USER MOD reduce.3.24.130724 H: found=0, std=0, add=1225, rem=0, adj=43 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 98 THR OG1 : rot 180:sc= 0.0168 USER MOD Set 1.2: A 101 CYS SG : rot -76:sc= -1.69! USER MOD Set 2.1: A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 163:sc= -0.245 (180deg=-0.946) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0305 USER MOD Single : A 8 THR OG1 : rot 110:sc= 0.16 USER MOD Single : A 18 SER OG : rot 65:sc= 0.074 USER MOD Single : A 25 HIS :FLIP no HD1:sc= -0.77 F(o=-2!,f=-0.77) USER MOD Single : A 27 LYS NZ :NH3+ 156:sc= -0.0266 (180deg=-0.192) USER MOD Single : A 30 LYS NZ :NH3+ -148:sc= 1.62 (180deg=1.23) USER MOD Single : A 33 TYR OH : rot 180:sc= -0.0755 USER MOD Single : A 34 CYS SG : rot 180:sc= -0.046 USER MOD Single : A 35 LYS NZ :NH3+ -128:sc= 0.0453 (180deg=-0.445) USER MOD Single : A 36 ASN :FLIP amide:sc= -8.71! C(o=-10!,f=-8.7!) USER MOD Single : A 44 HIS : no HD1:sc= -1.7 K(o=-1.7,f=-7.8!) USER MOD Single : A 55 LYS NZ :NH3+ 163:sc=-0.00874 (180deg=-0.248) USER MOD Single : A 56 SER OG : rot 140:sc= -0.329 USER MOD Single : A 59 HIS : no HD1:sc= -0.268 K(o=-0.27,f=-0.89) USER MOD Single : A 61 LYS NZ :NH3+ 141:sc= -0.307 (180deg=-1.27!) USER MOD Single : A 63 GLN : amide:sc= -0.0805 K(o=-0.081,f=-1.9!) USER MOD Single : A 65 GLN : amide:sc= -0.19 X(o=-0.19,f=-0.14) USER MOD Single : A 73 SER OG : rot 180:sc=-0.00649 USER MOD Single : A 78 SER OG : rot 110:sc= 0.0481 USER MOD Single : A 80 ASN : amide:sc= -0.0391 K(o=-0.039,f=-0.83) USER MOD Single : A 85 MET CE :methyl 169:sc= -1.12 (180deg=-1.65!) USER MOD Single : A 86 LYS NZ :NH3+ -152:sc= -0.0986 (180deg=-1.48) USER MOD Single : A 94 SER OG : rot 111:sc= 0.266 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 180:sc= 0.0218 USER MOD Single : A 110 ASN : amide:sc= -0.689! C(o=-0.69!,f=-11!) USER MOD Single : A 111 ASN : amide:sc= -2.37! C(o=-2.4!,f=-6.9!) USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -0.38 X(o=-0.38,f=-0.65) USER MOD Single : A 114 THR OG1 : rot 18:sc= -0.181 USER MOD Single : A 115 TYR OH : rot 45:sc= -0.0059 USER MOD Single : A 117 SER OG : rot 129:sc= 0.818 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 TYR OH : rot 180:sc= -0.0257 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0.0129 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 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 THR OG1 : rot -67:sc= 1.09 USER MOD Single : A 132 GLN :FLIP amide:sc= -0.252 F(o=-0.82,f=-0.25) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ -108:sc= -0.75 (180deg=-1.66!) USER MOD Single : A 137 SER OG : rot -178:sc= -0.87 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 THR OG1 : rot 60:sc= 0.31 USER MOD Single : A 143 GLN : amide:sc= -0.0407 X(o=-0.041,f=-0.029) USER MOD Single : A 144 LYS NZ :NH3+ -141:sc= -0.185 (180deg=-1.47!) USER MOD Single : A 151 MET CE :methyl -133:sc= -0.687 (180deg=-3.98!) USER MOD Single : A 152 SER OG : rot 180:sc=-0.00545 USER MOD Single : A 154 LYS NZ :NH3+ -148:sc= -1.02 (180deg=-1.08) USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 17.108 18.497 -4.093 1.00 0.00 N ATOM 2 CA MET A 1 16.827 17.045 -3.903 1.00 0.00 C ATOM 3 C MET A 1 15.779 16.869 -2.802 1.00 0.00 C ATOM 4 O MET A 1 15.540 15.775 -2.330 1.00 0.00 O ATOM 5 CB MET A 1 18.116 16.326 -3.501 1.00 0.00 C ATOM 6 CG MET A 1 18.787 17.083 -2.353 1.00 0.00 C ATOM 7 SD MET A 1 20.191 16.121 -1.735 1.00 0.00 S ATOM 8 CE MET A 1 19.339 15.346 -0.339 1.00 0.00 C ATOM 0 H1 MET A 1 18.000 18.613 -4.614 1.00 0.00 H new ATOM 0 H2 MET A 1 16.333 18.933 -4.632 1.00 0.00 H new ATOM 0 H3 MET A 1 17.187 18.960 -3.165 1.00 0.00 H new ATOM 0 HA MET A 1 16.450 16.622 -4.834 1.00 0.00 H new ATOM 0 HB2 MET A 1 17.894 15.303 -3.196 1.00 0.00 H new ATOM 0 HB3 MET A 1 18.792 16.265 -4.354 1.00 0.00 H new ATOM 0 HG2 MET A 1 19.125 18.061 -2.696 1.00 0.00 H new ATOM 0 HG3 MET A 1 18.070 17.258 -1.550 1.00 0.00 H new ATOM 0 HE1 MET A 1 20.032 14.696 0.195 1.00 0.00 H new ATOM 0 HE2 MET A 1 18.972 16.118 0.337 1.00 0.00 H new ATOM 0 HE3 MET A 1 18.499 14.757 -0.707 1.00 0.00 H new ATOM 20 N ALA A 2 15.151 17.936 -2.391 1.00 0.00 N ATOM 21 CA ALA A 2 14.120 17.827 -1.322 1.00 0.00 C ATOM 22 C ALA A 2 13.009 16.879 -1.779 1.00 0.00 C ATOM 23 O ALA A 2 12.243 16.375 -0.982 1.00 0.00 O ATOM 24 CB ALA A 2 13.526 19.211 -1.044 1.00 0.00 C ATOM 0 H ALA A 2 15.307 18.878 -2.749 1.00 0.00 H new ATOM 0 HA ALA A 2 14.579 17.438 -0.413 1.00 0.00 H new ATOM 0 HB1 ALA A 2 12.771 19.132 -0.262 1.00 0.00 H new ATOM 0 HB2 ALA A 2 14.316 19.888 -0.719 1.00 0.00 H new ATOM 0 HB3 ALA A 2 13.067 19.599 -1.953 1.00 0.00 H new ATOM 30 N GLU A 3 12.916 16.630 -3.057 1.00 0.00 N ATOM 31 CA GLU A 3 11.855 15.714 -3.563 1.00 0.00 C ATOM 32 C GLU A 3 12.396 14.283 -3.604 1.00 0.00 C ATOM 33 O GLU A 3 12.842 13.808 -4.629 1.00 0.00 O ATOM 34 CB GLU A 3 11.439 16.144 -4.970 1.00 0.00 C ATOM 35 CG GLU A 3 11.066 17.628 -4.963 1.00 0.00 C ATOM 36 CD GLU A 3 12.079 18.414 -5.796 1.00 0.00 C ATOM 37 OE1 GLU A 3 13.115 18.764 -5.256 1.00 0.00 O ATOM 38 OE2 GLU A 3 11.803 18.651 -6.960 1.00 0.00 O ATOM 0 H GLU A 3 13.529 17.021 -3.772 1.00 0.00 H new ATOM 0 HA GLU A 3 10.990 15.757 -2.901 1.00 0.00 H new ATOM 0 HB2 GLU A 3 12.254 15.967 -5.671 1.00 0.00 H new ATOM 0 HB3 GLU A 3 10.592 15.547 -5.308 1.00 0.00 H new ATOM 0 HG2 GLU A 3 10.063 17.763 -5.368 1.00 0.00 H new ATOM 0 HG3 GLU A 3 11.050 18.005 -3.940 1.00 0.00 H new ATOM 45 N GLY A 4 12.360 13.594 -2.497 1.00 0.00 N ATOM 46 CA GLY A 4 12.873 12.195 -2.472 1.00 0.00 C ATOM 47 C GLY A 4 13.306 11.834 -1.051 1.00 0.00 C ATOM 48 O GLY A 4 13.947 12.611 -0.371 1.00 0.00 O ATOM 0 H GLY A 4 11.997 13.939 -1.608 1.00 0.00 H new ATOM 0 HA2 GLY A 4 12.100 11.507 -2.813 1.00 0.00 H new ATOM 0 HA3 GLY A 4 13.715 12.093 -3.157 1.00 0.00 H new ATOM 52 N GLU A 5 12.961 10.661 -0.594 1.00 0.00 N ATOM 53 CA GLU A 5 13.353 10.254 0.784 1.00 0.00 C ATOM 54 C GLU A 5 14.787 9.723 0.771 1.00 0.00 C ATOM 55 O GLU A 5 15.641 10.228 0.068 1.00 0.00 O ATOM 56 CB GLU A 5 12.408 9.158 1.283 1.00 0.00 C ATOM 57 CG GLU A 5 10.994 9.424 0.759 1.00 0.00 C ATOM 58 CD GLU A 5 10.784 8.673 -0.558 1.00 0.00 C ATOM 59 OE1 GLU A 5 11.769 8.361 -1.205 1.00 0.00 O ATOM 60 OE2 GLU A 5 9.639 8.421 -0.896 1.00 0.00 O ATOM 0 H GLU A 5 12.425 9.968 -1.116 1.00 0.00 H new ATOM 0 HA GLU A 5 13.291 11.116 1.448 1.00 0.00 H new ATOM 0 HB2 GLU A 5 12.755 8.182 0.944 1.00 0.00 H new ATOM 0 HB3 GLU A 5 12.405 9.134 2.373 1.00 0.00 H new ATOM 0 HG2 GLU A 5 10.256 9.102 1.494 1.00 0.00 H new ATOM 0 HG3 GLU A 5 10.847 10.493 0.607 1.00 0.00 H new ATOM 67 N ILE A 6 15.060 8.704 1.540 1.00 0.00 N ATOM 68 CA ILE A 6 16.439 8.142 1.569 1.00 0.00 C ATOM 69 C ILE A 6 16.765 7.523 0.208 1.00 0.00 C ATOM 70 O ILE A 6 16.583 6.342 -0.006 1.00 0.00 O ATOM 71 CB ILE A 6 16.528 7.066 2.652 1.00 0.00 C ATOM 72 CG1 ILE A 6 15.141 6.460 2.881 1.00 0.00 C ATOM 73 CG2 ILE A 6 17.030 7.691 3.954 1.00 0.00 C ATOM 74 CD1 ILE A 6 15.286 5.083 3.530 1.00 0.00 C ATOM 0 H ILE A 6 14.388 8.237 2.149 1.00 0.00 H new ATOM 0 HA ILE A 6 17.152 8.937 1.787 1.00 0.00 H new ATOM 0 HB ILE A 6 17.220 6.286 2.333 1.00 0.00 H new ATOM 0 HG12 ILE A 6 14.548 7.114 3.520 1.00 0.00 H new ATOM 0 HG13 ILE A 6 14.610 6.373 1.933 1.00 0.00 H new ATOM 0 HG21 ILE A 6 17.093 6.923 4.725 1.00 0.00 H new ATOM 0 HG22 ILE A 6 18.017 8.125 3.792 1.00 0.00 H new ATOM 0 HG23 ILE A 6 16.339 8.471 4.274 1.00 0.00 H new ATOM 0 HD11 ILE A 6 14.298 4.652 3.693 1.00 0.00 H new ATOM 0 HD12 ILE A 6 15.863 4.431 2.875 1.00 0.00 H new ATOM 0 HD13 ILE A 6 15.800 5.184 4.486 1.00 0.00 H new ATOM 86 N THR A 7 17.245 8.312 -0.714 1.00 0.00 N ATOM 87 CA THR A 7 17.581 7.769 -2.060 1.00 0.00 C ATOM 88 C THR A 7 18.513 6.565 -1.905 1.00 0.00 C ATOM 89 O THR A 7 19.721 6.698 -1.921 1.00 0.00 O ATOM 90 CB THR A 7 18.278 8.852 -2.887 1.00 0.00 C ATOM 91 OG1 THR A 7 17.625 10.096 -2.682 1.00 0.00 O ATOM 92 CG2 THR A 7 18.218 8.481 -4.370 1.00 0.00 C ATOM 0 H THR A 7 17.419 9.310 -0.593 1.00 0.00 H new ATOM 0 HA THR A 7 16.667 7.458 -2.566 1.00 0.00 H new ATOM 0 HB THR A 7 19.320 8.933 -2.576 1.00 0.00 H new ATOM 0 HG1 THR A 7 18.071 10.791 -3.210 1.00 0.00 H new ATOM 0 HG21 THR A 7 18.714 9.253 -4.958 1.00 0.00 H new ATOM 0 HG22 THR A 7 18.720 7.526 -4.527 1.00 0.00 H new ATOM 0 HG23 THR A 7 17.177 8.400 -4.683 1.00 0.00 H new ATOM 100 N THR A 8 17.963 5.393 -1.756 1.00 0.00 N ATOM 101 CA THR A 8 18.817 4.182 -1.602 1.00 0.00 C ATOM 102 C THR A 8 19.064 3.554 -2.975 1.00 0.00 C ATOM 103 O THR A 8 19.481 2.419 -3.074 1.00 0.00 O ATOM 104 CB THR A 8 18.109 3.170 -0.698 1.00 0.00 C ATOM 105 OG1 THR A 8 18.711 1.893 -0.857 1.00 0.00 O ATOM 106 CG2 THR A 8 16.630 3.089 -1.079 1.00 0.00 C ATOM 0 H THR A 8 16.958 5.221 -1.734 1.00 0.00 H new ATOM 0 HA THR A 8 19.770 4.464 -1.155 1.00 0.00 H new ATOM 0 HB THR A 8 18.197 3.487 0.341 1.00 0.00 H new ATOM 0 HG1 THR A 8 19.206 1.661 -0.043 1.00 0.00 H new ATOM 0 HG21 THR A 8 16.127 2.368 -0.434 1.00 0.00 H new ATOM 0 HG22 THR A 8 16.169 4.069 -0.957 1.00 0.00 H new ATOM 0 HG23 THR A 8 16.539 2.772 -2.118 1.00 0.00 H new ATOM 114 N LEU A 9 18.808 4.298 -4.025 1.00 0.00 N ATOM 115 CA LEU A 9 19.016 3.782 -5.415 1.00 0.00 C ATOM 116 C LEU A 9 18.178 2.494 -5.611 1.00 0.00 C ATOM 117 O LEU A 9 17.945 1.779 -4.659 1.00 0.00 O ATOM 118 CB LEU A 9 20.507 3.484 -5.642 1.00 0.00 C ATOM 119 CG LEU A 9 21.302 4.794 -5.778 1.00 0.00 C ATOM 120 CD1 LEU A 9 20.890 5.559 -7.040 1.00 0.00 C ATOM 121 CD2 LEU A 9 21.065 5.682 -4.553 1.00 0.00 C ATOM 0 H LEU A 9 18.459 5.255 -3.976 1.00 0.00 H new ATOM 0 HA LEU A 9 18.696 4.533 -6.137 1.00 0.00 H new ATOM 0 HB2 LEU A 9 20.898 2.899 -4.810 1.00 0.00 H new ATOM 0 HB3 LEU A 9 20.631 2.881 -6.542 1.00 0.00 H new ATOM 0 HG LEU A 9 22.359 4.538 -5.851 1.00 0.00 H new ATOM 0 HD11 LEU A 9 21.467 6.481 -7.111 1.00 0.00 H new ATOM 0 HD12 LEU A 9 21.081 4.942 -7.918 1.00 0.00 H new ATOM 0 HD13 LEU A 9 19.828 5.799 -6.989 1.00 0.00 H new ATOM 0 HD21 LEU A 9 21.632 6.607 -4.659 1.00 0.00 H new ATOM 0 HD22 LEU A 9 20.003 5.915 -4.472 1.00 0.00 H new ATOM 0 HD23 LEU A 9 21.391 5.157 -3.655 1.00 0.00 H new ATOM 133 N PRO A 10 17.735 2.212 -6.826 1.00 0.00 N ATOM 134 CA PRO A 10 16.934 0.998 -7.076 1.00 0.00 C ATOM 135 C PRO A 10 17.720 -0.246 -6.654 1.00 0.00 C ATOM 136 O PRO A 10 18.918 -0.327 -6.838 1.00 0.00 O ATOM 137 CB PRO A 10 16.681 0.989 -8.589 1.00 0.00 C ATOM 138 CG PRO A 10 17.355 2.248 -9.186 1.00 0.00 C ATOM 139 CD PRO A 10 17.978 3.041 -8.027 1.00 0.00 C ATOM 0 HA PRO A 10 16.002 0.994 -6.510 1.00 0.00 H new ATOM 0 HB2 PRO A 10 17.091 0.085 -9.040 1.00 0.00 H new ATOM 0 HB3 PRO A 10 15.611 0.992 -8.798 1.00 0.00 H new ATOM 0 HG2 PRO A 10 18.119 1.965 -9.910 1.00 0.00 H new ATOM 0 HG3 PRO A 10 16.624 2.858 -9.716 1.00 0.00 H new ATOM 0 HD2 PRO A 10 19.044 3.203 -8.187 1.00 0.00 H new ATOM 0 HD3 PRO A 10 17.518 4.024 -7.928 1.00 0.00 H new ATOM 147 N ALA A 11 17.056 -1.217 -6.089 1.00 0.00 N ATOM 148 CA ALA A 11 17.768 -2.451 -5.657 1.00 0.00 C ATOM 149 C ALA A 11 16.765 -3.599 -5.518 1.00 0.00 C ATOM 150 O ALA A 11 15.596 -3.456 -5.816 1.00 0.00 O ATOM 151 CB ALA A 11 18.447 -2.203 -4.309 1.00 0.00 C ATOM 0 H ALA A 11 16.052 -1.208 -5.908 1.00 0.00 H new ATOM 0 HA ALA A 11 18.520 -2.714 -6.401 1.00 0.00 H new ATOM 0 HB1 ALA A 11 18.968 -3.106 -3.993 1.00 0.00 H new ATOM 0 HB2 ALA A 11 19.162 -1.387 -4.407 1.00 0.00 H new ATOM 0 HB3 ALA A 11 17.695 -1.939 -3.566 1.00 0.00 H new ATOM 157 N LEU A 12 17.215 -4.738 -5.067 1.00 0.00 N ATOM 158 CA LEU A 12 16.293 -5.896 -4.908 1.00 0.00 C ATOM 159 C LEU A 12 16.755 -6.755 -3.724 1.00 0.00 C ATOM 160 O LEU A 12 17.237 -7.854 -3.916 1.00 0.00 O ATOM 161 CB LEU A 12 16.319 -6.741 -6.186 1.00 0.00 C ATOM 162 CG LEU A 12 15.230 -7.821 -6.122 1.00 0.00 C ATOM 163 CD1 LEU A 12 13.840 -7.177 -6.124 1.00 0.00 C ATOM 164 CD2 LEU A 12 15.361 -8.742 -7.337 1.00 0.00 C ATOM 0 H LEU A 12 18.184 -4.916 -4.801 1.00 0.00 H new ATOM 0 HA LEU A 12 15.281 -5.536 -4.725 1.00 0.00 H new ATOM 0 HB2 LEU A 12 16.161 -6.104 -7.056 1.00 0.00 H new ATOM 0 HB3 LEU A 12 17.298 -7.206 -6.305 1.00 0.00 H new ATOM 0 HG LEU A 12 15.353 -8.394 -5.203 1.00 0.00 H new ATOM 0 HD11 LEU A 12 13.078 -7.955 -6.078 1.00 0.00 H new ATOM 0 HD12 LEU A 12 13.741 -6.522 -5.259 1.00 0.00 H new ATOM 0 HD13 LEU A 12 13.710 -6.595 -7.036 1.00 0.00 H new ATOM 0 HD21 LEU A 12 14.589 -9.511 -7.296 1.00 0.00 H new ATOM 0 HD22 LEU A 12 15.243 -8.159 -8.250 1.00 0.00 H new ATOM 0 HD23 LEU A 12 16.344 -9.214 -7.332 1.00 0.00 H new ATOM 176 N PRO A 13 16.605 -6.231 -2.530 1.00 0.00 N ATOM 177 CA PRO A 13 17.017 -6.947 -1.310 1.00 0.00 C ATOM 178 C PRO A 13 16.215 -8.237 -1.154 1.00 0.00 C ATOM 179 O PRO A 13 15.604 -8.721 -2.087 1.00 0.00 O ATOM 180 CB PRO A 13 16.713 -5.978 -0.159 1.00 0.00 C ATOM 181 CG PRO A 13 16.136 -4.680 -0.778 1.00 0.00 C ATOM 182 CD PRO A 13 16.021 -4.895 -2.296 1.00 0.00 C ATOM 0 HA PRO A 13 18.069 -7.233 -1.335 1.00 0.00 H new ATOM 0 HB2 PRO A 13 15.999 -6.421 0.536 1.00 0.00 H new ATOM 0 HB3 PRO A 13 17.618 -5.762 0.409 1.00 0.00 H new ATOM 0 HG2 PRO A 13 15.160 -4.453 -0.349 1.00 0.00 H new ATOM 0 HG3 PRO A 13 16.785 -3.832 -0.560 1.00 0.00 H new ATOM 0 HD2 PRO A 13 14.982 -4.854 -2.624 1.00 0.00 H new ATOM 0 HD3 PRO A 13 16.561 -4.125 -2.847 1.00 0.00 H new ATOM 190 N GLU A 14 16.219 -8.799 0.020 1.00 0.00 N ATOM 191 CA GLU A 14 15.464 -10.063 0.249 1.00 0.00 C ATOM 192 C GLU A 14 13.968 -9.759 0.360 1.00 0.00 C ATOM 193 O GLU A 14 13.313 -10.151 1.305 1.00 0.00 O ATOM 194 CB GLU A 14 15.946 -10.713 1.547 1.00 0.00 C ATOM 195 CG GLU A 14 17.272 -11.435 1.295 1.00 0.00 C ATOM 196 CD GLU A 14 17.822 -11.969 2.620 1.00 0.00 C ATOM 197 OE1 GLU A 14 17.190 -11.736 3.638 1.00 0.00 O ATOM 198 OE2 GLU A 14 18.865 -12.600 2.594 1.00 0.00 O ATOM 0 H GLU A 14 16.714 -8.437 0.835 1.00 0.00 H new ATOM 0 HA GLU A 14 15.634 -10.741 -0.587 1.00 0.00 H new ATOM 0 HB2 GLU A 14 16.074 -9.955 2.320 1.00 0.00 H new ATOM 0 HB3 GLU A 14 15.199 -11.418 1.912 1.00 0.00 H new ATOM 0 HG2 GLU A 14 17.124 -12.256 0.593 1.00 0.00 H new ATOM 0 HG3 GLU A 14 17.989 -10.752 0.840 1.00 0.00 H new ATOM 205 N ASP A 15 13.419 -9.067 -0.601 1.00 0.00 N ATOM 206 CA ASP A 15 11.966 -8.746 -0.550 1.00 0.00 C ATOM 207 C ASP A 15 11.168 -9.932 -1.096 1.00 0.00 C ATOM 208 O ASP A 15 10.027 -10.143 -0.738 1.00 0.00 O ATOM 209 CB ASP A 15 11.685 -7.506 -1.401 1.00 0.00 C ATOM 210 CG ASP A 15 10.470 -6.766 -0.839 1.00 0.00 C ATOM 211 OD1 ASP A 15 10.445 -6.529 0.357 1.00 0.00 O ATOM 212 OD2 ASP A 15 9.583 -6.449 -1.617 1.00 0.00 O ATOM 0 H ASP A 15 13.914 -8.711 -1.418 1.00 0.00 H new ATOM 0 HA ASP A 15 11.671 -8.550 0.481 1.00 0.00 H new ATOM 0 HB2 ASP A 15 12.555 -6.849 -1.404 1.00 0.00 H new ATOM 0 HB3 ASP A 15 11.501 -7.796 -2.436 1.00 0.00 H new ATOM 217 N GLY A 16 11.763 -10.709 -1.959 1.00 0.00 N ATOM 218 CA GLY A 16 11.043 -11.884 -2.526 1.00 0.00 C ATOM 219 C GLY A 16 11.133 -13.056 -1.547 1.00 0.00 C ATOM 220 O GLY A 16 10.137 -13.523 -1.029 1.00 0.00 O ATOM 0 H GLY A 16 12.717 -10.581 -2.296 1.00 0.00 H new ATOM 0 HA2 GLY A 16 9.999 -11.630 -2.711 1.00 0.00 H new ATOM 0 HA3 GLY A 16 11.479 -12.163 -3.485 1.00 0.00 H new ATOM 224 N GLY A 17 12.319 -13.535 -1.288 1.00 0.00 N ATOM 225 CA GLY A 17 12.472 -14.675 -0.341 1.00 0.00 C ATOM 226 C GLY A 17 12.083 -15.979 -1.038 1.00 0.00 C ATOM 227 O GLY A 17 12.065 -16.065 -2.251 1.00 0.00 O ATOM 0 H GLY A 17 13.188 -13.186 -1.691 1.00 0.00 H new ATOM 0 HA2 GLY A 17 13.502 -14.733 0.011 1.00 0.00 H new ATOM 0 HA3 GLY A 17 11.844 -14.519 0.536 1.00 0.00 H new ATOM 231 N SER A 18 11.773 -16.998 -0.283 1.00 0.00 N ATOM 232 CA SER A 18 11.385 -18.296 -0.904 1.00 0.00 C ATOM 233 C SER A 18 10.388 -19.018 0.005 1.00 0.00 C ATOM 234 O SER A 18 10.581 -20.159 0.372 1.00 0.00 O ATOM 235 CB SER A 18 12.630 -19.166 -1.086 1.00 0.00 C ATOM 236 OG SER A 18 13.273 -19.334 0.171 1.00 0.00 O ATOM 0 H SER A 18 11.772 -16.987 0.737 1.00 0.00 H new ATOM 0 HA SER A 18 10.925 -18.111 -1.875 1.00 0.00 H new ATOM 0 HB2 SER A 18 12.353 -20.136 -1.498 1.00 0.00 H new ATOM 0 HB3 SER A 18 13.312 -18.701 -1.797 1.00 0.00 H new ATOM 0 HG SER A 18 12.688 -19.840 0.773 1.00 0.00 H new ATOM 242 N GLY A 19 9.320 -18.361 0.369 1.00 0.00 N ATOM 243 CA GLY A 19 8.311 -19.010 1.253 1.00 0.00 C ATOM 244 C GLY A 19 7.063 -18.129 1.338 1.00 0.00 C ATOM 245 O GLY A 19 6.441 -18.016 2.374 1.00 0.00 O ATOM 0 H GLY A 19 9.103 -17.403 0.092 1.00 0.00 H new ATOM 0 HA2 GLY A 19 8.049 -19.993 0.862 1.00 0.00 H new ATOM 0 HA3 GLY A 19 8.729 -19.163 2.248 1.00 0.00 H new ATOM 249 N ALA A 20 6.693 -17.506 0.253 1.00 0.00 N ATOM 250 CA ALA A 20 5.487 -16.632 0.270 1.00 0.00 C ATOM 251 C ALA A 20 5.579 -15.656 1.443 1.00 0.00 C ATOM 252 O ALA A 20 5.146 -15.944 2.541 1.00 0.00 O ATOM 253 CB ALA A 20 4.234 -17.493 0.424 1.00 0.00 C ATOM 0 H ALA A 20 7.174 -17.565 -0.645 1.00 0.00 H new ATOM 0 HA ALA A 20 5.433 -16.074 -0.665 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.352 -16.853 0.436 1.00 0.00 H new ATOM 0 HB2 ALA A 20 4.166 -18.189 -0.412 1.00 0.00 H new ATOM 0 HB3 ALA A 20 4.289 -18.052 1.358 1.00 0.00 H new ATOM 259 N PHE A 21 6.142 -14.503 1.216 1.00 0.00 N ATOM 260 CA PHE A 21 6.268 -13.500 2.312 1.00 0.00 C ATOM 261 C PHE A 21 6.775 -14.183 3.589 1.00 0.00 C ATOM 262 O PHE A 21 6.045 -14.288 4.553 1.00 0.00 O ATOM 263 CB PHE A 21 4.896 -12.880 2.586 1.00 0.00 C ATOM 264 CG PHE A 21 4.320 -12.338 1.299 1.00 0.00 C ATOM 265 CD1 PHE A 21 3.590 -13.180 0.451 1.00 0.00 C ATOM 266 CD2 PHE A 21 4.515 -10.996 0.956 1.00 0.00 C ATOM 267 CE1 PHE A 21 3.056 -12.678 -0.741 1.00 0.00 C ATOM 268 CE2 PHE A 21 3.980 -10.494 -0.237 1.00 0.00 C ATOM 269 CZ PHE A 21 3.251 -11.334 -1.085 1.00 0.00 C ATOM 0 H PHE A 21 6.522 -14.210 0.316 1.00 0.00 H new ATOM 0 HA PHE A 21 6.975 -12.726 2.012 1.00 0.00 H new ATOM 0 HB2 PHE A 21 4.226 -13.628 3.010 1.00 0.00 H new ATOM 0 HB3 PHE A 21 4.987 -12.080 3.321 1.00 0.00 H new ATOM 0 HD1 PHE A 21 3.439 -14.216 0.717 1.00 0.00 H new ATOM 0 HD2 PHE A 21 5.078 -10.347 1.611 1.00 0.00 H new ATOM 0 HE1 PHE A 21 2.493 -13.327 -1.396 1.00 0.00 H new ATOM 0 HE2 PHE A 21 4.130 -9.458 -0.502 1.00 0.00 H new ATOM 0 HZ PHE A 21 2.838 -10.947 -2.005 1.00 0.00 H new ATOM 279 N PRO A 22 8.010 -14.630 3.563 1.00 0.00 N ATOM 280 CA PRO A 22 8.616 -15.308 4.726 1.00 0.00 C ATOM 281 C PRO A 22 8.729 -14.319 5.911 1.00 0.00 C ATOM 282 O PRO A 22 9.476 -13.366 5.811 1.00 0.00 O ATOM 283 CB PRO A 22 10.017 -15.718 4.252 1.00 0.00 C ATOM 284 CG PRO A 22 10.185 -15.232 2.791 1.00 0.00 C ATOM 285 CD PRO A 22 8.896 -14.502 2.389 1.00 0.00 C ATOM 0 HA PRO A 22 8.026 -16.160 5.065 1.00 0.00 H new ATOM 0 HB2 PRO A 22 10.781 -15.276 4.892 1.00 0.00 H new ATOM 0 HB3 PRO A 22 10.139 -16.800 4.311 1.00 0.00 H new ATOM 0 HG2 PRO A 22 11.044 -14.566 2.706 1.00 0.00 H new ATOM 0 HG3 PRO A 22 10.369 -16.076 2.126 1.00 0.00 H new ATOM 0 HD2 PRO A 22 9.091 -13.456 2.152 1.00 0.00 H new ATOM 0 HD3 PRO A 22 8.447 -14.951 1.503 1.00 0.00 H new ATOM 293 N PRO A 23 8.006 -14.540 7.000 1.00 0.00 N ATOM 294 CA PRO A 23 8.079 -13.621 8.152 1.00 0.00 C ATOM 295 C PRO A 23 9.497 -13.612 8.731 1.00 0.00 C ATOM 296 O PRO A 23 9.976 -14.606 9.240 1.00 0.00 O ATOM 297 CB PRO A 23 7.083 -14.180 9.177 1.00 0.00 C ATOM 298 CG PRO A 23 6.446 -15.452 8.569 1.00 0.00 C ATOM 299 CD PRO A 23 7.079 -15.679 7.188 1.00 0.00 C ATOM 0 HA PRO A 23 7.841 -12.594 7.875 1.00 0.00 H new ATOM 0 HB2 PRO A 23 7.589 -14.416 10.113 1.00 0.00 H new ATOM 0 HB3 PRO A 23 6.316 -13.441 9.407 1.00 0.00 H new ATOM 0 HG2 PRO A 23 6.620 -16.313 9.215 1.00 0.00 H new ATOM 0 HG3 PRO A 23 5.366 -15.333 8.480 1.00 0.00 H new ATOM 0 HD2 PRO A 23 7.609 -16.630 7.148 1.00 0.00 H new ATOM 0 HD3 PRO A 23 6.321 -15.704 6.405 1.00 0.00 H new ATOM 307 N GLY A 24 10.170 -12.497 8.658 1.00 0.00 N ATOM 308 CA GLY A 24 11.554 -12.424 9.204 1.00 0.00 C ATOM 309 C GLY A 24 12.027 -10.970 9.208 1.00 0.00 C ATOM 310 O GLY A 24 12.929 -10.602 9.935 1.00 0.00 O ATOM 0 H GLY A 24 9.821 -11.633 8.244 1.00 0.00 H new ATOM 0 HA2 GLY A 24 11.578 -12.828 10.216 1.00 0.00 H new ATOM 0 HA3 GLY A 24 12.226 -13.034 8.601 1.00 0.00 H new ATOM 314 N HIS A 25 11.426 -10.139 8.402 1.00 0.00 N ATOM 315 CA HIS A 25 11.840 -8.709 8.360 1.00 0.00 C ATOM 316 C HIS A 25 10.713 -7.868 7.757 1.00 0.00 C ATOM 317 O HIS A 25 10.633 -7.692 6.557 1.00 0.00 O ATOM 318 CB HIS A 25 13.100 -8.567 7.502 1.00 0.00 C ATOM 319 CG HIS A 25 13.172 -9.707 6.524 1.00 0.00 C ATOM 320 ND1 HIS A 25 12.203 -10.368 5.812 1.00 0.00 N flip ATOM 321 CD2 HIS A 25 14.374 -10.304 6.174 1.00 0.00 C flip ATOM 322 CE1 HIS A 25 12.790 -11.360 5.032 1.00 0.00 C flip ATOM 323 NE2 HIS A 25 14.098 -11.278 5.287 1.00 0.00 N flip ATOM 0 H HIS A 25 10.665 -10.389 7.770 1.00 0.00 H new ATOM 0 HA HIS A 25 12.049 -8.362 9.372 1.00 0.00 H new ATOM 0 HB2 HIS A 25 13.084 -7.617 6.968 1.00 0.00 H new ATOM 0 HB3 HIS A 25 13.986 -8.562 8.137 1.00 0.00 H new ATOM 0 HD2 HIS A 25 15.352 -10.036 6.545 1.00 0.00 H new ATOM 0 HE1 HIS A 25 12.294 -12.048 4.364 1.00 0.00 H new ATOM 0 HE2 HIS A 25 14.803 -11.880 4.861 1.00 0.00 H new ATOM 331 N PHE A 26 9.842 -7.351 8.579 1.00 0.00 N ATOM 332 CA PHE A 26 8.718 -6.522 8.058 1.00 0.00 C ATOM 333 C PHE A 26 8.422 -5.388 9.040 1.00 0.00 C ATOM 334 O PHE A 26 7.360 -4.800 9.022 1.00 0.00 O ATOM 335 CB PHE A 26 7.472 -7.397 7.905 1.00 0.00 C ATOM 336 CG PHE A 26 7.582 -8.221 6.645 1.00 0.00 C ATOM 337 CD1 PHE A 26 8.338 -9.400 6.643 1.00 0.00 C ATOM 338 CD2 PHE A 26 6.928 -7.807 5.479 1.00 0.00 C ATOM 339 CE1 PHE A 26 8.438 -10.165 5.475 1.00 0.00 C ATOM 340 CE2 PHE A 26 7.028 -8.572 4.310 1.00 0.00 C ATOM 341 CZ PHE A 26 7.784 -9.751 4.308 1.00 0.00 C ATOM 0 H PHE A 26 9.860 -7.467 9.592 1.00 0.00 H new ATOM 0 HA PHE A 26 8.993 -6.103 7.090 1.00 0.00 H new ATOM 0 HB2 PHE A 26 7.366 -8.051 8.771 1.00 0.00 H new ATOM 0 HB3 PHE A 26 6.580 -6.772 7.866 1.00 0.00 H new ATOM 0 HD1 PHE A 26 8.844 -9.719 7.542 1.00 0.00 H new ATOM 0 HD2 PHE A 26 6.346 -6.897 5.481 1.00 0.00 H new ATOM 0 HE1 PHE A 26 9.020 -11.075 5.474 1.00 0.00 H new ATOM 0 HE2 PHE A 26 6.522 -8.253 3.411 1.00 0.00 H new ATOM 0 HZ PHE A 26 7.863 -10.341 3.407 1.00 0.00 H new ATOM 351 N LYS A 27 9.355 -5.078 9.901 1.00 0.00 N ATOM 352 CA LYS A 27 9.126 -3.985 10.889 1.00 0.00 C ATOM 353 C LYS A 27 9.697 -2.672 10.347 1.00 0.00 C ATOM 354 O LYS A 27 9.969 -1.755 11.096 1.00 0.00 O ATOM 355 CB LYS A 27 9.822 -4.338 12.207 1.00 0.00 C ATOM 356 CG LYS A 27 11.339 -4.326 12.007 1.00 0.00 C ATOM 357 CD LYS A 27 12.017 -4.985 13.210 1.00 0.00 C ATOM 358 CE LYS A 27 12.527 -6.372 12.815 1.00 0.00 C ATOM 359 NZ LYS A 27 13.706 -6.231 11.915 1.00 0.00 N ATOM 0 H LYS A 27 10.265 -5.535 9.962 1.00 0.00 H new ATOM 0 HA LYS A 27 8.056 -3.869 11.059 1.00 0.00 H new ATOM 0 HB2 LYS A 27 9.542 -3.623 12.981 1.00 0.00 H new ATOM 0 HB3 LYS A 27 9.498 -5.321 12.549 1.00 0.00 H new ATOM 0 HG2 LYS A 27 11.600 -4.858 11.092 1.00 0.00 H new ATOM 0 HG3 LYS A 27 11.693 -3.302 11.892 1.00 0.00 H new ATOM 0 HD2 LYS A 27 12.845 -4.367 13.557 1.00 0.00 H new ATOM 0 HD3 LYS A 27 11.312 -5.068 14.037 1.00 0.00 H new ATOM 0 HE2 LYS A 27 12.802 -6.937 13.706 1.00 0.00 H new ATOM 0 HE3 LYS A 27 11.738 -6.932 12.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 14.288 -7.091 11.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 13.381 -6.093 10.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 14.272 -5.410 12.211 1.00 0.00 H new ATOM 373 N ASP A 28 9.875 -2.579 9.052 1.00 0.00 N ATOM 374 CA ASP A 28 10.427 -1.326 8.450 1.00 0.00 C ATOM 375 C ASP A 28 9.346 -0.684 7.555 1.00 0.00 C ATOM 376 O ASP A 28 8.542 -1.396 6.988 1.00 0.00 O ATOM 377 CB ASP A 28 11.646 -1.684 7.593 1.00 0.00 C ATOM 378 CG ASP A 28 12.471 -2.759 8.303 1.00 0.00 C ATOM 379 OD1 ASP A 28 11.920 -3.811 8.584 1.00 0.00 O ATOM 380 OD2 ASP A 28 13.639 -2.513 8.554 1.00 0.00 O ATOM 0 H ASP A 28 9.661 -3.320 8.384 1.00 0.00 H new ATOM 0 HA ASP A 28 10.719 -0.628 9.235 1.00 0.00 H new ATOM 0 HB2 ASP A 28 11.324 -2.044 6.616 1.00 0.00 H new ATOM 0 HB3 ASP A 28 12.256 -0.797 7.421 1.00 0.00 H new ATOM 385 N PRO A 29 9.340 0.634 7.433 1.00 0.00 N ATOM 386 CA PRO A 29 8.341 1.318 6.589 1.00 0.00 C ATOM 387 C PRO A 29 8.457 0.846 5.136 1.00 0.00 C ATOM 388 O PRO A 29 9.510 0.429 4.694 1.00 0.00 O ATOM 389 CB PRO A 29 8.685 2.810 6.690 1.00 0.00 C ATOM 390 CG PRO A 29 9.955 2.941 7.564 1.00 0.00 C ATOM 391 CD PRO A 29 10.297 1.544 8.103 1.00 0.00 C ATOM 0 HA PRO A 29 7.322 1.108 6.913 1.00 0.00 H new ATOM 0 HB2 PRO A 29 8.857 3.231 5.699 1.00 0.00 H new ATOM 0 HB3 PRO A 29 7.857 3.364 7.132 1.00 0.00 H new ATOM 0 HG2 PRO A 29 10.784 3.338 6.978 1.00 0.00 H new ATOM 0 HG3 PRO A 29 9.784 3.637 8.386 1.00 0.00 H new ATOM 0 HD2 PRO A 29 11.327 1.273 7.873 1.00 0.00 H new ATOM 0 HD3 PRO A 29 10.190 1.501 9.187 1.00 0.00 H new ATOM 399 N LYS A 30 7.383 0.917 4.394 1.00 0.00 N ATOM 400 CA LYS A 30 7.418 0.483 2.967 1.00 0.00 C ATOM 401 C LYS A 30 6.646 1.495 2.116 1.00 0.00 C ATOM 402 O LYS A 30 5.493 1.780 2.369 1.00 0.00 O ATOM 403 CB LYS A 30 6.767 -0.895 2.830 1.00 0.00 C ATOM 404 CG LYS A 30 7.453 -1.884 3.775 1.00 0.00 C ATOM 405 CD LYS A 30 7.496 -3.269 3.125 1.00 0.00 C ATOM 406 CE LYS A 30 7.656 -4.337 4.208 1.00 0.00 C ATOM 407 NZ LYS A 30 7.793 -5.675 3.569 1.00 0.00 N ATOM 0 H LYS A 30 6.478 1.259 4.718 1.00 0.00 H new ATOM 0 HA LYS A 30 8.453 0.427 2.629 1.00 0.00 H new ATOM 0 HB2 LYS A 30 5.704 -0.831 3.064 1.00 0.00 H new ATOM 0 HB3 LYS A 30 6.847 -1.245 1.801 1.00 0.00 H new ATOM 0 HG2 LYS A 30 8.464 -1.545 4.001 1.00 0.00 H new ATOM 0 HG3 LYS A 30 6.914 -1.932 4.721 1.00 0.00 H new ATOM 0 HD2 LYS A 30 6.582 -3.445 2.558 1.00 0.00 H new ATOM 0 HD3 LYS A 30 8.324 -3.325 2.419 1.00 0.00 H new ATOM 0 HE2 LYS A 30 8.533 -4.122 4.819 1.00 0.00 H new ATOM 0 HE3 LYS A 30 6.793 -4.327 4.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 7.374 -6.399 4.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 7.300 -5.674 2.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 8.800 -5.887 3.420 1.00 0.00 H new ATOM 421 N ARG A 31 7.274 2.042 1.112 1.00 0.00 N ATOM 422 CA ARG A 31 6.575 3.037 0.251 1.00 0.00 C ATOM 423 C ARG A 31 5.785 2.309 -0.839 1.00 0.00 C ATOM 424 O ARG A 31 6.342 1.604 -1.656 1.00 0.00 O ATOM 425 CB ARG A 31 7.609 3.959 -0.400 1.00 0.00 C ATOM 426 CG ARG A 31 8.651 4.373 0.644 1.00 0.00 C ATOM 427 CD ARG A 31 9.125 5.802 0.368 1.00 0.00 C ATOM 428 NE ARG A 31 9.167 6.052 -1.110 1.00 0.00 N ATOM 429 CZ ARG A 31 9.816 5.256 -1.917 1.00 0.00 C ATOM 430 NH1 ARG A 31 10.599 4.327 -1.441 1.00 0.00 N ATOM 431 NH2 ARG A 31 9.724 5.426 -3.207 1.00 0.00 N ATOM 0 H ARG A 31 8.240 1.843 0.851 1.00 0.00 H new ATOM 0 HA ARG A 31 5.890 3.627 0.861 1.00 0.00 H new ATOM 0 HB2 ARG A 31 8.095 3.449 -1.232 1.00 0.00 H new ATOM 0 HB3 ARG A 31 7.118 4.842 -0.810 1.00 0.00 H new ATOM 0 HG2 ARG A 31 8.222 4.310 1.644 1.00 0.00 H new ATOM 0 HG3 ARG A 31 9.498 3.688 0.617 1.00 0.00 H new ATOM 0 HD2 ARG A 31 8.454 6.515 0.847 1.00 0.00 H new ATOM 0 HD3 ARG A 31 10.114 5.956 0.799 1.00 0.00 H new ATOM 0 HE ARG A 31 8.678 6.861 -1.493 1.00 0.00 H new ATOM 0 HH11 ARG A 31 10.707 4.219 -0.433 1.00 0.00 H new ATOM 0 HH12 ARG A 31 11.103 3.709 -2.077 1.00 0.00 H new ATOM 0 HH21 ARG A 31 9.147 6.179 -3.582 1.00 0.00 H new ATOM 0 HH22 ARG A 31 10.229 4.806 -3.840 1.00 0.00 H new ATOM 445 N LEU A 32 4.489 2.476 -0.860 1.00 0.00 N ATOM 446 CA LEU A 32 3.667 1.794 -1.899 1.00 0.00 C ATOM 447 C LEU A 32 3.651 2.643 -3.171 1.00 0.00 C ATOM 448 O LEU A 32 2.929 3.615 -3.271 1.00 0.00 O ATOM 449 CB LEU A 32 2.235 1.620 -1.390 1.00 0.00 C ATOM 450 CG LEU A 32 2.260 1.146 0.064 1.00 0.00 C ATOM 451 CD1 LEU A 32 0.831 0.875 0.537 1.00 0.00 C ATOM 452 CD2 LEU A 32 3.081 -0.140 0.167 1.00 0.00 C ATOM 0 H LEU A 32 3.966 3.055 -0.203 1.00 0.00 H new ATOM 0 HA LEU A 32 4.097 0.816 -2.115 1.00 0.00 H new ATOM 0 HB2 LEU A 32 1.694 2.563 -1.466 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.704 0.897 -2.009 1.00 0.00 H new ATOM 0 HG LEU A 32 2.711 1.917 0.689 1.00 0.00 H new ATOM 0 HD11 LEU A 32 0.849 0.537 1.573 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.244 1.790 0.464 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.381 0.104 -0.088 1.00 0.00 H new ATOM 0 HD21 LEU A 32 3.099 -0.478 1.203 1.00 0.00 H new ATOM 0 HD22 LEU A 32 2.630 -0.911 -0.458 1.00 0.00 H new ATOM 0 HD23 LEU A 32 4.100 0.051 -0.170 1.00 0.00 H new ATOM 464 N TYR A 33 4.443 2.284 -4.145 1.00 0.00 N ATOM 465 CA TYR A 33 4.475 3.070 -5.411 1.00 0.00 C ATOM 466 C TYR A 33 3.524 2.440 -6.431 1.00 0.00 C ATOM 467 O TYR A 33 3.618 1.268 -6.742 1.00 0.00 O ATOM 468 CB TYR A 33 5.897 3.072 -5.974 1.00 0.00 C ATOM 469 CG TYR A 33 5.891 3.670 -7.362 1.00 0.00 C ATOM 470 CD1 TYR A 33 5.482 4.997 -7.549 1.00 0.00 C ATOM 471 CD2 TYR A 33 6.294 2.901 -8.462 1.00 0.00 C ATOM 472 CE1 TYR A 33 5.477 5.553 -8.833 1.00 0.00 C ATOM 473 CE2 TYR A 33 6.288 3.459 -9.746 1.00 0.00 C ATOM 474 CZ TYR A 33 5.879 4.785 -9.932 1.00 0.00 C ATOM 475 OH TYR A 33 5.873 5.334 -11.198 1.00 0.00 O ATOM 0 H TYR A 33 5.070 1.480 -4.118 1.00 0.00 H new ATOM 0 HA TYR A 33 4.162 4.094 -5.209 1.00 0.00 H new ATOM 0 HB2 TYR A 33 6.556 3.646 -5.323 1.00 0.00 H new ATOM 0 HB3 TYR A 33 6.288 2.055 -6.007 1.00 0.00 H new ATOM 0 HD1 TYR A 33 5.171 5.591 -6.702 1.00 0.00 H new ATOM 0 HD2 TYR A 33 6.609 1.878 -8.319 1.00 0.00 H new ATOM 0 HE1 TYR A 33 5.163 6.576 -8.976 1.00 0.00 H new ATOM 0 HE2 TYR A 33 6.599 2.866 -10.594 1.00 0.00 H new ATOM 0 HH TYR A 33 6.182 4.666 -11.846 1.00 0.00 H new ATOM 485 N CYS A 34 2.608 3.208 -6.955 1.00 0.00 N ATOM 486 CA CYS A 34 1.654 2.656 -7.957 1.00 0.00 C ATOM 487 C CYS A 34 2.240 2.833 -9.359 1.00 0.00 C ATOM 488 O CYS A 34 2.564 3.929 -9.773 1.00 0.00 O ATOM 489 CB CYS A 34 0.321 3.403 -7.862 1.00 0.00 C ATOM 490 SG CYS A 34 -0.941 2.506 -8.799 1.00 0.00 S ATOM 0 H CYS A 34 2.479 4.195 -6.732 1.00 0.00 H new ATOM 0 HA CYS A 34 1.488 1.597 -7.759 1.00 0.00 H new ATOM 0 HB2 CYS A 34 0.017 3.496 -6.819 1.00 0.00 H new ATOM 0 HB3 CYS A 34 0.430 4.414 -8.254 1.00 0.00 H new ATOM 0 HG CYS A 34 -2.074 3.138 -8.717 1.00 0.00 H new ATOM 496 N LYS A 35 2.383 1.761 -10.091 1.00 0.00 N ATOM 497 CA LYS A 35 2.956 1.863 -11.464 1.00 0.00 C ATOM 498 C LYS A 35 1.937 2.510 -12.406 1.00 0.00 C ATOM 499 O LYS A 35 2.266 2.920 -13.501 1.00 0.00 O ATOM 500 CB LYS A 35 3.300 0.461 -11.973 1.00 0.00 C ATOM 501 CG LYS A 35 3.912 0.556 -13.373 1.00 0.00 C ATOM 502 CD LYS A 35 2.883 0.108 -14.413 1.00 0.00 C ATOM 503 CE LYS A 35 3.481 0.242 -15.814 1.00 0.00 C ATOM 504 NZ LYS A 35 3.688 1.683 -16.131 1.00 0.00 N ATOM 0 H LYS A 35 2.128 0.818 -9.797 1.00 0.00 H new ATOM 0 HA LYS A 35 3.857 2.476 -11.434 1.00 0.00 H new ATOM 0 HB2 LYS A 35 4.000 -0.022 -11.292 1.00 0.00 H new ATOM 0 HB3 LYS A 35 2.403 -0.157 -11.999 1.00 0.00 H new ATOM 0 HG2 LYS A 35 4.226 1.580 -13.575 1.00 0.00 H new ATOM 0 HG3 LYS A 35 4.803 -0.069 -13.435 1.00 0.00 H new ATOM 0 HD2 LYS A 35 2.590 -0.926 -14.228 1.00 0.00 H new ATOM 0 HD3 LYS A 35 1.981 0.714 -14.332 1.00 0.00 H new ATOM 0 HE2 LYS A 35 4.429 -0.293 -15.869 1.00 0.00 H new ATOM 0 HE3 LYS A 35 2.816 -0.211 -16.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 3.246 1.904 -17.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 3.256 2.268 -15.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 4.707 1.884 -16.181 1.00 0.00 H new ATOM 518 N ASN A 36 0.704 2.605 -11.992 1.00 0.00 N ATOM 519 CA ASN A 36 -0.328 3.224 -12.871 1.00 0.00 C ATOM 520 C ASN A 36 -0.400 4.728 -12.600 1.00 0.00 C ATOM 521 O ASN A 36 -0.933 5.163 -11.598 1.00 0.00 O ATOM 522 CB ASN A 36 -1.690 2.590 -12.585 1.00 0.00 C ATOM 523 CG ASN A 36 -1.781 1.235 -13.289 1.00 0.00 C ATOM 524 OD1 ASN A 36 -0.751 0.432 -13.269 1.00 0.00 O flip ATOM 525 ND2 ASN A 36 -2.798 0.903 -13.865 1.00 0.00 N flip ATOM 0 H ASN A 36 0.367 2.282 -11.085 1.00 0.00 H new ATOM 0 HA ASN A 36 -0.060 3.057 -13.914 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -1.826 2.463 -11.511 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -2.488 3.246 -12.932 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -3.603 1.530 -13.881 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -2.847 -0.002 -14.332 1.00 0.00 H new ATOM 532 N GLY A 37 0.130 5.525 -13.486 1.00 0.00 N ATOM 533 CA GLY A 37 0.089 7.001 -13.279 1.00 0.00 C ATOM 534 C GLY A 37 1.177 7.412 -12.286 1.00 0.00 C ATOM 535 O GLY A 37 1.267 8.556 -11.887 1.00 0.00 O ATOM 0 H GLY A 37 0.589 5.219 -14.344 1.00 0.00 H new ATOM 0 HA2 GLY A 37 0.237 7.515 -14.229 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -0.890 7.298 -12.904 1.00 0.00 H new ATOM 539 N GLY A 38 2.008 6.489 -11.885 1.00 0.00 N ATOM 540 CA GLY A 38 3.089 6.832 -10.919 1.00 0.00 C ATOM 541 C GLY A 38 2.499 7.619 -9.749 1.00 0.00 C ATOM 542 O GLY A 38 2.496 8.835 -9.748 1.00 0.00 O ATOM 0 H GLY A 38 1.985 5.514 -12.184 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.567 5.923 -10.555 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.860 7.421 -11.415 1.00 0.00 H new ATOM 546 N PHE A 39 1.998 6.937 -8.753 1.00 0.00 N ATOM 547 CA PHE A 39 1.405 7.647 -7.582 1.00 0.00 C ATOM 548 C PHE A 39 1.728 6.878 -6.299 1.00 0.00 C ATOM 549 O PHE A 39 1.625 5.669 -6.247 1.00 0.00 O ATOM 550 CB PHE A 39 -0.111 7.736 -7.753 1.00 0.00 C ATOM 551 CG PHE A 39 -0.448 8.860 -8.702 1.00 0.00 C ATOM 552 CD1 PHE A 39 -0.509 10.178 -8.234 1.00 0.00 C ATOM 553 CD2 PHE A 39 -0.700 8.584 -10.051 1.00 0.00 C ATOM 554 CE1 PHE A 39 -0.823 11.220 -9.114 1.00 0.00 C ATOM 555 CE2 PHE A 39 -1.014 9.626 -10.931 1.00 0.00 C ATOM 556 CZ PHE A 39 -1.075 10.944 -10.464 1.00 0.00 C ATOM 0 H PHE A 39 1.974 5.919 -8.700 1.00 0.00 H new ATOM 0 HA PHE A 39 1.824 8.651 -7.518 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -0.500 6.793 -8.137 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.587 7.907 -6.787 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -0.314 10.391 -7.193 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -0.652 7.567 -10.413 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -0.871 12.237 -8.752 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -1.209 9.413 -11.972 1.00 0.00 H new ATOM 0 HZ PHE A 39 -1.316 11.748 -11.144 1.00 0.00 H new ATOM 566 N PHE A 40 2.115 7.574 -5.262 1.00 0.00 N ATOM 567 CA PHE A 40 2.444 6.891 -3.977 1.00 0.00 C ATOM 568 C PHE A 40 1.241 6.970 -3.034 1.00 0.00 C ATOM 569 O PHE A 40 0.762 8.040 -2.715 1.00 0.00 O ATOM 570 CB PHE A 40 3.645 7.581 -3.328 1.00 0.00 C ATOM 571 CG PHE A 40 4.855 7.427 -4.218 1.00 0.00 C ATOM 572 CD1 PHE A 40 5.008 8.249 -5.341 1.00 0.00 C ATOM 573 CD2 PHE A 40 5.825 6.463 -3.919 1.00 0.00 C ATOM 574 CE1 PHE A 40 6.131 8.107 -6.165 1.00 0.00 C ATOM 575 CE2 PHE A 40 6.948 6.321 -4.743 1.00 0.00 C ATOM 576 CZ PHE A 40 7.101 7.143 -5.866 1.00 0.00 C ATOM 0 H PHE A 40 2.217 8.589 -5.250 1.00 0.00 H new ATOM 0 HA PHE A 40 2.685 5.846 -4.172 1.00 0.00 H new ATOM 0 HB2 PHE A 40 3.429 8.638 -3.169 1.00 0.00 H new ATOM 0 HB3 PHE A 40 3.843 7.145 -2.349 1.00 0.00 H new ATOM 0 HD1 PHE A 40 4.260 8.993 -5.572 1.00 0.00 H new ATOM 0 HD2 PHE A 40 5.707 5.829 -3.053 1.00 0.00 H new ATOM 0 HE1 PHE A 40 6.249 8.741 -7.031 1.00 0.00 H new ATOM 0 HE2 PHE A 40 7.696 5.577 -4.512 1.00 0.00 H new ATOM 0 HZ PHE A 40 7.967 7.033 -6.502 1.00 0.00 H new ATOM 586 N LEU A 41 0.750 5.847 -2.586 1.00 0.00 N ATOM 587 CA LEU A 41 -0.419 5.862 -1.662 1.00 0.00 C ATOM 588 C LEU A 41 -0.093 6.742 -0.453 1.00 0.00 C ATOM 589 O LEU A 41 1.034 6.800 -0.002 1.00 0.00 O ATOM 590 CB LEU A 41 -0.715 4.432 -1.193 1.00 0.00 C ATOM 591 CG LEU A 41 -2.050 4.387 -0.433 1.00 0.00 C ATOM 592 CD1 LEU A 41 -3.231 4.344 -1.413 1.00 0.00 C ATOM 593 CD2 LEU A 41 -2.083 3.137 0.448 1.00 0.00 C ATOM 0 H LEU A 41 1.107 4.921 -2.820 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.292 6.261 -2.178 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.754 3.761 -2.051 1.00 0.00 H new ATOM 0 HB3 LEU A 41 0.090 4.079 -0.549 1.00 0.00 H new ATOM 0 HG LEU A 41 -2.136 5.285 0.180 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -4.166 4.312 -0.854 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -3.214 5.234 -2.042 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -3.152 3.455 -2.039 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -3.028 3.099 0.990 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -1.987 2.249 -0.177 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -1.258 3.171 1.159 1.00 0.00 H new ATOM 605 N ARG A 42 -1.067 7.431 0.076 1.00 0.00 N ATOM 606 CA ARG A 42 -0.804 8.306 1.253 1.00 0.00 C ATOM 607 C ARG A 42 -2.064 8.413 2.112 1.00 0.00 C ATOM 608 O ARG A 42 -3.134 8.723 1.626 1.00 0.00 O ATOM 609 CB ARG A 42 -0.402 9.702 0.770 1.00 0.00 C ATOM 610 CG ARG A 42 0.150 10.508 1.948 1.00 0.00 C ATOM 611 CD ARG A 42 0.533 11.914 1.478 1.00 0.00 C ATOM 612 NE ARG A 42 0.296 12.888 2.581 1.00 0.00 N ATOM 613 CZ ARG A 42 0.827 14.078 2.526 1.00 0.00 C ATOM 614 NH1 ARG A 42 1.568 14.415 1.506 1.00 0.00 N ATOM 615 NH2 ARG A 42 0.618 14.930 3.491 1.00 0.00 N ATOM 0 H ARG A 42 -2.032 7.426 -0.255 1.00 0.00 H new ATOM 0 HA ARG A 42 0.002 7.875 1.847 1.00 0.00 H new ATOM 0 HB2 ARG A 42 0.349 9.625 -0.016 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -1.263 10.212 0.338 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -0.596 10.570 2.740 1.00 0.00 H new ATOM 0 HG3 ARG A 42 1.021 10.005 2.369 1.00 0.00 H new ATOM 0 HD2 ARG A 42 1.581 11.936 1.178 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -0.055 12.189 0.603 1.00 0.00 H new ATOM 0 HE ARG A 42 -0.282 12.624 3.379 1.00 0.00 H new ATOM 0 HH11 ARG A 42 1.732 13.748 0.752 1.00 0.00 H new ATOM 0 HH12 ARG A 42 1.983 15.346 1.463 1.00 0.00 H new ATOM 0 HH21 ARG A 42 0.039 14.666 4.288 1.00 0.00 H new ATOM 0 HH22 ARG A 42 1.033 15.861 3.448 1.00 0.00 H new ATOM 629 N ILE A 43 -1.944 8.166 3.389 1.00 0.00 N ATOM 630 CA ILE A 43 -3.132 8.261 4.285 1.00 0.00 C ATOM 631 C ILE A 43 -3.166 9.649 4.927 1.00 0.00 C ATOM 632 O ILE A 43 -2.177 10.125 5.448 1.00 0.00 O ATOM 633 CB ILE A 43 -3.034 7.196 5.378 1.00 0.00 C ATOM 634 CG1 ILE A 43 -3.086 5.805 4.740 1.00 0.00 C ATOM 635 CG2 ILE A 43 -4.204 7.353 6.351 1.00 0.00 C ATOM 636 CD1 ILE A 43 -2.560 4.769 5.734 1.00 0.00 C ATOM 0 H ILE A 43 -1.073 7.902 3.850 1.00 0.00 H new ATOM 0 HA ILE A 43 -4.042 8.101 3.706 1.00 0.00 H new ATOM 0 HB ILE A 43 -2.094 7.315 5.917 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -4.109 5.563 4.453 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -2.487 5.788 3.829 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -4.134 6.594 7.130 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -4.169 8.343 6.805 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.144 7.234 5.812 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -2.597 3.778 5.281 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -1.530 5.009 5.999 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -3.178 4.780 6.632 1.00 0.00 H new ATOM 648 N HIS A 44 -4.293 10.306 4.894 1.00 0.00 N ATOM 649 CA HIS A 44 -4.378 11.663 5.500 1.00 0.00 C ATOM 650 C HIS A 44 -4.802 11.533 6.977 1.00 0.00 C ATOM 651 O HIS A 44 -5.480 10.586 7.322 1.00 0.00 O ATOM 652 CB HIS A 44 -5.422 12.483 4.736 1.00 0.00 C ATOM 653 CG HIS A 44 -4.809 13.017 3.470 1.00 0.00 C ATOM 654 ND1 HIS A 44 -3.705 13.853 3.479 1.00 0.00 N ATOM 655 CD2 HIS A 44 -5.135 12.839 2.148 1.00 0.00 C ATOM 656 CE1 HIS A 44 -3.407 14.145 2.200 1.00 0.00 C ATOM 657 NE2 HIS A 44 -4.248 13.553 1.348 1.00 0.00 N ATOM 0 H HIS A 44 -5.157 9.962 4.474 1.00 0.00 H new ATOM 0 HA HIS A 44 -3.409 12.159 5.444 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -6.287 11.863 4.501 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -5.779 13.306 5.356 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -5.955 12.237 1.785 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -2.587 14.781 1.899 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -4.242 13.612 0.330 1.00 0.00 H new ATOM 665 N PRO A 45 -4.409 12.476 7.817 1.00 0.00 N ATOM 666 CA PRO A 45 -4.780 12.431 9.245 1.00 0.00 C ATOM 667 C PRO A 45 -6.303 12.392 9.399 1.00 0.00 C ATOM 668 O PRO A 45 -6.825 11.880 10.369 1.00 0.00 O ATOM 669 CB PRO A 45 -4.214 13.725 9.845 1.00 0.00 C ATOM 670 CG PRO A 45 -3.521 14.510 8.704 1.00 0.00 C ATOM 671 CD PRO A 45 -3.585 13.644 7.436 1.00 0.00 C ATOM 0 HA PRO A 45 -4.388 11.544 9.743 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -5.011 14.321 10.290 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -3.503 13.499 10.640 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -4.019 15.466 8.540 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -2.486 14.730 8.965 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -4.033 14.190 6.606 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -2.589 13.338 7.115 1.00 0.00 H new ATOM 679 N ASP A 46 -7.018 12.932 8.450 1.00 0.00 N ATOM 680 CA ASP A 46 -8.506 12.928 8.546 1.00 0.00 C ATOM 681 C ASP A 46 -9.034 11.525 8.243 1.00 0.00 C ATOM 682 O ASP A 46 -10.221 11.318 8.087 1.00 0.00 O ATOM 683 CB ASP A 46 -9.084 13.920 7.535 1.00 0.00 C ATOM 684 CG ASP A 46 -8.423 13.704 6.173 1.00 0.00 C ATOM 685 OD1 ASP A 46 -7.988 12.592 5.918 1.00 0.00 O ATOM 686 OD2 ASP A 46 -8.362 14.652 5.408 1.00 0.00 O ATOM 0 H ASP A 46 -6.637 13.375 7.614 1.00 0.00 H new ATOM 0 HA ASP A 46 -8.806 13.218 9.553 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -10.163 13.785 7.453 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -8.915 14.942 7.875 1.00 0.00 H new ATOM 691 N GLY A 47 -8.163 10.558 8.158 1.00 0.00 N ATOM 692 CA GLY A 47 -8.618 9.169 7.865 1.00 0.00 C ATOM 693 C GLY A 47 -8.754 8.984 6.354 1.00 0.00 C ATOM 694 O GLY A 47 -8.512 7.916 5.826 1.00 0.00 O ATOM 0 H GLY A 47 -7.156 10.669 8.279 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -7.905 8.449 8.267 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -9.574 8.978 8.353 1.00 0.00 H new ATOM 698 N ARG A 48 -9.138 10.014 5.651 1.00 0.00 N ATOM 699 CA ARG A 48 -9.288 9.895 4.174 1.00 0.00 C ATOM 700 C ARG A 48 -8.050 9.213 3.591 1.00 0.00 C ATOM 701 O ARG A 48 -7.040 9.071 4.252 1.00 0.00 O ATOM 702 CB ARG A 48 -9.438 11.290 3.562 1.00 0.00 C ATOM 703 CG ARG A 48 -10.634 12.001 4.197 1.00 0.00 C ATOM 704 CD ARG A 48 -10.966 13.261 3.394 1.00 0.00 C ATOM 705 NE ARG A 48 -11.872 12.907 2.266 1.00 0.00 N ATOM 706 CZ ARG A 48 -12.522 13.844 1.631 1.00 0.00 C ATOM 707 NH1 ARG A 48 -12.377 15.092 1.985 1.00 0.00 N ATOM 708 NH2 ARG A 48 -13.315 13.534 0.643 1.00 0.00 N ATOM 0 H ARG A 48 -9.354 10.933 6.036 1.00 0.00 H new ATOM 0 HA ARG A 48 -10.173 9.301 3.945 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.529 11.869 3.724 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -9.578 11.212 2.484 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -11.496 11.334 4.220 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -10.407 12.265 5.230 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -11.442 14.001 4.038 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -10.051 13.713 3.011 1.00 0.00 H new ATOM 0 HE ARG A 48 -11.985 11.932 1.990 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -11.756 15.334 2.757 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -12.884 15.825 1.489 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -13.428 12.559 0.366 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -13.823 14.267 0.147 1.00 0.00 H new ATOM 722 N VAL A 49 -8.122 8.786 2.358 1.00 0.00 N ATOM 723 CA VAL A 49 -6.952 8.108 1.729 1.00 0.00 C ATOM 724 C VAL A 49 -6.839 8.545 0.266 1.00 0.00 C ATOM 725 O VAL A 49 -7.813 8.576 -0.459 1.00 0.00 O ATOM 726 CB VAL A 49 -7.151 6.595 1.795 1.00 0.00 C ATOM 727 CG1 VAL A 49 -6.083 5.900 0.948 1.00 0.00 C ATOM 728 CG2 VAL A 49 -7.032 6.131 3.247 1.00 0.00 C ATOM 0 H VAL A 49 -8.942 8.878 1.759 1.00 0.00 H new ATOM 0 HA VAL A 49 -6.040 8.380 2.261 1.00 0.00 H new ATOM 0 HB VAL A 49 -8.139 6.341 1.410 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -6.226 4.821 0.996 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -6.167 6.232 -0.087 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -5.094 6.152 1.331 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -7.174 5.051 3.297 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -6.044 6.385 3.630 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -7.794 6.625 3.850 1.00 0.00 H new ATOM 738 N ASP A 50 -5.658 8.883 -0.173 1.00 0.00 N ATOM 739 CA ASP A 50 -5.486 9.316 -1.588 1.00 0.00 C ATOM 740 C ASP A 50 -4.019 9.161 -1.995 1.00 0.00 C ATOM 741 O ASP A 50 -3.131 9.164 -1.166 1.00 0.00 O ATOM 742 CB ASP A 50 -5.899 10.782 -1.726 1.00 0.00 C ATOM 743 CG ASP A 50 -5.101 11.634 -0.737 1.00 0.00 C ATOM 744 OD1 ASP A 50 -4.497 11.060 0.154 1.00 0.00 O ATOM 745 OD2 ASP A 50 -5.108 12.844 -0.888 1.00 0.00 O ATOM 0 H ASP A 50 -4.805 8.878 0.387 1.00 0.00 H new ATOM 0 HA ASP A 50 -6.110 8.699 -2.234 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -5.721 11.126 -2.745 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -6.967 10.889 -1.535 1.00 0.00 H new ATOM 750 N GLY A 51 -3.758 9.023 -3.267 1.00 0.00 N ATOM 751 CA GLY A 51 -2.350 8.868 -3.727 1.00 0.00 C ATOM 752 C GLY A 51 -1.778 10.238 -4.096 1.00 0.00 C ATOM 753 O GLY A 51 -2.499 11.137 -4.482 1.00 0.00 O ATOM 0 H GLY A 51 -4.460 9.011 -4.007 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -1.748 8.411 -2.942 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -2.309 8.201 -4.588 1.00 0.00 H new ATOM 757 N VAL A 52 -0.489 10.404 -3.982 1.00 0.00 N ATOM 758 CA VAL A 52 0.130 11.714 -4.326 1.00 0.00 C ATOM 759 C VAL A 52 1.515 11.479 -4.932 1.00 0.00 C ATOM 760 O VAL A 52 2.194 10.528 -4.600 1.00 0.00 O ATOM 761 CB VAL A 52 0.266 12.564 -3.062 1.00 0.00 C ATOM 762 CG1 VAL A 52 -1.012 12.448 -2.228 1.00 0.00 C ATOM 763 CG2 VAL A 52 1.458 12.068 -2.240 1.00 0.00 C ATOM 0 H VAL A 52 0.163 9.687 -3.665 1.00 0.00 H new ATOM 0 HA VAL A 52 -0.501 12.234 -5.047 1.00 0.00 H new ATOM 0 HB VAL A 52 0.424 13.606 -3.341 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -0.915 13.054 -1.327 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -1.861 12.801 -2.813 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -1.171 11.406 -1.949 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.556 12.673 -1.339 1.00 0.00 H new ATOM 0 HG22 VAL A 52 1.300 11.026 -1.962 1.00 0.00 H new ATOM 0 HG23 VAL A 52 2.369 12.151 -2.833 1.00 0.00 H new ATOM 773 N ARG A 53 1.941 12.338 -5.817 1.00 0.00 N ATOM 774 CA ARG A 53 3.283 12.162 -6.439 1.00 0.00 C ATOM 775 C ARG A 53 4.355 12.724 -5.504 1.00 0.00 C ATOM 776 O ARG A 53 5.536 12.532 -5.712 1.00 0.00 O ATOM 777 CB ARG A 53 3.329 12.905 -7.776 1.00 0.00 C ATOM 778 CG ARG A 53 2.230 12.366 -8.698 1.00 0.00 C ATOM 779 CD ARG A 53 2.719 12.365 -10.150 1.00 0.00 C ATOM 780 NE ARG A 53 3.623 13.536 -10.392 1.00 0.00 N ATOM 781 CZ ARG A 53 3.260 14.752 -10.082 1.00 0.00 C ATOM 782 NH1 ARG A 53 2.029 15.007 -9.735 1.00 0.00 N ATOM 783 NH2 ARG A 53 4.121 15.729 -10.179 1.00 0.00 N ATOM 0 H ARG A 53 1.418 13.154 -6.136 1.00 0.00 H new ATOM 0 HA ARG A 53 3.469 11.101 -6.608 1.00 0.00 H new ATOM 0 HB2 ARG A 53 3.191 13.974 -7.615 1.00 0.00 H new ATOM 0 HB3 ARG A 53 4.306 12.776 -8.243 1.00 0.00 H new ATOM 0 HG2 ARG A 53 1.955 11.355 -8.397 1.00 0.00 H new ATOM 0 HG3 ARG A 53 1.334 12.980 -8.608 1.00 0.00 H new ATOM 0 HD2 ARG A 53 3.249 11.437 -10.362 1.00 0.00 H new ATOM 0 HD3 ARG A 53 1.867 12.408 -10.828 1.00 0.00 H new ATOM 0 HE ARG A 53 4.541 13.380 -10.808 1.00 0.00 H new ATOM 0 HH11 ARG A 53 1.341 14.254 -9.704 1.00 0.00 H new ATOM 0 HH12 ARG A 53 1.754 15.959 -9.494 1.00 0.00 H new ATOM 0 HH21 ARG A 53 5.072 15.541 -10.496 1.00 0.00 H new ATOM 0 HH22 ARG A 53 3.842 16.680 -9.938 1.00 0.00 H new ATOM 797 N GLU A 54 3.953 13.417 -4.474 1.00 0.00 N ATOM 798 CA GLU A 54 4.949 13.990 -3.526 1.00 0.00 C ATOM 799 C GLU A 54 5.609 12.856 -2.739 1.00 0.00 C ATOM 800 O GLU A 54 5.208 12.538 -1.637 1.00 0.00 O ATOM 801 CB GLU A 54 4.244 14.942 -2.558 1.00 0.00 C ATOM 802 CG GLU A 54 4.419 16.383 -3.040 1.00 0.00 C ATOM 803 CD GLU A 54 3.493 17.304 -2.243 1.00 0.00 C ATOM 804 OE1 GLU A 54 2.289 17.154 -2.368 1.00 0.00 O ATOM 805 OE2 GLU A 54 4.005 18.144 -1.520 1.00 0.00 O ATOM 0 H GLU A 54 2.977 13.611 -4.248 1.00 0.00 H new ATOM 0 HA GLU A 54 5.709 14.538 -4.082 1.00 0.00 H new ATOM 0 HB2 GLU A 54 3.184 14.695 -2.495 1.00 0.00 H new ATOM 0 HB3 GLU A 54 4.657 14.830 -1.556 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.456 16.696 -2.915 1.00 0.00 H new ATOM 0 HG3 GLU A 54 4.191 16.452 -4.104 1.00 0.00 H new ATOM 812 N LYS A 55 6.615 12.241 -3.297 1.00 0.00 N ATOM 813 CA LYS A 55 7.297 11.126 -2.583 1.00 0.00 C ATOM 814 C LYS A 55 8.354 11.696 -1.634 1.00 0.00 C ATOM 815 O LYS A 55 9.491 11.268 -1.630 1.00 0.00 O ATOM 816 CB LYS A 55 7.972 10.207 -3.603 1.00 0.00 C ATOM 817 CG LYS A 55 9.044 10.989 -4.366 1.00 0.00 C ATOM 818 CD LYS A 55 8.874 10.757 -5.868 1.00 0.00 C ATOM 819 CE LYS A 55 10.060 11.366 -6.616 1.00 0.00 C ATOM 820 NZ LYS A 55 11.265 10.511 -6.418 1.00 0.00 N ATOM 0 H LYS A 55 6.994 12.463 -4.217 1.00 0.00 H new ATOM 0 HA LYS A 55 6.563 10.559 -2.010 1.00 0.00 H new ATOM 0 HB2 LYS A 55 8.421 9.353 -3.097 1.00 0.00 H new ATOM 0 HB3 LYS A 55 7.231 9.812 -4.298 1.00 0.00 H new ATOM 0 HG2 LYS A 55 8.963 12.052 -4.140 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.037 10.670 -4.048 1.00 0.00 H new ATOM 0 HD2 LYS A 55 8.809 9.689 -6.077 1.00 0.00 H new ATOM 0 HD3 LYS A 55 7.943 11.207 -6.213 1.00 0.00 H new ATOM 0 HE2 LYS A 55 9.830 11.448 -7.678 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.253 12.375 -6.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 11.980 10.747 -7.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 11.658 10.679 -5.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 10.999 9.510 -6.510 1.00 0.00 H new ATOM 834 N SER A 56 7.990 12.660 -0.832 1.00 0.00 N ATOM 835 CA SER A 56 8.977 13.257 0.112 1.00 0.00 C ATOM 836 C SER A 56 8.276 13.664 1.411 1.00 0.00 C ATOM 837 O SER A 56 8.871 14.274 2.276 1.00 0.00 O ATOM 838 CB SER A 56 9.613 14.489 -0.531 1.00 0.00 C ATOM 839 OG SER A 56 9.181 14.591 -1.881 1.00 0.00 O ATOM 0 H SER A 56 7.052 13.059 -0.790 1.00 0.00 H new ATOM 0 HA SER A 56 9.749 12.521 0.337 1.00 0.00 H new ATOM 0 HB2 SER A 56 9.334 15.386 0.021 1.00 0.00 H new ATOM 0 HB3 SER A 56 10.700 14.415 -0.490 1.00 0.00 H new ATOM 0 HG SER A 56 9.005 15.530 -2.098 1.00 0.00 H new ATOM 845 N ASP A 57 7.019 13.334 1.555 1.00 0.00 N ATOM 846 CA ASP A 57 6.289 13.708 2.801 1.00 0.00 C ATOM 847 C ASP A 57 6.303 12.506 3.774 1.00 0.00 C ATOM 848 O ASP A 57 6.133 11.387 3.334 1.00 0.00 O ATOM 849 CB ASP A 57 4.840 14.050 2.449 1.00 0.00 C ATOM 850 CG ASP A 57 4.699 15.564 2.284 1.00 0.00 C ATOM 851 OD1 ASP A 57 4.981 16.273 3.235 1.00 0.00 O ATOM 852 OD2 ASP A 57 4.311 15.989 1.207 1.00 0.00 O ATOM 0 H ASP A 57 6.468 12.823 0.865 1.00 0.00 H new ATOM 0 HA ASP A 57 6.769 14.568 3.268 1.00 0.00 H new ATOM 0 HB2 ASP A 57 4.549 13.544 1.528 1.00 0.00 H new ATOM 0 HB3 ASP A 57 4.171 13.695 3.233 1.00 0.00 H new ATOM 857 N PRO A 58 6.492 12.741 5.065 1.00 0.00 N ATOM 858 CA PRO A 58 6.503 11.637 6.046 1.00 0.00 C ATOM 859 C PRO A 58 5.153 10.914 6.048 1.00 0.00 C ATOM 860 O PRO A 58 4.968 9.928 6.733 1.00 0.00 O ATOM 861 CB PRO A 58 6.742 12.312 7.403 1.00 0.00 C ATOM 862 CG PRO A 58 6.768 13.842 7.169 1.00 0.00 C ATOM 863 CD PRO A 58 6.705 14.081 5.654 1.00 0.00 C ATOM 0 HA PRO A 58 7.266 10.893 5.816 1.00 0.00 H new ATOM 0 HB2 PRO A 58 5.953 12.046 8.107 1.00 0.00 H new ATOM 0 HB3 PRO A 58 7.683 11.975 7.837 1.00 0.00 H new ATOM 0 HG2 PRO A 58 5.925 14.320 7.667 1.00 0.00 H new ATOM 0 HG3 PRO A 58 7.675 14.278 7.588 1.00 0.00 H new ATOM 0 HD2 PRO A 58 5.893 14.760 5.395 1.00 0.00 H new ATOM 0 HD3 PRO A 58 7.627 14.532 5.287 1.00 0.00 H new ATOM 871 N HIS A 59 4.205 11.401 5.295 1.00 0.00 N ATOM 872 CA HIS A 59 2.865 10.748 5.266 1.00 0.00 C ATOM 873 C HIS A 59 2.933 9.454 4.450 1.00 0.00 C ATOM 874 O HIS A 59 2.156 8.544 4.651 1.00 0.00 O ATOM 875 CB HIS A 59 1.850 11.699 4.632 1.00 0.00 C ATOM 876 CG HIS A 59 1.521 12.799 5.605 1.00 0.00 C ATOM 877 ND1 HIS A 59 2.318 13.924 5.748 1.00 0.00 N ATOM 878 CD2 HIS A 59 0.485 12.959 6.492 1.00 0.00 C ATOM 879 CE1 HIS A 59 1.755 14.704 6.689 1.00 0.00 C ATOM 880 NE2 HIS A 59 0.634 14.161 7.176 1.00 0.00 N ATOM 0 H HIS A 59 4.300 12.223 4.698 1.00 0.00 H new ATOM 0 HA HIS A 59 2.559 10.512 6.285 1.00 0.00 H new ATOM 0 HB2 HIS A 59 2.255 12.121 3.712 1.00 0.00 H new ATOM 0 HB3 HIS A 59 0.945 11.155 4.361 1.00 0.00 H new ATOM 0 HD2 HIS A 59 -0.323 12.258 6.637 1.00 0.00 H new ATOM 0 HE1 HIS A 59 2.159 15.652 7.011 1.00 0.00 H new ATOM 0 HE2 HIS A 59 0.020 14.546 7.894 1.00 0.00 H new ATOM 888 N ILE A 60 3.855 9.362 3.530 1.00 0.00 N ATOM 889 CA ILE A 60 3.959 8.121 2.711 1.00 0.00 C ATOM 890 C ILE A 60 4.684 7.042 3.517 1.00 0.00 C ATOM 891 O ILE A 60 4.854 5.927 3.065 1.00 0.00 O ATOM 892 CB ILE A 60 4.744 8.413 1.430 1.00 0.00 C ATOM 893 CG1 ILE A 60 6.229 8.564 1.770 1.00 0.00 C ATOM 894 CG2 ILE A 60 4.229 9.705 0.795 1.00 0.00 C ATOM 895 CD1 ILE A 60 6.941 9.294 0.629 1.00 0.00 C ATOM 0 H ILE A 60 4.537 10.088 3.311 1.00 0.00 H new ATOM 0 HA ILE A 60 2.959 7.774 2.450 1.00 0.00 H new ATOM 0 HB ILE A 60 4.613 7.591 0.727 1.00 0.00 H new ATOM 0 HG12 ILE A 60 6.345 9.120 2.700 1.00 0.00 H new ATOM 0 HG13 ILE A 60 6.679 7.584 1.926 1.00 0.00 H new ATOM 0 HG21 ILE A 60 4.789 9.911 -0.117 1.00 0.00 H new ATOM 0 HG22 ILE A 60 3.172 9.596 0.554 1.00 0.00 H new ATOM 0 HG23 ILE A 60 4.358 10.531 1.494 1.00 0.00 H new ATOM 0 HD11 ILE A 60 7.998 9.402 0.870 1.00 0.00 H new ATOM 0 HD12 ILE A 60 6.836 8.720 -0.292 1.00 0.00 H new ATOM 0 HD13 ILE A 60 6.497 10.280 0.495 1.00 0.00 H new ATOM 907 N LYS A 61 5.111 7.363 4.707 1.00 0.00 N ATOM 908 CA LYS A 61 5.824 6.354 5.540 1.00 0.00 C ATOM 909 C LYS A 61 4.799 5.488 6.275 1.00 0.00 C ATOM 910 O LYS A 61 4.427 5.765 7.398 1.00 0.00 O ATOM 911 CB LYS A 61 6.715 7.070 6.561 1.00 0.00 C ATOM 912 CG LYS A 61 7.923 7.698 5.854 1.00 0.00 C ATOM 913 CD LYS A 61 8.838 6.604 5.287 1.00 0.00 C ATOM 914 CE LYS A 61 10.298 6.966 5.565 1.00 0.00 C ATOM 915 NZ LYS A 61 10.510 7.083 7.035 1.00 0.00 N ATOM 0 H LYS A 61 4.997 8.280 5.139 1.00 0.00 H new ATOM 0 HA LYS A 61 6.442 5.724 4.900 1.00 0.00 H new ATOM 0 HB2 LYS A 61 6.143 7.842 7.077 1.00 0.00 H new ATOM 0 HB3 LYS A 61 7.054 6.364 7.319 1.00 0.00 H new ATOM 0 HG2 LYS A 61 7.583 8.350 5.049 1.00 0.00 H new ATOM 0 HG3 LYS A 61 8.480 8.320 6.555 1.00 0.00 H new ATOM 0 HD2 LYS A 61 8.598 5.643 5.741 1.00 0.00 H new ATOM 0 HD3 LYS A 61 8.676 6.499 4.214 1.00 0.00 H new ATOM 0 HE2 LYS A 61 10.958 6.203 5.151 1.00 0.00 H new ATOM 0 HE3 LYS A 61 10.550 7.906 5.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 11.436 6.681 7.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 10.482 8.085 7.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 9.761 6.565 7.536 1.00 0.00 H new ATOM 929 N LEU A 62 4.341 4.439 5.650 1.00 0.00 N ATOM 930 CA LEU A 62 3.343 3.552 6.311 1.00 0.00 C ATOM 931 C LEU A 62 4.074 2.441 7.067 1.00 0.00 C ATOM 932 O LEU A 62 5.007 1.846 6.564 1.00 0.00 O ATOM 933 CB LEU A 62 2.428 2.934 5.252 1.00 0.00 C ATOM 934 CG LEU A 62 2.018 4.005 4.241 1.00 0.00 C ATOM 935 CD1 LEU A 62 0.896 3.467 3.351 1.00 0.00 C ATOM 936 CD2 LEU A 62 1.525 5.247 4.986 1.00 0.00 C ATOM 0 H LEU A 62 4.615 4.157 4.709 1.00 0.00 H new ATOM 0 HA LEU A 62 2.744 4.135 7.010 1.00 0.00 H new ATOM 0 HB2 LEU A 62 2.942 2.118 4.744 1.00 0.00 H new ATOM 0 HB3 LEU A 62 1.543 2.508 5.725 1.00 0.00 H new ATOM 0 HG LEU A 62 2.877 4.267 3.623 1.00 0.00 H new ATOM 0 HD11 LEU A 62 0.605 4.231 2.631 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.246 2.582 2.819 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.037 3.204 3.968 1.00 0.00 H new ATOM 0 HD21 LEU A 62 1.233 6.011 4.266 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.667 4.984 5.604 1.00 0.00 H new ATOM 0 HD23 LEU A 62 2.324 5.632 5.619 1.00 0.00 H new ATOM 948 N GLN A 63 3.661 2.157 8.271 1.00 0.00 N ATOM 949 CA GLN A 63 4.336 1.086 9.055 1.00 0.00 C ATOM 950 C GLN A 63 3.660 -0.255 8.767 1.00 0.00 C ATOM 951 O GLN A 63 2.579 -0.532 9.249 1.00 0.00 O ATOM 952 CB GLN A 63 4.230 1.401 10.548 1.00 0.00 C ATOM 953 CG GLN A 63 4.890 0.282 11.355 1.00 0.00 C ATOM 954 CD GLN A 63 5.167 0.772 12.777 1.00 0.00 C ATOM 955 OE1 GLN A 63 5.370 1.949 12.999 1.00 0.00 O ATOM 956 NE2 GLN A 63 5.184 -0.088 13.759 1.00 0.00 N ATOM 0 H GLN A 63 2.886 2.620 8.745 1.00 0.00 H new ATOM 0 HA GLN A 63 5.387 1.033 8.770 1.00 0.00 H new ATOM 0 HB2 GLN A 63 4.714 2.354 10.765 1.00 0.00 H new ATOM 0 HB3 GLN A 63 3.183 1.502 10.835 1.00 0.00 H new ATOM 0 HG2 GLN A 63 4.241 -0.593 11.381 1.00 0.00 H new ATOM 0 HG3 GLN A 63 5.820 -0.025 10.877 1.00 0.00 H new ATOM 0 HE21 GLN A 63 5.014 -1.077 13.574 1.00 0.00 H new ATOM 0 HE22 GLN A 63 5.368 0.229 14.711 1.00 0.00 H new ATOM 965 N LEU A 64 4.286 -1.088 7.983 1.00 0.00 N ATOM 966 CA LEU A 64 3.675 -2.407 7.663 1.00 0.00 C ATOM 967 C LEU A 64 4.137 -3.449 8.683 1.00 0.00 C ATOM 968 O LEU A 64 5.186 -3.323 9.283 1.00 0.00 O ATOM 969 CB LEU A 64 4.103 -2.847 6.261 1.00 0.00 C ATOM 970 CG LEU A 64 3.243 -2.132 5.215 1.00 0.00 C ATOM 971 CD1 LEU A 64 3.460 -0.621 5.316 1.00 0.00 C ATOM 972 CD2 LEU A 64 3.642 -2.610 3.818 1.00 0.00 C ATOM 0 H LEU A 64 5.193 -0.912 7.551 1.00 0.00 H new ATOM 0 HA LEU A 64 2.589 -2.317 7.700 1.00 0.00 H new ATOM 0 HB2 LEU A 64 5.156 -2.615 6.101 1.00 0.00 H new ATOM 0 HB3 LEU A 64 3.995 -3.927 6.159 1.00 0.00 H new ATOM 0 HG LEU A 64 2.192 -2.359 5.394 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.847 -0.115 4.570 1.00 0.00 H new ATOM 0 HD12 LEU A 64 3.177 -0.279 6.311 1.00 0.00 H new ATOM 0 HD13 LEU A 64 4.511 -0.392 5.138 1.00 0.00 H new ATOM 0 HD21 LEU A 64 3.031 -2.102 3.071 1.00 0.00 H new ATOM 0 HD22 LEU A 64 4.693 -2.383 3.642 1.00 0.00 H new ATOM 0 HD23 LEU A 64 3.486 -3.686 3.743 1.00 0.00 H new ATOM 984 N GLN A 65 3.358 -4.478 8.877 1.00 0.00 N ATOM 985 CA GLN A 65 3.738 -5.542 9.850 1.00 0.00 C ATOM 986 C GLN A 65 3.366 -6.904 9.264 1.00 0.00 C ATOM 987 O GLN A 65 2.344 -7.056 8.626 1.00 0.00 O ATOM 988 CB GLN A 65 2.986 -5.324 11.164 1.00 0.00 C ATOM 989 CG GLN A 65 3.990 -5.102 12.297 1.00 0.00 C ATOM 990 CD GLN A 65 4.820 -6.370 12.501 1.00 0.00 C ATOM 991 OE1 GLN A 65 4.320 -7.366 12.985 1.00 0.00 O ATOM 992 NE2 GLN A 65 6.077 -6.376 12.150 1.00 0.00 N ATOM 0 H GLN A 65 2.469 -4.628 8.400 1.00 0.00 H new ATOM 0 HA GLN A 65 4.810 -5.504 10.042 1.00 0.00 H new ATOM 0 HB2 GLN A 65 2.323 -4.463 11.077 1.00 0.00 H new ATOM 0 HB3 GLN A 65 2.359 -6.188 11.384 1.00 0.00 H new ATOM 0 HG2 GLN A 65 4.643 -4.262 12.059 1.00 0.00 H new ATOM 0 HG3 GLN A 65 3.465 -4.847 13.217 1.00 0.00 H new ATOM 0 HE21 GLN A 65 6.497 -5.540 11.744 1.00 0.00 H new ATOM 0 HE22 GLN A 65 6.639 -7.217 12.282 1.00 0.00 H new ATOM 1001 N ALA A 66 4.189 -7.894 9.465 1.00 0.00 N ATOM 1002 CA ALA A 66 3.878 -9.239 8.906 1.00 0.00 C ATOM 1003 C ALA A 66 3.082 -10.053 9.927 1.00 0.00 C ATOM 1004 O ALA A 66 3.394 -10.076 11.101 1.00 0.00 O ATOM 1005 CB ALA A 66 5.183 -9.968 8.577 1.00 0.00 C ATOM 0 H ALA A 66 5.061 -7.831 9.990 1.00 0.00 H new ATOM 0 HA ALA A 66 3.285 -9.123 7.999 1.00 0.00 H new ATOM 0 HB1 ALA A 66 4.957 -10.953 8.168 1.00 0.00 H new ATOM 0 HB2 ALA A 66 5.747 -9.391 7.844 1.00 0.00 H new ATOM 0 HB3 ALA A 66 5.776 -10.080 9.485 1.00 0.00 H new ATOM 1011 N GLU A 67 2.056 -10.725 9.479 1.00 0.00 N ATOM 1012 CA GLU A 67 1.230 -11.551 10.404 1.00 0.00 C ATOM 1013 C GLU A 67 0.846 -12.850 9.696 1.00 0.00 C ATOM 1014 O GLU A 67 0.245 -12.837 8.640 1.00 0.00 O ATOM 1015 CB GLU A 67 -0.037 -10.782 10.786 1.00 0.00 C ATOM 1016 CG GLU A 67 -0.694 -11.447 11.997 1.00 0.00 C ATOM 1017 CD GLU A 67 0.152 -11.186 13.244 1.00 0.00 C ATOM 1018 OE1 GLU A 67 0.392 -10.028 13.543 1.00 0.00 O ATOM 1019 OE2 GLU A 67 0.546 -12.149 13.881 1.00 0.00 O ATOM 0 H GLU A 67 1.753 -10.737 8.505 1.00 0.00 H new ATOM 0 HA GLU A 67 1.798 -11.775 11.307 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.210 -9.746 11.017 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -0.732 -10.765 9.946 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.701 -11.054 12.139 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.791 -12.519 11.828 1.00 0.00 H new ATOM 1026 N GLU A 68 1.196 -13.973 10.258 1.00 0.00 N ATOM 1027 CA GLU A 68 0.857 -15.266 9.601 1.00 0.00 C ATOM 1028 C GLU A 68 1.515 -15.309 8.221 1.00 0.00 C ATOM 1029 O GLU A 68 1.948 -14.301 7.700 1.00 0.00 O ATOM 1030 CB GLU A 68 -0.662 -15.383 9.449 1.00 0.00 C ATOM 1031 CG GLU A 68 -1.145 -16.670 10.121 1.00 0.00 C ATOM 1032 CD GLU A 68 -2.642 -16.849 9.865 1.00 0.00 C ATOM 1033 OE1 GLU A 68 -3.387 -15.928 10.155 1.00 0.00 O ATOM 1034 OE2 GLU A 68 -3.018 -17.904 9.380 1.00 0.00 O ATOM 0 H GLU A 68 1.701 -14.052 11.141 1.00 0.00 H new ATOM 0 HA GLU A 68 1.220 -16.095 10.209 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -1.151 -14.519 9.900 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -0.933 -15.388 8.393 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.594 -17.525 9.731 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -0.951 -16.628 11.193 1.00 0.00 H new ATOM 1041 N ARG A 69 1.601 -16.466 7.625 1.00 0.00 N ATOM 1042 CA ARG A 69 2.238 -16.561 6.281 1.00 0.00 C ATOM 1043 C ARG A 69 1.196 -16.289 5.194 1.00 0.00 C ATOM 1044 O ARG A 69 1.255 -16.842 4.114 1.00 0.00 O ATOM 1045 CB ARG A 69 2.823 -17.963 6.088 1.00 0.00 C ATOM 1046 CG ARG A 69 1.749 -19.014 6.380 1.00 0.00 C ATOM 1047 CD ARG A 69 2.206 -19.902 7.540 1.00 0.00 C ATOM 1048 NE ARG A 69 1.211 -20.990 7.755 1.00 0.00 N ATOM 1049 CZ ARG A 69 1.529 -22.030 8.477 1.00 0.00 C ATOM 1050 NH1 ARG A 69 2.718 -22.116 9.008 1.00 0.00 N ATOM 1051 NH2 ARG A 69 0.659 -22.983 8.668 1.00 0.00 N ATOM 0 H ARG A 69 1.259 -17.347 8.009 1.00 0.00 H new ATOM 0 HA ARG A 69 3.035 -15.821 6.209 1.00 0.00 H new ATOM 0 HB2 ARG A 69 3.190 -18.077 5.068 1.00 0.00 H new ATOM 0 HB3 ARG A 69 3.676 -18.106 6.751 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.807 -18.527 6.630 1.00 0.00 H new ATOM 0 HG3 ARG A 69 1.568 -19.621 5.493 1.00 0.00 H new ATOM 0 HD2 ARG A 69 3.185 -20.328 7.322 1.00 0.00 H new ATOM 0 HD3 ARG A 69 2.312 -19.307 8.447 1.00 0.00 H new ATOM 0 HE ARG A 69 0.282 -20.922 7.338 1.00 0.00 H new ATOM 0 HH11 ARG A 69 3.398 -21.371 8.859 1.00 0.00 H new ATOM 0 HH12 ARG A 69 2.967 -22.928 9.572 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -0.270 -22.916 8.253 1.00 0.00 H new ATOM 0 HH22 ARG A 69 0.908 -23.795 9.232 1.00 0.00 H new ATOM 1065 N GLY A 70 0.242 -15.440 5.466 1.00 0.00 N ATOM 1066 CA GLY A 70 -0.796 -15.139 4.438 1.00 0.00 C ATOM 1067 C GLY A 70 -1.541 -13.850 4.800 1.00 0.00 C ATOM 1068 O GLY A 70 -2.606 -13.577 4.282 1.00 0.00 O ATOM 0 H GLY A 70 0.136 -14.944 6.351 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -0.329 -15.035 3.459 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -1.501 -15.968 4.369 1.00 0.00 H new ATOM 1072 N VAL A 71 -0.994 -13.053 5.680 1.00 0.00 N ATOM 1073 CA VAL A 71 -1.680 -11.784 6.063 1.00 0.00 C ATOM 1074 C VAL A 71 -0.635 -10.708 6.368 1.00 0.00 C ATOM 1075 O VAL A 71 0.491 -11.002 6.717 1.00 0.00 O ATOM 1076 CB VAL A 71 -2.542 -12.018 7.308 1.00 0.00 C ATOM 1077 CG1 VAL A 71 -3.594 -10.914 7.416 1.00 0.00 C ATOM 1078 CG2 VAL A 71 -3.242 -13.375 7.204 1.00 0.00 C ATOM 0 H VAL A 71 -0.105 -13.225 6.149 1.00 0.00 H new ATOM 0 HA VAL A 71 -2.313 -11.456 5.238 1.00 0.00 H new ATOM 0 HB VAL A 71 -1.905 -12.005 8.193 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.207 -11.081 8.302 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -3.099 -9.946 7.494 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.227 -10.927 6.529 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -3.854 -13.538 8.091 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -3.876 -13.390 6.318 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -2.495 -14.165 7.129 1.00 0.00 H new ATOM 1088 N VAL A 72 -1.004 -9.461 6.242 1.00 0.00 N ATOM 1089 CA VAL A 72 -0.040 -8.358 6.525 1.00 0.00 C ATOM 1090 C VAL A 72 -0.790 -7.190 7.171 1.00 0.00 C ATOM 1091 O VAL A 72 -1.813 -6.752 6.682 1.00 0.00 O ATOM 1092 CB VAL A 72 0.602 -7.892 5.218 1.00 0.00 C ATOM 1093 CG1 VAL A 72 1.084 -9.107 4.424 1.00 0.00 C ATOM 1094 CG2 VAL A 72 -0.429 -7.120 4.391 1.00 0.00 C ATOM 0 H VAL A 72 -1.935 -9.158 5.954 1.00 0.00 H new ATOM 0 HA VAL A 72 0.737 -8.714 7.201 1.00 0.00 H new ATOM 0 HB VAL A 72 1.450 -7.244 5.441 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.542 -8.775 3.492 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.818 -9.658 5.012 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.237 -9.755 4.201 1.00 0.00 H new ATOM 0 HG21 VAL A 72 0.028 -6.787 3.459 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -1.276 -7.769 4.169 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -0.773 -6.254 4.956 1.00 0.00 H new ATOM 1104 N SER A 73 -0.295 -6.686 8.268 1.00 0.00 N ATOM 1105 CA SER A 73 -0.986 -5.552 8.946 1.00 0.00 C ATOM 1106 C SER A 73 -0.406 -4.223 8.456 1.00 0.00 C ATOM 1107 O SER A 73 0.786 -3.995 8.520 1.00 0.00 O ATOM 1108 CB SER A 73 -0.789 -5.666 10.458 1.00 0.00 C ATOM 1109 OG SER A 73 -0.973 -7.019 10.854 1.00 0.00 O ATOM 0 H SER A 73 0.558 -7.010 8.724 1.00 0.00 H new ATOM 0 HA SER A 73 -2.050 -5.588 8.712 1.00 0.00 H new ATOM 0 HB2 SER A 73 0.210 -5.327 10.733 1.00 0.00 H new ATOM 0 HB3 SER A 73 -1.499 -5.023 10.979 1.00 0.00 H new ATOM 0 HG SER A 73 -0.846 -7.097 11.823 1.00 0.00 H new ATOM 1115 N ILE A 74 -1.245 -3.344 7.970 1.00 0.00 N ATOM 1116 CA ILE A 74 -0.759 -2.022 7.475 1.00 0.00 C ATOM 1117 C ILE A 74 -1.095 -0.939 8.504 1.00 0.00 C ATOM 1118 O ILE A 74 -2.136 -0.967 9.128 1.00 0.00 O ATOM 1119 CB ILE A 74 -1.449 -1.693 6.150 1.00 0.00 C ATOM 1120 CG1 ILE A 74 -1.161 -2.804 5.137 1.00 0.00 C ATOM 1121 CG2 ILE A 74 -0.914 -0.364 5.612 1.00 0.00 C ATOM 1122 CD1 ILE A 74 -2.029 -2.598 3.893 1.00 0.00 C ATOM 0 H ILE A 74 -2.252 -3.487 7.895 1.00 0.00 H new ATOM 0 HA ILE A 74 0.320 -2.062 7.326 1.00 0.00 H new ATOM 0 HB ILE A 74 -2.524 -1.614 6.310 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -0.106 -2.796 4.863 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -1.368 -3.778 5.581 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -1.406 -0.129 4.668 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -1.116 0.428 6.333 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.161 -0.443 5.451 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.824 -3.389 3.171 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -3.082 -2.628 4.175 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -1.800 -1.631 3.446 1.00 0.00 H new ATOM 1134 N LYS A 75 -0.222 0.015 8.687 1.00 0.00 N ATOM 1135 CA LYS A 75 -0.499 1.095 9.678 1.00 0.00 C ATOM 1136 C LYS A 75 0.125 2.405 9.192 1.00 0.00 C ATOM 1137 O LYS A 75 1.114 2.409 8.486 1.00 0.00 O ATOM 1138 CB LYS A 75 0.106 0.713 11.030 1.00 0.00 C ATOM 1139 CG LYS A 75 0.234 1.962 11.905 1.00 0.00 C ATOM 1140 CD LYS A 75 0.364 1.550 13.371 1.00 0.00 C ATOM 1141 CE LYS A 75 0.923 2.718 14.184 1.00 0.00 C ATOM 1142 NZ LYS A 75 0.399 2.652 15.577 1.00 0.00 N ATOM 0 H LYS A 75 0.668 0.093 8.195 1.00 0.00 H new ATOM 0 HA LYS A 75 -1.576 1.223 9.785 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -0.522 -0.028 11.525 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.085 0.255 10.886 1.00 0.00 H new ATOM 0 HG2 LYS A 75 1.105 2.543 11.602 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -0.638 2.602 11.773 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -0.609 1.253 13.763 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.021 0.685 13.459 1.00 0.00 H new ATOM 0 HE2 LYS A 75 2.012 2.680 14.192 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.640 3.664 13.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.780 3.447 16.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -0.639 2.708 15.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 0.690 1.755 16.015 1.00 0.00 H new ATOM 1156 N GLY A 76 -0.445 3.517 9.568 1.00 0.00 N ATOM 1157 CA GLY A 76 0.112 4.829 9.132 1.00 0.00 C ATOM 1158 C GLY A 76 1.052 5.367 10.212 1.00 0.00 C ATOM 1159 O GLY A 76 0.779 5.268 11.391 1.00 0.00 O ATOM 0 H GLY A 76 -1.274 3.574 10.159 1.00 0.00 H new ATOM 0 HA2 GLY A 76 0.650 4.713 8.191 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -0.696 5.538 8.952 1.00 0.00 H new ATOM 1163 N VAL A 77 2.160 5.937 9.820 1.00 0.00 N ATOM 1164 CA VAL A 77 3.115 6.479 10.827 1.00 0.00 C ATOM 1165 C VAL A 77 2.604 7.826 11.341 1.00 0.00 C ATOM 1166 O VAL A 77 2.263 7.971 12.499 1.00 0.00 O ATOM 1167 CB VAL A 77 4.487 6.667 10.179 1.00 0.00 C ATOM 1168 CG1 VAL A 77 5.398 7.449 11.128 1.00 0.00 C ATOM 1169 CG2 VAL A 77 5.107 5.298 9.892 1.00 0.00 C ATOM 0 H VAL A 77 2.444 6.050 8.847 1.00 0.00 H new ATOM 0 HA VAL A 77 3.200 5.781 11.660 1.00 0.00 H new ATOM 0 HB VAL A 77 4.375 7.219 9.246 1.00 0.00 H new ATOM 0 HG11 VAL A 77 6.376 7.583 10.666 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.957 8.425 11.334 1.00 0.00 H new ATOM 0 HG13 VAL A 77 5.510 6.897 12.061 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.085 5.431 9.430 1.00 0.00 H new ATOM 0 HG22 VAL A 77 5.219 4.746 10.825 1.00 0.00 H new ATOM 0 HG23 VAL A 77 4.459 4.740 9.216 1.00 0.00 H new ATOM 1179 N SER A 78 2.550 8.815 10.490 1.00 0.00 N ATOM 1180 CA SER A 78 2.062 10.152 10.932 1.00 0.00 C ATOM 1181 C SER A 78 0.551 10.094 11.163 1.00 0.00 C ATOM 1182 O SER A 78 0.039 10.627 12.128 1.00 0.00 O ATOM 1183 CB SER A 78 2.373 11.190 9.855 1.00 0.00 C ATOM 1184 OG SER A 78 3.620 10.878 9.248 1.00 0.00 O ATOM 0 H SER A 78 2.823 8.755 9.509 1.00 0.00 H new ATOM 0 HA SER A 78 2.561 10.431 11.860 1.00 0.00 H new ATOM 0 HB2 SER A 78 1.583 11.200 9.104 1.00 0.00 H new ATOM 0 HB3 SER A 78 2.409 12.187 10.294 1.00 0.00 H new ATOM 0 HG SER A 78 3.469 10.570 8.330 1.00 0.00 H new ATOM 1190 N ALA A 79 -0.169 9.450 10.285 1.00 0.00 N ATOM 1191 CA ALA A 79 -1.646 9.359 10.456 1.00 0.00 C ATOM 1192 C ALA A 79 -1.966 8.482 11.668 1.00 0.00 C ATOM 1193 O ALA A 79 -3.004 8.612 12.285 1.00 0.00 O ATOM 1194 CB ALA A 79 -2.269 8.743 9.201 1.00 0.00 C ATOM 0 H ALA A 79 0.202 8.983 9.457 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.056 10.357 10.612 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -3.350 8.677 9.326 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -2.042 9.368 8.338 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.860 7.745 9.044 1.00 0.00 H new ATOM 1200 N ASN A 80 -1.080 7.589 12.015 1.00 0.00 N ATOM 1201 CA ASN A 80 -1.332 6.704 13.187 1.00 0.00 C ATOM 1202 C ASN A 80 -2.722 6.076 13.064 1.00 0.00 C ATOM 1203 O ASN A 80 -3.520 6.128 13.980 1.00 0.00 O ATOM 1204 CB ASN A 80 -1.259 7.530 14.473 1.00 0.00 C ATOM 1205 CG ASN A 80 0.205 7.821 14.811 1.00 0.00 C ATOM 1206 OD1 ASN A 80 1.035 6.933 14.783 1.00 0.00 O ATOM 1207 ND2 ASN A 80 0.559 9.034 15.132 1.00 0.00 N ATOM 0 H ASN A 80 -0.192 7.434 11.537 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.579 5.916 13.216 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -1.807 8.464 14.349 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -1.732 6.989 15.293 1.00 0.00 H new ATOM 0 HD21 ASN A 80 1.532 9.238 15.360 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -0.137 9.779 15.156 1.00 0.00 H new ATOM 1214 N ARG A 81 -3.017 5.482 11.940 1.00 0.00 N ATOM 1215 CA ARG A 81 -4.356 4.850 11.759 1.00 0.00 C ATOM 1216 C ARG A 81 -4.215 3.604 10.881 1.00 0.00 C ATOM 1217 O ARG A 81 -3.400 3.554 9.983 1.00 0.00 O ATOM 1218 CB ARG A 81 -5.301 5.846 11.083 1.00 0.00 C ATOM 1219 CG ARG A 81 -5.817 6.847 12.119 1.00 0.00 C ATOM 1220 CD ARG A 81 -6.703 7.885 11.430 1.00 0.00 C ATOM 1221 NE ARG A 81 -8.043 7.906 12.082 1.00 0.00 N ATOM 1222 CZ ARG A 81 -8.857 8.903 11.869 1.00 0.00 C ATOM 1223 NH1 ARG A 81 -8.499 9.882 11.083 1.00 0.00 N ATOM 1224 NH2 ARG A 81 -10.031 8.921 12.440 1.00 0.00 N ATOM 0 H ARG A 81 -2.390 5.407 11.139 1.00 0.00 H new ATOM 0 HA ARG A 81 -4.761 4.567 12.731 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -4.780 6.371 10.283 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -6.137 5.317 10.626 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -6.382 6.327 12.892 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -4.979 7.339 12.613 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -6.242 8.871 11.491 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -6.806 7.646 10.371 1.00 0.00 H new ATOM 0 HE ARG A 81 -8.324 7.141 12.695 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -7.583 9.868 10.635 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -9.136 10.661 10.917 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -10.312 8.155 13.053 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -10.667 9.701 12.273 1.00 0.00 H new ATOM 1238 N TYR A 82 -5.006 2.597 11.136 1.00 0.00 N ATOM 1239 CA TYR A 82 -4.919 1.355 10.317 1.00 0.00 C ATOM 1240 C TYR A 82 -5.862 1.465 9.117 1.00 0.00 C ATOM 1241 O TYR A 82 -7.005 1.855 9.248 1.00 0.00 O ATOM 1242 CB TYR A 82 -5.321 0.152 11.172 1.00 0.00 C ATOM 1243 CG TYR A 82 -4.372 0.021 12.340 1.00 0.00 C ATOM 1244 CD1 TYR A 82 -4.585 0.772 13.502 1.00 0.00 C ATOM 1245 CD2 TYR A 82 -3.281 -0.852 12.260 1.00 0.00 C ATOM 1246 CE1 TYR A 82 -3.706 0.651 14.584 1.00 0.00 C ATOM 1247 CE2 TYR A 82 -2.402 -0.973 13.342 1.00 0.00 C ATOM 1248 CZ TYR A 82 -2.615 -0.222 14.504 1.00 0.00 C ATOM 1249 OH TYR A 82 -1.748 -0.341 15.572 1.00 0.00 O ATOM 0 H TYR A 82 -5.708 2.581 11.876 1.00 0.00 H new ATOM 0 HA TYR A 82 -3.896 1.225 9.963 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -6.342 0.274 11.532 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -5.302 -0.757 10.571 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -5.428 1.445 13.563 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -3.118 -1.432 11.364 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -3.869 1.231 15.480 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -1.559 -1.646 13.281 1.00 0.00 H new ATOM 0 HH TYR A 82 -1.046 -0.989 15.353 1.00 0.00 H new ATOM 1259 N LEU A 83 -5.392 1.125 7.949 1.00 0.00 N ATOM 1260 CA LEU A 83 -6.259 1.208 6.739 1.00 0.00 C ATOM 1261 C LEU A 83 -7.431 0.234 6.887 1.00 0.00 C ATOM 1262 O LEU A 83 -7.303 -0.821 7.476 1.00 0.00 O ATOM 1263 CB LEU A 83 -5.436 0.836 5.501 1.00 0.00 C ATOM 1264 CG LEU A 83 -6.271 1.041 4.231 1.00 0.00 C ATOM 1265 CD1 LEU A 83 -6.612 2.524 4.055 1.00 0.00 C ATOM 1266 CD2 LEU A 83 -5.472 0.560 3.019 1.00 0.00 C ATOM 0 H LEU A 83 -4.443 0.792 7.779 1.00 0.00 H new ATOM 0 HA LEU A 83 -6.642 2.223 6.630 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -4.535 1.448 5.456 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -5.112 -0.203 5.569 1.00 0.00 H new ATOM 0 HG LEU A 83 -7.196 0.471 4.318 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -7.205 2.656 3.150 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -7.183 2.871 4.916 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -5.691 3.102 3.973 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -6.062 0.704 2.114 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -4.547 1.131 2.943 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -5.237 -0.498 3.135 1.00 0.00 H new ATOM 1278 N ALA A 84 -8.574 0.578 6.356 1.00 0.00 N ATOM 1279 CA ALA A 84 -9.749 -0.330 6.467 1.00 0.00 C ATOM 1280 C ALA A 84 -10.650 -0.151 5.241 1.00 0.00 C ATOM 1281 O ALA A 84 -10.966 0.953 4.848 1.00 0.00 O ATOM 1282 CB ALA A 84 -10.539 0.009 7.733 1.00 0.00 C ATOM 0 H ALA A 84 -8.743 1.448 5.851 1.00 0.00 H new ATOM 0 HA ALA A 84 -9.405 -1.363 6.519 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -11.399 -0.656 7.814 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.899 -0.118 8.606 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.883 1.042 7.682 1.00 0.00 H new ATOM 1288 N MET A 85 -11.065 -1.234 4.637 1.00 0.00 N ATOM 1289 CA MET A 85 -11.946 -1.131 3.437 1.00 0.00 C ATOM 1290 C MET A 85 -13.405 -1.313 3.861 1.00 0.00 C ATOM 1291 O MET A 85 -13.782 -2.334 4.401 1.00 0.00 O ATOM 1292 CB MET A 85 -11.569 -2.221 2.433 1.00 0.00 C ATOM 1293 CG MET A 85 -12.558 -2.205 1.266 1.00 0.00 C ATOM 1294 SD MET A 85 -11.901 -3.202 -0.094 1.00 0.00 S ATOM 1295 CE MET A 85 -11.138 -1.849 -1.020 1.00 0.00 C ATOM 0 H MET A 85 -10.832 -2.185 4.923 1.00 0.00 H new ATOM 0 HA MET A 85 -11.819 -0.152 2.975 1.00 0.00 H new ATOM 0 HB2 MET A 85 -10.555 -2.058 2.067 1.00 0.00 H new ATOM 0 HB3 MET A 85 -11.579 -3.197 2.919 1.00 0.00 H new ATOM 0 HG2 MET A 85 -13.522 -2.599 1.587 1.00 0.00 H new ATOM 0 HG3 MET A 85 -12.727 -1.181 0.932 1.00 0.00 H new ATOM 0 HE1 MET A 85 -10.503 -2.258 -1.805 1.00 0.00 H new ATOM 0 HE2 MET A 85 -11.916 -1.231 -1.468 1.00 0.00 H new ATOM 0 HE3 MET A 85 -10.535 -1.241 -0.345 1.00 0.00 H new ATOM 1305 N LYS A 86 -14.230 -0.331 3.620 1.00 0.00 N ATOM 1306 CA LYS A 86 -15.663 -0.451 4.009 1.00 0.00 C ATOM 1307 C LYS A 86 -16.401 -1.305 2.976 1.00 0.00 C ATOM 1308 O LYS A 86 -15.836 -1.719 1.982 1.00 0.00 O ATOM 1309 CB LYS A 86 -16.296 0.941 4.066 1.00 0.00 C ATOM 1310 CG LYS A 86 -15.787 1.683 5.303 1.00 0.00 C ATOM 1311 CD LYS A 86 -16.753 1.458 6.469 1.00 0.00 C ATOM 1312 CE LYS A 86 -17.908 2.457 6.376 1.00 0.00 C ATOM 1313 NZ LYS A 86 -17.570 3.680 7.157 1.00 0.00 N ATOM 0 H LYS A 86 -13.974 0.548 3.171 1.00 0.00 H new ATOM 0 HA LYS A 86 -15.735 -0.922 4.989 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -16.048 1.502 3.165 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -17.382 0.857 4.101 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -14.791 1.328 5.569 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -15.699 2.748 5.090 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -17.137 0.438 6.445 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -16.229 1.579 7.417 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -18.095 2.718 5.334 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -18.823 2.008 6.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -18.445 4.127 7.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -16.975 3.420 7.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -17.054 4.348 6.550 1.00 0.00 H new ATOM 1327 N GLU A 87 -17.658 -1.571 3.199 1.00 0.00 N ATOM 1328 CA GLU A 87 -18.429 -2.399 2.228 1.00 0.00 C ATOM 1329 C GLU A 87 -18.933 -1.511 1.088 1.00 0.00 C ATOM 1330 O GLU A 87 -19.156 -1.967 -0.015 1.00 0.00 O ATOM 1331 CB GLU A 87 -19.622 -3.042 2.939 1.00 0.00 C ATOM 1332 CG GLU A 87 -20.242 -2.036 3.909 1.00 0.00 C ATOM 1333 CD GLU A 87 -21.701 -2.413 4.173 1.00 0.00 C ATOM 1334 OE1 GLU A 87 -21.924 -3.450 4.776 1.00 0.00 O ATOM 1335 OE2 GLU A 87 -22.570 -1.658 3.769 1.00 0.00 O ATOM 0 H GLU A 87 -18.185 -1.251 4.011 1.00 0.00 H new ATOM 0 HA GLU A 87 -17.784 -3.179 1.824 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -20.364 -3.363 2.208 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -19.300 -3.933 3.479 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -19.683 -2.025 4.845 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -20.185 -1.030 3.492 1.00 0.00 H new ATOM 1342 N ASP A 88 -19.114 -0.245 1.346 1.00 0.00 N ATOM 1343 CA ASP A 88 -19.603 0.671 0.277 1.00 0.00 C ATOM 1344 C ASP A 88 -18.478 0.927 -0.729 1.00 0.00 C ATOM 1345 O ASP A 88 -18.660 1.610 -1.717 1.00 0.00 O ATOM 1346 CB ASP A 88 -20.041 1.998 0.902 1.00 0.00 C ATOM 1347 CG ASP A 88 -18.959 2.490 1.866 1.00 0.00 C ATOM 1348 OD1 ASP A 88 -17.826 2.063 1.720 1.00 0.00 O ATOM 1349 OD2 ASP A 88 -19.283 3.284 2.733 1.00 0.00 O ATOM 0 H ASP A 88 -18.944 0.195 2.251 1.00 0.00 H new ATOM 0 HA ASP A 88 -20.450 0.214 -0.234 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -20.213 2.740 0.122 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -20.984 1.868 1.433 1.00 0.00 H new ATOM 1354 N GLY A 89 -17.317 0.384 -0.485 1.00 0.00 N ATOM 1355 CA GLY A 89 -16.183 0.597 -1.427 1.00 0.00 C ATOM 1356 C GLY A 89 -15.363 1.807 -0.977 1.00 0.00 C ATOM 1357 O GLY A 89 -14.251 2.016 -1.420 1.00 0.00 O ATOM 0 H GLY A 89 -17.105 -0.198 0.326 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -15.552 -0.291 -1.459 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -16.561 0.756 -2.437 1.00 0.00 H new ATOM 1361 N ARG A 90 -15.903 2.607 -0.099 1.00 0.00 N ATOM 1362 CA ARG A 90 -15.154 3.804 0.379 1.00 0.00 C ATOM 1363 C ARG A 90 -14.002 3.358 1.282 1.00 0.00 C ATOM 1364 O ARG A 90 -14.202 2.680 2.271 1.00 0.00 O ATOM 1365 CB ARG A 90 -16.097 4.715 1.167 1.00 0.00 C ATOM 1366 CG ARG A 90 -17.088 5.377 0.208 1.00 0.00 C ATOM 1367 CD ARG A 90 -17.975 6.352 0.990 1.00 0.00 C ATOM 1368 NE ARG A 90 -19.418 6.140 0.644 1.00 0.00 N ATOM 1369 CZ ARG A 90 -19.812 6.032 -0.599 1.00 0.00 C ATOM 1370 NH1 ARG A 90 -18.961 6.183 -1.576 1.00 0.00 N ATOM 1371 NH2 ARG A 90 -21.067 5.794 -0.865 1.00 0.00 N ATOM 0 H ARG A 90 -16.830 2.484 0.308 1.00 0.00 H new ATOM 0 HA ARG A 90 -14.755 4.348 -0.477 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -16.634 4.137 1.919 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -15.525 5.476 1.698 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -16.551 5.907 -0.579 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -17.702 4.619 -0.279 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -17.827 6.210 2.060 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -17.687 7.378 0.762 1.00 0.00 H new ATOM 0 HE ARG A 90 -20.107 6.079 1.393 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -17.982 6.386 -1.373 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -19.274 6.098 -2.543 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -21.739 5.692 -0.105 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -21.376 5.710 -1.833 1.00 0.00 H new ATOM 1385 N LEU A 91 -12.797 3.733 0.951 1.00 0.00 N ATOM 1386 CA LEU A 91 -11.634 3.330 1.792 1.00 0.00 C ATOM 1387 C LEU A 91 -11.388 4.391 2.866 1.00 0.00 C ATOM 1388 O LEU A 91 -11.423 5.576 2.600 1.00 0.00 O ATOM 1389 CB LEU A 91 -10.389 3.199 0.911 1.00 0.00 C ATOM 1390 CG LEU A 91 -10.410 1.849 0.193 1.00 0.00 C ATOM 1391 CD1 LEU A 91 -11.706 1.718 -0.610 1.00 0.00 C ATOM 1392 CD2 LEU A 91 -9.213 1.758 -0.756 1.00 0.00 C ATOM 0 H LEU A 91 -12.567 4.301 0.135 1.00 0.00 H new ATOM 0 HA LEU A 91 -11.845 2.373 2.269 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -10.359 4.009 0.183 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -9.489 3.285 1.520 1.00 0.00 H new ATOM 0 HG LEU A 91 -10.355 1.046 0.928 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -11.721 0.756 -1.122 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -12.560 1.784 0.064 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -11.761 2.521 -1.345 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -9.227 0.796 -1.268 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -9.269 2.561 -1.491 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -8.289 1.852 -0.186 1.00 0.00 H new ATOM 1404 N LEU A 92 -11.141 3.975 4.079 1.00 0.00 N ATOM 1405 CA LEU A 92 -10.892 4.961 5.169 1.00 0.00 C ATOM 1406 C LEU A 92 -9.880 4.382 6.158 1.00 0.00 C ATOM 1407 O LEU A 92 -9.344 3.311 5.954 1.00 0.00 O ATOM 1408 CB LEU A 92 -12.206 5.280 5.898 1.00 0.00 C ATOM 1409 CG LEU A 92 -13.018 3.997 6.138 1.00 0.00 C ATOM 1410 CD1 LEU A 92 -12.273 3.070 7.104 1.00 0.00 C ATOM 1411 CD2 LEU A 92 -14.373 4.368 6.744 1.00 0.00 C ATOM 0 H LEU A 92 -11.101 2.996 4.362 1.00 0.00 H new ATOM 0 HA LEU A 92 -10.494 5.880 4.738 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -11.991 5.764 6.851 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -12.794 5.984 5.308 1.00 0.00 H new ATOM 0 HG LEU A 92 -13.159 3.482 5.188 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -12.859 2.165 7.265 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.305 2.804 6.679 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -12.124 3.580 8.056 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -14.954 3.462 6.917 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -14.219 4.886 7.690 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -14.913 5.020 6.057 1.00 0.00 H new ATOM 1423 N ALA A 93 -9.616 5.083 7.229 1.00 0.00 N ATOM 1424 CA ALA A 93 -8.638 4.580 8.237 1.00 0.00 C ATOM 1425 C ALA A 93 -9.160 4.875 9.644 1.00 0.00 C ATOM 1426 O ALA A 93 -9.989 5.741 9.838 1.00 0.00 O ATOM 1427 CB ALA A 93 -7.293 5.281 8.034 1.00 0.00 C ATOM 0 H ALA A 93 -10.037 5.985 7.449 1.00 0.00 H new ATOM 0 HA ALA A 93 -8.510 3.504 8.116 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.577 4.915 8.770 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -6.921 5.072 7.031 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -7.421 6.356 8.157 1.00 0.00 H new ATOM 1433 N SER A 94 -8.682 4.160 10.626 1.00 0.00 N ATOM 1434 CA SER A 94 -9.151 4.398 12.021 1.00 0.00 C ATOM 1435 C SER A 94 -7.990 4.171 12.991 1.00 0.00 C ATOM 1436 O SER A 94 -6.944 3.681 12.618 1.00 0.00 O ATOM 1437 CB SER A 94 -10.286 3.427 12.350 1.00 0.00 C ATOM 1438 OG SER A 94 -9.744 2.137 12.598 1.00 0.00 O ATOM 0 H SER A 94 -7.987 3.421 10.522 1.00 0.00 H new ATOM 0 HA SER A 94 -9.511 5.422 12.115 1.00 0.00 H new ATOM 0 HB2 SER A 94 -10.837 3.776 13.223 1.00 0.00 H new ATOM 0 HB3 SER A 94 -10.994 3.384 11.522 1.00 0.00 H new ATOM 0 HG SER A 94 -9.846 1.916 13.547 1.00 0.00 H new ATOM 1444 N LYS A 95 -8.164 4.525 14.235 1.00 0.00 N ATOM 1445 CA LYS A 95 -7.068 4.328 15.224 1.00 0.00 C ATOM 1446 C LYS A 95 -7.048 2.868 15.682 1.00 0.00 C ATOM 1447 O LYS A 95 -6.002 2.291 15.902 1.00 0.00 O ATOM 1448 CB LYS A 95 -7.300 5.238 16.432 1.00 0.00 C ATOM 1449 CG LYS A 95 -7.496 6.679 15.955 1.00 0.00 C ATOM 1450 CD LYS A 95 -7.491 7.622 17.161 1.00 0.00 C ATOM 1451 CE LYS A 95 -6.130 8.312 17.264 1.00 0.00 C ATOM 1452 NZ LYS A 95 -6.074 9.115 18.519 1.00 0.00 N ATOM 0 H LYS A 95 -9.017 4.942 14.608 1.00 0.00 H new ATOM 0 HA LYS A 95 -6.113 4.576 14.760 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -8.176 4.905 16.988 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -6.450 5.181 17.112 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -6.702 6.955 15.261 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -8.438 6.769 15.414 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -8.281 8.366 17.057 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -7.697 7.063 18.074 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -5.332 7.569 17.259 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -5.971 8.957 16.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -5.149 9.585 18.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -6.826 9.833 18.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -6.208 8.488 19.338 1.00 0.00 H new ATOM 1466 N SER A 96 -8.197 2.265 15.825 1.00 0.00 N ATOM 1467 CA SER A 96 -8.243 0.843 16.267 1.00 0.00 C ATOM 1468 C SER A 96 -8.286 -0.073 15.041 1.00 0.00 C ATOM 1469 O SER A 96 -9.132 0.068 14.180 1.00 0.00 O ATOM 1470 CB SER A 96 -9.492 0.614 17.118 1.00 0.00 C ATOM 1471 OG SER A 96 -9.630 1.683 18.045 1.00 0.00 O ATOM 0 H SER A 96 -9.106 2.696 15.655 1.00 0.00 H new ATOM 0 HA SER A 96 -7.355 0.618 16.857 1.00 0.00 H new ATOM 0 HB2 SER A 96 -10.374 0.553 16.481 1.00 0.00 H new ATOM 0 HB3 SER A 96 -9.416 -0.335 17.648 1.00 0.00 H new ATOM 0 HG SER A 96 -10.431 1.541 18.592 1.00 0.00 H new ATOM 1477 N VAL A 97 -7.383 -1.011 14.957 1.00 0.00 N ATOM 1478 CA VAL A 97 -7.375 -1.934 13.788 1.00 0.00 C ATOM 1479 C VAL A 97 -8.570 -2.884 13.879 1.00 0.00 C ATOM 1480 O VAL A 97 -8.697 -3.648 14.815 1.00 0.00 O ATOM 1481 CB VAL A 97 -6.077 -2.746 13.788 1.00 0.00 C ATOM 1482 CG1 VAL A 97 -6.033 -3.637 15.030 1.00 0.00 C ATOM 1483 CG2 VAL A 97 -6.023 -3.620 12.533 1.00 0.00 C ATOM 0 H VAL A 97 -6.651 -1.178 15.647 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.442 -1.354 12.867 1.00 0.00 H new ATOM 0 HB VAL A 97 -5.224 -2.067 13.797 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -5.109 -4.215 15.030 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -6.073 -3.016 15.925 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -6.886 -4.316 15.021 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -5.099 -4.199 12.532 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.876 -4.298 12.525 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -6.055 -2.986 11.647 1.00 0.00 H new ATOM 1493 N THR A 98 -9.448 -2.842 12.911 1.00 0.00 N ATOM 1494 CA THR A 98 -10.637 -3.742 12.938 1.00 0.00 C ATOM 1495 C THR A 98 -10.368 -4.968 12.064 1.00 0.00 C ATOM 1496 O THR A 98 -9.489 -4.963 11.224 1.00 0.00 O ATOM 1497 CB THR A 98 -11.856 -2.988 12.397 1.00 0.00 C ATOM 1498 OG1 THR A 98 -11.511 -2.349 11.176 1.00 0.00 O ATOM 1499 CG2 THR A 98 -12.303 -1.940 13.417 1.00 0.00 C ATOM 0 H THR A 98 -9.392 -2.222 12.103 1.00 0.00 H new ATOM 0 HA THR A 98 -10.830 -4.061 13.962 1.00 0.00 H new ATOM 0 HB THR A 98 -12.671 -3.690 12.222 1.00 0.00 H new ATOM 0 HG1 THR A 98 -12.290 -1.867 10.827 1.00 0.00 H new ATOM 0 HG21 THR A 98 -13.170 -1.404 13.032 1.00 0.00 H new ATOM 0 HG22 THR A 98 -12.567 -2.433 14.353 1.00 0.00 H new ATOM 0 HG23 THR A 98 -11.490 -1.235 13.595 1.00 0.00 H new ATOM 1507 N ASP A 99 -11.119 -6.019 12.251 1.00 0.00 N ATOM 1508 CA ASP A 99 -10.905 -7.242 11.429 1.00 0.00 C ATOM 1509 C ASP A 99 -10.873 -6.859 9.948 1.00 0.00 C ATOM 1510 O ASP A 99 -10.338 -7.575 9.124 1.00 0.00 O ATOM 1511 CB ASP A 99 -12.047 -8.230 11.676 1.00 0.00 C ATOM 1512 CG ASP A 99 -11.743 -9.551 10.965 1.00 0.00 C ATOM 1513 OD1 ASP A 99 -10.596 -9.964 10.992 1.00 0.00 O ATOM 1514 OD2 ASP A 99 -12.663 -10.124 10.406 1.00 0.00 O ATOM 0 H ASP A 99 -11.871 -6.083 12.937 1.00 0.00 H new ATOM 0 HA ASP A 99 -9.958 -7.706 11.706 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -12.169 -8.400 12.746 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -12.986 -7.815 11.310 1.00 0.00 H new ATOM 1519 N GLU A 100 -11.443 -5.736 9.604 1.00 0.00 N ATOM 1520 CA GLU A 100 -11.447 -5.306 8.177 1.00 0.00 C ATOM 1521 C GLU A 100 -10.261 -4.374 7.921 1.00 0.00 C ATOM 1522 O GLU A 100 -10.424 -3.264 7.458 1.00 0.00 O ATOM 1523 CB GLU A 100 -12.751 -4.565 7.872 1.00 0.00 C ATOM 1524 CG GLU A 100 -13.923 -5.547 7.938 1.00 0.00 C ATOM 1525 CD GLU A 100 -15.240 -4.768 7.976 1.00 0.00 C ATOM 1526 OE1 GLU A 100 -15.382 -3.926 8.848 1.00 0.00 O ATOM 1527 OE2 GLU A 100 -16.084 -5.028 7.135 1.00 0.00 O ATOM 0 H GLU A 100 -11.906 -5.097 10.250 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.366 -6.182 7.534 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -12.899 -3.757 8.589 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -12.700 -4.109 6.883 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -13.905 -6.210 7.073 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -13.835 -6.176 8.824 1.00 0.00 H new ATOM 1534 N CYS A 101 -9.069 -4.820 8.221 1.00 0.00 N ATOM 1535 CA CYS A 101 -7.865 -3.967 7.997 1.00 0.00 C ATOM 1536 C CYS A 101 -6.727 -4.824 7.439 1.00 0.00 C ATOM 1537 O CYS A 101 -5.626 -4.353 7.238 1.00 0.00 O ATOM 1538 CB CYS A 101 -7.429 -3.345 9.326 1.00 0.00 C ATOM 1539 SG CYS A 101 -8.450 -1.893 9.678 1.00 0.00 S ATOM 0 H CYS A 101 -8.877 -5.742 8.613 1.00 0.00 H new ATOM 0 HA CYS A 101 -8.107 -3.177 7.285 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -7.526 -4.074 10.130 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -6.378 -3.061 9.279 1.00 0.00 H new ATOM 0 HG CYS A 101 -8.065 -0.901 8.932 1.00 0.00 H new ATOM 1545 N PHE A 102 -6.987 -6.080 7.184 1.00 0.00 N ATOM 1546 CA PHE A 102 -5.922 -6.970 6.638 1.00 0.00 C ATOM 1547 C PHE A 102 -6.059 -7.055 5.116 1.00 0.00 C ATOM 1548 O PHE A 102 -7.085 -6.725 4.556 1.00 0.00 O ATOM 1549 CB PHE A 102 -6.071 -8.368 7.242 1.00 0.00 C ATOM 1550 CG PHE A 102 -5.753 -8.317 8.716 1.00 0.00 C ATOM 1551 CD1 PHE A 102 -4.427 -8.184 9.143 1.00 0.00 C ATOM 1552 CD2 PHE A 102 -6.786 -8.402 9.658 1.00 0.00 C ATOM 1553 CE1 PHE A 102 -4.133 -8.138 10.511 1.00 0.00 C ATOM 1554 CE2 PHE A 102 -6.492 -8.356 11.025 1.00 0.00 C ATOM 1555 CZ PHE A 102 -5.165 -8.223 11.453 1.00 0.00 C ATOM 0 H PHE A 102 -7.892 -6.527 7.331 1.00 0.00 H new ATOM 0 HA PHE A 102 -4.942 -6.565 6.892 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -7.086 -8.734 7.091 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -5.402 -9.066 6.739 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -3.630 -8.117 8.417 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -7.810 -8.503 9.329 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -3.109 -8.037 10.840 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -7.289 -8.423 11.751 1.00 0.00 H new ATOM 0 HZ PHE A 102 -4.938 -8.186 12.508 1.00 0.00 H new ATOM 1565 N PHE A 103 -5.032 -7.499 4.443 1.00 0.00 N ATOM 1566 CA PHE A 103 -5.105 -7.607 2.959 1.00 0.00 C ATOM 1567 C PHE A 103 -4.208 -8.754 2.485 1.00 0.00 C ATOM 1568 O PHE A 103 -3.019 -8.769 2.736 1.00 0.00 O ATOM 1569 CB PHE A 103 -4.632 -6.296 2.328 1.00 0.00 C ATOM 1570 CG PHE A 103 -5.554 -5.175 2.742 1.00 0.00 C ATOM 1571 CD1 PHE A 103 -5.345 -4.509 3.955 1.00 0.00 C ATOM 1572 CD2 PHE A 103 -6.618 -4.802 1.913 1.00 0.00 C ATOM 1573 CE1 PHE A 103 -6.200 -3.469 4.340 1.00 0.00 C ATOM 1574 CE2 PHE A 103 -7.473 -3.762 2.297 1.00 0.00 C ATOM 1575 CZ PHE A 103 -7.264 -3.095 3.510 1.00 0.00 C ATOM 0 H PHE A 103 -4.147 -7.791 4.857 1.00 0.00 H new ATOM 0 HA PHE A 103 -6.135 -7.804 2.660 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -3.612 -6.076 2.642 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -4.618 -6.387 1.242 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -4.524 -4.797 4.594 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -6.780 -5.316 0.977 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -6.039 -2.956 5.276 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -8.294 -3.474 1.657 1.00 0.00 H new ATOM 0 HZ PHE A 103 -7.923 -2.292 3.806 1.00 0.00 H new ATOM 1585 N PHE A 104 -4.768 -9.714 1.801 1.00 0.00 N ATOM 1586 CA PHE A 104 -3.946 -10.857 1.313 1.00 0.00 C ATOM 1587 C PHE A 104 -2.880 -10.341 0.344 1.00 0.00 C ATOM 1588 O PHE A 104 -3.138 -10.130 -0.823 1.00 0.00 O ATOM 1589 CB PHE A 104 -4.845 -11.862 0.588 1.00 0.00 C ATOM 1590 CG PHE A 104 -5.561 -12.723 1.602 1.00 0.00 C ATOM 1591 CD1 PHE A 104 -4.838 -13.643 2.371 1.00 0.00 C ATOM 1592 CD2 PHE A 104 -6.945 -12.602 1.774 1.00 0.00 C ATOM 1593 CE1 PHE A 104 -5.500 -14.442 3.311 1.00 0.00 C ATOM 1594 CE2 PHE A 104 -7.607 -13.401 2.714 1.00 0.00 C ATOM 1595 CZ PHE A 104 -6.884 -14.321 3.483 1.00 0.00 C ATOM 0 H PHE A 104 -5.758 -9.756 1.559 1.00 0.00 H new ATOM 0 HA PHE A 104 -3.465 -11.344 2.161 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -5.569 -11.335 -0.033 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -4.248 -12.486 -0.077 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -3.770 -13.736 2.239 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -7.502 -11.892 1.181 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.943 -15.152 3.904 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -8.675 -13.308 2.846 1.00 0.00 H new ATOM 0 HZ PHE A 104 -7.394 -14.937 4.209 1.00 0.00 H new ATOM 1605 N GLU A 105 -1.682 -10.137 0.820 1.00 0.00 N ATOM 1606 CA GLU A 105 -0.602 -9.636 -0.075 1.00 0.00 C ATOM 1607 C GLU A 105 -0.157 -10.761 -1.012 1.00 0.00 C ATOM 1608 O GLU A 105 0.670 -11.580 -0.665 1.00 0.00 O ATOM 1609 CB GLU A 105 0.587 -9.172 0.768 1.00 0.00 C ATOM 1610 CG GLU A 105 1.487 -8.263 -0.072 1.00 0.00 C ATOM 1611 CD GLU A 105 2.637 -7.743 0.793 1.00 0.00 C ATOM 1612 OE1 GLU A 105 3.058 -8.466 1.681 1.00 0.00 O ATOM 1613 OE2 GLU A 105 3.077 -6.630 0.551 1.00 0.00 O ATOM 0 H GLU A 105 -1.405 -10.296 1.789 1.00 0.00 H new ATOM 0 HA GLU A 105 -0.976 -8.798 -0.664 1.00 0.00 H new ATOM 0 HB2 GLU A 105 0.234 -8.637 1.650 1.00 0.00 H new ATOM 0 HB3 GLU A 105 1.153 -10.034 1.123 1.00 0.00 H new ATOM 0 HG2 GLU A 105 1.881 -8.813 -0.927 1.00 0.00 H new ATOM 0 HG3 GLU A 105 0.910 -7.428 -0.469 1.00 0.00 H new ATOM 1620 N ARG A 106 -0.701 -10.808 -2.197 1.00 0.00 N ATOM 1621 CA ARG A 106 -0.311 -11.880 -3.155 1.00 0.00 C ATOM 1622 C ARG A 106 0.832 -11.383 -4.042 1.00 0.00 C ATOM 1623 O ARG A 106 0.720 -10.371 -4.705 1.00 0.00 O ATOM 1624 CB ARG A 106 -1.515 -12.242 -4.029 1.00 0.00 C ATOM 1625 CG ARG A 106 -1.152 -13.414 -4.943 1.00 0.00 C ATOM 1626 CD ARG A 106 -2.374 -13.810 -5.774 1.00 0.00 C ATOM 1627 NE ARG A 106 -1.959 -14.751 -6.853 1.00 0.00 N ATOM 1628 CZ ARG A 106 -2.859 -15.448 -7.491 1.00 0.00 C ATOM 1629 NH1 ARG A 106 -4.121 -15.321 -7.183 1.00 0.00 N ATOM 1630 NH2 ARG A 106 -2.498 -16.270 -8.437 1.00 0.00 N ATOM 0 H ARG A 106 -1.399 -10.150 -2.543 1.00 0.00 H new ATOM 0 HA ARG A 106 0.017 -12.760 -2.602 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -2.366 -12.507 -3.402 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -1.815 -11.381 -4.626 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -0.327 -13.136 -5.599 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -0.813 -14.262 -4.348 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -3.124 -14.279 -5.137 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -2.835 -12.923 -6.208 1.00 0.00 H new ATOM 0 HE ARG A 106 -0.972 -14.850 -7.092 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -4.403 -14.677 -6.444 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -4.825 -15.866 -7.681 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -1.512 -16.368 -8.678 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -3.202 -16.815 -8.935 1.00 0.00 H new ATOM 1644 N LEU A 107 1.930 -12.087 -4.060 1.00 0.00 N ATOM 1645 CA LEU A 107 3.079 -11.654 -4.905 1.00 0.00 C ATOM 1646 C LEU A 107 2.862 -12.134 -6.342 1.00 0.00 C ATOM 1647 O LEU A 107 2.501 -13.269 -6.580 1.00 0.00 O ATOM 1648 CB LEU A 107 4.374 -12.258 -4.356 1.00 0.00 C ATOM 1649 CG LEU A 107 5.571 -11.661 -5.097 1.00 0.00 C ATOM 1650 CD1 LEU A 107 6.364 -10.762 -4.147 1.00 0.00 C ATOM 1651 CD2 LEU A 107 6.472 -12.791 -5.601 1.00 0.00 C ATOM 0 H LEU A 107 2.082 -12.943 -3.526 1.00 0.00 H new ATOM 0 HA LEU A 107 3.152 -10.567 -4.890 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.457 -12.057 -3.288 1.00 0.00 H new ATOM 0 HB3 LEU A 107 4.362 -13.341 -4.476 1.00 0.00 H new ATOM 0 HG LEU A 107 5.218 -11.072 -5.943 1.00 0.00 H new ATOM 0 HD11 LEU A 107 7.217 -10.337 -4.676 1.00 0.00 H new ATOM 0 HD12 LEU A 107 5.723 -9.958 -3.787 1.00 0.00 H new ATOM 0 HD13 LEU A 107 6.718 -11.350 -3.300 1.00 0.00 H new ATOM 0 HD21 LEU A 107 7.326 -12.367 -6.130 1.00 0.00 H new ATOM 0 HD22 LEU A 107 6.825 -13.380 -4.754 1.00 0.00 H new ATOM 0 HD23 LEU A 107 5.908 -13.432 -6.278 1.00 0.00 H new ATOM 1663 N GLU A 108 3.082 -11.279 -7.304 1.00 0.00 N ATOM 1664 CA GLU A 108 2.888 -11.689 -8.723 1.00 0.00 C ATOM 1665 C GLU A 108 4.163 -12.364 -9.234 1.00 0.00 C ATOM 1666 O GLU A 108 5.070 -12.649 -8.478 1.00 0.00 O ATOM 1667 CB GLU A 108 2.584 -10.457 -9.576 1.00 0.00 C ATOM 1668 CG GLU A 108 1.346 -9.745 -9.026 1.00 0.00 C ATOM 1669 CD GLU A 108 0.182 -9.915 -10.004 1.00 0.00 C ATOM 1670 OE1 GLU A 108 -0.330 -11.018 -10.100 1.00 0.00 O ATOM 1671 OE2 GLU A 108 -0.177 -8.938 -10.642 1.00 0.00 O ATOM 0 H GLU A 108 3.387 -10.315 -7.168 1.00 0.00 H new ATOM 0 HA GLU A 108 2.054 -12.387 -8.789 1.00 0.00 H new ATOM 0 HB2 GLU A 108 3.438 -9.779 -9.572 1.00 0.00 H new ATOM 0 HB3 GLU A 108 2.416 -10.752 -10.612 1.00 0.00 H new ATOM 0 HG2 GLU A 108 1.080 -10.156 -8.052 1.00 0.00 H new ATOM 0 HG3 GLU A 108 1.558 -8.686 -8.878 1.00 0.00 H new ATOM 1678 N SER A 109 4.238 -12.620 -10.512 1.00 0.00 N ATOM 1679 CA SER A 109 5.452 -13.277 -11.075 1.00 0.00 C ATOM 1680 C SER A 109 6.404 -12.214 -11.625 1.00 0.00 C ATOM 1681 O SER A 109 7.573 -12.469 -11.844 1.00 0.00 O ATOM 1682 CB SER A 109 5.042 -14.224 -12.203 1.00 0.00 C ATOM 1683 OG SER A 109 4.068 -13.587 -13.018 1.00 0.00 O ATOM 0 H SER A 109 3.509 -12.402 -11.192 1.00 0.00 H new ATOM 0 HA SER A 109 5.954 -13.841 -10.289 1.00 0.00 H new ATOM 0 HB2 SER A 109 5.912 -14.495 -12.801 1.00 0.00 H new ATOM 0 HB3 SER A 109 4.639 -15.148 -11.789 1.00 0.00 H new ATOM 0 HG SER A 109 3.804 -14.190 -13.744 1.00 0.00 H new ATOM 1689 N ASN A 110 5.915 -11.024 -11.853 1.00 0.00 N ATOM 1690 CA ASN A 110 6.793 -9.948 -12.394 1.00 0.00 C ATOM 1691 C ASN A 110 7.353 -9.107 -11.241 1.00 0.00 C ATOM 1692 O ASN A 110 7.694 -7.956 -11.413 1.00 0.00 O ATOM 1693 CB ASN A 110 5.984 -9.059 -13.341 1.00 0.00 C ATOM 1694 CG ASN A 110 4.589 -8.825 -12.758 1.00 0.00 C ATOM 1695 OD1 ASN A 110 4.355 -9.079 -11.594 1.00 0.00 O ATOM 1696 ND2 ASN A 110 3.646 -8.348 -13.524 1.00 0.00 N ATOM 0 H ASN A 110 4.946 -10.752 -11.688 1.00 0.00 H new ATOM 0 HA ASN A 110 7.622 -10.397 -12.941 1.00 0.00 H new ATOM 0 HB2 ASN A 110 6.493 -8.106 -13.486 1.00 0.00 H new ATOM 0 HB3 ASN A 110 5.906 -9.530 -14.321 1.00 0.00 H new ATOM 0 HD21 ASN A 110 2.713 -8.189 -13.145 1.00 0.00 H new ATOM 0 HD22 ASN A 110 3.842 -8.135 -14.502 1.00 0.00 H new ATOM 1703 N ASN A 111 7.456 -9.688 -10.073 1.00 0.00 N ATOM 1704 CA ASN A 111 8.007 -8.957 -8.887 1.00 0.00 C ATOM 1705 C ASN A 111 7.013 -7.898 -8.393 1.00 0.00 C ATOM 1706 O ASN A 111 7.293 -7.170 -7.462 1.00 0.00 O ATOM 1707 CB ASN A 111 9.333 -8.280 -9.250 1.00 0.00 C ATOM 1708 CG ASN A 111 10.143 -9.198 -10.168 1.00 0.00 C ATOM 1709 OD1 ASN A 111 9.770 -10.332 -10.397 1.00 0.00 O ATOM 1710 ND2 ASN A 111 11.244 -8.752 -10.710 1.00 0.00 N ATOM 0 H ASN A 111 7.178 -10.652 -9.886 1.00 0.00 H new ATOM 0 HA ASN A 111 8.176 -9.682 -8.091 1.00 0.00 H new ATOM 0 HB2 ASN A 111 9.143 -7.328 -9.746 1.00 0.00 H new ATOM 0 HB3 ASN A 111 9.901 -8.060 -8.346 1.00 0.00 H new ATOM 0 HD21 ASN A 111 11.790 -9.355 -11.325 1.00 0.00 H new ATOM 0 HD22 ASN A 111 11.558 -7.801 -10.518 1.00 0.00 H new ATOM 1717 N TYR A 112 5.858 -7.805 -8.993 1.00 0.00 N ATOM 1718 CA TYR A 112 4.865 -6.790 -8.529 1.00 0.00 C ATOM 1719 C TYR A 112 3.966 -7.410 -7.456 1.00 0.00 C ATOM 1720 O TYR A 112 3.579 -8.558 -7.546 1.00 0.00 O ATOM 1721 CB TYR A 112 4.010 -6.319 -9.708 1.00 0.00 C ATOM 1722 CG TYR A 112 4.770 -5.277 -10.494 1.00 0.00 C ATOM 1723 CD1 TYR A 112 5.625 -5.669 -11.527 1.00 0.00 C ATOM 1724 CD2 TYR A 112 4.620 -3.919 -10.189 1.00 0.00 C ATOM 1725 CE1 TYR A 112 6.333 -4.707 -12.257 1.00 0.00 C ATOM 1726 CE2 TYR A 112 5.327 -2.955 -10.917 1.00 0.00 C ATOM 1727 CZ TYR A 112 6.184 -3.349 -11.952 1.00 0.00 C ATOM 1728 OH TYR A 112 6.881 -2.399 -12.670 1.00 0.00 O ATOM 0 H TYR A 112 5.559 -8.382 -9.779 1.00 0.00 H new ATOM 0 HA TYR A 112 5.395 -5.934 -8.110 1.00 0.00 H new ATOM 0 HB2 TYR A 112 3.759 -7.163 -10.350 1.00 0.00 H new ATOM 0 HB3 TYR A 112 3.070 -5.903 -9.346 1.00 0.00 H new ATOM 0 HD1 TYR A 112 5.740 -6.717 -11.763 1.00 0.00 H new ATOM 0 HD2 TYR A 112 3.958 -3.615 -9.391 1.00 0.00 H new ATOM 0 HE1 TYR A 112 6.994 -5.012 -13.055 1.00 0.00 H new ATOM 0 HE2 TYR A 112 5.212 -1.908 -10.681 1.00 0.00 H new ATOM 0 HH TYR A 112 6.662 -1.506 -12.330 1.00 0.00 H new ATOM 1738 N ASN A 113 3.636 -6.661 -6.439 1.00 0.00 N ATOM 1739 CA ASN A 113 2.768 -7.208 -5.355 1.00 0.00 C ATOM 1740 C ASN A 113 1.310 -6.831 -5.623 1.00 0.00 C ATOM 1741 O ASN A 113 1.020 -5.957 -6.416 1.00 0.00 O ATOM 1742 CB ASN A 113 3.206 -6.623 -4.011 1.00 0.00 C ATOM 1743 CG ASN A 113 4.580 -7.180 -3.635 1.00 0.00 C ATOM 1744 OD1 ASN A 113 5.566 -6.882 -4.280 1.00 0.00 O ATOM 1745 ND2 ASN A 113 4.688 -7.984 -2.612 1.00 0.00 N ATOM 0 H ASN A 113 3.930 -5.693 -6.311 1.00 0.00 H new ATOM 0 HA ASN A 113 2.861 -8.294 -5.330 1.00 0.00 H new ATOM 0 HB2 ASN A 113 3.247 -5.535 -4.072 1.00 0.00 H new ATOM 0 HB3 ASN A 113 2.477 -6.872 -3.239 1.00 0.00 H new ATOM 0 HD21 ASN A 113 5.600 -8.362 -2.354 1.00 0.00 H new ATOM 0 HD22 ASN A 113 3.861 -8.234 -2.070 1.00 0.00 H new ATOM 1752 N THR A 114 0.390 -7.484 -4.962 1.00 0.00 N ATOM 1753 CA THR A 114 -1.054 -7.170 -5.169 1.00 0.00 C ATOM 1754 C THR A 114 -1.788 -7.253 -3.828 1.00 0.00 C ATOM 1755 O THR A 114 -1.813 -8.284 -3.187 1.00 0.00 O ATOM 1756 CB THR A 114 -1.662 -8.181 -6.146 1.00 0.00 C ATOM 1757 OG1 THR A 114 -1.150 -9.476 -5.863 1.00 0.00 O ATOM 1758 CG2 THR A 114 -1.302 -7.791 -7.580 1.00 0.00 C ATOM 0 H THR A 114 0.578 -8.224 -4.285 1.00 0.00 H new ATOM 0 HA THR A 114 -1.153 -6.165 -5.579 1.00 0.00 H new ATOM 0 HB THR A 114 -2.746 -8.185 -6.036 1.00 0.00 H new ATOM 0 HG1 THR A 114 -0.766 -9.486 -4.962 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.736 -8.512 -8.273 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.695 -6.798 -7.797 1.00 0.00 H new ATOM 0 HG23 THR A 114 -0.218 -7.785 -7.694 1.00 0.00 H new ATOM 1766 N TYR A 115 -2.384 -6.174 -3.398 1.00 0.00 N ATOM 1767 CA TYR A 115 -3.114 -6.193 -2.099 1.00 0.00 C ATOM 1768 C TYR A 115 -4.581 -6.550 -2.339 1.00 0.00 C ATOM 1769 O TYR A 115 -5.355 -5.743 -2.815 1.00 0.00 O ATOM 1770 CB TYR A 115 -3.031 -4.812 -1.446 1.00 0.00 C ATOM 1771 CG TYR A 115 -1.609 -4.541 -1.015 1.00 0.00 C ATOM 1772 CD1 TYR A 115 -1.067 -5.228 0.078 1.00 0.00 C ATOM 1773 CD2 TYR A 115 -0.833 -3.603 -1.706 1.00 0.00 C ATOM 1774 CE1 TYR A 115 0.251 -4.977 0.480 1.00 0.00 C ATOM 1775 CE2 TYR A 115 0.485 -3.352 -1.304 1.00 0.00 C ATOM 1776 CZ TYR A 115 1.026 -4.039 -0.212 1.00 0.00 C ATOM 1777 OH TYR A 115 2.325 -3.791 0.185 1.00 0.00 O ATOM 0 H TYR A 115 -2.397 -5.281 -3.890 1.00 0.00 H new ATOM 0 HA TYR A 115 -2.661 -6.936 -1.443 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -3.361 -4.046 -2.148 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -3.698 -4.765 -0.585 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -1.665 -5.952 0.611 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -1.251 -3.073 -2.549 1.00 0.00 H new ATOM 0 HE1 TYR A 115 0.669 -5.507 1.323 1.00 0.00 H new ATOM 0 HE2 TYR A 115 1.084 -2.628 -1.837 1.00 0.00 H new ATOM 0 HH TYR A 115 2.779 -4.640 0.368 1.00 0.00 H new ATOM 1787 N ARG A 116 -4.971 -7.753 -2.009 1.00 0.00 N ATOM 1788 CA ARG A 116 -6.390 -8.162 -2.214 1.00 0.00 C ATOM 1789 C ARG A 116 -7.167 -7.975 -0.910 1.00 0.00 C ATOM 1790 O ARG A 116 -6.639 -8.163 0.169 1.00 0.00 O ATOM 1791 CB ARG A 116 -6.440 -9.634 -2.629 1.00 0.00 C ATOM 1792 CG ARG A 116 -7.831 -10.199 -2.337 1.00 0.00 C ATOM 1793 CD ARG A 116 -8.078 -11.428 -3.215 1.00 0.00 C ATOM 1794 NE ARG A 116 -7.005 -12.435 -2.972 1.00 0.00 N ATOM 1795 CZ ARG A 116 -7.164 -13.666 -3.375 1.00 0.00 C ATOM 1796 NH1 ARG A 116 -8.261 -14.016 -3.990 1.00 0.00 N ATOM 1797 NH2 ARG A 116 -6.225 -14.548 -3.163 1.00 0.00 N ATOM 0 H ARG A 116 -4.367 -8.470 -1.606 1.00 0.00 H new ATOM 0 HA ARG A 116 -6.837 -7.547 -2.995 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -6.212 -9.732 -3.690 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -5.684 -10.202 -2.087 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -7.912 -10.469 -1.284 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -8.591 -9.442 -2.531 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -9.054 -11.859 -2.990 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -8.091 -11.141 -4.266 1.00 0.00 H new ATOM 0 HE ARG A 116 -6.148 -12.162 -2.491 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -8.995 -13.327 -4.156 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -8.384 -14.978 -4.305 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -5.368 -14.275 -2.683 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -6.349 -15.510 -3.478 1.00 0.00 H new ATOM 1811 N SER A 117 -8.417 -7.607 -0.995 1.00 0.00 N ATOM 1812 CA SER A 117 -9.216 -7.414 0.249 1.00 0.00 C ATOM 1813 C SER A 117 -9.440 -8.768 0.924 1.00 0.00 C ATOM 1814 O SER A 117 -9.526 -9.790 0.272 1.00 0.00 O ATOM 1815 CB SER A 117 -10.566 -6.789 -0.103 1.00 0.00 C ATOM 1816 OG SER A 117 -11.121 -6.185 1.059 1.00 0.00 O ATOM 0 H SER A 117 -8.917 -7.433 -1.867 1.00 0.00 H new ATOM 0 HA SER A 117 -8.678 -6.753 0.929 1.00 0.00 H new ATOM 0 HB2 SER A 117 -10.441 -6.045 -0.890 1.00 0.00 H new ATOM 0 HB3 SER A 117 -11.243 -7.551 -0.490 1.00 0.00 H new ATOM 0 HG SER A 117 -11.385 -5.264 0.854 1.00 0.00 H new ATOM 1822 N ARG A 118 -9.534 -8.786 2.226 1.00 0.00 N ATOM 1823 CA ARG A 118 -9.750 -10.078 2.940 1.00 0.00 C ATOM 1824 C ARG A 118 -11.232 -10.456 2.879 1.00 0.00 C ATOM 1825 O ARG A 118 -11.591 -11.519 2.413 1.00 0.00 O ATOM 1826 CB ARG A 118 -9.321 -9.934 4.402 1.00 0.00 C ATOM 1827 CG ARG A 118 -9.248 -11.320 5.049 1.00 0.00 C ATOM 1828 CD ARG A 118 -9.147 -11.167 6.571 1.00 0.00 C ATOM 1829 NE ARG A 118 -8.048 -12.031 7.113 1.00 0.00 N ATOM 1830 CZ ARG A 118 -7.924 -13.282 6.751 1.00 0.00 C ATOM 1831 NH1 ARG A 118 -8.806 -13.832 5.963 1.00 0.00 N ATOM 1832 NH2 ARG A 118 -6.925 -13.992 7.200 1.00 0.00 N ATOM 0 H ARG A 118 -9.471 -7.963 2.826 1.00 0.00 H new ATOM 0 HA ARG A 118 -9.156 -10.858 2.463 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -8.350 -9.441 4.461 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -10.031 -9.306 4.941 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -10.132 -11.902 4.789 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -8.384 -11.866 4.669 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -8.957 -10.124 6.826 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -10.095 -11.441 7.034 1.00 0.00 H new ATOM 0 HE ARG A 118 -7.383 -11.635 7.778 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -9.599 -13.286 5.625 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -8.703 -14.808 5.685 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -6.243 -13.571 7.832 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -6.826 -14.968 6.919 1.00 0.00 H new ATOM 1846 N LYS A 119 -12.093 -9.597 3.347 1.00 0.00 N ATOM 1847 CA LYS A 119 -13.549 -9.910 3.316 1.00 0.00 C ATOM 1848 C LYS A 119 -14.048 -9.882 1.871 1.00 0.00 C ATOM 1849 O LYS A 119 -14.753 -10.768 1.429 1.00 0.00 O ATOM 1850 CB LYS A 119 -14.313 -8.871 4.139 1.00 0.00 C ATOM 1851 CG LYS A 119 -15.816 -9.134 4.028 1.00 0.00 C ATOM 1852 CD LYS A 119 -16.454 -9.052 5.415 1.00 0.00 C ATOM 1853 CE LYS A 119 -17.959 -9.308 5.302 1.00 0.00 C ATOM 1854 NZ LYS A 119 -18.700 -8.045 5.579 1.00 0.00 N ATOM 0 H LYS A 119 -11.852 -8.691 3.750 1.00 0.00 H new ATOM 0 HA LYS A 119 -13.715 -10.901 3.738 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -14.001 -8.918 5.182 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -14.082 -7.867 3.782 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -16.275 -8.404 3.362 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -15.992 -10.118 3.593 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -15.999 -9.786 6.080 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -16.273 -8.070 5.852 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -18.203 -9.674 4.305 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -18.261 -10.082 6.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -19.723 -8.218 5.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -18.476 -7.715 6.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -18.419 -7.319 4.889 1.00 0.00 H new ATOM 1868 N TYR A 120 -13.689 -8.868 1.130 1.00 0.00 N ATOM 1869 CA TYR A 120 -14.143 -8.778 -0.287 1.00 0.00 C ATOM 1870 C TYR A 120 -13.059 -9.338 -1.210 1.00 0.00 C ATOM 1871 O TYR A 120 -12.553 -8.655 -2.077 1.00 0.00 O ATOM 1872 CB TYR A 120 -14.407 -7.313 -0.641 1.00 0.00 C ATOM 1873 CG TYR A 120 -15.076 -6.627 0.528 1.00 0.00 C ATOM 1874 CD1 TYR A 120 -16.398 -6.948 0.861 1.00 0.00 C ATOM 1875 CD2 TYR A 120 -14.375 -5.675 1.277 1.00 0.00 C ATOM 1876 CE1 TYR A 120 -17.019 -6.314 1.945 1.00 0.00 C ATOM 1877 CE2 TYR A 120 -14.996 -5.042 2.361 1.00 0.00 C ATOM 1878 CZ TYR A 120 -16.319 -5.361 2.694 1.00 0.00 C ATOM 1879 OH TYR A 120 -16.931 -4.737 3.762 1.00 0.00 O ATOM 0 H TYR A 120 -13.100 -8.097 1.446 1.00 0.00 H new ATOM 0 HA TYR A 120 -15.058 -9.356 -0.413 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -13.470 -6.811 -0.884 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -15.041 -7.250 -1.525 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -16.938 -7.683 0.283 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -13.356 -5.429 1.019 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -18.038 -6.561 2.203 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -14.455 -4.308 2.940 1.00 0.00 H new ATOM 0 HH TYR A 120 -16.306 -4.105 4.174 1.00 0.00 H new ATOM 1889 N THR A 121 -12.701 -10.581 -1.032 1.00 0.00 N ATOM 1890 CA THR A 121 -11.649 -11.188 -1.897 1.00 0.00 C ATOM 1891 C THR A 121 -12.064 -11.076 -3.367 1.00 0.00 C ATOM 1892 O THR A 121 -11.332 -11.463 -4.257 1.00 0.00 O ATOM 1893 CB THR A 121 -11.476 -12.664 -1.531 1.00 0.00 C ATOM 1894 OG1 THR A 121 -12.750 -13.239 -1.277 1.00 0.00 O ATOM 1895 CG2 THR A 121 -10.602 -12.783 -0.281 1.00 0.00 C ATOM 0 H THR A 121 -13.092 -11.203 -0.324 1.00 0.00 H new ATOM 0 HA THR A 121 -10.708 -10.660 -1.744 1.00 0.00 H new ATOM 0 HB THR A 121 -10.997 -13.190 -2.357 1.00 0.00 H new ATOM 0 HG1 THR A 121 -12.642 -14.185 -1.044 1.00 0.00 H new ATOM 0 HG21 THR A 121 -10.480 -13.835 -0.021 1.00 0.00 H new ATOM 0 HG22 THR A 121 -9.625 -12.341 -0.477 1.00 0.00 H new ATOM 0 HG23 THR A 121 -11.078 -12.258 0.547 1.00 0.00 H new ATOM 1903 N SER A 122 -13.231 -10.556 -3.631 1.00 0.00 N ATOM 1904 CA SER A 122 -13.686 -10.428 -5.044 1.00 0.00 C ATOM 1905 C SER A 122 -13.240 -9.076 -5.609 1.00 0.00 C ATOM 1906 O SER A 122 -13.654 -8.677 -6.680 1.00 0.00 O ATOM 1907 CB SER A 122 -15.210 -10.524 -5.098 1.00 0.00 C ATOM 1908 OG SER A 122 -15.603 -11.875 -4.888 1.00 0.00 O ATOM 0 H SER A 122 -13.889 -10.215 -2.930 1.00 0.00 H new ATOM 0 HA SER A 122 -13.248 -11.230 -5.638 1.00 0.00 H new ATOM 0 HB2 SER A 122 -15.654 -9.882 -4.337 1.00 0.00 H new ATOM 0 HB3 SER A 122 -15.574 -10.173 -6.064 1.00 0.00 H new ATOM 0 HG SER A 122 -16.580 -11.940 -4.920 1.00 0.00 H new ATOM 1914 N TRP A 123 -12.398 -8.369 -4.903 1.00 0.00 N ATOM 1915 CA TRP A 123 -11.934 -7.048 -5.413 1.00 0.00 C ATOM 1916 C TRP A 123 -10.570 -6.706 -4.804 1.00 0.00 C ATOM 1917 O TRP A 123 -10.232 -7.151 -3.722 1.00 0.00 O ATOM 1918 CB TRP A 123 -12.948 -5.966 -5.037 1.00 0.00 C ATOM 1919 CG TRP A 123 -14.089 -5.998 -6.005 1.00 0.00 C ATOM 1920 CD1 TRP A 123 -13.977 -5.810 -7.341 1.00 0.00 C ATOM 1921 CD2 TRP A 123 -15.504 -6.224 -5.742 1.00 0.00 C ATOM 1922 NE1 TRP A 123 -15.231 -5.909 -7.913 1.00 0.00 N ATOM 1923 CE2 TRP A 123 -16.206 -6.162 -6.968 1.00 0.00 C ATOM 1924 CE3 TRP A 123 -16.238 -6.473 -4.569 1.00 0.00 C ATOM 1925 CZ2 TRP A 123 -17.589 -6.342 -7.030 1.00 0.00 C ATOM 1926 CZ3 TRP A 123 -17.630 -6.655 -4.627 1.00 0.00 C ATOM 1927 CH2 TRP A 123 -18.303 -6.590 -5.856 1.00 0.00 C ATOM 0 H TRP A 123 -12.014 -8.648 -4.000 1.00 0.00 H new ATOM 0 HA TRP A 123 -11.841 -7.096 -6.498 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -13.312 -6.130 -4.023 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -12.472 -4.985 -5.051 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -13.058 -5.615 -7.873 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -15.414 -5.808 -8.911 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -15.729 -6.525 -3.618 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 -18.103 -6.290 -7.979 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -18.185 -6.846 -3.720 1.00 0.00 H new ATOM 0 HH2 TRP A 123 -19.373 -6.732 -5.894 1.00 0.00 H new ATOM 1938 N TYR A 124 -9.790 -5.918 -5.501 1.00 0.00 N ATOM 1939 CA TYR A 124 -8.441 -5.531 -4.990 1.00 0.00 C ATOM 1940 C TYR A 124 -8.393 -4.017 -4.773 1.00 0.00 C ATOM 1941 O TYR A 124 -9.271 -3.291 -5.194 1.00 0.00 O ATOM 1942 CB TYR A 124 -7.378 -5.922 -6.020 1.00 0.00 C ATOM 1943 CG TYR A 124 -7.540 -7.377 -6.395 1.00 0.00 C ATOM 1944 CD1 TYR A 124 -8.606 -7.775 -7.212 1.00 0.00 C ATOM 1945 CD2 TYR A 124 -6.623 -8.326 -5.929 1.00 0.00 C ATOM 1946 CE1 TYR A 124 -8.754 -9.122 -7.562 1.00 0.00 C ATOM 1947 CE2 TYR A 124 -6.771 -9.674 -6.279 1.00 0.00 C ATOM 1948 CZ TYR A 124 -7.837 -10.071 -7.095 1.00 0.00 C ATOM 1949 OH TYR A 124 -7.982 -11.400 -7.440 1.00 0.00 O ATOM 0 H TYR A 124 -10.033 -5.523 -6.410 1.00 0.00 H new ATOM 0 HA TYR A 124 -8.249 -6.044 -4.047 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -7.470 -5.296 -6.907 1.00 0.00 H new ATOM 0 HB3 TYR A 124 -6.382 -5.751 -5.611 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -9.314 -7.043 -7.572 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -5.801 -8.019 -5.299 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -9.575 -9.429 -8.192 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -6.063 -10.407 -5.920 1.00 0.00 H new ATOM 0 HH TYR A 124 -7.261 -11.924 -7.033 1.00 0.00 H new ATOM 1959 N VAL A 125 -7.368 -3.536 -4.124 1.00 0.00 N ATOM 1960 CA VAL A 125 -7.258 -2.069 -3.886 1.00 0.00 C ATOM 1961 C VAL A 125 -6.442 -1.437 -5.016 1.00 0.00 C ATOM 1962 O VAL A 125 -5.397 -1.932 -5.389 1.00 0.00 O ATOM 1963 CB VAL A 125 -6.556 -1.820 -2.550 1.00 0.00 C ATOM 1964 CG1 VAL A 125 -6.421 -0.315 -2.317 1.00 0.00 C ATOM 1965 CG2 VAL A 125 -7.380 -2.438 -1.417 1.00 0.00 C ATOM 0 H VAL A 125 -6.602 -4.095 -3.748 1.00 0.00 H new ATOM 0 HA VAL A 125 -8.254 -1.626 -3.859 1.00 0.00 H new ATOM 0 HB VAL A 125 -5.566 -2.275 -2.571 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -5.921 -0.138 -1.365 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -5.835 0.127 -3.123 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -7.411 0.140 -2.297 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -6.880 -2.261 -0.465 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -8.370 -1.983 -1.397 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -7.477 -3.511 -1.581 1.00 0.00 H new ATOM 1975 N ALA A 126 -6.909 -0.351 -5.568 1.00 0.00 N ATOM 1976 CA ALA A 126 -6.154 0.300 -6.675 1.00 0.00 C ATOM 1977 C ALA A 126 -6.405 1.810 -6.656 1.00 0.00 C ATOM 1978 O ALA A 126 -7.164 2.310 -5.849 1.00 0.00 O ATOM 1979 CB ALA A 126 -6.619 -0.274 -8.014 1.00 0.00 C ATOM 0 H ALA A 126 -7.778 0.112 -5.301 1.00 0.00 H new ATOM 0 HA ALA A 126 -5.089 0.110 -6.544 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -6.067 0.202 -8.825 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.437 -1.348 -8.032 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -7.685 -0.085 -8.141 1.00 0.00 H new ATOM 1985 N LEU A 127 -5.768 2.533 -7.541 1.00 0.00 N ATOM 1986 CA LEU A 127 -5.952 4.015 -7.593 1.00 0.00 C ATOM 1987 C LEU A 127 -6.257 4.435 -9.034 1.00 0.00 C ATOM 1988 O LEU A 127 -5.947 3.731 -9.974 1.00 0.00 O ATOM 1989 CB LEU A 127 -4.666 4.704 -7.128 1.00 0.00 C ATOM 1990 CG LEU A 127 -4.374 4.329 -5.671 1.00 0.00 C ATOM 1991 CD1 LEU A 127 -3.031 4.929 -5.251 1.00 0.00 C ATOM 1992 CD2 LEU A 127 -5.479 4.873 -4.758 1.00 0.00 C ATOM 0 H LEU A 127 -5.123 2.157 -8.236 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.777 4.304 -6.942 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.832 4.406 -7.764 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -4.768 5.785 -7.222 1.00 0.00 H new ATOM 0 HG LEU A 127 -4.338 3.243 -5.583 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.822 4.663 -4.215 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -2.241 4.538 -5.892 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -3.072 6.014 -5.346 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -5.263 4.602 -3.725 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -5.523 5.958 -4.847 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -6.438 4.446 -5.053 1.00 0.00 H new ATOM 2004 N LYS A 128 -6.860 5.578 -9.214 1.00 0.00 N ATOM 2005 CA LYS A 128 -7.183 6.041 -10.594 1.00 0.00 C ATOM 2006 C LYS A 128 -6.048 6.928 -11.112 1.00 0.00 C ATOM 2007 O LYS A 128 -5.155 7.302 -10.378 1.00 0.00 O ATOM 2008 CB LYS A 128 -8.486 6.844 -10.573 1.00 0.00 C ATOM 2009 CG LYS A 128 -9.678 5.883 -10.549 1.00 0.00 C ATOM 2010 CD LYS A 128 -10.888 6.586 -9.930 1.00 0.00 C ATOM 2011 CE LYS A 128 -11.233 7.830 -10.751 1.00 0.00 C ATOM 2012 NZ LYS A 128 -12.712 8.005 -10.791 1.00 0.00 N ATOM 0 H LYS A 128 -7.143 6.211 -8.466 1.00 0.00 H new ATOM 0 HA LYS A 128 -7.299 5.177 -11.248 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -8.511 7.493 -9.698 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -8.543 7.489 -11.450 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -9.914 5.554 -11.561 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -9.428 4.991 -9.974 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -11.741 5.908 -9.903 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -10.671 6.867 -8.899 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -10.764 8.710 -10.312 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -10.840 7.731 -11.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -12.947 8.851 -11.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -13.149 7.169 -11.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -13.075 8.118 -9.823 1.00 0.00 H new ATOM 2026 N ARG A 129 -6.076 7.268 -12.371 1.00 0.00 N ATOM 2027 CA ARG A 129 -4.999 8.130 -12.935 1.00 0.00 C ATOM 2028 C ARG A 129 -5.254 9.587 -12.542 1.00 0.00 C ATOM 2029 O ARG A 129 -4.406 10.441 -12.705 1.00 0.00 O ATOM 2030 CB ARG A 129 -4.993 8.006 -14.460 1.00 0.00 C ATOM 2031 CG ARG A 129 -6.417 8.183 -14.992 1.00 0.00 C ATOM 2032 CD ARG A 129 -6.383 8.304 -16.517 1.00 0.00 C ATOM 2033 NE ARG A 129 -5.977 6.999 -17.110 1.00 0.00 N ATOM 2034 CZ ARG A 129 -6.166 6.774 -18.381 1.00 0.00 C ATOM 2035 NH1 ARG A 129 -6.709 7.691 -19.133 1.00 0.00 N ATOM 2036 NH2 ARG A 129 -5.810 5.631 -18.902 1.00 0.00 N ATOM 0 H ARG A 129 -6.798 6.986 -13.034 1.00 0.00 H new ATOM 0 HA ARG A 129 -4.034 7.811 -12.541 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -4.335 8.759 -14.894 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -4.602 7.032 -14.755 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -7.034 7.334 -14.698 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -6.871 9.073 -14.556 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -7.364 8.596 -16.891 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -5.683 9.085 -16.815 1.00 0.00 H new ATOM 0 HE ARG A 129 -5.552 6.282 -16.523 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -6.986 8.585 -18.727 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -6.856 7.514 -20.127 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -5.384 4.914 -18.315 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -5.958 5.455 -19.896 1.00 0.00 H new ATOM 2050 N THR A 130 -6.418 9.878 -12.029 1.00 0.00 N ATOM 2051 CA THR A 130 -6.725 11.279 -11.628 1.00 0.00 C ATOM 2052 C THR A 130 -6.358 11.482 -10.157 1.00 0.00 C ATOM 2053 O THR A 130 -6.912 12.324 -9.480 1.00 0.00 O ATOM 2054 CB THR A 130 -8.218 11.552 -11.825 1.00 0.00 C ATOM 2055 OG1 THR A 130 -8.560 12.782 -11.199 1.00 0.00 O ATOM 2056 CG2 THR A 130 -9.034 10.418 -11.205 1.00 0.00 C ATOM 0 H THR A 130 -7.169 9.206 -11.870 1.00 0.00 H new ATOM 0 HA THR A 130 -6.146 11.967 -12.244 1.00 0.00 H new ATOM 0 HB THR A 130 -8.438 11.612 -12.891 1.00 0.00 H new ATOM 0 HG1 THR A 130 -8.466 12.692 -10.228 1.00 0.00 H new ATOM 0 HG21 THR A 130 -10.097 10.615 -11.347 1.00 0.00 H new ATOM 0 HG22 THR A 130 -8.772 9.476 -11.687 1.00 0.00 H new ATOM 0 HG23 THR A 130 -8.816 10.353 -10.139 1.00 0.00 H new ATOM 2064 N GLY A 131 -5.428 10.715 -9.657 1.00 0.00 N ATOM 2065 CA GLY A 131 -5.027 10.866 -8.231 1.00 0.00 C ATOM 2066 C GLY A 131 -6.249 10.669 -7.333 1.00 0.00 C ATOM 2067 O GLY A 131 -6.525 11.471 -6.463 1.00 0.00 O ATOM 0 H GLY A 131 -4.929 9.991 -10.174 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -4.257 10.137 -7.980 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -4.597 11.854 -8.066 1.00 0.00 H new ATOM 2071 N GLN A 132 -6.981 9.605 -7.540 1.00 0.00 N ATOM 2072 CA GLN A 132 -8.190 9.346 -6.702 1.00 0.00 C ATOM 2073 C GLN A 132 -8.241 7.863 -6.326 1.00 0.00 C ATOM 2074 O GLN A 132 -7.528 7.047 -6.876 1.00 0.00 O ATOM 2075 CB GLN A 132 -9.447 9.714 -7.493 1.00 0.00 C ATOM 2076 CG GLN A 132 -9.539 11.235 -7.631 1.00 0.00 C ATOM 2077 CD GLN A 132 -9.864 11.853 -6.270 1.00 0.00 C ATOM 2078 OE1 GLN A 132 -10.793 11.314 -5.528 1.00 0.00 O flip ATOM 2079 NE2 GLN A 132 -9.269 12.837 -5.878 1.00 0.00 N flip ATOM 0 H GLN A 132 -6.793 8.902 -8.255 1.00 0.00 H new ATOM 0 HA GLN A 132 -8.141 9.950 -5.796 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -9.417 9.250 -8.479 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -10.333 9.330 -6.987 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -8.597 11.634 -8.008 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -10.310 11.499 -8.355 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -8.543 13.258 -6.457 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -9.495 13.242 -4.969 1.00 0.00 H new ATOM 2088 N TYR A 133 -9.078 7.509 -5.390 1.00 0.00 N ATOM 2089 CA TYR A 133 -9.175 6.080 -4.975 1.00 0.00 C ATOM 2090 C TYR A 133 -10.234 5.371 -5.822 1.00 0.00 C ATOM 2091 O TYR A 133 -11.389 5.746 -5.832 1.00 0.00 O ATOM 2092 CB TYR A 133 -9.567 6.004 -3.497 1.00 0.00 C ATOM 2093 CG TYR A 133 -11.004 6.435 -3.333 1.00 0.00 C ATOM 2094 CD1 TYR A 133 -11.330 7.797 -3.320 1.00 0.00 C ATOM 2095 CD2 TYR A 133 -12.012 5.474 -3.192 1.00 0.00 C ATOM 2096 CE1 TYR A 133 -12.662 8.196 -3.168 1.00 0.00 C ATOM 2097 CE2 TYR A 133 -13.344 5.874 -3.040 1.00 0.00 C ATOM 2098 CZ TYR A 133 -13.670 7.235 -3.027 1.00 0.00 C ATOM 2099 OH TYR A 133 -14.984 7.629 -2.877 1.00 0.00 O ATOM 0 H TYR A 133 -9.700 8.148 -4.894 1.00 0.00 H new ATOM 0 HA TYR A 133 -8.211 5.594 -5.121 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -9.437 4.987 -3.128 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -8.914 6.644 -2.904 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -10.553 8.539 -3.427 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -11.761 4.424 -3.201 1.00 0.00 H new ATOM 0 HE1 TYR A 133 -12.913 9.246 -3.159 1.00 0.00 H new ATOM 0 HE2 TYR A 133 -14.121 5.132 -2.933 1.00 0.00 H new ATOM 0 HH TYR A 133 -15.555 6.837 -2.793 1.00 0.00 H new ATOM 2109 N LYS A 134 -9.848 4.348 -6.535 1.00 0.00 N ATOM 2110 CA LYS A 134 -10.832 3.617 -7.382 1.00 0.00 C ATOM 2111 C LYS A 134 -11.808 2.854 -6.484 1.00 0.00 C ATOM 2112 O LYS A 134 -11.412 2.174 -5.557 1.00 0.00 O ATOM 2113 CB LYS A 134 -10.091 2.628 -8.285 1.00 0.00 C ATOM 2114 CG LYS A 134 -10.983 2.251 -9.471 1.00 0.00 C ATOM 2115 CD LYS A 134 -10.224 1.301 -10.399 1.00 0.00 C ATOM 2116 CE LYS A 134 -10.216 1.870 -11.818 1.00 0.00 C ATOM 2117 NZ LYS A 134 -9.491 0.935 -12.724 1.00 0.00 N ATOM 0 H LYS A 134 -8.894 3.987 -6.567 1.00 0.00 H new ATOM 0 HA LYS A 134 -11.383 4.329 -7.997 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -9.162 3.071 -8.642 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -9.822 1.735 -7.721 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.897 1.776 -9.115 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -11.281 3.147 -10.015 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -9.202 1.168 -10.044 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -10.694 0.318 -10.393 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -11.238 2.015 -12.169 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -9.735 2.848 -11.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -8.573 1.347 -12.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.337 0.029 -12.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -10.056 0.775 -13.582 1.00 0.00 H new ATOM 2131 N LEU A 135 -13.080 2.961 -6.750 1.00 0.00 N ATOM 2132 CA LEU A 135 -14.081 2.242 -5.911 1.00 0.00 C ATOM 2133 C LEU A 135 -13.725 0.754 -5.859 1.00 0.00 C ATOM 2134 O LEU A 135 -12.992 0.253 -6.689 1.00 0.00 O ATOM 2135 CB LEU A 135 -15.475 2.416 -6.523 1.00 0.00 C ATOM 2136 CG LEU A 135 -16.551 2.140 -5.463 1.00 0.00 C ATOM 2137 CD1 LEU A 135 -16.537 3.235 -4.388 1.00 0.00 C ATOM 2138 CD2 LEU A 135 -17.926 2.111 -6.134 1.00 0.00 C ATOM 0 H LEU A 135 -13.470 3.515 -7.512 1.00 0.00 H new ATOM 0 HA LEU A 135 -14.075 2.651 -4.901 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.587 3.428 -6.912 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -15.599 1.735 -7.365 1.00 0.00 H new ATOM 0 HG LEU A 135 -16.344 1.179 -4.992 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -17.306 3.025 -3.644 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -15.560 3.258 -3.904 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -16.735 4.202 -4.851 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -18.693 1.915 -5.384 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -18.120 3.073 -6.608 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -17.946 1.324 -6.888 1.00 0.00 H new ATOM 2150 N GLY A 136 -14.236 0.044 -4.891 1.00 0.00 N ATOM 2151 CA GLY A 136 -13.923 -1.409 -4.787 1.00 0.00 C ATOM 2152 C GLY A 136 -14.769 -2.193 -5.792 1.00 0.00 C ATOM 2153 O GLY A 136 -14.672 -3.400 -5.889 1.00 0.00 O ATOM 0 H GLY A 136 -14.857 0.407 -4.168 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -12.863 -1.577 -4.980 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -14.123 -1.762 -3.775 1.00 0.00 H new ATOM 2157 N SER A 137 -15.600 -1.517 -6.539 1.00 0.00 N ATOM 2158 CA SER A 137 -16.452 -2.225 -7.537 1.00 0.00 C ATOM 2159 C SER A 137 -15.768 -2.193 -8.907 1.00 0.00 C ATOM 2160 O SER A 137 -15.671 -3.196 -9.586 1.00 0.00 O ATOM 2161 CB SER A 137 -17.810 -1.530 -7.631 1.00 0.00 C ATOM 2162 OG SER A 137 -17.693 -0.380 -8.459 1.00 0.00 O ATOM 0 H SER A 137 -15.726 -0.505 -6.501 1.00 0.00 H new ATOM 0 HA SER A 137 -16.593 -3.260 -7.225 1.00 0.00 H new ATOM 0 HB2 SER A 137 -18.554 -2.213 -8.041 1.00 0.00 H new ATOM 0 HB3 SER A 137 -18.154 -1.243 -6.637 1.00 0.00 H new ATOM 0 HG SER A 137 -18.555 0.085 -8.497 1.00 0.00 H new ATOM 2168 N LYS A 138 -15.294 -1.048 -9.316 1.00 0.00 N ATOM 2169 CA LYS A 138 -14.618 -0.952 -10.640 1.00 0.00 C ATOM 2170 C LYS A 138 -13.249 -1.630 -10.564 1.00 0.00 C ATOM 2171 O LYS A 138 -12.565 -1.785 -11.556 1.00 0.00 O ATOM 2172 CB LYS A 138 -14.438 0.520 -11.014 1.00 0.00 C ATOM 2173 CG LYS A 138 -15.754 1.268 -10.791 1.00 0.00 C ATOM 2174 CD LYS A 138 -15.644 2.681 -11.367 1.00 0.00 C ATOM 2175 CE LYS A 138 -16.967 3.422 -11.162 1.00 0.00 C ATOM 2176 NZ LYS A 138 -17.694 3.508 -12.459 1.00 0.00 N ATOM 0 H LYS A 138 -15.346 -0.175 -8.791 1.00 0.00 H new ATOM 0 HA LYS A 138 -15.227 -1.448 -11.396 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -13.647 0.966 -10.410 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -14.130 0.606 -12.056 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -16.574 0.732 -11.269 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -15.982 1.315 -9.726 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -14.833 3.222 -10.879 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -15.402 2.634 -12.429 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -17.578 2.901 -10.425 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -16.779 4.422 -10.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -18.593 4.012 -12.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -17.112 4.023 -13.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -17.885 2.549 -12.814 1.00 0.00 H new ATOM 2190 N THR A 139 -12.843 -2.038 -9.392 1.00 0.00 N ATOM 2191 CA THR A 139 -11.519 -2.707 -9.253 1.00 0.00 C ATOM 2192 C THR A 139 -11.576 -4.089 -9.908 1.00 0.00 C ATOM 2193 O THR A 139 -12.624 -4.696 -10.009 1.00 0.00 O ATOM 2194 CB THR A 139 -11.177 -2.859 -7.769 1.00 0.00 C ATOM 2195 OG1 THR A 139 -12.348 -3.222 -7.051 1.00 0.00 O ATOM 2196 CG2 THR A 139 -10.636 -1.533 -7.230 1.00 0.00 C ATOM 0 H THR A 139 -13.371 -1.937 -8.525 1.00 0.00 H new ATOM 0 HA THR A 139 -10.754 -2.104 -9.742 1.00 0.00 H new ATOM 0 HB THR A 139 -10.420 -3.634 -7.647 1.00 0.00 H new ATOM 0 HG1 THR A 139 -12.692 -4.073 -7.395 1.00 0.00 H new ATOM 0 HG21 THR A 139 -10.393 -1.642 -6.173 1.00 0.00 H new ATOM 0 HG22 THR A 139 -9.738 -1.255 -7.782 1.00 0.00 H new ATOM 0 HG23 THR A 139 -11.391 -0.756 -7.350 1.00 0.00 H new ATOM 2204 N GLY A 140 -10.458 -4.590 -10.355 1.00 0.00 N ATOM 2205 CA GLY A 140 -10.451 -5.933 -11.003 1.00 0.00 C ATOM 2206 C GLY A 140 -9.299 -6.003 -12.013 1.00 0.00 C ATOM 2207 O GLY A 140 -8.566 -5.047 -12.174 1.00 0.00 O ATOM 0 H GLY A 140 -9.550 -4.129 -10.300 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -10.337 -6.712 -10.250 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -11.402 -6.112 -11.505 1.00 0.00 H new ATOM 2211 N PRO A 141 -9.171 -7.134 -12.666 1.00 0.00 N ATOM 2212 CA PRO A 141 -8.107 -7.337 -13.666 1.00 0.00 C ATOM 2213 C PRO A 141 -8.247 -6.319 -14.801 1.00 0.00 C ATOM 2214 O PRO A 141 -9.071 -5.429 -14.751 1.00 0.00 O ATOM 2215 CB PRO A 141 -8.325 -8.763 -14.188 1.00 0.00 C ATOM 2216 CG PRO A 141 -9.538 -9.363 -13.432 1.00 0.00 C ATOM 2217 CD PRO A 141 -10.065 -8.290 -12.465 1.00 0.00 C ATOM 0 HA PRO A 141 -7.110 -7.205 -13.245 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -8.511 -8.753 -15.262 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -7.435 -9.370 -14.025 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -10.317 -9.661 -14.134 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -9.243 -10.259 -12.885 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -11.101 -8.033 -12.685 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -10.036 -8.638 -11.433 1.00 0.00 H new ATOM 2225 N GLY A 142 -7.446 -6.445 -15.824 1.00 0.00 N ATOM 2226 CA GLY A 142 -7.532 -5.484 -16.960 1.00 0.00 C ATOM 2227 C GLY A 142 -6.873 -4.163 -16.562 1.00 0.00 C ATOM 2228 O GLY A 142 -6.142 -3.568 -17.328 1.00 0.00 O ATOM 0 H GLY A 142 -6.736 -7.171 -15.922 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -7.038 -5.899 -17.839 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -8.575 -5.316 -17.230 1.00 0.00 H new ATOM 2232 N GLN A 143 -7.126 -3.699 -15.369 1.00 0.00 N ATOM 2233 CA GLN A 143 -6.513 -2.416 -14.923 1.00 0.00 C ATOM 2234 C GLN A 143 -5.196 -2.704 -14.200 1.00 0.00 C ATOM 2235 O GLN A 143 -5.165 -3.384 -13.193 1.00 0.00 O ATOM 2236 CB GLN A 143 -7.470 -1.698 -13.969 1.00 0.00 C ATOM 2237 CG GLN A 143 -8.892 -1.762 -14.528 1.00 0.00 C ATOM 2238 CD GLN A 143 -8.916 -1.162 -15.935 1.00 0.00 C ATOM 2239 OE1 GLN A 143 -8.706 0.022 -16.107 1.00 0.00 O ATOM 2240 NE2 GLN A 143 -9.164 -1.936 -16.957 1.00 0.00 N ATOM 0 H GLN A 143 -7.730 -4.153 -14.684 1.00 0.00 H new ATOM 0 HA GLN A 143 -6.322 -1.785 -15.791 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -7.434 -2.162 -12.984 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -7.164 -0.659 -13.843 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -9.237 -2.796 -14.556 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -9.575 -1.216 -13.877 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -9.340 -2.930 -16.813 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -9.181 -1.546 -17.899 1.00 0.00 H new ATOM 2249 N LYS A 144 -4.108 -2.192 -14.705 1.00 0.00 N ATOM 2250 CA LYS A 144 -2.794 -2.436 -14.047 1.00 0.00 C ATOM 2251 C LYS A 144 -2.732 -1.656 -12.731 1.00 0.00 C ATOM 2252 O LYS A 144 -1.720 -1.635 -12.059 1.00 0.00 O ATOM 2253 CB LYS A 144 -1.666 -1.968 -14.969 1.00 0.00 C ATOM 2254 CG LYS A 144 -1.718 -2.754 -16.282 1.00 0.00 C ATOM 2255 CD LYS A 144 -1.104 -1.914 -17.403 1.00 0.00 C ATOM 2256 CE LYS A 144 0.316 -1.500 -17.013 1.00 0.00 C ATOM 2257 NZ LYS A 144 1.061 -1.073 -18.230 1.00 0.00 N ATOM 0 H LYS A 144 -4.072 -1.615 -15.545 1.00 0.00 H new ATOM 0 HA LYS A 144 -2.680 -3.501 -13.846 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -1.764 -0.901 -15.168 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -0.701 -2.114 -14.483 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -1.175 -3.693 -16.178 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -2.750 -3.007 -16.526 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -1.085 -2.485 -18.331 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -1.715 -1.030 -17.585 1.00 0.00 H new ATOM 0 HE2 LYS A 144 0.283 -0.685 -16.289 1.00 0.00 H new ATOM 0 HE3 LYS A 144 0.830 -2.333 -16.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 2.043 -1.412 -18.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 0.605 -1.473 -19.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 1.056 -0.035 -18.293 1.00 0.00 H new ATOM 2271 N ALA A 145 -3.806 -1.014 -12.361 1.00 0.00 N ATOM 2272 CA ALA A 145 -3.809 -0.236 -11.092 1.00 0.00 C ATOM 2273 C ALA A 145 -3.597 -1.184 -9.910 1.00 0.00 C ATOM 2274 O ALA A 145 -3.400 -0.759 -8.789 1.00 0.00 O ATOM 2275 CB ALA A 145 -5.150 0.484 -10.936 1.00 0.00 C ATOM 0 H ALA A 145 -4.682 -0.995 -12.884 1.00 0.00 H new ATOM 0 HA ALA A 145 -3.004 0.499 -11.116 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -5.151 1.053 -10.007 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -5.299 1.161 -11.777 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -5.956 -0.249 -10.913 1.00 0.00 H new ATOM 2281 N ILE A 146 -3.638 -2.465 -10.151 1.00 0.00 N ATOM 2282 CA ILE A 146 -3.439 -3.439 -9.040 1.00 0.00 C ATOM 2283 C ILE A 146 -1.962 -3.831 -8.962 1.00 0.00 C ATOM 2284 O ILE A 146 -1.565 -4.626 -8.134 1.00 0.00 O ATOM 2285 CB ILE A 146 -4.284 -4.687 -9.300 1.00 0.00 C ATOM 2286 CG1 ILE A 146 -3.839 -5.339 -10.611 1.00 0.00 C ATOM 2287 CG2 ILE A 146 -5.760 -4.293 -9.403 1.00 0.00 C ATOM 2288 CD1 ILE A 146 -4.951 -6.252 -11.133 1.00 0.00 C ATOM 0 H ILE A 146 -3.801 -2.880 -11.068 1.00 0.00 H new ATOM 0 HA ILE A 146 -3.743 -2.983 -8.098 1.00 0.00 H new ATOM 0 HB ILE A 146 -4.153 -5.392 -8.479 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -3.607 -4.572 -11.350 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -2.927 -5.914 -10.452 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -6.362 -5.183 -9.588 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -6.078 -3.827 -8.470 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -5.892 -3.588 -10.224 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -4.633 -6.716 -12.067 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -5.161 -7.027 -10.396 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -5.852 -5.664 -11.308 1.00 0.00 H new ATOM 2300 N LEU A 147 -1.145 -3.281 -9.818 1.00 0.00 N ATOM 2301 CA LEU A 147 0.306 -3.626 -9.791 1.00 0.00 C ATOM 2302 C LEU A 147 1.055 -2.629 -8.905 1.00 0.00 C ATOM 2303 O LEU A 147 1.508 -1.598 -9.363 1.00 0.00 O ATOM 2304 CB LEU A 147 0.873 -3.570 -11.211 1.00 0.00 C ATOM 2305 CG LEU A 147 0.059 -4.486 -12.130 1.00 0.00 C ATOM 2306 CD1 LEU A 147 0.632 -4.428 -13.549 1.00 0.00 C ATOM 2307 CD2 LEU A 147 0.129 -5.926 -11.617 1.00 0.00 C ATOM 0 H LEU A 147 -1.418 -2.608 -10.534 1.00 0.00 H new ATOM 0 HA LEU A 147 0.429 -4.632 -9.390 1.00 0.00 H new ATOM 0 HB2 LEU A 147 0.844 -2.546 -11.584 1.00 0.00 H new ATOM 0 HB3 LEU A 147 1.918 -3.879 -11.208 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.979 -4.153 -12.139 1.00 0.00 H new ATOM 0 HD11 LEU A 147 0.052 -5.080 -14.202 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.581 -3.404 -13.920 1.00 0.00 H new ATOM 0 HD13 LEU A 147 1.671 -4.758 -13.536 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -0.451 -6.575 -12.273 1.00 0.00 H new ATOM 0 HD22 LEU A 147 1.167 -6.258 -11.604 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -0.279 -5.973 -10.607 1.00 0.00 H new ATOM 2319 N PHE A 148 1.195 -2.931 -7.643 1.00 0.00 N ATOM 2320 CA PHE A 148 1.921 -2.004 -6.727 1.00 0.00 C ATOM 2321 C PHE A 148 3.380 -2.450 -6.613 1.00 0.00 C ATOM 2322 O PHE A 148 3.744 -3.524 -7.049 1.00 0.00 O ATOM 2323 CB PHE A 148 1.267 -2.038 -5.344 1.00 0.00 C ATOM 2324 CG PHE A 148 0.010 -1.204 -5.360 1.00 0.00 C ATOM 2325 CD1 PHE A 148 -1.174 -1.733 -5.885 1.00 0.00 C ATOM 2326 CD2 PHE A 148 0.029 0.100 -4.852 1.00 0.00 C ATOM 2327 CE1 PHE A 148 -2.341 -0.960 -5.901 1.00 0.00 C ATOM 2328 CE2 PHE A 148 -1.137 0.875 -4.868 1.00 0.00 C ATOM 2329 CZ PHE A 148 -2.322 0.344 -5.392 1.00 0.00 C ATOM 0 H PHE A 148 0.838 -3.780 -7.206 1.00 0.00 H new ATOM 0 HA PHE A 148 1.878 -0.989 -7.122 1.00 0.00 H new ATOM 0 HB2 PHE A 148 1.031 -3.065 -5.067 1.00 0.00 H new ATOM 0 HB3 PHE A 148 1.959 -1.657 -4.593 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -1.188 -2.739 -6.278 1.00 0.00 H new ATOM 0 HD2 PHE A 148 0.943 0.509 -4.448 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -3.255 -1.369 -6.306 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -1.122 1.881 -4.477 1.00 0.00 H new ATOM 0 HZ PHE A 148 -3.222 0.941 -5.403 1.00 0.00 H new ATOM 2339 N LEU A 149 4.218 -1.633 -6.033 1.00 0.00 N ATOM 2340 CA LEU A 149 5.655 -2.009 -5.892 1.00 0.00 C ATOM 2341 C LEU A 149 6.189 -1.502 -4.546 1.00 0.00 C ATOM 2342 O LEU A 149 6.977 -0.578 -4.510 1.00 0.00 O ATOM 2343 CB LEU A 149 6.457 -1.365 -7.030 1.00 0.00 C ATOM 2344 CG LEU A 149 7.896 -1.900 -7.024 1.00 0.00 C ATOM 2345 CD1 LEU A 149 7.908 -3.401 -7.332 1.00 0.00 C ATOM 2346 CD2 LEU A 149 8.713 -1.162 -8.088 1.00 0.00 C ATOM 0 H LEU A 149 3.969 -0.721 -5.650 1.00 0.00 H new ATOM 0 HA LEU A 149 5.755 -3.094 -5.936 1.00 0.00 H new ATOM 0 HB2 LEU A 149 5.984 -1.581 -7.988 1.00 0.00 H new ATOM 0 HB3 LEU A 149 6.462 -0.281 -6.915 1.00 0.00 H new ATOM 0 HG LEU A 149 8.330 -1.737 -6.038 1.00 0.00 H new ATOM 0 HD11 LEU A 149 8.935 -3.766 -7.324 1.00 0.00 H new ATOM 0 HD12 LEU A 149 7.329 -3.932 -6.577 1.00 0.00 H new ATOM 0 HD13 LEU A 149 7.469 -3.574 -8.314 1.00 0.00 H new ATOM 0 HD21 LEU A 149 9.736 -1.539 -8.087 1.00 0.00 H new ATOM 0 HD22 LEU A 149 8.266 -1.326 -9.069 1.00 0.00 H new ATOM 0 HD23 LEU A 149 8.719 -0.095 -7.867 1.00 0.00 H new ATOM 2358 N PRO A 150 5.740 -2.114 -3.475 1.00 0.00 N ATOM 2359 CA PRO A 150 6.167 -1.721 -2.119 1.00 0.00 C ATOM 2360 C PRO A 150 7.677 -1.924 -1.959 1.00 0.00 C ATOM 2361 O PRO A 150 8.158 -3.036 -1.873 1.00 0.00 O ATOM 2362 CB PRO A 150 5.390 -2.651 -1.177 1.00 0.00 C ATOM 2363 CG PRO A 150 4.474 -3.546 -2.049 1.00 0.00 C ATOM 2364 CD PRO A 150 4.780 -3.234 -3.521 1.00 0.00 C ATOM 0 HA PRO A 150 5.968 -0.670 -1.909 1.00 0.00 H new ATOM 0 HB2 PRO A 150 6.076 -3.262 -0.591 1.00 0.00 H new ATOM 0 HB3 PRO A 150 4.797 -2.071 -0.470 1.00 0.00 H new ATOM 0 HG2 PRO A 150 4.654 -4.600 -1.836 1.00 0.00 H new ATOM 0 HG3 PRO A 150 3.425 -3.351 -1.827 1.00 0.00 H new ATOM 0 HD2 PRO A 150 5.205 -4.099 -4.029 1.00 0.00 H new ATOM 0 HD3 PRO A 150 3.876 -2.958 -4.064 1.00 0.00 H new ATOM 2372 N MET A 151 8.424 -0.855 -1.919 1.00 0.00 N ATOM 2373 CA MET A 151 9.901 -0.982 -1.764 1.00 0.00 C ATOM 2374 C MET A 151 10.270 -0.880 -0.284 1.00 0.00 C ATOM 2375 O MET A 151 10.153 0.166 0.325 1.00 0.00 O ATOM 2376 CB MET A 151 10.593 0.142 -2.540 1.00 0.00 C ATOM 2377 CG MET A 151 9.932 0.301 -3.909 1.00 0.00 C ATOM 2378 SD MET A 151 11.023 1.250 -4.998 1.00 0.00 S ATOM 2379 CE MET A 151 9.783 1.685 -6.241 1.00 0.00 C ATOM 0 H MET A 151 8.075 0.101 -1.987 1.00 0.00 H new ATOM 0 HA MET A 151 10.225 -1.947 -2.153 1.00 0.00 H new ATOM 0 HB2 MET A 151 10.528 1.076 -1.983 1.00 0.00 H new ATOM 0 HB3 MET A 151 11.652 -0.084 -2.660 1.00 0.00 H new ATOM 0 HG2 MET A 151 9.729 -0.678 -4.343 1.00 0.00 H new ATOM 0 HG3 MET A 151 8.973 0.808 -3.805 1.00 0.00 H new ATOM 0 HE1 MET A 151 10.184 1.495 -7.237 1.00 0.00 H new ATOM 0 HE2 MET A 151 8.888 1.082 -6.089 1.00 0.00 H new ATOM 0 HE3 MET A 151 9.529 2.741 -6.147 1.00 0.00 H new ATOM 2389 N SER A 152 10.716 -1.957 0.302 1.00 0.00 N ATOM 2390 CA SER A 152 11.093 -1.922 1.743 1.00 0.00 C ATOM 2391 C SER A 152 12.312 -1.015 1.928 1.00 0.00 C ATOM 2392 O SER A 152 13.182 -0.950 1.082 1.00 0.00 O ATOM 2393 CB SER A 152 11.432 -3.336 2.215 1.00 0.00 C ATOM 2394 OG SER A 152 11.836 -3.293 3.576 1.00 0.00 O ATOM 0 H SER A 152 10.836 -2.861 -0.156 1.00 0.00 H new ATOM 0 HA SER A 152 10.259 -1.534 2.329 1.00 0.00 H new ATOM 0 HB2 SER A 152 10.565 -3.987 2.102 1.00 0.00 H new ATOM 0 HB3 SER A 152 12.228 -3.756 1.600 1.00 0.00 H new ATOM 0 HG SER A 152 12.052 -4.199 3.882 1.00 0.00 H new ATOM 2400 N ALA A 153 12.383 -0.317 3.028 1.00 0.00 N ATOM 2401 CA ALA A 153 13.547 0.583 3.265 1.00 0.00 C ATOM 2402 C ALA A 153 14.697 -0.221 3.876 1.00 0.00 C ATOM 2403 O ALA A 153 15.198 0.101 4.934 1.00 0.00 O ATOM 2404 CB ALA A 153 13.140 1.702 4.226 1.00 0.00 C ATOM 0 H ALA A 153 11.686 -0.331 3.772 1.00 0.00 H new ATOM 0 HA ALA A 153 13.869 1.017 2.318 1.00 0.00 H new ATOM 0 HB1 ALA A 153 13.991 2.360 4.399 1.00 0.00 H new ATOM 0 HB2 ALA A 153 12.321 2.275 3.791 1.00 0.00 H new ATOM 0 HB3 ALA A 153 12.817 1.269 5.173 1.00 0.00 H new ATOM 2410 N LYS A 154 15.118 -1.266 3.216 1.00 0.00 N ATOM 2411 CA LYS A 154 16.235 -2.088 3.760 1.00 0.00 C ATOM 2412 C LYS A 154 17.558 -1.344 3.568 1.00 0.00 C ATOM 2413 O LYS A 154 18.041 -0.677 4.462 1.00 0.00 O ATOM 2414 CB LYS A 154 16.290 -3.427 3.018 1.00 0.00 C ATOM 2415 CG LYS A 154 14.962 -4.165 3.197 1.00 0.00 C ATOM 2416 CD LYS A 154 15.228 -5.593 3.682 1.00 0.00 C ATOM 2417 CE LYS A 154 15.736 -5.555 5.125 1.00 0.00 C ATOM 2418 NZ LYS A 154 14.695 -6.115 6.032 1.00 0.00 N ATOM 0 H LYS A 154 14.737 -1.585 2.325 1.00 0.00 H new ATOM 0 HA LYS A 154 16.071 -2.267 4.823 1.00 0.00 H new ATOM 0 HB2 LYS A 154 16.485 -3.260 1.959 1.00 0.00 H new ATOM 0 HB3 LYS A 154 17.110 -4.034 3.402 1.00 0.00 H new ATOM 0 HG2 LYS A 154 14.335 -3.637 3.916 1.00 0.00 H new ATOM 0 HG3 LYS A 154 14.416 -4.186 2.254 1.00 0.00 H new ATOM 0 HD2 LYS A 154 14.315 -6.185 3.622 1.00 0.00 H new ATOM 0 HD3 LYS A 154 15.964 -6.076 3.039 1.00 0.00 H new ATOM 0 HE2 LYS A 154 16.658 -6.130 5.213 1.00 0.00 H new ATOM 0 HE3 LYS A 154 15.971 -4.530 5.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 14.746 -5.639 6.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 13.754 -5.963 5.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 14.857 -7.134 6.159 1.00 0.00 H new ATOM 2432 N SER A 155 18.147 -1.451 2.408 1.00 0.00 N ATOM 2433 CA SER A 155 19.438 -0.749 2.161 1.00 0.00 C ATOM 2434 C SER A 155 19.258 0.750 2.406 1.00 0.00 C ATOM 2435 O SER A 155 18.882 1.442 1.474 1.00 0.00 O ATOM 2436 CB SER A 155 19.874 -0.980 0.714 1.00 0.00 C ATOM 2437 OG SER A 155 21.224 -0.566 0.558 1.00 0.00 O ATOM 2438 OXT SER A 155 19.502 1.182 3.521 1.00 0.00 O ATOM 0 H SER A 155 17.790 -1.994 1.622 1.00 0.00 H new ATOM 0 HA SER A 155 20.199 -1.139 2.837 1.00 0.00 H new ATOM 0 HB2 SER A 155 19.773 -2.034 0.456 1.00 0.00 H new ATOM 0 HB3 SER A 155 19.230 -0.422 0.035 1.00 0.00 H new ATOM 0 HG SER A 155 21.507 -0.714 -0.369 1.00 0.00 H new TER 2444 SER A 155