USER MOD reduce.3.24.130724 H: found=0, std=0, add=880, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 879 hydrogens (32 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 NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 105 HECFE :(H bumps) USER MOD NoAdj-H: A 105 HEC HAC : A 105 HEC CAC : A 17 CYS SG :(H bumps) USER MOD NoAdj-H: A 105 HEC HAB : A 105 HEC CAB : A 14 CYS SG :(H bumps) USER MOD NoAdj-H: A 105 HEC H2D : A 105 HEC O2D : A 105 HEC CGD :(short bond) USER MOD Set 1.1: A 49 THR OG1 : rot -150:sc=-0.00636 USER MOD Set 1.2: A 52 ASN : amide:sc= 0.698 K(o=3,f=-1.2!) USER MOD Set 1.3: A 53 LYS NZ :NH3+ -120:sc= 1.1 (180deg=-2.58) USER MOD Set 1.4: A 78 THR OG1 : rot -86:sc= 1.2 USER MOD Set 2.1: A 31 ASN : amide:sc= -0.0439 K(o=-0.18,f=-6) USER MOD Set 2.2: A 33 HIS : no HD1:sc= -0.137 K(o=-0.18,f=-2.5) USER MOD Set 2.3: A 105 HEC O2A : rot 168:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 158:sc= 3.55 (180deg=2.23) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 172:sc= 1.24 (180deg=1.11) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -0.204 X(o=-0.2,f=-0.31) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= 1.01 K(o=1,f=-0.019) USER MOD Single : A 19 THR OG1 : rot 150:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 163:sc= -0.0508 (180deg=-0.478) USER MOD Single : A 25 LYS NZ :NH3+ 158:sc= -0.049 (180deg=-0.318) USER MOD Single : A 26 HIS : no HE2:sc= -0.0491 K(o=-0.049,f=-1.1) USER MOD Single : A 27 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0087) USER MOD Single : A 28 THR OG1 : rot 180:sc=-0.00628 USER MOD Single : A 39 LYS NZ :NH3+ 150:sc= 0 (180deg=-0.238) USER MOD Single : A 40 THR OG1 : rot 177:sc= 0.611 USER MOD Single : A 42 GLN : amide:sc= -0.031 X(o=-0.031,f=-0.28) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 35:sc= 1.26 USER MOD Single : A 54 ASN : amide:sc= 1.22 K(o=1.2,f=-0.21) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -155:sc= 1.19 (180deg=1.05) USER MOD Single : A 63 THR OG1 : rot -164:sc= 1.15 USER MOD Single : A 65 MET CE :methyl -178:sc= -0.0631 (180deg=-0.0714) USER MOD Single : A 67 TYR OH : rot -127:sc= 1.26 USER MOD Single : A 70 ASN : amide:sc= 0.23 K(o=0.23,f=-5.6!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00627) USER MOD Single : A 74 TYR OH : rot 30:sc= -0.279 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl 158:sc= -0.989 (180deg=-2.98) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 166:sc= 1.2 (180deg=0.509) USER MOD Single : A 88 LYS NZ :NH3+ 175:sc= 1.31 (180deg=1.24) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 177:sc= 0.939 (180deg=0.768) USER MOD Single : A 100 LYS NZ :NH3+ -147:sc= 1.27 (180deg=-2.12!) USER MOD Single : A 102 THR OG1 : rot -170:sc= 1.27 USER MOD Single : A 103 ASN : amide:sc= 0.383 X(o=0.38,f=-0.042) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.688 1.873 0.505 1.00 10.00 N ATOM 2 CA GLY A 1 1.672 0.619 1.282 1.00 10.00 C ATOM 3 C GLY A 1 0.698 0.682 2.439 1.00 10.00 C ATOM 4 O GLY A 1 1.101 0.489 3.581 1.00 10.00 O ATOM 0 H1 GLY A 1 2.584 1.946 -0.017 1.00 10.00 H new ATOM 0 H2 GLY A 1 0.895 1.875 -0.167 1.00 10.00 H new ATOM 0 H3 GLY A 1 1.596 2.683 1.151 1.00 10.00 H new ATOM 0 HA2 GLY A 1 1.404 -0.210 0.627 1.00 10.00 H new ATOM 0 HA3 GLY A 1 2.673 0.415 1.661 1.00 10.00 H new ATOM 10 N ASP A 2 -0.573 0.960 2.152 1.00 10.00 N ATOM 11 CA ASP A 2 -1.527 1.523 3.103 1.00 10.00 C ATOM 12 C ASP A 2 -2.849 0.741 3.090 1.00 10.00 C ATOM 13 O ASP A 2 -3.506 0.614 2.056 1.00 10.00 O ATOM 14 CB ASP A 2 -1.724 3.002 2.737 1.00 10.00 C ATOM 15 CG ASP A 2 -0.451 3.836 2.945 1.00 10.00 C ATOM 16 OD1 ASP A 2 0.480 3.720 2.108 1.00 10.00 O ATOM 17 OD2 ASP A 2 -0.425 4.578 3.950 1.00 10.00 O ATOM 0 H ASP A 2 -0.976 0.796 1.230 1.00 10.00 H new ATOM 0 HA ASP A 2 -1.147 1.446 4.122 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -2.037 3.076 1.695 1.00 10.00 H new ATOM 0 HB3 ASP A 2 -2.530 3.418 3.342 1.00 10.00 H new ATOM 22 N VAL A 3 -3.243 0.212 4.257 1.00 10.00 N ATOM 23 CA VAL A 3 -4.345 -0.746 4.445 1.00 10.00 C ATOM 24 C VAL A 3 -5.643 -0.243 3.820 1.00 10.00 C ATOM 25 O VAL A 3 -6.216 -0.916 2.968 1.00 10.00 O ATOM 26 CB VAL A 3 -4.529 -1.061 5.944 1.00 10.00 C ATOM 27 CG1 VAL A 3 -5.766 -1.927 6.229 1.00 10.00 C ATOM 28 CG2 VAL A 3 -3.295 -1.785 6.499 1.00 10.00 C ATOM 0 H VAL A 3 -2.783 0.450 5.136 1.00 10.00 H new ATOM 0 HA VAL A 3 -4.082 -1.669 3.928 1.00 10.00 H new ATOM 0 HB VAL A 3 -4.666 -0.098 6.436 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -5.840 -2.114 7.300 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -6.661 -1.406 5.888 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -5.675 -2.876 5.701 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -3.444 -1.999 7.557 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -3.147 -2.719 5.958 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -2.416 -1.152 6.377 1.00 10.00 H new ATOM 38 N GLU A 4 -6.106 0.946 4.203 1.00 10.00 N ATOM 39 CA GLU A 4 -7.354 1.529 3.714 1.00 10.00 C ATOM 40 C GLU A 4 -7.393 1.709 2.202 1.00 10.00 C ATOM 41 O GLU A 4 -8.386 1.336 1.578 1.00 10.00 O ATOM 42 CB GLU A 4 -7.627 2.853 4.423 1.00 10.00 C ATOM 43 CG GLU A 4 -8.334 2.691 5.773 1.00 10.00 C ATOM 44 CD GLU A 4 -7.736 1.582 6.643 1.00 10.00 C ATOM 45 OE1 GLU A 4 -6.518 1.668 6.919 1.00 10.00 O ATOM 46 OE2 GLU A 4 -8.487 0.622 6.935 1.00 10.00 O ATOM 0 H GLU A 4 -5.617 1.540 4.872 1.00 10.00 H new ATOM 0 HA GLU A 4 -8.144 0.816 3.950 1.00 10.00 H new ATOM 0 HB2 GLU A 4 -6.682 3.375 4.577 1.00 10.00 H new ATOM 0 HB3 GLU A 4 -8.237 3.483 3.776 1.00 10.00 H new ATOM 0 HG2 GLU A 4 -8.285 3.635 6.316 1.00 10.00 H new ATOM 0 HG3 GLU A 4 -9.389 2.478 5.599 1.00 10.00 H new ATOM 53 N LYS A 5 -6.309 2.212 1.599 1.00 10.00 N ATOM 54 CA LYS A 5 -6.166 2.291 0.142 1.00 10.00 C ATOM 55 C LYS A 5 -6.292 0.894 -0.479 1.00 10.00 C ATOM 56 O LYS A 5 -6.920 0.742 -1.528 1.00 10.00 O ATOM 57 CB LYS A 5 -4.806 2.922 -0.209 1.00 10.00 C ATOM 58 CG LYS A 5 -4.574 4.328 0.381 1.00 10.00 C ATOM 59 CD LYS A 5 -4.641 5.447 -0.662 1.00 10.00 C ATOM 60 CE LYS A 5 -6.078 5.640 -1.147 1.00 10.00 C ATOM 61 NZ LYS A 5 -6.198 6.798 -2.060 1.00 10.00 N ATOM 0 H LYS A 5 -5.505 2.576 2.110 1.00 10.00 H new ATOM 0 HA LYS A 5 -6.960 2.917 -0.265 1.00 10.00 H new ATOM 0 HB2 LYS A 5 -4.013 2.261 0.141 1.00 10.00 H new ATOM 0 HB3 LYS A 5 -4.717 2.979 -1.294 1.00 10.00 H new ATOM 0 HG2 LYS A 5 -5.320 4.517 1.153 1.00 10.00 H new ATOM 0 HG3 LYS A 5 -3.599 4.353 0.867 1.00 10.00 H new ATOM 0 HD2 LYS A 5 -4.268 6.376 -0.232 1.00 10.00 H new ATOM 0 HD3 LYS A 5 -3.995 5.205 -1.506 1.00 10.00 H new ATOM 0 HE2 LYS A 5 -6.414 4.738 -1.658 1.00 10.00 H new ATOM 0 HE3 LYS A 5 -6.735 5.784 -0.289 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 -7.187 6.897 -2.368 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 -5.902 7.663 -1.564 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 -5.590 6.650 -2.891 1.00 10.00 H new ATOM 75 N GLY A 6 -5.775 -0.123 0.220 1.00 10.00 N ATOM 76 CA GLY A 6 -5.705 -1.503 -0.250 1.00 10.00 C ATOM 77 C GLY A 6 -7.063 -2.171 -0.175 1.00 10.00 C ATOM 78 O GLY A 6 -7.501 -2.797 -1.139 1.00 10.00 O ATOM 0 H GLY A 6 -5.384 -0.001 1.154 1.00 10.00 H new ATOM 0 HA2 GLY A 6 -5.342 -1.523 -1.278 1.00 10.00 H new ATOM 0 HA3 GLY A 6 -4.988 -2.060 0.352 1.00 10.00 H new ATOM 82 N LYS A 7 -7.772 -2.000 0.948 1.00 10.00 N ATOM 83 CA LYS A 7 -9.115 -2.542 1.068 1.00 10.00 C ATOM 84 C LYS A 7 -10.167 -1.763 0.291 1.00 10.00 C ATOM 85 O LYS A 7 -11.100 -2.384 -0.209 1.00 10.00 O ATOM 86 CB LYS A 7 -9.513 -2.814 2.511 1.00 10.00 C ATOM 87 CG LYS A 7 -9.644 -1.606 3.447 1.00 10.00 C ATOM 88 CD LYS A 7 -10.576 -2.067 4.567 1.00 10.00 C ATOM 89 CE LYS A 7 -10.772 -1.088 5.717 1.00 10.00 C ATOM 90 NZ LYS A 7 -11.810 -1.649 6.607 1.00 10.00 N ATOM 0 H LYS A 7 -7.438 -1.497 1.770 1.00 10.00 H new ATOM 0 HA LYS A 7 -9.076 -3.515 0.578 1.00 10.00 H new ATOM 0 HB2 LYS A 7 -10.468 -3.339 2.504 1.00 10.00 H new ATOM 0 HB3 LYS A 7 -8.778 -3.495 2.941 1.00 10.00 H new ATOM 0 HG2 LYS A 7 -8.673 -1.306 3.841 1.00 10.00 H new ATOM 0 HG3 LYS A 7 -10.055 -0.744 2.922 1.00 10.00 H new ATOM 0 HD2 LYS A 7 -11.551 -2.288 4.133 1.00 10.00 H new ATOM 0 HD3 LYS A 7 -10.189 -3.001 4.973 1.00 10.00 H new ATOM 0 HE2 LYS A 7 -9.838 -0.943 6.261 1.00 10.00 H new ATOM 0 HE3 LYS A 7 -11.076 -0.111 5.341 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 -11.873 -1.075 7.472 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 -12.728 -1.641 6.118 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 -11.560 -2.627 6.858 1.00 10.00 H new ATOM 104 N LYS A 8 -9.996 -0.451 0.086 1.00 10.00 N ATOM 105 CA LYS A 8 -10.832 0.307 -0.852 1.00 10.00 C ATOM 106 C LYS A 8 -10.693 -0.235 -2.271 1.00 10.00 C ATOM 107 O LYS A 8 -11.711 -0.570 -2.873 1.00 10.00 O ATOM 108 CB LYS A 8 -10.535 1.812 -0.813 1.00 10.00 C ATOM 109 CG LYS A 8 -11.273 2.495 0.351 1.00 10.00 C ATOM 110 CD LYS A 8 -11.262 4.025 0.240 1.00 10.00 C ATOM 111 CE LYS A 8 -12.080 4.488 -0.975 1.00 10.00 C ATOM 112 NZ LYS A 8 -12.241 5.959 -0.995 1.00 10.00 N ATOM 0 H LYS A 8 -9.285 0.108 0.558 1.00 10.00 H new ATOM 0 HA LYS A 8 -11.865 0.175 -0.531 1.00 10.00 H new ATOM 0 HB2 LYS A 8 -9.462 1.971 -0.710 1.00 10.00 H new ATOM 0 HB3 LYS A 8 -10.836 2.269 -1.756 1.00 10.00 H new ATOM 0 HG2 LYS A 8 -12.305 2.144 0.378 1.00 10.00 H new ATOM 0 HG3 LYS A 8 -10.811 2.199 1.293 1.00 10.00 H new ATOM 0 HD2 LYS A 8 -11.673 4.463 1.149 1.00 10.00 H new ATOM 0 HD3 LYS A 8 -10.236 4.381 0.150 1.00 10.00 H new ATOM 0 HE2 LYS A 8 -11.587 4.163 -1.891 1.00 10.00 H new ATOM 0 HE3 LYS A 8 -13.061 4.014 -0.955 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 -12.798 6.236 -1.828 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 -12.733 6.266 -0.132 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 -11.305 6.410 -1.039 1.00 10.00 H new ATOM 126 N ILE A 9 -9.465 -0.352 -2.801 1.00 10.00 N ATOM 127 CA ILE A 9 -9.286 -0.924 -4.142 1.00 10.00 C ATOM 128 C ILE A 9 -9.720 -2.404 -4.202 1.00 10.00 C ATOM 129 O ILE A 9 -10.302 -2.813 -5.211 1.00 10.00 O ATOM 130 CB ILE A 9 -7.869 -0.638 -4.703 1.00 10.00 C ATOM 131 CG1 ILE A 9 -7.779 -0.794 -6.235 1.00 10.00 C ATOM 132 CG2 ILE A 9 -6.783 -1.515 -4.064 1.00 10.00 C ATOM 133 CD1 ILE A 9 -8.640 0.196 -7.031 1.00 10.00 C ATOM 0 H ILE A 9 -8.604 -0.066 -2.335 1.00 10.00 H new ATOM 0 HA ILE A 9 -9.965 -0.412 -4.823 1.00 10.00 H new ATOM 0 HB ILE A 9 -7.689 0.405 -4.441 1.00 10.00 H new ATOM 0 HG12 ILE A 9 -6.739 -0.676 -6.538 1.00 10.00 H new ATOM 0 HG13 ILE A 9 -8.075 -1.809 -6.502 1.00 10.00 H new ATOM 0 HG21 ILE A 9 -5.814 -1.268 -4.498 1.00 10.00 H new ATOM 0 HG22 ILE A 9 -6.756 -1.335 -2.989 1.00 10.00 H new ATOM 0 HG23 ILE A 9 -7.007 -2.565 -4.251 1.00 10.00 H new ATOM 0 HD11 ILE A 9 -8.514 0.012 -8.098 1.00 10.00 H new ATOM 0 HD12 ILE A 9 -9.688 0.065 -6.762 1.00 10.00 H new ATOM 0 HD13 ILE A 9 -8.331 1.215 -6.799 1.00 10.00 H new ATOM 145 N PHE A 10 -9.563 -3.174 -3.107 1.00 10.00 N ATOM 146 CA PHE A 10 -10.116 -4.523 -2.999 1.00 10.00 C ATOM 147 C PHE A 10 -11.635 -4.514 -3.153 1.00 10.00 C ATOM 148 O PHE A 10 -12.174 -5.160 -4.050 1.00 10.00 O ATOM 149 CB PHE A 10 -9.689 -5.248 -1.707 1.00 10.00 C ATOM 150 CG PHE A 10 -10.078 -6.717 -1.675 1.00 10.00 C ATOM 151 CD1 PHE A 10 -11.380 -7.104 -1.303 1.00 10.00 C ATOM 152 CD2 PHE A 10 -9.148 -7.709 -2.043 1.00 10.00 C ATOM 153 CE1 PHE A 10 -11.765 -8.455 -1.343 1.00 10.00 C ATOM 154 CE2 PHE A 10 -9.524 -9.061 -2.058 1.00 10.00 C ATOM 155 CZ PHE A 10 -10.838 -9.434 -1.735 1.00 10.00 C ATOM 0 H PHE A 10 -9.049 -2.872 -2.279 1.00 10.00 H new ATOM 0 HA PHE A 10 -9.693 -5.094 -3.825 1.00 10.00 H new ATOM 0 HB2 PHE A 10 -8.608 -5.165 -1.594 1.00 10.00 H new ATOM 0 HB3 PHE A 10 -10.139 -4.743 -0.852 1.00 10.00 H new ATOM 0 HD1 PHE A 10 -12.090 -6.355 -0.984 1.00 10.00 H new ATOM 0 HD2 PHE A 10 -8.141 -7.428 -2.315 1.00 10.00 H new ATOM 0 HE1 PHE A 10 -12.771 -8.739 -1.073 1.00 10.00 H new ATOM 0 HE2 PHE A 10 -8.799 -9.818 -2.319 1.00 10.00 H new ATOM 0 HZ PHE A 10 -11.135 -10.471 -1.788 1.00 10.00 H new ATOM 165 N VAL A 11 -12.343 -3.753 -2.316 1.00 10.00 N ATOM 166 CA VAL A 11 -13.808 -3.691 -2.345 1.00 10.00 C ATOM 167 C VAL A 11 -14.353 -3.072 -3.651 1.00 10.00 C ATOM 168 O VAL A 11 -15.544 -3.174 -3.932 1.00 10.00 O ATOM 169 CB VAL A 11 -14.337 -3.001 -1.062 1.00 10.00 C ATOM 170 CG1 VAL A 11 -15.854 -2.766 -1.026 1.00 10.00 C ATOM 171 CG2 VAL A 11 -14.018 -3.868 0.171 1.00 10.00 C ATOM 0 H VAL A 11 -11.919 -3.163 -1.600 1.00 10.00 H new ATOM 0 HA VAL A 11 -14.194 -4.710 -2.348 1.00 10.00 H new ATOM 0 HB VAL A 11 -13.839 -2.032 -1.057 1.00 10.00 H new ATOM 0 HG11 VAL A 11 -16.125 -2.279 -0.089 1.00 10.00 H new ATOM 0 HG12 VAL A 11 -16.144 -2.130 -1.863 1.00 10.00 H new ATOM 0 HG13 VAL A 11 -16.372 -3.722 -1.101 1.00 10.00 H new ATOM 0 HG21 VAL A 11 -14.393 -3.376 1.069 1.00 10.00 H new ATOM 0 HG22 VAL A 11 -14.496 -4.842 0.064 1.00 10.00 H new ATOM 0 HG23 VAL A 11 -12.939 -4.000 0.254 1.00 10.00 H new ATOM 181 N GLN A 12 -13.480 -2.508 -4.495 1.00 10.00 N ATOM 182 CA GLN A 12 -13.816 -1.997 -5.822 1.00 10.00 C ATOM 183 C GLN A 12 -13.658 -3.100 -6.879 1.00 10.00 C ATOM 184 O GLN A 12 -14.645 -3.469 -7.514 1.00 10.00 O ATOM 185 CB GLN A 12 -12.971 -0.745 -6.137 1.00 10.00 C ATOM 186 CG GLN A 12 -13.605 0.194 -7.176 1.00 10.00 C ATOM 187 CD GLN A 12 -13.495 -0.294 -8.616 1.00 10.00 C ATOM 188 OE1 GLN A 12 -12.533 -0.019 -9.314 1.00 10.00 O ATOM 189 NE2 GLN A 12 -14.470 -1.026 -9.120 1.00 10.00 N ATOM 0 H GLN A 12 -12.493 -2.393 -4.263 1.00 10.00 H new ATOM 0 HA GLN A 12 -14.862 -1.692 -5.841 1.00 10.00 H new ATOM 0 HB2 GLN A 12 -12.806 -0.190 -5.214 1.00 10.00 H new ATOM 0 HB3 GLN A 12 -11.992 -1.061 -6.498 1.00 10.00 H new ATOM 0 HG2 GLN A 12 -14.658 0.329 -6.931 1.00 10.00 H new ATOM 0 HG3 GLN A 12 -13.132 1.173 -7.100 1.00 10.00 H new ATOM 0 HE21 GLN A 12 -15.279 -1.262 -8.546 1.00 10.00 H new ATOM 0 HE22 GLN A 12 -14.414 -1.356 -10.084 1.00 10.00 H new ATOM 198 N LYS A 13 -12.430 -3.606 -7.086 1.00 10.00 N ATOM 199 CA LYS A 13 -12.072 -4.469 -8.225 1.00 10.00 C ATOM 200 C LYS A 13 -11.699 -5.909 -7.876 1.00 10.00 C ATOM 201 O LYS A 13 -11.511 -6.717 -8.780 1.00 10.00 O ATOM 202 CB LYS A 13 -11.005 -3.759 -9.076 1.00 10.00 C ATOM 203 CG LYS A 13 -11.662 -3.230 -10.359 1.00 10.00 C ATOM 204 CD LYS A 13 -10.763 -2.233 -11.086 1.00 10.00 C ATOM 205 CE LYS A 13 -11.409 -1.895 -12.434 1.00 10.00 C ATOM 206 NZ LYS A 13 -10.603 -0.935 -13.221 1.00 10.00 N ATOM 0 H LYS A 13 -11.647 -3.424 -6.458 1.00 10.00 H new ATOM 0 HA LYS A 13 -12.981 -4.606 -8.811 1.00 10.00 H new ATOM 0 HB2 LYS A 13 -10.560 -2.938 -8.514 1.00 10.00 H new ATOM 0 HB3 LYS A 13 -10.199 -4.450 -9.323 1.00 10.00 H new ATOM 0 HG2 LYS A 13 -11.890 -4.065 -11.022 1.00 10.00 H new ATOM 0 HG3 LYS A 13 -12.610 -2.752 -10.112 1.00 10.00 H new ATOM 0 HD2 LYS A 13 -10.637 -1.330 -10.489 1.00 10.00 H new ATOM 0 HD3 LYS A 13 -9.770 -2.657 -11.237 1.00 10.00 H new ATOM 0 HE2 LYS A 13 -11.542 -2.811 -13.010 1.00 10.00 H new ATOM 0 HE3 LYS A 13 -12.402 -1.478 -12.264 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 -11.081 -0.738 -14.123 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 -10.497 -0.050 -12.685 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 -9.664 -1.341 -13.408 1.00 10.00 H new ATOM 220 N CYS A 14 -11.670 -6.254 -6.590 1.00 10.00 N ATOM 221 CA CYS A 14 -11.517 -7.626 -6.110 1.00 10.00 C ATOM 222 C CYS A 14 -12.850 -8.195 -5.627 1.00 10.00 C ATOM 223 O CYS A 14 -13.195 -9.316 -5.996 1.00 10.00 O ATOM 224 CB CYS A 14 -10.482 -7.649 -4.994 1.00 10.00 C ATOM 225 SG CYS A 14 -8.891 -6.850 -5.373 1.00 10.00 S ATOM 0 H CYS A 14 -11.754 -5.572 -5.836 1.00 10.00 H new ATOM 0 HA CYS A 14 -11.178 -8.255 -6.933 1.00 10.00 H new ATOM 0 HB2 CYS A 14 -10.911 -7.165 -4.117 1.00 10.00 H new ATOM 0 HB3 CYS A 14 -10.290 -8.687 -4.723 1.00 10.00 H new ATOM 230 N ALA A 15 -13.640 -7.406 -4.884 1.00 10.00 N ATOM 231 CA ALA A 15 -15.006 -7.768 -4.474 1.00 10.00 C ATOM 232 C ALA A 15 -15.982 -8.001 -5.652 1.00 10.00 C ATOM 233 O ALA A 15 -17.081 -8.519 -5.468 1.00 10.00 O ATOM 234 CB ALA A 15 -15.549 -6.729 -3.494 1.00 10.00 C ATOM 0 H ALA A 15 -13.346 -6.489 -4.547 1.00 10.00 H new ATOM 0 HA ALA A 15 -14.934 -8.735 -3.977 1.00 10.00 H new ATOM 0 HB1 ALA A 15 -16.561 -7.004 -3.195 1.00 10.00 H new ATOM 0 HB2 ALA A 15 -14.908 -6.690 -2.613 1.00 10.00 H new ATOM 0 HB3 ALA A 15 -15.566 -5.750 -3.974 1.00 10.00 H new ATOM 240 N GLN A 16 -15.563 -7.667 -6.878 1.00 10.00 N ATOM 241 CA GLN A 16 -16.227 -8.038 -8.126 1.00 10.00 C ATOM 242 C GLN A 16 -16.205 -9.562 -8.392 1.00 10.00 C ATOM 243 O GLN A 16 -17.000 -10.040 -9.202 1.00 10.00 O ATOM 244 CB GLN A 16 -15.571 -7.225 -9.258 1.00 10.00 C ATOM 245 CG GLN A 16 -16.429 -7.100 -10.531 1.00 10.00 C ATOM 246 CD GLN A 16 -15.908 -7.942 -11.692 1.00 10.00 C ATOM 247 OE1 GLN A 16 -15.255 -7.450 -12.597 1.00 10.00 O ATOM 248 NE2 GLN A 16 -16.182 -9.229 -11.707 1.00 10.00 N ATOM 0 H GLN A 16 -14.722 -7.111 -7.030 1.00 10.00 H new ATOM 0 HA GLN A 16 -17.288 -7.797 -8.063 1.00 10.00 H new ATOM 0 HB2 GLN A 16 -15.345 -6.225 -8.887 1.00 10.00 H new ATOM 0 HB3 GLN A 16 -14.621 -7.690 -9.519 1.00 10.00 H new ATOM 0 HG2 GLN A 16 -17.452 -7.400 -10.303 1.00 10.00 H new ATOM 0 HG3 GLN A 16 -16.464 -6.054 -10.836 1.00 10.00 H new ATOM 0 HE21 GLN A 16 -16.728 -9.643 -10.951 1.00 10.00 H new ATOM 0 HE22 GLN A 16 -15.848 -9.813 -12.474 1.00 10.00 H new ATOM 257 N CYS A 17 -15.343 -10.327 -7.701 1.00 10.00 N ATOM 258 CA CYS A 17 -15.159 -11.772 -7.862 1.00 10.00 C ATOM 259 C CYS A 17 -14.874 -12.519 -6.539 1.00 10.00 C ATOM 260 O CYS A 17 -15.316 -13.660 -6.383 1.00 10.00 O ATOM 261 CB CYS A 17 -13.988 -11.992 -8.823 1.00 10.00 C ATOM 262 SG CYS A 17 -14.306 -11.648 -10.586 1.00 10.00 S ATOM 0 H CYS A 17 -14.731 -9.935 -6.985 1.00 10.00 H new ATOM 0 HA CYS A 17 -16.094 -12.180 -8.246 1.00 10.00 H new ATOM 0 HB2 CYS A 17 -13.157 -11.366 -8.498 1.00 10.00 H new ATOM 0 HB3 CYS A 17 -13.661 -13.028 -8.731 1.00 10.00 H new ATOM 267 N HIS A 18 -14.168 -11.889 -5.597 1.00 10.00 N ATOM 268 CA HIS A 18 -13.897 -12.348 -4.234 1.00 10.00 C ATOM 269 C HIS A 18 -14.833 -11.649 -3.230 1.00 10.00 C ATOM 270 O HIS A 18 -15.677 -10.858 -3.640 1.00 10.00 O ATOM 271 CB HIS A 18 -12.418 -12.060 -3.939 1.00 10.00 C ATOM 272 CG HIS A 18 -11.503 -12.689 -4.939 1.00 10.00 C ATOM 273 ND1 HIS A 18 -11.231 -14.020 -4.989 1.00 10.00 N ATOM 274 CD2 HIS A 18 -10.756 -12.067 -5.896 1.00 10.00 C ATOM 275 CE1 HIS A 18 -10.298 -14.198 -5.938 1.00 10.00 C ATOM 276 NE2 HIS A 18 -9.991 -13.048 -6.538 1.00 10.00 N ATOM 0 H HIS A 18 -13.741 -10.981 -5.780 1.00 10.00 H new ATOM 0 HA HIS A 18 -14.088 -13.417 -4.136 1.00 10.00 H new ATOM 0 HB2 HIS A 18 -12.256 -10.982 -3.930 1.00 10.00 H new ATOM 0 HB3 HIS A 18 -12.171 -12.428 -2.943 1.00 10.00 H new ATOM 0 HD1 HIS A 18 -11.656 -14.747 -4.414 1.00 10.00 H new ATOM 0 HD2 HIS A 18 -10.755 -11.010 -6.118 1.00 10.00 H new ATOM 0 HE1 HIS A 18 -9.853 -15.151 -6.184 1.00 10.00 H new ATOM 284 N THR A 19 -14.694 -11.927 -1.923 1.00 10.00 N ATOM 285 CA THR A 19 -15.514 -11.326 -0.850 1.00 10.00 C ATOM 286 C THR A 19 -15.021 -11.784 0.536 1.00 10.00 C ATOM 287 O THR A 19 -15.002 -12.983 0.813 1.00 10.00 O ATOM 288 CB THR A 19 -17.015 -11.612 -1.089 1.00 10.00 C ATOM 289 OG1 THR A 19 -17.820 -11.016 -0.113 1.00 10.00 O ATOM 290 CG2 THR A 19 -17.393 -13.085 -1.203 1.00 10.00 C ATOM 0 H THR A 19 -13.998 -12.586 -1.573 1.00 10.00 H new ATOM 0 HA THR A 19 -15.397 -10.243 -0.873 1.00 10.00 H new ATOM 0 HB THR A 19 -17.200 -11.166 -2.066 1.00 10.00 H new ATOM 0 HG1 THR A 19 -18.691 -10.790 -0.501 1.00 10.00 H new ATOM 0 HG21 THR A 19 -18.467 -13.173 -1.369 1.00 10.00 H new ATOM 0 HG22 THR A 19 -16.858 -13.534 -2.040 1.00 10.00 H new ATOM 0 HG23 THR A 19 -17.125 -13.602 -0.281 1.00 10.00 H new ATOM 298 N VAL A 20 -14.552 -10.842 1.375 1.00 10.00 N ATOM 299 CA VAL A 20 -13.921 -11.106 2.689 1.00 10.00 C ATOM 300 C VAL A 20 -14.275 -10.044 3.743 1.00 10.00 C ATOM 301 O VAL A 20 -14.936 -10.395 4.716 1.00 10.00 O ATOM 302 CB VAL A 20 -12.400 -11.380 2.573 1.00 10.00 C ATOM 303 CG1 VAL A 20 -11.662 -10.443 1.606 1.00 10.00 C ATOM 304 CG2 VAL A 20 -11.665 -11.356 3.918 1.00 10.00 C ATOM 0 H VAL A 20 -14.601 -9.847 1.155 1.00 10.00 H new ATOM 0 HA VAL A 20 -14.357 -12.034 3.059 1.00 10.00 H new ATOM 0 HB VAL A 20 -12.373 -12.391 2.167 1.00 10.00 H new ATOM 0 HG11 VAL A 20 -10.604 -10.703 1.584 1.00 10.00 H new ATOM 0 HG12 VAL A 20 -12.082 -10.548 0.606 1.00 10.00 H new ATOM 0 HG13 VAL A 20 -11.776 -9.412 1.941 1.00 10.00 H new ATOM 0 HG21 VAL A 20 -10.606 -11.556 3.757 1.00 10.00 H new ATOM 0 HG22 VAL A 20 -11.783 -10.376 4.380 1.00 10.00 H new ATOM 0 HG23 VAL A 20 -12.083 -12.119 4.575 1.00 10.00 H new ATOM 314 N GLU A 21 -13.895 -8.760 3.586 1.00 10.00 N ATOM 315 CA GLU A 21 -14.419 -7.707 4.485 1.00 10.00 C ATOM 316 C GLU A 21 -15.937 -7.519 4.271 1.00 10.00 C ATOM 317 O GLU A 21 -16.692 -7.289 5.214 1.00 10.00 O ATOM 318 CB GLU A 21 -13.632 -6.382 4.354 1.00 10.00 C ATOM 319 CG GLU A 21 -14.109 -5.402 5.447 1.00 10.00 C ATOM 320 CD GLU A 21 -13.227 -4.163 5.649 1.00 10.00 C ATOM 321 OE1 GLU A 21 -12.134 -4.275 6.254 1.00 10.00 O ATOM 322 OE2 GLU A 21 -13.656 -3.042 5.285 1.00 10.00 O ATOM 0 H GLU A 21 -13.248 -8.432 2.869 1.00 10.00 H new ATOM 0 HA GLU A 21 -14.270 -8.038 5.513 1.00 10.00 H new ATOM 0 HB2 GLU A 21 -12.563 -6.568 4.456 1.00 10.00 H new ATOM 0 HB3 GLU A 21 -13.787 -5.948 3.366 1.00 10.00 H new ATOM 0 HG2 GLU A 21 -15.118 -5.073 5.201 1.00 10.00 H new ATOM 0 HG3 GLU A 21 -14.172 -5.941 6.392 1.00 10.00 H new ATOM 329 N LYS A 22 -16.398 -7.729 3.032 1.00 10.00 N ATOM 330 CA LYS A 22 -17.777 -8.095 2.706 1.00 10.00 C ATOM 331 C LYS A 22 -18.055 -9.515 3.223 1.00 10.00 C ATOM 332 O LYS A 22 -17.411 -10.467 2.791 1.00 10.00 O ATOM 333 CB LYS A 22 -17.981 -8.029 1.179 1.00 10.00 C ATOM 334 CG LYS A 22 -17.999 -6.602 0.604 1.00 10.00 C ATOM 335 CD LYS A 22 -19.291 -5.812 0.882 1.00 10.00 C ATOM 336 CE LYS A 22 -20.382 -5.997 -0.186 1.00 10.00 C ATOM 337 NZ LYS A 22 -21.022 -7.334 -0.161 1.00 10.00 N ATOM 0 H LYS A 22 -15.803 -7.646 2.207 1.00 10.00 H new ATOM 0 HA LYS A 22 -18.470 -7.400 3.181 1.00 10.00 H new ATOM 0 HB2 LYS A 22 -17.185 -8.594 0.693 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -18.921 -8.521 0.928 1.00 10.00 H new ATOM 0 HG2 LYS A 22 -17.155 -6.048 1.016 1.00 10.00 H new ATOM 0 HG3 LYS A 22 -17.848 -6.657 -0.474 1.00 10.00 H new ATOM 0 HD2 LYS A 22 -19.689 -6.117 1.850 1.00 10.00 H new ATOM 0 HD3 LYS A 22 -19.047 -4.752 0.957 1.00 10.00 H new ATOM 0 HE2 LYS A 22 -21.148 -5.235 -0.045 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -19.945 -5.832 -1.171 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -21.917 -7.300 -0.689 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -20.387 -8.031 -0.600 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 -21.211 -7.610 0.824 1.00 10.00 H new ATOM 351 N GLY A 23 -19.045 -9.673 4.108 1.00 10.00 N ATOM 352 CA GLY A 23 -19.495 -10.977 4.609 1.00 10.00 C ATOM 353 C GLY A 23 -20.304 -11.769 3.572 1.00 10.00 C ATOM 354 O GLY A 23 -21.496 -11.986 3.768 1.00 10.00 O ATOM 0 H GLY A 23 -19.564 -8.888 4.502 1.00 10.00 H new ATOM 0 HA2 GLY A 23 -18.627 -11.564 4.911 1.00 10.00 H new ATOM 0 HA3 GLY A 23 -20.104 -10.827 5.500 1.00 10.00 H new ATOM 358 N GLY A 24 -19.662 -12.165 2.468 1.00 10.00 N ATOM 359 CA GLY A 24 -20.281 -12.849 1.330 1.00 10.00 C ATOM 360 C GLY A 24 -19.934 -14.339 1.222 1.00 10.00 C ATOM 361 O GLY A 24 -19.792 -15.042 2.220 1.00 10.00 O ATOM 0 H GLY A 24 -18.662 -12.012 2.339 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -21.363 -12.745 1.404 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -19.975 -12.349 0.411 1.00 10.00 H new ATOM 365 N LYS A 25 -19.840 -14.822 -0.025 1.00 10.00 N ATOM 366 CA LYS A 25 -19.775 -16.248 -0.392 1.00 10.00 C ATOM 367 C LYS A 25 -19.226 -16.455 -1.822 1.00 10.00 C ATOM 368 O LYS A 25 -19.957 -16.844 -2.730 1.00 10.00 O ATOM 369 CB LYS A 25 -21.174 -16.886 -0.216 1.00 10.00 C ATOM 370 CG LYS A 25 -22.300 -16.098 -0.918 1.00 10.00 C ATOM 371 CD LYS A 25 -23.514 -16.971 -1.284 1.00 10.00 C ATOM 372 CE LYS A 25 -24.250 -16.365 -2.485 1.00 10.00 C ATOM 373 NZ LYS A 25 -23.468 -16.540 -3.734 1.00 10.00 N ATOM 0 H LYS A 25 -19.806 -14.208 -0.839 1.00 10.00 H new ATOM 0 HA LYS A 25 -19.072 -16.748 0.275 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -21.153 -17.903 -0.608 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -21.401 -16.959 0.848 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -22.627 -15.287 -0.268 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -21.904 -15.640 -1.824 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -23.187 -17.984 -1.520 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -24.190 -17.045 -0.432 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -25.226 -16.838 -2.594 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -24.428 -15.304 -2.309 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -24.105 -16.476 -4.554 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -22.745 -15.795 -3.798 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -23.006 -17.472 -3.726 1.00 10.00 H new ATOM 387 N HIS A 26 -17.922 -16.175 -1.983 1.00 10.00 N ATOM 388 CA HIS A 26 -17.030 -16.566 -3.097 1.00 10.00 C ATOM 389 C HIS A 26 -17.703 -16.626 -4.483 1.00 10.00 C ATOM 390 O HIS A 26 -18.103 -17.687 -4.960 1.00 10.00 O ATOM 391 CB HIS A 26 -16.243 -17.838 -2.729 1.00 10.00 C ATOM 392 CG HIS A 26 -16.932 -18.787 -1.780 1.00 10.00 C ATOM 393 ND1 HIS A 26 -17.935 -19.683 -2.084 1.00 10.00 N ATOM 394 CD2 HIS A 26 -16.712 -18.846 -0.432 1.00 10.00 C ATOM 395 CE1 HIS A 26 -18.319 -20.256 -0.928 1.00 10.00 C ATOM 396 NE2 HIS A 26 -17.608 -19.770 0.100 1.00 10.00 N ATOM 0 H HIS A 26 -17.421 -15.626 -1.284 1.00 10.00 H new ATOM 0 HA HIS A 26 -16.315 -15.753 -3.223 1.00 10.00 H new ATOM 0 HB2 HIS A 26 -16.012 -18.377 -3.648 1.00 10.00 H new ATOM 0 HB3 HIS A 26 -15.293 -17.539 -2.287 1.00 10.00 H new ATOM 0 HD1 HIS A 26 -18.315 -19.876 -3.011 1.00 10.00 H new ATOM 0 HD2 HIS A 26 -15.977 -18.279 0.120 1.00 10.00 H new ATOM 0 HE1 HIS A 26 -19.093 -21.004 -0.840 1.00 10.00 H new ATOM 404 N LYS A 27 -17.848 -15.445 -5.101 1.00 10.00 N ATOM 405 CA LYS A 27 -18.655 -15.192 -6.305 1.00 10.00 C ATOM 406 C LYS A 27 -18.077 -15.855 -7.563 1.00 10.00 C ATOM 407 O LYS A 27 -18.804 -16.509 -8.306 1.00 10.00 O ATOM 408 CB LYS A 27 -18.791 -13.674 -6.543 1.00 10.00 C ATOM 409 CG LYS A 27 -19.258 -12.871 -5.312 1.00 10.00 C ATOM 410 CD LYS A 27 -19.306 -11.357 -5.583 1.00 10.00 C ATOM 411 CE LYS A 27 -20.340 -10.942 -6.637 1.00 10.00 C ATOM 412 NZ LYS A 27 -21.729 -11.178 -6.176 1.00 10.00 N ATOM 0 H LYS A 27 -17.386 -14.602 -4.761 1.00 10.00 H new ATOM 0 HA LYS A 27 -19.633 -15.637 -6.123 1.00 10.00 H new ATOM 0 HB2 LYS A 27 -17.828 -13.283 -6.871 1.00 10.00 H new ATOM 0 HB3 LYS A 27 -19.497 -13.509 -7.357 1.00 10.00 H new ATOM 0 HG2 LYS A 27 -20.248 -13.215 -5.011 1.00 10.00 H new ATOM 0 HG3 LYS A 27 -18.585 -13.067 -4.477 1.00 10.00 H new ATOM 0 HD2 LYS A 27 -19.526 -10.839 -4.650 1.00 10.00 H new ATOM 0 HD3 LYS A 27 -18.320 -11.025 -5.907 1.00 10.00 H new ATOM 0 HE2 LYS A 27 -20.211 -9.886 -6.875 1.00 10.00 H new ATOM 0 HE3 LYS A 27 -20.164 -11.500 -7.557 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 -22.397 -10.837 -6.897 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 -21.875 -12.196 -6.022 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 -21.891 -10.666 -5.285 1.00 10.00 H new ATOM 426 N THR A 28 -16.770 -15.675 -7.779 1.00 10.00 N ATOM 427 CA THR A 28 -16.060 -15.977 -9.041 1.00 10.00 C ATOM 428 C THR A 28 -14.577 -16.313 -8.800 1.00 10.00 C ATOM 429 O THR A 28 -13.980 -17.024 -9.603 1.00 10.00 O ATOM 430 CB THR A 28 -16.118 -14.768 -10.004 1.00 10.00 C ATOM 431 OG1 THR A 28 -17.388 -14.154 -10.027 1.00 10.00 O ATOM 432 CG2 THR A 28 -15.771 -15.118 -11.452 1.00 10.00 C ATOM 0 H THR A 28 -16.150 -15.303 -7.060 1.00 10.00 H new ATOM 0 HA THR A 28 -16.562 -16.841 -9.477 1.00 10.00 H new ATOM 0 HB THR A 28 -15.367 -14.088 -9.602 1.00 10.00 H new ATOM 0 HG1 THR A 28 -17.374 -13.396 -10.648 1.00 10.00 H new ATOM 0 HG21 THR A 28 -15.833 -14.221 -12.068 1.00 10.00 H new ATOM 0 HG22 THR A 28 -14.759 -15.520 -11.497 1.00 10.00 H new ATOM 0 HG23 THR A 28 -16.474 -15.863 -11.825 1.00 10.00 H new ATOM 440 N GLY A 29 -14.000 -15.853 -7.685 1.00 10.00 N ATOM 441 CA GLY A 29 -12.835 -16.425 -7.015 1.00 10.00 C ATOM 442 C GLY A 29 -13.233 -16.838 -5.587 1.00 10.00 C ATOM 443 O GLY A 29 -14.396 -16.654 -5.207 1.00 10.00 O ATOM 0 H GLY A 29 -14.355 -15.027 -7.203 1.00 10.00 H new ATOM 0 HA2 GLY A 29 -12.468 -17.289 -7.569 1.00 10.00 H new ATOM 0 HA3 GLY A 29 -12.023 -15.698 -6.985 1.00 10.00 H new ATOM 447 N PRO A 30 -12.313 -17.376 -4.758 1.00 10.00 N ATOM 448 CA PRO A 30 -12.642 -17.704 -3.376 1.00 10.00 C ATOM 449 C PRO A 30 -12.779 -16.434 -2.519 1.00 10.00 C ATOM 450 O PRO A 30 -12.662 -15.312 -3.010 1.00 10.00 O ATOM 451 CB PRO A 30 -11.519 -18.620 -2.899 1.00 10.00 C ATOM 452 CG PRO A 30 -10.317 -18.112 -3.670 1.00 10.00 C ATOM 453 CD PRO A 30 -10.899 -17.638 -5.001 1.00 10.00 C ATOM 0 HA PRO A 30 -13.608 -18.202 -3.290 1.00 10.00 H new ATOM 0 HB2 PRO A 30 -11.368 -18.547 -1.822 1.00 10.00 H new ATOM 0 HB3 PRO A 30 -11.729 -19.666 -3.121 1.00 10.00 H new ATOM 0 HG2 PRO A 30 -9.819 -17.299 -3.141 1.00 10.00 H new ATOM 0 HG3 PRO A 30 -9.576 -18.898 -3.817 1.00 10.00 H new ATOM 0 HD2 PRO A 30 -10.391 -16.739 -5.349 1.00 10.00 H new ATOM 0 HD3 PRO A 30 -10.771 -18.396 -5.774 1.00 10.00 H new ATOM 461 N ASN A 31 -13.007 -16.596 -1.218 1.00 10.00 N ATOM 462 CA ASN A 31 -13.145 -15.482 -0.282 1.00 10.00 C ATOM 463 C ASN A 31 -11.869 -14.639 -0.120 1.00 10.00 C ATOM 464 O ASN A 31 -11.981 -13.424 -0.007 1.00 10.00 O ATOM 465 CB ASN A 31 -13.677 -15.998 1.071 1.00 10.00 C ATOM 466 CG ASN A 31 -12.941 -17.204 1.654 1.00 10.00 C ATOM 467 OD1 ASN A 31 -11.935 -17.678 1.145 1.00 10.00 O ATOM 468 ND2 ASN A 31 -13.457 -17.765 2.725 1.00 10.00 N ATOM 0 H ASN A 31 -13.102 -17.512 -0.779 1.00 10.00 H new ATOM 0 HA ASN A 31 -13.872 -14.793 -0.711 1.00 10.00 H new ATOM 0 HB2 ASN A 31 -13.631 -15.183 1.794 1.00 10.00 H new ATOM 0 HB3 ASN A 31 -14.728 -16.260 0.952 1.00 10.00 H new ATOM 0 HD21 ASN A 31 -13.018 -18.593 3.129 1.00 10.00 H new ATOM 0 HD22 ASN A 31 -14.296 -17.373 3.152 1.00 10.00 H new ATOM 475 N LEU A 32 -10.692 -15.280 -0.162 1.00 10.00 N ATOM 476 CA LEU A 32 -9.437 -14.935 0.501 1.00 10.00 C ATOM 477 C LEU A 32 -9.559 -15.088 2.025 1.00 10.00 C ATOM 478 O LEU A 32 -9.489 -14.130 2.794 1.00 10.00 O ATOM 479 CB LEU A 32 -8.881 -13.568 0.089 1.00 10.00 C ATOM 480 CG LEU A 32 -8.313 -13.450 -1.336 1.00 10.00 C ATOM 481 CD1 LEU A 32 -9.384 -13.227 -2.395 1.00 10.00 C ATOM 482 CD2 LEU A 32 -7.356 -12.256 -1.367 1.00 10.00 C ATOM 0 H LEU A 32 -10.591 -16.132 -0.714 1.00 10.00 H new ATOM 0 HA LEU A 32 -8.694 -15.653 0.154 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -9.676 -12.831 0.200 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -8.094 -13.296 0.792 1.00 10.00 H new ATOM 0 HG LEU A 32 -7.817 -14.392 -1.569 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -8.915 -13.153 -3.376 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -10.082 -14.064 -2.389 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -9.922 -12.304 -2.179 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -6.939 -12.150 -2.368 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -7.898 -11.348 -1.102 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -6.549 -12.418 -0.653 1.00 10.00 H new ATOM 494 N HIS A 33 -9.689 -16.345 2.459 1.00 10.00 N ATOM 495 CA HIS A 33 -9.449 -16.825 3.823 1.00 10.00 C ATOM 496 C HIS A 33 -8.013 -16.532 4.312 1.00 10.00 C ATOM 497 O HIS A 33 -7.164 -17.425 4.393 1.00 10.00 O ATOM 498 CB HIS A 33 -9.808 -18.323 3.894 1.00 10.00 C ATOM 499 CG HIS A 33 -9.285 -19.145 2.736 1.00 10.00 C ATOM 500 ND1 HIS A 33 -8.039 -19.025 2.156 1.00 10.00 N ATOM 501 CD2 HIS A 33 -10.008 -20.036 1.991 1.00 10.00 C ATOM 502 CE1 HIS A 33 -8.027 -19.805 1.061 1.00 10.00 C ATOM 503 NE2 HIS A 33 -9.197 -20.448 0.938 1.00 10.00 N ATOM 0 H HIS A 33 -9.981 -17.096 1.834 1.00 10.00 H new ATOM 0 HA HIS A 33 -10.093 -16.276 4.510 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -9.415 -18.735 4.823 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -10.893 -18.423 3.935 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -11.020 -20.359 2.184 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -7.195 -19.900 0.379 1.00 10.00 H new ATOM 0 HE2 HIS A 33 -9.446 -21.115 0.208 1.00 10.00 H new ATOM 511 N GLY A 34 -7.745 -15.259 4.622 1.00 10.00 N ATOM 512 CA GLY A 34 -6.525 -14.731 5.236 1.00 10.00 C ATOM 513 C GLY A 34 -5.282 -14.791 4.344 1.00 10.00 C ATOM 514 O GLY A 34 -4.760 -13.756 3.935 1.00 10.00 O ATOM 0 H GLY A 34 -8.423 -14.520 4.437 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -6.699 -13.694 5.524 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.325 -15.287 6.152 1.00 10.00 H new ATOM 518 N LEU A 35 -4.807 -16.009 4.055 1.00 10.00 N ATOM 519 CA LEU A 35 -3.538 -16.329 3.408 1.00 10.00 C ATOM 520 C LEU A 35 -2.322 -15.694 4.114 1.00 10.00 C ATOM 521 O LEU A 35 -2.375 -15.347 5.294 1.00 10.00 O ATOM 522 CB LEU A 35 -3.652 -15.990 1.909 1.00 10.00 C ATOM 523 CG LEU A 35 -4.535 -16.882 1.027 1.00 10.00 C ATOM 524 CD1 LEU A 35 -4.532 -18.369 1.393 1.00 10.00 C ATOM 525 CD2 LEU A 35 -5.980 -16.382 0.927 1.00 10.00 C ATOM 0 H LEU A 35 -5.338 -16.849 4.284 1.00 10.00 H new ATOM 0 HA LEU A 35 -3.343 -17.398 3.498 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -4.024 -14.969 1.826 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -2.646 -15.998 1.489 1.00 10.00 H new ATOM 0 HG LEU A 35 -4.058 -16.799 0.050 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -5.186 -18.913 0.711 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -3.518 -18.761 1.313 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -4.890 -18.493 2.415 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -6.554 -17.055 0.290 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -6.425 -16.355 1.921 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -5.989 -15.380 0.498 1.00 10.00 H new ATOM 537 N PHE A 36 -1.180 -15.651 3.419 1.00 10.00 N ATOM 538 CA PHE A 36 0.131 -15.171 3.863 1.00 10.00 C ATOM 539 C PHE A 36 0.801 -16.036 4.943 1.00 10.00 C ATOM 540 O PHE A 36 1.834 -15.669 5.500 1.00 10.00 O ATOM 541 CB PHE A 36 0.112 -13.673 4.184 1.00 10.00 C ATOM 542 CG PHE A 36 -0.219 -12.768 3.011 1.00 10.00 C ATOM 543 CD1 PHE A 36 -1.536 -12.652 2.523 1.00 10.00 C ATOM 544 CD2 PHE A 36 0.810 -12.031 2.400 1.00 10.00 C ATOM 545 CE1 PHE A 36 -1.799 -11.857 1.394 1.00 10.00 C ATOM 546 CE2 PHE A 36 0.538 -11.200 1.305 1.00 10.00 C ATOM 547 CZ PHE A 36 -0.760 -11.132 0.787 1.00 10.00 C ATOM 0 H PHE A 36 -1.147 -15.978 2.453 1.00 10.00 H new ATOM 0 HA PHE A 36 0.794 -15.294 3.007 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -0.615 -13.496 4.976 1.00 10.00 H new ATOM 0 HB3 PHE A 36 1.088 -13.389 4.578 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -2.343 -13.174 3.016 1.00 10.00 H new ATOM 0 HD2 PHE A 36 1.819 -12.106 2.778 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -2.800 -11.804 0.993 1.00 10.00 H new ATOM 0 HE2 PHE A 36 1.329 -10.613 0.862 1.00 10.00 H new ATOM 0 HZ PHE A 36 -0.963 -10.522 -0.080 1.00 10.00 H new ATOM 557 N GLY A 37 0.224 -17.213 5.193 1.00 10.00 N ATOM 558 CA GLY A 37 0.675 -18.195 6.181 1.00 10.00 C ATOM 559 C GLY A 37 0.150 -19.613 5.940 1.00 10.00 C ATOM 560 O GLY A 37 0.232 -20.448 6.836 1.00 10.00 O ATOM 0 H GLY A 37 -0.608 -17.521 4.690 1.00 10.00 H new ATOM 0 HA2 GLY A 37 1.765 -18.218 6.183 1.00 10.00 H new ATOM 0 HA3 GLY A 37 0.362 -17.867 7.172 1.00 10.00 H new ATOM 564 N ARG A 38 -0.420 -19.887 4.756 1.00 10.00 N ATOM 565 CA ARG A 38 -1.022 -21.175 4.394 1.00 10.00 C ATOM 566 C ARG A 38 -1.015 -21.405 2.877 1.00 10.00 C ATOM 567 O ARG A 38 -0.740 -20.492 2.095 1.00 10.00 O ATOM 568 CB ARG A 38 -2.448 -21.273 4.977 1.00 10.00 C ATOM 569 CG ARG A 38 -3.393 -20.134 4.540 1.00 10.00 C ATOM 570 CD ARG A 38 -4.881 -20.518 4.600 1.00 10.00 C ATOM 571 NE ARG A 38 -5.241 -21.399 3.472 1.00 10.00 N ATOM 572 CZ ARG A 38 -5.251 -22.726 3.454 1.00 10.00 C ATOM 573 NH1 ARG A 38 -5.288 -23.460 4.540 1.00 10.00 N ATOM 574 NH2 ARG A 38 -5.170 -23.357 2.315 1.00 10.00 N ATOM 0 H ARG A 38 -0.475 -19.199 4.005 1.00 10.00 H new ATOM 0 HA ARG A 38 -0.414 -21.969 4.829 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -2.885 -22.226 4.679 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -2.383 -21.278 6.065 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -3.223 -19.266 5.178 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -3.143 -19.835 3.522 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -5.093 -21.022 5.543 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -5.495 -19.618 4.574 1.00 10.00 H new ATOM 0 HE ARG A 38 -5.514 -20.934 2.606 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -5.311 -23.014 5.457 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -5.294 -24.477 4.468 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -5.099 -22.831 1.444 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -5.177 -24.377 2.295 1.00 10.00 H new ATOM 588 N LYS A 39 -1.338 -22.640 2.478 1.00 10.00 N ATOM 589 CA LYS A 39 -1.417 -23.101 1.086 1.00 10.00 C ATOM 590 C LYS A 39 -2.534 -22.402 0.296 1.00 10.00 C ATOM 591 O LYS A 39 -3.475 -21.843 0.868 1.00 10.00 O ATOM 592 CB LYS A 39 -1.604 -24.632 1.074 1.00 10.00 C ATOM 593 CG LYS A 39 -0.372 -25.361 1.647 1.00 10.00 C ATOM 594 CD LYS A 39 -0.327 -26.872 1.366 1.00 10.00 C ATOM 595 CE LYS A 39 -1.444 -27.648 2.078 1.00 10.00 C ATOM 596 NZ LYS A 39 -2.684 -27.734 1.269 1.00 10.00 N ATOM 0 H LYS A 39 -1.561 -23.379 3.145 1.00 10.00 H new ATOM 0 HA LYS A 39 -0.485 -22.838 0.586 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -2.487 -24.895 1.657 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -1.784 -24.969 0.053 1.00 10.00 H new ATOM 0 HG2 LYS A 39 0.527 -24.903 1.236 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -0.345 -25.205 2.726 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -0.404 -27.039 0.292 1.00 10.00 H new ATOM 0 HD3 LYS A 39 0.639 -27.266 1.681 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -1.093 -28.654 2.307 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -1.668 -27.165 3.029 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 -3.187 -28.615 1.497 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -3.296 -26.921 1.484 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -2.440 -27.726 0.258 1.00 10.00 H new ATOM 610 N THR A 40 -2.472 -22.487 -1.034 1.00 10.00 N ATOM 611 CA THR A 40 -3.555 -22.045 -1.925 1.00 10.00 C ATOM 612 C THR A 40 -4.779 -22.978 -1.811 1.00 10.00 C ATOM 613 O THR A 40 -4.671 -24.085 -1.277 1.00 10.00 O ATOM 614 CB THR A 40 -3.048 -21.922 -3.381 1.00 10.00 C ATOM 615 OG1 THR A 40 -2.861 -23.173 -3.994 1.00 10.00 O ATOM 616 CG2 THR A 40 -1.696 -21.214 -3.491 1.00 10.00 C ATOM 0 H THR A 40 -1.665 -22.866 -1.530 1.00 10.00 H new ATOM 0 HA THR A 40 -3.881 -21.053 -1.611 1.00 10.00 H new ATOM 0 HB THR A 40 -3.831 -21.346 -3.874 1.00 10.00 H new ATOM 0 HG1 THR A 40 -2.588 -23.043 -4.926 1.00 10.00 H new ATOM 0 HG21 THR A 40 -1.397 -21.161 -4.538 1.00 10.00 H new ATOM 0 HG22 THR A 40 -1.779 -20.206 -3.086 1.00 10.00 H new ATOM 0 HG23 THR A 40 -0.947 -21.771 -2.928 1.00 10.00 H new ATOM 624 N GLY A 41 -5.945 -22.547 -2.306 1.00 10.00 N ATOM 625 CA GLY A 41 -7.136 -23.393 -2.470 1.00 10.00 C ATOM 626 C GLY A 41 -8.276 -23.130 -1.486 1.00 10.00 C ATOM 627 O GLY A 41 -8.926 -22.102 -1.616 1.00 10.00 O ATOM 0 H GLY A 41 -6.091 -21.584 -2.609 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -7.517 -23.260 -3.483 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -6.834 -24.436 -2.377 1.00 10.00 H new ATOM 631 N GLN A 42 -8.560 -24.096 -0.591 1.00 10.00 N ATOM 632 CA GLN A 42 -9.563 -24.174 0.507 1.00 10.00 C ATOM 633 C GLN A 42 -10.985 -23.585 0.335 1.00 10.00 C ATOM 634 O GLN A 42 -11.790 -23.680 1.258 1.00 10.00 O ATOM 635 CB GLN A 42 -8.919 -23.717 1.833 1.00 10.00 C ATOM 636 CG GLN A 42 -8.068 -24.810 2.494 1.00 10.00 C ATOM 637 CD GLN A 42 -8.830 -26.051 2.966 1.00 10.00 C ATOM 638 OE1 GLN A 42 -10.048 -26.106 3.025 1.00 10.00 O ATOM 639 NE2 GLN A 42 -8.124 -27.102 3.331 1.00 10.00 N ATOM 0 H GLN A 42 -8.021 -24.961 -0.620 1.00 10.00 H new ATOM 0 HA GLN A 42 -9.814 -25.235 0.491 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -8.296 -22.843 1.646 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -9.703 -23.407 2.524 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -7.301 -25.125 1.787 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -7.553 -24.375 3.350 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -7.105 -27.072 3.288 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -8.596 -27.945 3.657 1.00 10.00 H new ATOM 648 N ALA A 43 -11.340 -23.040 -0.828 1.00 10.00 N ATOM 649 CA ALA A 43 -12.616 -22.414 -1.168 1.00 10.00 C ATOM 650 C ALA A 43 -13.870 -23.199 -0.704 1.00 10.00 C ATOM 651 O ALA A 43 -14.233 -24.191 -1.346 1.00 10.00 O ATOM 652 CB ALA A 43 -12.629 -22.213 -2.685 1.00 10.00 C ATOM 0 H ALA A 43 -10.693 -23.024 -1.617 1.00 10.00 H new ATOM 0 HA ALA A 43 -12.682 -21.470 -0.628 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -13.568 -21.746 -2.982 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -11.797 -21.571 -2.974 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -12.531 -23.179 -3.181 1.00 10.00 H new ATOM 658 N PRO A 44 -14.574 -22.777 0.370 1.00 10.00 N ATOM 659 CA PRO A 44 -15.671 -23.540 0.978 1.00 10.00 C ATOM 660 C PRO A 44 -17.004 -23.420 0.198 1.00 10.00 C ATOM 661 O PRO A 44 -18.056 -23.139 0.768 1.00 10.00 O ATOM 662 CB PRO A 44 -15.732 -23.029 2.425 1.00 10.00 C ATOM 663 CG PRO A 44 -15.328 -21.564 2.293 1.00 10.00 C ATOM 664 CD PRO A 44 -14.287 -21.593 1.174 1.00 10.00 C ATOM 0 HA PRO A 44 -15.494 -24.615 0.950 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -16.731 -23.135 2.848 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -15.051 -23.578 3.075 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -16.179 -20.932 2.036 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -14.911 -21.175 3.222 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -14.345 -20.689 0.567 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -13.278 -21.638 1.584 1.00 10.00 H new ATOM 672 N GLY A 45 -16.957 -23.658 -1.120 1.00 10.00 N ATOM 673 CA GLY A 45 -18.109 -23.662 -2.028 1.00 10.00 C ATOM 674 C GLY A 45 -17.894 -22.844 -3.305 1.00 10.00 C ATOM 675 O GLY A 45 -18.736 -22.012 -3.643 1.00 10.00 O ATOM 0 H GLY A 45 -16.080 -23.861 -1.600 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -18.340 -24.691 -2.302 1.00 10.00 H new ATOM 0 HA3 GLY A 45 -18.978 -23.270 -1.499 1.00 10.00 H new ATOM 679 N PHE A 46 -16.774 -23.056 -4.009 1.00 10.00 N ATOM 680 CA PHE A 46 -16.468 -22.408 -5.286 1.00 10.00 C ATOM 681 C PHE A 46 -15.615 -23.328 -6.177 1.00 10.00 C ATOM 682 O PHE A 46 -14.500 -23.704 -5.815 1.00 10.00 O ATOM 683 CB PHE A 46 -15.802 -21.045 -5.024 1.00 10.00 C ATOM 684 CG PHE A 46 -14.877 -20.551 -6.121 1.00 10.00 C ATOM 685 CD1 PHE A 46 -15.370 -20.323 -7.418 1.00 10.00 C ATOM 686 CD2 PHE A 46 -13.504 -20.391 -5.865 1.00 10.00 C ATOM 687 CE1 PHE A 46 -14.507 -19.898 -8.441 1.00 10.00 C ATOM 688 CE2 PHE A 46 -12.637 -19.999 -6.897 1.00 10.00 C ATOM 689 CZ PHE A 46 -13.139 -19.734 -8.176 1.00 10.00 C ATOM 0 H PHE A 46 -16.043 -23.696 -3.698 1.00 10.00 H new ATOM 0 HA PHE A 46 -17.391 -22.224 -5.836 1.00 10.00 H new ATOM 0 HB2 PHE A 46 -16.584 -20.301 -4.869 1.00 10.00 H new ATOM 0 HB3 PHE A 46 -15.235 -21.109 -4.095 1.00 10.00 H new ATOM 0 HD1 PHE A 46 -16.418 -20.476 -7.629 1.00 10.00 H new ATOM 0 HD2 PHE A 46 -13.116 -20.570 -4.873 1.00 10.00 H new ATOM 0 HE1 PHE A 46 -14.895 -19.698 -9.429 1.00 10.00 H new ATOM 0 HE2 PHE A 46 -11.579 -19.902 -6.703 1.00 10.00 H new ATOM 0 HZ PHE A 46 -12.473 -19.403 -8.959 1.00 10.00 H new ATOM 699 N THR A 47 -16.159 -23.699 -7.341 1.00 10.00 N ATOM 700 CA THR A 47 -15.504 -24.506 -8.378 1.00 10.00 C ATOM 701 C THR A 47 -14.424 -23.696 -9.108 1.00 10.00 C ATOM 702 O THR A 47 -14.726 -22.709 -9.774 1.00 10.00 O ATOM 703 CB THR A 47 -16.545 -25.007 -9.393 1.00 10.00 C ATOM 704 OG1 THR A 47 -17.613 -25.626 -8.716 1.00 10.00 O ATOM 705 CG2 THR A 47 -15.963 -26.043 -10.360 1.00 10.00 C ATOM 0 H THR A 47 -17.110 -23.434 -7.598 1.00 10.00 H new ATOM 0 HA THR A 47 -15.029 -25.358 -7.891 1.00 10.00 H new ATOM 0 HB THR A 47 -16.875 -24.134 -9.956 1.00 10.00 H new ATOM 0 HG1 THR A 47 -18.274 -25.942 -9.367 1.00 10.00 H new ATOM 0 HG21 THR A 47 -16.737 -26.366 -11.056 1.00 10.00 H new ATOM 0 HG22 THR A 47 -15.137 -25.599 -10.916 1.00 10.00 H new ATOM 0 HG23 THR A 47 -15.600 -26.903 -9.797 1.00 10.00 H new ATOM 713 N TYR A 48 -13.172 -24.149 -9.010 1.00 10.00 N ATOM 714 CA TYR A 48 -11.967 -23.500 -9.542 1.00 10.00 C ATOM 715 C TYR A 48 -11.123 -24.453 -10.408 1.00 10.00 C ATOM 716 O TYR A 48 -11.439 -25.639 -10.508 1.00 10.00 O ATOM 717 CB TYR A 48 -11.206 -22.922 -8.349 1.00 10.00 C ATOM 718 CG TYR A 48 -10.764 -23.817 -7.188 1.00 10.00 C ATOM 719 CD1 TYR A 48 -10.102 -25.046 -7.396 1.00 10.00 C ATOM 720 CD2 TYR A 48 -10.833 -23.298 -5.877 1.00 10.00 C ATOM 721 CE1 TYR A 48 -9.468 -25.717 -6.330 1.00 10.00 C ATOM 722 CE2 TYR A 48 -10.212 -23.970 -4.805 1.00 10.00 C ATOM 723 CZ TYR A 48 -9.508 -25.173 -5.028 1.00 10.00 C ATOM 724 OH TYR A 48 -8.812 -25.755 -4.008 1.00 10.00 O ATOM 0 H TYR A 48 -12.958 -25.025 -8.533 1.00 10.00 H new ATOM 0 HA TYR A 48 -12.233 -22.695 -10.227 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -10.309 -22.444 -8.743 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -11.828 -22.133 -7.925 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -10.081 -25.479 -8.385 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -11.367 -22.377 -5.694 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -8.951 -26.648 -6.510 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -10.275 -23.562 -3.807 1.00 10.00 H new ATOM 0 HH TYR A 48 -7.972 -26.123 -4.353 1.00 10.00 H new ATOM 734 N THR A 49 -10.020 -23.972 -11.006 1.00 10.00 N ATOM 735 CA THR A 49 -9.034 -24.859 -11.646 1.00 10.00 C ATOM 736 C THR A 49 -8.126 -25.541 -10.613 1.00 10.00 C ATOM 737 O THR A 49 -7.709 -24.923 -9.624 1.00 10.00 O ATOM 738 CB THR A 49 -8.150 -24.129 -12.678 1.00 10.00 C ATOM 739 OG1 THR A 49 -7.459 -23.061 -12.085 1.00 10.00 O ATOM 740 CG2 THR A 49 -8.960 -23.563 -13.844 1.00 10.00 C ATOM 0 H THR A 49 -9.790 -22.980 -11.060 1.00 10.00 H new ATOM 0 HA THR A 49 -9.624 -25.612 -12.169 1.00 10.00 H new ATOM 0 HB THR A 49 -7.454 -24.879 -13.053 1.00 10.00 H new ATOM 0 HG1 THR A 49 -7.308 -22.359 -12.752 1.00 10.00 H new ATOM 0 HG21 THR A 49 -8.291 -23.059 -14.541 1.00 10.00 H new ATOM 0 HG22 THR A 49 -9.475 -24.375 -14.357 1.00 10.00 H new ATOM 0 HG23 THR A 49 -9.693 -22.850 -13.466 1.00 10.00 H new ATOM 748 N ASP A 50 -7.798 -26.807 -10.896 1.00 10.00 N ATOM 749 CA ASP A 50 -6.717 -27.596 -10.301 1.00 10.00 C ATOM 750 C ASP A 50 -5.315 -27.036 -10.633 1.00 10.00 C ATOM 751 O ASP A 50 -5.175 -25.930 -11.155 1.00 10.00 O ATOM 752 CB ASP A 50 -6.878 -29.059 -10.763 1.00 10.00 C ATOM 753 CG ASP A 50 -7.963 -29.773 -9.960 1.00 10.00 C ATOM 754 OD1 ASP A 50 -7.595 -30.305 -8.884 1.00 10.00 O ATOM 755 OD2 ASP A 50 -9.121 -29.763 -10.421 1.00 10.00 O ATOM 0 H ASP A 50 -8.316 -27.341 -11.593 1.00 10.00 H new ATOM 0 HA ASP A 50 -6.793 -27.540 -9.215 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -7.131 -29.083 -11.823 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -5.931 -29.586 -10.649 1.00 10.00 H new ATOM 760 N ALA A 51 -4.265 -27.789 -10.269 1.00 10.00 N ATOM 761 CA ALA A 51 -2.848 -27.409 -10.203 1.00 10.00 C ATOM 762 C ALA A 51 -2.609 -26.231 -9.243 1.00 10.00 C ATOM 763 O ALA A 51 -2.061 -26.410 -8.162 1.00 10.00 O ATOM 764 CB ALA A 51 -2.276 -27.197 -11.613 1.00 10.00 C ATOM 0 H ALA A 51 -4.399 -28.761 -9.990 1.00 10.00 H new ATOM 0 HA ALA A 51 -2.287 -28.236 -9.769 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -1.225 -26.916 -11.541 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -2.366 -28.120 -12.185 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -2.830 -26.404 -12.115 1.00 10.00 H new ATOM 770 N ASN A 52 -3.113 -25.051 -9.590 1.00 10.00 N ATOM 771 CA ASN A 52 -3.046 -23.757 -8.908 1.00 10.00 C ATOM 772 C ASN A 52 -3.391 -23.827 -7.408 1.00 10.00 C ATOM 773 O ASN A 52 -2.861 -23.079 -6.583 1.00 10.00 O ATOM 774 CB ASN A 52 -4.066 -22.854 -9.626 1.00 10.00 C ATOM 775 CG ASN A 52 -3.925 -22.761 -11.145 1.00 10.00 C ATOM 776 OD1 ASN A 52 -3.103 -23.404 -11.779 1.00 10.00 O ATOM 777 ND2 ASN A 52 -4.756 -21.973 -11.782 1.00 10.00 N ATOM 0 H ASN A 52 -3.641 -24.966 -10.458 1.00 10.00 H new ATOM 0 HA ASN A 52 -2.024 -23.381 -8.954 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -5.068 -23.216 -9.395 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -3.987 -21.849 -9.211 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -4.713 -21.901 -12.799 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -5.446 -21.432 -11.261 1.00 10.00 H new ATOM 784 N LYS A 53 -4.284 -24.764 -7.076 1.00 10.00 N ATOM 785 CA LYS A 53 -5.088 -24.884 -5.851 1.00 10.00 C ATOM 786 C LYS A 53 -5.586 -26.317 -5.614 1.00 10.00 C ATOM 787 O LYS A 53 -6.330 -26.572 -4.667 1.00 10.00 O ATOM 788 CB LYS A 53 -6.321 -23.986 -6.001 1.00 10.00 C ATOM 789 CG LYS A 53 -6.024 -22.478 -6.014 1.00 10.00 C ATOM 790 CD LYS A 53 -7.306 -21.644 -6.105 1.00 10.00 C ATOM 791 CE LYS A 53 -8.207 -22.083 -7.268 1.00 10.00 C ATOM 792 NZ LYS A 53 -7.508 -22.323 -8.555 1.00 10.00 N ATOM 0 H LYS A 53 -4.483 -25.532 -7.718 1.00 10.00 H new ATOM 0 HA LYS A 53 -4.458 -24.596 -5.010 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -6.834 -24.249 -6.926 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -7.010 -24.199 -5.183 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -5.478 -22.208 -5.110 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -5.377 -22.243 -6.859 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -7.858 -21.728 -5.169 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -7.045 -20.593 -6.228 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -8.726 -22.997 -6.979 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -8.969 -21.319 -7.424 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -7.889 -21.684 -9.282 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -6.490 -22.144 -8.436 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -7.654 -23.309 -8.851 1.00 10.00 H new ATOM 806 N ASN A 54 -5.162 -27.248 -6.471 1.00 10.00 N ATOM 807 CA ASN A 54 -4.735 -28.581 -6.069 1.00 10.00 C ATOM 808 C ASN A 54 -3.408 -28.525 -5.275 1.00 10.00 C ATOM 809 O ASN A 54 -3.367 -28.898 -4.104 1.00 10.00 O ATOM 810 CB ASN A 54 -4.647 -29.444 -7.339 1.00 10.00 C ATOM 811 CG ASN A 54 -4.701 -30.928 -7.022 1.00 10.00 C ATOM 812 OD1 ASN A 54 -3.778 -31.481 -6.449 1.00 10.00 O ATOM 813 ND2 ASN A 54 -5.767 -31.603 -7.397 1.00 10.00 N ATOM 0 H ASN A 54 -5.106 -27.090 -7.477 1.00 10.00 H new ATOM 0 HA ASN A 54 -5.455 -29.033 -5.387 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -5.466 -29.186 -8.010 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -3.720 -29.219 -7.867 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -5.829 -32.604 -7.209 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -6.531 -31.125 -7.875 1.00 10.00 H new ATOM 820 N LYS A 55 -2.321 -28.051 -5.914 1.00 10.00 N ATOM 821 CA LYS A 55 -0.929 -28.226 -5.469 1.00 10.00 C ATOM 822 C LYS A 55 -0.511 -27.331 -4.295 1.00 10.00 C ATOM 823 O LYS A 55 0.452 -27.653 -3.605 1.00 10.00 O ATOM 824 CB LYS A 55 0.013 -28.073 -6.683 1.00 10.00 C ATOM 825 CG LYS A 55 1.243 -29.004 -6.636 1.00 10.00 C ATOM 826 CD LYS A 55 2.551 -28.346 -6.174 1.00 10.00 C ATOM 827 CE LYS A 55 3.124 -27.426 -7.259 1.00 10.00 C ATOM 828 NZ LYS A 55 4.483 -26.950 -6.908 1.00 10.00 N ATOM 0 H LYS A 55 -2.392 -27.519 -6.781 1.00 10.00 H new ATOM 0 HA LYS A 55 -0.849 -29.234 -5.062 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -0.549 -28.274 -7.595 1.00 10.00 H new ATOM 0 HB3 LYS A 55 0.353 -27.039 -6.740 1.00 10.00 H new ATOM 0 HG2 LYS A 55 1.021 -29.838 -5.970 1.00 10.00 H new ATOM 0 HG3 LYS A 55 1.398 -29.423 -7.630 1.00 10.00 H new ATOM 0 HD2 LYS A 55 2.371 -27.772 -5.265 1.00 10.00 H new ATOM 0 HD3 LYS A 55 3.280 -29.117 -5.925 1.00 10.00 H new ATOM 0 HE2 LYS A 55 3.159 -27.960 -8.209 1.00 10.00 H new ATOM 0 HE3 LYS A 55 2.463 -26.571 -7.398 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 4.840 -26.331 -7.663 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 4.445 -26.419 -6.014 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 5.119 -27.766 -6.800 1.00 10.00 H new ATOM 842 N GLY A 56 -1.232 -26.233 -4.036 1.00 10.00 N ATOM 843 CA GLY A 56 -1.168 -25.549 -2.742 1.00 10.00 C ATOM 844 C GLY A 56 0.017 -24.595 -2.533 1.00 10.00 C ATOM 845 O GLY A 56 0.403 -24.417 -1.385 1.00 10.00 O ATOM 0 H GLY A 56 -1.866 -25.800 -4.707 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -2.090 -24.983 -2.608 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -1.141 -26.305 -1.957 1.00 10.00 H new ATOM 849 N ILE A 57 0.578 -23.987 -3.589 1.00 10.00 N ATOM 850 CA ILE A 57 1.856 -23.235 -3.700 1.00 10.00 C ATOM 851 C ILE A 57 2.133 -22.034 -2.747 1.00 10.00 C ATOM 852 O ILE A 57 3.008 -21.226 -3.042 1.00 10.00 O ATOM 853 CB ILE A 57 2.111 -22.874 -5.194 1.00 10.00 C ATOM 854 CG1 ILE A 57 1.071 -21.943 -5.869 1.00 10.00 C ATOM 855 CG2 ILE A 57 2.199 -24.170 -6.024 1.00 10.00 C ATOM 856 CD1 ILE A 57 1.164 -20.465 -5.469 1.00 10.00 C ATOM 0 H ILE A 57 0.101 -24.007 -4.491 1.00 10.00 H new ATOM 0 HA ILE A 57 2.591 -23.940 -3.313 1.00 10.00 H new ATOM 0 HB ILE A 57 3.043 -22.308 -5.176 1.00 10.00 H new ATOM 0 HG12 ILE A 57 1.187 -22.019 -6.950 1.00 10.00 H new ATOM 0 HG13 ILE A 57 0.072 -22.306 -5.629 1.00 10.00 H new ATOM 0 HG21 ILE A 57 2.377 -23.921 -7.070 1.00 10.00 H new ATOM 0 HG22 ILE A 57 3.019 -24.785 -5.653 1.00 10.00 H new ATOM 0 HG23 ILE A 57 1.263 -24.722 -5.937 1.00 10.00 H new ATOM 0 HD11 ILE A 57 0.396 -19.897 -5.994 1.00 10.00 H new ATOM 0 HD12 ILE A 57 1.015 -20.369 -4.393 1.00 10.00 H new ATOM 0 HD13 ILE A 57 2.147 -20.077 -5.735 1.00 10.00 H new ATOM 868 N THR A 58 1.458 -21.933 -1.596 1.00 10.00 N ATOM 869 CA THR A 58 1.596 -20.924 -0.526 1.00 10.00 C ATOM 870 C THR A 58 1.439 -19.470 -0.982 1.00 10.00 C ATOM 871 O THR A 58 2.375 -18.818 -1.452 1.00 10.00 O ATOM 872 CB THR A 58 2.883 -21.130 0.294 1.00 10.00 C ATOM 873 OG1 THR A 58 2.925 -22.458 0.767 1.00 10.00 O ATOM 874 CG2 THR A 58 2.937 -20.236 1.537 1.00 10.00 C ATOM 0 H THR A 58 0.735 -22.614 -1.364 1.00 10.00 H new ATOM 0 HA THR A 58 0.742 -21.101 0.128 1.00 10.00 H new ATOM 0 HB THR A 58 3.714 -20.888 -0.368 1.00 10.00 H new ATOM 0 HG1 THR A 58 3.744 -22.594 1.288 1.00 10.00 H new ATOM 0 HG21 THR A 58 3.865 -20.421 2.079 1.00 10.00 H new ATOM 0 HG22 THR A 58 2.896 -19.190 1.235 1.00 10.00 H new ATOM 0 HG23 THR A 58 2.088 -20.460 2.183 1.00 10.00 H new ATOM 882 N TRP A 59 0.241 -18.919 -0.765 1.00 10.00 N ATOM 883 CA TRP A 59 0.012 -17.481 -0.885 1.00 10.00 C ATOM 884 C TRP A 59 0.689 -16.717 0.249 1.00 10.00 C ATOM 885 O TRP A 59 0.436 -16.998 1.420 1.00 10.00 O ATOM 886 CB TRP A 59 -1.479 -17.172 -0.952 1.00 10.00 C ATOM 887 CG TRP A 59 -2.129 -17.630 -2.213 1.00 10.00 C ATOM 888 CD1 TRP A 59 -3.280 -18.331 -2.287 1.00 10.00 C ATOM 889 CD2 TRP A 59 -1.678 -17.452 -3.594 1.00 10.00 C ATOM 890 NE1 TRP A 59 -3.542 -18.640 -3.602 1.00 10.00 N ATOM 891 CE2 TRP A 59 -2.596 -18.122 -4.456 1.00 10.00 C ATOM 892 CE3 TRP A 59 -0.593 -16.795 -4.209 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -2.448 -18.153 -5.849 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -0.404 -16.859 -5.598 1.00 10.00 C ATOM 895 CH2 TRP A 59 -1.329 -17.523 -6.416 1.00 10.00 C ATOM 0 H TRP A 59 -0.588 -19.453 -0.504 1.00 10.00 H new ATOM 0 HA TRP A 59 0.463 -17.146 -1.819 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -1.977 -17.643 -0.105 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -1.623 -16.097 -0.849 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -3.899 -18.606 -1.446 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -4.345 -19.190 -3.908 1.00 10.00 H new ATOM 0 HE3 TRP A 59 0.103 -16.234 -3.602 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -3.177 -18.650 -6.472 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 0.463 -16.392 -6.041 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -1.180 -17.550 -7.485 1.00 10.00 H new ATOM 906 N LYS A 60 1.536 -15.756 -0.132 1.00 10.00 N ATOM 907 CA LYS A 60 2.378 -14.876 0.684 1.00 10.00 C ATOM 908 C LYS A 60 2.834 -13.710 -0.201 1.00 10.00 C ATOM 909 O LYS A 60 2.631 -13.768 -1.413 1.00 10.00 O ATOM 910 CB LYS A 60 3.563 -15.688 1.252 1.00 10.00 C ATOM 911 CG LYS A 60 4.629 -16.001 0.181 1.00 10.00 C ATOM 912 CD LYS A 60 5.642 -17.084 0.564 1.00 10.00 C ATOM 913 CE LYS A 60 6.390 -16.743 1.857 1.00 10.00 C ATOM 914 NZ LYS A 60 7.809 -17.160 1.782 1.00 10.00 N ATOM 0 H LYS A 60 1.662 -15.554 -1.124 1.00 10.00 H new ATOM 0 HA LYS A 60 1.833 -14.470 1.536 1.00 10.00 H new ATOM 0 HB2 LYS A 60 4.024 -15.131 2.068 1.00 10.00 H new ATOM 0 HB3 LYS A 60 3.191 -16.622 1.674 1.00 10.00 H new ATOM 0 HG2 LYS A 60 4.122 -16.308 -0.734 1.00 10.00 H new ATOM 0 HG3 LYS A 60 5.171 -15.084 -0.047 1.00 10.00 H new ATOM 0 HD2 LYS A 60 5.126 -18.036 0.685 1.00 10.00 H new ATOM 0 HD3 LYS A 60 6.360 -17.211 -0.247 1.00 10.00 H new ATOM 0 HE2 LYS A 60 6.333 -15.670 2.041 1.00 10.00 H new ATOM 0 HE3 LYS A 60 5.907 -17.237 2.700 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 8.175 -17.319 2.742 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 7.884 -18.040 1.233 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 8.366 -16.414 1.318 1.00 10.00 H new ATOM 928 N GLU A 61 3.450 -12.667 0.360 1.00 10.00 N ATOM 929 CA GLU A 61 3.753 -11.442 -0.401 1.00 10.00 C ATOM 930 C GLU A 61 4.589 -11.670 -1.670 1.00 10.00 C ATOM 931 O GLU A 61 4.334 -11.002 -2.664 1.00 10.00 O ATOM 932 CB GLU A 61 4.357 -10.340 0.488 1.00 10.00 C ATOM 933 CG GLU A 61 5.408 -10.800 1.506 1.00 10.00 C ATOM 934 CD GLU A 61 4.753 -11.125 2.852 1.00 10.00 C ATOM 935 OE1 GLU A 61 4.207 -12.246 3.010 1.00 10.00 O ATOM 936 OE2 GLU A 61 4.739 -10.246 3.744 1.00 10.00 O ATOM 0 H GLU A 61 3.750 -12.641 1.335 1.00 10.00 H new ATOM 0 HA GLU A 61 2.784 -11.092 -0.757 1.00 10.00 H new ATOM 0 HB2 GLU A 61 4.810 -9.587 -0.157 1.00 10.00 H new ATOM 0 HB3 GLU A 61 3.546 -9.851 1.028 1.00 10.00 H new ATOM 0 HG2 GLU A 61 5.928 -11.680 1.127 1.00 10.00 H new ATOM 0 HG3 GLU A 61 6.158 -10.020 1.640 1.00 10.00 H new ATOM 943 N GLU A 62 5.507 -12.641 -1.681 1.00 10.00 N ATOM 944 CA GLU A 62 6.244 -13.074 -2.875 1.00 10.00 C ATOM 945 C GLU A 62 5.300 -13.611 -3.970 1.00 10.00 C ATOM 946 O GLU A 62 5.176 -13.028 -5.049 1.00 10.00 O ATOM 947 CB GLU A 62 7.272 -14.153 -2.482 1.00 10.00 C ATOM 948 CG GLU A 62 8.329 -13.666 -1.481 1.00 10.00 C ATOM 949 CD GLU A 62 9.197 -14.836 -1.006 1.00 10.00 C ATOM 950 OE1 GLU A 62 8.697 -15.609 -0.154 1.00 10.00 O ATOM 951 OE2 GLU A 62 10.338 -14.965 -1.493 1.00 10.00 O ATOM 0 H GLU A 62 5.765 -13.160 -0.842 1.00 10.00 H new ATOM 0 HA GLU A 62 6.759 -12.206 -3.287 1.00 10.00 H new ATOM 0 HB2 GLU A 62 6.745 -15.005 -2.053 1.00 10.00 H new ATOM 0 HB3 GLU A 62 7.774 -14.508 -3.382 1.00 10.00 H new ATOM 0 HG2 GLU A 62 8.956 -12.906 -1.946 1.00 10.00 H new ATOM 0 HG3 GLU A 62 7.841 -13.197 -0.627 1.00 10.00 H new ATOM 958 N THR A 63 4.622 -14.732 -3.690 1.00 10.00 N ATOM 959 CA THR A 63 3.748 -15.437 -4.636 1.00 10.00 C ATOM 960 C THR A 63 2.566 -14.580 -5.067 1.00 10.00 C ATOM 961 O THR A 63 2.227 -14.585 -6.245 1.00 10.00 O ATOM 962 CB THR A 63 3.293 -16.796 -4.064 1.00 10.00 C ATOM 963 OG1 THR A 63 2.587 -16.636 -2.856 1.00 10.00 O ATOM 964 CG2 THR A 63 4.464 -17.723 -3.733 1.00 10.00 C ATOM 0 H THR A 63 4.667 -15.184 -2.777 1.00 10.00 H new ATOM 0 HA THR A 63 4.332 -15.636 -5.534 1.00 10.00 H new ATOM 0 HB THR A 63 2.670 -17.228 -4.847 1.00 10.00 H new ATOM 0 HG1 THR A 63 2.533 -17.498 -2.392 1.00 10.00 H new ATOM 0 HG21 THR A 63 4.082 -18.663 -3.335 1.00 10.00 H new ATOM 0 HG22 THR A 63 5.040 -17.919 -4.638 1.00 10.00 H new ATOM 0 HG23 THR A 63 5.105 -17.248 -2.991 1.00 10.00 H new ATOM 972 N LEU A 64 1.961 -13.811 -4.160 1.00 10.00 N ATOM 973 CA LEU A 64 0.887 -12.863 -4.455 1.00 10.00 C ATOM 974 C LEU A 64 1.347 -11.552 -5.109 1.00 10.00 C ATOM 975 O LEU A 64 0.522 -10.857 -5.711 1.00 10.00 O ATOM 976 CB LEU A 64 0.062 -12.602 -3.175 1.00 10.00 C ATOM 977 CG LEU A 64 -1.433 -12.927 -3.301 1.00 10.00 C ATOM 978 CD1 LEU A 64 -2.088 -12.804 -1.923 1.00 10.00 C ATOM 979 CD2 LEU A 64 -2.138 -11.969 -4.260 1.00 10.00 C ATOM 0 H LEU A 64 2.213 -13.832 -3.172 1.00 10.00 H new ATOM 0 HA LEU A 64 0.260 -13.333 -5.213 1.00 10.00 H new ATOM 0 HB2 LEU A 64 0.482 -13.193 -2.361 1.00 10.00 H new ATOM 0 HB3 LEU A 64 0.170 -11.554 -2.896 1.00 10.00 H new ATOM 0 HG LEU A 64 -1.526 -13.940 -3.692 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -3.151 -13.033 -2.003 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -1.617 -13.504 -1.233 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -1.963 -11.787 -1.550 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -3.194 -12.230 -4.324 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -2.038 -10.948 -3.893 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -1.685 -12.045 -5.249 1.00 10.00 H new ATOM 991 N MET A 65 2.638 -11.203 -5.055 1.00 10.00 N ATOM 992 CA MET A 65 3.180 -10.224 -5.993 1.00 10.00 C ATOM 993 C MET A 65 3.183 -10.832 -7.386 1.00 10.00 C ATOM 994 O MET A 65 2.447 -10.336 -8.240 1.00 10.00 O ATOM 995 CB MET A 65 4.533 -9.635 -5.561 1.00 10.00 C ATOM 996 CG MET A 65 4.275 -8.404 -4.683 1.00 10.00 C ATOM 997 SD MET A 65 5.749 -7.491 -4.162 1.00 10.00 S ATOM 998 CE MET A 65 6.113 -8.364 -2.620 1.00 10.00 C ATOM 0 H MET A 65 3.311 -11.577 -4.386 1.00 10.00 H new ATOM 0 HA MET A 65 2.530 -9.349 -6.002 1.00 10.00 H new ATOM 0 HB2 MET A 65 5.110 -10.378 -5.010 1.00 10.00 H new ATOM 0 HB3 MET A 65 5.122 -9.359 -6.436 1.00 10.00 H new ATOM 0 HG2 MET A 65 3.621 -7.723 -5.227 1.00 10.00 H new ATOM 0 HG3 MET A 65 3.733 -8.722 -3.792 1.00 10.00 H new ATOM 0 HE1 MET A 65 6.978 -7.908 -2.139 1.00 10.00 H new ATOM 0 HE2 MET A 65 5.253 -8.300 -1.954 1.00 10.00 H new ATOM 0 HE3 MET A 65 6.328 -9.411 -2.836 1.00 10.00 H new ATOM 1008 N GLU A 66 3.904 -11.943 -7.577 1.00 10.00 N ATOM 1009 CA GLU A 66 4.065 -12.579 -8.890 1.00 10.00 C ATOM 1010 C GLU A 66 2.702 -12.880 -9.526 1.00 10.00 C ATOM 1011 O GLU A 66 2.457 -12.575 -10.695 1.00 10.00 O ATOM 1012 CB GLU A 66 4.897 -13.865 -8.727 1.00 10.00 C ATOM 1013 CG GLU A 66 5.570 -14.310 -10.031 1.00 10.00 C ATOM 1014 CD GLU A 66 6.681 -13.354 -10.484 1.00 10.00 C ATOM 1015 OE1 GLU A 66 6.354 -12.400 -11.223 1.00 10.00 O ATOM 1016 OE2 GLU A 66 7.841 -13.595 -10.087 1.00 10.00 O ATOM 0 H GLU A 66 4.393 -12.427 -6.824 1.00 10.00 H new ATOM 0 HA GLU A 66 4.588 -11.896 -9.559 1.00 10.00 H new ATOM 0 HB2 GLU A 66 5.661 -13.703 -7.967 1.00 10.00 H new ATOM 0 HB3 GLU A 66 4.252 -14.666 -8.365 1.00 10.00 H new ATOM 0 HG2 GLU A 66 5.988 -15.308 -9.896 1.00 10.00 H new ATOM 0 HG3 GLU A 66 4.817 -14.383 -10.816 1.00 10.00 H new ATOM 1023 N TYR A 67 1.781 -13.408 -8.711 1.00 10.00 N ATOM 1024 CA TYR A 67 0.428 -13.713 -9.144 1.00 10.00 C ATOM 1025 C TYR A 67 -0.373 -12.466 -9.535 1.00 10.00 C ATOM 1026 O TYR A 67 -0.888 -12.435 -10.645 1.00 10.00 O ATOM 1027 CB TYR A 67 -0.282 -14.531 -8.075 1.00 10.00 C ATOM 1028 CG TYR A 67 -1.729 -14.862 -8.387 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -2.032 -15.806 -9.388 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -2.772 -14.244 -7.672 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -3.369 -16.149 -9.657 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -4.113 -14.539 -7.978 1.00 10.00 C ATOM 1033 CZ TYR A 67 -4.412 -15.495 -8.974 1.00 10.00 C ATOM 1034 OH TYR A 67 -5.698 -15.777 -9.304 1.00 10.00 O ATOM 0 H TYR A 67 1.961 -13.633 -7.733 1.00 10.00 H new ATOM 0 HA TYR A 67 0.499 -14.307 -10.055 1.00 10.00 H new ATOM 0 HB2 TYR A 67 0.265 -15.462 -7.926 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -0.244 -13.984 -7.133 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -1.234 -16.268 -9.951 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -2.542 -13.541 -6.885 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -3.595 -16.913 -10.386 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -4.912 -14.036 -7.453 1.00 10.00 H new ATOM 0 HH TYR A 67 -6.176 -14.944 -9.500 1.00 10.00 H new ATOM 1044 N LEU A 68 -0.513 -11.441 -8.675 1.00 10.00 N ATOM 1045 CA LEU A 68 -1.316 -10.277 -9.085 1.00 10.00 C ATOM 1046 C LEU A 68 -0.674 -9.451 -10.212 1.00 10.00 C ATOM 1047 O LEU A 68 -1.424 -8.835 -10.971 1.00 10.00 O ATOM 1048 CB LEU A 68 -1.738 -9.398 -7.888 1.00 10.00 C ATOM 1049 CG LEU A 68 -3.252 -9.290 -7.652 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -3.976 -8.629 -8.828 1.00 10.00 C ATOM 1051 CD2 LEU A 68 -3.875 -10.647 -7.334 1.00 10.00 C ATOM 0 H LEU A 68 -0.105 -11.392 -7.741 1.00 10.00 H new ATOM 0 HA LEU A 68 -2.229 -10.695 -9.510 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -1.274 -9.796 -6.985 1.00 10.00 H new ATOM 0 HB3 LEU A 68 -1.338 -8.395 -8.037 1.00 10.00 H new ATOM 0 HG LEU A 68 -3.380 -8.646 -6.782 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -5.043 -8.575 -8.614 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -3.585 -7.623 -8.977 1.00 10.00 H new ATOM 0 HD13 LEU A 68 -3.816 -9.218 -9.731 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -4.946 -10.527 -7.174 1.00 10.00 H new ATOM 0 HD22 LEU A 68 -3.707 -11.329 -8.168 1.00 10.00 H new ATOM 0 HD23 LEU A 68 -3.417 -11.055 -6.433 1.00 10.00 H new ATOM 1063 N GLU A 69 0.662 -9.459 -10.373 1.00 10.00 N ATOM 1064 CA GLU A 69 1.306 -8.851 -11.532 1.00 10.00 C ATOM 1065 C GLU A 69 1.015 -9.613 -12.839 1.00 10.00 C ATOM 1066 O GLU A 69 0.788 -8.958 -13.857 1.00 10.00 O ATOM 1067 CB GLU A 69 2.816 -8.729 -11.286 1.00 10.00 C ATOM 1068 CG GLU A 69 3.282 -7.774 -10.173 1.00 10.00 C ATOM 1069 CD GLU A 69 2.565 -6.424 -10.117 1.00 10.00 C ATOM 1070 OE1 GLU A 69 1.393 -6.434 -9.672 1.00 10.00 O ATOM 1071 OE2 GLU A 69 3.218 -5.385 -10.370 1.00 10.00 O ATOM 0 H GLU A 69 1.310 -9.883 -9.709 1.00 10.00 H new ATOM 0 HA GLU A 69 0.883 -7.855 -11.660 1.00 10.00 H new ATOM 0 HB2 GLU A 69 3.201 -9.723 -11.058 1.00 10.00 H new ATOM 0 HB3 GLU A 69 3.284 -8.412 -12.218 1.00 10.00 H new ATOM 0 HG2 GLU A 69 3.153 -8.274 -9.213 1.00 10.00 H new ATOM 0 HG3 GLU A 69 4.350 -7.593 -10.298 1.00 10.00 H new ATOM 1078 N ASN A 70 0.927 -10.956 -12.823 1.00 10.00 N ATOM 1079 CA ASN A 70 0.438 -11.734 -13.969 1.00 10.00 C ATOM 1080 C ASN A 70 0.004 -13.165 -13.574 1.00 10.00 C ATOM 1081 O ASN A 70 0.825 -14.089 -13.530 1.00 10.00 O ATOM 1082 CB ASN A 70 1.478 -11.781 -15.101 1.00 10.00 C ATOM 1083 CG ASN A 70 0.810 -12.196 -16.406 1.00 10.00 C ATOM 1084 OD1 ASN A 70 0.086 -13.181 -16.488 1.00 10.00 O ATOM 1085 ND2 ASN A 70 1.013 -11.443 -17.468 1.00 10.00 N ATOM 0 H ASN A 70 1.192 -11.526 -12.020 1.00 10.00 H new ATOM 0 HA ASN A 70 -0.449 -11.215 -14.334 1.00 10.00 H new ATOM 0 HB2 ASN A 70 1.946 -10.803 -15.217 1.00 10.00 H new ATOM 0 HB3 ASN A 70 2.271 -12.485 -14.849 1.00 10.00 H new ATOM 0 HD21 ASN A 70 0.568 -11.681 -18.354 1.00 10.00 H new ATOM 0 HD22 ASN A 70 1.615 -10.622 -17.404 1.00 10.00 H new ATOM 1092 N PRO A 71 -1.302 -13.387 -13.326 1.00 10.00 N ATOM 1093 CA PRO A 71 -1.779 -14.606 -12.692 1.00 10.00 C ATOM 1094 C PRO A 71 -1.693 -15.797 -13.652 1.00 10.00 C ATOM 1095 O PRO A 71 -1.196 -16.854 -13.272 1.00 10.00 O ATOM 1096 CB PRO A 71 -3.197 -14.254 -12.217 1.00 10.00 C ATOM 1097 CG PRO A 71 -3.686 -13.206 -13.209 1.00 10.00 C ATOM 1098 CD PRO A 71 -2.396 -12.440 -13.491 1.00 10.00 C ATOM 0 HA PRO A 71 -1.174 -14.932 -11.846 1.00 10.00 H new ATOM 0 HB2 PRO A 71 -3.844 -15.131 -12.216 1.00 10.00 H new ATOM 0 HB3 PRO A 71 -3.189 -13.863 -11.200 1.00 10.00 H new ATOM 0 HG2 PRO A 71 -4.103 -13.655 -14.110 1.00 10.00 H new ATOM 0 HG3 PRO A 71 -4.460 -12.567 -12.784 1.00 10.00 H new ATOM 0 HD2 PRO A 71 -2.403 -12.029 -14.500 1.00 10.00 H new ATOM 0 HD3 PRO A 71 -2.287 -11.600 -12.805 1.00 10.00 H new ATOM 1106 N LYS A 72 -2.109 -15.597 -14.913 1.00 10.00 N ATOM 1107 CA LYS A 72 -2.119 -16.591 -15.984 1.00 10.00 C ATOM 1108 C LYS A 72 -0.729 -16.958 -16.519 1.00 10.00 C ATOM 1109 O LYS A 72 -0.577 -18.051 -17.058 1.00 10.00 O ATOM 1110 CB LYS A 72 -3.031 -16.098 -17.114 1.00 10.00 C ATOM 1111 CG LYS A 72 -4.517 -16.192 -16.730 1.00 10.00 C ATOM 1112 CD LYS A 72 -5.470 -15.930 -17.903 1.00 10.00 C ATOM 1113 CE LYS A 72 -5.480 -14.460 -18.332 1.00 10.00 C ATOM 1114 NZ LYS A 72 -6.418 -14.244 -19.459 1.00 10.00 N ATOM 0 H LYS A 72 -2.464 -14.692 -15.222 1.00 10.00 H new ATOM 0 HA LYS A 72 -2.505 -17.516 -15.556 1.00 10.00 H new ATOM 0 HB2 LYS A 72 -2.783 -15.065 -17.357 1.00 10.00 H new ATOM 0 HB3 LYS A 72 -2.849 -16.689 -18.012 1.00 10.00 H new ATOM 0 HG2 LYS A 72 -4.717 -17.184 -16.324 1.00 10.00 H new ATOM 0 HG3 LYS A 72 -4.725 -15.475 -15.936 1.00 10.00 H new ATOM 0 HD2 LYS A 72 -5.178 -16.551 -18.750 1.00 10.00 H new ATOM 0 HD3 LYS A 72 -6.479 -16.230 -17.621 1.00 10.00 H new ATOM 0 HE2 LYS A 72 -5.768 -13.833 -17.488 1.00 10.00 H new ATOM 0 HE3 LYS A 72 -4.475 -14.156 -18.626 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 -6.407 -13.241 -19.732 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 -6.127 -14.827 -20.270 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 -7.379 -14.513 -19.167 1.00 10.00 H new ATOM 1128 N LYS A 73 0.290 -16.091 -16.387 1.00 10.00 N ATOM 1129 CA LYS A 73 1.688 -16.511 -16.523 1.00 10.00 C ATOM 1130 C LYS A 73 2.194 -17.264 -15.293 1.00 10.00 C ATOM 1131 O LYS A 73 2.946 -18.218 -15.471 1.00 10.00 O ATOM 1132 CB LYS A 73 2.608 -15.323 -16.825 1.00 10.00 C ATOM 1133 CG LYS A 73 2.503 -14.880 -18.293 1.00 10.00 C ATOM 1134 CD LYS A 73 3.577 -13.853 -18.690 1.00 10.00 C ATOM 1135 CE LYS A 73 5.024 -14.360 -18.564 1.00 10.00 C ATOM 1136 NZ LYS A 73 5.279 -15.571 -19.382 1.00 10.00 N ATOM 0 H LYS A 73 0.168 -15.098 -16.187 1.00 10.00 H new ATOM 0 HA LYS A 73 1.715 -17.198 -17.369 1.00 10.00 H new ATOM 0 HB2 LYS A 73 2.349 -14.488 -16.174 1.00 10.00 H new ATOM 0 HB3 LYS A 73 3.639 -15.595 -16.600 1.00 10.00 H new ATOM 0 HG2 LYS A 73 2.589 -15.755 -18.938 1.00 10.00 H new ATOM 0 HG3 LYS A 73 1.516 -14.451 -18.468 1.00 10.00 H new ATOM 0 HD2 LYS A 73 3.402 -13.544 -19.721 1.00 10.00 H new ATOM 0 HD3 LYS A 73 3.461 -12.966 -18.067 1.00 10.00 H new ATOM 0 HE2 LYS A 73 5.710 -13.569 -18.869 1.00 10.00 H new ATOM 0 HE3 LYS A 73 5.238 -14.581 -17.518 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 6.276 -15.850 -19.287 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 4.669 -16.347 -19.053 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 5.070 -15.366 -20.380 1.00 10.00 H new ATOM 1150 N TYR A 74 1.832 -16.836 -14.076 1.00 10.00 N ATOM 1151 CA TYR A 74 2.343 -17.466 -12.860 1.00 10.00 C ATOM 1152 C TYR A 74 1.820 -18.901 -12.652 1.00 10.00 C ATOM 1153 O TYR A 74 2.612 -19.776 -12.310 1.00 10.00 O ATOM 1154 CB TYR A 74 2.118 -16.557 -11.647 1.00 10.00 C ATOM 1155 CG TYR A 74 2.829 -17.043 -10.393 1.00 10.00 C ATOM 1156 CD1 TYR A 74 4.210 -17.332 -10.428 1.00 10.00 C ATOM 1157 CD2 TYR A 74 2.120 -17.213 -9.192 1.00 10.00 C ATOM 1158 CE1 TYR A 74 4.871 -17.803 -9.281 1.00 10.00 C ATOM 1159 CE2 TYR A 74 2.778 -17.655 -8.032 1.00 10.00 C ATOM 1160 CZ TYR A 74 4.152 -17.964 -8.077 1.00 10.00 C ATOM 1161 OH TYR A 74 4.780 -18.424 -6.965 1.00 10.00 O ATOM 0 H TYR A 74 1.191 -16.060 -13.912 1.00 10.00 H new ATOM 0 HA TYR A 74 3.419 -17.586 -12.982 1.00 10.00 H new ATOM 0 HB2 TYR A 74 2.464 -15.551 -11.886 1.00 10.00 H new ATOM 0 HB3 TYR A 74 1.049 -16.488 -11.447 1.00 10.00 H new ATOM 0 HD1 TYR A 74 4.764 -17.190 -11.344 1.00 10.00 H new ATOM 0 HD2 TYR A 74 1.061 -17.002 -9.160 1.00 10.00 H new ATOM 0 HE1 TYR A 74 5.924 -18.041 -9.320 1.00 10.00 H new ATOM 0 HE2 TYR A 74 2.231 -17.758 -7.106 1.00 10.00 H new ATOM 0 HH TYR A 74 5.722 -18.154 -6.986 1.00 10.00 H new ATOM 1171 N ILE A 75 0.533 -19.166 -12.919 1.00 10.00 N ATOM 1172 CA ILE A 75 -0.039 -20.524 -12.982 1.00 10.00 C ATOM 1173 C ILE A 75 -1.064 -20.668 -14.134 1.00 10.00 C ATOM 1174 O ILE A 75 -1.605 -19.665 -14.597 1.00 10.00 O ATOM 1175 CB ILE A 75 -0.646 -20.960 -11.625 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -1.562 -19.919 -10.948 1.00 10.00 C ATOM 1177 CG2 ILE A 75 0.423 -21.554 -10.688 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -0.901 -18.997 -9.929 1.00 10.00 C ATOM 0 H ILE A 75 -0.153 -18.433 -13.100 1.00 10.00 H new ATOM 0 HA ILE A 75 0.787 -21.202 -13.199 1.00 10.00 H new ATOM 0 HB ILE A 75 -1.340 -21.765 -11.866 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -2.012 -19.302 -11.726 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -2.375 -20.450 -10.452 1.00 10.00 H new ATOM 0 HG21 ILE A 75 -0.041 -21.848 -9.747 1.00 10.00 H new ATOM 0 HG22 ILE A 75 0.874 -22.428 -11.158 1.00 10.00 H new ATOM 0 HG23 ILE A 75 1.193 -20.807 -10.495 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -1.644 -18.311 -9.523 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -0.477 -19.593 -9.121 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -0.108 -18.427 -10.414 1.00 10.00 H new ATOM 1190 N PRO A 76 -1.326 -21.898 -14.635 1.00 10.00 N ATOM 1191 CA PRO A 76 -2.157 -22.120 -15.823 1.00 10.00 C ATOM 1192 C PRO A 76 -3.677 -22.042 -15.574 1.00 10.00 C ATOM 1193 O PRO A 76 -4.168 -22.134 -14.452 1.00 10.00 O ATOM 1194 CB PRO A 76 -1.756 -23.514 -16.321 1.00 10.00 C ATOM 1195 CG PRO A 76 -1.391 -24.246 -15.031 1.00 10.00 C ATOM 1196 CD PRO A 76 -0.695 -23.152 -14.229 1.00 10.00 C ATOM 0 HA PRO A 76 -1.980 -21.326 -16.549 1.00 10.00 H new ATOM 0 HB2 PRO A 76 -2.574 -24.006 -16.847 1.00 10.00 H new ATOM 0 HB3 PRO A 76 -0.914 -23.469 -17.012 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -2.272 -24.630 -14.517 1.00 10.00 H new ATOM 0 HG3 PRO A 76 -0.734 -25.096 -15.216 1.00 10.00 H new ATOM 0 HD2 PRO A 76 -0.810 -23.319 -13.158 1.00 10.00 H new ATOM 0 HD3 PRO A 76 0.375 -23.136 -14.436 1.00 10.00 H new ATOM 1204 N GLY A 77 -4.441 -21.927 -16.668 1.00 10.00 N ATOM 1205 CA GLY A 77 -5.904 -21.830 -16.721 1.00 10.00 C ATOM 1206 C GLY A 77 -6.418 -20.542 -16.079 1.00 10.00 C ATOM 1207 O GLY A 77 -6.739 -19.582 -16.775 1.00 10.00 O ATOM 0 H GLY A 77 -4.026 -21.897 -17.599 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -6.232 -21.873 -17.759 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -6.343 -22.688 -16.212 1.00 10.00 H new ATOM 1211 N THR A 78 -6.436 -20.541 -14.745 1.00 10.00 N ATOM 1212 CA THR A 78 -6.560 -19.425 -13.797 1.00 10.00 C ATOM 1213 C THR A 78 -7.794 -18.534 -13.864 1.00 10.00 C ATOM 1214 O THR A 78 -8.297 -18.163 -12.810 1.00 10.00 O ATOM 1215 CB THR A 78 -5.237 -18.640 -13.775 1.00 10.00 C ATOM 1216 OG1 THR A 78 -4.348 -19.271 -12.894 1.00 10.00 O ATOM 1217 CG2 THR A 78 -5.312 -17.180 -13.347 1.00 10.00 C ATOM 0 H THR A 78 -6.355 -21.424 -14.242 1.00 10.00 H new ATOM 0 HA THR A 78 -6.751 -19.903 -12.836 1.00 10.00 H new ATOM 0 HB THR A 78 -4.917 -18.638 -14.817 1.00 10.00 H new ATOM 0 HG1 THR A 78 -4.505 -18.947 -11.983 1.00 10.00 H new ATOM 0 HG21 THR A 78 -4.315 -16.741 -13.374 1.00 10.00 H new ATOM 0 HG22 THR A 78 -5.967 -16.635 -14.027 1.00 10.00 H new ATOM 0 HG23 THR A 78 -5.708 -17.118 -12.334 1.00 10.00 H new ATOM 1225 N LYS A 79 -8.297 -18.163 -15.045 1.00 10.00 N ATOM 1226 CA LYS A 79 -9.537 -17.403 -15.271 1.00 10.00 C ATOM 1227 C LYS A 79 -9.686 -16.041 -14.564 1.00 10.00 C ATOM 1228 O LYS A 79 -10.655 -15.333 -14.836 1.00 10.00 O ATOM 1229 CB LYS A 79 -10.736 -18.334 -14.991 1.00 10.00 C ATOM 1230 CG LYS A 79 -10.906 -19.484 -16.004 1.00 10.00 C ATOM 1231 CD LYS A 79 -10.997 -19.047 -17.477 1.00 10.00 C ATOM 1232 CE LYS A 79 -12.087 -17.989 -17.706 1.00 10.00 C ATOM 1233 NZ LYS A 79 -12.010 -17.420 -19.069 1.00 10.00 N ATOM 0 H LYS A 79 -7.826 -18.396 -15.919 1.00 10.00 H new ATOM 0 HA LYS A 79 -9.496 -17.092 -16.315 1.00 10.00 H new ATOM 0 HB2 LYS A 79 -10.624 -18.759 -13.994 1.00 10.00 H new ATOM 0 HB3 LYS A 79 -11.648 -17.737 -14.982 1.00 10.00 H new ATOM 0 HG2 LYS A 79 -10.066 -20.170 -15.896 1.00 10.00 H new ATOM 0 HG3 LYS A 79 -11.808 -20.041 -15.750 1.00 10.00 H new ATOM 0 HD2 LYS A 79 -10.034 -18.648 -17.795 1.00 10.00 H new ATOM 0 HD3 LYS A 79 -11.203 -19.918 -18.100 1.00 10.00 H new ATOM 0 HE2 LYS A 79 -13.069 -18.437 -17.552 1.00 10.00 H new ATOM 0 HE3 LYS A 79 -11.982 -17.191 -16.971 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 -12.759 -16.709 -19.191 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 -11.082 -16.972 -19.206 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 -12.135 -18.179 -19.769 1.00 10.00 H new ATOM 1247 N MET A 80 -8.728 -15.625 -13.729 1.00 10.00 N ATOM 1248 CA MET A 80 -8.594 -14.279 -13.176 1.00 10.00 C ATOM 1249 C MET A 80 -8.314 -13.249 -14.286 1.00 10.00 C ATOM 1250 O MET A 80 -7.180 -12.825 -14.528 1.00 10.00 O ATOM 1251 CB MET A 80 -7.535 -14.280 -12.062 1.00 10.00 C ATOM 1252 CG MET A 80 -7.417 -12.883 -11.452 1.00 10.00 C ATOM 1253 SD MET A 80 -6.679 -12.804 -9.809 1.00 10.00 S ATOM 1254 CE MET A 80 -6.331 -11.035 -9.836 1.00 10.00 C ATOM 0 H MET A 80 -7.990 -16.251 -13.406 1.00 10.00 H new ATOM 0 HA MET A 80 -9.537 -13.973 -12.723 1.00 10.00 H new ATOM 0 HB2 MET A 80 -7.807 -15.001 -11.291 1.00 10.00 H new ATOM 0 HB3 MET A 80 -6.572 -14.593 -12.465 1.00 10.00 H new ATOM 0 HG2 MET A 80 -6.826 -12.262 -12.125 1.00 10.00 H new ATOM 0 HG3 MET A 80 -8.413 -12.443 -11.404 1.00 10.00 H new ATOM 0 HE1 MET A 80 -6.235 -10.667 -8.814 1.00 10.00 H new ATOM 0 HE2 MET A 80 -5.401 -10.855 -10.375 1.00 10.00 H new ATOM 0 HE3 MET A 80 -7.147 -10.511 -10.335 1.00 10.00 H new ATOM 1264 N ILE A 81 -9.383 -12.857 -14.981 1.00 10.00 N ATOM 1265 CA ILE A 81 -9.391 -11.866 -16.053 1.00 10.00 C ATOM 1266 C ILE A 81 -9.154 -10.446 -15.507 1.00 10.00 C ATOM 1267 O ILE A 81 -10.078 -9.653 -15.344 1.00 10.00 O ATOM 1268 CB ILE A 81 -10.659 -12.052 -16.929 1.00 10.00 C ATOM 1269 CG1 ILE A 81 -10.680 -11.134 -18.172 1.00 10.00 C ATOM 1270 CG2 ILE A 81 -12.005 -11.940 -16.195 1.00 10.00 C ATOM 1271 CD1 ILE A 81 -9.449 -11.263 -19.078 1.00 10.00 C ATOM 0 H ILE A 81 -10.310 -13.242 -14.801 1.00 10.00 H new ATOM 0 HA ILE A 81 -8.548 -12.025 -16.726 1.00 10.00 H new ATOM 0 HB ILE A 81 -10.563 -13.091 -17.243 1.00 10.00 H new ATOM 0 HG12 ILE A 81 -11.572 -11.357 -18.758 1.00 10.00 H new ATOM 0 HG13 ILE A 81 -10.766 -10.099 -17.842 1.00 10.00 H new ATOM 0 HG21 ILE A 81 -12.820 -12.087 -16.904 1.00 10.00 H new ATOM 0 HG22 ILE A 81 -12.060 -12.702 -15.417 1.00 10.00 H new ATOM 0 HG23 ILE A 81 -12.092 -10.952 -15.742 1.00 10.00 H new ATOM 0 HD11 ILE A 81 -9.548 -10.584 -19.925 1.00 10.00 H new ATOM 0 HD12 ILE A 81 -8.553 -11.010 -18.512 1.00 10.00 H new ATOM 0 HD13 ILE A 81 -9.371 -12.287 -19.442 1.00 10.00 H new ATOM 1283 N PHE A 82 -7.884 -10.118 -15.232 1.00 10.00 N ATOM 1284 CA PHE A 82 -7.507 -8.834 -14.632 1.00 10.00 C ATOM 1285 C PHE A 82 -6.021 -8.478 -14.823 1.00 10.00 C ATOM 1286 O PHE A 82 -5.751 -7.483 -15.484 1.00 10.00 O ATOM 1287 CB PHE A 82 -7.895 -8.822 -13.143 1.00 10.00 C ATOM 1288 CG PHE A 82 -7.920 -7.441 -12.530 1.00 10.00 C ATOM 1289 CD1 PHE A 82 -8.681 -6.406 -13.107 1.00 10.00 C ATOM 1290 CD2 PHE A 82 -7.181 -7.194 -11.366 1.00 10.00 C ATOM 1291 CE1 PHE A 82 -8.645 -5.113 -12.558 1.00 10.00 C ATOM 1292 CE2 PHE A 82 -7.147 -5.903 -10.816 1.00 10.00 C ATOM 1293 CZ PHE A 82 -7.862 -4.856 -11.419 1.00 10.00 C ATOM 0 H PHE A 82 -7.093 -10.734 -15.419 1.00 10.00 H new ATOM 0 HA PHE A 82 -8.062 -8.059 -15.161 1.00 10.00 H new ATOM 0 HB2 PHE A 82 -8.879 -9.277 -13.030 1.00 10.00 H new ATOM 0 HB3 PHE A 82 -7.191 -9.443 -12.589 1.00 10.00 H new ATOM 0 HD1 PHE A 82 -9.294 -6.607 -13.973 1.00 10.00 H new ATOM 0 HD2 PHE A 82 -6.637 -7.997 -10.891 1.00 10.00 H new ATOM 0 HE1 PHE A 82 -9.218 -4.317 -13.011 1.00 10.00 H new ATOM 0 HE2 PHE A 82 -6.568 -5.714 -9.924 1.00 10.00 H new ATOM 0 HZ PHE A 82 -7.811 -3.858 -11.010 1.00 10.00 H new ATOM 1303 N ALA A 83 -5.084 -9.297 -14.315 1.00 10.00 N ATOM 1304 CA ALA A 83 -3.625 -9.223 -14.526 1.00 10.00 C ATOM 1305 C ALA A 83 -2.969 -7.823 -14.411 1.00 10.00 C ATOM 1306 O ALA A 83 -2.821 -7.115 -15.407 1.00 10.00 O ATOM 1307 CB ALA A 83 -3.302 -9.908 -15.865 1.00 10.00 C ATOM 0 H ALA A 83 -5.339 -10.077 -13.709 1.00 10.00 H new ATOM 0 HA ALA A 83 -3.168 -9.747 -13.686 1.00 10.00 H new ATOM 0 HB1 ALA A 83 -2.228 -9.867 -16.045 1.00 10.00 H new ATOM 0 HB2 ALA A 83 -3.624 -10.949 -15.828 1.00 10.00 H new ATOM 0 HB3 ALA A 83 -3.825 -9.395 -16.672 1.00 10.00 H new ATOM 1313 N GLY A 84 -2.497 -7.457 -13.207 1.00 10.00 N ATOM 1314 CA GLY A 84 -1.851 -6.172 -12.928 1.00 10.00 C ATOM 1315 C GLY A 84 -2.855 -5.151 -12.390 1.00 10.00 C ATOM 1316 O GLY A 84 -3.667 -4.631 -13.148 1.00 10.00 O ATOM 0 H GLY A 84 -2.557 -8.061 -12.387 1.00 10.00 H new ATOM 0 HA2 GLY A 84 -1.050 -6.315 -12.202 1.00 10.00 H new ATOM 0 HA3 GLY A 84 -1.391 -5.788 -13.839 1.00 10.00 H new ATOM 1320 N ILE A 85 -2.815 -4.857 -11.079 1.00 10.00 N ATOM 1321 CA ILE A 85 -3.907 -4.145 -10.393 1.00 10.00 C ATOM 1322 C ILE A 85 -4.136 -2.721 -10.923 1.00 10.00 C ATOM 1323 O ILE A 85 -5.257 -2.406 -11.324 1.00 10.00 O ATOM 1324 CB ILE A 85 -3.741 -4.192 -8.850 1.00 10.00 C ATOM 1325 CG1 ILE A 85 -4.924 -3.462 -8.171 1.00 10.00 C ATOM 1326 CG2 ILE A 85 -2.392 -3.644 -8.334 1.00 10.00 C ATOM 1327 CD1 ILE A 85 -5.058 -3.757 -6.674 1.00 10.00 C ATOM 0 H ILE A 85 -2.034 -5.103 -10.471 1.00 10.00 H new ATOM 0 HA ILE A 85 -4.822 -4.686 -10.633 1.00 10.00 H new ATOM 0 HB ILE A 85 -3.743 -5.247 -8.578 1.00 10.00 H new ATOM 0 HG12 ILE A 85 -4.803 -2.388 -8.310 1.00 10.00 H new ATOM 0 HG13 ILE A 85 -5.849 -3.747 -8.672 1.00 10.00 H new ATOM 0 HG21 ILE A 85 -2.362 -3.715 -7.247 1.00 10.00 H new ATOM 0 HG22 ILE A 85 -1.576 -4.228 -8.758 1.00 10.00 H new ATOM 0 HG23 ILE A 85 -2.285 -2.601 -8.632 1.00 10.00 H new ATOM 0 HD11 ILE A 85 -5.909 -3.209 -6.270 1.00 10.00 H new ATOM 0 HD12 ILE A 85 -5.211 -4.826 -6.526 1.00 10.00 H new ATOM 0 HD13 ILE A 85 -4.149 -3.446 -6.159 1.00 10.00 H new ATOM 1339 N LYS A 86 -3.094 -1.880 -10.907 1.00 10.00 N ATOM 1340 CA LYS A 86 -3.055 -0.522 -11.474 1.00 10.00 C ATOM 1341 C LYS A 86 -1.620 -0.044 -11.655 1.00 10.00 C ATOM 1342 O LYS A 86 -1.170 0.159 -12.778 1.00 10.00 O ATOM 1343 CB LYS A 86 -3.811 0.495 -10.588 1.00 10.00 C ATOM 1344 CG LYS A 86 -5.319 0.554 -10.866 1.00 10.00 C ATOM 1345 CD LYS A 86 -5.901 1.929 -10.529 1.00 10.00 C ATOM 1346 CE LYS A 86 -7.349 1.972 -11.017 1.00 10.00 C ATOM 1347 NZ LYS A 86 -7.958 3.313 -10.886 1.00 10.00 N ATOM 0 H LYS A 86 -2.207 -2.141 -10.476 1.00 10.00 H new ATOM 0 HA LYS A 86 -3.548 -0.579 -12.444 1.00 10.00 H new ATOM 0 HB2 LYS A 86 -3.653 0.238 -9.540 1.00 10.00 H new ATOM 0 HB3 LYS A 86 -3.383 1.486 -10.741 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -5.505 0.327 -11.916 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -5.828 -0.211 -10.279 1.00 10.00 H new ATOM 0 HD2 LYS A 86 -5.857 2.106 -9.454 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -5.316 2.716 -11.006 1.00 10.00 H new ATOM 0 HE2 LYS A 86 -7.385 1.662 -12.061 1.00 10.00 H new ATOM 0 HE3 LYS A 86 -7.940 1.253 -10.450 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 -8.939 3.284 -11.231 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 -7.951 3.601 -9.887 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 -7.413 3.998 -11.448 1.00 10.00 H new ATOM 1361 N LYS A 87 -0.929 0.141 -10.530 1.00 10.00 N ATOM 1362 CA LYS A 87 0.309 0.902 -10.355 1.00 10.00 C ATOM 1363 C LYS A 87 0.956 0.454 -9.034 1.00 10.00 C ATOM 1364 O LYS A 87 0.380 -0.328 -8.269 1.00 10.00 O ATOM 1365 CB LYS A 87 -0.028 2.411 -10.296 1.00 10.00 C ATOM 1366 CG LYS A 87 -0.108 3.133 -11.649 1.00 10.00 C ATOM 1367 CD LYS A 87 -0.807 4.493 -11.464 1.00 10.00 C ATOM 1368 CE LYS A 87 -2.339 4.334 -11.407 1.00 10.00 C ATOM 1369 NZ LYS A 87 -2.961 4.983 -10.223 1.00 10.00 N ATOM 0 H LYS A 87 -1.244 -0.268 -9.650 1.00 10.00 H new ATOM 0 HA LYS A 87 0.994 0.727 -11.184 1.00 10.00 H new ATOM 0 HB2 LYS A 87 -0.983 2.531 -9.785 1.00 10.00 H new ATOM 0 HB3 LYS A 87 0.725 2.908 -9.685 1.00 10.00 H new ATOM 0 HG2 LYS A 87 0.893 3.279 -12.055 1.00 10.00 H new ATOM 0 HG3 LYS A 87 -0.658 2.524 -12.366 1.00 10.00 H new ATOM 0 HD2 LYS A 87 -0.454 4.963 -10.546 1.00 10.00 H new ATOM 0 HD3 LYS A 87 -0.539 5.157 -12.286 1.00 10.00 H new ATOM 0 HE2 LYS A 87 -2.774 4.757 -12.313 1.00 10.00 H new ATOM 0 HE3 LYS A 87 -2.586 3.272 -11.400 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 -3.990 5.047 -10.363 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 -2.761 4.418 -9.373 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 -2.568 5.938 -10.104 1.00 10.00 H new ATOM 1383 N LYS A 88 2.202 0.885 -8.803 1.00 10.00 N ATOM 1384 CA LYS A 88 3.050 0.332 -7.738 1.00 10.00 C ATOM 1385 C LYS A 88 2.706 0.776 -6.309 1.00 10.00 C ATOM 1386 O LYS A 88 3.185 0.139 -5.378 1.00 10.00 O ATOM 1387 CB LYS A 88 4.545 0.518 -8.071 1.00 10.00 C ATOM 1388 CG LYS A 88 5.303 -0.823 -8.115 1.00 10.00 C ATOM 1389 CD LYS A 88 4.882 -1.724 -9.290 1.00 10.00 C ATOM 1390 CE LYS A 88 5.744 -2.991 -9.323 1.00 10.00 C ATOM 1391 NZ LYS A 88 5.378 -3.878 -10.454 1.00 10.00 N ATOM 0 H LYS A 88 2.650 1.623 -9.346 1.00 10.00 H new ATOM 0 HA LYS A 88 2.822 -0.734 -7.725 1.00 10.00 H new ATOM 0 HB2 LYS A 88 4.641 1.020 -9.034 1.00 10.00 H new ATOM 0 HB3 LYS A 88 5.003 1.168 -7.326 1.00 10.00 H new ATOM 0 HG2 LYS A 88 6.373 -0.625 -8.183 1.00 10.00 H new ATOM 0 HG3 LYS A 88 5.137 -1.357 -7.179 1.00 10.00 H new ATOM 0 HD2 LYS A 88 3.830 -1.994 -9.192 1.00 10.00 H new ATOM 0 HD3 LYS A 88 4.986 -1.181 -10.229 1.00 10.00 H new ATOM 0 HE2 LYS A 88 6.795 -2.713 -9.404 1.00 10.00 H new ATOM 0 HE3 LYS A 88 5.629 -3.533 -8.384 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 6.037 -4.681 -10.493 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 4.409 -4.231 -10.319 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 5.430 -3.344 -11.345 1.00 10.00 H new ATOM 1405 N THR A 89 1.846 1.781 -6.111 1.00 10.00 N ATOM 1406 CA THR A 89 1.301 2.111 -4.781 1.00 10.00 C ATOM 1407 C THR A 89 0.232 1.084 -4.400 1.00 10.00 C ATOM 1408 O THR A 89 0.373 0.367 -3.413 1.00 10.00 O ATOM 1409 CB THR A 89 0.720 3.536 -4.746 1.00 10.00 C ATOM 1410 OG1 THR A 89 1.596 4.441 -5.381 1.00 10.00 O ATOM 1411 CG2 THR A 89 0.533 4.034 -3.312 1.00 10.00 C ATOM 0 H THR A 89 1.508 2.387 -6.859 1.00 10.00 H new ATOM 0 HA THR A 89 2.114 2.075 -4.056 1.00 10.00 H new ATOM 0 HB THR A 89 -0.242 3.490 -5.256 1.00 10.00 H new ATOM 0 HG1 THR A 89 1.212 5.342 -5.352 1.00 10.00 H new ATOM 0 HG21 THR A 89 0.121 5.043 -3.328 1.00 10.00 H new ATOM 0 HG22 THR A 89 -0.152 3.371 -2.783 1.00 10.00 H new ATOM 0 HG23 THR A 89 1.496 4.043 -2.802 1.00 10.00 H new ATOM 1419 N GLU A 90 -0.784 0.933 -5.253 1.00 10.00 N ATOM 1420 CA GLU A 90 -1.902 -0.002 -5.128 1.00 10.00 C ATOM 1421 C GLU A 90 -1.405 -1.446 -4.929 1.00 10.00 C ATOM 1422 O GLU A 90 -1.968 -2.205 -4.137 1.00 10.00 O ATOM 1423 CB GLU A 90 -2.802 0.102 -6.377 1.00 10.00 C ATOM 1424 CG GLU A 90 -3.409 1.498 -6.625 1.00 10.00 C ATOM 1425 CD GLU A 90 -2.568 2.411 -7.531 1.00 10.00 C ATOM 1426 OE1 GLU A 90 -1.327 2.459 -7.376 1.00 10.00 O ATOM 1427 OE2 GLU A 90 -3.178 3.070 -8.406 1.00 10.00 O ATOM 0 H GLU A 90 -0.851 1.496 -6.101 1.00 10.00 H new ATOM 0 HA GLU A 90 -2.483 0.264 -4.245 1.00 10.00 H new ATOM 0 HB2 GLU A 90 -2.219 -0.185 -7.252 1.00 10.00 H new ATOM 0 HB3 GLU A 90 -3.613 -0.620 -6.283 1.00 10.00 H new ATOM 0 HG2 GLU A 90 -4.396 1.376 -7.071 1.00 10.00 H new ATOM 0 HG3 GLU A 90 -3.552 1.993 -5.665 1.00 10.00 H new ATOM 1434 N ARG A 91 -0.299 -1.788 -5.608 1.00 10.00 N ATOM 1435 CA ARG A 91 0.476 -3.025 -5.461 1.00 10.00 C ATOM 1436 C ARG A 91 0.919 -3.320 -4.028 1.00 10.00 C ATOM 1437 O ARG A 91 0.815 -4.475 -3.612 1.00 10.00 O ATOM 1438 CB ARG A 91 1.701 -2.924 -6.382 1.00 10.00 C ATOM 1439 CG ARG A 91 2.725 -4.065 -6.303 1.00 10.00 C ATOM 1440 CD ARG A 91 2.189 -5.369 -6.882 1.00 10.00 C ATOM 1441 NE ARG A 91 1.295 -6.107 -5.970 1.00 10.00 N ATOM 1442 CZ ARG A 91 0.892 -7.344 -6.235 1.00 10.00 C ATOM 1443 NH1 ARG A 91 1.040 -7.868 -7.429 1.00 10.00 N ATOM 1444 NH2 ARG A 91 0.381 -8.097 -5.295 1.00 10.00 N ATOM 0 H ARG A 91 0.100 -1.171 -6.315 1.00 10.00 H new ATOM 0 HA ARG A 91 -0.173 -3.856 -5.737 1.00 10.00 H new ATOM 0 HB2 ARG A 91 1.347 -2.856 -7.411 1.00 10.00 H new ATOM 0 HB3 ARG A 91 2.216 -1.990 -6.160 1.00 10.00 H new ATOM 0 HG2 ARG A 91 3.628 -3.776 -6.840 1.00 10.00 H new ATOM 0 HG3 ARG A 91 3.010 -4.223 -5.263 1.00 10.00 H new ATOM 0 HD2 ARG A 91 1.651 -5.151 -7.804 1.00 10.00 H new ATOM 0 HD3 ARG A 91 3.030 -6.010 -7.147 1.00 10.00 H new ATOM 0 HE ARG A 91 0.978 -5.655 -5.113 1.00 10.00 H new ATOM 0 HH11 ARG A 91 1.472 -7.323 -8.175 1.00 10.00 H new ATOM 0 HH12 ARG A 91 0.723 -8.820 -7.611 1.00 10.00 H new ATOM 0 HH21 ARG A 91 0.288 -7.735 -4.346 1.00 10.00 H new ATOM 0 HH22 ARG A 91 0.075 -9.046 -5.511 1.00 10.00 H new ATOM 1458 N GLU A 92 1.452 -2.321 -3.319 1.00 10.00 N ATOM 1459 CA GLU A 92 1.801 -2.416 -1.897 1.00 10.00 C ATOM 1460 C GLU A 92 0.542 -2.413 -1.034 1.00 10.00 C ATOM 1461 O GLU A 92 0.445 -3.195 -0.096 1.00 10.00 O ATOM 1462 CB GLU A 92 2.624 -1.208 -1.431 1.00 10.00 C ATOM 1463 CG GLU A 92 3.980 -0.965 -2.093 1.00 10.00 C ATOM 1464 CD GLU A 92 4.629 0.336 -1.583 1.00 10.00 C ATOM 1465 OE1 GLU A 92 3.937 1.125 -0.886 1.00 10.00 O ATOM 1466 OE2 GLU A 92 5.826 0.524 -1.886 1.00 10.00 O ATOM 0 H GLU A 92 1.657 -1.407 -3.723 1.00 10.00 H new ATOM 0 HA GLU A 92 2.370 -3.339 -1.789 1.00 10.00 H new ATOM 0 HB2 GLU A 92 2.017 -0.314 -1.576 1.00 10.00 H new ATOM 0 HB3 GLU A 92 2.790 -1.310 -0.359 1.00 10.00 H new ATOM 0 HG2 GLU A 92 4.642 -1.807 -1.891 1.00 10.00 H new ATOM 0 HG3 GLU A 92 3.854 -0.911 -3.174 1.00 10.00 H new ATOM 1473 N ASP A 93 -0.399 -1.510 -1.335 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.569 -1.219 -0.510 1.00 10.00 C ATOM 1475 C ASP A 93 -2.398 -2.479 -0.257 1.00 10.00 C ATOM 1476 O ASP A 93 -2.716 -2.817 0.884 1.00 10.00 O ATOM 1477 CB ASP A 93 -2.415 -0.139 -1.202 1.00 10.00 C ATOM 1478 CG ASP A 93 -1.751 1.236 -1.298 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -0.790 1.484 -0.529 1.00 10.00 O ATOM 1480 OD2 ASP A 93 -2.235 2.040 -2.124 1.00 10.00 O ATOM 0 H ASP A 93 -0.363 -0.947 -2.185 1.00 10.00 H new ATOM 0 HA ASP A 93 -1.236 -0.853 0.461 1.00 10.00 H new ATOM 0 HB2 ASP A 93 -2.660 -0.479 -2.208 1.00 10.00 H new ATOM 0 HB3 ASP A 93 -3.357 -0.035 -0.663 1.00 10.00 H new ATOM 1485 N LEU A 94 -2.692 -3.209 -1.333 1.00 10.00 N ATOM 1486 CA LEU A 94 -3.366 -4.498 -1.298 1.00 10.00 C ATOM 1487 C LEU A 94 -2.623 -5.529 -0.429 1.00 10.00 C ATOM 1488 O LEU A 94 -3.247 -6.175 0.417 1.00 10.00 O ATOM 1489 CB LEU A 94 -3.473 -4.955 -2.763 1.00 10.00 C ATOM 1490 CG LEU A 94 -4.023 -6.378 -2.926 1.00 10.00 C ATOM 1491 CD1 LEU A 94 -5.519 -6.421 -2.624 1.00 10.00 C ATOM 1492 CD2 LEU A 94 -3.730 -6.890 -4.337 1.00 10.00 C ATOM 0 H LEU A 94 -2.459 -2.907 -2.279 1.00 10.00 H new ATOM 0 HA LEU A 94 -4.349 -4.407 -0.836 1.00 10.00 H new ATOM 0 HB2 LEU A 94 -4.117 -4.262 -3.305 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -2.487 -4.901 -3.224 1.00 10.00 H new ATOM 0 HG LEU A 94 -3.525 -7.032 -2.210 1.00 10.00 H new ATOM 0 HD11 LEU A 94 -5.886 -7.440 -2.746 1.00 10.00 H new ATOM 0 HD12 LEU A 94 -5.693 -6.093 -1.599 1.00 10.00 H new ATOM 0 HD13 LEU A 94 -6.048 -5.760 -3.311 1.00 10.00 H new ATOM 0 HD21 LEU A 94 -4.123 -7.901 -4.446 1.00 10.00 H new ATOM 0 HD22 LEU A 94 -4.205 -6.235 -5.068 1.00 10.00 H new ATOM 0 HD23 LEU A 94 -2.653 -6.900 -4.504 1.00 10.00 H new ATOM 1504 N ILE A 95 -1.312 -5.697 -0.651 1.00 10.00 N ATOM 1505 CA ILE A 95 -0.455 -6.607 0.119 1.00 10.00 C ATOM 1506 C ILE A 95 -0.503 -6.230 1.606 1.00 10.00 C ATOM 1507 O ILE A 95 -0.721 -7.096 2.452 1.00 10.00 O ATOM 1508 CB ILE A 95 0.983 -6.620 -0.454 1.00 10.00 C ATOM 1509 CG1 ILE A 95 1.050 -7.287 -1.851 1.00 10.00 C ATOM 1510 CG2 ILE A 95 1.985 -7.288 0.505 1.00 10.00 C ATOM 1511 CD1 ILE A 95 0.703 -8.782 -1.907 1.00 10.00 C ATOM 0 H ILE A 95 -0.810 -5.195 -1.383 1.00 10.00 H new ATOM 0 HA ILE A 95 -0.829 -7.627 0.031 1.00 10.00 H new ATOM 0 HB ILE A 95 1.270 -5.574 -0.566 1.00 10.00 H new ATOM 0 HG12 ILE A 95 0.373 -6.753 -2.518 1.00 10.00 H new ATOM 0 HG13 ILE A 95 2.057 -7.154 -2.246 1.00 10.00 H new ATOM 0 HG21 ILE A 95 2.980 -7.273 0.060 1.00 10.00 H new ATOM 0 HG22 ILE A 95 2.002 -6.745 1.450 1.00 10.00 H new ATOM 0 HG23 ILE A 95 1.683 -8.320 0.685 1.00 10.00 H new ATOM 0 HD11 ILE A 95 0.785 -9.136 -2.935 1.00 10.00 H new ATOM 0 HD12 ILE A 95 1.394 -9.340 -1.275 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -0.316 -8.932 -1.551 1.00 10.00 H new ATOM 1523 N ALA A 96 -0.357 -4.937 1.920 1.00 10.00 N ATOM 1524 CA ALA A 96 -0.424 -4.401 3.276 1.00 10.00 C ATOM 1525 C ALA A 96 -1.774 -4.695 3.940 1.00 10.00 C ATOM 1526 O ALA A 96 -1.802 -5.203 5.063 1.00 10.00 O ATOM 1527 CB ALA A 96 -0.104 -2.899 3.247 1.00 10.00 C ATOM 0 H ALA A 96 -0.185 -4.219 1.216 1.00 10.00 H new ATOM 0 HA ALA A 96 0.324 -4.901 3.891 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -0.154 -2.497 4.259 1.00 10.00 H new ATOM 0 HB2 ALA A 96 0.898 -2.748 2.845 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -0.829 -2.385 2.616 1.00 10.00 H new ATOM 1533 N TYR A 97 -2.881 -4.443 3.229 1.00 10.00 N ATOM 1534 CA TYR A 97 -4.221 -4.809 3.689 1.00 10.00 C ATOM 1535 C TYR A 97 -4.335 -6.306 3.999 1.00 10.00 C ATOM 1536 O TYR A 97 -4.691 -6.649 5.122 1.00 10.00 O ATOM 1537 CB TYR A 97 -5.272 -4.333 2.678 1.00 10.00 C ATOM 1538 CG TYR A 97 -6.549 -5.154 2.594 1.00 10.00 C ATOM 1539 CD1 TYR A 97 -7.337 -5.423 3.735 1.00 10.00 C ATOM 1540 CD2 TYR A 97 -6.933 -5.673 1.345 1.00 10.00 C ATOM 1541 CE1 TYR A 97 -8.519 -6.185 3.614 1.00 10.00 C ATOM 1542 CE2 TYR A 97 -8.090 -6.459 1.230 1.00 10.00 C ATOM 1543 CZ TYR A 97 -8.895 -6.706 2.358 1.00 10.00 C ATOM 1544 OH TYR A 97 -10.027 -7.446 2.224 1.00 10.00 O ATOM 0 H TYR A 97 -2.870 -3.980 2.320 1.00 10.00 H new ATOM 0 HA TYR A 97 -4.412 -4.299 4.633 1.00 10.00 H new ATOM 0 HB2 TYR A 97 -5.542 -3.306 2.923 1.00 10.00 H new ATOM 0 HB3 TYR A 97 -4.812 -4.314 1.690 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -7.035 -5.045 4.701 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -6.335 -5.466 0.470 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -9.135 -6.369 4.482 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -8.364 -6.876 0.272 1.00 10.00 H new ATOM 0 HH TYR A 97 -10.129 -7.721 1.289 1.00 10.00 H new ATOM 1554 N LEU A 98 -4.041 -7.196 3.043 1.00 10.00 N ATOM 1555 CA LEU A 98 -4.245 -8.629 3.255 1.00 10.00 C ATOM 1556 C LEU A 98 -3.286 -9.211 4.313 1.00 10.00 C ATOM 1557 O LEU A 98 -3.692 -10.074 5.096 1.00 10.00 O ATOM 1558 CB LEU A 98 -4.198 -9.375 1.911 1.00 10.00 C ATOM 1559 CG LEU A 98 -5.378 -9.029 0.978 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -5.113 -9.533 -0.442 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -6.695 -9.643 1.464 1.00 10.00 C ATOM 0 H LEU A 98 -3.666 -6.951 2.127 1.00 10.00 H new ATOM 0 HA LEU A 98 -5.241 -8.776 3.673 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -3.262 -9.138 1.405 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -4.196 -10.449 2.099 1.00 10.00 H new ATOM 0 HG LEU A 98 -5.467 -7.943 0.985 1.00 10.00 H new ATOM 0 HD11 LEU A 98 -5.958 -9.278 -1.082 1.00 10.00 H new ATOM 0 HD12 LEU A 98 -4.209 -9.065 -0.831 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -4.984 -10.615 -0.426 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -7.497 -9.373 0.777 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -6.599 -10.728 1.501 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -6.927 -9.265 2.460 1.00 10.00 H new ATOM 1573 N LYS A 99 -2.046 -8.696 4.419 1.00 10.00 N ATOM 1574 CA LYS A 99 -1.097 -9.103 5.471 1.00 10.00 C ATOM 1575 C LYS A 99 -1.464 -8.611 6.883 1.00 10.00 C ATOM 1576 O LYS A 99 -1.096 -9.254 7.871 1.00 10.00 O ATOM 1577 CB LYS A 99 0.327 -8.697 5.047 1.00 10.00 C ATOM 1578 CG LYS A 99 1.467 -9.316 5.883 1.00 10.00 C ATOM 1579 CD LYS A 99 1.396 -10.851 5.925 1.00 10.00 C ATOM 1580 CE LYS A 99 2.605 -11.517 6.592 1.00 10.00 C ATOM 1581 NZ LYS A 99 3.753 -11.693 5.671 1.00 10.00 N ATOM 0 H LYS A 99 -1.676 -7.991 3.782 1.00 10.00 H new ATOM 0 HA LYS A 99 -1.150 -10.188 5.562 1.00 10.00 H new ATOM 0 HB2 LYS A 99 0.471 -8.977 4.003 1.00 10.00 H new ATOM 0 HB3 LYS A 99 0.408 -7.611 5.100 1.00 10.00 H new ATOM 0 HG2 LYS A 99 2.427 -9.011 5.466 1.00 10.00 H new ATOM 0 HG3 LYS A 99 1.422 -8.925 6.899 1.00 10.00 H new ATOM 0 HD2 LYS A 99 0.492 -11.147 6.457 1.00 10.00 H new ATOM 0 HD3 LYS A 99 1.304 -11.227 4.906 1.00 10.00 H new ATOM 0 HE2 LYS A 99 2.920 -10.915 7.444 1.00 10.00 H new ATOM 0 HE3 LYS A 99 2.307 -12.490 6.982 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 4.556 -12.101 6.191 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 3.482 -12.332 4.896 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 4.028 -10.770 5.278 1.00 10.00 H new ATOM 1595 N LYS A 100 -2.246 -7.531 6.988 1.00 10.00 N ATOM 1596 CA LYS A 100 -3.018 -7.207 8.196 1.00 10.00 C ATOM 1597 C LYS A 100 -4.218 -8.144 8.342 1.00 10.00 C ATOM 1598 O LYS A 100 -4.246 -8.883 9.314 1.00 10.00 O ATOM 1599 CB LYS A 100 -3.435 -5.726 8.228 1.00 10.00 C ATOM 1600 CG LYS A 100 -2.269 -4.770 8.536 1.00 10.00 C ATOM 1601 CD LYS A 100 -1.630 -5.002 9.917 1.00 10.00 C ATOM 1602 CE LYS A 100 -0.278 -5.717 9.813 1.00 10.00 C ATOM 1603 NZ LYS A 100 0.193 -6.149 11.146 1.00 10.00 N ATOM 0 H LYS A 100 -2.363 -6.853 6.235 1.00 10.00 H new ATOM 0 HA LYS A 100 -2.370 -7.365 9.058 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -3.871 -5.458 7.265 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -4.214 -5.591 8.979 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -1.504 -4.884 7.768 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -2.628 -3.742 8.479 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -1.496 -4.044 10.419 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -2.306 -5.594 10.534 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -0.369 -6.583 9.157 1.00 10.00 H new ATOM 0 HE3 LYS A 100 0.457 -5.051 9.361 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 1.231 -6.102 11.179 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -0.205 -5.523 11.875 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -0.115 -7.126 11.323 1.00 10.00 H new ATOM 1617 N ALA A 101 -5.143 -8.199 7.383 1.00 10.00 N ATOM 1618 CA ALA A 101 -6.436 -8.890 7.512 1.00 10.00 C ATOM 1619 C ALA A 101 -6.360 -10.390 7.871 1.00 10.00 C ATOM 1620 O ALA A 101 -7.303 -10.939 8.435 1.00 10.00 O ATOM 1621 CB ALA A 101 -7.232 -8.677 6.219 1.00 10.00 C ATOM 0 H ALA A 101 -5.016 -7.756 6.473 1.00 10.00 H new ATOM 0 HA ALA A 101 -6.938 -8.444 8.370 1.00 10.00 H new ATOM 0 HB1 ALA A 101 -8.194 -9.183 6.297 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -7.394 -7.610 6.063 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -6.674 -9.086 5.377 1.00 10.00 H new ATOM 1627 N THR A 102 -5.231 -11.053 7.594 1.00 10.00 N ATOM 1628 CA THR A 102 -4.908 -12.418 8.053 1.00 10.00 C ATOM 1629 C THR A 102 -4.472 -12.513 9.539 1.00 10.00 C ATOM 1630 O THR A 102 -4.150 -13.596 10.021 1.00 10.00 O ATOM 1631 CB THR A 102 -3.874 -13.022 7.089 1.00 10.00 C ATOM 1632 OG1 THR A 102 -3.909 -14.431 7.113 1.00 10.00 O ATOM 1633 CG2 THR A 102 -2.451 -12.553 7.362 1.00 10.00 C ATOM 0 H THR A 102 -4.489 -10.644 7.025 1.00 10.00 H new ATOM 0 HA THR A 102 -5.826 -13.006 8.028 1.00 10.00 H new ATOM 0 HB THR A 102 -4.159 -12.663 6.100 1.00 10.00 H new ATOM 0 HG1 THR A 102 -3.141 -14.786 6.619 1.00 10.00 H new ATOM 0 HG21 THR A 102 -1.772 -13.016 6.647 1.00 10.00 H new ATOM 0 HG22 THR A 102 -2.400 -11.469 7.261 1.00 10.00 H new ATOM 0 HG23 THR A 102 -2.162 -12.838 8.374 1.00 10.00 H new ATOM 1641 N ASN A 103 -4.505 -11.404 10.291 1.00 10.00 N ATOM 1642 CA ASN A 103 -3.958 -11.230 11.648 1.00 10.00 C ATOM 1643 C ASN A 103 -4.738 -10.187 12.483 1.00 10.00 C ATOM 1644 O ASN A 103 -4.847 -10.364 13.695 1.00 10.00 O ATOM 1645 CB ASN A 103 -2.506 -10.705 11.561 1.00 10.00 C ATOM 1646 CG ASN A 103 -1.496 -11.651 10.937 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -1.201 -12.716 11.456 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -0.868 -11.275 9.840 1.00 10.00 N ATOM 0 H ASN A 103 -4.942 -10.549 9.948 1.00 10.00 H new ATOM 0 HA ASN A 103 -4.027 -12.207 12.126 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -2.509 -9.778 10.988 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -2.169 -10.457 12.567 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -0.146 -11.871 9.436 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -1.104 -10.388 9.396 1.00 10.00 H new ATOM 1655 N GLU A 104 -5.286 -9.133 11.858 1.00 10.00 N ATOM 1656 CA GLU A 104 -5.644 -7.827 12.442 1.00 10.00 C ATOM 1657 C GLU A 104 -6.647 -7.099 11.535 1.00 10.00 C ATOM 1658 O GLU A 104 -7.685 -6.665 12.081 1.00 10.00 O ATOM 1659 CB GLU A 104 -4.384 -6.936 12.508 1.00 10.00 C ATOM 1660 CG GLU A 104 -3.345 -7.268 13.593 1.00 10.00 C ATOM 1661 CD GLU A 104 -1.936 -6.944 13.085 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -1.493 -5.771 13.157 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -1.285 -7.841 12.497 1.00 10.00 O ATOM 1664 OXT GLU A 104 -6.360 -6.977 10.319 1.00 10.00 O ATOM 0 H GLU A 104 -5.507 -9.172 10.863 1.00 10.00 H new ATOM 0 HA GLU A 104 -6.069 -8.000 13.431 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -3.887 -6.981 11.539 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -4.706 -5.905 12.653 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -3.555 -6.696 14.497 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -3.411 -8.323 13.861 1.00 10.00 H new TER 1671 GLU A 104 HETATM 1672 FE HEC A 105 -8.535 -13.180 -7.894 1.00 10.00 FE HETATM 1673 CHA HEC A 105 -7.742 -16.423 -7.001 1.00 10.00 C HETATM 1674 CHB HEC A 105 -6.697 -12.066 -5.290 1.00 10.00 C HETATM 1675 CHC HEC A 105 -9.439 -10.037 -8.686 1.00 10.00 C HETATM 1676 CHD HEC A 105 -10.712 -14.441 -10.190 1.00 10.00 C HETATM 1677 NA HEC A 105 -7.441 -14.061 -6.464 1.00 10.00 N HETATM 1678 C1A HEC A 105 -7.234 -15.406 -6.226 1.00 10.00 C HETATM 1679 C2A HEC A 105 -6.401 -15.622 -5.062 1.00 10.00 C HETATM 1680 C3A HEC A 105 -6.075 -14.397 -4.592 1.00 10.00 C HETATM 1681 C4A HEC A 105 -6.749 -13.434 -5.454 1.00 10.00 C HETATM 1682 CMA HEC A 105 -5.166 -14.112 -3.418 1.00 10.00 C HETATM 1683 CAA HEC A 105 -5.937 -16.956 -4.516 1.00 10.00 C HETATM 1684 CBA HEC A 105 -7.013 -17.805 -3.816 1.00 10.00 C HETATM 1685 CGA HEC A 105 -6.474 -19.005 -3.031 1.00 10.00 C HETATM 1686 O1A HEC A 105 -6.023 -19.971 -3.686 1.00 10.00 O HETATM 1687 O2A HEC A 105 -6.472 -18.932 -1.784 1.00 10.00 O HETATM 1688 NB HEC A 105 -8.140 -11.418 -7.159 1.00 10.00 N HETATM 1689 C1B HEC A 105 -7.365 -11.138 -6.065 1.00 10.00 C HETATM 1690 C2B HEC A 105 -7.310 -9.716 -5.820 1.00 10.00 C HETATM 1691 C3B HEC A 105 -8.096 -9.120 -6.756 1.00 10.00 C HETATM 1692 C4B HEC A 105 -8.596 -10.195 -7.602 1.00 10.00 C HETATM 1693 CMB HEC A 105 -6.508 -9.084 -4.709 1.00 10.00 C HETATM 1694 CAB HEC A 105 -8.381 -7.637 -6.914 1.00 10.00 C HETATM 1695 CBB HEC A 105 -7.194 -6.896 -7.525 1.00 10.00 C HETATM 1696 NC HEC A 105 -9.864 -12.414 -9.088 1.00 10.00 N HETATM 1697 C1C HEC A 105 -10.055 -11.077 -9.358 1.00 10.00 C HETATM 1698 C2C HEC A 105 -11.102 -10.889 -10.345 1.00 10.00 C HETATM 1699 C3C HEC A 105 -11.603 -12.128 -10.601 1.00 10.00 C HETATM 1700 C4C HEC A 105 -10.722 -13.076 -9.941 1.00 10.00 C HETATM 1701 CMC HEC A 105 -11.614 -9.539 -10.810 1.00 10.00 C HETATM 1702 CAC HEC A 105 -12.880 -12.491 -11.329 1.00 10.00 C HETATM 1703 CBC HEC A 105 -12.766 -12.350 -12.853 1.00 10.00 C HETATM 1704 ND HEC A 105 -9.058 -15.043 -8.513 1.00 10.00 N HETATM 1705 C1D HEC A 105 -9.925 -15.366 -9.529 1.00 10.00 C HETATM 1706 C2D HEC A 105 -9.892 -16.799 -9.825 1.00 10.00 C HETATM 1707 C3D HEC A 105 -9.015 -17.360 -8.946 1.00 10.00 C HETATM 1708 C4D HEC A 105 -8.555 -16.262 -8.105 1.00 10.00 C HETATM 1709 CMD HEC A 105 -10.698 -17.486 -10.910 1.00 10.00 C HETATM 1710 CAD HEC A 105 -8.598 -18.824 -8.783 1.00 10.00 C HETATM 1711 CBD HEC A 105 -7.057 -19.059 -8.840 1.00 10.00 C HETATM 1712 CGD HEC A 105 -6.481 -19.600 -10.135 1.00 10.00 C HETATM 1713 O1D HEC A 105 -7.011 -20.628 -10.597 1.00 10.00 O HETATM 1714 O2D HEC A 105 -5.433 -19.092 -10.579 1.00 10.00 O HETATM 0 HMD3 HEC A 105 -11.761 -17.334 -10.725 1.00 10.00 H new HETATM 0 HMD2 HEC A 105 -10.435 -17.065 -11.880 1.00 10.00 H new HETATM 0 HMD1 HEC A 105 -10.478 -18.554 -10.906 1.00 10.00 H new HETATM 0 HMC3 HEC A 105 -12.017 -8.990 -9.959 1.00 10.00 H new HETATM 0 HMC2 HEC A 105 -10.795 -8.972 -11.252 1.00 10.00 H new HETATM 0 HMC1 HEC A 105 -12.398 -9.684 -11.553 1.00 10.00 H new HETATM 0 HMB3 HEC A 105 -6.856 -9.463 -3.748 1.00 10.00 H new HETATM 0 HMB2 HEC A 105 -5.454 -9.330 -4.836 1.00 10.00 H new HETATM 0 HMB1 HEC A 105 -6.634 -8.002 -4.739 1.00 10.00 H new HETATM 0 HMA3 HEC A 105 -5.577 -14.572 -2.519 1.00 10.00 H new HETATM 0 HMA2 HEC A 105 -4.176 -14.524 -3.616 1.00 10.00 H new HETATM 0 HMA1 HEC A 105 -5.088 -13.035 -3.271 1.00 10.00 H new HETATM 0 HBD2 HEC A 105 -6.564 -18.112 -8.621 1.00 10.00 H new HETATM 0 HBD1 HEC A 105 -6.792 -19.749 -8.039 1.00 10.00 H new HETATM 0 HBC3 HEC A 105 -12.525 -11.318 -13.106 1.00 10.00 H new HETATM 0 HBC2 HEC A 105 -11.978 -13.007 -13.221 1.00 10.00 H new HETATM 0 HBC1 HEC A 105 -13.714 -12.625 -13.316 1.00 10.00 H new HETATM 0 HBB3 HEC A 105 -6.322 -7.011 -6.880 1.00 10.00 H new HETATM 0 HBB2 HEC A 105 -6.974 -7.310 -8.509 1.00 10.00 H new HETATM 0 HBB1 HEC A 105 -7.437 -5.838 -7.622 1.00 10.00 H new HETATM 0 HBA2 HEC A 105 -7.574 -17.165 -3.135 1.00 10.00 H new HETATM 0 HBA1 HEC A 105 -7.716 -18.166 -4.567 1.00 10.00 H new HETATM 0 HAD2 HEC A 105 -8.976 -19.194 -7.830 1.00 10.00 H new HETATM 0 HAD1 HEC A 105 -9.074 -19.415 -9.566 1.00 10.00 H new HETATM 0 HAA2 HEC A 105 -5.520 -17.538 -5.338 1.00 10.00 H new HETATM 0 HAA1 HEC A 105 -5.127 -16.776 -3.809 1.00 10.00 H new HETATM 0 HHD HEC A 105 -11.377 -14.814 -10.969 1.00 10.00 H new HETATM 0 HHC HEC A 105 -9.632 -9.023 -9.035 1.00 10.00 H new HETATM 0 HHB HEC A 105 -6.076 -11.684 -4.480 1.00 10.00 H new HETATM 0 HHA HEC A 105 -7.480 -17.443 -6.719 1.00 10.00 H new HETATM 0 H2A HEC A 105 -6.296 -19.818 -1.405 1.00 10.00 H new