USER MOD reduce.3.24.130724 H: found=0, std=0, add=1091, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1089 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 100 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 104 MET CE :methyl 180:sc= -1.23 (180deg=-1.23) USER MOD Set 2.1: A 55 GLN : amide:sc= 0.0167 K(o=0.04,f=-3.2!) USER MOD Set 2.2: A 88 SER OG : rot -149:sc= 0.0233 USER MOD Set 3.1: A 69 ASN : amide:sc= -3! C(o=-5.9!,f=-7!) USER MOD Set 3.2: A 71 SER OG : rot -95:sc= -2.87! USER MOD Set 4.1: A 62 CYS SG : rot -84:sc= -0.18 USER MOD Set 4.2: A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 44:sc= 0.235 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ -131:sc= -0.77 (180deg=-0.949!) USER MOD Single : A 14 HIS : no HD1:sc= -4.3! C(o=-4.3!,f=-4.6!) USER MOD Single : A 22 LYS NZ :NH3+ -154:sc= -0.425 (180deg=-1.62!) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 HIS : no HE2:sc= -3.51 X(o=-3.5,f=-3.6!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 6:sc= 1.09 USER MOD Single : A 46 GLN : amide:sc= -0.216 X(o=-0.22,f=-0.44) USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 LYS NZ :NH3+ 158:sc= 0.757 (180deg=0.487) USER MOD Single : A 73 GLN : amide:sc= -0.363 X(o=-0.36,f=-0.59) USER MOD Single : A 74 LYS NZ :NH3+ -162:sc= -0.0274 (180deg=-0.26) USER MOD Single : A 76 CYS SG : rot 25:sc= 0.605 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 87 MET CE :methyl 179:sc= -4.48! (180deg=-4.51!) USER MOD Single : A 91 TYR OH : rot 66:sc= 0.855 USER MOD Single : A 94 CYS SG : rot -120:sc= -1.34 USER MOD Single : A 95 GLN : amide:sc= -0.101 K(o=-0.1,f=-2.3!) USER MOD Single : A 98 GLN : amide:sc= -0.0999 K(o=-0.1,f=-2.7!) USER MOD Single : A 99 GLN : amide:sc= -1.28 K(o=-1.3,f=-3!) USER MOD Single : A 107 CYS SG : rot 170:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot 180:sc= -0.104 USER MOD Single : A 116 MET CE :methyl -129:sc= -1.55 (180deg=-6.65!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot -111:sc= 1.25 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 GLN : amide:sc= -0.25 K(o=-0.25,f=-2.1!) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -0.0842 K(o=-0.084,f=-0.73) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.193 -20.643 -1.189 1.00 0.00 N ATOM 2 CA GLY A 1 11.351 -20.043 0.123 1.00 0.00 C ATOM 3 C GLY A 1 11.375 -18.529 0.068 1.00 0.00 C ATOM 4 O GLY A 1 12.276 -17.936 -0.526 1.00 0.00 O ATOM 0 H1 GLY A 1 11.183 -21.679 -1.098 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.298 -20.323 -1.611 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.985 -20.357 -1.799 1.00 0.00 H new ATOM 0 HA2 GLY A 1 10.535 -20.367 0.768 1.00 0.00 H new ATOM 0 HA3 GLY A 1 12.276 -20.402 0.574 1.00 0.00 H new ATOM 8 N SER A 2 10.382 -17.900 0.689 1.00 0.00 N ATOM 9 CA SER A 2 10.289 -16.445 0.704 1.00 0.00 C ATOM 10 C SER A 2 11.469 -15.833 1.453 1.00 0.00 C ATOM 11 O SER A 2 11.695 -16.131 2.626 1.00 0.00 O ATOM 12 CB SER A 2 8.975 -16.003 1.350 1.00 0.00 C ATOM 13 OG SER A 2 8.650 -14.673 0.986 1.00 0.00 O ATOM 0 H SER A 2 9.630 -18.376 1.188 1.00 0.00 H new ATOM 0 HA SER A 2 10.314 -16.093 -0.327 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.172 -16.674 1.044 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.056 -16.077 2.434 1.00 0.00 H new ATOM 0 HG SER A 2 7.805 -14.415 1.410 1.00 0.00 H new ATOM 19 N SER A 3 12.218 -14.976 0.767 1.00 0.00 N ATOM 20 CA SER A 3 13.377 -14.324 1.365 1.00 0.00 C ATOM 21 C SER A 3 12.947 -13.337 2.447 1.00 0.00 C ATOM 22 O SER A 3 11.757 -13.110 2.658 1.00 0.00 O ATOM 23 CB SER A 3 14.191 -13.599 0.292 1.00 0.00 C ATOM 24 OG SER A 3 15.109 -14.479 -0.333 1.00 0.00 O ATOM 0 H SER A 3 12.043 -14.717 -0.204 1.00 0.00 H new ATOM 0 HA SER A 3 13.998 -15.093 1.825 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.519 -13.178 -0.456 1.00 0.00 H new ATOM 0 HB3 SER A 3 14.730 -12.765 0.742 1.00 0.00 H new ATOM 0 HG SER A 3 15.616 -13.992 -1.016 1.00 0.00 H new ATOM 30 N GLY A 4 13.927 -12.754 3.130 1.00 0.00 N ATOM 31 CA GLY A 4 13.632 -11.799 4.182 1.00 0.00 C ATOM 32 C GLY A 4 14.109 -10.400 3.846 1.00 0.00 C ATOM 33 O GLY A 4 14.101 -9.997 2.682 1.00 0.00 O ATOM 0 H GLY A 4 14.920 -12.926 2.974 1.00 0.00 H new ATOM 0 HA2 GLY A 4 12.557 -11.780 4.360 1.00 0.00 H new ATOM 0 HA3 GLY A 4 14.103 -12.127 5.109 1.00 0.00 H new ATOM 37 N SER A 5 14.523 -9.656 4.866 1.00 0.00 N ATOM 38 CA SER A 5 15.000 -8.292 4.673 1.00 0.00 C ATOM 39 C SER A 5 16.013 -7.913 5.750 1.00 0.00 C ATOM 40 O SER A 5 15.700 -7.916 6.940 1.00 0.00 O ATOM 41 CB SER A 5 13.826 -7.311 4.694 1.00 0.00 C ATOM 42 OG SER A 5 13.031 -7.492 5.853 1.00 0.00 O ATOM 0 H SER A 5 14.538 -9.975 5.835 1.00 0.00 H new ATOM 0 HA SER A 5 15.491 -8.239 3.701 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.202 -6.288 4.663 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.214 -7.453 3.803 1.00 0.00 H new ATOM 0 HG SER A 5 13.612 -7.600 6.635 1.00 0.00 H new ATOM 48 N SER A 6 17.228 -7.588 5.321 1.00 0.00 N ATOM 49 CA SER A 6 18.290 -7.210 6.247 1.00 0.00 C ATOM 50 C SER A 6 17.977 -5.876 6.917 1.00 0.00 C ATOM 51 O SER A 6 17.575 -4.917 6.259 1.00 0.00 O ATOM 52 CB SER A 6 19.629 -7.124 5.513 1.00 0.00 C ATOM 53 OG SER A 6 20.061 -8.405 5.088 1.00 0.00 O ATOM 0 H SER A 6 17.502 -7.579 4.339 1.00 0.00 H new ATOM 0 HA SER A 6 18.356 -7.977 7.018 1.00 0.00 H new ATOM 0 HB2 SER A 6 19.533 -6.465 4.650 1.00 0.00 H new ATOM 0 HB3 SER A 6 20.379 -6.683 6.169 1.00 0.00 H new ATOM 0 HG SER A 6 20.918 -8.323 4.620 1.00 0.00 H new ATOM 59 N GLY A 7 18.165 -5.823 8.233 1.00 0.00 N ATOM 60 CA GLY A 7 17.898 -4.602 8.971 1.00 0.00 C ATOM 61 C GLY A 7 16.420 -4.273 9.033 1.00 0.00 C ATOM 62 O GLY A 7 15.574 -5.161 8.920 1.00 0.00 O ATOM 0 H GLY A 7 18.497 -6.603 8.800 1.00 0.00 H new ATOM 0 HA2 GLY A 7 18.288 -4.701 9.984 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.432 -3.775 8.504 1.00 0.00 H new ATOM 66 N ILE A 8 16.107 -2.994 9.213 1.00 0.00 N ATOM 67 CA ILE A 8 14.721 -2.551 9.290 1.00 0.00 C ATOM 68 C ILE A 8 13.876 -3.195 8.196 1.00 0.00 C ATOM 69 O ILE A 8 14.277 -3.279 7.035 1.00 0.00 O ATOM 70 CB ILE A 8 14.612 -1.019 9.171 1.00 0.00 C ATOM 71 CG1 ILE A 8 15.333 -0.343 10.339 1.00 0.00 C ATOM 72 CG2 ILE A 8 13.152 -0.594 9.125 1.00 0.00 C ATOM 73 CD1 ILE A 8 15.112 1.152 10.402 1.00 0.00 C ATOM 0 H ILE A 8 16.795 -2.247 9.308 1.00 0.00 H new ATOM 0 HA ILE A 8 14.345 -2.860 10.266 1.00 0.00 H new ATOM 0 HB ILE A 8 15.090 -0.706 8.243 1.00 0.00 H new ATOM 0 HG12 ILE A 8 14.995 -0.792 11.273 1.00 0.00 H new ATOM 0 HG13 ILE A 8 16.402 -0.541 10.259 1.00 0.00 H new ATOM 0 HG21 ILE A 8 13.091 0.491 9.041 1.00 0.00 H new ATOM 0 HG22 ILE A 8 12.667 -1.052 8.263 1.00 0.00 H new ATOM 0 HG23 ILE A 8 12.650 -0.916 10.038 1.00 0.00 H new ATOM 0 HD11 ILE A 8 15.652 1.564 11.254 1.00 0.00 H new ATOM 0 HD12 ILE A 8 15.477 1.613 9.484 1.00 0.00 H new ATOM 0 HD13 ILE A 8 14.047 1.358 10.513 1.00 0.00 H new ATOM 85 N PRO A 9 12.676 -3.662 8.573 1.00 0.00 N ATOM 86 CA PRO A 9 11.748 -4.305 7.638 1.00 0.00 C ATOM 87 C PRO A 9 11.159 -3.319 6.635 1.00 0.00 C ATOM 88 O PRO A 9 10.350 -2.464 6.994 1.00 0.00 O ATOM 89 CB PRO A 9 10.651 -4.858 8.552 1.00 0.00 C ATOM 90 CG PRO A 9 10.693 -3.989 9.762 1.00 0.00 C ATOM 91 CD PRO A 9 12.133 -3.596 9.940 1.00 0.00 C ATOM 0 HA PRO A 9 12.241 -5.065 7.032 1.00 0.00 H new ATOM 0 HB2 PRO A 9 9.675 -4.817 8.069 1.00 0.00 H new ATOM 0 HB3 PRO A 9 10.837 -5.901 8.807 1.00 0.00 H new ATOM 0 HG2 PRO A 9 10.062 -3.110 9.633 1.00 0.00 H new ATOM 0 HG3 PRO A 9 10.323 -4.522 10.638 1.00 0.00 H new ATOM 0 HD2 PRO A 9 12.227 -2.595 10.362 1.00 0.00 H new ATOM 0 HD3 PRO A 9 12.655 -4.276 10.613 1.00 0.00 H new ATOM 99 N GLU A 10 11.570 -3.445 5.377 1.00 0.00 N ATOM 100 CA GLU A 10 11.082 -2.564 4.323 1.00 0.00 C ATOM 101 C GLU A 10 10.649 -3.366 3.099 1.00 0.00 C ATOM 102 O GLU A 10 11.291 -4.351 2.730 1.00 0.00 O ATOM 103 CB GLU A 10 12.164 -1.556 3.929 1.00 0.00 C ATOM 104 CG GLU A 10 12.408 -0.484 4.978 1.00 0.00 C ATOM 105 CD GLU A 10 13.457 0.523 4.549 1.00 0.00 C ATOM 106 OE1 GLU A 10 13.428 0.946 3.375 1.00 0.00 O ATOM 107 OE2 GLU A 10 14.308 0.888 5.388 1.00 0.00 O ATOM 0 H GLU A 10 12.239 -4.148 5.063 1.00 0.00 H new ATOM 0 HA GLU A 10 10.216 -2.026 4.708 1.00 0.00 H new ATOM 0 HB2 GLU A 10 13.096 -2.090 3.744 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.879 -1.077 2.992 1.00 0.00 H new ATOM 0 HG2 GLU A 10 11.473 0.037 5.185 1.00 0.00 H new ATOM 0 HG3 GLU A 10 12.722 -0.956 5.909 1.00 0.00 H new ATOM 114 N LEU A 11 9.558 -2.939 2.475 1.00 0.00 N ATOM 115 CA LEU A 11 9.038 -3.617 1.292 1.00 0.00 C ATOM 116 C LEU A 11 9.427 -2.871 0.021 1.00 0.00 C ATOM 117 O LEU A 11 9.410 -1.640 -0.020 1.00 0.00 O ATOM 118 CB LEU A 11 7.515 -3.740 1.379 1.00 0.00 C ATOM 119 CG LEU A 11 6.981 -5.020 2.023 1.00 0.00 C ATOM 120 CD1 LEU A 11 5.650 -4.756 2.710 1.00 0.00 C ATOM 121 CD2 LEU A 11 6.836 -6.121 0.982 1.00 0.00 C ATOM 0 H LEU A 11 9.015 -2.126 2.768 1.00 0.00 H new ATOM 0 HA LEU A 11 9.476 -4.614 1.254 1.00 0.00 H new ATOM 0 HB2 LEU A 11 7.133 -2.888 1.941 1.00 0.00 H new ATOM 0 HB3 LEU A 11 7.106 -3.666 0.371 1.00 0.00 H new ATOM 0 HG LEU A 11 7.697 -5.351 2.776 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.285 -5.678 3.163 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.784 -4.000 3.484 1.00 0.00 H new ATOM 0 HD13 LEU A 11 4.926 -4.401 1.977 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.455 -7.024 1.458 1.00 0.00 H new ATOM 0 HD22 LEU A 11 6.141 -5.799 0.206 1.00 0.00 H new ATOM 0 HD23 LEU A 11 7.808 -6.329 0.535 1.00 0.00 H new ATOM 133 N LYS A 12 9.777 -3.623 -1.017 1.00 0.00 N ATOM 134 CA LYS A 12 10.168 -3.034 -2.293 1.00 0.00 C ATOM 135 C LYS A 12 9.384 -3.658 -3.443 1.00 0.00 C ATOM 136 O LYS A 12 9.649 -4.791 -3.844 1.00 0.00 O ATOM 137 CB LYS A 12 11.669 -3.220 -2.525 1.00 0.00 C ATOM 138 CG LYS A 12 12.531 -2.664 -1.405 1.00 0.00 C ATOM 139 CD LYS A 12 12.974 -1.240 -1.696 1.00 0.00 C ATOM 140 CE LYS A 12 14.375 -1.201 -2.285 1.00 0.00 C ATOM 141 NZ LYS A 12 14.359 -1.368 -3.765 1.00 0.00 N ATOM 0 H LYS A 12 9.798 -4.643 -1.000 1.00 0.00 H new ATOM 0 HA LYS A 12 9.941 -1.968 -2.258 1.00 0.00 H new ATOM 0 HB2 LYS A 12 11.881 -4.283 -2.642 1.00 0.00 H new ATOM 0 HB3 LYS A 12 11.946 -2.735 -3.461 1.00 0.00 H new ATOM 0 HG2 LYS A 12 11.973 -2.688 -0.469 1.00 0.00 H new ATOM 0 HG3 LYS A 12 13.407 -3.298 -1.270 1.00 0.00 H new ATOM 0 HD2 LYS A 12 12.274 -0.775 -2.390 1.00 0.00 H new ATOM 0 HD3 LYS A 12 12.948 -0.655 -0.777 1.00 0.00 H new ATOM 0 HE2 LYS A 12 14.849 -0.253 -2.032 1.00 0.00 H new ATOM 0 HE3 LYS A 12 14.979 -1.990 -1.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 15.052 -2.094 -4.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 13.409 -1.662 -4.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 14.605 -0.465 -4.219 1.00 0.00 H new ATOM 155 N ASP A 13 8.420 -2.911 -3.969 1.00 0.00 N ATOM 156 CA ASP A 13 7.599 -3.390 -5.076 1.00 0.00 C ATOM 157 C ASP A 13 6.644 -2.301 -5.555 1.00 0.00 C ATOM 158 O ASP A 13 6.282 -1.400 -4.797 1.00 0.00 O ATOM 159 CB ASP A 13 6.809 -4.629 -4.653 1.00 0.00 C ATOM 160 CG ASP A 13 7.579 -5.914 -4.885 1.00 0.00 C ATOM 161 OD1 ASP A 13 8.382 -5.960 -5.840 1.00 0.00 O ATOM 162 OD2 ASP A 13 7.379 -6.874 -4.111 1.00 0.00 O ATOM 0 H ASP A 13 8.187 -1.971 -3.647 1.00 0.00 H new ATOM 0 HA ASP A 13 8.262 -3.655 -5.900 1.00 0.00 H new ATOM 0 HB2 ASP A 13 6.551 -4.549 -3.597 1.00 0.00 H new ATOM 0 HB3 ASP A 13 5.872 -4.665 -5.208 1.00 0.00 H new ATOM 167 N HIS A 14 6.240 -2.389 -6.818 1.00 0.00 N ATOM 168 CA HIS A 14 5.327 -1.411 -7.399 1.00 0.00 C ATOM 169 C HIS A 14 3.946 -2.020 -7.617 1.00 0.00 C ATOM 170 O HIS A 14 3.773 -2.911 -8.450 1.00 0.00 O ATOM 171 CB HIS A 14 5.882 -0.887 -8.724 1.00 0.00 C ATOM 172 CG HIS A 14 4.841 -0.275 -9.609 1.00 0.00 C ATOM 173 ND1 HIS A 14 4.299 -0.927 -10.697 1.00 0.00 N ATOM 174 CD2 HIS A 14 4.241 0.938 -9.562 1.00 0.00 C ATOM 175 CE1 HIS A 14 3.412 -0.141 -11.281 1.00 0.00 C ATOM 176 NE2 HIS A 14 3.357 0.996 -10.611 1.00 0.00 N ATOM 0 H HIS A 14 6.530 -3.127 -7.459 1.00 0.00 H new ATOM 0 HA HIS A 14 5.232 -0.580 -6.700 1.00 0.00 H new ATOM 0 HB2 HIS A 14 6.653 -0.145 -8.517 1.00 0.00 H new ATOM 0 HB3 HIS A 14 6.363 -1.707 -9.257 1.00 0.00 H new ATOM 0 HD2 HIS A 14 4.424 1.715 -8.835 1.00 0.00 H new ATOM 0 HE1 HIS A 14 2.831 -0.386 -12.157 1.00 0.00 H new ATOM 0 HE2 HIS A 14 2.756 1.788 -10.836 1.00 0.00 H new ATOM 185 N LEU A 15 2.965 -1.535 -6.864 1.00 0.00 N ATOM 186 CA LEU A 15 1.598 -2.032 -6.975 1.00 0.00 C ATOM 187 C LEU A 15 0.825 -1.267 -8.045 1.00 0.00 C ATOM 188 O LEU A 15 1.387 -0.427 -8.749 1.00 0.00 O ATOM 189 CB LEU A 15 0.880 -1.913 -5.629 1.00 0.00 C ATOM 190 CG LEU A 15 1.617 -2.496 -4.422 1.00 0.00 C ATOM 191 CD1 LEU A 15 1.255 -1.735 -3.157 1.00 0.00 C ATOM 192 CD2 LEU A 15 1.297 -3.976 -4.266 1.00 0.00 C ATOM 0 H LEU A 15 3.091 -0.798 -6.170 1.00 0.00 H new ATOM 0 HA LEU A 15 1.642 -3.082 -7.265 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.685 -0.858 -5.436 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.088 -2.406 -5.711 1.00 0.00 H new ATOM 0 HG LEU A 15 2.689 -2.392 -4.590 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.789 -2.164 -2.309 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.535 -0.688 -3.270 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.181 -1.807 -2.984 1.00 0.00 H new ATOM 0 HD21 LEU A 15 1.830 -4.374 -3.403 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.224 -4.103 -4.121 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.608 -4.512 -5.163 1.00 0.00 H new ATOM 204 N ARG A 16 -0.466 -1.561 -8.159 1.00 0.00 N ATOM 205 CA ARG A 16 -1.316 -0.900 -9.142 1.00 0.00 C ATOM 206 C ARG A 16 -1.787 0.457 -8.629 1.00 0.00 C ATOM 207 O ARG A 16 -2.489 0.541 -7.621 1.00 0.00 O ATOM 208 CB ARG A 16 -2.523 -1.778 -9.476 1.00 0.00 C ATOM 209 CG ARG A 16 -2.262 -2.775 -10.593 1.00 0.00 C ATOM 210 CD ARG A 16 -1.361 -3.908 -10.129 1.00 0.00 C ATOM 211 NE ARG A 16 0.053 -3.602 -10.330 1.00 0.00 N ATOM 212 CZ ARG A 16 0.598 -3.400 -11.524 1.00 0.00 C ATOM 213 NH1 ARG A 16 -0.147 -3.472 -12.618 1.00 0.00 N ATOM 214 NH2 ARG A 16 1.892 -3.125 -11.626 1.00 0.00 N ATOM 0 H ARG A 16 -0.946 -2.252 -7.583 1.00 0.00 H new ATOM 0 HA ARG A 16 -0.728 -0.743 -10.046 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -2.826 -2.320 -8.580 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -3.359 -1.139 -9.759 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -3.209 -3.183 -10.946 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -1.800 -2.264 -11.438 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -1.542 -4.105 -9.072 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -1.615 -4.818 -10.672 1.00 0.00 H new ATOM 0 HE ARG A 16 0.655 -3.540 -9.509 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -1.142 -3.683 -12.544 1.00 0.00 H new ATOM 0 HH12 ARG A 16 0.275 -3.316 -13.533 1.00 0.00 H new ATOM 0 HH21 ARG A 16 2.469 -3.069 -10.787 1.00 0.00 H new ATOM 0 HH22 ARG A 16 2.310 -2.970 -12.544 1.00 0.00 H new ATOM 228 N ILE A 17 -1.395 1.517 -9.329 1.00 0.00 N ATOM 229 CA ILE A 17 -1.777 2.870 -8.944 1.00 0.00 C ATOM 230 C ILE A 17 -2.576 3.551 -10.050 1.00 0.00 C ATOM 231 O ILE A 17 -2.212 3.485 -11.224 1.00 0.00 O ATOM 232 CB ILE A 17 -0.544 3.731 -8.612 1.00 0.00 C ATOM 233 CG1 ILE A 17 0.042 3.321 -7.260 1.00 0.00 C ATOM 234 CG2 ILE A 17 -0.913 5.207 -8.611 1.00 0.00 C ATOM 235 CD1 ILE A 17 1.308 4.067 -6.899 1.00 0.00 C ATOM 0 H ILE A 17 -0.813 1.465 -10.165 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.398 2.781 -8.052 1.00 0.00 H new ATOM 0 HB ILE A 17 0.213 3.567 -9.379 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -0.704 3.490 -6.483 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.251 2.251 -7.273 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -0.031 5.802 -8.375 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -1.288 5.489 -9.595 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -1.685 5.389 -7.863 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.667 3.725 -5.928 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.070 3.878 -7.655 1.00 0.00 H new ATOM 0 HD13 ILE A 17 1.100 5.136 -6.853 1.00 0.00 H new ATOM 247 N PHE A 18 -3.667 4.206 -9.666 1.00 0.00 N ATOM 248 CA PHE A 18 -4.518 4.901 -10.625 1.00 0.00 C ATOM 249 C PHE A 18 -5.028 6.217 -10.046 1.00 0.00 C ATOM 250 O PHE A 18 -5.454 6.277 -8.893 1.00 0.00 O ATOM 251 CB PHE A 18 -5.700 4.015 -11.026 1.00 0.00 C ATOM 252 CG PHE A 18 -6.727 4.727 -11.859 1.00 0.00 C ATOM 253 CD1 PHE A 18 -6.382 5.287 -13.078 1.00 0.00 C ATOM 254 CD2 PHE A 18 -8.038 4.836 -11.423 1.00 0.00 C ATOM 255 CE1 PHE A 18 -7.325 5.943 -13.848 1.00 0.00 C ATOM 256 CE2 PHE A 18 -8.985 5.490 -12.188 1.00 0.00 C ATOM 257 CZ PHE A 18 -8.628 6.045 -13.401 1.00 0.00 C ATOM 0 H PHE A 18 -3.982 4.270 -8.698 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.921 5.121 -11.510 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -5.327 3.154 -11.581 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -6.178 3.630 -10.125 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.364 5.210 -13.431 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -8.323 4.405 -10.475 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -7.043 6.375 -14.797 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -10.004 5.567 -11.837 1.00 0.00 H new ATOM 0 HZ PHE A 18 -9.366 6.558 -13.999 1.00 0.00 H new ATOM 267 N ARG A 19 -4.980 7.270 -10.855 1.00 0.00 N ATOM 268 CA ARG A 19 -5.435 8.586 -10.424 1.00 0.00 C ATOM 269 C ARG A 19 -6.370 9.205 -11.459 1.00 0.00 C ATOM 270 O ARG A 19 -5.948 9.944 -12.350 1.00 0.00 O ATOM 271 CB ARG A 19 -4.240 9.510 -10.184 1.00 0.00 C ATOM 272 CG ARG A 19 -3.680 9.428 -8.773 1.00 0.00 C ATOM 273 CD ARG A 19 -2.451 10.307 -8.609 1.00 0.00 C ATOM 274 NE ARG A 19 -2.797 11.724 -8.534 1.00 0.00 N ATOM 275 CZ ARG A 19 -1.897 12.699 -8.488 1.00 0.00 C ATOM 276 NH1 ARG A 19 -0.602 12.413 -8.510 1.00 0.00 N ATOM 277 NH2 ARG A 19 -2.291 13.965 -8.421 1.00 0.00 N ATOM 0 H ARG A 19 -4.631 7.237 -11.813 1.00 0.00 H new ATOM 0 HA ARG A 19 -5.984 8.464 -9.490 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -3.451 9.261 -10.894 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -4.540 10.538 -10.388 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -4.445 9.733 -8.059 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -3.423 8.394 -8.542 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -1.916 10.016 -7.705 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -1.774 10.143 -9.447 1.00 0.00 H new ATOM 0 HE ARG A 19 -3.785 11.979 -8.516 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -0.295 11.442 -8.562 1.00 0.00 H new ATOM 0 HH12 ARG A 19 0.087 13.164 -8.475 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.286 14.189 -8.405 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -1.599 14.713 -8.386 1.00 0.00 H new ATOM 291 N PRO A 20 -7.670 8.898 -11.342 1.00 0.00 N ATOM 292 CA PRO A 20 -8.691 9.414 -12.259 1.00 0.00 C ATOM 293 C PRO A 20 -8.928 10.910 -12.082 1.00 0.00 C ATOM 294 O PRO A 20 -9.528 11.559 -12.939 1.00 0.00 O ATOM 295 CB PRO A 20 -9.945 8.624 -11.874 1.00 0.00 C ATOM 296 CG PRO A 20 -9.726 8.235 -10.453 1.00 0.00 C ATOM 297 CD PRO A 20 -8.244 8.025 -10.305 1.00 0.00 C ATOM 0 HA PRO A 20 -8.399 9.295 -13.302 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -10.844 9.230 -11.984 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -10.071 7.747 -12.509 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -10.079 9.013 -9.776 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -10.275 7.326 -10.208 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -7.897 8.302 -9.310 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -7.969 6.982 -10.460 1.00 0.00 H new ATOM 305 N ARG A 21 -8.452 11.451 -10.965 1.00 0.00 N ATOM 306 CA ARG A 21 -8.613 12.870 -10.675 1.00 0.00 C ATOM 307 C ARG A 21 -7.593 13.702 -11.447 1.00 0.00 C ATOM 308 O ARG A 21 -6.384 13.518 -11.296 1.00 0.00 O ATOM 309 CB ARG A 21 -8.465 13.127 -9.174 1.00 0.00 C ATOM 310 CG ARG A 21 -8.953 14.499 -8.740 1.00 0.00 C ATOM 311 CD ARG A 21 -7.884 15.561 -8.945 1.00 0.00 C ATOM 312 NE ARG A 21 -6.725 15.345 -8.083 1.00 0.00 N ATOM 313 CZ ARG A 21 -5.682 16.166 -8.036 1.00 0.00 C ATOM 314 NH1 ARG A 21 -5.652 17.251 -8.797 1.00 0.00 N ATOM 315 NH2 ARG A 21 -4.665 15.901 -7.225 1.00 0.00 N ATOM 0 H ARG A 21 -7.952 10.928 -10.246 1.00 0.00 H new ATOM 0 HA ARG A 21 -9.613 13.168 -10.990 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -9.019 12.364 -8.627 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -7.416 13.019 -8.897 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -9.845 14.765 -9.307 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -9.240 14.469 -7.689 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -7.566 15.558 -9.988 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -8.307 16.545 -8.743 1.00 0.00 H new ATOM 0 HE ARG A 21 -6.716 14.519 -7.485 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -6.432 17.458 -9.421 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -4.849 17.879 -8.758 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -4.685 15.067 -6.638 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -3.864 16.531 -7.189 1.00 0.00 H new ATOM 329 N LYS A 22 -8.087 14.617 -12.274 1.00 0.00 N ATOM 330 CA LYS A 22 -7.219 15.477 -13.070 1.00 0.00 C ATOM 331 C LYS A 22 -6.130 14.663 -13.761 1.00 0.00 C ATOM 332 O LYS A 22 -4.957 15.040 -13.749 1.00 0.00 O ATOM 333 CB LYS A 22 -6.584 16.553 -12.186 1.00 0.00 C ATOM 334 CG LYS A 22 -6.062 17.749 -12.963 1.00 0.00 C ATOM 335 CD LYS A 22 -7.127 18.822 -13.116 1.00 0.00 C ATOM 336 CE LYS A 22 -7.947 18.617 -14.381 1.00 0.00 C ATOM 337 NZ LYS A 22 -7.083 18.361 -15.566 1.00 0.00 N ATOM 0 H LYS A 22 -9.084 14.782 -12.411 1.00 0.00 H new ATOM 0 HA LYS A 22 -7.829 15.957 -13.836 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -7.321 16.896 -11.460 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -5.763 16.110 -11.622 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -5.195 18.166 -12.451 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -5.726 17.426 -13.948 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -7.786 18.809 -12.248 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -6.655 19.804 -13.142 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -8.628 17.778 -14.240 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -8.561 19.499 -14.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -7.582 18.656 -16.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -6.199 18.902 -15.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -6.864 17.346 -15.623 1.00 0.00 H new ATOM 351 N LEU A 23 -6.524 13.546 -14.362 1.00 0.00 N ATOM 352 CA LEU A 23 -5.581 12.679 -15.060 1.00 0.00 C ATOM 353 C LEU A 23 -4.812 13.456 -16.124 1.00 0.00 C ATOM 354 O LEU A 23 -5.378 14.294 -16.828 1.00 0.00 O ATOM 355 CB LEU A 23 -6.319 11.504 -15.704 1.00 0.00 C ATOM 356 CG LEU A 23 -5.440 10.380 -16.253 1.00 0.00 C ATOM 357 CD1 LEU A 23 -5.116 9.373 -15.160 1.00 0.00 C ATOM 358 CD2 LEU A 23 -6.124 9.694 -17.427 1.00 0.00 C ATOM 0 H LEU A 23 -7.490 13.219 -14.380 1.00 0.00 H new ATOM 0 HA LEU A 23 -4.868 12.296 -14.330 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -6.999 11.079 -14.965 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.933 11.889 -16.518 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.505 10.815 -16.606 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.490 8.580 -15.570 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.585 9.873 -14.350 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.041 8.943 -14.776 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -5.484 8.897 -17.805 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.074 9.272 -17.099 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.304 10.421 -18.219 1.00 0.00 H new ATOM 370 N THR A 24 -3.519 13.170 -16.239 1.00 0.00 N ATOM 371 CA THR A 24 -2.672 13.841 -17.218 1.00 0.00 C ATOM 372 C THR A 24 -2.130 12.852 -18.244 1.00 0.00 C ATOM 373 O THR A 24 -1.935 13.197 -19.410 1.00 0.00 O ATOM 374 CB THR A 24 -1.491 14.560 -16.540 1.00 0.00 C ATOM 375 OG1 THR A 24 -0.617 15.109 -17.532 1.00 0.00 O ATOM 376 CG2 THR A 24 -0.715 13.603 -15.647 1.00 0.00 C ATOM 0 H THR A 24 -3.035 12.478 -15.666 1.00 0.00 H new ATOM 0 HA THR A 24 -3.295 14.579 -17.723 1.00 0.00 H new ATOM 0 HB THR A 24 -1.890 15.365 -15.923 1.00 0.00 H new ATOM 0 HG1 THR A 24 0.130 15.566 -17.093 1.00 0.00 H new ATOM 0 HG21 THR A 24 0.114 14.134 -15.179 1.00 0.00 H new ATOM 0 HG22 THR A 24 -1.376 13.209 -14.875 1.00 0.00 H new ATOM 0 HG23 THR A 24 -0.327 12.780 -16.247 1.00 0.00 H new ATOM 384 N LEU A 25 -1.889 11.622 -17.804 1.00 0.00 N ATOM 385 CA LEU A 25 -1.369 10.583 -18.685 1.00 0.00 C ATOM 386 C LEU A 25 -2.080 9.255 -18.440 1.00 0.00 C ATOM 387 O LEU A 25 -2.893 9.134 -17.524 1.00 0.00 O ATOM 388 CB LEU A 25 0.137 10.414 -18.475 1.00 0.00 C ATOM 389 CG LEU A 25 1.007 11.609 -18.867 1.00 0.00 C ATOM 390 CD1 LEU A 25 2.399 11.475 -18.269 1.00 0.00 C ATOM 391 CD2 LEU A 25 1.085 11.737 -20.382 1.00 0.00 C ATOM 0 H LEU A 25 -2.045 11.320 -16.842 1.00 0.00 H new ATOM 0 HA LEU A 25 -1.554 10.889 -19.715 1.00 0.00 H new ATOM 0 HB2 LEU A 25 0.314 10.191 -17.423 1.00 0.00 H new ATOM 0 HB3 LEU A 25 0.468 9.546 -19.045 1.00 0.00 H new ATOM 0 HG LEU A 25 0.549 12.514 -18.469 1.00 0.00 H new ATOM 0 HD11 LEU A 25 3.004 12.334 -18.559 1.00 0.00 H new ATOM 0 HD12 LEU A 25 2.326 11.433 -17.182 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.867 10.562 -18.637 1.00 0.00 H new ATOM 0 HD21 LEU A 25 1.708 12.592 -20.643 1.00 0.00 H new ATOM 0 HD22 LEU A 25 1.520 10.830 -20.802 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.083 11.880 -20.787 1.00 0.00 H new ATOM 403 N LYS A 26 -1.766 8.261 -19.263 1.00 0.00 N ATOM 404 CA LYS A 26 -2.371 6.941 -19.135 1.00 0.00 C ATOM 405 C LYS A 26 -2.569 6.573 -17.668 1.00 0.00 C ATOM 406 O LYS A 26 -1.688 6.793 -16.838 1.00 0.00 O ATOM 407 CB LYS A 26 -1.498 5.888 -19.821 1.00 0.00 C ATOM 408 CG LYS A 26 -2.070 4.483 -19.750 1.00 0.00 C ATOM 409 CD LYS A 26 -1.512 3.597 -20.851 1.00 0.00 C ATOM 410 CE LYS A 26 -1.766 2.125 -20.565 1.00 0.00 C ATOM 411 NZ LYS A 26 -3.125 1.700 -21.002 1.00 0.00 N ATOM 0 H LYS A 26 -1.095 8.345 -20.027 1.00 0.00 H new ATOM 0 HA LYS A 26 -3.347 6.968 -19.620 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -1.365 6.164 -20.867 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -0.510 5.892 -19.362 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.841 4.045 -18.778 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -3.156 4.527 -19.832 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -1.968 3.868 -21.803 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -0.440 3.770 -20.950 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -1.015 1.521 -21.075 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -1.653 1.938 -19.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -3.258 0.691 -20.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -3.842 2.258 -20.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -3.225 1.854 -22.026 1.00 0.00 H new ATOM 425 N GLY A 27 -3.733 6.011 -17.355 1.00 0.00 N ATOM 426 CA GLY A 27 -4.025 5.621 -15.988 1.00 0.00 C ATOM 427 C GLY A 27 -2.844 4.953 -15.311 1.00 0.00 C ATOM 428 O GLY A 27 -1.978 5.625 -14.752 1.00 0.00 O ATOM 0 H GLY A 27 -4.479 5.819 -18.024 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -4.317 6.502 -15.416 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.876 4.940 -15.981 1.00 0.00 H new ATOM 432 N TYR A 28 -2.810 3.626 -15.360 1.00 0.00 N ATOM 433 CA TYR A 28 -1.730 2.866 -14.743 1.00 0.00 C ATOM 434 C TYR A 28 -0.452 2.965 -15.571 1.00 0.00 C ATOM 435 O TYR A 28 -0.487 2.878 -16.799 1.00 0.00 O ATOM 436 CB TYR A 28 -2.135 1.400 -14.584 1.00 0.00 C ATOM 437 CG TYR A 28 -3.348 1.199 -13.704 1.00 0.00 C ATOM 438 CD1 TYR A 28 -3.238 1.225 -12.319 1.00 0.00 C ATOM 439 CD2 TYR A 28 -4.604 0.982 -14.257 1.00 0.00 C ATOM 440 CE1 TYR A 28 -4.344 1.042 -11.511 1.00 0.00 C ATOM 441 CE2 TYR A 28 -5.715 0.799 -13.457 1.00 0.00 C ATOM 442 CZ TYR A 28 -5.580 0.830 -12.085 1.00 0.00 C ATOM 443 OH TYR A 28 -6.685 0.646 -11.284 1.00 0.00 O ATOM 0 H TYR A 28 -3.518 3.054 -15.821 1.00 0.00 H new ATOM 0 HA TYR A 28 -1.538 3.292 -13.758 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -2.337 0.979 -15.569 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -1.297 0.843 -14.165 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -2.272 1.391 -11.866 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -4.714 0.956 -15.331 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -4.241 1.065 -10.436 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -6.684 0.633 -13.904 1.00 0.00 H new ATOM 0 HH TYR A 28 -7.477 0.510 -11.845 1.00 0.00 H new ATOM 453 N ARG A 29 0.674 3.147 -14.890 1.00 0.00 N ATOM 454 CA ARG A 29 1.964 3.258 -15.561 1.00 0.00 C ATOM 455 C ARG A 29 3.063 2.591 -14.740 1.00 0.00 C ATOM 456 O ARG A 29 2.834 2.164 -13.609 1.00 0.00 O ATOM 457 CB ARG A 29 2.312 4.728 -15.801 1.00 0.00 C ATOM 458 CG ARG A 29 1.640 5.321 -17.028 1.00 0.00 C ATOM 459 CD ARG A 29 1.911 6.813 -17.146 1.00 0.00 C ATOM 460 NE ARG A 29 1.904 7.263 -18.535 1.00 0.00 N ATOM 461 CZ ARG A 29 2.899 7.038 -19.386 1.00 0.00 C ATOM 462 NH1 ARG A 29 3.976 6.372 -18.990 1.00 0.00 N ATOM 463 NH2 ARG A 29 2.819 7.479 -20.635 1.00 0.00 N ATOM 0 H ARG A 29 0.720 3.221 -13.874 1.00 0.00 H new ATOM 0 HA ARG A 29 1.892 2.747 -16.521 1.00 0.00 H new ATOM 0 HB2 ARG A 29 2.025 5.308 -14.924 1.00 0.00 H new ATOM 0 HB3 ARG A 29 3.393 4.824 -15.907 1.00 0.00 H new ATOM 0 HG2 ARG A 29 2.000 4.813 -17.923 1.00 0.00 H new ATOM 0 HG3 ARG A 29 0.565 5.149 -16.974 1.00 0.00 H new ATOM 0 HD2 ARG A 29 1.158 7.364 -16.583 1.00 0.00 H new ATOM 0 HD3 ARG A 29 2.877 7.043 -16.696 1.00 0.00 H new ATOM 0 HE ARG A 29 1.090 7.779 -18.870 1.00 0.00 H new ATOM 0 HH11 ARG A 29 4.041 6.032 -18.031 1.00 0.00 H new ATOM 0 HH12 ARG A 29 4.739 6.200 -19.645 1.00 0.00 H new ATOM 0 HH21 ARG A 29 1.993 7.992 -20.943 1.00 0.00 H new ATOM 0 HH22 ARG A 29 3.584 7.305 -21.287 1.00 0.00 H new ATOM 477 N GLN A 30 4.257 2.505 -15.319 1.00 0.00 N ATOM 478 CA GLN A 30 5.391 1.888 -14.641 1.00 0.00 C ATOM 479 C GLN A 30 5.990 2.837 -13.608 1.00 0.00 C ATOM 480 O GLN A 30 6.884 3.625 -13.918 1.00 0.00 O ATOM 481 CB GLN A 30 6.460 1.482 -15.657 1.00 0.00 C ATOM 482 CG GLN A 30 7.546 0.592 -15.075 1.00 0.00 C ATOM 483 CD GLN A 30 8.271 -0.214 -16.135 1.00 0.00 C ATOM 484 OE1 GLN A 30 8.981 0.340 -16.974 1.00 0.00 O ATOM 485 NE2 GLN A 30 8.096 -1.530 -16.101 1.00 0.00 N ATOM 0 H GLN A 30 4.464 2.854 -16.255 1.00 0.00 H new ATOM 0 HA GLN A 30 5.033 0.997 -14.125 1.00 0.00 H new ATOM 0 HB2 GLN A 30 5.982 0.962 -16.487 1.00 0.00 H new ATOM 0 HB3 GLN A 30 6.920 2.381 -16.067 1.00 0.00 H new ATOM 0 HG2 GLN A 30 8.266 1.209 -14.537 1.00 0.00 H new ATOM 0 HG3 GLN A 30 7.102 -0.088 -14.348 1.00 0.00 H new ATOM 0 HE21 GLN A 30 7.498 -1.947 -15.387 1.00 0.00 H new ATOM 0 HE22 GLN A 30 8.559 -2.124 -16.789 1.00 0.00 H new ATOM 494 N HIS A 31 5.490 2.757 -12.379 1.00 0.00 N ATOM 495 CA HIS A 31 5.976 3.609 -11.300 1.00 0.00 C ATOM 496 C HIS A 31 6.669 2.780 -10.223 1.00 0.00 C ATOM 497 O HIS A 31 6.612 1.550 -10.240 1.00 0.00 O ATOM 498 CB HIS A 31 4.820 4.399 -10.686 1.00 0.00 C ATOM 499 CG HIS A 31 4.236 5.422 -11.610 1.00 0.00 C ATOM 500 ND1 HIS A 31 3.682 6.606 -11.170 1.00 0.00 N ATOM 501 CD2 HIS A 31 4.123 5.434 -12.959 1.00 0.00 C ATOM 502 CE1 HIS A 31 3.252 7.301 -12.208 1.00 0.00 C ATOM 503 NE2 HIS A 31 3.508 6.612 -13.306 1.00 0.00 N ATOM 0 H HIS A 31 4.749 2.111 -12.106 1.00 0.00 H new ATOM 0 HA HIS A 31 6.701 4.306 -11.720 1.00 0.00 H new ATOM 0 HB2 HIS A 31 4.036 3.704 -10.384 1.00 0.00 H new ATOM 0 HB3 HIS A 31 5.171 4.896 -9.782 1.00 0.00 H new ATOM 0 HD1 HIS A 31 3.615 6.899 -10.195 1.00 0.00 H new ATOM 0 HD2 HIS A 31 4.455 4.661 -13.636 1.00 0.00 H new ATOM 0 HE1 HIS A 31 2.773 8.268 -12.166 1.00 0.00 H new ATOM 512 N TRP A 32 7.324 3.460 -9.289 1.00 0.00 N ATOM 513 CA TRP A 32 8.029 2.786 -8.205 1.00 0.00 C ATOM 514 C TRP A 32 7.431 3.156 -6.853 1.00 0.00 C ATOM 515 O TRP A 32 7.068 4.309 -6.618 1.00 0.00 O ATOM 516 CB TRP A 32 9.516 3.146 -8.235 1.00 0.00 C ATOM 517 CG TRP A 32 10.304 2.503 -7.134 1.00 0.00 C ATOM 518 CD1 TRP A 32 10.990 3.139 -6.138 1.00 0.00 C ATOM 519 CD2 TRP A 32 10.490 1.100 -6.919 1.00 0.00 C ATOM 520 NE1 TRP A 32 11.590 2.215 -5.317 1.00 0.00 N ATOM 521 CE2 TRP A 32 11.298 0.957 -5.774 1.00 0.00 C ATOM 522 CE3 TRP A 32 10.050 -0.050 -7.581 1.00 0.00 C ATOM 523 CZ2 TRP A 32 11.675 -0.289 -5.280 1.00 0.00 C ATOM 524 CZ3 TRP A 32 10.426 -1.285 -7.089 1.00 0.00 C ATOM 525 CH2 TRP A 32 11.231 -1.397 -5.948 1.00 0.00 C ATOM 0 H TRP A 32 7.382 4.478 -9.261 1.00 0.00 H new ATOM 0 HA TRP A 32 7.919 1.711 -8.347 1.00 0.00 H new ATOM 0 HB2 TRP A 32 9.936 2.847 -9.195 1.00 0.00 H new ATOM 0 HB3 TRP A 32 9.622 4.228 -8.164 1.00 0.00 H new ATOM 0 HD1 TRP A 32 11.052 4.210 -6.014 1.00 0.00 H new ATOM 0 HE1 TRP A 32 12.161 2.431 -4.499 1.00 0.00 H new ATOM 0 HE3 TRP A 32 9.428 0.026 -8.461 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 12.296 -0.377 -4.401 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 10.093 -2.180 -7.593 1.00 0.00 H new ATOM 0 HH2 TRP A 32 11.506 -2.378 -5.589 1.00 0.00 H new ATOM 536 N VAL A 33 7.330 2.172 -5.965 1.00 0.00 N ATOM 537 CA VAL A 33 6.776 2.395 -4.635 1.00 0.00 C ATOM 538 C VAL A 33 7.623 1.714 -3.566 1.00 0.00 C ATOM 539 O VAL A 33 8.271 0.699 -3.825 1.00 0.00 O ATOM 540 CB VAL A 33 5.329 1.877 -4.536 1.00 0.00 C ATOM 541 CG1 VAL A 33 4.728 2.229 -3.184 1.00 0.00 C ATOM 542 CG2 VAL A 33 4.483 2.440 -5.668 1.00 0.00 C ATOM 0 H VAL A 33 7.625 1.212 -6.143 1.00 0.00 H new ATOM 0 HA VAL A 33 6.781 3.472 -4.466 1.00 0.00 H new ATOM 0 HB VAL A 33 5.343 0.791 -4.629 1.00 0.00 H new ATOM 0 HG11 VAL A 33 3.705 1.855 -3.132 1.00 0.00 H new ATOM 0 HG12 VAL A 33 5.322 1.773 -2.392 1.00 0.00 H new ATOM 0 HG13 VAL A 33 4.725 3.312 -3.058 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.464 2.064 -5.582 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.474 3.528 -5.609 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.904 2.132 -6.625 1.00 0.00 H new ATOM 552 N VAL A 34 7.612 2.277 -2.362 1.00 0.00 N ATOM 553 CA VAL A 34 8.378 1.724 -1.252 1.00 0.00 C ATOM 554 C VAL A 34 7.676 1.975 0.078 1.00 0.00 C ATOM 555 O VAL A 34 7.366 3.115 0.424 1.00 0.00 O ATOM 556 CB VAL A 34 9.795 2.323 -1.193 1.00 0.00 C ATOM 557 CG1 VAL A 34 10.510 1.882 0.075 1.00 0.00 C ATOM 558 CG2 VAL A 34 10.592 1.929 -2.428 1.00 0.00 C ATOM 0 H VAL A 34 7.081 3.116 -2.131 1.00 0.00 H new ATOM 0 HA VAL A 34 8.453 0.650 -1.424 1.00 0.00 H new ATOM 0 HB VAL A 34 9.710 3.410 -1.174 1.00 0.00 H new ATOM 0 HG11 VAL A 34 11.510 2.316 0.098 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.948 2.219 0.946 1.00 0.00 H new ATOM 0 HG13 VAL A 34 10.586 0.795 0.091 1.00 0.00 H new ATOM 0 HG21 VAL A 34 11.591 2.361 -2.369 1.00 0.00 H new ATOM 0 HG22 VAL A 34 10.669 0.843 -2.480 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.088 2.300 -3.320 1.00 0.00 H new ATOM 568 N PHE A 35 7.430 0.902 0.823 1.00 0.00 N ATOM 569 CA PHE A 35 6.764 1.005 2.116 1.00 0.00 C ATOM 570 C PHE A 35 7.784 1.063 3.249 1.00 0.00 C ATOM 571 O PHE A 35 8.762 0.315 3.260 1.00 0.00 O ATOM 572 CB PHE A 35 5.821 -0.182 2.324 1.00 0.00 C ATOM 573 CG PHE A 35 5.339 -0.324 3.740 1.00 0.00 C ATOM 574 CD1 PHE A 35 4.503 0.629 4.300 1.00 0.00 C ATOM 575 CD2 PHE A 35 5.723 -1.409 4.511 1.00 0.00 C ATOM 576 CE1 PHE A 35 4.058 0.501 5.602 1.00 0.00 C ATOM 577 CE2 PHE A 35 5.280 -1.542 5.813 1.00 0.00 C ATOM 578 CZ PHE A 35 4.448 -0.585 6.360 1.00 0.00 C ATOM 0 H PHE A 35 7.682 -0.049 0.553 1.00 0.00 H new ATOM 0 HA PHE A 35 6.183 1.927 2.125 1.00 0.00 H new ATOM 0 HB2 PHE A 35 4.960 -0.071 1.665 1.00 0.00 H new ATOM 0 HB3 PHE A 35 6.333 -1.098 2.029 1.00 0.00 H new ATOM 0 HD1 PHE A 35 4.196 1.481 3.712 1.00 0.00 H new ATOM 0 HD2 PHE A 35 6.376 -2.159 4.090 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.406 1.250 6.026 1.00 0.00 H new ATOM 0 HE2 PHE A 35 5.584 -2.394 6.403 1.00 0.00 H new ATOM 0 HZ PHE A 35 4.103 -0.686 7.378 1.00 0.00 H new ATOM 588 N LYS A 36 7.549 1.958 4.203 1.00 0.00 N ATOM 589 CA LYS A 36 8.445 2.116 5.342 1.00 0.00 C ATOM 590 C LYS A 36 7.719 1.822 6.651 1.00 0.00 C ATOM 591 O LYS A 36 6.493 1.905 6.722 1.00 0.00 O ATOM 592 CB LYS A 36 9.019 3.535 5.373 1.00 0.00 C ATOM 593 CG LYS A 36 9.988 3.774 6.517 1.00 0.00 C ATOM 594 CD LYS A 36 11.278 2.993 6.328 1.00 0.00 C ATOM 595 CE LYS A 36 12.431 3.627 7.090 1.00 0.00 C ATOM 596 NZ LYS A 36 13.011 4.785 6.355 1.00 0.00 N ATOM 0 H LYS A 36 6.745 2.585 4.210 1.00 0.00 H new ATOM 0 HA LYS A 36 9.261 1.402 5.231 1.00 0.00 H new ATOM 0 HB2 LYS A 36 9.528 3.733 4.430 1.00 0.00 H new ATOM 0 HB3 LYS A 36 8.198 4.248 5.448 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.213 4.838 6.588 1.00 0.00 H new ATOM 0 HG3 LYS A 36 9.520 3.484 7.458 1.00 0.00 H new ATOM 0 HD2 LYS A 36 11.136 1.967 6.668 1.00 0.00 H new ATOM 0 HD3 LYS A 36 11.524 2.946 5.267 1.00 0.00 H new ATOM 0 HE2 LYS A 36 12.082 3.956 8.069 1.00 0.00 H new ATOM 0 HE3 LYS A 36 13.207 2.881 7.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 13.794 5.190 6.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 13.367 4.467 5.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 12.278 5.509 6.213 1.00 0.00 H new ATOM 610 N GLU A 37 8.483 1.479 7.683 1.00 0.00 N ATOM 611 CA GLU A 37 7.911 1.173 8.988 1.00 0.00 C ATOM 612 C GLU A 37 6.652 1.998 9.237 1.00 0.00 C ATOM 613 O GLU A 37 5.538 1.474 9.225 1.00 0.00 O ATOM 614 CB GLU A 37 8.935 1.438 10.094 1.00 0.00 C ATOM 615 CG GLU A 37 10.256 0.717 9.885 1.00 0.00 C ATOM 616 CD GLU A 37 11.123 0.715 11.129 1.00 0.00 C ATOM 617 OE1 GLU A 37 10.926 -0.170 11.988 1.00 0.00 O ATOM 618 OE2 GLU A 37 11.998 1.598 11.244 1.00 0.00 O ATOM 0 H GLU A 37 9.499 1.406 7.640 1.00 0.00 H new ATOM 0 HA GLU A 37 7.641 0.117 8.999 1.00 0.00 H new ATOM 0 HB2 GLU A 37 9.122 2.510 10.156 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.511 1.133 11.051 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.060 -0.311 9.582 1.00 0.00 H new ATOM 0 HG3 GLU A 37 10.800 1.192 9.069 1.00 0.00 H new ATOM 625 N THR A 38 6.837 3.295 9.464 1.00 0.00 N ATOM 626 CA THR A 38 5.719 4.194 9.718 1.00 0.00 C ATOM 627 C THR A 38 5.645 5.292 8.663 1.00 0.00 C ATOM 628 O THR A 38 5.071 6.356 8.898 1.00 0.00 O ATOM 629 CB THR A 38 5.824 4.843 11.111 1.00 0.00 C ATOM 630 OG1 THR A 38 7.200 5.024 11.464 1.00 0.00 O ATOM 631 CG2 THR A 38 5.135 3.985 12.161 1.00 0.00 C ATOM 0 H THR A 38 7.752 3.746 9.477 1.00 0.00 H new ATOM 0 HA THR A 38 4.813 3.590 9.674 1.00 0.00 H new ATOM 0 HB THR A 38 5.328 5.813 11.074 1.00 0.00 H new ATOM 0 HG1 THR A 38 7.259 5.439 12.350 1.00 0.00 H new ATOM 0 HG21 THR A 38 5.222 4.464 13.136 1.00 0.00 H new ATOM 0 HG22 THR A 38 4.081 3.873 11.905 1.00 0.00 H new ATOM 0 HG23 THR A 38 5.607 3.003 12.195 1.00 0.00 H new ATOM 639 N THR A 39 6.229 5.028 7.498 1.00 0.00 N ATOM 640 CA THR A 39 6.230 5.993 6.407 1.00 0.00 C ATOM 641 C THR A 39 5.987 5.309 5.067 1.00 0.00 C ATOM 642 O THR A 39 6.075 4.085 4.958 1.00 0.00 O ATOM 643 CB THR A 39 7.561 6.766 6.342 1.00 0.00 C ATOM 644 OG1 THR A 39 8.124 6.883 7.653 1.00 0.00 O ATOM 645 CG2 THR A 39 7.354 8.151 5.747 1.00 0.00 C ATOM 0 H THR A 39 6.708 4.152 7.287 1.00 0.00 H new ATOM 0 HA THR A 39 5.420 6.695 6.605 1.00 0.00 H new ATOM 0 HB THR A 39 8.247 6.212 5.701 1.00 0.00 H new ATOM 0 HG1 THR A 39 8.971 7.374 7.603 1.00 0.00 H new ATOM 0 HG21 THR A 39 8.308 8.678 5.711 1.00 0.00 H new ATOM 0 HG22 THR A 39 6.953 8.057 4.738 1.00 0.00 H new ATOM 0 HG23 THR A 39 6.653 8.711 6.365 1.00 0.00 H new ATOM 653 N LEU A 40 5.682 6.105 4.048 1.00 0.00 N ATOM 654 CA LEU A 40 5.426 5.575 2.713 1.00 0.00 C ATOM 655 C LEU A 40 5.736 6.619 1.645 1.00 0.00 C ATOM 656 O LEU A 40 5.254 7.750 1.709 1.00 0.00 O ATOM 657 CB LEU A 40 3.970 5.123 2.592 1.00 0.00 C ATOM 658 CG LEU A 40 3.664 4.139 1.462 1.00 0.00 C ATOM 659 CD1 LEU A 40 2.448 3.294 1.805 1.00 0.00 C ATOM 660 CD2 LEU A 40 3.448 4.883 0.152 1.00 0.00 C ATOM 0 H LEU A 40 5.606 7.120 4.121 1.00 0.00 H new ATOM 0 HA LEU A 40 6.080 4.717 2.558 1.00 0.00 H new ATOM 0 HB2 LEU A 40 3.673 4.665 3.536 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.346 6.007 2.456 1.00 0.00 H new ATOM 0 HG LEU A 40 4.520 3.474 1.342 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.246 2.600 0.989 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.641 2.733 2.719 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.584 3.942 1.952 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.231 4.168 -0.641 1.00 0.00 H new ATOM 0 HD22 LEU A 40 2.610 5.572 0.259 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.348 5.444 -0.101 1.00 0.00 H new ATOM 672 N SER A 41 6.543 6.231 0.662 1.00 0.00 N ATOM 673 CA SER A 41 6.919 7.133 -0.420 1.00 0.00 C ATOM 674 C SER A 41 6.934 6.400 -1.758 1.00 0.00 C ATOM 675 O SER A 41 7.252 5.213 -1.824 1.00 0.00 O ATOM 676 CB SER A 41 8.293 7.747 -0.146 1.00 0.00 C ATOM 677 OG SER A 41 8.305 8.438 1.091 1.00 0.00 O ATOM 0 H SER A 41 6.949 5.298 0.593 1.00 0.00 H new ATOM 0 HA SER A 41 6.177 7.930 -0.471 1.00 0.00 H new ATOM 0 HB2 SER A 41 9.050 6.963 -0.135 1.00 0.00 H new ATOM 0 HB3 SER A 41 8.556 8.433 -0.952 1.00 0.00 H new ATOM 0 HG SER A 41 9.195 8.820 1.244 1.00 0.00 H new ATOM 683 N TYR A 42 6.589 7.117 -2.822 1.00 0.00 N ATOM 684 CA TYR A 42 6.560 6.536 -4.159 1.00 0.00 C ATOM 685 C TYR A 42 7.210 7.471 -5.174 1.00 0.00 C ATOM 686 O TYR A 42 7.598 8.592 -4.843 1.00 0.00 O ATOM 687 CB TYR A 42 5.120 6.234 -4.576 1.00 0.00 C ATOM 688 CG TYR A 42 4.359 7.452 -5.049 1.00 0.00 C ATOM 689 CD1 TYR A 42 4.018 8.469 -4.166 1.00 0.00 C ATOM 690 CD2 TYR A 42 3.982 7.586 -6.380 1.00 0.00 C ATOM 691 CE1 TYR A 42 3.322 9.583 -4.594 1.00 0.00 C ATOM 692 CE2 TYR A 42 3.287 8.697 -6.817 1.00 0.00 C ATOM 693 CZ TYR A 42 2.959 9.693 -5.921 1.00 0.00 C ATOM 694 OH TYR A 42 2.267 10.802 -6.351 1.00 0.00 O ATOM 0 H TYR A 42 6.326 8.102 -2.784 1.00 0.00 H new ATOM 0 HA TYR A 42 7.127 5.605 -4.135 1.00 0.00 H new ATOM 0 HB2 TYR A 42 5.130 5.490 -5.372 1.00 0.00 H new ATOM 0 HB3 TYR A 42 4.591 5.791 -3.732 1.00 0.00 H new ATOM 0 HD1 TYR A 42 4.302 8.387 -3.127 1.00 0.00 H new ATOM 0 HD2 TYR A 42 4.237 6.808 -7.085 1.00 0.00 H new ATOM 0 HE1 TYR A 42 3.063 10.364 -3.894 1.00 0.00 H new ATOM 0 HE2 TYR A 42 3.002 8.785 -7.855 1.00 0.00 H new ATOM 0 HH TYR A 42 2.090 10.725 -7.312 1.00 0.00 H new ATOM 704 N TYR A 43 7.325 7.002 -6.411 1.00 0.00 N ATOM 705 CA TYR A 43 7.929 7.795 -7.476 1.00 0.00 C ATOM 706 C TYR A 43 7.284 7.481 -8.822 1.00 0.00 C ATOM 707 O TYR A 43 6.865 6.351 -9.075 1.00 0.00 O ATOM 708 CB TYR A 43 9.434 7.531 -7.545 1.00 0.00 C ATOM 709 CG TYR A 43 10.045 7.156 -6.214 1.00 0.00 C ATOM 710 CD1 TYR A 43 9.621 6.025 -5.526 1.00 0.00 C ATOM 711 CD2 TYR A 43 11.046 7.932 -5.643 1.00 0.00 C ATOM 712 CE1 TYR A 43 10.175 5.679 -4.310 1.00 0.00 C ATOM 713 CE2 TYR A 43 11.608 7.592 -4.427 1.00 0.00 C ATOM 714 CZ TYR A 43 11.169 6.465 -3.765 1.00 0.00 C ATOM 715 OH TYR A 43 11.725 6.124 -2.553 1.00 0.00 O ATOM 0 H TYR A 43 7.008 6.077 -6.702 1.00 0.00 H new ATOM 0 HA TYR A 43 7.761 8.848 -7.250 1.00 0.00 H new ATOM 0 HB2 TYR A 43 9.621 6.730 -8.260 1.00 0.00 H new ATOM 0 HB3 TYR A 43 9.933 8.422 -7.926 1.00 0.00 H new ATOM 0 HD1 TYR A 43 8.844 5.406 -5.950 1.00 0.00 H new ATOM 0 HD2 TYR A 43 11.391 8.816 -6.158 1.00 0.00 H new ATOM 0 HE1 TYR A 43 9.832 4.798 -3.788 1.00 0.00 H new ATOM 0 HE2 TYR A 43 12.386 8.205 -3.998 1.00 0.00 H new ATOM 0 HH TYR A 43 12.411 6.781 -2.312 1.00 0.00 H new ATOM 725 N LYS A 44 7.208 8.490 -9.683 1.00 0.00 N ATOM 726 CA LYS A 44 6.616 8.324 -11.006 1.00 0.00 C ATOM 727 C LYS A 44 7.290 7.186 -11.765 1.00 0.00 C ATOM 728 O LYS A 44 6.683 6.561 -12.634 1.00 0.00 O ATOM 729 CB LYS A 44 6.731 9.624 -11.805 1.00 0.00 C ATOM 730 CG LYS A 44 6.213 9.511 -13.228 1.00 0.00 C ATOM 731 CD LYS A 44 6.669 10.681 -14.083 1.00 0.00 C ATOM 732 CE LYS A 44 5.832 11.923 -13.820 1.00 0.00 C ATOM 733 NZ LYS A 44 6.313 13.093 -14.606 1.00 0.00 N ATOM 0 H LYS A 44 7.549 9.432 -9.489 1.00 0.00 H new ATOM 0 HA LYS A 44 5.562 8.076 -10.877 1.00 0.00 H new ATOM 0 HB2 LYS A 44 6.179 10.409 -11.288 1.00 0.00 H new ATOM 0 HB3 LYS A 44 7.776 9.933 -11.831 1.00 0.00 H new ATOM 0 HG2 LYS A 44 6.563 8.578 -13.670 1.00 0.00 H new ATOM 0 HG3 LYS A 44 5.124 9.470 -13.217 1.00 0.00 H new ATOM 0 HD2 LYS A 44 7.717 10.897 -13.877 1.00 0.00 H new ATOM 0 HD3 LYS A 44 6.601 10.411 -15.137 1.00 0.00 H new ATOM 0 HE2 LYS A 44 4.791 11.719 -14.072 1.00 0.00 H new ATOM 0 HE3 LYS A 44 5.862 12.163 -12.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 5.717 13.919 -14.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 7.298 13.304 -14.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 6.261 12.874 -15.621 1.00 0.00 H new ATOM 747 N SER A 45 8.549 6.922 -11.430 1.00 0.00 N ATOM 748 CA SER A 45 9.307 5.860 -12.083 1.00 0.00 C ATOM 749 C SER A 45 10.608 5.583 -11.335 1.00 0.00 C ATOM 750 O SER A 45 11.315 6.508 -10.936 1.00 0.00 O ATOM 751 CB SER A 45 9.610 6.239 -13.534 1.00 0.00 C ATOM 752 OG SER A 45 8.459 6.099 -14.348 1.00 0.00 O ATOM 0 H SER A 45 9.066 7.428 -10.711 1.00 0.00 H new ATOM 0 HA SER A 45 8.701 4.954 -12.071 1.00 0.00 H new ATOM 0 HB2 SER A 45 9.967 7.268 -13.578 1.00 0.00 H new ATOM 0 HB3 SER A 45 10.411 5.607 -13.919 1.00 0.00 H new ATOM 0 HG SER A 45 7.688 5.870 -13.788 1.00 0.00 H new ATOM 758 N GLN A 46 10.916 4.303 -11.151 1.00 0.00 N ATOM 759 CA GLN A 46 12.131 3.904 -10.451 1.00 0.00 C ATOM 760 C GLN A 46 13.265 4.886 -10.726 1.00 0.00 C ATOM 761 O GLN A 46 14.111 5.129 -9.865 1.00 0.00 O ATOM 762 CB GLN A 46 12.547 2.494 -10.873 1.00 0.00 C ATOM 763 CG GLN A 46 13.289 1.729 -9.789 1.00 0.00 C ATOM 764 CD GLN A 46 14.734 2.166 -9.651 1.00 0.00 C ATOM 765 OE1 GLN A 46 15.469 2.240 -10.637 1.00 0.00 O ATOM 766 NE2 GLN A 46 15.150 2.459 -8.425 1.00 0.00 N ATOM 0 H GLN A 46 10.342 3.526 -11.477 1.00 0.00 H new ATOM 0 HA GLN A 46 11.923 3.909 -9.381 1.00 0.00 H new ATOM 0 HB2 GLN A 46 11.658 1.932 -11.159 1.00 0.00 H new ATOM 0 HB3 GLN A 46 13.180 2.560 -11.758 1.00 0.00 H new ATOM 0 HG2 GLN A 46 12.778 1.869 -8.836 1.00 0.00 H new ATOM 0 HG3 GLN A 46 13.256 0.663 -10.014 1.00 0.00 H new ATOM 0 HE21 GLN A 46 14.507 2.384 -7.637 1.00 0.00 H new ATOM 0 HE22 GLN A 46 16.113 2.759 -8.271 1.00 0.00 H new ATOM 775 N ASP A 47 13.277 5.446 -11.930 1.00 0.00 N ATOM 776 CA ASP A 47 14.307 6.403 -12.318 1.00 0.00 C ATOM 777 C ASP A 47 14.440 7.511 -11.278 1.00 0.00 C ATOM 778 O ASP A 47 15.532 7.779 -10.780 1.00 0.00 O ATOM 779 CB ASP A 47 13.984 7.006 -13.686 1.00 0.00 C ATOM 780 CG ASP A 47 14.407 6.106 -14.830 1.00 0.00 C ATOM 781 OD1 ASP A 47 15.627 5.894 -14.999 1.00 0.00 O ATOM 782 OD2 ASP A 47 13.519 5.613 -15.557 1.00 0.00 O ATOM 0 H ASP A 47 12.585 5.254 -12.655 1.00 0.00 H new ATOM 0 HA ASP A 47 15.257 5.872 -12.379 1.00 0.00 H new ATOM 0 HB2 ASP A 47 12.912 7.194 -13.753 1.00 0.00 H new ATOM 0 HB3 ASP A 47 14.484 7.970 -13.782 1.00 0.00 H new ATOM 787 N GLU A 48 13.320 8.151 -10.957 1.00 0.00 N ATOM 788 CA GLU A 48 13.312 9.231 -9.977 1.00 0.00 C ATOM 789 C GLU A 48 14.298 8.948 -8.847 1.00 0.00 C ATOM 790 O GLU A 48 15.236 9.712 -8.621 1.00 0.00 O ATOM 791 CB GLU A 48 11.906 9.422 -9.406 1.00 0.00 C ATOM 792 CG GLU A 48 10.924 10.028 -10.395 1.00 0.00 C ATOM 793 CD GLU A 48 11.169 11.507 -10.628 1.00 0.00 C ATOM 794 OE1 GLU A 48 12.112 11.842 -11.374 1.00 0.00 O ATOM 795 OE2 GLU A 48 10.416 12.328 -10.064 1.00 0.00 O ATOM 0 H GLU A 48 12.407 7.941 -11.361 1.00 0.00 H new ATOM 0 HA GLU A 48 13.618 10.147 -10.482 1.00 0.00 H new ATOM 0 HB2 GLU A 48 11.524 8.457 -9.073 1.00 0.00 H new ATOM 0 HB3 GLU A 48 11.964 10.063 -8.526 1.00 0.00 H new ATOM 0 HG2 GLU A 48 10.996 9.497 -11.344 1.00 0.00 H new ATOM 0 HG3 GLU A 48 9.908 9.885 -10.027 1.00 0.00 H new ATOM 802 N ALA A 49 14.077 7.844 -8.140 1.00 0.00 N ATOM 803 CA ALA A 49 14.945 7.459 -7.035 1.00 0.00 C ATOM 804 C ALA A 49 16.270 6.902 -7.546 1.00 0.00 C ATOM 805 O ALA A 49 16.428 6.596 -8.728 1.00 0.00 O ATOM 806 CB ALA A 49 14.248 6.438 -6.148 1.00 0.00 C ATOM 0 H ALA A 49 13.304 7.201 -8.313 1.00 0.00 H new ATOM 0 HA ALA A 49 15.159 8.351 -6.445 1.00 0.00 H new ATOM 0 HB1 ALA A 49 14.908 6.159 -5.326 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.331 6.870 -5.747 1.00 0.00 H new ATOM 0 HB3 ALA A 49 14.005 5.552 -6.735 1.00 0.00 H new ATOM 812 N PRO A 50 17.246 6.767 -6.636 1.00 0.00 N ATOM 813 CA PRO A 50 17.070 7.129 -5.227 1.00 0.00 C ATOM 814 C PRO A 50 16.956 8.636 -5.025 1.00 0.00 C ATOM 815 O PRO A 50 16.765 9.110 -3.906 1.00 0.00 O ATOM 816 CB PRO A 50 18.342 6.596 -4.562 1.00 0.00 C ATOM 817 CG PRO A 50 19.356 6.565 -5.653 1.00 0.00 C ATOM 818 CD PRO A 50 18.598 6.252 -6.914 1.00 0.00 C ATOM 0 HA PRO A 50 16.150 6.716 -4.813 1.00 0.00 H new ATOM 0 HB2 PRO A 50 18.661 7.241 -3.744 1.00 0.00 H new ATOM 0 HB3 PRO A 50 18.183 5.603 -4.142 1.00 0.00 H new ATOM 0 HG2 PRO A 50 19.871 7.522 -5.735 1.00 0.00 H new ATOM 0 HG3 PRO A 50 20.117 5.809 -5.457 1.00 0.00 H new ATOM 0 HD2 PRO A 50 19.043 6.739 -7.782 1.00 0.00 H new ATOM 0 HD3 PRO A 50 18.586 5.182 -7.120 1.00 0.00 H new ATOM 826 N GLY A 51 17.074 9.386 -6.117 1.00 0.00 N ATOM 827 CA GLY A 51 16.980 10.832 -6.038 1.00 0.00 C ATOM 828 C GLY A 51 16.075 11.294 -4.913 1.00 0.00 C ATOM 829 O GLY A 51 16.532 11.525 -3.794 1.00 0.00 O ATOM 0 H GLY A 51 17.233 9.018 -7.055 1.00 0.00 H new ATOM 0 HA2 GLY A 51 17.976 11.250 -5.894 1.00 0.00 H new ATOM 0 HA3 GLY A 51 16.605 11.221 -6.985 1.00 0.00 H new ATOM 833 N ASP A 52 14.787 11.429 -5.211 1.00 0.00 N ATOM 834 CA ASP A 52 13.815 11.867 -4.216 1.00 0.00 C ATOM 835 C ASP A 52 12.401 11.466 -4.625 1.00 0.00 C ATOM 836 O ASP A 52 12.022 11.541 -5.794 1.00 0.00 O ATOM 837 CB ASP A 52 13.894 13.383 -4.028 1.00 0.00 C ATOM 838 CG ASP A 52 15.117 13.806 -3.239 1.00 0.00 C ATOM 839 OD1 ASP A 52 15.129 13.601 -2.007 1.00 0.00 O ATOM 840 OD2 ASP A 52 16.064 14.340 -3.853 1.00 0.00 O ATOM 0 H ASP A 52 14.392 11.242 -6.133 1.00 0.00 H new ATOM 0 HA ASP A 52 14.053 11.378 -3.271 1.00 0.00 H new ATOM 0 HB2 ASP A 52 13.910 13.867 -5.005 1.00 0.00 H new ATOM 0 HB3 ASP A 52 12.997 13.730 -3.515 1.00 0.00 H new ATOM 845 N PRO A 53 11.602 11.029 -3.641 1.00 0.00 N ATOM 846 CA PRO A 53 10.217 10.606 -3.874 1.00 0.00 C ATOM 847 C PRO A 53 9.306 11.776 -4.227 1.00 0.00 C ATOM 848 O PRO A 53 9.514 12.899 -3.766 1.00 0.00 O ATOM 849 CB PRO A 53 9.804 9.992 -2.535 1.00 0.00 C ATOM 850 CG PRO A 53 10.681 10.652 -1.528 1.00 0.00 C ATOM 851 CD PRO A 53 11.987 10.913 -2.224 1.00 0.00 C ATOM 0 HA PRO A 53 10.137 9.919 -4.716 1.00 0.00 H new ATOM 0 HB2 PRO A 53 8.751 10.176 -2.323 1.00 0.00 H new ATOM 0 HB3 PRO A 53 9.945 8.911 -2.535 1.00 0.00 H new ATOM 0 HG2 PRO A 53 10.236 11.581 -1.172 1.00 0.00 H new ATOM 0 HG3 PRO A 53 10.824 10.013 -0.657 1.00 0.00 H new ATOM 0 HD2 PRO A 53 12.461 11.825 -1.860 1.00 0.00 H new ATOM 0 HD3 PRO A 53 12.696 10.100 -2.066 1.00 0.00 H new ATOM 859 N ILE A 54 8.295 11.507 -5.047 1.00 0.00 N ATOM 860 CA ILE A 54 7.351 12.538 -5.460 1.00 0.00 C ATOM 861 C ILE A 54 6.785 13.279 -4.254 1.00 0.00 C ATOM 862 O ILE A 54 6.672 14.505 -4.264 1.00 0.00 O ATOM 863 CB ILE A 54 6.188 11.942 -6.275 1.00 0.00 C ATOM 864 CG1 ILE A 54 6.702 11.382 -7.603 1.00 0.00 C ATOM 865 CG2 ILE A 54 5.117 12.995 -6.517 1.00 0.00 C ATOM 866 CD1 ILE A 54 5.750 10.403 -8.255 1.00 0.00 C ATOM 0 H ILE A 54 8.109 10.584 -5.438 1.00 0.00 H new ATOM 0 HA ILE A 54 7.902 13.238 -6.088 1.00 0.00 H new ATOM 0 HB ILE A 54 5.745 11.125 -5.705 1.00 0.00 H new ATOM 0 HG12 ILE A 54 6.887 12.208 -8.289 1.00 0.00 H new ATOM 0 HG13 ILE A 54 7.659 10.888 -7.434 1.00 0.00 H new ATOM 0 HG21 ILE A 54 4.302 12.559 -7.094 1.00 0.00 H new ATOM 0 HG22 ILE A 54 4.734 13.351 -5.561 1.00 0.00 H new ATOM 0 HG23 ILE A 54 5.546 13.830 -7.070 1.00 0.00 H new ATOM 0 HD11 ILE A 54 6.179 10.047 -9.192 1.00 0.00 H new ATOM 0 HD12 ILE A 54 5.584 9.557 -7.587 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.800 10.898 -8.456 1.00 0.00 H new ATOM 878 N GLN A 55 6.432 12.528 -3.216 1.00 0.00 N ATOM 879 CA GLN A 55 5.879 13.115 -2.002 1.00 0.00 C ATOM 880 C GLN A 55 6.000 12.150 -0.827 1.00 0.00 C ATOM 881 O GLN A 55 5.684 10.967 -0.949 1.00 0.00 O ATOM 882 CB GLN A 55 4.412 13.494 -2.216 1.00 0.00 C ATOM 883 CG GLN A 55 3.938 14.623 -1.315 1.00 0.00 C ATOM 884 CD GLN A 55 2.428 14.680 -1.196 1.00 0.00 C ATOM 885 OE1 GLN A 55 1.709 14.034 -1.960 1.00 0.00 O ATOM 886 NE2 GLN A 55 1.938 15.454 -0.235 1.00 0.00 N ATOM 0 H GLN A 55 6.519 11.512 -3.192 1.00 0.00 H new ATOM 0 HA GLN A 55 6.450 14.014 -1.771 1.00 0.00 H new ATOM 0 HB2 GLN A 55 4.269 13.786 -3.256 1.00 0.00 H new ATOM 0 HB3 GLN A 55 3.790 12.616 -2.043 1.00 0.00 H new ATOM 0 HG2 GLN A 55 4.372 14.498 -0.323 1.00 0.00 H new ATOM 0 HG3 GLN A 55 4.304 15.573 -1.706 1.00 0.00 H new ATOM 0 HE21 GLN A 55 2.571 15.972 0.375 1.00 0.00 H new ATOM 0 HE22 GLN A 55 0.929 15.531 -0.107 1.00 0.00 H new ATOM 895 N GLN A 56 6.459 12.664 0.310 1.00 0.00 N ATOM 896 CA GLN A 56 6.623 11.847 1.506 1.00 0.00 C ATOM 897 C GLN A 56 5.613 12.243 2.578 1.00 0.00 C ATOM 898 O GLN A 56 5.495 13.418 2.931 1.00 0.00 O ATOM 899 CB GLN A 56 8.045 11.983 2.052 1.00 0.00 C ATOM 900 CG GLN A 56 8.357 13.368 2.596 1.00 0.00 C ATOM 901 CD GLN A 56 9.843 13.595 2.796 1.00 0.00 C ATOM 902 OE1 GLN A 56 10.442 13.069 3.734 1.00 0.00 O ATOM 903 NE2 GLN A 56 10.446 14.382 1.913 1.00 0.00 N ATOM 0 H GLN A 56 6.724 13.642 0.428 1.00 0.00 H new ATOM 0 HA GLN A 56 6.446 10.807 1.232 1.00 0.00 H new ATOM 0 HB2 GLN A 56 8.193 11.249 2.844 1.00 0.00 H new ATOM 0 HB3 GLN A 56 8.754 11.745 1.259 1.00 0.00 H new ATOM 0 HG2 GLN A 56 7.967 14.120 1.910 1.00 0.00 H new ATOM 0 HG3 GLN A 56 7.841 13.506 3.546 1.00 0.00 H new ATOM 0 HE21 GLN A 56 9.911 14.797 1.151 1.00 0.00 H new ATOM 0 HE22 GLN A 56 11.445 14.571 1.997 1.00 0.00 H new ATOM 912 N LEU A 57 4.887 11.258 3.093 1.00 0.00 N ATOM 913 CA LEU A 57 3.886 11.503 4.126 1.00 0.00 C ATOM 914 C LEU A 57 4.020 10.497 5.265 1.00 0.00 C ATOM 915 O LEU A 57 4.743 9.508 5.150 1.00 0.00 O ATOM 916 CB LEU A 57 2.480 11.431 3.529 1.00 0.00 C ATOM 917 CG LEU A 57 2.245 12.253 2.261 1.00 0.00 C ATOM 918 CD1 LEU A 57 2.824 11.541 1.049 1.00 0.00 C ATOM 919 CD2 LEU A 57 0.760 12.521 2.066 1.00 0.00 C ATOM 0 H LEU A 57 4.972 10.281 2.812 1.00 0.00 H new ATOM 0 HA LEU A 57 4.052 12.502 4.528 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.254 10.388 3.308 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.768 11.758 4.287 1.00 0.00 H new ATOM 0 HG LEU A 57 2.754 13.210 2.372 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.647 12.141 0.156 1.00 0.00 H new ATOM 0 HD12 LEU A 57 3.896 11.402 1.187 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.344 10.569 0.934 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.612 13.107 1.159 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.228 11.574 1.977 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.375 13.074 2.922 1.00 0.00 H new ATOM 931 N ASN A 58 3.317 10.757 6.362 1.00 0.00 N ATOM 932 CA ASN A 58 3.356 9.872 7.522 1.00 0.00 C ATOM 933 C ASN A 58 2.027 9.145 7.696 1.00 0.00 C ATOM 934 O ASN A 58 1.051 9.719 8.182 1.00 0.00 O ATOM 935 CB ASN A 58 3.684 10.670 8.786 1.00 0.00 C ATOM 936 CG ASN A 58 5.177 10.813 9.008 1.00 0.00 C ATOM 937 OD1 ASN A 58 5.826 11.667 8.404 1.00 0.00 O ATOM 938 ND2 ASN A 58 5.729 9.976 9.879 1.00 0.00 N ATOM 0 H ASN A 58 2.714 11.572 6.473 1.00 0.00 H new ATOM 0 HA ASN A 58 4.136 9.129 7.356 1.00 0.00 H new ATOM 0 HB2 ASN A 58 3.234 11.660 8.714 1.00 0.00 H new ATOM 0 HB3 ASN A 58 3.237 10.178 9.649 1.00 0.00 H new ATOM 0 HD21 ASN A 58 6.730 10.026 10.070 1.00 0.00 H new ATOM 0 HD22 ASN A 58 5.152 9.284 10.357 1.00 0.00 H new ATOM 945 N LEU A 59 1.996 7.878 7.298 1.00 0.00 N ATOM 946 CA LEU A 59 0.787 7.070 7.410 1.00 0.00 C ATOM 947 C LEU A 59 0.077 7.333 8.734 1.00 0.00 C ATOM 948 O LEU A 59 -1.150 7.273 8.817 1.00 0.00 O ATOM 949 CB LEU A 59 1.129 5.584 7.289 1.00 0.00 C ATOM 950 CG LEU A 59 1.769 5.148 5.970 1.00 0.00 C ATOM 951 CD1 LEU A 59 2.326 3.738 6.087 1.00 0.00 C ATOM 952 CD2 LEU A 59 0.761 5.232 4.834 1.00 0.00 C ATOM 0 H LEU A 59 2.795 7.388 6.895 1.00 0.00 H new ATOM 0 HA LEU A 59 0.117 7.350 6.597 1.00 0.00 H new ATOM 0 HB2 LEU A 59 1.805 5.320 8.102 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.215 5.008 7.434 1.00 0.00 H new ATOM 0 HG LEU A 59 2.594 5.825 5.748 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.777 3.445 5.139 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.081 3.709 6.873 1.00 0.00 H new ATOM 0 HD13 LEU A 59 1.519 3.047 6.333 1.00 0.00 H new ATOM 0 HD21 LEU A 59 1.234 4.918 3.904 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.085 4.579 5.049 1.00 0.00 H new ATOM 0 HD23 LEU A 59 0.410 6.259 4.734 1.00 0.00 H new ATOM 964 N LYS A 60 0.857 7.628 9.769 1.00 0.00 N ATOM 965 CA LYS A 60 0.304 7.904 11.090 1.00 0.00 C ATOM 966 C LYS A 60 -0.765 8.990 11.016 1.00 0.00 C ATOM 967 O LYS A 60 -0.476 10.136 10.677 1.00 0.00 O ATOM 968 CB LYS A 60 1.416 8.332 12.051 1.00 0.00 C ATOM 969 CG LYS A 60 1.049 8.170 13.516 1.00 0.00 C ATOM 970 CD LYS A 60 2.284 7.980 14.382 1.00 0.00 C ATOM 971 CE LYS A 60 2.015 8.369 15.827 1.00 0.00 C ATOM 972 NZ LYS A 60 0.917 7.559 16.425 1.00 0.00 N ATOM 0 H LYS A 60 1.874 7.682 9.718 1.00 0.00 H new ATOM 0 HA LYS A 60 -0.158 6.989 11.462 1.00 0.00 H new ATOM 0 HB2 LYS A 60 2.311 7.746 11.842 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.667 9.376 11.861 1.00 0.00 H new ATOM 0 HG2 LYS A 60 0.498 9.048 13.853 1.00 0.00 H new ATOM 0 HG3 LYS A 60 0.386 7.313 13.633 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.604 6.939 14.338 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.102 8.582 13.988 1.00 0.00 H new ATOM 0 HE2 LYS A 60 2.924 8.237 16.414 1.00 0.00 H new ATOM 0 HE3 LYS A 60 1.754 9.426 15.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 1.002 7.570 17.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -0.001 7.961 16.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 0.983 6.579 16.083 1.00 0.00 H new ATOM 986 N GLY A 61 -2.001 8.620 11.338 1.00 0.00 N ATOM 987 CA GLY A 61 -3.093 9.575 11.302 1.00 0.00 C ATOM 988 C GLY A 61 -3.894 9.492 10.018 1.00 0.00 C ATOM 989 O GLY A 61 -4.874 10.217 9.842 1.00 0.00 O ATOM 0 H GLY A 61 -2.265 7.677 11.623 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -3.754 9.399 12.151 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -2.694 10.583 11.413 1.00 0.00 H new ATOM 993 N CYS A 62 -3.476 8.609 9.118 1.00 0.00 N ATOM 994 CA CYS A 62 -4.160 8.437 7.841 1.00 0.00 C ATOM 995 C CYS A 62 -5.428 7.606 8.011 1.00 0.00 C ATOM 996 O CYS A 62 -5.714 7.110 9.100 1.00 0.00 O ATOM 997 CB CYS A 62 -3.230 7.769 6.827 1.00 0.00 C ATOM 998 SG CYS A 62 -2.994 5.997 7.098 1.00 0.00 S ATOM 0 H CYS A 62 -2.667 8.001 9.249 1.00 0.00 H new ATOM 0 HA CYS A 62 -4.441 9.423 7.471 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -3.632 7.922 5.825 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -2.259 8.263 6.860 1.00 0.00 H new ATOM 0 HG CYS A 62 -2.062 5.814 7.986 1.00 0.00 H new ATOM 1004 N GLU A 63 -6.184 7.461 6.928 1.00 0.00 N ATOM 1005 CA GLU A 63 -7.423 6.693 6.959 1.00 0.00 C ATOM 1006 C GLU A 63 -7.276 5.392 6.175 1.00 0.00 C ATOM 1007 O GLU A 63 -6.885 5.398 5.008 1.00 0.00 O ATOM 1008 CB GLU A 63 -8.576 7.519 6.386 1.00 0.00 C ATOM 1009 CG GLU A 63 -9.934 7.145 6.955 1.00 0.00 C ATOM 1010 CD GLU A 63 -10.911 8.304 6.944 1.00 0.00 C ATOM 1011 OE1 GLU A 63 -10.614 9.336 7.583 1.00 0.00 O ATOM 1012 OE2 GLU A 63 -11.972 8.181 6.297 1.00 0.00 O ATOM 0 H GLU A 63 -5.961 7.865 6.018 1.00 0.00 H new ATOM 0 HA GLU A 63 -7.643 6.448 7.998 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -8.388 8.575 6.582 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -8.598 7.394 5.303 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.350 6.319 6.379 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -9.810 6.789 7.978 1.00 0.00 H new ATOM 1019 N VAL A 64 -7.591 4.277 6.826 1.00 0.00 N ATOM 1020 CA VAL A 64 -7.495 2.967 6.192 1.00 0.00 C ATOM 1021 C VAL A 64 -8.874 2.435 5.818 1.00 0.00 C ATOM 1022 O VAL A 64 -9.680 2.104 6.688 1.00 0.00 O ATOM 1023 CB VAL A 64 -6.795 1.948 7.110 1.00 0.00 C ATOM 1024 CG1 VAL A 64 -6.765 0.574 6.458 1.00 0.00 C ATOM 1025 CG2 VAL A 64 -5.389 2.417 7.451 1.00 0.00 C ATOM 0 H VAL A 64 -7.915 4.254 7.793 1.00 0.00 H new ATOM 0 HA VAL A 64 -6.901 3.097 5.287 1.00 0.00 H new ATOM 0 HB VAL A 64 -7.362 1.871 8.038 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -6.267 -0.133 7.121 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -7.785 0.238 6.270 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -6.222 0.631 5.515 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -4.909 1.685 8.100 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.809 2.525 6.534 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.440 3.378 7.963 1.00 0.00 H new ATOM 1035 N VAL A 65 -9.140 2.356 4.518 1.00 0.00 N ATOM 1036 CA VAL A 65 -10.421 1.862 4.028 1.00 0.00 C ATOM 1037 C VAL A 65 -10.232 0.663 3.106 1.00 0.00 C ATOM 1038 O VAL A 65 -9.902 0.800 1.928 1.00 0.00 O ATOM 1039 CB VAL A 65 -11.194 2.960 3.273 1.00 0.00 C ATOM 1040 CG1 VAL A 65 -12.573 2.460 2.868 1.00 0.00 C ATOM 1041 CG2 VAL A 65 -11.302 4.216 4.124 1.00 0.00 C ATOM 0 H VAL A 65 -8.485 2.628 3.785 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.998 1.557 4.901 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.644 3.210 2.366 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -13.104 3.249 2.336 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -12.469 1.591 2.218 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -13.135 2.181 3.759 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -11.851 4.981 3.575 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -11.829 3.984 5.049 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.303 4.584 4.358 1.00 0.00 H new ATOM 1051 N PRO A 66 -10.446 -0.543 3.652 1.00 0.00 N ATOM 1052 CA PRO A 66 -10.306 -1.791 2.896 1.00 0.00 C ATOM 1053 C PRO A 66 -11.403 -1.961 1.851 1.00 0.00 C ATOM 1054 O PRO A 66 -12.591 -1.925 2.172 1.00 0.00 O ATOM 1055 CB PRO A 66 -10.420 -2.873 3.972 1.00 0.00 C ATOM 1056 CG PRO A 66 -11.211 -2.239 5.064 1.00 0.00 C ATOM 1057 CD PRO A 66 -10.841 -0.782 5.051 1.00 0.00 C ATOM 0 HA PRO A 66 -9.372 -1.825 2.336 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -10.918 -3.763 3.587 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -9.437 -3.185 4.325 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -12.280 -2.372 4.899 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -10.979 -2.692 6.028 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -11.680 -0.152 5.345 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -10.025 -0.568 5.741 1.00 0.00 H new ATOM 1065 N ASP A 67 -10.998 -2.147 0.599 1.00 0.00 N ATOM 1066 CA ASP A 67 -11.947 -2.325 -0.494 1.00 0.00 C ATOM 1067 C ASP A 67 -11.710 -3.652 -1.208 1.00 0.00 C ATOM 1068 O ASP A 67 -11.829 -3.741 -2.430 1.00 0.00 O ATOM 1069 CB ASP A 67 -11.834 -1.169 -1.488 1.00 0.00 C ATOM 1070 CG ASP A 67 -12.415 0.121 -0.944 1.00 0.00 C ATOM 1071 OD1 ASP A 67 -11.870 0.644 0.051 1.00 0.00 O ATOM 1072 OD2 ASP A 67 -13.415 0.609 -1.513 1.00 0.00 O ATOM 0 H ASP A 67 -10.019 -2.178 0.316 1.00 0.00 H new ATOM 0 HA ASP A 67 -12.952 -2.334 -0.073 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -10.786 -1.013 -1.742 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -12.349 -1.435 -2.411 1.00 0.00 H new ATOM 1077 N VAL A 68 -11.374 -4.682 -0.438 1.00 0.00 N ATOM 1078 CA VAL A 68 -11.121 -6.004 -0.997 1.00 0.00 C ATOM 1079 C VAL A 68 -12.408 -6.814 -1.097 1.00 0.00 C ATOM 1080 O VAL A 68 -13.142 -6.956 -0.120 1.00 0.00 O ATOM 1081 CB VAL A 68 -10.100 -6.786 -0.148 1.00 0.00 C ATOM 1082 CG1 VAL A 68 -10.521 -6.802 1.313 1.00 0.00 C ATOM 1083 CG2 VAL A 68 -9.939 -8.202 -0.681 1.00 0.00 C ATOM 0 H VAL A 68 -11.271 -4.626 0.575 1.00 0.00 H new ATOM 0 HA VAL A 68 -10.712 -5.852 -1.996 1.00 0.00 H new ATOM 0 HB VAL A 68 -9.135 -6.284 -0.217 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -9.788 -7.359 1.897 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -10.581 -5.779 1.686 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -11.497 -7.279 1.405 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -9.214 -8.741 -0.070 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -10.899 -8.716 -0.643 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.588 -8.165 -1.712 1.00 0.00 H new ATOM 1093 N ASN A 69 -12.676 -7.344 -2.286 1.00 0.00 N ATOM 1094 CA ASN A 69 -13.876 -8.140 -2.515 1.00 0.00 C ATOM 1095 C ASN A 69 -13.515 -9.542 -2.997 1.00 0.00 C ATOM 1096 O ASN A 69 -13.613 -9.846 -4.186 1.00 0.00 O ATOM 1097 CB ASN A 69 -14.781 -7.454 -3.541 1.00 0.00 C ATOM 1098 CG ASN A 69 -16.248 -7.774 -3.323 1.00 0.00 C ATOM 1099 OD1 ASN A 69 -16.653 -8.169 -2.230 1.00 0.00 O ATOM 1100 ND2 ASN A 69 -17.051 -7.604 -4.367 1.00 0.00 N ATOM 0 H ASN A 69 -12.078 -7.237 -3.106 1.00 0.00 H new ATOM 0 HA ASN A 69 -14.410 -8.226 -1.569 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -14.635 -6.375 -3.486 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -14.489 -7.765 -4.544 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -18.048 -7.803 -4.281 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -16.671 -7.274 -5.254 1.00 0.00 H new ATOM 1107 N VAL A 70 -13.097 -10.393 -2.065 1.00 0.00 N ATOM 1108 CA VAL A 70 -12.723 -11.763 -2.394 1.00 0.00 C ATOM 1109 C VAL A 70 -13.682 -12.365 -3.414 1.00 0.00 C ATOM 1110 O VAL A 70 -13.286 -13.178 -4.249 1.00 0.00 O ATOM 1111 CB VAL A 70 -12.701 -12.655 -1.138 1.00 0.00 C ATOM 1112 CG1 VAL A 70 -12.268 -14.069 -1.495 1.00 0.00 C ATOM 1113 CG2 VAL A 70 -11.786 -12.060 -0.078 1.00 0.00 C ATOM 0 H VAL A 70 -13.009 -10.158 -1.076 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.721 -11.724 -2.821 1.00 0.00 H new ATOM 0 HB VAL A 70 -13.710 -12.702 -0.729 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -12.258 -14.685 -0.596 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -12.967 -14.492 -2.217 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -11.268 -14.045 -1.929 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -11.783 -12.703 0.802 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -10.774 -11.981 -0.474 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -12.146 -11.069 0.198 1.00 0.00 H new ATOM 1123 N SER A 71 -14.946 -11.960 -3.342 1.00 0.00 N ATOM 1124 CA SER A 71 -15.963 -12.462 -4.258 1.00 0.00 C ATOM 1125 C SER A 71 -15.425 -12.529 -5.684 1.00 0.00 C ATOM 1126 O SER A 71 -15.619 -13.520 -6.387 1.00 0.00 O ATOM 1127 CB SER A 71 -17.206 -11.571 -4.212 1.00 0.00 C ATOM 1128 OG SER A 71 -16.854 -10.216 -3.988 1.00 0.00 O ATOM 0 H SER A 71 -15.290 -11.285 -2.659 1.00 0.00 H new ATOM 0 HA SER A 71 -16.234 -13.469 -3.943 1.00 0.00 H new ATOM 0 HB2 SER A 71 -17.754 -11.657 -5.150 1.00 0.00 H new ATOM 0 HB3 SER A 71 -17.873 -11.912 -3.420 1.00 0.00 H new ATOM 0 HG SER A 71 -16.916 -10.016 -3.031 1.00 0.00 H new ATOM 1134 N GLY A 72 -14.746 -11.466 -6.104 1.00 0.00 N ATOM 1135 CA GLY A 72 -14.190 -11.423 -7.444 1.00 0.00 C ATOM 1136 C GLY A 72 -12.675 -11.488 -7.445 1.00 0.00 C ATOM 1137 O GLY A 72 -12.037 -11.205 -8.459 1.00 0.00 O ATOM 0 H GLY A 72 -14.571 -10.634 -5.540 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -14.587 -12.255 -8.026 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -14.512 -10.506 -7.938 1.00 0.00 H new ATOM 1141 N GLN A 73 -12.099 -11.859 -6.306 1.00 0.00 N ATOM 1142 CA GLN A 73 -10.650 -11.957 -6.180 1.00 0.00 C ATOM 1143 C GLN A 73 -9.986 -10.615 -6.467 1.00 0.00 C ATOM 1144 O GLN A 73 -9.026 -10.536 -7.233 1.00 0.00 O ATOM 1145 CB GLN A 73 -10.105 -13.023 -7.132 1.00 0.00 C ATOM 1146 CG GLN A 73 -10.630 -14.421 -6.846 1.00 0.00 C ATOM 1147 CD GLN A 73 -11.966 -14.690 -7.511 1.00 0.00 C ATOM 1148 OE1 GLN A 73 -12.025 -15.070 -8.681 1.00 0.00 O ATOM 1149 NE2 GLN A 73 -13.048 -14.493 -6.767 1.00 0.00 N ATOM 0 H GLN A 73 -12.613 -12.096 -5.458 1.00 0.00 H new ATOM 0 HA GLN A 73 -10.419 -12.244 -5.154 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -10.362 -12.750 -8.155 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.017 -13.033 -7.069 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -9.902 -15.156 -7.191 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -10.731 -14.554 -5.769 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -12.953 -14.178 -5.802 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -13.975 -14.657 -7.161 1.00 0.00 H new ATOM 1158 N LYS A 74 -10.505 -9.560 -5.847 1.00 0.00 N ATOM 1159 CA LYS A 74 -9.963 -8.219 -6.035 1.00 0.00 C ATOM 1160 C LYS A 74 -9.571 -7.599 -4.697 1.00 0.00 C ATOM 1161 O LYS A 74 -10.431 -7.226 -3.899 1.00 0.00 O ATOM 1162 CB LYS A 74 -10.985 -7.328 -6.743 1.00 0.00 C ATOM 1163 CG LYS A 74 -10.511 -5.898 -6.942 1.00 0.00 C ATOM 1164 CD LYS A 74 -11.680 -4.932 -7.041 1.00 0.00 C ATOM 1165 CE LYS A 74 -12.355 -5.012 -8.402 1.00 0.00 C ATOM 1166 NZ LYS A 74 -11.485 -4.476 -9.485 1.00 0.00 N ATOM 0 H LYS A 74 -11.300 -9.608 -5.210 1.00 0.00 H new ATOM 0 HA LYS A 74 -9.070 -8.298 -6.655 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -11.222 -7.762 -7.714 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -11.909 -7.319 -6.165 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -9.868 -5.608 -6.111 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -9.909 -5.836 -7.848 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -12.406 -5.157 -6.260 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -11.329 -3.915 -6.867 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -12.610 -6.049 -8.621 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -13.290 -4.453 -8.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -12.064 -4.263 -10.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -11.018 -3.607 -9.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -10.765 -5.184 -9.734 1.00 0.00 H new ATOM 1180 N PHE A 75 -8.268 -7.491 -4.459 1.00 0.00 N ATOM 1181 CA PHE A 75 -7.763 -6.915 -3.218 1.00 0.00 C ATOM 1182 C PHE A 75 -7.232 -5.503 -3.451 1.00 0.00 C ATOM 1183 O PHE A 75 -6.253 -5.308 -4.172 1.00 0.00 O ATOM 1184 CB PHE A 75 -6.659 -7.798 -2.634 1.00 0.00 C ATOM 1185 CG PHE A 75 -6.975 -9.265 -2.683 1.00 0.00 C ATOM 1186 CD1 PHE A 75 -6.927 -9.958 -3.882 1.00 0.00 C ATOM 1187 CD2 PHE A 75 -7.322 -9.952 -1.531 1.00 0.00 C ATOM 1188 CE1 PHE A 75 -7.219 -11.308 -3.930 1.00 0.00 C ATOM 1189 CE2 PHE A 75 -7.614 -11.302 -1.572 1.00 0.00 C ATOM 1190 CZ PHE A 75 -7.562 -11.981 -2.774 1.00 0.00 C ATOM 0 H PHE A 75 -7.543 -7.795 -5.109 1.00 0.00 H new ATOM 0 HA PHE A 75 -8.589 -6.861 -2.508 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -5.733 -7.616 -3.179 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -6.482 -7.507 -1.599 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -6.658 -9.437 -4.789 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -7.365 -9.426 -0.589 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -7.179 -11.836 -4.871 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -7.882 -11.825 -0.666 1.00 0.00 H new ATOM 0 HZ PHE A 75 -7.789 -13.036 -2.810 1.00 0.00 H new ATOM 1200 N CYS A 76 -7.884 -4.523 -2.835 1.00 0.00 N ATOM 1201 CA CYS A 76 -7.479 -3.129 -2.975 1.00 0.00 C ATOM 1202 C CYS A 76 -7.304 -2.474 -1.609 1.00 0.00 C ATOM 1203 O CYS A 76 -7.795 -2.980 -0.600 1.00 0.00 O ATOM 1204 CB CYS A 76 -8.512 -2.356 -3.797 1.00 0.00 C ATOM 1205 SG CYS A 76 -7.968 -0.708 -4.304 1.00 0.00 S ATOM 0 H CYS A 76 -8.695 -4.668 -2.234 1.00 0.00 H new ATOM 0 HA CYS A 76 -6.521 -3.105 -3.494 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -8.760 -2.935 -4.687 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -9.428 -2.261 -3.213 1.00 0.00 H new ATOM 0 HG CYS A 76 -6.669 -0.673 -4.344 1.00 0.00 H new ATOM 1211 N ILE A 77 -6.601 -1.347 -1.585 1.00 0.00 N ATOM 1212 CA ILE A 77 -6.361 -0.623 -0.343 1.00 0.00 C ATOM 1213 C ILE A 77 -6.336 0.883 -0.580 1.00 0.00 C ATOM 1214 O ILE A 77 -5.369 1.422 -1.118 1.00 0.00 O ATOM 1215 CB ILE A 77 -5.034 -1.051 0.310 1.00 0.00 C ATOM 1216 CG1 ILE A 77 -4.933 -2.576 0.361 1.00 0.00 C ATOM 1217 CG2 ILE A 77 -4.917 -0.460 1.708 1.00 0.00 C ATOM 1218 CD1 ILE A 77 -3.555 -3.079 0.729 1.00 0.00 C ATOM 0 H ILE A 77 -6.188 -0.915 -2.412 1.00 0.00 H new ATOM 0 HA ILE A 77 -7.183 -0.868 0.329 1.00 0.00 H new ATOM 0 HB ILE A 77 -4.210 -0.672 -0.295 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -5.655 -2.956 1.084 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -5.212 -2.983 -0.611 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -3.974 -0.771 2.157 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -4.948 0.628 1.647 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -5.745 -0.813 2.323 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -3.558 -4.169 0.746 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.831 -2.729 -0.007 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -3.281 -2.702 1.714 1.00 0.00 H new ATOM 1230 N LYS A 78 -7.406 1.558 -0.174 1.00 0.00 N ATOM 1231 CA LYS A 78 -7.508 3.003 -0.338 1.00 0.00 C ATOM 1232 C LYS A 78 -6.652 3.730 0.694 1.00 0.00 C ATOM 1233 O LYS A 78 -6.871 3.600 1.900 1.00 0.00 O ATOM 1234 CB LYS A 78 -8.966 3.451 -0.213 1.00 0.00 C ATOM 1235 CG LYS A 78 -9.152 4.954 -0.316 1.00 0.00 C ATOM 1236 CD LYS A 78 -10.476 5.395 0.285 1.00 0.00 C ATOM 1237 CE LYS A 78 -10.457 6.871 0.654 1.00 0.00 C ATOM 1238 NZ LYS A 78 -11.814 7.371 1.010 1.00 0.00 N ATOM 0 H LYS A 78 -8.216 1.127 0.272 1.00 0.00 H new ATOM 0 HA LYS A 78 -7.141 3.256 -1.333 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -9.554 2.966 -0.992 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -9.361 3.109 0.744 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -8.333 5.459 0.196 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -9.108 5.256 -1.362 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -11.280 5.207 -0.426 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -10.690 4.800 1.173 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -9.781 7.027 1.494 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -10.065 7.449 -0.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -11.759 8.380 1.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -12.454 7.246 0.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -12.178 6.836 1.824 1.00 0.00 H new ATOM 1252 N LEU A 79 -5.677 4.495 0.215 1.00 0.00 N ATOM 1253 CA LEU A 79 -4.789 5.244 1.097 1.00 0.00 C ATOM 1254 C LEU A 79 -5.168 6.721 1.125 1.00 0.00 C ATOM 1255 O LEU A 79 -4.959 7.446 0.151 1.00 0.00 O ATOM 1256 CB LEU A 79 -3.336 5.087 0.644 1.00 0.00 C ATOM 1257 CG LEU A 79 -2.570 3.907 1.241 1.00 0.00 C ATOM 1258 CD1 LEU A 79 -3.248 2.594 0.882 1.00 0.00 C ATOM 1259 CD2 LEU A 79 -1.125 3.912 0.764 1.00 0.00 C ATOM 0 H LEU A 79 -5.481 4.613 -0.779 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.894 4.842 2.105 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.324 4.990 -0.442 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -2.799 6.004 0.889 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.573 4.009 2.326 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -2.689 1.765 1.316 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -4.265 2.590 1.275 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -3.277 2.484 -0.202 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.595 3.065 1.199 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.100 3.836 -0.323 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.643 4.839 1.074 1.00 0.00 H new ATOM 1271 N LEU A 80 -5.724 7.163 2.248 1.00 0.00 N ATOM 1272 CA LEU A 80 -6.130 8.555 2.405 1.00 0.00 C ATOM 1273 C LEU A 80 -5.318 9.240 3.499 1.00 0.00 C ATOM 1274 O LEU A 80 -5.406 8.875 4.672 1.00 0.00 O ATOM 1275 CB LEU A 80 -7.622 8.638 2.733 1.00 0.00 C ATOM 1276 CG LEU A 80 -8.346 9.897 2.256 1.00 0.00 C ATOM 1277 CD1 LEU A 80 -8.612 9.826 0.760 1.00 0.00 C ATOM 1278 CD2 LEU A 80 -9.646 10.088 3.023 1.00 0.00 C ATOM 0 H LEU A 80 -5.904 6.577 3.063 1.00 0.00 H new ATOM 0 HA LEU A 80 -5.942 9.070 1.463 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.118 7.771 2.297 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -7.740 8.563 3.814 1.00 0.00 H new ATOM 0 HG LEU A 80 -7.704 10.757 2.449 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -9.128 10.731 0.439 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -7.666 9.739 0.226 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -9.233 8.957 0.542 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -10.148 10.989 2.670 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -10.293 9.226 2.862 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -9.430 10.186 4.087 1.00 0.00 H new ATOM 1290 N VAL A 81 -4.529 10.236 3.109 1.00 0.00 N ATOM 1291 CA VAL A 81 -3.704 10.974 4.057 1.00 0.00 C ATOM 1292 C VAL A 81 -3.984 12.471 3.980 1.00 0.00 C ATOM 1293 O VAL A 81 -3.778 13.114 2.951 1.00 0.00 O ATOM 1294 CB VAL A 81 -2.204 10.729 3.806 1.00 0.00 C ATOM 1295 CG1 VAL A 81 -1.360 11.566 4.755 1.00 0.00 C ATOM 1296 CG2 VAL A 81 -1.875 9.251 3.947 1.00 0.00 C ATOM 0 H VAL A 81 -4.444 10.550 2.142 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.962 10.610 5.052 1.00 0.00 H new ATOM 0 HB VAL A 81 -1.969 11.033 2.786 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -0.303 11.380 4.563 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.576 12.623 4.599 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.595 11.296 5.785 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.811 9.096 3.766 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -2.124 8.917 4.954 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.453 8.679 3.222 1.00 0.00 H new ATOM 1306 N PRO A 82 -4.464 13.041 5.095 1.00 0.00 N ATOM 1307 CA PRO A 82 -4.782 14.470 5.180 1.00 0.00 C ATOM 1308 C PRO A 82 -3.533 15.344 5.154 1.00 0.00 C ATOM 1309 O PRO A 82 -2.524 15.020 5.781 1.00 0.00 O ATOM 1310 CB PRO A 82 -5.495 14.595 6.529 1.00 0.00 C ATOM 1311 CG PRO A 82 -4.984 13.452 7.335 1.00 0.00 C ATOM 1312 CD PRO A 82 -4.735 12.335 6.359 1.00 0.00 C ATOM 0 HA PRO A 82 -5.381 14.806 4.333 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -5.272 15.548 7.008 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -6.577 14.544 6.411 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -4.068 13.723 7.860 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -5.709 13.154 8.093 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -3.891 11.716 6.663 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -5.599 11.676 6.274 1.00 0.00 H new ATOM 1320 N SER A 83 -3.607 16.453 4.425 1.00 0.00 N ATOM 1321 CA SER A 83 -2.480 17.372 4.315 1.00 0.00 C ATOM 1322 C SER A 83 -2.921 18.807 4.587 1.00 0.00 C ATOM 1323 O SER A 83 -4.050 19.202 4.296 1.00 0.00 O ATOM 1324 CB SER A 83 -1.850 17.275 2.925 1.00 0.00 C ATOM 1325 OG SER A 83 -0.939 16.192 2.852 1.00 0.00 O ATOM 0 H SER A 83 -4.435 16.737 3.902 1.00 0.00 H new ATOM 0 HA SER A 83 -1.739 17.090 5.063 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.632 17.148 2.176 1.00 0.00 H new ATOM 0 HB3 SER A 83 -1.333 18.206 2.691 1.00 0.00 H new ATOM 0 HG SER A 83 -0.551 16.151 1.953 1.00 0.00 H new ATOM 1331 N PRO A 84 -2.009 19.607 5.160 1.00 0.00 N ATOM 1332 CA PRO A 84 -2.280 21.010 5.484 1.00 0.00 C ATOM 1333 C PRO A 84 -2.403 21.880 4.238 1.00 0.00 C ATOM 1334 O PRO A 84 -2.708 23.069 4.327 1.00 0.00 O ATOM 1335 CB PRO A 84 -1.058 21.426 6.307 1.00 0.00 C ATOM 1336 CG PRO A 84 0.027 20.507 5.865 1.00 0.00 C ATOM 1337 CD PRO A 84 -0.644 19.202 5.534 1.00 0.00 C ATOM 0 HA PRO A 84 -3.227 21.131 6.010 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -0.794 22.468 6.124 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -1.249 21.328 7.376 1.00 0.00 H new ATOM 0 HG2 PRO A 84 0.549 20.909 4.996 1.00 0.00 H new ATOM 0 HG3 PRO A 84 0.771 20.375 6.651 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -0.139 18.686 4.717 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -0.645 18.523 6.387 1.00 0.00 H new ATOM 1345 N GLU A 85 -2.165 21.279 3.076 1.00 0.00 N ATOM 1346 CA GLU A 85 -2.249 22.000 1.812 1.00 0.00 C ATOM 1347 C GLU A 85 -3.154 21.266 0.826 1.00 0.00 C ATOM 1348 O GLU A 85 -3.821 21.886 -0.001 1.00 0.00 O ATOM 1349 CB GLU A 85 -0.856 22.178 1.207 1.00 0.00 C ATOM 1350 CG GLU A 85 0.062 23.056 2.040 1.00 0.00 C ATOM 1351 CD GLU A 85 1.509 22.980 1.592 1.00 0.00 C ATOM 1352 OE1 GLU A 85 1.747 22.853 0.373 1.00 0.00 O ATOM 1353 OE2 GLU A 85 2.403 23.046 2.461 1.00 0.00 O ATOM 0 H GLU A 85 -1.913 20.295 2.984 1.00 0.00 H new ATOM 0 HA GLU A 85 -2.678 22.982 2.011 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -0.395 21.198 1.084 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -0.954 22.611 0.212 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -0.279 24.090 1.981 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -0.007 22.757 3.086 1.00 0.00 H new ATOM 1360 N GLY A 86 -3.170 19.940 0.921 1.00 0.00 N ATOM 1361 CA GLY A 86 -3.995 19.143 0.032 1.00 0.00 C ATOM 1362 C GLY A 86 -3.788 17.654 0.229 1.00 0.00 C ATOM 1363 O GLY A 86 -2.871 17.067 -0.345 1.00 0.00 O ATOM 0 H GLY A 86 -2.627 19.404 1.597 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -5.044 19.386 0.199 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -3.768 19.405 -1.001 1.00 0.00 H new ATOM 1367 N MET A 87 -4.641 17.042 1.044 1.00 0.00 N ATOM 1368 CA MET A 87 -4.546 15.612 1.315 1.00 0.00 C ATOM 1369 C MET A 87 -4.246 14.835 0.037 1.00 0.00 C ATOM 1370 O MET A 87 -4.397 15.357 -1.067 1.00 0.00 O ATOM 1371 CB MET A 87 -5.846 15.103 1.942 1.00 0.00 C ATOM 1372 CG MET A 87 -6.981 14.946 0.943 1.00 0.00 C ATOM 1373 SD MET A 87 -8.576 14.676 1.741 1.00 0.00 S ATOM 1374 CE MET A 87 -8.304 13.081 2.510 1.00 0.00 C ATOM 0 H MET A 87 -5.405 17.513 1.528 1.00 0.00 H new ATOM 0 HA MET A 87 -3.726 15.454 2.016 1.00 0.00 H new ATOM 0 HB2 MET A 87 -5.657 14.141 2.420 1.00 0.00 H new ATOM 0 HB3 MET A 87 -6.156 15.793 2.727 1.00 0.00 H new ATOM 0 HG2 MET A 87 -7.037 15.838 0.320 1.00 0.00 H new ATOM 0 HG3 MET A 87 -6.764 14.108 0.281 1.00 0.00 H new ATOM 0 HE1 MET A 87 -9.198 12.785 3.059 1.00 0.00 H new ATOM 0 HE2 MET A 87 -8.087 12.339 1.742 1.00 0.00 H new ATOM 0 HE3 MET A 87 -7.461 13.148 3.198 1.00 0.00 H new ATOM 1384 N SER A 88 -3.820 13.586 0.196 1.00 0.00 N ATOM 1385 CA SER A 88 -3.494 12.739 -0.945 1.00 0.00 C ATOM 1386 C SER A 88 -4.291 11.439 -0.902 1.00 0.00 C ATOM 1387 O SER A 88 -4.477 10.849 0.162 1.00 0.00 O ATOM 1388 CB SER A 88 -1.996 12.431 -0.968 1.00 0.00 C ATOM 1389 OG SER A 88 -1.256 13.533 -1.465 1.00 0.00 O ATOM 0 H SER A 88 -3.693 13.138 1.104 1.00 0.00 H new ATOM 0 HA SER A 88 -3.760 13.279 -1.854 1.00 0.00 H new ATOM 0 HB2 SER A 88 -1.657 12.185 0.038 1.00 0.00 H new ATOM 0 HB3 SER A 88 -1.811 11.555 -1.590 1.00 0.00 H new ATOM 0 HG SER A 88 -0.455 13.208 -1.926 1.00 0.00 H new ATOM 1395 N GLU A 89 -4.759 10.999 -2.066 1.00 0.00 N ATOM 1396 CA GLU A 89 -5.537 9.770 -2.160 1.00 0.00 C ATOM 1397 C GLU A 89 -4.973 8.851 -3.241 1.00 0.00 C ATOM 1398 O GLU A 89 -5.054 9.154 -4.432 1.00 0.00 O ATOM 1399 CB GLU A 89 -7.003 10.089 -2.461 1.00 0.00 C ATOM 1400 CG GLU A 89 -7.912 8.872 -2.418 1.00 0.00 C ATOM 1401 CD GLU A 89 -9.358 9.234 -2.143 1.00 0.00 C ATOM 1402 OE1 GLU A 89 -9.608 10.366 -1.680 1.00 0.00 O ATOM 1403 OE2 GLU A 89 -10.240 8.385 -2.391 1.00 0.00 O ATOM 0 H GLU A 89 -4.613 11.475 -2.956 1.00 0.00 H new ATOM 0 HA GLU A 89 -5.474 9.256 -1.201 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -7.361 10.825 -1.741 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -7.071 10.548 -3.447 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -7.848 8.342 -3.368 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.560 8.187 -1.647 1.00 0.00 H new ATOM 1410 N ILE A 90 -4.402 7.729 -2.817 1.00 0.00 N ATOM 1411 CA ILE A 90 -3.826 6.766 -3.747 1.00 0.00 C ATOM 1412 C ILE A 90 -4.592 5.448 -3.719 1.00 0.00 C ATOM 1413 O ILE A 90 -5.144 5.061 -2.689 1.00 0.00 O ATOM 1414 CB ILE A 90 -2.344 6.493 -3.428 1.00 0.00 C ATOM 1415 CG1 ILE A 90 -1.488 7.706 -3.797 1.00 0.00 C ATOM 1416 CG2 ILE A 90 -1.863 5.254 -4.169 1.00 0.00 C ATOM 1417 CD1 ILE A 90 -1.456 8.772 -2.723 1.00 0.00 C ATOM 0 H ILE A 90 -4.326 7.464 -1.835 1.00 0.00 H new ATOM 0 HA ILE A 90 -3.900 7.205 -4.742 1.00 0.00 H new ATOM 0 HB ILE A 90 -2.245 6.314 -2.357 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -0.470 7.374 -3.999 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -1.870 8.143 -4.720 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -0.814 5.074 -3.934 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -2.457 4.393 -3.862 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -1.973 5.407 -5.243 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -0.831 9.602 -3.052 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -2.468 9.132 -2.537 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -1.046 8.351 -1.805 1.00 0.00 H new ATOM 1429 N TYR A 91 -4.620 4.763 -4.857 1.00 0.00 N ATOM 1430 CA TYR A 91 -5.318 3.487 -4.963 1.00 0.00 C ATOM 1431 C TYR A 91 -4.341 2.353 -5.257 1.00 0.00 C ATOM 1432 O TYR A 91 -3.555 2.425 -6.203 1.00 0.00 O ATOM 1433 CB TYR A 91 -6.383 3.555 -6.060 1.00 0.00 C ATOM 1434 CG TYR A 91 -7.568 4.423 -5.701 1.00 0.00 C ATOM 1435 CD1 TYR A 91 -8.262 4.227 -4.513 1.00 0.00 C ATOM 1436 CD2 TYR A 91 -7.994 5.437 -6.549 1.00 0.00 C ATOM 1437 CE1 TYR A 91 -9.346 5.016 -4.181 1.00 0.00 C ATOM 1438 CE2 TYR A 91 -9.076 6.232 -6.224 1.00 0.00 C ATOM 1439 CZ TYR A 91 -9.749 6.018 -5.039 1.00 0.00 C ATOM 1440 OH TYR A 91 -10.828 6.807 -4.712 1.00 0.00 O ATOM 0 H TYR A 91 -4.168 5.070 -5.718 1.00 0.00 H new ATOM 0 HA TYR A 91 -5.802 3.286 -4.007 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -5.927 3.937 -6.974 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -6.735 2.546 -6.276 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -7.948 3.444 -3.838 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -7.471 5.607 -7.478 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -9.875 4.849 -3.254 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -9.393 7.017 -6.894 1.00 0.00 H new ATOM 0 HH TYR A 91 -10.615 7.340 -3.918 1.00 0.00 H new ATOM 1450 N LEU A 92 -4.397 1.307 -4.441 1.00 0.00 N ATOM 1451 CA LEU A 92 -3.517 0.156 -4.612 1.00 0.00 C ATOM 1452 C LEU A 92 -4.323 -1.107 -4.902 1.00 0.00 C ATOM 1453 O LEU A 92 -5.221 -1.470 -4.142 1.00 0.00 O ATOM 1454 CB LEU A 92 -2.662 -0.048 -3.360 1.00 0.00 C ATOM 1455 CG LEU A 92 -2.011 1.208 -2.780 1.00 0.00 C ATOM 1456 CD1 LEU A 92 -1.290 0.885 -1.481 1.00 0.00 C ATOM 1457 CD2 LEU A 92 -1.051 1.825 -3.786 1.00 0.00 C ATOM 0 H LEU A 92 -5.042 1.232 -3.654 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.864 0.352 -5.462 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.285 -0.499 -2.588 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.876 -0.765 -3.594 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.796 1.933 -2.565 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.833 1.791 -1.083 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -2.003 0.491 -0.757 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.516 0.141 -1.670 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.597 2.718 -3.356 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.271 1.105 -4.034 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -1.596 2.095 -4.691 1.00 0.00 H new ATOM 1469 N ARG A 93 -3.995 -1.772 -6.005 1.00 0.00 N ATOM 1470 CA ARG A 93 -4.688 -2.994 -6.395 1.00 0.00 C ATOM 1471 C ARG A 93 -3.720 -4.172 -6.451 1.00 0.00 C ATOM 1472 O ARG A 93 -2.913 -4.281 -7.375 1.00 0.00 O ATOM 1473 CB ARG A 93 -5.365 -2.810 -7.754 1.00 0.00 C ATOM 1474 CG ARG A 93 -6.625 -3.643 -7.924 1.00 0.00 C ATOM 1475 CD ARG A 93 -7.000 -3.794 -9.390 1.00 0.00 C ATOM 1476 NE ARG A 93 -5.932 -4.417 -10.167 1.00 0.00 N ATOM 1477 CZ ARG A 93 -5.755 -5.731 -10.250 1.00 0.00 C ATOM 1478 NH1 ARG A 93 -6.571 -6.555 -9.608 1.00 0.00 N ATOM 1479 NH2 ARG A 93 -4.760 -6.223 -10.977 1.00 0.00 N ATOM 0 H ARG A 93 -3.254 -1.485 -6.644 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.449 -3.207 -5.644 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -5.615 -1.757 -7.886 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -4.658 -3.071 -8.541 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -6.473 -4.628 -7.483 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -7.448 -3.175 -7.383 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -7.906 -4.395 -9.472 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -7.228 -2.814 -9.809 1.00 0.00 H new ATOM 0 HE ARG A 93 -5.287 -3.810 -10.673 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -7.337 -6.181 -9.048 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -6.433 -7.563 -9.674 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -4.130 -5.592 -11.473 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -4.625 -7.232 -11.040 1.00 0.00 H new ATOM 1493 N CYS A 94 -3.808 -5.051 -5.459 1.00 0.00 N ATOM 1494 CA CYS A 94 -2.939 -6.221 -5.395 1.00 0.00 C ATOM 1495 C CYS A 94 -3.427 -7.313 -6.342 1.00 0.00 C ATOM 1496 O CYS A 94 -4.580 -7.304 -6.772 1.00 0.00 O ATOM 1497 CB CYS A 94 -2.879 -6.760 -3.964 1.00 0.00 C ATOM 1498 SG CYS A 94 -2.001 -5.683 -2.807 1.00 0.00 S ATOM 0 H CYS A 94 -4.472 -4.976 -4.688 1.00 0.00 H new ATOM 0 HA CYS A 94 -1.939 -5.917 -5.704 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -3.896 -6.913 -3.602 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -2.394 -7.736 -3.975 1.00 0.00 H new ATOM 0 HG CYS A 94 -0.989 -6.323 -2.301 1.00 0.00 H new ATOM 1504 N GLN A 95 -2.540 -8.249 -6.663 1.00 0.00 N ATOM 1505 CA GLN A 95 -2.881 -9.346 -7.562 1.00 0.00 C ATOM 1506 C GLN A 95 -3.434 -10.535 -6.784 1.00 0.00 C ATOM 1507 O GLN A 95 -4.386 -11.185 -7.218 1.00 0.00 O ATOM 1508 CB GLN A 95 -1.652 -9.774 -8.366 1.00 0.00 C ATOM 1509 CG GLN A 95 -0.496 -10.252 -7.502 1.00 0.00 C ATOM 1510 CD GLN A 95 0.849 -10.081 -8.180 1.00 0.00 C ATOM 1511 OE1 GLN A 95 0.945 -9.486 -9.254 1.00 0.00 O ATOM 1512 NE2 GLN A 95 1.898 -10.603 -7.555 1.00 0.00 N ATOM 0 H GLN A 95 -1.581 -8.270 -6.315 1.00 0.00 H new ATOM 0 HA GLN A 95 -3.651 -8.995 -8.248 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -1.937 -10.572 -9.052 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -1.316 -8.935 -8.975 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -0.498 -9.700 -6.562 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -0.643 -11.303 -7.255 1.00 0.00 H new ATOM 0 HE21 GLN A 95 1.773 -11.088 -6.666 1.00 0.00 H new ATOM 0 HE22 GLN A 95 2.829 -10.519 -7.963 1.00 0.00 H new ATOM 1521 N ASP A 96 -2.831 -10.815 -5.634 1.00 0.00 N ATOM 1522 CA ASP A 96 -3.265 -11.927 -4.794 1.00 0.00 C ATOM 1523 C ASP A 96 -3.417 -11.484 -3.343 1.00 0.00 C ATOM 1524 O ASP A 96 -2.925 -10.426 -2.952 1.00 0.00 O ATOM 1525 CB ASP A 96 -2.266 -13.082 -4.886 1.00 0.00 C ATOM 1526 CG ASP A 96 -2.680 -14.272 -4.044 1.00 0.00 C ATOM 1527 OD1 ASP A 96 -3.799 -14.787 -4.252 1.00 0.00 O ATOM 1528 OD2 ASP A 96 -1.885 -14.690 -3.176 1.00 0.00 O ATOM 0 H ASP A 96 -2.041 -10.288 -5.262 1.00 0.00 H new ATOM 0 HA ASP A 96 -4.236 -12.266 -5.155 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -2.169 -13.393 -5.926 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -1.284 -12.736 -4.563 1.00 0.00 H new ATOM 1533 N GLU A 97 -4.103 -12.300 -2.549 1.00 0.00 N ATOM 1534 CA GLU A 97 -4.322 -11.991 -1.141 1.00 0.00 C ATOM 1535 C GLU A 97 -2.995 -11.882 -0.395 1.00 0.00 C ATOM 1536 O GLU A 97 -2.864 -11.103 0.548 1.00 0.00 O ATOM 1537 CB GLU A 97 -5.199 -13.063 -0.490 1.00 0.00 C ATOM 1538 CG GLU A 97 -4.630 -14.467 -0.607 1.00 0.00 C ATOM 1539 CD GLU A 97 -5.513 -15.510 0.051 1.00 0.00 C ATOM 1540 OE1 GLU A 97 -6.177 -15.178 1.055 1.00 0.00 O ATOM 1541 OE2 GLU A 97 -5.539 -16.659 -0.439 1.00 0.00 O ATOM 0 H GLU A 97 -4.517 -13.180 -2.857 1.00 0.00 H new ATOM 0 HA GLU A 97 -4.832 -11.030 -1.082 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -5.332 -12.821 0.564 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -6.187 -13.041 -0.950 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -4.502 -14.717 -1.660 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -3.641 -14.493 -0.151 1.00 0.00 H new ATOM 1548 N GLN A 98 -2.015 -12.670 -0.826 1.00 0.00 N ATOM 1549 CA GLN A 98 -0.698 -12.663 -0.198 1.00 0.00 C ATOM 1550 C GLN A 98 -0.149 -11.244 -0.100 1.00 0.00 C ATOM 1551 O GLN A 98 0.070 -10.728 0.995 1.00 0.00 O ATOM 1552 CB GLN A 98 0.271 -13.545 -0.988 1.00 0.00 C ATOM 1553 CG GLN A 98 0.119 -15.029 -0.697 1.00 0.00 C ATOM 1554 CD GLN A 98 0.840 -15.452 0.567 1.00 0.00 C ATOM 1555 OE1 GLN A 98 0.853 -14.726 1.562 1.00 0.00 O ATOM 1556 NE2 GLN A 98 1.447 -16.633 0.536 1.00 0.00 N ATOM 0 H GLN A 98 -2.107 -13.320 -1.606 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.802 -13.062 0.811 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.118 -13.375 -2.054 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.293 -13.242 -0.761 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -0.940 -15.271 -0.605 1.00 0.00 H new ATOM 0 HG3 GLN A 98 0.505 -15.602 -1.540 1.00 0.00 H new ATOM 0 HE21 GLN A 98 1.411 -17.203 -0.309 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.949 -16.970 1.358 1.00 0.00 H new ATOM 1565 N GLN A 99 0.070 -10.619 -1.253 1.00 0.00 N ATOM 1566 CA GLN A 99 0.595 -9.259 -1.296 1.00 0.00 C ATOM 1567 C GLN A 99 -0.318 -8.299 -0.540 1.00 0.00 C ATOM 1568 O GLN A 99 0.152 -7.406 0.165 1.00 0.00 O ATOM 1569 CB GLN A 99 0.753 -8.796 -2.745 1.00 0.00 C ATOM 1570 CG GLN A 99 1.554 -7.512 -2.890 1.00 0.00 C ATOM 1571 CD GLN A 99 3.046 -7.735 -2.745 1.00 0.00 C ATOM 1572 OE1 GLN A 99 3.483 -8.731 -2.167 1.00 0.00 O ATOM 1573 NE2 GLN A 99 3.837 -6.808 -3.272 1.00 0.00 N ATOM 0 H GLN A 99 -0.108 -11.032 -2.168 1.00 0.00 H new ATOM 0 HA GLN A 99 1.572 -9.259 -0.813 1.00 0.00 H new ATOM 0 HB2 GLN A 99 1.240 -9.585 -3.319 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -0.235 -8.649 -3.180 1.00 0.00 H new ATOM 0 HG2 GLN A 99 1.350 -7.069 -3.865 1.00 0.00 H new ATOM 0 HG3 GLN A 99 1.223 -6.795 -2.139 1.00 0.00 H new ATOM 0 HE21 GLN A 99 3.431 -5.999 -3.742 1.00 0.00 H new ATOM 0 HE22 GLN A 99 4.850 -6.905 -3.207 1.00 0.00 H new ATOM 1582 N TYR A 100 -1.624 -8.489 -0.692 1.00 0.00 N ATOM 1583 CA TYR A 100 -2.603 -7.638 -0.026 1.00 0.00 C ATOM 1584 C TYR A 100 -2.315 -7.544 1.469 1.00 0.00 C ATOM 1585 O TYR A 100 -2.093 -6.457 2.002 1.00 0.00 O ATOM 1586 CB TYR A 100 -4.016 -8.179 -0.251 1.00 0.00 C ATOM 1587 CG TYR A 100 -5.024 -7.679 0.759 1.00 0.00 C ATOM 1588 CD1 TYR A 100 -5.336 -6.328 0.849 1.00 0.00 C ATOM 1589 CD2 TYR A 100 -5.664 -8.558 1.624 1.00 0.00 C ATOM 1590 CE1 TYR A 100 -6.255 -5.867 1.771 1.00 0.00 C ATOM 1591 CE2 TYR A 100 -6.586 -8.105 2.549 1.00 0.00 C ATOM 1592 CZ TYR A 100 -6.877 -6.759 2.619 1.00 0.00 C ATOM 1593 OH TYR A 100 -7.795 -6.304 3.538 1.00 0.00 O ATOM 0 H TYR A 100 -2.029 -9.225 -1.271 1.00 0.00 H new ATOM 0 HA TYR A 100 -2.531 -6.639 -0.455 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -4.348 -7.900 -1.251 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -3.989 -9.268 -0.216 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -4.851 -5.626 0.186 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -5.437 -9.613 1.573 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -6.485 -4.813 1.828 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -7.076 -8.802 3.213 1.00 0.00 H new ATOM 0 HH TYR A 100 -8.141 -7.060 4.057 1.00 0.00 H new ATOM 1603 N ALA A 101 -2.319 -8.691 2.140 1.00 0.00 N ATOM 1604 CA ALA A 101 -2.056 -8.739 3.573 1.00 0.00 C ATOM 1605 C ALA A 101 -0.728 -8.071 3.910 1.00 0.00 C ATOM 1606 O ALA A 101 -0.683 -7.109 4.677 1.00 0.00 O ATOM 1607 CB ALA A 101 -2.063 -10.180 4.062 1.00 0.00 C ATOM 0 H ALA A 101 -2.502 -9.600 1.714 1.00 0.00 H new ATOM 0 HA ALA A 101 -2.848 -8.190 4.082 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -1.865 -10.202 5.134 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -3.037 -10.627 3.864 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -1.291 -10.745 3.539 1.00 0.00 H new ATOM 1613 N ARG A 102 0.352 -8.587 3.332 1.00 0.00 N ATOM 1614 CA ARG A 102 1.682 -8.040 3.573 1.00 0.00 C ATOM 1615 C ARG A 102 1.639 -6.517 3.649 1.00 0.00 C ATOM 1616 O ARG A 102 1.936 -5.928 4.688 1.00 0.00 O ATOM 1617 CB ARG A 102 2.645 -8.480 2.469 1.00 0.00 C ATOM 1618 CG ARG A 102 3.017 -9.952 2.535 1.00 0.00 C ATOM 1619 CD ARG A 102 3.581 -10.444 1.211 1.00 0.00 C ATOM 1620 NE ARG A 102 4.025 -11.834 1.288 1.00 0.00 N ATOM 1621 CZ ARG A 102 4.552 -12.495 0.264 1.00 0.00 C ATOM 1622 NH1 ARG A 102 4.701 -11.896 -0.909 1.00 0.00 N ATOM 1623 NH2 ARG A 102 4.932 -13.757 0.412 1.00 0.00 N ATOM 0 H ARG A 102 0.332 -9.383 2.694 1.00 0.00 H new ATOM 0 HA ARG A 102 2.037 -8.423 4.530 1.00 0.00 H new ATOM 0 HB2 ARG A 102 2.192 -8.272 1.500 1.00 0.00 H new ATOM 0 HB3 ARG A 102 3.554 -7.881 2.532 1.00 0.00 H new ATOM 0 HG2 ARG A 102 3.752 -10.108 3.325 1.00 0.00 H new ATOM 0 HG3 ARG A 102 2.137 -10.539 2.798 1.00 0.00 H new ATOM 0 HD2 ARG A 102 2.821 -10.349 0.435 1.00 0.00 H new ATOM 0 HD3 ARG A 102 4.418 -9.812 0.916 1.00 0.00 H new ATOM 0 HE ARG A 102 3.925 -12.323 2.177 1.00 0.00 H new ATOM 0 HH11 ARG A 102 4.411 -10.925 -1.026 1.00 0.00 H new ATOM 0 HH12 ARG A 102 5.106 -12.406 -1.694 1.00 0.00 H new ATOM 0 HH21 ARG A 102 4.820 -14.221 1.313 1.00 0.00 H new ATOM 0 HH22 ARG A 102 5.337 -14.263 -0.376 1.00 0.00 H new ATOM 1637 N TRP A 103 1.268 -5.886 2.541 1.00 0.00 N ATOM 1638 CA TRP A 103 1.186 -4.431 2.481 1.00 0.00 C ATOM 1639 C TRP A 103 0.121 -3.906 3.438 1.00 0.00 C ATOM 1640 O TRP A 103 0.427 -3.176 4.381 1.00 0.00 O ATOM 1641 CB TRP A 103 0.877 -3.975 1.054 1.00 0.00 C ATOM 1642 CG TRP A 103 2.080 -3.965 0.160 1.00 0.00 C ATOM 1643 CD1 TRP A 103 2.611 -5.029 -0.511 1.00 0.00 C ATOM 1644 CD2 TRP A 103 2.902 -2.836 -0.158 1.00 0.00 C ATOM 1645 NE1 TRP A 103 3.714 -4.630 -1.228 1.00 0.00 N ATOM 1646 CE2 TRP A 103 3.913 -3.289 -1.028 1.00 0.00 C ATOM 1647 CE3 TRP A 103 2.882 -1.487 0.206 1.00 0.00 C ATOM 1648 CZ2 TRP A 103 4.892 -2.441 -1.537 1.00 0.00 C ATOM 1649 CZ3 TRP A 103 3.855 -0.646 -0.299 1.00 0.00 C ATOM 1650 CH2 TRP A 103 4.848 -1.125 -1.164 1.00 0.00 C ATOM 0 H TRP A 103 1.019 -6.359 1.672 1.00 0.00 H new ATOM 0 HA TRP A 103 2.151 -4.025 2.783 1.00 0.00 H new ATOM 0 HB2 TRP A 103 0.121 -4.633 0.626 1.00 0.00 H new ATOM 0 HB3 TRP A 103 0.448 -2.973 1.085 1.00 0.00 H new ATOM 0 HD1 TRP A 103 2.222 -6.036 -0.483 1.00 0.00 H new ATOM 0 HE1 TRP A 103 4.291 -5.234 -1.814 1.00 0.00 H new ATOM 0 HE3 TRP A 103 2.119 -1.108 0.870 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 5.659 -2.808 -2.203 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 3.850 0.398 -0.022 1.00 0.00 H new ATOM 0 HH2 TRP A 103 5.593 -0.442 -1.544 1.00 0.00 H new ATOM 1661 N MET A 104 -1.129 -4.281 3.189 1.00 0.00 N ATOM 1662 CA MET A 104 -2.238 -3.848 4.030 1.00 0.00 C ATOM 1663 C MET A 104 -1.828 -3.819 5.499 1.00 0.00 C ATOM 1664 O MET A 104 -1.767 -2.756 6.115 1.00 0.00 O ATOM 1665 CB MET A 104 -3.441 -4.776 3.843 1.00 0.00 C ATOM 1666 CG MET A 104 -4.539 -4.563 4.872 1.00 0.00 C ATOM 1667 SD MET A 104 -4.962 -2.823 5.086 1.00 0.00 S ATOM 1668 CE MET A 104 -6.436 -2.707 4.075 1.00 0.00 C ATOM 0 H MET A 104 -1.399 -4.884 2.412 1.00 0.00 H new ATOM 0 HA MET A 104 -2.516 -2.838 3.729 1.00 0.00 H new ATOM 0 HB2 MET A 104 -3.855 -4.625 2.846 1.00 0.00 H new ATOM 0 HB3 MET A 104 -3.102 -5.811 3.894 1.00 0.00 H new ATOM 0 HG2 MET A 104 -5.429 -5.114 4.568 1.00 0.00 H new ATOM 0 HG3 MET A 104 -4.220 -4.976 5.829 1.00 0.00 H new ATOM 0 HE1 MET A 104 -6.818 -1.687 4.105 1.00 0.00 H new ATOM 0 HE2 MET A 104 -6.193 -2.973 3.046 1.00 0.00 H new ATOM 0 HE3 MET A 104 -7.194 -3.390 4.458 1.00 0.00 H new ATOM 1678 N ALA A 105 -1.547 -4.994 6.053 1.00 0.00 N ATOM 1679 CA ALA A 105 -1.141 -5.102 7.449 1.00 0.00 C ATOM 1680 C ALA A 105 -0.165 -3.993 7.824 1.00 0.00 C ATOM 1681 O ALA A 105 -0.241 -3.428 8.915 1.00 0.00 O ATOM 1682 CB ALA A 105 -0.520 -6.466 7.714 1.00 0.00 C ATOM 0 H ALA A 105 -1.593 -5.884 5.557 1.00 0.00 H new ATOM 0 HA ALA A 105 -2.030 -4.993 8.070 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -0.221 -6.533 8.760 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -1.248 -7.246 7.494 1.00 0.00 H new ATOM 0 HB3 ALA A 105 0.355 -6.597 7.078 1.00 0.00 H new ATOM 1688 N GLY A 106 0.754 -3.685 6.913 1.00 0.00 N ATOM 1689 CA GLY A 106 1.732 -2.645 7.168 1.00 0.00 C ATOM 1690 C GLY A 106 1.097 -1.278 7.331 1.00 0.00 C ATOM 1691 O GLY A 106 1.403 -0.553 8.278 1.00 0.00 O ATOM 0 H GLY A 106 0.838 -4.138 6.003 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.293 -2.891 8.070 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.447 -2.614 6.346 1.00 0.00 H new ATOM 1695 N CYS A 107 0.212 -0.925 6.405 1.00 0.00 N ATOM 1696 CA CYS A 107 -0.466 0.366 6.449 1.00 0.00 C ATOM 1697 C CYS A 107 -1.260 0.519 7.742 1.00 0.00 C ATOM 1698 O CYS A 107 -1.269 1.587 8.354 1.00 0.00 O ATOM 1699 CB CYS A 107 -1.397 0.517 5.244 1.00 0.00 C ATOM 1700 SG CYS A 107 -0.535 0.740 3.670 1.00 0.00 S ATOM 0 H CYS A 107 -0.053 -1.514 5.615 1.00 0.00 H new ATOM 0 HA CYS A 107 0.292 1.149 6.415 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -2.032 -0.366 5.176 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -2.054 1.371 5.411 1.00 0.00 H new ATOM 0 HG CYS A 107 -1.386 0.644 2.692 1.00 0.00 H new ATOM 1706 N ARG A 108 -1.927 -0.555 8.152 1.00 0.00 N ATOM 1707 CA ARG A 108 -2.727 -0.539 9.371 1.00 0.00 C ATOM 1708 C ARG A 108 -1.841 -0.355 10.599 1.00 0.00 C ATOM 1709 O ARG A 108 -2.225 0.312 11.561 1.00 0.00 O ATOM 1710 CB ARG A 108 -3.529 -1.836 9.497 1.00 0.00 C ATOM 1711 CG ARG A 108 -4.754 -1.883 8.598 1.00 0.00 C ATOM 1712 CD ARG A 108 -5.212 -3.313 8.356 1.00 0.00 C ATOM 1713 NE ARG A 108 -5.430 -4.037 9.606 1.00 0.00 N ATOM 1714 CZ ARG A 108 -5.836 -5.301 9.662 1.00 0.00 C ATOM 1715 NH1 ARG A 108 -6.067 -5.977 8.545 1.00 0.00 N ATOM 1716 NH2 ARG A 108 -6.012 -5.891 10.837 1.00 0.00 N ATOM 0 H ARG A 108 -1.929 -1.447 7.658 1.00 0.00 H new ATOM 0 HA ARG A 108 -3.417 0.303 9.312 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -2.881 -2.679 9.258 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -3.844 -1.960 10.533 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -5.563 -1.313 9.054 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -4.526 -1.406 7.645 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -6.135 -3.305 7.776 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -4.465 -3.837 7.759 1.00 0.00 H new ATOM 0 HE ARG A 108 -5.261 -3.545 10.484 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -5.933 -5.527 7.640 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -6.379 -6.947 8.591 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -5.836 -5.374 11.699 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -6.324 -6.861 10.879 1.00 0.00 H new ATOM 1730 N LEU A 109 -0.654 -0.952 10.561 1.00 0.00 N ATOM 1731 CA LEU A 109 0.287 -0.854 11.672 1.00 0.00 C ATOM 1732 C LEU A 109 0.831 0.565 11.802 1.00 0.00 C ATOM 1733 O LEU A 109 0.840 1.139 12.890 1.00 0.00 O ATOM 1734 CB LEU A 109 1.441 -1.839 11.476 1.00 0.00 C ATOM 1735 CG LEU A 109 1.079 -3.322 11.561 1.00 0.00 C ATOM 1736 CD1 LEU A 109 2.064 -4.159 10.759 1.00 0.00 C ATOM 1737 CD2 LEU A 109 1.043 -3.781 13.011 1.00 0.00 C ATOM 0 H LEU A 109 -0.321 -1.508 9.774 1.00 0.00 H new ATOM 0 HA LEU A 109 -0.245 -1.104 12.590 1.00 0.00 H new ATOM 0 HB2 LEU A 109 1.891 -1.651 10.501 1.00 0.00 H new ATOM 0 HB3 LEU A 109 2.204 -1.628 12.226 1.00 0.00 H new ATOM 0 HG LEU A 109 0.086 -3.458 11.134 1.00 0.00 H new ATOM 0 HD11 LEU A 109 1.790 -5.212 10.831 1.00 0.00 H new ATOM 0 HD12 LEU A 109 2.039 -3.849 9.714 1.00 0.00 H new ATOM 0 HD13 LEU A 109 3.069 -4.017 11.156 1.00 0.00 H new ATOM 0 HD21 LEU A 109 0.784 -4.839 13.051 1.00 0.00 H new ATOM 0 HD22 LEU A 109 2.022 -3.630 13.465 1.00 0.00 H new ATOM 0 HD23 LEU A 109 0.297 -3.203 13.557 1.00 0.00 H new ATOM 1749 N ALA A 110 1.282 1.125 10.684 1.00 0.00 N ATOM 1750 CA ALA A 110 1.823 2.478 10.672 1.00 0.00 C ATOM 1751 C ALA A 110 0.746 3.503 11.008 1.00 0.00 C ATOM 1752 O ALA A 110 1.026 4.536 11.615 1.00 0.00 O ATOM 1753 CB ALA A 110 2.444 2.786 9.317 1.00 0.00 C ATOM 0 H ALA A 110 1.283 0.662 9.775 1.00 0.00 H new ATOM 0 HA ALA A 110 2.597 2.540 11.437 1.00 0.00 H new ATOM 0 HB1 ALA A 110 2.844 3.800 9.322 1.00 0.00 H new ATOM 0 HB2 ALA A 110 3.249 2.079 9.117 1.00 0.00 H new ATOM 0 HB3 ALA A 110 1.684 2.700 8.540 1.00 0.00 H new ATOM 1759 N SER A 111 -0.488 3.212 10.607 1.00 0.00 N ATOM 1760 CA SER A 111 -1.607 4.111 10.862 1.00 0.00 C ATOM 1761 C SER A 111 -1.608 4.579 12.315 1.00 0.00 C ATOM 1762 O SER A 111 -1.736 5.771 12.596 1.00 0.00 O ATOM 1763 CB SER A 111 -2.931 3.417 10.537 1.00 0.00 C ATOM 1764 OG SER A 111 -4.018 4.320 10.639 1.00 0.00 O ATOM 0 H SER A 111 -0.738 2.360 10.104 1.00 0.00 H new ATOM 0 HA SER A 111 -1.494 4.983 10.218 1.00 0.00 H new ATOM 0 HB2 SER A 111 -2.891 3.004 9.529 1.00 0.00 H new ATOM 0 HB3 SER A 111 -3.084 2.580 11.219 1.00 0.00 H new ATOM 0 HG SER A 111 -4.853 3.853 10.425 1.00 0.00 H new ATOM 1770 N LYS A 112 -1.465 3.631 13.235 1.00 0.00 N ATOM 1771 CA LYS A 112 -1.448 3.943 14.659 1.00 0.00 C ATOM 1772 C LYS A 112 -0.030 4.240 15.134 1.00 0.00 C ATOM 1773 O LYS A 112 0.169 4.840 16.189 1.00 0.00 O ATOM 1774 CB LYS A 112 -2.034 2.780 15.463 1.00 0.00 C ATOM 1775 CG LYS A 112 -3.481 2.471 15.120 1.00 0.00 C ATOM 1776 CD LYS A 112 -4.423 3.527 15.674 1.00 0.00 C ATOM 1777 CE LYS A 112 -5.876 3.185 15.383 1.00 0.00 C ATOM 1778 NZ LYS A 112 -6.758 4.382 15.478 1.00 0.00 N ATOM 0 H LYS A 112 -1.359 2.640 13.020 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.059 4.832 14.819 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -1.430 1.889 15.290 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -1.963 3.012 16.526 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -3.595 2.412 14.038 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -3.751 1.494 15.522 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -4.278 3.617 16.751 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -4.182 4.496 15.238 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -5.955 2.754 14.385 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -6.218 2.425 16.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -7.740 4.107 15.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -6.703 4.779 16.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -6.448 5.097 14.790 1.00 0.00 H new ATOM 1792 N GLY A 113 0.954 3.816 14.347 1.00 0.00 N ATOM 1793 CA GLY A 113 2.342 4.048 14.704 1.00 0.00 C ATOM 1794 C GLY A 113 3.165 2.775 14.685 1.00 0.00 C ATOM 1795 O GLY A 113 4.368 2.810 14.425 1.00 0.00 O ATOM 0 H GLY A 113 0.815 3.316 13.469 1.00 0.00 H new ATOM 0 HA2 GLY A 113 2.777 4.769 14.011 1.00 0.00 H new ATOM 0 HA3 GLY A 113 2.389 4.493 15.698 1.00 0.00 H new ATOM 1799 N ARG A 114 2.517 1.649 14.962 1.00 0.00 N ATOM 1800 CA ARG A 114 3.199 0.360 14.979 1.00 0.00 C ATOM 1801 C ARG A 114 3.948 0.124 13.671 1.00 0.00 C ATOM 1802 O ARG A 114 3.684 0.782 12.664 1.00 0.00 O ATOM 1803 CB ARG A 114 2.193 -0.769 15.214 1.00 0.00 C ATOM 1804 CG ARG A 114 1.678 -0.839 16.642 1.00 0.00 C ATOM 1805 CD ARG A 114 0.696 -1.985 16.824 1.00 0.00 C ATOM 1806 NE ARG A 114 0.665 -2.465 18.204 1.00 0.00 N ATOM 1807 CZ ARG A 114 -0.059 -1.897 19.163 1.00 0.00 C ATOM 1808 NH1 ARG A 114 -0.807 -0.837 18.893 1.00 0.00 N ATOM 1809 NH2 ARG A 114 -0.035 -2.392 20.394 1.00 0.00 N ATOM 0 H ARG A 114 1.521 1.603 15.178 1.00 0.00 H new ATOM 0 HA ARG A 114 3.922 0.370 15.795 1.00 0.00 H new ATOM 0 HB2 ARG A 114 1.348 -0.638 14.538 1.00 0.00 H new ATOM 0 HB3 ARG A 114 2.661 -1.720 14.958 1.00 0.00 H new ATOM 0 HG2 ARG A 114 2.517 -0.965 17.327 1.00 0.00 H new ATOM 0 HG3 ARG A 114 1.193 0.102 16.902 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -0.302 -1.658 16.532 1.00 0.00 H new ATOM 0 HD3 ARG A 114 0.969 -2.806 16.161 1.00 0.00 H new ATOM 0 HE ARG A 114 1.229 -3.280 18.444 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -0.828 -0.455 17.947 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -1.362 -0.403 19.631 1.00 0.00 H new ATOM 0 HH21 ARG A 114 0.539 -3.208 20.604 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -0.591 -1.956 21.130 1.00 0.00 H new ATOM 1823 N THR A 115 4.885 -0.819 13.693 1.00 0.00 N ATOM 1824 CA THR A 115 5.674 -1.140 12.511 1.00 0.00 C ATOM 1825 C THR A 115 5.872 -2.645 12.374 1.00 0.00 C ATOM 1826 O THR A 115 5.754 -3.387 13.349 1.00 0.00 O ATOM 1827 CB THR A 115 7.053 -0.455 12.552 1.00 0.00 C ATOM 1828 OG1 THR A 115 7.904 -1.121 13.491 1.00 0.00 O ATOM 1829 CG2 THR A 115 6.917 1.011 12.935 1.00 0.00 C ATOM 0 H THR A 115 5.116 -1.374 14.517 1.00 0.00 H new ATOM 0 HA THR A 115 5.118 -0.769 11.650 1.00 0.00 H new ATOM 0 HB THR A 115 7.494 -0.516 11.557 1.00 0.00 H new ATOM 0 HG1 THR A 115 8.779 -0.680 13.509 1.00 0.00 H new ATOM 0 HG21 THR A 115 7.903 1.474 12.958 1.00 0.00 H new ATOM 0 HG22 THR A 115 6.293 1.522 12.202 1.00 0.00 H new ATOM 0 HG23 THR A 115 6.457 1.089 13.920 1.00 0.00 H new ATOM 1837 N MET A 116 6.174 -3.090 11.159 1.00 0.00 N ATOM 1838 CA MET A 116 6.390 -4.508 10.896 1.00 0.00 C ATOM 1839 C MET A 116 7.323 -5.118 11.937 1.00 0.00 C ATOM 1840 O MET A 116 7.192 -6.289 12.291 1.00 0.00 O ATOM 1841 CB MET A 116 6.972 -4.706 9.495 1.00 0.00 C ATOM 1842 CG MET A 116 6.033 -4.273 8.380 1.00 0.00 C ATOM 1843 SD MET A 116 6.487 -4.969 6.780 1.00 0.00 S ATOM 1844 CE MET A 116 7.690 -3.768 6.217 1.00 0.00 C ATOM 0 H MET A 116 6.275 -2.489 10.341 1.00 0.00 H new ATOM 0 HA MET A 116 5.426 -5.014 10.956 1.00 0.00 H new ATOM 0 HB2 MET A 116 7.902 -4.144 9.414 1.00 0.00 H new ATOM 0 HB3 MET A 116 7.223 -5.758 9.360 1.00 0.00 H new ATOM 0 HG2 MET A 116 5.016 -4.576 8.628 1.00 0.00 H new ATOM 0 HG3 MET A 116 6.033 -3.185 8.312 1.00 0.00 H new ATOM 0 HE1 MET A 116 7.434 -3.441 5.209 1.00 0.00 H new ATOM 0 HE2 MET A 116 7.688 -2.909 6.888 1.00 0.00 H new ATOM 0 HE3 MET A 116 8.681 -4.221 6.210 1.00 0.00 H new ATOM 1854 N ALA A 117 8.264 -4.316 12.424 1.00 0.00 N ATOM 1855 CA ALA A 117 9.218 -4.777 13.426 1.00 0.00 C ATOM 1856 C ALA A 117 8.517 -5.559 14.532 1.00 0.00 C ATOM 1857 O ALA A 117 9.075 -6.506 15.085 1.00 0.00 O ATOM 1858 CB ALA A 117 9.979 -3.598 14.012 1.00 0.00 C ATOM 0 H ALA A 117 8.386 -3.344 12.141 1.00 0.00 H new ATOM 0 HA ALA A 117 9.927 -5.445 12.937 1.00 0.00 H new ATOM 0 HB1 ALA A 117 10.687 -3.957 14.758 1.00 0.00 H new ATOM 0 HB2 ALA A 117 10.519 -3.082 13.218 1.00 0.00 H new ATOM 0 HB3 ALA A 117 9.277 -2.908 14.480 1.00 0.00 H new ATOM 1864 N ASP A 118 7.292 -5.155 14.850 1.00 0.00 N ATOM 1865 CA ASP A 118 6.514 -5.818 15.890 1.00 0.00 C ATOM 1866 C ASP A 118 6.040 -7.191 15.423 1.00 0.00 C ATOM 1867 O ASP A 118 5.431 -7.320 14.361 1.00 0.00 O ATOM 1868 CB ASP A 118 5.313 -4.958 16.286 1.00 0.00 C ATOM 1869 CG ASP A 118 4.711 -5.379 17.612 1.00 0.00 C ATOM 1870 OD1 ASP A 118 5.477 -5.792 18.507 1.00 0.00 O ATOM 1871 OD2 ASP A 118 3.473 -5.295 17.754 1.00 0.00 O ATOM 0 H ASP A 118 6.816 -4.372 14.402 1.00 0.00 H new ATOM 0 HA ASP A 118 7.157 -5.952 16.760 1.00 0.00 H new ATOM 0 HB2 ASP A 118 5.621 -3.914 16.345 1.00 0.00 H new ATOM 0 HB3 ASP A 118 4.552 -5.022 15.508 1.00 0.00 H new ATOM 1876 N SER A 119 6.325 -8.214 16.222 1.00 0.00 N ATOM 1877 CA SER A 119 5.933 -9.578 15.888 1.00 0.00 C ATOM 1878 C SER A 119 4.465 -9.635 15.475 1.00 0.00 C ATOM 1879 O SER A 119 4.066 -10.483 14.678 1.00 0.00 O ATOM 1880 CB SER A 119 6.176 -10.507 17.079 1.00 0.00 C ATOM 1881 OG SER A 119 5.764 -11.831 16.785 1.00 0.00 O ATOM 0 H SER A 119 6.826 -8.124 17.106 1.00 0.00 H new ATOM 0 HA SER A 119 6.542 -9.910 15.047 1.00 0.00 H new ATOM 0 HB2 SER A 119 7.235 -10.501 17.339 1.00 0.00 H new ATOM 0 HB3 SER A 119 5.632 -10.138 17.949 1.00 0.00 H new ATOM 0 HG SER A 119 5.931 -12.406 17.561 1.00 0.00 H new ATOM 1887 N SER A 120 3.667 -8.726 16.024 1.00 0.00 N ATOM 1888 CA SER A 120 2.242 -8.674 15.717 1.00 0.00 C ATOM 1889 C SER A 120 2.012 -8.662 14.209 1.00 0.00 C ATOM 1890 O SER A 120 1.013 -9.189 13.718 1.00 0.00 O ATOM 1891 CB SER A 120 1.607 -7.435 16.351 1.00 0.00 C ATOM 1892 OG SER A 120 2.028 -6.252 15.694 1.00 0.00 O ATOM 0 H SER A 120 3.982 -8.015 16.684 1.00 0.00 H new ATOM 0 HA SER A 120 1.773 -9.566 16.132 1.00 0.00 H new ATOM 0 HB2 SER A 120 0.521 -7.514 16.303 1.00 0.00 H new ATOM 0 HB3 SER A 120 1.876 -7.384 17.406 1.00 0.00 H new ATOM 0 HG SER A 120 2.608 -5.735 16.291 1.00 0.00 H new ATOM 1898 N TYR A 121 2.942 -8.057 13.480 1.00 0.00 N ATOM 1899 CA TYR A 121 2.841 -7.973 12.028 1.00 0.00 C ATOM 1900 C TYR A 121 2.301 -9.275 11.443 1.00 0.00 C ATOM 1901 O TYR A 121 1.175 -9.328 10.947 1.00 0.00 O ATOM 1902 CB TYR A 121 4.207 -7.655 11.417 1.00 0.00 C ATOM 1903 CG TYR A 121 4.269 -7.876 9.923 1.00 0.00 C ATOM 1904 CD1 TYR A 121 3.624 -7.013 9.046 1.00 0.00 C ATOM 1905 CD2 TYR A 121 4.973 -8.948 9.388 1.00 0.00 C ATOM 1906 CE1 TYR A 121 3.677 -7.211 7.680 1.00 0.00 C ATOM 1907 CE2 TYR A 121 5.033 -9.153 8.023 1.00 0.00 C ATOM 1908 CZ TYR A 121 4.383 -8.283 7.173 1.00 0.00 C ATOM 1909 OH TYR A 121 4.440 -8.483 5.813 1.00 0.00 O ATOM 0 H TYR A 121 3.775 -7.617 13.871 1.00 0.00 H new ATOM 0 HA TYR A 121 2.146 -7.170 11.784 1.00 0.00 H new ATOM 0 HB2 TYR A 121 4.459 -6.617 11.633 1.00 0.00 H new ATOM 0 HB3 TYR A 121 4.964 -8.274 11.899 1.00 0.00 H new ATOM 0 HD1 TYR A 121 3.071 -6.172 9.439 1.00 0.00 H new ATOM 0 HD2 TYR A 121 5.482 -9.633 10.050 1.00 0.00 H new ATOM 0 HE1 TYR A 121 3.169 -6.531 7.013 1.00 0.00 H new ATOM 0 HE2 TYR A 121 5.586 -9.990 7.624 1.00 0.00 H new ATOM 0 HH TYR A 121 4.977 -9.280 5.622 1.00 0.00 H new ATOM 1919 N THR A 122 3.113 -10.326 11.507 1.00 0.00 N ATOM 1920 CA THR A 122 2.719 -11.629 10.985 1.00 0.00 C ATOM 1921 C THR A 122 1.333 -12.023 11.480 1.00 0.00 C ATOM 1922 O THR A 122 0.574 -12.684 10.770 1.00 0.00 O ATOM 1923 CB THR A 122 3.726 -12.723 11.387 1.00 0.00 C ATOM 1924 OG1 THR A 122 3.530 -13.889 10.579 1.00 0.00 O ATOM 1925 CG2 THR A 122 3.573 -13.085 12.856 1.00 0.00 C ATOM 0 H THR A 122 4.047 -10.300 11.915 1.00 0.00 H new ATOM 0 HA THR A 122 2.703 -11.543 9.899 1.00 0.00 H new ATOM 0 HB THR A 122 4.733 -12.337 11.228 1.00 0.00 H new ATOM 0 HG1 THR A 122 4.175 -14.580 10.839 1.00 0.00 H new ATOM 0 HG21 THR A 122 4.294 -13.859 13.117 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.751 -12.201 13.469 1.00 0.00 H new ATOM 0 HG23 THR A 122 2.563 -13.454 13.037 1.00 0.00 H new ATOM 1933 N SER A 123 1.007 -11.614 12.702 1.00 0.00 N ATOM 1934 CA SER A 123 -0.288 -11.928 13.294 1.00 0.00 C ATOM 1935 C SER A 123 -1.426 -11.443 12.400 1.00 0.00 C ATOM 1936 O SER A 123 -2.493 -12.054 12.350 1.00 0.00 O ATOM 1937 CB SER A 123 -0.407 -11.292 14.680 1.00 0.00 C ATOM 1938 OG SER A 123 -1.258 -12.053 15.519 1.00 0.00 O ATOM 0 H SER A 123 1.622 -11.064 13.302 1.00 0.00 H new ATOM 0 HA SER A 123 -0.362 -13.011 13.392 1.00 0.00 H new ATOM 0 HB2 SER A 123 0.581 -11.214 15.134 1.00 0.00 H new ATOM 0 HB3 SER A 123 -0.796 -10.278 14.586 1.00 0.00 H new ATOM 0 HG SER A 123 -1.316 -11.626 16.399 1.00 0.00 H new ATOM 1944 N GLU A 124 -1.188 -10.341 11.696 1.00 0.00 N ATOM 1945 CA GLU A 124 -2.193 -9.774 10.804 1.00 0.00 C ATOM 1946 C GLU A 124 -2.223 -10.520 9.473 1.00 0.00 C ATOM 1947 O GLU A 124 -3.276 -10.975 9.027 1.00 0.00 O ATOM 1948 CB GLU A 124 -1.912 -8.289 10.563 1.00 0.00 C ATOM 1949 CG GLU A 124 -2.573 -7.372 11.578 1.00 0.00 C ATOM 1950 CD GLU A 124 -2.067 -7.602 12.989 1.00 0.00 C ATOM 1951 OE1 GLU A 124 -0.948 -7.140 13.299 1.00 0.00 O ATOM 1952 OE2 GLU A 124 -2.787 -8.243 13.781 1.00 0.00 O ATOM 0 H GLU A 124 -0.309 -9.824 11.726 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.167 -9.880 11.281 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -0.835 -8.124 10.584 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -2.256 -8.020 9.564 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -2.393 -6.335 11.296 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -3.652 -7.526 11.553 1.00 0.00 H new ATOM 1959 N VAL A 125 -1.058 -10.641 8.843 1.00 0.00 N ATOM 1960 CA VAL A 125 -0.950 -11.332 7.564 1.00 0.00 C ATOM 1961 C VAL A 125 -1.690 -12.664 7.594 1.00 0.00 C ATOM 1962 O VAL A 125 -2.317 -13.059 6.612 1.00 0.00 O ATOM 1963 CB VAL A 125 0.522 -11.583 7.184 1.00 0.00 C ATOM 1964 CG1 VAL A 125 0.614 -12.291 5.841 1.00 0.00 C ATOM 1965 CG2 VAL A 125 1.296 -10.274 7.160 1.00 0.00 C ATOM 0 H VAL A 125 -0.177 -10.270 9.198 1.00 0.00 H new ATOM 0 HA VAL A 125 -1.406 -10.684 6.815 1.00 0.00 H new ATOM 0 HB VAL A 125 0.969 -12.229 7.939 1.00 0.00 H new ATOM 0 HG11 VAL A 125 1.661 -12.460 5.590 1.00 0.00 H new ATOM 0 HG12 VAL A 125 0.096 -13.248 5.898 1.00 0.00 H new ATOM 0 HG13 VAL A 125 0.151 -11.673 5.072 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.334 -10.470 6.890 1.00 0.00 H new ATOM 0 HG22 VAL A 125 0.851 -9.601 6.427 1.00 0.00 H new ATOM 0 HG23 VAL A 125 1.259 -9.811 8.146 1.00 0.00 H new ATOM 1975 N GLN A 126 -1.612 -13.352 8.729 1.00 0.00 N ATOM 1976 CA GLN A 126 -2.275 -14.641 8.887 1.00 0.00 C ATOM 1977 C GLN A 126 -3.780 -14.462 9.055 1.00 0.00 C ATOM 1978 O GLN A 126 -4.565 -14.898 8.213 1.00 0.00 O ATOM 1979 CB GLN A 126 -1.701 -15.390 10.091 1.00 0.00 C ATOM 1980 CG GLN A 126 -0.181 -15.432 10.113 1.00 0.00 C ATOM 1981 CD GLN A 126 0.380 -16.635 9.381 1.00 0.00 C ATOM 1982 OE1 GLN A 126 -0.317 -17.627 9.168 1.00 0.00 O ATOM 1983 NE2 GLN A 126 1.647 -16.554 8.992 1.00 0.00 N ATOM 0 H GLN A 126 -1.097 -13.039 9.552 1.00 0.00 H new ATOM 0 HA GLN A 126 -2.095 -15.226 7.985 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -2.056 -14.917 11.006 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -2.084 -16.410 10.090 1.00 0.00 H new ATOM 0 HG2 GLN A 126 0.210 -14.521 9.660 1.00 0.00 H new ATOM 0 HG3 GLN A 126 0.163 -15.448 11.147 1.00 0.00 H new ATOM 0 HE21 GLN A 126 2.188 -15.712 9.189 1.00 0.00 H new ATOM 0 HE22 GLN A 126 2.079 -17.333 8.496 1.00 0.00 H new ATOM 1992 N ALA A 127 -4.176 -13.819 10.149 1.00 0.00 N ATOM 1993 CA ALA A 127 -5.587 -13.582 10.427 1.00 0.00 C ATOM 1994 C ALA A 127 -6.335 -13.177 9.161 1.00 0.00 C ATOM 1995 O ALA A 127 -7.467 -13.607 8.934 1.00 0.00 O ATOM 1996 CB ALA A 127 -5.741 -12.512 11.498 1.00 0.00 C ATOM 0 H ALA A 127 -3.539 -13.453 10.857 1.00 0.00 H new ATOM 0 HA ALA A 127 -6.021 -14.512 10.793 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -6.800 -12.345 11.696 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -5.248 -12.840 12.413 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -5.286 -11.584 11.153 1.00 0.00 H new ATOM 2002 N ILE A 128 -5.697 -12.349 8.341 1.00 0.00 N ATOM 2003 CA ILE A 128 -6.303 -11.888 7.098 1.00 0.00 C ATOM 2004 C ILE A 128 -6.521 -13.046 6.130 1.00 0.00 C ATOM 2005 O ILE A 128 -7.658 -13.388 5.801 1.00 0.00 O ATOM 2006 CB ILE A 128 -5.435 -10.817 6.412 1.00 0.00 C ATOM 2007 CG1 ILE A 128 -5.270 -9.601 7.327 1.00 0.00 C ATOM 2008 CG2 ILE A 128 -6.052 -10.406 5.083 1.00 0.00 C ATOM 2009 CD1 ILE A 128 -4.088 -8.729 6.964 1.00 0.00 C ATOM 0 H ILE A 128 -4.761 -11.984 8.515 1.00 0.00 H new ATOM 0 HA ILE A 128 -7.266 -11.450 7.360 1.00 0.00 H new ATOM 0 HB ILE A 128 -4.449 -11.239 6.217 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -6.179 -9.001 7.289 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -5.157 -9.943 8.356 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -5.427 -9.648 4.610 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -6.124 -11.276 4.430 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -7.048 -9.999 5.255 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -4.032 -7.887 7.654 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.171 -9.314 7.030 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.209 -8.357 5.946 1.00 0.00 H new ATOM 2021 N LEU A 129 -5.426 -13.646 5.679 1.00 0.00 N ATOM 2022 CA LEU A 129 -5.497 -14.768 4.749 1.00 0.00 C ATOM 2023 C LEU A 129 -6.700 -15.655 5.056 1.00 0.00 C ATOM 2024 O LEU A 129 -7.433 -16.057 4.153 1.00 0.00 O ATOM 2025 CB LEU A 129 -4.210 -15.594 4.817 1.00 0.00 C ATOM 2026 CG LEU A 129 -2.990 -14.994 4.117 1.00 0.00 C ATOM 2027 CD1 LEU A 129 -1.722 -15.720 4.538 1.00 0.00 C ATOM 2028 CD2 LEU A 129 -3.162 -15.049 2.606 1.00 0.00 C ATOM 0 H LEU A 129 -4.478 -13.375 5.942 1.00 0.00 H new ATOM 0 HA LEU A 129 -5.612 -14.367 3.742 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -3.960 -15.754 5.866 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -4.408 -16.574 4.383 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.901 -13.949 4.415 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -0.864 -15.279 4.030 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -1.591 -15.628 5.616 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -1.800 -16.774 4.270 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -2.285 -14.618 2.124 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -3.277 -16.086 2.290 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -4.048 -14.483 2.320 1.00 0.00 H new ATOM 2040 N ALA A 130 -6.897 -15.954 6.335 1.00 0.00 N ATOM 2041 CA ALA A 130 -8.014 -16.788 6.761 1.00 0.00 C ATOM 2042 C ALA A 130 -9.332 -16.027 6.676 1.00 0.00 C ATOM 2043 O ALA A 130 -10.263 -16.452 5.992 1.00 0.00 O ATOM 2044 CB ALA A 130 -7.784 -17.294 8.178 1.00 0.00 C ATOM 0 H ALA A 130 -6.298 -15.631 7.095 1.00 0.00 H new ATOM 0 HA ALA A 130 -8.075 -17.642 6.087 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -8.626 -17.915 8.484 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -6.868 -17.883 8.210 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -7.694 -16.446 8.857 1.00 0.00 H new ATOM 2050 N PHE A 131 -9.405 -14.900 7.377 1.00 0.00 N ATOM 2051 CA PHE A 131 -10.611 -14.080 7.381 1.00 0.00 C ATOM 2052 C PHE A 131 -11.231 -14.015 5.989 1.00 0.00 C ATOM 2053 O PHE A 131 -12.413 -14.310 5.808 1.00 0.00 O ATOM 2054 CB PHE A 131 -10.291 -12.667 7.875 1.00 0.00 C ATOM 2055 CG PHE A 131 -11.461 -11.728 7.804 1.00 0.00 C ATOM 2056 CD1 PHE A 131 -12.494 -11.816 8.724 1.00 0.00 C ATOM 2057 CD2 PHE A 131 -11.528 -10.757 6.818 1.00 0.00 C ATOM 2058 CE1 PHE A 131 -13.571 -10.953 8.661 1.00 0.00 C ATOM 2059 CE2 PHE A 131 -12.603 -9.891 6.751 1.00 0.00 C ATOM 2060 CZ PHE A 131 -13.626 -9.990 7.673 1.00 0.00 C ATOM 0 H PHE A 131 -8.644 -14.534 7.949 1.00 0.00 H new ATOM 0 HA PHE A 131 -11.330 -14.541 8.058 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -9.941 -12.722 8.906 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -9.472 -12.260 7.282 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -12.457 -12.568 9.499 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -10.731 -10.676 6.094 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -14.369 -11.032 9.384 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -12.643 -9.138 5.978 1.00 0.00 H new ATOM 0 HZ PHE A 131 -14.468 -9.315 7.621 1.00 0.00 H new ATOM 2070 N LEU A 132 -10.424 -13.628 5.006 1.00 0.00 N ATOM 2071 CA LEU A 132 -10.892 -13.524 3.628 1.00 0.00 C ATOM 2072 C LEU A 132 -11.573 -14.815 3.186 1.00 0.00 C ATOM 2073 O LEU A 132 -12.636 -14.787 2.566 1.00 0.00 O ATOM 2074 CB LEU A 132 -9.723 -13.205 2.695 1.00 0.00 C ATOM 2075 CG LEU A 132 -9.008 -11.876 2.945 1.00 0.00 C ATOM 2076 CD1 LEU A 132 -7.765 -11.767 2.076 1.00 0.00 C ATOM 2077 CD2 LEU A 132 -9.948 -10.708 2.685 1.00 0.00 C ATOM 0 H LEU A 132 -9.443 -13.381 5.138 1.00 0.00 H new ATOM 0 HA LEU A 132 -11.621 -12.715 3.577 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -8.991 -14.009 2.774 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -10.091 -13.209 1.669 1.00 0.00 H new ATOM 0 HG LEU A 132 -8.699 -11.842 3.990 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -7.270 -10.815 2.267 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -7.084 -12.585 2.311 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -8.050 -11.823 1.025 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -9.423 -9.771 2.868 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -10.288 -10.738 1.650 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -10.808 -10.778 3.351 1.00 0.00 H new ATOM 2089 N SER A 133 -10.954 -15.946 3.509 1.00 0.00 N ATOM 2090 CA SER A 133 -11.499 -17.248 3.144 1.00 0.00 C ATOM 2091 C SER A 133 -12.919 -17.412 3.679 1.00 0.00 C ATOM 2092 O SER A 133 -13.804 -17.911 2.982 1.00 0.00 O ATOM 2093 CB SER A 133 -10.607 -18.368 3.682 1.00 0.00 C ATOM 2094 OG SER A 133 -10.715 -19.534 2.884 1.00 0.00 O ATOM 0 H SER A 133 -10.074 -15.987 4.023 1.00 0.00 H new ATOM 0 HA SER A 133 -11.529 -17.309 2.056 1.00 0.00 H new ATOM 0 HB2 SER A 133 -9.570 -18.033 3.703 1.00 0.00 H new ATOM 0 HB3 SER A 133 -10.888 -18.599 4.709 1.00 0.00 H new ATOM 0 HG SER A 133 -10.134 -20.234 3.248 1.00 0.00 H new ATOM 2100 N LEU A 134 -13.129 -16.989 4.920 1.00 0.00 N ATOM 2101 CA LEU A 134 -14.441 -17.088 5.551 1.00 0.00 C ATOM 2102 C LEU A 134 -15.497 -16.357 4.728 1.00 0.00 C ATOM 2103 O LEU A 134 -16.674 -16.716 4.753 1.00 0.00 O ATOM 2104 CB LEU A 134 -14.392 -16.512 6.967 1.00 0.00 C ATOM 2105 CG LEU A 134 -13.279 -17.044 7.870 1.00 0.00 C ATOM 2106 CD1 LEU A 134 -13.329 -16.370 9.233 1.00 0.00 C ATOM 2107 CD2 LEU A 134 -13.388 -18.555 8.017 1.00 0.00 C ATOM 0 H LEU A 134 -12.408 -16.574 5.510 1.00 0.00 H new ATOM 0 HA LEU A 134 -14.714 -18.142 5.604 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -14.287 -15.430 6.894 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -15.349 -16.707 7.450 1.00 0.00 H new ATOM 0 HG LEU A 134 -12.320 -16.812 7.407 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -12.529 -16.761 9.862 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -13.202 -15.294 9.112 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -14.292 -16.571 9.703 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -12.588 -18.916 8.663 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -14.352 -18.809 8.457 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -13.302 -19.023 7.036 1.00 0.00 H new ATOM 2119 N GLN A 135 -15.067 -15.332 3.999 1.00 0.00 N ATOM 2120 CA GLN A 135 -15.976 -14.552 3.168 1.00 0.00 C ATOM 2121 C GLN A 135 -16.539 -15.401 2.032 1.00 0.00 C ATOM 2122 O GLN A 135 -17.696 -15.244 1.642 1.00 0.00 O ATOM 2123 CB GLN A 135 -15.257 -13.329 2.597 1.00 0.00 C ATOM 2124 CG GLN A 135 -14.687 -12.407 3.662 1.00 0.00 C ATOM 2125 CD GLN A 135 -14.634 -10.959 3.214 1.00 0.00 C ATOM 2126 OE1 GLN A 135 -15.564 -10.459 2.580 1.00 0.00 O ATOM 2127 NE2 GLN A 135 -13.542 -10.278 3.540 1.00 0.00 N ATOM 0 H GLN A 135 -14.096 -15.023 3.967 1.00 0.00 H new ATOM 0 HA GLN A 135 -16.804 -14.219 3.794 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -14.448 -13.664 1.947 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -15.953 -12.766 1.975 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -15.294 -12.482 4.564 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -13.683 -12.739 3.925 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -12.796 -10.732 4.066 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -13.449 -9.300 3.264 1.00 0.00 H new ATOM 2136 N ARG A 136 -15.714 -16.301 1.507 1.00 0.00 N ATOM 2137 CA ARG A 136 -16.129 -17.173 0.416 1.00 0.00 C ATOM 2138 C ARG A 136 -17.439 -17.880 0.753 1.00 0.00 C ATOM 2139 O ARG A 136 -18.049 -17.619 1.790 1.00 0.00 O ATOM 2140 CB ARG A 136 -15.041 -18.207 0.118 1.00 0.00 C ATOM 2141 CG ARG A 136 -13.773 -17.606 -0.465 1.00 0.00 C ATOM 2142 CD ARG A 136 -13.881 -17.433 -1.972 1.00 0.00 C ATOM 2143 NE ARG A 136 -15.217 -17.010 -2.381 1.00 0.00 N ATOM 2144 CZ ARG A 136 -16.171 -17.853 -2.761 1.00 0.00 C ATOM 2145 NH1 ARG A 136 -15.936 -19.158 -2.784 1.00 0.00 N ATOM 2146 NH2 ARG A 136 -17.362 -17.392 -3.119 1.00 0.00 N ATOM 0 H ARG A 136 -14.754 -16.445 1.820 1.00 0.00 H new ATOM 0 HA ARG A 136 -16.286 -16.556 -0.469 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -14.793 -18.736 1.038 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -15.436 -18.947 -0.578 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -13.580 -16.640 0.000 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -12.924 -18.248 -0.231 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -13.150 -16.696 -2.305 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -13.633 -18.374 -2.463 1.00 0.00 H new ATOM 0 HE ARG A 136 -15.430 -16.012 -2.375 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -15.021 -19.516 -2.510 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -16.670 -19.803 -3.076 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -17.547 -16.389 -3.103 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -18.093 -18.041 -3.411 1.00 0.00 H new ATOM 2160 N THR A 137 -17.867 -18.776 -0.131 1.00 0.00 N ATOM 2161 CA THR A 137 -19.104 -19.519 0.071 1.00 0.00 C ATOM 2162 C THR A 137 -18.843 -20.834 0.797 1.00 0.00 C ATOM 2163 O THR A 137 -17.788 -21.448 0.631 1.00 0.00 O ATOM 2164 CB THR A 137 -19.807 -19.815 -1.267 1.00 0.00 C ATOM 2165 OG1 THR A 137 -19.996 -18.599 -2.000 1.00 0.00 O ATOM 2166 CG2 THR A 137 -21.152 -20.486 -1.034 1.00 0.00 C ATOM 0 H THR A 137 -17.374 -19.005 -0.994 1.00 0.00 H new ATOM 0 HA THR A 137 -19.753 -18.892 0.682 1.00 0.00 H new ATOM 0 HB THR A 137 -19.176 -20.492 -1.843 1.00 0.00 H new ATOM 0 HG1 THR A 137 -20.442 -18.796 -2.850 1.00 0.00 H new ATOM 0 HG21 THR A 137 -21.630 -20.685 -1.993 1.00 0.00 H new ATOM 0 HG22 THR A 137 -21.003 -21.425 -0.501 1.00 0.00 H new ATOM 0 HG23 THR A 137 -21.788 -19.829 -0.441 1.00 0.00 H new TER 2174 THR A 137