ATOM 269 CZ PHE A 21 4.088 -11.875 -1.748 1.00 0.00 C ATOM 0 H PHE A 21 7.635 -13.933 0.208 1.00 0.00 H new ATOM 0 HA PHE A 21 8.134 -12.179 1.584 1.00 0.00 H new ATOM 0 HB2 PHE A 21 5.375 -12.430 2.833 1.00 0.00 H new ATOM 0 HB3 PHE A 21 6.259 -10.972 2.427 1.00 0.00 H new ATOM 0 HD1 PHE A 21 6.523 -10.288 0.021 1.00 0.00 H new ATOM 0 HD2 PHE A 21 4.045 -13.598 1.184 1.00 0.00 H new ATOM 0 HE1 PHE A 21 5.402 -10.224 -2.190 1.00 0.00 H new ATOM 0 HE2 PHE A 21 2.921 -13.532 -1.023 1.00 0.00 H new ATOM 0 HZ PHE A 21 3.598 -11.848 -2.710 1.00 0.00 H new ATOM 279 N PRO A 22 8.861 -13.961 3.476 1.00 0.00 N ATOM 280 CA PRO A 22 9.347 -14.477 4.768 1.00 0.00 C ATOM 281 C PRO A 22 9.670 -13.296 5.701 1.00 0.00 C ATOM 282 O PRO A 22 9.897 -12.201 5.228 1.00 0.00 O ATOM 283 CB PRO A 22 10.627 -15.251 4.426 1.00 0.00 C ATOM 284 CG PRO A 22 10.901 -15.063 2.913 1.00 0.00 C ATOM 285 CD PRO A 22 9.733 -14.258 2.321 1.00 0.00 C ATOM 0 HA PRO A 22 8.614 -15.106 5.274 1.00 0.00 H new ATOM 0 HB2 PRO A 22 11.466 -14.882 5.015 1.00 0.00 H new ATOM 0 HB3 PRO A 22 10.510 -16.308 4.665 1.00 0.00 H new ATOM 0 HG2 PRO A 22 11.844 -14.539 2.758 1.00 0.00 H new ATOM 0 HG3 PRO A 22 10.989 -16.030 2.418 1.00 0.00 H new ATOM 0 HD2 PRO A 22 10.084 -13.343 1.844 1.00 0.00 H new ATOM 0 HD3 PRO A 22 9.202 -14.831 1.561 1.00 0.00 H new ATOM 293 N PRO A 23 9.698 -13.533 6.998 1.00 0.00 N ATOM 294 CA PRO A 23 10.015 -12.466 7.966 1.00 0.00 C ATOM 295 C PRO A 23 11.443 -11.963 7.739 1.00 0.00 C ATOM 296 O PRO A 23 12.402 -12.610 8.114 1.00 0.00 O ATOM 297 CB PRO A 23 9.900 -13.135 9.342 1.00 0.00 C ATOM 298 CG PRO A 23 9.654 -14.646 9.109 1.00 0.00 C ATOM 299 CD PRO A 23 9.424 -14.853 7.605 1.00 0.00 C ATOM 0 HA PRO A 23 9.350 -11.607 7.871 1.00 0.00 H new ATOM 0 HB2 PRO A 23 10.811 -12.980 9.920 1.00 0.00 H new ATOM 0 HB3 PRO A 23 9.081 -12.697 9.913 1.00 0.00 H new ATOM 0 HG2 PRO A 23 10.509 -15.230 9.449 1.00 0.00 H new ATOM 0 HG3 PRO A 23 8.789 -14.985 9.679 1.00 0.00 H new ATOM 0 HD2 PRO A 23 10.089 -15.619 7.205 1.00 0.00 H new ATOM 0 HD3 PRO A 23 8.404 -15.178 7.402 1.00 0.00 H new ATOM 307 N GLY A 24 11.595 -10.820 7.123 1.00 0.00 N ATOM 308 CA GLY A 24 12.967 -10.286 6.870 1.00 0.00 C ATOM 309 C GLY A 24 12.976 -8.760 7.002 1.00 0.00 C ATOM 310 O GLY A 24 13.348 -8.221 8.026 1.00 0.00 O ATOM 0 H GLY A 24 10.831 -10.234 6.785 1.00 0.00 H new ATOM 0 HA2 GLY A 24 13.671 -10.723 7.578 1.00 0.00 H new ATOM 0 HA3 GLY A 24 13.298 -10.574 5.872 1.00 0.00 H new ATOM 314 N HIS A 25 12.584 -8.060 5.969 1.00 0.00 N ATOM 315 CA HIS A 25 12.582 -6.568 6.021 1.00 0.00 C ATOM 316 C HIS A 25 11.162 -6.058 6.272 1.00 0.00 C ATOM 317 O HIS A 25 10.567 -5.419 5.427 1.00 0.00 O ATOM 318 CB HIS A 25 13.088 -6.014 4.687 1.00 0.00 C ATOM 319 CG HIS A 25 14.280 -6.811 4.234 1.00 0.00 C ATOM 320 ND1 HIS A 25 15.575 -6.478 4.598 1.00 0.00 N ATOM 321 CD2 HIS A 25 14.388 -7.930 3.445 1.00 0.00 C ATOM 322 CE1 HIS A 25 16.399 -7.380 4.034 1.00 0.00 C ATOM 323 NE2 HIS A 25 15.728 -8.288 3.319 1.00 0.00 N ATOM 0 H HIS A 25 12.264 -8.460 5.087 1.00 0.00 H new ATOM 0 HA HIS A 25 13.232 -6.237 6.830 1.00 0.00 H new ATOM 0 HB2 HIS A 25 12.298 -6.063 3.937 1.00 0.00 H new ATOM 0 HB3 HIS A 25 13.359 -4.964 4.796 1.00 0.00 H new ATOM 0 HD2 HIS A 25 13.559 -8.453 2.991 1.00 0.00 H new ATOM 0 HE1 HIS A 25 17.473 -7.371 4.146 1.00 0.00 H new ATOM 0 HE2 HIS A 25 16.114 -9.073 2.795 1.00 0.00 H new ATOM 331 N PHE A 26 10.624 -6.338 7.429 1.00 0.00 N ATOM 332 CA PHE A 26 9.242 -5.879 7.761 1.00 0.00 C ATOM 333 C PHE A 26 9.279 -5.029 9.031 1.00 0.00 C ATOM 334 O PHE A 26 8.258 -4.615 9.543 1.00 0.00 O ATOM 335 CB PHE A 26 8.351 -7.098 7.985 1.00 0.00 C ATOM 336 CG PHE A 26 8.269 -7.873 6.698 1.00 0.00 C ATOM 337 CD1 PHE A 26 9.367 -8.622 6.266 1.00 0.00 C ATOM 338 CD2 PHE A 26 7.101 -7.833 5.931 1.00 0.00 C ATOM 339 CE1 PHE A 26 9.298 -9.336 5.065 1.00 0.00 C ATOM 340 CE2 PHE A 26 7.031 -8.547 4.731 1.00 0.00 C ATOM 341 CZ PHE A 26 8.129 -9.299 4.297 1.00 0.00 C ATOM 0 H PHE A 26 11.087 -6.870 8.166 1.00 0.00 H new ATOM 0 HA PHE A 26 8.845 -5.282 6.940 1.00 0.00 H new ATOM 0 HB2 PHE A 26 8.758 -7.724 8.779 1.00 0.00 H new ATOM 0 HB3 PHE A 26 7.356 -6.787 8.304 1.00 0.00 H new ATOM 0 HD1 PHE A 26 10.269 -8.650 6.859 1.00 0.00 H new ATOM 0 HD2 PHE A 26 6.254 -7.252 6.265 1.00 0.00 H new ATOM 0 HE1 PHE A 26 10.146 -9.915 4.731 1.00 0.00 H new ATOM 0 HE2 PHE A 26 6.129 -8.518 4.138 1.00 0.00 H new ATOM 0 HZ PHE A 26 8.074 -9.850 3.370 1.00 0.00 H new ATOM 351 N LYS A 27 10.451 -4.766 9.541 1.00 0.00 N ATOM 352 CA LYS A 27 10.563 -3.941 10.777 1.00 0.00 C ATOM 353 C LYS A 27 10.826 -2.482 10.394 1.00 0.00 C ATOM 354 O LYS A 27 11.369 -1.717 11.166 1.00 0.00 O ATOM 355 CB LYS A 27 11.722 -4.461 11.632 1.00 0.00 C ATOM 356 CG LYS A 27 11.240 -5.633 12.489 1.00 0.00 C ATOM 357 CD LYS A 27 10.648 -6.719 11.587 1.00 0.00 C ATOM 358 CE LYS A 27 10.485 -8.014 12.384 1.00 0.00 C ATOM 359 NZ LYS A 27 9.140 -8.598 12.113 1.00 0.00 N ATOM 0 H LYS A 27 11.338 -5.088 9.154 1.00 0.00 H new ATOM 0 HA LYS A 27 9.634 -4.006 11.344 1.00 0.00 H new ATOM 0 HB2 LYS A 27 12.545 -4.779 10.992 1.00 0.00 H new ATOM 0 HB3 LYS A 27 12.104 -3.664 12.270 1.00 0.00 H new ATOM 0 HG2 LYS A 27 12.070 -6.039 13.068 1.00 0.00 H new ATOM 0 HG3 LYS A 27 10.491 -5.291 13.203 1.00 0.00 H new ATOM 0 HD2 LYS A 27 9.683 -6.396 11.197 1.00 0.00 H new ATOM 0 HD3 LYS A 27 11.298 -6.888 10.729 1.00 0.00 H new ATOM 0 HE2 LYS A 27 11.264 -8.724 12.108 1.00 0.00 H new ATOM 0 HE3 LYS A 27 10.599 -7.815 13.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 9.028 -9.479 12.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 8.404 -7.921 12.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 9.048 -8.802 11.097 1.00 0.00 H new ATOM 373 N ASP A 28 10.448 -2.094 9.206 1.00 0.00 N ATOM 374 CA ASP A 28 10.676 -0.686 8.772 1.00 0.00 C ATOM 375 C ASP A 28 9.537 -0.256 7.828 1.00 0.00 C ATOM 376 O ASP A 28 8.965 -1.094 7.161 1.00 0.00 O ATOM 377 CB ASP A 28 12.015 -0.606 8.030 1.00 0.00 C ATOM 378 CG ASP A 28 13.158 -0.541 9.043 1.00 0.00 C ATOM 379 OD1 ASP A 28 13.209 0.424 9.788 1.00 0.00 O ATOM 380 OD2 ASP A 28 13.965 -1.456 9.056 1.00 0.00 O ATOM 0 H ASP A 28 9.991 -2.692 8.517 1.00 0.00 H new ATOM 0 HA ASP A 28 10.696 -0.026 9.639 1.00 0.00 H new ATOM 0 HB2 ASP A 28 12.137 -1.475 7.384 1.00 0.00 H new ATOM 0 HB3 ASP A 28 12.034 0.274 7.387 1.00 0.00 H new ATOM 385 N PRO A 29 9.230 1.030 7.778 1.00 0.00 N ATOM 386 CA PRO A 29 8.158 1.525 6.892 1.00 0.00 C ATOM 387 C PRO A 29 8.450 1.148 5.437 1.00 0.00 C ATOM 388 O PRO A 29 9.540 0.730 5.100 1.00 0.00 O ATOM 389 CB PRO A 29 8.174 3.050 7.063 1.00 0.00 C ATOM 390 CG PRO A 29 9.300 3.401 8.065 1.00 0.00 C ATOM 391 CD PRO A 29 9.900 2.082 8.574 1.00 0.00 C ATOM 0 HA PRO A 29 7.188 1.094 7.142 1.00 0.00 H new ATOM 0 HB2 PRO A 29 8.348 3.540 6.105 1.00 0.00 H new ATOM 0 HB3 PRO A 29 7.211 3.403 7.431 1.00 0.00 H new ATOM 0 HG2 PRO A 29 10.066 4.008 7.582 1.00 0.00 H new ATOM 0 HG3 PRO A 29 8.905 3.987 8.895 1.00 0.00 H new ATOM 0 HD2 PRO A 29 10.980 2.058 8.432 1.00 0.00 H new ATOM 0 HD3 PRO A 29 9.716 1.949 9.640 1.00 0.00 H new ATOM 399 N LYS A 30 7.483 1.298 4.573 1.00 0.00 N ATOM 400 CA LYS A 30 7.699 0.955 3.139 1.00 0.00 C ATOM 401 C LYS A 30 6.895 1.918 2.264 1.00 0.00 C ATOM 402 O LYS A 30 5.735 2.180 2.516 1.00 0.00 O ATOM 403 CB LYS A 30 7.233 -0.480 2.880 1.00 0.00 C ATOM 404 CG LYS A 30 7.888 -1.420 3.896 1.00 0.00 C ATOM 405 CD LYS A 30 7.641 -2.872 3.481 1.00 0.00 C ATOM 406 CE LYS A 30 8.311 -3.816 4.484 1.00 0.00 C ATOM 407 NZ LYS A 30 8.705 -5.075 3.793 1.00 0.00 N ATOM 0 H LYS A 30 6.551 1.644 4.799 1.00 0.00 H new ATOM 0 HA LYS A 30 8.759 1.039 2.899 1.00 0.00 H new ATOM 0 HB2 LYS A 30 6.148 -0.541 2.959 1.00 0.00 H new ATOM 0 HB3 LYS A 30 7.496 -0.782 1.866 1.00 0.00 H new ATOM 0 HG2 LYS A 30 8.959 -1.224 3.952 1.00 0.00 H new ATOM 0 HG3 LYS A 30 7.479 -1.240 4.890 1.00 0.00 H new ATOM 0 HD2 LYS A 30 6.570 -3.071 3.439 1.00 0.00 H new ATOM 0 HD3 LYS A 30 8.038 -3.047 2.481 1.00 0.00 H new ATOM 0 HE2 LYS A 30 9.188 -3.338 4.920 1.00 0.00 H new ATOM 0 HE3 LYS A 30 7.628 -4.037 5.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 9.506 -5.510 4.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 7.901 -5.734 3.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 8.984 -4.861 2.814 1.00 0.00 H new ATOM 421 N ARG A 31 7.502 2.452 1.241 1.00 0.00 N ATOM 422 CA ARG A 31 6.772 3.404 0.355 1.00 0.00 C ATOM 423 C ARG A 31 5.991 2.625 -0.705 1.00 0.00 C ATOM 424 O ARG A 31 6.553 1.882 -1.484 1.00 0.00 O ATOM 425 CB ARG A 31 7.775 4.330 -0.335 1.00 0.00 C ATOM 426 CG ARG A 31 8.816 4.805 0.683 1.00 0.00 C ATOM 427 CD ARG A 31 9.326 6.189 0.283 1.00 0.00 C ATOM 428 NE ARG A 31 10.389 6.621 1.231 1.00 0.00 N ATOM 429 CZ ARG A 31 11.171 7.621 0.925 1.00 0.00 C ATOM 430 NH1 ARG A 31 11.021 8.241 -0.213 1.00 0.00 N ATOM 431 NH2 ARG A 31 12.103 7.999 1.757 1.00 0.00 N ATOM 0 H ARG A 31 8.471 2.271 0.979 1.00 0.00 H new ATOM 0 HA ARG A 31 6.080 3.995 0.955 1.00 0.00 H new ATOM 0 HB2 ARG A 31 8.266 3.806 -1.155 1.00 0.00 H new ATOM 0 HB3 ARG A 31 7.257 5.186 -0.768 1.00 0.00 H new ATOM 0 HG2 ARG A 31 8.375 4.842 1.679 1.00 0.00 H new ATOM 0 HG3 ARG A 31 9.645 4.099 0.727 1.00 0.00 H new ATOM 0 HD2 ARG A 31 9.719 6.163 -0.733 1.00 0.00 H new ATOM 0 HD3 ARG A 31 8.505 6.906 0.289 1.00 0.00 H new ATOM 0 HE ARG A 31 10.507 6.136 2.120 1.00 0.00 H new ATOM 0 HH11 ARG A 31 10.293 7.945 -0.863 1.00 0.00 H new ATOM 0 HH12 ARG A 31 11.632 9.022 -0.453 1.00 0.00 H new ATOM 0 HH21 ARG A 31 12.220 7.513 2.646 1.00 0.00 H new ATOM 0 HH22 ARG A 31 12.714 8.780 1.518 1.00 0.00 H new ATOM 445 N LEU A 32 4.696 2.793 -0.744 1.00 0.00 N ATOM 446 CA LEU A 32 3.880 2.065 -1.757 1.00 0.00 C ATOM 447 C LEU A 32 3.878 2.854 -3.068 1.00 0.00 C ATOM 448 O LEU A 32 3.099 3.768 -3.252 1.00 0.00 O ATOM 449 CB LEU A 32 2.443 1.919 -1.249 1.00 0.00 C ATOM 450 CG LEU A 32 2.456 1.341 0.167 1.00 0.00 C ATOM 451 CD1 LEU A 32 1.019 1.142 0.650 1.00 0.00 C ATOM 452 CD2 LEU A 32 3.182 -0.007 0.161 1.00 0.00 C ATOM 0 H LEU A 32 4.169 3.402 -0.119 1.00 0.00 H new ATOM 0 HA LEU A 32 4.307 1.076 -1.925 1.00 0.00 H new ATOM 0 HB2 LEU A 32 1.945 2.889 -1.252 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.876 1.267 -1.914 1.00 0.00 H new ATOM 0 HG LEU A 32 2.972 2.030 0.835 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.028 0.730 1.659 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.500 2.101 0.654 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.503 0.453 -0.018 1.00 0.00 H new ATOM 0 HD21 LEU A 32 3.192 -0.420 1.170 1.00 0.00 H new ATOM 0 HD22 LEU A 32 2.665 -0.696 -0.508 1.00 0.00 H new ATOM 0 HD23 LEU A 32 4.207 0.133 -0.184 1.00 0.00 H new ATOM 464 N TYR A 33 4.746 2.509 -3.980 1.00 0.00 N ATOM 465 CA TYR A 33 4.793 3.242 -5.276 1.00 0.00 C ATOM 466 C TYR A 33 3.890 2.544 -6.294 1.00 0.00 C ATOM 467 O TYR A 33 4.136 1.422 -6.692 1.00 0.00 O ATOM 468 CB TYR A 33 6.231 3.261 -5.800 1.00 0.00 C ATOM 469 CG TYR A 33 6.242 3.757 -7.228 1.00 0.00 C ATOM 470 CD1 TYR A 33 5.767 5.040 -7.526 1.00 0.00 C ATOM 471 CD2 TYR A 33 6.729 2.935 -8.255 1.00 0.00 C ATOM 472 CE1 TYR A 33 5.775 5.501 -8.847 1.00 0.00 C ATOM 473 CE2 TYR A 33 6.738 3.398 -9.576 1.00 0.00 C ATOM 474 CZ TYR A 33 6.261 4.681 -9.873 1.00 0.00 C ATOM 475 OH TYR A 33 6.270 5.137 -11.175 1.00 0.00 O ATOM 0 H TYR A 33 5.423 1.752 -3.883 1.00 0.00 H new ATOM 0 HA TYR A 33 4.446 4.264 -5.125 1.00 0.00 H new ATOM 0 HB2 TYR A 33 6.848 3.906 -5.175 1.00 0.00 H new ATOM 0 HB3 TYR A 33 6.661 2.261 -5.748 1.00 0.00 H new ATOM 0 HD1 TYR A 33 5.394 5.674 -6.735 1.00 0.00 H new ATOM 0 HD2 TYR A 33 7.097 1.946 -8.027 1.00 0.00 H new ATOM 0 HE1 TYR A 33 5.406 6.490 -9.076 1.00 0.00 H new ATOM 0 HE2 TYR A 33 7.113 2.765 -10.367 1.00 0.00 H new ATOM 0 HH TYR A 33 6.640 4.445 -11.762 1.00 0.00 H new ATOM 485 N CYS A 34 2.847 3.201 -6.723 1.00 0.00 N ATOM 486 CA CYS A 34 1.932 2.578 -7.719 1.00 0.00 C ATOM 487 C CYS A 34 2.523 2.748 -9.119 1.00 0.00 C ATOM 488 O CYS A 34 2.828 3.846 -9.545 1.00 0.00 O ATOM 489 CB CYS A 34 0.563 3.258 -7.654 1.00 0.00 C ATOM 490 SG CYS A 34 -0.550 2.489 -8.856 1.00 0.00 S ATOM 0 H CYS A 34 2.590 4.142 -6.426 1.00 0.00 H new ATOM 0 HA CYS A 34 1.816 1.517 -7.497 1.00 0.00 H new ATOM 0 HB2 CYS A 34 0.148 3.169 -6.650 1.00 0.00 H new ATOM 0 HB3 CYS A 34 0.663 4.323 -7.865 1.00 0.00 H new ATOM 0 HG CYS A 34 -0.723 3.292 -9.863 1.00 0.00 H new ATOM 496 N LYS A 35 2.692 1.673 -9.837 1.00 0.00 N ATOM 497 CA LYS A 35 3.270 1.770 -11.206 1.00 0.00 C ATOM 498 C LYS A 35 2.193 2.232 -12.191 1.00 0.00 C ATOM 499 O LYS A 35 2.485 2.635 -13.299 1.00 0.00 O ATOM 500 CB LYS A 35 3.794 0.398 -11.631 1.00 0.00 C ATOM 501 CG LYS A 35 4.765 0.559 -12.804 1.00 0.00 C ATOM 502 CD LYS A 35 4.559 -0.586 -13.799 1.00 0.00 C ATOM 503 CE LYS A 35 3.333 -0.297 -14.668 1.00 0.00 C ATOM 504 NZ LYS A 35 2.576 -1.561 -14.893 1.00 0.00 N ATOM 0 H LYS A 35 2.454 0.729 -9.534 1.00 0.00 H new ATOM 0 HA LYS A 35 4.087 2.491 -11.204 1.00 0.00 H new ATOM 0 HB2 LYS A 35 4.297 -0.086 -10.794 1.00 0.00 H new ATOM 0 HB3 LYS A 35 2.963 -0.246 -11.919 1.00 0.00 H new ATOM 0 HG2 LYS A 35 4.601 1.517 -13.297 1.00 0.00 H new ATOM 0 HG3 LYS A 35 5.793 0.559 -12.441 1.00 0.00 H new ATOM 0 HD2 LYS A 35 5.443 -0.700 -14.426 1.00 0.00 H new ATOM 0 HD3 LYS A 35 4.425 -1.526 -13.264 1.00 0.00 H new ATOM 0 HE2 LYS A 35 2.695 0.440 -14.182 1.00 0.00 H new ATOM 0 HE3 LYS A 35 3.642 0.129 -15.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 1.771 -1.376 -15.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 3.202 -2.268 -15.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 2.225 -1.922 -13.983 1.00 0.00 H new ATOM 518 N ASN A 36 0.951 2.175 -11.797 1.00 0.00 N ATOM 519 CA ASN A 36 -0.140 2.609 -12.714 1.00 0.00 C ATOM 520 C ASN A 36 -0.384 4.109 -12.544 1.00 0.00 C ATOM 521 O ASN A 36 -1.151 4.532 -11.702 1.00 0.00 O ATOM 522 CB ASN A 36 -1.418 1.839 -12.381 1.00 0.00 C ATOM 523 CG ASN A 36 -1.161 0.340 -12.542 1.00 0.00 C ATOM 524 OD1 ASN A 36 -1.375 -0.214 -13.602 1.00 0.00 O ATOM 525 ND2 ASN A 36 -0.707 -0.343 -11.528 1.00 0.00 N ATOM 0 H ASN A 36 0.645 1.847 -10.881 1.00 0.00 H new ATOM 0 HA ASN A 36 0.148 2.406 -13.746 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -1.733 2.058 -11.361 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -2.228 2.154 -13.039 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -0.531 -1.343 -11.624 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -0.528 0.123 -10.639 1.00 0.00 H new ATOM 532 N GLY A 37 0.265 4.918 -13.337 1.00 0.00 N ATOM 533 CA GLY A 37 0.072 6.391 -13.221 1.00 0.00 C ATOM 534 C GLY A 37 1.134 6.975 -12.287 1.00 0.00 C ATOM 535 O GLY A 37 1.121 8.148 -11.973 1.00 0.00 O ATOM 0 H GLY A 37 0.921 4.622 -14.060 1.00 0.00 H new ATOM 0 HA2 GLY A 37 0.143 6.856 -14.204 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -0.924 6.608 -12.836 1.00 0.00 H new ATOM 539 N GLY A 38 2.055 6.163 -11.843 1.00 0.00 N ATOM 540 CA GLY A 38 3.116 6.673 -10.930 1.00 0.00 C ATOM 541 C GLY A 38 2.478 7.500 -9.813 1.00 0.00 C ATOM 542 O GLY A 38 2.421 8.712 -9.882 1.00 0.00 O ATOM 0 H GLY A 38 2.118 5.171 -12.073 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.675 5.840 -10.505 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.827 7.283 -11.487 1.00 0.00 H new ATOM 546 N PHE A 39 1.997 6.854 -8.784 1.00 0.00 N ATOM 547 CA PHE A 39 1.361 7.599 -7.659 1.00 0.00 C ATOM 548 C PHE A 39 1.714 6.923 -6.333 1.00 0.00 C ATOM 549 O PHE A 39 1.619 5.720 -6.194 1.00 0.00 O ATOM 550 CB PHE A 39 -0.159 7.595 -7.840 1.00 0.00 C ATOM 551 CG PHE A 39 -0.546 8.613 -8.886 1.00 0.00 C ATOM 552 CD1 PHE A 39 -0.644 9.966 -8.543 1.00 0.00 C ATOM 553 CD2 PHE A 39 -0.810 8.201 -10.197 1.00 0.00 C ATOM 554 CE1 PHE A 39 -1.005 10.909 -9.514 1.00 0.00 C ATOM 555 CE2 PHE A 39 -1.172 9.143 -11.167 1.00 0.00 C ATOM 556 CZ PHE A 39 -1.269 10.498 -10.826 1.00 0.00 C ATOM 0 H PHE A 39 2.017 5.840 -8.674 1.00 0.00 H new ATOM 0 HA PHE A 39 1.726 8.626 -7.653 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -0.497 6.603 -8.140 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.649 7.826 -6.894 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -0.442 10.283 -7.531 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -0.734 7.156 -10.460 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -1.080 11.954 -9.250 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -1.377 8.825 -12.179 1.00 0.00 H new ATOM 0 HZ PHE A 39 -1.547 11.225 -11.575 1.00 0.00 H new ATOM 566 N PHE A 40 2.120 7.689 -5.357 1.00 0.00 N ATOM 567 CA PHE A 40 2.476 7.092 -4.038 1.00 0.00 C ATOM 568 C PHE A 40 1.255 7.131 -3.118 1.00 0.00 C ATOM 569 O PHE A 40 0.625 8.156 -2.950 1.00 0.00 O ATOM 570 CB PHE A 40 3.617 7.893 -3.408 1.00 0.00 C ATOM 571 CG PHE A 40 4.907 7.593 -4.133 1.00 0.00 C ATOM 572 CD1 PHE A 40 5.204 8.249 -5.334 1.00 0.00 C ATOM 573 CD2 PHE A 40 5.806 6.659 -3.605 1.00 0.00 C ATOM 574 CE1 PHE A 40 6.400 7.972 -6.005 1.00 0.00 C ATOM 575 CE2 PHE A 40 7.003 6.381 -4.277 1.00 0.00 C ATOM 576 CZ PHE A 40 7.300 7.038 -5.478 1.00 0.00 C ATOM 0 H PHE A 40 2.221 8.702 -5.416 1.00 0.00 H new ATOM 0 HA PHE A 40 2.793 6.059 -4.178 1.00 0.00 H new ATOM 0 HB2 PHE A 40 3.398 8.960 -3.460 1.00 0.00 H new ATOM 0 HB3 PHE A 40 3.714 7.639 -2.352 1.00 0.00 H new ATOM 0 HD1 PHE A 40 4.510 8.969 -5.742 1.00 0.00 H new ATOM 0 HD2 PHE A 40 5.577 6.153 -2.679 1.00 0.00 H new ATOM 0 HE1 PHE A 40 6.629 8.479 -6.931 1.00 0.00 H new ATOM 0 HE2 PHE A 40 7.697 5.660 -3.869 1.00 0.00 H new ATOM 0 HZ PHE A 40 8.223 6.824 -5.997 1.00 0.00 H new ATOM 586 N LEU A 41 0.916 6.022 -2.519 1.00 0.00 N ATOM 587 CA LEU A 41 -0.265 5.997 -1.611 1.00 0.00 C ATOM 588 C LEU A 41 0.005 6.892 -0.399 1.00 0.00 C ATOM 589 O LEU A 41 1.124 7.009 0.061 1.00 0.00 O ATOM 590 CB LEU A 41 -0.512 4.561 -1.139 1.00 0.00 C ATOM 591 CG LEU A 41 -1.899 4.457 -0.492 1.00 0.00 C ATOM 592 CD1 LEU A 41 -2.983 4.333 -1.569 1.00 0.00 C ATOM 593 CD2 LEU A 41 -1.942 3.223 0.411 1.00 0.00 C ATOM 0 H LEU A 41 1.406 5.133 -2.619 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.143 6.362 -2.144 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.442 3.874 -1.983 1.00 0.00 H new ATOM 0 HB3 LEU A 41 0.256 4.267 -0.424 1.00 0.00 H new ATOM 0 HG LEU A 41 -2.085 5.357 0.094 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -3.961 4.260 -1.094 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -2.957 5.211 -2.214 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -2.802 3.439 -2.166 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -2.926 3.145 0.873 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -1.748 2.330 -0.183 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -1.182 3.314 1.188 1.00 0.00 H new ATOM 605 N ARG A 42 -1.011 7.527 0.120 1.00 0.00 N ATOM 606 CA ARG A 42 -0.815 8.413 1.302 1.00 0.00 C ATOM 607 C ARG A 42 -2.049 8.342 2.202 1.00 0.00 C ATOM 608 O ARG A 42 -3.121 7.966 1.768 1.00 0.00 O ATOM 609 CB ARG A 42 -0.611 9.856 0.831 1.00 0.00 C ATOM 610 CG ARG A 42 0.070 10.663 1.937 1.00 0.00 C ATOM 611 CD ARG A 42 0.281 12.105 1.465 1.00 0.00 C ATOM 612 NE ARG A 42 -0.050 13.043 2.575 1.00 0.00 N ATOM 613 CZ ARG A 42 0.330 14.289 2.510 1.00 0.00 C ATOM 614 NH1 ARG A 42 0.998 14.715 1.474 1.00 0.00 N ATOM 615 NH2 ARG A 42 0.041 15.111 3.483 1.00 0.00 N ATOM 0 H ARG A 42 -1.969 7.470 -0.224 1.00 0.00 H new ATOM 0 HA ARG A 42 0.062 8.085 1.860 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -0.002 9.872 -0.073 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -1.571 10.306 0.577 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -0.542 10.651 2.839 1.00 0.00 H new ATOM 0 HG3 ARG A 42 1.027 10.210 2.195 1.00 0.00 H new ATOM 0 HD2 ARG A 42 1.314 12.248 1.149 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -0.349 12.312 0.600 1.00 0.00 H new ATOM 0 HE ARG A 42 -0.573 12.711 3.385 1.00 0.00 H new ATOM 0 HH11 ARG A 42 1.224 14.074 0.714 1.00 0.00 H new ATOM 0 HH12 ARG A 42 1.295 15.690 1.424 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -0.482 14.778 4.293 1.00 0.00 H new ATOM 0 HH22 ARG A 42 0.338 16.085 3.433 1.00 0.00 H new ATOM 629 N ILE A 43 -1.904 8.701 3.451 1.00 0.00 N ATOM 630 CA ILE A 43 -3.061 8.661 4.393 1.00 0.00 C ATOM 631 C ILE A 43 -3.109 9.966 5.187 1.00 0.00 C ATOM 632 O ILE A 43 -2.321 10.186 6.086 1.00 0.00 O ATOM 633 CB ILE A 43 -2.897 7.483 5.356 1.00 0.00 C ATOM 634 CG1 ILE A 43 -2.865 6.174 4.565 1.00 0.00 C ATOM 635 CG2 ILE A 43 -4.071 7.456 6.336 1.00 0.00 C ATOM 636 CD1 ILE A 43 -2.463 5.025 5.491 1.00 0.00 C ATOM 0 H ILE A 43 -1.027 9.022 3.861 1.00 0.00 H new ATOM 0 HA ILE A 43 -3.987 8.540 3.830 1.00 0.00 H new ATOM 0 HB ILE A 43 -1.964 7.596 5.908 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -3.844 5.977 4.128 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -2.158 6.253 3.739 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -3.953 6.617 7.022 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -4.093 8.387 6.903 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.004 7.345 5.783 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -2.441 4.093 4.926 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -1.475 5.221 5.906 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -3.187 4.941 6.302 1.00 0.00 H new ATOM 648 N HIS A 44 -4.024 10.837 4.862 1.00 0.00 N ATOM 649 CA HIS A 44 -4.117 12.129 5.597 1.00 0.00 C ATOM 650 C HIS A 44 -4.551 11.852 7.050 1.00 0.00 C ATOM 651 O HIS A 44 -5.252 10.889 7.290 1.00 0.00 O ATOM 652 CB HIS A 44 -5.160 13.014 4.906 1.00 0.00 C ATOM 653 CG HIS A 44 -4.612 13.496 3.591 1.00 0.00 C ATOM 654 ND1 HIS A 44 -3.456 14.255 3.506 1.00 0.00 N ATOM 655 CD2 HIS A 44 -5.047 13.327 2.301 1.00 0.00 C ATOM 656 CE1 HIS A 44 -3.236 14.513 2.203 1.00 0.00 C ATOM 657 NE2 HIS A 44 -4.177 13.971 1.425 1.00 0.00 N ATOM 0 H HIS A 44 -4.711 10.710 4.119 1.00 0.00 H new ATOM 0 HA HIS A 44 -3.151 12.633 5.599 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -6.081 12.453 4.745 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -5.411 13.863 5.541 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -5.930 12.778 2.009 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -2.401 15.088 1.832 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -4.244 14.019 0.408 1.00 0.00 H new ATOM 665 N PRO A 45 -4.143 12.690 7.990 1.00 0.00 N ATOM 666 CA PRO A 45 -4.522 12.496 9.402 1.00 0.00 C ATOM 667 C PRO A 45 -6.048 12.459 9.544 1.00 0.00 C ATOM 668 O PRO A 45 -6.578 11.901 10.484 1.00 0.00 O ATOM 669 CB PRO A 45 -3.944 13.710 10.142 1.00 0.00 C ATOM 670 CG PRO A 45 -3.220 14.595 9.098 1.00 0.00 C ATOM 671 CD PRO A 45 -3.291 13.875 7.744 1.00 0.00 C ATOM 0 HA PRO A 45 -4.143 11.556 9.802 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -4.738 14.271 10.635 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -3.250 13.390 10.919 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -3.692 15.575 9.035 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -2.183 14.759 9.390 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -3.720 14.518 6.976 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -2.299 13.584 7.398 1.00 0.00 H new ATOM 679 N ASP A 46 -6.755 13.050 8.621 1.00 0.00 N ATOM 680 CA ASP A 46 -8.242 13.048 8.709 1.00 0.00 C ATOM 681 C ASP A 46 -8.776 11.665 8.329 1.00 0.00 C ATOM 682 O ASP A 46 -9.965 11.419 8.361 1.00 0.00 O ATOM 683 CB ASP A 46 -8.812 14.097 7.750 1.00 0.00 C ATOM 684 CG ASP A 46 -8.292 13.831 6.336 1.00 0.00 C ATOM 685 OD1 ASP A 46 -8.001 12.684 6.040 1.00 0.00 O ATOM 686 OD2 ASP A 46 -8.194 14.778 5.574 1.00 0.00 O ATOM 0 H ASP A 46 -6.368 13.534 7.811 1.00 0.00 H new ATOM 0 HA ASP A 46 -8.545 13.285 9.729 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.901 14.062 7.761 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -8.522 15.097 8.074 1.00 0.00 H new ATOM 691 N GLY A 47 -7.905 10.761 7.972 1.00 0.00 N ATOM 692 CA GLY A 47 -8.361 9.393 7.591 1.00 0.00 C ATOM 693 C GLY A 47 -8.550 9.317 6.076 1.00 0.00 C ATOM 694 O GLY A 47 -8.351 8.284 5.468 1.00 0.00 O ATOM 0 H GLY A 47 -6.897 10.910 7.928 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -7.629 8.652 7.914 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -9.298 9.157 8.096 1.00 0.00 H new ATOM 698 N ARG A 48 -8.934 10.401 5.458 1.00 0.00 N ATOM 699 CA ARG A 48 -9.137 10.386 3.981 1.00 0.00 C ATOM 700 C ARG A 48 -7.886 9.825 3.300 1.00 0.00 C ATOM 701 O ARG A 48 -6.804 10.363 3.427 1.00 0.00 O ATOM 702 CB ARG A 48 -9.390 11.811 3.486 1.00 0.00 C ATOM 703 CG ARG A 48 -10.676 12.350 4.118 1.00 0.00 C ATOM 704 CD ARG A 48 -11.767 12.449 3.051 1.00 0.00 C ATOM 705 NE ARG A 48 -11.820 11.178 2.275 1.00 0.00 N ATOM 706 CZ ARG A 48 -12.853 10.916 1.521 1.00 0.00 C ATOM 707 NH1 ARG A 48 -13.840 11.767 1.448 1.00 0.00 N ATOM 708 NH2 ARG A 48 -12.900 9.803 0.841 1.00 0.00 N ATOM 0 H ARG A 48 -9.116 11.296 5.912 1.00 0.00 H new ATOM 0 HA ARG A 48 -9.995 9.759 3.739 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.548 12.452 3.746 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -9.475 11.820 2.399 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -11.000 11.693 4.925 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -10.494 13.330 4.559 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -12.732 12.642 3.519 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -11.563 13.287 2.384 1.00 0.00 H new ATOM 0 HE ARG A 48 -11.049 10.513 2.333 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -13.804 12.637 1.980 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -14.647 11.562 0.859 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -12.129 9.137 0.899 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -13.707 9.599 0.252 1.00 0.00 H new ATOM 722 N VAL A 49 -8.027 8.747 2.578 1.00 0.00 N ATOM 723 CA VAL A 49 -6.847 8.152 1.887 1.00 0.00 C ATOM 724 C VAL A 49 -6.762 8.697 0.461 1.00 0.00 C ATOM 725 O VAL A 49 -7.760 9.030 -0.148 1.00 0.00 O ATOM 726 CB VAL A 49 -6.996 6.631 1.844 1.00 0.00 C ATOM 727 CG1 VAL A 49 -5.770 6.017 1.166 1.00 0.00 C ATOM 728 CG2 VAL A 49 -7.114 6.089 3.270 1.00 0.00 C ATOM 0 H VAL A 49 -8.908 8.252 2.437 1.00 0.00 H new ATOM 0 HA VAL A 49 -5.938 8.413 2.430 1.00 0.00 H new ATOM 0 HB VAL A 49 -7.892 6.370 1.281 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.876 4.933 1.135 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.685 6.402 0.150 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -4.874 6.278 1.729 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -7.220 5.005 3.239 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -6.218 6.350 3.834 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -7.988 6.526 3.754 1.00 0.00 H new ATOM 738 N ASP A 50 -5.577 8.790 -0.079 1.00 0.00 N ATOM 739 CA ASP A 50 -5.429 9.313 -1.467 1.00 0.00 C ATOM 740 C ASP A 50 -3.967 9.192 -1.904 1.00 0.00 C ATOM 741 O ASP A 50 -3.062 9.231 -1.092 1.00 0.00 O ATOM 742 CB ASP A 50 -5.855 10.782 -1.508 1.00 0.00 C ATOM 743 CG ASP A 50 -5.190 11.540 -0.360 1.00 0.00 C ATOM 744 OD1 ASP A 50 -4.507 10.905 0.427 1.00 0.00 O ATOM 745 OD2 ASP A 50 -5.374 12.744 -0.285 1.00 0.00 O ATOM 0 H ASP A 50 -4.706 8.527 0.381 1.00 0.00 H new ATOM 0 HA ASP A 50 -6.059 8.734 -2.142 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -5.573 11.227 -2.462 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -6.939 10.859 -1.428 1.00 0.00 H new ATOM 750 N GLY A 51 -3.729 9.044 -3.178 1.00 0.00 N ATOM 751 CA GLY A 51 -2.326 8.918 -3.667 1.00 0.00 C ATOM 752 C GLY A 51 -1.799 10.294 -4.077 1.00 0.00 C ATOM 753 O GLY A 51 -2.554 11.185 -4.411 1.00 0.00 O ATOM 0 H GLY A 51 -4.446 9.005 -3.903 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -1.695 8.494 -2.886 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -2.286 8.235 -4.515 1.00 0.00 H new ATOM 757 N VAL A 52 -0.505 10.475 -4.053 1.00 0.00 N ATOM 758 CA VAL A 52 0.072 11.792 -4.440 1.00 0.00 C ATOM 759 C VAL A 52 1.428 11.577 -5.114 1.00 0.00 C ATOM 760 O VAL A 52 2.215 10.751 -4.696 1.00 0.00 O ATOM 761 CB VAL A 52 0.255 12.655 -3.190 1.00 0.00 C ATOM 762 CG1 VAL A 52 -1.072 12.753 -2.436 1.00 0.00 C ATOM 763 CG2 VAL A 52 1.308 12.017 -2.281 1.00 0.00 C ATOM 0 H VAL A 52 0.176 9.766 -3.782 1.00 0.00 H new ATOM 0 HA VAL A 52 -0.602 12.294 -5.133 1.00 0.00 H new ATOM 0 HB VAL A 52 0.581 13.653 -3.484 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -0.940 13.368 -1.546 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -1.825 13.206 -3.082 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -1.398 11.755 -2.143 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.439 12.631 -1.390 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.980 11.019 -1.989 1.00 0.00 H new ATOM 0 HG23 VAL A 52 2.255 11.946 -2.816 1.00 0.00 H new ATOM 773 N ARG A 53 1.709 12.315 -6.154 1.00 0.00 N ATOM 774 CA ARG A 53 3.017 12.150 -6.851 1.00 0.00 C ATOM 775 C ARG A 53 4.136 12.710 -5.972 1.00 0.00 C ATOM 776 O ARG A 53 5.304 12.573 -6.275 1.00 0.00 O ATOM 777 CB ARG A 53 2.988 12.908 -8.179 1.00 0.00 C ATOM 778 CG ARG A 53 1.777 12.456 -9.001 1.00 0.00 C ATOM 779 CD ARG A 53 2.127 12.449 -10.494 1.00 0.00 C ATOM 780 NE ARG A 53 3.088 13.558 -10.806 1.00 0.00 N ATOM 781 CZ ARG A 53 2.845 14.791 -10.448 1.00 0.00 C ATOM 782 NH1 ARG A 53 1.677 15.126 -9.977 1.00 0.00 N ATOM 783 NH2 ARG A 53 3.762 15.705 -10.618 1.00 0.00 N ATOM 0 H ARG A 53 1.091 13.023 -6.550 1.00 0.00 H new ATOM 0 HA ARG A 53 3.196 11.092 -7.040 1.00 0.00 H new ATOM 0 HB2 ARG A 53 2.936 13.981 -7.996 1.00 0.00 H new ATOM 0 HB3 ARG A 53 3.907 12.724 -8.735 1.00 0.00 H new ATOM 0 HG2 ARG A 53 1.466 11.459 -8.688 1.00 0.00 H new ATOM 0 HG3 ARG A 53 0.935 13.124 -8.820 1.00 0.00 H new ATOM 0 HD2 ARG A 53 2.566 11.490 -10.768 1.00 0.00 H new ATOM 0 HD3 ARG A 53 1.221 12.566 -11.088 1.00 0.00 H new ATOM 0 HE ARG A 53 3.950 13.345 -11.308 1.00 0.00 H new ATOM 0 HH11 ARG A 53 0.943 14.423 -9.885 1.00 0.00 H new ATOM 0 HH12 ARG A 53 1.496 16.091 -9.700 1.00 0.00 H new ATOM 0 HH21 ARG A 53 4.662 15.455 -11.028 1.00 0.00 H new ATOM 0 HH22 ARG A 53 3.579 16.669 -10.341 1.00 0.00 H new ATOM 797 N GLU A 54 3.788 13.343 -4.884 1.00 0.00 N ATOM 798 CA GLU A 54 4.832 13.914 -3.988 1.00 0.00 C ATOM 799 C GLU A 54 5.397 12.811 -3.091 1.00 0.00 C ATOM 800 O GLU A 54 4.823 12.466 -2.078 1.00 0.00 O ATOM 801 CB GLU A 54 4.212 15.009 -3.117 1.00 0.00 C ATOM 802 CG GLU A 54 5.302 15.987 -2.673 1.00 0.00 C ATOM 803 CD GLU A 54 5.396 17.138 -3.676 1.00 0.00 C ATOM 804 OE1 GLU A 54 5.650 16.866 -4.838 1.00 0.00 O ATOM 805 OE2 GLU A 54 5.213 18.272 -3.266 1.00 0.00 O ATOM 0 H GLU A 54 2.826 13.489 -4.578 1.00 0.00 H new ATOM 0 HA GLU A 54 5.635 14.338 -4.592 1.00 0.00 H new ATOM 0 HB2 GLU A 54 3.439 15.538 -3.675 1.00 0.00 H new ATOM 0 HB3 GLU A 54 3.729 14.566 -2.246 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.075 16.374 -1.680 1.00 0.00 H new ATOM 0 HG3 GLU A 54 6.260 15.472 -2.603 1.00 0.00 H new ATOM 812 N LYS A 55 6.520 12.254 -3.455 1.00 0.00 N ATOM 813 CA LYS A 55 7.121 11.174 -2.623 1.00 0.00 C ATOM 814 C LYS A 55 7.962 11.798 -1.507 1.00 0.00 C ATOM 815 O LYS A 55 8.655 11.113 -0.782 1.00 0.00 O ATOM 816 CB LYS A 55 8.011 10.290 -3.499 1.00 0.00 C ATOM 817 CG LYS A 55 8.895 11.172 -4.383 1.00 0.00 C ATOM 818 CD LYS A 55 9.979 10.313 -5.038 1.00 0.00 C ATOM 819 CE LYS A 55 10.904 11.203 -5.870 1.00 0.00 C ATOM 820 NZ LYS A 55 10.123 11.847 -6.964 1.00 0.00 N ATOM 0 H LYS A 55 7.047 12.501 -4.293 1.00 0.00 H new ATOM 0 HA LYS A 55 6.327 10.569 -2.185 1.00 0.00 H new ATOM 0 HB2 LYS A 55 8.630 9.647 -2.874 1.00 0.00 H new ATOM 0 HB3 LYS A 55 7.396 9.637 -4.118 1.00 0.00 H new ATOM 0 HG2 LYS A 55 8.291 11.660 -5.148 1.00 0.00 H new ATOM 0 HG3 LYS A 55 9.352 11.961 -3.786 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.553 9.788 -4.274 1.00 0.00 H new ATOM 0 HD3 LYS A 55 9.522 9.553 -5.672 1.00 0.00 H new ATOM 0 HE2 LYS A 55 11.359 11.965 -5.237 1.00 0.00 H new ATOM 0 HE3 LYS A 55 11.716 10.610 -6.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 10.773 12.180 -7.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 9.460 11.156 -7.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 9.590 12.654 -6.582 1.00 0.00 H new ATOM 834 N SER A 56 7.909 13.095 -1.366 1.00 0.00 N ATOM 835 CA SER A 56 8.707 13.761 -0.298 1.00 0.00 C ATOM 836 C SER A 56 7.865 13.875 0.974 1.00 0.00 C ATOM 837 O SER A 56 8.384 14.041 2.060 1.00 0.00 O ATOM 838 CB SER A 56 9.116 15.158 -0.766 1.00 0.00 C ATOM 839 OG SER A 56 10.289 15.561 -0.069 1.00 0.00 O ATOM 0 H SER A 56 7.348 13.721 -1.944 1.00 0.00 H new ATOM 0 HA SER A 56 9.599 13.171 -0.090 1.00 0.00 H new ATOM 0 HB2 SER A 56 9.300 15.155 -1.840 1.00 0.00 H new ATOM 0 HB3 SER A 56 8.308 15.867 -0.583 1.00 0.00 H new ATOM 0 HG SER A 56 10.556 16.456 -0.367 1.00 0.00 H new ATOM 845 N ASP A 57 6.569 13.788 0.848 1.00 0.00 N ATOM 846 CA ASP A 57 5.693 13.892 2.049 1.00 0.00 C ATOM 847 C ASP A 57 5.991 12.707 2.998 1.00 0.00 C ATOM 848 O ASP A 57 5.762 11.577 2.615 1.00 0.00 O ATOM 849 CB ASP A 57 4.231 13.814 1.603 1.00 0.00 C ATOM 850 CG ASP A 57 3.626 15.219 1.591 1.00 0.00 C ATOM 851 OD1 ASP A 57 3.345 15.731 2.661 1.00 0.00 O ATOM 852 OD2 ASP A 57 3.454 15.759 0.510 1.00 0.00 O ATOM 0 H ASP A 57 6.079 13.649 -0.036 1.00 0.00 H new ATOM 0 HA ASP A 57 5.879 14.835 2.564 1.00 0.00 H new ATOM 0 HB2 ASP A 57 4.166 13.370 0.610 1.00 0.00 H new ATOM 0 HB3 ASP A 57 3.668 13.170 2.278 1.00 0.00 H new ATOM 857 N PRO A 58 6.491 12.956 4.203 1.00 0.00 N ATOM 858 CA PRO A 58 6.790 11.851 5.137 1.00 0.00 C ATOM 859 C PRO A 58 5.509 11.080 5.471 1.00 0.00 C ATOM 860 O PRO A 58 5.524 10.132 6.228 1.00 0.00 O ATOM 861 CB PRO A 58 7.356 12.525 6.393 1.00 0.00 C ATOM 862 CG PRO A 58 7.372 14.053 6.141 1.00 0.00 C ATOM 863 CD PRO A 58 6.795 14.303 4.739 1.00 0.00 C ATOM 0 HA PRO A 58 7.492 11.133 4.712 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.744 12.287 7.263 1.00 0.00 H new ATOM 0 HB3 PRO A 58 8.362 12.161 6.602 1.00 0.00 H new ATOM 0 HG2 PRO A 58 6.780 14.571 6.896 1.00 0.00 H new ATOM 0 HG3 PRO A 58 8.388 14.441 6.211 1.00 0.00 H new ATOM 0 HD2 PRO A 58 5.898 14.921 4.786 1.00 0.00 H new ATOM 0 HD3 PRO A 58 7.510 14.827 4.106 1.00 0.00 H new ATOM 871 N HIS A 59 4.401 11.482 4.908 1.00 0.00 N ATOM 872 CA HIS A 59 3.122 10.771 5.194 1.00 0.00 C ATOM 873 C HIS A 59 3.073 9.470 4.391 1.00 0.00 C ATOM 874 O HIS A 59 2.178 8.664 4.550 1.00 0.00 O ATOM 875 CB HIS A 59 1.945 11.663 4.793 1.00 0.00 C ATOM 876 CG HIS A 59 1.726 12.708 5.851 1.00 0.00 C ATOM 877 ND1 HIS A 59 2.328 13.956 5.795 1.00 0.00 N ATOM 878 CD2 HIS A 59 0.974 12.707 7.000 1.00 0.00 C ATOM 879 CE1 HIS A 59 1.931 14.647 6.879 1.00 0.00 C ATOM 880 NE2 HIS A 59 1.105 13.932 7.647 1.00 0.00 N ATOM 0 H HIS A 59 4.326 12.270 4.264 1.00 0.00 H new ATOM 0 HA HIS A 59 3.060 10.544 6.258 1.00 0.00 H new ATOM 0 HB2 HIS A 59 2.146 12.138 3.833 1.00 0.00 H new ATOM 0 HB3 HIS A 59 1.045 11.061 4.669 1.00 0.00 H new ATOM 0 HD2 HIS A 59 0.372 11.881 7.349 1.00 0.00 H new ATOM 0 HE1 HIS A 59 2.242 15.657 7.101 1.00 0.00 H new ATOM 0 HE2 HIS A 59 0.665 14.222 8.520 1.00 0.00 H new ATOM 888 N ILE A 60 4.028 9.259 3.527 1.00 0.00 N ATOM 889 CA ILE A 60 4.035 8.010 2.715 1.00 0.00 C ATOM 890 C ILE A 60 4.764 6.906 3.483 1.00 0.00 C ATOM 891 O ILE A 60 5.004 5.833 2.968 1.00 0.00 O ATOM 892 CB ILE A 60 4.754 8.267 1.388 1.00 0.00 C ATOM 893 CG1 ILE A 60 6.214 8.631 1.664 1.00 0.00 C ATOM 894 CG2 ILE A 60 4.071 9.422 0.652 1.00 0.00 C ATOM 895 CD1 ILE A 60 6.798 9.358 0.451 1.00 0.00 C ATOM 0 H ILE A 60 4.803 9.897 3.349 1.00 0.00 H new ATOM 0 HA ILE A 60 3.009 7.700 2.518 1.00 0.00 H new ATOM 0 HB ILE A 60 4.712 7.369 0.772 1.00 0.00 H new ATOM 0 HG12 ILE A 60 6.281 9.265 2.548 1.00 0.00 H new ATOM 0 HG13 ILE A 60 6.791 7.730 1.874 1.00 0.00 H new ATOM 0 HG21 ILE A 60 4.583 9.605 -0.293 1.00 0.00 H new ATOM 0 HG22 ILE A 60 3.030 9.164 0.457 1.00 0.00 H new ATOM 0 HG23 ILE A 60 4.113 10.321 1.267 1.00 0.00 H new ATOM 0 HD11 ILE A 60 7.838 9.617 0.648 1.00 0.00 H new ATOM 0 HD12 ILE A 60 6.745 8.708 -0.423 1.00 0.00 H new ATOM 0 HD13 ILE A 60 6.227 10.267 0.262 1.00 0.00 H new ATOM 907 N LYS A 61 5.119 7.162 4.713 1.00 0.00 N ATOM 908 CA LYS A 61 5.833 6.127 5.513 1.00 0.00 C ATOM 909 C LYS A 61 4.812 5.253 6.244 1.00 0.00 C ATOM 910 O LYS A 61 4.454 5.512 7.375 1.00 0.00 O ATOM 911 CB LYS A 61 6.744 6.811 6.536 1.00 0.00 C ATOM 912 CG LYS A 61 7.802 7.645 5.807 1.00 0.00 C ATOM 913 CD LYS A 61 9.014 6.772 5.468 1.00 0.00 C ATOM 914 CE LYS A 61 10.053 6.882 6.585 1.00 0.00 C ATOM 915 NZ LYS A 61 9.365 6.880 7.908 1.00 0.00 N ATOM 0 H LYS A 61 4.945 8.042 5.198 1.00 0.00 H new ATOM 0 HA LYS A 61 6.434 5.506 4.849 1.00 0.00 H new ATOM 0 HB2 LYS A 61 6.154 7.449 7.194 1.00 0.00 H new ATOM 0 HB3 LYS A 61 7.226 6.063 7.165 1.00 0.00 H new ATOM 0 HG2 LYS A 61 7.380 8.066 4.894 1.00 0.00 H new ATOM 0 HG3 LYS A 61 8.110 8.483 6.432 1.00 0.00 H new ATOM 0 HD2 LYS A 61 8.705 5.734 5.346 1.00 0.00 H new ATOM 0 HD3 LYS A 61 9.449 7.088 4.520 1.00 0.00 H new ATOM 0 HE2 LYS A 61 10.754 6.050 6.527 1.00 0.00 H new ATOM 0 HE3 LYS A 61 10.634 7.797 6.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 10.072 6.955 8.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 8.713 7.688 7.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 8.830 5.995 8.020 1.00 0.00 H new ATOM 929 N LEU A 62 4.342 4.218 5.605 1.00 0.00 N ATOM 930 CA LEU A 62 3.344 3.326 6.263 1.00 0.00 C ATOM 931 C LEU A 62 4.072 2.186 6.976 1.00 0.00 C ATOM 932 O LEU A 62 4.983 1.586 6.440 1.00 0.00 O ATOM 933 CB LEU A 62 2.402 2.748 5.205 1.00 0.00 C ATOM 934 CG LEU A 62 1.993 3.852 4.228 1.00 0.00 C ATOM 935 CD1 LEU A 62 0.882 3.336 3.312 1.00 0.00 C ATOM 936 CD2 LEU A 62 1.485 5.063 5.013 1.00 0.00 C ATOM 0 H LEU A 62 4.605 3.951 4.656 1.00 0.00 H new ATOM 0 HA LEU A 62 2.767 3.898 6.989 1.00 0.00 H new ATOM 0 HB2 LEU A 62 2.894 1.937 4.668 1.00 0.00 H new ATOM 0 HB3 LEU A 62 1.518 2.324 5.682 1.00 0.00 H new ATOM 0 HG LEU A 62 2.854 4.143 3.626 1.00 0.00 H new ATOM 0 HD11 LEU A 62 0.590 4.122 2.616 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.243 2.472 2.754 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.020 3.045 3.913 1.00 0.00 H new ATOM 0 HD21 LEU A 62 1.193 5.851 4.318 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.624 4.772 5.614 1.00 0.00 H new ATOM 0 HD23 LEU A 62 2.276 5.431 5.667 1.00 0.00 H new ATOM 948 N GLN A 63 3.681 1.882 8.183 1.00 0.00 N ATOM 949 CA GLN A 63 4.352 0.783 8.931 1.00 0.00 C ATOM 950 C GLN A 63 3.643 -0.541 8.639 1.00 0.00 C ATOM 951 O GLN A 63 2.561 -0.797 9.129 1.00 0.00 O ATOM 952 CB GLN A 63 4.292 1.075 10.431 1.00 0.00 C ATOM 953 CG GLN A 63 5.323 0.213 11.162 1.00 0.00 C ATOM 954 CD GLN A 63 6.724 0.777 10.920 1.00 0.00 C ATOM 955 OE1 GLN A 63 7.573 0.096 10.201 1.00 0.00 O flip ATOM 956 NE2 GLN A 63 7.050 1.849 11.390 1.00 0.00 N flip ATOM 0 H GLN A 63 2.925 2.348 8.684 1.00 0.00 H new ATOM 0 HA GLN A 63 5.393 0.714 8.617 1.00 0.00 H new ATOM 0 HB2 GLN A 63 4.490 2.131 10.615 1.00 0.00 H new ATOM 0 HB3 GLN A 63 3.292 0.867 10.813 1.00 0.00 H new ATOM 0 HG2 GLN A 63 5.106 0.195 12.230 1.00 0.00 H new ATOM 0 HG3 GLN A 63 5.268 -0.817 10.809 1.00 0.00 H new ATOM 0 HE21 GLN A 63 6.387 2.382 11.952 1.00 0.00 H new ATOM 0 HE22 GLN A 63 7.987 2.216 11.222 1.00 0.00 H new ATOM 965 N LEU A 64 4.243 -1.382 7.842 1.00 0.00 N ATOM 966 CA LEU A 64 3.605 -2.688 7.520 1.00 0.00 C ATOM 967 C LEU A 64 4.042 -3.734 8.547 1.00 0.00 C ATOM 968 O LEU A 64 5.104 -3.639 9.130 1.00 0.00 O ATOM 969 CB LEU A 64 4.033 -3.135 6.121 1.00 0.00 C ATOM 970 CG LEU A 64 3.199 -2.398 5.071 1.00 0.00 C ATOM 971 CD1 LEU A 64 3.347 -0.888 5.269 1.00 0.00 C ATOM 972 CD2 LEU A 64 3.691 -2.778 3.673 1.00 0.00 C ATOM 0 H LEU A 64 5.148 -1.220 7.400 1.00 0.00 H new ATOM 0 HA LEU A 64 2.521 -2.580 7.549 1.00 0.00 H new ATOM 0 HB2 LEU A 64 5.092 -2.928 5.970 1.00 0.00 H new ATOM 0 HB3 LEU A 64 3.901 -4.212 6.016 1.00 0.00 H new ATOM 0 HG LEU A 64 2.151 -2.677 5.178 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.753 -0.363 4.521 1.00 0.00 H new ATOM 0 HD12 LEU A 64 2.999 -0.616 6.265 1.00 0.00 H new ATOM 0 HD13 LEU A 64 4.395 -0.608 5.162 1.00 0.00 H new ATOM 0 HD21 LEU A 64 3.098 -2.254 2.924 1.00 0.00 H new ATOM 0 HD22 LEU A 64 4.739 -2.498 3.567 1.00 0.00 H new ATOM 0 HD23 LEU A 64 3.587 -3.854 3.531 1.00 0.00 H new ATOM 984 N GLN A 65 3.230 -4.732 8.773 1.00 0.00 N ATOM 985 CA GLN A 65 3.599 -5.785 9.762 1.00 0.00 C ATOM 986 C GLN A 65 3.082 -7.142 9.280 1.00 0.00 C ATOM 987 O GLN A 65 1.976 -7.258 8.790 1.00 0.00 O ATOM 988 CB GLN A 65 2.971 -5.453 11.118 1.00 0.00 C ATOM 989 CG GLN A 65 2.956 -6.706 11.995 1.00 0.00 C ATOM 990 CD GLN A 65 2.940 -6.297 13.469 1.00 0.00 C ATOM 991 OE1 GLN A 65 2.175 -5.440 13.866 1.00 0.00 O ATOM 992 NE2 GLN A 65 3.758 -6.877 14.304 1.00 0.00 N ATOM 0 H GLN A 65 2.328 -4.863 8.316 1.00 0.00 H new ATOM 0 HA GLN A 65 4.684 -5.824 9.863 1.00 0.00 H new ATOM 0 HB2 GLN A 65 3.536 -4.660 11.608 1.00 0.00 H new ATOM 0 HB3 GLN A 65 1.956 -5.081 10.979 1.00 0.00 H new ATOM 0 HG2 GLN A 65 2.080 -7.313 11.766 1.00 0.00 H new ATOM 0 HG3 GLN A 65 3.833 -7.319 11.786 1.00 0.00 H new ATOM 0 HE21 GLN A 65 4.400 -7.596 13.972 1.00 0.00 H new ATOM 0 HE22 GLN A 65 3.755 -6.611 15.289 1.00 0.00 H new ATOM 1001 N ALA A 66 3.875 -8.170 9.414 1.00 0.00 N ATOM 1002 CA ALA A 66 3.430 -9.519 8.963 1.00 0.00 C ATOM 1003 C ALA A 66 2.676 -10.213 10.100 1.00 0.00 C ATOM 1004 O ALA A 66 3.196 -10.388 11.184 1.00 0.00 O ATOM 1005 CB ALA A 66 4.652 -10.355 8.576 1.00 0.00 C ATOM 0 H ALA A 66 4.812 -8.134 9.816 1.00 0.00 H new ATOM 0 HA ALA A 66 2.772 -9.416 8.100 1.00 0.00 H new ATOM 0 HB1 ALA A 66 4.328 -11.342 8.246 1.00 0.00 H new ATOM 0 HB2 ALA A 66 5.190 -9.860 7.767 1.00 0.00 H new ATOM 0 HB3 ALA A 66 5.310 -10.459 9.439 1.00 0.00 H new ATOM 1011 N GLU A 67 1.455 -10.608 9.860 1.00 0.00 N ATOM 1012 CA GLU A 67 0.666 -11.290 10.925 1.00 0.00 C ATOM 1013 C GLU A 67 0.787 -12.805 10.760 1.00 0.00 C ATOM 1014 O GLU A 67 1.505 -13.462 11.488 1.00 0.00 O ATOM 1015 CB GLU A 67 -0.803 -10.878 10.813 1.00 0.00 C ATOM 1016 CG GLU A 67 -1.552 -11.309 12.076 1.00 0.00 C ATOM 1017 CD GLU A 67 -1.468 -10.198 13.125 1.00 0.00 C ATOM 1018 OE1 GLU A 67 -0.362 -9.800 13.450 1.00 0.00 O ATOM 1019 OE2 GLU A 67 -2.511 -9.764 13.584 1.00 0.00 O ATOM 0 H GLU A 67 0.969 -10.488 8.971 1.00 0.00 H new ATOM 0 HA GLU A 67 1.050 -11.001 11.903 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -0.880 -9.799 10.682 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.255 -11.339 9.934 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -2.594 -11.521 11.839 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.121 -12.229 12.471 1.00 0.00 H new ATOM 1026 N GLU A 68 0.091 -13.363 9.810 1.00 0.00 N ATOM 1027 CA GLU A 68 0.160 -14.836 9.594 1.00 0.00 C ATOM 1028 C GLU A 68 1.180 -15.145 8.497 1.00 0.00 C ATOM 1029 O GLU A 68 2.329 -14.756 8.576 1.00 0.00 O ATOM 1030 CB GLU A 68 -1.216 -15.354 9.169 1.00 0.00 C ATOM 1031 CG GLU A 68 -2.249 -14.996 10.238 1.00 0.00 C ATOM 1032 CD GLU A 68 -3.156 -16.201 10.495 1.00 0.00 C ATOM 1033 OE1 GLU A 68 -3.853 -16.599 9.576 1.00 0.00 O ATOM 1034 OE2 GLU A 68 -3.139 -16.704 11.607 1.00 0.00 O ATOM 0 H GLU A 68 -0.525 -12.861 9.171 1.00 0.00 H new ATOM 0 HA GLU A 68 0.463 -15.324 10.520 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -1.501 -14.917 8.212 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -1.182 -16.434 9.028 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -1.747 -14.702 11.160 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.844 -14.142 9.913 1.00 0.00 H new ATOM 1041 N ARG A 69 0.770 -15.843 7.472 1.00 0.00 N ATOM 1042 CA ARG A 69 1.716 -16.177 6.371 1.00 0.00 C ATOM 1043 C ARG A 69 1.627 -15.110 5.279 1.00 0.00 C ATOM 1044 O ARG A 69 2.482 -14.255 5.158 1.00 0.00 O ATOM 1045 CB ARG A 69 1.352 -17.541 5.783 1.00 0.00 C ATOM 1046 CG ARG A 69 2.444 -18.556 6.130 1.00 0.00 C ATOM 1047 CD ARG A 69 2.077 -19.921 5.546 1.00 0.00 C ATOM 1048 NE ARG A 69 2.878 -20.982 6.222 1.00 0.00 N ATOM 1049 CZ ARG A 69 2.532 -22.234 6.108 1.00 0.00 C ATOM 1050 NH1 ARG A 69 1.483 -22.559 5.402 1.00 0.00 N ATOM 1051 NH2 ARG A 69 3.233 -23.163 6.698 1.00 0.00 N ATOM 0 H ARG A 69 -0.179 -16.196 7.351 1.00 0.00 H new ATOM 0 HA ARG A 69 2.732 -16.210 6.763 1.00 0.00 H new ATOM 0 HB2 ARG A 69 0.392 -17.874 6.178 1.00 0.00 H new ATOM 0 HB3 ARG A 69 1.242 -17.465 4.701 1.00 0.00 H new ATOM 0 HG2 ARG A 69 3.403 -18.224 5.732 1.00 0.00 H new ATOM 0 HG3 ARG A 69 2.556 -18.630 7.212 1.00 0.00 H new ATOM 0 HD2 ARG A 69 1.012 -20.112 5.681 1.00 0.00 H new ATOM 0 HD3 ARG A 69 2.269 -19.933 4.473 1.00 0.00 H new ATOM 0 HE ARG A 69 3.697 -20.728 6.774 1.00 0.00 H new ATOM 0 HH11 ARG A 69 0.935 -21.834 4.940 1.00 0.00 H new ATOM 0 HH12 ARG A 69 1.212 -23.538 5.312 1.00 0.00 H new ATOM 0 HH21 ARG A 69 4.053 -22.910 7.249 1.00 0.00 H new ATOM 0 HH22 ARG A 69 2.961 -24.142 6.608 1.00 0.00 H new ATOM 1065 N GLY A 70 0.598 -15.156 4.482 1.00 0.00 N ATOM 1066 CA GLY A 70 0.450 -14.148 3.394 1.00 0.00 C ATOM 1067 C GLY A 70 -0.359 -12.954 3.905 1.00 0.00 C ATOM 1068 O GLY A 70 -0.689 -12.053 3.161 1.00 0.00 O ATOM 0 H GLY A 70 -0.149 -15.849 4.536 1.00 0.00 H new ATOM 0 HA2 GLY A 70 1.432 -13.817 3.056 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.048 -14.597 2.535 1.00 0.00 H new ATOM 1072 N VAL A 71 -0.681 -12.941 5.169 1.00 0.00 N ATOM 1073 CA VAL A 71 -1.469 -11.803 5.722 1.00 0.00 C ATOM 1074 C VAL A 71 -0.515 -10.714 6.218 1.00 0.00 C ATOM 1075 O VAL A 71 0.514 -10.996 6.801 1.00 0.00 O ATOM 1076 CB VAL A 71 -2.330 -12.296 6.887 1.00 0.00 C ATOM 1077 CG1 VAL A 71 -3.225 -11.157 7.378 1.00 0.00 C ATOM 1078 CG2 VAL A 71 -3.203 -13.462 6.417 1.00 0.00 C ATOM 0 H VAL A 71 -0.434 -13.667 5.842 1.00 0.00 H new ATOM 0 HA VAL A 71 -2.112 -11.395 4.942 1.00 0.00 H new ATOM 0 HB VAL A 71 -1.685 -12.628 7.700 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.838 -11.508 8.208 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -2.605 -10.325 7.712 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -3.870 -10.825 6.565 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -3.817 -13.814 7.246 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -3.848 -13.129 5.604 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -2.567 -14.274 6.066 1.00 0.00 H new ATOM 1088 N VAL A 72 -0.852 -9.472 5.991 1.00 0.00 N ATOM 1089 CA VAL A 72 0.030 -8.358 6.446 1.00 0.00 C ATOM 1090 C VAL A 72 -0.835 -7.209 6.968 1.00 0.00 C ATOM 1091 O VAL A 72 -1.735 -6.744 6.298 1.00 0.00 O ATOM 1092 CB VAL A 72 0.878 -7.865 5.273 1.00 0.00 C ATOM 1093 CG1 VAL A 72 1.725 -9.020 4.734 1.00 0.00 C ATOM 1094 CG2 VAL A 72 -0.039 -7.346 4.163 1.00 0.00 C ATOM 0 H VAL A 72 -1.702 -9.181 5.509 1.00 0.00 H new ATOM 0 HA VAL A 72 0.685 -8.714 7.241 1.00 0.00 H new ATOM 0 HB VAL A 72 1.532 -7.061 5.611 1.00 0.00 H new ATOM 0 HG11 VAL A 72 2.329 -8.669 3.898 1.00 0.00 H new ATOM 0 HG12 VAL A 72 2.379 -9.391 5.523 1.00 0.00 H new ATOM 0 HG13 VAL A 72 1.071 -9.824 4.396 1.00 0.00 H new ATOM 0 HG21 VAL A 72 0.565 -6.994 3.327 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -0.693 -8.150 3.826 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -0.643 -6.523 4.545 1.00 0.00 H new ATOM 1104 N SER A 73 -0.572 -6.751 8.161 1.00 0.00 N ATOM 1105 CA SER A 73 -1.382 -5.635 8.725 1.00 0.00 C ATOM 1106 C SER A 73 -0.723 -4.298 8.382 1.00 0.00 C ATOM 1107 O SER A 73 0.411 -4.044 8.738 1.00 0.00 O ATOM 1108 CB SER A 73 -1.468 -5.785 10.245 1.00 0.00 C ATOM 1109 OG SER A 73 -1.644 -7.157 10.571 1.00 0.00 O ATOM 0 H SER A 73 0.168 -7.101 8.769 1.00 0.00 H new ATOM 0 HA SER A 73 -2.385 -5.664 8.298 1.00 0.00 H new ATOM 0 HB2 SER A 73 -0.561 -5.402 10.712 1.00 0.00 H new ATOM 0 HB3 SER A 73 -2.299 -5.197 10.634 1.00 0.00 H new ATOM 0 HG SER A 73 -1.698 -7.258 11.544 1.00 0.00 H new ATOM 1115 N ILE A 74 -1.425 -3.438 7.695 1.00 0.00 N ATOM 1116 CA ILE A 74 -0.838 -2.118 7.331 1.00 0.00 C ATOM 1117 C ILE A 74 -1.197 -1.090 8.407 1.00 0.00 C ATOM 1118 O ILE A 74 -2.265 -1.128 8.983 1.00 0.00 O ATOM 1119 CB ILE A 74 -1.401 -1.663 5.984 1.00 0.00 C ATOM 1120 CG1 ILE A 74 -1.426 -2.848 5.015 1.00 0.00 C ATOM 1121 CG2 ILE A 74 -0.517 -0.554 5.409 1.00 0.00 C ATOM 1122 CD1 ILE A 74 -1.890 -2.371 3.637 1.00 0.00 C ATOM 0 H ILE A 74 -2.379 -3.593 7.370 1.00 0.00 H new ATOM 0 HA ILE A 74 0.246 -2.208 7.259 1.00 0.00 H new ATOM 0 HB ILE A 74 -2.414 -1.285 6.123 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -0.434 -3.293 4.942 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -2.096 -3.622 5.388 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.918 -0.230 4.449 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -0.498 0.290 6.098 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.496 -0.932 5.270 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.908 -3.215 2.947 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -2.891 -1.946 3.717 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -1.202 -1.612 3.264 1.00 0.00 H new ATOM 1134 N LYS A 75 -0.311 -0.171 8.682 1.00 0.00 N ATOM 1135 CA LYS A 75 -0.603 0.857 9.721 1.00 0.00 C ATOM 1136 C LYS A 75 0.066 2.178 9.331 1.00 0.00 C ATOM 1137 O LYS A 75 1.149 2.196 8.780 1.00 0.00 O ATOM 1138 CB LYS A 75 -0.056 0.385 11.070 1.00 0.00 C ATOM 1139 CG LYS A 75 -0.507 1.347 12.172 1.00 0.00 C ATOM 1140 CD LYS A 75 0.709 1.798 12.982 1.00 0.00 C ATOM 1141 CE LYS A 75 0.242 2.580 14.212 1.00 0.00 C ATOM 1142 NZ LYS A 75 1.420 3.196 14.885 1.00 0.00 N ATOM 0 H LYS A 75 0.601 -0.088 8.233 1.00 0.00 H new ATOM 0 HA LYS A 75 -1.680 1.004 9.797 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -0.411 -0.623 11.285 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.033 0.339 11.036 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -1.006 2.211 11.734 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -1.231 0.857 12.824 1.00 0.00 H new ATOM 0 HD2 LYS A 75 1.296 0.932 13.290 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.358 2.421 12.367 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -0.467 3.353 13.917 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -0.279 1.916 14.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 1.104 3.728 15.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.081 2.449 15.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 1.899 3.842 14.225 1.00 0.00 H new ATOM 1156 N GLY A 76 -0.570 3.282 9.610 1.00 0.00 N ATOM 1157 CA GLY A 76 0.032 4.599 9.254 1.00 0.00 C ATOM 1158 C GLY A 76 1.003 5.034 10.351 1.00 0.00 C ATOM 1159 O GLY A 76 0.745 4.862 11.526 1.00 0.00 O ATOM 0 H GLY A 76 -1.480 3.330 10.069 1.00 0.00 H new ATOM 0 HA2 GLY A 76 0.555 4.525 8.300 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -0.752 5.347 9.131 1.00 0.00 H new ATOM 1163 N VAL A 77 2.120 5.598 9.979 1.00 0.00 N ATOM 1164 CA VAL A 77 3.107 6.044 11.002 1.00 0.00 C ATOM 1165 C VAL A 77 2.666 7.390 11.583 1.00 0.00 C ATOM 1166 O VAL A 77 2.464 7.526 12.774 1.00 0.00 O ATOM 1167 CB VAL A 77 4.482 6.198 10.350 1.00 0.00 C ATOM 1168 CG1 VAL A 77 5.442 6.868 11.334 1.00 0.00 C ATOM 1169 CG2 VAL A 77 5.023 4.816 9.973 1.00 0.00 C ATOM 0 H VAL A 77 2.391 5.769 9.011 1.00 0.00 H new ATOM 0 HA VAL A 77 3.163 5.304 11.800 1.00 0.00 H new ATOM 0 HB VAL A 77 4.393 6.813 9.454 1.00 0.00 H new ATOM 0 HG11 VAL A 77 6.422 6.978 10.869 1.00 0.00 H new ATOM 0 HG12 VAL A 77 5.057 7.851 11.606 1.00 0.00 H new ATOM 0 HG13 VAL A 77 5.532 6.254 12.230 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.003 4.923 9.508 1.00 0.00 H new ATOM 0 HG22 VAL A 77 5.112 4.203 10.870 1.00 0.00 H new ATOM 0 HG23 VAL A 77 4.340 4.336 9.272 1.00 0.00 H new ATOM 1179 N SER A 78 2.514 8.384 10.752 1.00 0.00 N ATOM 1180 CA SER A 78 2.087 9.719 11.257 1.00 0.00 C ATOM 1181 C SER A 78 0.567 9.733 11.441 1.00 0.00 C ATOM 1182 O SER A 78 0.057 10.220 12.429 1.00 0.00 O ATOM 1183 CB SER A 78 2.487 10.797 10.250 1.00 0.00 C ATOM 1184 OG SER A 78 1.499 11.819 10.239 1.00 0.00 O ATOM 0 H SER A 78 2.667 8.329 9.745 1.00 0.00 H new ATOM 0 HA SER A 78 2.571 9.917 12.213 1.00 0.00 H new ATOM 0 HB2 SER A 78 3.458 11.216 10.515 1.00 0.00 H new ATOM 0 HB3 SER A 78 2.588 10.362 9.256 1.00 0.00 H new ATOM 0 HG SER A 78 1.753 12.513 9.595 1.00 0.00 H new ATOM 1190 N ALA A 79 -0.158 9.203 10.494 1.00 0.00 N ATOM 1191 CA ALA A 79 -1.644 9.187 10.617 1.00 0.00 C ATOM 1192 C ALA A 79 -2.046 8.372 11.848 1.00 0.00 C ATOM 1193 O ALA A 79 -3.102 8.568 12.415 1.00 0.00 O ATOM 1194 CB ALA A 79 -2.251 8.554 9.364 1.00 0.00 C ATOM 0 H ALA A 79 0.213 8.781 9.642 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.011 10.208 10.723 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -3.337 8.542 9.452 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -1.965 9.135 8.488 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.884 7.533 9.258 1.00 0.00 H new ATOM 1200 N ASN A 80 -1.212 7.459 12.264 1.00 0.00 N ATOM 1201 CA ASN A 80 -1.547 6.632 13.458 1.00 0.00 C ATOM 1202 C ASN A 80 -2.943 6.030 13.289 1.00 0.00 C ATOM 1203 O ASN A 80 -3.783 6.133 14.161 1.00 0.00 O ATOM 1204 CB ASN A 80 -1.518 7.511 14.711 1.00 0.00 C ATOM 1205 CG ASN A 80 -0.069 7.735 15.145 1.00 0.00 C ATOM 1206 OD1 ASN A 80 0.743 8.386 14.359 1.00 0.00 O flip ATOM 1207 ND2 ASN A 80 0.330 7.312 16.213 1.00 0.00 N flip ATOM 0 H ASN A 80 -0.313 7.250 11.829 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.817 5.829 13.560 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -2.000 8.467 14.508 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -2.080 7.035 15.515 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -0.304 6.803 16.829 1.00 0.00 H new ATOM 0 HD22 ASN A 80 1.299 7.467 16.493 1.00 0.00 H new ATOM 1214 N ARG A 81 -3.198 5.401 12.175 1.00 0.00 N ATOM 1215 CA ARG A 81 -4.540 4.792 11.954 1.00 0.00 C ATOM 1216 C ARG A 81 -4.396 3.546 11.080 1.00 0.00 C ATOM 1217 O ARG A 81 -3.517 3.457 10.246 1.00 0.00 O ATOM 1218 CB ARG A 81 -5.452 5.802 11.255 1.00 0.00 C ATOM 1219 CG ARG A 81 -5.970 6.818 12.275 1.00 0.00 C ATOM 1220 CD ARG A 81 -6.942 7.781 11.588 1.00 0.00 C ATOM 1221 NE ARG A 81 -7.334 8.855 12.544 1.00 0.00 N ATOM 1222 CZ ARG A 81 -7.912 9.939 12.105 1.00 0.00 C ATOM 1223 NH1 ARG A 81 -8.146 10.082 10.828 1.00 0.00 N ATOM 1224 NH2 ARG A 81 -8.256 10.880 12.941 1.00 0.00 N ATOM 0 H ARG A 81 -2.536 5.282 11.409 1.00 0.00 H new ATOM 0 HA ARG A 81 -4.975 4.515 12.914 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -4.905 6.313 10.463 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -6.288 5.286 10.783 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -6.470 6.303 13.095 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -5.137 7.372 12.707 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -6.475 8.218 10.705 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -7.826 7.242 11.248 1.00 0.00 H new ATOM 0 HE ARG A 81 -7.150 8.743 13.541 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -7.877 9.346 10.175 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -8.598 10.929 10.484 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -8.073 10.768 13.938 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -8.708 11.727 12.597 1.00 0.00 H new ATOM 1238 N TYR A 82 -5.253 2.579 11.265 1.00 0.00 N ATOM 1239 CA TYR A 82 -5.167 1.337 10.447 1.00 0.00 C ATOM 1240 C TYR A 82 -6.074 1.466 9.222 1.00 0.00 C ATOM 1241 O TYR A 82 -7.234 1.813 9.329 1.00 0.00 O ATOM 1242 CB TYR A 82 -5.616 0.142 11.289 1.00 0.00 C ATOM 1243 CG TYR A 82 -4.686 -0.022 12.467 1.00 0.00 C ATOM 1244 CD1 TYR A 82 -4.848 0.780 13.603 1.00 0.00 C ATOM 1245 CD2 TYR A 82 -3.663 -0.974 12.422 1.00 0.00 C ATOM 1246 CE1 TYR A 82 -3.984 0.628 14.695 1.00 0.00 C ATOM 1247 CE2 TYR A 82 -2.799 -1.126 13.513 1.00 0.00 C ATOM 1248 CZ TYR A 82 -2.960 -0.326 14.650 1.00 0.00 C ATOM 1249 OH TYR A 82 -2.108 -0.475 15.726 1.00 0.00 O ATOM 0 H TYR A 82 -6.010 2.596 11.949 1.00 0.00 H new ATOM 0 HA TYR A 82 -4.138 1.188 10.121 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -6.638 0.292 11.637 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -5.616 -0.764 10.683 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -5.638 1.515 13.637 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -3.539 -1.592 11.545 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -4.108 1.247 15.572 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -2.008 -1.861 13.477 1.00 0.00 H new ATOM 0 HH TYR A 82 -1.456 -1.180 15.532 1.00 0.00 H new ATOM 1259 N LEU A 83 -5.556 1.190 8.055 1.00 0.00 N ATOM 1260 CA LEU A 83 -6.390 1.296 6.825 1.00 0.00 C ATOM 1261 C LEU A 83 -7.590 0.353 6.945 1.00 0.00 C ATOM 1262 O LEU A 83 -7.482 -0.737 7.472 1.00 0.00 O ATOM 1263 CB LEU A 83 -5.548 0.905 5.605 1.00 0.00 C ATOM 1264 CG LEU A 83 -6.361 1.096 4.318 1.00 0.00 C ATOM 1265 CD1 LEU A 83 -6.721 2.574 4.136 1.00 0.00 C ATOM 1266 CD2 LEU A 83 -5.529 0.630 3.121 1.00 0.00 C ATOM 0 H LEU A 83 -4.591 0.896 7.901 1.00 0.00 H new ATOM 0 HA LEU A 83 -6.744 2.320 6.707 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -4.645 1.514 5.567 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -5.229 -0.134 5.692 1.00 0.00 H new ATOM 0 HG LEU A 83 -7.278 0.510 4.386 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -7.298 2.698 3.219 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -7.314 2.911 4.986 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -5.808 3.166 4.073 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -6.103 0.764 2.204 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -4.613 1.217 3.064 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -5.278 -0.424 3.241 1.00 0.00 H new ATOM 1278 N ALA A 84 -8.730 0.762 6.462 1.00 0.00 N ATOM 1279 CA ALA A 84 -9.933 -0.114 6.551 1.00 0.00 C ATOM 1280 C ALA A 84 -10.838 0.135 5.343 1.00 0.00 C ATOM 1281 O ALA A 84 -11.117 1.261 4.986 1.00 0.00 O ATOM 1282 CB ALA A 84 -10.699 0.202 7.837 1.00 0.00 C ATOM 0 H ALA A 84 -8.881 1.664 6.010 1.00 0.00 H new ATOM 0 HA ALA A 84 -9.622 -1.159 6.561 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -11.579 -0.438 7.903 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.055 0.023 8.698 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.010 1.247 7.828 1.00 0.00 H new ATOM 1288 N MET A 85 -11.301 -0.910 4.714 1.00 0.00 N ATOM 1289 CA MET A 85 -12.190 -0.733 3.532 1.00 0.00 C ATOM 1290 C MET A 85 -13.648 -0.744 3.992 1.00 0.00 C ATOM 1291 O MET A 85 -14.011 -1.442 4.918 1.00 0.00 O ATOM 1292 CB MET A 85 -11.956 -1.879 2.543 1.00 0.00 C ATOM 1293 CG MET A 85 -12.812 -1.661 1.293 1.00 0.00 C ATOM 1294 SD MET A 85 -12.474 -2.975 0.093 1.00 0.00 S ATOM 1295 CE MET A 85 -11.067 -2.184 -0.726 1.00 0.00 C ATOM 0 H MET A 85 -11.102 -1.878 4.967 1.00 0.00 H new ATOM 0 HA MET A 85 -11.968 0.216 3.045 1.00 0.00 H new ATOM 0 HB2 MET A 85 -10.902 -1.928 2.270 1.00 0.00 H new ATOM 0 HB3 MET A 85 -12.209 -2.832 3.008 1.00 0.00 H new ATOM 0 HG2 MET A 85 -13.869 -1.660 1.559 1.00 0.00 H new ATOM 0 HG3 MET A 85 -12.593 -0.688 0.854 1.00 0.00 H new ATOM 0 HE1 MET A 85 -10.413 -2.949 -1.145 1.00 0.00 H new ATOM 0 HE2 MET A 85 -11.428 -1.537 -1.526 1.00 0.00 H new ATOM 0 HE3 MET A 85 -10.511 -1.589 -0.001 1.00 0.00 H new ATOM 1305 N LYS A 86 -14.489 0.024 3.353 1.00 0.00 N ATOM 1306 CA LYS A 86 -15.923 0.057 3.759 1.00 0.00 C ATOM 1307 C LYS A 86 -16.714 -0.955 2.928 1.00 0.00 C ATOM 1308 O LYS A 86 -16.162 -1.677 2.121 1.00 0.00 O ATOM 1309 CB LYS A 86 -16.486 1.462 3.527 1.00 0.00 C ATOM 1310 CG LYS A 86 -16.073 2.378 4.684 1.00 0.00 C ATOM 1311 CD LYS A 86 -17.036 2.201 5.864 1.00 0.00 C ATOM 1312 CE LYS A 86 -16.247 2.238 7.175 1.00 0.00 C ATOM 1313 NZ LYS A 86 -17.185 2.093 8.324 1.00 0.00 N ATOM 0 H LYS A 86 -14.245 0.629 2.569 1.00 0.00 H new ATOM 0 HA LYS A 86 -16.007 -0.198 4.815 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -16.116 1.862 2.583 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -17.573 1.422 3.452 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -15.055 2.146 4.997 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -16.076 3.417 4.355 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -17.787 2.991 5.856 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -17.569 1.254 5.774 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -15.509 1.436 7.191 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -15.699 3.177 7.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -16.649 2.118 9.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -17.873 2.873 8.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -17.689 1.186 8.249 1.00 0.00 H new ATOM 1327 N GLU A 87 -18.004 -1.016 3.122 1.00 0.00 N ATOM 1328 CA GLU A 87 -18.830 -1.984 2.344 1.00 0.00 C ATOM 1329 C GLU A 87 -19.099 -1.423 0.947 1.00 0.00 C ATOM 1330 O GLU A 87 -19.066 -2.137 -0.036 1.00 0.00 O ATOM 1331 CB GLU A 87 -20.160 -2.212 3.064 1.00 0.00 C ATOM 1332 CG GLU A 87 -19.916 -2.318 4.570 1.00 0.00 C ATOM 1333 CD GLU A 87 -18.865 -3.396 4.842 1.00 0.00 C ATOM 1334 OE1 GLU A 87 -18.985 -4.469 4.275 1.00 0.00 O ATOM 1335 OE2 GLU A 87 -17.958 -3.128 5.613 1.00 0.00 O ATOM 0 H GLU A 87 -18.521 -0.438 3.785 1.00 0.00 H new ATOM 0 HA GLU A 87 -18.294 -2.929 2.258 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -20.845 -1.391 2.853 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -20.632 -3.123 2.697 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -19.579 -1.359 4.963 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -20.846 -2.564 5.083 1.00 0.00 H new ATOM 1342 N ASP A 88 -19.367 -0.151 0.849 1.00 0.00 N ATOM 1343 CA ASP A 88 -19.641 0.451 -0.486 1.00 0.00 C ATOM 1344 C ASP A 88 -18.350 0.482 -1.307 1.00 0.00 C ATOM 1345 O ASP A 88 -18.363 0.269 -2.503 1.00 0.00 O ATOM 1346 CB ASP A 88 -20.168 1.877 -0.306 1.00 0.00 C ATOM 1347 CG ASP A 88 -19.401 2.569 0.821 1.00 0.00 C ATOM 1348 OD1 ASP A 88 -18.223 2.291 0.967 1.00 0.00 O ATOM 1349 OD2 ASP A 88 -20.005 3.367 1.519 1.00 0.00 O ATOM 0 H ASP A 88 -19.408 0.498 1.635 1.00 0.00 H new ATOM 0 HA ASP A 88 -20.388 -0.148 -1.007 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -20.055 2.437 -1.234 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -21.233 1.855 -0.075 1.00 0.00 H new ATOM 1354 N GLY A 89 -17.236 0.740 -0.669 1.00 0.00 N ATOM 1355 CA GLY A 89 -15.938 0.782 -1.406 1.00 0.00 C ATOM 1356 C GLY A 89 -15.127 1.997 -0.950 1.00 0.00 C ATOM 1357 O GLY A 89 -14.045 2.251 -1.441 1.00 0.00 O ATOM 0 H GLY A 89 -17.170 0.924 0.332 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -15.375 -0.133 -1.223 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -16.119 0.835 -2.479 1.00 0.00 H new ATOM 1361 N ARG A 90 -15.639 2.751 -0.016 1.00 0.00 N ATOM 1362 CA ARG A 90 -14.893 3.948 0.466 1.00 0.00 C ATOM 1363 C ARG A 90 -13.759 3.502 1.393 1.00 0.00 C ATOM 1364 O ARG A 90 -13.987 2.896 2.421 1.00 0.00 O ATOM 1365 CB ARG A 90 -15.844 4.873 1.230 1.00 0.00 C ATOM 1366 CG ARG A 90 -16.996 5.290 0.310 1.00 0.00 C ATOM 1367 CD ARG A 90 -17.417 6.731 0.619 1.00 0.00 C ATOM 1368 NE ARG A 90 -17.272 7.006 2.085 1.00 0.00 N ATOM 1369 CZ ARG A 90 -17.812 6.222 2.981 1.00 0.00 C ATOM 1370 NH1 ARG A 90 -18.651 5.289 2.625 1.00 0.00 N ATOM 1371 NH2 ARG A 90 -17.556 6.414 4.246 1.00 0.00 N ATOM 0 H ARG A 90 -16.540 2.590 0.434 1.00 0.00 H new ATOM 0 HA ARG A 90 -14.477 4.483 -0.387 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -16.234 4.364 2.112 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -15.308 5.754 1.582 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -16.688 5.208 -0.732 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -17.843 4.618 0.446 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -16.804 7.428 0.048 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -18.451 6.890 0.312 1.00 0.00 H new ATOM 0 HE ARG A 90 -16.741 7.822 2.390 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -18.890 5.167 1.641 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -19.068 4.682 3.331 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -16.937 7.173 4.532 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -17.975 5.805 4.949 1.00 0.00 H new ATOM 1385 N LEU A 91 -12.538 3.797 1.036 1.00 0.00 N ATOM 1386 CA LEU A 91 -11.392 3.388 1.895 1.00 0.00 C ATOM 1387 C LEU A 91 -11.047 4.524 2.859 1.00 0.00 C ATOM 1388 O LEU A 91 -10.971 5.674 2.476 1.00 0.00 O ATOM 1389 CB LEU A 91 -10.178 3.083 1.014 1.00 0.00 C ATOM 1390 CG LEU A 91 -10.361 1.720 0.345 1.00 0.00 C ATOM 1391 CD1 LEU A 91 -11.656 1.719 -0.470 1.00 0.00 C ATOM 1392 CD2 LEU A 91 -9.177 1.447 -0.585 1.00 0.00 C ATOM 0 H LEU A 91 -12.286 4.303 0.187 1.00 0.00 H new ATOM 0 HA LEU A 91 -11.663 2.498 2.463 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -10.061 3.858 0.257 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -9.269 3.085 1.616 1.00 0.00 H new ATOM 0 HG LEU A 91 -10.412 0.945 1.110 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -11.785 0.747 -0.946 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -12.501 1.915 0.190 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -11.605 2.494 -1.235 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -9.306 0.476 -1.063 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -9.128 2.223 -1.349 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -8.253 1.447 -0.007 1.00 0.00 H new ATOM 1404 N LEU A 92 -10.833 4.210 4.108 1.00 0.00 N ATOM 1405 CA LEU A 92 -10.490 5.275 5.093 1.00 0.00 C ATOM 1406 C LEU A 92 -9.584 4.698 6.182 1.00 0.00 C ATOM 1407 O LEU A 92 -9.274 3.522 6.181 1.00 0.00 O ATOM 1408 CB LEU A 92 -11.771 5.836 5.727 1.00 0.00 C ATOM 1409 CG LEU A 92 -12.773 4.707 6.003 1.00 0.00 C ATOM 1410 CD1 LEU A 92 -12.185 3.720 7.013 1.00 0.00 C ATOM 1411 CD2 LEU A 92 -14.059 5.308 6.578 1.00 0.00 C ATOM 0 H LEU A 92 -10.881 3.265 4.488 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.966 6.081 4.578 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -11.528 6.350 6.657 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -12.220 6.574 5.062 1.00 0.00 H new ATOM 0 HG LEU A 92 -12.988 4.182 5.072 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -12.903 2.922 7.203 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.266 3.293 6.612 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -11.966 4.241 7.945 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -14.776 4.511 6.777 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -13.832 5.832 7.507 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -14.485 6.009 5.861 1.00 0.00 H new ATOM 1423 N ALA A 93 -9.159 5.520 7.107 1.00 0.00 N ATOM 1424 CA ALA A 93 -8.269 5.037 8.205 1.00 0.00 C ATOM 1425 C ALA A 93 -9.027 5.084 9.533 1.00 0.00 C ATOM 1426 O ALA A 93 -9.993 5.807 9.681 1.00 0.00 O ATOM 1427 CB ALA A 93 -7.037 5.942 8.291 1.00 0.00 C ATOM 0 H ALA A 93 -9.392 6.512 7.149 1.00 0.00 H new ATOM 0 HA ALA A 93 -7.958 4.013 8.000 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.384 5.593 9.091 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -6.498 5.913 7.344 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -7.351 6.965 8.499 1.00 0.00 H new ATOM 1433 N SER A 94 -8.599 4.320 10.500 1.00 0.00 N ATOM 1434 CA SER A 94 -9.298 4.323 11.817 1.00 0.00 C ATOM 1435 C SER A 94 -8.294 4.007 12.928 1.00 0.00 C ATOM 1436 O SER A 94 -7.495 3.099 12.816 1.00 0.00 O ATOM 1437 CB SER A 94 -10.401 3.265 11.810 1.00 0.00 C ATOM 1438 OG SER A 94 -9.927 2.097 11.154 1.00 0.00 O ATOM 0 H SER A 94 -7.796 3.694 10.436 1.00 0.00 H new ATOM 0 HA SER A 94 -9.737 5.305 11.994 1.00 0.00 H new ATOM 0 HB2 SER A 94 -10.699 3.027 12.831 1.00 0.00 H new ATOM 0 HB3 SER A 94 -11.285 3.648 11.301 1.00 0.00 H new ATOM 0 HG SER A 94 -10.632 1.416 11.149 1.00 0.00 H new ATOM 1444 N LYS A 95 -8.329 4.750 14.001 1.00 0.00 N ATOM 1445 CA LYS A 95 -7.377 4.491 15.117 1.00 0.00 C ATOM 1446 C LYS A 95 -7.493 3.031 15.560 1.00 0.00 C ATOM 1447 O LYS A 95 -6.509 2.330 15.682 1.00 0.00 O ATOM 1448 CB LYS A 95 -7.710 5.408 16.296 1.00 0.00 C ATOM 1449 CG LYS A 95 -7.834 6.852 15.803 1.00 0.00 C ATOM 1450 CD LYS A 95 -7.950 7.793 17.003 1.00 0.00 C ATOM 1451 CE LYS A 95 -9.172 7.409 17.840 1.00 0.00 C ATOM 1452 NZ LYS A 95 -9.629 8.592 18.622 1.00 0.00 N ATOM 0 H LYS A 95 -8.975 5.524 14.152 1.00 0.00 H new ATOM 0 HA LYS A 95 -6.360 4.688 14.778 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -8.642 5.091 16.764 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -6.932 5.338 17.056 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -6.965 7.118 15.202 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -8.709 6.954 15.161 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -7.047 7.736 17.611 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -8.040 8.824 16.662 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -9.974 7.056 17.192 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -8.922 6.589 18.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -10.460 8.332 19.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -8.864 8.909 19.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -9.883 9.362 17.970 1.00 0.00 H new ATOM 1466 N SER A 96 -8.689 2.569 15.805 1.00 0.00 N ATOM 1467 CA SER A 96 -8.866 1.156 16.243 1.00 0.00 C ATOM 1468 C SER A 96 -8.925 0.244 15.016 1.00 0.00 C ATOM 1469 O SER A 96 -9.658 0.493 14.079 1.00 0.00 O ATOM 1470 CB SER A 96 -10.168 1.029 17.036 1.00 0.00 C ATOM 1471 OG SER A 96 -10.332 2.176 17.858 1.00 0.00 O ATOM 0 H SER A 96 -9.550 3.109 15.721 1.00 0.00 H new ATOM 0 HA SER A 96 -8.026 0.863 16.872 1.00 0.00 H new ATOM 0 HB2 SER A 96 -11.014 0.932 16.355 1.00 0.00 H new ATOM 0 HB3 SER A 96 -10.147 0.128 17.649 1.00 0.00 H new ATOM 0 HG SER A 96 -11.166 2.098 18.366 1.00 0.00 H new ATOM 1477 N VAL A 97 -8.159 -0.813 15.014 1.00 0.00 N ATOM 1478 CA VAL A 97 -8.171 -1.740 13.849 1.00 0.00 C ATOM 1479 C VAL A 97 -9.302 -2.758 14.020 1.00 0.00 C ATOM 1480 O VAL A 97 -9.795 -2.974 15.109 1.00 0.00 O ATOM 1481 CB VAL A 97 -6.833 -2.476 13.767 1.00 0.00 C ATOM 1482 CG1 VAL A 97 -6.750 -3.513 14.888 1.00 0.00 C ATOM 1483 CG2 VAL A 97 -6.718 -3.181 12.414 1.00 0.00 C ATOM 0 H VAL A 97 -7.525 -1.074 15.770 1.00 0.00 H new ATOM 0 HA VAL A 97 -8.328 -1.170 12.933 1.00 0.00 H new ATOM 0 HB VAL A 97 -6.019 -1.758 13.874 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -5.796 -4.037 14.829 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -6.830 -3.013 15.853 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -7.565 -4.229 14.782 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -5.764 -3.705 12.357 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -7.533 -3.897 12.307 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -6.775 -2.444 11.613 1.00 0.00 H new ATOM 1493 N THR A 98 -9.715 -3.385 12.953 1.00 0.00 N ATOM 1494 CA THR A 98 -10.812 -4.388 13.057 1.00 0.00 C ATOM 1495 C THR A 98 -10.592 -5.492 12.021 1.00 0.00 C ATOM 1496 O THR A 98 -9.575 -5.540 11.358 1.00 0.00 O ATOM 1497 CB THR A 98 -12.156 -3.704 12.796 1.00 0.00 C ATOM 1498 OG1 THR A 98 -12.018 -2.792 11.716 1.00 0.00 O ATOM 1499 CG2 THR A 98 -12.601 -2.949 14.050 1.00 0.00 C ATOM 0 H THR A 98 -9.341 -3.246 12.014 1.00 0.00 H new ATOM 0 HA THR A 98 -10.814 -4.822 14.057 1.00 0.00 H new ATOM 0 HB THR A 98 -12.904 -4.456 12.545 1.00 0.00 H new ATOM 0 HG1 THR A 98 -11.211 -3.010 11.205 1.00 0.00 H new ATOM 0 HG21 THR A 98 -13.558 -2.463 13.862 1.00 0.00 H new ATOM 0 HG22 THR A 98 -12.707 -3.650 14.878 1.00 0.00 H new ATOM 0 HG23 THR A 98 -11.856 -2.196 14.305 1.00 0.00 H new ATOM 1507 N ASP A 99 -11.536 -6.381 11.878 1.00 0.00 N ATOM 1508 CA ASP A 99 -11.379 -7.481 10.885 1.00 0.00 C ATOM 1509 C ASP A 99 -11.456 -6.903 9.470 1.00 0.00 C ATOM 1510 O ASP A 99 -11.125 -7.561 8.502 1.00 0.00 O ATOM 1511 CB ASP A 99 -12.498 -8.508 11.080 1.00 0.00 C ATOM 1512 CG ASP A 99 -13.628 -8.227 10.087 1.00 0.00 C ATOM 1513 OD1 ASP A 99 -13.497 -8.627 8.943 1.00 0.00 O ATOM 1514 OD2 ASP A 99 -14.605 -7.617 10.490 1.00 0.00 O ATOM 0 H ASP A 99 -12.409 -6.393 12.406 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.413 -7.966 11.028 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -12.111 -9.516 10.931 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -12.876 -8.460 12.101 1.00 0.00 H new ATOM 1519 N GLU A 100 -11.890 -5.679 9.341 1.00 0.00 N ATOM 1520 CA GLU A 100 -11.990 -5.056 7.991 1.00 0.00 C ATOM 1521 C GLU A 100 -10.733 -4.228 7.716 1.00 0.00 C ATOM 1522 O GLU A 100 -10.807 -3.075 7.339 1.00 0.00 O ATOM 1523 CB GLU A 100 -13.218 -4.144 7.941 1.00 0.00 C ATOM 1524 CG GLU A 100 -14.480 -4.995 7.780 1.00 0.00 C ATOM 1525 CD GLU A 100 -15.692 -4.214 8.292 1.00 0.00 C ATOM 1526 OE1 GLU A 100 -16.184 -3.375 7.556 1.00 0.00 O ATOM 1527 OE2 GLU A 100 -16.107 -4.469 9.410 1.00 0.00 O ATOM 0 H GLU A 100 -12.181 -5.082 10.115 1.00 0.00 H new ATOM 0 HA GLU A 100 -12.084 -5.838 7.237 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -13.281 -3.551 8.853 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -13.130 -3.444 7.110 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -14.621 -5.260 6.732 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -14.375 -5.928 8.334 1.00 0.00 H new ATOM 1534 N CYS A 101 -9.576 -4.805 7.902 1.00 0.00 N ATOM 1535 CA CYS A 101 -8.317 -4.047 7.652 1.00 0.00 C ATOM 1536 C CYS A 101 -7.233 -5.002 7.145 1.00 0.00 C ATOM 1537 O CYS A 101 -6.078 -4.642 7.041 1.00 0.00 O ATOM 1538 CB CYS A 101 -7.851 -3.393 8.955 1.00 0.00 C ATOM 1539 SG CYS A 101 -9.241 -2.525 9.724 1.00 0.00 S ATOM 0 H CYS A 101 -9.449 -5.767 8.216 1.00 0.00 H new ATOM 0 HA CYS A 101 -8.500 -3.278 6.902 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -7.460 -4.150 9.635 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -7.039 -2.695 8.754 1.00 0.00 H new ATOM 0 HG CYS A 101 -10.126 -2.234 8.817 1.00 0.00 H new ATOM 1545 N PHE A 102 -7.596 -6.217 6.832 1.00 0.00 N ATOM 1546 CA PHE A 102 -6.587 -7.196 6.334 1.00 0.00 C ATOM 1547 C PHE A 102 -6.603 -7.219 4.803 1.00 0.00 C ATOM 1548 O PHE A 102 -7.605 -6.935 4.179 1.00 0.00 O ATOM 1549 CB PHE A 102 -6.928 -8.590 6.862 1.00 0.00 C ATOM 1550 CG PHE A 102 -6.654 -8.649 8.346 1.00 0.00 C ATOM 1551 CD1 PHE A 102 -5.335 -8.611 8.815 1.00 0.00 C ATOM 1552 CD2 PHE A 102 -7.718 -8.743 9.252 1.00 0.00 C ATOM 1553 CE1 PHE A 102 -5.080 -8.667 10.191 1.00 0.00 C ATOM 1554 CE2 PHE A 102 -7.461 -8.799 10.627 1.00 0.00 C ATOM 1555 CZ PHE A 102 -6.144 -8.761 11.097 1.00 0.00 C ATOM 0 H PHE A 102 -8.549 -6.574 6.900 1.00 0.00 H new ATOM 0 HA PHE A 102 -5.597 -6.902 6.683 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -7.976 -8.818 6.666 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -6.335 -9.342 6.342 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -4.515 -8.539 8.116 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -8.735 -8.772 8.890 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -4.063 -8.638 10.553 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -8.281 -8.872 11.326 1.00 0.00 H new ATOM 0 HZ PHE A 102 -5.948 -8.804 12.158 1.00 0.00 H new ATOM 1565 N PHE A 103 -5.498 -7.556 4.194 1.00 0.00 N ATOM 1566 CA PHE A 103 -5.449 -7.600 2.705 1.00 0.00 C ATOM 1567 C PHE A 103 -4.433 -8.654 2.258 1.00 0.00 C ATOM 1568 O PHE A 103 -3.251 -8.533 2.510 1.00 0.00 O ATOM 1569 CB PHE A 103 -5.032 -6.228 2.168 1.00 0.00 C ATOM 1570 CG PHE A 103 -6.016 -5.182 2.632 1.00 0.00 C ATOM 1571 CD1 PHE A 103 -5.868 -4.591 3.893 1.00 0.00 C ATOM 1572 CD2 PHE A 103 -7.078 -4.804 1.802 1.00 0.00 C ATOM 1573 CE1 PHE A 103 -6.782 -3.622 4.323 1.00 0.00 C ATOM 1574 CE2 PHE A 103 -7.992 -3.835 2.233 1.00 0.00 C ATOM 1575 CZ PHE A 103 -7.844 -3.244 3.493 1.00 0.00 C ATOM 0 H PHE A 103 -4.627 -7.803 4.664 1.00 0.00 H new ATOM 0 HA PHE A 103 -6.434 -7.858 2.316 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -4.030 -5.979 2.517 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -4.994 -6.249 1.079 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -5.049 -4.883 4.534 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -7.192 -5.260 0.830 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -6.668 -3.166 5.295 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -8.812 -3.543 1.593 1.00 0.00 H new ATOM 0 HZ PHE A 103 -8.549 -2.496 3.825 1.00 0.00 H new ATOM 1585 N PHE A 104 -4.882 -9.686 1.597 1.00 0.00 N ATOM 1586 CA PHE A 104 -3.935 -10.743 1.136 1.00 0.00 C ATOM 1587 C PHE A 104 -2.860 -10.116 0.246 1.00 0.00 C ATOM 1588 O PHE A 104 -3.086 -9.108 -0.394 1.00 0.00 O ATOM 1589 CB PHE A 104 -4.694 -11.805 0.337 1.00 0.00 C ATOM 1590 CG PHE A 104 -5.381 -12.765 1.282 1.00 0.00 C ATOM 1591 CD1 PHE A 104 -4.618 -13.590 2.117 1.00 0.00 C ATOM 1592 CD2 PHE A 104 -6.779 -12.835 1.318 1.00 0.00 C ATOM 1593 CE1 PHE A 104 -5.252 -14.483 2.989 1.00 0.00 C ATOM 1594 CE2 PHE A 104 -7.412 -13.728 2.189 1.00 0.00 C ATOM 1595 CZ PHE A 104 -6.650 -14.552 3.024 1.00 0.00 C ATOM 0 H PHE A 104 -5.861 -9.844 1.356 1.00 0.00 H new ATOM 0 HA PHE A 104 -3.467 -11.207 2.005 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -5.430 -11.329 -0.310 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -4.005 -12.348 -0.310 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -3.540 -13.537 2.088 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -7.368 -12.200 0.673 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.663 -15.118 3.634 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -8.490 -13.781 2.217 1.00 0.00 H new ATOM 0 HZ PHE A 104 -7.140 -15.241 3.696 1.00 0.00 H new ATOM 1605 N GLU A 105 -1.695 -10.711 0.204 1.00 0.00 N ATOM 1606 CA GLU A 105 -0.591 -10.167 -0.642 1.00 0.00 C ATOM 1607 C GLU A 105 -0.086 -11.263 -1.582 1.00 0.00 C ATOM 1608 O GLU A 105 0.084 -12.400 -1.189 1.00 0.00 O ATOM 1609 CB GLU A 105 0.557 -9.704 0.259 1.00 0.00 C ATOM 1610 CG GLU A 105 1.678 -9.119 -0.603 1.00 0.00 C ATOM 1611 CD GLU A 105 2.617 -8.290 0.275 1.00 0.00 C ATOM 1612 OE1 GLU A 105 2.982 -8.769 1.336 1.00 0.00 O ATOM 1613 OE2 GLU A 105 2.955 -7.190 -0.129 1.00 0.00 O ATOM 0 H GLU A 105 -1.460 -11.557 0.724 1.00 0.00 H new ATOM 0 HA GLU A 105 -0.960 -9.324 -1.227 1.00 0.00 H new ATOM 0 HB2 GLU A 105 0.199 -8.956 0.966 1.00 0.00 H new ATOM 0 HB3 GLU A 105 0.934 -10.542 0.845 1.00 0.00 H new ATOM 0 HG2 GLU A 105 2.232 -9.921 -1.091 1.00 0.00 H new ATOM 0 HG3 GLU A 105 1.257 -8.497 -1.393 1.00 0.00 H new ATOM 1620 N ARG A 106 0.158 -10.929 -2.822 1.00 0.00 N ATOM 1621 CA ARG A 106 0.656 -11.949 -3.790 1.00 0.00 C ATOM 1622 C ARG A 106 1.672 -11.303 -4.732 1.00 0.00 C ATOM 1623 O ARG A 106 1.457 -10.220 -5.242 1.00 0.00 O ATOM 1624 CB ARG A 106 -0.519 -12.498 -4.605 1.00 0.00 C ATOM 1625 CG ARG A 106 -0.031 -13.638 -5.502 1.00 0.00 C ATOM 1626 CD ARG A 106 -0.300 -13.287 -6.967 1.00 0.00 C ATOM 1627 NE ARG A 106 -1.760 -13.067 -7.164 1.00 0.00 N ATOM 1628 CZ ARG A 106 -2.191 -12.477 -8.246 1.00 0.00 C ATOM 1629 NH1 ARG A 106 -1.345 -12.083 -9.157 1.00 0.00 N ATOM 1630 NH2 ARG A 106 -3.470 -12.283 -8.417 1.00 0.00 N ATOM 0 H ARG A 106 0.034 -9.992 -3.206 1.00 0.00 H new ATOM 0 HA ARG A 106 1.132 -12.765 -3.245 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -1.302 -12.857 -3.937 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -0.956 -11.705 -5.212 1.00 0.00 H new ATOM 0 HG2 ARG A 106 1.035 -13.806 -5.347 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -0.541 -14.565 -5.240 1.00 0.00 H new ATOM 0 HD2 ARG A 106 0.255 -12.391 -7.245 1.00 0.00 H new ATOM 0 HD3 ARG A 106 0.048 -14.091 -7.615 1.00 0.00 H new ATOM 0 HE ARG A 106 -2.423 -13.377 -6.454 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -0.345 -12.236 -9.025 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -1.683 -11.622 -10.002 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -4.132 -12.592 -7.706 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -3.807 -11.822 -9.262 1.00 0.00 H new ATOM 1644 N LEU A 107 2.779 -11.958 -4.963 1.00 0.00 N ATOM 1645 CA LEU A 107 3.818 -11.386 -5.868 1.00 0.00 C ATOM 1646 C LEU A 107 3.712 -12.035 -7.249 1.00 0.00 C ATOM 1647 O LEU A 107 3.699 -13.243 -7.378 1.00 0.00 O ATOM 1648 CB LEU A 107 5.206 -11.661 -5.283 1.00 0.00 C ATOM 1649 CG LEU A 107 6.270 -10.974 -6.140 1.00 0.00 C ATOM 1650 CD1 LEU A 107 7.006 -9.929 -5.299 1.00 0.00 C ATOM 1651 CD2 LEU A 107 7.269 -12.017 -6.644 1.00 0.00 C ATOM 0 H LEU A 107 3.009 -12.867 -4.562 1.00 0.00 H new ATOM 0 HA LEU A 107 3.665 -10.311 -5.961 1.00 0.00 H new ATOM 0 HB2 LEU A 107 5.259 -11.295 -4.258 1.00 0.00 H new ATOM 0 HB3 LEU A 107 5.391 -12.735 -5.248 1.00 0.00 H new ATOM 0 HG LEU A 107 5.793 -10.486 -6.990 1.00 0.00 H new ATOM 0 HD11 LEU A 107 7.765 -9.439 -5.910 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.295 -9.186 -4.938 1.00 0.00 H new ATOM 0 HD13 LEU A 107 7.484 -10.417 -4.449 1.00 0.00 H new ATOM 0 HD21 LEU A 107 8.028 -11.528 -7.255 1.00 0.00 H new ATOM 0 HD22 LEU A 107 7.746 -12.504 -5.794 1.00 0.00 H new ATOM 0 HD23 LEU A 107 6.746 -12.762 -7.243 1.00 0.00 H new ATOM 1663 N GLU A 108 3.642 -11.242 -8.281 1.00 0.00 N ATOM 1664 CA GLU A 108 3.541 -11.813 -9.654 1.00 0.00 C ATOM 1665 C GLU A 108 4.947 -12.099 -10.187 1.00 0.00 C ATOM 1666 O GLU A 108 5.936 -11.724 -9.587 1.00 0.00 O ATOM 1667 CB GLU A 108 2.841 -10.811 -10.574 1.00 0.00 C ATOM 1668 CG GLU A 108 1.660 -10.177 -9.836 1.00 0.00 C ATOM 1669 CD GLU A 108 0.765 -9.447 -10.838 1.00 0.00 C ATOM 1670 OE1 GLU A 108 1.300 -8.868 -11.769 1.00 0.00 O ATOM 1671 OE2 GLU A 108 -0.441 -9.478 -10.656 1.00 0.00 O ATOM 0 H GLU A 108 3.650 -10.223 -8.234 1.00 0.00 H new ATOM 0 HA GLU A 108 2.966 -12.739 -9.623 1.00 0.00 H new ATOM 0 HB2 GLU A 108 3.543 -10.039 -10.889 1.00 0.00 H new ATOM 0 HB3 GLU A 108 2.492 -11.313 -11.477 1.00 0.00 H new ATOM 0 HG2 GLU A 108 1.089 -10.945 -9.314 1.00 0.00 H new ATOM 0 HG3 GLU A 108 2.022 -9.480 -9.080 1.00 0.00 H new ATOM 1678 N SER A 109 5.046 -12.760 -11.307 1.00 0.00 N ATOM 1679 CA SER A 109 6.389 -13.068 -11.873 1.00 0.00 C ATOM 1680 C SER A 109 6.976 -11.809 -12.516 1.00 0.00 C ATOM 1681 O SER A 109 8.105 -11.799 -12.964 1.00 0.00 O ATOM 1682 CB SER A 109 6.258 -14.165 -12.929 1.00 0.00 C ATOM 1683 OG SER A 109 7.505 -14.332 -13.592 1.00 0.00 O ATOM 0 H SER A 109 4.255 -13.100 -11.854 1.00 0.00 H new ATOM 0 HA SER A 109 7.048 -13.408 -11.075 1.00 0.00 H new ATOM 0 HB2 SER A 109 5.954 -15.101 -12.461 1.00 0.00 H new ATOM 0 HB3 SER A 109 5.483 -13.902 -13.649 1.00 0.00 H new ATOM 0 HG SER A 109 8.140 -13.659 -13.269 1.00 0.00 H new ATOM 1689 N ASN A 110 6.217 -10.747 -12.565 1.00 0.00 N ATOM 1690 CA ASN A 110 6.732 -9.491 -13.180 1.00 0.00 C ATOM 1691 C ASN A 110 7.336 -8.598 -12.092 1.00 0.00 C ATOM 1692 O ASN A 110 7.527 -7.414 -12.283 1.00 0.00 O ATOM 1693 CB ASN A 110 5.582 -8.755 -13.872 1.00 0.00 C ATOM 1694 CG ASN A 110 5.313 -9.395 -15.235 1.00 0.00 C ATOM 1695 OD1 ASN A 110 5.927 -9.036 -16.220 1.00 0.00 O ATOM 1696 ND2 ASN A 110 4.413 -10.336 -15.334 1.00 0.00 N ATOM 0 H ASN A 110 5.264 -10.696 -12.206 1.00 0.00 H new ATOM 0 HA ASN A 110 7.501 -9.733 -13.914 1.00 0.00 H new ATOM 0 HB2 ASN A 110 4.685 -8.798 -13.255 1.00 0.00 H new ATOM 0 HB3 ASN A 110 5.833 -7.702 -13.996 1.00 0.00 H new ATOM 0 HD21 ASN A 110 4.226 -10.769 -16.238 1.00 0.00 H new ATOM 0 HD22 ASN A 110 3.897 -10.638 -14.507 1.00 0.00 H new ATOM 1703 N ASN A 111 7.640 -9.163 -10.953 1.00 0.00 N ATOM 1704 CA ASN A 111 8.238 -8.364 -9.843 1.00 0.00 C ATOM 1705 C ASN A 111 7.246 -7.300 -9.363 1.00 0.00 C ATOM 1706 O ASN A 111 7.511 -6.116 -9.434 1.00 0.00 O ATOM 1707 CB ASN A 111 9.521 -7.681 -10.327 1.00 0.00 C ATOM 1708 CG ASN A 111 10.298 -8.637 -11.234 1.00 0.00 C ATOM 1709 OD1 ASN A 111 9.943 -8.829 -12.380 1.00 0.00 O ATOM 1710 ND2 ASN A 111 11.352 -9.248 -10.766 1.00 0.00 N ATOM 0 H ASN A 111 7.499 -10.151 -10.743 1.00 0.00 H new ATOM 0 HA ASN A 111 8.471 -9.035 -9.016 1.00 0.00 H new ATOM 0 HB2 ASN A 111 9.277 -6.767 -10.868 1.00 0.00 H new ATOM 0 HB3 ASN A 111 10.135 -7.392 -9.474 1.00 0.00 H new ATOM 0 HD21 ASN A 111 11.878 -9.887 -11.362 1.00 0.00 H new ATOM 0 HD22 ASN A 111 11.650 -9.087 -9.804 1.00 0.00 H new ATOM 1717 N TYR A 112 6.110 -7.712 -8.866 1.00 0.00 N ATOM 1718 CA TYR A 112 5.106 -6.727 -8.371 1.00 0.00 C ATOM 1719 C TYR A 112 4.387 -7.305 -7.152 1.00 0.00 C ATOM 1720 O TYR A 112 4.759 -8.340 -6.636 1.00 0.00 O ATOM 1721 CB TYR A 112 4.092 -6.435 -9.476 1.00 0.00 C ATOM 1722 CG TYR A 112 4.703 -5.481 -10.472 1.00 0.00 C ATOM 1723 CD1 TYR A 112 4.719 -4.106 -10.208 1.00 0.00 C ATOM 1724 CD2 TYR A 112 5.260 -5.973 -11.655 1.00 0.00 C ATOM 1725 CE1 TYR A 112 5.291 -3.224 -11.131 1.00 0.00 C ATOM 1726 CE2 TYR A 112 5.835 -5.090 -12.579 1.00 0.00 C ATOM 1727 CZ TYR A 112 5.849 -3.716 -12.317 1.00 0.00 C ATOM 1728 OH TYR A 112 6.415 -2.845 -13.225 1.00 0.00 O ATOM 0 H TYR A 112 5.834 -8.690 -8.782 1.00 0.00 H new ATOM 0 HA TYR A 112 5.609 -5.802 -8.090 1.00 0.00 H new ATOM 0 HB2 TYR A 112 3.801 -7.361 -9.973 1.00 0.00 H new ATOM 0 HB3 TYR A 112 3.186 -6.004 -9.050 1.00 0.00 H new ATOM 0 HD1 TYR A 112 4.290 -3.727 -9.292 1.00 0.00 H new ATOM 0 HD2 TYR A 112 5.247 -7.034 -11.857 1.00 0.00 H new ATOM 0 HE1 TYR A 112 5.302 -2.163 -10.929 1.00 0.00 H new ATOM 0 HE2 TYR A 112 6.267 -5.470 -13.493 1.00 0.00 H new ATOM 0 HH TYR A 112 6.757 -3.349 -13.993 1.00 0.00 H new ATOM 1738 N ASN A 113 3.362 -6.646 -6.684 1.00 0.00 N ATOM 1739 CA ASN A 113 2.628 -7.164 -5.495 1.00 0.00 C ATOM 1740 C ASN A 113 1.148 -6.788 -5.595 1.00 0.00 C ATOM 1741 O ASN A 113 0.788 -5.628 -5.547 1.00 0.00 O ATOM 1742 CB ASN A 113 3.221 -6.553 -4.223 1.00 0.00 C ATOM 1743 CG ASN A 113 4.648 -7.068 -4.025 1.00 0.00 C ATOM 1744 OD1 ASN A 113 5.590 -6.665 -4.833 1.00 0.00 O flip ATOM 1745 ND2 ASN A 113 4.907 -7.844 -3.127 1.00 0.00 N flip ATOM 0 H ASN A 113 3.002 -5.774 -7.072 1.00 0.00 H new ATOM 0 HA ASN A 113 2.723 -8.249 -5.460 1.00 0.00 H new ATOM 0 HB2 ASN A 113 3.223 -5.465 -4.296 1.00 0.00 H new ATOM 0 HB3 ASN A 113 2.606 -6.814 -3.361 1.00 0.00 H new ATOM 0 HD21 ASN A 113 4.170 -8.158 -2.496 1.00 0.00 H new ATOM 0 HD22 ASN A 113 5.862 -8.181 -3.004 1.00 0.00 H new ATOM 1752 N THR A 114 0.286 -7.761 -5.727 1.00 0.00 N ATOM 1753 CA THR A 114 -1.171 -7.464 -5.823 1.00 0.00 C ATOM 1754 C THR A 114 -1.804 -7.589 -4.436 1.00 0.00 C ATOM 1755 O THR A 114 -1.703 -8.611 -3.788 1.00 0.00 O ATOM 1756 CB THR A 114 -1.836 -8.457 -6.779 1.00 0.00 C ATOM 1757 OG1 THR A 114 -1.794 -9.759 -6.211 1.00 0.00 O ATOM 1758 CG2 THR A 114 -1.093 -8.458 -8.116 1.00 0.00 C ATOM 0 H THR A 114 0.530 -8.750 -5.772 1.00 0.00 H new ATOM 0 HA THR A 114 -1.312 -6.451 -6.200 1.00 0.00 H new ATOM 0 HB THR A 114 -2.873 -8.164 -6.943 1.00 0.00 H new ATOM 0 HG1 THR A 114 -1.847 -9.692 -5.235 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.568 -9.166 -8.796 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.126 -7.459 -8.551 1.00 0.00 H new ATOM 0 HG23 THR A 114 -0.055 -8.750 -7.955 1.00 0.00 H new ATOM 1766 N TYR A 115 -2.453 -6.553 -3.976 1.00 0.00 N ATOM 1767 CA TYR A 115 -3.092 -6.606 -2.630 1.00 0.00 C ATOM 1768 C TYR A 115 -4.569 -6.968 -2.775 1.00 0.00 C ATOM 1769 O TYR A 115 -5.367 -6.179 -3.242 1.00 0.00 O ATOM 1770 CB TYR A 115 -2.972 -5.240 -1.956 1.00 0.00 C ATOM 1771 CG TYR A 115 -1.535 -5.001 -1.557 1.00 0.00 C ATOM 1772 CD1 TYR A 115 -1.007 -5.644 -0.432 1.00 0.00 C ATOM 1773 CD2 TYR A 115 -0.732 -4.137 -2.311 1.00 0.00 C ATOM 1774 CE1 TYR A 115 0.325 -5.425 -0.061 1.00 0.00 C ATOM 1775 CE2 TYR A 115 0.600 -3.916 -1.939 1.00 0.00 C ATOM 1776 CZ TYR A 115 1.128 -4.561 -0.814 1.00 0.00 C ATOM 1777 OH TYR A 115 2.442 -4.346 -0.448 1.00 0.00 O ATOM 0 H TYR A 115 -2.568 -5.671 -4.475 1.00 0.00 H new ATOM 0 HA TYR A 115 -2.591 -7.361 -2.024 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -3.307 -4.456 -2.635 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -3.616 -5.198 -1.078 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -1.627 -6.309 0.150 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -1.140 -3.641 -3.179 1.00 0.00 H new ATOM 0 HE1 TYR A 115 0.733 -5.923 0.806 1.00 0.00 H new ATOM 0 HE2 TYR A 115 1.220 -3.248 -2.520 1.00 0.00 H new ATOM 0 HH TYR A 115 2.872 -5.205 -0.254 1.00 0.00 H new ATOM 1787 N ARG A 116 -4.938 -8.155 -2.376 1.00 0.00 N ATOM 1788 CA ARG A 116 -6.365 -8.573 -2.485 1.00 0.00 C ATOM 1789 C ARG A 116 -7.055 -8.364 -1.135 1.00 0.00 C ATOM 1790 O ARG A 116 -6.448 -8.496 -0.091 1.00 0.00 O ATOM 1791 CB ARG A 116 -6.424 -10.053 -2.885 1.00 0.00 C ATOM 1792 CG ARG A 116 -7.686 -10.708 -2.312 1.00 0.00 C ATOM 1793 CD ARG A 116 -7.945 -12.036 -3.027 1.00 0.00 C ATOM 1794 NE ARG A 116 -8.306 -13.078 -2.024 1.00 0.00 N ATOM 1795 CZ ARG A 116 -8.854 -14.196 -2.413 1.00 0.00 C ATOM 1796 NH1 ARG A 116 -9.091 -14.400 -3.680 1.00 0.00 N ATOM 1797 NH2 ARG A 116 -9.166 -15.109 -1.534 1.00 0.00 N ATOM 0 H ARG A 116 -4.311 -8.855 -1.978 1.00 0.00 H new ATOM 0 HA ARG A 116 -6.875 -7.976 -3.242 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -6.420 -10.144 -3.971 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -5.538 -10.572 -2.518 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -7.566 -10.877 -1.242 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -8.541 -10.044 -2.436 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -8.750 -11.920 -3.752 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -7.058 -12.342 -3.582 1.00 0.00 H new ATOM 0 HE ARG A 116 -8.124 -12.917 -1.033 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -8.848 -13.685 -4.366 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -9.519 -15.274 -3.984 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -8.981 -14.948 -0.544 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -9.595 -15.984 -1.837 1.00 0.00 H new ATOM 1811 N SER A 117 -8.319 -8.041 -1.145 1.00 0.00 N ATOM 1812 CA SER A 117 -9.042 -7.824 0.140 1.00 0.00 C ATOM 1813 C SER A 117 -9.411 -9.175 0.757 1.00 0.00 C ATOM 1814 O SER A 117 -9.475 -10.181 0.079 1.00 0.00 O ATOM 1815 CB SER A 117 -10.314 -7.018 -0.121 1.00 0.00 C ATOM 1816 OG SER A 117 -11.217 -7.206 0.961 1.00 0.00 O ATOM 0 H SER A 117 -8.882 -7.918 -1.987 1.00 0.00 H new ATOM 0 HA SER A 117 -8.399 -7.276 0.829 1.00 0.00 H new ATOM 0 HB2 SER A 117 -10.073 -5.961 -0.230 1.00 0.00 H new ATOM 0 HB3 SER A 117 -10.776 -7.337 -1.055 1.00 0.00 H new ATOM 0 HG SER A 117 -11.053 -6.524 1.646 1.00 0.00 H new ATOM 1822 N ARG A 118 -9.657 -9.206 2.040 1.00 0.00 N ATOM 1823 CA ARG A 118 -10.022 -10.492 2.700 1.00 0.00 C ATOM 1824 C ARG A 118 -11.547 -10.632 2.736 1.00 0.00 C ATOM 1825 O ARG A 118 -12.132 -11.348 1.950 1.00 0.00 O ATOM 1826 CB ARG A 118 -9.475 -10.512 4.130 1.00 0.00 C ATOM 1827 CG ARG A 118 -9.655 -11.911 4.722 1.00 0.00 C ATOM 1828 CD ARG A 118 -9.167 -11.917 6.175 1.00 0.00 C ATOM 1829 NE ARG A 118 -8.255 -13.083 6.418 1.00 0.00 N ATOM 1830 CZ ARG A 118 -8.572 -14.289 6.020 1.00 0.00 C ATOM 1831 NH1 ARG A 118 -9.731 -14.518 5.465 1.00 0.00 N ATOM 1832 NH2 ARG A 118 -7.733 -15.272 6.198 1.00 0.00 N ATOM 0 H ARG A 118 -9.621 -8.396 2.659 1.00 0.00 H new ATOM 0 HA ARG A 118 -9.592 -11.321 2.137 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -8.420 -10.237 4.132 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -9.997 -9.776 4.741 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -10.704 -12.204 4.678 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -9.096 -12.640 4.136 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -8.643 -10.986 6.393 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -10.020 -11.968 6.851 1.00 0.00 H new ATOM 0 HE ARG A 118 -7.370 -12.933 6.903 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -10.396 -13.755 5.339 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -9.972 -15.460 5.157 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -6.833 -15.100 6.646 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -7.977 -16.213 5.889 1.00 0.00 H new ATOM 1846 N LYS A 119 -12.194 -9.953 3.643 1.00 0.00 N ATOM 1847 CA LYS A 119 -13.678 -10.051 3.727 1.00 0.00 C ATOM 1848 C LYS A 119 -14.278 -9.882 2.330 1.00 0.00 C ATOM 1849 O LYS A 119 -15.275 -10.494 1.998 1.00 0.00 O ATOM 1850 CB LYS A 119 -14.211 -8.951 4.647 1.00 0.00 C ATOM 1851 CG LYS A 119 -15.734 -9.062 4.752 1.00 0.00 C ATOM 1852 CD LYS A 119 -16.149 -9.009 6.223 1.00 0.00 C ATOM 1853 CE LYS A 119 -17.674 -9.076 6.326 1.00 0.00 C ATOM 1854 NZ LYS A 119 -18.058 -9.602 7.666 1.00 0.00 N ATOM 0 H LYS A 119 -11.760 -9.335 4.329 1.00 0.00 H new ATOM 0 HA LYS A 119 -13.956 -11.026 4.128 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -13.761 -9.040 5.636 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -13.934 -7.971 4.258 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -16.207 -8.250 4.200 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -16.073 -9.994 4.301 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -15.700 -9.839 6.769 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -15.783 -8.091 6.682 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -18.103 -8.085 6.176 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -18.074 -9.719 5.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -19.095 -9.648 7.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -17.660 -10.554 7.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -17.688 -8.971 8.406 1.00 0.00 H new ATOM 1868 N TYR A 120 -13.675 -9.056 1.513 1.00 0.00 N ATOM 1869 CA TYR A 120 -14.196 -8.834 0.132 1.00 0.00 C ATOM 1870 C TYR A 120 -13.207 -9.406 -0.886 1.00 0.00 C ATOM 1871 O TYR A 120 -12.614 -8.685 -1.663 1.00 0.00 O ATOM 1872 CB TYR A 120 -14.360 -7.332 -0.110 1.00 0.00 C ATOM 1873 CG TYR A 120 -14.971 -6.687 1.112 1.00 0.00 C ATOM 1874 CD1 TYR A 120 -16.363 -6.614 1.243 1.00 0.00 C ATOM 1875 CD2 TYR A 120 -14.146 -6.161 2.114 1.00 0.00 C ATOM 1876 CE1 TYR A 120 -16.931 -6.016 2.374 1.00 0.00 C ATOM 1877 CE2 TYR A 120 -14.714 -5.562 3.245 1.00 0.00 C ATOM 1878 CZ TYR A 120 -16.105 -5.491 3.376 1.00 0.00 C ATOM 1879 OH TYR A 120 -16.665 -4.901 4.491 1.00 0.00 O ATOM 0 H TYR A 120 -12.838 -8.522 1.746 1.00 0.00 H new ATOM 0 HA TYR A 120 -15.159 -9.332 0.022 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -13.392 -6.880 -0.327 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -14.994 -7.160 -0.980 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -16.999 -7.020 0.470 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -13.072 -6.217 2.014 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -18.005 -5.959 2.474 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -14.078 -5.155 4.017 1.00 0.00 H new ATOM 0 HH TYR A 120 -17.523 -5.329 4.692 1.00 0.00 H new ATOM 1889 N THR A 121 -13.024 -10.700 -0.889 1.00 0.00 N ATOM 1890 CA THR A 121 -12.073 -11.317 -1.858 1.00 0.00 C ATOM 1891 C THR A 121 -12.578 -11.093 -3.284 1.00 0.00 C ATOM 1892 O THR A 121 -11.994 -11.566 -4.239 1.00 0.00 O ATOM 1893 CB THR A 121 -11.973 -12.822 -1.588 1.00 0.00 C ATOM 1894 OG1 THR A 121 -13.258 -13.410 -1.730 1.00 0.00 O ATOM 1895 CG2 THR A 121 -11.457 -13.060 -0.168 1.00 0.00 C ATOM 0 H THR A 121 -13.492 -11.355 -0.263 1.00 0.00 H new ATOM 0 HA THR A 121 -11.091 -10.858 -1.742 1.00 0.00 H new ATOM 0 HB THR A 121 -11.282 -13.273 -2.300 1.00 0.00 H new ATOM 0 HG1 THR A 121 -13.198 -14.373 -1.560 1.00 0.00 H new ATOM 0 HG21 THR A 121 -11.388 -14.132 0.019 1.00 0.00 H new ATOM 0 HG22 THR A 121 -10.471 -12.608 -0.059 1.00 0.00 H new ATOM 0 HG23 THR A 121 -12.144 -12.610 0.549 1.00 0.00 H new ATOM 1903 N SER A 122 -13.660 -10.381 -3.438 1.00 0.00 N ATOM 1904 CA SER A 122 -14.202 -10.132 -4.803 1.00 0.00 C ATOM 1905 C SER A 122 -13.658 -8.808 -5.343 1.00 0.00 C ATOM 1906 O SER A 122 -14.123 -8.299 -6.343 1.00 0.00 O ATOM 1907 CB SER A 122 -15.728 -10.065 -4.739 1.00 0.00 C ATOM 1908 OG SER A 122 -16.232 -11.300 -4.248 1.00 0.00 O ATOM 0 H SER A 122 -14.193 -9.960 -2.677 1.00 0.00 H new ATOM 0 HA SER A 122 -13.897 -10.943 -5.464 1.00 0.00 H new ATOM 0 HB2 SER A 122 -16.041 -9.247 -4.089 1.00 0.00 H new ATOM 0 HB3 SER A 122 -16.136 -9.860 -5.729 1.00 0.00 H new ATOM 0 HG SER A 122 -17.210 -11.260 -4.204 1.00 0.00 H new ATOM 1914 N TRP A 123 -12.676 -8.244 -4.692 1.00 0.00 N ATOM 1915 CA TRP A 123 -12.113 -6.953 -5.181 1.00 0.00 C ATOM 1916 C TRP A 123 -10.668 -6.796 -4.699 1.00 0.00 C ATOM 1917 O TRP A 123 -10.238 -7.452 -3.768 1.00 0.00 O ATOM 1918 CB TRP A 123 -12.960 -5.795 -4.649 1.00 0.00 C ATOM 1919 CG TRP A 123 -14.185 -5.648 -5.493 1.00 0.00 C ATOM 1920 CD1 TRP A 123 -14.187 -5.391 -6.820 1.00 0.00 C ATOM 1921 CD2 TRP A 123 -15.583 -5.746 -5.092 1.00 0.00 C ATOM 1922 NE1 TRP A 123 -15.497 -5.324 -7.261 1.00 0.00 N ATOM 1923 CE2 TRP A 123 -16.394 -5.536 -6.233 1.00 0.00 C ATOM 1924 CE3 TRP A 123 -16.220 -5.993 -3.864 1.00 0.00 C ATOM 1925 CZ2 TRP A 123 -17.787 -5.572 -6.158 1.00 0.00 C ATOM 1926 CZ3 TRP A 123 -17.622 -6.029 -3.783 1.00 0.00 C ATOM 1927 CH2 TRP A 123 -18.403 -5.819 -4.928 1.00 0.00 C ATOM 0 H TRP A 123 -12.242 -8.619 -3.848 1.00 0.00 H new ATOM 0 HA TRP A 123 -12.127 -6.946 -6.271 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -13.240 -5.981 -3.612 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -12.382 -4.871 -4.663 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -13.309 -5.259 -7.436 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -15.767 -5.140 -8.227 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -15.627 -6.156 -2.976 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 -18.384 -5.410 -7.043 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -18.101 -6.219 -2.834 1.00 0.00 H new ATOM 0 HH2 TRP A 123 -19.480 -5.848 -4.860 1.00 0.00 H new ATOM 1938 N TYR A 124 -9.922 -5.929 -5.336 1.00 0.00 N ATOM 1939 CA TYR A 124 -8.500 -5.705 -4.942 1.00 0.00 C ATOM 1940 C TYR A 124 -8.290 -4.221 -4.631 1.00 0.00 C ATOM 1941 O TYR A 124 -9.142 -3.396 -4.895 1.00 0.00 O ATOM 1942 CB TYR A 124 -7.582 -6.111 -6.098 1.00 0.00 C ATOM 1943 CG TYR A 124 -7.827 -7.556 -6.466 1.00 0.00 C ATOM 1944 CD1 TYR A 124 -9.006 -7.922 -7.128 1.00 0.00 C ATOM 1945 CD2 TYR A 124 -6.873 -8.532 -6.148 1.00 0.00 C ATOM 1946 CE1 TYR A 124 -9.231 -9.261 -7.471 1.00 0.00 C ATOM 1947 CE2 TYR A 124 -7.099 -9.870 -6.491 1.00 0.00 C ATOM 1948 CZ TYR A 124 -8.277 -10.234 -7.152 1.00 0.00 C ATOM 1949 OH TYR A 124 -8.499 -11.554 -7.490 1.00 0.00 O ATOM 0 H TYR A 124 -10.242 -5.361 -6.121 1.00 0.00 H new ATOM 0 HA TYR A 124 -8.267 -6.303 -4.061 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -7.765 -5.471 -6.961 1.00 0.00 H new ATOM 0 HB3 TYR A 124 -6.539 -5.971 -5.812 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -9.742 -7.171 -7.374 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -5.963 -8.252 -5.638 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -10.140 -9.543 -7.981 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -6.364 -10.622 -6.245 1.00 0.00 H new ATOM 0 HH TYR A 124 -7.739 -12.099 -7.198 1.00 0.00 H new ATOM 1959 N VAL A 125 -7.161 -3.874 -4.077 1.00 0.00 N ATOM 1960 CA VAL A 125 -6.899 -2.442 -3.757 1.00 0.00 C ATOM 1961 C VAL A 125 -6.273 -1.758 -4.974 1.00 0.00 C ATOM 1962 O VAL A 125 -5.243 -2.171 -5.467 1.00 0.00 O ATOM 1963 CB VAL A 125 -5.937 -2.351 -2.572 1.00 0.00 C ATOM 1964 CG1 VAL A 125 -5.663 -0.881 -2.249 1.00 0.00 C ATOM 1965 CG2 VAL A 125 -6.564 -3.031 -1.354 1.00 0.00 C ATOM 0 H VAL A 125 -6.410 -4.519 -3.832 1.00 0.00 H new ATOM 0 HA VAL A 125 -7.837 -1.948 -3.501 1.00 0.00 H new ATOM 0 HB VAL A 125 -5.001 -2.848 -2.825 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -4.977 -0.816 -1.404 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -5.217 -0.395 -3.117 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -6.599 -0.384 -1.996 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -5.879 -2.967 -0.509 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -7.500 -2.533 -1.101 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -6.760 -4.078 -1.583 1.00 0.00 H new ATOM 1975 N ALA A 126 -6.888 -0.717 -5.465 1.00 0.00 N ATOM 1976 CA ALA A 126 -6.325 -0.014 -6.652 1.00 0.00 C ATOM 1977 C ALA A 126 -6.772 1.450 -6.642 1.00 0.00 C ATOM 1978 O ALA A 126 -7.875 1.769 -6.243 1.00 0.00 O ATOM 1979 CB ALA A 126 -6.824 -0.692 -7.929 1.00 0.00 C ATOM 0 H ALA A 126 -7.754 -0.324 -5.096 1.00 0.00 H new ATOM 0 HA ALA A 126 -5.236 -0.059 -6.617 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -6.413 -0.179 -8.798 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.503 -1.734 -7.937 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -7.913 -0.648 -7.963 1.00 0.00 H new ATOM 1985 N LEU A 127 -5.923 2.341 -7.081 1.00 0.00 N ATOM 1986 CA LEU A 127 -6.295 3.784 -7.100 1.00 0.00 C ATOM 1987 C LEU A 127 -6.816 4.159 -8.489 1.00 0.00 C ATOM 1988 O LEU A 127 -6.939 3.323 -9.362 1.00 0.00 O ATOM 1989 CB LEU A 127 -5.063 4.633 -6.776 1.00 0.00 C ATOM 1990 CG LEU A 127 -4.319 4.024 -5.587 1.00 0.00 C ATOM 1991 CD1 LEU A 127 -3.122 4.905 -5.228 1.00 0.00 C ATOM 1992 CD2 LEU A 127 -5.263 3.935 -4.386 1.00 0.00 C ATOM 0 H LEU A 127 -4.987 2.130 -7.427 1.00 0.00 H new ATOM 0 HA LEU A 127 -7.071 3.967 -6.357 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -4.405 4.683 -7.643 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -5.364 5.655 -6.545 1.00 0.00 H new ATOM 0 HG LEU A 127 -3.970 3.026 -5.851 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.592 4.471 -4.380 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -2.449 4.970 -6.083 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -3.471 5.903 -4.965 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -4.733 3.501 -3.538 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -5.612 4.933 -4.123 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -6.117 3.307 -4.640 1.00 0.00 H new ATOM 2004 N LYS A 128 -7.118 5.411 -8.701 1.00 0.00 N ATOM 2005 CA LYS A 128 -7.628 5.841 -10.034 1.00 0.00 C ATOM 2006 C LYS A 128 -6.461 6.342 -10.888 1.00 0.00 C ATOM 2007 O LYS A 128 -5.637 5.574 -11.342 1.00 0.00 O ATOM 2008 CB LYS A 128 -8.647 6.969 -9.852 1.00 0.00 C ATOM 2009 CG LYS A 128 -9.829 6.461 -9.026 1.00 0.00 C ATOM 2010 CD LYS A 128 -10.859 7.581 -8.865 1.00 0.00 C ATOM 2011 CE LYS A 128 -12.129 7.222 -9.640 1.00 0.00 C ATOM 2012 NZ LYS A 128 -11.803 7.069 -11.086 1.00 0.00 N ATOM 0 H LYS A 128 -7.034 6.155 -8.008 1.00 0.00 H new ATOM 0 HA LYS A 128 -8.106 4.996 -10.530 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -8.180 7.818 -9.354 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -8.993 7.321 -10.824 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -10.285 5.601 -9.516 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -9.485 6.126 -8.048 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -11.093 7.726 -7.810 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -10.449 8.522 -9.233 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -12.555 6.296 -9.252 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -12.881 7.999 -9.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -12.682 7.062 -11.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -11.206 7.863 -11.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -11.293 6.175 -11.234 1.00 0.00 H new ATOM 2026 N ARG A 129 -6.387 7.626 -11.109 1.00 0.00 N ATOM 2027 CA ARG A 129 -5.275 8.179 -11.931 1.00 0.00 C ATOM 2028 C ARG A 129 -4.922 9.582 -11.433 1.00 0.00 C ATOM 2029 O ARG A 129 -3.775 9.983 -11.442 1.00 0.00 O ATOM 2030 CB ARG A 129 -5.712 8.253 -13.397 1.00 0.00 C ATOM 2031 CG ARG A 129 -7.216 7.990 -13.498 1.00 0.00 C ATOM 2032 CD ARG A 129 -7.687 8.256 -14.929 1.00 0.00 C ATOM 2033 NE ARG A 129 -7.537 9.705 -15.238 1.00 0.00 N ATOM 2034 CZ ARG A 129 -7.595 10.119 -16.474 1.00 0.00 C ATOM 2035 NH1 ARG A 129 -7.788 9.263 -17.441 1.00 0.00 N ATOM 2036 NH2 ARG A 129 -7.462 11.388 -16.745 1.00 0.00 N ATOM 0 H ARG A 129 -7.050 8.316 -10.755 1.00 0.00 H new ATOM 0 HA ARG A 129 -4.402 7.532 -11.844 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -5.476 9.234 -13.808 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -5.164 7.519 -13.988 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -7.435 6.960 -13.218 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -7.755 8.632 -12.801 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -7.104 7.661 -15.632 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -8.728 7.955 -15.043 1.00 0.00 H new ATOM 0 HE ARG A 129 -7.389 10.374 -14.483 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -7.893 8.271 -17.230 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -7.833 9.587 -18.407 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -7.312 12.058 -15.990 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -7.507 11.711 -17.712 1.00 0.00 H new ATOM 2050 N THR A 130 -5.898 10.330 -10.999 1.00 0.00 N ATOM 2051 CA THR A 130 -5.617 11.705 -10.500 1.00 0.00 C ATOM 2052 C THR A 130 -5.118 11.633 -9.056 1.00 0.00 C ATOM 2053 O THR A 130 -5.004 12.634 -8.378 1.00 0.00 O ATOM 2054 CB THR A 130 -6.899 12.540 -10.557 1.00 0.00 C ATOM 2055 OG1 THR A 130 -6.719 13.730 -9.802 1.00 0.00 O ATOM 2056 CG2 THR A 130 -8.061 11.735 -9.974 1.00 0.00 C ATOM 0 H THR A 130 -6.878 10.049 -10.968 1.00 0.00 H new ATOM 0 HA THR A 130 -4.853 12.169 -11.124 1.00 0.00 H new ATOM 0 HB THR A 130 -7.122 12.795 -11.593 1.00 0.00 H new ATOM 0 HG1 THR A 130 -5.789 13.787 -9.498 1.00 0.00 H new ATOM 0 HG21 THR A 130 -8.973 12.331 -10.015 1.00 0.00 H new ATOM 0 HG22 THR A 130 -8.198 10.822 -10.553 1.00 0.00 H new ATOM 0 HG23 THR A 130 -7.842 11.478 -8.938 1.00 0.00 H new ATOM 2064 N GLY A 131 -4.818 10.455 -8.580 1.00 0.00 N ATOM 2065 CA GLY A 131 -4.326 10.320 -7.179 1.00 0.00 C ATOM 2066 C GLY A 131 -5.507 10.048 -6.246 1.00 0.00 C ATOM 2067 O GLY A 131 -5.378 10.091 -5.038 1.00 0.00 O ATOM 0 H GLY A 131 -4.892 9.581 -9.100 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -3.603 9.507 -7.113 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -3.811 11.231 -6.874 1.00 0.00 H new ATOM 2071 N GLN A 132 -6.659 9.768 -6.794 1.00 0.00 N ATOM 2072 CA GLN A 132 -7.847 9.494 -5.938 1.00 0.00 C ATOM 2073 C GLN A 132 -7.976 7.986 -5.711 1.00 0.00 C ATOM 2074 O GLN A 132 -7.340 7.192 -6.375 1.00 0.00 O ATOM 2075 CB GLN A 132 -9.107 10.014 -6.633 1.00 0.00 C ATOM 2076 CG GLN A 132 -9.164 11.538 -6.514 1.00 0.00 C ATOM 2077 CD GLN A 132 -9.484 11.927 -5.069 1.00 0.00 C ATOM 2078 OE1 GLN A 132 -8.818 12.761 -4.489 1.00 0.00 O ATOM 2079 NE2 GLN A 132 -10.485 11.353 -4.460 1.00 0.00 N ATOM 0 H GLN A 132 -6.828 9.717 -7.799 1.00 0.00 H new ATOM 0 HA GLN A 132 -7.727 9.997 -4.978 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -9.103 9.721 -7.683 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -9.994 9.570 -6.181 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -8.211 11.973 -6.816 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -9.924 11.937 -7.186 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -11.044 10.653 -4.947 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -10.708 11.605 -3.497 1.00 0.00 H new ATOM 2088 N TYR A 133 -8.796 7.586 -4.778 1.00 0.00 N ATOM 2089 CA TYR A 133 -8.967 6.129 -4.511 1.00 0.00 C ATOM 2090 C TYR A 133 -10.097 5.581 -5.384 1.00 0.00 C ATOM 2091 O TYR A 133 -11.226 6.024 -5.308 1.00 0.00 O ATOM 2092 CB TYR A 133 -9.307 5.918 -3.033 1.00 0.00 C ATOM 2093 CG TYR A 133 -10.720 6.381 -2.768 1.00 0.00 C ATOM 2094 CD1 TYR A 133 -10.976 7.733 -2.510 1.00 0.00 C ATOM 2095 CD2 TYR A 133 -11.772 5.459 -2.779 1.00 0.00 C ATOM 2096 CE1 TYR A 133 -12.286 8.163 -2.265 1.00 0.00 C ATOM 2097 CE2 TYR A 133 -13.081 5.887 -2.533 1.00 0.00 C ATOM 2098 CZ TYR A 133 -13.339 7.239 -2.277 1.00 0.00 C ATOM 2099 OH TYR A 133 -14.630 7.661 -2.034 1.00 0.00 O ATOM 0 H TYR A 133 -9.355 8.204 -4.189 1.00 0.00 H new ATOM 0 HA TYR A 133 -8.042 5.603 -4.747 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -9.204 4.865 -2.772 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -8.608 6.472 -2.406 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -10.163 8.444 -2.500 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -11.574 4.416 -2.978 1.00 0.00 H new ATOM 0 HE1 TYR A 133 -12.484 9.206 -2.067 1.00 0.00 H new ATOM 0 HE2 TYR A 133 -13.893 5.174 -2.541 1.00 0.00 H new ATOM 0 HH TYR A 133 -15.239 6.895 -2.081 1.00 0.00 H new ATOM 2109 N LYS A 134 -9.803 4.622 -6.219 1.00 0.00 N ATOM 2110 CA LYS A 134 -10.861 4.050 -7.099 1.00 0.00 C ATOM 2111 C LYS A 134 -11.851 3.248 -6.253 1.00 0.00 C ATOM 2112 O LYS A 134 -11.471 2.532 -5.348 1.00 0.00 O ATOM 2113 CB LYS A 134 -10.217 3.132 -8.140 1.00 0.00 C ATOM 2114 CG LYS A 134 -11.255 2.754 -9.198 1.00 0.00 C ATOM 2115 CD LYS A 134 -10.603 1.865 -10.258 1.00 0.00 C ATOM 2116 CE LYS A 134 -10.850 2.458 -11.647 1.00 0.00 C ATOM 2117 NZ LYS A 134 -10.186 3.789 -11.744 1.00 0.00 N ATOM 0 H LYS A 134 -8.876 4.210 -6.330 1.00 0.00 H new ATOM 0 HA LYS A 134 -11.389 4.858 -7.605 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -9.370 3.634 -8.609 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -9.829 2.234 -7.659 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -12.090 2.230 -8.733 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -11.661 3.653 -9.662 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -9.532 1.784 -10.071 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -11.013 0.856 -10.204 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -10.461 1.789 -12.414 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -11.920 2.560 -11.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -10.877 4.500 -12.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.811 4.059 -10.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -9.406 3.739 -12.430 1.00 0.00 H new ATOM 2131 N LEU A 135 -13.119 3.363 -6.541 1.00 0.00 N ATOM 2132 CA LEU A 135 -14.132 2.607 -5.754 1.00 0.00 C ATOM 2133 C LEU A 135 -13.836 1.109 -5.853 1.00 0.00 C ATOM 2134 O LEU A 135 -13.442 0.612 -6.889 1.00 0.00 O ATOM 2135 CB LEU A 135 -15.529 2.890 -6.317 1.00 0.00 C ATOM 2136 CG LEU A 135 -16.593 2.558 -5.262 1.00 0.00 C ATOM 2137 CD1 LEU A 135 -16.532 3.566 -4.106 1.00 0.00 C ATOM 2138 CD2 LEU A 135 -17.979 2.615 -5.907 1.00 0.00 C ATOM 0 H LEU A 135 -13.496 3.948 -7.287 1.00 0.00 H new ATOM 0 HA LEU A 135 -14.091 2.918 -4.710 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.608 3.937 -6.609 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -15.696 2.295 -7.215 1.00 0.00 H new ATOM 0 HG LEU A 135 -16.403 1.558 -4.871 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -17.293 3.317 -3.366 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -15.547 3.527 -3.641 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -16.713 4.570 -4.489 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -18.738 2.380 -5.161 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -18.156 3.616 -6.301 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -18.032 1.890 -6.719 1.00 0.00 H new ATOM 2150 N GLY A 136 -14.022 0.385 -4.783 1.00 0.00 N ATOM 2151 CA GLY A 136 -13.748 -1.079 -4.817 1.00 0.00 C ATOM 2152 C GLY A 136 -14.747 -1.766 -5.751 1.00 0.00 C ATOM 2153 O GLY A 136 -14.774 -2.976 -5.863 1.00 0.00 O ATOM 0 H GLY A 136 -14.352 0.744 -3.887 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -12.729 -1.261 -5.160 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -13.826 -1.497 -3.813 1.00 0.00 H new ATOM 2157 N SER A 137 -15.569 -1.005 -6.422 1.00 0.00 N ATOM 2158 CA SER A 137 -16.564 -1.616 -7.347 1.00 0.00 C ATOM 2159 C SER A 137 -15.986 -1.668 -8.762 1.00 0.00 C ATOM 2160 O SER A 137 -16.278 -2.562 -9.530 1.00 0.00 O ATOM 2161 CB SER A 137 -17.841 -0.773 -7.349 1.00 0.00 C ATOM 2162 OG SER A 137 -17.549 0.518 -7.867 1.00 0.00 O ATOM 0 H SER A 137 -15.594 0.013 -6.369 1.00 0.00 H new ATOM 0 HA SER A 137 -16.795 -2.628 -7.014 1.00 0.00 H new ATOM 0 HB2 SER A 137 -18.608 -1.256 -7.954 1.00 0.00 H new ATOM 0 HB3 SER A 137 -18.238 -0.691 -6.337 1.00 0.00 H new ATOM 0 HG SER A 137 -18.333 0.865 -8.341 1.00 0.00 H new ATOM 2168 N LYS A 138 -15.169 -0.714 -9.115 1.00 0.00 N ATOM 2169 CA LYS A 138 -14.575 -0.709 -10.482 1.00 0.00 C ATOM 2170 C LYS A 138 -13.256 -1.484 -10.470 1.00 0.00 C ATOM 2171 O LYS A 138 -12.746 -1.877 -11.500 1.00 0.00 O ATOM 2172 CB LYS A 138 -14.316 0.733 -10.921 1.00 0.00 C ATOM 2173 CG LYS A 138 -15.637 1.389 -11.325 1.00 0.00 C ATOM 2174 CD LYS A 138 -15.413 2.881 -11.576 1.00 0.00 C ATOM 2175 CE LYS A 138 -16.472 3.400 -12.552 1.00 0.00 C ATOM 2176 NZ LYS A 138 -17.815 2.908 -12.134 1.00 0.00 N ATOM 0 H LYS A 138 -14.887 0.062 -8.516 1.00 0.00 H new ATOM 0 HA LYS A 138 -15.267 -1.182 -11.179 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -13.853 1.294 -10.109 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -13.619 0.750 -11.758 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -16.031 0.914 -12.223 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -16.379 1.250 -10.539 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -15.469 3.431 -10.637 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -14.416 3.046 -11.984 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -16.462 4.490 -12.571 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -16.247 3.061 -13.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -18.552 3.505 -12.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -17.939 1.925 -12.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -17.893 2.950 -11.098 1.00 0.00 H new ATOM 2190 N THR A 139 -12.698 -1.709 -9.312 1.00 0.00 N ATOM 2191 CA THR A 139 -11.413 -2.459 -9.236 1.00 0.00 C ATOM 2192 C THR A 139 -11.657 -3.924 -9.599 1.00 0.00 C ATOM 2193 O THR A 139 -12.772 -4.405 -9.566 1.00 0.00 O ATOM 2194 CB THR A 139 -10.855 -2.371 -7.814 1.00 0.00 C ATOM 2195 OG1 THR A 139 -11.849 -2.791 -6.890 1.00 0.00 O ATOM 2196 CG2 THR A 139 -10.448 -0.929 -7.510 1.00 0.00 C ATOM 0 H THR A 139 -13.077 -1.406 -8.415 1.00 0.00 H new ATOM 0 HA THR A 139 -10.697 -2.026 -9.934 1.00 0.00 H new ATOM 0 HB THR A 139 -9.981 -3.017 -7.726 1.00 0.00 H new ATOM 0 HG1 THR A 139 -11.448 -2.890 -6.001 1.00 0.00 H new ATOM 0 HG21 THR A 139 -10.051 -0.869 -6.497 1.00 0.00 H new ATOM 0 HG22 THR A 139 -9.684 -0.609 -8.219 1.00 0.00 H new ATOM 0 HG23 THR A 139 -11.319 -0.279 -7.598 1.00 0.00 H new ATOM 2204 N GLY A 140 -10.621 -4.640 -9.946 1.00 0.00 N ATOM 2205 CA GLY A 140 -10.796 -6.075 -10.310 1.00 0.00 C ATOM 2206 C GLY A 140 -9.635 -6.517 -11.208 1.00 0.00 C ATOM 2207 O GLY A 140 -8.767 -5.727 -11.521 1.00 0.00 O ATOM 0 H GLY A 140 -9.663 -4.293 -9.993 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -10.828 -6.689 -9.410 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -11.745 -6.217 -10.827 1.00 0.00 H new ATOM 2211 N PRO A 141 -9.651 -7.769 -11.597 1.00 0.00 N ATOM 2212 CA PRO A 141 -8.597 -8.329 -12.464 1.00 0.00 C ATOM 2213 C PRO A 141 -8.575 -7.598 -13.809 1.00 0.00 C ATOM 2214 O PRO A 141 -9.370 -6.714 -14.060 1.00 0.00 O ATOM 2215 CB PRO A 141 -8.986 -9.801 -12.658 1.00 0.00 C ATOM 2216 CG PRO A 141 -10.313 -10.043 -11.895 1.00 0.00 C ATOM 2217 CD PRO A 141 -10.709 -8.724 -11.213 1.00 0.00 C ATOM 0 HA PRO A 141 -7.603 -8.223 -12.029 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -9.107 -10.028 -13.717 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -8.202 -10.457 -12.279 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -11.095 -10.368 -12.582 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -10.190 -10.834 -11.155 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -11.689 -8.384 -11.548 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -10.764 -8.839 -10.131 1.00 0.00 H new ATOM 2225 N GLY A 142 -7.669 -7.961 -14.677 1.00 0.00 N ATOM 2226 CA GLY A 142 -7.597 -7.289 -16.005 1.00 0.00 C ATOM 2227 C GLY A 142 -7.023 -5.881 -15.840 1.00 0.00 C ATOM 2228 O GLY A 142 -6.337 -5.375 -16.706 1.00 0.00 O ATOM 0 H GLY A 142 -6.976 -8.694 -14.523 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -6.972 -7.870 -16.684 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -8.590 -7.237 -16.451 1.00 0.00 H new ATOM 2232 N GLN A 143 -7.300 -5.240 -14.738 1.00 0.00 N ATOM 2233 CA GLN A 143 -6.770 -3.865 -14.523 1.00 0.00 C ATOM 2234 C GLN A 143 -5.382 -3.944 -13.885 1.00 0.00 C ATOM 2235 O GLN A 143 -5.186 -4.600 -12.881 1.00 0.00 O ATOM 2236 CB GLN A 143 -7.715 -3.094 -13.598 1.00 0.00 C ATOM 2237 CG GLN A 143 -8.911 -2.581 -14.402 1.00 0.00 C ATOM 2238 CD GLN A 143 -10.176 -2.666 -13.547 1.00 0.00 C ATOM 2239 OE1 GLN A 143 -10.107 -2.661 -12.334 1.00 0.00 O ATOM 2240 NE2 GLN A 143 -11.340 -2.744 -14.133 1.00 0.00 N ATOM 0 H GLN A 143 -7.870 -5.609 -13.977 1.00 0.00 H new ATOM 0 HA GLN A 143 -6.698 -3.350 -15.481 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -8.057 -3.740 -12.790 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -7.188 -2.259 -13.137 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -8.738 -1.551 -14.713 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -9.033 -3.172 -15.310 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -11.399 -2.748 -15.151 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -12.190 -2.801 -13.573 1.00 0.00 H new ATOM 2249 N LYS A 144 -4.417 -3.278 -14.459 1.00 0.00 N ATOM 2250 CA LYS A 144 -3.042 -3.315 -13.884 1.00 0.00 C ATOM 2251 C LYS A 144 -2.990 -2.444 -12.629 1.00 0.00 C ATOM 2252 O LYS A 144 -1.979 -2.360 -11.962 1.00 0.00 O ATOM 2253 CB LYS A 144 -2.044 -2.781 -14.912 1.00 0.00 C ATOM 2254 CG LYS A 144 -2.126 -3.618 -16.190 1.00 0.00 C ATOM 2255 CD LYS A 144 -0.791 -3.542 -16.937 1.00 0.00 C ATOM 2256 CE LYS A 144 -0.456 -2.079 -17.238 1.00 0.00 C ATOM 2257 NZ LYS A 144 0.703 -2.017 -18.171 1.00 0.00 N ATOM 0 H LYS A 144 -4.521 -2.711 -15.300 1.00 0.00 H new ATOM 0 HA LYS A 144 -2.786 -4.343 -13.626 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -2.260 -1.736 -15.135 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -1.033 -2.818 -14.506 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -2.359 -4.654 -15.944 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -2.932 -3.252 -16.826 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -0.000 -3.991 -16.336 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -0.849 -4.111 -17.865 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -1.319 -1.581 -17.679 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -0.221 -1.551 -16.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 0.931 -1.023 -18.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 1.526 -2.478 -17.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 0.462 -2.507 -19.056 1.00 0.00 H new ATOM 2271 N ALA A 145 -4.071 -1.791 -12.301 1.00 0.00 N ATOM 2272 CA ALA A 145 -4.079 -0.925 -11.089 1.00 0.00 C ATOM 2273 C ALA A 145 -3.750 -1.770 -9.857 1.00 0.00 C ATOM 2274 O ALA A 145 -3.647 -1.265 -8.756 1.00 0.00 O ATOM 2275 CB ALA A 145 -5.463 -0.294 -10.922 1.00 0.00 C ATOM 0 H ALA A 145 -4.949 -1.820 -12.820 1.00 0.00 H new ATOM 0 HA ALA A 145 -3.333 -0.138 -11.199 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -5.469 0.340 -10.035 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -5.697 0.308 -11.800 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -6.210 -1.080 -10.812 1.00 0.00 H new ATOM 2281 N ILE A 146 -3.586 -3.054 -10.034 1.00 0.00 N ATOM 2282 CA ILE A 146 -3.266 -3.937 -8.876 1.00 0.00 C ATOM 2283 C ILE A 146 -1.756 -4.182 -8.816 1.00 0.00 C ATOM 2284 O ILE A 146 -1.272 -4.921 -7.981 1.00 0.00 O ATOM 2285 CB ILE A 146 -3.991 -5.274 -9.042 1.00 0.00 C ATOM 2286 CG1 ILE A 146 -3.503 -5.964 -10.318 1.00 0.00 C ATOM 2287 CG2 ILE A 146 -5.497 -5.031 -9.140 1.00 0.00 C ATOM 2288 CD1 ILE A 146 -4.464 -7.096 -10.687 1.00 0.00 C ATOM 0 H ILE A 146 -3.660 -3.530 -10.933 1.00 0.00 H new ATOM 0 HA ILE A 146 -3.591 -3.455 -7.954 1.00 0.00 H new ATOM 0 HB ILE A 146 -3.781 -5.909 -8.181 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -3.443 -5.243 -11.134 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -2.499 -6.360 -10.168 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -6.012 -5.984 -9.258 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -5.846 -4.540 -8.232 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -5.708 -4.395 -10.000 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -4.116 -7.587 -11.596 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -4.501 -7.821 -9.874 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -5.461 -6.687 -10.854 1.00 0.00 H new ATOM 2300 N LEU A 147 -1.006 -3.570 -9.691 1.00 0.00 N ATOM 2301 CA LEU A 147 0.470 -3.773 -9.678 1.00 0.00 C ATOM 2302 C LEU A 147 1.126 -2.711 -8.791 1.00 0.00 C ATOM 2303 O LEU A 147 1.167 -1.547 -9.134 1.00 0.00 O ATOM 2304 CB LEU A 147 1.018 -3.653 -11.102 1.00 0.00 C ATOM 2305 CG LEU A 147 0.280 -4.625 -12.025 1.00 0.00 C ATOM 2306 CD1 LEU A 147 0.831 -4.496 -13.446 1.00 0.00 C ATOM 2307 CD2 LEU A 147 0.487 -6.060 -11.531 1.00 0.00 C ATOM 0 H LEU A 147 -1.351 -2.939 -10.414 1.00 0.00 H new ATOM 0 HA LEU A 147 0.693 -4.765 -9.285 1.00 0.00 H new ATOM 0 HB2 LEU A 147 0.897 -2.632 -11.463 1.00 0.00 H new ATOM 0 HB3 LEU A 147 2.086 -3.870 -11.110 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.784 -4.389 -12.021 1.00 0.00 H new ATOM 0 HD11 LEU A 147 0.306 -5.188 -14.104 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.685 -3.476 -13.802 1.00 0.00 H new ATOM 0 HD13 LEU A 147 1.895 -4.732 -13.446 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -0.039 -6.751 -12.190 1.00 0.00 H new ATOM 0 HD22 LEU A 147 1.551 -6.296 -11.534 1.00 0.00 H new ATOM 0 HD23 LEU A 147 0.097 -6.156 -10.518 1.00 0.00 H new ATOM 2319 N PHE A 148 1.641 -3.114 -7.656 1.00 0.00 N ATOM 2320 CA PHE A 148 2.304 -2.144 -6.732 1.00 0.00 C ATOM 2321 C PHE A 148 3.787 -2.498 -6.602 1.00 0.00 C ATOM 2322 O PHE A 148 4.209 -3.583 -6.949 1.00 0.00 O ATOM 2323 CB PHE A 148 1.643 -2.221 -5.354 1.00 0.00 C ATOM 2324 CG PHE A 148 0.361 -1.425 -5.362 1.00 0.00 C ATOM 2325 CD1 PHE A 148 -0.781 -1.941 -5.986 1.00 0.00 C ATOM 2326 CD2 PHE A 148 0.314 -0.170 -4.743 1.00 0.00 C ATOM 2327 CE1 PHE A 148 -1.970 -1.202 -5.993 1.00 0.00 C ATOM 2328 CE2 PHE A 148 -0.875 0.569 -4.749 1.00 0.00 C ATOM 2329 CZ PHE A 148 -2.017 0.054 -5.374 1.00 0.00 C ATOM 0 H PHE A 148 1.630 -4.080 -7.328 1.00 0.00 H new ATOM 0 HA PHE A 148 2.202 -1.135 -7.130 1.00 0.00 H new ATOM 0 HB2 PHE A 148 1.436 -3.260 -5.096 1.00 0.00 H new ATOM 0 HB3 PHE A 148 2.319 -1.832 -4.593 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -0.745 -2.910 -6.462 1.00 0.00 H new ATOM 0 HD2 PHE A 148 1.195 0.228 -4.261 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -2.851 -1.600 -6.475 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -0.911 1.537 -4.271 1.00 0.00 H new ATOM 0 HZ PHE A 148 -2.934 0.625 -5.379 1.00 0.00 H new ATOM 2339 N LEU A 149 4.580 -1.586 -6.106 1.00 0.00 N ATOM 2340 CA LEU A 149 6.038 -1.854 -5.950 1.00 0.00 C ATOM 2341 C LEU A 149 6.524 -1.241 -4.629 1.00 0.00 C ATOM 2342 O LEU A 149 7.208 -0.238 -4.638 1.00 0.00 O ATOM 2343 CB LEU A 149 6.794 -1.209 -7.117 1.00 0.00 C ATOM 2344 CG LEU A 149 8.251 -1.691 -7.131 1.00 0.00 C ATOM 2345 CD1 LEU A 149 8.313 -3.192 -7.438 1.00 0.00 C ATOM 2346 CD2 LEU A 149 9.025 -0.925 -8.206 1.00 0.00 C ATOM 0 H LEU A 149 4.278 -0.661 -5.800 1.00 0.00 H new ATOM 0 HA LEU A 149 6.219 -2.929 -5.944 1.00 0.00 H new ATOM 0 HB2 LEU A 149 6.309 -1.463 -8.060 1.00 0.00 H new ATOM 0 HB3 LEU A 149 6.763 -0.123 -7.025 1.00 0.00 H new ATOM 0 HG LEU A 149 8.693 -1.511 -6.151 1.00 0.00 H new ATOM 0 HD11 LEU A 149 9.353 -3.519 -7.445 1.00 0.00 H new ATOM 0 HD12 LEU A 149 7.764 -3.743 -6.674 1.00 0.00 H new ATOM 0 HD13 LEU A 149 7.866 -3.383 -8.414 1.00 0.00 H new ATOM 0 HD21 LEU A 149 10.061 -1.264 -8.220 1.00 0.00 H new ATOM 0 HD22 LEU A 149 8.571 -1.106 -9.180 1.00 0.00 H new ATOM 0 HD23 LEU A 149 8.995 0.142 -7.985 1.00 0.00 H new ATOM 2358 N PRO A 150 6.147 -1.850 -3.528 1.00 0.00 N ATOM 2359 CA PRO A 150 6.532 -1.354 -2.193 1.00 0.00 C ATOM 2360 C PRO A 150 8.055 -1.343 -2.038 1.00 0.00 C ATOM 2361 O PRO A 150 8.699 -2.373 -2.050 1.00 0.00 O ATOM 2362 CB PRO A 150 5.889 -2.337 -1.205 1.00 0.00 C ATOM 2363 CG PRO A 150 5.057 -3.352 -2.028 1.00 0.00 C ATOM 2364 CD PRO A 150 5.315 -3.071 -3.516 1.00 0.00 C ATOM 0 HA PRO A 150 6.199 -0.330 -2.024 1.00 0.00 H new ATOM 0 HB2 PRO A 150 6.654 -2.851 -0.624 1.00 0.00 H new ATOM 0 HB3 PRO A 150 5.253 -1.806 -0.496 1.00 0.00 H new ATOM 0 HG2 PRO A 150 5.343 -4.373 -1.777 1.00 0.00 H new ATOM 0 HG3 PRO A 150 3.996 -3.252 -1.798 1.00 0.00 H new ATOM 0 HD2 PRO A 150 5.829 -3.905 -3.993 1.00 0.00 H new ATOM 0 HD3 PRO A 150 4.382 -2.920 -4.058 1.00 0.00 H new ATOM 2372 N MET A 151 8.632 -0.179 -1.892 1.00 0.00 N ATOM 2373 CA MET A 151 10.111 -0.088 -1.734 1.00 0.00 C ATOM 2374 C MET A 151 10.455 0.015 -0.247 1.00 0.00 C ATOM 2375 O MET A 151 10.016 0.917 0.440 1.00 0.00 O ATOM 2376 CB MET A 151 10.628 1.162 -2.455 1.00 0.00 C ATOM 2377 CG MET A 151 10.141 1.163 -3.905 1.00 0.00 C ATOM 2378 SD MET A 151 10.536 2.757 -4.668 1.00 0.00 S ATOM 2379 CE MET A 151 10.935 2.130 -6.317 1.00 0.00 C ATOM 0 H MET A 151 8.140 0.714 -1.876 1.00 0.00 H new ATOM 0 HA MET A 151 10.576 -0.976 -2.162 1.00 0.00 H new ATOM 0 HB2 MET A 151 10.278 2.059 -1.944 1.00 0.00 H new ATOM 0 HB3 MET A 151 11.717 1.184 -2.428 1.00 0.00 H new ATOM 0 HG2 MET A 151 10.615 0.354 -4.460 1.00 0.00 H new ATOM 0 HG3 MET A 151 9.066 0.987 -3.940 1.00 0.00 H new ATOM 0 HE1 MET A 151 10.629 2.859 -7.067 1.00 0.00 H new ATOM 0 HE2 MET A 151 12.009 1.961 -6.392 1.00 0.00 H new ATOM 0 HE3 MET A 151 10.407 1.191 -6.487 1.00 0.00 H new ATOM 2389 N SER A 152 11.238 -0.897 0.258 1.00 0.00 N ATOM 2390 CA SER A 152 11.608 -0.842 1.700 1.00 0.00 C ATOM 2391 C SER A 152 12.544 0.346 1.936 1.00 0.00 C ATOM 2392 O SER A 152 13.417 0.626 1.140 1.00 0.00 O ATOM 2393 CB SER A 152 12.316 -2.137 2.097 1.00 0.00 C ATOM 2394 OG SER A 152 12.771 -2.031 3.439 1.00 0.00 O ATOM 0 H SER A 152 11.637 -1.677 -0.264 1.00 0.00 H new ATOM 0 HA SER A 152 10.708 -0.724 2.303 1.00 0.00 H new ATOM 0 HB2 SER A 152 11.635 -2.982 1.997 1.00 0.00 H new ATOM 0 HB3 SER A 152 13.157 -2.325 1.429 1.00 0.00 H new ATOM 0 HG SER A 152 13.224 -2.861 3.697 1.00 0.00 H new ATOM 2400 N ALA A 153 12.368 1.047 3.023 1.00 0.00 N ATOM 2401 CA ALA A 153 13.249 2.216 3.304 1.00 0.00 C ATOM 2402 C ALA A 153 14.529 1.737 3.991 1.00 0.00 C ATOM 2403 O ALA A 153 14.869 2.178 5.071 1.00 0.00 O ATOM 2404 CB ALA A 153 12.517 3.201 4.218 1.00 0.00 C ATOM 0 H ALA A 153 11.654 0.861 3.727 1.00 0.00 H new ATOM 0 HA ALA A 153 13.503 2.712 2.367 1.00 0.00 H new ATOM 0 HB1 ALA A 153 13.162 4.055 4.423 1.00 0.00 H new ATOM 0 HB2 ALA A 153 11.606 3.544 3.728 1.00 0.00 H new ATOM 0 HB3 ALA A 153 12.261 2.707 5.155 1.00 0.00 H new ATOM 2410 N LYS A 154 15.243 0.835 3.373 1.00 0.00 N ATOM 2411 CA LYS A 154 16.500 0.328 3.990 1.00 0.00 C ATOM 2412 C LYS A 154 17.512 1.472 4.099 1.00 0.00 C ATOM 2413 O LYS A 154 17.624 2.118 5.121 1.00 0.00 O ATOM 2414 CB LYS A 154 17.083 -0.786 3.119 1.00 0.00 C ATOM 2415 CG LYS A 154 16.083 -1.940 3.027 1.00 0.00 C ATOM 2416 CD LYS A 154 16.786 -3.254 3.368 1.00 0.00 C ATOM 2417 CE LYS A 154 17.937 -3.487 2.388 1.00 0.00 C ATOM 2418 NZ LYS A 154 17.878 -4.886 1.877 1.00 0.00 N ATOM 0 H LYS A 154 15.009 0.428 2.467 1.00 0.00 H new ATOM 0 HA LYS A 154 16.284 -0.063 4.984 1.00 0.00 H new ATOM 0 HB2 LYS A 154 17.306 -0.404 2.123 1.00 0.00 H new ATOM 0 HB3 LYS A 154 18.023 -1.139 3.543 1.00 0.00 H new ATOM 0 HG2 LYS A 154 15.253 -1.771 3.713 1.00 0.00 H new ATOM 0 HG3 LYS A 154 15.662 -1.991 2.023 1.00 0.00 H new ATOM 0 HD2 LYS A 154 17.165 -3.221 4.389 1.00 0.00 H new ATOM 0 HD3 LYS A 154 16.078 -4.081 3.317 1.00 0.00 H new ATOM 0 HE2 LYS A 154 17.871 -2.782 1.559 1.00 0.00 H new ATOM 0 HE3 LYS A 154 18.892 -3.309 2.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 18.660 -5.045 1.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 17.961 -5.550 2.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 16.972 -5.040 1.390 1.00 0.00 H new ATOM 2432 N SER A 155 18.248 1.727 3.052 1.00 0.00 N ATOM 2433 CA SER A 155 19.251 2.828 3.097 1.00 0.00 C ATOM 2434 C SER A 155 18.613 4.120 2.581 1.00 0.00 C ATOM 2435 O SER A 155 18.712 4.372 1.392 1.00 0.00 O ATOM 2436 CB SER A 155 20.448 2.464 2.218 1.00 0.00 C ATOM 2437 OG SER A 155 21.475 3.428 2.400 1.00 0.00 O ATOM 2438 OXT SER A 155 18.038 4.835 3.386 1.00 0.00 O ATOM 0 H SER A 155 18.198 1.221 2.168 1.00 0.00 H new ATOM 0 HA SER A 155 19.586 2.973 4.124 1.00 0.00 H new ATOM 0 HB2 SER A 155 20.815 1.471 2.477 1.00 0.00 H new ATOM 0 HB3 SER A 155 20.148 2.429 1.171 1.00 0.00 H new ATOM 0 HG SER A 155 22.244 3.196 1.839 1.00 0.00 H new TER 2444 SER A 155