USER MOD reduce.3.24.130724 H: found=0, std=0, add=1225, rem=0, adj=34 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 130 THR OG1 : rot -59:sc= 1.61 USER MOD Set 1.2: A 132 GLN : amide:sc= -9.51! C(o=-7.9!,f=-23!) USER MOD Set 2.1: A 109 SER OG : rot 30:sc= -0.0196 USER MOD Set 2.2: A 110 ASN : amide:sc= -0.966! C(o=-0.99!,f=-7!) USER MOD Set 3.1: A 98 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 101 CYS SG : rot -74:sc= 0.343 USER MOD Set 4.1: A 75 LYS NZ :NH3+ 179:sc= 0.965 (180deg=0) USER MOD Set 4.2: A 82 TYR OH : rot -178:sc= 0.545 USER MOD Set 5.1: A 63 GLN : amide:sc= 0 K(o=-0.71,f=0) USER MOD Set 5.2: A 65 GLN : amide:sc= -0.713 K(o=-0.71,f=0) USER MOD Set 6.1: A 34 CYS SG : rot 180:sc= -0.328 USER MOD Set 6.2: A 36 ASN : amide:sc= -9.08! C(o=-9.4!,f=-4.6!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= -0.106 USER MOD Single : A 8 THR OG1 : rot -59:sc= 0.356 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HD1:sc= -0.472 X(o=-0.47,f=0.0022) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 HIS : no HD1:sc= -0.93 X(o=-0.93,f=-0.89) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= -0.488 USER MOD Single : A 59 HIS : no HD1:sc= 0.592 K(o=0.59,f=-4.5!) USER MOD Single : A 61 LYS NZ :NH3+ -153:sc=-0.00598 (180deg=-0.602) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -4.18! C(o=-4.2!,f=-3.7!) USER MOD Single : A 85 MET CE :methyl -179:sc= -3.48! (180deg=-3.57!) USER MOD Single : A 86 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.188) USER MOD Single : A 94 SER OG : rot 125:sc= 0.437 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 111 ASN : amide:sc= -0.221 X(o=-0.22,f=-0.22) USER MOD Single : A 112 TYR OH : rot 180:sc= -0.86 USER MOD Single : A 113 ASN : amide:sc= -2! C(o=-2!,f=-6.4!) USER MOD Single : A 114 THR OG1 : rot -15:sc= 0.505 USER MOD Single : A 115 TYR OH : rot 29:sc= 0.19 USER MOD Single : A 117 SER OG : rot 120:sc= -0.0389 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0.00119 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 TYR OH : rot 165:sc= -3.6! USER MOD Single : A 128 LYS NZ :NH3+ -112:sc= -0.0551 (180deg=-4.43!) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ -134:sc= 0.0169 (180deg=-0.363) USER MOD Single : A 137 SER OG : rot 170:sc= -0.526 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 THR OG1 : rot 75:sc= 0.0557 USER MOD Single : A 143 GLN : amide:sc= -5.69! K(o=-5.7!,f=-0.84) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 152 SER OG : rot 180:sc= -0.0937 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.501 18.845 -1.268 1.00 0.00 N ATOM 2 CA MET A 1 19.448 19.894 -1.157 1.00 0.00 C ATOM 3 C MET A 1 18.122 19.343 -1.688 1.00 0.00 C ATOM 4 O MET A 1 17.149 19.241 -0.967 1.00 0.00 O ATOM 5 CB MET A 1 19.858 21.117 -1.980 1.00 0.00 C ATOM 6 CG MET A 1 20.476 22.169 -1.057 1.00 0.00 C ATOM 7 SD MET A 1 21.435 23.347 -2.041 1.00 0.00 S ATOM 8 CE MET A 1 21.324 24.744 -0.896 1.00 0.00 C ATOM 0 H1 MET A 1 21.402 19.218 -0.908 1.00 0.00 H new ATOM 0 H2 MET A 1 20.223 18.013 -0.709 1.00 0.00 H new ATOM 0 H3 MET A 1 20.614 18.571 -2.265 1.00 0.00 H new ATOM 0 HA MET A 1 19.330 20.182 -0.112 1.00 0.00 H new ATOM 0 HB2 MET A 1 20.574 20.828 -2.750 1.00 0.00 H new ATOM 0 HB3 MET A 1 18.990 21.532 -2.492 1.00 0.00 H new ATOM 0 HG2 MET A 1 19.693 22.691 -0.507 1.00 0.00 H new ATOM 0 HG3 MET A 1 21.118 21.688 -0.319 1.00 0.00 H new ATOM 0 HE1 MET A 1 21.858 25.598 -1.311 1.00 0.00 H new ATOM 0 HE2 MET A 1 20.277 25.009 -0.746 1.00 0.00 H new ATOM 0 HE3 MET A 1 21.769 24.467 0.060 1.00 0.00 H new ATOM 20 N ALA A 2 18.076 18.989 -2.942 1.00 0.00 N ATOM 21 CA ALA A 2 16.814 18.446 -3.518 1.00 0.00 C ATOM 22 C ALA A 2 16.754 16.936 -3.283 1.00 0.00 C ATOM 23 O ALA A 2 16.094 16.212 -4.001 1.00 0.00 O ATOM 24 CB ALA A 2 16.773 18.731 -5.020 1.00 0.00 C ATOM 0 H ALA A 2 18.858 19.052 -3.593 1.00 0.00 H new ATOM 0 HA ALA A 2 15.961 18.923 -3.035 1.00 0.00 H new ATOM 0 HB1 ALA A 2 15.849 18.333 -5.441 1.00 0.00 H new ATOM 0 HB2 ALA A 2 16.814 19.807 -5.187 1.00 0.00 H new ATOM 0 HB3 ALA A 2 17.626 18.256 -5.504 1.00 0.00 H new ATOM 30 N GLU A 3 17.439 16.454 -2.282 1.00 0.00 N ATOM 31 CA GLU A 3 17.421 14.990 -2.003 1.00 0.00 C ATOM 32 C GLU A 3 16.310 14.676 -0.999 1.00 0.00 C ATOM 33 O GLU A 3 16.340 15.117 0.133 1.00 0.00 O ATOM 34 CB GLU A 3 18.771 14.566 -1.418 1.00 0.00 C ATOM 35 CG GLU A 3 19.901 15.185 -2.242 1.00 0.00 C ATOM 36 CD GLU A 3 21.232 14.541 -1.849 1.00 0.00 C ATOM 37 OE1 GLU A 3 21.203 13.582 -1.095 1.00 0.00 O ATOM 38 OE2 GLU A 3 22.256 15.018 -2.308 1.00 0.00 O ATOM 0 H GLU A 3 18.010 17.010 -1.646 1.00 0.00 H new ATOM 0 HA GLU A 3 17.239 14.446 -2.929 1.00 0.00 H new ATOM 0 HB2 GLU A 3 18.846 14.887 -0.379 1.00 0.00 H new ATOM 0 HB3 GLU A 3 18.856 13.479 -1.423 1.00 0.00 H new ATOM 0 HG2 GLU A 3 19.713 15.037 -3.305 1.00 0.00 H new ATOM 0 HG3 GLU A 3 19.942 16.261 -2.073 1.00 0.00 H new ATOM 45 N GLY A 4 15.328 13.918 -1.405 1.00 0.00 N ATOM 46 CA GLY A 4 14.217 13.576 -0.473 1.00 0.00 C ATOM 47 C GLY A 4 14.794 13.035 0.835 1.00 0.00 C ATOM 48 O GLY A 4 14.918 13.747 1.811 1.00 0.00 O ATOM 0 H GLY A 4 15.247 13.521 -2.341 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.609 14.459 -0.276 1.00 0.00 H new ATOM 0 HA3 GLY A 4 13.562 12.833 -0.928 1.00 0.00 H new ATOM 52 N GLU A 5 15.149 11.779 0.863 1.00 0.00 N ATOM 53 CA GLU A 5 15.718 11.193 2.109 1.00 0.00 C ATOM 54 C GLU A 5 16.751 10.125 1.743 1.00 0.00 C ATOM 55 O GLU A 5 17.908 10.419 1.517 1.00 0.00 O ATOM 56 CB GLU A 5 14.596 10.558 2.933 1.00 0.00 C ATOM 57 CG GLU A 5 14.019 11.596 3.896 1.00 0.00 C ATOM 58 CD GLU A 5 12.847 10.984 4.666 1.00 0.00 C ATOM 59 OE1 GLU A 5 11.731 11.087 4.186 1.00 0.00 O ATOM 60 OE2 GLU A 5 13.088 10.422 5.722 1.00 0.00 O ATOM 0 H GLU A 5 15.069 11.134 0.077 1.00 0.00 H new ATOM 0 HA GLU A 5 16.198 11.977 2.694 1.00 0.00 H new ATOM 0 HB2 GLU A 5 13.813 10.184 2.273 1.00 0.00 H new ATOM 0 HB3 GLU A 5 14.979 9.703 3.490 1.00 0.00 H new ATOM 0 HG2 GLU A 5 14.789 11.930 4.591 1.00 0.00 H new ATOM 0 HG3 GLU A 5 13.685 12.474 3.343 1.00 0.00 H new ATOM 67 N ILE A 6 16.343 8.887 1.685 1.00 0.00 N ATOM 68 CA ILE A 6 17.306 7.803 1.334 1.00 0.00 C ATOM 69 C ILE A 6 17.834 8.035 -0.083 1.00 0.00 C ATOM 70 O ILE A 6 17.432 8.959 -0.762 1.00 0.00 O ATOM 71 CB ILE A 6 16.618 6.433 1.400 1.00 0.00 C ATOM 72 CG1 ILE A 6 15.145 6.590 1.798 1.00 0.00 C ATOM 73 CG2 ILE A 6 17.326 5.560 2.437 1.00 0.00 C ATOM 74 CD1 ILE A 6 14.388 7.334 0.694 1.00 0.00 C ATOM 0 H ILE A 6 15.387 8.579 1.865 1.00 0.00 H new ATOM 0 HA ILE A 6 18.130 7.819 2.047 1.00 0.00 H new ATOM 0 HB ILE A 6 16.672 5.966 0.416 1.00 0.00 H new ATOM 0 HG12 ILE A 6 14.697 5.610 1.963 1.00 0.00 H new ATOM 0 HG13 ILE A 6 15.069 7.138 2.737 1.00 0.00 H new ATOM 0 HG21 ILE A 6 16.839 4.586 2.486 1.00 0.00 H new ATOM 0 HG22 ILE A 6 18.370 5.430 2.151 1.00 0.00 H new ATOM 0 HG23 ILE A 6 17.274 6.041 3.414 1.00 0.00 H new ATOM 0 HD11 ILE A 6 13.342 7.444 0.980 1.00 0.00 H new ATOM 0 HD12 ILE A 6 14.830 8.320 0.551 1.00 0.00 H new ATOM 0 HD13 ILE A 6 14.452 6.769 -0.236 1.00 0.00 H new ATOM 86 N THR A 7 18.730 7.201 -0.535 1.00 0.00 N ATOM 87 CA THR A 7 19.282 7.374 -1.909 1.00 0.00 C ATOM 88 C THR A 7 19.602 6.001 -2.503 1.00 0.00 C ATOM 89 O THR A 7 20.739 5.695 -2.805 1.00 0.00 O ATOM 90 CB THR A 7 20.560 8.213 -1.844 1.00 0.00 C ATOM 91 OG1 THR A 7 20.384 9.268 -0.908 1.00 0.00 O ATOM 92 CG2 THR A 7 20.861 8.797 -3.225 1.00 0.00 C ATOM 0 H THR A 7 19.103 6.408 -0.013 1.00 0.00 H new ATOM 0 HA THR A 7 18.548 7.880 -2.536 1.00 0.00 H new ATOM 0 HB THR A 7 21.393 7.584 -1.530 1.00 0.00 H new ATOM 0 HG1 THR A 7 21.202 9.806 -0.864 1.00 0.00 H new ATOM 0 HG21 THR A 7 21.772 9.394 -3.177 1.00 0.00 H new ATOM 0 HG22 THR A 7 20.996 7.987 -3.941 1.00 0.00 H new ATOM 0 HG23 THR A 7 20.030 9.427 -3.543 1.00 0.00 H new ATOM 100 N THR A 8 18.608 5.173 -2.673 1.00 0.00 N ATOM 101 CA THR A 8 18.851 3.819 -3.248 1.00 0.00 C ATOM 102 C THR A 8 17.658 3.414 -4.114 1.00 0.00 C ATOM 103 O THR A 8 16.937 2.486 -3.801 1.00 0.00 O ATOM 104 CB THR A 8 19.026 2.807 -2.112 1.00 0.00 C ATOM 105 OG1 THR A 8 19.195 1.507 -2.662 1.00 0.00 O ATOM 106 CG2 THR A 8 17.789 2.827 -1.213 1.00 0.00 C ATOM 0 H THR A 8 17.636 5.376 -2.438 1.00 0.00 H new ATOM 0 HA THR A 8 19.754 3.838 -3.859 1.00 0.00 H new ATOM 0 HB THR A 8 19.904 3.070 -1.522 1.00 0.00 H new ATOM 0 HG1 THR A 8 18.410 1.275 -3.201 1.00 0.00 H new ATOM 0 HG21 THR A 8 17.915 2.106 -0.405 1.00 0.00 H new ATOM 0 HG22 THR A 8 17.661 3.825 -0.793 1.00 0.00 H new ATOM 0 HG23 THR A 8 16.909 2.564 -1.800 1.00 0.00 H new ATOM 114 N LEU A 9 17.442 4.103 -5.201 1.00 0.00 N ATOM 115 CA LEU A 9 16.295 3.758 -6.085 1.00 0.00 C ATOM 116 C LEU A 9 16.386 2.292 -6.548 1.00 0.00 C ATOM 117 O LEU A 9 15.408 1.577 -6.457 1.00 0.00 O ATOM 118 CB LEU A 9 16.273 4.693 -7.298 1.00 0.00 C ATOM 119 CG LEU A 9 14.980 5.510 -7.289 1.00 0.00 C ATOM 120 CD1 LEU A 9 15.013 6.530 -8.428 1.00 0.00 C ATOM 121 CD2 LEU A 9 13.784 4.574 -7.478 1.00 0.00 C ATOM 0 H LEU A 9 18.011 4.890 -5.514 1.00 0.00 H new ATOM 0 HA LEU A 9 15.371 3.882 -5.520 1.00 0.00 H new ATOM 0 HB2 LEU A 9 17.136 5.358 -7.273 1.00 0.00 H new ATOM 0 HB3 LEU A 9 16.343 4.114 -8.219 1.00 0.00 H new ATOM 0 HG LEU A 9 14.887 6.032 -6.336 1.00 0.00 H new ATOM 0 HD11 LEU A 9 14.092 7.112 -8.422 1.00 0.00 H new ATOM 0 HD12 LEU A 9 15.865 7.197 -8.295 1.00 0.00 H new ATOM 0 HD13 LEU A 9 15.106 6.009 -9.381 1.00 0.00 H new ATOM 0 HD21 LEU A 9 12.862 5.156 -7.472 1.00 0.00 H new ATOM 0 HD22 LEU A 9 13.877 4.052 -8.430 1.00 0.00 H new ATOM 0 HD23 LEU A 9 13.760 3.847 -6.667 1.00 0.00 H new ATOM 133 N PRO A 10 17.538 1.866 -7.036 1.00 0.00 N ATOM 134 CA PRO A 10 17.695 0.476 -7.505 1.00 0.00 C ATOM 135 C PRO A 10 17.546 -0.494 -6.331 1.00 0.00 C ATOM 136 O PRO A 10 17.146 -0.115 -5.248 1.00 0.00 O ATOM 137 CB PRO A 10 19.113 0.407 -8.087 1.00 0.00 C ATOM 138 CG PRO A 10 19.758 1.805 -7.919 1.00 0.00 C ATOM 139 CD PRO A 10 18.756 2.697 -7.169 1.00 0.00 C ATOM 0 HA PRO A 10 16.942 0.201 -8.243 1.00 0.00 H new ATOM 0 HB2 PRO A 10 19.702 -0.351 -7.571 1.00 0.00 H new ATOM 0 HB3 PRO A 10 19.081 0.124 -9.139 1.00 0.00 H new ATOM 0 HG2 PRO A 10 20.693 1.730 -7.364 1.00 0.00 H new ATOM 0 HG3 PRO A 10 19.998 2.234 -8.892 1.00 0.00 H new ATOM 0 HD2 PRO A 10 19.142 2.992 -6.193 1.00 0.00 H new ATOM 0 HD3 PRO A 10 18.551 3.614 -7.722 1.00 0.00 H new ATOM 147 N ALA A 11 17.863 -1.742 -6.538 1.00 0.00 N ATOM 148 CA ALA A 11 17.740 -2.738 -5.435 1.00 0.00 C ATOM 149 C ALA A 11 18.864 -3.769 -5.549 1.00 0.00 C ATOM 150 O ALA A 11 18.700 -4.818 -6.139 1.00 0.00 O ATOM 151 CB ALA A 11 16.387 -3.445 -5.538 1.00 0.00 C ATOM 0 H ALA A 11 18.202 -2.116 -7.424 1.00 0.00 H new ATOM 0 HA ALA A 11 17.813 -2.228 -4.475 1.00 0.00 H new ATOM 0 HB1 ALA A 11 16.295 -4.174 -4.733 1.00 0.00 H new ATOM 0 HB2 ALA A 11 15.586 -2.711 -5.456 1.00 0.00 H new ATOM 0 HB3 ALA A 11 16.315 -3.955 -6.499 1.00 0.00 H new ATOM 157 N LEU A 12 20.005 -3.480 -4.987 1.00 0.00 N ATOM 158 CA LEU A 12 21.136 -4.443 -5.062 1.00 0.00 C ATOM 159 C LEU A 12 21.093 -5.425 -3.878 1.00 0.00 C ATOM 160 O LEU A 12 21.230 -6.615 -4.082 1.00 0.00 O ATOM 161 CB LEU A 12 22.468 -3.685 -5.065 1.00 0.00 C ATOM 162 CG LEU A 12 23.230 -3.992 -6.355 1.00 0.00 C ATOM 163 CD1 LEU A 12 22.447 -3.448 -7.552 1.00 0.00 C ATOM 164 CD2 LEU A 12 24.606 -3.327 -6.302 1.00 0.00 C ATOM 0 H LEU A 12 20.202 -2.618 -4.479 1.00 0.00 H new ATOM 0 HA LEU A 12 21.045 -5.013 -5.987 1.00 0.00 H new ATOM 0 HB2 LEU A 12 22.288 -2.613 -4.983 1.00 0.00 H new ATOM 0 HB3 LEU A 12 23.065 -3.975 -4.200 1.00 0.00 H new ATOM 0 HG LEU A 12 23.350 -5.070 -6.459 1.00 0.00 H new ATOM 0 HD11 LEU A 12 22.990 -3.667 -8.472 1.00 0.00 H new ATOM 0 HD12 LEU A 12 21.465 -3.920 -7.589 1.00 0.00 H new ATOM 0 HD13 LEU A 12 22.328 -2.369 -7.449 1.00 0.00 H new ATOM 0 HD21 LEU A 12 25.151 -3.545 -7.221 1.00 0.00 H new ATOM 0 HD22 LEU A 12 24.485 -2.249 -6.198 1.00 0.00 H new ATOM 0 HD23 LEU A 12 25.164 -3.713 -5.449 1.00 0.00 H new ATOM 176 N PRO A 13 20.915 -4.925 -2.668 1.00 0.00 N ATOM 177 CA PRO A 13 20.872 -5.800 -1.481 1.00 0.00 C ATOM 178 C PRO A 13 19.620 -6.679 -1.520 1.00 0.00 C ATOM 179 O PRO A 13 18.508 -6.198 -1.428 1.00 0.00 O ATOM 180 CB PRO A 13 20.820 -4.843 -0.283 1.00 0.00 C ATOM 181 CG PRO A 13 20.784 -3.397 -0.837 1.00 0.00 C ATOM 182 CD PRO A 13 20.748 -3.484 -2.371 1.00 0.00 C ATOM 0 HA PRO A 13 21.730 -6.470 -1.430 1.00 0.00 H new ATOM 0 HB2 PRO A 13 19.938 -5.041 0.327 1.00 0.00 H new ATOM 0 HB3 PRO A 13 21.690 -4.985 0.358 1.00 0.00 H new ATOM 0 HG2 PRO A 13 19.908 -2.866 -0.464 1.00 0.00 H new ATOM 0 HG3 PRO A 13 21.660 -2.839 -0.506 1.00 0.00 H new ATOM 0 HD2 PRO A 13 19.806 -3.104 -2.767 1.00 0.00 H new ATOM 0 HD3 PRO A 13 21.545 -2.892 -2.820 1.00 0.00 H new ATOM 190 N GLU A 14 19.791 -7.967 -1.656 1.00 0.00 N ATOM 191 CA GLU A 14 18.611 -8.874 -1.700 1.00 0.00 C ATOM 192 C GLU A 14 19.085 -10.329 -1.654 1.00 0.00 C ATOM 193 O GLU A 14 19.463 -10.903 -2.657 1.00 0.00 O ATOM 194 CB GLU A 14 17.827 -8.631 -2.994 1.00 0.00 C ATOM 195 CG GLU A 14 16.352 -8.974 -2.772 1.00 0.00 C ATOM 196 CD GLU A 14 16.240 -10.317 -2.047 1.00 0.00 C ATOM 197 OE1 GLU A 14 16.751 -11.294 -2.570 1.00 0.00 O ATOM 198 OE2 GLU A 14 15.648 -10.344 -0.981 1.00 0.00 O ATOM 0 H GLU A 14 20.697 -8.429 -1.738 1.00 0.00 H new ATOM 0 HA GLU A 14 17.967 -8.675 -0.844 1.00 0.00 H new ATOM 0 HB2 GLU A 14 17.927 -7.590 -3.302 1.00 0.00 H new ATOM 0 HB3 GLU A 14 18.236 -9.242 -3.799 1.00 0.00 H new ATOM 0 HG2 GLU A 14 15.871 -8.192 -2.185 1.00 0.00 H new ATOM 0 HG3 GLU A 14 15.831 -9.021 -3.728 1.00 0.00 H new ATOM 205 N ASP A 15 19.068 -10.931 -0.497 1.00 0.00 N ATOM 206 CA ASP A 15 19.517 -12.348 -0.388 1.00 0.00 C ATOM 207 C ASP A 15 18.850 -13.176 -1.486 1.00 0.00 C ATOM 208 O ASP A 15 19.408 -13.389 -2.545 1.00 0.00 O ATOM 209 CB ASP A 15 19.123 -12.905 0.982 1.00 0.00 C ATOM 210 CG ASP A 15 20.277 -12.705 1.966 1.00 0.00 C ATOM 211 OD1 ASP A 15 20.508 -11.572 2.354 1.00 0.00 O ATOM 212 OD2 ASP A 15 20.910 -13.688 2.313 1.00 0.00 O ATOM 0 H ASP A 15 18.763 -10.504 0.377 1.00 0.00 H new ATOM 0 HA ASP A 15 20.600 -12.397 -0.501 1.00 0.00 H new ATOM 0 HB2 ASP A 15 18.228 -12.401 1.347 1.00 0.00 H new ATOM 0 HB3 ASP A 15 18.881 -13.965 0.900 1.00 0.00 H new ATOM 217 N GLY A 16 17.657 -13.644 -1.243 1.00 0.00 N ATOM 218 CA GLY A 16 16.950 -14.459 -2.272 1.00 0.00 C ATOM 219 C GLY A 16 15.472 -14.582 -1.900 1.00 0.00 C ATOM 220 O GLY A 16 15.006 -15.633 -1.510 1.00 0.00 O ATOM 0 H GLY A 16 17.140 -13.497 -0.376 1.00 0.00 H new ATOM 0 HA2 GLY A 16 17.051 -13.993 -3.252 1.00 0.00 H new ATOM 0 HA3 GLY A 16 17.402 -15.448 -2.341 1.00 0.00 H new ATOM 224 N GLY A 17 14.731 -13.515 -2.017 1.00 0.00 N ATOM 225 CA GLY A 17 13.282 -13.572 -1.669 1.00 0.00 C ATOM 226 C GLY A 17 12.476 -13.980 -2.902 1.00 0.00 C ATOM 227 O GLY A 17 12.780 -14.957 -3.559 1.00 0.00 O ATOM 0 H GLY A 17 15.065 -12.606 -2.338 1.00 0.00 H new ATOM 0 HA2 GLY A 17 13.119 -14.287 -0.862 1.00 0.00 H new ATOM 0 HA3 GLY A 17 12.946 -12.600 -1.307 1.00 0.00 H new ATOM 231 N SER A 18 11.449 -13.242 -3.224 1.00 0.00 N ATOM 232 CA SER A 18 10.625 -13.589 -4.414 1.00 0.00 C ATOM 233 C SER A 18 10.229 -15.065 -4.347 1.00 0.00 C ATOM 234 O SER A 18 10.924 -15.928 -4.845 1.00 0.00 O ATOM 235 CB SER A 18 11.434 -13.336 -5.686 1.00 0.00 C ATOM 236 OG SER A 18 10.600 -13.537 -6.820 1.00 0.00 O ATOM 0 H SER A 18 11.145 -12.413 -2.713 1.00 0.00 H new ATOM 0 HA SER A 18 9.727 -12.972 -4.426 1.00 0.00 H new ATOM 0 HB2 SER A 18 11.827 -12.319 -5.685 1.00 0.00 H new ATOM 0 HB3 SER A 18 12.291 -14.009 -5.726 1.00 0.00 H new ATOM 0 HG SER A 18 11.115 -13.374 -7.638 1.00 0.00 H new ATOM 242 N GLY A 19 9.115 -15.362 -3.734 1.00 0.00 N ATOM 243 CA GLY A 19 8.676 -16.782 -3.635 1.00 0.00 C ATOM 244 C GLY A 19 7.832 -16.969 -2.373 1.00 0.00 C ATOM 245 O GLY A 19 6.663 -17.292 -2.443 1.00 0.00 O ATOM 0 H GLY A 19 8.491 -14.683 -3.298 1.00 0.00 H new ATOM 0 HA2 GLY A 19 8.097 -17.057 -4.517 1.00 0.00 H new ATOM 0 HA3 GLY A 19 9.544 -17.441 -3.606 1.00 0.00 H new ATOM 249 N ALA A 20 8.421 -16.767 -1.222 1.00 0.00 N ATOM 250 CA ALA A 20 7.667 -16.930 0.058 1.00 0.00 C ATOM 251 C ALA A 20 7.861 -15.686 0.929 1.00 0.00 C ATOM 252 O ALA A 20 7.182 -15.506 1.919 1.00 0.00 O ATOM 253 CB ALA A 20 8.191 -18.159 0.804 1.00 0.00 C ATOM 0 H ALA A 20 9.398 -16.494 -1.113 1.00 0.00 H new ATOM 0 HA ALA A 20 6.607 -17.059 -0.160 1.00 0.00 H new ATOM 0 HB1 ALA A 20 7.642 -18.279 1.738 1.00 0.00 H new ATOM 0 HB2 ALA A 20 8.054 -19.046 0.186 1.00 0.00 H new ATOM 0 HB3 ALA A 20 9.251 -18.028 1.021 1.00 0.00 H new ATOM 259 N PHE A 21 8.782 -14.829 0.559 1.00 0.00 N ATOM 260 CA PHE A 21 9.041 -13.583 1.351 1.00 0.00 C ATOM 261 C PHE A 21 8.923 -13.869 2.854 1.00 0.00 C ATOM 262 O PHE A 21 8.022 -13.372 3.500 1.00 0.00 O ATOM 263 CB PHE A 21 8.031 -12.496 0.958 1.00 0.00 C ATOM 264 CG PHE A 21 6.668 -13.106 0.729 1.00 0.00 C ATOM 265 CD1 PHE A 21 6.363 -13.697 -0.503 1.00 0.00 C ATOM 266 CD2 PHE A 21 5.707 -13.079 1.748 1.00 0.00 C ATOM 267 CE1 PHE A 21 5.100 -14.262 -0.717 1.00 0.00 C ATOM 268 CE2 PHE A 21 4.444 -13.644 1.535 1.00 0.00 C ATOM 269 CZ PHE A 21 4.140 -14.235 0.303 1.00 0.00 C ATOM 0 H PHE A 21 9.372 -14.940 -0.266 1.00 0.00 H new ATOM 0 HA PHE A 21 10.052 -13.238 1.134 1.00 0.00 H new ATOM 0 HB2 PHE A 21 7.973 -11.743 1.744 1.00 0.00 H new ATOM 0 HB3 PHE A 21 8.366 -11.988 0.054 1.00 0.00 H new ATOM 0 HD1 PHE A 21 7.103 -13.717 -1.289 1.00 0.00 H new ATOM 0 HD2 PHE A 21 5.941 -12.622 2.698 1.00 0.00 H new ATOM 0 HE1 PHE A 21 4.866 -14.718 -1.668 1.00 0.00 H new ATOM 0 HE2 PHE A 21 3.704 -13.624 2.321 1.00 0.00 H new ATOM 0 HZ PHE A 21 3.165 -14.670 0.139 1.00 0.00 H new ATOM 279 N PRO A 22 9.833 -14.661 3.374 1.00 0.00 N ATOM 280 CA PRO A 22 9.824 -15.013 4.807 1.00 0.00 C ATOM 281 C PRO A 22 10.020 -13.747 5.655 1.00 0.00 C ATOM 282 O PRO A 22 10.369 -12.710 5.127 1.00 0.00 O ATOM 283 CB PRO A 22 11.008 -15.975 4.981 1.00 0.00 C ATOM 284 CG PRO A 22 11.682 -16.153 3.597 1.00 0.00 C ATOM 285 CD PRO A 22 10.930 -15.267 2.593 1.00 0.00 C ATOM 0 HA PRO A 22 8.885 -15.466 5.124 1.00 0.00 H new ATOM 0 HB2 PRO A 22 11.720 -15.577 5.704 1.00 0.00 H new ATOM 0 HB3 PRO A 22 10.666 -16.936 5.366 1.00 0.00 H new ATOM 0 HG2 PRO A 22 12.733 -15.869 3.645 1.00 0.00 H new ATOM 0 HG3 PRO A 22 11.647 -17.197 3.286 1.00 0.00 H new ATOM 0 HD2 PRO A 22 11.584 -14.504 2.171 1.00 0.00 H new ATOM 0 HD3 PRO A 22 10.545 -15.853 1.759 1.00 0.00 H new ATOM 293 N PRO A 23 9.798 -13.860 6.946 1.00 0.00 N ATOM 294 CA PRO A 23 9.959 -12.715 7.861 1.00 0.00 C ATOM 295 C PRO A 23 11.380 -12.155 7.761 1.00 0.00 C ATOM 296 O PRO A 23 12.332 -12.883 7.566 1.00 0.00 O ATOM 297 CB PRO A 23 9.700 -13.288 9.260 1.00 0.00 C ATOM 298 CG PRO A 23 9.362 -14.791 9.099 1.00 0.00 C ATOM 299 CD PRO A 23 9.376 -15.117 7.597 1.00 0.00 C ATOM 0 HA PRO A 23 9.280 -11.896 7.625 1.00 0.00 H new ATOM 0 HB2 PRO A 23 10.577 -13.159 9.894 1.00 0.00 H new ATOM 0 HB3 PRO A 23 8.877 -12.761 9.743 1.00 0.00 H new ATOM 0 HG2 PRO A 23 10.089 -15.405 9.630 1.00 0.00 H new ATOM 0 HG3 PRO A 23 8.385 -15.011 9.529 1.00 0.00 H new ATOM 0 HD2 PRO A 23 10.067 -15.930 7.374 1.00 0.00 H new ATOM 0 HD3 PRO A 23 8.392 -15.432 7.251 1.00 0.00 H new ATOM 307 N GLY A 24 11.530 -10.865 7.894 1.00 0.00 N ATOM 308 CA GLY A 24 12.890 -10.260 7.807 1.00 0.00 C ATOM 309 C GLY A 24 12.770 -8.789 7.406 1.00 0.00 C ATOM 310 O GLY A 24 12.942 -7.899 8.214 1.00 0.00 O ATOM 0 H GLY A 24 10.770 -10.204 8.059 1.00 0.00 H new ATOM 0 HA2 GLY A 24 13.400 -10.346 8.767 1.00 0.00 H new ATOM 0 HA3 GLY A 24 13.493 -10.799 7.076 1.00 0.00 H new ATOM 314 N HIS A 25 12.476 -8.526 6.161 1.00 0.00 N ATOM 315 CA HIS A 25 12.346 -7.112 5.710 1.00 0.00 C ATOM 316 C HIS A 25 11.132 -6.471 6.385 1.00 0.00 C ATOM 317 O HIS A 25 10.895 -5.286 6.260 1.00 0.00 O ATOM 318 CB HIS A 25 12.163 -7.077 4.192 1.00 0.00 C ATOM 319 CG HIS A 25 13.285 -7.834 3.534 1.00 0.00 C ATOM 320 ND1 HIS A 25 14.427 -7.204 3.068 1.00 0.00 N ATOM 321 CD2 HIS A 25 13.453 -9.168 3.258 1.00 0.00 C ATOM 322 CE1 HIS A 25 15.226 -8.151 2.541 1.00 0.00 C ATOM 323 NE2 HIS A 25 14.679 -9.367 2.632 1.00 0.00 N ATOM 0 H HIS A 25 12.321 -9.229 5.438 1.00 0.00 H new ATOM 0 HA HIS A 25 13.246 -6.560 5.981 1.00 0.00 H new ATOM 0 HB2 HIS A 25 11.204 -7.518 3.920 1.00 0.00 H new ATOM 0 HB3 HIS A 25 12.151 -6.045 3.840 1.00 0.00 H new ATOM 0 HD2 HIS A 25 12.741 -9.946 3.492 1.00 0.00 H new ATOM 0 HE1 HIS A 25 16.191 -7.952 2.099 1.00 0.00 H new ATOM 0 HE2 HIS A 25 15.075 -10.251 2.311 1.00 0.00 H new ATOM 331 N PHE A 26 10.361 -7.245 7.098 1.00 0.00 N ATOM 332 CA PHE A 26 9.163 -6.680 7.780 1.00 0.00 C ATOM 333 C PHE A 26 9.594 -5.969 9.064 1.00 0.00 C ATOM 334 O PHE A 26 8.954 -6.085 10.090 1.00 0.00 O ATOM 335 CB PHE A 26 8.193 -7.811 8.122 1.00 0.00 C ATOM 336 CG PHE A 26 7.796 -8.524 6.854 1.00 0.00 C ATOM 337 CD1 PHE A 26 8.648 -9.485 6.296 1.00 0.00 C ATOM 338 CD2 PHE A 26 6.579 -8.223 6.234 1.00 0.00 C ATOM 339 CE1 PHE A 26 8.281 -10.145 5.118 1.00 0.00 C ATOM 340 CE2 PHE A 26 6.212 -8.883 5.056 1.00 0.00 C ATOM 341 CZ PHE A 26 7.062 -9.844 4.497 1.00 0.00 C ATOM 0 H PHE A 26 10.509 -8.244 7.238 1.00 0.00 H new ATOM 0 HA PHE A 26 8.671 -5.966 7.120 1.00 0.00 H new ATOM 0 HB2 PHE A 26 8.661 -8.510 8.815 1.00 0.00 H new ATOM 0 HB3 PHE A 26 7.310 -7.411 8.620 1.00 0.00 H new ATOM 0 HD1 PHE A 26 9.588 -9.717 6.775 1.00 0.00 H new ATOM 0 HD2 PHE A 26 5.923 -7.481 6.664 1.00 0.00 H new ATOM 0 HE1 PHE A 26 8.938 -10.887 4.688 1.00 0.00 H new ATOM 0 HE2 PHE A 26 5.272 -8.651 4.578 1.00 0.00 H new ATOM 0 HZ PHE A 26 6.778 -10.353 3.588 1.00 0.00 H new ATOM 351 N LYS A 27 10.676 -5.236 9.008 1.00 0.00 N ATOM 352 CA LYS A 27 11.166 -4.509 10.217 1.00 0.00 C ATOM 353 C LYS A 27 11.433 -3.047 9.855 1.00 0.00 C ATOM 354 O LYS A 27 12.059 -2.318 10.597 1.00 0.00 O ATOM 355 CB LYS A 27 12.464 -5.156 10.708 1.00 0.00 C ATOM 356 CG LYS A 27 12.133 -6.279 11.692 1.00 0.00 C ATOM 357 CD LYS A 27 12.024 -5.706 13.107 1.00 0.00 C ATOM 358 CE LYS A 27 13.399 -5.726 13.776 1.00 0.00 C ATOM 359 NZ LYS A 27 13.297 -5.135 15.139 1.00 0.00 N ATOM 0 H LYS A 27 11.245 -5.109 8.171 1.00 0.00 H new ATOM 0 HA LYS A 27 10.413 -4.559 11.004 1.00 0.00 H new ATOM 0 HB2 LYS A 27 13.028 -5.552 9.863 1.00 0.00 H new ATOM 0 HB3 LYS A 27 13.095 -4.410 11.190 1.00 0.00 H new ATOM 0 HG2 LYS A 27 11.196 -6.759 11.410 1.00 0.00 H new ATOM 0 HG3 LYS A 27 12.907 -7.046 11.658 1.00 0.00 H new ATOM 0 HD2 LYS A 27 11.642 -4.686 13.069 1.00 0.00 H new ATOM 0 HD3 LYS A 27 11.315 -6.290 13.693 1.00 0.00 H new ATOM 0 HE2 LYS A 27 13.770 -6.749 13.839 1.00 0.00 H new ATOM 0 HE3 LYS A 27 14.115 -5.163 13.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 14.232 -5.149 15.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 12.961 -4.153 15.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 12.627 -5.690 15.709 1.00 0.00 H new ATOM 373 N ASP A 28 10.959 -2.612 8.718 1.00 0.00 N ATOM 374 CA ASP A 28 11.184 -1.197 8.310 1.00 0.00 C ATOM 375 C ASP A 28 9.993 -0.734 7.445 1.00 0.00 C ATOM 376 O ASP A 28 9.407 -1.545 6.757 1.00 0.00 O ATOM 377 CB ASP A 28 12.476 -1.116 7.490 1.00 0.00 C ATOM 378 CG ASP A 28 13.529 -2.037 8.109 1.00 0.00 C ATOM 379 OD1 ASP A 28 13.388 -3.241 7.974 1.00 0.00 O ATOM 380 OD2 ASP A 28 14.458 -1.521 8.708 1.00 0.00 O ATOM 0 H ASP A 28 10.426 -3.176 8.055 1.00 0.00 H new ATOM 0 HA ASP A 28 11.269 -0.558 9.189 1.00 0.00 H new ATOM 0 HB2 ASP A 28 12.283 -1.408 6.458 1.00 0.00 H new ATOM 0 HB3 ASP A 28 12.842 -0.090 7.468 1.00 0.00 H new ATOM 385 N PRO A 29 9.656 0.545 7.481 1.00 0.00 N ATOM 386 CA PRO A 29 8.533 1.060 6.675 1.00 0.00 C ATOM 387 C PRO A 29 8.763 0.758 5.192 1.00 0.00 C ATOM 388 O PRO A 29 9.843 0.372 4.787 1.00 0.00 O ATOM 389 CB PRO A 29 8.525 2.574 6.920 1.00 0.00 C ATOM 390 CG PRO A 29 9.680 2.899 7.899 1.00 0.00 C ATOM 391 CD PRO A 29 10.338 1.571 8.301 1.00 0.00 C ATOM 0 HA PRO A 29 7.584 0.599 6.950 1.00 0.00 H new ATOM 0 HB2 PRO A 29 8.655 3.114 5.982 1.00 0.00 H new ATOM 0 HB3 PRO A 29 7.569 2.889 7.339 1.00 0.00 H new ATOM 0 HG2 PRO A 29 10.408 3.559 7.427 1.00 0.00 H new ATOM 0 HG3 PRO A 29 9.301 3.420 8.778 1.00 0.00 H new ATOM 0 HD2 PRO A 29 11.410 1.586 8.104 1.00 0.00 H new ATOM 0 HD3 PRO A 29 10.212 1.374 9.366 1.00 0.00 H new ATOM 399 N LYS A 30 7.755 0.934 4.379 1.00 0.00 N ATOM 400 CA LYS A 30 7.907 0.660 2.920 1.00 0.00 C ATOM 401 C LYS A 30 7.127 1.711 2.125 1.00 0.00 C ATOM 402 O LYS A 30 6.027 2.084 2.484 1.00 0.00 O ATOM 403 CB LYS A 30 7.357 -0.732 2.600 1.00 0.00 C ATOM 404 CG LYS A 30 7.959 -1.753 3.567 1.00 0.00 C ATOM 405 CD LYS A 30 7.781 -3.162 2.999 1.00 0.00 C ATOM 406 CE LYS A 30 8.252 -4.191 4.029 1.00 0.00 C ATOM 407 NZ LYS A 30 8.629 -5.453 3.333 1.00 0.00 N ATOM 0 H LYS A 30 6.830 1.257 4.664 1.00 0.00 H new ATOM 0 HA LYS A 30 8.962 0.703 2.649 1.00 0.00 H new ATOM 0 HB2 LYS A 30 6.270 -0.733 2.683 1.00 0.00 H new ATOM 0 HB3 LYS A 30 7.598 -1.003 1.572 1.00 0.00 H new ATOM 0 HG2 LYS A 30 9.017 -1.543 3.722 1.00 0.00 H new ATOM 0 HG3 LYS A 30 7.474 -1.678 4.540 1.00 0.00 H new ATOM 0 HD2 LYS A 30 6.734 -3.335 2.749 1.00 0.00 H new ATOM 0 HD3 LYS A 30 8.351 -3.268 2.076 1.00 0.00 H new ATOM 0 HE2 LYS A 30 9.105 -3.801 4.585 1.00 0.00 H new ATOM 0 HE3 LYS A 30 7.461 -4.385 4.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 8.949 -6.153 4.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 7.804 -5.827 2.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 9.397 -5.261 2.658 1.00 0.00 H new ATOM 421 N ARG A 31 7.685 2.189 1.047 1.00 0.00 N ATOM 422 CA ARG A 31 6.975 3.215 0.231 1.00 0.00 C ATOM 423 C ARG A 31 6.117 2.518 -0.828 1.00 0.00 C ATOM 424 O ARG A 31 6.610 1.760 -1.639 1.00 0.00 O ATOM 425 CB ARG A 31 8.002 4.116 -0.456 1.00 0.00 C ATOM 426 CG ARG A 31 9.059 4.552 0.565 1.00 0.00 C ATOM 427 CD ARG A 31 9.532 5.974 0.252 1.00 0.00 C ATOM 428 NE ARG A 31 9.551 6.196 -1.230 1.00 0.00 N ATOM 429 CZ ARG A 31 10.175 5.375 -2.033 1.00 0.00 C ATOM 430 NH1 ARG A 31 10.957 4.447 -1.555 1.00 0.00 N ATOM 431 NH2 ARG A 31 10.060 5.521 -3.325 1.00 0.00 N ATOM 0 H ARG A 31 8.602 1.914 0.696 1.00 0.00 H new ATOM 0 HA ARG A 31 6.336 3.818 0.877 1.00 0.00 H new ATOM 0 HB2 ARG A 31 8.475 3.584 -1.281 1.00 0.00 H new ATOM 0 HB3 ARG A 31 7.509 4.990 -0.881 1.00 0.00 H new ATOM 0 HG2 ARG A 31 8.643 4.511 1.572 1.00 0.00 H new ATOM 0 HG3 ARG A 31 9.905 3.865 0.542 1.00 0.00 H new ATOM 0 HD2 ARG A 31 8.871 6.698 0.728 1.00 0.00 H new ATOM 0 HD3 ARG A 31 10.528 6.133 0.664 1.00 0.00 H new ATOM 0 HE ARG A 31 9.067 7.005 -1.620 1.00 0.00 H new ATOM 0 HH11 ARG A 31 11.085 4.358 -0.547 1.00 0.00 H new ATOM 0 HH12 ARG A 31 11.440 3.811 -2.189 1.00 0.00 H new ATOM 0 HH21 ARG A 31 9.485 6.273 -3.704 1.00 0.00 H new ATOM 0 HH22 ARG A 31 10.545 4.883 -3.956 1.00 0.00 H new ATOM 445 N LEU A 32 4.835 2.770 -0.828 1.00 0.00 N ATOM 446 CA LEU A 32 3.949 2.120 -1.836 1.00 0.00 C ATOM 447 C LEU A 32 3.960 2.934 -3.130 1.00 0.00 C ATOM 448 O LEU A 32 3.249 3.909 -3.267 1.00 0.00 O ATOM 449 CB LEU A 32 2.520 2.052 -1.293 1.00 0.00 C ATOM 450 CG LEU A 32 2.531 1.440 0.111 1.00 0.00 C ATOM 451 CD1 LEU A 32 1.094 1.299 0.616 1.00 0.00 C ATOM 452 CD2 LEU A 32 3.189 0.061 0.062 1.00 0.00 C ATOM 0 H LEU A 32 4.364 3.396 -0.175 1.00 0.00 H new ATOM 0 HA LEU A 32 4.312 1.112 -2.037 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.084 3.051 -1.262 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.896 1.453 -1.957 1.00 0.00 H new ATOM 0 HG LEU A 32 3.093 2.087 0.784 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.101 0.863 1.615 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.623 2.281 0.651 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.533 0.652 -0.058 1.00 0.00 H new ATOM 0 HD21 LEU A 32 3.197 -0.374 1.061 1.00 0.00 H new ATOM 0 HD22 LEU A 32 2.627 -0.586 -0.611 1.00 0.00 H new ATOM 0 HD23 LEU A 32 4.213 0.159 -0.299 1.00 0.00 H new ATOM 464 N TYR A 33 4.762 2.539 -4.083 1.00 0.00 N ATOM 465 CA TYR A 33 4.820 3.287 -5.372 1.00 0.00 C ATOM 466 C TYR A 33 3.898 2.616 -6.392 1.00 0.00 C ATOM 467 O TYR A 33 4.132 1.500 -6.815 1.00 0.00 O ATOM 468 CB TYR A 33 6.256 3.281 -5.900 1.00 0.00 C ATOM 469 CG TYR A 33 6.270 3.776 -7.329 1.00 0.00 C ATOM 470 CD1 TYR A 33 5.811 5.066 -7.625 1.00 0.00 C ATOM 471 CD2 TYR A 33 6.741 2.948 -8.356 1.00 0.00 C ATOM 472 CE1 TYR A 33 5.823 5.527 -8.947 1.00 0.00 C ATOM 473 CE2 TYR A 33 6.752 3.410 -9.678 1.00 0.00 C ATOM 474 CZ TYR A 33 6.294 4.700 -9.973 1.00 0.00 C ATOM 475 OH TYR A 33 6.305 5.155 -11.275 1.00 0.00 O ATOM 0 H TYR A 33 5.380 1.730 -4.024 1.00 0.00 H new ATOM 0 HA TYR A 33 4.496 4.315 -5.211 1.00 0.00 H new ATOM 0 HB2 TYR A 33 6.886 3.916 -5.278 1.00 0.00 H new ATOM 0 HB3 TYR A 33 6.669 2.274 -5.849 1.00 0.00 H new ATOM 0 HD1 TYR A 33 5.448 5.705 -6.834 1.00 0.00 H new ATOM 0 HD2 TYR A 33 7.096 1.954 -8.128 1.00 0.00 H new ATOM 0 HE1 TYR A 33 5.469 6.521 -9.175 1.00 0.00 H new ATOM 0 HE2 TYR A 33 7.114 2.771 -10.470 1.00 0.00 H new ATOM 0 HH TYR A 33 6.663 4.457 -11.862 1.00 0.00 H new ATOM 485 N CYS A 34 2.853 3.285 -6.792 1.00 0.00 N ATOM 486 CA CYS A 34 1.918 2.685 -7.787 1.00 0.00 C ATOM 487 C CYS A 34 2.466 2.909 -9.198 1.00 0.00 C ATOM 488 O CYS A 34 2.624 4.028 -9.643 1.00 0.00 O ATOM 489 CB CYS A 34 0.546 3.349 -7.661 1.00 0.00 C ATOM 490 SG CYS A 34 -0.617 2.548 -8.793 1.00 0.00 S ATOM 0 H CYS A 34 2.605 4.222 -6.473 1.00 0.00 H new ATOM 0 HA CYS A 34 1.822 1.616 -7.599 1.00 0.00 H new ATOM 0 HB2 CYS A 34 0.185 3.270 -6.636 1.00 0.00 H new ATOM 0 HB3 CYS A 34 0.622 4.412 -7.892 1.00 0.00 H new ATOM 0 HG CYS A 34 -1.784 3.111 -8.686 1.00 0.00 H new ATOM 496 N LYS A 35 2.758 1.851 -9.904 1.00 0.00 N ATOM 497 CA LYS A 35 3.297 2.001 -11.286 1.00 0.00 C ATOM 498 C LYS A 35 2.206 2.551 -12.204 1.00 0.00 C ATOM 499 O LYS A 35 2.475 3.030 -13.289 1.00 0.00 O ATOM 500 CB LYS A 35 3.753 0.634 -11.801 1.00 0.00 C ATOM 501 CG LYS A 35 4.732 0.822 -12.964 1.00 0.00 C ATOM 502 CD LYS A 35 4.478 -0.249 -14.027 1.00 0.00 C ATOM 503 CE LYS A 35 3.282 0.158 -14.891 1.00 0.00 C ATOM 504 NZ LYS A 35 2.485 -1.053 -15.238 1.00 0.00 N ATOM 0 H LYS A 35 2.647 0.889 -9.584 1.00 0.00 H new ATOM 0 HA LYS A 35 4.142 2.690 -11.275 1.00 0.00 H new ATOM 0 HB2 LYS A 35 4.231 0.073 -10.998 1.00 0.00 H new ATOM 0 HB3 LYS A 35 2.892 0.052 -12.128 1.00 0.00 H new ATOM 0 HG2 LYS A 35 4.611 1.815 -13.397 1.00 0.00 H new ATOM 0 HG3 LYS A 35 5.758 0.754 -12.603 1.00 0.00 H new ATOM 0 HD2 LYS A 35 5.364 -0.374 -14.650 1.00 0.00 H new ATOM 0 HD3 LYS A 35 4.285 -1.210 -13.550 1.00 0.00 H new ATOM 0 HE2 LYS A 35 2.660 0.875 -14.355 1.00 0.00 H new ATOM 0 HE3 LYS A 35 3.627 0.652 -15.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 1.672 -0.777 -15.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 3.082 -1.722 -15.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 2.144 -1.506 -14.366 1.00 0.00 H new ATOM 518 N ASN A 36 0.973 2.485 -11.782 1.00 0.00 N ATOM 519 CA ASN A 36 -0.136 3.001 -12.632 1.00 0.00 C ATOM 520 C ASN A 36 -0.319 4.499 -12.384 1.00 0.00 C ATOM 521 O ASN A 36 -0.862 4.911 -11.378 1.00 0.00 O ATOM 522 CB ASN A 36 -1.426 2.260 -12.283 1.00 0.00 C ATOM 523 CG ASN A 36 -1.195 0.755 -12.418 1.00 0.00 C ATOM 524 OD1 ASN A 36 -0.824 0.098 -11.466 1.00 0.00 O ATOM 525 ND2 ASN A 36 -1.398 0.178 -13.569 1.00 0.00 N ATOM 0 H ASN A 36 0.686 2.095 -10.884 1.00 0.00 H new ATOM 0 HA ASN A 36 0.104 2.839 -13.683 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -1.735 2.503 -11.266 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -2.232 2.577 -12.945 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -1.245 -0.825 -13.670 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -1.710 0.730 -14.368 1.00 0.00 H new ATOM 532 N GLY A 37 0.131 5.319 -13.294 1.00 0.00 N ATOM 533 CA GLY A 37 -0.016 6.791 -13.113 1.00 0.00 C ATOM 534 C GLY A 37 1.075 7.302 -12.171 1.00 0.00 C ATOM 535 O GLY A 37 1.104 8.461 -11.809 1.00 0.00 O ATOM 0 H GLY A 37 0.595 5.033 -14.156 1.00 0.00 H new ATOM 0 HA2 GLY A 37 0.056 7.295 -14.077 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -1.000 7.021 -12.705 1.00 0.00 H new ATOM 539 N GLY A 38 1.976 6.447 -11.773 1.00 0.00 N ATOM 540 CA GLY A 38 3.065 6.886 -10.855 1.00 0.00 C ATOM 541 C GLY A 38 2.467 7.691 -9.700 1.00 0.00 C ATOM 542 O GLY A 38 2.435 8.906 -9.730 1.00 0.00 O ATOM 0 H GLY A 38 2.006 5.464 -12.043 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.601 6.019 -10.469 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.790 7.493 -11.398 1.00 0.00 H new ATOM 546 N PHE A 39 1.990 7.023 -8.683 1.00 0.00 N ATOM 547 CA PHE A 39 1.392 7.748 -7.523 1.00 0.00 C ATOM 548 C PHE A 39 1.751 7.021 -6.225 1.00 0.00 C ATOM 549 O PHE A 39 1.618 5.818 -6.119 1.00 0.00 O ATOM 550 CB PHE A 39 -0.129 7.789 -7.677 1.00 0.00 C ATOM 551 CG PHE A 39 -0.507 8.853 -8.679 1.00 0.00 C ATOM 552 CD1 PHE A 39 -0.568 10.194 -8.286 1.00 0.00 C ATOM 553 CD2 PHE A 39 -0.796 8.496 -10.001 1.00 0.00 C ATOM 554 CE1 PHE A 39 -0.920 11.180 -9.215 1.00 0.00 C ATOM 555 CE2 PHE A 39 -1.148 9.481 -10.930 1.00 0.00 C ATOM 556 CZ PHE A 39 -1.211 10.824 -10.537 1.00 0.00 C ATOM 0 H PHE A 39 1.989 6.006 -8.605 1.00 0.00 H new ATOM 0 HA PHE A 39 1.783 8.765 -7.491 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -0.498 6.818 -8.006 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.597 7.998 -6.715 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -0.344 10.469 -7.266 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -0.747 7.460 -10.304 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -0.967 12.215 -8.912 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -1.371 9.206 -11.950 1.00 0.00 H new ATOM 0 HZ PHE A 39 -1.484 11.584 -11.254 1.00 0.00 H new ATOM 566 N PHE A 40 2.201 7.744 -5.235 1.00 0.00 N ATOM 567 CA PHE A 40 2.565 7.097 -3.942 1.00 0.00 C ATOM 568 C PHE A 40 1.375 7.173 -2.983 1.00 0.00 C ATOM 569 O PHE A 40 0.968 8.241 -2.569 1.00 0.00 O ATOM 570 CB PHE A 40 3.762 7.825 -3.326 1.00 0.00 C ATOM 571 CG PHE A 40 4.957 7.693 -4.240 1.00 0.00 C ATOM 572 CD1 PHE A 40 5.045 8.477 -5.395 1.00 0.00 C ATOM 573 CD2 PHE A 40 5.977 6.785 -3.931 1.00 0.00 C ATOM 574 CE1 PHE A 40 6.153 8.356 -6.242 1.00 0.00 C ATOM 575 CE2 PHE A 40 7.085 6.663 -4.777 1.00 0.00 C ATOM 576 CZ PHE A 40 7.173 7.448 -5.933 1.00 0.00 C ATOM 0 H PHE A 40 2.332 8.755 -5.266 1.00 0.00 H new ATOM 0 HA PHE A 40 2.826 6.053 -4.118 1.00 0.00 H new ATOM 0 HB2 PHE A 40 3.522 8.877 -3.173 1.00 0.00 H new ATOM 0 HB3 PHE A 40 3.992 7.405 -2.347 1.00 0.00 H new ATOM 0 HD1 PHE A 40 4.257 9.176 -5.634 1.00 0.00 H new ATOM 0 HD2 PHE A 40 5.909 6.179 -3.040 1.00 0.00 H new ATOM 0 HE1 PHE A 40 6.221 8.963 -7.133 1.00 0.00 H new ATOM 0 HE2 PHE A 40 7.872 5.963 -4.538 1.00 0.00 H new ATOM 0 HZ PHE A 40 8.028 7.353 -6.586 1.00 0.00 H new ATOM 586 N LEU A 41 0.815 6.051 -2.625 1.00 0.00 N ATOM 587 CA LEU A 41 -0.346 6.062 -1.692 1.00 0.00 C ATOM 588 C LEU A 41 -0.030 6.969 -0.500 1.00 0.00 C ATOM 589 O LEU A 41 1.088 7.022 -0.028 1.00 0.00 O ATOM 590 CB LEU A 41 -0.614 4.637 -1.197 1.00 0.00 C ATOM 591 CG LEU A 41 -1.883 4.607 -0.334 1.00 0.00 C ATOM 592 CD1 LEU A 41 -3.105 4.984 -1.179 1.00 0.00 C ATOM 593 CD2 LEU A 41 -2.075 3.199 0.231 1.00 0.00 C ATOM 0 H LEU A 41 1.111 5.127 -2.938 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.229 6.438 -2.209 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.727 3.964 -2.047 1.00 0.00 H new ATOM 0 HB3 LEU A 41 0.237 4.279 -0.618 1.00 0.00 H new ATOM 0 HG LEU A 41 -1.778 5.324 0.480 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -3.999 4.959 -0.557 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -2.972 5.987 -1.584 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -3.214 4.274 -1.999 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -2.975 3.173 0.845 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -2.174 2.488 -0.589 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -1.212 2.931 0.841 1.00 0.00 H new ATOM 605 N ARG A 42 -1.007 7.684 -0.010 1.00 0.00 N ATOM 606 CA ARG A 42 -0.760 8.585 1.151 1.00 0.00 C ATOM 607 C ARG A 42 -2.040 8.714 1.979 1.00 0.00 C ATOM 608 O ARG A 42 -3.047 9.206 1.512 1.00 0.00 O ATOM 609 CB ARG A 42 -0.340 9.967 0.643 1.00 0.00 C ATOM 610 CG ARG A 42 0.195 10.802 1.809 1.00 0.00 C ATOM 611 CD ARG A 42 -0.088 12.285 1.552 1.00 0.00 C ATOM 612 NE ARG A 42 0.440 13.097 2.684 1.00 0.00 N ATOM 613 CZ ARG A 42 0.591 14.386 2.547 1.00 0.00 C ATOM 614 NH1 ARG A 42 0.284 14.963 1.417 1.00 0.00 N ATOM 615 NH2 ARG A 42 1.048 15.098 3.540 1.00 0.00 N ATOM 0 H ARG A 42 -1.964 7.683 -0.363 1.00 0.00 H new ATOM 0 HA ARG A 42 0.033 8.168 1.772 1.00 0.00 H new ATOM 0 HB2 ARG A 42 0.426 9.866 -0.126 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -1.190 10.470 0.182 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -0.276 10.488 2.741 1.00 0.00 H new ATOM 0 HG3 ARG A 42 1.267 10.641 1.923 1.00 0.00 H new ATOM 0 HD2 ARG A 42 0.378 12.598 0.618 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -1.160 12.448 1.443 1.00 0.00 H new ATOM 0 HE ARG A 42 0.683 12.646 3.566 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -0.074 14.406 0.641 1.00 0.00 H new ATOM 0 HH12 ARG A 42 0.402 15.970 1.310 1.00 0.00 H new ATOM 0 HH21 ARG A 42 1.287 14.647 4.423 1.00 0.00 H new ATOM 0 HH22 ARG A 42 1.166 16.105 3.433 1.00 0.00 H new ATOM 629 N ILE A 43 -2.008 8.276 3.209 1.00 0.00 N ATOM 630 CA ILE A 43 -3.222 8.376 4.067 1.00 0.00 C ATOM 631 C ILE A 43 -3.203 9.714 4.809 1.00 0.00 C ATOM 632 O ILE A 43 -2.243 10.053 5.472 1.00 0.00 O ATOM 633 CB ILE A 43 -3.228 7.230 5.080 1.00 0.00 C ATOM 634 CG1 ILE A 43 -3.195 5.892 4.336 1.00 0.00 C ATOM 635 CG2 ILE A 43 -4.496 7.306 5.932 1.00 0.00 C ATOM 636 CD1 ILE A 43 -2.856 4.770 5.318 1.00 0.00 C ATOM 0 H ILE A 43 -1.194 7.854 3.656 1.00 0.00 H new ATOM 0 HA ILE A 43 -4.116 8.313 3.447 1.00 0.00 H new ATOM 0 HB ILE A 43 -2.352 7.312 5.724 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -4.160 5.700 3.868 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -2.454 5.926 3.537 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -4.499 6.489 6.653 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -4.522 8.258 6.462 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.372 7.225 5.289 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -2.833 3.818 4.788 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -1.880 4.960 5.765 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -3.613 4.731 6.101 1.00 0.00 H new ATOM 648 N HIS A 44 -4.254 10.480 4.701 1.00 0.00 N ATOM 649 CA HIS A 44 -4.289 11.795 5.398 1.00 0.00 C ATOM 650 C HIS A 44 -4.838 11.596 6.825 1.00 0.00 C ATOM 651 O HIS A 44 -5.611 10.684 7.046 1.00 0.00 O ATOM 652 CB HIS A 44 -5.207 12.744 4.623 1.00 0.00 C ATOM 653 CG HIS A 44 -4.463 13.310 3.445 1.00 0.00 C ATOM 654 ND1 HIS A 44 -3.306 14.059 3.589 1.00 0.00 N ATOM 655 CD2 HIS A 44 -4.700 13.244 2.093 1.00 0.00 C ATOM 656 CE1 HIS A 44 -2.893 14.409 2.357 1.00 0.00 C ATOM 657 NE2 HIS A 44 -3.708 13.938 1.409 1.00 0.00 N ATOM 0 H HIS A 44 -5.089 10.252 4.161 1.00 0.00 H new ATOM 0 HA HIS A 44 -3.286 12.218 5.451 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -6.096 12.211 4.284 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -5.547 13.550 5.273 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -5.531 12.731 1.632 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -2.010 14.999 2.159 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -3.621 14.061 0.400 1.00 0.00 H new ATOM 665 N PRO A 45 -4.446 12.444 7.761 1.00 0.00 N ATOM 666 CA PRO A 45 -4.935 12.328 9.149 1.00 0.00 C ATOM 667 C PRO A 45 -6.463 12.416 9.182 1.00 0.00 C ATOM 668 O PRO A 45 -7.101 11.957 10.108 1.00 0.00 O ATOM 669 CB PRO A 45 -4.313 13.518 9.892 1.00 0.00 C ATOM 670 CG PRO A 45 -3.478 14.327 8.869 1.00 0.00 C ATOM 671 CD PRO A 45 -3.508 13.566 7.535 1.00 0.00 C ATOM 0 HA PRO A 45 -4.662 11.376 9.603 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -5.090 14.143 10.331 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -3.683 13.171 10.711 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -3.889 15.329 8.747 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -2.453 14.444 9.220 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -3.847 14.207 6.721 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -2.516 13.204 7.264 1.00 0.00 H new ATOM 679 N ASP A 46 -7.054 13.007 8.181 1.00 0.00 N ATOM 680 CA ASP A 46 -8.540 13.126 8.157 1.00 0.00 C ATOM 681 C ASP A 46 -9.158 11.769 7.814 1.00 0.00 C ATOM 682 O ASP A 46 -10.345 11.659 7.581 1.00 0.00 O ATOM 683 CB ASP A 46 -8.952 14.156 7.105 1.00 0.00 C ATOM 684 CG ASP A 46 -8.311 13.800 5.763 1.00 0.00 C ATOM 685 OD1 ASP A 46 -7.985 12.639 5.576 1.00 0.00 O ATOM 686 OD2 ASP A 46 -8.156 14.692 4.946 1.00 0.00 O ATOM 0 H ASP A 46 -6.573 13.413 7.378 1.00 0.00 H new ATOM 0 HA ASP A 46 -8.894 13.446 9.137 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -10.037 14.177 7.007 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -8.640 15.153 7.416 1.00 0.00 H new ATOM 691 N GLY A 47 -8.363 10.735 7.779 1.00 0.00 N ATOM 692 CA GLY A 47 -8.908 9.387 7.452 1.00 0.00 C ATOM 693 C GLY A 47 -8.957 9.208 5.933 1.00 0.00 C ATOM 694 O GLY A 47 -8.724 8.133 5.418 1.00 0.00 O ATOM 0 H GLY A 47 -7.360 10.765 7.963 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -8.284 8.613 7.900 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -9.907 9.275 7.874 1.00 0.00 H new ATOM 698 N ARG A 48 -9.257 10.254 5.212 1.00 0.00 N ATOM 699 CA ARG A 48 -9.321 10.142 3.727 1.00 0.00 C ATOM 700 C ARG A 48 -8.081 9.404 3.218 1.00 0.00 C ATOM 701 O ARG A 48 -7.104 9.255 3.925 1.00 0.00 O ATOM 702 CB ARG A 48 -9.370 11.542 3.110 1.00 0.00 C ATOM 703 CG ARG A 48 -10.556 12.315 3.690 1.00 0.00 C ATOM 704 CD ARG A 48 -10.755 13.607 2.892 1.00 0.00 C ATOM 705 NE ARG A 48 -10.900 14.779 3.817 1.00 0.00 N ATOM 706 CZ ARG A 48 -11.701 14.735 4.851 1.00 0.00 C ATOM 707 NH1 ARG A 48 -12.452 13.688 5.059 1.00 0.00 N ATOM 708 NH2 ARG A 48 -11.764 15.752 5.666 1.00 0.00 N ATOM 0 H ARG A 48 -9.460 11.181 5.587 1.00 0.00 H new ATOM 0 HA ARG A 48 -10.216 9.589 3.443 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.441 12.074 3.315 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -9.464 11.470 2.026 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -11.458 11.705 3.648 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -10.376 12.546 4.740 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -9.906 13.765 2.226 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -11.641 13.520 2.264 1.00 0.00 H new ATOM 0 HE ARG A 48 -10.363 15.627 3.636 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -12.416 12.899 4.414 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -13.074 13.659 5.867 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -11.190 16.578 5.496 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -12.387 15.721 6.473 1.00 0.00 H new ATOM 722 N VAL A 49 -8.116 8.939 1.996 1.00 0.00 N ATOM 723 CA VAL A 49 -6.945 8.207 1.433 1.00 0.00 C ATOM 724 C VAL A 49 -6.716 8.651 -0.013 1.00 0.00 C ATOM 725 O VAL A 49 -7.594 8.554 -0.849 1.00 0.00 O ATOM 726 CB VAL A 49 -7.223 6.704 1.467 1.00 0.00 C ATOM 727 CG1 VAL A 49 -6.099 5.961 0.743 1.00 0.00 C ATOM 728 CG2 VAL A 49 -7.291 6.231 2.920 1.00 0.00 C ATOM 0 H VAL A 49 -8.909 9.036 1.362 1.00 0.00 H new ATOM 0 HA VAL A 49 -6.057 8.426 2.026 1.00 0.00 H new ATOM 0 HB VAL A 49 -8.172 6.499 0.972 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -6.297 4.889 0.767 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -6.048 6.298 -0.293 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -5.150 6.166 1.238 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -7.489 5.159 2.945 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -6.341 6.436 3.414 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -8.091 6.760 3.438 1.00 0.00 H new ATOM 738 N ASP A 50 -5.544 9.138 -0.316 1.00 0.00 N ATOM 739 CA ASP A 50 -5.260 9.587 -1.708 1.00 0.00 C ATOM 740 C ASP A 50 -3.761 9.460 -1.988 1.00 0.00 C ATOM 741 O ASP A 50 -2.944 9.556 -1.095 1.00 0.00 O ATOM 742 CB ASP A 50 -5.685 11.049 -1.866 1.00 0.00 C ATOM 743 CG ASP A 50 -4.750 11.945 -1.053 1.00 0.00 C ATOM 744 OD1 ASP A 50 -4.200 11.461 -0.076 1.00 0.00 O ATOM 745 OD2 ASP A 50 -4.599 13.098 -1.419 1.00 0.00 O ATOM 0 H ASP A 50 -4.771 9.244 0.341 1.00 0.00 H new ATOM 0 HA ASP A 50 -5.815 8.967 -2.412 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -5.656 11.335 -2.917 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -6.713 11.178 -1.529 1.00 0.00 H new ATOM 750 N GLY A 51 -3.395 9.247 -3.222 1.00 0.00 N ATOM 751 CA GLY A 51 -1.950 9.115 -3.560 1.00 0.00 C ATOM 752 C GLY A 51 -1.399 10.476 -3.991 1.00 0.00 C ATOM 753 O GLY A 51 -2.141 11.380 -4.320 1.00 0.00 O ATOM 0 H GLY A 51 -4.035 9.159 -4.011 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -1.397 8.744 -2.698 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -1.818 8.387 -4.361 1.00 0.00 H new ATOM 757 N VAL A 52 -0.103 10.629 -3.991 1.00 0.00 N ATOM 758 CA VAL A 52 0.494 11.931 -4.401 1.00 0.00 C ATOM 759 C VAL A 52 1.832 11.683 -5.101 1.00 0.00 C ATOM 760 O VAL A 52 2.532 10.735 -4.804 1.00 0.00 O ATOM 761 CB VAL A 52 0.721 12.801 -3.163 1.00 0.00 C ATOM 762 CG1 VAL A 52 -0.608 13.007 -2.435 1.00 0.00 C ATOM 763 CG2 VAL A 52 1.711 12.108 -2.226 1.00 0.00 C ATOM 0 H VAL A 52 0.568 9.908 -3.725 1.00 0.00 H new ATOM 0 HA VAL A 52 -0.185 12.441 -5.085 1.00 0.00 H new ATOM 0 HB VAL A 52 1.124 13.767 -3.468 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -0.447 13.627 -1.553 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -1.315 13.501 -3.101 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -1.010 12.040 -2.131 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.872 12.728 -1.344 1.00 0.00 H new ATOM 0 HG22 VAL A 52 1.309 11.142 -1.921 1.00 0.00 H new ATOM 0 HG23 VAL A 52 2.659 11.959 -2.743 1.00 0.00 H new ATOM 773 N ARG A 53 2.191 12.526 -6.030 1.00 0.00 N ATOM 774 CA ARG A 53 3.483 12.337 -6.749 1.00 0.00 C ATOM 775 C ARG A 53 4.623 12.911 -5.906 1.00 0.00 C ATOM 776 O ARG A 53 5.742 13.038 -6.363 1.00 0.00 O ATOM 777 CB ARG A 53 3.427 13.062 -8.095 1.00 0.00 C ATOM 778 CG ARG A 53 2.490 12.310 -9.042 1.00 0.00 C ATOM 779 CD ARG A 53 2.549 12.946 -10.432 1.00 0.00 C ATOM 780 NE ARG A 53 2.594 14.430 -10.298 1.00 0.00 N ATOM 781 CZ ARG A 53 2.945 15.166 -11.317 1.00 0.00 C ATOM 782 NH1 ARG A 53 3.253 14.604 -12.453 1.00 0.00 N ATOM 783 NH2 ARG A 53 2.986 16.466 -11.199 1.00 0.00 N ATOM 0 H ARG A 53 1.646 13.337 -6.322 1.00 0.00 H new ATOM 0 HA ARG A 53 3.655 11.274 -6.916 1.00 0.00 H new ATOM 0 HB2 ARG A 53 3.076 14.084 -7.955 1.00 0.00 H new ATOM 0 HB3 ARG A 53 4.425 13.125 -8.528 1.00 0.00 H new ATOM 0 HG2 ARG A 53 2.779 11.260 -9.098 1.00 0.00 H new ATOM 0 HG3 ARG A 53 1.470 12.340 -8.660 1.00 0.00 H new ATOM 0 HD2 ARG A 53 3.429 12.592 -10.969 1.00 0.00 H new ATOM 0 HD3 ARG A 53 1.678 12.649 -11.017 1.00 0.00 H new ATOM 0 HE ARG A 53 2.351 14.870 -9.410 1.00 0.00 H new ATOM 0 HH11 ARG A 53 3.220 13.589 -12.545 1.00 0.00 H new ATOM 0 HH12 ARG A 53 3.527 15.180 -13.249 1.00 0.00 H new ATOM 0 HH21 ARG A 53 2.744 16.905 -10.311 1.00 0.00 H new ATOM 0 HH22 ARG A 53 3.260 17.042 -11.995 1.00 0.00 H new ATOM 797 N GLU A 54 4.349 13.258 -4.678 1.00 0.00 N ATOM 798 CA GLU A 54 5.417 13.823 -3.806 1.00 0.00 C ATOM 799 C GLU A 54 6.056 12.698 -2.988 1.00 0.00 C ATOM 800 O GLU A 54 5.571 12.329 -1.937 1.00 0.00 O ATOM 801 CB GLU A 54 4.807 14.860 -2.859 1.00 0.00 C ATOM 802 CG GLU A 54 5.893 15.838 -2.404 1.00 0.00 C ATOM 803 CD GLU A 54 5.909 17.053 -3.334 1.00 0.00 C ATOM 804 OE1 GLU A 54 5.035 17.892 -3.193 1.00 0.00 O ATOM 805 OE2 GLU A 54 6.794 17.123 -4.170 1.00 0.00 O ATOM 0 H GLU A 54 3.431 13.174 -4.241 1.00 0.00 H new ATOM 0 HA GLU A 54 6.178 14.299 -4.425 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.004 15.400 -3.362 1.00 0.00 H new ATOM 0 HB3 GLU A 54 4.365 14.364 -1.995 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.705 16.155 -1.378 1.00 0.00 H new ATOM 0 HG3 GLU A 54 6.866 15.347 -2.413 1.00 0.00 H new ATOM 812 N LYS A 55 7.141 12.149 -3.460 1.00 0.00 N ATOM 813 CA LYS A 55 7.806 11.048 -2.707 1.00 0.00 C ATOM 814 C LYS A 55 8.548 11.635 -1.505 1.00 0.00 C ATOM 815 O LYS A 55 9.088 10.917 -0.687 1.00 0.00 O ATOM 816 CB LYS A 55 8.806 10.313 -3.611 1.00 0.00 C ATOM 817 CG LYS A 55 8.939 11.026 -4.963 1.00 0.00 C ATOM 818 CD LYS A 55 9.536 12.422 -4.757 1.00 0.00 C ATOM 819 CE LYS A 55 10.930 12.476 -5.385 1.00 0.00 C ATOM 820 NZ LYS A 55 11.544 13.807 -5.118 1.00 0.00 N ATOM 0 H LYS A 55 7.596 12.415 -4.334 1.00 0.00 H new ATOM 0 HA LYS A 55 7.048 10.341 -2.369 1.00 0.00 H new ATOM 0 HB2 LYS A 55 9.779 10.265 -3.122 1.00 0.00 H new ATOM 0 HB3 LYS A 55 8.477 9.286 -3.767 1.00 0.00 H new ATOM 0 HG2 LYS A 55 9.574 10.444 -5.631 1.00 0.00 H new ATOM 0 HG3 LYS A 55 7.962 11.105 -5.441 1.00 0.00 H new ATOM 0 HD2 LYS A 55 8.892 13.176 -5.210 1.00 0.00 H new ATOM 0 HD3 LYS A 55 9.595 12.651 -3.693 1.00 0.00 H new ATOM 0 HE2 LYS A 55 11.557 11.685 -4.973 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.864 12.303 -6.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 12.492 13.844 -5.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 10.949 14.553 -5.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 11.621 13.954 -4.091 1.00 0.00 H new ATOM 834 N SER A 56 8.576 12.936 -1.390 1.00 0.00 N ATOM 835 CA SER A 56 9.281 13.568 -0.240 1.00 0.00 C ATOM 836 C SER A 56 8.278 13.844 0.882 1.00 0.00 C ATOM 837 O SER A 56 8.539 14.612 1.787 1.00 0.00 O ATOM 838 CB SER A 56 9.916 14.885 -0.690 1.00 0.00 C ATOM 839 OG SER A 56 8.960 15.641 -1.422 1.00 0.00 O ATOM 0 H SER A 56 8.141 13.587 -2.043 1.00 0.00 H new ATOM 0 HA SER A 56 10.059 12.896 0.123 1.00 0.00 H new ATOM 0 HB2 SER A 56 10.259 15.451 0.176 1.00 0.00 H new ATOM 0 HB3 SER A 56 10.791 14.687 -1.309 1.00 0.00 H new ATOM 0 HG SER A 56 9.363 16.486 -1.710 1.00 0.00 H new ATOM 845 N ASP A 57 7.131 13.223 0.831 1.00 0.00 N ATOM 846 CA ASP A 57 6.110 13.446 1.893 1.00 0.00 C ATOM 847 C ASP A 57 6.308 12.399 3.015 1.00 0.00 C ATOM 848 O ASP A 57 6.116 11.226 2.764 1.00 0.00 O ATOM 849 CB ASP A 57 4.717 13.261 1.285 1.00 0.00 C ATOM 850 CG ASP A 57 3.992 14.609 1.246 1.00 0.00 C ATOM 851 OD1 ASP A 57 3.991 15.287 2.259 1.00 0.00 O ATOM 852 OD2 ASP A 57 3.452 14.939 0.203 1.00 0.00 O ATOM 0 H ASP A 57 6.857 12.569 0.098 1.00 0.00 H new ATOM 0 HA ASP A 57 6.213 14.451 2.301 1.00 0.00 H new ATOM 0 HB2 ASP A 57 4.800 12.852 0.278 1.00 0.00 H new ATOM 0 HB3 ASP A 57 4.144 12.545 1.874 1.00 0.00 H new ATOM 857 N PRO A 58 6.685 12.811 4.220 1.00 0.00 N ATOM 858 CA PRO A 58 6.889 11.842 5.317 1.00 0.00 C ATOM 859 C PRO A 58 5.580 11.114 5.631 1.00 0.00 C ATOM 860 O PRO A 58 5.511 10.305 6.534 1.00 0.00 O ATOM 861 CB PRO A 58 7.340 12.683 6.518 1.00 0.00 C ATOM 862 CG PRO A 58 7.384 14.163 6.068 1.00 0.00 C ATOM 863 CD PRO A 58 6.938 14.221 4.600 1.00 0.00 C ATOM 0 HA PRO A 58 7.623 11.078 5.059 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.650 12.558 7.353 1.00 0.00 H new ATOM 0 HB3 PRO A 58 8.322 12.359 6.864 1.00 0.00 H new ATOM 0 HG2 PRO A 58 6.728 14.771 6.691 1.00 0.00 H new ATOM 0 HG3 PRO A 58 8.391 14.566 6.177 1.00 0.00 H new ATOM 0 HD2 PRO A 58 6.040 14.828 4.484 1.00 0.00 H new ATOM 0 HD3 PRO A 58 7.708 14.667 3.971 1.00 0.00 H new ATOM 871 N HIS A 59 4.540 11.396 4.894 1.00 0.00 N ATOM 872 CA HIS A 59 3.239 10.719 5.152 1.00 0.00 C ATOM 873 C HIS A 59 3.196 9.390 4.395 1.00 0.00 C ATOM 874 O HIS A 59 2.326 8.570 4.610 1.00 0.00 O ATOM 875 CB HIS A 59 2.095 11.615 4.672 1.00 0.00 C ATOM 876 CG HIS A 59 1.822 12.676 5.704 1.00 0.00 C ATOM 877 ND1 HIS A 59 2.450 13.911 5.677 1.00 0.00 N ATOM 878 CD2 HIS A 59 0.992 12.700 6.798 1.00 0.00 C ATOM 879 CE1 HIS A 59 1.992 14.621 6.725 1.00 0.00 C ATOM 880 NE2 HIS A 59 1.101 13.930 7.441 1.00 0.00 N ATOM 0 H HIS A 59 4.536 12.066 4.125 1.00 0.00 H new ATOM 0 HA HIS A 59 3.132 10.532 6.221 1.00 0.00 H new ATOM 0 HB2 HIS A 59 2.356 12.077 3.720 1.00 0.00 H new ATOM 0 HB3 HIS A 59 1.199 11.019 4.502 1.00 0.00 H new ATOM 0 HD2 HIS A 59 0.352 11.888 7.112 1.00 0.00 H new ATOM 0 HE1 HIS A 59 2.307 15.627 6.959 1.00 0.00 H new ATOM 0 HE2 HIS A 59 0.607 14.237 8.279 1.00 0.00 H new ATOM 888 N ILE A 60 4.129 9.170 3.508 1.00 0.00 N ATOM 889 CA ILE A 60 4.140 7.895 2.738 1.00 0.00 C ATOM 890 C ILE A 60 4.871 6.819 3.543 1.00 0.00 C ATOM 891 O ILE A 60 4.932 5.671 3.150 1.00 0.00 O ATOM 892 CB ILE A 60 4.855 8.110 1.404 1.00 0.00 C ATOM 893 CG1 ILE A 60 6.351 8.318 1.655 1.00 0.00 C ATOM 894 CG2 ILE A 60 4.280 9.345 0.709 1.00 0.00 C ATOM 895 CD1 ILE A 60 6.972 9.051 0.464 1.00 0.00 C ATOM 0 H ILE A 60 4.884 9.819 3.284 1.00 0.00 H new ATOM 0 HA ILE A 60 3.115 7.575 2.552 1.00 0.00 H new ATOM 0 HB ILE A 60 4.710 7.235 0.770 1.00 0.00 H new ATOM 0 HG12 ILE A 60 6.501 8.894 2.568 1.00 0.00 H new ATOM 0 HG13 ILE A 60 6.843 7.356 1.800 1.00 0.00 H new ATOM 0 HG21 ILE A 60 4.790 9.498 -0.242 1.00 0.00 H new ATOM 0 HG22 ILE A 60 3.215 9.199 0.530 1.00 0.00 H new ATOM 0 HG23 ILE A 60 4.425 10.220 1.343 1.00 0.00 H new ATOM 0 HD11 ILE A 60 8.037 9.199 0.643 1.00 0.00 H new ATOM 0 HD12 ILE A 60 6.835 8.458 -0.440 1.00 0.00 H new ATOM 0 HD13 ILE A 60 6.487 10.019 0.340 1.00 0.00 H new ATOM 907 N LYS A 61 5.428 7.179 4.667 1.00 0.00 N ATOM 908 CA LYS A 61 6.154 6.175 5.495 1.00 0.00 C ATOM 909 C LYS A 61 5.142 5.301 6.237 1.00 0.00 C ATOM 910 O LYS A 61 4.820 5.544 7.384 1.00 0.00 O ATOM 911 CB LYS A 61 7.045 6.899 6.511 1.00 0.00 C ATOM 912 CG LYS A 61 8.198 7.605 5.786 1.00 0.00 C ATOM 913 CD LYS A 61 9.134 6.573 5.144 1.00 0.00 C ATOM 914 CE LYS A 61 10.587 7.009 5.343 1.00 0.00 C ATOM 915 NZ LYS A 61 10.765 8.394 4.821 1.00 0.00 N ATOM 0 H LYS A 61 5.412 8.125 5.048 1.00 0.00 H new ATOM 0 HA LYS A 61 6.772 5.550 4.850 1.00 0.00 H new ATOM 0 HB2 LYS A 61 6.456 7.626 7.071 1.00 0.00 H new ATOM 0 HB3 LYS A 61 7.441 6.186 7.234 1.00 0.00 H new ATOM 0 HG2 LYS A 61 7.801 8.272 5.021 1.00 0.00 H new ATOM 0 HG3 LYS A 61 8.755 8.223 6.490 1.00 0.00 H new ATOM 0 HD2 LYS A 61 8.973 5.592 5.591 1.00 0.00 H new ATOM 0 HD3 LYS A 61 8.914 6.478 4.081 1.00 0.00 H new ATOM 0 HE2 LYS A 61 10.848 6.971 6.401 1.00 0.00 H new ATOM 0 HE3 LYS A 61 11.258 6.324 4.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 11.753 8.530 4.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 10.138 8.540 4.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 10.528 9.079 5.567 1.00 0.00 H new ATOM 929 N LEU A 62 4.637 4.284 5.594 1.00 0.00 N ATOM 930 CA LEU A 62 3.646 3.395 6.264 1.00 0.00 C ATOM 931 C LEU A 62 4.380 2.245 6.956 1.00 0.00 C ATOM 932 O LEU A 62 5.273 1.640 6.399 1.00 0.00 O ATOM 933 CB LEU A 62 2.680 2.831 5.221 1.00 0.00 C ATOM 934 CG LEU A 62 2.322 3.923 4.212 1.00 0.00 C ATOM 935 CD1 LEU A 62 1.189 3.433 3.309 1.00 0.00 C ATOM 936 CD2 LEU A 62 1.869 5.178 4.960 1.00 0.00 C ATOM 0 H LEU A 62 4.868 4.030 4.633 1.00 0.00 H new ATOM 0 HA LEU A 62 3.086 3.966 7.005 1.00 0.00 H new ATOM 0 HB2 LEU A 62 3.136 1.983 4.709 1.00 0.00 H new ATOM 0 HB3 LEU A 62 1.778 2.462 5.708 1.00 0.00 H new ATOM 0 HG LEU A 62 3.196 4.156 3.604 1.00 0.00 H new ATOM 0 HD11 LEU A 62 0.934 4.212 2.590 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.510 2.538 2.776 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.315 3.200 3.916 1.00 0.00 H new ATOM 0 HD21 LEU A 62 1.614 5.957 4.242 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.995 4.944 5.568 1.00 0.00 H new ATOM 0 HD23 LEU A 62 2.675 5.529 5.604 1.00 0.00 H new ATOM 948 N GLN A 63 4.010 1.939 8.171 1.00 0.00 N ATOM 949 CA GLN A 63 4.687 0.829 8.899 1.00 0.00 C ATOM 950 C GLN A 63 3.953 -0.484 8.623 1.00 0.00 C ATOM 951 O GLN A 63 2.824 -0.673 9.032 1.00 0.00 O ATOM 952 CB GLN A 63 4.668 1.119 10.401 1.00 0.00 C ATOM 953 CG GLN A 63 5.482 0.053 11.138 1.00 0.00 C ATOM 954 CD GLN A 63 5.489 0.361 12.637 1.00 0.00 C ATOM 955 OE1 GLN A 63 6.471 0.845 13.164 1.00 0.00 O ATOM 956 NE2 GLN A 63 4.428 0.099 13.350 1.00 0.00 N ATOM 0 H GLN A 63 3.269 2.410 8.690 1.00 0.00 H new ATOM 0 HA GLN A 63 5.719 0.746 8.558 1.00 0.00 H new ATOM 0 HB2 GLN A 63 5.083 2.108 10.596 1.00 0.00 H new ATOM 0 HB3 GLN A 63 3.642 1.126 10.768 1.00 0.00 H new ATOM 0 HG2 GLN A 63 5.054 -0.934 10.961 1.00 0.00 H new ATOM 0 HG3 GLN A 63 6.503 0.031 10.756 1.00 0.00 H new ATOM 0 HE21 GLN A 63 3.604 -0.307 12.907 1.00 0.00 H new ATOM 0 HE22 GLN A 63 4.423 0.301 14.350 1.00 0.00 H new ATOM 965 N LEU A 64 4.584 -1.395 7.934 1.00 0.00 N ATOM 966 CA LEU A 64 3.921 -2.694 7.633 1.00 0.00 C ATOM 967 C LEU A 64 4.271 -3.708 8.723 1.00 0.00 C ATOM 968 O LEU A 64 5.299 -3.613 9.365 1.00 0.00 O ATOM 969 CB LEU A 64 4.405 -3.213 6.277 1.00 0.00 C ATOM 970 CG LEU A 64 3.652 -2.494 5.155 1.00 0.00 C ATOM 971 CD1 LEU A 64 3.954 -0.995 5.215 1.00 0.00 C ATOM 972 CD2 LEU A 64 4.104 -3.051 3.803 1.00 0.00 C ATOM 0 H LEU A 64 5.530 -1.295 7.567 1.00 0.00 H new ATOM 0 HA LEU A 64 2.841 -2.552 7.602 1.00 0.00 H new ATOM 0 HB2 LEU A 64 5.477 -3.047 6.174 1.00 0.00 H new ATOM 0 HB3 LEU A 64 4.241 -4.288 6.208 1.00 0.00 H new ATOM 0 HG LEU A 64 2.580 -2.653 5.276 1.00 0.00 H new ATOM 0 HD11 LEU A 64 3.418 -0.483 4.416 1.00 0.00 H new ATOM 0 HD12 LEU A 64 3.635 -0.598 6.179 1.00 0.00 H new ATOM 0 HD13 LEU A 64 5.025 -0.835 5.093 1.00 0.00 H new ATOM 0 HD21 LEU A 64 3.569 -2.541 3.002 1.00 0.00 H new ATOM 0 HD22 LEU A 64 5.176 -2.891 3.683 1.00 0.00 H new ATOM 0 HD23 LEU A 64 3.890 -4.119 3.759 1.00 0.00 H new ATOM 984 N GLN A 65 3.425 -4.679 8.938 1.00 0.00 N ATOM 985 CA GLN A 65 3.709 -5.700 9.987 1.00 0.00 C ATOM 986 C GLN A 65 3.171 -7.059 9.535 1.00 0.00 C ATOM 987 O GLN A 65 2.197 -7.144 8.814 1.00 0.00 O ATOM 988 CB GLN A 65 3.025 -5.289 11.294 1.00 0.00 C ATOM 989 CG GLN A 65 3.494 -3.890 11.699 1.00 0.00 C ATOM 990 CD GLN A 65 2.974 -3.563 13.100 1.00 0.00 C ATOM 991 OE1 GLN A 65 3.597 -2.820 13.833 1.00 0.00 O ATOM 992 NE2 GLN A 65 1.851 -4.089 13.505 1.00 0.00 N ATOM 0 H GLN A 65 2.549 -4.809 8.432 1.00 0.00 H new ATOM 0 HA GLN A 65 4.785 -5.771 10.145 1.00 0.00 H new ATOM 0 HB2 GLN A 65 1.942 -5.299 11.169 1.00 0.00 H new ATOM 0 HB3 GLN A 65 3.261 -6.005 12.081 1.00 0.00 H new ATOM 0 HG2 GLN A 65 4.583 -3.841 11.683 1.00 0.00 H new ATOM 0 HG3 GLN A 65 3.131 -3.152 10.984 1.00 0.00 H new ATOM 0 HE21 GLN A 65 1.329 -4.712 12.889 1.00 0.00 H new ATOM 0 HE22 GLN A 65 1.495 -3.877 14.437 1.00 0.00 H new ATOM 1001 N ALA A 66 3.798 -8.124 9.954 1.00 0.00 N ATOM 1002 CA ALA A 66 3.324 -9.477 9.548 1.00 0.00 C ATOM 1003 C ALA A 66 2.303 -9.987 10.567 1.00 0.00 C ATOM 1004 O ALA A 66 2.351 -9.644 11.733 1.00 0.00 O ATOM 1005 CB ALA A 66 4.512 -10.438 9.492 1.00 0.00 C ATOM 0 H ALA A 66 4.618 -8.115 10.560 1.00 0.00 H new ATOM 0 HA ALA A 66 2.858 -9.418 8.565 1.00 0.00 H new ATOM 0 HB1 ALA A 66 4.166 -11.428 9.195 1.00 0.00 H new ATOM 0 HB2 ALA A 66 5.240 -10.075 8.766 1.00 0.00 H new ATOM 0 HB3 ALA A 66 4.979 -10.497 10.475 1.00 0.00 H new ATOM 1011 N GLU A 67 1.380 -10.805 10.139 1.00 0.00 N ATOM 1012 CA GLU A 67 0.358 -11.337 11.083 1.00 0.00 C ATOM 1013 C GLU A 67 -0.016 -12.764 10.677 1.00 0.00 C ATOM 1014 O GLU A 67 -0.304 -13.038 9.529 1.00 0.00 O ATOM 1015 CB GLU A 67 -0.889 -10.451 11.039 1.00 0.00 C ATOM 1016 CG GLU A 67 -1.150 -9.867 12.429 1.00 0.00 C ATOM 1017 CD GLU A 67 -1.472 -10.999 13.407 1.00 0.00 C ATOM 1018 OE1 GLU A 67 -1.987 -12.012 12.961 1.00 0.00 O ATOM 1019 OE2 GLU A 67 -1.200 -10.834 14.585 1.00 0.00 O ATOM 0 H GLU A 67 1.290 -11.128 9.176 1.00 0.00 H new ATOM 0 HA GLU A 67 0.765 -11.341 12.094 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -0.752 -9.648 10.315 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.750 -11.033 10.710 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.276 -9.313 12.772 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.979 -9.161 12.388 1.00 0.00 H new ATOM 1026 N GLU A 68 -0.012 -13.677 11.610 1.00 0.00 N ATOM 1027 CA GLU A 68 -0.366 -15.085 11.276 1.00 0.00 C ATOM 1028 C GLU A 68 0.460 -15.547 10.073 1.00 0.00 C ATOM 1029 O GLU A 68 1.648 -15.782 10.177 1.00 0.00 O ATOM 1030 CB GLU A 68 -1.855 -15.169 10.934 1.00 0.00 C ATOM 1031 CG GLU A 68 -2.684 -14.968 12.204 1.00 0.00 C ATOM 1032 CD GLU A 68 -3.165 -16.324 12.722 1.00 0.00 C ATOM 1033 OE1 GLU A 68 -2.355 -17.234 12.779 1.00 0.00 O ATOM 1034 OE2 GLU A 68 -4.334 -16.429 13.052 1.00 0.00 O ATOM 0 H GLU A 68 0.221 -13.508 12.589 1.00 0.00 H new ATOM 0 HA GLU A 68 -0.153 -15.726 12.131 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -2.112 -14.410 10.195 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -2.082 -16.137 10.488 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -2.086 -14.468 12.966 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -3.538 -14.323 11.995 1.00 0.00 H new ATOM 1041 N ARG A 69 -0.158 -15.679 8.932 1.00 0.00 N ATOM 1042 CA ARG A 69 0.594 -16.124 7.725 1.00 0.00 C ATOM 1043 C ARG A 69 -0.117 -15.621 6.467 1.00 0.00 C ATOM 1044 O ARG A 69 -1.308 -15.794 6.304 1.00 0.00 O ATOM 1045 CB ARG A 69 0.655 -17.653 7.698 1.00 0.00 C ATOM 1046 CG ARG A 69 -0.709 -18.212 7.287 1.00 0.00 C ATOM 1047 CD ARG A 69 -0.808 -19.678 7.710 1.00 0.00 C ATOM 1048 NE ARG A 69 0.506 -20.347 7.497 1.00 0.00 N ATOM 1049 CZ ARG A 69 0.747 -21.502 8.053 1.00 0.00 C ATOM 1050 NH1 ARG A 69 -0.161 -22.072 8.796 1.00 0.00 N ATOM 1051 NH2 ARG A 69 1.898 -22.088 7.867 1.00 0.00 N ATOM 0 H ARG A 69 -1.151 -15.498 8.783 1.00 0.00 H new ATOM 0 HA ARG A 69 1.606 -15.719 7.757 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.422 -17.984 6.998 1.00 0.00 H new ATOM 0 HB3 ARG A 69 0.935 -18.034 8.680 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -1.506 -17.633 7.753 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -0.840 -18.124 6.208 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -1.097 -19.746 8.759 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -1.583 -20.183 7.133 1.00 0.00 H new ATOM 0 HE ARG A 69 1.217 -19.902 6.917 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -1.061 -21.614 8.943 1.00 0.00 H new ATOM 0 HH12 ARG A 69 0.029 -22.975 9.230 1.00 0.00 H new ATOM 0 HH21 ARG A 69 2.609 -21.643 7.287 1.00 0.00 H new ATOM 0 HH22 ARG A 69 2.087 -22.991 8.302 1.00 0.00 H new ATOM 1065 N GLY A 70 0.604 -14.997 5.576 1.00 0.00 N ATOM 1066 CA GLY A 70 -0.031 -14.483 4.330 1.00 0.00 C ATOM 1067 C GLY A 70 -0.984 -13.339 4.677 1.00 0.00 C ATOM 1068 O GLY A 70 -1.965 -13.107 3.998 1.00 0.00 O ATOM 0 H GLY A 70 1.605 -14.821 5.657 1.00 0.00 H new ATOM 0 HA2 GLY A 70 0.734 -14.135 3.636 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.575 -15.284 3.829 1.00 0.00 H new ATOM 1072 N VAL A 71 -0.705 -12.621 5.730 1.00 0.00 N ATOM 1073 CA VAL A 71 -1.594 -11.492 6.121 1.00 0.00 C ATOM 1074 C VAL A 71 -0.756 -10.378 6.753 1.00 0.00 C ATOM 1075 O VAL A 71 -0.450 -10.412 7.929 1.00 0.00 O ATOM 1076 CB VAL A 71 -2.632 -11.984 7.132 1.00 0.00 C ATOM 1077 CG1 VAL A 71 -3.552 -10.828 7.525 1.00 0.00 C ATOM 1078 CG2 VAL A 71 -3.463 -13.106 6.504 1.00 0.00 C ATOM 0 H VAL A 71 0.101 -12.768 6.337 1.00 0.00 H new ATOM 0 HA VAL A 71 -2.102 -11.108 5.236 1.00 0.00 H new ATOM 0 HB VAL A 71 -2.123 -12.360 8.020 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.291 -11.180 8.245 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -2.961 -10.029 7.972 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.061 -10.450 6.638 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -4.203 -13.457 7.223 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -3.971 -12.729 5.616 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -2.808 -13.931 6.225 1.00 0.00 H new ATOM 1088 N VAL A 72 -0.382 -9.393 5.982 1.00 0.00 N ATOM 1089 CA VAL A 72 0.437 -8.279 6.537 1.00 0.00 C ATOM 1090 C VAL A 72 -0.480 -7.128 6.958 1.00 0.00 C ATOM 1091 O VAL A 72 -1.325 -6.690 6.204 1.00 0.00 O ATOM 1092 CB VAL A 72 1.416 -7.786 5.470 1.00 0.00 C ATOM 1093 CG1 VAL A 72 2.621 -8.726 5.406 1.00 0.00 C ATOM 1094 CG2 VAL A 72 0.717 -7.765 4.108 1.00 0.00 C ATOM 0 H VAL A 72 -0.609 -9.312 4.991 1.00 0.00 H new ATOM 0 HA VAL A 72 0.992 -8.635 7.405 1.00 0.00 H new ATOM 0 HB VAL A 72 1.752 -6.781 5.725 1.00 0.00 H new ATOM 0 HG11 VAL A 72 3.318 -8.373 4.645 1.00 0.00 H new ATOM 0 HG12 VAL A 72 3.120 -8.744 6.375 1.00 0.00 H new ATOM 0 HG13 VAL A 72 2.285 -9.731 5.152 1.00 0.00 H new ATOM 0 HG21 VAL A 72 1.414 -7.414 3.347 1.00 0.00 H new ATOM 0 HG22 VAL A 72 0.381 -8.771 3.856 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -0.142 -7.095 4.150 1.00 0.00 H new ATOM 1104 N SER A 73 -0.319 -6.637 8.155 1.00 0.00 N ATOM 1105 CA SER A 73 -1.180 -5.515 8.623 1.00 0.00 C ATOM 1106 C SER A 73 -0.487 -4.184 8.325 1.00 0.00 C ATOM 1107 O SER A 73 0.615 -3.934 8.773 1.00 0.00 O ATOM 1108 CB SER A 73 -1.414 -5.644 10.129 1.00 0.00 C ATOM 1109 OG SER A 73 -1.752 -6.990 10.436 1.00 0.00 O ATOM 0 H SER A 73 0.372 -6.964 8.830 1.00 0.00 H new ATOM 0 HA SER A 73 -2.138 -5.550 8.104 1.00 0.00 H new ATOM 0 HB2 SER A 73 -0.518 -5.348 10.675 1.00 0.00 H new ATOM 0 HB3 SER A 73 -2.215 -4.975 10.443 1.00 0.00 H new ATOM 0 HG SER A 73 -1.901 -7.078 11.401 1.00 0.00 H new ATOM 1115 N ILE A 74 -1.121 -3.329 7.571 1.00 0.00 N ATOM 1116 CA ILE A 74 -0.496 -2.016 7.245 1.00 0.00 C ATOM 1117 C ILE A 74 -0.889 -0.984 8.304 1.00 0.00 C ATOM 1118 O ILE A 74 -1.962 -1.038 8.869 1.00 0.00 O ATOM 1119 CB ILE A 74 -0.980 -1.548 5.872 1.00 0.00 C ATOM 1120 CG1 ILE A 74 -0.474 -2.515 4.797 1.00 0.00 C ATOM 1121 CG2 ILE A 74 -0.440 -0.146 5.589 1.00 0.00 C ATOM 1122 CD1 ILE A 74 -1.522 -2.642 3.690 1.00 0.00 C ATOM 0 H ILE A 74 -2.045 -3.483 7.167 1.00 0.00 H new ATOM 0 HA ILE A 74 0.588 -2.125 7.231 1.00 0.00 H new ATOM 0 HB ILE A 74 -2.070 -1.526 5.860 1.00 0.00 H new ATOM 0 HG12 ILE A 74 0.467 -2.154 4.382 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -0.274 -3.492 5.237 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.786 0.186 4.610 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -0.798 0.543 6.354 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.650 -0.167 5.601 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.162 -3.330 2.925 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -2.452 -3.023 4.112 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -1.700 -1.664 3.243 1.00 0.00 H new ATOM 1134 N LYS A 75 -0.026 -0.042 8.576 1.00 0.00 N ATOM 1135 CA LYS A 75 -0.351 0.992 9.599 1.00 0.00 C ATOM 1136 C LYS A 75 0.332 2.309 9.224 1.00 0.00 C ATOM 1137 O LYS A 75 1.454 2.327 8.757 1.00 0.00 O ATOM 1138 CB LYS A 75 0.151 0.528 10.968 1.00 0.00 C ATOM 1139 CG LYS A 75 -0.410 1.444 12.057 1.00 0.00 C ATOM 1140 CD LYS A 75 0.351 1.208 13.364 1.00 0.00 C ATOM 1141 CE LYS A 75 -0.132 2.201 14.423 1.00 0.00 C ATOM 1142 NZ LYS A 75 0.191 1.676 15.779 1.00 0.00 N ATOM 0 H LYS A 75 0.888 0.056 8.135 1.00 0.00 H new ATOM 0 HA LYS A 75 -1.430 1.140 9.639 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -0.157 -0.501 11.150 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.241 0.543 10.991 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -0.318 2.487 11.753 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -1.472 1.247 12.201 1.00 0.00 H new ATOM 0 HD2 LYS A 75 0.193 0.186 13.710 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.422 1.327 13.200 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.345 3.170 14.273 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.207 2.357 14.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -0.122 2.358 16.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -0.297 0.770 15.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 1.218 1.533 15.860 1.00 0.00 H new ATOM 1156 N GLY A 76 -0.336 3.413 9.424 1.00 0.00 N ATOM 1157 CA GLY A 76 0.277 4.726 9.078 1.00 0.00 C ATOM 1158 C GLY A 76 1.106 5.232 10.259 1.00 0.00 C ATOM 1159 O GLY A 76 0.769 5.014 11.406 1.00 0.00 O ATOM 0 H GLY A 76 -1.278 3.462 9.811 1.00 0.00 H new ATOM 0 HA2 GLY A 76 0.908 4.623 8.195 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -0.501 5.448 8.831 1.00 0.00 H new ATOM 1163 N VAL A 77 2.191 5.905 9.990 1.00 0.00 N ATOM 1164 CA VAL A 77 3.041 6.424 11.099 1.00 0.00 C ATOM 1165 C VAL A 77 2.420 7.704 11.662 1.00 0.00 C ATOM 1166 O VAL A 77 1.674 7.674 12.620 1.00 0.00 O ATOM 1167 CB VAL A 77 4.442 6.730 10.566 1.00 0.00 C ATOM 1168 CG1 VAL A 77 5.257 7.441 11.648 1.00 0.00 C ATOM 1169 CG2 VAL A 77 5.137 5.422 10.182 1.00 0.00 C ATOM 0 H VAL A 77 2.526 6.118 9.050 1.00 0.00 H new ATOM 0 HA VAL A 77 3.107 5.675 11.888 1.00 0.00 H new ATOM 0 HB VAL A 77 4.364 7.373 9.689 1.00 0.00 H new ATOM 0 HG11 VAL A 77 6.255 7.659 11.268 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.762 8.373 11.923 1.00 0.00 H new ATOM 0 HG13 VAL A 77 5.335 6.799 12.525 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.135 5.638 9.802 1.00 0.00 H new ATOM 0 HG22 VAL A 77 5.214 4.780 11.059 1.00 0.00 H new ATOM 0 HG23 VAL A 77 4.557 4.915 9.411 1.00 0.00 H new ATOM 1179 N SER A 78 2.723 8.829 11.075 1.00 0.00 N ATOM 1180 CA SER A 78 2.150 10.109 11.577 1.00 0.00 C ATOM 1181 C SER A 78 0.645 9.944 11.796 1.00 0.00 C ATOM 1182 O SER A 78 0.133 10.188 12.870 1.00 0.00 O ATOM 1183 CB SER A 78 2.398 11.217 10.551 1.00 0.00 C ATOM 1184 OG SER A 78 3.144 12.262 11.161 1.00 0.00 O ATOM 0 H SER A 78 3.343 8.917 10.270 1.00 0.00 H new ATOM 0 HA SER A 78 2.627 10.374 12.520 1.00 0.00 H new ATOM 0 HB2 SER A 78 2.941 10.820 9.693 1.00 0.00 H new ATOM 0 HB3 SER A 78 1.449 11.602 10.177 1.00 0.00 H new ATOM 0 HG SER A 78 3.306 12.973 10.506 1.00 0.00 H new ATOM 1190 N ALA A 79 -0.068 9.528 10.786 1.00 0.00 N ATOM 1191 CA ALA A 79 -1.539 9.345 10.938 1.00 0.00 C ATOM 1192 C ALA A 79 -1.814 8.370 12.085 1.00 0.00 C ATOM 1193 O ALA A 79 -2.822 8.456 12.757 1.00 0.00 O ATOM 1194 CB ALA A 79 -2.121 8.784 9.639 1.00 0.00 C ATOM 0 H ALA A 79 0.304 9.307 9.862 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.005 10.306 11.158 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -3.197 8.650 9.750 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -1.924 9.479 8.822 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.657 7.823 9.418 1.00 0.00 H new ATOM 1200 N ASN A 80 -0.923 7.445 12.316 1.00 0.00 N ATOM 1201 CA ASN A 80 -1.131 6.466 13.420 1.00 0.00 C ATOM 1202 C ASN A 80 -2.519 5.834 13.290 1.00 0.00 C ATOM 1203 O ASN A 80 -3.239 5.698 14.259 1.00 0.00 O ATOM 1204 CB ASN A 80 -1.020 7.183 14.766 1.00 0.00 C ATOM 1205 CG ASN A 80 0.404 7.712 14.950 1.00 0.00 C ATOM 1206 OD1 ASN A 80 1.346 6.947 15.004 1.00 0.00 O ATOM 1207 ND2 ASN A 80 0.600 8.998 15.047 1.00 0.00 N ATOM 0 H ASN A 80 -0.059 7.325 11.787 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.372 5.686 13.360 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -1.733 8.006 14.811 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -1.272 6.498 15.576 1.00 0.00 H new ATOM 0 HD21 ASN A 80 1.545 9.362 15.168 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -0.192 9.639 15.001 1.00 0.00 H new ATOM 1214 N ARG A 81 -2.895 5.449 12.099 1.00 0.00 N ATOM 1215 CA ARG A 81 -4.235 4.823 11.893 1.00 0.00 C ATOM 1216 C ARG A 81 -4.098 3.624 10.953 1.00 0.00 C ATOM 1217 O ARG A 81 -3.294 3.627 10.041 1.00 0.00 O ATOM 1218 CB ARG A 81 -5.189 5.848 11.274 1.00 0.00 C ATOM 1219 CG ARG A 81 -5.723 6.779 12.364 1.00 0.00 C ATOM 1220 CD ARG A 81 -5.814 8.207 11.821 1.00 0.00 C ATOM 1221 NE ARG A 81 -6.348 9.108 12.880 1.00 0.00 N ATOM 1222 CZ ARG A 81 -6.226 10.402 12.758 1.00 0.00 C ATOM 1223 NH1 ARG A 81 -5.625 10.904 11.714 1.00 0.00 N ATOM 1224 NH2 ARG A 81 -6.701 11.192 13.681 1.00 0.00 N ATOM 0 H ARG A 81 -2.329 5.542 11.256 1.00 0.00 H new ATOM 0 HA ARG A 81 -4.631 4.491 12.853 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -4.670 6.427 10.510 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -6.016 5.338 10.781 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -6.705 6.442 12.695 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -5.067 6.751 13.234 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -4.830 8.549 11.500 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -6.462 8.234 10.945 1.00 0.00 H new ATOM 0 HE ARG A 81 -6.809 8.714 13.700 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -5.251 10.285 10.994 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -5.529 11.915 11.618 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -7.168 10.799 14.498 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -6.606 12.203 13.586 1.00 0.00 H new ATOM 1238 N TYR A 82 -4.875 2.597 11.168 1.00 0.00 N ATOM 1239 CA TYR A 82 -4.788 1.398 10.287 1.00 0.00 C ATOM 1240 C TYR A 82 -5.756 1.554 9.113 1.00 0.00 C ATOM 1241 O TYR A 82 -6.887 1.965 9.279 1.00 0.00 O ATOM 1242 CB TYR A 82 -5.157 0.150 11.091 1.00 0.00 C ATOM 1243 CG TYR A 82 -4.158 -0.045 12.206 1.00 0.00 C ATOM 1244 CD1 TYR A 82 -4.286 0.682 13.395 1.00 0.00 C ATOM 1245 CD2 TYR A 82 -3.106 -0.955 12.051 1.00 0.00 C ATOM 1246 CE1 TYR A 82 -3.360 0.500 14.430 1.00 0.00 C ATOM 1247 CE2 TYR A 82 -2.180 -1.137 13.086 1.00 0.00 C ATOM 1248 CZ TYR A 82 -2.308 -0.410 14.275 1.00 0.00 C ATOM 1249 OH TYR A 82 -1.396 -0.589 15.295 1.00 0.00 O ATOM 0 H TYR A 82 -5.566 2.537 11.916 1.00 0.00 H new ATOM 0 HA TYR A 82 -3.771 1.299 9.906 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -6.161 0.253 11.502 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -5.167 -0.725 10.441 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -5.099 1.383 13.514 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -3.008 -1.517 11.134 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -3.458 1.062 15.347 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -1.367 -1.838 12.967 1.00 0.00 H new ATOM 0 HH TYR A 82 -0.713 -1.233 15.014 1.00 0.00 H new ATOM 1259 N LEU A 83 -5.321 1.228 7.928 1.00 0.00 N ATOM 1260 CA LEU A 83 -6.215 1.356 6.743 1.00 0.00 C ATOM 1261 C LEU A 83 -7.402 0.402 6.900 1.00 0.00 C ATOM 1262 O LEU A 83 -7.300 -0.629 7.535 1.00 0.00 O ATOM 1263 CB LEU A 83 -5.431 0.998 5.474 1.00 0.00 C ATOM 1264 CG LEU A 83 -6.308 1.204 4.232 1.00 0.00 C ATOM 1265 CD1 LEU A 83 -6.698 2.679 4.103 1.00 0.00 C ATOM 1266 CD2 LEU A 83 -5.527 0.778 2.987 1.00 0.00 C ATOM 0 H LEU A 83 -4.384 0.878 7.728 1.00 0.00 H new ATOM 0 HA LEU A 83 -6.580 2.380 6.666 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -4.537 1.618 5.403 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -5.097 -0.038 5.524 1.00 0.00 H new ATOM 0 HG LEU A 83 -7.212 0.602 4.329 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -7.320 2.815 3.218 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -7.254 2.987 4.989 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -5.798 3.287 4.010 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -6.146 0.923 2.102 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -4.623 1.381 2.900 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -5.254 -0.274 3.071 1.00 0.00 H new ATOM 1278 N ALA A 84 -8.525 0.739 6.325 1.00 0.00 N ATOM 1279 CA ALA A 84 -9.721 -0.146 6.435 1.00 0.00 C ATOM 1280 C ALA A 84 -10.486 -0.136 5.111 1.00 0.00 C ATOM 1281 O ALA A 84 -10.360 0.779 4.320 1.00 0.00 O ATOM 1282 CB ALA A 84 -10.633 0.363 7.553 1.00 0.00 C ATOM 0 H ALA A 84 -8.666 1.591 5.782 1.00 0.00 H new ATOM 0 HA ALA A 84 -9.400 -1.162 6.663 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -11.507 -0.284 7.633 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.089 0.356 8.498 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.954 1.380 7.326 1.00 0.00 H new ATOM 1288 N MET A 85 -11.275 -1.147 4.866 1.00 0.00 N ATOM 1289 CA MET A 85 -12.051 -1.209 3.594 1.00 0.00 C ATOM 1290 C MET A 85 -13.461 -1.729 3.882 1.00 0.00 C ATOM 1291 O MET A 85 -13.639 -2.738 4.537 1.00 0.00 O ATOM 1292 CB MET A 85 -11.346 -2.155 2.616 1.00 0.00 C ATOM 1293 CG MET A 85 -12.184 -2.302 1.344 1.00 0.00 C ATOM 1294 SD MET A 85 -11.228 -3.197 0.094 1.00 0.00 S ATOM 1295 CE MET A 85 -10.363 -1.767 -0.601 1.00 0.00 C ATOM 0 H MET A 85 -11.416 -1.937 5.496 1.00 0.00 H new ATOM 0 HA MET A 85 -12.115 -0.213 3.156 1.00 0.00 H new ATOM 0 HB2 MET A 85 -10.358 -1.767 2.369 1.00 0.00 H new ATOM 0 HB3 MET A 85 -11.199 -3.130 3.081 1.00 0.00 H new ATOM 0 HG2 MET A 85 -13.108 -2.838 1.564 1.00 0.00 H new ATOM 0 HG3 MET A 85 -12.467 -1.320 0.966 1.00 0.00 H new ATOM 0 HE1 MET A 85 -9.718 -2.093 -1.417 1.00 0.00 H new ATOM 0 HE2 MET A 85 -11.091 -1.049 -0.978 1.00 0.00 H new ATOM 0 HE3 MET A 85 -9.758 -1.296 0.174 1.00 0.00 H new ATOM 1305 N LYS A 86 -14.464 -1.050 3.395 1.00 0.00 N ATOM 1306 CA LYS A 86 -15.862 -1.505 3.635 1.00 0.00 C ATOM 1307 C LYS A 86 -16.325 -2.367 2.459 1.00 0.00 C ATOM 1308 O LYS A 86 -15.549 -2.722 1.594 1.00 0.00 O ATOM 1309 CB LYS A 86 -16.781 -0.288 3.768 1.00 0.00 C ATOM 1310 CG LYS A 86 -16.669 0.291 5.183 1.00 0.00 C ATOM 1311 CD LYS A 86 -15.197 0.498 5.542 1.00 0.00 C ATOM 1312 CE LYS A 86 -15.090 1.416 6.761 1.00 0.00 C ATOM 1313 NZ LYS A 86 -15.801 0.797 7.916 1.00 0.00 N ATOM 0 H LYS A 86 -14.375 -0.199 2.840 1.00 0.00 H new ATOM 0 HA LYS A 86 -15.901 -2.090 4.554 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -16.508 0.468 3.032 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -17.812 -0.575 3.562 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -17.204 1.239 5.242 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -17.136 -0.384 5.900 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -14.726 -0.462 5.754 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -14.664 0.935 4.697 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -14.043 1.583 7.013 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -15.523 2.390 6.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -15.522 1.279 8.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -16.828 0.890 7.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -15.550 -0.210 7.979 1.00 0.00 H new ATOM 1327 N GLU A 87 -17.585 -2.706 2.419 1.00 0.00 N ATOM 1328 CA GLU A 87 -18.096 -3.546 1.298 1.00 0.00 C ATOM 1329 C GLU A 87 -18.647 -2.644 0.191 1.00 0.00 C ATOM 1330 O GLU A 87 -18.862 -3.074 -0.926 1.00 0.00 O ATOM 1331 CB GLU A 87 -19.212 -4.457 1.814 1.00 0.00 C ATOM 1332 CG GLU A 87 -20.423 -3.609 2.208 1.00 0.00 C ATOM 1333 CD GLU A 87 -21.341 -3.436 0.997 1.00 0.00 C ATOM 1334 OE1 GLU A 87 -21.683 -4.437 0.390 1.00 0.00 O ATOM 1335 OE2 GLU A 87 -21.686 -2.305 0.697 1.00 0.00 O ATOM 0 H GLU A 87 -18.282 -2.438 3.114 1.00 0.00 H new ATOM 0 HA GLU A 87 -17.283 -4.153 0.900 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -19.493 -5.176 1.045 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -18.861 -5.029 2.673 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -20.965 -4.087 3.023 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -20.095 -2.635 2.571 1.00 0.00 H new ATOM 1342 N ASP A 88 -18.879 -1.394 0.489 1.00 0.00 N ATOM 1343 CA ASP A 88 -19.417 -0.467 -0.546 1.00 0.00 C ATOM 1344 C ASP A 88 -18.265 0.071 -1.398 1.00 0.00 C ATOM 1345 O ASP A 88 -18.474 0.770 -2.371 1.00 0.00 O ATOM 1346 CB ASP A 88 -20.134 0.700 0.136 1.00 0.00 C ATOM 1347 CG ASP A 88 -19.320 1.164 1.345 1.00 0.00 C ATOM 1348 OD1 ASP A 88 -18.109 1.024 1.307 1.00 0.00 O ATOM 1349 OD2 ASP A 88 -19.922 1.653 2.288 1.00 0.00 O ATOM 0 H ASP A 88 -18.719 -0.975 1.405 1.00 0.00 H new ATOM 0 HA ASP A 88 -20.121 -1.004 -1.183 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -20.262 1.523 -0.567 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -21.131 0.393 0.452 1.00 0.00 H new ATOM 1354 N GLY A 89 -17.051 -0.249 -1.041 1.00 0.00 N ATOM 1355 CA GLY A 89 -15.885 0.243 -1.828 1.00 0.00 C ATOM 1356 C GLY A 89 -15.351 1.532 -1.201 1.00 0.00 C ATOM 1357 O GLY A 89 -14.492 2.192 -1.750 1.00 0.00 O ATOM 0 H GLY A 89 -16.816 -0.831 -0.237 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -15.102 -0.515 -1.849 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -16.181 0.425 -2.861 1.00 0.00 H new ATOM 1361 N ARG A 90 -15.855 1.897 -0.053 1.00 0.00 N ATOM 1362 CA ARG A 90 -15.374 3.142 0.609 1.00 0.00 C ATOM 1363 C ARG A 90 -14.120 2.830 1.427 1.00 0.00 C ATOM 1364 O ARG A 90 -14.183 2.188 2.456 1.00 0.00 O ATOM 1365 CB ARG A 90 -16.467 3.682 1.533 1.00 0.00 C ATOM 1366 CG ARG A 90 -17.692 4.072 0.704 1.00 0.00 C ATOM 1367 CD ARG A 90 -18.794 4.590 1.630 1.00 0.00 C ATOM 1368 NE ARG A 90 -20.021 4.873 0.833 1.00 0.00 N ATOM 1369 CZ ARG A 90 -21.170 5.032 1.434 1.00 0.00 C ATOM 1370 NH1 ARG A 90 -21.244 4.941 2.734 1.00 0.00 N ATOM 1371 NH2 ARG A 90 -22.243 5.282 0.736 1.00 0.00 N ATOM 0 H ARG A 90 -16.578 1.387 0.454 1.00 0.00 H new ATOM 0 HA ARG A 90 -15.137 3.890 -0.148 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -16.740 2.927 2.271 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -16.097 4.547 2.084 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -17.423 4.839 -0.022 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -18.051 3.211 0.140 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -19.011 3.852 2.402 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -18.461 5.495 2.138 1.00 0.00 H new ATOM 0 HE ARG A 90 -19.964 4.943 -0.183 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -20.405 4.746 3.280 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -22.141 5.065 3.204 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -22.185 5.353 -0.280 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -23.140 5.406 1.206 1.00 0.00 H new ATOM 1385 N LEU A 91 -12.980 3.277 0.976 1.00 0.00 N ATOM 1386 CA LEU A 91 -11.721 3.005 1.724 1.00 0.00 C ATOM 1387 C LEU A 91 -11.416 4.179 2.654 1.00 0.00 C ATOM 1388 O LEU A 91 -11.447 5.325 2.252 1.00 0.00 O ATOM 1389 CB LEU A 91 -10.566 2.828 0.734 1.00 0.00 C ATOM 1390 CG LEU A 91 -10.752 1.528 -0.053 1.00 0.00 C ATOM 1391 CD1 LEU A 91 -12.027 1.606 -0.899 1.00 0.00 C ATOM 1392 CD2 LEU A 91 -9.547 1.314 -0.973 1.00 0.00 C ATOM 0 H LEU A 91 -12.866 3.820 0.120 1.00 0.00 H new ATOM 0 HA LEU A 91 -11.839 2.095 2.312 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -10.528 3.676 0.050 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -9.616 2.807 1.269 1.00 0.00 H new ATOM 0 HG LEU A 91 -10.836 0.696 0.646 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -12.152 0.677 -1.456 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -12.888 1.757 -0.247 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -11.950 2.440 -1.597 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -9.678 0.389 -1.534 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -9.466 2.151 -1.667 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -8.639 1.250 -0.374 1.00 0.00 H new ATOM 1404 N LEU A 92 -11.118 3.905 3.895 1.00 0.00 N ATOM 1405 CA LEU A 92 -10.808 5.012 4.843 1.00 0.00 C ATOM 1406 C LEU A 92 -9.825 4.517 5.907 1.00 0.00 C ATOM 1407 O LEU A 92 -9.505 3.346 5.970 1.00 0.00 O ATOM 1408 CB LEU A 92 -12.100 5.506 5.511 1.00 0.00 C ATOM 1409 CG LEU A 92 -12.901 4.323 6.081 1.00 0.00 C ATOM 1410 CD1 LEU A 92 -12.204 3.736 7.316 1.00 0.00 C ATOM 1411 CD2 LEU A 92 -14.296 4.811 6.478 1.00 0.00 C ATOM 0 H LEU A 92 -11.076 2.966 4.292 1.00 0.00 H new ATOM 0 HA LEU A 92 -10.356 5.839 4.295 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -11.858 6.207 6.310 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -12.707 6.047 4.785 1.00 0.00 H new ATOM 0 HG LEU A 92 -12.971 3.547 5.318 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -12.789 2.901 7.701 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.209 3.386 7.040 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -12.118 4.504 8.085 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -14.871 3.978 6.883 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -14.207 5.592 7.233 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -14.805 5.211 5.601 1.00 0.00 H new ATOM 1423 N ALA A 93 -9.342 5.405 6.738 1.00 0.00 N ATOM 1424 CA ALA A 93 -8.374 5.001 7.802 1.00 0.00 C ATOM 1425 C ALA A 93 -9.085 4.977 9.157 1.00 0.00 C ATOM 1426 O ALA A 93 -10.117 5.591 9.338 1.00 0.00 O ATOM 1427 CB ALA A 93 -7.224 6.009 7.850 1.00 0.00 C ATOM 0 H ALA A 93 -9.578 6.397 6.725 1.00 0.00 H new ATOM 0 HA ALA A 93 -7.982 4.009 7.580 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.516 5.717 8.626 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -6.717 6.029 6.885 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -7.618 7.000 8.074 1.00 0.00 H new ATOM 1433 N SER A 94 -8.537 4.275 10.111 1.00 0.00 N ATOM 1434 CA SER A 94 -9.179 4.214 11.454 1.00 0.00 C ATOM 1435 C SER A 94 -8.103 4.021 12.525 1.00 0.00 C ATOM 1436 O SER A 94 -6.985 3.646 12.233 1.00 0.00 O ATOM 1437 CB SER A 94 -10.157 3.040 11.499 1.00 0.00 C ATOM 1438 OG SER A 94 -9.479 1.881 11.964 1.00 0.00 O ATOM 0 H SER A 94 -7.673 3.741 10.018 1.00 0.00 H new ATOM 0 HA SER A 94 -9.717 5.143 11.642 1.00 0.00 H new ATOM 0 HB2 SER A 94 -10.994 3.274 12.157 1.00 0.00 H new ATOM 0 HB3 SER A 94 -10.572 2.859 10.507 1.00 0.00 H new ATOM 0 HG SER A 94 -9.956 1.511 12.736 1.00 0.00 H new ATOM 1444 N LYS A 95 -8.431 4.274 13.762 1.00 0.00 N ATOM 1445 CA LYS A 95 -7.426 4.103 14.849 1.00 0.00 C ATOM 1446 C LYS A 95 -7.474 2.664 15.366 1.00 0.00 C ATOM 1447 O LYS A 95 -6.468 2.098 15.747 1.00 0.00 O ATOM 1448 CB LYS A 95 -7.744 5.066 15.995 1.00 0.00 C ATOM 1449 CG LYS A 95 -7.534 6.509 15.529 1.00 0.00 C ATOM 1450 CD LYS A 95 -7.530 7.442 16.741 1.00 0.00 C ATOM 1451 CE LYS A 95 -8.847 7.296 17.505 1.00 0.00 C ATOM 1452 NZ LYS A 95 -9.059 8.494 18.365 1.00 0.00 N ATOM 0 H LYS A 95 -9.351 4.592 14.067 1.00 0.00 H new ATOM 0 HA LYS A 95 -6.431 4.317 14.460 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -8.773 4.926 16.325 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -7.103 4.853 16.851 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -6.591 6.594 14.988 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -8.325 6.798 14.837 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -6.691 7.203 17.394 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -7.398 8.474 16.417 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -9.675 7.187 16.805 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -8.826 6.395 18.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -9.955 8.394 18.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -8.274 8.579 19.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -9.097 9.346 17.770 1.00 0.00 H new ATOM 1466 N SER A 96 -8.635 2.069 15.383 1.00 0.00 N ATOM 1467 CA SER A 96 -8.749 0.667 15.876 1.00 0.00 C ATOM 1468 C SER A 96 -8.648 -0.299 14.693 1.00 0.00 C ATOM 1469 O SER A 96 -9.318 -0.142 13.692 1.00 0.00 O ATOM 1470 CB SER A 96 -10.097 0.480 16.573 1.00 0.00 C ATOM 1471 OG SER A 96 -10.513 -0.872 16.433 1.00 0.00 O ATOM 0 H SER A 96 -9.510 2.493 15.077 1.00 0.00 H new ATOM 0 HA SER A 96 -7.944 0.463 16.582 1.00 0.00 H new ATOM 0 HB2 SER A 96 -10.013 0.740 17.628 1.00 0.00 H new ATOM 0 HB3 SER A 96 -10.840 1.148 16.138 1.00 0.00 H new ATOM 0 HG SER A 96 -11.376 -0.997 16.880 1.00 0.00 H new ATOM 1477 N VAL A 97 -7.816 -1.299 14.801 1.00 0.00 N ATOM 1478 CA VAL A 97 -7.674 -2.274 13.682 1.00 0.00 C ATOM 1479 C VAL A 97 -8.801 -3.306 13.760 1.00 0.00 C ATOM 1480 O VAL A 97 -8.775 -4.208 14.574 1.00 0.00 O ATOM 1481 CB VAL A 97 -6.322 -2.983 13.792 1.00 0.00 C ATOM 1482 CG1 VAL A 97 -6.251 -3.751 15.114 1.00 0.00 C ATOM 1483 CG2 VAL A 97 -6.162 -3.960 12.627 1.00 0.00 C ATOM 0 H VAL A 97 -7.229 -1.483 15.615 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.730 -1.747 12.730 1.00 0.00 H new ATOM 0 HB VAL A 97 -5.522 -2.243 13.759 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -5.288 -4.255 15.191 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -6.364 -3.055 15.945 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -7.051 -4.490 15.149 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -5.199 -4.465 12.705 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.963 -4.699 12.659 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -6.210 -3.414 11.685 1.00 0.00 H new ATOM 1493 N THR A 98 -9.791 -3.180 12.918 1.00 0.00 N ATOM 1494 CA THR A 98 -10.922 -4.152 12.940 1.00 0.00 C ATOM 1495 C THR A 98 -10.680 -5.240 11.893 1.00 0.00 C ATOM 1496 O THR A 98 -9.844 -5.102 11.022 1.00 0.00 O ATOM 1497 CB THR A 98 -12.229 -3.421 12.622 1.00 0.00 C ATOM 1498 OG1 THR A 98 -12.173 -2.912 11.296 1.00 0.00 O ATOM 1499 CG2 THR A 98 -12.421 -2.266 13.606 1.00 0.00 C ATOM 0 H THR A 98 -9.866 -2.445 12.215 1.00 0.00 H new ATOM 0 HA THR A 98 -10.990 -4.607 13.928 1.00 0.00 H new ATOM 0 HB THR A 98 -13.066 -4.114 12.711 1.00 0.00 H new ATOM 0 HG1 THR A 98 -13.009 -2.445 11.089 1.00 0.00 H new ATOM 0 HG21 THR A 98 -13.352 -1.746 13.379 1.00 0.00 H new ATOM 0 HG22 THR A 98 -12.462 -2.657 14.623 1.00 0.00 H new ATOM 0 HG23 THR A 98 -11.586 -1.571 13.518 1.00 0.00 H new ATOM 1507 N ASP A 99 -11.404 -6.323 11.970 1.00 0.00 N ATOM 1508 CA ASP A 99 -11.214 -7.419 10.978 1.00 0.00 C ATOM 1509 C ASP A 99 -11.233 -6.834 9.565 1.00 0.00 C ATOM 1510 O ASP A 99 -10.788 -7.455 8.620 1.00 0.00 O ATOM 1511 CB ASP A 99 -12.345 -8.440 11.123 1.00 0.00 C ATOM 1512 CG ASP A 99 -11.866 -9.615 11.976 1.00 0.00 C ATOM 1513 OD1 ASP A 99 -11.613 -9.406 13.150 1.00 0.00 O ATOM 1514 OD2 ASP A 99 -11.759 -10.707 11.439 1.00 0.00 O ATOM 0 H ASP A 99 -12.119 -6.496 12.677 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.257 -7.910 11.156 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -13.214 -7.972 11.585 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -12.658 -8.794 10.141 1.00 0.00 H new ATOM 1519 N GLU A 100 -11.744 -5.643 9.413 1.00 0.00 N ATOM 1520 CA GLU A 100 -11.790 -5.019 8.062 1.00 0.00 C ATOM 1521 C GLU A 100 -10.539 -4.164 7.851 1.00 0.00 C ATOM 1522 O GLU A 100 -10.618 -3.019 7.453 1.00 0.00 O ATOM 1523 CB GLU A 100 -13.036 -4.134 7.951 1.00 0.00 C ATOM 1524 CG GLU A 100 -14.290 -4.984 8.172 1.00 0.00 C ATOM 1525 CD GLU A 100 -14.741 -4.858 9.629 1.00 0.00 C ATOM 1526 OE1 GLU A 100 -15.186 -3.784 10.001 1.00 0.00 O ATOM 1527 OE2 GLU A 100 -14.635 -5.838 10.348 1.00 0.00 O ATOM 0 H GLU A 100 -12.132 -5.075 10.167 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.829 -5.800 7.303 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -12.993 -3.333 8.689 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -13.073 -3.662 6.969 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -15.087 -4.657 7.504 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -14.082 -6.027 7.933 1.00 0.00 H new ATOM 1534 N CYS A 101 -9.384 -4.714 8.118 1.00 0.00 N ATOM 1535 CA CYS A 101 -8.125 -3.936 7.936 1.00 0.00 C ATOM 1536 C CYS A 101 -7.021 -4.862 7.417 1.00 0.00 C ATOM 1537 O CYS A 101 -5.877 -4.472 7.301 1.00 0.00 O ATOM 1538 CB CYS A 101 -7.697 -3.340 9.279 1.00 0.00 C ATOM 1539 SG CYS A 101 -8.641 -1.829 9.595 1.00 0.00 S ATOM 0 H CYS A 101 -9.259 -5.669 8.454 1.00 0.00 H new ATOM 0 HA CYS A 101 -8.295 -3.134 7.217 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -7.865 -4.061 10.079 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -6.630 -3.119 9.268 1.00 0.00 H new ATOM 0 HG CYS A 101 -8.192 -0.871 8.840 1.00 0.00 H new ATOM 1545 N PHE A 102 -7.358 -6.084 7.100 1.00 0.00 N ATOM 1546 CA PHE A 102 -6.330 -7.036 6.586 1.00 0.00 C ATOM 1547 C PHE A 102 -6.373 -7.056 5.057 1.00 0.00 C ATOM 1548 O PHE A 102 -7.386 -6.773 4.451 1.00 0.00 O ATOM 1549 CB PHE A 102 -6.623 -8.439 7.120 1.00 0.00 C ATOM 1550 CG PHE A 102 -6.419 -8.464 8.616 1.00 0.00 C ATOM 1551 CD1 PHE A 102 -5.138 -8.274 9.150 1.00 0.00 C ATOM 1552 CD2 PHE A 102 -7.508 -8.679 9.472 1.00 0.00 C ATOM 1553 CE1 PHE A 102 -4.946 -8.298 10.537 1.00 0.00 C ATOM 1554 CE2 PHE A 102 -7.315 -8.703 10.857 1.00 0.00 C ATOM 1555 CZ PHE A 102 -6.034 -8.512 11.390 1.00 0.00 C ATOM 0 H PHE A 102 -8.301 -6.464 7.175 1.00 0.00 H new ATOM 0 HA PHE A 102 -5.342 -6.718 6.919 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -7.646 -8.725 6.877 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -5.967 -9.166 6.641 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -4.298 -8.109 8.492 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -8.496 -8.826 9.062 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -3.958 -8.151 10.948 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -8.154 -8.869 11.516 1.00 0.00 H new ATOM 0 HZ PHE A 102 -5.886 -8.530 12.460 1.00 0.00 H new ATOM 1565 N PHE A 103 -5.279 -7.392 4.429 1.00 0.00 N ATOM 1566 CA PHE A 103 -5.258 -7.433 2.940 1.00 0.00 C ATOM 1567 C PHE A 103 -4.256 -8.489 2.473 1.00 0.00 C ATOM 1568 O PHE A 103 -3.068 -8.373 2.700 1.00 0.00 O ATOM 1569 CB PHE A 103 -4.844 -6.063 2.398 1.00 0.00 C ATOM 1570 CG PHE A 103 -5.883 -5.034 2.774 1.00 0.00 C ATOM 1571 CD1 PHE A 103 -5.837 -4.422 4.033 1.00 0.00 C ATOM 1572 CD2 PHE A 103 -6.892 -4.693 1.867 1.00 0.00 C ATOM 1573 CE1 PHE A 103 -6.800 -3.468 4.383 1.00 0.00 C ATOM 1574 CE2 PHE A 103 -7.855 -3.739 2.216 1.00 0.00 C ATOM 1575 CZ PHE A 103 -7.809 -3.127 3.474 1.00 0.00 C ATOM 0 H PHE A 103 -4.400 -7.640 4.883 1.00 0.00 H new ATOM 0 HA PHE A 103 -6.252 -7.686 2.570 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -3.873 -5.779 2.803 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -4.737 -6.107 1.314 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -5.059 -4.686 4.734 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -6.928 -5.166 0.897 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -6.765 -2.995 5.353 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -8.633 -3.475 1.515 1.00 0.00 H new ATOM 0 HZ PHE A 103 -8.552 -2.391 3.744 1.00 0.00 H new ATOM 1585 N PHE A 104 -4.722 -9.519 1.820 1.00 0.00 N ATOM 1586 CA PHE A 104 -3.789 -10.577 1.340 1.00 0.00 C ATOM 1587 C PHE A 104 -2.697 -9.934 0.484 1.00 0.00 C ATOM 1588 O PHE A 104 -2.906 -8.905 -0.128 1.00 0.00 O ATOM 1589 CB PHE A 104 -4.557 -11.596 0.495 1.00 0.00 C ATOM 1590 CG PHE A 104 -5.284 -12.565 1.399 1.00 0.00 C ATOM 1591 CD1 PHE A 104 -4.558 -13.434 2.222 1.00 0.00 C ATOM 1592 CD2 PHE A 104 -6.685 -12.596 1.411 1.00 0.00 C ATOM 1593 CE1 PHE A 104 -5.231 -14.334 3.056 1.00 0.00 C ATOM 1594 CE2 PHE A 104 -7.357 -13.497 2.246 1.00 0.00 C ATOM 1595 CZ PHE A 104 -6.631 -14.365 3.069 1.00 0.00 C ATOM 0 H PHE A 104 -5.706 -9.673 1.599 1.00 0.00 H new ATOM 0 HA PHE A 104 -3.340 -11.081 2.196 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -5.269 -11.083 -0.152 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -3.868 -12.137 -0.154 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -3.478 -13.410 2.213 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -7.246 -11.926 0.777 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.670 -15.005 3.690 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -8.437 -13.522 2.255 1.00 0.00 H new ATOM 0 HZ PHE A 104 -7.150 -15.059 3.714 1.00 0.00 H new ATOM 1605 N GLU A 105 -1.537 -10.537 0.439 1.00 0.00 N ATOM 1606 CA GLU A 105 -0.418 -9.975 -0.375 1.00 0.00 C ATOM 1607 C GLU A 105 0.088 -11.042 -1.349 1.00 0.00 C ATOM 1608 O GLU A 105 0.980 -11.805 -1.038 1.00 0.00 O ATOM 1609 CB GLU A 105 0.723 -9.552 0.552 1.00 0.00 C ATOM 1610 CG GLU A 105 1.808 -8.845 -0.262 1.00 0.00 C ATOM 1611 CD GLU A 105 2.942 -8.409 0.667 1.00 0.00 C ATOM 1612 OE1 GLU A 105 3.433 -9.249 1.404 1.00 0.00 O ATOM 1613 OE2 GLU A 105 3.301 -7.244 0.626 1.00 0.00 O ATOM 0 H GLU A 105 -1.316 -11.401 0.935 1.00 0.00 H new ATOM 0 HA GLU A 105 -0.773 -9.109 -0.934 1.00 0.00 H new ATOM 0 HB2 GLU A 105 0.346 -8.888 1.330 1.00 0.00 H new ATOM 0 HB3 GLU A 105 1.141 -10.425 1.053 1.00 0.00 H new ATOM 0 HG2 GLU A 105 2.192 -9.513 -1.033 1.00 0.00 H new ATOM 0 HG3 GLU A 105 1.388 -7.978 -0.772 1.00 0.00 H new ATOM 1620 N ARG A 106 -0.475 -11.099 -2.524 1.00 0.00 N ATOM 1621 CA ARG A 106 -0.025 -12.117 -3.515 1.00 0.00 C ATOM 1622 C ARG A 106 1.106 -11.533 -4.364 1.00 0.00 C ATOM 1623 O ARG A 106 0.942 -10.529 -5.028 1.00 0.00 O ATOM 1624 CB ARG A 106 -1.198 -12.503 -4.419 1.00 0.00 C ATOM 1625 CG ARG A 106 -0.855 -13.784 -5.181 1.00 0.00 C ATOM 1626 CD ARG A 106 -1.594 -14.966 -4.551 1.00 0.00 C ATOM 1627 NE ARG A 106 -1.012 -16.241 -5.057 1.00 0.00 N ATOM 1628 CZ ARG A 106 -1.272 -17.366 -4.444 1.00 0.00 C ATOM 1629 NH1 ARG A 106 -2.039 -17.371 -3.389 1.00 0.00 N ATOM 1630 NH2 ARG A 106 -0.762 -18.482 -4.888 1.00 0.00 N ATOM 0 H ARG A 106 -1.226 -10.486 -2.841 1.00 0.00 H new ATOM 0 HA ARG A 106 0.334 -13.003 -2.991 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -2.097 -12.652 -3.822 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -1.411 -11.696 -5.120 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -1.136 -13.683 -6.229 1.00 0.00 H new ATOM 0 HG3 ARG A 106 0.221 -13.958 -5.155 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -1.513 -14.922 -3.465 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -2.655 -14.916 -4.794 1.00 0.00 H new ATOM 0 HE ARG A 106 -0.411 -16.236 -5.881 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -2.436 -16.497 -3.043 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -2.242 -18.249 -2.910 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -0.161 -18.476 -5.712 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -0.964 -19.361 -4.411 1.00 0.00 H new ATOM 1644 N LEU A 107 2.253 -12.155 -4.347 1.00 0.00 N ATOM 1645 CA LEU A 107 3.395 -11.636 -5.150 1.00 0.00 C ATOM 1646 C LEU A 107 3.385 -12.297 -6.530 1.00 0.00 C ATOM 1647 O LEU A 107 3.483 -13.503 -6.652 1.00 0.00 O ATOM 1648 CB LEU A 107 4.709 -11.956 -4.426 1.00 0.00 C ATOM 1649 CG LEU A 107 5.909 -11.635 -5.324 1.00 0.00 C ATOM 1650 CD1 LEU A 107 5.785 -10.214 -5.875 1.00 0.00 C ATOM 1651 CD2 LEU A 107 7.196 -11.746 -4.503 1.00 0.00 C ATOM 0 H LEU A 107 2.448 -13.001 -3.811 1.00 0.00 H new ATOM 0 HA LEU A 107 3.304 -10.556 -5.269 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.773 -11.379 -3.504 1.00 0.00 H new ATOM 0 HB3 LEU A 107 4.729 -13.009 -4.145 1.00 0.00 H new ATOM 0 HG LEU A 107 5.934 -12.341 -6.154 1.00 0.00 H new ATOM 0 HD11 LEU A 107 6.642 -9.995 -6.512 1.00 0.00 H new ATOM 0 HD12 LEU A 107 4.868 -10.129 -6.458 1.00 0.00 H new ATOM 0 HD13 LEU A 107 5.756 -9.504 -5.048 1.00 0.00 H new ATOM 0 HD21 LEU A 107 8.053 -11.519 -5.137 1.00 0.00 H new ATOM 0 HD22 LEU A 107 7.161 -11.039 -3.674 1.00 0.00 H new ATOM 0 HD23 LEU A 107 7.292 -12.759 -4.113 1.00 0.00 H new ATOM 1663 N GLU A 108 3.270 -11.520 -7.572 1.00 0.00 N ATOM 1664 CA GLU A 108 3.256 -12.105 -8.942 1.00 0.00 C ATOM 1665 C GLU A 108 4.693 -12.300 -9.428 1.00 0.00 C ATOM 1666 O GLU A 108 5.639 -12.117 -8.688 1.00 0.00 O ATOM 1667 CB GLU A 108 2.519 -11.161 -9.893 1.00 0.00 C ATOM 1668 CG GLU A 108 1.032 -11.128 -9.531 1.00 0.00 C ATOM 1669 CD GLU A 108 0.358 -12.407 -10.031 1.00 0.00 C ATOM 1670 OE1 GLU A 108 0.506 -12.712 -11.203 1.00 0.00 O ATOM 1671 OE2 GLU A 108 -0.296 -13.059 -9.233 1.00 0.00 O ATOM 0 H GLU A 108 3.185 -10.504 -7.533 1.00 0.00 H new ATOM 0 HA GLU A 108 2.746 -13.068 -8.920 1.00 0.00 H new ATOM 0 HB2 GLU A 108 2.942 -10.159 -9.827 1.00 0.00 H new ATOM 0 HB3 GLU A 108 2.646 -11.494 -10.923 1.00 0.00 H new ATOM 0 HG2 GLU A 108 0.911 -11.039 -8.451 1.00 0.00 H new ATOM 0 HG3 GLU A 108 0.557 -10.255 -9.978 1.00 0.00 H new ATOM 1678 N SER A 109 4.865 -12.671 -10.668 1.00 0.00 N ATOM 1679 CA SER A 109 6.241 -12.877 -11.200 1.00 0.00 C ATOM 1680 C SER A 109 6.736 -11.584 -11.851 1.00 0.00 C ATOM 1681 O SER A 109 7.920 -11.380 -12.027 1.00 0.00 O ATOM 1682 CB SER A 109 6.223 -13.996 -12.242 1.00 0.00 C ATOM 1683 OG SER A 109 5.158 -13.771 -13.155 1.00 0.00 O ATOM 0 H SER A 109 4.112 -12.840 -11.335 1.00 0.00 H new ATOM 0 HA SER A 109 6.908 -13.151 -10.383 1.00 0.00 H new ATOM 0 HB2 SER A 109 7.173 -14.028 -12.775 1.00 0.00 H new ATOM 0 HB3 SER A 109 6.100 -14.962 -11.753 1.00 0.00 H new ATOM 0 HG SER A 109 4.995 -12.808 -13.237 1.00 0.00 H new ATOM 1689 N ASN A 110 5.837 -10.708 -12.211 1.00 0.00 N ATOM 1690 CA ASN A 110 6.257 -9.430 -12.850 1.00 0.00 C ATOM 1691 C ASN A 110 6.857 -8.501 -11.792 1.00 0.00 C ATOM 1692 O ASN A 110 6.850 -7.295 -11.937 1.00 0.00 O ATOM 1693 CB ASN A 110 5.042 -8.757 -13.492 1.00 0.00 C ATOM 1694 CG ASN A 110 4.309 -9.765 -14.379 1.00 0.00 C ATOM 1695 OD1 ASN A 110 4.128 -10.906 -14.000 1.00 0.00 O ATOM 1696 ND2 ASN A 110 3.876 -9.391 -15.551 1.00 0.00 N ATOM 0 H ASN A 110 4.831 -10.823 -12.090 1.00 0.00 H new ATOM 0 HA ASN A 110 7.005 -9.636 -13.616 1.00 0.00 H new ATOM 0 HB2 ASN A 110 4.371 -8.381 -12.720 1.00 0.00 H new ATOM 0 HB3 ASN A 110 5.359 -7.899 -14.084 1.00 0.00 H new ATOM 0 HD21 ASN A 110 3.386 -10.056 -16.149 1.00 0.00 H new ATOM 0 HD22 ASN A 110 4.028 -8.434 -15.869 1.00 0.00 H new ATOM 1703 N ASN A 111 7.375 -9.054 -10.728 1.00 0.00 N ATOM 1704 CA ASN A 111 7.977 -8.208 -9.657 1.00 0.00 C ATOM 1705 C ASN A 111 6.913 -7.270 -9.080 1.00 0.00 C ATOM 1706 O ASN A 111 7.180 -6.499 -8.181 1.00 0.00 O ATOM 1707 CB ASN A 111 9.125 -7.381 -10.242 1.00 0.00 C ATOM 1708 CG ASN A 111 9.924 -8.237 -11.226 1.00 0.00 C ATOM 1709 OD1 ASN A 111 9.976 -7.940 -12.404 1.00 0.00 O ATOM 1710 ND2 ASN A 111 10.554 -9.293 -10.791 1.00 0.00 N ATOM 0 H ASN A 111 7.407 -10.059 -10.554 1.00 0.00 H new ATOM 0 HA ASN A 111 8.359 -8.850 -8.864 1.00 0.00 H new ATOM 0 HB2 ASN A 111 8.731 -6.500 -10.748 1.00 0.00 H new ATOM 0 HB3 ASN A 111 9.775 -7.026 -9.442 1.00 0.00 H new ATOM 0 HD21 ASN A 111 11.090 -9.870 -11.439 1.00 0.00 H new ATOM 0 HD22 ASN A 111 10.510 -9.542 -9.803 1.00 0.00 H new ATOM 1717 N TYR A 112 5.710 -7.333 -9.589 1.00 0.00 N ATOM 1718 CA TYR A 112 4.629 -6.447 -9.071 1.00 0.00 C ATOM 1719 C TYR A 112 3.765 -7.227 -8.076 1.00 0.00 C ATOM 1720 O TYR A 112 3.371 -8.348 -8.329 1.00 0.00 O ATOM 1721 CB TYR A 112 3.761 -5.967 -10.236 1.00 0.00 C ATOM 1722 CG TYR A 112 4.502 -4.896 -11.002 1.00 0.00 C ATOM 1723 CD1 TYR A 112 4.771 -3.664 -10.395 1.00 0.00 C ATOM 1724 CD2 TYR A 112 4.925 -5.135 -12.316 1.00 0.00 C ATOM 1725 CE1 TYR A 112 5.460 -2.671 -11.100 1.00 0.00 C ATOM 1726 CE2 TYR A 112 5.614 -4.141 -13.022 1.00 0.00 C ATOM 1727 CZ TYR A 112 5.882 -2.909 -12.414 1.00 0.00 C ATOM 1728 OH TYR A 112 6.562 -1.930 -13.109 1.00 0.00 O ATOM 0 H TYR A 112 5.431 -7.961 -10.342 1.00 0.00 H new ATOM 0 HA TYR A 112 5.072 -5.586 -8.571 1.00 0.00 H new ATOM 0 HB2 TYR A 112 3.522 -6.802 -10.895 1.00 0.00 H new ATOM 0 HB3 TYR A 112 2.815 -5.575 -9.862 1.00 0.00 H new ATOM 0 HD1 TYR A 112 4.446 -3.480 -9.382 1.00 0.00 H new ATOM 0 HD2 TYR A 112 4.720 -6.086 -12.785 1.00 0.00 H new ATOM 0 HE1 TYR A 112 5.666 -1.721 -10.631 1.00 0.00 H new ATOM 0 HE2 TYR A 112 5.939 -4.325 -14.036 1.00 0.00 H new ATOM 0 HH TYR A 112 6.782 -2.259 -14.006 1.00 0.00 H new ATOM 1738 N ASN A 113 3.473 -6.645 -6.946 1.00 0.00 N ATOM 1739 CA ASN A 113 2.639 -7.353 -5.934 1.00 0.00 C ATOM 1740 C ASN A 113 1.168 -6.983 -6.127 1.00 0.00 C ATOM 1741 O ASN A 113 0.837 -6.086 -6.879 1.00 0.00 O ATOM 1742 CB ASN A 113 3.087 -6.944 -4.529 1.00 0.00 C ATOM 1743 CG ASN A 113 4.613 -6.998 -4.443 1.00 0.00 C ATOM 1744 OD1 ASN A 113 5.301 -6.505 -5.315 1.00 0.00 O ATOM 1745 ND2 ASN A 113 5.177 -7.580 -3.420 1.00 0.00 N ATOM 0 H ASN A 113 3.776 -5.708 -6.679 1.00 0.00 H new ATOM 0 HA ASN A 113 2.759 -8.429 -6.057 1.00 0.00 H new ATOM 0 HB2 ASN A 113 2.735 -5.938 -4.302 1.00 0.00 H new ATOM 0 HB3 ASN A 113 2.647 -7.610 -3.787 1.00 0.00 H new ATOM 0 HD21 ASN A 113 6.194 -7.621 -3.353 1.00 0.00 H new ATOM 0 HD22 ASN A 113 4.601 -7.994 -2.687 1.00 0.00 H new ATOM 1752 N THR A 114 0.283 -7.667 -5.451 1.00 0.00 N ATOM 1753 CA THR A 114 -1.170 -7.362 -5.587 1.00 0.00 C ATOM 1754 C THR A 114 -1.842 -7.484 -4.218 1.00 0.00 C ATOM 1755 O THR A 114 -1.936 -8.556 -3.655 1.00 0.00 O ATOM 1756 CB THR A 114 -1.812 -8.354 -6.560 1.00 0.00 C ATOM 1757 OG1 THR A 114 -2.068 -9.577 -5.885 1.00 0.00 O ATOM 1758 CG2 THR A 114 -0.865 -8.605 -7.734 1.00 0.00 C ATOM 0 H THR A 114 0.506 -8.427 -4.808 1.00 0.00 H new ATOM 0 HA THR A 114 -1.296 -6.349 -5.968 1.00 0.00 H new ATOM 0 HB THR A 114 -2.749 -7.942 -6.935 1.00 0.00 H new ATOM 0 HG1 THR A 114 -1.569 -9.596 -5.042 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.323 -9.311 -8.426 1.00 0.00 H new ATOM 0 HG22 THR A 114 -0.669 -7.666 -8.251 1.00 0.00 H new ATOM 0 HG23 THR A 114 0.073 -9.017 -7.363 1.00 0.00 H new ATOM 1766 N TYR A 115 -2.311 -6.393 -3.676 1.00 0.00 N ATOM 1767 CA TYR A 115 -2.974 -6.447 -2.344 1.00 0.00 C ATOM 1768 C TYR A 115 -4.473 -6.694 -2.528 1.00 0.00 C ATOM 1769 O TYR A 115 -5.211 -5.813 -2.924 1.00 0.00 O ATOM 1770 CB TYR A 115 -2.762 -5.120 -1.613 1.00 0.00 C ATOM 1771 CG TYR A 115 -1.300 -4.961 -1.272 1.00 0.00 C ATOM 1772 CD1 TYR A 115 -0.735 -5.723 -0.241 1.00 0.00 C ATOM 1773 CD2 TYR A 115 -0.509 -4.052 -1.985 1.00 0.00 C ATOM 1774 CE1 TYR A 115 0.621 -5.575 0.076 1.00 0.00 C ATOM 1775 CE2 TYR A 115 0.847 -3.905 -1.668 1.00 0.00 C ATOM 1776 CZ TYR A 115 1.411 -4.666 -0.638 1.00 0.00 C ATOM 1777 OH TYR A 115 2.748 -4.521 -0.326 1.00 0.00 O ATOM 0 H TYR A 115 -2.263 -5.466 -4.099 1.00 0.00 H new ATOM 0 HA TYR A 115 -2.542 -7.258 -1.757 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -3.093 -4.291 -2.239 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -3.363 -5.093 -0.704 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -1.345 -6.424 0.309 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -0.945 -3.464 -2.779 1.00 0.00 H new ATOM 0 HE1 TYR A 115 1.057 -6.162 0.871 1.00 0.00 H new ATOM 0 HE2 TYR A 115 1.457 -3.204 -2.218 1.00 0.00 H new ATOM 0 HH TYR A 115 3.093 -5.365 0.034 1.00 0.00 H new ATOM 1787 N ARG A 116 -4.928 -7.885 -2.241 1.00 0.00 N ATOM 1788 CA ARG A 116 -6.379 -8.189 -2.398 1.00 0.00 C ATOM 1789 C ARG A 116 -7.082 -8.022 -1.048 1.00 0.00 C ATOM 1790 O ARG A 116 -6.490 -8.204 -0.003 1.00 0.00 O ATOM 1791 CB ARG A 116 -6.547 -9.630 -2.887 1.00 0.00 C ATOM 1792 CG ARG A 116 -8.020 -9.893 -3.206 1.00 0.00 C ATOM 1793 CD ARG A 116 -8.195 -11.347 -3.648 1.00 0.00 C ATOM 1794 NE ARG A 116 -9.223 -11.417 -4.725 1.00 0.00 N ATOM 1795 CZ ARG A 116 -9.332 -12.494 -5.453 1.00 0.00 C ATOM 1796 NH1 ARG A 116 -8.541 -13.510 -5.237 1.00 0.00 N ATOM 1797 NH2 ARG A 116 -10.231 -12.557 -6.397 1.00 0.00 N ATOM 0 H ARG A 116 -4.357 -8.660 -1.905 1.00 0.00 H new ATOM 0 HA ARG A 116 -6.819 -7.506 -3.124 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -5.936 -9.798 -3.774 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -6.199 -10.327 -2.124 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -8.635 -9.692 -2.328 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -8.358 -9.219 -3.993 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -7.247 -11.746 -4.009 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -8.498 -11.962 -2.801 1.00 0.00 H new ATOM 0 HE ARG A 116 -9.841 -10.623 -4.893 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -7.838 -13.461 -4.499 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -8.626 -14.352 -5.806 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -10.849 -11.764 -6.566 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -10.315 -13.400 -6.966 1.00 0.00 H new ATOM 1811 N SER A 117 -8.342 -7.675 -1.061 1.00 0.00 N ATOM 1812 CA SER A 117 -9.077 -7.494 0.224 1.00 0.00 C ATOM 1813 C SER A 117 -9.416 -8.862 0.821 1.00 0.00 C ATOM 1814 O SER A 117 -9.508 -9.851 0.122 1.00 0.00 O ATOM 1815 CB SER A 117 -10.366 -6.715 -0.034 1.00 0.00 C ATOM 1816 OG SER A 117 -11.271 -6.936 1.039 1.00 0.00 O ATOM 0 H SER A 117 -8.892 -7.510 -1.904 1.00 0.00 H new ATOM 0 HA SER A 117 -8.451 -6.941 0.925 1.00 0.00 H new ATOM 0 HB2 SER A 117 -10.149 -5.651 -0.128 1.00 0.00 H new ATOM 0 HB3 SER A 117 -10.815 -7.033 -0.975 1.00 0.00 H new ATOM 0 HG SER A 117 -11.484 -6.081 1.469 1.00 0.00 H new ATOM 1822 N ARG A 118 -9.603 -8.926 2.113 1.00 0.00 N ATOM 1823 CA ARG A 118 -9.936 -10.228 2.757 1.00 0.00 C ATOM 1824 C ARG A 118 -11.456 -10.396 2.816 1.00 0.00 C ATOM 1825 O ARG A 118 -12.035 -11.163 2.072 1.00 0.00 O ATOM 1826 CB ARG A 118 -9.368 -10.255 4.179 1.00 0.00 C ATOM 1827 CG ARG A 118 -9.382 -11.692 4.707 1.00 0.00 C ATOM 1828 CD ARG A 118 -9.140 -11.683 6.221 1.00 0.00 C ATOM 1829 NE ARG A 118 -8.091 -12.689 6.590 1.00 0.00 N ATOM 1830 CZ ARG A 118 -8.125 -13.910 6.121 1.00 0.00 C ATOM 1831 NH1 ARG A 118 -9.121 -14.305 5.378 1.00 0.00 N ATOM 1832 NH2 ARG A 118 -7.165 -14.745 6.418 1.00 0.00 N ATOM 0 H ARG A 118 -9.539 -8.132 2.750 1.00 0.00 H new ATOM 0 HA ARG A 118 -9.502 -11.041 2.175 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -8.350 -9.865 4.183 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -9.959 -9.611 4.830 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -10.339 -12.163 4.484 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -8.612 -12.281 4.208 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -8.827 -10.689 6.540 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -10.069 -11.908 6.745 1.00 0.00 H new ATOM 0 HE ARG A 118 -7.336 -12.416 7.219 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -9.881 -13.661 5.159 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -9.140 -15.258 5.016 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -6.393 -14.444 7.013 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -7.187 -15.698 6.055 1.00 0.00 H new ATOM 1846 N LYS A 119 -12.107 -9.687 3.697 1.00 0.00 N ATOM 1847 CA LYS A 119 -13.588 -9.807 3.809 1.00 0.00 C ATOM 1848 C LYS A 119 -14.226 -9.607 2.433 1.00 0.00 C ATOM 1849 O LYS A 119 -15.405 -9.836 2.248 1.00 0.00 O ATOM 1850 CB LYS A 119 -14.114 -8.742 4.774 1.00 0.00 C ATOM 1851 CG LYS A 119 -15.507 -9.140 5.263 1.00 0.00 C ATOM 1852 CD LYS A 119 -15.394 -9.814 6.632 1.00 0.00 C ATOM 1853 CE LYS A 119 -16.778 -10.285 7.086 1.00 0.00 C ATOM 1854 NZ LYS A 119 -16.857 -10.233 8.573 1.00 0.00 N ATOM 0 H LYS A 119 -11.676 -9.028 4.346 1.00 0.00 H new ATOM 0 HA LYS A 119 -13.843 -10.798 4.185 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -13.436 -8.637 5.621 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -14.155 -7.773 4.276 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -16.146 -8.259 5.331 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -15.975 -9.818 4.549 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -14.710 -10.661 6.577 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -14.979 -9.116 7.359 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -17.551 -9.653 6.648 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -16.961 -11.301 6.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -17.797 -10.553 8.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -16.129 -10.853 8.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -16.700 -9.257 8.895 1.00 0.00 H new ATOM 1868 N TYR A 120 -13.456 -9.182 1.467 1.00 0.00 N ATOM 1869 CA TYR A 120 -14.019 -8.966 0.101 1.00 0.00 C ATOM 1870 C TYR A 120 -12.985 -9.377 -0.948 1.00 0.00 C ATOM 1871 O TYR A 120 -12.467 -8.556 -1.678 1.00 0.00 O ATOM 1872 CB TYR A 120 -14.369 -7.487 -0.078 1.00 0.00 C ATOM 1873 CG TYR A 120 -15.054 -6.976 1.168 1.00 0.00 C ATOM 1874 CD1 TYR A 120 -16.310 -7.479 1.529 1.00 0.00 C ATOM 1875 CD2 TYR A 120 -14.435 -6.001 1.960 1.00 0.00 C ATOM 1876 CE1 TYR A 120 -16.947 -7.007 2.683 1.00 0.00 C ATOM 1877 CE2 TYR A 120 -15.073 -5.529 3.114 1.00 0.00 C ATOM 1878 CZ TYR A 120 -16.328 -6.032 3.476 1.00 0.00 C ATOM 1879 OH TYR A 120 -16.957 -5.567 4.613 1.00 0.00 O ATOM 0 H TYR A 120 -12.462 -8.975 1.564 1.00 0.00 H new ATOM 0 HA TYR A 120 -14.919 -9.569 -0.021 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -13.465 -6.909 -0.272 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -15.020 -7.359 -0.942 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -16.787 -8.231 0.918 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -13.466 -5.613 1.681 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -17.916 -7.395 2.962 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -14.596 -4.777 3.725 1.00 0.00 H new ATOM 0 HH TYR A 120 -16.392 -4.895 5.048 1.00 0.00 H new ATOM 1889 N THR A 121 -12.682 -10.643 -1.030 1.00 0.00 N ATOM 1890 CA THR A 121 -11.683 -11.110 -2.032 1.00 0.00 C ATOM 1891 C THR A 121 -12.225 -10.872 -3.444 1.00 0.00 C ATOM 1892 O THR A 121 -11.623 -11.268 -4.423 1.00 0.00 O ATOM 1893 CB THR A 121 -11.419 -12.603 -1.831 1.00 0.00 C ATOM 1894 OG1 THR A 121 -12.658 -13.296 -1.761 1.00 0.00 O ATOM 1895 CG2 THR A 121 -10.638 -12.817 -0.534 1.00 0.00 C ATOM 0 H THR A 121 -13.084 -11.376 -0.445 1.00 0.00 H new ATOM 0 HA THR A 121 -10.753 -10.556 -1.903 1.00 0.00 H new ATOM 0 HB THR A 121 -10.835 -12.984 -2.669 1.00 0.00 H new ATOM 0 HG1 THR A 121 -12.491 -14.253 -1.634 1.00 0.00 H new ATOM 0 HG21 THR A 121 -10.451 -13.882 -0.393 1.00 0.00 H new ATOM 0 HG22 THR A 121 -9.688 -12.286 -0.590 1.00 0.00 H new ATOM 0 HG23 THR A 121 -11.218 -12.436 0.307 1.00 0.00 H new ATOM 1903 N SER A 122 -13.357 -10.236 -3.557 1.00 0.00 N ATOM 1904 CA SER A 122 -13.935 -9.982 -4.907 1.00 0.00 C ATOM 1905 C SER A 122 -13.420 -8.645 -5.447 1.00 0.00 C ATOM 1906 O SER A 122 -13.857 -8.174 -6.479 1.00 0.00 O ATOM 1907 CB SER A 122 -15.461 -9.935 -4.806 1.00 0.00 C ATOM 1908 OG SER A 122 -15.940 -11.194 -4.351 1.00 0.00 O ATOM 0 H SER A 122 -13.907 -9.881 -2.775 1.00 0.00 H new ATOM 0 HA SER A 122 -13.637 -10.783 -5.583 1.00 0.00 H new ATOM 0 HB2 SER A 122 -15.767 -9.146 -4.119 1.00 0.00 H new ATOM 0 HB3 SER A 122 -15.894 -9.697 -5.778 1.00 0.00 H new ATOM 0 HG SER A 122 -16.917 -11.167 -4.283 1.00 0.00 H new ATOM 1914 N TRP A 123 -12.493 -8.030 -4.764 1.00 0.00 N ATOM 1915 CA TRP A 123 -11.956 -6.727 -5.251 1.00 0.00 C ATOM 1916 C TRP A 123 -10.538 -6.518 -4.713 1.00 0.00 C ATOM 1917 O TRP A 123 -10.086 -7.225 -3.833 1.00 0.00 O ATOM 1918 CB TRP A 123 -12.857 -5.588 -4.766 1.00 0.00 C ATOM 1919 CG TRP A 123 -14.176 -5.664 -5.467 1.00 0.00 C ATOM 1920 CD1 TRP A 123 -14.350 -5.594 -6.806 1.00 0.00 C ATOM 1921 CD2 TRP A 123 -15.504 -5.816 -4.888 1.00 0.00 C ATOM 1922 NE1 TRP A 123 -15.699 -5.699 -7.088 1.00 0.00 N ATOM 1923 CE2 TRP A 123 -16.453 -5.836 -5.938 1.00 0.00 C ATOM 1924 CE3 TRP A 123 -15.973 -5.938 -3.569 1.00 0.00 C ATOM 1925 CZ2 TRP A 123 -17.818 -5.973 -5.687 1.00 0.00 C ATOM 1926 CZ3 TRP A 123 -17.347 -6.076 -3.312 1.00 0.00 C ATOM 1927 CH2 TRP A 123 -18.268 -6.093 -4.369 1.00 0.00 C ATOM 0 H TRP A 123 -12.086 -8.371 -3.893 1.00 0.00 H new ATOM 0 HA TRP A 123 -11.931 -6.734 -6.341 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -13.001 -5.658 -3.688 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -12.383 -4.626 -4.963 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -13.563 -5.475 -7.536 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -16.090 -5.678 -8.030 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -15.272 -5.926 -2.747 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 -18.523 -5.986 -6.505 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -17.696 -6.170 -2.294 1.00 0.00 H new ATOM 0 HH2 TRP A 123 -19.323 -6.199 -4.165 1.00 0.00 H new ATOM 1938 N TYR A 124 -9.837 -5.549 -5.246 1.00 0.00 N ATOM 1939 CA TYR A 124 -8.444 -5.275 -4.784 1.00 0.00 C ATOM 1940 C TYR A 124 -8.285 -3.778 -4.511 1.00 0.00 C ATOM 1941 O TYR A 124 -9.127 -2.979 -4.871 1.00 0.00 O ATOM 1942 CB TYR A 124 -7.452 -5.696 -5.873 1.00 0.00 C ATOM 1943 CG TYR A 124 -7.738 -7.116 -6.301 1.00 0.00 C ATOM 1944 CD1 TYR A 124 -8.861 -7.399 -7.087 1.00 0.00 C ATOM 1945 CD2 TYR A 124 -6.878 -8.150 -5.913 1.00 0.00 C ATOM 1946 CE1 TYR A 124 -9.125 -8.715 -7.485 1.00 0.00 C ATOM 1947 CE2 TYR A 124 -7.140 -9.466 -6.311 1.00 0.00 C ATOM 1948 CZ TYR A 124 -8.264 -9.748 -7.097 1.00 0.00 C ATOM 1949 OH TYR A 124 -8.524 -11.046 -7.488 1.00 0.00 O ATOM 0 H TYR A 124 -10.173 -4.933 -5.986 1.00 0.00 H new ATOM 0 HA TYR A 124 -8.247 -5.839 -3.872 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -7.530 -5.025 -6.729 1.00 0.00 H new ATOM 0 HB3 TYR A 124 -6.431 -5.617 -5.499 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -9.525 -6.601 -7.387 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -6.012 -7.932 -5.306 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -9.992 -8.933 -8.091 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -6.476 -10.263 -6.012 1.00 0.00 H new ATOM 0 HH TYR A 124 -7.725 -11.596 -7.347 1.00 0.00 H new ATOM 1959 N VAL A 125 -7.210 -3.392 -3.880 1.00 0.00 N ATOM 1960 CA VAL A 125 -6.998 -1.946 -3.586 1.00 0.00 C ATOM 1961 C VAL A 125 -6.329 -1.277 -4.789 1.00 0.00 C ATOM 1962 O VAL A 125 -5.293 -1.709 -5.255 1.00 0.00 O ATOM 1963 CB VAL A 125 -6.099 -1.801 -2.357 1.00 0.00 C ATOM 1964 CG1 VAL A 125 -5.853 -0.318 -2.075 1.00 0.00 C ATOM 1965 CG2 VAL A 125 -6.784 -2.441 -1.148 1.00 0.00 C ATOM 0 H VAL A 125 -6.470 -4.014 -3.556 1.00 0.00 H new ATOM 0 HA VAL A 125 -7.959 -1.469 -3.390 1.00 0.00 H new ATOM 0 HB VAL A 125 -5.147 -2.298 -2.543 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -5.212 -0.216 -1.199 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -5.366 0.140 -2.936 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -6.805 0.180 -1.889 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -6.145 -2.339 -0.271 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -7.736 -1.943 -0.963 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -6.960 -3.498 -1.347 1.00 0.00 H new ATOM 1975 N ALA A 126 -6.914 -0.227 -5.300 1.00 0.00 N ATOM 1976 CA ALA A 126 -6.308 0.463 -6.474 1.00 0.00 C ATOM 1977 C ALA A 126 -6.724 1.936 -6.475 1.00 0.00 C ATOM 1978 O ALA A 126 -7.660 2.324 -5.803 1.00 0.00 O ATOM 1979 CB ALA A 126 -6.793 -0.204 -7.762 1.00 0.00 C ATOM 0 H ALA A 126 -7.783 0.182 -4.956 1.00 0.00 H new ATOM 0 HA ALA A 126 -5.222 0.394 -6.414 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -6.351 0.300 -8.621 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.495 -1.253 -7.763 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -7.879 -0.135 -7.821 1.00 0.00 H new ATOM 1985 N LEU A 127 -6.032 2.753 -7.228 1.00 0.00 N ATOM 1986 CA LEU A 127 -6.369 4.208 -7.291 1.00 0.00 C ATOM 1987 C LEU A 127 -6.729 4.580 -8.731 1.00 0.00 C ATOM 1988 O LEU A 127 -6.406 3.872 -9.664 1.00 0.00 O ATOM 1989 CB LEU A 127 -5.159 5.033 -6.845 1.00 0.00 C ATOM 1990 CG LEU A 127 -4.613 4.484 -5.522 1.00 0.00 C ATOM 1991 CD1 LEU A 127 -3.356 5.261 -5.128 1.00 0.00 C ATOM 1992 CD2 LEU A 127 -5.670 4.640 -4.426 1.00 0.00 C ATOM 0 H LEU A 127 -5.241 2.472 -7.807 1.00 0.00 H new ATOM 0 HA LEU A 127 -7.213 4.415 -6.634 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -4.383 5.000 -7.610 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -5.445 6.078 -6.725 1.00 0.00 H new ATOM 0 HG LEU A 127 -4.368 3.429 -5.643 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.967 4.871 -4.187 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -2.601 5.150 -5.906 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -3.603 6.316 -5.009 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -5.280 4.249 -3.486 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -5.917 5.695 -4.306 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -6.567 4.087 -4.704 1.00 0.00 H new ATOM 2004 N LYS A 128 -7.392 5.688 -8.922 1.00 0.00 N ATOM 2005 CA LYS A 128 -7.765 6.103 -10.303 1.00 0.00 C ATOM 2006 C LYS A 128 -6.553 6.736 -10.991 1.00 0.00 C ATOM 2007 O LYS A 128 -5.682 6.049 -11.489 1.00 0.00 O ATOM 2008 CB LYS A 128 -8.907 7.121 -10.243 1.00 0.00 C ATOM 2009 CG LYS A 128 -10.236 6.389 -10.044 1.00 0.00 C ATOM 2010 CD LYS A 128 -11.379 7.406 -9.981 1.00 0.00 C ATOM 2011 CE LYS A 128 -11.570 7.880 -8.538 1.00 0.00 C ATOM 2012 NZ LYS A 128 -12.563 7.005 -7.855 1.00 0.00 N ATOM 0 H LYS A 128 -7.691 6.323 -8.182 1.00 0.00 H new ATOM 0 HA LYS A 128 -8.089 5.229 -10.868 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -8.740 7.822 -9.425 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -8.936 7.705 -11.163 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -10.403 5.689 -10.863 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -10.206 5.803 -9.125 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -11.158 8.256 -10.627 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -12.300 6.956 -10.351 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -10.619 7.853 -8.006 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -11.912 8.915 -8.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -13.427 7.549 -7.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -12.794 6.198 -8.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -12.162 6.657 -6.961 1.00 0.00 H new ATOM 2026 N ARG A 129 -6.488 8.039 -11.021 1.00 0.00 N ATOM 2027 CA ARG A 129 -5.330 8.711 -11.677 1.00 0.00 C ATOM 2028 C ARG A 129 -5.062 10.052 -10.990 1.00 0.00 C ATOM 2029 O ARG A 129 -3.929 10.462 -10.832 1.00 0.00 O ATOM 2030 CB ARG A 129 -5.647 8.949 -13.155 1.00 0.00 C ATOM 2031 CG ARG A 129 -7.105 9.385 -13.302 1.00 0.00 C ATOM 2032 CD ARG A 129 -7.213 10.441 -14.405 1.00 0.00 C ATOM 2033 NE ARG A 129 -6.521 9.951 -15.629 1.00 0.00 N ATOM 2034 CZ ARG A 129 -6.731 10.539 -16.776 1.00 0.00 C ATOM 2035 NH1 ARG A 129 -7.544 11.556 -16.848 1.00 0.00 N ATOM 2036 NH2 ARG A 129 -6.125 10.109 -17.849 1.00 0.00 N ATOM 0 H ARG A 129 -7.185 8.667 -10.620 1.00 0.00 H new ATOM 0 HA ARG A 129 -4.447 8.077 -11.593 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -4.985 9.714 -13.561 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -5.470 8.038 -13.727 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -7.730 8.526 -13.544 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -7.472 9.790 -12.359 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -8.261 10.648 -14.624 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -6.766 11.378 -14.072 1.00 0.00 H new ATOM 0 HE ARG A 129 -5.884 9.157 -15.572 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -8.016 11.892 -16.008 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -7.708 12.015 -17.744 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -5.488 9.314 -17.791 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -6.288 10.568 -18.745 1.00 0.00 H new ATOM 2050 N THR A 130 -6.095 10.737 -10.580 1.00 0.00 N ATOM 2051 CA THR A 130 -5.894 12.050 -9.904 1.00 0.00 C ATOM 2052 C THR A 130 -5.472 11.816 -8.452 1.00 0.00 C ATOM 2053 O THR A 130 -5.431 12.730 -7.653 1.00 0.00 O ATOM 2054 CB THR A 130 -7.202 12.845 -9.934 1.00 0.00 C ATOM 2055 OG1 THR A 130 -7.160 13.860 -8.940 1.00 0.00 O ATOM 2056 CG2 THR A 130 -8.378 11.907 -9.656 1.00 0.00 C ATOM 0 H THR A 130 -7.067 10.445 -10.684 1.00 0.00 H new ATOM 0 HA THR A 130 -5.116 12.611 -10.423 1.00 0.00 H new ATOM 0 HB THR A 130 -7.328 13.301 -10.916 1.00 0.00 H new ATOM 0 HG1 THR A 130 -7.033 13.450 -8.059 1.00 0.00 H new ATOM 0 HG21 THR A 130 -9.309 12.474 -9.678 1.00 0.00 H new ATOM 0 HG22 THR A 130 -8.410 11.128 -10.418 1.00 0.00 H new ATOM 0 HG23 THR A 130 -8.254 11.450 -8.674 1.00 0.00 H new ATOM 2064 N GLY A 131 -5.159 10.598 -8.106 1.00 0.00 N ATOM 2065 CA GLY A 131 -4.741 10.306 -6.705 1.00 0.00 C ATOM 2066 C GLY A 131 -5.970 9.941 -5.871 1.00 0.00 C ATOM 2067 O GLY A 131 -5.892 9.778 -4.670 1.00 0.00 O ATOM 0 H GLY A 131 -5.174 9.793 -8.732 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -4.023 9.486 -6.692 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -4.241 11.174 -6.275 1.00 0.00 H new ATOM 2071 N GLN A 132 -7.107 9.812 -6.499 1.00 0.00 N ATOM 2072 CA GLN A 132 -8.341 9.456 -5.742 1.00 0.00 C ATOM 2073 C GLN A 132 -8.422 7.937 -5.581 1.00 0.00 C ATOM 2074 O GLN A 132 -7.696 7.196 -6.215 1.00 0.00 O ATOM 2075 CB GLN A 132 -9.569 9.957 -6.506 1.00 0.00 C ATOM 2076 CG GLN A 132 -9.761 11.452 -6.242 1.00 0.00 C ATOM 2077 CD GLN A 132 -8.396 12.136 -6.149 1.00 0.00 C ATOM 2078 OE1 GLN A 132 -7.698 12.262 -7.135 1.00 0.00 O ATOM 2079 NE2 GLN A 132 -7.982 12.584 -4.996 1.00 0.00 N ATOM 0 H GLN A 132 -7.235 9.938 -7.503 1.00 0.00 H new ATOM 0 HA GLN A 132 -8.311 9.922 -4.757 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -9.443 9.779 -7.574 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -10.455 9.405 -6.193 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -10.350 11.900 -7.042 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -10.317 11.600 -5.316 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -8.568 12.478 -4.168 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -7.072 13.040 -4.923 1.00 0.00 H new ATOM 2088 N TYR A 133 -9.299 7.468 -4.736 1.00 0.00 N ATOM 2089 CA TYR A 133 -9.425 5.996 -4.531 1.00 0.00 C ATOM 2090 C TYR A 133 -10.516 5.441 -5.449 1.00 0.00 C ATOM 2091 O TYR A 133 -11.664 5.831 -5.372 1.00 0.00 O ATOM 2092 CB TYR A 133 -9.793 5.714 -3.072 1.00 0.00 C ATOM 2093 CG TYR A 133 -11.208 6.169 -2.809 1.00 0.00 C ATOM 2094 CD1 TYR A 133 -11.479 7.526 -2.594 1.00 0.00 C ATOM 2095 CD2 TYR A 133 -12.251 5.235 -2.778 1.00 0.00 C ATOM 2096 CE1 TYR A 133 -12.790 7.948 -2.349 1.00 0.00 C ATOM 2097 CE2 TYR A 133 -13.563 5.657 -2.532 1.00 0.00 C ATOM 2098 CZ TYR A 133 -13.832 7.014 -2.318 1.00 0.00 C ATOM 2099 OH TYR A 133 -15.126 7.431 -2.076 1.00 0.00 O ATOM 0 H TYR A 133 -9.934 8.040 -4.179 1.00 0.00 H new ATOM 0 HA TYR A 133 -8.476 5.515 -4.767 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -9.698 4.649 -2.862 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -9.104 6.233 -2.406 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -10.675 8.247 -2.617 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -12.043 4.188 -2.944 1.00 0.00 H new ATOM 0 HE1 TYR A 133 -12.998 8.995 -2.184 1.00 0.00 H new ATOM 0 HE2 TYR A 133 -14.367 4.936 -2.507 1.00 0.00 H new ATOM 0 HH TYR A 133 -15.727 6.657 -2.090 1.00 0.00 H new ATOM 2109 N LYS A 134 -10.166 4.531 -6.317 1.00 0.00 N ATOM 2110 CA LYS A 134 -11.182 3.948 -7.239 1.00 0.00 C ATOM 2111 C LYS A 134 -12.145 3.067 -6.441 1.00 0.00 C ATOM 2112 O LYS A 134 -11.736 2.178 -5.720 1.00 0.00 O ATOM 2113 CB LYS A 134 -10.476 3.105 -8.304 1.00 0.00 C ATOM 2114 CG LYS A 134 -11.412 2.899 -9.499 1.00 0.00 C ATOM 2115 CD LYS A 134 -10.686 2.117 -10.599 1.00 0.00 C ATOM 2116 CE LYS A 134 -10.833 0.614 -10.347 1.00 0.00 C ATOM 2117 NZ LYS A 134 -10.139 -0.141 -11.430 1.00 0.00 N ATOM 0 H LYS A 134 -9.220 4.166 -6.427 1.00 0.00 H new ATOM 0 HA LYS A 134 -11.741 4.749 -7.723 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -9.561 3.601 -8.627 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -10.186 2.141 -7.886 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -12.305 2.358 -9.184 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -11.743 3.864 -9.884 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -11.099 2.374 -11.574 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -9.631 2.391 -10.617 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -10.408 0.354 -9.378 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -11.888 0.341 -10.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -10.754 -0.909 -11.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.925 0.502 -12.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -9.254 -0.543 -11.061 1.00 0.00 H new ATOM 2131 N LEU A 135 -13.422 3.311 -6.560 1.00 0.00 N ATOM 2132 CA LEU A 135 -14.412 2.491 -5.806 1.00 0.00 C ATOM 2133 C LEU A 135 -14.069 1.008 -5.957 1.00 0.00 C ATOM 2134 O LEU A 135 -13.595 0.572 -6.987 1.00 0.00 O ATOM 2135 CB LEU A 135 -15.817 2.751 -6.360 1.00 0.00 C ATOM 2136 CG LEU A 135 -16.873 2.339 -5.325 1.00 0.00 C ATOM 2137 CD1 LEU A 135 -16.834 3.281 -4.114 1.00 0.00 C ATOM 2138 CD2 LEU A 135 -18.262 2.400 -5.965 1.00 0.00 C ATOM 0 H LEU A 135 -13.822 4.043 -7.147 1.00 0.00 H new ATOM 0 HA LEU A 135 -14.381 2.764 -4.751 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.930 3.807 -6.607 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -15.962 2.190 -7.283 1.00 0.00 H new ATOM 0 HG LEU A 135 -16.659 1.324 -4.991 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -17.589 2.974 -3.390 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -15.848 3.237 -3.651 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -17.037 4.301 -4.440 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -19.014 2.108 -5.232 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -18.462 3.416 -6.304 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -18.301 1.719 -6.815 1.00 0.00 H new ATOM 2150 N GLY A 136 -14.303 0.229 -4.935 1.00 0.00 N ATOM 2151 CA GLY A 136 -13.988 -1.225 -5.018 1.00 0.00 C ATOM 2152 C GLY A 136 -14.983 -1.915 -5.954 1.00 0.00 C ATOM 2153 O GLY A 136 -15.012 -3.125 -6.060 1.00 0.00 O ATOM 0 H GLY A 136 -14.699 0.537 -4.047 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -12.971 -1.366 -5.384 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -14.035 -1.674 -4.026 1.00 0.00 H new ATOM 2157 N SER A 137 -15.798 -1.156 -6.634 1.00 0.00 N ATOM 2158 CA SER A 137 -16.788 -1.772 -7.561 1.00 0.00 C ATOM 2159 C SER A 137 -16.174 -1.889 -8.956 1.00 0.00 C ATOM 2160 O SER A 137 -16.438 -2.824 -9.686 1.00 0.00 O ATOM 2161 CB SER A 137 -18.038 -0.895 -7.627 1.00 0.00 C ATOM 2162 OG SER A 137 -17.799 0.196 -8.507 1.00 0.00 O ATOM 0 H SER A 137 -15.821 -0.137 -6.588 1.00 0.00 H new ATOM 0 HA SER A 137 -17.058 -2.764 -7.198 1.00 0.00 H new ATOM 0 HB2 SER A 137 -18.889 -1.480 -7.977 1.00 0.00 H new ATOM 0 HB3 SER A 137 -18.291 -0.527 -6.633 1.00 0.00 H new ATOM 0 HG SER A 137 -18.640 0.668 -8.679 1.00 0.00 H new ATOM 2168 N LYS A 138 -15.356 -0.945 -9.335 1.00 0.00 N ATOM 2169 CA LYS A 138 -14.726 -1.004 -10.684 1.00 0.00 C ATOM 2170 C LYS A 138 -13.401 -1.764 -10.597 1.00 0.00 C ATOM 2171 O LYS A 138 -12.777 -2.058 -11.598 1.00 0.00 O ATOM 2172 CB LYS A 138 -14.470 0.418 -11.189 1.00 0.00 C ATOM 2173 CG LYS A 138 -15.768 1.004 -11.748 1.00 0.00 C ATOM 2174 CD LYS A 138 -15.833 2.500 -11.430 1.00 0.00 C ATOM 2175 CE LYS A 138 -17.076 3.108 -12.082 1.00 0.00 C ATOM 2176 NZ LYS A 138 -17.396 4.407 -11.426 1.00 0.00 N ATOM 0 H LYS A 138 -15.097 -0.137 -8.769 1.00 0.00 H new ATOM 0 HA LYS A 138 -15.393 -1.520 -11.375 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -14.097 1.042 -10.377 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -13.701 0.408 -11.962 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -15.815 0.848 -12.826 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -16.627 0.492 -11.314 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -15.864 2.652 -10.351 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -14.936 3.000 -11.796 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -16.904 3.259 -13.148 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -17.920 2.424 -11.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -18.241 4.821 -11.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -17.577 4.250 -10.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -16.593 5.059 -11.536 1.00 0.00 H new ATOM 2190 N THR A 139 -12.968 -2.090 -9.410 1.00 0.00 N ATOM 2191 CA THR A 139 -11.684 -2.833 -9.265 1.00 0.00 C ATOM 2192 C THR A 139 -11.865 -4.263 -9.778 1.00 0.00 C ATOM 2193 O THR A 139 -12.948 -4.814 -9.742 1.00 0.00 O ATOM 2194 CB THR A 139 -11.272 -2.869 -7.791 1.00 0.00 C ATOM 2195 OG1 THR A 139 -12.370 -3.312 -7.005 1.00 0.00 O ATOM 2196 CG2 THR A 139 -10.854 -1.468 -7.343 1.00 0.00 C ATOM 0 H THR A 139 -13.447 -1.874 -8.536 1.00 0.00 H new ATOM 0 HA THR A 139 -10.908 -2.331 -9.844 1.00 0.00 H new ATOM 0 HB THR A 139 -10.434 -3.554 -7.664 1.00 0.00 H new ATOM 0 HG1 THR A 139 -12.489 -4.277 -7.124 1.00 0.00 H new ATOM 0 HG21 THR A 139 -10.561 -1.494 -6.294 1.00 0.00 H new ATOM 0 HG22 THR A 139 -10.012 -1.129 -7.947 1.00 0.00 H new ATOM 0 HG23 THR A 139 -11.691 -0.781 -7.469 1.00 0.00 H new ATOM 2204 N GLY A 140 -10.814 -4.870 -10.256 1.00 0.00 N ATOM 2205 CA GLY A 140 -10.927 -6.263 -10.772 1.00 0.00 C ATOM 2206 C GLY A 140 -9.771 -6.542 -11.738 1.00 0.00 C ATOM 2207 O GLY A 140 -8.938 -5.686 -11.960 1.00 0.00 O ATOM 0 H GLY A 140 -9.881 -4.461 -10.312 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -10.904 -6.972 -9.945 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -11.882 -6.398 -11.281 1.00 0.00 H new ATOM 2211 N PRO A 141 -9.749 -7.734 -12.285 1.00 0.00 N ATOM 2212 CA PRO A 141 -8.693 -8.136 -13.232 1.00 0.00 C ATOM 2213 C PRO A 141 -8.714 -7.225 -14.463 1.00 0.00 C ATOM 2214 O PRO A 141 -9.624 -6.442 -14.652 1.00 0.00 O ATOM 2215 CB PRO A 141 -9.041 -9.580 -13.622 1.00 0.00 C ATOM 2216 CG PRO A 141 -10.328 -9.978 -12.854 1.00 0.00 C ATOM 2217 CD PRO A 141 -10.764 -8.770 -12.011 1.00 0.00 C ATOM 0 HA PRO A 141 -7.696 -8.060 -12.799 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -9.198 -9.658 -14.698 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -8.221 -10.253 -13.369 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -11.116 -10.262 -13.551 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -10.140 -10.842 -12.216 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -11.761 -8.431 -12.292 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -10.799 -9.019 -10.950 1.00 0.00 H new ATOM 2225 N GLY A 142 -7.719 -7.321 -15.300 1.00 0.00 N ATOM 2226 CA GLY A 142 -7.683 -6.459 -16.516 1.00 0.00 C ATOM 2227 C GLY A 142 -7.077 -5.101 -16.161 1.00 0.00 C ATOM 2228 O GLY A 142 -6.183 -4.616 -16.826 1.00 0.00 O ATOM 0 H GLY A 142 -6.929 -7.958 -15.196 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -7.094 -6.939 -17.298 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -8.690 -6.327 -16.911 1.00 0.00 H new ATOM 2232 N GLN A 143 -7.555 -4.482 -15.117 1.00 0.00 N ATOM 2233 CA GLN A 143 -7.004 -3.155 -14.719 1.00 0.00 C ATOM 2234 C GLN A 143 -5.609 -3.343 -14.122 1.00 0.00 C ATOM 2235 O GLN A 143 -5.395 -4.183 -13.270 1.00 0.00 O ATOM 2236 CB GLN A 143 -7.923 -2.512 -13.677 1.00 0.00 C ATOM 2237 CG GLN A 143 -9.379 -2.642 -14.129 1.00 0.00 C ATOM 2238 CD GLN A 143 -9.534 -2.055 -15.532 1.00 0.00 C ATOM 2239 OE1 GLN A 143 -10.015 -0.951 -15.692 1.00 0.00 O ATOM 2240 NE2 GLN A 143 -9.144 -2.752 -16.564 1.00 0.00 N ATOM 0 H GLN A 143 -8.303 -4.837 -14.522 1.00 0.00 H new ATOM 0 HA GLN A 143 -6.941 -2.509 -15.595 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -7.787 -2.995 -12.710 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -7.664 -1.461 -13.548 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -9.679 -3.690 -14.127 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -10.035 -2.121 -13.431 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -8.740 -3.679 -16.430 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -9.243 -2.370 -17.504 1.00 0.00 H new ATOM 2249 N LYS A 144 -4.656 -2.568 -14.562 1.00 0.00 N ATOM 2250 CA LYS A 144 -3.275 -2.703 -14.019 1.00 0.00 C ATOM 2251 C LYS A 144 -3.149 -1.881 -12.734 1.00 0.00 C ATOM 2252 O LYS A 144 -2.089 -1.786 -12.148 1.00 0.00 O ATOM 2253 CB LYS A 144 -2.269 -2.194 -15.053 1.00 0.00 C ATOM 2254 CG LYS A 144 -2.394 -3.015 -16.338 1.00 0.00 C ATOM 2255 CD LYS A 144 -2.295 -2.087 -17.550 1.00 0.00 C ATOM 2256 CE LYS A 144 -0.958 -1.346 -17.517 1.00 0.00 C ATOM 2257 NZ LYS A 144 -0.296 -1.453 -18.848 1.00 0.00 N ATOM 0 H LYS A 144 -4.774 -1.847 -15.274 1.00 0.00 H new ATOM 0 HA LYS A 144 -3.071 -3.751 -13.800 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -2.451 -1.140 -15.264 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -1.256 -2.270 -14.658 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -1.607 -3.768 -16.379 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -3.345 -3.547 -16.351 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -2.381 -2.664 -18.471 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -3.119 -1.373 -17.543 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -1.117 -0.298 -17.262 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -0.315 -1.768 -16.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 0.613 -0.949 -18.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -0.131 -2.455 -19.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -0.908 -1.030 -19.575 1.00 0.00 H new ATOM 2271 N ALA A 145 -4.223 -1.286 -12.292 1.00 0.00 N ATOM 2272 CA ALA A 145 -4.166 -0.470 -11.047 1.00 0.00 C ATOM 2273 C ALA A 145 -3.810 -1.370 -9.860 1.00 0.00 C ATOM 2274 O ALA A 145 -3.664 -0.910 -8.745 1.00 0.00 O ATOM 2275 CB ALA A 145 -5.529 0.180 -10.802 1.00 0.00 C ATOM 0 H ALA A 145 -5.138 -1.330 -12.740 1.00 0.00 H new ATOM 0 HA ALA A 145 -3.407 0.304 -11.155 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -5.489 0.777 -9.891 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -5.783 0.821 -11.646 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -6.288 -0.595 -10.694 1.00 0.00 H new ATOM 2281 N ILE A 146 -3.671 -2.648 -10.093 1.00 0.00 N ATOM 2282 CA ILE A 146 -3.327 -3.580 -8.980 1.00 0.00 C ATOM 2283 C ILE A 146 -1.820 -3.845 -8.973 1.00 0.00 C ATOM 2284 O ILE A 146 -1.305 -4.524 -8.106 1.00 0.00 O ATOM 2285 CB ILE A 146 -4.076 -4.900 -9.174 1.00 0.00 C ATOM 2286 CG1 ILE A 146 -3.813 -5.430 -10.586 1.00 0.00 C ATOM 2287 CG2 ILE A 146 -5.577 -4.670 -8.989 1.00 0.00 C ATOM 2288 CD1 ILE A 146 -4.504 -6.784 -10.760 1.00 0.00 C ATOM 0 H ILE A 146 -3.781 -3.087 -11.007 1.00 0.00 H new ATOM 0 HA ILE A 146 -3.617 -3.130 -8.030 1.00 0.00 H new ATOM 0 HB ILE A 146 -3.728 -5.626 -8.439 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -4.185 -4.722 -11.327 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -2.741 -5.533 -10.753 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -6.109 -5.611 -9.128 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -5.766 -4.291 -7.985 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -5.927 -3.944 -9.723 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -4.317 -7.161 -11.765 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -4.111 -7.490 -10.028 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -5.577 -6.667 -10.611 1.00 0.00 H new ATOM 2300 N LEU A 147 -1.106 -3.319 -9.932 1.00 0.00 N ATOM 2301 CA LEU A 147 0.367 -3.547 -9.972 1.00 0.00 C ATOM 2302 C LEU A 147 1.064 -2.552 -9.042 1.00 0.00 C ATOM 2303 O LEU A 147 1.285 -1.411 -9.396 1.00 0.00 O ATOM 2304 CB LEU A 147 0.878 -3.350 -11.401 1.00 0.00 C ATOM 2305 CG LEU A 147 0.085 -4.239 -12.361 1.00 0.00 C ATOM 2306 CD1 LEU A 147 0.608 -4.045 -13.786 1.00 0.00 C ATOM 2307 CD2 LEU A 147 0.251 -5.707 -11.956 1.00 0.00 C ATOM 0 H LEU A 147 -1.478 -2.743 -10.687 1.00 0.00 H new ATOM 0 HA LEU A 147 0.584 -4.564 -9.646 1.00 0.00 H new ATOM 0 HB2 LEU A 147 0.778 -2.304 -11.692 1.00 0.00 H new ATOM 0 HB3 LEU A 147 1.939 -3.596 -11.455 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.969 -3.966 -12.318 1.00 0.00 H new ATOM 0 HD11 LEU A 147 0.043 -4.678 -14.470 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.491 -3.001 -14.078 1.00 0.00 H new ATOM 0 HD13 LEU A 147 1.663 -4.317 -13.827 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -0.314 -6.339 -12.640 1.00 0.00 H new ATOM 0 HD22 LEU A 147 1.306 -5.979 -11.998 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -0.120 -5.849 -10.941 1.00 0.00 H new ATOM 2319 N PHE A 148 1.414 -2.982 -7.856 1.00 0.00 N ATOM 2320 CA PHE A 148 2.100 -2.073 -6.891 1.00 0.00 C ATOM 2321 C PHE A 148 3.574 -2.470 -6.773 1.00 0.00 C ATOM 2322 O PHE A 148 3.952 -3.581 -7.089 1.00 0.00 O ATOM 2323 CB PHE A 148 1.432 -2.189 -5.519 1.00 0.00 C ATOM 2324 CG PHE A 148 0.166 -1.365 -5.504 1.00 0.00 C ATOM 2325 CD1 PHE A 148 -1.028 -1.905 -5.996 1.00 0.00 C ATOM 2326 CD2 PHE A 148 0.187 -0.060 -4.996 1.00 0.00 C ATOM 2327 CE1 PHE A 148 -2.201 -1.140 -5.981 1.00 0.00 C ATOM 2328 CE2 PHE A 148 -0.985 0.704 -4.981 1.00 0.00 C ATOM 2329 CZ PHE A 148 -2.179 0.164 -5.474 1.00 0.00 C ATOM 0 H PHE A 148 1.253 -3.929 -7.514 1.00 0.00 H new ATOM 0 HA PHE A 148 2.027 -1.045 -7.247 1.00 0.00 H new ATOM 0 HB2 PHE A 148 1.202 -3.232 -5.302 1.00 0.00 H new ATOM 0 HB3 PHE A 148 2.113 -1.844 -4.741 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -1.045 -2.912 -6.387 1.00 0.00 H new ATOM 0 HD2 PHE A 148 1.108 0.357 -4.616 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -3.122 -1.556 -6.361 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -0.969 1.710 -4.589 1.00 0.00 H new ATOM 0 HZ PHE A 148 -3.083 0.754 -5.463 1.00 0.00 H new ATOM 2339 N LEU A 149 4.402 -1.568 -6.319 1.00 0.00 N ATOM 2340 CA LEU A 149 5.856 -1.876 -6.176 1.00 0.00 C ATOM 2341 C LEU A 149 6.366 -1.296 -4.850 1.00 0.00 C ATOM 2342 O LEU A 149 7.082 -0.314 -4.848 1.00 0.00 O ATOM 2343 CB LEU A 149 6.620 -1.231 -7.337 1.00 0.00 C ATOM 2344 CG LEU A 149 8.091 -1.669 -7.306 1.00 0.00 C ATOM 2345 CD1 LEU A 149 8.200 -3.177 -7.553 1.00 0.00 C ATOM 2346 CD2 LEU A 149 8.864 -0.922 -8.397 1.00 0.00 C ATOM 0 H LEU A 149 4.133 -0.625 -6.039 1.00 0.00 H new ATOM 0 HA LEU A 149 6.009 -2.955 -6.187 1.00 0.00 H new ATOM 0 HB2 LEU A 149 6.166 -1.518 -8.286 1.00 0.00 H new ATOM 0 HB3 LEU A 149 6.554 -0.145 -7.268 1.00 0.00 H new ATOM 0 HG LEU A 149 8.510 -1.437 -6.327 1.00 0.00 H new ATOM 0 HD11 LEU A 149 9.248 -3.475 -7.529 1.00 0.00 H new ATOM 0 HD12 LEU A 149 7.652 -3.713 -6.778 1.00 0.00 H new ATOM 0 HD13 LEU A 149 7.777 -3.417 -8.528 1.00 0.00 H new ATOM 0 HD21 LEU A 149 9.909 -1.230 -8.378 1.00 0.00 H new ATOM 0 HD22 LEU A 149 8.434 -1.155 -9.371 1.00 0.00 H new ATOM 0 HD23 LEU A 149 8.799 0.151 -8.219 1.00 0.00 H new ATOM 2358 N PRO A 150 5.977 -1.908 -3.756 1.00 0.00 N ATOM 2359 CA PRO A 150 6.384 -1.442 -2.418 1.00 0.00 C ATOM 2360 C PRO A 150 7.906 -1.506 -2.267 1.00 0.00 C ATOM 2361 O PRO A 150 8.503 -2.562 -2.331 1.00 0.00 O ATOM 2362 CB PRO A 150 5.698 -2.404 -1.438 1.00 0.00 C ATOM 2363 CG PRO A 150 4.844 -3.394 -2.270 1.00 0.00 C ATOM 2364 CD PRO A 150 5.105 -3.101 -3.756 1.00 0.00 C ATOM 0 HA PRO A 150 6.098 -0.406 -2.238 1.00 0.00 H new ATOM 0 HB2 PRO A 150 6.440 -2.942 -0.847 1.00 0.00 H new ATOM 0 HB3 PRO A 150 5.071 -1.853 -0.737 1.00 0.00 H new ATOM 0 HG2 PRO A 150 5.110 -4.424 -2.031 1.00 0.00 H new ATOM 0 HG3 PRO A 150 3.786 -3.276 -2.037 1.00 0.00 H new ATOM 0 HD2 PRO A 150 5.589 -3.945 -4.247 1.00 0.00 H new ATOM 0 HD3 PRO A 150 4.175 -2.911 -4.292 1.00 0.00 H new ATOM 2372 N MET A 151 8.534 -0.378 -2.063 1.00 0.00 N ATOM 2373 CA MET A 151 10.017 -0.362 -1.904 1.00 0.00 C ATOM 2374 C MET A 151 10.365 -0.366 -0.414 1.00 0.00 C ATOM 2375 O MET A 151 9.888 0.453 0.346 1.00 0.00 O ATOM 2376 CB MET A 151 10.586 0.903 -2.552 1.00 0.00 C ATOM 2377 CG MET A 151 10.125 0.989 -4.009 1.00 0.00 C ATOM 2378 SD MET A 151 10.582 2.604 -4.688 1.00 0.00 S ATOM 2379 CE MET A 151 10.847 2.069 -6.395 1.00 0.00 C ATOM 0 H MET A 151 8.082 0.534 -2.000 1.00 0.00 H new ATOM 0 HA MET A 151 10.445 -1.242 -2.385 1.00 0.00 H new ATOM 0 HB2 MET A 151 10.255 1.785 -2.003 1.00 0.00 H new ATOM 0 HB3 MET A 151 11.675 0.889 -2.505 1.00 0.00 H new ATOM 0 HG2 MET A 151 10.584 0.193 -4.595 1.00 0.00 H new ATOM 0 HG3 MET A 151 9.046 0.848 -4.070 1.00 0.00 H new ATOM 0 HE1 MET A 151 11.142 2.924 -7.003 1.00 0.00 H new ATOM 0 HE2 MET A 151 11.634 1.315 -6.422 1.00 0.00 H new ATOM 0 HE3 MET A 151 9.924 1.644 -6.791 1.00 0.00 H new ATOM 2389 N SER A 152 11.193 -1.280 0.009 1.00 0.00 N ATOM 2390 CA SER A 152 11.569 -1.331 1.451 1.00 0.00 C ATOM 2391 C SER A 152 12.452 -0.127 1.788 1.00 0.00 C ATOM 2392 O SER A 152 13.015 0.505 0.916 1.00 0.00 O ATOM 2393 CB SER A 152 12.338 -2.622 1.731 1.00 0.00 C ATOM 2394 OG SER A 152 12.791 -2.615 3.079 1.00 0.00 O ATOM 0 H SER A 152 11.625 -1.993 -0.579 1.00 0.00 H new ATOM 0 HA SER A 152 10.668 -1.305 2.064 1.00 0.00 H new ATOM 0 HB2 SER A 152 11.697 -3.486 1.555 1.00 0.00 H new ATOM 0 HB3 SER A 152 13.185 -2.709 1.051 1.00 0.00 H new ATOM 0 HG SER A 152 13.283 -3.442 3.263 1.00 0.00 H new ATOM 2400 N ALA A 153 12.577 0.196 3.046 1.00 0.00 N ATOM 2401 CA ALA A 153 13.424 1.358 3.437 1.00 0.00 C ATOM 2402 C ALA A 153 14.082 1.078 4.790 1.00 0.00 C ATOM 2403 O ALA A 153 13.584 1.469 5.827 1.00 0.00 O ATOM 2404 CB ALA A 153 12.551 2.610 3.545 1.00 0.00 C ATOM 0 H ALA A 153 12.129 -0.295 3.820 1.00 0.00 H new ATOM 0 HA ALA A 153 14.196 1.515 2.683 1.00 0.00 H new ATOM 0 HB1 ALA A 153 13.169 3.461 3.831 1.00 0.00 H new ATOM 0 HB2 ALA A 153 12.081 2.810 2.582 1.00 0.00 H new ATOM 0 HB3 ALA A 153 11.780 2.452 4.299 1.00 0.00 H new ATOM 2410 N LYS A 154 15.198 0.403 4.788 1.00 0.00 N ATOM 2411 CA LYS A 154 15.887 0.097 6.073 1.00 0.00 C ATOM 2412 C LYS A 154 16.529 1.373 6.626 1.00 0.00 C ATOM 2413 O LYS A 154 16.148 1.868 7.668 1.00 0.00 O ATOM 2414 CB LYS A 154 16.972 -0.955 5.832 1.00 0.00 C ATOM 2415 CG LYS A 154 16.326 -2.247 5.329 1.00 0.00 C ATOM 2416 CD LYS A 154 17.374 -3.096 4.607 1.00 0.00 C ATOM 2417 CE LYS A 154 16.727 -4.385 4.099 1.00 0.00 C ATOM 2418 NZ LYS A 154 16.854 -4.453 2.615 1.00 0.00 N ATOM 0 H LYS A 154 15.663 0.050 3.952 1.00 0.00 H new ATOM 0 HA LYS A 154 15.162 -0.286 6.791 1.00 0.00 H new ATOM 0 HB2 LYS A 154 17.693 -0.588 5.102 1.00 0.00 H new ATOM 0 HB3 LYS A 154 17.521 -1.145 6.754 1.00 0.00 H new ATOM 0 HG2 LYS A 154 15.905 -2.805 6.165 1.00 0.00 H new ATOM 0 HG3 LYS A 154 15.503 -2.015 4.653 1.00 0.00 H new ATOM 0 HD2 LYS A 154 17.798 -2.537 3.773 1.00 0.00 H new ATOM 0 HD3 LYS A 154 18.195 -3.331 5.284 1.00 0.00 H new ATOM 0 HE2 LYS A 154 17.207 -5.250 4.556 1.00 0.00 H new ATOM 0 HE3 LYS A 154 15.676 -4.415 4.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 16.414 -5.329 2.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 16.377 -3.634 2.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 17.860 -4.443 2.352 1.00 0.00 H new ATOM 2432 N SER A 155 17.498 1.908 5.935 1.00 0.00 N ATOM 2433 CA SER A 155 18.160 3.150 6.422 1.00 0.00 C ATOM 2434 C SER A 155 17.198 4.331 6.279 1.00 0.00 C ATOM 2435 O SER A 155 16.165 4.156 5.654 1.00 0.00 O ATOM 2436 CB SER A 155 19.418 3.415 5.593 1.00 0.00 C ATOM 2437 OG SER A 155 19.054 3.599 4.231 1.00 0.00 O ATOM 2438 OXT SER A 155 17.511 5.391 6.796 1.00 0.00 O ATOM 0 H SER A 155 17.859 1.539 5.055 1.00 0.00 H new ATOM 0 HA SER A 155 18.433 3.029 7.470 1.00 0.00 H new ATOM 0 HB2 SER A 155 19.933 4.300 5.966 1.00 0.00 H new ATOM 0 HB3 SER A 155 20.111 2.579 5.686 1.00 0.00 H new ATOM 0 HG SER A 155 19.858 3.771 3.698 1.00 0.00 H new TER 2444 SER A 155