USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 950 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 30 HIS : no HE2:sc= -3.38 K(o=-4.1,f=-4.6) USER MOD Set 1.2: A 124 SER OG : rot 21:sc= -0.701 USER MOD Set 2.1: A 104 SER OG : rot -103:sc= 0.812 USER MOD Set 2.2: A 106 THR OG1 : rot 180:sc= 0.751 USER MOD Set 3.1: A 101 ASN : amide:sc= -6.41! C(o=-17!,f=-16!) USER MOD Set 3.2: A 107 ASN : amide:sc= -11! C(o=-17!,f=-16!) USER MOD Set 4.1: A 87 ASN : amide:sc= -5 K(o=-5,f=-1.7) USER MOD Set 4.2: A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 64 SER OG : rot 160:sc= 0.0473 USER MOD Single : A 3 LYS NZ :NH3+ 152:sc= 1.38 (180deg=0.51) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -0.458 X(o=-0.46,f=-0.11) USER MOD Single : A 11 ASN : amide:sc= -2.6 K(o=-2.6,f=-3.8!) USER MOD Single : A 12 GLN : amide:sc= -2.63! K(o=-2.6!,f=-1.8) USER MOD Single : A 14 LYS NZ :NH3+ 157:sc= -1.89! (180deg=-3.47!) USER MOD Single : A 15 SER OG : rot 110:sc= 1.22 USER MOD Single : A 20 SER OG : rot 165:sc= -2.87! USER MOD Single : A 25 ASN : amide:sc= -2.12! K(o=-2.1!,f=-0.93) USER MOD Single : A 29 TYR OH : rot 130:sc= -3.26! USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 152:sc= -0.0131 (180deg=-1.09) USER MOD Single : A 38 THR OG1 : rot 173:sc= -2.5! USER MOD Single : A 42 ASN : amide:sc= -2.15 X(o=-2.2,f=-1.9) USER MOD Single : A 49 ASN : amide:sc= 1.24 K(o=1.2,f=0) USER MOD Single : A 50 LYS NZ :NH3+ -125:sc= 1 (180deg=-1.2) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.139 USER MOD Single : A 59 ASN : amide:sc= -0.0336 K(o=-0.034,f=-5.1!) USER MOD Single : A 62 LYS NZ :NH3+ -113:sc= -0.409 (180deg=-1.62!) USER MOD Single : A 73 ASN : amide:sc= -4.9! C(o=-4.9!,f=-8.2!) USER MOD Single : A 74 SER OG : rot 180:sc= -1.84 USER MOD Single : A 80 SER OG : rot -58:sc= 1.17 USER MOD Single : A 81 THR OG1 : rot -11:sc= -1.19! USER MOD Single : A 85 ASN : amide:sc= -0.91 K(o=-0.91,f=-11!) USER MOD Single : A 97 MET CE :methyl -178:sc= -4.72! (180deg=-4.74!) USER MOD Single : A 99 SER OG : rot 150:sc= 0.0928 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0.0437 USER MOD Single : A 109 SER OG : rot -109:sc= 0.0122 USER MOD Single : A 113 ASN : amide:sc= -11.5! C(o=-11!,f=-13!) USER MOD Single : A 114 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.126) USER MOD Single : A 117 SER OG : rot 57:sc= -1.17 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= -7.62! C(o=-7.6!,f=-13!) USER MOD Single : A 128 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 32 N LYS A 3 -14.296 21.464 -1.462 1.00 0.00 N ATOM 33 CA LYS A 3 -14.404 20.521 -0.353 1.00 0.00 C ATOM 34 C LYS A 3 -14.851 19.142 -0.838 1.00 0.00 C ATOM 35 O LYS A 3 -14.853 18.178 -0.074 1.00 0.00 O ATOM 36 CB LYS A 3 -15.381 21.045 0.705 1.00 0.00 C ATOM 37 CG LYS A 3 -16.646 21.661 0.127 1.00 0.00 C ATOM 38 CD LYS A 3 -17.533 22.243 1.217 1.00 0.00 C ATOM 39 CE LYS A 3 -17.785 21.239 2.330 1.00 0.00 C ATOM 40 NZ LYS A 3 -18.960 21.614 3.165 1.00 0.00 N ATOM 0 HA LYS A 3 -13.415 20.422 0.094 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -15.658 20.225 1.367 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -14.873 21.790 1.317 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -16.379 22.444 -0.582 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -17.200 20.904 -0.428 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -17.063 23.135 1.631 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -18.484 22.554 0.785 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -17.948 20.252 1.898 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -16.899 21.168 2.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -19.388 20.756 3.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -18.652 22.242 3.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -19.661 22.107 2.576 1.00 0.00 H new ATOM 54 N THR A 4 -15.222 19.053 -2.113 1.00 0.00 N ATOM 55 CA THR A 4 -15.662 17.790 -2.694 1.00 0.00 C ATOM 56 C THR A 4 -14.557 16.747 -2.594 1.00 0.00 C ATOM 57 O THR A 4 -14.824 15.565 -2.381 1.00 0.00 O ATOM 58 CB THR A 4 -16.062 17.983 -4.160 1.00 0.00 C ATOM 59 OG1 THR A 4 -17.195 18.828 -4.262 1.00 0.00 O ATOM 60 CG2 THR A 4 -16.392 16.685 -4.872 1.00 0.00 C ATOM 0 H THR A 4 -15.226 19.840 -2.762 1.00 0.00 H new ATOM 0 HA THR A 4 -16.531 17.442 -2.135 1.00 0.00 H new ATOM 0 HB THR A 4 -15.190 18.428 -4.639 1.00 0.00 H new ATOM 0 HG1 THR A 4 -17.435 18.941 -5.205 1.00 0.00 H new ATOM 0 HG21 THR A 4 -16.667 16.897 -5.905 1.00 0.00 H new ATOM 0 HG22 THR A 4 -15.522 16.029 -4.855 1.00 0.00 H new ATOM 0 HG23 THR A 4 -17.225 16.195 -4.368 1.00 0.00 H new ATOM 68 N ASN A 5 -13.316 17.197 -2.748 1.00 0.00 N ATOM 69 CA ASN A 5 -12.164 16.307 -2.676 1.00 0.00 C ATOM 70 C ASN A 5 -12.263 15.387 -1.464 1.00 0.00 C ATOM 71 O ASN A 5 -11.771 14.260 -1.488 1.00 0.00 O ATOM 72 CB ASN A 5 -10.868 17.118 -2.623 1.00 0.00 C ATOM 73 CG ASN A 5 -9.877 16.684 -3.685 1.00 0.00 C ATOM 74 OD1 ASN A 5 -8.691 16.506 -3.408 1.00 0.00 O ATOM 75 ND2 ASN A 5 -10.361 16.512 -4.910 1.00 0.00 N ATOM 0 H ASN A 5 -13.083 18.174 -2.924 1.00 0.00 H new ATOM 0 HA ASN A 5 -12.155 15.689 -3.574 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -11.098 18.176 -2.753 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -10.413 17.009 -1.638 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -9.742 16.221 -5.667 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -11.352 16.671 -5.094 1.00 0.00 H new ATOM 82 N LEU A 6 -12.921 15.866 -0.412 1.00 0.00 N ATOM 83 CA LEU A 6 -13.099 15.075 0.786 1.00 0.00 C ATOM 84 C LEU A 6 -14.245 14.103 0.589 1.00 0.00 C ATOM 85 O LEU A 6 -14.049 12.893 0.623 1.00 0.00 O ATOM 86 CB LEU A 6 -13.360 15.972 1.988 1.00 0.00 C ATOM 87 CG LEU A 6 -12.107 16.345 2.774 1.00 0.00 C ATOM 88 CD1 LEU A 6 -11.666 17.760 2.438 1.00 0.00 C ATOM 89 CD2 LEU A 6 -12.352 16.184 4.265 1.00 0.00 C ATOM 0 H LEU A 6 -13.336 16.797 -0.372 1.00 0.00 H new ATOM 0 HA LEU A 6 -12.185 14.513 0.978 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -13.846 16.886 1.646 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -14.059 15.470 2.657 1.00 0.00 H new ATOM 0 HG LEU A 6 -11.301 15.669 2.489 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -10.771 18.007 3.009 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -11.448 17.830 1.372 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -12.463 18.459 2.692 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -11.449 16.454 4.813 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -13.171 16.835 4.572 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -12.612 15.148 4.481 1.00 0.00 H new ATOM 101 N GLY A 7 -15.437 14.636 0.341 1.00 0.00 N ATOM 102 CA GLY A 7 -16.584 13.782 0.097 1.00 0.00 C ATOM 103 C GLY A 7 -16.278 12.749 -0.969 1.00 0.00 C ATOM 104 O GLY A 7 -16.886 11.682 -1.014 1.00 0.00 O ATOM 0 H GLY A 7 -15.628 15.637 0.305 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -16.872 13.281 1.021 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -17.434 14.389 -0.214 1.00 0.00 H new ATOM 108 N GLU A 8 -15.315 13.081 -1.827 1.00 0.00 N ATOM 109 CA GLU A 8 -14.898 12.199 -2.906 1.00 0.00 C ATOM 110 C GLU A 8 -13.867 11.183 -2.421 1.00 0.00 C ATOM 111 O GLU A 8 -13.735 10.103 -2.996 1.00 0.00 O ATOM 112 CB GLU A 8 -14.304 13.027 -4.047 1.00 0.00 C ATOM 113 CG GLU A 8 -14.646 12.500 -5.429 1.00 0.00 C ATOM 114 CD GLU A 8 -13.468 12.555 -6.381 1.00 0.00 C ATOM 115 OE1 GLU A 8 -13.046 13.674 -6.739 1.00 0.00 O ATOM 116 OE2 GLU A 8 -12.970 11.478 -6.771 1.00 0.00 O ATOM 0 H GLU A 8 -14.807 13.965 -1.791 1.00 0.00 H new ATOM 0 HA GLU A 8 -15.774 11.655 -3.260 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -14.660 14.054 -3.962 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -13.220 13.055 -3.937 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -14.993 11.470 -5.346 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -15.470 13.082 -5.842 1.00 0.00 H new ATOM 123 N LEU A 9 -13.132 11.531 -1.365 1.00 0.00 N ATOM 124 CA LEU A 9 -12.115 10.636 -0.828 1.00 0.00 C ATOM 125 C LEU A 9 -12.623 9.902 0.406 1.00 0.00 C ATOM 126 O LEU A 9 -12.126 8.830 0.750 1.00 0.00 O ATOM 127 CB LEU A 9 -10.843 11.413 -0.477 1.00 0.00 C ATOM 128 CG LEU A 9 -9.976 11.841 -1.665 1.00 0.00 C ATOM 129 CD1 LEU A 9 -8.655 12.426 -1.175 1.00 0.00 C ATOM 130 CD2 LEU A 9 -9.727 10.666 -2.600 1.00 0.00 C ATOM 0 H LEU A 9 -13.222 12.418 -0.870 1.00 0.00 H new ATOM 0 HA LEU A 9 -11.884 9.901 -1.599 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -11.127 12.305 0.082 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -10.237 10.799 0.189 1.00 0.00 H new ATOM 0 HG LEU A 9 -10.510 12.611 -2.221 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -8.050 12.725 -2.031 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -8.852 13.296 -0.548 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -8.117 11.676 -0.595 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -9.109 10.992 -3.437 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -9.214 9.872 -2.058 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -10.679 10.292 -2.976 1.00 0.00 H new ATOM 142 N ILE A 10 -13.603 10.493 1.083 1.00 0.00 N ATOM 143 CA ILE A 10 -14.151 9.897 2.289 1.00 0.00 C ATOM 144 C ILE A 10 -15.252 8.890 1.981 1.00 0.00 C ATOM 145 O ILE A 10 -15.272 7.801 2.553 1.00 0.00 O ATOM 146 CB ILE A 10 -14.695 10.960 3.263 1.00 0.00 C ATOM 147 CG1 ILE A 10 -15.902 11.715 2.682 1.00 0.00 C ATOM 148 CG2 ILE A 10 -13.614 11.935 3.636 1.00 0.00 C ATOM 149 CD1 ILE A 10 -16.282 12.979 3.459 1.00 0.00 C ATOM 0 H ILE A 10 -14.030 11.380 0.816 1.00 0.00 H new ATOM 0 HA ILE A 10 -13.321 9.375 2.765 1.00 0.00 H new ATOM 0 HB ILE A 10 -15.032 10.433 4.156 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -15.684 11.988 1.650 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -16.760 11.044 2.659 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -14.016 12.678 4.324 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -12.793 11.402 4.116 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.247 12.433 2.738 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -17.142 13.453 2.985 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -16.534 12.713 4.486 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -15.441 13.672 3.460 1.00 0.00 H new ATOM 161 N ASN A 11 -16.169 9.250 1.081 1.00 0.00 N ATOM 162 CA ASN A 11 -17.268 8.355 0.712 1.00 0.00 C ATOM 163 C ASN A 11 -16.759 6.929 0.568 1.00 0.00 C ATOM 164 O ASN A 11 -17.389 5.973 1.020 1.00 0.00 O ATOM 165 CB ASN A 11 -17.906 8.802 -0.601 1.00 0.00 C ATOM 166 CG ASN A 11 -18.878 9.944 -0.412 1.00 0.00 C ATOM 167 OD1 ASN A 11 -19.364 10.188 0.692 1.00 0.00 O ATOM 168 ND2 ASN A 11 -19.167 10.651 -1.495 1.00 0.00 N ATOM 0 H ASN A 11 -16.173 10.148 0.597 1.00 0.00 H new ATOM 0 HA ASN A 11 -18.018 8.393 1.502 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -17.124 9.106 -1.296 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -18.426 7.958 -1.055 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -19.817 11.435 -1.434 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -18.739 10.412 -2.390 1.00 0.00 H new ATOM 175 N GLN A 12 -15.599 6.809 -0.059 1.00 0.00 N ATOM 176 CA GLN A 12 -14.968 5.515 -0.269 1.00 0.00 C ATOM 177 C GLN A 12 -14.169 5.101 0.960 1.00 0.00 C ATOM 178 O GLN A 12 -14.048 3.916 1.259 1.00 0.00 O ATOM 179 CB GLN A 12 -14.044 5.571 -1.487 1.00 0.00 C ATOM 180 CG GLN A 12 -12.829 6.460 -1.275 1.00 0.00 C ATOM 181 CD GLN A 12 -11.939 6.542 -2.498 1.00 0.00 C ATOM 182 OE1 GLN A 12 -12.033 5.719 -3.407 1.00 0.00 O ATOM 183 NE2 GLN A 12 -11.068 7.543 -2.521 1.00 0.00 N ATOM 0 H GLN A 12 -15.072 7.598 -0.434 1.00 0.00 H new ATOM 0 HA GLN A 12 -15.751 4.777 -0.444 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -13.710 4.562 -1.729 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -14.607 5.935 -2.346 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -13.161 7.463 -1.005 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -12.249 6.080 -0.434 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -11.027 8.201 -1.743 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -10.440 7.654 -3.317 1.00 0.00 H new ATOM 192 N GLY A 13 -13.620 6.086 1.662 1.00 0.00 N ATOM 193 CA GLY A 13 -12.832 5.803 2.845 1.00 0.00 C ATOM 194 C GLY A 13 -13.612 5.051 3.907 1.00 0.00 C ATOM 195 O GLY A 13 -13.297 3.904 4.222 1.00 0.00 O ATOM 0 H GLY A 13 -13.707 7.076 1.432 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.957 5.218 2.561 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -12.467 6.740 3.265 1.00 0.00 H new ATOM 199 N LYS A 14 -14.628 5.701 4.465 1.00 0.00 N ATOM 200 CA LYS A 14 -15.450 5.082 5.507 1.00 0.00 C ATOM 201 C LYS A 14 -16.058 3.781 5.001 1.00 0.00 C ATOM 202 O LYS A 14 -16.286 2.848 5.772 1.00 0.00 O ATOM 203 CB LYS A 14 -16.557 6.028 6.006 1.00 0.00 C ATOM 204 CG LYS A 14 -16.939 7.141 5.037 1.00 0.00 C ATOM 205 CD LYS A 14 -16.327 8.477 5.452 1.00 0.00 C ATOM 206 CE LYS A 14 -16.934 9.648 4.689 1.00 0.00 C ATOM 207 NZ LYS A 14 -18.361 9.866 5.052 1.00 0.00 N ATOM 0 H LYS A 14 -14.904 6.651 4.217 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.796 4.867 6.352 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -17.446 5.438 6.226 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -16.233 6.479 6.944 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -16.603 6.882 4.033 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -18.024 7.233 4.997 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -16.475 8.626 6.522 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -15.251 8.451 5.280 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -16.364 10.553 4.899 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -16.856 9.463 3.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -18.626 10.849 4.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -18.962 9.220 4.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -18.493 9.682 6.067 1.00 0.00 H new ATOM 221 N SER A 15 -16.297 3.719 3.698 1.00 0.00 N ATOM 222 CA SER A 15 -16.856 2.525 3.079 1.00 0.00 C ATOM 223 C SER A 15 -15.751 1.518 2.772 1.00 0.00 C ATOM 224 O SER A 15 -16.013 0.333 2.577 1.00 0.00 O ATOM 225 CB SER A 15 -17.590 2.892 1.791 1.00 0.00 C ATOM 226 OG SER A 15 -18.651 3.796 2.047 1.00 0.00 O ATOM 0 H SER A 15 -16.112 4.483 3.048 1.00 0.00 H new ATOM 0 HA SER A 15 -17.562 2.074 3.776 1.00 0.00 H new ATOM 0 HB2 SER A 15 -16.890 3.339 1.085 1.00 0.00 H new ATOM 0 HB3 SER A 15 -17.982 1.989 1.323 1.00 0.00 H new ATOM 0 HG SER A 15 -18.424 4.678 1.684 1.00 0.00 H new ATOM 232 N LEU A 16 -14.512 2.005 2.740 1.00 0.00 N ATOM 233 CA LEU A 16 -13.357 1.169 2.464 1.00 0.00 C ATOM 234 C LEU A 16 -12.977 0.389 3.712 1.00 0.00 C ATOM 235 O LEU A 16 -12.990 -0.840 3.701 1.00 0.00 O ATOM 236 CB LEU A 16 -12.189 2.035 1.978 1.00 0.00 C ATOM 237 CG LEU A 16 -10.845 1.319 1.825 1.00 0.00 C ATOM 238 CD1 LEU A 16 -11.006 0.047 1.008 1.00 0.00 C ATOM 239 CD2 LEU A 16 -9.822 2.246 1.173 1.00 0.00 C ATOM 0 H LEU A 16 -14.286 2.986 2.904 1.00 0.00 H new ATOM 0 HA LEU A 16 -13.603 0.457 1.676 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -12.459 2.469 1.015 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -12.061 2.863 2.676 1.00 0.00 H new ATOM 0 HG LEU A 16 -10.485 1.046 2.817 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -10.040 -0.448 0.910 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -11.707 -0.621 1.509 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -11.388 0.296 0.018 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -8.871 1.724 1.070 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -10.179 2.546 0.188 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -9.685 3.131 1.795 1.00 0.00 H new ATOM 251 N LEU A 17 -12.673 1.097 4.805 1.00 0.00 N ATOM 252 CA LEU A 17 -12.330 0.422 6.052 1.00 0.00 C ATOM 253 C LEU A 17 -13.472 -0.506 6.455 1.00 0.00 C ATOM 254 O LEU A 17 -13.250 -1.590 6.995 1.00 0.00 O ATOM 255 CB LEU A 17 -12.063 1.406 7.202 1.00 0.00 C ATOM 256 CG LEU A 17 -11.324 2.700 6.858 1.00 0.00 C ATOM 257 CD1 LEU A 17 -12.122 3.904 7.328 1.00 0.00 C ATOM 258 CD2 LEU A 17 -9.928 2.708 7.492 1.00 0.00 C ATOM 0 H LEU A 17 -12.658 2.116 4.849 1.00 0.00 H new ATOM 0 HA LEU A 17 -11.412 -0.138 5.873 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -13.021 1.673 7.648 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -11.490 0.883 7.968 1.00 0.00 H new ATOM 0 HG LEU A 17 -11.212 2.755 5.775 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -11.584 4.818 7.076 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -13.095 3.909 6.837 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -12.260 3.850 8.408 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -9.417 3.636 7.236 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -10.020 2.631 8.575 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -9.353 1.862 7.116 1.00 0.00 H new ATOM 270 N ASP A 18 -14.701 -0.062 6.185 1.00 0.00 N ATOM 271 CA ASP A 18 -15.890 -0.843 6.516 1.00 0.00 C ATOM 272 C ASP A 18 -16.173 -1.914 5.460 1.00 0.00 C ATOM 273 O ASP A 18 -17.110 -2.700 5.603 1.00 0.00 O ATOM 274 CB ASP A 18 -17.103 0.079 6.655 1.00 0.00 C ATOM 275 CG ASP A 18 -18.334 -0.656 7.147 1.00 0.00 C ATOM 276 OD1 ASP A 18 -18.453 -0.861 8.374 1.00 0.00 O ATOM 277 OD2 ASP A 18 -19.180 -1.028 6.306 1.00 0.00 O ATOM 0 H ASP A 18 -14.897 0.834 5.738 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.702 -1.346 7.465 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -16.865 0.887 7.347 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -17.319 0.539 5.691 1.00 0.00 H new ATOM 282 N GLU A 19 -15.345 -1.963 4.418 1.00 0.00 N ATOM 283 CA GLU A 19 -15.493 -2.957 3.369 1.00 0.00 C ATOM 284 C GLU A 19 -14.401 -3.980 3.542 1.00 0.00 C ATOM 285 O GLU A 19 -14.611 -5.186 3.407 1.00 0.00 O ATOM 286 CB GLU A 19 -15.404 -2.315 1.982 1.00 0.00 C ATOM 287 CG GLU A 19 -16.759 -1.978 1.380 1.00 0.00 C ATOM 288 CD GLU A 19 -16.649 -1.071 0.169 1.00 0.00 C ATOM 289 OE1 GLU A 19 -15.616 -1.136 -0.529 1.00 0.00 O ATOM 290 OE2 GLU A 19 -17.595 -0.295 -0.079 1.00 0.00 O ATOM 0 H GLU A 19 -14.564 -1.321 4.282 1.00 0.00 H new ATOM 0 HA GLU A 19 -16.473 -3.427 3.445 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -14.809 -1.404 2.050 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -14.875 -2.992 1.311 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -17.265 -2.900 1.094 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -17.379 -1.495 2.136 1.00 0.00 H new ATOM 297 N SER A 20 -13.227 -3.466 3.873 1.00 0.00 N ATOM 298 CA SER A 20 -12.076 -4.278 4.108 1.00 0.00 C ATOM 299 C SER A 20 -12.232 -4.996 5.425 1.00 0.00 C ATOM 300 O SER A 20 -13.219 -4.821 6.139 1.00 0.00 O ATOM 301 CB SER A 20 -10.822 -3.413 4.139 1.00 0.00 C ATOM 302 OG SER A 20 -11.154 -2.064 4.413 1.00 0.00 O ATOM 0 H SER A 20 -13.060 -2.466 3.983 1.00 0.00 H new ATOM 0 HA SER A 20 -11.981 -5.007 3.303 1.00 0.00 H new ATOM 0 HB2 SER A 20 -10.135 -3.786 4.899 1.00 0.00 H new ATOM 0 HB3 SER A 20 -10.305 -3.479 3.182 1.00 0.00 H new ATOM 0 HG SER A 20 -10.345 -1.573 4.666 1.00 0.00 H new ATOM 308 N VAL A 21 -11.255 -5.800 5.728 1.00 0.00 N ATOM 309 CA VAL A 21 -11.253 -6.568 6.953 1.00 0.00 C ATOM 310 C VAL A 21 -9.845 -6.959 7.362 1.00 0.00 C ATOM 311 O VAL A 21 -9.079 -7.471 6.554 1.00 0.00 O ATOM 312 CB VAL A 21 -12.113 -7.829 6.795 1.00 0.00 C ATOM 313 CG1 VAL A 21 -11.758 -8.553 5.507 1.00 0.00 C ATOM 314 CG2 VAL A 21 -11.975 -8.749 8.001 1.00 0.00 C ATOM 0 H VAL A 21 -10.436 -5.946 5.139 1.00 0.00 H new ATOM 0 HA VAL A 21 -11.674 -5.937 7.736 1.00 0.00 H new ATOM 0 HB VAL A 21 -13.158 -7.523 6.739 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -12.376 -9.445 5.409 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -11.936 -7.893 4.658 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -10.707 -8.841 5.529 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -12.597 -9.633 7.858 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -10.934 -9.052 8.110 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -12.296 -8.222 8.899 1.00 0.00 H new ATOM 324 N GLU A 22 -9.515 -6.741 8.620 1.00 0.00 N ATOM 325 CA GLU A 22 -8.197 -7.109 9.112 1.00 0.00 C ATOM 326 C GLU A 22 -8.145 -8.614 9.376 1.00 0.00 C ATOM 327 O GLU A 22 -8.765 -9.107 10.319 1.00 0.00 O ATOM 328 CB GLU A 22 -7.874 -6.357 10.405 1.00 0.00 C ATOM 329 CG GLU A 22 -9.030 -6.312 11.391 1.00 0.00 C ATOM 330 CD GLU A 22 -8.578 -6.495 12.827 1.00 0.00 C ATOM 331 OE1 GLU A 22 -8.077 -7.592 13.157 1.00 0.00 O ATOM 332 OE2 GLU A 22 -8.725 -5.543 13.621 1.00 0.00 O ATOM 0 H GLU A 22 -10.130 -6.317 9.314 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.460 -6.842 8.355 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -7.017 -6.829 10.885 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -7.579 -5.337 10.158 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -9.547 -5.357 11.296 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -9.749 -7.091 11.138 1.00 0.00 H new ATOM 339 N GLY A 23 -7.405 -9.337 8.544 1.00 0.00 N ATOM 340 CA GLY A 23 -7.290 -10.774 8.709 1.00 0.00 C ATOM 341 C GLY A 23 -5.848 -11.241 8.697 1.00 0.00 C ATOM 342 O GLY A 23 -5.192 -11.275 9.738 1.00 0.00 O ATOM 0 H GLY A 23 -6.882 -8.953 7.757 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -7.757 -11.068 9.649 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.838 -11.274 7.911 1.00 0.00 H new ATOM 346 N PHE A 24 -5.352 -11.602 7.515 1.00 0.00 N ATOM 347 CA PHE A 24 -3.976 -12.070 7.367 1.00 0.00 C ATOM 348 C PHE A 24 -3.751 -12.677 5.985 1.00 0.00 C ATOM 349 O PHE A 24 -3.110 -13.720 5.851 1.00 0.00 O ATOM 350 CB PHE A 24 -3.636 -13.104 8.446 1.00 0.00 C ATOM 351 CG PHE A 24 -4.753 -14.069 8.732 1.00 0.00 C ATOM 352 CD1 PHE A 24 -5.276 -14.861 7.724 1.00 0.00 C ATOM 353 CD2 PHE A 24 -5.277 -14.182 10.010 1.00 0.00 C ATOM 354 CE1 PHE A 24 -6.303 -15.749 7.984 1.00 0.00 C ATOM 355 CE2 PHE A 24 -6.303 -15.068 10.276 1.00 0.00 C ATOM 356 CZ PHE A 24 -6.817 -15.852 9.262 1.00 0.00 C ATOM 0 H PHE A 24 -5.884 -11.579 6.645 1.00 0.00 H new ATOM 0 HA PHE A 24 -3.319 -11.208 7.482 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -2.754 -13.664 8.135 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -3.374 -12.583 9.367 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -4.877 -14.784 6.723 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -4.879 -13.571 10.807 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -6.703 -16.361 7.189 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -6.703 -15.147 11.276 1.00 0.00 H new ATOM 0 HZ PHE A 24 -7.620 -16.545 9.468 1.00 0.00 H new ATOM 366 N ASN A 25 -4.280 -12.021 4.957 1.00 0.00 N ATOM 367 CA ASN A 25 -4.129 -12.506 3.588 1.00 0.00 C ATOM 368 C ASN A 25 -4.746 -11.534 2.587 1.00 0.00 C ATOM 369 O ASN A 25 -5.410 -10.572 2.971 1.00 0.00 O ATOM 370 CB ASN A 25 -4.776 -13.885 3.443 1.00 0.00 C ATOM 371 CG ASN A 25 -3.894 -14.862 2.690 1.00 0.00 C ATOM 372 OD1 ASN A 25 -3.036 -15.521 3.278 1.00 0.00 O ATOM 373 ND2 ASN A 25 -4.101 -14.959 1.382 1.00 0.00 N ATOM 0 H ASN A 25 -4.814 -11.157 5.044 1.00 0.00 H new ATOM 0 HA ASN A 25 -3.063 -12.584 3.374 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -4.995 -14.286 4.433 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -5.728 -13.784 2.922 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -3.538 -15.599 0.823 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -4.823 -14.393 0.937 1.00 0.00 H new ATOM 380 N VAL A 26 -4.526 -11.795 1.299 1.00 0.00 N ATOM 381 CA VAL A 26 -5.066 -10.942 0.244 1.00 0.00 C ATOM 382 C VAL A 26 -6.561 -10.714 0.443 1.00 0.00 C ATOM 383 O VAL A 26 -7.345 -11.662 0.479 1.00 0.00 O ATOM 384 CB VAL A 26 -4.823 -11.547 -1.154 1.00 0.00 C ATOM 385 CG1 VAL A 26 -5.553 -12.874 -1.302 1.00 0.00 C ATOM 386 CG2 VAL A 26 -5.248 -10.570 -2.241 1.00 0.00 C ATOM 0 H VAL A 26 -3.979 -12.588 0.963 1.00 0.00 H new ATOM 0 HA VAL A 26 -4.543 -9.987 0.306 1.00 0.00 H new ATOM 0 HB VAL A 26 -3.755 -11.736 -1.265 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.368 -13.282 -2.295 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.192 -13.574 -0.549 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.623 -12.717 -1.168 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.069 -11.015 -3.220 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -6.309 -10.345 -2.133 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -4.671 -9.650 -2.149 1.00 0.00 H new ATOM 396 N GLY A 27 -6.946 -9.453 0.591 1.00 0.00 N ATOM 397 CA GLY A 27 -8.341 -9.123 0.805 1.00 0.00 C ATOM 398 C GLY A 27 -8.601 -8.660 2.226 1.00 0.00 C ATOM 399 O GLY A 27 -9.604 -8.003 2.501 1.00 0.00 O ATOM 0 H GLY A 27 -6.315 -8.652 0.567 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -8.640 -8.340 0.108 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -8.958 -9.995 0.589 1.00 0.00 H new ATOM 403 N GLU A 28 -7.682 -8.998 3.128 1.00 0.00 N ATOM 404 CA GLU A 28 -7.792 -8.616 4.520 1.00 0.00 C ATOM 405 C GLU A 28 -6.425 -8.225 5.051 1.00 0.00 C ATOM 406 O GLU A 28 -5.436 -8.908 4.798 1.00 0.00 O ATOM 407 CB GLU A 28 -8.381 -9.761 5.345 1.00 0.00 C ATOM 408 CG GLU A 28 -7.739 -11.110 5.058 1.00 0.00 C ATOM 409 CD GLU A 28 -8.452 -11.871 3.958 1.00 0.00 C ATOM 410 OE1 GLU A 28 -9.660 -11.628 3.754 1.00 0.00 O ATOM 411 OE2 GLU A 28 -7.802 -12.711 3.301 1.00 0.00 O ATOM 0 H GLU A 28 -6.847 -9.542 2.909 1.00 0.00 H new ATOM 0 HA GLU A 28 -8.462 -7.760 4.602 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -8.266 -9.531 6.404 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -9.451 -9.828 5.147 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -6.697 -10.960 4.775 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -7.739 -11.709 5.968 1.00 0.00 H new ATOM 418 N TYR A 29 -6.368 -7.114 5.765 1.00 0.00 N ATOM 419 CA TYR A 29 -5.103 -6.629 6.300 1.00 0.00 C ATOM 420 C TYR A 29 -4.860 -7.147 7.711 1.00 0.00 C ATOM 421 O TYR A 29 -5.692 -7.845 8.274 1.00 0.00 O ATOM 422 CB TYR A 29 -5.079 -5.102 6.271 1.00 0.00 C ATOM 423 CG TYR A 29 -6.000 -4.459 7.273 1.00 0.00 C ATOM 424 CD1 TYR A 29 -7.358 -4.287 7.002 1.00 0.00 C ATOM 425 CD2 TYR A 29 -5.507 -4.016 8.493 1.00 0.00 C ATOM 426 CE1 TYR A 29 -8.192 -3.692 7.923 1.00 0.00 C ATOM 427 CE2 TYR A 29 -6.342 -3.421 9.417 1.00 0.00 C ATOM 428 CZ TYR A 29 -7.681 -3.261 9.126 1.00 0.00 C ATOM 429 OH TYR A 29 -8.512 -2.672 10.047 1.00 0.00 O ATOM 0 H TYR A 29 -7.176 -6.533 5.988 1.00 0.00 H new ATOM 0 HA TYR A 29 -4.297 -7.009 5.672 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -4.061 -4.761 6.457 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -5.352 -4.763 5.272 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -7.760 -4.625 6.058 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -4.459 -4.138 8.722 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -9.241 -3.564 7.702 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -5.949 -3.082 10.364 1.00 0.00 H new ATOM 0 HH TYR A 29 -8.386 -3.098 10.921 1.00 0.00 H new ATOM 439 N HIS A 30 -3.707 -6.822 8.272 1.00 0.00 N ATOM 440 CA HIS A 30 -3.373 -7.287 9.615 1.00 0.00 C ATOM 441 C HIS A 30 -4.001 -6.405 10.688 1.00 0.00 C ATOM 442 O HIS A 30 -4.909 -6.829 11.399 1.00 0.00 O ATOM 443 CB HIS A 30 -1.863 -7.330 9.800 1.00 0.00 C ATOM 444 CG HIS A 30 -1.419 -8.275 10.874 1.00 0.00 C ATOM 445 ND1 HIS A 30 -1.661 -8.058 12.214 1.00 0.00 N ATOM 446 CD2 HIS A 30 -0.746 -9.448 10.800 1.00 0.00 C ATOM 447 CE1 HIS A 30 -1.155 -9.056 12.918 1.00 0.00 C ATOM 448 NE2 HIS A 30 -0.595 -9.912 12.084 1.00 0.00 N ATOM 0 H HIS A 30 -2.992 -6.246 7.828 1.00 0.00 H new ATOM 0 HA HIS A 30 -3.780 -8.292 9.724 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -1.398 -7.619 8.858 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -1.505 -6.328 10.038 1.00 0.00 H new ATOM 0 HD1 HIS A 30 -2.153 -7.253 12.602 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -0.394 -9.929 9.899 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -1.193 -9.154 13.993 1.00 0.00 H new ATOM 457 N LYS A 31 -3.505 -5.179 10.806 1.00 0.00 N ATOM 458 CA LYS A 31 -4.016 -4.245 11.800 1.00 0.00 C ATOM 459 C LYS A 31 -3.442 -2.853 11.578 1.00 0.00 C ATOM 460 O LYS A 31 -2.337 -2.702 11.054 1.00 0.00 O ATOM 461 CB LYS A 31 -3.674 -4.731 13.210 1.00 0.00 C ATOM 462 CG LYS A 31 -4.704 -4.338 14.255 1.00 0.00 C ATOM 463 CD LYS A 31 -5.913 -5.258 14.220 1.00 0.00 C ATOM 464 CE LYS A 31 -5.787 -6.383 15.236 1.00 0.00 C ATOM 465 NZ LYS A 31 -6.508 -6.071 16.501 1.00 0.00 N ATOM 0 H LYS A 31 -2.751 -4.810 10.227 1.00 0.00 H new ATOM 0 HA LYS A 31 -5.100 -4.195 11.694 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.577 -5.817 13.198 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.703 -4.328 13.499 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -4.250 -4.370 15.245 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -5.023 -3.310 14.084 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -6.816 -4.682 14.423 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -6.022 -5.679 13.221 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -6.184 -7.304 14.809 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -4.734 -6.560 15.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -6.398 -6.862 17.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -6.112 -5.206 16.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -7.518 -5.927 16.298 1.00 0.00 H new ATOM 479 N GLY A 32 -4.196 -1.836 11.977 1.00 0.00 N ATOM 480 CA GLY A 32 -3.742 -0.471 11.811 1.00 0.00 C ATOM 481 C GLY A 32 -4.426 0.234 10.657 1.00 0.00 C ATOM 482 O GLY A 32 -4.477 1.463 10.619 1.00 0.00 O ATOM 0 H GLY A 32 -5.113 -1.933 12.412 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -3.926 0.084 12.731 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.664 -0.468 11.647 1.00 0.00 H new ATOM 486 N ALA A 33 -4.959 -0.540 9.714 1.00 0.00 N ATOM 487 CA ALA A 33 -5.640 0.035 8.563 1.00 0.00 C ATOM 488 C ALA A 33 -6.961 0.676 8.977 1.00 0.00 C ATOM 489 O ALA A 33 -7.229 1.833 8.656 1.00 0.00 O ATOM 490 CB ALA A 33 -5.871 -1.030 7.501 1.00 0.00 C ATOM 0 H ALA A 33 -4.932 -1.560 9.726 1.00 0.00 H new ATOM 0 HA ALA A 33 -5.005 0.814 8.142 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -6.381 -0.586 6.646 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -4.912 -1.438 7.180 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -6.485 -1.830 7.915 1.00 0.00 H new ATOM 496 N LYS A 34 -7.781 -0.087 9.696 1.00 0.00 N ATOM 497 CA LYS A 34 -9.083 0.392 10.162 1.00 0.00 C ATOM 498 C LYS A 34 -9.020 1.829 10.687 1.00 0.00 C ATOM 499 O LYS A 34 -10.020 2.545 10.654 1.00 0.00 O ATOM 500 CB LYS A 34 -9.622 -0.527 11.262 1.00 0.00 C ATOM 501 CG LYS A 34 -10.772 -1.412 10.807 1.00 0.00 C ATOM 502 CD LYS A 34 -12.118 -0.726 11.000 1.00 0.00 C ATOM 503 CE LYS A 34 -12.767 -0.381 9.668 1.00 0.00 C ATOM 504 NZ LYS A 34 -14.205 -0.768 9.635 1.00 0.00 N ATOM 0 H LYS A 34 -7.566 -1.046 9.971 1.00 0.00 H new ATOM 0 HA LYS A 34 -9.753 0.379 9.302 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -8.811 -1.158 11.626 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -9.954 0.082 12.103 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -10.641 -1.668 9.756 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -10.756 -2.347 11.367 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -12.780 -1.377 11.570 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -11.983 0.183 11.586 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -12.675 0.690 9.486 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -12.236 -0.889 8.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -14.718 -0.142 8.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -14.292 -1.752 9.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -14.610 -0.680 10.589 1.00 0.00 H new ATOM 518 N ASP A 35 -7.860 2.243 11.193 1.00 0.00 N ATOM 519 CA ASP A 35 -7.720 3.590 11.739 1.00 0.00 C ATOM 520 C ASP A 35 -7.216 4.591 10.699 1.00 0.00 C ATOM 521 O ASP A 35 -7.962 5.454 10.268 1.00 0.00 O ATOM 522 CB ASP A 35 -6.783 3.584 12.944 1.00 0.00 C ATOM 523 CG ASP A 35 -7.059 2.432 13.890 1.00 0.00 C ATOM 524 OD1 ASP A 35 -8.138 2.425 14.518 1.00 0.00 O ATOM 525 OD2 ASP A 35 -6.195 1.537 14.004 1.00 0.00 O ATOM 0 H ASP A 35 -7.015 1.674 11.236 1.00 0.00 H new ATOM 0 HA ASP A 35 -8.715 3.909 12.050 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -5.751 3.526 12.597 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -6.885 4.525 13.484 1.00 0.00 H new ATOM 530 N GLY A 36 -5.945 4.477 10.310 1.00 0.00 N ATOM 531 CA GLY A 36 -5.359 5.388 9.332 1.00 0.00 C ATOM 532 C GLY A 36 -6.363 5.918 8.326 1.00 0.00 C ATOM 533 O GLY A 36 -6.826 7.053 8.441 1.00 0.00 O ATOM 0 H GLY A 36 -5.305 3.763 10.658 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -4.903 6.228 9.856 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.560 4.873 8.800 1.00 0.00 H new ATOM 537 N LEU A 37 -6.702 5.095 7.342 1.00 0.00 N ATOM 538 CA LEU A 37 -7.653 5.475 6.316 1.00 0.00 C ATOM 539 C LEU A 37 -8.940 6.063 6.914 1.00 0.00 C ATOM 540 O LEU A 37 -9.677 6.760 6.224 1.00 0.00 O ATOM 541 CB LEU A 37 -7.957 4.262 5.441 1.00 0.00 C ATOM 542 CG LEU A 37 -9.369 4.198 4.882 1.00 0.00 C ATOM 543 CD1 LEU A 37 -9.566 5.324 3.890 1.00 0.00 C ATOM 544 CD2 LEU A 37 -9.631 2.842 4.243 1.00 0.00 C ATOM 0 H LEU A 37 -6.326 4.153 7.236 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.209 6.261 5.705 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -7.254 4.251 4.608 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -7.774 3.360 6.024 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.087 4.318 5.693 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -10.578 5.281 3.487 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.415 6.280 4.391 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.847 5.223 3.077 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -10.647 2.816 3.849 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -8.922 2.679 3.431 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.512 2.058 4.991 1.00 0.00 H new ATOM 556 N THR A 38 -9.213 5.789 8.190 1.00 0.00 N ATOM 557 CA THR A 38 -10.405 6.333 8.837 1.00 0.00 C ATOM 558 C THR A 38 -10.051 7.605 9.601 1.00 0.00 C ATOM 559 O THR A 38 -10.808 8.570 9.606 1.00 0.00 O ATOM 560 CB THR A 38 -11.072 5.309 9.766 1.00 0.00 C ATOM 561 OG1 THR A 38 -12.480 5.365 9.637 1.00 0.00 O ATOM 562 CG2 THR A 38 -10.750 5.513 11.219 1.00 0.00 C ATOM 0 H THR A 38 -8.633 5.201 8.789 1.00 0.00 H new ATOM 0 HA THR A 38 -11.127 6.575 8.057 1.00 0.00 H new ATOM 0 HB THR A 38 -10.675 4.343 9.455 1.00 0.00 H new ATOM 0 HG1 THR A 38 -12.885 4.633 10.148 1.00 0.00 H new ATOM 0 HG21 THR A 38 -11.256 4.753 11.814 1.00 0.00 H new ATOM 0 HG22 THR A 38 -9.673 5.433 11.368 1.00 0.00 H new ATOM 0 HG23 THR A 38 -11.087 6.502 11.531 1.00 0.00 H new ATOM 570 N VAL A 39 -8.880 7.600 10.234 1.00 0.00 N ATOM 571 CA VAL A 39 -8.407 8.755 10.982 1.00 0.00 C ATOM 572 C VAL A 39 -8.498 9.980 10.095 1.00 0.00 C ATOM 573 O VAL A 39 -8.875 11.067 10.534 1.00 0.00 O ATOM 574 CB VAL A 39 -6.957 8.536 11.464 1.00 0.00 C ATOM 575 CG1 VAL A 39 -6.299 9.838 11.894 1.00 0.00 C ATOM 576 CG2 VAL A 39 -6.949 7.532 12.601 1.00 0.00 C ATOM 0 H VAL A 39 -8.242 6.804 10.242 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.029 8.898 11.866 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.375 8.146 10.629 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -5.280 9.638 12.226 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.278 10.530 11.052 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -6.867 10.280 12.713 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.925 7.377 12.942 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -7.553 7.911 13.426 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.363 6.586 12.254 1.00 0.00 H new ATOM 586 N GLU A 40 -8.198 9.766 8.823 1.00 0.00 N ATOM 587 CA GLU A 40 -8.292 10.814 7.831 1.00 0.00 C ATOM 588 C GLU A 40 -9.753 11.217 7.699 1.00 0.00 C ATOM 589 O GLU A 40 -10.069 12.389 7.543 1.00 0.00 O ATOM 590 CB GLU A 40 -7.764 10.315 6.490 1.00 0.00 C ATOM 591 CG GLU A 40 -8.252 8.917 6.148 1.00 0.00 C ATOM 592 CD GLU A 40 -8.886 8.834 4.770 1.00 0.00 C ATOM 593 OE1 GLU A 40 -8.151 8.939 3.767 1.00 0.00 O ATOM 594 OE2 GLU A 40 -10.120 8.663 4.697 1.00 0.00 O ATOM 0 H GLU A 40 -7.885 8.867 8.456 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.693 11.672 8.136 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -8.072 11.005 5.704 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -6.674 10.320 6.509 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.414 8.222 6.199 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.977 8.597 6.896 1.00 0.00 H new ATOM 601 N ILE A 41 -10.635 10.216 7.796 1.00 0.00 N ATOM 602 CA ILE A 41 -12.076 10.427 7.724 1.00 0.00 C ATOM 603 C ILE A 41 -12.556 11.169 8.956 1.00 0.00 C ATOM 604 O ILE A 41 -13.140 12.247 8.851 1.00 0.00 O ATOM 605 CB ILE A 41 -12.844 9.099 7.624 1.00 0.00 C ATOM 606 CG1 ILE A 41 -12.316 8.264 6.463 1.00 0.00 C ATOM 607 CG2 ILE A 41 -14.333 9.357 7.463 1.00 0.00 C ATOM 608 CD1 ILE A 41 -12.933 6.887 6.392 1.00 0.00 C ATOM 0 H ILE A 41 -10.366 9.241 7.926 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.270 11.012 6.825 1.00 0.00 H new ATOM 0 HB ILE A 41 -12.690 8.540 8.547 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -12.509 8.790 5.528 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -11.234 8.166 6.556 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -14.862 8.406 7.394 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -14.701 9.915 8.324 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -14.506 9.935 6.555 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -12.515 6.344 5.544 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -12.718 6.344 7.312 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -14.012 6.978 6.268 1.00 0.00 H new ATOM 620 N ASN A 42 -12.287 10.600 10.133 1.00 0.00 N ATOM 621 CA ASN A 42 -12.676 11.243 11.383 1.00 0.00 C ATOM 622 C ASN A 42 -12.268 12.708 11.328 1.00 0.00 C ATOM 623 O ASN A 42 -12.953 13.586 11.852 1.00 0.00 O ATOM 624 CB ASN A 42 -12.008 10.562 12.583 1.00 0.00 C ATOM 625 CG ASN A 42 -12.011 9.048 12.482 1.00 0.00 C ATOM 626 OD1 ASN A 42 -12.862 8.460 11.815 1.00 0.00 O ATOM 627 ND2 ASN A 42 -11.055 8.409 13.150 1.00 0.00 N ATOM 0 H ASN A 42 -11.807 9.707 10.244 1.00 0.00 H new ATOM 0 HA ASN A 42 -13.756 11.157 11.506 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -10.980 10.913 12.667 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -12.522 10.861 13.496 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -11.007 7.391 13.122 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -10.370 8.937 13.690 1.00 0.00 H new ATOM 634 N LYS A 43 -11.141 12.949 10.665 1.00 0.00 N ATOM 635 CA LYS A 43 -10.614 14.303 10.503 1.00 0.00 C ATOM 636 C LYS A 43 -11.093 14.952 9.195 1.00 0.00 C ATOM 637 O LYS A 43 -11.091 16.176 9.069 1.00 0.00 O ATOM 638 CB LYS A 43 -9.084 14.280 10.538 1.00 0.00 C ATOM 639 CG LYS A 43 -8.461 15.644 10.787 1.00 0.00 C ATOM 640 CD LYS A 43 -7.006 15.523 11.205 1.00 0.00 C ATOM 641 CE LYS A 43 -6.141 14.994 10.072 1.00 0.00 C ATOM 642 NZ LYS A 43 -5.081 14.072 10.565 1.00 0.00 N ATOM 0 H LYS A 43 -10.572 12.223 10.229 1.00 0.00 H new ATOM 0 HA LYS A 43 -10.992 14.902 11.331 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -8.757 13.592 11.318 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -8.713 13.888 9.591 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -8.532 16.248 9.883 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -9.022 16.165 11.563 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -6.635 16.498 11.522 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -6.928 14.857 12.065 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -6.769 14.472 9.350 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -5.679 15.830 9.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -4.514 13.734 9.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -4.466 14.577 11.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -5.522 13.261 11.043 1.00 0.00 H new ATOM 656 N ALA A 44 -11.495 14.130 8.222 1.00 0.00 N ATOM 657 CA ALA A 44 -11.963 14.635 6.930 1.00 0.00 C ATOM 658 C ALA A 44 -13.447 14.958 6.971 1.00 0.00 C ATOM 659 O ALA A 44 -13.852 16.085 6.696 1.00 0.00 O ATOM 660 CB ALA A 44 -11.689 13.624 5.824 1.00 0.00 C ATOM 0 H ALA A 44 -11.506 13.113 8.305 1.00 0.00 H new ATOM 0 HA ALA A 44 -11.413 15.552 6.719 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -12.045 14.020 4.873 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -10.617 13.436 5.761 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -12.209 12.692 6.046 1.00 0.00 H new ATOM 666 N GLU A 45 -14.254 13.960 7.312 1.00 0.00 N ATOM 667 CA GLU A 45 -15.698 14.138 7.389 1.00 0.00 C ATOM 668 C GLU A 45 -16.045 15.390 8.182 1.00 0.00 C ATOM 669 O GLU A 45 -16.944 16.146 7.811 1.00 0.00 O ATOM 670 CB GLU A 45 -16.344 12.915 8.031 1.00 0.00 C ATOM 671 CG GLU A 45 -16.883 11.933 7.014 1.00 0.00 C ATOM 672 CD GLU A 45 -18.346 12.176 6.698 1.00 0.00 C ATOM 673 OE1 GLU A 45 -19.202 11.797 7.524 1.00 0.00 O ATOM 674 OE2 GLU A 45 -18.635 12.747 5.625 1.00 0.00 O ATOM 0 H GLU A 45 -13.932 13.019 7.540 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.085 14.254 6.376 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -15.611 12.412 8.662 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.156 13.239 8.682 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.299 12.006 6.097 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -16.759 10.918 7.391 1.00 0.00 H new ATOM 681 N GLU A 46 -15.312 15.611 9.265 1.00 0.00 N ATOM 682 CA GLU A 46 -15.526 16.781 10.100 1.00 0.00 C ATOM 683 C GLU A 46 -15.349 18.050 9.275 1.00 0.00 C ATOM 684 O GLU A 46 -15.905 19.096 9.605 1.00 0.00 O ATOM 685 CB GLU A 46 -14.550 16.782 11.279 1.00 0.00 C ATOM 686 CG GLU A 46 -13.090 16.746 10.862 1.00 0.00 C ATOM 687 CD GLU A 46 -12.207 17.599 11.750 1.00 0.00 C ATOM 688 OE1 GLU A 46 -11.727 17.084 12.782 1.00 0.00 O ATOM 689 OE2 GLU A 46 -11.997 18.784 11.416 1.00 0.00 O ATOM 0 H GLU A 46 -14.565 14.995 9.584 1.00 0.00 H new ATOM 0 HA GLU A 46 -16.543 16.749 10.490 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -14.724 17.672 11.883 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -14.759 15.921 11.913 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -12.735 15.716 10.886 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -13.002 17.090 9.831 1.00 0.00 H new ATOM 696 N VAL A 47 -14.580 17.939 8.191 1.00 0.00 N ATOM 697 CA VAL A 47 -14.338 19.066 7.302 1.00 0.00 C ATOM 698 C VAL A 47 -15.289 19.020 6.111 1.00 0.00 C ATOM 699 O VAL A 47 -15.855 20.038 5.716 1.00 0.00 O ATOM 700 CB VAL A 47 -12.859 19.115 6.829 1.00 0.00 C ATOM 701 CG1 VAL A 47 -12.727 19.361 5.328 1.00 0.00 C ATOM 702 CG2 VAL A 47 -12.127 20.203 7.587 1.00 0.00 C ATOM 0 H VAL A 47 -14.115 17.076 7.911 1.00 0.00 H new ATOM 0 HA VAL A 47 -14.530 19.980 7.864 1.00 0.00 H new ATOM 0 HB VAL A 47 -12.419 18.139 7.034 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.672 19.385 5.055 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -13.225 18.559 4.783 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -13.190 20.314 5.073 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.089 20.240 7.258 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -12.604 21.164 7.395 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -12.161 19.988 8.655 1.00 0.00 H new ATOM 712 N PHE A 48 -15.463 17.828 5.544 1.00 0.00 N ATOM 713 CA PHE A 48 -16.349 17.650 4.397 1.00 0.00 C ATOM 714 C PHE A 48 -17.706 18.294 4.656 1.00 0.00 C ATOM 715 O PHE A 48 -18.242 19.004 3.807 1.00 0.00 O ATOM 716 CB PHE A 48 -16.536 16.163 4.087 1.00 0.00 C ATOM 717 CG PHE A 48 -17.543 15.901 3.000 1.00 0.00 C ATOM 718 CD1 PHE A 48 -17.502 16.618 1.815 1.00 0.00 C ATOM 719 CD2 PHE A 48 -18.529 14.943 3.167 1.00 0.00 C ATOM 720 CE1 PHE A 48 -18.427 16.382 0.816 1.00 0.00 C ATOM 721 CE2 PHE A 48 -19.457 14.703 2.170 1.00 0.00 C ATOM 722 CZ PHE A 48 -19.405 15.425 0.994 1.00 0.00 C ATOM 0 H PHE A 48 -15.003 16.974 5.859 1.00 0.00 H new ATOM 0 HA PHE A 48 -15.886 18.137 3.539 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -15.577 15.737 3.793 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -16.849 15.647 4.994 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -16.739 17.369 1.671 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -18.574 14.377 4.086 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -18.385 16.946 -0.104 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -20.221 13.952 2.311 1.00 0.00 H new ATOM 0 HZ PHE A 48 -20.129 15.241 0.214 1.00 0.00 H new ATOM 732 N ASN A 49 -18.257 18.039 5.838 1.00 0.00 N ATOM 733 CA ASN A 49 -19.552 18.596 6.206 1.00 0.00 C ATOM 734 C ASN A 49 -19.393 19.910 6.968 1.00 0.00 C ATOM 735 O ASN A 49 -20.359 20.435 7.520 1.00 0.00 O ATOM 736 CB ASN A 49 -20.337 17.594 7.056 1.00 0.00 C ATOM 737 CG ASN A 49 -20.469 16.243 6.380 1.00 0.00 C ATOM 738 OD1 ASN A 49 -21.490 15.942 5.762 1.00 0.00 O ATOM 739 ND2 ASN A 49 -19.433 15.420 6.497 1.00 0.00 N ATOM 0 H ASN A 49 -17.829 17.453 6.554 1.00 0.00 H new ATOM 0 HA ASN A 49 -20.102 18.798 5.287 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -19.840 17.469 8.018 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -21.330 17.994 7.260 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -19.464 14.497 6.065 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -18.607 15.711 7.019 1.00 0.00 H new ATOM 746 N LYS A 50 -18.168 20.435 7.007 1.00 0.00 N ATOM 747 CA LYS A 50 -17.904 21.686 7.718 1.00 0.00 C ATOM 748 C LYS A 50 -18.087 22.903 6.816 1.00 0.00 C ATOM 749 O LYS A 50 -18.164 22.779 5.593 1.00 0.00 O ATOM 750 CB LYS A 50 -16.485 21.673 8.277 1.00 0.00 C ATOM 751 CG LYS A 50 -16.365 22.258 9.673 1.00 0.00 C ATOM 752 CD LYS A 50 -14.908 22.399 10.089 1.00 0.00 C ATOM 753 CE LYS A 50 -14.505 23.857 10.222 1.00 0.00 C ATOM 754 NZ LYS A 50 -14.991 24.455 11.496 1.00 0.00 N ATOM 0 H LYS A 50 -17.351 20.019 6.560 1.00 0.00 H new ATOM 0 HA LYS A 50 -18.625 21.762 8.532 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -16.121 20.646 8.292 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -15.835 22.231 7.603 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -16.850 23.233 9.704 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -16.888 21.619 10.384 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -14.749 21.889 11.039 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -14.270 21.910 9.353 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -13.419 23.939 10.174 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -14.905 24.422 9.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -15.550 25.307 11.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -15.585 23.765 11.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -14.178 24.711 12.092 1.00 0.00 H new ATOM 768 N GLU A 51 -18.142 24.083 7.433 1.00 0.00 N ATOM 769 CA GLU A 51 -18.301 25.331 6.695 1.00 0.00 C ATOM 770 C GLU A 51 -16.956 25.983 6.463 1.00 0.00 C ATOM 771 O GLU A 51 -16.753 26.653 5.451 1.00 0.00 O ATOM 772 CB GLU A 51 -19.240 26.287 7.433 1.00 0.00 C ATOM 773 CG GLU A 51 -20.129 27.102 6.507 1.00 0.00 C ATOM 774 CD GLU A 51 -19.635 28.524 6.329 1.00 0.00 C ATOM 775 OE1 GLU A 51 -18.466 28.701 5.925 1.00 0.00 O ATOM 776 OE2 GLU A 51 -20.418 29.461 6.592 1.00 0.00 O ATOM 0 H GLU A 51 -18.078 24.199 8.444 1.00 0.00 H new ATOM 0 HA GLU A 51 -18.746 25.099 5.728 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -19.868 25.713 8.114 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -18.646 26.967 8.044 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -20.178 26.614 5.534 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -21.143 27.121 6.906 1.00 0.00 H new ATOM 783 N ASP A 52 -16.017 25.752 7.370 1.00 0.00 N ATOM 784 CA ASP A 52 -14.689 26.296 7.188 1.00 0.00 C ATOM 785 C ASP A 52 -13.884 25.375 6.294 1.00 0.00 C ATOM 786 O ASP A 52 -12.664 25.491 6.206 1.00 0.00 O ATOM 787 CB ASP A 52 -13.955 26.518 8.510 1.00 0.00 C ATOM 788 CG ASP A 52 -14.869 27.007 9.617 1.00 0.00 C ATOM 789 OD1 ASP A 52 -15.897 26.346 9.876 1.00 0.00 O ATOM 790 OD2 ASP A 52 -14.557 28.053 10.225 1.00 0.00 O ATOM 0 H ASP A 52 -16.150 25.203 8.220 1.00 0.00 H new ATOM 0 HA ASP A 52 -14.798 27.275 6.720 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -13.484 25.585 8.820 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -13.156 27.243 8.359 1.00 0.00 H new ATOM 795 N ALA A 53 -14.584 24.488 5.585 1.00 0.00 N ATOM 796 CA ALA A 53 -13.947 23.589 4.656 1.00 0.00 C ATOM 797 C ALA A 53 -13.619 24.385 3.416 1.00 0.00 C ATOM 798 O ALA A 53 -13.994 24.035 2.301 1.00 0.00 O ATOM 799 CB ALA A 53 -14.842 22.402 4.338 1.00 0.00 C ATOM 0 H ALA A 53 -15.597 24.383 5.646 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.036 23.174 5.088 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -14.334 21.742 3.635 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -15.061 21.856 5.255 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -15.773 22.756 3.896 1.00 0.00 H new ATOM 805 N THR A 54 -12.939 25.490 3.663 1.00 0.00 N ATOM 806 CA THR A 54 -12.535 26.423 2.636 1.00 0.00 C ATOM 807 C THR A 54 -11.117 26.128 2.166 1.00 0.00 C ATOM 808 O THR A 54 -10.793 25.008 1.781 1.00 0.00 O ATOM 809 CB THR A 54 -12.667 27.848 3.185 1.00 0.00 C ATOM 810 OG1 THR A 54 -11.628 28.131 4.107 1.00 0.00 O ATOM 811 CG2 THR A 54 -13.986 28.096 3.891 1.00 0.00 C ATOM 0 H THR A 54 -12.649 25.766 4.601 1.00 0.00 H new ATOM 0 HA THR A 54 -13.183 26.320 1.765 1.00 0.00 H new ATOM 0 HB THR A 54 -12.609 28.500 2.313 1.00 0.00 H new ATOM 0 HG1 THR A 54 -11.730 29.046 4.444 1.00 0.00 H new ATOM 0 HG21 THR A 54 -14.016 29.123 4.256 1.00 0.00 H new ATOM 0 HG22 THR A 54 -14.808 27.935 3.194 1.00 0.00 H new ATOM 0 HG23 THR A 54 -14.083 27.409 4.732 1.00 0.00 H new ATOM 819 N GLU A 55 -10.289 27.140 2.180 1.00 0.00 N ATOM 820 CA GLU A 55 -8.907 27.003 1.736 1.00 0.00 C ATOM 821 C GLU A 55 -7.981 26.523 2.855 1.00 0.00 C ATOM 822 O GLU A 55 -6.881 26.041 2.586 1.00 0.00 O ATOM 823 CB GLU A 55 -8.399 28.337 1.185 1.00 0.00 C ATOM 824 CG GLU A 55 -7.387 28.185 0.061 1.00 0.00 C ATOM 825 CD GLU A 55 -7.581 29.209 -1.041 1.00 0.00 C ATOM 826 OE1 GLU A 55 -7.028 30.322 -0.920 1.00 0.00 O ATOM 827 OE2 GLU A 55 -8.286 28.897 -2.023 1.00 0.00 O ATOM 0 H GLU A 55 -10.540 28.077 2.494 1.00 0.00 H new ATOM 0 HA GLU A 55 -8.895 26.246 0.952 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -9.247 28.918 0.823 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -7.946 28.907 1.996 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -6.380 28.281 0.468 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -7.466 27.183 -0.361 1.00 0.00 H new ATOM 834 N GLU A 56 -8.405 26.680 4.106 1.00 0.00 N ATOM 835 CA GLU A 56 -7.571 26.278 5.236 1.00 0.00 C ATOM 836 C GLU A 56 -7.905 24.885 5.785 1.00 0.00 C ATOM 837 O GLU A 56 -7.009 24.070 6.001 1.00 0.00 O ATOM 838 CB GLU A 56 -7.668 27.317 6.361 1.00 0.00 C ATOM 839 CG GLU A 56 -8.939 27.218 7.190 1.00 0.00 C ATOM 840 CD GLU A 56 -9.084 28.362 8.174 1.00 0.00 C ATOM 841 OE1 GLU A 56 -9.274 29.512 7.723 1.00 0.00 O ATOM 842 OE2 GLU A 56 -9.007 28.110 9.395 1.00 0.00 O ATOM 0 H GLU A 56 -9.309 27.077 4.362 1.00 0.00 H new ATOM 0 HA GLU A 56 -6.551 26.225 4.856 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.807 27.204 7.020 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.608 28.315 5.926 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -9.802 27.204 6.525 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -8.941 26.273 7.734 1.00 0.00 H new ATOM 849 N GLU A 57 -9.183 24.634 6.065 1.00 0.00 N ATOM 850 CA GLU A 57 -9.602 23.360 6.656 1.00 0.00 C ATOM 851 C GLU A 57 -9.565 22.180 5.681 1.00 0.00 C ATOM 852 O GLU A 57 -9.204 21.070 6.073 1.00 0.00 O ATOM 853 CB GLU A 57 -11.002 23.499 7.253 1.00 0.00 C ATOM 854 CG GLU A 57 -11.159 22.807 8.597 1.00 0.00 C ATOM 855 CD GLU A 57 -10.700 23.672 9.755 1.00 0.00 C ATOM 856 OE1 GLU A 57 -10.857 24.908 9.672 1.00 0.00 O ATOM 857 OE2 GLU A 57 -10.183 23.112 10.744 1.00 0.00 O ATOM 0 H GLU A 57 -9.944 25.291 5.894 1.00 0.00 H new ATOM 0 HA GLU A 57 -8.875 23.132 7.435 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -11.236 24.557 7.369 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -11.729 23.087 6.554 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -12.205 22.537 8.742 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -10.588 21.879 8.593 1.00 0.00 H new ATOM 864 N ILE A 58 -9.949 22.397 4.429 1.00 0.00 N ATOM 865 CA ILE A 58 -9.958 21.311 3.448 1.00 0.00 C ATOM 866 C ILE A 58 -8.594 20.652 3.340 1.00 0.00 C ATOM 867 O ILE A 58 -8.434 19.484 3.681 1.00 0.00 O ATOM 868 CB ILE A 58 -10.382 21.801 2.057 1.00 0.00 C ATOM 869 CG1 ILE A 58 -11.741 22.484 2.144 1.00 0.00 C ATOM 870 CG2 ILE A 58 -10.424 20.643 1.067 1.00 0.00 C ATOM 871 CD1 ILE A 58 -12.277 22.955 0.811 1.00 0.00 C ATOM 0 H ILE A 58 -10.255 23.301 4.069 1.00 0.00 H new ATOM 0 HA ILE A 58 -10.687 20.583 3.805 1.00 0.00 H new ATOM 0 HB ILE A 58 -9.647 22.522 1.698 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -12.457 21.792 2.588 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -11.665 23.339 2.816 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -10.727 21.013 0.087 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -9.435 20.190 0.994 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -11.140 19.897 1.410 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -13.247 23.430 0.956 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -11.583 23.673 0.373 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -12.388 22.102 0.141 1.00 0.00 H new ATOM 883 N ASN A 59 -7.613 21.406 2.858 1.00 0.00 N ATOM 884 CA ASN A 59 -6.255 20.878 2.705 1.00 0.00 C ATOM 885 C ASN A 59 -5.819 20.168 3.980 1.00 0.00 C ATOM 886 O ASN A 59 -5.186 19.114 3.934 1.00 0.00 O ATOM 887 CB ASN A 59 -5.247 21.987 2.356 1.00 0.00 C ATOM 888 CG ASN A 59 -5.818 23.388 2.481 1.00 0.00 C ATOM 889 OD1 ASN A 59 -6.861 23.697 1.905 1.00 0.00 O ATOM 890 ND2 ASN A 59 -5.135 24.241 3.236 1.00 0.00 N ATOM 0 H ASN A 59 -7.727 22.377 2.568 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.272 20.167 1.879 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -4.380 21.897 3.010 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -4.893 21.837 1.336 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -5.471 25.197 3.357 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -4.275 23.940 3.695 1.00 0.00 H new ATOM 897 N LEU A 60 -6.178 20.751 5.117 1.00 0.00 N ATOM 898 CA LEU A 60 -5.842 20.173 6.410 1.00 0.00 C ATOM 899 C LEU A 60 -6.551 18.835 6.594 1.00 0.00 C ATOM 900 O LEU A 60 -6.043 17.940 7.270 1.00 0.00 O ATOM 901 CB LEU A 60 -6.229 21.133 7.540 1.00 0.00 C ATOM 902 CG LEU A 60 -5.390 22.410 7.623 1.00 0.00 C ATOM 903 CD1 LEU A 60 -6.090 23.459 8.477 1.00 0.00 C ATOM 904 CD2 LEU A 60 -4.009 22.102 8.183 1.00 0.00 C ATOM 0 H LEU A 60 -6.702 21.624 5.169 1.00 0.00 H new ATOM 0 HA LEU A 60 -4.765 20.007 6.444 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.275 21.412 7.416 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.150 20.603 8.489 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.274 22.811 6.616 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -5.477 24.359 8.523 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -7.057 23.701 8.036 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -6.238 23.069 9.484 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.425 23.021 8.236 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -4.108 21.677 9.182 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.504 21.387 7.533 1.00 0.00 H new ATOM 916 N ALA A 61 -7.731 18.706 5.989 1.00 0.00 N ATOM 917 CA ALA A 61 -8.510 17.477 6.087 1.00 0.00 C ATOM 918 C ALA A 61 -8.257 16.546 4.898 1.00 0.00 C ATOM 919 O ALA A 61 -8.532 15.349 4.968 1.00 0.00 O ATOM 920 CB ALA A 61 -9.990 17.814 6.181 1.00 0.00 C ATOM 0 H ALA A 61 -8.166 19.438 5.427 1.00 0.00 H new ATOM 0 HA ALA A 61 -8.194 16.951 6.988 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.569 16.893 6.254 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -10.168 18.426 7.065 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.295 18.365 5.291 1.00 0.00 H new ATOM 926 N LYS A 62 -7.743 17.106 3.807 1.00 0.00 N ATOM 927 CA LYS A 62 -7.465 16.338 2.603 1.00 0.00 C ATOM 928 C LYS A 62 -6.029 15.807 2.601 1.00 0.00 C ATOM 929 O LYS A 62 -5.722 14.817 1.937 1.00 0.00 O ATOM 930 CB LYS A 62 -7.711 17.211 1.362 1.00 0.00 C ATOM 931 CG LYS A 62 -6.468 17.912 0.831 1.00 0.00 C ATOM 932 CD LYS A 62 -5.745 17.061 -0.200 1.00 0.00 C ATOM 933 CE LYS A 62 -4.995 17.921 -1.205 1.00 0.00 C ATOM 934 NZ LYS A 62 -4.709 17.180 -2.465 1.00 0.00 N ATOM 0 H LYS A 62 -7.510 18.096 3.735 1.00 0.00 H new ATOM 0 HA LYS A 62 -8.137 15.480 2.581 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.128 16.588 0.571 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.462 17.963 1.605 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -6.750 18.865 0.384 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -5.794 18.135 1.658 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -5.045 16.394 0.303 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -6.465 16.432 -0.723 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -5.583 18.810 -1.432 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -4.059 18.262 -0.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -3.683 17.035 -2.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -5.189 16.257 -2.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -5.055 17.730 -3.277 1.00 0.00 H new ATOM 948 N GLU A 63 -5.156 16.492 3.336 1.00 0.00 N ATOM 949 CA GLU A 63 -3.742 16.126 3.420 1.00 0.00 C ATOM 950 C GLU A 63 -3.528 14.617 3.540 1.00 0.00 C ATOM 951 O GLU A 63 -2.840 14.015 2.715 1.00 0.00 O ATOM 952 CB GLU A 63 -3.090 16.832 4.609 1.00 0.00 C ATOM 953 CG GLU A 63 -1.617 17.145 4.399 1.00 0.00 C ATOM 954 CD GLU A 63 -0.832 17.162 5.696 1.00 0.00 C ATOM 955 OE1 GLU A 63 -1.012 16.231 6.510 1.00 0.00 O ATOM 956 OE2 GLU A 63 -0.040 18.106 5.899 1.00 0.00 O ATOM 0 H GLU A 63 -5.406 17.313 3.888 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.276 16.447 2.489 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -3.625 17.761 4.807 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -3.197 16.207 5.495 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -1.184 16.404 3.727 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -1.522 18.114 3.909 1.00 0.00 H new ATOM 963 N SER A 64 -4.100 14.011 4.576 1.00 0.00 N ATOM 964 CA SER A 64 -3.944 12.583 4.800 1.00 0.00 C ATOM 965 C SER A 64 -5.105 11.788 4.217 1.00 0.00 C ATOM 966 O SER A 64 -5.029 10.573 4.108 1.00 0.00 O ATOM 967 CB SER A 64 -3.820 12.295 6.296 1.00 0.00 C ATOM 968 OG SER A 64 -4.566 13.226 7.060 1.00 0.00 O ATOM 0 H SER A 64 -4.674 14.488 5.271 1.00 0.00 H new ATOM 0 HA SER A 64 -3.033 12.269 4.290 1.00 0.00 H new ATOM 0 HB2 SER A 64 -4.171 11.285 6.505 1.00 0.00 H new ATOM 0 HB3 SER A 64 -2.772 12.335 6.591 1.00 0.00 H new ATOM 0 HG SER A 64 -4.739 12.854 7.950 1.00 0.00 H new ATOM 974 N LEU A 65 -6.180 12.468 3.841 1.00 0.00 N ATOM 975 CA LEU A 65 -7.335 11.793 3.280 1.00 0.00 C ATOM 976 C LEU A 65 -7.006 11.225 1.911 1.00 0.00 C ATOM 977 O LEU A 65 -7.545 10.195 1.504 1.00 0.00 O ATOM 978 CB LEU A 65 -8.514 12.755 3.185 1.00 0.00 C ATOM 979 CG LEU A 65 -9.752 12.186 2.503 1.00 0.00 C ATOM 980 CD1 LEU A 65 -10.289 10.990 3.272 1.00 0.00 C ATOM 981 CD2 LEU A 65 -10.818 13.256 2.369 1.00 0.00 C ATOM 0 H LEU A 65 -6.273 13.481 3.915 1.00 0.00 H new ATOM 0 HA LEU A 65 -7.608 10.969 3.939 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.786 13.074 4.191 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.195 13.645 2.643 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.471 11.849 1.505 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -11.173 10.600 2.767 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -9.525 10.214 3.318 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -10.555 11.297 4.283 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -11.697 12.835 1.880 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -11.093 13.621 3.358 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.431 14.082 1.772 1.00 0.00 H new ATOM 993 N GLU A 66 -6.114 11.903 1.208 1.00 0.00 N ATOM 994 CA GLU A 66 -5.703 11.472 -0.112 1.00 0.00 C ATOM 995 C GLU A 66 -4.556 10.468 -0.026 1.00 0.00 C ATOM 996 O GLU A 66 -4.352 9.664 -0.935 1.00 0.00 O ATOM 997 CB GLU A 66 -5.287 12.674 -0.963 1.00 0.00 C ATOM 998 CG GLU A 66 -4.060 13.398 -0.433 1.00 0.00 C ATOM 999 CD GLU A 66 -3.626 14.541 -1.330 1.00 0.00 C ATOM 1000 OE1 GLU A 66 -3.883 14.469 -2.550 1.00 0.00 O ATOM 1001 OE2 GLU A 66 -3.029 15.508 -0.812 1.00 0.00 O ATOM 0 H GLU A 66 -5.661 12.757 1.533 1.00 0.00 H new ATOM 0 HA GLU A 66 -6.554 10.982 -0.586 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -5.089 12.337 -1.981 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -6.119 13.377 -1.016 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -4.272 13.784 0.564 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -3.239 12.688 -0.332 1.00 0.00 H new ATOM 1008 N GLY A 67 -3.808 10.523 1.075 1.00 0.00 N ATOM 1009 CA GLY A 67 -2.692 9.615 1.260 1.00 0.00 C ATOM 1010 C GLY A 67 -2.983 8.513 2.264 1.00 0.00 C ATOM 1011 O GLY A 67 -2.182 7.594 2.430 1.00 0.00 O ATOM 0 H GLY A 67 -3.957 11.181 1.840 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -2.433 9.166 0.301 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.822 10.181 1.592 1.00 0.00 H new ATOM 1015 N ALA A 68 -4.131 8.599 2.933 1.00 0.00 N ATOM 1016 CA ALA A 68 -4.516 7.594 3.915 1.00 0.00 C ATOM 1017 C ALA A 68 -5.253 6.449 3.243 1.00 0.00 C ATOM 1018 O ALA A 68 -4.951 5.281 3.483 1.00 0.00 O ATOM 1019 CB ALA A 68 -5.373 8.208 5.006 1.00 0.00 C ATOM 0 H ALA A 68 -4.807 9.353 2.812 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.609 7.201 4.374 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -5.649 7.439 5.728 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -4.812 8.995 5.510 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -6.275 8.632 4.565 1.00 0.00 H new ATOM 1025 N ILE A 69 -6.201 6.784 2.369 1.00 0.00 N ATOM 1026 CA ILE A 69 -6.936 5.772 1.645 1.00 0.00 C ATOM 1027 C ILE A 69 -5.955 5.015 0.782 1.00 0.00 C ATOM 1028 O ILE A 69 -6.012 3.792 0.654 1.00 0.00 O ATOM 1029 CB ILE A 69 -8.023 6.379 0.729 1.00 0.00 C ATOM 1030 CG1 ILE A 69 -7.399 7.352 -0.280 1.00 0.00 C ATOM 1031 CG2 ILE A 69 -9.092 7.076 1.546 1.00 0.00 C ATOM 1032 CD1 ILE A 69 -8.417 8.075 -1.137 1.00 0.00 C ATOM 0 H ILE A 69 -6.470 7.744 2.153 1.00 0.00 H new ATOM 0 HA ILE A 69 -7.433 5.126 2.369 1.00 0.00 H new ATOM 0 HB ILE A 69 -8.493 5.564 0.178 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.803 8.088 0.259 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.717 6.802 -0.928 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -9.845 7.495 0.878 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -9.562 6.358 2.218 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -8.639 7.877 2.130 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.903 8.745 -1.826 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -8.997 7.347 -1.704 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -9.085 8.654 -0.499 1.00 0.00 H new ATOM 1044 N ALA A 70 -5.035 5.778 0.204 1.00 0.00 N ATOM 1045 CA ALA A 70 -4.002 5.214 -0.644 1.00 0.00 C ATOM 1046 C ALA A 70 -3.160 4.218 0.142 1.00 0.00 C ATOM 1047 O ALA A 70 -2.611 3.268 -0.418 1.00 0.00 O ATOM 1048 CB ALA A 70 -3.128 6.314 -1.226 1.00 0.00 C ATOM 0 H ALA A 70 -4.987 6.791 0.310 1.00 0.00 H new ATOM 0 HA ALA A 70 -4.480 4.687 -1.470 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -2.359 5.871 -1.859 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -3.742 6.991 -1.820 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -2.655 6.870 -0.416 1.00 0.00 H new ATOM 1054 N ARG A 71 -3.075 4.440 1.451 1.00 0.00 N ATOM 1055 CA ARG A 71 -2.315 3.565 2.332 1.00 0.00 C ATOM 1056 C ARG A 71 -3.109 2.297 2.631 1.00 0.00 C ATOM 1057 O ARG A 71 -2.648 1.188 2.358 1.00 0.00 O ATOM 1058 CB ARG A 71 -1.965 4.303 3.629 1.00 0.00 C ATOM 1059 CG ARG A 71 -1.437 3.401 4.736 1.00 0.00 C ATOM 1060 CD ARG A 71 -2.376 3.383 5.932 1.00 0.00 C ATOM 1061 NE ARG A 71 -1.671 3.096 7.178 1.00 0.00 N ATOM 1062 CZ ARG A 71 -0.755 3.899 7.715 1.00 0.00 C ATOM 1063 NH1 ARG A 71 -0.432 5.040 7.119 1.00 0.00 N ATOM 1064 NH2 ARG A 71 -0.162 3.561 8.852 1.00 0.00 N ATOM 0 H ARG A 71 -3.526 5.223 1.924 1.00 0.00 H new ATOM 0 HA ARG A 71 -1.388 3.279 1.835 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -1.218 5.066 3.410 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -2.853 4.821 3.990 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -1.313 2.388 4.354 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -0.452 3.746 5.050 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -2.878 4.347 6.013 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -3.151 2.633 5.773 1.00 0.00 H new ATOM 0 HE ARG A 71 -1.894 2.228 7.666 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -0.886 5.305 6.245 1.00 0.00 H new ATOM 0 HH12 ARG A 71 0.271 5.652 7.535 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -0.408 2.686 9.315 1.00 0.00 H new ATOM 0 HH22 ARG A 71 0.540 4.176 9.264 1.00 0.00 H new ATOM 1078 N PHE A 72 -4.309 2.462 3.188 1.00 0.00 N ATOM 1079 CA PHE A 72 -5.161 1.331 3.513 1.00 0.00 C ATOM 1080 C PHE A 72 -5.336 0.399 2.316 1.00 0.00 C ATOM 1081 O PHE A 72 -5.251 -0.821 2.450 1.00 0.00 O ATOM 1082 CB PHE A 72 -6.522 1.834 3.984 1.00 0.00 C ATOM 1083 CG PHE A 72 -7.389 0.755 4.554 1.00 0.00 C ATOM 1084 CD1 PHE A 72 -7.834 -0.285 3.758 1.00 0.00 C ATOM 1085 CD2 PHE A 72 -7.752 0.776 5.888 1.00 0.00 C ATOM 1086 CE1 PHE A 72 -8.624 -1.281 4.281 1.00 0.00 C ATOM 1087 CE2 PHE A 72 -8.547 -0.219 6.420 1.00 0.00 C ATOM 1088 CZ PHE A 72 -8.983 -1.250 5.615 1.00 0.00 C ATOM 0 H PHE A 72 -4.708 3.371 3.422 1.00 0.00 H new ATOM 0 HA PHE A 72 -4.681 0.763 4.310 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -6.374 2.608 4.738 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -7.039 2.300 3.145 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -7.558 -0.315 2.714 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -7.409 1.581 6.521 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -8.964 -2.088 3.649 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -8.826 -0.190 7.463 1.00 0.00 H new ATOM 0 HZ PHE A 72 -9.604 -2.032 6.026 1.00 0.00 H new ATOM 1098 N ASN A 73 -5.589 0.980 1.148 1.00 0.00 N ATOM 1099 CA ASN A 73 -5.784 0.201 -0.074 1.00 0.00 C ATOM 1100 C ASN A 73 -4.715 -0.878 -0.210 1.00 0.00 C ATOM 1101 O ASN A 73 -4.972 -1.959 -0.738 1.00 0.00 O ATOM 1102 CB ASN A 73 -5.756 1.118 -1.299 1.00 0.00 C ATOM 1103 CG ASN A 73 -6.909 2.101 -1.310 1.00 0.00 C ATOM 1104 OD1 ASN A 73 -7.996 1.807 -0.816 1.00 0.00 O ATOM 1105 ND2 ASN A 73 -6.675 3.279 -1.879 1.00 0.00 N ATOM 0 H ASN A 73 -5.664 1.989 1.020 1.00 0.00 H new ATOM 0 HA ASN A 73 -6.758 -0.284 -0.012 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -4.814 1.666 -1.318 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -5.790 0.512 -2.204 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -7.413 3.982 -1.918 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -5.757 3.480 -2.276 1.00 0.00 H new ATOM 1112 N SER A 74 -3.516 -0.571 0.270 1.00 0.00 N ATOM 1113 CA SER A 74 -2.405 -1.512 0.204 1.00 0.00 C ATOM 1114 C SER A 74 -2.085 -2.085 1.583 1.00 0.00 C ATOM 1115 O SER A 74 -0.923 -2.325 1.908 1.00 0.00 O ATOM 1116 CB SER A 74 -1.168 -0.825 -0.378 1.00 0.00 C ATOM 1117 OG SER A 74 -1.163 -0.898 -1.793 1.00 0.00 O ATOM 0 H SER A 74 -3.288 0.321 0.709 1.00 0.00 H new ATOM 0 HA SER A 74 -2.698 -2.336 -0.446 1.00 0.00 H new ATOM 0 HB2 SER A 74 -1.146 0.219 -0.064 1.00 0.00 H new ATOM 0 HB3 SER A 74 -0.267 -1.295 0.017 1.00 0.00 H new ATOM 0 HG SER A 74 -0.363 -0.451 -2.141 1.00 0.00 H new ATOM 1123 N LEU A 75 -3.121 -2.307 2.391 1.00 0.00 N ATOM 1124 CA LEU A 75 -2.936 -2.857 3.731 1.00 0.00 C ATOM 1125 C LEU A 75 -3.480 -4.282 3.822 1.00 0.00 C ATOM 1126 O LEU A 75 -2.984 -5.097 4.599 1.00 0.00 O ATOM 1127 CB LEU A 75 -3.612 -1.964 4.778 1.00 0.00 C ATOM 1128 CG LEU A 75 -2.656 -1.309 5.779 1.00 0.00 C ATOM 1129 CD1 LEU A 75 -3.013 0.153 5.990 1.00 0.00 C ATOM 1130 CD2 LEU A 75 -2.668 -2.058 7.105 1.00 0.00 C ATOM 0 H LEU A 75 -4.091 -2.115 2.142 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.866 -2.888 3.934 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.168 -1.181 4.262 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.339 -2.561 5.329 1.00 0.00 H new ATOM 0 HG LEU A 75 -1.649 -1.358 5.366 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.320 0.597 6.705 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.945 0.685 5.041 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -4.030 0.227 6.376 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.982 -1.576 7.801 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.675 -2.045 7.521 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -2.355 -3.090 6.943 1.00 0.00 H new ATOM 1142 N LEU A 76 -4.491 -4.576 3.011 1.00 0.00 N ATOM 1143 CA LEU A 76 -5.112 -5.902 2.977 1.00 0.00 C ATOM 1144 C LEU A 76 -4.228 -6.893 2.236 1.00 0.00 C ATOM 1145 O LEU A 76 -4.679 -7.576 1.315 1.00 0.00 O ATOM 1146 CB LEU A 76 -6.478 -5.825 2.288 1.00 0.00 C ATOM 1147 CG LEU A 76 -6.543 -4.947 1.024 1.00 0.00 C ATOM 1148 CD1 LEU A 76 -6.888 -3.510 1.391 1.00 0.00 C ATOM 1149 CD2 LEU A 76 -5.234 -5.007 0.226 1.00 0.00 C ATOM 0 H LEU A 76 -4.904 -3.908 2.360 1.00 0.00 H new ATOM 0 HA LEU A 76 -5.240 -6.244 4.004 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -6.787 -6.836 2.022 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -7.206 -5.448 3.007 1.00 0.00 H new ATOM 0 HG LEU A 76 -7.333 -5.342 0.385 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -6.930 -2.903 0.486 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -7.857 -3.484 1.890 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -6.125 -3.112 2.060 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.318 -4.375 -0.658 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -4.412 -4.653 0.848 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -5.041 -6.035 -0.080 1.00 0.00 H new ATOM 1161 N ILE A 77 -2.959 -6.943 2.613 1.00 0.00 N ATOM 1162 CA ILE A 77 -2.011 -7.825 1.947 1.00 0.00 C ATOM 1163 C ILE A 77 -2.085 -7.575 0.465 1.00 0.00 C ATOM 1164 O ILE A 77 -2.433 -8.463 -0.313 1.00 0.00 O ATOM 1165 CB ILE A 77 -2.288 -9.312 2.243 1.00 0.00 C ATOM 1166 CG1 ILE A 77 -2.612 -9.512 3.727 1.00 0.00 C ATOM 1167 CG2 ILE A 77 -1.098 -10.167 1.834 1.00 0.00 C ATOM 1168 CD1 ILE A 77 -1.607 -8.877 4.665 1.00 0.00 C ATOM 0 H ILE A 77 -2.563 -6.387 3.371 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.013 -7.606 2.327 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.153 -9.626 1.658 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.599 -9.097 3.933 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -2.665 -10.580 3.936 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.311 -11.214 2.050 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.914 -10.047 0.766 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.216 -9.853 2.392 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -1.905 -9.062 5.697 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -0.622 -9.309 4.489 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.570 -7.803 4.485 1.00 0.00 H new ATOM 1180 N GLU A 78 -1.773 -6.330 0.098 1.00 0.00 N ATOM 1181 CA GLU A 78 -1.809 -5.886 -1.285 1.00 0.00 C ATOM 1182 C GLU A 78 -1.918 -7.062 -2.232 1.00 0.00 C ATOM 1183 O GLU A 78 -1.085 -7.968 -2.226 1.00 0.00 O ATOM 1184 CB GLU A 78 -0.582 -5.038 -1.611 1.00 0.00 C ATOM 1185 CG GLU A 78 -0.935 -3.621 -2.023 1.00 0.00 C ATOM 1186 CD GLU A 78 -0.646 -3.347 -3.486 1.00 0.00 C ATOM 1187 OE1 GLU A 78 0.505 -3.577 -3.917 1.00 0.00 O ATOM 1188 OE2 GLU A 78 -1.568 -2.903 -4.202 1.00 0.00 O ATOM 0 H GLU A 78 -1.489 -5.605 0.757 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.697 -5.268 -1.417 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.072 -5.005 -0.740 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.020 -5.515 -2.414 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.992 -3.443 -1.826 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.373 -2.918 -1.408 1.00 0.00 H new ATOM 1195 N GLU A 79 -2.974 -7.040 -3.022 1.00 0.00 N ATOM 1196 CA GLU A 79 -3.267 -8.094 -3.983 1.00 0.00 C ATOM 1197 C GLU A 79 -2.000 -8.666 -4.631 1.00 0.00 C ATOM 1198 O GLU A 79 -2.001 -9.806 -5.095 1.00 0.00 O ATOM 1199 CB GLU A 79 -4.232 -7.554 -5.036 1.00 0.00 C ATOM 1200 CG GLU A 79 -5.360 -6.718 -4.436 1.00 0.00 C ATOM 1201 CD GLU A 79 -6.711 -7.038 -5.045 1.00 0.00 C ATOM 1202 OE1 GLU A 79 -7.180 -8.184 -4.881 1.00 0.00 O ATOM 1203 OE2 GLU A 79 -7.301 -6.143 -5.687 1.00 0.00 O ATOM 0 H GLU A 79 -3.660 -6.285 -3.017 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.732 -8.924 -3.451 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -3.678 -6.947 -5.752 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -4.661 -8.389 -5.591 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.401 -6.889 -3.360 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -5.141 -5.660 -4.583 1.00 0.00 H new ATOM 1210 N SER A 80 -0.918 -7.886 -4.650 1.00 0.00 N ATOM 1211 CA SER A 80 0.335 -8.351 -5.230 1.00 0.00 C ATOM 1212 C SER A 80 1.558 -7.902 -4.418 1.00 0.00 C ATOM 1213 O SER A 80 2.600 -7.598 -4.999 1.00 0.00 O ATOM 1214 CB SER A 80 0.460 -7.853 -6.671 1.00 0.00 C ATOM 1215 OG SER A 80 1.701 -8.236 -7.237 1.00 0.00 O ATOM 0 H SER A 80 -0.887 -6.939 -4.273 1.00 0.00 H new ATOM 0 HA SER A 80 0.314 -9.441 -5.213 1.00 0.00 H new ATOM 0 HB2 SER A 80 -0.356 -8.256 -7.270 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.366 -6.767 -6.693 1.00 0.00 H new ATOM 0 HG SER A 80 2.433 -7.884 -6.689 1.00 0.00 H new ATOM 1221 N THR A 81 1.452 -7.867 -3.082 1.00 0.00 N ATOM 1222 CA THR A 81 2.594 -7.458 -2.260 1.00 0.00 C ATOM 1223 C THR A 81 3.556 -8.619 -2.023 1.00 0.00 C ATOM 1224 O THR A 81 4.609 -8.440 -1.412 1.00 0.00 O ATOM 1225 CB THR A 81 2.119 -6.903 -0.921 1.00 0.00 C ATOM 1226 OG1 THR A 81 3.212 -6.710 -0.041 1.00 0.00 O ATOM 1227 CG2 THR A 81 1.124 -7.803 -0.229 1.00 0.00 C ATOM 0 H THR A 81 0.610 -8.110 -2.561 1.00 0.00 H new ATOM 0 HA THR A 81 3.125 -6.678 -2.805 1.00 0.00 H new ATOM 0 HB THR A 81 1.632 -5.956 -1.153 1.00 0.00 H new ATOM 0 HG1 THR A 81 4.012 -7.136 -0.414 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.824 -7.354 0.718 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.247 -7.932 -0.864 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.581 -8.774 -0.041 1.00 0.00 H new ATOM 1235 N GLY A 82 3.204 -9.803 -2.516 1.00 0.00 N ATOM 1236 CA GLY A 82 4.071 -10.954 -2.344 1.00 0.00 C ATOM 1237 C GLY A 82 5.488 -10.672 -2.801 1.00 0.00 C ATOM 1238 O GLY A 82 6.441 -11.285 -2.319 1.00 0.00 O ATOM 0 H GLY A 82 2.341 -9.985 -3.028 1.00 0.00 H new ATOM 0 HA2 GLY A 82 4.080 -11.247 -1.294 1.00 0.00 H new ATOM 0 HA3 GLY A 82 3.670 -11.797 -2.907 1.00 0.00 H new ATOM 1242 N ASP A 83 5.626 -9.732 -3.733 1.00 0.00 N ATOM 1243 CA ASP A 83 6.933 -9.357 -4.259 1.00 0.00 C ATOM 1244 C ASP A 83 7.633 -8.382 -3.318 1.00 0.00 C ATOM 1245 O ASP A 83 7.627 -7.172 -3.541 1.00 0.00 O ATOM 1246 CB ASP A 83 6.788 -8.730 -5.646 1.00 0.00 C ATOM 1247 CG ASP A 83 6.788 -9.767 -6.752 1.00 0.00 C ATOM 1248 OD1 ASP A 83 6.294 -10.888 -6.514 1.00 0.00 O ATOM 1249 OD2 ASP A 83 7.283 -9.456 -7.856 1.00 0.00 O ATOM 0 H ASP A 83 4.846 -9.216 -4.139 1.00 0.00 H new ATOM 0 HA ASP A 83 7.539 -10.259 -4.339 1.00 0.00 H new ATOM 0 HB2 ASP A 83 5.861 -8.158 -5.688 1.00 0.00 H new ATOM 0 HB3 ASP A 83 7.604 -8.027 -5.811 1.00 0.00 H new ATOM 1254 N PHE A 84 8.234 -8.921 -2.264 1.00 0.00 N ATOM 1255 CA PHE A 84 8.939 -8.109 -1.281 1.00 0.00 C ATOM 1256 C PHE A 84 10.237 -7.557 -1.854 1.00 0.00 C ATOM 1257 O PHE A 84 10.527 -6.367 -1.730 1.00 0.00 O ATOM 1258 CB PHE A 84 9.238 -8.942 -0.033 1.00 0.00 C ATOM 1259 CG PHE A 84 8.112 -8.996 0.967 1.00 0.00 C ATOM 1260 CD1 PHE A 84 6.904 -8.350 0.730 1.00 0.00 C ATOM 1261 CD2 PHE A 84 8.266 -9.698 2.152 1.00 0.00 C ATOM 1262 CE1 PHE A 84 5.881 -8.405 1.654 1.00 0.00 C ATOM 1263 CE2 PHE A 84 7.244 -9.752 3.078 1.00 0.00 C ATOM 1264 CZ PHE A 84 6.051 -9.105 2.830 1.00 0.00 C ATOM 0 H PHE A 84 8.247 -9.922 -2.068 1.00 0.00 H new ATOM 0 HA PHE A 84 8.298 -7.269 -1.014 1.00 0.00 H new ATOM 0 HB2 PHE A 84 9.483 -9.959 -0.340 1.00 0.00 H new ATOM 0 HB3 PHE A 84 10.123 -8.535 0.457 1.00 0.00 H new ATOM 0 HD1 PHE A 84 6.765 -7.799 -0.188 1.00 0.00 H new ATOM 0 HD2 PHE A 84 9.196 -10.209 2.353 1.00 0.00 H new ATOM 0 HE1 PHE A 84 4.947 -7.900 1.456 1.00 0.00 H new ATOM 0 HE2 PHE A 84 7.378 -10.301 3.998 1.00 0.00 H new ATOM 0 HZ PHE A 84 5.252 -9.147 3.555 1.00 0.00 H new ATOM 1274 N ASN A 85 11.016 -8.430 -2.476 1.00 0.00 N ATOM 1275 CA ASN A 85 12.287 -8.032 -3.063 1.00 0.00 C ATOM 1276 C ASN A 85 12.101 -7.480 -4.474 1.00 0.00 C ATOM 1277 O ASN A 85 13.075 -7.144 -5.149 1.00 0.00 O ATOM 1278 CB ASN A 85 13.242 -9.224 -3.088 1.00 0.00 C ATOM 1279 CG ASN A 85 12.608 -10.460 -3.697 1.00 0.00 C ATOM 1280 OD1 ASN A 85 11.825 -10.370 -4.641 1.00 0.00 O ATOM 1281 ND2 ASN A 85 12.944 -11.624 -3.152 1.00 0.00 N ATOM 0 H ASN A 85 10.790 -9.418 -2.587 1.00 0.00 H new ATOM 0 HA ASN A 85 12.711 -7.239 -2.447 1.00 0.00 H new ATOM 0 HB2 ASN A 85 14.134 -8.959 -3.656 1.00 0.00 H new ATOM 0 HB3 ASN A 85 13.566 -9.448 -2.072 1.00 0.00 H new ATOM 0 HD21 ASN A 85 12.548 -12.491 -3.516 1.00 0.00 H new ATOM 0 HD22 ASN A 85 13.598 -11.651 -2.370 1.00 0.00 H new ATOM 1288 N GLY A 86 10.849 -7.391 -4.921 1.00 0.00 N ATOM 1289 CA GLY A 86 10.574 -6.883 -6.252 1.00 0.00 C ATOM 1290 C GLY A 86 11.340 -7.633 -7.325 1.00 0.00 C ATOM 1291 O GLY A 86 11.524 -7.132 -8.433 1.00 0.00 O ATOM 0 H GLY A 86 10.024 -7.661 -4.385 1.00 0.00 H new ATOM 0 HA2 GLY A 86 9.505 -6.957 -6.453 1.00 0.00 H new ATOM 0 HA3 GLY A 86 10.834 -5.825 -6.296 1.00 0.00 H new ATOM 1295 N ASN A 87 11.791 -8.840 -6.991 1.00 0.00 N ATOM 1296 CA ASN A 87 12.544 -9.663 -7.930 1.00 0.00 C ATOM 1297 C ASN A 87 11.619 -10.626 -8.674 1.00 0.00 C ATOM 1298 O ASN A 87 11.930 -11.067 -9.780 1.00 0.00 O ATOM 1299 CB ASN A 87 13.639 -10.435 -7.187 1.00 0.00 C ATOM 1300 CG ASN A 87 14.251 -11.545 -8.021 1.00 0.00 C ATOM 1301 OD1 ASN A 87 15.153 -11.310 -8.825 1.00 0.00 O ATOM 1302 ND2 ASN A 87 13.758 -12.762 -7.831 1.00 0.00 N ATOM 0 H ASN A 87 11.647 -9.269 -6.077 1.00 0.00 H new ATOM 0 HA ASN A 87 13.011 -9.010 -8.667 1.00 0.00 H new ATOM 0 HB2 ASN A 87 14.423 -9.741 -6.884 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.221 -10.861 -6.275 1.00 0.00 H new ATOM 0 HD21 ASN A 87 14.127 -13.550 -8.363 1.00 0.00 H new ATOM 0 HD22 ASN A 87 13.010 -12.909 -7.153 1.00 0.00 H new ATOM 1309 N GLY A 88 10.483 -10.947 -8.062 1.00 0.00 N ATOM 1310 CA GLY A 88 9.537 -11.852 -8.688 1.00 0.00 C ATOM 1311 C GLY A 88 9.629 -13.264 -8.142 1.00 0.00 C ATOM 1312 O GLY A 88 9.500 -14.233 -8.890 1.00 0.00 O ATOM 0 H GLY A 88 10.202 -10.597 -7.146 1.00 0.00 H new ATOM 0 HA2 GLY A 88 8.526 -11.474 -8.539 1.00 0.00 H new ATOM 0 HA3 GLY A 88 9.715 -11.870 -9.763 1.00 0.00 H new ATOM 1316 N LYS A 89 9.849 -13.381 -6.837 1.00 0.00 N ATOM 1317 CA LYS A 89 9.953 -14.685 -6.195 1.00 0.00 C ATOM 1318 C LYS A 89 9.499 -14.608 -4.742 1.00 0.00 C ATOM 1319 O LYS A 89 10.115 -13.922 -3.925 1.00 0.00 O ATOM 1320 CB LYS A 89 11.391 -15.207 -6.272 1.00 0.00 C ATOM 1321 CG LYS A 89 12.365 -14.461 -5.372 1.00 0.00 C ATOM 1322 CD LYS A 89 13.808 -14.765 -5.740 1.00 0.00 C ATOM 1323 CE LYS A 89 14.743 -13.656 -5.285 1.00 0.00 C ATOM 1324 NZ LYS A 89 16.085 -13.764 -5.922 1.00 0.00 N ATOM 0 H LYS A 89 9.959 -12.589 -6.204 1.00 0.00 H new ATOM 0 HA LYS A 89 9.300 -15.378 -6.725 1.00 0.00 H new ATOM 0 HB2 LYS A 89 11.399 -16.263 -6.003 1.00 0.00 H new ATOM 0 HB3 LYS A 89 11.738 -15.138 -7.303 1.00 0.00 H new ATOM 0 HG2 LYS A 89 12.186 -13.389 -5.451 1.00 0.00 H new ATOM 0 HG3 LYS A 89 12.187 -14.738 -4.333 1.00 0.00 H new ATOM 0 HD2 LYS A 89 14.110 -15.708 -5.284 1.00 0.00 H new ATOM 0 HD3 LYS A 89 13.891 -14.892 -6.819 1.00 0.00 H new ATOM 0 HE2 LYS A 89 14.303 -12.688 -5.527 1.00 0.00 H new ATOM 0 HE3 LYS A 89 14.852 -13.695 -4.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 16.692 -12.990 -5.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 16.516 -14.676 -5.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 15.985 -13.701 -6.955 1.00 0.00 H new ATOM 1338 N ILE A 90 8.418 -15.311 -4.424 1.00 0.00 N ATOM 1339 CA ILE A 90 7.887 -15.314 -3.066 1.00 0.00 C ATOM 1340 C ILE A 90 8.199 -16.627 -2.363 1.00 0.00 C ATOM 1341 O ILE A 90 7.632 -17.669 -2.691 1.00 0.00 O ATOM 1342 CB ILE A 90 6.362 -15.079 -3.041 1.00 0.00 C ATOM 1343 CG1 ILE A 90 5.915 -14.235 -4.241 1.00 0.00 C ATOM 1344 CG2 ILE A 90 5.958 -14.409 -1.737 1.00 0.00 C ATOM 1345 CD1 ILE A 90 6.771 -13.008 -4.479 1.00 0.00 C ATOM 0 H ILE A 90 7.894 -15.884 -5.085 1.00 0.00 H new ATOM 0 HA ILE A 90 8.373 -14.492 -2.540 1.00 0.00 H new ATOM 0 HB ILE A 90 5.865 -16.047 -3.109 1.00 0.00 H new ATOM 0 HG12 ILE A 90 5.931 -14.857 -5.136 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.882 -13.922 -4.088 1.00 0.00 H new ATOM 0 HG21 ILE A 90 4.880 -14.248 -1.730 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.235 -15.048 -0.899 1.00 0.00 H new ATOM 0 HG23 ILE A 90 6.469 -13.450 -1.647 1.00 0.00 H new ATOM 0 HD11 ILE A 90 6.393 -12.463 -5.344 1.00 0.00 H new ATOM 0 HD12 ILE A 90 6.736 -12.364 -3.600 1.00 0.00 H new ATOM 0 HD13 ILE A 90 7.801 -13.313 -4.665 1.00 0.00 H new ATOM 1357 N ASP A 91 9.103 -16.567 -1.394 1.00 0.00 N ATOM 1358 CA ASP A 91 9.493 -17.753 -0.640 1.00 0.00 C ATOM 1359 C ASP A 91 10.459 -17.384 0.479 1.00 0.00 C ATOM 1360 O ASP A 91 10.125 -17.481 1.660 1.00 0.00 O ATOM 1361 CB ASP A 91 10.139 -18.784 -1.567 1.00 0.00 C ATOM 1362 CG ASP A 91 9.819 -20.209 -1.160 1.00 0.00 C ATOM 1363 OD1 ASP A 91 9.702 -20.466 0.057 1.00 0.00 O ATOM 1364 OD2 ASP A 91 9.685 -21.067 -2.056 1.00 0.00 O ATOM 0 H ASP A 91 9.580 -15.711 -1.111 1.00 0.00 H new ATOM 0 HA ASP A 91 8.596 -18.187 -0.198 1.00 0.00 H new ATOM 0 HB2 ASP A 91 9.797 -18.615 -2.588 1.00 0.00 H new ATOM 0 HB3 ASP A 91 11.220 -18.643 -1.566 1.00 0.00 H new ATOM 1369 N ILE A 92 11.654 -16.953 0.097 1.00 0.00 N ATOM 1370 CA ILE A 92 12.669 -16.557 1.064 1.00 0.00 C ATOM 1371 C ILE A 92 12.208 -15.346 1.871 1.00 0.00 C ATOM 1372 O ILE A 92 12.691 -15.099 2.976 1.00 0.00 O ATOM 1373 CB ILE A 92 14.001 -16.225 0.367 1.00 0.00 C ATOM 1374 CG1 ILE A 92 15.087 -15.921 1.414 1.00 0.00 C ATOM 1375 CG2 ILE A 92 13.809 -15.064 -0.603 1.00 0.00 C ATOM 1376 CD1 ILE A 92 15.740 -14.561 1.269 1.00 0.00 C ATOM 0 H ILE A 92 11.944 -16.869 -0.877 1.00 0.00 H new ATOM 0 HA ILE A 92 12.822 -17.401 1.737 1.00 0.00 H new ATOM 0 HB ILE A 92 14.332 -17.088 -0.210 1.00 0.00 H new ATOM 0 HG12 ILE A 92 14.645 -15.993 2.408 1.00 0.00 H new ATOM 0 HG13 ILE A 92 15.858 -16.688 1.351 1.00 0.00 H new ATOM 0 HG21 ILE A 92 14.757 -14.837 -1.091 1.00 0.00 H new ATOM 0 HG22 ILE A 92 13.070 -15.337 -1.356 1.00 0.00 H new ATOM 0 HG23 ILE A 92 13.463 -14.187 -0.056 1.00 0.00 H new ATOM 0 HD11 ILE A 92 16.492 -14.433 2.048 1.00 0.00 H new ATOM 0 HD12 ILE A 92 16.215 -14.488 0.291 1.00 0.00 H new ATOM 0 HD13 ILE A 92 14.983 -13.782 1.364 1.00 0.00 H new ATOM 1388 N GLY A 93 11.267 -14.596 1.305 1.00 0.00 N ATOM 1389 CA GLY A 93 10.744 -13.418 1.969 1.00 0.00 C ATOM 1390 C GLY A 93 10.173 -13.711 3.343 1.00 0.00 C ATOM 1391 O GLY A 93 9.935 -12.793 4.127 1.00 0.00 O ATOM 0 H GLY A 93 10.856 -14.786 0.391 1.00 0.00 H new ATOM 0 HA2 GLY A 93 11.539 -12.679 2.063 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.967 -12.973 1.347 1.00 0.00 H new ATOM 1395 N ASP A 94 9.943 -14.985 3.636 1.00 0.00 N ATOM 1396 CA ASP A 94 9.387 -15.375 4.925 1.00 0.00 C ATOM 1397 C ASP A 94 10.476 -15.798 5.900 1.00 0.00 C ATOM 1398 O ASP A 94 10.342 -15.619 7.110 1.00 0.00 O ATOM 1399 CB ASP A 94 8.385 -16.516 4.748 1.00 0.00 C ATOM 1400 CG ASP A 94 7.533 -16.735 5.983 1.00 0.00 C ATOM 1401 OD1 ASP A 94 7.422 -15.798 6.801 1.00 0.00 O ATOM 1402 OD2 ASP A 94 6.977 -17.844 6.131 1.00 0.00 O ATOM 0 H ASP A 94 10.132 -15.762 3.002 1.00 0.00 H new ATOM 0 HA ASP A 94 8.879 -14.504 5.339 1.00 0.00 H new ATOM 0 HB2 ASP A 94 7.738 -16.299 3.898 1.00 0.00 H new ATOM 0 HB3 ASP A 94 8.923 -17.435 4.513 1.00 0.00 H new ATOM 1407 N LEU A 95 11.546 -16.374 5.373 1.00 0.00 N ATOM 1408 CA LEU A 95 12.645 -16.837 6.211 1.00 0.00 C ATOM 1409 C LEU A 95 13.880 -15.955 6.065 1.00 0.00 C ATOM 1410 O LEU A 95 15.003 -16.430 6.231 1.00 0.00 O ATOM 1411 CB LEU A 95 12.998 -18.284 5.864 1.00 0.00 C ATOM 1412 CG LEU A 95 12.148 -19.345 6.563 1.00 0.00 C ATOM 1413 CD1 LEU A 95 10.882 -19.625 5.768 1.00 0.00 C ATOM 1414 CD2 LEU A 95 12.948 -20.623 6.763 1.00 0.00 C ATOM 0 H LEU A 95 11.678 -16.532 4.374 1.00 0.00 H new ATOM 0 HA LEU A 95 12.314 -16.779 7.248 1.00 0.00 H new ATOM 0 HB2 LEU A 95 12.902 -18.416 4.786 1.00 0.00 H new ATOM 0 HB3 LEU A 95 14.045 -18.456 6.115 1.00 0.00 H new ATOM 0 HG LEU A 95 11.860 -18.964 7.543 1.00 0.00 H new ATOM 0 HD11 LEU A 95 10.290 -20.383 6.281 1.00 0.00 H new ATOM 0 HD12 LEU A 95 10.299 -18.709 5.678 1.00 0.00 H new ATOM 0 HD13 LEU A 95 11.149 -19.985 4.774 1.00 0.00 H new ATOM 0 HD21 LEU A 95 12.327 -21.367 7.262 1.00 0.00 H new ATOM 0 HD22 LEU A 95 13.267 -21.008 5.794 1.00 0.00 H new ATOM 0 HD23 LEU A 95 13.824 -20.412 7.376 1.00 0.00 H new ATOM 1426 N ALA A 96 13.685 -14.672 5.758 1.00 0.00 N ATOM 1427 CA ALA A 96 14.821 -13.768 5.603 1.00 0.00 C ATOM 1428 C ALA A 96 14.403 -12.331 5.280 1.00 0.00 C ATOM 1429 O ALA A 96 14.313 -11.488 6.170 1.00 0.00 O ATOM 1430 CB ALA A 96 15.758 -14.296 4.527 1.00 0.00 C ATOM 0 H ALA A 96 12.771 -14.244 5.615 1.00 0.00 H new ATOM 0 HA ALA A 96 15.336 -13.735 6.563 1.00 0.00 H new ATOM 0 HB1 ALA A 96 16.604 -13.617 4.416 1.00 0.00 H new ATOM 0 HB2 ALA A 96 16.120 -15.283 4.813 1.00 0.00 H new ATOM 0 HB3 ALA A 96 15.222 -14.366 3.580 1.00 0.00 H new ATOM 1436 N MET A 97 14.185 -12.062 3.990 1.00 0.00 N ATOM 1437 CA MET A 97 13.817 -10.727 3.500 1.00 0.00 C ATOM 1438 C MET A 97 13.038 -9.895 4.522 1.00 0.00 C ATOM 1439 O MET A 97 13.577 -8.949 5.098 1.00 0.00 O ATOM 1440 CB MET A 97 13.010 -10.855 2.206 1.00 0.00 C ATOM 1441 CG MET A 97 13.515 -9.983 1.067 1.00 0.00 C ATOM 1442 SD MET A 97 13.835 -8.279 1.565 1.00 0.00 S ATOM 1443 CE MET A 97 13.943 -7.486 -0.036 1.00 0.00 C ATOM 0 H MET A 97 14.258 -12.764 3.253 1.00 0.00 H new ATOM 0 HA MET A 97 14.750 -10.194 3.315 1.00 0.00 H new ATOM 0 HB2 MET A 97 13.023 -11.896 1.885 1.00 0.00 H new ATOM 0 HB3 MET A 97 11.971 -10.598 2.412 1.00 0.00 H new ATOM 0 HG2 MET A 97 14.431 -10.416 0.666 1.00 0.00 H new ATOM 0 HG3 MET A 97 12.781 -9.988 0.261 1.00 0.00 H new ATOM 0 HE1 MET A 97 14.174 -6.429 0.096 1.00 0.00 H new ATOM 0 HE2 MET A 97 14.730 -7.959 -0.624 1.00 0.00 H new ATOM 0 HE3 MET A 97 12.991 -7.587 -0.557 1.00 0.00 H new ATOM 1453 N VAL A 98 11.766 -10.224 4.722 1.00 0.00 N ATOM 1454 CA VAL A 98 10.926 -9.471 5.649 1.00 0.00 C ATOM 1455 C VAL A 98 11.399 -9.590 7.102 1.00 0.00 C ATOM 1456 O VAL A 98 11.623 -8.582 7.766 1.00 0.00 O ATOM 1457 CB VAL A 98 9.428 -9.876 5.518 1.00 0.00 C ATOM 1458 CG1 VAL A 98 9.072 -11.078 6.380 1.00 0.00 C ATOM 1459 CG2 VAL A 98 8.521 -8.705 5.861 1.00 0.00 C ATOM 0 H VAL A 98 11.296 -11.002 4.259 1.00 0.00 H new ATOM 0 HA VAL A 98 11.022 -8.422 5.368 1.00 0.00 H new ATOM 0 HB VAL A 98 9.272 -10.161 4.478 1.00 0.00 H new ATOM 0 HG11 VAL A 98 8.017 -11.318 6.251 1.00 0.00 H new ATOM 0 HG12 VAL A 98 9.678 -11.933 6.080 1.00 0.00 H new ATOM 0 HG13 VAL A 98 9.266 -10.845 7.427 1.00 0.00 H new ATOM 0 HG21 VAL A 98 7.479 -9.011 5.763 1.00 0.00 H new ATOM 0 HG22 VAL A 98 8.710 -8.386 6.886 1.00 0.00 H new ATOM 0 HG23 VAL A 98 8.722 -7.878 5.181 1.00 0.00 H new ATOM 1469 N SER A 99 11.549 -10.806 7.605 1.00 0.00 N ATOM 1470 CA SER A 99 11.969 -10.997 8.989 1.00 0.00 C ATOM 1471 C SER A 99 13.349 -10.403 9.294 1.00 0.00 C ATOM 1472 O SER A 99 13.785 -10.427 10.445 1.00 0.00 O ATOM 1473 CB SER A 99 11.945 -12.472 9.375 1.00 0.00 C ATOM 1474 OG SER A 99 11.349 -13.262 8.360 1.00 0.00 O ATOM 0 H SER A 99 11.389 -11.668 7.084 1.00 0.00 H new ATOM 0 HA SER A 99 11.244 -10.451 9.593 1.00 0.00 H new ATOM 0 HB2 SER A 99 12.962 -12.819 9.558 1.00 0.00 H new ATOM 0 HB3 SER A 99 11.393 -12.597 10.307 1.00 0.00 H new ATOM 0 HG SER A 99 11.744 -14.159 8.369 1.00 0.00 H new ATOM 1480 N LYS A 100 14.051 -9.894 8.282 1.00 0.00 N ATOM 1481 CA LYS A 100 15.382 -9.337 8.512 1.00 0.00 C ATOM 1482 C LYS A 100 15.339 -7.911 9.047 1.00 0.00 C ATOM 1483 O LYS A 100 16.122 -7.550 9.926 1.00 0.00 O ATOM 1484 CB LYS A 100 16.237 -9.409 7.237 1.00 0.00 C ATOM 1485 CG LYS A 100 16.034 -8.243 6.279 1.00 0.00 C ATOM 1486 CD LYS A 100 17.036 -7.130 6.544 1.00 0.00 C ATOM 1487 CE LYS A 100 16.798 -5.934 5.636 1.00 0.00 C ATOM 1488 NZ LYS A 100 18.054 -5.478 4.978 1.00 0.00 N ATOM 0 H LYS A 100 13.729 -9.856 7.315 1.00 0.00 H new ATOM 0 HA LYS A 100 15.846 -9.952 9.283 1.00 0.00 H new ATOM 0 HB2 LYS A 100 17.289 -9.452 7.521 1.00 0.00 H new ATOM 0 HB3 LYS A 100 16.010 -10.338 6.714 1.00 0.00 H new ATOM 0 HG2 LYS A 100 16.137 -8.591 5.251 1.00 0.00 H new ATOM 0 HG3 LYS A 100 15.021 -7.856 6.384 1.00 0.00 H new ATOM 0 HD2 LYS A 100 16.965 -6.816 7.586 1.00 0.00 H new ATOM 0 HD3 LYS A 100 18.048 -7.507 6.393 1.00 0.00 H new ATOM 0 HE2 LYS A 100 16.064 -6.197 4.874 1.00 0.00 H new ATOM 0 HE3 LYS A 100 16.375 -5.115 6.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 17.849 -4.661 4.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 18.746 -5.203 5.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 18.445 -6.251 4.402 1.00 0.00 H new ATOM 1502 N ASN A 101 14.430 -7.108 8.529 1.00 0.00 N ATOM 1503 CA ASN A 101 14.306 -5.728 8.979 1.00 0.00 C ATOM 1504 C ASN A 101 13.349 -5.663 10.156 1.00 0.00 C ATOM 1505 O ASN A 101 13.679 -5.134 11.216 1.00 0.00 O ATOM 1506 CB ASN A 101 13.813 -4.815 7.844 1.00 0.00 C ATOM 1507 CG ASN A 101 13.448 -5.581 6.585 1.00 0.00 C ATOM 1508 OD1 ASN A 101 12.623 -6.494 6.619 1.00 0.00 O ATOM 1509 ND2 ASN A 101 14.065 -5.219 5.470 1.00 0.00 N ATOM 0 H ASN A 101 13.769 -7.381 7.801 1.00 0.00 H new ATOM 0 HA ASN A 101 15.290 -5.375 9.288 1.00 0.00 H new ATOM 0 HB2 ASN A 101 12.943 -4.255 8.187 1.00 0.00 H new ATOM 0 HB3 ASN A 101 14.589 -4.086 7.608 1.00 0.00 H new ATOM 0 HD21 ASN A 101 13.863 -5.703 4.595 1.00 0.00 H new ATOM 0 HD22 ASN A 101 14.742 -4.456 5.486 1.00 0.00 H new ATOM 1516 N ILE A 102 12.160 -6.212 9.939 1.00 0.00 N ATOM 1517 CA ILE A 102 11.102 -6.248 10.939 1.00 0.00 C ATOM 1518 C ILE A 102 11.086 -4.993 11.800 1.00 0.00 C ATOM 1519 O ILE A 102 11.872 -4.843 12.736 1.00 0.00 O ATOM 1520 CB ILE A 102 11.188 -7.509 11.824 1.00 0.00 C ATOM 1521 CG1 ILE A 102 10.967 -8.759 10.969 1.00 0.00 C ATOM 1522 CG2 ILE A 102 10.178 -7.456 12.966 1.00 0.00 C ATOM 1523 CD1 ILE A 102 9.506 -9.070 10.665 1.00 0.00 C ATOM 0 H ILE A 102 11.901 -6.649 9.054 1.00 0.00 H new ATOM 0 HA ILE A 102 10.162 -6.287 10.388 1.00 0.00 H new ATOM 0 HB ILE A 102 12.183 -7.550 12.267 1.00 0.00 H new ATOM 0 HG12 ILE A 102 11.503 -8.638 10.027 1.00 0.00 H new ATOM 0 HG13 ILE A 102 11.408 -9.615 11.479 1.00 0.00 H new ATOM 0 HG21 ILE A 102 10.265 -8.359 13.570 1.00 0.00 H new ATOM 0 HG22 ILE A 102 10.377 -6.583 13.587 1.00 0.00 H new ATOM 0 HG23 ILE A 102 9.170 -7.388 12.557 1.00 0.00 H new ATOM 0 HD11 ILE A 102 9.445 -9.971 10.055 1.00 0.00 H new ATOM 0 HD12 ILE A 102 8.965 -9.227 11.598 1.00 0.00 H new ATOM 0 HD13 ILE A 102 9.061 -8.235 10.124 1.00 0.00 H new ATOM 1535 N GLY A 103 10.170 -4.102 11.464 1.00 0.00 N ATOM 1536 CA GLY A 103 10.034 -2.855 12.195 1.00 0.00 C ATOM 1537 C GLY A 103 10.678 -1.682 11.478 1.00 0.00 C ATOM 1538 O GLY A 103 10.767 -0.585 12.030 1.00 0.00 O ATOM 0 H GLY A 103 9.512 -4.218 10.693 1.00 0.00 H new ATOM 0 HA2 GLY A 103 8.976 -2.644 12.351 1.00 0.00 H new ATOM 0 HA3 GLY A 103 10.486 -2.965 13.181 1.00 0.00 H new ATOM 1542 N SER A 104 11.128 -1.908 10.246 1.00 0.00 N ATOM 1543 CA SER A 104 11.765 -0.858 9.459 1.00 0.00 C ATOM 1544 C SER A 104 10.748 -0.155 8.566 1.00 0.00 C ATOM 1545 O SER A 104 9.878 -0.795 7.976 1.00 0.00 O ATOM 1546 CB SER A 104 12.893 -1.443 8.607 1.00 0.00 C ATOM 1547 OG SER A 104 13.897 -0.476 8.358 1.00 0.00 O ATOM 0 H SER A 104 11.063 -2.809 9.772 1.00 0.00 H new ATOM 0 HA SER A 104 12.184 -0.125 10.148 1.00 0.00 H new ATOM 0 HB2 SER A 104 13.329 -2.302 9.116 1.00 0.00 H new ATOM 0 HB3 SER A 104 12.489 -1.804 7.661 1.00 0.00 H new ATOM 0 HG SER A 104 13.802 -0.133 7.445 1.00 0.00 H new ATOM 1553 N THR A 105 10.865 1.165 8.471 1.00 0.00 N ATOM 1554 CA THR A 105 9.955 1.957 7.650 1.00 0.00 C ATOM 1555 C THR A 105 10.478 2.095 6.223 1.00 0.00 C ATOM 1556 O THR A 105 9.708 2.328 5.291 1.00 0.00 O ATOM 1557 CB THR A 105 9.755 3.341 8.268 1.00 0.00 C ATOM 1558 OG1 THR A 105 10.898 4.152 8.064 1.00 0.00 O ATOM 1559 CG2 THR A 105 9.482 3.298 9.756 1.00 0.00 C ATOM 0 H THR A 105 11.581 1.710 8.952 1.00 0.00 H new ATOM 0 HA THR A 105 8.997 1.438 7.614 1.00 0.00 H new ATOM 0 HB THR A 105 8.881 3.757 7.766 1.00 0.00 H new ATOM 0 HG1 THR A 105 10.749 5.034 8.465 1.00 0.00 H new ATOM 0 HG21 THR A 105 9.350 4.313 10.131 1.00 0.00 H new ATOM 0 HG22 THR A 105 8.576 2.721 9.943 1.00 0.00 H new ATOM 0 HG23 THR A 105 10.323 2.829 10.267 1.00 0.00 H new ATOM 1567 N THR A 106 11.791 1.954 6.057 1.00 0.00 N ATOM 1568 CA THR A 106 12.413 2.067 4.741 1.00 0.00 C ATOM 1569 C THR A 106 11.774 1.101 3.747 1.00 0.00 C ATOM 1570 O THR A 106 11.504 1.463 2.601 1.00 0.00 O ATOM 1571 CB THR A 106 13.914 1.794 4.840 1.00 0.00 C ATOM 1572 OG1 THR A 106 14.189 0.869 5.879 1.00 0.00 O ATOM 1573 CG2 THR A 106 14.733 3.038 5.106 1.00 0.00 C ATOM 0 H THR A 106 12.444 1.762 6.817 1.00 0.00 H new ATOM 0 HA THR A 106 12.256 3.084 4.381 1.00 0.00 H new ATOM 0 HB THR A 106 14.198 1.392 3.867 1.00 0.00 H new ATOM 0 HG1 THR A 106 15.154 0.706 5.925 1.00 0.00 H new ATOM 0 HG21 THR A 106 15.789 2.773 5.165 1.00 0.00 H new ATOM 0 HG22 THR A 106 14.583 3.753 4.297 1.00 0.00 H new ATOM 0 HG23 THR A 106 14.419 3.486 6.049 1.00 0.00 H new ATOM 1581 N ASN A 107 11.536 -0.128 4.192 1.00 0.00 N ATOM 1582 CA ASN A 107 10.928 -1.145 3.340 1.00 0.00 C ATOM 1583 C ASN A 107 9.428 -0.907 3.194 1.00 0.00 C ATOM 1584 O ASN A 107 8.669 -1.080 4.145 1.00 0.00 O ATOM 1585 CB ASN A 107 11.185 -2.538 3.918 1.00 0.00 C ATOM 1586 CG ASN A 107 12.077 -3.378 3.026 1.00 0.00 C ATOM 1587 OD1 ASN A 107 12.979 -4.065 3.501 1.00 0.00 O ATOM 1588 ND2 ASN A 107 11.831 -3.323 1.724 1.00 0.00 N ATOM 0 H ASN A 107 11.754 -0.444 5.137 1.00 0.00 H new ATOM 0 HA ASN A 107 11.383 -1.079 2.352 1.00 0.00 H new ATOM 0 HB2 ASN A 107 11.646 -2.441 4.901 1.00 0.00 H new ATOM 0 HB3 ASN A 107 10.234 -3.050 4.062 1.00 0.00 H new ATOM 0 HD21 ASN A 107 12.401 -3.864 1.074 1.00 0.00 H new ATOM 0 HD22 ASN A 107 11.072 -2.739 1.373 1.00 0.00 H new ATOM 1595 N THR A 108 9.012 -0.498 2.002 1.00 0.00 N ATOM 1596 CA THR A 108 7.601 -0.226 1.737 1.00 0.00 C ATOM 1597 C THR A 108 6.880 -1.452 1.180 1.00 0.00 C ATOM 1598 O THR A 108 5.985 -2.002 1.820 1.00 0.00 O ATOM 1599 CB THR A 108 7.464 0.942 0.763 1.00 0.00 C ATOM 1600 OG1 THR A 108 8.661 1.124 0.024 1.00 0.00 O ATOM 1601 CG2 THR A 108 7.141 2.248 1.452 1.00 0.00 C ATOM 0 H THR A 108 9.628 -0.347 1.204 1.00 0.00 H new ATOM 0 HA THR A 108 7.134 0.033 2.687 1.00 0.00 H new ATOM 0 HB THR A 108 6.636 0.680 0.104 1.00 0.00 H new ATOM 0 HG1 THR A 108 8.552 1.876 -0.595 1.00 0.00 H new ATOM 0 HG21 THR A 108 7.056 3.040 0.708 1.00 0.00 H new ATOM 0 HG22 THR A 108 6.198 2.152 1.990 1.00 0.00 H new ATOM 0 HG23 THR A 108 7.936 2.495 2.156 1.00 0.00 H new ATOM 1609 N SER A 109 7.273 -1.869 -0.020 1.00 0.00 N ATOM 1610 CA SER A 109 6.660 -3.022 -0.670 1.00 0.00 C ATOM 1611 C SER A 109 6.865 -4.293 0.147 1.00 0.00 C ATOM 1612 O SER A 109 6.164 -5.286 -0.046 1.00 0.00 O ATOM 1613 CB SER A 109 7.237 -3.207 -2.074 1.00 0.00 C ATOM 1614 OG SER A 109 6.524 -4.199 -2.792 1.00 0.00 O ATOM 0 H SER A 109 8.014 -1.425 -0.562 1.00 0.00 H new ATOM 0 HA SER A 109 5.589 -2.833 -0.743 1.00 0.00 H new ATOM 0 HB2 SER A 109 7.195 -2.262 -2.615 1.00 0.00 H new ATOM 0 HB3 SER A 109 8.288 -3.489 -2.005 1.00 0.00 H new ATOM 0 HG SER A 109 7.086 -4.995 -2.897 1.00 0.00 H new ATOM 1620 N LEU A 110 7.833 -4.260 1.056 1.00 0.00 N ATOM 1621 CA LEU A 110 8.130 -5.414 1.893 1.00 0.00 C ATOM 1622 C LEU A 110 7.102 -5.585 3.006 1.00 0.00 C ATOM 1623 O LEU A 110 7.139 -6.567 3.747 1.00 0.00 O ATOM 1624 CB LEU A 110 9.526 -5.280 2.491 1.00 0.00 C ATOM 1625 CG LEU A 110 10.447 -6.467 2.227 1.00 0.00 C ATOM 1626 CD1 LEU A 110 11.374 -6.167 1.057 1.00 0.00 C ATOM 1627 CD2 LEU A 110 11.240 -6.819 3.479 1.00 0.00 C ATOM 0 H LEU A 110 8.424 -3.447 1.231 1.00 0.00 H new ATOM 0 HA LEU A 110 8.087 -6.301 1.261 1.00 0.00 H new ATOM 0 HB2 LEU A 110 9.993 -4.379 2.092 1.00 0.00 H new ATOM 0 HB3 LEU A 110 9.434 -5.141 3.568 1.00 0.00 H new ATOM 0 HG LEU A 110 9.837 -7.331 1.964 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.025 -7.023 0.880 1.00 0.00 H new ATOM 0 HD12 LEU A 110 10.781 -5.972 0.164 1.00 0.00 H new ATOM 0 HD13 LEU A 110 11.980 -5.291 1.288 1.00 0.00 H new ATOM 0 HD21 LEU A 110 11.891 -7.668 3.271 1.00 0.00 H new ATOM 0 HD22 LEU A 110 11.845 -5.963 3.779 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.553 -7.078 4.284 1.00 0.00 H new ATOM 1639 N ASP A 111 6.177 -4.638 3.116 1.00 0.00 N ATOM 1640 CA ASP A 111 5.151 -4.694 4.115 1.00 0.00 C ATOM 1641 C ASP A 111 3.813 -4.893 3.434 1.00 0.00 C ATOM 1642 O ASP A 111 3.275 -3.961 2.837 1.00 0.00 O ATOM 1643 CB ASP A 111 5.134 -3.391 4.921 1.00 0.00 C ATOM 1644 CG ASP A 111 6.332 -3.239 5.834 1.00 0.00 C ATOM 1645 OD1 ASP A 111 6.295 -3.769 6.960 1.00 0.00 O ATOM 1646 OD2 ASP A 111 7.308 -2.579 5.423 1.00 0.00 O ATOM 0 H ASP A 111 6.129 -3.818 2.511 1.00 0.00 H new ATOM 0 HA ASP A 111 5.347 -5.524 4.794 1.00 0.00 H new ATOM 0 HB2 ASP A 111 5.100 -2.546 4.233 1.00 0.00 H new ATOM 0 HB3 ASP A 111 4.223 -3.353 5.518 1.00 0.00 H new ATOM 1651 N LEU A 112 3.257 -6.093 3.537 1.00 0.00 N ATOM 1652 CA LEU A 112 1.956 -6.365 2.937 1.00 0.00 C ATOM 1653 C LEU A 112 0.948 -5.303 3.385 1.00 0.00 C ATOM 1654 O LEU A 112 -0.142 -5.179 2.827 1.00 0.00 O ATOM 1655 CB LEU A 112 1.453 -7.755 3.341 1.00 0.00 C ATOM 1656 CG LEU A 112 2.496 -8.874 3.325 1.00 0.00 C ATOM 1657 CD1 LEU A 112 2.016 -10.060 4.154 1.00 0.00 C ATOM 1658 CD2 LEU A 112 2.798 -9.299 1.897 1.00 0.00 C ATOM 0 H LEU A 112 3.679 -6.884 4.023 1.00 0.00 H new ATOM 0 HA LEU A 112 2.062 -6.335 1.853 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.033 -7.691 4.345 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.639 -8.034 2.672 1.00 0.00 H new ATOM 0 HG LEU A 112 3.417 -8.498 3.770 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.769 -10.848 4.132 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.853 -9.742 5.184 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.082 -10.440 3.739 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.542 -10.096 1.904 1.00 0.00 H new ATOM 0 HD22 LEU A 112 1.885 -9.660 1.424 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.184 -8.447 1.338 1.00 0.00 H new ATOM 1670 N ASN A 113 1.336 -4.553 4.416 1.00 0.00 N ATOM 1671 CA ASN A 113 0.515 -3.509 4.994 1.00 0.00 C ATOM 1672 C ASN A 113 1.104 -2.122 4.747 1.00 0.00 C ATOM 1673 O ASN A 113 0.430 -1.112 4.940 1.00 0.00 O ATOM 1674 CB ASN A 113 0.446 -3.744 6.489 1.00 0.00 C ATOM 1675 CG ASN A 113 -0.728 -4.619 6.889 1.00 0.00 C ATOM 1676 OD1 ASN A 113 -1.406 -4.353 7.881 1.00 0.00 O ATOM 1677 ND2 ASN A 113 -0.971 -5.674 6.120 1.00 0.00 N ATOM 0 H ASN A 113 2.241 -4.661 4.873 1.00 0.00 H new ATOM 0 HA ASN A 113 -0.471 -3.544 4.531 1.00 0.00 H new ATOM 0 HB2 ASN A 113 1.373 -4.211 6.823 1.00 0.00 H new ATOM 0 HB3 ASN A 113 0.370 -2.785 7.001 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -1.745 -6.300 6.343 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -0.384 -5.858 5.306 1.00 0.00 H new ATOM 1684 N LYS A 114 2.378 -2.078 4.359 1.00 0.00 N ATOM 1685 CA LYS A 114 3.071 -0.815 4.127 1.00 0.00 C ATOM 1686 C LYS A 114 2.803 0.152 5.274 1.00 0.00 C ATOM 1687 O LYS A 114 2.537 1.335 5.059 1.00 0.00 O ATOM 1688 CB LYS A 114 2.653 -0.195 2.793 1.00 0.00 C ATOM 1689 CG LYS A 114 1.174 0.142 2.702 1.00 0.00 C ATOM 1690 CD LYS A 114 0.833 0.800 1.378 1.00 0.00 C ATOM 1691 CE LYS A 114 1.642 2.069 1.157 1.00 0.00 C ATOM 1692 NZ LYS A 114 1.033 2.942 0.117 1.00 0.00 N ATOM 0 H LYS A 114 2.951 -2.906 4.199 1.00 0.00 H new ATOM 0 HA LYS A 114 4.141 -1.017 4.081 1.00 0.00 H new ATOM 0 HB2 LYS A 114 3.232 0.714 2.629 1.00 0.00 H new ATOM 0 HB3 LYS A 114 2.908 -0.885 1.988 1.00 0.00 H new ATOM 0 HG2 LYS A 114 0.585 -0.767 2.820 1.00 0.00 H new ATOM 0 HG3 LYS A 114 0.900 0.807 3.521 1.00 0.00 H new ATOM 0 HD2 LYS A 114 1.023 0.100 0.564 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -0.231 1.037 1.352 1.00 0.00 H new ATOM 0 HE2 LYS A 114 1.717 2.620 2.095 1.00 0.00 H new ATOM 0 HE3 LYS A 114 2.657 1.805 0.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 1.774 3.518 -0.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 0.571 2.352 -0.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 0.328 3.567 0.558 1.00 0.00 H new ATOM 1706 N ASP A 115 2.867 -0.371 6.496 1.00 0.00 N ATOM 1707 CA ASP A 115 2.623 0.432 7.686 1.00 0.00 C ATOM 1708 C ASP A 115 3.902 1.119 8.171 1.00 0.00 C ATOM 1709 O ASP A 115 3.872 1.887 9.133 1.00 0.00 O ATOM 1710 CB ASP A 115 2.029 -0.442 8.798 1.00 0.00 C ATOM 1711 CG ASP A 115 3.015 -1.471 9.317 1.00 0.00 C ATOM 1712 OD1 ASP A 115 3.314 -2.432 8.579 1.00 0.00 O ATOM 1713 OD2 ASP A 115 3.488 -1.314 10.463 1.00 0.00 O ATOM 0 H ASP A 115 3.086 -1.349 6.686 1.00 0.00 H new ATOM 0 HA ASP A 115 1.908 1.212 7.425 1.00 0.00 H new ATOM 0 HB2 ASP A 115 1.705 0.194 9.622 1.00 0.00 H new ATOM 0 HB3 ASP A 115 1.142 -0.951 8.421 1.00 0.00 H new ATOM 1718 N GLY A 116 5.024 0.849 7.502 1.00 0.00 N ATOM 1719 CA GLY A 116 6.281 1.465 7.891 1.00 0.00 C ATOM 1720 C GLY A 116 7.030 0.655 8.930 1.00 0.00 C ATOM 1721 O GLY A 116 7.705 1.210 9.797 1.00 0.00 O ATOM 0 H GLY A 116 5.083 0.218 6.703 1.00 0.00 H new ATOM 0 HA2 GLY A 116 6.910 1.588 7.009 1.00 0.00 H new ATOM 0 HA3 GLY A 116 6.086 2.463 8.285 1.00 0.00 H new ATOM 1725 N SER A 117 6.906 -0.662 8.841 1.00 0.00 N ATOM 1726 CA SER A 117 7.569 -1.567 9.778 1.00 0.00 C ATOM 1727 C SER A 117 7.311 -2.998 9.400 1.00 0.00 C ATOM 1728 O SER A 117 6.174 -3.469 9.426 1.00 0.00 O ATOM 1729 CB SER A 117 7.077 -1.329 11.209 1.00 0.00 C ATOM 1730 OG SER A 117 8.048 -0.641 11.978 1.00 0.00 O ATOM 0 H SER A 117 6.350 -1.132 8.127 1.00 0.00 H new ATOM 0 HA SER A 117 8.639 -1.366 9.731 1.00 0.00 H new ATOM 0 HB2 SER A 117 6.152 -0.753 11.187 1.00 0.00 H new ATOM 0 HB3 SER A 117 6.846 -2.284 11.680 1.00 0.00 H new ATOM 0 HG SER A 117 8.278 0.203 11.536 1.00 0.00 H new ATOM 1736 N ILE A 118 8.378 -3.698 9.076 1.00 0.00 N ATOM 1737 CA ILE A 118 8.264 -5.083 8.727 1.00 0.00 C ATOM 1738 C ILE A 118 7.822 -5.866 9.947 1.00 0.00 C ATOM 1739 O ILE A 118 8.589 -6.123 10.865 1.00 0.00 O ATOM 1740 CB ILE A 118 9.584 -5.627 8.155 1.00 0.00 C ATOM 1741 CG1 ILE A 118 9.788 -5.098 6.736 1.00 0.00 C ATOM 1742 CG2 ILE A 118 9.592 -7.142 8.163 1.00 0.00 C ATOM 1743 CD1 ILE A 118 8.611 -5.364 5.824 1.00 0.00 C ATOM 0 H ILE A 118 9.327 -3.325 9.049 1.00 0.00 H new ATOM 0 HA ILE A 118 7.515 -5.195 7.943 1.00 0.00 H new ATOM 0 HB ILE A 118 10.405 -5.284 8.784 1.00 0.00 H new ATOM 0 HG12 ILE A 118 9.970 -4.024 6.779 1.00 0.00 H new ATOM 0 HG13 ILE A 118 10.680 -5.556 6.309 1.00 0.00 H new ATOM 0 HG21 ILE A 118 10.536 -7.503 7.754 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.479 -7.501 9.186 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.767 -7.513 7.555 1.00 0.00 H new ATOM 0 HD11 ILE A 118 8.821 -4.963 4.832 1.00 0.00 H new ATOM 0 HD12 ILE A 118 8.442 -6.438 5.753 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.721 -4.883 6.229 1.00 0.00 H new ATOM 1755 N ASP A 119 6.559 -6.198 9.965 1.00 0.00 N ATOM 1756 CA ASP A 119 5.991 -6.921 11.095 1.00 0.00 C ATOM 1757 C ASP A 119 5.098 -8.070 10.646 1.00 0.00 C ATOM 1758 O ASP A 119 5.191 -8.540 9.514 1.00 0.00 O ATOM 1759 CB ASP A 119 5.216 -5.958 11.995 1.00 0.00 C ATOM 1760 CG ASP A 119 5.479 -6.207 13.468 1.00 0.00 C ATOM 1761 OD1 ASP A 119 6.656 -6.397 13.837 1.00 0.00 O ATOM 1762 OD2 ASP A 119 4.506 -6.210 14.252 1.00 0.00 O ATOM 0 H ASP A 119 5.898 -5.985 9.218 1.00 0.00 H new ATOM 0 HA ASP A 119 6.815 -7.357 11.660 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.491 -4.933 11.748 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.149 -6.059 11.797 1.00 0.00 H new ATOM 1767 N GLU A 120 4.238 -8.517 11.555 1.00 0.00 N ATOM 1768 CA GLU A 120 3.320 -9.620 11.277 1.00 0.00 C ATOM 1769 C GLU A 120 2.481 -9.337 10.038 1.00 0.00 C ATOM 1770 O GLU A 120 2.292 -10.209 9.188 1.00 0.00 O ATOM 1771 CB GLU A 120 2.405 -9.862 12.480 1.00 0.00 C ATOM 1772 CG GLU A 120 3.158 -10.140 13.770 1.00 0.00 C ATOM 1773 CD GLU A 120 2.526 -9.463 14.971 1.00 0.00 C ATOM 1774 OE1 GLU A 120 1.280 -9.445 15.054 1.00 0.00 O ATOM 1775 OE2 GLU A 120 3.276 -8.953 15.830 1.00 0.00 O ATOM 0 H GLU A 120 4.156 -8.131 12.496 1.00 0.00 H new ATOM 0 HA GLU A 120 3.915 -10.514 11.091 1.00 0.00 H new ATOM 0 HB2 GLU A 120 1.767 -8.990 12.622 1.00 0.00 H new ATOM 0 HB3 GLU A 120 1.749 -10.705 12.263 1.00 0.00 H new ATOM 0 HG2 GLU A 120 3.194 -11.216 13.941 1.00 0.00 H new ATOM 0 HG3 GLU A 120 4.188 -9.799 13.666 1.00 0.00 H new ATOM 1782 N TYR A 121 1.981 -8.110 9.941 1.00 0.00 N ATOM 1783 CA TYR A 121 1.161 -7.698 8.806 1.00 0.00 C ATOM 1784 C TYR A 121 1.816 -8.092 7.485 1.00 0.00 C ATOM 1785 O TYR A 121 1.133 -8.299 6.483 1.00 0.00 O ATOM 1786 CB TYR A 121 0.913 -6.181 8.825 1.00 0.00 C ATOM 1787 CG TYR A 121 1.403 -5.464 10.068 1.00 0.00 C ATOM 1788 CD1 TYR A 121 0.718 -5.564 11.274 1.00 0.00 C ATOM 1789 CD2 TYR A 121 2.548 -4.684 10.029 1.00 0.00 C ATOM 1790 CE1 TYR A 121 1.164 -4.906 12.404 1.00 0.00 C ATOM 1791 CE2 TYR A 121 3.002 -4.023 11.155 1.00 0.00 C ATOM 1792 CZ TYR A 121 2.306 -4.136 12.340 1.00 0.00 C ATOM 1793 OH TYR A 121 2.753 -3.479 13.463 1.00 0.00 O ATOM 0 H TYR A 121 2.130 -7.380 10.638 1.00 0.00 H new ATOM 0 HA TYR A 121 0.204 -8.213 8.893 1.00 0.00 H new ATOM 0 HB2 TYR A 121 1.397 -5.739 7.955 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.157 -6.002 8.719 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -0.177 -6.166 11.328 1.00 0.00 H new ATOM 0 HD2 TYR A 121 3.095 -4.591 9.103 1.00 0.00 H new ATOM 0 HE1 TYR A 121 0.621 -4.994 13.333 1.00 0.00 H new ATOM 0 HE2 TYR A 121 3.897 -3.421 11.107 1.00 0.00 H new ATOM 0 HH TYR A 121 3.570 -2.982 13.248 1.00 0.00 H new ATOM 1803 N GLU A 122 3.145 -8.179 7.484 1.00 0.00 N ATOM 1804 CA GLU A 122 3.883 -8.531 6.274 1.00 0.00 C ATOM 1805 C GLU A 122 4.147 -10.033 6.178 1.00 0.00 C ATOM 1806 O GLU A 122 4.481 -10.545 5.112 1.00 0.00 O ATOM 1807 CB GLU A 122 5.202 -7.764 6.202 1.00 0.00 C ATOM 1808 CG GLU A 122 5.224 -6.519 7.065 1.00 0.00 C ATOM 1809 CD GLU A 122 4.046 -5.594 6.811 1.00 0.00 C ATOM 1810 OE1 GLU A 122 3.113 -5.999 6.086 1.00 0.00 O ATOM 1811 OE2 GLU A 122 4.056 -4.464 7.338 1.00 0.00 O ATOM 0 H GLU A 122 3.729 -8.012 8.303 1.00 0.00 H new ATOM 0 HA GLU A 122 3.257 -8.248 5.427 1.00 0.00 H new ATOM 0 HB2 GLU A 122 6.014 -8.423 6.508 1.00 0.00 H new ATOM 0 HB3 GLU A 122 5.394 -7.482 5.167 1.00 0.00 H new ATOM 0 HG2 GLU A 122 5.228 -6.812 8.115 1.00 0.00 H new ATOM 0 HG3 GLU A 122 6.151 -5.975 6.883 1.00 0.00 H new ATOM 1818 N ILE A 123 3.991 -10.730 7.290 1.00 0.00 N ATOM 1819 CA ILE A 123 4.204 -12.175 7.326 1.00 0.00 C ATOM 1820 C ILE A 123 2.891 -12.933 7.141 1.00 0.00 C ATOM 1821 O ILE A 123 2.890 -14.110 6.782 1.00 0.00 O ATOM 1822 CB ILE A 123 4.855 -12.633 8.650 1.00 0.00 C ATOM 1823 CG1 ILE A 123 5.712 -11.518 9.252 1.00 0.00 C ATOM 1824 CG2 ILE A 123 5.693 -13.881 8.421 1.00 0.00 C ATOM 1825 CD1 ILE A 123 6.785 -11.007 8.315 1.00 0.00 C ATOM 0 H ILE A 123 3.717 -10.322 8.184 1.00 0.00 H new ATOM 0 HA ILE A 123 4.881 -12.402 6.502 1.00 0.00 H new ATOM 0 HB ILE A 123 4.060 -12.869 9.358 1.00 0.00 H new ATOM 0 HG12 ILE A 123 5.066 -10.688 9.538 1.00 0.00 H new ATOM 0 HG13 ILE A 123 6.182 -11.885 10.164 1.00 0.00 H new ATOM 0 HG21 ILE A 123 6.146 -14.193 9.362 1.00 0.00 H new ATOM 0 HG22 ILE A 123 5.058 -14.681 8.041 1.00 0.00 H new ATOM 0 HG23 ILE A 123 6.477 -13.665 7.695 1.00 0.00 H new ATOM 0 HD11 ILE A 123 7.353 -10.218 8.808 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.455 -11.825 8.048 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.321 -10.609 7.412 1.00 0.00 H new ATOM 1837 N SER A 124 1.776 -12.252 7.401 1.00 0.00 N ATOM 1838 CA SER A 124 0.446 -12.852 7.282 1.00 0.00 C ATOM 1839 C SER A 124 0.311 -13.718 6.030 1.00 0.00 C ATOM 1840 O SER A 124 -0.089 -14.879 6.110 1.00 0.00 O ATOM 1841 CB SER A 124 -0.623 -11.758 7.271 1.00 0.00 C ATOM 1842 OG SER A 124 -1.158 -11.553 8.567 1.00 0.00 O ATOM 0 H SER A 124 1.767 -11.276 7.698 1.00 0.00 H new ATOM 0 HA SER A 124 0.305 -13.500 8.147 1.00 0.00 H new ATOM 0 HB2 SER A 124 -0.192 -10.828 6.901 1.00 0.00 H new ATOM 0 HB3 SER A 124 -1.423 -12.034 6.584 1.00 0.00 H new ATOM 0 HG SER A 124 -0.529 -11.892 9.238 1.00 0.00 H new ATOM 1848 N PHE A 125 0.638 -13.149 4.874 1.00 0.00 N ATOM 1849 CA PHE A 125 0.539 -13.879 3.613 1.00 0.00 C ATOM 1850 C PHE A 125 1.846 -14.594 3.289 1.00 0.00 C ATOM 1851 O PHE A 125 1.851 -15.648 2.653 1.00 0.00 O ATOM 1852 CB PHE A 125 0.168 -12.925 2.475 1.00 0.00 C ATOM 1853 CG PHE A 125 0.054 -13.598 1.136 1.00 0.00 C ATOM 1854 CD1 PHE A 125 -0.918 -14.559 0.910 1.00 0.00 C ATOM 1855 CD2 PHE A 125 0.918 -13.267 0.105 1.00 0.00 C ATOM 1856 CE1 PHE A 125 -1.026 -15.179 -0.320 1.00 0.00 C ATOM 1857 CE2 PHE A 125 0.817 -13.884 -1.128 1.00 0.00 C ATOM 1858 CZ PHE A 125 -0.157 -14.842 -1.340 1.00 0.00 C ATOM 0 H PHE A 125 0.972 -12.190 4.783 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.244 -14.630 3.719 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -0.781 -12.443 2.711 1.00 0.00 H new ATOM 0 HB3 PHE A 125 0.919 -12.138 2.413 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -1.599 -14.827 1.704 1.00 0.00 H new ATOM 0 HD2 PHE A 125 1.679 -12.518 0.266 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -1.789 -15.926 -0.484 1.00 0.00 H new ATOM 0 HE2 PHE A 125 1.497 -13.618 -1.924 1.00 0.00 H new ATOM 0 HZ PHE A 125 -0.239 -15.326 -2.302 1.00 0.00 H new ATOM 1868 N ILE A 126 2.951 -14.012 3.733 1.00 0.00 N ATOM 1869 CA ILE A 126 4.270 -14.583 3.497 1.00 0.00 C ATOM 1870 C ILE A 126 4.504 -15.827 4.353 1.00 0.00 C ATOM 1871 O ILE A 126 5.494 -16.535 4.172 1.00 0.00 O ATOM 1872 CB ILE A 126 5.374 -13.548 3.780 1.00 0.00 C ATOM 1873 CG1 ILE A 126 5.077 -12.239 3.041 1.00 0.00 C ATOM 1874 CG2 ILE A 126 6.737 -14.094 3.390 1.00 0.00 C ATOM 1875 CD1 ILE A 126 5.465 -12.255 1.576 1.00 0.00 C ATOM 0 H ILE A 126 2.960 -13.140 4.262 1.00 0.00 H new ATOM 0 HA ILE A 126 4.311 -14.873 2.447 1.00 0.00 H new ATOM 0 HB ILE A 126 5.390 -13.342 4.850 1.00 0.00 H new ATOM 0 HG12 ILE A 126 4.012 -12.022 3.122 1.00 0.00 H new ATOM 0 HG13 ILE A 126 5.606 -11.426 3.537 1.00 0.00 H new ATOM 0 HG21 ILE A 126 7.502 -13.346 3.599 1.00 0.00 H new ATOM 0 HG22 ILE A 126 6.946 -14.996 3.965 1.00 0.00 H new ATOM 0 HG23 ILE A 126 6.743 -14.332 2.326 1.00 0.00 H new ATOM 0 HD11 ILE A 126 5.223 -11.293 1.125 1.00 0.00 H new ATOM 0 HD12 ILE A 126 6.536 -12.439 1.485 1.00 0.00 H new ATOM 0 HD13 ILE A 126 4.916 -13.045 1.063 1.00 0.00 H new ATOM 1887 N ASN A 127 3.590 -16.097 5.282 1.00 0.00 N ATOM 1888 CA ASN A 127 3.710 -17.264 6.148 1.00 0.00 C ATOM 1889 C ASN A 127 2.937 -18.445 5.572 1.00 0.00 C ATOM 1890 O ASN A 127 3.333 -19.599 5.737 1.00 0.00 O ATOM 1891 CB ASN A 127 3.196 -16.944 7.554 1.00 0.00 C ATOM 1892 CG ASN A 127 4.310 -16.538 8.500 1.00 0.00 C ATOM 1893 OD1 ASN A 127 5.489 -16.600 8.151 1.00 0.00 O ATOM 1894 ND2 ASN A 127 3.940 -16.120 9.705 1.00 0.00 N ATOM 0 H ASN A 127 2.762 -15.526 5.453 1.00 0.00 H new ATOM 0 HA ASN A 127 4.765 -17.532 6.209 1.00 0.00 H new ATOM 0 HB2 ASN A 127 2.462 -16.140 7.495 1.00 0.00 H new ATOM 0 HB3 ASN A 127 2.681 -17.816 7.957 1.00 0.00 H new ATOM 0 HD21 ASN A 127 4.645 -15.834 10.384 1.00 0.00 H new ATOM 0 HD22 ASN A 127 2.951 -16.085 9.951 1.00 0.00 H new ATOM 1901 N HIS A 128 1.825 -18.150 4.903 1.00 0.00 N ATOM 1902 CA HIS A 128 0.991 -19.190 4.311 1.00 0.00 C ATOM 1903 C HIS A 128 1.369 -19.450 2.856 1.00 0.00 C ATOM 1904 O HIS A 128 1.514 -20.601 2.443 1.00 0.00 O ATOM 1905 CB HIS A 128 -0.487 -18.804 4.411 1.00 0.00 C ATOM 1906 CG HIS A 128 -1.276 -19.692 5.324 1.00 0.00 C ATOM 1907 ND1 HIS A 128 -2.000 -20.777 4.876 1.00 0.00 N ATOM 1908 CD2 HIS A 128 -1.451 -19.652 6.665 1.00 0.00 C ATOM 1909 CE1 HIS A 128 -2.588 -21.365 5.903 1.00 0.00 C ATOM 1910 NE2 HIS A 128 -2.270 -20.702 7.000 1.00 0.00 N ATOM 0 H HIS A 128 1.482 -17.200 4.758 1.00 0.00 H new ATOM 0 HA HIS A 128 1.160 -20.110 4.870 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -0.563 -17.775 4.763 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -0.930 -18.834 3.416 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -1.026 -18.929 7.345 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -3.221 -22.239 5.854 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -2.582 -20.933 7.943 1.00 0.00 H new ATOM 1919 N ARG A 129 1.522 -18.379 2.080 1.00 0.00 N ATOM 1920 CA ARG A 129 1.880 -18.500 0.668 1.00 0.00 C ATOM 1921 C ARG A 129 3.015 -19.503 0.474 1.00 0.00 C ATOM 1922 O ARG A 129 3.102 -20.167 -0.559 1.00 0.00 O ATOM 1923 CB ARG A 129 2.287 -17.137 0.103 1.00 0.00 C ATOM 1924 CG ARG A 129 2.141 -17.034 -1.406 1.00 0.00 C ATOM 1925 CD ARG A 129 3.225 -17.820 -2.129 1.00 0.00 C ATOM 1926 NE ARG A 129 2.683 -18.983 -2.828 1.00 0.00 N ATOM 1927 CZ ARG A 129 3.332 -19.639 -3.787 1.00 0.00 C ATOM 1928 NH1 ARG A 129 4.543 -19.251 -4.165 1.00 0.00 N ATOM 1929 NH2 ARG A 129 2.767 -20.688 -4.371 1.00 0.00 N ATOM 0 H ARG A 129 1.404 -17.419 2.404 1.00 0.00 H new ATOM 0 HA ARG A 129 1.004 -18.863 0.130 1.00 0.00 H new ATOM 0 HB2 ARG A 129 1.679 -16.363 0.572 1.00 0.00 H new ATOM 0 HB3 ARG A 129 3.324 -16.936 0.374 1.00 0.00 H new ATOM 0 HG2 ARG A 129 1.161 -17.407 -1.703 1.00 0.00 H new ATOM 0 HG3 ARG A 129 2.188 -15.987 -1.706 1.00 0.00 H new ATOM 0 HD2 ARG A 129 3.729 -17.170 -2.844 1.00 0.00 H new ATOM 0 HD3 ARG A 129 3.977 -18.147 -1.410 1.00 0.00 H new ATOM 0 HE ARG A 129 1.753 -19.311 -2.566 1.00 0.00 H new ATOM 0 HH11 ARG A 129 4.982 -18.445 -3.720 1.00 0.00 H new ATOM 0 HH12 ARG A 129 5.035 -19.758 -4.901 1.00 0.00 H new ATOM 0 HH21 ARG A 129 1.836 -20.991 -4.085 1.00 0.00 H new ATOM 0 HH22 ARG A 129 3.264 -21.191 -5.106 1.00 0.00 H new ATOM 1943 N ILE A 130 3.876 -19.607 1.478 1.00 0.00 N ATOM 1944 CA ILE A 130 5.003 -20.527 1.431 1.00 0.00 C ATOM 1945 C ILE A 130 4.643 -21.863 2.079 1.00 0.00 C ATOM 1946 O ILE A 130 5.151 -22.913 1.685 1.00 0.00 O ATOM 1947 CB ILE A 130 6.238 -19.926 2.135 1.00 0.00 C ATOM 1948 CG1 ILE A 130 6.750 -18.720 1.352 1.00 0.00 C ATOM 1949 CG2 ILE A 130 7.341 -20.965 2.290 1.00 0.00 C ATOM 1950 CD1 ILE A 130 6.041 -17.433 1.705 1.00 0.00 C ATOM 0 H ILE A 130 3.814 -19.062 2.338 1.00 0.00 H new ATOM 0 HA ILE A 130 5.244 -20.696 0.382 1.00 0.00 H new ATOM 0 HB ILE A 130 5.940 -19.602 3.132 1.00 0.00 H new ATOM 0 HG12 ILE A 130 7.817 -18.601 1.538 1.00 0.00 H new ATOM 0 HG13 ILE A 130 6.632 -18.911 0.285 1.00 0.00 H new ATOM 0 HG21 ILE A 130 8.199 -20.514 2.789 1.00 0.00 H new ATOM 0 HG22 ILE A 130 6.973 -21.800 2.886 1.00 0.00 H new ATOM 0 HG23 ILE A 130 7.642 -21.326 1.306 1.00 0.00 H new ATOM 0 HD11 ILE A 130 6.453 -16.616 1.113 1.00 0.00 H new ATOM 0 HD12 ILE A 130 4.977 -17.534 1.493 1.00 0.00 H new ATOM 0 HD13 ILE A 130 6.181 -17.219 2.765 1.00 0.00 H new