USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=26 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 HD1:sc= -4.52 K(o=-4.6,f=-11!) USER MOD Set 1.2: A 124 SER OG : rot -60:sc= -0.0569 USER MOD Set 2.1: A 100 LYS NZ :NH3+ -130:sc= 0.0271 (180deg=0) USER MOD Set 2.2: A 107 ASN : amide:sc= -1.75 X(o=-1.7,f=-1.9) USER MOD Set 3.1: A 104 SER OG : rot 180:sc= 0.158 USER MOD Set 3.2: A 106 THR OG1 : rot -39:sc= 0.164 USER MOD Set 4.1: A 87 ASN : amide:sc= -6.57! C(o=-8.4!,f=-4.9!) USER MOD Set 4.2: A 89 LYS NZ :NH3+ 158:sc= -1.79 (180deg=0) USER MOD Set 5.1: A 38 THR OG1 : rot -54:sc= 0.0148 USER MOD Set 5.2: A 42 ASN : amide:sc= -4.78 K(o=-4.8,f=-2.2) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -0.381 K(o=-0.38,f=-0.96) USER MOD Single : A 11 ASN : amide:sc= -2.99! K(o=-3!,f=-1.7) USER MOD Single : A 12 GLN : amide:sc= -3.46! K(o=-3.5!,f=-1.4) USER MOD Single : A 14 LYS NZ :NH3+ 163:sc= -0.666 (180deg=-3.05!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 146:sc= -4.12! USER MOD Single : A 25 ASN : amide:sc= -3.13 K(o=-3.1,f=-9.2!) USER MOD Single : A 29 TYR OH : rot 49:sc= -2.47! USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 177:sc= 1.16 (180deg=1.06) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= 0.408 X(o=0.41,f=0) USER MOD Single : A 50 LYS NZ :NH3+ -128:sc= 0.169 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.261 USER MOD Single : A 59 ASN : amide:sc= -5.17! C(o=-5.2!,f=-21!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 140:sc= -0.0715 USER MOD Single : A 73 ASN : amide:sc= -3.05 K(o=-3.1,f=-9.1!) USER MOD Single : A 74 SER OG : rot 8:sc=-0.00557 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot -27:sc= -0.797 USER MOD Single : A 85 ASN : amide:sc= -2.16 K(o=-2.2,f=-3!) USER MOD Single : A 97 MET CE :methyl 144:sc= -6.29! (180deg=-7.43!) USER MOD Single : A 99 SER OG : rot -79:sc= 0.185 USER MOD Single : A 101 ASN : amide:sc= -9.67 K(o=-9.7,f=-19!) USER MOD Single : A 105 THR OG1 : rot 180:sc= -0.0719 USER MOD Single : A 108 THR OG1 : rot -33:sc= 0.604 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -7.62! C(o=-7.6!,f=-18!) USER MOD Single : A 114 LYS NZ :NH3+ -138:sc= 0.0128 (180deg=0) USER MOD Single : A 117 SER OG : rot 180:sc= -0.865 USER MOD Single : A 121 TYR OH : rot -120:sc= 0.464 USER MOD Single : A 127 ASN : amide:sc= -5.95! C(o=-6!,f=-8.8!) USER MOD Single : A 128 HIS : no HD1:sc= -0.28 X(o=-0.28,f=0.04) USER MOD ----------------------------------------------------------------- ATOM 32 N LYS A 3 -16.457 21.329 -0.484 1.00 0.00 N ATOM 33 CA LYS A 3 -16.091 20.035 0.107 1.00 0.00 C ATOM 34 C LYS A 3 -16.283 18.880 -0.877 1.00 0.00 C ATOM 35 O LYS A 3 -17.006 17.924 -0.598 1.00 0.00 O ATOM 36 CB LYS A 3 -16.893 19.770 1.388 1.00 0.00 C ATOM 37 CG LYS A 3 -18.356 20.185 1.309 1.00 0.00 C ATOM 38 CD LYS A 3 -18.682 21.284 2.309 1.00 0.00 C ATOM 39 CE LYS A 3 -17.838 22.526 2.075 1.00 0.00 C ATOM 40 NZ LYS A 3 -18.529 23.511 1.197 1.00 0.00 N ATOM 0 HA LYS A 3 -15.031 20.090 0.356 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -16.841 18.707 1.621 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -16.421 20.301 2.215 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -18.582 20.531 0.301 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -18.991 19.320 1.499 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -19.738 21.542 2.234 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -18.515 20.916 3.321 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -17.607 22.993 3.032 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -16.889 22.240 1.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -17.920 24.343 1.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -18.727 23.074 0.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -19.423 23.804 1.641 1.00 0.00 H new ATOM 54 N THR A 4 -15.628 18.981 -2.028 1.00 0.00 N ATOM 55 CA THR A 4 -15.721 17.950 -3.052 1.00 0.00 C ATOM 56 C THR A 4 -14.622 16.909 -2.876 1.00 0.00 C ATOM 57 O THR A 4 -14.894 15.711 -2.810 1.00 0.00 O ATOM 58 CB THR A 4 -15.631 18.575 -4.445 1.00 0.00 C ATOM 59 OG1 THR A 4 -16.499 19.689 -4.552 1.00 0.00 O ATOM 60 CG2 THR A 4 -15.981 17.610 -5.557 1.00 0.00 C ATOM 0 H THR A 4 -15.027 19.767 -2.274 1.00 0.00 H new ATOM 0 HA THR A 4 -16.686 17.454 -2.947 1.00 0.00 H new ATOM 0 HB THR A 4 -14.589 18.875 -4.561 1.00 0.00 H new ATOM 0 HG1 THR A 4 -16.426 20.076 -5.449 1.00 0.00 H new ATOM 0 HG21 THR A 4 -15.897 18.117 -6.518 1.00 0.00 H new ATOM 0 HG22 THR A 4 -15.296 16.763 -5.533 1.00 0.00 H new ATOM 0 HG23 THR A 4 -17.003 17.255 -5.422 1.00 0.00 H new ATOM 68 N ASN A 5 -13.379 17.376 -2.801 1.00 0.00 N ATOM 69 CA ASN A 5 -12.232 16.488 -2.635 1.00 0.00 C ATOM 70 C ASN A 5 -12.437 15.536 -1.459 1.00 0.00 C ATOM 71 O ASN A 5 -11.944 14.411 -1.471 1.00 0.00 O ATOM 72 CB ASN A 5 -10.954 17.304 -2.430 1.00 0.00 C ATOM 73 CG ASN A 5 -9.792 16.768 -3.241 1.00 0.00 C ATOM 74 OD1 ASN A 5 -8.698 16.560 -2.718 1.00 0.00 O ATOM 75 ND2 ASN A 5 -10.024 16.542 -4.530 1.00 0.00 N ATOM 0 H ASN A 5 -13.140 18.366 -2.853 1.00 0.00 H new ATOM 0 HA ASN A 5 -12.135 15.893 -3.543 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -11.140 18.342 -2.708 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -10.689 17.300 -1.373 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -9.279 16.182 -5.127 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -10.947 16.729 -4.922 1.00 0.00 H new ATOM 82 N LEU A 6 -13.170 15.994 -0.450 1.00 0.00 N ATOM 83 CA LEU A 6 -13.444 15.189 0.725 1.00 0.00 C ATOM 84 C LEU A 6 -14.519 14.157 0.427 1.00 0.00 C ATOM 85 O LEU A 6 -14.250 12.959 0.401 1.00 0.00 O ATOM 86 CB LEU A 6 -13.894 16.089 1.876 1.00 0.00 C ATOM 87 CG LEU A 6 -12.774 16.736 2.699 1.00 0.00 C ATOM 88 CD1 LEU A 6 -12.712 16.108 4.080 1.00 0.00 C ATOM 89 CD2 LEU A 6 -11.425 16.621 1.998 1.00 0.00 C ATOM 0 H LEU A 6 -13.586 16.925 -0.427 1.00 0.00 H new ATOM 0 HA LEU A 6 -12.531 14.667 1.010 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -14.522 16.881 1.468 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -14.519 15.501 2.548 1.00 0.00 H new ATOM 0 HG LEU A 6 -13.001 17.797 2.800 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -11.913 16.575 4.656 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -13.663 16.258 4.591 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -12.515 15.040 3.986 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -10.655 17.091 2.611 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -11.180 15.569 1.851 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -11.474 17.121 1.031 1.00 0.00 H new ATOM 101 N GLY A 7 -15.739 14.631 0.195 1.00 0.00 N ATOM 102 CA GLY A 7 -16.843 13.738 -0.105 1.00 0.00 C ATOM 103 C GLY A 7 -16.499 12.713 -1.168 1.00 0.00 C ATOM 104 O GLY A 7 -17.109 11.648 -1.231 1.00 0.00 O ATOM 0 H GLY A 7 -15.983 15.621 0.210 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -17.145 13.222 0.806 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -17.699 14.325 -0.437 1.00 0.00 H new ATOM 108 N GLU A 8 -15.522 13.031 -2.008 1.00 0.00 N ATOM 109 CA GLU A 8 -15.112 12.118 -3.066 1.00 0.00 C ATOM 110 C GLU A 8 -13.927 11.264 -2.632 1.00 0.00 C ATOM 111 O GLU A 8 -13.673 10.208 -3.212 1.00 0.00 O ATOM 112 CB GLU A 8 -14.753 12.887 -4.339 1.00 0.00 C ATOM 113 CG GLU A 8 -13.540 13.791 -4.188 1.00 0.00 C ATOM 114 CD GLU A 8 -12.351 13.322 -5.007 1.00 0.00 C ATOM 115 OE1 GLU A 8 -12.552 12.520 -5.943 1.00 0.00 O ATOM 116 OE2 GLU A 8 -11.219 13.760 -4.712 1.00 0.00 O ATOM 0 H GLU A 8 -15.002 13.908 -1.978 1.00 0.00 H new ATOM 0 HA GLU A 8 -15.956 11.461 -3.273 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -14.566 12.174 -5.142 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -15.609 13.490 -4.641 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -13.807 14.803 -4.491 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -13.256 13.837 -3.137 1.00 0.00 H new ATOM 123 N LEU A 9 -13.205 11.712 -1.609 1.00 0.00 N ATOM 124 CA LEU A 9 -12.061 10.964 -1.115 1.00 0.00 C ATOM 125 C LEU A 9 -12.441 10.178 0.131 1.00 0.00 C ATOM 126 O LEU A 9 -11.756 9.229 0.515 1.00 0.00 O ATOM 127 CB LEU A 9 -10.892 11.903 -0.812 1.00 0.00 C ATOM 128 CG LEU A 9 -10.117 12.390 -2.037 1.00 0.00 C ATOM 129 CD1 LEU A 9 -8.997 13.331 -1.619 1.00 0.00 C ATOM 130 CD2 LEU A 9 -9.561 11.210 -2.818 1.00 0.00 C ATOM 0 H LEU A 9 -13.392 12.583 -1.112 1.00 0.00 H new ATOM 0 HA LEU A 9 -11.749 10.264 -1.890 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -11.273 12.771 -0.274 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -10.200 11.392 -0.143 1.00 0.00 H new ATOM 0 HG LEU A 9 -10.802 12.938 -2.684 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -8.456 13.668 -2.503 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -9.420 14.193 -1.102 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -8.312 12.808 -0.952 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -9.012 11.575 -3.686 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -8.890 10.635 -2.180 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -10.382 10.573 -3.148 1.00 0.00 H new ATOM 142 N ILE A 10 -13.540 10.582 0.759 1.00 0.00 N ATOM 143 CA ILE A 10 -14.013 9.920 1.958 1.00 0.00 C ATOM 144 C ILE A 10 -15.039 8.846 1.624 1.00 0.00 C ATOM 145 O ILE A 10 -15.088 7.802 2.273 1.00 0.00 O ATOM 146 CB ILE A 10 -14.614 10.923 2.963 1.00 0.00 C ATOM 147 CG1 ILE A 10 -15.914 11.569 2.444 1.00 0.00 C ATOM 148 CG2 ILE A 10 -13.611 11.995 3.291 1.00 0.00 C ATOM 149 CD1 ILE A 10 -16.343 12.813 3.226 1.00 0.00 C ATOM 0 H ILE A 10 -14.117 11.366 0.453 1.00 0.00 H new ATOM 0 HA ILE A 10 -13.147 9.448 2.422 1.00 0.00 H new ATOM 0 HB ILE A 10 -14.863 10.361 3.863 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -15.781 11.838 1.396 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -16.716 10.832 2.485 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -14.048 12.697 4.002 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -12.723 11.540 3.729 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.335 12.526 2.380 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -17.265 13.210 2.801 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -16.509 12.547 4.270 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -15.560 13.569 3.165 1.00 0.00 H new ATOM 161 N ASN A 11 -15.849 9.098 0.597 1.00 0.00 N ATOM 162 CA ASN A 11 -16.861 8.133 0.175 1.00 0.00 C ATOM 163 C ASN A 11 -16.241 6.748 0.032 1.00 0.00 C ATOM 164 O ASN A 11 -16.910 5.730 0.209 1.00 0.00 O ATOM 165 CB ASN A 11 -17.484 8.563 -1.155 1.00 0.00 C ATOM 166 CG ASN A 11 -18.736 9.395 -0.968 1.00 0.00 C ATOM 167 OD1 ASN A 11 -19.699 9.269 -1.726 1.00 0.00 O ATOM 168 ND2 ASN A 11 -18.731 10.254 0.044 1.00 0.00 N ATOM 0 H ASN A 11 -15.825 9.956 0.046 1.00 0.00 H new ATOM 0 HA ASN A 11 -17.642 8.096 0.935 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -16.753 9.136 -1.726 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -17.725 7.677 -1.743 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -19.546 10.842 0.218 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -17.912 10.326 0.648 1.00 0.00 H new ATOM 175 N GLN A 12 -14.950 6.728 -0.285 1.00 0.00 N ATOM 176 CA GLN A 12 -14.218 5.483 -0.449 1.00 0.00 C ATOM 177 C GLN A 12 -13.552 5.074 0.859 1.00 0.00 C ATOM 178 O GLN A 12 -13.403 3.888 1.146 1.00 0.00 O ATOM 179 CB GLN A 12 -13.159 5.635 -1.542 1.00 0.00 C ATOM 180 CG GLN A 12 -12.050 6.605 -1.166 1.00 0.00 C ATOM 181 CD GLN A 12 -11.173 6.984 -2.342 1.00 0.00 C ATOM 182 OE1 GLN A 12 -11.043 6.231 -3.307 1.00 0.00 O ATOM 183 NE2 GLN A 12 -10.566 8.162 -2.264 1.00 0.00 N ATOM 0 H GLN A 12 -14.389 7.567 -0.434 1.00 0.00 H new ATOM 0 HA GLN A 12 -14.925 4.706 -0.739 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -12.723 4.659 -1.756 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -13.638 5.978 -2.459 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -12.492 7.507 -0.743 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -11.432 6.158 -0.388 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -10.703 8.753 -1.444 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -9.962 8.476 -3.024 1.00 0.00 H new ATOM 192 N GLY A 13 -13.152 6.066 1.648 1.00 0.00 N ATOM 193 CA GLY A 13 -12.508 5.785 2.915 1.00 0.00 C ATOM 194 C GLY A 13 -13.382 4.947 3.825 1.00 0.00 C ATOM 195 O GLY A 13 -13.074 3.790 4.104 1.00 0.00 O ATOM 0 H GLY A 13 -13.263 7.057 1.432 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.568 5.264 2.735 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -12.262 6.723 3.412 1.00 0.00 H new ATOM 199 N LYS A 14 -14.483 5.528 4.280 1.00 0.00 N ATOM 200 CA LYS A 14 -15.405 4.812 5.162 1.00 0.00 C ATOM 201 C LYS A 14 -15.864 3.509 4.509 1.00 0.00 C ATOM 202 O LYS A 14 -16.262 2.567 5.195 1.00 0.00 O ATOM 203 CB LYS A 14 -16.619 5.678 5.545 1.00 0.00 C ATOM 204 CG LYS A 14 -16.835 6.896 4.660 1.00 0.00 C ATOM 205 CD LYS A 14 -16.160 8.140 5.235 1.00 0.00 C ATOM 206 CE LYS A 14 -16.620 9.407 4.527 1.00 0.00 C ATOM 207 NZ LYS A 14 -18.071 9.660 4.734 1.00 0.00 N ATOM 0 H LYS A 14 -14.761 6.484 4.058 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.866 4.578 6.080 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -17.515 5.058 5.512 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -16.500 6.011 6.576 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -16.441 6.696 3.664 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -17.904 7.080 4.549 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -16.383 8.216 6.299 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -15.078 8.043 5.142 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -16.047 10.258 4.895 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -16.415 9.322 3.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -18.289 10.649 4.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -18.625 9.026 4.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -18.316 9.482 5.729 1.00 0.00 H new ATOM 221 N SER A 15 -15.787 3.455 3.180 1.00 0.00 N ATOM 222 CA SER A 15 -16.173 2.261 2.437 1.00 0.00 C ATOM 223 C SER A 15 -15.012 1.269 2.385 1.00 0.00 C ATOM 224 O SER A 15 -15.218 0.061 2.260 1.00 0.00 O ATOM 225 CB SER A 15 -16.608 2.632 1.018 1.00 0.00 C ATOM 226 OG SER A 15 -17.624 1.763 0.551 1.00 0.00 O ATOM 0 H SER A 15 -15.460 4.226 2.597 1.00 0.00 H new ATOM 0 HA SER A 15 -17.013 1.793 2.950 1.00 0.00 H new ATOM 0 HB2 SER A 15 -16.970 3.660 1.003 1.00 0.00 H new ATOM 0 HB3 SER A 15 -15.750 2.586 0.348 1.00 0.00 H new ATOM 0 HG SER A 15 -17.885 2.023 -0.357 1.00 0.00 H new ATOM 232 N LEU A 16 -13.794 1.792 2.500 1.00 0.00 N ATOM 233 CA LEU A 16 -12.595 0.973 2.490 1.00 0.00 C ATOM 234 C LEU A 16 -12.462 0.267 3.832 1.00 0.00 C ATOM 235 O LEU A 16 -12.454 -0.960 3.907 1.00 0.00 O ATOM 236 CB LEU A 16 -11.365 1.852 2.242 1.00 0.00 C ATOM 237 CG LEU A 16 -10.927 2.015 0.785 1.00 0.00 C ATOM 238 CD1 LEU A 16 -10.111 3.294 0.618 1.00 0.00 C ATOM 239 CD2 LEU A 16 -10.122 0.806 0.332 1.00 0.00 C ATOM 0 H LEU A 16 -13.615 2.791 2.602 1.00 0.00 H new ATOM 0 HA LEU A 16 -12.666 0.233 1.693 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -11.565 2.842 2.651 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.529 1.437 2.805 1.00 0.00 H new ATOM 0 HG LEU A 16 -11.818 2.087 0.161 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -9.806 3.398 -0.423 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -10.718 4.153 0.905 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -9.226 3.246 1.252 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -9.819 0.939 -0.706 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.236 0.703 0.958 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -10.734 -0.092 0.419 1.00 0.00 H new ATOM 251 N LEU A 17 -12.377 1.068 4.895 1.00 0.00 N ATOM 252 CA LEU A 17 -12.263 0.542 6.248 1.00 0.00 C ATOM 253 C LEU A 17 -13.401 -0.435 6.535 1.00 0.00 C ATOM 254 O LEU A 17 -13.235 -1.397 7.284 1.00 0.00 O ATOM 255 CB LEU A 17 -12.304 1.687 7.273 1.00 0.00 C ATOM 256 CG LEU A 17 -11.046 2.562 7.370 1.00 0.00 C ATOM 257 CD1 LEU A 17 -11.153 3.504 8.556 1.00 0.00 C ATOM 258 CD2 LEU A 17 -9.787 1.716 7.489 1.00 0.00 C ATOM 0 H LEU A 17 -12.385 2.086 4.840 1.00 0.00 H new ATOM 0 HA LEU A 17 -11.310 0.019 6.331 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -13.150 2.331 7.032 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -12.499 1.259 8.256 1.00 0.00 H new ATOM 0 HG LEU A 17 -10.974 3.145 6.452 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -10.255 4.119 8.614 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -12.025 4.146 8.433 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -11.256 2.924 9.473 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -8.916 2.368 7.556 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -9.847 1.098 8.385 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -9.695 1.075 6.612 1.00 0.00 H new ATOM 270 N ASP A 18 -14.564 -0.171 5.940 1.00 0.00 N ATOM 271 CA ASP A 18 -15.739 -1.017 6.141 1.00 0.00 C ATOM 272 C ASP A 18 -15.628 -2.353 5.401 1.00 0.00 C ATOM 273 O ASP A 18 -16.314 -3.314 5.747 1.00 0.00 O ATOM 274 CB ASP A 18 -17.000 -0.280 5.686 1.00 0.00 C ATOM 275 CG ASP A 18 -17.544 0.648 6.754 1.00 0.00 C ATOM 276 OD1 ASP A 18 -16.753 1.095 7.611 1.00 0.00 O ATOM 277 OD2 ASP A 18 -18.761 0.927 6.733 1.00 0.00 O ATOM 0 H ASP A 18 -14.717 0.621 5.316 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.799 -1.235 7.207 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -16.777 0.296 4.788 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -17.766 -1.008 5.416 1.00 0.00 H new ATOM 282 N GLU A 19 -14.774 -2.415 4.380 1.00 0.00 N ATOM 283 CA GLU A 19 -14.605 -3.644 3.605 1.00 0.00 C ATOM 284 C GLU A 19 -13.321 -4.370 3.995 1.00 0.00 C ATOM 285 O GLU A 19 -13.358 -5.469 4.549 1.00 0.00 O ATOM 286 CB GLU A 19 -14.590 -3.329 2.109 1.00 0.00 C ATOM 287 CG GLU A 19 -15.978 -3.228 1.496 1.00 0.00 C ATOM 288 CD GLU A 19 -15.950 -3.280 -0.019 1.00 0.00 C ATOM 289 OE1 GLU A 19 -15.041 -2.667 -0.618 1.00 0.00 O ATOM 290 OE2 GLU A 19 -16.837 -3.933 -0.607 1.00 0.00 O ATOM 0 H GLU A 19 -14.193 -1.636 4.072 1.00 0.00 H new ATOM 0 HA GLU A 19 -15.449 -4.298 3.826 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -14.062 -2.389 1.949 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -14.027 -4.104 1.588 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -16.598 -4.042 1.873 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -16.446 -2.297 1.816 1.00 0.00 H new ATOM 297 N SER A 20 -12.187 -3.740 3.707 1.00 0.00 N ATOM 298 CA SER A 20 -10.884 -4.305 4.026 1.00 0.00 C ATOM 299 C SER A 20 -10.819 -4.686 5.486 1.00 0.00 C ATOM 300 O SER A 20 -10.710 -3.828 6.363 1.00 0.00 O ATOM 301 CB SER A 20 -9.803 -3.282 3.745 1.00 0.00 C ATOM 302 OG SER A 20 -10.276 -2.007 4.092 1.00 0.00 O ATOM 0 H SER A 20 -12.146 -2.830 3.249 1.00 0.00 H new ATOM 0 HA SER A 20 -10.733 -5.192 3.411 1.00 0.00 H new ATOM 0 HB2 SER A 20 -8.905 -3.518 4.315 1.00 0.00 H new ATOM 0 HB3 SER A 20 -9.527 -3.307 2.691 1.00 0.00 H new ATOM 0 HG SER A 20 -9.536 -1.466 4.438 1.00 0.00 H new ATOM 308 N VAL A 21 -10.894 -5.968 5.743 1.00 0.00 N ATOM 309 CA VAL A 21 -10.851 -6.461 7.098 1.00 0.00 C ATOM 310 C VAL A 21 -9.479 -6.993 7.442 1.00 0.00 C ATOM 311 O VAL A 21 -8.796 -7.572 6.607 1.00 0.00 O ATOM 312 CB VAL A 21 -11.894 -7.562 7.307 1.00 0.00 C ATOM 313 CG1 VAL A 21 -11.801 -8.603 6.203 1.00 0.00 C ATOM 314 CG2 VAL A 21 -11.758 -8.203 8.681 1.00 0.00 C ATOM 0 H VAL A 21 -10.985 -6.691 5.030 1.00 0.00 H new ATOM 0 HA VAL A 21 -11.077 -5.624 7.758 1.00 0.00 H new ATOM 0 HB VAL A 21 -12.881 -7.103 7.260 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -12.550 -9.377 6.369 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -11.978 -8.127 5.238 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -10.808 -9.052 6.209 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -12.513 -8.980 8.796 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -10.766 -8.644 8.780 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -11.897 -7.445 9.452 1.00 0.00 H new ATOM 324 N GLU A 22 -9.083 -6.793 8.681 1.00 0.00 N ATOM 325 CA GLU A 22 -7.784 -7.259 9.137 1.00 0.00 C ATOM 326 C GLU A 22 -7.810 -8.774 9.340 1.00 0.00 C ATOM 327 O GLU A 22 -8.444 -9.276 10.268 1.00 0.00 O ATOM 328 CB GLU A 22 -7.417 -6.587 10.459 1.00 0.00 C ATOM 329 CG GLU A 22 -8.465 -6.767 11.545 1.00 0.00 C ATOM 330 CD GLU A 22 -8.031 -7.743 12.620 1.00 0.00 C ATOM 331 OE1 GLU A 22 -7.134 -8.568 12.348 1.00 0.00 O ATOM 332 OE2 GLU A 22 -8.590 -7.684 13.736 1.00 0.00 O ATOM 0 H GLU A 22 -9.637 -6.313 9.391 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.042 -7.004 8.380 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.468 -6.991 10.811 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -7.265 -5.522 10.285 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -8.679 -5.801 12.002 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -9.393 -7.118 11.094 1.00 0.00 H new ATOM 339 N GLY A 23 -7.116 -9.494 8.464 1.00 0.00 N ATOM 340 CA GLY A 23 -7.068 -10.940 8.559 1.00 0.00 C ATOM 341 C GLY A 23 -5.653 -11.476 8.479 1.00 0.00 C ATOM 342 O GLY A 23 -4.986 -11.636 9.502 1.00 0.00 O ATOM 0 H GLY A 23 -6.585 -9.099 7.688 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -7.521 -11.255 9.499 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.664 -11.374 7.757 1.00 0.00 H new ATOM 346 N PHE A 24 -5.189 -11.752 7.260 1.00 0.00 N ATOM 347 CA PHE A 24 -3.838 -12.274 7.047 1.00 0.00 C ATOM 348 C PHE A 24 -3.669 -12.802 5.624 1.00 0.00 C ATOM 349 O PHE A 24 -3.184 -13.916 5.419 1.00 0.00 O ATOM 350 CB PHE A 24 -3.517 -13.388 8.052 1.00 0.00 C ATOM 351 CG PHE A 24 -4.681 -14.294 8.346 1.00 0.00 C ATOM 352 CD1 PHE A 24 -5.359 -14.929 7.318 1.00 0.00 C ATOM 353 CD2 PHE A 24 -5.095 -14.508 9.650 1.00 0.00 C ATOM 354 CE1 PHE A 24 -6.429 -15.763 7.586 1.00 0.00 C ATOM 355 CE2 PHE A 24 -6.164 -15.340 9.925 1.00 0.00 C ATOM 356 CZ PHE A 24 -6.832 -15.968 8.892 1.00 0.00 C ATOM 0 H PHE A 24 -5.729 -11.623 6.404 1.00 0.00 H new ATOM 0 HA PHE A 24 -3.142 -11.449 7.198 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -2.692 -13.986 7.666 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -3.175 -12.937 8.984 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -5.048 -14.771 6.296 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -4.577 -14.019 10.462 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -6.949 -16.253 6.776 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -6.477 -15.499 10.946 1.00 0.00 H new ATOM 0 HZ PHE A 24 -7.668 -16.618 9.104 1.00 0.00 H new ATOM 366 N ASN A 25 -4.070 -12.001 4.641 1.00 0.00 N ATOM 367 CA ASN A 25 -3.956 -12.398 3.239 1.00 0.00 C ATOM 368 C ASN A 25 -4.519 -11.321 2.317 1.00 0.00 C ATOM 369 O ASN A 25 -5.044 -10.308 2.779 1.00 0.00 O ATOM 370 CB ASN A 25 -4.688 -13.721 2.999 1.00 0.00 C ATOM 371 CG ASN A 25 -3.739 -14.901 2.917 1.00 0.00 C ATOM 372 OD1 ASN A 25 -2.541 -14.768 3.169 1.00 0.00 O ATOM 373 ND2 ASN A 25 -4.271 -16.065 2.564 1.00 0.00 N ATOM 0 H ASN A 25 -4.475 -11.076 4.787 1.00 0.00 H new ATOM 0 HA ASN A 25 -2.898 -12.528 3.012 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -5.403 -13.889 3.805 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -5.260 -13.654 2.074 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -3.682 -16.894 2.493 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -5.269 -16.130 2.364 1.00 0.00 H new ATOM 380 N VAL A 26 -4.410 -11.547 1.010 1.00 0.00 N ATOM 381 CA VAL A 26 -4.915 -10.596 0.026 1.00 0.00 C ATOM 382 C VAL A 26 -6.381 -10.275 0.291 1.00 0.00 C ATOM 383 O VAL A 26 -7.232 -11.163 0.291 1.00 0.00 O ATOM 384 CB VAL A 26 -4.761 -11.131 -1.412 1.00 0.00 C ATOM 385 CG1 VAL A 26 -5.573 -12.403 -1.604 1.00 0.00 C ATOM 386 CG2 VAL A 26 -5.167 -10.070 -2.426 1.00 0.00 C ATOM 0 H VAL A 26 -3.977 -12.379 0.609 1.00 0.00 H new ATOM 0 HA VAL A 26 -4.320 -9.688 0.123 1.00 0.00 H new ATOM 0 HB VAL A 26 -3.711 -11.373 -1.576 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.450 -12.763 -2.625 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.226 -13.165 -0.906 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.626 -12.194 -1.418 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.051 -10.467 -3.434 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -6.208 -9.791 -2.263 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -4.533 -9.191 -2.307 1.00 0.00 H new ATOM 396 N GLY A 27 -6.667 -9.001 0.531 1.00 0.00 N ATOM 397 CA GLY A 27 -8.027 -8.588 0.812 1.00 0.00 C ATOM 398 C GLY A 27 -8.238 -8.291 2.285 1.00 0.00 C ATOM 399 O GLY A 27 -9.215 -7.643 2.661 1.00 0.00 O ATOM 0 H GLY A 27 -5.980 -8.247 0.536 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -8.265 -7.701 0.226 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -8.716 -9.372 0.498 1.00 0.00 H new ATOM 403 N GLU A 28 -7.311 -8.757 3.118 1.00 0.00 N ATOM 404 CA GLU A 28 -7.383 -8.536 4.550 1.00 0.00 C ATOM 405 C GLU A 28 -6.015 -8.150 5.083 1.00 0.00 C ATOM 406 O GLU A 28 -5.009 -8.739 4.703 1.00 0.00 O ATOM 407 CB GLU A 28 -7.898 -9.790 5.261 1.00 0.00 C ATOM 408 CG GLU A 28 -9.229 -10.290 4.725 1.00 0.00 C ATOM 409 CD GLU A 28 -9.066 -11.382 3.685 1.00 0.00 C ATOM 410 OE1 GLU A 28 -8.003 -11.425 3.032 1.00 0.00 O ATOM 411 OE2 GLU A 28 -10.002 -12.192 3.524 1.00 0.00 O ATOM 0 H GLU A 28 -6.497 -9.293 2.818 1.00 0.00 H new ATOM 0 HA GLU A 28 -8.081 -7.721 4.745 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -7.156 -10.583 5.164 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -8.001 -9.578 6.325 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -9.831 -10.668 5.552 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -9.777 -9.455 4.287 1.00 0.00 H new ATOM 418 N TYR A 29 -5.977 -7.147 5.950 1.00 0.00 N ATOM 419 CA TYR A 29 -4.706 -6.682 6.501 1.00 0.00 C ATOM 420 C TYR A 29 -4.440 -7.272 7.879 1.00 0.00 C ATOM 421 O TYR A 29 -5.259 -8.006 8.418 1.00 0.00 O ATOM 422 CB TYR A 29 -4.684 -5.155 6.557 1.00 0.00 C ATOM 423 CG TYR A 29 -5.556 -4.572 7.633 1.00 0.00 C ATOM 424 CD1 TYR A 29 -6.907 -4.330 7.405 1.00 0.00 C ATOM 425 CD2 TYR A 29 -5.028 -4.259 8.877 1.00 0.00 C ATOM 426 CE1 TYR A 29 -7.708 -3.792 8.389 1.00 0.00 C ATOM 427 CE2 TYR A 29 -5.824 -3.722 9.868 1.00 0.00 C ATOM 428 CZ TYR A 29 -7.162 -3.489 9.620 1.00 0.00 C ATOM 429 OH TYR A 29 -7.957 -2.958 10.608 1.00 0.00 O ATOM 0 H TYR A 29 -6.799 -6.644 6.285 1.00 0.00 H new ATOM 0 HA TYR A 29 -3.910 -7.025 5.840 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -3.658 -4.822 6.714 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -5.003 -4.761 5.592 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -7.335 -4.567 6.442 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -3.981 -4.438 9.072 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -8.755 -3.609 8.198 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -5.402 -3.485 10.834 1.00 0.00 H new ATOM 0 HH TYR A 29 -8.774 -3.493 10.694 1.00 0.00 H new ATOM 439 N HIS A 30 -3.279 -6.964 8.445 1.00 0.00 N ATOM 440 CA HIS A 30 -2.931 -7.493 9.759 1.00 0.00 C ATOM 441 C HIS A 30 -3.506 -6.638 10.886 1.00 0.00 C ATOM 442 O HIS A 30 -4.427 -7.060 11.583 1.00 0.00 O ATOM 443 CB HIS A 30 -1.419 -7.605 9.911 1.00 0.00 C ATOM 444 CG HIS A 30 -1.008 -8.548 10.999 1.00 0.00 C ATOM 445 ND1 HIS A 30 -0.931 -8.178 12.325 1.00 0.00 N ATOM 446 CD2 HIS A 30 -0.669 -9.858 10.957 1.00 0.00 C ATOM 447 CE1 HIS A 30 -0.562 -9.218 13.051 1.00 0.00 C ATOM 448 NE2 HIS A 30 -0.398 -10.251 12.244 1.00 0.00 N ATOM 0 H HIS A 30 -2.573 -6.361 8.024 1.00 0.00 H new ATOM 0 HA HIS A 30 -3.372 -8.487 9.833 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -0.988 -7.939 8.967 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -1.006 -6.618 10.118 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -0.621 -10.479 10.075 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -0.419 -9.223 14.121 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -0.116 -11.188 12.531 1.00 0.00 H new ATOM 457 N LYS A 31 -2.954 -5.443 11.070 1.00 0.00 N ATOM 458 CA LYS A 31 -3.419 -4.549 12.125 1.00 0.00 C ATOM 459 C LYS A 31 -2.863 -3.141 11.942 1.00 0.00 C ATOM 460 O LYS A 31 -1.751 -2.961 11.447 1.00 0.00 O ATOM 461 CB LYS A 31 -3.010 -5.094 13.495 1.00 0.00 C ATOM 462 CG LYS A 31 -4.030 -6.043 14.102 1.00 0.00 C ATOM 463 CD LYS A 31 -4.046 -5.948 15.619 1.00 0.00 C ATOM 464 CE LYS A 31 -3.214 -7.050 16.254 1.00 0.00 C ATOM 465 NZ LYS A 31 -2.736 -6.671 17.614 1.00 0.00 N ATOM 0 H LYS A 31 -2.189 -5.073 10.506 1.00 0.00 H new ATOM 0 HA LYS A 31 -4.506 -4.497 12.065 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -2.056 -5.612 13.400 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.853 -4.258 14.177 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -5.021 -5.812 13.712 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -3.800 -7.066 13.803 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -3.661 -4.976 15.928 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.073 -6.013 15.978 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -3.808 -7.962 16.319 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -2.358 -7.272 15.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -2.173 -7.449 18.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -2.148 -5.815 17.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -3.553 -6.484 18.230 1.00 0.00 H new ATOM 479 N GLY A 32 -3.642 -2.144 12.353 1.00 0.00 N ATOM 480 CA GLY A 32 -3.208 -0.765 12.233 1.00 0.00 C ATOM 481 C GLY A 32 -3.809 -0.050 11.037 1.00 0.00 C ATOM 482 O GLY A 32 -3.652 1.162 10.892 1.00 0.00 O ATOM 0 H GLY A 32 -4.566 -2.268 12.767 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -3.476 -0.226 13.142 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.121 -0.739 12.155 1.00 0.00 H new ATOM 486 N ALA A 33 -4.493 -0.795 10.172 1.00 0.00 N ATOM 487 CA ALA A 33 -5.106 -0.212 8.985 1.00 0.00 C ATOM 488 C ALA A 33 -6.416 0.505 9.331 1.00 0.00 C ATOM 489 O ALA A 33 -6.549 1.712 9.125 1.00 0.00 O ATOM 490 CB ALA A 33 -5.336 -1.299 7.946 1.00 0.00 C ATOM 0 H ALA A 33 -4.636 -1.800 10.272 1.00 0.00 H new ATOM 0 HA ALA A 33 -4.429 0.536 8.572 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -5.794 -0.863 7.058 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -4.382 -1.752 7.676 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -5.997 -2.062 8.358 1.00 0.00 H new ATOM 496 N LYS A 34 -7.378 -0.258 9.846 1.00 0.00 N ATOM 497 CA LYS A 34 -8.696 0.259 10.224 1.00 0.00 C ATOM 498 C LYS A 34 -8.653 1.673 10.819 1.00 0.00 C ATOM 499 O LYS A 34 -9.627 2.416 10.712 1.00 0.00 O ATOM 500 CB LYS A 34 -9.364 -0.695 11.222 1.00 0.00 C ATOM 501 CG LYS A 34 -10.696 -0.192 11.761 1.00 0.00 C ATOM 502 CD LYS A 34 -11.827 -1.161 11.452 1.00 0.00 C ATOM 503 CE LYS A 34 -12.159 -1.175 9.969 1.00 0.00 C ATOM 504 NZ LYS A 34 -12.492 -2.544 9.487 1.00 0.00 N ATOM 0 H LYS A 34 -7.267 -1.258 10.015 1.00 0.00 H new ATOM 0 HA LYS A 34 -9.276 0.322 9.303 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -9.520 -1.659 10.739 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -8.685 -0.864 12.058 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -10.622 -0.050 12.839 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -10.921 0.782 11.326 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -11.546 -2.164 11.772 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -12.713 -0.881 12.022 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -13.000 -0.509 9.779 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -11.312 -0.787 9.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -12.762 -2.503 8.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -11.663 -3.162 9.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -13.284 -2.925 10.043 1.00 0.00 H new ATOM 518 N ASP A 35 -7.550 2.043 11.468 1.00 0.00 N ATOM 519 CA ASP A 35 -7.463 3.368 12.083 1.00 0.00 C ATOM 520 C ASP A 35 -7.068 4.458 11.087 1.00 0.00 C ATOM 521 O ASP A 35 -7.884 5.305 10.751 1.00 0.00 O ATOM 522 CB ASP A 35 -6.499 3.364 13.267 1.00 0.00 C ATOM 523 CG ASP A 35 -5.252 2.537 13.019 1.00 0.00 C ATOM 524 OD1 ASP A 35 -5.288 1.316 13.273 1.00 0.00 O ATOM 525 OD2 ASP A 35 -4.239 3.113 12.570 1.00 0.00 O ATOM 0 H ASP A 35 -6.721 1.460 11.581 1.00 0.00 H new ATOM 0 HA ASP A 35 -8.465 3.603 12.441 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -6.208 4.390 13.494 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -7.015 2.977 14.146 1.00 0.00 H new ATOM 530 N GLY A 36 -5.820 4.447 10.620 1.00 0.00 N ATOM 531 CA GLY A 36 -5.365 5.457 9.669 1.00 0.00 C ATOM 532 C GLY A 36 -6.497 6.026 8.832 1.00 0.00 C ATOM 533 O GLY A 36 -6.919 7.163 9.034 1.00 0.00 O ATOM 0 H GLY A 36 -5.114 3.758 10.881 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -4.877 6.267 10.211 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.616 5.018 9.010 1.00 0.00 H new ATOM 537 N LEU A 37 -6.992 5.225 7.896 1.00 0.00 N ATOM 538 CA LEU A 37 -8.081 5.634 7.029 1.00 0.00 C ATOM 539 C LEU A 37 -9.256 6.239 7.807 1.00 0.00 C ATOM 540 O LEU A 37 -9.919 7.144 7.310 1.00 0.00 O ATOM 541 CB LEU A 37 -8.555 4.443 6.220 1.00 0.00 C ATOM 542 CG LEU A 37 -9.572 4.764 5.136 1.00 0.00 C ATOM 543 CD1 LEU A 37 -8.973 5.697 4.106 1.00 0.00 C ATOM 544 CD2 LEU A 37 -10.059 3.491 4.479 1.00 0.00 C ATOM 0 H LEU A 37 -6.650 4.280 7.720 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.701 6.413 6.368 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -7.689 3.971 5.756 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -8.991 3.711 6.900 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.424 5.264 5.597 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.715 5.916 3.338 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.667 6.625 4.590 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.105 5.224 3.647 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -10.786 3.736 3.705 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.215 2.967 4.031 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -10.527 2.851 5.227 1.00 0.00 H new ATOM 556 N THR A 38 -9.517 5.763 9.027 1.00 0.00 N ATOM 557 CA THR A 38 -10.614 6.330 9.811 1.00 0.00 C ATOM 558 C THR A 38 -10.159 7.643 10.427 1.00 0.00 C ATOM 559 O THR A 38 -10.924 8.595 10.526 1.00 0.00 O ATOM 560 CB THR A 38 -11.126 5.380 10.911 1.00 0.00 C ATOM 561 OG1 THR A 38 -12.415 5.779 11.349 1.00 0.00 O ATOM 562 CG2 THR A 38 -10.241 5.316 12.121 1.00 0.00 C ATOM 0 H THR A 38 -9.001 5.010 9.482 1.00 0.00 H new ATOM 0 HA THR A 38 -11.450 6.494 9.131 1.00 0.00 H new ATOM 0 HB THR A 38 -11.142 4.393 10.448 1.00 0.00 H new ATOM 0 HG1 THR A 38 -12.390 6.719 11.626 1.00 0.00 H new ATOM 0 HG21 THR A 38 -10.669 4.627 12.849 1.00 0.00 H new ATOM 0 HG22 THR A 38 -9.251 4.967 11.829 1.00 0.00 H new ATOM 0 HG23 THR A 38 -10.159 6.308 12.565 1.00 0.00 H new ATOM 570 N VAL A 39 -8.891 7.685 10.818 1.00 0.00 N ATOM 571 CA VAL A 39 -8.304 8.880 11.404 1.00 0.00 C ATOM 572 C VAL A 39 -8.409 10.029 10.421 1.00 0.00 C ATOM 573 O VAL A 39 -8.704 11.163 10.797 1.00 0.00 O ATOM 574 CB VAL A 39 -6.834 8.617 11.784 1.00 0.00 C ATOM 575 CG1 VAL A 39 -6.107 9.895 12.167 1.00 0.00 C ATOM 576 CG2 VAL A 39 -6.783 7.608 12.914 1.00 0.00 C ATOM 0 H VAL A 39 -8.247 6.898 10.738 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.847 9.144 12.312 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.320 8.215 10.911 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -5.074 9.662 12.427 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.122 10.588 11.326 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -6.603 10.353 13.023 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.745 7.419 13.186 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -7.319 8.002 13.778 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.249 6.677 12.592 1.00 0.00 H new ATOM 586 N GLU A 40 -8.212 9.711 9.152 1.00 0.00 N ATOM 587 CA GLU A 40 -8.333 10.698 8.100 1.00 0.00 C ATOM 588 C GLU A 40 -9.812 10.925 7.814 1.00 0.00 C ATOM 589 O GLU A 40 -10.214 12.021 7.447 1.00 0.00 O ATOM 590 CB GLU A 40 -7.609 10.233 6.843 1.00 0.00 C ATOM 591 CG GLU A 40 -7.991 8.828 6.438 1.00 0.00 C ATOM 592 CD GLU A 40 -8.465 8.739 5.005 1.00 0.00 C ATOM 593 OE1 GLU A 40 -7.688 9.100 4.099 1.00 0.00 O ATOM 594 OE2 GLU A 40 -9.619 8.316 4.789 1.00 0.00 O ATOM 0 H GLU A 40 -7.967 8.775 8.829 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.873 11.633 8.419 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -7.834 10.917 6.025 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -6.533 10.279 7.010 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.133 8.170 6.573 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.778 8.466 7.099 1.00 0.00 H new ATOM 601 N ILE A 41 -10.623 9.878 8.027 1.00 0.00 N ATOM 602 CA ILE A 41 -12.069 9.976 7.837 1.00 0.00 C ATOM 603 C ILE A 41 -12.637 10.890 8.908 1.00 0.00 C ATOM 604 O ILE A 41 -13.198 11.944 8.611 1.00 0.00 O ATOM 605 CB ILE A 41 -12.768 8.600 7.935 1.00 0.00 C ATOM 606 CG1 ILE A 41 -12.521 7.773 6.675 1.00 0.00 C ATOM 607 CG2 ILE A 41 -14.266 8.765 8.161 1.00 0.00 C ATOM 608 CD1 ILE A 41 -12.583 6.281 6.918 1.00 0.00 C ATOM 0 H ILE A 41 -10.299 8.959 8.330 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.250 10.371 6.837 1.00 0.00 H new ATOM 0 HB ILE A 41 -12.342 8.073 8.789 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -13.260 8.043 5.921 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -11.543 8.028 6.267 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -14.734 7.783 8.226 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -14.436 9.311 9.089 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -14.701 9.320 7.329 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -12.399 5.752 5.983 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -11.825 6.000 7.649 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -13.570 6.015 7.297 1.00 0.00 H new ATOM 620 N ASN A 42 -12.452 10.487 10.163 1.00 0.00 N ATOM 621 CA ASN A 42 -12.906 11.281 11.294 1.00 0.00 C ATOM 622 C ASN A 42 -12.439 12.713 11.097 1.00 0.00 C ATOM 623 O ASN A 42 -13.166 13.669 11.363 1.00 0.00 O ATOM 624 CB ASN A 42 -12.341 10.724 12.605 1.00 0.00 C ATOM 625 CG ASN A 42 -12.430 9.214 12.686 1.00 0.00 C ATOM 626 OD1 ASN A 42 -13.477 8.623 12.420 1.00 0.00 O ATOM 627 ND2 ASN A 42 -11.322 8.580 13.058 1.00 0.00 N ATOM 0 H ASN A 42 -11.990 9.614 10.419 1.00 0.00 H new ATOM 0 HA ASN A 42 -13.994 11.244 11.351 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -11.299 11.028 12.705 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -12.883 11.161 13.444 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -11.317 7.563 13.133 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -10.477 9.111 13.269 1.00 0.00 H new ATOM 634 N LYS A 43 -11.209 12.835 10.610 1.00 0.00 N ATOM 635 CA LYS A 43 -10.615 14.142 10.347 1.00 0.00 C ATOM 636 C LYS A 43 -11.111 14.736 9.020 1.00 0.00 C ATOM 637 O LYS A 43 -11.103 15.953 8.841 1.00 0.00 O ATOM 638 CB LYS A 43 -9.090 14.039 10.331 1.00 0.00 C ATOM 639 CG LYS A 43 -8.388 15.368 10.560 1.00 0.00 C ATOM 640 CD LYS A 43 -8.199 16.132 9.259 1.00 0.00 C ATOM 641 CE LYS A 43 -6.786 15.976 8.722 1.00 0.00 C ATOM 642 NZ LYS A 43 -5.825 16.877 9.415 1.00 0.00 N ATOM 0 H LYS A 43 -10.603 12.045 10.389 1.00 0.00 H new ATOM 0 HA LYS A 43 -10.925 14.809 11.151 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -8.774 13.333 11.099 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -8.772 13.630 9.372 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -8.970 15.972 11.256 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -7.417 15.192 11.024 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -8.913 15.773 8.518 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -8.413 17.188 9.422 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -6.464 14.941 8.842 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -6.778 16.190 7.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -4.873 16.740 9.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -6.117 17.866 9.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -5.813 16.656 10.431 1.00 0.00 H new ATOM 656 N ALA A 44 -11.535 13.875 8.090 1.00 0.00 N ATOM 657 CA ALA A 44 -12.022 14.329 6.789 1.00 0.00 C ATOM 658 C ALA A 44 -13.494 14.690 6.852 1.00 0.00 C ATOM 659 O ALA A 44 -13.870 15.834 6.611 1.00 0.00 O ATOM 660 CB ALA A 44 -11.803 13.261 5.728 1.00 0.00 C ATOM 0 H ALA A 44 -11.550 12.863 8.216 1.00 0.00 H new ATOM 0 HA ALA A 44 -11.455 15.220 6.520 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -12.173 13.621 4.768 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -10.738 13.041 5.647 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -12.340 12.355 6.008 1.00 0.00 H new ATOM 666 N GLU A 45 -14.327 13.708 7.173 1.00 0.00 N ATOM 667 CA GLU A 45 -15.763 13.928 7.269 1.00 0.00 C ATOM 668 C GLU A 45 -16.062 15.163 8.109 1.00 0.00 C ATOM 669 O GLU A 45 -17.025 15.885 7.853 1.00 0.00 O ATOM 670 CB GLU A 45 -16.446 12.701 7.863 1.00 0.00 C ATOM 671 CG GLU A 45 -16.920 11.723 6.809 1.00 0.00 C ATOM 672 CD GLU A 45 -18.405 11.853 6.530 1.00 0.00 C ATOM 673 OE1 GLU A 45 -19.200 11.745 7.488 1.00 0.00 O ATOM 674 OE2 GLU A 45 -18.774 12.062 5.355 1.00 0.00 O ATOM 0 H GLU A 45 -14.032 12.752 7.371 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.155 14.094 6.266 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -15.753 12.195 8.535 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.297 13.021 8.464 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.363 11.888 5.887 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -16.701 10.706 7.135 1.00 0.00 H new ATOM 681 N GLU A 46 -15.208 15.412 9.095 1.00 0.00 N ATOM 682 CA GLU A 46 -15.358 16.578 9.954 1.00 0.00 C ATOM 683 C GLU A 46 -15.259 17.845 9.116 1.00 0.00 C ATOM 684 O GLU A 46 -15.809 18.883 9.475 1.00 0.00 O ATOM 685 CB GLU A 46 -14.286 16.581 11.045 1.00 0.00 C ATOM 686 CG GLU A 46 -14.681 15.802 12.289 1.00 0.00 C ATOM 687 CD GLU A 46 -13.533 15.643 13.266 1.00 0.00 C ATOM 688 OE1 GLU A 46 -12.370 15.599 12.813 1.00 0.00 O ATOM 689 OE2 GLU A 46 -13.797 15.563 14.484 1.00 0.00 O ATOM 0 H GLU A 46 -14.406 14.823 9.318 1.00 0.00 H new ATOM 0 HA GLU A 46 -16.336 16.540 10.435 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -13.366 16.160 10.640 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -14.068 17.611 11.326 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -15.507 16.311 12.785 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -15.043 14.817 11.996 1.00 0.00 H new ATOM 696 N VAL A 47 -14.565 17.734 7.982 1.00 0.00 N ATOM 697 CA VAL A 47 -14.400 18.846 7.061 1.00 0.00 C ATOM 698 C VAL A 47 -15.442 18.758 5.951 1.00 0.00 C ATOM 699 O VAL A 47 -16.045 19.759 5.566 1.00 0.00 O ATOM 700 CB VAL A 47 -12.964 18.886 6.468 1.00 0.00 C ATOM 701 CG1 VAL A 47 -12.961 18.997 4.946 1.00 0.00 C ATOM 702 CG2 VAL A 47 -12.199 20.046 7.067 1.00 0.00 C ATOM 0 H VAL A 47 -14.106 16.874 7.683 1.00 0.00 H new ATOM 0 HA VAL A 47 -14.548 19.773 7.614 1.00 0.00 H new ATOM 0 HB VAL A 47 -12.481 17.943 6.723 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.933 19.021 4.585 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -13.476 18.137 4.517 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -13.472 19.912 4.647 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.192 20.072 6.650 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -12.712 20.979 6.835 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -12.140 19.924 8.149 1.00 0.00 H new ATOM 712 N PHE A 48 -15.649 17.543 5.445 1.00 0.00 N ATOM 713 CA PHE A 48 -16.617 17.305 4.380 1.00 0.00 C ATOM 714 C PHE A 48 -17.946 17.985 4.691 1.00 0.00 C ATOM 715 O PHE A 48 -18.473 18.745 3.878 1.00 0.00 O ATOM 716 CB PHE A 48 -16.840 15.802 4.189 1.00 0.00 C ATOM 717 CG PHE A 48 -17.937 15.475 3.215 1.00 0.00 C ATOM 718 CD1 PHE A 48 -17.968 16.064 1.960 1.00 0.00 C ATOM 719 CD2 PHE A 48 -18.941 14.583 3.557 1.00 0.00 C ATOM 720 CE1 PHE A 48 -18.979 15.768 1.066 1.00 0.00 C ATOM 721 CE2 PHE A 48 -19.954 14.283 2.665 1.00 0.00 C ATOM 722 CZ PHE A 48 -19.973 14.876 1.418 1.00 0.00 C ATOM 0 H PHE A 48 -15.156 16.707 5.758 1.00 0.00 H new ATOM 0 HA PHE A 48 -16.215 17.728 3.460 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -15.912 15.346 3.844 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -17.076 15.353 5.154 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -17.193 16.762 1.678 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -18.932 14.117 4.531 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -18.992 16.234 0.092 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -20.730 13.585 2.943 1.00 0.00 H new ATOM 0 HZ PHE A 48 -20.763 14.643 0.720 1.00 0.00 H new ATOM 732 N ASN A 49 -18.482 17.701 5.872 1.00 0.00 N ATOM 733 CA ASN A 49 -19.751 18.282 6.290 1.00 0.00 C ATOM 734 C ASN A 49 -19.539 19.589 7.050 1.00 0.00 C ATOM 735 O ASN A 49 -20.467 20.110 7.668 1.00 0.00 O ATOM 736 CB ASN A 49 -20.525 17.293 7.162 1.00 0.00 C ATOM 737 CG ASN A 49 -20.613 15.915 6.534 1.00 0.00 C ATOM 738 OD1 ASN A 49 -21.531 15.628 5.764 1.00 0.00 O ATOM 739 ND2 ASN A 49 -19.657 15.053 6.860 1.00 0.00 N ATOM 0 H ASN A 49 -18.058 17.073 6.555 1.00 0.00 H new ATOM 0 HA ASN A 49 -20.330 18.500 5.392 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -20.041 17.215 8.136 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -21.531 17.675 7.335 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -19.664 14.111 6.469 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -18.915 15.333 7.502 1.00 0.00 H new ATOM 746 N LYS A 50 -18.317 20.114 7.011 1.00 0.00 N ATOM 747 CA LYS A 50 -18.006 21.358 7.711 1.00 0.00 C ATOM 748 C LYS A 50 -18.346 22.580 6.865 1.00 0.00 C ATOM 749 O LYS A 50 -18.527 22.479 5.651 1.00 0.00 O ATOM 750 CB LYS A 50 -16.529 21.390 8.085 1.00 0.00 C ATOM 751 CG LYS A 50 -16.242 22.060 9.418 1.00 0.00 C ATOM 752 CD LYS A 50 -14.747 22.186 9.664 1.00 0.00 C ATOM 753 CE LYS A 50 -14.315 23.641 9.743 1.00 0.00 C ATOM 754 NZ LYS A 50 -14.397 24.170 11.132 1.00 0.00 N ATOM 0 H LYS A 50 -17.532 19.702 6.507 1.00 0.00 H new ATOM 0 HA LYS A 50 -18.616 21.391 8.613 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -16.150 20.368 8.115 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -15.978 21.911 7.302 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -16.700 23.049 9.436 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -16.698 21.483 10.223 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -14.486 21.677 10.592 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -14.202 21.687 8.863 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -13.292 23.736 9.378 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -14.945 24.243 9.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -14.946 25.053 11.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -14.864 23.470 11.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -13.438 24.357 11.489 1.00 0.00 H new ATOM 768 N GLU A 51 -18.419 23.738 7.517 1.00 0.00 N ATOM 769 CA GLU A 51 -18.724 24.986 6.828 1.00 0.00 C ATOM 770 C GLU A 51 -17.450 25.673 6.382 1.00 0.00 C ATOM 771 O GLU A 51 -17.436 26.363 5.363 1.00 0.00 O ATOM 772 CB GLU A 51 -19.545 25.914 7.724 1.00 0.00 C ATOM 773 CG GLU A 51 -20.852 25.303 8.199 1.00 0.00 C ATOM 774 CD GLU A 51 -20.734 24.663 9.569 1.00 0.00 C ATOM 775 OE1 GLU A 51 -19.899 23.748 9.727 1.00 0.00 O ATOM 776 OE2 GLU A 51 -21.475 25.079 10.484 1.00 0.00 O ATOM 0 H GLU A 51 -18.271 23.836 8.521 1.00 0.00 H new ATOM 0 HA GLU A 51 -19.317 24.750 5.945 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -18.946 26.190 8.592 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -19.760 26.834 7.180 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -21.620 26.076 8.228 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -21.181 24.553 7.479 1.00 0.00 H new ATOM 783 N ASP A 52 -16.367 25.459 7.119 1.00 0.00 N ATOM 784 CA ASP A 52 -15.099 26.048 6.735 1.00 0.00 C ATOM 785 C ASP A 52 -14.367 25.132 5.776 1.00 0.00 C ATOM 786 O ASP A 52 -13.181 25.319 5.510 1.00 0.00 O ATOM 787 CB ASP A 52 -14.212 26.363 7.937 1.00 0.00 C ATOM 788 CG ASP A 52 -14.996 26.880 9.128 1.00 0.00 C ATOM 789 OD1 ASP A 52 -15.937 26.186 9.567 1.00 0.00 O ATOM 790 OD2 ASP A 52 -14.669 27.980 9.622 1.00 0.00 O ATOM 0 H ASP A 52 -16.343 24.894 7.968 1.00 0.00 H new ATOM 0 HA ASP A 52 -15.322 26.994 6.242 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -13.670 25.463 8.228 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -13.467 27.105 7.649 1.00 0.00 H new ATOM 795 N ALA A 53 -15.091 24.168 5.218 1.00 0.00 N ATOM 796 CA ALA A 53 -14.522 23.262 4.249 1.00 0.00 C ATOM 797 C ALA A 53 -14.407 24.000 2.932 1.00 0.00 C ATOM 798 O ALA A 53 -14.821 23.520 1.881 1.00 0.00 O ATOM 799 CB ALA A 53 -15.364 22.004 4.114 1.00 0.00 C ATOM 0 H ALA A 53 -16.075 24.000 5.426 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.534 22.937 4.575 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -14.911 21.340 3.377 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -15.416 21.496 5.077 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -16.370 22.272 3.791 1.00 0.00 H new ATOM 805 N THR A 54 -13.850 25.196 3.032 1.00 0.00 N ATOM 806 CA THR A 54 -13.649 26.076 1.903 1.00 0.00 C ATOM 807 C THR A 54 -12.260 25.872 1.315 1.00 0.00 C ATOM 808 O THR A 54 -11.860 24.753 0.999 1.00 0.00 O ATOM 809 CB THR A 54 -13.866 27.526 2.354 1.00 0.00 C ATOM 810 OG1 THR A 54 -12.778 27.977 3.141 1.00 0.00 O ATOM 811 CG2 THR A 54 -15.129 27.712 3.170 1.00 0.00 C ATOM 0 H THR A 54 -13.521 25.585 3.916 1.00 0.00 H new ATOM 0 HA THR A 54 -14.369 25.845 1.118 1.00 0.00 H new ATOM 0 HB THR A 54 -13.953 28.105 1.435 1.00 0.00 H new ATOM 0 HG1 THR A 54 -12.936 28.904 3.417 1.00 0.00 H new ATOM 0 HG21 THR A 54 -15.225 28.759 3.458 1.00 0.00 H new ATOM 0 HG22 THR A 54 -15.994 27.419 2.574 1.00 0.00 H new ATOM 0 HG23 THR A 54 -15.078 27.092 4.065 1.00 0.00 H new ATOM 819 N GLU A 55 -11.539 26.955 1.169 1.00 0.00 N ATOM 820 CA GLU A 55 -10.190 26.911 0.612 1.00 0.00 C ATOM 821 C GLU A 55 -9.136 26.682 1.695 1.00 0.00 C ATOM 822 O GLU A 55 -7.977 26.405 1.388 1.00 0.00 O ATOM 823 CB GLU A 55 -9.888 28.209 -0.139 1.00 0.00 C ATOM 824 CG GLU A 55 -9.152 27.995 -1.451 1.00 0.00 C ATOM 825 CD GLU A 55 -9.365 29.132 -2.431 1.00 0.00 C ATOM 826 OE1 GLU A 55 -10.491 29.260 -2.957 1.00 0.00 O ATOM 827 OE2 GLU A 55 -8.406 29.894 -2.674 1.00 0.00 O ATOM 0 H GLU A 55 -11.857 27.889 1.427 1.00 0.00 H new ATOM 0 HA GLU A 55 -10.147 26.070 -0.080 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -10.824 28.730 -0.338 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -9.291 28.859 0.501 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -8.086 27.887 -1.252 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -9.488 27.062 -1.904 1.00 0.00 H new ATOM 834 N GLU A 56 -9.530 26.824 2.959 1.00 0.00 N ATOM 835 CA GLU A 56 -8.598 26.652 4.070 1.00 0.00 C ATOM 836 C GLU A 56 -8.651 25.250 4.686 1.00 0.00 C ATOM 837 O GLU A 56 -7.640 24.551 4.743 1.00 0.00 O ATOM 838 CB GLU A 56 -8.874 27.698 5.153 1.00 0.00 C ATOM 839 CG GLU A 56 -7.737 28.689 5.344 1.00 0.00 C ATOM 840 CD GLU A 56 -8.146 29.896 6.165 1.00 0.00 C ATOM 841 OE1 GLU A 56 -8.039 29.832 7.408 1.00 0.00 O ATOM 842 OE2 GLU A 56 -8.575 30.905 5.566 1.00 0.00 O ATOM 0 H GLU A 56 -10.483 27.056 3.238 1.00 0.00 H new ATOM 0 HA GLU A 56 -7.597 26.786 3.661 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -9.782 28.244 4.896 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -9.064 27.189 6.098 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -6.902 28.188 5.833 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -7.382 29.021 4.368 1.00 0.00 H new ATOM 849 N GLU A 57 -9.820 24.870 5.195 1.00 0.00 N ATOM 850 CA GLU A 57 -9.988 23.577 5.864 1.00 0.00 C ATOM 851 C GLU A 57 -9.831 22.376 4.928 1.00 0.00 C ATOM 852 O GLU A 57 -9.141 21.415 5.270 1.00 0.00 O ATOM 853 CB GLU A 57 -11.347 23.522 6.560 1.00 0.00 C ATOM 854 CG GLU A 57 -11.325 22.758 7.874 1.00 0.00 C ATOM 855 CD GLU A 57 -10.824 23.601 9.030 1.00 0.00 C ATOM 856 OE1 GLU A 57 -11.264 24.764 9.153 1.00 0.00 O ATOM 857 OE2 GLU A 57 -9.990 23.100 9.813 1.00 0.00 O ATOM 0 H GLU A 57 -10.667 25.437 5.158 1.00 0.00 H new ATOM 0 HA GLU A 57 -9.184 23.503 6.596 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -11.692 24.539 6.746 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -12.071 23.057 5.891 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -12.330 22.400 8.099 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -10.690 21.879 7.768 1.00 0.00 H new ATOM 864 N ILE A 58 -10.476 22.408 3.764 1.00 0.00 N ATOM 865 CA ILE A 58 -10.391 21.288 2.825 1.00 0.00 C ATOM 866 C ILE A 58 -8.949 20.879 2.586 1.00 0.00 C ATOM 867 O ILE A 58 -8.552 19.759 2.895 1.00 0.00 O ATOM 868 CB ILE A 58 -11.036 21.620 1.471 1.00 0.00 C ATOM 869 CG1 ILE A 58 -12.460 22.127 1.682 1.00 0.00 C ATOM 870 CG2 ILE A 58 -11.024 20.397 0.561 1.00 0.00 C ATOM 871 CD1 ILE A 58 -13.240 22.322 0.401 1.00 0.00 C ATOM 0 H ILE A 58 -11.056 23.186 3.450 1.00 0.00 H new ATOM 0 HA ILE A 58 -10.937 20.465 3.285 1.00 0.00 H new ATOM 0 HB ILE A 58 -10.457 22.406 0.987 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -12.995 21.422 2.317 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -12.421 23.074 2.220 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -11.485 20.650 -0.394 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -9.995 20.077 0.394 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -11.584 19.588 1.031 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -14.241 22.684 0.636 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -12.729 23.051 -0.228 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -13.312 21.372 -0.129 1.00 0.00 H new ATOM 883 N ASN A 59 -8.169 21.802 2.038 1.00 0.00 N ATOM 884 CA ASN A 59 -6.757 21.547 1.758 1.00 0.00 C ATOM 885 C ASN A 59 -6.098 20.862 2.947 1.00 0.00 C ATOM 886 O ASN A 59 -5.388 19.868 2.796 1.00 0.00 O ATOM 887 CB ASN A 59 -6.015 22.851 1.441 1.00 0.00 C ATOM 888 CG ASN A 59 -6.584 24.059 2.165 1.00 0.00 C ATOM 889 OD1 ASN A 59 -7.797 24.197 2.311 1.00 0.00 O ATOM 890 ND2 ASN A 59 -5.704 24.943 2.622 1.00 0.00 N ATOM 0 H ASN A 59 -8.488 22.735 1.778 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.701 20.894 0.887 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -4.965 22.737 1.709 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -6.052 23.030 0.366 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -6.027 25.775 3.116 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -4.706 24.790 2.479 1.00 0.00 H new ATOM 897 N LEU A 60 -6.351 21.401 4.129 1.00 0.00 N ATOM 898 CA LEU A 60 -5.800 20.847 5.356 1.00 0.00 C ATOM 899 C LEU A 60 -6.378 19.460 5.630 1.00 0.00 C ATOM 900 O LEU A 60 -5.703 18.600 6.193 1.00 0.00 O ATOM 901 CB LEU A 60 -6.090 21.779 6.536 1.00 0.00 C ATOM 902 CG LEU A 60 -5.626 23.225 6.349 1.00 0.00 C ATOM 903 CD1 LEU A 60 -6.466 24.170 7.195 1.00 0.00 C ATOM 904 CD2 LEU A 60 -4.152 23.360 6.700 1.00 0.00 C ATOM 0 H LEU A 60 -6.937 22.225 4.265 1.00 0.00 H new ATOM 0 HA LEU A 60 -4.721 20.754 5.235 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.164 21.780 6.723 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -5.611 21.372 7.427 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.757 23.496 5.301 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -6.121 25.194 7.049 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -7.512 24.093 6.897 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -6.368 23.901 8.247 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.838 24.395 6.561 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -3.997 23.070 7.739 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.563 22.712 6.051 1.00 0.00 H new ATOM 916 N ALA A 61 -7.635 19.249 5.236 1.00 0.00 N ATOM 917 CA ALA A 61 -8.292 17.964 5.454 1.00 0.00 C ATOM 918 C ALA A 61 -8.012 16.973 4.321 1.00 0.00 C ATOM 919 O ALA A 61 -8.200 15.768 4.484 1.00 0.00 O ATOM 920 CB ALA A 61 -9.789 18.171 5.605 1.00 0.00 C ATOM 0 H ALA A 61 -8.213 19.947 4.768 1.00 0.00 H new ATOM 0 HA ALA A 61 -7.883 17.536 6.369 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.275 17.209 5.767 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -9.982 18.823 6.457 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.186 18.630 4.699 1.00 0.00 H new ATOM 926 N LYS A 62 -7.583 17.484 3.170 1.00 0.00 N ATOM 927 CA LYS A 62 -7.305 16.635 2.013 1.00 0.00 C ATOM 928 C LYS A 62 -5.930 15.967 2.108 1.00 0.00 C ATOM 929 O LYS A 62 -5.774 14.800 1.748 1.00 0.00 O ATOM 930 CB LYS A 62 -7.424 17.448 0.715 1.00 0.00 C ATOM 931 CG LYS A 62 -6.138 18.138 0.279 1.00 0.00 C ATOM 932 CD LYS A 62 -5.279 17.223 -0.580 1.00 0.00 C ATOM 933 CE LYS A 62 -3.798 17.470 -0.347 1.00 0.00 C ATOM 934 NZ LYS A 62 -3.296 18.630 -1.134 1.00 0.00 N ATOM 0 H LYS A 62 -7.420 18.479 3.013 1.00 0.00 H new ATOM 0 HA LYS A 62 -8.049 15.839 2.003 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -7.754 16.785 -0.085 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.200 18.203 0.844 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -6.380 19.042 -0.280 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -5.574 18.448 1.159 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -5.515 16.183 -0.355 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -5.515 17.383 -1.632 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -3.623 17.648 0.714 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -3.234 16.577 -0.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -2.282 18.764 -0.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -3.439 18.450 -2.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -3.815 19.488 -0.858 1.00 0.00 H new ATOM 948 N GLU A 63 -4.936 16.709 2.585 1.00 0.00 N ATOM 949 CA GLU A 63 -3.580 16.178 2.713 1.00 0.00 C ATOM 950 C GLU A 63 -3.542 14.981 3.660 1.00 0.00 C ATOM 951 O GLU A 63 -2.629 14.157 3.601 1.00 0.00 O ATOM 952 CB GLU A 63 -2.630 17.268 3.214 1.00 0.00 C ATOM 953 CG GLU A 63 -1.228 17.163 2.638 1.00 0.00 C ATOM 954 CD GLU A 63 -0.342 18.325 3.048 1.00 0.00 C ATOM 955 OE1 GLU A 63 0.156 18.317 4.193 1.00 0.00 O ATOM 956 OE2 GLU A 63 -0.146 19.241 2.222 1.00 0.00 O ATOM 0 H GLU A 63 -5.041 17.677 2.889 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.257 15.844 1.727 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -3.045 18.244 2.963 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.572 17.217 4.301 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -0.772 16.229 2.968 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -1.288 17.122 1.550 1.00 0.00 H new ATOM 963 N SER A 64 -4.540 14.892 4.530 1.00 0.00 N ATOM 964 CA SER A 64 -4.637 13.807 5.491 1.00 0.00 C ATOM 965 C SER A 64 -5.547 12.699 4.975 1.00 0.00 C ATOM 966 O SER A 64 -5.624 11.633 5.574 1.00 0.00 O ATOM 967 CB SER A 64 -5.159 14.328 6.831 1.00 0.00 C ATOM 968 OG SER A 64 -4.722 13.510 7.902 1.00 0.00 O ATOM 0 H SER A 64 -5.301 15.569 4.587 1.00 0.00 H new ATOM 0 HA SER A 64 -3.638 13.394 5.633 1.00 0.00 H new ATOM 0 HB2 SER A 64 -4.814 15.350 6.986 1.00 0.00 H new ATOM 0 HB3 SER A 64 -6.248 14.358 6.813 1.00 0.00 H new ATOM 0 HG SER A 64 -4.477 14.074 8.665 1.00 0.00 H new ATOM 974 N LEU A 65 -6.261 12.971 3.883 1.00 0.00 N ATOM 975 CA LEU A 65 -7.189 12.002 3.309 1.00 0.00 C ATOM 976 C LEU A 65 -6.580 11.256 2.118 1.00 0.00 C ATOM 977 O LEU A 65 -6.614 10.027 2.062 1.00 0.00 O ATOM 978 CB LEU A 65 -8.469 12.719 2.877 1.00 0.00 C ATOM 979 CG LEU A 65 -9.605 11.808 2.411 1.00 0.00 C ATOM 980 CD1 LEU A 65 -9.920 10.757 3.465 1.00 0.00 C ATOM 981 CD2 LEU A 65 -10.840 12.632 2.092 1.00 0.00 C ATOM 0 H LEU A 65 -6.213 13.856 3.379 1.00 0.00 H new ATOM 0 HA LEU A 65 -7.415 11.260 4.075 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.828 13.321 3.712 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.224 13.409 2.069 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.286 11.293 1.505 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.731 10.120 3.112 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -9.034 10.149 3.648 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -10.221 11.248 4.390 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -11.642 11.972 1.761 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -11.158 13.171 2.984 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.607 13.345 1.301 1.00 0.00 H new ATOM 993 N GLU A 66 -6.035 12.006 1.162 1.00 0.00 N ATOM 994 CA GLU A 66 -5.431 11.420 -0.032 1.00 0.00 C ATOM 995 C GLU A 66 -4.299 10.468 0.332 1.00 0.00 C ATOM 996 O GLU A 66 -4.373 9.269 0.065 1.00 0.00 O ATOM 997 CB GLU A 66 -4.909 12.521 -0.956 1.00 0.00 C ATOM 998 CG GLU A 66 -5.948 13.031 -1.942 1.00 0.00 C ATOM 999 CD GLU A 66 -5.352 13.361 -3.297 1.00 0.00 C ATOM 1000 OE1 GLU A 66 -4.705 12.474 -3.893 1.00 0.00 O ATOM 1001 OE2 GLU A 66 -5.533 14.506 -3.762 1.00 0.00 O ATOM 0 H GLU A 66 -6.000 13.025 1.192 1.00 0.00 H new ATOM 0 HA GLU A 66 -6.202 10.850 -0.551 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -4.555 13.355 -0.350 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -4.050 12.142 -1.510 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.727 12.279 -2.065 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -6.426 13.921 -1.533 1.00 0.00 H new ATOM 1008 N GLY A 67 -3.255 11.010 0.949 1.00 0.00 N ATOM 1009 CA GLY A 67 -2.126 10.191 1.347 1.00 0.00 C ATOM 1010 C GLY A 67 -2.467 9.241 2.482 1.00 0.00 C ATOM 1011 O GLY A 67 -1.623 8.458 2.918 1.00 0.00 O ATOM 0 H GLY A 67 -3.171 12.000 1.180 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.778 9.616 0.489 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.303 10.837 1.653 1.00 0.00 H new ATOM 1015 N ALA A 68 -3.707 9.307 2.961 1.00 0.00 N ATOM 1016 CA ALA A 68 -4.157 8.453 4.045 1.00 0.00 C ATOM 1017 C ALA A 68 -4.788 7.178 3.504 1.00 0.00 C ATOM 1018 O ALA A 68 -4.383 6.074 3.868 1.00 0.00 O ATOM 1019 CB ALA A 68 -5.144 9.202 4.913 1.00 0.00 C ATOM 0 H ALA A 68 -4.418 9.949 2.610 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.293 8.173 4.648 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -5.478 8.556 5.725 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -4.664 10.088 5.329 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -6.002 9.503 4.312 1.00 0.00 H new ATOM 1025 N ILE A 69 -5.769 7.330 2.613 1.00 0.00 N ATOM 1026 CA ILE A 69 -6.422 6.189 2.012 1.00 0.00 C ATOM 1027 C ILE A 69 -5.390 5.391 1.252 1.00 0.00 C ATOM 1028 O ILE A 69 -5.377 4.160 1.273 1.00 0.00 O ATOM 1029 CB ILE A 69 -7.528 6.621 1.022 1.00 0.00 C ATOM 1030 CG1 ILE A 69 -6.938 7.462 -0.118 1.00 0.00 C ATOM 1031 CG2 ILE A 69 -8.617 7.402 1.735 1.00 0.00 C ATOM 1032 CD1 ILE A 69 -7.979 7.972 -1.094 1.00 0.00 C ATOM 0 H ILE A 69 -6.121 8.234 2.299 1.00 0.00 H new ATOM 0 HA ILE A 69 -6.880 5.600 2.806 1.00 0.00 H new ATOM 0 HB ILE A 69 -7.969 5.718 0.599 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.403 8.311 0.307 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.206 6.863 -0.660 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -9.384 7.695 1.018 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -9.064 6.779 2.510 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -8.186 8.294 2.190 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.491 8.558 -1.873 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -8.498 7.127 -1.547 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -8.698 8.598 -0.565 1.00 0.00 H new ATOM 1044 N ALA A 70 -4.517 6.130 0.583 1.00 0.00 N ATOM 1045 CA ALA A 70 -3.452 5.538 -0.198 1.00 0.00 C ATOM 1046 C ALA A 70 -2.667 4.527 0.631 1.00 0.00 C ATOM 1047 O ALA A 70 -2.081 3.587 0.095 1.00 0.00 O ATOM 1048 CB ALA A 70 -2.541 6.627 -0.740 1.00 0.00 C ATOM 0 H ALA A 70 -4.530 7.150 0.569 1.00 0.00 H new ATOM 0 HA ALA A 70 -3.890 5.002 -1.040 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -1.742 6.174 -1.327 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -3.117 7.302 -1.372 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -2.109 7.187 0.090 1.00 0.00 H new ATOM 1054 N ARG A 71 -2.675 4.722 1.948 1.00 0.00 N ATOM 1055 CA ARG A 71 -1.982 3.822 2.859 1.00 0.00 C ATOM 1056 C ARG A 71 -2.851 2.607 3.165 1.00 0.00 C ATOM 1057 O ARG A 71 -2.501 1.480 2.816 1.00 0.00 O ATOM 1058 CB ARG A 71 -1.620 4.549 4.155 1.00 0.00 C ATOM 1059 CG ARG A 71 -0.722 5.757 3.945 1.00 0.00 C ATOM 1060 CD ARG A 71 0.738 5.352 3.827 1.00 0.00 C ATOM 1061 NE ARG A 71 1.637 6.400 4.303 1.00 0.00 N ATOM 1062 CZ ARG A 71 1.960 7.479 3.593 1.00 0.00 C ATOM 1063 NH1 ARG A 71 1.459 7.655 2.375 1.00 0.00 N ATOM 1064 NH2 ARG A 71 2.785 8.385 4.101 1.00 0.00 N ATOM 0 H ARG A 71 -3.155 5.497 2.406 1.00 0.00 H new ATOM 0 HA ARG A 71 -1.063 3.485 2.379 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -2.537 4.870 4.650 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -1.123 3.850 4.827 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -1.028 6.287 3.043 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -0.842 6.450 4.778 1.00 0.00 H new ATOM 0 HD2 ARG A 71 0.909 4.440 4.400 1.00 0.00 H new ATOM 0 HD3 ARG A 71 0.968 5.123 2.786 1.00 0.00 H new ATOM 0 HE ARG A 71 2.041 6.299 5.234 1.00 0.00 H new ATOM 0 HH11 ARG A 71 0.824 6.962 1.980 1.00 0.00 H new ATOM 0 HH12 ARG A 71 1.710 8.483 1.835 1.00 0.00 H new ATOM 0 HH21 ARG A 71 3.172 8.255 5.036 1.00 0.00 H new ATOM 0 HH22 ARG A 71 3.032 9.212 3.557 1.00 0.00 H new ATOM 1078 N PHE A 72 -3.992 2.842 3.814 1.00 0.00 N ATOM 1079 CA PHE A 72 -4.913 1.775 4.162 1.00 0.00 C ATOM 1080 C PHE A 72 -5.194 0.862 2.968 1.00 0.00 C ATOM 1081 O PHE A 72 -5.501 -0.318 3.138 1.00 0.00 O ATOM 1082 CB PHE A 72 -6.211 2.380 4.673 1.00 0.00 C ATOM 1083 CG PHE A 72 -7.194 1.352 5.106 1.00 0.00 C ATOM 1084 CD1 PHE A 72 -7.009 0.657 6.286 1.00 0.00 C ATOM 1085 CD2 PHE A 72 -8.294 1.071 4.327 1.00 0.00 C ATOM 1086 CE1 PHE A 72 -7.911 -0.307 6.682 1.00 0.00 C ATOM 1087 CE2 PHE A 72 -9.200 0.116 4.716 1.00 0.00 C ATOM 1088 CZ PHE A 72 -9.009 -0.578 5.897 1.00 0.00 C ATOM 0 H PHE A 72 -4.296 3.770 4.108 1.00 0.00 H new ATOM 0 HA PHE A 72 -4.454 1.166 4.941 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -5.993 3.043 5.510 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -6.655 2.993 3.888 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -6.149 0.871 6.904 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -8.445 1.607 3.402 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -7.757 -0.848 7.604 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -10.062 -0.093 4.100 1.00 0.00 H new ATOM 0 HZ PHE A 72 -9.720 -1.331 6.203 1.00 0.00 H new ATOM 1098 N ASN A 73 -5.085 1.408 1.763 1.00 0.00 N ATOM 1099 CA ASN A 73 -5.324 0.632 0.554 1.00 0.00 C ATOM 1100 C ASN A 73 -4.274 -0.460 0.412 1.00 0.00 C ATOM 1101 O ASN A 73 -4.546 -1.537 -0.120 1.00 0.00 O ATOM 1102 CB ASN A 73 -5.303 1.539 -0.677 1.00 0.00 C ATOM 1103 CG ASN A 73 -6.426 2.556 -0.664 1.00 0.00 C ATOM 1104 OD1 ASN A 73 -7.492 2.315 -0.098 1.00 0.00 O ATOM 1105 ND2 ASN A 73 -6.191 3.703 -1.290 1.00 0.00 N ATOM 0 H ASN A 73 -4.833 2.383 1.598 1.00 0.00 H new ATOM 0 HA ASN A 73 -6.308 0.169 0.631 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -4.346 2.059 -0.726 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -5.380 0.928 -1.576 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -6.909 4.427 -1.315 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -5.292 3.860 -1.746 1.00 0.00 H new ATOM 1112 N SER A 74 -3.071 -0.171 0.894 1.00 0.00 N ATOM 1113 CA SER A 74 -1.970 -1.125 0.829 1.00 0.00 C ATOM 1114 C SER A 74 -1.747 -1.792 2.184 1.00 0.00 C ATOM 1115 O SER A 74 -0.618 -2.130 2.543 1.00 0.00 O ATOM 1116 CB SER A 74 -0.688 -0.424 0.374 1.00 0.00 C ATOM 1117 OG SER A 74 -0.511 0.807 1.055 1.00 0.00 O ATOM 0 H SER A 74 -2.833 0.718 1.335 1.00 0.00 H new ATOM 0 HA SER A 74 -2.231 -1.896 0.104 1.00 0.00 H new ATOM 0 HB2 SER A 74 0.169 -1.072 0.558 1.00 0.00 H new ATOM 0 HB3 SER A 74 -0.729 -0.246 -0.701 1.00 0.00 H new ATOM 0 HG SER A 74 -1.179 0.886 1.768 1.00 0.00 H new ATOM 1123 N LEU A 75 -2.828 -1.976 2.932 1.00 0.00 N ATOM 1124 CA LEU A 75 -2.755 -2.598 4.250 1.00 0.00 C ATOM 1125 C LEU A 75 -3.217 -4.055 4.191 1.00 0.00 C ATOM 1126 O LEU A 75 -2.636 -4.929 4.835 1.00 0.00 O ATOM 1127 CB LEU A 75 -3.621 -1.819 5.247 1.00 0.00 C ATOM 1128 CG LEU A 75 -2.891 -0.752 6.070 1.00 0.00 C ATOM 1129 CD1 LEU A 75 -2.002 -1.402 7.115 1.00 0.00 C ATOM 1130 CD2 LEU A 75 -2.077 0.172 5.174 1.00 0.00 C ATOM 0 H LEU A 75 -3.769 -1.703 2.648 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.716 -2.577 4.580 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.430 -1.337 4.698 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.080 -2.530 5.934 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.642 -0.148 6.580 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.492 -0.629 7.690 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.611 -2.009 7.784 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -1.264 -2.035 6.622 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.570 0.918 5.786 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -1.337 -0.411 4.626 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -2.740 0.671 4.468 1.00 0.00 H new ATOM 1142 N LEU A 76 -4.262 -4.301 3.408 1.00 0.00 N ATOM 1143 CA LEU A 76 -4.831 -5.639 3.240 1.00 0.00 C ATOM 1144 C LEU A 76 -3.924 -6.528 2.404 1.00 0.00 C ATOM 1145 O LEU A 76 -4.370 -7.140 1.433 1.00 0.00 O ATOM 1146 CB LEU A 76 -6.200 -5.535 2.558 1.00 0.00 C ATOM 1147 CG LEU A 76 -6.276 -4.577 1.354 1.00 0.00 C ATOM 1148 CD1 LEU A 76 -6.675 -3.180 1.809 1.00 0.00 C ATOM 1149 CD2 LEU A 76 -4.954 -4.539 0.578 1.00 0.00 C ATOM 0 H LEU A 76 -4.741 -3.579 2.870 1.00 0.00 H new ATOM 0 HA LEU A 76 -4.935 -6.086 4.229 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -6.497 -6.530 2.226 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -6.932 -5.215 3.300 1.00 0.00 H new ATOM 0 HG LEU A 76 -7.042 -4.955 0.677 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -6.724 -2.516 0.946 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -7.651 -3.220 2.292 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -5.936 -2.802 2.516 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.046 -3.853 -0.264 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -4.155 -4.200 1.237 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.720 -5.537 0.208 1.00 0.00 H new ATOM 1161 N ILE A 77 -2.649 -6.574 2.758 1.00 0.00 N ATOM 1162 CA ILE A 77 -1.694 -7.367 1.997 1.00 0.00 C ATOM 1163 C ILE A 77 -1.831 -7.014 0.542 1.00 0.00 C ATOM 1164 O ILE A 77 -2.254 -7.836 -0.271 1.00 0.00 O ATOM 1165 CB ILE A 77 -1.913 -8.880 2.181 1.00 0.00 C ATOM 1166 CG1 ILE A 77 -2.238 -9.204 3.642 1.00 0.00 C ATOM 1167 CG2 ILE A 77 -0.687 -9.649 1.718 1.00 0.00 C ATOM 1168 CD1 ILE A 77 -1.219 -8.678 4.629 1.00 0.00 C ATOM 0 H ILE A 77 -2.254 -6.078 3.557 1.00 0.00 H new ATOM 0 HA ILE A 77 -0.693 -7.138 2.363 1.00 0.00 H new ATOM 0 HB ILE A 77 -2.763 -9.185 1.570 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.215 -8.788 3.887 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -2.314 -10.285 3.756 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.855 -10.717 1.854 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.504 -9.441 0.664 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.179 -9.341 2.304 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -1.520 -8.948 5.641 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -0.244 -9.114 4.412 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.158 -7.593 4.546 1.00 0.00 H new ATOM 1180 N GLU A 78 -1.492 -5.760 0.235 1.00 0.00 N ATOM 1181 CA GLU A 78 -1.588 -5.241 -1.118 1.00 0.00 C ATOM 1182 C GLU A 78 -1.747 -6.368 -2.117 1.00 0.00 C ATOM 1183 O GLU A 78 -0.914 -7.270 -2.201 1.00 0.00 O ATOM 1184 CB GLU A 78 -0.376 -4.378 -1.459 1.00 0.00 C ATOM 1185 CG GLU A 78 -0.749 -2.937 -1.762 1.00 0.00 C ATOM 1186 CD GLU A 78 -0.525 -2.569 -3.216 1.00 0.00 C ATOM 1187 OE1 GLU A 78 0.574 -2.852 -3.737 1.00 0.00 O ATOM 1188 OE2 GLU A 78 -1.448 -1.996 -3.833 1.00 0.00 O ATOM 0 H GLU A 78 -1.146 -5.085 0.917 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.476 -4.611 -1.175 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.326 -4.400 -0.626 1.00 0.00 H new ATOM 0 HB3 GLU A 78 0.138 -4.805 -2.320 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.797 -2.776 -1.508 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.161 -2.273 -1.128 1.00 0.00 H new ATOM 1195 N GLU A 79 -2.845 -6.312 -2.843 1.00 0.00 N ATOM 1196 CA GLU A 79 -3.190 -7.319 -3.835 1.00 0.00 C ATOM 1197 C GLU A 79 -1.962 -7.843 -4.592 1.00 0.00 C ATOM 1198 O GLU A 79 -1.990 -8.950 -5.129 1.00 0.00 O ATOM 1199 CB GLU A 79 -4.224 -6.736 -4.792 1.00 0.00 C ATOM 1200 CG GLU A 79 -5.341 -5.984 -4.072 1.00 0.00 C ATOM 1201 CD GLU A 79 -6.718 -6.337 -4.599 1.00 0.00 C ATOM 1202 OE1 GLU A 79 -7.300 -7.333 -4.120 1.00 0.00 O ATOM 1203 OE2 GLU A 79 -7.214 -5.618 -5.492 1.00 0.00 O ATOM 0 H GLU A 79 -3.531 -5.561 -2.763 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.612 -8.181 -3.319 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -3.727 -6.060 -5.488 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -4.658 -7.541 -5.385 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.296 -6.208 -3.006 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -5.179 -4.911 -4.179 1.00 0.00 H new ATOM 1210 N SER A 80 -0.884 -7.057 -4.626 1.00 0.00 N ATOM 1211 CA SER A 80 0.332 -7.477 -5.312 1.00 0.00 C ATOM 1212 C SER A 80 1.594 -7.236 -4.471 1.00 0.00 C ATOM 1213 O SER A 80 2.667 -7.004 -5.031 1.00 0.00 O ATOM 1214 CB SER A 80 0.458 -6.744 -6.648 1.00 0.00 C ATOM 1215 OG SER A 80 -0.414 -7.298 -7.618 1.00 0.00 O ATOM 0 H SER A 80 -0.831 -6.136 -4.190 1.00 0.00 H new ATOM 0 HA SER A 80 0.250 -8.551 -5.480 1.00 0.00 H new ATOM 0 HB2 SER A 80 0.229 -5.687 -6.510 1.00 0.00 H new ATOM 0 HB3 SER A 80 1.487 -6.803 -7.003 1.00 0.00 H new ATOM 0 HG SER A 80 -0.316 -6.811 -8.463 1.00 0.00 H new ATOM 1221 N THR A 81 1.492 -7.300 -3.135 1.00 0.00 N ATOM 1222 CA THR A 81 2.669 -7.091 -2.290 1.00 0.00 C ATOM 1223 C THR A 81 3.407 -8.401 -2.031 1.00 0.00 C ATOM 1224 O THR A 81 4.499 -8.400 -1.460 1.00 0.00 O ATOM 1225 CB THR A 81 2.270 -6.457 -0.962 1.00 0.00 C ATOM 1226 OG1 THR A 81 3.405 -6.265 -0.135 1.00 0.00 O ATOM 1227 CG2 THR A 81 1.275 -7.289 -0.192 1.00 0.00 C ATOM 0 H THR A 81 0.627 -7.490 -2.629 1.00 0.00 H new ATOM 0 HA THR A 81 3.339 -6.417 -2.824 1.00 0.00 H new ATOM 0 HB THR A 81 1.808 -5.503 -1.218 1.00 0.00 H new ATOM 0 HG1 THR A 81 4.093 -6.924 -0.365 1.00 0.00 H new ATOM 0 HG21 THR A 81 1.029 -6.788 0.744 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.370 -7.415 -0.786 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.707 -8.266 0.023 1.00 0.00 H new ATOM 1235 N GLY A 82 2.819 -9.516 -2.454 1.00 0.00 N ATOM 1236 CA GLY A 82 3.455 -10.806 -2.254 1.00 0.00 C ATOM 1237 C GLY A 82 4.902 -10.805 -2.710 1.00 0.00 C ATOM 1238 O GLY A 82 5.755 -11.444 -2.097 1.00 0.00 O ATOM 0 H GLY A 82 1.917 -9.550 -2.930 1.00 0.00 H new ATOM 0 HA2 GLY A 82 3.408 -11.073 -1.198 1.00 0.00 H new ATOM 0 HA3 GLY A 82 2.903 -11.571 -2.801 1.00 0.00 H new ATOM 1242 N ASP A 83 5.175 -10.077 -3.789 1.00 0.00 N ATOM 1243 CA ASP A 83 6.527 -9.988 -4.328 1.00 0.00 C ATOM 1244 C ASP A 83 7.412 -9.135 -3.426 1.00 0.00 C ATOM 1245 O ASP A 83 7.686 -7.972 -3.725 1.00 0.00 O ATOM 1246 CB ASP A 83 6.497 -9.401 -5.740 1.00 0.00 C ATOM 1247 CG ASP A 83 5.969 -10.385 -6.765 1.00 0.00 C ATOM 1248 OD1 ASP A 83 5.277 -11.345 -6.365 1.00 0.00 O ATOM 1249 OD2 ASP A 83 6.249 -10.197 -7.968 1.00 0.00 O ATOM 0 H ASP A 83 4.478 -9.541 -4.306 1.00 0.00 H new ATOM 0 HA ASP A 83 6.945 -10.994 -4.371 1.00 0.00 H new ATOM 0 HB2 ASP A 83 5.874 -8.506 -5.745 1.00 0.00 H new ATOM 0 HB3 ASP A 83 7.503 -9.091 -6.023 1.00 0.00 H new ATOM 1254 N PHE A 84 7.855 -9.722 -2.321 1.00 0.00 N ATOM 1255 CA PHE A 84 8.708 -9.025 -1.368 1.00 0.00 C ATOM 1256 C PHE A 84 10.033 -8.634 -2.003 1.00 0.00 C ATOM 1257 O PHE A 84 10.439 -7.475 -1.955 1.00 0.00 O ATOM 1258 CB PHE A 84 8.963 -9.910 -0.145 1.00 0.00 C ATOM 1259 CG PHE A 84 7.869 -9.860 0.889 1.00 0.00 C ATOM 1260 CD1 PHE A 84 7.041 -8.753 1.000 1.00 0.00 C ATOM 1261 CD2 PHE A 84 7.671 -10.925 1.753 1.00 0.00 C ATOM 1262 CE1 PHE A 84 6.041 -8.709 1.949 1.00 0.00 C ATOM 1263 CE2 PHE A 84 6.672 -10.885 2.705 1.00 0.00 C ATOM 1264 CZ PHE A 84 5.857 -9.776 2.802 1.00 0.00 C ATOM 0 H PHE A 84 7.636 -10.684 -2.062 1.00 0.00 H new ATOM 0 HA PHE A 84 8.193 -8.116 -1.057 1.00 0.00 H new ATOM 0 HB2 PHE A 84 9.089 -10.941 -0.476 1.00 0.00 H new ATOM 0 HB3 PHE A 84 9.901 -9.608 0.320 1.00 0.00 H new ATOM 0 HD1 PHE A 84 7.181 -7.914 0.334 1.00 0.00 H new ATOM 0 HD2 PHE A 84 8.305 -11.796 1.681 1.00 0.00 H new ATOM 0 HE1 PHE A 84 5.404 -7.840 2.024 1.00 0.00 H new ATOM 0 HE2 PHE A 84 6.529 -11.721 3.373 1.00 0.00 H new ATOM 0 HZ PHE A 84 5.075 -9.744 3.546 1.00 0.00 H new ATOM 1274 N ASN A 85 10.700 -9.605 -2.609 1.00 0.00 N ATOM 1275 CA ASN A 85 11.983 -9.354 -3.255 1.00 0.00 C ATOM 1276 C ASN A 85 11.833 -8.316 -4.361 1.00 0.00 C ATOM 1277 O ASN A 85 12.821 -7.755 -4.837 1.00 0.00 O ATOM 1278 CB ASN A 85 12.554 -10.649 -3.842 1.00 0.00 C ATOM 1279 CG ASN A 85 12.265 -11.862 -2.979 1.00 0.00 C ATOM 1280 OD1 ASN A 85 11.341 -12.628 -3.252 1.00 0.00 O ATOM 1281 ND2 ASN A 85 13.056 -12.042 -1.931 1.00 0.00 N ATOM 0 H ASN A 85 10.377 -10.571 -2.668 1.00 0.00 H new ATOM 0 HA ASN A 85 12.670 -8.972 -2.500 1.00 0.00 H new ATOM 0 HB2 ASN A 85 12.135 -10.808 -4.836 1.00 0.00 H new ATOM 0 HB3 ASN A 85 13.632 -10.543 -3.963 1.00 0.00 H new ATOM 0 HD21 ASN A 85 12.910 -12.841 -1.313 1.00 0.00 H new ATOM 0 HD22 ASN A 85 13.810 -11.382 -1.742 1.00 0.00 H new ATOM 1288 N GLY A 86 10.593 -8.070 -4.773 1.00 0.00 N ATOM 1289 CA GLY A 86 10.343 -7.108 -5.826 1.00 0.00 C ATOM 1290 C GLY A 86 10.670 -7.669 -7.193 1.00 0.00 C ATOM 1291 O GLY A 86 10.575 -6.967 -8.200 1.00 0.00 O ATOM 0 H GLY A 86 9.759 -8.520 -4.396 1.00 0.00 H new ATOM 0 HA2 GLY A 86 9.296 -6.804 -5.799 1.00 0.00 H new ATOM 0 HA3 GLY A 86 10.939 -6.213 -5.649 1.00 0.00 H new ATOM 1295 N ASN A 87 11.056 -8.941 -7.227 1.00 0.00 N ATOM 1296 CA ASN A 87 11.399 -9.600 -8.485 1.00 0.00 C ATOM 1297 C ASN A 87 10.374 -10.672 -8.845 1.00 0.00 C ATOM 1298 O ASN A 87 10.206 -11.012 -10.017 1.00 0.00 O ATOM 1299 CB ASN A 87 12.796 -10.218 -8.404 1.00 0.00 C ATOM 1300 CG ASN A 87 13.029 -10.968 -7.107 1.00 0.00 C ATOM 1301 OD1 ASN A 87 13.815 -10.540 -6.263 1.00 0.00 O ATOM 1302 ND2 ASN A 87 12.346 -12.095 -6.944 1.00 0.00 N ATOM 0 H ASN A 87 11.139 -9.535 -6.402 1.00 0.00 H new ATOM 0 HA ASN A 87 11.391 -8.843 -9.269 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.937 -10.899 -9.243 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.543 -9.431 -8.503 1.00 0.00 H new ATOM 0 HD21 ASN A 87 12.463 -12.643 -6.092 1.00 0.00 H new ATOM 0 HD22 ASN A 87 11.705 -12.412 -7.671 1.00 0.00 H new ATOM 1309 N GLY A 88 9.690 -11.203 -7.836 1.00 0.00 N ATOM 1310 CA GLY A 88 8.691 -12.228 -8.077 1.00 0.00 C ATOM 1311 C GLY A 88 9.028 -13.542 -7.401 1.00 0.00 C ATOM 1312 O GLY A 88 9.390 -14.514 -8.064 1.00 0.00 O ATOM 0 H GLY A 88 9.810 -10.942 -6.857 1.00 0.00 H new ATOM 0 HA2 GLY A 88 7.723 -11.878 -7.719 1.00 0.00 H new ATOM 0 HA3 GLY A 88 8.594 -12.390 -9.150 1.00 0.00 H new ATOM 1316 N LYS A 89 8.904 -13.573 -6.079 1.00 0.00 N ATOM 1317 CA LYS A 89 9.194 -14.777 -5.312 1.00 0.00 C ATOM 1318 C LYS A 89 8.500 -14.729 -3.957 1.00 0.00 C ATOM 1319 O LYS A 89 8.804 -13.876 -3.124 1.00 0.00 O ATOM 1320 CB LYS A 89 10.702 -14.934 -5.119 1.00 0.00 C ATOM 1321 CG LYS A 89 11.384 -15.694 -6.246 1.00 0.00 C ATOM 1322 CD LYS A 89 12.787 -16.128 -5.857 1.00 0.00 C ATOM 1323 CE LYS A 89 13.662 -14.937 -5.497 1.00 0.00 C ATOM 1324 NZ LYS A 89 14.106 -14.189 -6.705 1.00 0.00 N ATOM 0 H LYS A 89 8.604 -12.777 -5.516 1.00 0.00 H new ATOM 0 HA LYS A 89 8.817 -15.635 -5.868 1.00 0.00 H new ATOM 0 HB2 LYS A 89 11.154 -13.946 -5.033 1.00 0.00 H new ATOM 0 HB3 LYS A 89 10.887 -15.452 -4.178 1.00 0.00 H new ATOM 0 HG2 LYS A 89 10.790 -16.570 -6.507 1.00 0.00 H new ATOM 0 HG3 LYS A 89 11.430 -15.065 -7.135 1.00 0.00 H new ATOM 0 HD2 LYS A 89 12.735 -16.811 -5.009 1.00 0.00 H new ATOM 0 HD3 LYS A 89 13.241 -16.677 -6.682 1.00 0.00 H new ATOM 0 HE2 LYS A 89 13.110 -14.267 -4.838 1.00 0.00 H new ATOM 0 HE3 LYS A 89 14.535 -15.282 -4.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 14.366 -13.218 -6.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 14.931 -14.664 -7.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 13.333 -14.161 -7.400 1.00 0.00 H new ATOM 1338 N ILE A 90 7.565 -15.648 -3.741 1.00 0.00 N ATOM 1339 CA ILE A 90 6.830 -15.702 -2.483 1.00 0.00 C ATOM 1340 C ILE A 90 6.974 -17.069 -1.825 1.00 0.00 C ATOM 1341 O ILE A 90 6.166 -17.969 -2.055 1.00 0.00 O ATOM 1342 CB ILE A 90 5.327 -15.392 -2.671 1.00 0.00 C ATOM 1343 CG1 ILE A 90 5.070 -14.700 -4.014 1.00 0.00 C ATOM 1344 CG2 ILE A 90 4.826 -14.531 -1.522 1.00 0.00 C ATOM 1345 CD1 ILE A 90 5.834 -13.405 -4.188 1.00 0.00 C ATOM 0 H ILE A 90 7.299 -16.363 -4.418 1.00 0.00 H new ATOM 0 HA ILE A 90 7.264 -14.936 -1.841 1.00 0.00 H new ATOM 0 HB ILE A 90 4.779 -16.334 -2.672 1.00 0.00 H new ATOM 0 HG12 ILE A 90 5.339 -15.381 -4.821 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.003 -14.498 -4.110 1.00 0.00 H new ATOM 0 HG21 ILE A 90 3.766 -14.317 -1.663 1.00 0.00 H new ATOM 0 HG22 ILE A 90 4.967 -15.062 -0.581 1.00 0.00 H new ATOM 0 HG23 ILE A 90 5.385 -13.595 -1.498 1.00 0.00 H new ATOM 0 HD11 ILE A 90 5.601 -12.973 -5.162 1.00 0.00 H new ATOM 0 HD12 ILE A 90 5.547 -12.705 -3.403 1.00 0.00 H new ATOM 0 HD13 ILE A 90 6.904 -13.603 -4.125 1.00 0.00 H new ATOM 1357 N ASP A 91 8.007 -17.215 -1.005 1.00 0.00 N ATOM 1358 CA ASP A 91 8.255 -18.475 -0.310 1.00 0.00 C ATOM 1359 C ASP A 91 9.450 -18.355 0.627 1.00 0.00 C ATOM 1360 O ASP A 91 9.399 -18.798 1.774 1.00 0.00 O ATOM 1361 CB ASP A 91 8.488 -19.603 -1.320 1.00 0.00 C ATOM 1362 CG ASP A 91 7.429 -20.685 -1.232 1.00 0.00 C ATOM 1363 OD1 ASP A 91 6.231 -20.354 -1.342 1.00 0.00 O ATOM 1364 OD2 ASP A 91 7.800 -21.865 -1.051 1.00 0.00 O ATOM 0 H ASP A 91 8.685 -16.480 -0.804 1.00 0.00 H new ATOM 0 HA ASP A 91 7.374 -18.711 0.287 1.00 0.00 H new ATOM 0 HB2 ASP A 91 8.497 -19.188 -2.328 1.00 0.00 H new ATOM 0 HB3 ASP A 91 9.470 -20.044 -1.148 1.00 0.00 H new ATOM 1369 N ILE A 92 10.521 -17.751 0.133 1.00 0.00 N ATOM 1370 CA ILE A 92 11.723 -17.567 0.932 1.00 0.00 C ATOM 1371 C ILE A 92 11.880 -16.107 1.333 1.00 0.00 C ATOM 1372 O ILE A 92 12.447 -15.795 2.381 1.00 0.00 O ATOM 1373 CB ILE A 92 12.984 -18.022 0.175 1.00 0.00 C ATOM 1374 CG1 ILE A 92 14.212 -17.904 1.079 1.00 0.00 C ATOM 1375 CG2 ILE A 92 13.172 -17.204 -1.096 1.00 0.00 C ATOM 1376 CD1 ILE A 92 14.423 -19.111 1.967 1.00 0.00 C ATOM 0 H ILE A 92 10.582 -17.381 -0.815 1.00 0.00 H new ATOM 0 HA ILE A 92 11.613 -18.183 1.824 1.00 0.00 H new ATOM 0 HB ILE A 92 12.861 -19.067 -0.110 1.00 0.00 H new ATOM 0 HG12 ILE A 92 15.097 -17.759 0.460 1.00 0.00 H new ATOM 0 HG13 ILE A 92 14.110 -17.016 1.703 1.00 0.00 H new ATOM 0 HG21 ILE A 92 14.068 -17.541 -1.616 1.00 0.00 H new ATOM 0 HG22 ILE A 92 12.305 -17.335 -1.744 1.00 0.00 H new ATOM 0 HG23 ILE A 92 13.277 -16.150 -0.838 1.00 0.00 H new ATOM 0 HD11 ILE A 92 15.311 -18.960 2.581 1.00 0.00 H new ATOM 0 HD12 ILE A 92 13.554 -19.245 2.611 1.00 0.00 H new ATOM 0 HD13 ILE A 92 14.556 -19.999 1.349 1.00 0.00 H new ATOM 1388 N GLY A 93 11.370 -15.214 0.494 1.00 0.00 N ATOM 1389 CA GLY A 93 11.461 -13.798 0.780 1.00 0.00 C ATOM 1390 C GLY A 93 10.808 -13.422 2.097 1.00 0.00 C ATOM 1391 O GLY A 93 10.997 -12.312 2.592 1.00 0.00 O ATOM 0 H GLY A 93 10.896 -15.446 -0.379 1.00 0.00 H new ATOM 0 HA2 GLY A 93 12.510 -13.503 0.802 1.00 0.00 H new ATOM 0 HA3 GLY A 93 10.989 -13.238 -0.027 1.00 0.00 H new ATOM 1395 N ASP A 94 10.040 -14.342 2.670 1.00 0.00 N ATOM 1396 CA ASP A 94 9.369 -14.083 3.938 1.00 0.00 C ATOM 1397 C ASP A 94 10.328 -14.278 5.105 1.00 0.00 C ATOM 1398 O ASP A 94 10.393 -13.452 6.016 1.00 0.00 O ATOM 1399 CB ASP A 94 8.149 -14.993 4.102 1.00 0.00 C ATOM 1400 CG ASP A 94 8.524 -16.447 4.318 1.00 0.00 C ATOM 1401 OD1 ASP A 94 8.948 -16.793 5.440 1.00 0.00 O ATOM 1402 OD2 ASP A 94 8.389 -17.241 3.363 1.00 0.00 O ATOM 0 H ASP A 94 9.867 -15.268 2.279 1.00 0.00 H new ATOM 0 HA ASP A 94 9.032 -13.047 3.934 1.00 0.00 H new ATOM 0 HB2 ASP A 94 7.554 -14.647 4.947 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.520 -14.913 3.215 1.00 0.00 H new ATOM 1407 N LEU A 95 11.071 -15.377 5.071 1.00 0.00 N ATOM 1408 CA LEU A 95 12.026 -15.685 6.127 1.00 0.00 C ATOM 1409 C LEU A 95 13.442 -15.288 5.722 1.00 0.00 C ATOM 1410 O LEU A 95 14.415 -15.900 6.163 1.00 0.00 O ATOM 1411 CB LEU A 95 11.980 -17.177 6.466 1.00 0.00 C ATOM 1412 CG LEU A 95 10.931 -17.573 7.505 1.00 0.00 C ATOM 1413 CD1 LEU A 95 10.417 -18.978 7.235 1.00 0.00 C ATOM 1414 CD2 LEU A 95 11.510 -17.476 8.909 1.00 0.00 C ATOM 0 H LEU A 95 11.030 -16.070 4.323 1.00 0.00 H new ATOM 0 HA LEU A 95 11.748 -15.108 7.009 1.00 0.00 H new ATOM 0 HB2 LEU A 95 11.791 -17.736 5.550 1.00 0.00 H new ATOM 0 HB3 LEU A 95 12.962 -17.482 6.829 1.00 0.00 H new ATOM 0 HG LEU A 95 10.092 -16.881 7.430 1.00 0.00 H new ATOM 0 HD11 LEU A 95 9.671 -19.243 7.984 1.00 0.00 H new ATOM 0 HD12 LEU A 95 9.965 -19.016 6.244 1.00 0.00 H new ATOM 0 HD13 LEU A 95 11.246 -19.684 7.283 1.00 0.00 H new ATOM 0 HD21 LEU A 95 10.750 -17.761 9.636 1.00 0.00 H new ATOM 0 HD22 LEU A 95 12.366 -18.145 8.997 1.00 0.00 H new ATOM 0 HD23 LEU A 95 11.829 -16.452 9.101 1.00 0.00 H new ATOM 1426 N ALA A 96 13.556 -14.266 4.876 1.00 0.00 N ATOM 1427 CA ALA A 96 14.864 -13.808 4.420 1.00 0.00 C ATOM 1428 C ALA A 96 14.817 -12.379 3.881 1.00 0.00 C ATOM 1429 O ALA A 96 15.735 -11.594 4.115 1.00 0.00 O ATOM 1430 CB ALA A 96 15.407 -14.752 3.359 1.00 0.00 C ATOM 0 H ALA A 96 12.766 -13.745 4.496 1.00 0.00 H new ATOM 0 HA ALA A 96 15.530 -13.808 5.283 1.00 0.00 H new ATOM 0 HB1 ALA A 96 16.384 -14.401 3.025 1.00 0.00 H new ATOM 0 HB2 ALA A 96 15.505 -15.753 3.779 1.00 0.00 H new ATOM 0 HB3 ALA A 96 14.722 -14.779 2.511 1.00 0.00 H new ATOM 1436 N MET A 97 13.760 -12.049 3.145 1.00 0.00 N ATOM 1437 CA MET A 97 13.628 -10.714 2.566 1.00 0.00 C ATOM 1438 C MET A 97 12.990 -9.728 3.542 1.00 0.00 C ATOM 1439 O MET A 97 13.661 -8.836 4.060 1.00 0.00 O ATOM 1440 CB MET A 97 12.806 -10.766 1.274 1.00 0.00 C ATOM 1441 CG MET A 97 13.258 -9.779 0.206 1.00 0.00 C ATOM 1442 SD MET A 97 13.723 -8.168 0.874 1.00 0.00 S ATOM 1443 CE MET A 97 13.016 -7.080 -0.357 1.00 0.00 C ATOM 0 H MET A 97 12.987 -12.681 2.936 1.00 0.00 H new ATOM 0 HA MET A 97 14.635 -10.362 2.342 1.00 0.00 H new ATOM 0 HB2 MET A 97 12.857 -11.775 0.865 1.00 0.00 H new ATOM 0 HB3 MET A 97 11.761 -10.571 1.514 1.00 0.00 H new ATOM 0 HG2 MET A 97 14.107 -10.200 -0.332 1.00 0.00 H new ATOM 0 HG3 MET A 97 12.455 -9.646 -0.519 1.00 0.00 H new ATOM 0 HE1 MET A 97 12.636 -6.180 0.127 1.00 0.00 H new ATOM 0 HE2 MET A 97 13.781 -6.806 -1.083 1.00 0.00 H new ATOM 0 HE3 MET A 97 12.199 -7.590 -0.867 1.00 0.00 H new ATOM 1453 N VAL A 98 11.688 -9.873 3.769 1.00 0.00 N ATOM 1454 CA VAL A 98 10.969 -8.971 4.659 1.00 0.00 C ATOM 1455 C VAL A 98 11.340 -9.182 6.125 1.00 0.00 C ATOM 1456 O VAL A 98 11.703 -8.233 6.819 1.00 0.00 O ATOM 1457 CB VAL A 98 9.435 -9.093 4.483 1.00 0.00 C ATOM 1458 CG1 VAL A 98 8.902 -10.388 5.084 1.00 0.00 C ATOM 1459 CG2 VAL A 98 8.735 -7.890 5.096 1.00 0.00 C ATOM 0 H VAL A 98 11.112 -10.604 3.350 1.00 0.00 H new ATOM 0 HA VAL A 98 11.275 -7.964 4.375 1.00 0.00 H new ATOM 0 HB VAL A 98 9.223 -9.116 3.414 1.00 0.00 H new ATOM 0 HG11 VAL A 98 7.823 -10.438 4.941 1.00 0.00 H new ATOM 0 HG12 VAL A 98 9.373 -11.239 4.591 1.00 0.00 H new ATOM 0 HG13 VAL A 98 9.129 -10.415 6.150 1.00 0.00 H new ATOM 0 HG21 VAL A 98 7.658 -7.990 4.965 1.00 0.00 H new ATOM 0 HG22 VAL A 98 8.967 -7.837 6.160 1.00 0.00 H new ATOM 0 HG23 VAL A 98 9.078 -6.980 4.604 1.00 0.00 H new ATOM 1469 N SER A 99 11.247 -10.420 6.602 1.00 0.00 N ATOM 1470 CA SER A 99 11.562 -10.721 7.995 1.00 0.00 C ATOM 1471 C SER A 99 12.986 -10.308 8.369 1.00 0.00 C ATOM 1472 O SER A 99 13.364 -10.370 9.539 1.00 0.00 O ATOM 1473 CB SER A 99 11.362 -12.208 8.285 1.00 0.00 C ATOM 1474 OG SER A 99 12.285 -13.000 7.559 1.00 0.00 O ATOM 0 H SER A 99 10.958 -11.226 6.048 1.00 0.00 H new ATOM 0 HA SER A 99 10.874 -10.137 8.607 1.00 0.00 H new ATOM 0 HB2 SER A 99 11.482 -12.392 9.353 1.00 0.00 H new ATOM 0 HB3 SER A 99 10.345 -12.499 8.023 1.00 0.00 H new ATOM 0 HG SER A 99 11.982 -13.087 6.631 1.00 0.00 H new ATOM 1480 N LYS A 100 13.777 -9.901 7.382 1.00 0.00 N ATOM 1481 CA LYS A 100 15.152 -9.500 7.634 1.00 0.00 C ATOM 1482 C LYS A 100 15.242 -8.337 8.611 1.00 0.00 C ATOM 1483 O LYS A 100 15.836 -8.463 9.682 1.00 0.00 O ATOM 1484 CB LYS A 100 15.851 -9.138 6.323 1.00 0.00 C ATOM 1485 CG LYS A 100 17.317 -8.776 6.495 1.00 0.00 C ATOM 1486 CD LYS A 100 17.510 -7.273 6.611 1.00 0.00 C ATOM 1487 CE LYS A 100 17.059 -6.554 5.350 1.00 0.00 C ATOM 1488 NZ LYS A 100 17.803 -5.280 5.140 1.00 0.00 N ATOM 0 H LYS A 100 13.489 -9.841 6.405 1.00 0.00 H new ATOM 0 HA LYS A 100 15.656 -10.352 8.090 1.00 0.00 H new ATOM 0 HB2 LYS A 100 15.771 -9.979 5.634 1.00 0.00 H new ATOM 0 HB3 LYS A 100 15.330 -8.299 5.863 1.00 0.00 H new ATOM 0 HG2 LYS A 100 17.711 -9.264 7.386 1.00 0.00 H new ATOM 0 HG3 LYS A 100 17.888 -9.153 5.646 1.00 0.00 H new ATOM 0 HD2 LYS A 100 16.947 -6.898 7.466 1.00 0.00 H new ATOM 0 HD3 LYS A 100 18.561 -7.054 6.800 1.00 0.00 H new ATOM 0 HE2 LYS A 100 17.205 -7.206 4.489 1.00 0.00 H new ATOM 0 HE3 LYS A 100 15.991 -6.344 5.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 17.128 -4.509 4.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 18.361 -5.060 5.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 18.440 -5.380 4.324 1.00 0.00 H new ATOM 1502 N ASN A 101 14.666 -7.204 8.243 1.00 0.00 N ATOM 1503 CA ASN A 101 14.709 -6.032 9.099 1.00 0.00 C ATOM 1504 C ASN A 101 13.699 -6.145 10.233 1.00 0.00 C ATOM 1505 O ASN A 101 14.034 -5.906 11.392 1.00 0.00 O ATOM 1506 CB ASN A 101 14.450 -4.763 8.284 1.00 0.00 C ATOM 1507 CG ASN A 101 13.133 -4.809 7.533 1.00 0.00 C ATOM 1508 OD1 ASN A 101 12.107 -4.345 8.031 1.00 0.00 O ATOM 1509 ND2 ASN A 101 13.158 -5.366 6.329 1.00 0.00 N ATOM 0 H ASN A 101 14.167 -7.072 7.363 1.00 0.00 H new ATOM 0 HA ASN A 101 15.706 -5.972 9.535 1.00 0.00 H new ATOM 0 HB2 ASN A 101 14.454 -3.901 8.951 1.00 0.00 H new ATOM 0 HB3 ASN A 101 15.264 -4.620 7.573 1.00 0.00 H new ATOM 0 HD21 ASN A 101 12.303 -5.423 5.775 1.00 0.00 H new ATOM 0 HD22 ASN A 101 14.032 -5.737 5.957 1.00 0.00 H new ATOM 1516 N ILE A 102 12.459 -6.493 9.892 1.00 0.00 N ATOM 1517 CA ILE A 102 11.395 -6.616 10.874 1.00 0.00 C ATOM 1518 C ILE A 102 11.392 -5.424 11.821 1.00 0.00 C ATOM 1519 O ILE A 102 12.162 -5.361 12.779 1.00 0.00 O ATOM 1520 CB ILE A 102 11.490 -7.927 11.680 1.00 0.00 C ATOM 1521 CG1 ILE A 102 11.116 -9.119 10.790 1.00 0.00 C ATOM 1522 CG2 ILE A 102 10.595 -7.881 12.919 1.00 0.00 C ATOM 1523 CD1 ILE A 102 9.617 -9.323 10.616 1.00 0.00 C ATOM 0 H ILE A 102 12.170 -6.695 8.935 1.00 0.00 H new ATOM 0 HA ILE A 102 10.457 -6.637 10.319 1.00 0.00 H new ATOM 0 HB ILE A 102 12.519 -8.046 12.018 1.00 0.00 H new ATOM 0 HG12 ILE A 102 11.569 -8.981 9.808 1.00 0.00 H new ATOM 0 HG13 ILE A 102 11.548 -10.025 11.215 1.00 0.00 H new ATOM 0 HG21 ILE A 102 10.683 -8.819 13.467 1.00 0.00 H new ATOM 0 HG22 ILE A 102 10.904 -7.056 13.561 1.00 0.00 H new ATOM 0 HG23 ILE A 102 9.559 -7.735 12.614 1.00 0.00 H new ATOM 0 HD11 ILE A 102 9.439 -10.185 9.973 1.00 0.00 H new ATOM 0 HD12 ILE A 102 9.158 -9.495 11.589 1.00 0.00 H new ATOM 0 HD13 ILE A 102 9.179 -8.435 10.160 1.00 0.00 H new ATOM 1535 N GLY A 103 10.501 -4.493 11.542 1.00 0.00 N ATOM 1536 CA GLY A 103 10.378 -3.307 12.368 1.00 0.00 C ATOM 1537 C GLY A 103 11.188 -2.137 11.844 1.00 0.00 C ATOM 1538 O GLY A 103 11.526 -1.224 12.597 1.00 0.00 O ATOM 0 H GLY A 103 9.854 -4.534 10.754 1.00 0.00 H new ATOM 0 HA2 GLY A 103 9.329 -3.019 12.427 1.00 0.00 H new ATOM 0 HA3 GLY A 103 10.702 -3.541 13.382 1.00 0.00 H new ATOM 1542 N SER A 104 11.501 -2.160 10.552 1.00 0.00 N ATOM 1543 CA SER A 104 12.276 -1.089 9.937 1.00 0.00 C ATOM 1544 C SER A 104 11.409 -0.259 8.998 1.00 0.00 C ATOM 1545 O SER A 104 10.980 -0.735 7.947 1.00 0.00 O ATOM 1546 CB SER A 104 13.467 -1.666 9.170 1.00 0.00 C ATOM 1547 OG SER A 104 14.186 -0.644 8.501 1.00 0.00 O ATOM 0 H SER A 104 11.230 -2.907 9.912 1.00 0.00 H new ATOM 0 HA SER A 104 12.644 -0.441 10.732 1.00 0.00 H new ATOM 0 HB2 SER A 104 14.129 -2.189 9.860 1.00 0.00 H new ATOM 0 HB3 SER A 104 13.116 -2.401 8.446 1.00 0.00 H new ATOM 0 HG SER A 104 14.943 -1.038 8.019 1.00 0.00 H new ATOM 1553 N THR A 105 11.154 0.987 9.384 1.00 0.00 N ATOM 1554 CA THR A 105 10.339 1.885 8.577 1.00 0.00 C ATOM 1555 C THR A 105 10.973 2.108 7.209 1.00 0.00 C ATOM 1556 O THR A 105 10.289 2.087 6.186 1.00 0.00 O ATOM 1557 CB THR A 105 10.154 3.221 9.297 1.00 0.00 C ATOM 1558 OG1 THR A 105 11.354 3.975 9.270 1.00 0.00 O ATOM 1559 CG2 THR A 105 9.742 3.064 10.745 1.00 0.00 C ATOM 0 H THR A 105 11.501 1.397 10.251 1.00 0.00 H new ATOM 0 HA THR A 105 9.362 1.424 8.431 1.00 0.00 H new ATOM 0 HB THR A 105 9.355 3.733 8.761 1.00 0.00 H new ATOM 0 HG1 THR A 105 11.215 4.827 9.734 1.00 0.00 H new ATOM 0 HG21 THR A 105 9.627 4.048 11.199 1.00 0.00 H new ATOM 0 HG22 THR A 105 8.795 2.527 10.798 1.00 0.00 H new ATOM 0 HG23 THR A 105 10.507 2.503 11.282 1.00 0.00 H new ATOM 1567 N THR A 106 12.286 2.310 7.196 1.00 0.00 N ATOM 1568 CA THR A 106 13.012 2.525 5.950 1.00 0.00 C ATOM 1569 C THR A 106 12.868 1.317 5.031 1.00 0.00 C ATOM 1570 O THR A 106 12.938 1.441 3.808 1.00 0.00 O ATOM 1571 CB THR A 106 14.491 2.794 6.234 1.00 0.00 C ATOM 1572 OG1 THR A 106 15.140 1.613 6.669 1.00 0.00 O ATOM 1573 CG2 THR A 106 14.713 3.855 7.290 1.00 0.00 C ATOM 0 H THR A 106 12.869 2.329 8.033 1.00 0.00 H new ATOM 0 HA THR A 106 12.585 3.395 5.452 1.00 0.00 H new ATOM 0 HB THR A 106 14.907 3.149 5.291 1.00 0.00 H new ATOM 0 HG1 THR A 106 14.540 1.108 7.257 1.00 0.00 H new ATOM 0 HG21 THR A 106 15.783 3.997 7.444 1.00 0.00 H new ATOM 0 HG22 THR A 106 14.265 4.793 6.963 1.00 0.00 H new ATOM 0 HG23 THR A 106 14.251 3.540 8.225 1.00 0.00 H new ATOM 1581 N ASN A 107 12.663 0.147 5.632 1.00 0.00 N ATOM 1582 CA ASN A 107 12.505 -1.087 4.874 1.00 0.00 C ATOM 1583 C ASN A 107 11.028 -1.435 4.711 1.00 0.00 C ATOM 1584 O ASN A 107 10.650 -2.606 4.735 1.00 0.00 O ATOM 1585 CB ASN A 107 13.238 -2.234 5.574 1.00 0.00 C ATOM 1586 CG ASN A 107 13.851 -3.216 4.594 1.00 0.00 C ATOM 1587 OD1 ASN A 107 15.013 -3.599 4.726 1.00 0.00 O ATOM 1588 ND2 ASN A 107 13.070 -3.628 3.602 1.00 0.00 N ATOM 0 H ASN A 107 12.603 0.030 6.643 1.00 0.00 H new ATOM 0 HA ASN A 107 12.937 -0.939 3.884 1.00 0.00 H new ATOM 0 HB2 ASN A 107 14.022 -1.825 6.211 1.00 0.00 H new ATOM 0 HB3 ASN A 107 12.541 -2.762 6.225 1.00 0.00 H new ATOM 0 HD21 ASN A 107 13.428 -4.288 2.911 1.00 0.00 H new ATOM 0 HD22 ASN A 107 12.112 -3.285 3.531 1.00 0.00 H new ATOM 1595 N THR A 108 10.201 -0.409 4.546 1.00 0.00 N ATOM 1596 CA THR A 108 8.764 -0.602 4.379 1.00 0.00 C ATOM 1597 C THR A 108 8.418 -0.990 2.942 1.00 0.00 C ATOM 1598 O THR A 108 7.252 -1.226 2.622 1.00 0.00 O ATOM 1599 CB THR A 108 8.011 0.670 4.769 1.00 0.00 C ATOM 1600 OG1 THR A 108 6.611 0.464 4.705 1.00 0.00 O ATOM 1601 CG2 THR A 108 8.341 1.854 3.888 1.00 0.00 C ATOM 0 H THR A 108 10.500 0.566 4.524 1.00 0.00 H new ATOM 0 HA THR A 108 8.459 -1.418 5.034 1.00 0.00 H new ATOM 0 HB THR A 108 8.331 0.894 5.787 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.406 -0.166 3.983 1.00 0.00 H new ATOM 0 HG21 THR A 108 7.773 2.723 4.219 1.00 0.00 H new ATOM 0 HG22 THR A 108 9.407 2.071 3.954 1.00 0.00 H new ATOM 0 HG23 THR A 108 8.081 1.623 2.855 1.00 0.00 H new ATOM 1609 N SER A 109 9.431 -1.058 2.077 1.00 0.00 N ATOM 1610 CA SER A 109 9.220 -1.419 0.678 1.00 0.00 C ATOM 1611 C SER A 109 8.340 -2.660 0.559 1.00 0.00 C ATOM 1612 O SER A 109 7.613 -2.827 -0.420 1.00 0.00 O ATOM 1613 CB SER A 109 10.563 -1.665 -0.014 1.00 0.00 C ATOM 1614 OG SER A 109 10.510 -1.292 -1.379 1.00 0.00 O ATOM 0 H SER A 109 10.403 -0.868 2.322 1.00 0.00 H new ATOM 0 HA SER A 109 8.711 -0.588 0.189 1.00 0.00 H new ATOM 0 HB2 SER A 109 11.345 -1.098 0.491 1.00 0.00 H new ATOM 0 HB3 SER A 109 10.830 -2.719 0.068 1.00 0.00 H new ATOM 0 HG SER A 109 11.381 -1.457 -1.797 1.00 0.00 H new ATOM 1620 N LEU A 110 8.408 -3.523 1.567 1.00 0.00 N ATOM 1621 CA LEU A 110 7.613 -4.745 1.582 1.00 0.00 C ATOM 1622 C LEU A 110 6.294 -4.523 2.314 1.00 0.00 C ATOM 1623 O LEU A 110 5.239 -4.427 1.688 1.00 0.00 O ATOM 1624 CB LEU A 110 8.393 -5.879 2.248 1.00 0.00 C ATOM 1625 CG LEU A 110 9.858 -5.999 1.822 1.00 0.00 C ATOM 1626 CD1 LEU A 110 10.777 -5.917 3.037 1.00 0.00 C ATOM 1627 CD2 LEU A 110 10.083 -7.299 1.059 1.00 0.00 C ATOM 0 H LEU A 110 9.006 -3.399 2.384 1.00 0.00 H new ATOM 0 HA LEU A 110 7.396 -5.021 0.550 1.00 0.00 H new ATOM 0 HB2 LEU A 110 8.356 -5.739 3.328 1.00 0.00 H new ATOM 0 HB3 LEU A 110 7.890 -6.821 2.031 1.00 0.00 H new ATOM 0 HG LEU A 110 10.097 -5.167 1.159 1.00 0.00 H new ATOM 0 HD11 LEU A 110 11.815 -6.004 2.715 1.00 0.00 H new ATOM 0 HD12 LEU A 110 10.632 -4.960 3.539 1.00 0.00 H new ATOM 0 HD13 LEU A 110 10.542 -6.728 3.726 1.00 0.00 H new ATOM 0 HD21 LEU A 110 11.129 -7.370 0.762 1.00 0.00 H new ATOM 0 HD22 LEU A 110 9.828 -8.145 1.698 1.00 0.00 H new ATOM 0 HD23 LEU A 110 9.452 -7.313 0.170 1.00 0.00 H new ATOM 1639 N ASP A 111 6.375 -4.429 3.646 1.00 0.00 N ATOM 1640 CA ASP A 111 5.231 -4.207 4.505 1.00 0.00 C ATOM 1641 C ASP A 111 3.900 -4.463 3.812 1.00 0.00 C ATOM 1642 O ASP A 111 3.247 -3.530 3.346 1.00 0.00 O ATOM 1643 CB ASP A 111 5.279 -2.781 5.047 1.00 0.00 C ATOM 1644 CG ASP A 111 5.060 -2.720 6.546 1.00 0.00 C ATOM 1645 OD1 ASP A 111 3.975 -3.135 7.005 1.00 0.00 O ATOM 1646 OD2 ASP A 111 5.974 -2.258 7.261 1.00 0.00 O ATOM 0 H ASP A 111 7.256 -4.508 4.155 1.00 0.00 H new ATOM 0 HA ASP A 111 5.293 -4.928 5.320 1.00 0.00 H new ATOM 0 HB2 ASP A 111 6.245 -2.337 4.806 1.00 0.00 H new ATOM 0 HB3 ASP A 111 4.519 -2.181 4.548 1.00 0.00 H new ATOM 1651 N LEU A 112 3.475 -5.729 3.786 1.00 0.00 N ATOM 1652 CA LEU A 112 2.185 -6.074 3.193 1.00 0.00 C ATOM 1653 C LEU A 112 1.124 -5.136 3.764 1.00 0.00 C ATOM 1654 O LEU A 112 0.098 -4.855 3.144 1.00 0.00 O ATOM 1655 CB LEU A 112 1.801 -7.525 3.522 1.00 0.00 C ATOM 1656 CG LEU A 112 2.881 -8.584 3.286 1.00 0.00 C ATOM 1657 CD1 LEU A 112 2.511 -9.894 3.983 1.00 0.00 C ATOM 1658 CD2 LEU A 112 3.074 -8.813 1.795 1.00 0.00 C ATOM 0 H LEU A 112 3.998 -6.520 4.163 1.00 0.00 H new ATOM 0 HA LEU A 112 2.252 -5.972 2.110 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.501 -7.570 4.569 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.926 -7.790 2.928 1.00 0.00 H new ATOM 0 HG LEU A 112 3.819 -8.224 3.709 1.00 0.00 H new ATOM 0 HD11 LEU A 112 3.291 -10.634 3.804 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.414 -9.721 5.055 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.564 -10.261 3.588 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.845 -9.568 1.640 1.00 0.00 H new ATOM 0 HD22 LEU A 112 2.137 -9.155 1.355 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.379 -7.880 1.320 1.00 0.00 H new ATOM 1670 N ASN A 113 1.417 -4.669 4.973 1.00 0.00 N ATOM 1671 CA ASN A 113 0.569 -3.767 5.724 1.00 0.00 C ATOM 1672 C ASN A 113 0.935 -2.312 5.452 1.00 0.00 C ATOM 1673 O ASN A 113 0.065 -1.455 5.327 1.00 0.00 O ATOM 1674 CB ASN A 113 0.778 -4.097 7.200 1.00 0.00 C ATOM 1675 CG ASN A 113 0.267 -3.046 8.167 1.00 0.00 C ATOM 1676 OD1 ASN A 113 0.505 -1.852 7.996 1.00 0.00 O ATOM 1677 ND2 ASN A 113 -0.428 -3.500 9.203 1.00 0.00 N ATOM 0 H ASN A 113 2.275 -4.917 5.466 1.00 0.00 H new ATOM 0 HA ASN A 113 -0.474 -3.892 5.432 1.00 0.00 H new ATOM 0 HB2 ASN A 113 0.283 -5.043 7.420 1.00 0.00 H new ATOM 0 HB3 ASN A 113 1.843 -4.246 7.377 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -0.790 -2.848 9.899 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -0.600 -4.500 9.303 1.00 0.00 H new ATOM 1684 N LYS A 114 2.236 -2.046 5.392 1.00 0.00 N ATOM 1685 CA LYS A 114 2.749 -0.696 5.169 1.00 0.00 C ATOM 1686 C LYS A 114 2.687 0.106 6.456 1.00 0.00 C ATOM 1687 O LYS A 114 2.517 1.325 6.433 1.00 0.00 O ATOM 1688 CB LYS A 114 1.972 0.032 4.075 1.00 0.00 C ATOM 1689 CG LYS A 114 1.745 -0.802 2.828 1.00 0.00 C ATOM 1690 CD LYS A 114 2.912 -0.687 1.862 1.00 0.00 C ATOM 1691 CE LYS A 114 2.873 -1.784 0.812 1.00 0.00 C ATOM 1692 NZ LYS A 114 4.116 -1.817 -0.006 1.00 0.00 N ATOM 0 H LYS A 114 2.962 -2.755 5.496 1.00 0.00 H new ATOM 0 HA LYS A 114 3.785 -0.790 4.843 1.00 0.00 H new ATOM 0 HB2 LYS A 114 1.006 0.343 4.474 1.00 0.00 H new ATOM 0 HB3 LYS A 114 2.511 0.939 3.801 1.00 0.00 H new ATOM 0 HG2 LYS A 114 1.604 -1.846 3.108 1.00 0.00 H new ATOM 0 HG3 LYS A 114 0.829 -0.478 2.334 1.00 0.00 H new ATOM 0 HD2 LYS A 114 2.887 0.287 1.374 1.00 0.00 H new ATOM 0 HD3 LYS A 114 3.850 -0.743 2.414 1.00 0.00 H new ATOM 0 HE2 LYS A 114 2.735 -2.749 1.300 1.00 0.00 H new ATOM 0 HE3 LYS A 114 2.013 -1.631 0.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 3.870 -1.967 -1.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 4.622 -0.914 0.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 4.726 -2.593 0.321 1.00 0.00 H new ATOM 1706 N ASP A 115 2.836 -0.583 7.580 1.00 0.00 N ATOM 1707 CA ASP A 115 2.804 0.075 8.874 1.00 0.00 C ATOM 1708 C ASP A 115 4.116 0.815 9.129 1.00 0.00 C ATOM 1709 O ASP A 115 4.224 1.589 10.081 1.00 0.00 O ATOM 1710 CB ASP A 115 2.538 -0.946 9.985 1.00 0.00 C ATOM 1711 CG ASP A 115 2.581 -0.327 11.370 1.00 0.00 C ATOM 1712 OD1 ASP A 115 2.152 0.838 11.512 1.00 0.00 O ATOM 1713 OD2 ASP A 115 3.044 -1.006 12.310 1.00 0.00 O ATOM 0 H ASP A 115 2.979 -1.592 7.619 1.00 0.00 H new ATOM 0 HA ASP A 115 1.993 0.803 8.873 1.00 0.00 H new ATOM 0 HB2 ASP A 115 1.562 -1.404 9.826 1.00 0.00 H new ATOM 0 HB3 ASP A 115 3.278 -1.744 9.925 1.00 0.00 H new ATOM 1718 N GLY A 116 5.120 0.562 8.287 1.00 0.00 N ATOM 1719 CA GLY A 116 6.407 1.206 8.465 1.00 0.00 C ATOM 1720 C GLY A 116 7.273 0.409 9.409 1.00 0.00 C ATOM 1721 O GLY A 116 8.080 0.961 10.156 1.00 0.00 O ATOM 0 H GLY A 116 5.062 -0.074 7.491 1.00 0.00 H new ATOM 0 HA2 GLY A 116 6.906 1.306 7.501 1.00 0.00 H new ATOM 0 HA3 GLY A 116 6.265 2.213 8.856 1.00 0.00 H new ATOM 1725 N SER A 117 7.074 -0.900 9.378 1.00 0.00 N ATOM 1726 CA SER A 117 7.806 -1.818 10.237 1.00 0.00 C ATOM 1727 C SER A 117 7.522 -3.240 9.832 1.00 0.00 C ATOM 1728 O SER A 117 6.390 -3.712 9.938 1.00 0.00 O ATOM 1729 CB SER A 117 7.394 -1.626 11.699 1.00 0.00 C ATOM 1730 OG SER A 117 6.577 -0.478 11.859 1.00 0.00 O ATOM 0 H SER A 117 6.403 -1.355 8.759 1.00 0.00 H new ATOM 0 HA SER A 117 8.871 -1.610 10.131 1.00 0.00 H new ATOM 0 HB2 SER A 117 6.856 -2.508 12.046 1.00 0.00 H new ATOM 0 HB3 SER A 117 8.285 -1.530 12.320 1.00 0.00 H new ATOM 0 HG SER A 117 6.329 -0.382 12.802 1.00 0.00 H new ATOM 1736 N ILE A 118 8.551 -3.936 9.388 1.00 0.00 N ATOM 1737 CA ILE A 118 8.382 -5.308 9.003 1.00 0.00 C ATOM 1738 C ILE A 118 8.040 -6.129 10.227 1.00 0.00 C ATOM 1739 O ILE A 118 8.849 -6.341 11.122 1.00 0.00 O ATOM 1740 CB ILE A 118 9.620 -5.855 8.278 1.00 0.00 C ATOM 1741 CG1 ILE A 118 9.738 -5.189 6.907 1.00 0.00 C ATOM 1742 CG2 ILE A 118 9.552 -7.369 8.150 1.00 0.00 C ATOM 1743 CD1 ILE A 118 8.424 -5.078 6.159 1.00 0.00 C ATOM 0 H ILE A 118 9.499 -3.572 9.289 1.00 0.00 H new ATOM 0 HA ILE A 118 7.560 -5.375 8.290 1.00 0.00 H new ATOM 0 HB ILE A 118 10.510 -5.621 8.863 1.00 0.00 H new ATOM 0 HG12 ILE A 118 10.157 -4.191 7.034 1.00 0.00 H new ATOM 0 HG13 ILE A 118 10.443 -5.755 6.299 1.00 0.00 H new ATOM 0 HG21 ILE A 118 10.441 -7.731 7.633 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.503 -7.816 9.143 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.664 -7.647 7.582 1.00 0.00 H new ATOM 0 HD11 ILE A 118 8.593 -4.595 5.197 1.00 0.00 H new ATOM 0 HD12 ILE A 118 8.012 -6.074 5.998 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.721 -4.485 6.744 1.00 0.00 H new ATOM 1755 N ASP A 119 6.804 -6.534 10.269 1.00 0.00 N ATOM 1756 CA ASP A 119 6.293 -7.296 11.401 1.00 0.00 C ATOM 1757 C ASP A 119 5.468 -8.500 10.950 1.00 0.00 C ATOM 1758 O ASP A 119 5.757 -9.116 9.925 1.00 0.00 O ATOM 1759 CB ASP A 119 5.477 -6.374 12.311 1.00 0.00 C ATOM 1760 CG ASP A 119 5.629 -6.724 13.779 1.00 0.00 C ATOM 1761 OD1 ASP A 119 5.269 -7.858 14.160 1.00 0.00 O ATOM 1762 OD2 ASP A 119 6.109 -5.864 14.547 1.00 0.00 O ATOM 0 H ASP A 119 6.119 -6.355 9.535 1.00 0.00 H new ATOM 0 HA ASP A 119 7.140 -7.691 11.961 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.790 -5.342 12.152 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.425 -6.434 12.034 1.00 0.00 H new ATOM 1767 N GLU A 120 4.450 -8.844 11.730 1.00 0.00 N ATOM 1768 CA GLU A 120 3.596 -9.982 11.410 1.00 0.00 C ATOM 1769 C GLU A 120 2.760 -9.701 10.164 1.00 0.00 C ATOM 1770 O GLU A 120 2.439 -10.611 9.400 1.00 0.00 O ATOM 1771 CB GLU A 120 2.684 -10.308 12.593 1.00 0.00 C ATOM 1772 CG GLU A 120 2.195 -11.747 12.605 1.00 0.00 C ATOM 1773 CD GLU A 120 1.571 -12.139 13.929 1.00 0.00 C ATOM 1774 OE1 GLU A 120 2.327 -12.419 14.884 1.00 0.00 O ATOM 1775 OE2 GLU A 120 0.325 -12.167 14.014 1.00 0.00 O ATOM 0 H GLU A 120 4.196 -8.353 12.587 1.00 0.00 H new ATOM 0 HA GLU A 120 4.235 -10.841 11.208 1.00 0.00 H new ATOM 0 HB2 GLU A 120 3.220 -10.107 13.521 1.00 0.00 H new ATOM 0 HB3 GLU A 120 1.823 -9.640 12.572 1.00 0.00 H new ATOM 0 HG2 GLU A 120 1.464 -11.885 11.808 1.00 0.00 H new ATOM 0 HG3 GLU A 120 3.031 -12.413 12.390 1.00 0.00 H new ATOM 1782 N TYR A 121 2.412 -8.433 9.968 1.00 0.00 N ATOM 1783 CA TYR A 121 1.618 -8.021 8.819 1.00 0.00 C ATOM 1784 C TYR A 121 2.294 -8.424 7.509 1.00 0.00 C ATOM 1785 O TYR A 121 1.634 -8.538 6.479 1.00 0.00 O ATOM 1786 CB TYR A 121 1.389 -6.503 8.825 1.00 0.00 C ATOM 1787 CG TYR A 121 1.915 -5.773 10.046 1.00 0.00 C ATOM 1788 CD1 TYR A 121 1.294 -5.899 11.284 1.00 0.00 C ATOM 1789 CD2 TYR A 121 3.035 -4.956 9.956 1.00 0.00 C ATOM 1790 CE1 TYR A 121 1.774 -5.231 12.395 1.00 0.00 C ATOM 1791 CE2 TYR A 121 3.521 -4.284 11.062 1.00 0.00 C ATOM 1792 CZ TYR A 121 2.887 -4.425 12.278 1.00 0.00 C ATOM 1793 OH TYR A 121 3.368 -3.759 13.381 1.00 0.00 O ATOM 0 H TYR A 121 2.670 -7.671 10.595 1.00 0.00 H new ATOM 0 HA TYR A 121 0.656 -8.528 8.893 1.00 0.00 H new ATOM 0 HB2 TYR A 121 1.858 -6.078 7.938 1.00 0.00 H new ATOM 0 HB3 TYR A 121 0.319 -6.313 8.742 1.00 0.00 H new ATOM 0 HD1 TYR A 121 0.422 -6.529 11.379 1.00 0.00 H new ATOM 0 HD2 TYR A 121 3.535 -4.844 9.005 1.00 0.00 H new ATOM 0 HE1 TYR A 121 1.280 -5.340 13.349 1.00 0.00 H new ATOM 0 HE2 TYR A 121 4.392 -3.652 10.974 1.00 0.00 H new ATOM 0 HH TYR A 121 3.357 -2.794 13.211 1.00 0.00 H new ATOM 1803 N GLU A 122 3.611 -8.624 7.553 1.00 0.00 N ATOM 1804 CA GLU A 122 4.375 -9.001 6.359 1.00 0.00 C ATOM 1805 C GLU A 122 4.437 -10.519 6.186 1.00 0.00 C ATOM 1806 O GLU A 122 4.759 -11.025 5.114 1.00 0.00 O ATOM 1807 CB GLU A 122 5.799 -8.446 6.416 1.00 0.00 C ATOM 1808 CG GLU A 122 6.013 -7.372 7.467 1.00 0.00 C ATOM 1809 CD GLU A 122 5.102 -6.174 7.282 1.00 0.00 C ATOM 1810 OE1 GLU A 122 4.091 -6.301 6.558 1.00 0.00 O ATOM 1811 OE2 GLU A 122 5.401 -5.108 7.858 1.00 0.00 O ATOM 0 H GLU A 122 4.172 -8.532 8.400 1.00 0.00 H new ATOM 0 HA GLU A 122 3.853 -8.570 5.505 1.00 0.00 H new ATOM 0 HB2 GLU A 122 6.489 -9.268 6.609 1.00 0.00 H new ATOM 0 HB3 GLU A 122 6.056 -8.037 5.439 1.00 0.00 H new ATOM 0 HG2 GLU A 122 5.846 -7.800 8.455 1.00 0.00 H new ATOM 0 HG3 GLU A 122 7.051 -7.041 7.435 1.00 0.00 H new ATOM 1818 N ILE A 123 4.141 -11.230 7.252 1.00 0.00 N ATOM 1819 CA ILE A 123 4.167 -12.690 7.243 1.00 0.00 C ATOM 1820 C ILE A 123 2.780 -13.273 7.000 1.00 0.00 C ATOM 1821 O ILE A 123 2.636 -14.330 6.389 1.00 0.00 O ATOM 1822 CB ILE A 123 4.719 -13.254 8.569 1.00 0.00 C ATOM 1823 CG1 ILE A 123 5.728 -12.286 9.194 1.00 0.00 C ATOM 1824 CG2 ILE A 123 5.360 -14.616 8.338 1.00 0.00 C ATOM 1825 CD1 ILE A 123 6.924 -12.007 8.312 1.00 0.00 C ATOM 0 H ILE A 123 3.876 -10.822 8.149 1.00 0.00 H new ATOM 0 HA ILE A 123 4.827 -12.981 6.426 1.00 0.00 H new ATOM 0 HB ILE A 123 3.887 -13.373 9.264 1.00 0.00 H new ATOM 0 HG12 ILE A 123 5.225 -11.345 9.419 1.00 0.00 H new ATOM 0 HG13 ILE A 123 6.074 -12.697 10.142 1.00 0.00 H new ATOM 0 HG21 ILE A 123 5.745 -15.002 9.282 1.00 0.00 H new ATOM 0 HG22 ILE A 123 4.615 -15.306 7.941 1.00 0.00 H new ATOM 0 HG23 ILE A 123 6.179 -14.517 7.626 1.00 0.00 H new ATOM 0 HD11 ILE A 123 7.596 -11.314 8.819 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.451 -12.939 8.108 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.589 -11.566 7.373 1.00 0.00 H new ATOM 1837 N SER A 124 1.765 -12.578 7.504 1.00 0.00 N ATOM 1838 CA SER A 124 0.373 -13.014 7.378 1.00 0.00 C ATOM 1839 C SER A 124 0.056 -13.581 5.993 1.00 0.00 C ATOM 1840 O SER A 124 -0.809 -14.447 5.858 1.00 0.00 O ATOM 1841 CB SER A 124 -0.572 -11.848 7.687 1.00 0.00 C ATOM 1842 OG SER A 124 0.152 -10.665 7.981 1.00 0.00 O ATOM 0 H SER A 124 1.880 -11.700 8.010 1.00 0.00 H new ATOM 0 HA SER A 124 0.225 -13.818 8.099 1.00 0.00 H new ATOM 0 HB2 SER A 124 -1.229 -11.673 6.835 1.00 0.00 H new ATOM 0 HB3 SER A 124 -1.209 -12.107 8.533 1.00 0.00 H new ATOM 0 HG SER A 124 0.719 -10.815 8.766 1.00 0.00 H new ATOM 1848 N PHE A 125 0.736 -13.084 4.967 1.00 0.00 N ATOM 1849 CA PHE A 125 0.492 -13.545 3.604 1.00 0.00 C ATOM 1850 C PHE A 125 1.340 -14.762 3.247 1.00 0.00 C ATOM 1851 O PHE A 125 0.824 -15.873 3.124 1.00 0.00 O ATOM 1852 CB PHE A 125 0.761 -12.419 2.607 1.00 0.00 C ATOM 1853 CG PHE A 125 0.370 -12.758 1.197 1.00 0.00 C ATOM 1854 CD1 PHE A 125 -0.906 -13.215 0.909 1.00 0.00 C ATOM 1855 CD2 PHE A 125 1.278 -12.621 0.160 1.00 0.00 C ATOM 1856 CE1 PHE A 125 -1.269 -13.529 -0.388 1.00 0.00 C ATOM 1857 CE2 PHE A 125 0.921 -12.933 -1.138 1.00 0.00 C ATOM 1858 CZ PHE A 125 -0.354 -13.387 -1.412 1.00 0.00 C ATOM 0 H PHE A 125 1.456 -12.367 5.050 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.555 -13.842 3.549 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.217 -11.529 2.922 1.00 0.00 H new ATOM 0 HB3 PHE A 125 1.822 -12.170 2.631 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -1.625 -13.327 1.707 1.00 0.00 H new ATOM 0 HD2 PHE A 125 2.277 -12.266 0.368 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -2.267 -13.885 -0.599 1.00 0.00 H new ATOM 0 HE2 PHE A 125 1.639 -12.822 -1.937 1.00 0.00 H new ATOM 0 HZ PHE A 125 -0.635 -13.631 -2.426 1.00 0.00 H new ATOM 1868 N ILE A 126 2.639 -14.544 3.063 1.00 0.00 N ATOM 1869 CA ILE A 126 3.553 -15.628 2.697 1.00 0.00 C ATOM 1870 C ILE A 126 3.331 -16.865 3.563 1.00 0.00 C ATOM 1871 O ILE A 126 3.328 -17.986 3.059 1.00 0.00 O ATOM 1872 CB ILE A 126 5.044 -15.217 2.783 1.00 0.00 C ATOM 1873 CG1 ILE A 126 5.227 -13.703 2.604 1.00 0.00 C ATOM 1874 CG2 ILE A 126 5.852 -15.972 1.734 1.00 0.00 C ATOM 1875 CD1 ILE A 126 4.582 -13.152 1.351 1.00 0.00 C ATOM 0 H ILE A 126 3.084 -13.631 3.160 1.00 0.00 H new ATOM 0 HA ILE A 126 3.323 -15.860 1.657 1.00 0.00 H new ATOM 0 HB ILE A 126 5.406 -15.477 3.778 1.00 0.00 H new ATOM 0 HG12 ILE A 126 4.809 -13.191 3.471 1.00 0.00 H new ATOM 0 HG13 ILE A 126 6.293 -13.476 2.582 1.00 0.00 H new ATOM 0 HG21 ILE A 126 6.899 -15.678 1.800 1.00 0.00 H new ATOM 0 HG22 ILE A 126 5.764 -17.044 1.909 1.00 0.00 H new ATOM 0 HG23 ILE A 126 5.471 -15.735 0.741 1.00 0.00 H new ATOM 0 HD11 ILE A 126 4.755 -12.077 1.295 1.00 0.00 H new ATOM 0 HD12 ILE A 126 5.016 -13.635 0.476 1.00 0.00 H new ATOM 0 HD13 ILE A 126 3.510 -13.346 1.378 1.00 0.00 H new ATOM 1887 N ASN A 127 3.141 -16.659 4.865 1.00 0.00 N ATOM 1888 CA ASN A 127 2.916 -17.771 5.789 1.00 0.00 C ATOM 1889 C ASN A 127 1.908 -18.763 5.216 1.00 0.00 C ATOM 1890 O ASN A 127 2.023 -19.971 5.423 1.00 0.00 O ATOM 1891 CB ASN A 127 2.425 -17.254 7.142 1.00 0.00 C ATOM 1892 CG ASN A 127 3.552 -17.078 8.138 1.00 0.00 C ATOM 1893 OD1 ASN A 127 4.726 -17.226 7.797 1.00 0.00 O ATOM 1894 ND2 ASN A 127 3.202 -16.762 9.379 1.00 0.00 N ATOM 0 H ASN A 127 3.138 -15.738 5.303 1.00 0.00 H new ATOM 0 HA ASN A 127 3.867 -18.285 5.929 1.00 0.00 H new ATOM 0 HB2 ASN A 127 1.917 -16.300 7.000 1.00 0.00 H new ATOM 0 HB3 ASN A 127 1.690 -17.949 7.548 1.00 0.00 H new ATOM 0 HD21 ASN A 127 3.918 -16.632 10.094 1.00 0.00 H new ATOM 0 HD22 ASN A 127 2.217 -16.649 9.618 1.00 0.00 H new ATOM 1901 N HIS A 128 0.923 -18.244 4.490 1.00 0.00 N ATOM 1902 CA HIS A 128 -0.102 -19.082 3.882 1.00 0.00 C ATOM 1903 C HIS A 128 0.278 -19.457 2.453 1.00 0.00 C ATOM 1904 O HIS A 128 0.206 -20.624 2.067 1.00 0.00 O ATOM 1905 CB HIS A 128 -1.452 -18.365 3.894 1.00 0.00 C ATOM 1906 CG HIS A 128 -1.994 -18.130 5.270 1.00 0.00 C ATOM 1907 ND1 HIS A 128 -3.116 -18.768 5.757 1.00 0.00 N ATOM 1908 CD2 HIS A 128 -1.561 -17.323 6.268 1.00 0.00 C ATOM 1909 CE1 HIS A 128 -3.350 -18.362 6.992 1.00 0.00 C ATOM 1910 NE2 HIS A 128 -2.421 -17.487 7.326 1.00 0.00 N ATOM 0 H HIS A 128 0.814 -17.246 4.309 1.00 0.00 H new ATOM 0 HA HIS A 128 -0.182 -19.997 4.468 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -1.350 -17.407 3.384 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -2.172 -18.953 3.325 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -0.700 -16.672 6.237 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -4.164 -18.691 7.621 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -2.353 -17.009 8.225 1.00 0.00 H new ATOM 1919 N ARG A 129 0.684 -18.460 1.671 1.00 0.00 N ATOM 1920 CA ARG A 129 1.076 -18.686 0.283 1.00 0.00 C ATOM 1921 C ARG A 129 2.179 -19.735 0.193 1.00 0.00 C ATOM 1922 O ARG A 129 2.225 -20.523 -0.751 1.00 0.00 O ATOM 1923 CB ARG A 129 1.546 -17.376 -0.354 1.00 0.00 C ATOM 1924 CG ARG A 129 1.070 -17.191 -1.786 1.00 0.00 C ATOM 1925 CD ARG A 129 -0.421 -16.898 -1.842 1.00 0.00 C ATOM 1926 NE ARG A 129 -0.969 -17.102 -3.181 1.00 0.00 N ATOM 1927 CZ ARG A 129 -1.271 -18.296 -3.686 1.00 0.00 C ATOM 1928 NH1 ARG A 129 -1.080 -19.395 -2.966 1.00 0.00 N ATOM 1929 NH2 ARG A 129 -1.765 -18.391 -4.912 1.00 0.00 N ATOM 0 H ARG A 129 0.750 -17.489 1.975 1.00 0.00 H new ATOM 0 HA ARG A 129 0.206 -19.055 -0.260 1.00 0.00 H new ATOM 0 HB2 ARG A 129 1.191 -16.540 0.249 1.00 0.00 H new ATOM 0 HB3 ARG A 129 2.635 -17.343 -0.335 1.00 0.00 H new ATOM 0 HG2 ARG A 129 1.621 -16.373 -2.251 1.00 0.00 H new ATOM 0 HG3 ARG A 129 1.287 -18.090 -2.362 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -0.944 -17.542 -1.134 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -0.600 -15.869 -1.530 1.00 0.00 H new ATOM 0 HE ARG A 129 -1.130 -16.280 -3.764 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -0.700 -19.327 -2.022 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -1.313 -20.308 -3.357 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -1.914 -17.549 -5.469 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -1.996 -19.306 -5.299 1.00 0.00 H new ATOM 1943 N ILE A 130 3.061 -19.741 1.186 1.00 0.00 N ATOM 1944 CA ILE A 130 4.162 -20.696 1.230 1.00 0.00 C ATOM 1945 C ILE A 130 3.640 -22.130 1.187 1.00 0.00 C ATOM 1946 O ILE A 130 3.793 -22.829 0.185 1.00 0.00 O ATOM 1947 CB ILE A 130 5.017 -20.503 2.502 1.00 0.00 C ATOM 1948 CG1 ILE A 130 5.716 -19.145 2.479 1.00 0.00 C ATOM 1949 CG2 ILE A 130 6.040 -21.623 2.645 1.00 0.00 C ATOM 1950 CD1 ILE A 130 5.860 -18.524 3.851 1.00 0.00 C ATOM 0 H ILE A 130 3.035 -19.093 1.973 1.00 0.00 H new ATOM 0 HA ILE A 130 4.784 -20.513 0.354 1.00 0.00 H new ATOM 0 HB ILE A 130 4.351 -20.537 3.364 1.00 0.00 H new ATOM 0 HG12 ILE A 130 6.704 -19.260 2.034 1.00 0.00 H new ATOM 0 HG13 ILE A 130 5.155 -18.466 1.837 1.00 0.00 H new ATOM 0 HG21 ILE A 130 6.629 -21.464 3.548 1.00 0.00 H new ATOM 0 HG22 ILE A 130 5.524 -22.581 2.712 1.00 0.00 H new ATOM 0 HG23 ILE A 130 6.700 -21.626 1.777 1.00 0.00 H new ATOM 0 HD11 ILE A 130 6.364 -17.562 3.764 1.00 0.00 H new ATOM 0 HD12 ILE A 130 4.873 -18.378 4.290 1.00 0.00 H new ATOM 0 HD13 ILE A 130 6.447 -19.184 4.490 1.00 0.00 H new