USER MOD reduce.3.24.130724 H: found=0, std=0, add=872, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 870 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: B 2 LYS NZ :NH3+ 168:sc= 0.467 (180deg=0.393) USER MOD Set 1.2: B 35 ASN : amide:sc= -0.0672 X(o=0.4,f=0.38) USER MOD Set 2.1: B 31 ASN : amide:sc= -0.0372 X(o=-0.14,f=-0.33) USER MOD Set 2.2: B 32 LYS NZ :NH3+ -168:sc= -0.102 (180deg=-0.385) USER MOD Set 3.1: A 2 LYS NZ :NH3+ 168:sc= 0.473 (180deg=0.396) USER MOD Set 3.2: A 35 ASN : amide:sc= -0.0395 X(o=0.43,f=0.37) USER MOD Set 4.1: A 31 ASN : amide:sc= -0.0253 X(o=-0.13,f=-0.32) USER MOD Set 4.2: A 32 LYS NZ :NH3+ -167:sc= -0.102 (180deg=-0.38) USER MOD Single : A 1 MET CE :methyl 147:sc= -3.27 (180deg=-6.72!) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ -112:sc= 0.094 (180deg=0) USER MOD Single : A 8 ASN : amide:sc= 0.199 K(o=0.2,f=-11!) USER MOD Single : A 9 HIS : no HD1:sc= -0.698 X(o=-0.7,f=-0.37) USER MOD Single : A 10 ASN : amide:sc= -1.09 K(o=-1.1,f=-8.3!) USER MOD Single : A 15 LYS NZ :NH3+ -169:sc= -0.11 (180deg=-0.293) USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00534) USER MOD Single : A 33 LYS NZ :NH3+ 136:sc= 0.29 (180deg=-0.247) USER MOD Single : A 34 LYS NZ :NH3+ -172:sc= 0.602 (180deg=0.553) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 176:sc= -0.0605 (180deg=-0.101) USER MOD Single : A 45 LYS NZ :NH3+ -163:sc= 0.165 (180deg=0.0527) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 147:sc= -3.23 (180deg=-6.6!) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 LYS NZ :NH3+ -111:sc= 0.0918 (180deg=0) USER MOD Single : B 8 ASN : amide:sc= 0.118 K(o=0.12,f=-12!) USER MOD Single : B 9 HIS : no HD1:sc= -0.729 X(o=-0.73,f=-0.41) USER MOD Single : B 10 ASN : amide:sc= -1.03 K(o=-1,f=-8.3!) USER MOD Single : B 15 LYS NZ :NH3+ -168:sc= -0.113 (180deg=-0.285) USER MOD Single : B 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 21 LYS NZ :NH3+ -131:sc= 0 (180deg=-0.0097) USER MOD Single : B 33 LYS NZ :NH3+ 136:sc= 0.298 (180deg=-0.247) USER MOD Single : B 34 LYS NZ :NH3+ -171:sc= 0.589 (180deg=0.528) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 LYS NZ :NH3+ 143:sc= 0 (180deg=-1.06) USER MOD Single : B 45 LYS NZ :NH3+ -164:sc= 0.163 (180deg=0.0542) USER MOD Single : B 46 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.887 16.161 7.761 1.00 0.00 N ATOM 2 CA MET A 1 -9.836 14.677 7.608 1.00 0.00 C ATOM 3 C MET A 1 -10.291 14.295 6.193 1.00 0.00 C ATOM 4 O MET A 1 -11.386 13.804 5.987 1.00 0.00 O ATOM 5 CB MET A 1 -10.752 14.026 8.649 1.00 0.00 C ATOM 6 CG MET A 1 -9.909 13.497 9.810 1.00 0.00 C ATOM 7 SD MET A 1 -10.901 13.485 11.326 1.00 0.00 S ATOM 8 CE MET A 1 -11.963 12.081 10.905 1.00 0.00 C ATOM 0 H1 MET A 1 -9.579 16.422 8.719 1.00 0.00 H new ATOM 0 H2 MET A 1 -9.257 16.604 7.062 1.00 0.00 H new ATOM 0 H3 MET A 1 -10.861 16.492 7.608 1.00 0.00 H new ATOM 0 HA MET A 1 -8.816 14.325 7.762 1.00 0.00 H new ATOM 0 HB2 MET A 1 -11.479 14.752 9.014 1.00 0.00 H new ATOM 0 HB3 MET A 1 -11.316 13.212 8.194 1.00 0.00 H new ATOM 0 HG2 MET A 1 -9.556 12.490 9.587 1.00 0.00 H new ATOM 0 HG3 MET A 1 -9.026 14.122 9.946 1.00 0.00 H new ATOM 0 HE1 MET A 1 -12.218 11.533 11.812 1.00 0.00 H new ATOM 0 HE2 MET A 1 -12.875 12.444 10.432 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.436 11.420 10.217 1.00 0.00 H new ATOM 20 N LYS A 2 -9.446 14.523 5.219 1.00 0.00 N ATOM 21 CA LYS A 2 -9.795 14.189 3.811 1.00 0.00 C ATOM 22 C LYS A 2 -9.503 12.714 3.540 1.00 0.00 C ATOM 23 O LYS A 2 -8.825 12.047 4.301 1.00 0.00 O ATOM 24 CB LYS A 2 -8.965 15.052 2.861 1.00 0.00 C ATOM 25 CG LYS A 2 -9.540 16.468 2.827 1.00 0.00 C ATOM 26 CD LYS A 2 -8.562 17.404 2.112 1.00 0.00 C ATOM 27 CE LYS A 2 -9.247 18.744 1.831 1.00 0.00 C ATOM 28 NZ LYS A 2 -9.727 18.774 0.420 1.00 0.00 N ATOM 0 H LYS A 2 -8.520 14.931 5.345 1.00 0.00 H new ATOM 0 HA LYS A 2 -10.856 14.382 3.650 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -7.926 15.078 3.189 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -8.972 14.621 1.860 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -10.501 16.469 2.313 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -9.721 16.822 3.842 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -7.676 17.559 2.727 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -8.227 16.952 1.178 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -10.085 18.886 2.514 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -8.550 19.564 2.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -10.363 19.586 0.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -8.913 18.862 -0.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -10.240 17.894 0.209 1.00 0.00 H new ATOM 42 N ILE A 3 -10.012 12.213 2.450 1.00 0.00 N ATOM 43 CA ILE A 3 -9.787 10.782 2.089 1.00 0.00 C ATOM 44 C ILE A 3 -8.589 10.683 1.142 1.00 0.00 C ATOM 45 O ILE A 3 -8.688 10.964 -0.038 1.00 0.00 O ATOM 46 CB ILE A 3 -11.046 10.215 1.416 1.00 0.00 C ATOM 47 CG1 ILE A 3 -12.204 10.216 2.422 1.00 0.00 C ATOM 48 CG2 ILE A 3 -10.783 8.779 0.950 1.00 0.00 C ATOM 49 CD1 ILE A 3 -13.537 10.087 1.680 1.00 0.00 C ATOM 0 H ILE A 3 -10.581 12.738 1.785 1.00 0.00 H new ATOM 0 HA ILE A 3 -9.580 10.203 2.989 1.00 0.00 H new ATOM 0 HB ILE A 3 -11.303 10.833 0.556 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -12.088 9.391 3.125 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -12.190 11.137 3.005 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -11.679 8.381 0.473 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -9.959 8.773 0.236 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -10.523 8.160 1.809 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -14.356 10.088 2.400 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -13.655 10.927 0.995 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -13.551 9.154 1.116 1.00 0.00 H new ATOM 61 N LYS A 4 -7.458 10.276 1.663 1.00 0.00 N ATOM 62 CA LYS A 4 -6.237 10.136 0.821 1.00 0.00 C ATOM 63 C LYS A 4 -6.370 8.879 -0.040 1.00 0.00 C ATOM 64 O LYS A 4 -6.002 8.869 -1.200 1.00 0.00 O ATOM 65 CB LYS A 4 -5.008 10.007 1.726 1.00 0.00 C ATOM 66 CG LYS A 4 -3.747 10.383 0.945 1.00 0.00 C ATOM 67 CD LYS A 4 -2.513 10.092 1.802 1.00 0.00 C ATOM 68 CE LYS A 4 -1.260 10.612 1.094 1.00 0.00 C ATOM 69 NZ LYS A 4 -0.049 10.207 1.863 1.00 0.00 N ATOM 0 H LYS A 4 -7.331 10.033 2.645 1.00 0.00 H new ATOM 0 HA LYS A 4 -6.125 11.012 0.182 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -5.115 10.656 2.595 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -4.925 8.986 2.099 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -3.699 9.816 0.015 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -3.775 11.438 0.674 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -2.615 10.568 2.777 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -2.425 9.020 1.978 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -1.210 10.213 0.081 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -1.303 11.698 1.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 0.398 11.050 2.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -0.324 9.553 2.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 0.624 9.734 1.227 1.00 0.00 H new ATOM 83 N ARG A 5 -6.899 7.820 0.530 1.00 0.00 N ATOM 84 CA ARG A 5 -7.069 6.550 -0.234 1.00 0.00 C ATOM 85 C ARG A 5 -8.374 5.860 0.180 1.00 0.00 C ATOM 86 O ARG A 5 -8.990 6.210 1.172 1.00 0.00 O ATOM 87 CB ARG A 5 -5.898 5.609 0.063 1.00 0.00 C ATOM 88 CG ARG A 5 -4.589 6.208 -0.459 1.00 0.00 C ATOM 89 CD ARG A 5 -3.406 5.516 0.222 1.00 0.00 C ATOM 90 NE ARG A 5 -2.669 6.501 1.064 1.00 0.00 N ATOM 91 CZ ARG A 5 -1.421 6.783 0.800 1.00 0.00 C ATOM 92 NH1 ARG A 5 -1.132 7.686 -0.100 1.00 0.00 N ATOM 93 NH2 ARG A 5 -0.463 6.160 1.434 1.00 0.00 N ATOM 0 H ARG A 5 -7.221 7.785 1.497 1.00 0.00 H new ATOM 0 HA ARG A 5 -7.099 6.783 -1.298 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -5.824 5.437 1.137 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -6.074 4.640 -0.404 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -4.525 6.083 -1.540 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -4.562 7.279 -0.260 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -3.760 4.689 0.837 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -2.739 5.092 -0.528 1.00 0.00 H new ATOM 0 HE ARG A 5 -3.139 6.955 1.847 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -1.881 8.170 -0.596 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -0.158 7.907 -0.307 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -0.690 5.454 2.134 1.00 0.00 H new ATOM 0 HH22 ARG A 5 0.512 6.380 1.228 1.00 0.00 H new ATOM 107 N ILE A 6 -8.787 4.871 -0.575 1.00 0.00 N ATOM 108 CA ILE A 6 -10.039 4.129 -0.245 1.00 0.00 C ATOM 109 C ILE A 6 -9.713 2.639 -0.117 1.00 0.00 C ATOM 110 O ILE A 6 -9.265 2.006 -1.057 1.00 0.00 O ATOM 111 CB ILE A 6 -11.079 4.335 -1.353 1.00 0.00 C ATOM 112 CG1 ILE A 6 -11.285 5.835 -1.602 1.00 0.00 C ATOM 113 CG2 ILE A 6 -12.410 3.706 -0.930 1.00 0.00 C ATOM 114 CD1 ILE A 6 -10.519 6.259 -2.858 1.00 0.00 C ATOM 0 H ILE A 6 -8.304 4.545 -1.412 1.00 0.00 H new ATOM 0 HA ILE A 6 -10.447 4.502 0.694 1.00 0.00 H new ATOM 0 HB ILE A 6 -10.723 3.862 -2.268 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -12.347 6.051 -1.721 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -10.938 6.407 -0.742 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -13.149 3.853 -1.718 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -12.270 2.639 -0.758 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -12.760 4.178 -0.012 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -10.667 7.325 -3.032 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -9.456 6.058 -2.721 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -10.887 5.696 -3.716 1.00 0.00 H new ATOM 126 N LEU A 7 -9.939 2.083 1.045 1.00 0.00 N ATOM 127 CA LEU A 7 -9.657 0.638 1.268 1.00 0.00 C ATOM 128 C LEU A 7 -10.829 -0.181 0.724 1.00 0.00 C ATOM 129 O LEU A 7 -10.648 -1.135 -0.011 1.00 0.00 O ATOM 130 CB LEU A 7 -9.482 0.388 2.764 1.00 0.00 C ATOM 131 CG LEU A 7 -8.296 1.214 3.266 1.00 0.00 C ATOM 132 CD1 LEU A 7 -8.456 1.501 4.760 1.00 0.00 C ATOM 133 CD2 LEU A 7 -6.996 0.445 3.035 1.00 0.00 C ATOM 0 H LEU A 7 -10.311 2.576 1.857 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.743 0.343 0.752 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -10.389 0.664 3.302 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -9.310 -0.672 2.952 1.00 0.00 H new ATOM 0 HG LEU A 7 -8.264 2.156 2.718 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -7.608 2.089 5.110 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -9.378 2.058 4.927 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -8.496 0.560 5.309 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -6.154 1.037 3.394 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.032 -0.501 3.576 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -6.874 0.249 1.970 1.00 0.00 H new ATOM 145 N ASN A 8 -12.030 0.218 1.062 1.00 0.00 N ATOM 146 CA ASN A 8 -13.249 -0.485 0.556 1.00 0.00 C ATOM 147 C ASN A 8 -14.473 0.429 0.767 1.00 0.00 C ATOM 148 O ASN A 8 -14.338 1.640 0.810 1.00 0.00 O ATOM 149 CB ASN A 8 -13.426 -1.847 1.259 1.00 0.00 C ATOM 150 CG ASN A 8 -13.527 -1.675 2.774 1.00 0.00 C ATOM 151 OD1 ASN A 8 -14.526 -1.219 3.280 1.00 0.00 O ATOM 152 ND2 ASN A 8 -12.538 -2.049 3.530 1.00 0.00 N ATOM 0 H ASN A 8 -12.220 1.011 1.675 1.00 0.00 H new ATOM 0 HA ASN A 8 -13.142 -0.691 -0.509 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -14.324 -2.339 0.885 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -12.584 -2.496 1.019 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -12.608 -1.957 4.543 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -11.692 -2.435 3.110 1.00 0.00 H new ATOM 159 N HIS A 9 -15.660 -0.122 0.883 1.00 0.00 N ATOM 160 CA HIS A 9 -16.875 0.737 1.073 1.00 0.00 C ATOM 161 C HIS A 9 -16.993 1.215 2.534 1.00 0.00 C ATOM 162 O HIS A 9 -17.872 1.992 2.863 1.00 0.00 O ATOM 163 CB HIS A 9 -18.127 -0.064 0.700 1.00 0.00 C ATOM 164 CG HIS A 9 -18.917 0.694 -0.332 1.00 0.00 C ATOM 165 ND1 HIS A 9 -19.406 1.971 -0.100 1.00 0.00 N ATOM 166 CD2 HIS A 9 -19.307 0.370 -1.608 1.00 0.00 C ATOM 167 CE1 HIS A 9 -20.054 2.365 -1.211 1.00 0.00 C ATOM 168 NE2 HIS A 9 -20.024 1.427 -2.162 1.00 0.00 N ATOM 0 H HIS A 9 -15.840 -1.126 0.854 1.00 0.00 H new ATOM 0 HA HIS A 9 -16.782 1.612 0.430 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -17.844 -1.042 0.311 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -18.738 -0.238 1.586 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -19.090 -0.563 -2.106 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -20.540 3.323 -1.321 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -20.437 1.475 -3.093 1.00 0.00 H new ATOM 176 N ASN A 10 -16.133 0.747 3.409 1.00 0.00 N ATOM 177 CA ASN A 10 -16.201 1.147 4.842 1.00 0.00 C ATOM 178 C ASN A 10 -14.851 1.685 5.325 1.00 0.00 C ATOM 179 O ASN A 10 -14.800 2.585 6.142 1.00 0.00 O ATOM 180 CB ASN A 10 -16.574 -0.075 5.687 1.00 0.00 C ATOM 181 CG ASN A 10 -17.560 -0.970 4.924 1.00 0.00 C ATOM 182 OD1 ASN A 10 -18.701 -0.605 4.719 1.00 0.00 O ATOM 183 ND2 ASN A 10 -17.164 -2.137 4.491 1.00 0.00 N ATOM 0 H ASN A 10 -15.380 0.097 3.183 1.00 0.00 H new ATOM 0 HA ASN A 10 -16.951 1.931 4.946 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -15.676 -0.641 5.936 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -17.019 0.247 6.628 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -17.812 -2.739 3.982 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -16.207 -2.446 4.661 1.00 0.00 H new ATOM 190 N ALA A 11 -13.762 1.132 4.851 1.00 0.00 N ATOM 191 CA ALA A 11 -12.427 1.598 5.309 1.00 0.00 C ATOM 192 C ALA A 11 -11.810 2.550 4.285 1.00 0.00 C ATOM 193 O ALA A 11 -11.922 2.356 3.087 1.00 0.00 O ATOM 194 CB ALA A 11 -11.510 0.391 5.506 1.00 0.00 C ATOM 0 H ALA A 11 -13.745 0.377 4.166 1.00 0.00 H new ATOM 0 HA ALA A 11 -12.544 2.131 6.252 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -10.530 0.730 5.842 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -11.940 -0.274 6.254 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -11.405 -0.144 4.562 1.00 0.00 H new ATOM 200 N ILE A 12 -11.153 3.578 4.763 1.00 0.00 N ATOM 201 CA ILE A 12 -10.504 4.568 3.856 1.00 0.00 C ATOM 202 C ILE A 12 -9.276 5.169 4.551 1.00 0.00 C ATOM 203 O ILE A 12 -9.273 5.379 5.751 1.00 0.00 O ATOM 204 CB ILE A 12 -11.494 5.690 3.518 1.00 0.00 C ATOM 205 CG1 ILE A 12 -12.291 6.074 4.772 1.00 0.00 C ATOM 206 CG2 ILE A 12 -12.458 5.220 2.425 1.00 0.00 C ATOM 207 CD1 ILE A 12 -12.848 7.489 4.617 1.00 0.00 C ATOM 0 H ILE A 12 -11.039 3.773 5.758 1.00 0.00 H new ATOM 0 HA ILE A 12 -10.198 4.066 2.938 1.00 0.00 H new ATOM 0 HB ILE A 12 -10.939 6.558 3.162 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -13.106 5.367 4.927 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -11.650 6.020 5.652 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -13.159 6.021 2.189 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -11.893 4.957 1.531 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -13.009 4.348 2.776 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -13.413 7.757 5.510 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -12.025 8.191 4.484 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -13.503 7.529 3.747 1.00 0.00 H new ATOM 219 N VAL A 13 -8.238 5.456 3.803 1.00 0.00 N ATOM 220 CA VAL A 13 -7.013 6.054 4.408 1.00 0.00 C ATOM 221 C VAL A 13 -7.147 7.577 4.379 1.00 0.00 C ATOM 222 O VAL A 13 -7.179 8.183 3.326 1.00 0.00 O ATOM 223 CB VAL A 13 -5.770 5.633 3.613 1.00 0.00 C ATOM 224 CG1 VAL A 13 -4.510 6.077 4.360 1.00 0.00 C ATOM 225 CG2 VAL A 13 -5.749 4.109 3.444 1.00 0.00 C ATOM 0 H VAL A 13 -8.189 5.300 2.796 1.00 0.00 H new ATOM 0 HA VAL A 13 -6.905 5.705 5.435 1.00 0.00 H new ATOM 0 HB VAL A 13 -5.799 6.104 2.630 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.627 5.778 3.795 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -4.518 7.161 4.474 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -4.487 5.609 5.344 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -4.864 3.818 2.879 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -5.725 3.634 4.425 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -6.643 3.790 2.908 1.00 0.00 H new ATOM 235 N VAL A 14 -7.234 8.195 5.529 1.00 0.00 N ATOM 236 CA VAL A 14 -7.376 9.679 5.582 1.00 0.00 C ATOM 237 C VAL A 14 -6.099 10.307 6.158 1.00 0.00 C ATOM 238 O VAL A 14 -5.187 9.618 6.576 1.00 0.00 O ATOM 239 CB VAL A 14 -8.580 10.052 6.463 1.00 0.00 C ATOM 240 CG1 VAL A 14 -9.865 9.499 5.838 1.00 0.00 C ATOM 241 CG2 VAL A 14 -8.406 9.461 7.867 1.00 0.00 C ATOM 0 H VAL A 14 -7.213 7.732 6.438 1.00 0.00 H new ATOM 0 HA VAL A 14 -7.535 10.059 4.573 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.643 11.138 6.534 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -10.717 9.764 6.464 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -9.998 9.925 4.844 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -9.795 8.414 5.762 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.263 9.730 8.484 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.335 8.375 7.799 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -7.496 9.857 8.318 1.00 0.00 H new ATOM 251 N LYS A 15 -6.039 11.615 6.180 1.00 0.00 N ATOM 252 CA LYS A 15 -4.840 12.320 6.727 1.00 0.00 C ATOM 253 C LYS A 15 -5.268 13.218 7.889 1.00 0.00 C ATOM 254 O LYS A 15 -6.366 13.748 7.907 1.00 0.00 O ATOM 255 CB LYS A 15 -4.196 13.178 5.635 1.00 0.00 C ATOM 256 CG LYS A 15 -3.770 12.291 4.461 1.00 0.00 C ATOM 257 CD LYS A 15 -3.546 13.159 3.220 1.00 0.00 C ATOM 258 CE LYS A 15 -2.053 13.463 3.069 1.00 0.00 C ATOM 259 NZ LYS A 15 -1.813 14.148 1.766 1.00 0.00 N ATOM 0 H LYS A 15 -6.777 12.230 5.839 1.00 0.00 H new ATOM 0 HA LYS A 15 -4.118 11.582 7.076 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -4.900 13.936 5.293 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -3.331 13.705 6.037 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -2.856 11.753 4.711 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -4.536 11.542 4.261 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -3.914 12.644 2.333 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -4.110 14.088 3.307 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -1.715 14.094 3.891 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -1.476 12.539 3.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -0.791 14.187 1.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -2.285 13.621 1.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -2.195 15.114 1.806 1.00 0.00 H new ATOM 273 N ASP A 16 -4.406 13.385 8.858 1.00 0.00 N ATOM 274 CA ASP A 16 -4.741 14.238 10.033 1.00 0.00 C ATOM 275 C ASP A 16 -3.529 15.092 10.429 1.00 0.00 C ATOM 276 O ASP A 16 -2.471 15.010 9.826 1.00 0.00 O ATOM 277 CB ASP A 16 -5.140 13.337 11.206 1.00 0.00 C ATOM 278 CG ASP A 16 -6.648 13.067 11.160 1.00 0.00 C ATOM 279 OD1 ASP A 16 -7.051 12.175 10.431 1.00 0.00 O ATOM 280 OD2 ASP A 16 -7.375 13.757 11.858 1.00 0.00 O ATOM 0 H ASP A 16 -3.478 12.963 8.884 1.00 0.00 H new ATOM 0 HA ASP A 16 -5.568 14.900 9.775 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -4.591 12.397 11.158 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -4.875 13.813 12.150 1.00 0.00 H new ATOM 285 N GLN A 17 -3.685 15.908 11.444 1.00 0.00 N ATOM 286 CA GLN A 17 -2.567 16.781 11.915 1.00 0.00 C ATOM 287 C GLN A 17 -1.358 15.926 12.278 1.00 0.00 C ATOM 288 O GLN A 17 -0.231 16.261 11.959 1.00 0.00 O ATOM 289 CB GLN A 17 -3.019 17.558 13.154 1.00 0.00 C ATOM 290 CG GLN A 17 -3.246 19.028 12.790 1.00 0.00 C ATOM 291 CD GLN A 17 -4.585 19.177 12.061 1.00 0.00 C ATOM 292 OE1 GLN A 17 -4.626 19.237 10.848 1.00 0.00 O ATOM 293 NE2 GLN A 17 -5.691 19.238 12.754 1.00 0.00 N ATOM 0 H GLN A 17 -4.552 16.006 11.972 1.00 0.00 H new ATOM 0 HA GLN A 17 -2.295 17.474 11.119 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -3.938 17.126 13.550 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -2.266 17.480 13.938 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -3.241 19.641 13.691 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -2.434 19.386 12.157 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -5.658 19.188 13.772 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -6.587 19.336 12.277 1.00 0.00 H new ATOM 302 N ASN A 18 -1.591 14.830 12.950 1.00 0.00 N ATOM 303 CA ASN A 18 -0.469 13.938 13.355 1.00 0.00 C ATOM 304 C ASN A 18 0.253 13.399 12.114 1.00 0.00 C ATOM 305 O ASN A 18 1.459 13.518 12.001 1.00 0.00 O ATOM 306 CB ASN A 18 -1.010 12.769 14.183 1.00 0.00 C ATOM 307 CG ASN A 18 -1.494 13.279 15.543 1.00 0.00 C ATOM 308 OD1 ASN A 18 -0.708 13.459 16.453 1.00 0.00 O ATOM 309 ND2 ASN A 18 -2.766 13.519 15.724 1.00 0.00 N ATOM 0 H ASN A 18 -2.517 14.514 13.237 1.00 0.00 H new ATOM 0 HA ASN A 18 0.237 14.511 13.955 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -1.830 12.284 13.653 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -0.232 12.018 14.321 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -3.098 13.857 16.627 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -3.427 13.369 14.962 1.00 0.00 H new ATOM 316 N GLU A 19 -0.473 12.810 11.184 1.00 0.00 N ATOM 317 CA GLU A 19 0.172 12.260 9.949 1.00 0.00 C ATOM 318 C GLU A 19 -0.902 11.622 9.056 1.00 0.00 C ATOM 319 O GLU A 19 -1.514 12.289 8.241 1.00 0.00 O ATOM 320 CB GLU A 19 1.236 11.218 10.346 1.00 0.00 C ATOM 321 CG GLU A 19 1.875 10.608 9.091 1.00 0.00 C ATOM 322 CD GLU A 19 2.128 9.113 9.317 1.00 0.00 C ATOM 323 OE1 GLU A 19 3.187 8.780 9.827 1.00 0.00 O ATOM 324 OE2 GLU A 19 1.260 8.325 8.977 1.00 0.00 O ATOM 0 H GLU A 19 -1.485 12.689 11.231 1.00 0.00 H new ATOM 0 HA GLU A 19 0.659 13.062 9.395 1.00 0.00 H new ATOM 0 HB2 GLU A 19 2.003 11.687 10.962 1.00 0.00 H new ATOM 0 HB3 GLU A 19 0.779 10.433 10.949 1.00 0.00 H new ATOM 0 HG2 GLU A 19 1.220 10.750 8.231 1.00 0.00 H new ATOM 0 HG3 GLU A 19 2.813 11.116 8.865 1.00 0.00 H new ATOM 331 N GLU A 20 -1.128 10.341 9.205 1.00 0.00 N ATOM 332 CA GLU A 20 -2.150 9.641 8.379 1.00 0.00 C ATOM 333 C GLU A 20 -3.048 8.796 9.286 1.00 0.00 C ATOM 334 O GLU A 20 -2.586 8.162 10.219 1.00 0.00 O ATOM 335 CB GLU A 20 -1.445 8.738 7.369 1.00 0.00 C ATOM 336 CG GLU A 20 -2.374 8.467 6.181 1.00 0.00 C ATOM 337 CD GLU A 20 -1.645 7.613 5.138 1.00 0.00 C ATOM 338 OE1 GLU A 20 -1.568 6.410 5.333 1.00 0.00 O ATOM 339 OE2 GLU A 20 -1.178 8.175 4.160 1.00 0.00 O ATOM 0 H GLU A 20 -0.639 9.746 9.874 1.00 0.00 H new ATOM 0 HA GLU A 20 -2.761 10.373 7.850 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -0.526 9.211 7.024 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -1.161 7.798 7.843 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -3.274 7.954 6.520 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -2.693 9.409 5.735 1.00 0.00 H new ATOM 346 N LYS A 21 -4.329 8.785 9.011 1.00 0.00 N ATOM 347 CA LYS A 21 -5.280 7.989 9.837 1.00 0.00 C ATOM 348 C LYS A 21 -6.066 7.025 8.939 1.00 0.00 C ATOM 349 O LYS A 21 -5.993 7.084 7.724 1.00 0.00 O ATOM 350 CB LYS A 21 -6.255 8.934 10.545 1.00 0.00 C ATOM 351 CG LYS A 21 -5.573 9.554 11.766 1.00 0.00 C ATOM 352 CD LYS A 21 -6.626 9.898 12.822 1.00 0.00 C ATOM 353 CE LYS A 21 -6.075 10.967 13.769 1.00 0.00 C ATOM 354 NZ LYS A 21 -6.901 11.009 15.010 1.00 0.00 N ATOM 0 H LYS A 21 -4.757 9.300 8.241 1.00 0.00 H new ATOM 0 HA LYS A 21 -4.721 7.417 10.578 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -6.580 9.717 9.860 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -7.148 8.389 10.852 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -4.842 8.859 12.179 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -5.029 10.452 11.474 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -7.535 10.259 12.340 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -6.897 9.004 13.384 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -5.037 10.747 14.018 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -6.085 11.941 13.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -6.505 11.712 15.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -7.878 11.272 14.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -6.897 10.072 15.462 1.00 0.00 H new ATOM 368 N ILE A 22 -6.822 6.145 9.540 1.00 0.00 N ATOM 369 CA ILE A 22 -7.637 5.167 8.764 1.00 0.00 C ATOM 370 C ILE A 22 -9.074 5.216 9.286 1.00 0.00 C ATOM 371 O ILE A 22 -9.324 4.981 10.457 1.00 0.00 O ATOM 372 CB ILE A 22 -7.063 3.754 8.945 1.00 0.00 C ATOM 373 CG1 ILE A 22 -5.798 3.596 8.091 1.00 0.00 C ATOM 374 CG2 ILE A 22 -8.104 2.709 8.523 1.00 0.00 C ATOM 375 CD1 ILE A 22 -6.150 3.670 6.604 1.00 0.00 C ATOM 0 H ILE A 22 -6.910 6.062 10.553 1.00 0.00 H new ATOM 0 HA ILE A 22 -7.616 5.418 7.704 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.811 3.604 9.995 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -5.081 4.378 8.342 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -5.319 2.642 8.311 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -7.690 1.709 8.654 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -8.997 2.816 9.139 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -8.366 2.859 7.476 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -5.244 3.557 6.009 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -6.849 2.872 6.355 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.608 4.635 6.386 1.00 0.00 H new ATOM 387 N LEU A 23 -10.019 5.527 8.435 1.00 0.00 N ATOM 388 CA LEU A 23 -11.434 5.600 8.891 1.00 0.00 C ATOM 389 C LEU A 23 -12.164 4.302 8.535 1.00 0.00 C ATOM 390 O LEU A 23 -12.400 4.009 7.376 1.00 0.00 O ATOM 391 CB LEU A 23 -12.138 6.788 8.218 1.00 0.00 C ATOM 392 CG LEU A 23 -13.011 7.559 9.228 1.00 0.00 C ATOM 393 CD1 LEU A 23 -13.385 6.674 10.425 1.00 0.00 C ATOM 394 CD2 LEU A 23 -12.247 8.791 9.720 1.00 0.00 C ATOM 0 H LEU A 23 -9.869 5.732 7.447 1.00 0.00 H new ATOM 0 HA LEU A 23 -11.451 5.737 9.972 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.395 7.459 7.788 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -12.758 6.430 7.396 1.00 0.00 H new ATOM 0 HG LEU A 23 -13.931 7.863 8.729 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -14.001 7.244 11.121 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -13.943 5.805 10.075 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -12.478 6.343 10.931 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.861 9.339 10.435 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.322 8.477 10.203 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -12.013 9.436 8.873 1.00 0.00 H new ATOM 406 N LEU A 24 -12.530 3.530 9.530 1.00 0.00 N ATOM 407 CA LEU A 24 -13.257 2.253 9.274 1.00 0.00 C ATOM 408 C LEU A 24 -14.721 2.423 9.698 1.00 0.00 C ATOM 409 O LEU A 24 -15.079 2.184 10.837 1.00 0.00 O ATOM 410 CB LEU A 24 -12.613 1.110 10.077 1.00 0.00 C ATOM 411 CG LEU A 24 -11.088 1.145 9.926 1.00 0.00 C ATOM 412 CD1 LEU A 24 -10.456 0.173 10.925 1.00 0.00 C ATOM 413 CD2 LEU A 24 -10.703 0.732 8.504 1.00 0.00 C ATOM 0 H LEU A 24 -12.354 3.734 10.514 1.00 0.00 H new ATOM 0 HA LEU A 24 -13.204 2.008 8.213 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -12.883 1.199 11.129 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -12.997 0.151 9.729 1.00 0.00 H new ATOM 0 HG LEU A 24 -10.728 2.155 10.120 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -9.371 0.196 10.819 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -10.728 0.466 11.939 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -10.818 -0.836 10.729 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.618 0.758 8.399 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -11.063 -0.278 8.308 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -11.153 1.422 7.790 1.00 0.00 H new ATOM 425 N GLY A 25 -15.564 2.840 8.783 1.00 0.00 N ATOM 426 CA GLY A 25 -17.007 3.035 9.108 1.00 0.00 C ATOM 427 C GLY A 25 -17.857 2.348 8.041 1.00 0.00 C ATOM 428 O GLY A 25 -17.725 2.627 6.867 1.00 0.00 O ATOM 0 H GLY A 25 -15.309 3.054 7.819 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -17.230 2.620 10.091 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -17.243 4.098 9.149 1.00 0.00 H new ATOM 432 N ALA A 26 -18.714 1.443 8.446 1.00 0.00 N ATOM 433 CA ALA A 26 -19.578 0.708 7.473 1.00 0.00 C ATOM 434 C ALA A 26 -20.364 1.693 6.598 1.00 0.00 C ATOM 435 O ALA A 26 -21.379 2.235 6.999 1.00 0.00 O ATOM 436 CB ALA A 26 -20.555 -0.192 8.229 1.00 0.00 C ATOM 0 H ALA A 26 -18.852 1.180 9.422 1.00 0.00 H new ATOM 0 HA ALA A 26 -18.939 0.101 6.832 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -21.183 -0.726 7.516 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -19.997 -0.910 8.831 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -21.182 0.417 8.880 1.00 0.00 H new ATOM 442 N GLY A 27 -19.889 1.909 5.401 1.00 0.00 N ATOM 443 CA GLY A 27 -20.573 2.836 4.452 1.00 0.00 C ATOM 444 C GLY A 27 -19.886 4.210 4.424 1.00 0.00 C ATOM 445 O GLY A 27 -20.378 5.129 3.794 1.00 0.00 O ATOM 0 H GLY A 27 -19.042 1.475 5.034 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -20.569 2.404 3.451 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -21.617 2.954 4.744 1.00 0.00 H new ATOM 449 N ILE A 28 -18.761 4.364 5.090 1.00 0.00 N ATOM 450 CA ILE A 28 -18.053 5.671 5.091 1.00 0.00 C ATOM 451 C ILE A 28 -17.645 6.030 3.655 1.00 0.00 C ATOM 452 O ILE A 28 -17.739 7.175 3.249 1.00 0.00 O ATOM 453 CB ILE A 28 -16.828 5.563 6.013 1.00 0.00 C ATOM 454 CG1 ILE A 28 -16.683 6.855 6.802 1.00 0.00 C ATOM 455 CG2 ILE A 28 -15.548 5.312 5.207 1.00 0.00 C ATOM 456 CD1 ILE A 28 -16.094 6.545 8.177 1.00 0.00 C ATOM 0 H ILE A 28 -18.307 3.630 5.634 1.00 0.00 H new ATOM 0 HA ILE A 28 -18.702 6.463 5.463 1.00 0.00 H new ATOM 0 HB ILE A 28 -16.976 4.721 6.689 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -16.038 7.551 6.266 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -17.654 7.339 6.910 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -14.699 5.240 5.886 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -15.646 4.381 4.649 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -15.388 6.136 4.512 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -15.989 7.470 8.745 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -16.757 5.864 8.712 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -15.116 6.080 8.057 1.00 0.00 H new ATOM 468 N ALA A 29 -17.217 5.054 2.880 1.00 0.00 N ATOM 469 CA ALA A 29 -16.831 5.327 1.462 1.00 0.00 C ATOM 470 C ALA A 29 -18.064 5.847 0.721 1.00 0.00 C ATOM 471 O ALA A 29 -17.974 6.759 -0.082 1.00 0.00 O ATOM 472 CB ALA A 29 -16.333 4.040 0.799 1.00 0.00 C ATOM 0 H ALA A 29 -17.120 4.082 3.173 1.00 0.00 H new ATOM 0 HA ALA A 29 -16.031 6.067 1.428 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -16.054 4.247 -0.234 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -15.465 3.664 1.341 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -17.125 3.291 0.817 1.00 0.00 H new ATOM 478 N PHE A 30 -19.222 5.293 1.017 1.00 0.00 N ATOM 479 CA PHE A 30 -20.473 5.769 0.370 1.00 0.00 C ATOM 480 C PHE A 30 -20.763 7.180 0.885 1.00 0.00 C ATOM 481 O PHE A 30 -20.557 7.475 2.051 1.00 0.00 O ATOM 482 CB PHE A 30 -21.633 4.834 0.733 1.00 0.00 C ATOM 483 CG PHE A 30 -22.859 5.207 -0.069 1.00 0.00 C ATOM 484 CD1 PHE A 30 -23.004 4.749 -1.384 1.00 0.00 C ATOM 485 CD2 PHE A 30 -23.851 6.013 0.505 1.00 0.00 C ATOM 486 CE1 PHE A 30 -24.139 5.097 -2.125 1.00 0.00 C ATOM 487 CE2 PHE A 30 -24.986 6.360 -0.237 1.00 0.00 C ATOM 488 CZ PHE A 30 -25.130 5.903 -1.551 1.00 0.00 C ATOM 0 H PHE A 30 -19.345 4.530 1.682 1.00 0.00 H new ATOM 0 HA PHE A 30 -20.361 5.777 -0.714 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -21.356 3.799 0.531 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -21.849 4.904 1.799 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -22.240 4.127 -1.827 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -23.740 6.366 1.519 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -24.251 4.744 -3.140 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -25.751 6.981 0.205 1.00 0.00 H new ATOM 0 HZ PHE A 30 -26.006 6.172 -2.123 1.00 0.00 H new ATOM 498 N ASN A 31 -21.219 8.053 0.022 1.00 0.00 N ATOM 499 CA ASN A 31 -21.512 9.463 0.436 1.00 0.00 C ATOM 500 C ASN A 31 -20.192 10.212 0.685 1.00 0.00 C ATOM 501 O ASN A 31 -20.121 11.114 1.500 1.00 0.00 O ATOM 502 CB ASN A 31 -22.368 9.460 1.711 1.00 0.00 C ATOM 503 CG ASN A 31 -23.126 10.785 1.831 1.00 0.00 C ATOM 504 OD1 ASN A 31 -22.778 11.627 2.635 1.00 0.00 O ATOM 505 ND2 ASN A 31 -24.157 11.007 1.060 1.00 0.00 N ATOM 0 H ASN A 31 -21.403 7.849 -0.960 1.00 0.00 H new ATOM 0 HA ASN A 31 -22.062 9.968 -0.358 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -23.073 8.629 1.685 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -21.734 9.313 2.585 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -24.669 11.886 1.133 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -24.450 10.301 0.385 1.00 0.00 H new ATOM 512 N LYS A 32 -19.153 9.842 -0.025 1.00 0.00 N ATOM 513 CA LYS A 32 -17.825 10.514 0.139 1.00 0.00 C ATOM 514 C LYS A 32 -16.894 10.111 -1.016 1.00 0.00 C ATOM 515 O LYS A 32 -17.185 9.197 -1.769 1.00 0.00 O ATOM 516 CB LYS A 32 -17.198 10.096 1.474 1.00 0.00 C ATOM 517 CG LYS A 32 -16.788 11.345 2.262 1.00 0.00 C ATOM 518 CD LYS A 32 -17.805 11.611 3.376 1.00 0.00 C ATOM 519 CE LYS A 32 -18.511 12.947 3.123 1.00 0.00 C ATOM 520 NZ LYS A 32 -19.763 13.013 3.932 1.00 0.00 N ATOM 0 H LYS A 32 -19.169 9.095 -0.719 1.00 0.00 H new ATOM 0 HA LYS A 32 -17.965 11.595 0.128 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -17.909 9.506 2.052 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -16.328 9.464 1.297 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -15.795 11.207 2.689 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -16.732 12.205 1.595 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -18.536 10.804 3.414 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -17.302 11.632 4.343 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -17.852 13.774 3.387 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -18.745 13.051 2.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -20.348 13.807 3.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -20.292 12.124 3.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -19.522 13.154 4.934 1.00 0.00 H new ATOM 534 N LYS A 33 -15.778 10.790 -1.164 1.00 0.00 N ATOM 535 CA LYS A 33 -14.829 10.453 -2.272 1.00 0.00 C ATOM 536 C LYS A 33 -13.404 10.904 -1.913 1.00 0.00 C ATOM 537 O LYS A 33 -13.174 11.527 -0.892 1.00 0.00 O ATOM 538 CB LYS A 33 -15.281 11.154 -3.561 1.00 0.00 C ATOM 539 CG LYS A 33 -15.377 12.666 -3.329 1.00 0.00 C ATOM 540 CD LYS A 33 -15.415 13.391 -4.678 1.00 0.00 C ATOM 541 CE LYS A 33 -14.032 13.969 -4.993 1.00 0.00 C ATOM 542 NZ LYS A 33 -13.170 12.911 -5.599 1.00 0.00 N ATOM 0 H LYS A 33 -15.485 11.562 -0.565 1.00 0.00 H new ATOM 0 HA LYS A 33 -14.828 9.373 -2.420 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -14.575 10.945 -4.365 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -16.249 10.764 -3.877 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -16.273 12.900 -2.754 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -14.524 13.009 -2.744 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -15.719 12.700 -5.465 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -16.156 14.190 -4.652 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -14.127 14.811 -5.679 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -13.570 14.350 -4.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -12.655 13.306 -6.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -12.489 12.570 -4.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -13.764 12.119 -5.917 1.00 0.00 H new ATOM 556 N LYS A 34 -12.448 10.589 -2.760 1.00 0.00 N ATOM 557 CA LYS A 34 -11.028 10.983 -2.504 1.00 0.00 C ATOM 558 C LYS A 34 -10.922 12.503 -2.391 1.00 0.00 C ATOM 559 O LYS A 34 -11.451 13.235 -3.207 1.00 0.00 O ATOM 560 CB LYS A 34 -10.147 10.488 -3.659 1.00 0.00 C ATOM 561 CG LYS A 34 -8.688 10.402 -3.199 1.00 0.00 C ATOM 562 CD LYS A 34 -7.931 11.653 -3.654 1.00 0.00 C ATOM 563 CE LYS A 34 -6.652 11.810 -2.826 1.00 0.00 C ATOM 564 NZ LYS A 34 -6.919 12.697 -1.657 1.00 0.00 N ATOM 0 H LYS A 34 -12.596 10.070 -3.626 1.00 0.00 H new ATOM 0 HA LYS A 34 -10.692 10.533 -1.570 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -10.490 9.510 -3.997 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -10.231 11.166 -4.509 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -8.643 10.312 -2.114 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -8.218 9.510 -3.612 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -7.683 11.575 -4.713 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.562 12.534 -3.538 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -6.306 10.835 -2.484 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -5.858 12.232 -3.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -6.024 12.913 -1.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.357 13.581 -1.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -7.563 12.216 -0.996 1.00 0.00 H new ATOM 578 N ASN A 35 -10.240 12.962 -1.366 1.00 0.00 N ATOM 579 CA ASN A 35 -10.054 14.429 -1.122 1.00 0.00 C ATOM 580 C ASN A 35 -11.243 15.000 -0.333 1.00 0.00 C ATOM 581 O ASN A 35 -11.159 16.087 0.209 1.00 0.00 O ATOM 582 CB ASN A 35 -9.899 15.186 -2.449 1.00 0.00 C ATOM 583 CG ASN A 35 -9.169 16.511 -2.206 1.00 0.00 C ATOM 584 OD1 ASN A 35 -9.730 17.570 -2.407 1.00 0.00 O ATOM 585 ND2 ASN A 35 -7.934 16.500 -1.780 1.00 0.00 N ATOM 0 H ASN A 35 -9.793 12.364 -0.671 1.00 0.00 H new ATOM 0 HA ASN A 35 -9.144 14.560 -0.536 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -9.342 14.578 -3.162 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -10.879 15.375 -2.888 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -7.443 17.379 -1.617 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -7.461 15.612 -1.610 1.00 0.00 H new ATOM 592 N ASP A 36 -12.342 14.281 -0.250 1.00 0.00 N ATOM 593 CA ASP A 36 -13.517 14.785 0.515 1.00 0.00 C ATOM 594 C ASP A 36 -13.338 14.442 1.996 1.00 0.00 C ATOM 595 O ASP A 36 -12.728 13.446 2.344 1.00 0.00 O ATOM 596 CB ASP A 36 -14.797 14.130 -0.013 1.00 0.00 C ATOM 597 CG ASP A 36 -16.013 14.971 0.386 1.00 0.00 C ATOM 598 OD1 ASP A 36 -16.378 15.850 -0.378 1.00 0.00 O ATOM 599 OD2 ASP A 36 -16.561 14.721 1.448 1.00 0.00 O ATOM 0 H ASP A 36 -12.469 13.366 -0.682 1.00 0.00 H new ATOM 0 HA ASP A 36 -13.593 15.866 0.396 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -14.748 14.037 -1.098 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -14.893 13.122 0.389 1.00 0.00 H new ATOM 604 N ILE A 37 -13.871 15.261 2.865 1.00 0.00 N ATOM 605 CA ILE A 37 -13.746 15.000 4.330 1.00 0.00 C ATOM 606 C ILE A 37 -14.564 13.758 4.695 1.00 0.00 C ATOM 607 O ILE A 37 -15.606 13.497 4.123 1.00 0.00 O ATOM 608 CB ILE A 37 -14.264 16.203 5.130 1.00 0.00 C ATOM 609 CG1 ILE A 37 -13.636 17.502 4.597 1.00 0.00 C ATOM 610 CG2 ILE A 37 -13.903 16.032 6.610 1.00 0.00 C ATOM 611 CD1 ILE A 37 -12.115 17.467 4.783 1.00 0.00 C ATOM 0 H ILE A 37 -14.390 16.104 2.621 1.00 0.00 H new ATOM 0 HA ILE A 37 -12.696 14.838 4.573 1.00 0.00 H new ATOM 0 HB ILE A 37 -15.347 16.259 5.022 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -13.878 17.626 3.541 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -14.055 18.360 5.123 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -14.272 16.888 7.176 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -14.360 15.119 6.993 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -12.820 15.967 6.715 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -11.681 18.391 4.402 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -11.880 17.365 5.843 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -11.701 16.620 4.237 1.00 0.00 H new ATOM 623 N VAL A 38 -14.091 12.996 5.646 1.00 0.00 N ATOM 624 CA VAL A 38 -14.820 11.764 6.070 1.00 0.00 C ATOM 625 C VAL A 38 -16.042 12.144 6.907 1.00 0.00 C ATOM 626 O VAL A 38 -15.983 13.015 7.760 1.00 0.00 O ATOM 627 CB VAL A 38 -13.894 10.856 6.896 1.00 0.00 C ATOM 628 CG1 VAL A 38 -13.495 11.550 8.201 1.00 0.00 C ATOM 629 CG2 VAL A 38 -14.627 9.555 7.229 1.00 0.00 C ATOM 0 H VAL A 38 -13.223 13.176 6.151 1.00 0.00 H new ATOM 0 HA VAL A 38 -15.144 11.226 5.179 1.00 0.00 H new ATOM 0 HB VAL A 38 -12.997 10.645 6.314 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -12.840 10.895 8.775 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -12.972 12.479 7.974 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -14.389 11.770 8.784 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -13.973 8.909 7.815 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -15.525 9.780 7.804 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -14.906 9.048 6.305 1.00 0.00 H new ATOM 639 N ASP A 39 -17.144 11.478 6.676 1.00 0.00 N ATOM 640 CA ASP A 39 -18.378 11.762 7.457 1.00 0.00 C ATOM 641 C ASP A 39 -18.156 11.267 8.892 1.00 0.00 C ATOM 642 O ASP A 39 -17.797 10.121 9.091 1.00 0.00 O ATOM 643 CB ASP A 39 -19.563 11.022 6.828 1.00 0.00 C ATOM 644 CG ASP A 39 -20.877 11.572 7.391 1.00 0.00 C ATOM 645 OD1 ASP A 39 -21.403 12.508 6.812 1.00 0.00 O ATOM 646 OD2 ASP A 39 -21.337 11.046 8.392 1.00 0.00 O ATOM 0 H ASP A 39 -17.239 10.745 5.974 1.00 0.00 H new ATOM 0 HA ASP A 39 -18.593 12.831 7.457 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -19.543 11.140 5.745 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -19.487 9.954 7.034 1.00 0.00 H new ATOM 651 N PRO A 40 -18.360 12.145 9.847 1.00 0.00 N ATOM 652 CA PRO A 40 -18.167 11.821 11.274 1.00 0.00 C ATOM 653 C PRO A 40 -19.264 10.877 11.775 1.00 0.00 C ATOM 654 O PRO A 40 -19.001 9.979 12.553 1.00 0.00 O ATOM 655 CB PRO A 40 -18.224 13.182 11.969 1.00 0.00 C ATOM 656 CG PRO A 40 -18.979 14.129 11.008 1.00 0.00 C ATOM 657 CD PRO A 40 -18.821 13.528 9.598 1.00 0.00 C ATOM 0 HA PRO A 40 -17.231 11.299 11.470 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -18.739 13.108 12.927 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -17.221 13.556 12.175 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -20.031 14.205 11.283 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -18.565 15.137 11.050 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -19.763 13.542 9.050 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -18.099 14.088 9.004 1.00 0.00 H new ATOM 665 N SER A 41 -20.484 11.054 11.316 1.00 0.00 N ATOM 666 CA SER A 41 -21.586 10.141 11.745 1.00 0.00 C ATOM 667 C SER A 41 -21.259 8.718 11.269 1.00 0.00 C ATOM 668 O SER A 41 -21.663 7.742 11.876 1.00 0.00 O ATOM 669 CB SER A 41 -22.910 10.600 11.126 1.00 0.00 C ATOM 670 OG SER A 41 -23.987 10.191 11.960 1.00 0.00 O ATOM 0 H SER A 41 -20.759 11.790 10.665 1.00 0.00 H new ATOM 0 HA SER A 41 -21.680 10.158 12.831 1.00 0.00 H new ATOM 0 HB2 SER A 41 -22.915 11.684 11.012 1.00 0.00 H new ATOM 0 HB3 SER A 41 -23.025 10.174 10.129 1.00 0.00 H new ATOM 0 HG SER A 41 -24.835 10.485 11.567 1.00 0.00 H new ATOM 676 N LYS A 42 -20.515 8.605 10.190 1.00 0.00 N ATOM 677 CA LYS A 42 -20.131 7.267 9.654 1.00 0.00 C ATOM 678 C LYS A 42 -18.834 6.781 10.325 1.00 0.00 C ATOM 679 O LYS A 42 -18.545 5.599 10.321 1.00 0.00 O ATOM 680 CB LYS A 42 -19.923 7.369 8.140 1.00 0.00 C ATOM 681 CG LYS A 42 -21.233 7.809 7.475 1.00 0.00 C ATOM 682 CD LYS A 42 -21.549 6.893 6.291 1.00 0.00 C ATOM 683 CE LYS A 42 -21.975 5.513 6.800 1.00 0.00 C ATOM 684 NZ LYS A 42 -22.975 4.922 5.865 1.00 0.00 N ATOM 0 H LYS A 42 -20.156 9.396 9.656 1.00 0.00 H new ATOM 0 HA LYS A 42 -20.926 6.553 9.867 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -19.131 8.084 7.918 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -19.604 6.406 7.740 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -22.047 7.776 8.199 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -21.150 8.841 7.135 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -22.344 7.328 5.685 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -20.673 6.799 5.649 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -21.106 4.860 6.880 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -22.402 5.599 7.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -23.213 3.958 6.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -23.835 5.507 5.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -22.576 4.889 4.905 1.00 0.00 H new ATOM 698 N ILE A 43 -18.054 7.680 10.903 1.00 0.00 N ATOM 699 CA ILE A 43 -16.780 7.266 11.579 1.00 0.00 C ATOM 700 C ILE A 43 -17.094 6.232 12.666 1.00 0.00 C ATOM 701 O ILE A 43 -17.662 6.547 13.697 1.00 0.00 O ATOM 702 CB ILE A 43 -16.100 8.488 12.217 1.00 0.00 C ATOM 703 CG1 ILE A 43 -15.501 9.375 11.120 1.00 0.00 C ATOM 704 CG2 ILE A 43 -14.982 8.022 13.160 1.00 0.00 C ATOM 705 CD1 ILE A 43 -14.957 10.667 11.736 1.00 0.00 C ATOM 0 H ILE A 43 -18.250 8.681 10.932 1.00 0.00 H new ATOM 0 HA ILE A 43 -16.108 6.831 10.839 1.00 0.00 H new ATOM 0 HB ILE A 43 -16.840 9.056 12.781 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -14.702 8.842 10.605 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -16.260 9.609 10.374 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -14.501 8.890 13.611 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -15.405 7.393 13.943 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -14.244 7.451 12.596 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -14.532 11.293 10.952 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -15.767 11.203 12.230 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -14.184 10.425 12.465 1.00 0.00 H new ATOM 717 N GLU A 44 -16.719 5.001 12.433 1.00 0.00 N ATOM 718 CA GLU A 44 -16.972 3.924 13.431 1.00 0.00 C ATOM 719 C GLU A 44 -15.656 3.558 14.125 1.00 0.00 C ATOM 720 O GLU A 44 -15.646 3.171 15.280 1.00 0.00 O ATOM 721 CB GLU A 44 -17.534 2.691 12.720 1.00 0.00 C ATOM 722 CG GLU A 44 -18.998 2.940 12.344 1.00 0.00 C ATOM 723 CD GLU A 44 -19.761 1.611 12.331 1.00 0.00 C ATOM 724 OE1 GLU A 44 -20.290 1.243 13.367 1.00 0.00 O ATOM 725 OE2 GLU A 44 -19.805 0.985 11.283 1.00 0.00 O ATOM 0 H GLU A 44 -16.243 4.695 11.584 1.00 0.00 H new ATOM 0 HA GLU A 44 -17.691 4.274 14.172 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -16.949 2.476 11.826 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -17.457 1.818 13.368 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -19.455 3.626 13.057 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -19.056 3.414 11.364 1.00 0.00 H new ATOM 732 N LYS A 45 -14.549 3.681 13.427 1.00 0.00 N ATOM 733 CA LYS A 45 -13.226 3.344 14.038 1.00 0.00 C ATOM 734 C LYS A 45 -12.133 4.234 13.432 1.00 0.00 C ATOM 735 O LYS A 45 -11.955 4.280 12.227 1.00 0.00 O ATOM 736 CB LYS A 45 -12.896 1.870 13.772 1.00 0.00 C ATOM 737 CG LYS A 45 -13.415 1.013 14.931 1.00 0.00 C ATOM 738 CD LYS A 45 -12.778 -0.378 14.871 1.00 0.00 C ATOM 739 CE LYS A 45 -12.478 -0.866 16.292 1.00 0.00 C ATOM 740 NZ LYS A 45 -12.960 -2.268 16.454 1.00 0.00 N ATOM 0 H LYS A 45 -14.508 4.001 12.459 1.00 0.00 H new ATOM 0 HA LYS A 45 -13.273 3.515 15.113 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -13.351 1.548 12.835 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -11.819 1.741 13.664 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -13.180 1.490 15.882 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -14.500 0.929 14.876 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -13.449 -1.075 14.370 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -11.859 -0.344 14.286 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -11.407 -0.815 16.486 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -12.965 -0.217 17.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -13.024 -2.498 17.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -13.899 -2.365 16.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -12.294 -2.920 15.992 1.00 0.00 H new ATOM 754 N THR A 46 -11.403 4.940 14.264 1.00 0.00 N ATOM 755 CA THR A 46 -10.318 5.832 13.758 1.00 0.00 C ATOM 756 C THR A 46 -8.953 5.212 14.087 1.00 0.00 C ATOM 757 O THR A 46 -8.595 5.051 15.241 1.00 0.00 O ATOM 758 CB THR A 46 -10.437 7.216 14.415 1.00 0.00 C ATOM 759 OG1 THR A 46 -11.725 7.760 14.151 1.00 0.00 O ATOM 760 CG2 THR A 46 -9.362 8.151 13.851 1.00 0.00 C ATOM 0 H THR A 46 -11.516 4.934 15.278 1.00 0.00 H new ATOM 0 HA THR A 46 -10.412 5.943 12.678 1.00 0.00 H new ATOM 0 HB THR A 46 -10.299 7.115 15.491 1.00 0.00 H new ATOM 0 HG1 THR A 46 -11.800 8.642 14.572 1.00 0.00 H new ATOM 0 HG21 THR A 46 -9.450 9.131 14.320 1.00 0.00 H new ATOM 0 HG22 THR A 46 -8.375 7.737 14.058 1.00 0.00 H new ATOM 0 HG23 THR A 46 -9.495 8.251 12.774 1.00 0.00 H new ATOM 768 N PHE A 47 -8.198 4.861 13.074 1.00 0.00 N ATOM 769 CA PHE A 47 -6.856 4.245 13.293 1.00 0.00 C ATOM 770 C PHE A 47 -5.755 5.225 12.873 1.00 0.00 C ATOM 771 O PHE A 47 -5.941 6.044 11.996 1.00 0.00 O ATOM 772 CB PHE A 47 -6.739 2.974 12.453 1.00 0.00 C ATOM 773 CG PHE A 47 -7.268 1.790 13.225 1.00 0.00 C ATOM 774 CD1 PHE A 47 -8.638 1.679 13.495 1.00 0.00 C ATOM 775 CD2 PHE A 47 -6.386 0.798 13.664 1.00 0.00 C ATOM 776 CE1 PHE A 47 -9.122 0.575 14.207 1.00 0.00 C ATOM 777 CE2 PHE A 47 -6.870 -0.304 14.375 1.00 0.00 C ATOM 778 CZ PHE A 47 -8.237 -0.417 14.647 1.00 0.00 C ATOM 0 H PHE A 47 -8.459 4.977 12.095 1.00 0.00 H new ATOM 0 HA PHE A 47 -6.743 4.005 14.350 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -7.297 3.091 11.524 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -5.697 2.804 12.180 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -9.320 2.444 13.154 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -5.330 0.883 13.454 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -10.178 0.488 14.417 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -6.187 -1.069 14.715 1.00 0.00 H new ATOM 0 HZ PHE A 47 -8.610 -1.269 15.196 1.00 0.00 H new ATOM 788 N ILE A 48 -4.612 5.144 13.505 1.00 0.00 N ATOM 789 CA ILE A 48 -3.481 6.060 13.163 1.00 0.00 C ATOM 790 C ILE A 48 -2.186 5.253 13.011 1.00 0.00 C ATOM 791 O ILE A 48 -1.916 4.345 13.778 1.00 0.00 O ATOM 792 CB ILE A 48 -3.303 7.100 14.275 1.00 0.00 C ATOM 793 CG1 ILE A 48 -4.630 7.270 15.031 1.00 0.00 C ATOM 794 CG2 ILE A 48 -2.871 8.435 13.657 1.00 0.00 C ATOM 795 CD1 ILE A 48 -4.602 8.549 15.861 1.00 0.00 C ATOM 0 H ILE A 48 -4.412 4.477 14.250 1.00 0.00 H new ATOM 0 HA ILE A 48 -3.705 6.566 12.224 1.00 0.00 H new ATOM 0 HB ILE A 48 -2.536 6.767 14.974 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -5.458 7.305 14.323 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -4.801 6.411 15.679 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -2.744 9.177 14.446 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -1.927 8.302 13.128 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -3.634 8.776 12.958 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -5.547 8.659 16.392 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -3.785 8.498 16.581 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -4.453 9.406 15.204 1.00 0.00 H new ATOM 807 N ARG A 49 -1.385 5.583 12.025 1.00 0.00 N ATOM 808 CA ARG A 49 -0.105 4.849 11.805 1.00 0.00 C ATOM 809 C ARG A 49 0.900 5.228 12.897 1.00 0.00 C ATOM 810 O ARG A 49 1.219 6.390 13.082 1.00 0.00 O ATOM 811 CB ARG A 49 0.469 5.223 10.436 1.00 0.00 C ATOM 812 CG ARG A 49 1.314 4.065 9.905 1.00 0.00 C ATOM 813 CD ARG A 49 2.074 4.515 8.655 1.00 0.00 C ATOM 814 NE ARG A 49 3.528 4.230 8.826 1.00 0.00 N ATOM 815 CZ ARG A 49 4.026 3.093 8.416 1.00 0.00 C ATOM 816 NH1 ARG A 49 4.448 2.971 7.185 1.00 0.00 N ATOM 817 NH2 ARG A 49 4.102 2.080 9.239 1.00 0.00 N ATOM 0 H ARG A 49 -1.568 6.335 11.361 1.00 0.00 H new ATOM 0 HA ARG A 49 -0.294 3.776 11.842 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -0.339 5.447 9.740 1.00 0.00 H new ATOM 0 HB3 ARG A 49 1.077 6.124 10.518 1.00 0.00 H new ATOM 0 HG2 ARG A 49 2.016 3.733 10.670 1.00 0.00 H new ATOM 0 HG3 ARG A 49 0.675 3.214 9.668 1.00 0.00 H new ATOM 0 HD2 ARG A 49 1.692 3.994 7.777 1.00 0.00 H new ATOM 0 HD3 ARG A 49 1.919 5.581 8.486 1.00 0.00 H new ATOM 0 HE ARG A 49 4.135 4.923 9.264 1.00 0.00 H new ATOM 0 HH11 ARG A 49 4.389 3.763 6.545 1.00 0.00 H new ATOM 0 HH12 ARG A 49 4.837 2.084 6.865 1.00 0.00 H new ATOM 0 HH21 ARG A 49 3.773 2.177 10.200 1.00 0.00 H new ATOM 0 HH22 ARG A 49 4.490 1.192 8.921 1.00 0.00 H new ATOM 928 N MET B 1 -0.079 -11.195 16.003 1.00 0.00 N ATOM 929 CA MET B 1 -0.773 -10.273 15.056 1.00 0.00 C ATOM 930 C MET B 1 -1.682 -11.088 14.127 1.00 0.00 C ATOM 931 O MET B 1 -1.384 -11.294 12.964 1.00 0.00 O ATOM 932 CB MET B 1 0.270 -9.509 14.234 1.00 0.00 C ATOM 933 CG MET B 1 0.432 -8.098 14.802 1.00 0.00 C ATOM 934 SD MET B 1 2.102 -7.489 14.452 1.00 0.00 S ATOM 935 CE MET B 1 1.885 -7.207 12.677 1.00 0.00 C ATOM 0 H1 MET B 1 0.538 -10.645 16.634 1.00 0.00 H new ATOM 0 H2 MET B 1 -0.785 -11.707 16.569 1.00 0.00 H new ATOM 0 H3 MET B 1 0.494 -11.877 15.466 1.00 0.00 H new ATOM 0 HA MET B 1 -1.380 -9.559 15.613 1.00 0.00 H new ATOM 0 HB2 MET B 1 1.225 -10.035 14.259 1.00 0.00 H new ATOM 0 HB3 MET B 1 -0.039 -9.459 13.190 1.00 0.00 H new ATOM 0 HG2 MET B 1 -0.309 -7.431 14.362 1.00 0.00 H new ATOM 0 HG3 MET B 1 0.255 -8.106 15.877 1.00 0.00 H new ATOM 0 HE1 MET B 1 2.487 -6.353 12.368 1.00 0.00 H new ATOM 0 HE2 MET B 1 2.202 -8.093 12.126 1.00 0.00 H new ATOM 0 HE3 MET B 1 0.835 -7.006 12.466 1.00 0.00 H new ATOM 947 N LYS B 2 -2.793 -11.550 14.643 1.00 0.00 N ATOM 948 CA LYS B 2 -3.741 -12.352 13.823 1.00 0.00 C ATOM 949 C LYS B 2 -4.656 -11.423 13.028 1.00 0.00 C ATOM 950 O LYS B 2 -4.741 -10.236 13.286 1.00 0.00 O ATOM 951 CB LYS B 2 -4.589 -13.234 14.740 1.00 0.00 C ATOM 952 CG LYS B 2 -3.754 -14.423 15.217 1.00 0.00 C ATOM 953 CD LYS B 2 -4.487 -15.146 16.348 1.00 0.00 C ATOM 954 CE LYS B 2 -3.800 -16.485 16.632 1.00 0.00 C ATOM 955 NZ LYS B 2 -4.538 -17.582 15.943 1.00 0.00 N ATOM 0 H LYS B 2 -3.084 -11.402 15.609 1.00 0.00 H new ATOM 0 HA LYS B 2 -3.175 -12.977 13.132 1.00 0.00 H new ATOM 0 HB2 LYS B 2 -4.941 -12.656 15.595 1.00 0.00 H new ATOM 0 HB3 LYS B 2 -5.473 -13.586 14.208 1.00 0.00 H new ATOM 0 HG2 LYS B 2 -3.575 -15.109 14.389 1.00 0.00 H new ATOM 0 HG3 LYS B 2 -2.779 -14.080 15.563 1.00 0.00 H new ATOM 0 HD2 LYS B 2 -4.489 -14.529 17.247 1.00 0.00 H new ATOM 0 HD3 LYS B 2 -5.529 -15.311 16.073 1.00 0.00 H new ATOM 0 HE2 LYS B 2 -2.767 -16.455 16.287 1.00 0.00 H new ATOM 0 HE3 LYS B 2 -3.772 -16.670 17.706 1.00 0.00 H new ATOM 0 HZ1 LYS B 2 -3.967 -18.451 15.964 1.00 0.00 H new ATOM 0 HZ2 LYS B 2 -5.443 -17.750 16.428 1.00 0.00 H new ATOM 0 HZ3 LYS B 2 -4.720 -17.311 14.955 1.00 0.00 H new ATOM 969 N ILE B 3 -5.342 -11.969 12.064 1.00 0.00 N ATOM 970 CA ILE B 3 -6.267 -11.152 11.225 1.00 0.00 C ATOM 971 C ILE B 3 -7.683 -11.246 11.797 1.00 0.00 C ATOM 972 O ILE B 3 -8.380 -12.225 11.606 1.00 0.00 O ATOM 973 CB ILE B 3 -6.242 -11.666 9.777 1.00 0.00 C ATOM 974 CG1 ILE B 3 -4.842 -11.451 9.187 1.00 0.00 C ATOM 975 CG2 ILE B 3 -7.268 -10.898 8.936 1.00 0.00 C ATOM 976 CD1 ILE B 3 -4.661 -12.333 7.949 1.00 0.00 C ATOM 0 H ILE B 3 -5.302 -12.958 11.817 1.00 0.00 H new ATOM 0 HA ILE B 3 -5.947 -10.110 11.232 1.00 0.00 H new ATOM 0 HB ILE B 3 -6.489 -12.728 9.767 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -4.706 -10.403 8.921 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -4.083 -11.692 9.931 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -7.246 -11.266 7.910 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -8.264 -11.045 9.353 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -7.024 -9.836 8.945 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -3.665 -12.177 7.533 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -4.778 -13.380 8.228 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -5.411 -12.071 7.203 1.00 0.00 H new ATOM 988 N LYS B 4 -8.107 -10.221 12.492 1.00 0.00 N ATOM 989 CA LYS B 4 -9.476 -10.211 13.081 1.00 0.00 C ATOM 990 C LYS B 4 -10.493 -9.961 11.967 1.00 0.00 C ATOM 991 O LYS B 4 -11.554 -10.558 11.938 1.00 0.00 O ATOM 992 CB LYS B 4 -9.573 -9.091 14.121 1.00 0.00 C ATOM 993 CG LYS B 4 -10.730 -9.375 15.082 1.00 0.00 C ATOM 994 CD LYS B 4 -10.923 -8.175 16.012 1.00 0.00 C ATOM 995 CE LYS B 4 -11.967 -8.514 17.079 1.00 0.00 C ATOM 996 NZ LYS B 4 -12.256 -7.301 17.896 1.00 0.00 N ATOM 0 H LYS B 4 -7.556 -9.383 12.677 1.00 0.00 H new ATOM 0 HA LYS B 4 -9.681 -11.168 13.560 1.00 0.00 H new ATOM 0 HB2 LYS B 4 -8.638 -9.015 14.676 1.00 0.00 H new ATOM 0 HB3 LYS B 4 -9.728 -8.133 13.624 1.00 0.00 H new ATOM 0 HG2 LYS B 4 -11.645 -9.566 14.521 1.00 0.00 H new ATOM 0 HG3 LYS B 4 -10.521 -10.272 15.665 1.00 0.00 H new ATOM 0 HD2 LYS B 4 -9.977 -7.913 16.485 1.00 0.00 H new ATOM 0 HD3 LYS B 4 -11.244 -7.306 15.438 1.00 0.00 H new ATOM 0 HE2 LYS B 4 -12.881 -8.874 16.607 1.00 0.00 H new ATOM 0 HE3 LYS B 4 -11.601 -9.317 17.718 1.00 0.00 H new ATOM 0 HZ1 LYS B 4 -11.885 -7.434 18.858 1.00 0.00 H new ATOM 0 HZ2 LYS B 4 -11.801 -6.473 17.461 1.00 0.00 H new ATOM 0 HZ3 LYS B 4 -13.284 -7.149 17.940 1.00 0.00 H new ATOM 1010 N ARG B 5 -10.167 -9.081 11.049 1.00 0.00 N ATOM 1011 CA ARG B 5 -11.098 -8.774 9.923 1.00 0.00 C ATOM 1012 C ARG B 5 -10.302 -8.529 8.636 1.00 0.00 C ATOM 1013 O ARG B 5 -9.095 -8.358 8.659 1.00 0.00 O ATOM 1014 CB ARG B 5 -11.906 -7.515 10.252 1.00 0.00 C ATOM 1015 CG ARG B 5 -12.815 -7.768 11.457 1.00 0.00 C ATOM 1016 CD ARG B 5 -13.261 -6.427 12.048 1.00 0.00 C ATOM 1017 NE ARG B 5 -12.706 -6.281 13.425 1.00 0.00 N ATOM 1018 CZ ARG B 5 -13.513 -6.177 14.447 1.00 0.00 C ATOM 1019 NH1 ARG B 5 -14.001 -7.253 15.007 1.00 0.00 N ATOM 1020 NH2 ARG B 5 -13.832 -4.996 14.909 1.00 0.00 N ATOM 0 H ARG B 5 -9.290 -8.561 11.034 1.00 0.00 H new ATOM 0 HA ARG B 5 -11.769 -9.621 9.782 1.00 0.00 H new ATOM 0 HB2 ARG B 5 -11.231 -6.686 10.465 1.00 0.00 H new ATOM 0 HB3 ARG B 5 -12.506 -7.224 9.390 1.00 0.00 H new ATOM 0 HG2 ARG B 5 -13.684 -8.352 11.155 1.00 0.00 H new ATOM 0 HG3 ARG B 5 -12.285 -8.352 12.210 1.00 0.00 H new ATOM 0 HD2 ARG B 5 -12.917 -5.607 11.417 1.00 0.00 H new ATOM 0 HD3 ARG B 5 -14.349 -6.374 12.076 1.00 0.00 H new ATOM 0 HE ARG B 5 -11.696 -6.262 13.569 1.00 0.00 H new ATOM 0 HH11 ARG B 5 -13.752 -8.174 14.646 1.00 0.00 H new ATOM 0 HH12 ARG B 5 -14.631 -7.172 15.805 1.00 0.00 H new ATOM 0 HH21 ARG B 5 -13.451 -4.157 14.471 1.00 0.00 H new ATOM 0 HH22 ARG B 5 -14.462 -4.914 15.707 1.00 0.00 H new ATOM 1034 N ILE B 6 -10.981 -8.499 7.516 1.00 0.00 N ATOM 1035 CA ILE B 6 -10.296 -8.253 6.213 1.00 0.00 C ATOM 1036 C ILE B 6 -10.944 -7.044 5.533 1.00 0.00 C ATOM 1037 O ILE B 6 -12.122 -7.050 5.220 1.00 0.00 O ATOM 1038 CB ILE B 6 -10.428 -9.484 5.308 1.00 0.00 C ATOM 1039 CG1 ILE B 6 -9.932 -10.732 6.051 1.00 0.00 C ATOM 1040 CG2 ILE B 6 -9.589 -9.284 4.043 1.00 0.00 C ATOM 1041 CD1 ILE B 6 -11.129 -11.535 6.566 1.00 0.00 C ATOM 0 H ILE B 6 -11.990 -8.636 7.450 1.00 0.00 H new ATOM 0 HA ILE B 6 -9.238 -8.059 6.389 1.00 0.00 H new ATOM 0 HB ILE B 6 -11.475 -9.616 5.037 1.00 0.00 H new ATOM 0 HG12 ILE B 6 -9.328 -11.348 5.385 1.00 0.00 H new ATOM 0 HG13 ILE B 6 -9.292 -10.441 6.884 1.00 0.00 H new ATOM 0 HG21 ILE B 6 -9.684 -10.160 3.401 1.00 0.00 H new ATOM 0 HG22 ILE B 6 -9.942 -8.402 3.508 1.00 0.00 H new ATOM 0 HG23 ILE B 6 -8.543 -9.147 4.318 1.00 0.00 H new ATOM 0 HD11 ILE B 6 -10.774 -12.420 7.093 1.00 0.00 H new ATOM 0 HD12 ILE B 6 -11.715 -10.918 7.247 1.00 0.00 H new ATOM 0 HD13 ILE B 6 -11.752 -11.839 5.725 1.00 0.00 H new ATOM 1053 N LEU B 7 -10.175 -6.012 5.305 1.00 0.00 N ATOM 1054 CA LEU B 7 -10.712 -4.789 4.646 1.00 0.00 C ATOM 1055 C LEU B 7 -10.739 -5.017 3.133 1.00 0.00 C ATOM 1056 O LEU B 7 -11.733 -4.773 2.474 1.00 0.00 O ATOM 1057 CB LEU B 7 -9.815 -3.603 4.988 1.00 0.00 C ATOM 1058 CG LEU B 7 -9.833 -3.394 6.503 1.00 0.00 C ATOM 1059 CD1 LEU B 7 -8.565 -2.660 6.943 1.00 0.00 C ATOM 1060 CD2 LEU B 7 -11.059 -2.570 6.895 1.00 0.00 C ATOM 0 H LEU B 7 -9.186 -5.966 5.551 1.00 0.00 H new ATOM 0 HA LEU B 7 -11.723 -4.580 4.996 1.00 0.00 H new ATOM 0 HB2 LEU B 7 -8.797 -3.788 4.644 1.00 0.00 H new ATOM 0 HB3 LEU B 7 -10.165 -2.705 4.479 1.00 0.00 H new ATOM 0 HG LEU B 7 -9.875 -4.366 6.995 1.00 0.00 H new ATOM 0 HD11 LEU B 7 -8.585 -2.515 8.023 1.00 0.00 H new ATOM 0 HD12 LEU B 7 -7.690 -3.251 6.672 1.00 0.00 H new ATOM 0 HD13 LEU B 7 -8.515 -1.690 6.447 1.00 0.00 H new ATOM 0 HD21 LEU B 7 -11.069 -2.423 7.975 1.00 0.00 H new ATOM 0 HD22 LEU B 7 -11.020 -1.601 6.397 1.00 0.00 H new ATOM 0 HD23 LEU B 7 -11.964 -3.097 6.593 1.00 0.00 H new ATOM 1072 N ASN B 8 -9.654 -5.519 2.596 1.00 0.00 N ATOM 1073 CA ASN B 8 -9.583 -5.818 1.133 1.00 0.00 C ATOM 1074 C ASN B 8 -8.385 -6.754 0.876 1.00 0.00 C ATOM 1075 O ASN B 8 -7.985 -7.499 1.755 1.00 0.00 O ATOM 1076 CB ASN B 8 -9.475 -4.515 0.313 1.00 0.00 C ATOM 1077 CG ASN B 8 -8.255 -3.698 0.740 1.00 0.00 C ATOM 1078 OD1 ASN B 8 -7.139 -4.048 0.434 1.00 0.00 O ATOM 1079 ND2 ASN B 8 -8.422 -2.600 1.415 1.00 0.00 N ATOM 0 H ASN B 8 -8.804 -5.737 3.117 1.00 0.00 H new ATOM 0 HA ASN B 8 -10.497 -6.318 0.812 1.00 0.00 H new ATOM 0 HB2 ASN B 8 -9.404 -4.754 -0.748 1.00 0.00 H new ATOM 0 HB3 ASN B 8 -10.379 -3.921 0.446 1.00 0.00 H new ATOM 0 HD21 ASN B 8 -7.614 -2.039 1.684 1.00 0.00 H new ATOM 0 HD22 ASN B 8 -9.361 -2.300 1.676 1.00 0.00 H new ATOM 1086 N HIS B 9 -7.818 -6.743 -0.309 1.00 0.00 N ATOM 1087 CA HIS B 9 -6.661 -7.652 -0.599 1.00 0.00 C ATOM 1088 C HIS B 9 -5.353 -7.087 -0.012 1.00 0.00 C ATOM 1089 O HIS B 9 -4.319 -7.729 -0.069 1.00 0.00 O ATOM 1090 CB HIS B 9 -6.508 -7.814 -2.116 1.00 0.00 C ATOM 1091 CG HIS B 9 -6.522 -9.277 -2.468 1.00 0.00 C ATOM 1092 ND1 HIS B 9 -5.597 -10.171 -1.952 1.00 0.00 N ATOM 1093 CD2 HIS B 9 -7.347 -10.017 -3.278 1.00 0.00 C ATOM 1094 CE1 HIS B 9 -5.886 -11.386 -2.452 1.00 0.00 C ATOM 1095 NE2 HIS B 9 -6.944 -11.348 -3.267 1.00 0.00 N ATOM 0 H HIS B 9 -8.105 -6.146 -1.085 1.00 0.00 H new ATOM 0 HA HIS B 9 -6.858 -8.619 -0.136 1.00 0.00 H new ATOM 0 HB2 HIS B 9 -7.318 -7.297 -2.631 1.00 0.00 H new ATOM 0 HB3 HIS B 9 -5.576 -7.358 -2.449 1.00 0.00 H new ATOM 0 HD2 HIS B 9 -8.183 -9.625 -3.839 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -5.330 -12.283 -2.222 1.00 0.00 H new ATOM 0 HE2 HIS B 9 -7.365 -12.127 -3.772 1.00 0.00 H new ATOM 1103 N ASN B 10 -5.385 -5.891 0.531 1.00 0.00 N ATOM 1104 CA ASN B 10 -4.154 -5.273 1.098 1.00 0.00 C ATOM 1105 C ASN B 10 -4.382 -4.826 2.544 1.00 0.00 C ATOM 1106 O ASN B 10 -3.483 -4.888 3.361 1.00 0.00 O ATOM 1107 CB ASN B 10 -3.777 -4.048 0.260 1.00 0.00 C ATOM 1108 CG ASN B 10 -4.101 -4.293 -1.221 1.00 0.00 C ATOM 1109 OD1 ASN B 10 -3.458 -5.090 -1.874 1.00 0.00 O ATOM 1110 ND2 ASN B 10 -5.082 -3.636 -1.779 1.00 0.00 N ATOM 0 H ASN B 10 -6.224 -5.315 0.603 1.00 0.00 H new ATOM 0 HA ASN B 10 -3.355 -6.015 1.080 1.00 0.00 H new ATOM 0 HB2 ASN B 10 -4.320 -3.173 0.618 1.00 0.00 H new ATOM 0 HB3 ASN B 10 -2.715 -3.833 0.376 1.00 0.00 H new ATOM 0 HD21 ASN B 10 -5.307 -3.793 -2.761 1.00 0.00 H new ATOM 0 HD22 ASN B 10 -5.623 -2.966 -1.232 1.00 0.00 H new ATOM 1117 N ALA B 11 -5.562 -4.355 2.864 1.00 0.00 N ATOM 1118 CA ALA B 11 -5.829 -3.880 4.247 1.00 0.00 C ATOM 1119 C ALA B 11 -6.572 -4.949 5.049 1.00 0.00 C ATOM 1120 O ALA B 11 -7.446 -5.629 4.543 1.00 0.00 O ATOM 1121 CB ALA B 11 -6.669 -2.605 4.189 1.00 0.00 C ATOM 0 H ALA B 11 -6.351 -4.281 2.222 1.00 0.00 H new ATOM 0 HA ALA B 11 -4.879 -3.675 4.740 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -6.867 -2.253 5.202 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -6.127 -1.837 3.638 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -7.613 -2.814 3.686 1.00 0.00 H new ATOM 1127 N ILE B 12 -6.221 -5.089 6.303 1.00 0.00 N ATOM 1128 CA ILE B 12 -6.883 -6.097 7.180 1.00 0.00 C ATOM 1129 C ILE B 12 -6.862 -5.602 8.633 1.00 0.00 C ATOM 1130 O ILE B 12 -5.913 -4.974 9.069 1.00 0.00 O ATOM 1131 CB ILE B 12 -6.138 -7.435 7.090 1.00 0.00 C ATOM 1132 CG1 ILE B 12 -4.625 -7.184 7.070 1.00 0.00 C ATOM 1133 CG2 ILE B 12 -6.551 -8.174 5.814 1.00 0.00 C ATOM 1134 CD1 ILE B 12 -3.886 -8.444 7.523 1.00 0.00 C ATOM 0 H ILE B 12 -5.494 -4.539 6.760 1.00 0.00 H new ATOM 0 HA ILE B 12 -7.913 -6.235 6.853 1.00 0.00 H new ATOM 0 HB ILE B 12 -6.392 -8.044 7.957 1.00 0.00 H new ATOM 0 HG12 ILE B 12 -4.306 -6.906 6.066 1.00 0.00 H new ATOM 0 HG13 ILE B 12 -4.377 -6.350 7.726 1.00 0.00 H new ATOM 0 HG21 ILE B 12 -6.019 -9.124 5.755 1.00 0.00 H new ATOM 0 HG22 ILE B 12 -7.625 -8.360 5.833 1.00 0.00 H new ATOM 0 HG23 ILE B 12 -6.304 -7.565 4.945 1.00 0.00 H new ATOM 0 HD11 ILE B 12 -2.812 -8.261 7.507 1.00 0.00 H new ATOM 0 HD12 ILE B 12 -4.195 -8.703 8.536 1.00 0.00 H new ATOM 0 HD13 ILE B 12 -4.124 -9.267 6.849 1.00 0.00 H new ATOM 1146 N VAL B 13 -7.895 -5.892 9.385 1.00 0.00 N ATOM 1147 CA VAL B 13 -7.938 -5.455 10.811 1.00 0.00 C ATOM 1148 C VAL B 13 -7.315 -6.550 11.678 1.00 0.00 C ATOM 1149 O VAL B 13 -7.839 -7.642 11.778 1.00 0.00 O ATOM 1150 CB VAL B 13 -9.390 -5.217 11.248 1.00 0.00 C ATOM 1151 CG1 VAL B 13 -9.407 -4.569 12.635 1.00 0.00 C ATOM 1152 CG2 VAL B 13 -10.092 -4.292 10.246 1.00 0.00 C ATOM 0 H VAL B 13 -8.712 -6.415 9.070 1.00 0.00 H new ATOM 0 HA VAL B 13 -7.382 -4.524 10.924 1.00 0.00 H new ATOM 0 HB VAL B 13 -9.913 -6.173 11.283 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -10.438 -4.400 12.945 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -8.916 -5.229 13.351 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -8.879 -3.616 12.598 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -11.122 -4.128 10.562 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -9.568 -3.337 10.204 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -10.085 -4.753 9.258 1.00 0.00 H new ATOM 1162 N VAL B 14 -6.198 -6.265 12.295 1.00 0.00 N ATOM 1163 CA VAL B 14 -5.525 -7.284 13.153 1.00 0.00 C ATOM 1164 C VAL B 14 -5.609 -6.867 14.627 1.00 0.00 C ATOM 1165 O VAL B 14 -6.089 -5.798 14.957 1.00 0.00 O ATOM 1166 CB VAL B 14 -4.052 -7.418 12.734 1.00 0.00 C ATOM 1167 CG1 VAL B 14 -3.970 -7.921 11.290 1.00 0.00 C ATOM 1168 CG2 VAL B 14 -3.353 -6.058 12.837 1.00 0.00 C ATOM 0 H VAL B 14 -5.721 -5.365 12.241 1.00 0.00 H new ATOM 0 HA VAL B 14 -6.026 -8.244 13.028 1.00 0.00 H new ATOM 0 HB VAL B 14 -3.559 -8.128 13.397 1.00 0.00 H new ATOM 0 HG11 VAL B 14 -2.925 -8.015 10.996 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -4.457 -8.893 11.215 1.00 0.00 H new ATOM 0 HG13 VAL B 14 -4.470 -7.213 10.629 1.00 0.00 H new ATOM 0 HG21 VAL B 14 -2.310 -6.162 12.538 1.00 0.00 H new ATOM 0 HG22 VAL B 14 -3.849 -5.343 12.180 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -3.402 -5.701 13.866 1.00 0.00 H new ATOM 1178 N LYS B 15 -5.140 -7.712 15.511 1.00 0.00 N ATOM 1179 CA LYS B 15 -5.171 -7.394 16.971 1.00 0.00 C ATOM 1180 C LYS B 15 -3.745 -7.416 17.523 1.00 0.00 C ATOM 1181 O LYS B 15 -2.901 -8.169 17.066 1.00 0.00 O ATOM 1182 CB LYS B 15 -6.017 -8.433 17.713 1.00 0.00 C ATOM 1183 CG LYS B 15 -7.446 -8.426 17.164 1.00 0.00 C ATOM 1184 CD LYS B 15 -8.155 -9.721 17.570 1.00 0.00 C ATOM 1185 CE LYS B 15 -9.012 -9.469 18.813 1.00 0.00 C ATOM 1186 NZ LYS B 15 -9.845 -10.672 19.099 1.00 0.00 N ATOM 0 H LYS B 15 -4.733 -8.618 15.280 1.00 0.00 H new ATOM 0 HA LYS B 15 -5.608 -6.406 17.114 1.00 0.00 H new ATOM 0 HB2 LYS B 15 -5.578 -9.424 17.596 1.00 0.00 H new ATOM 0 HB3 LYS B 15 -6.027 -8.212 18.780 1.00 0.00 H new ATOM 0 HG2 LYS B 15 -7.991 -7.564 17.549 1.00 0.00 H new ATOM 0 HG3 LYS B 15 -7.429 -8.333 16.078 1.00 0.00 H new ATOM 0 HD2 LYS B 15 -8.780 -10.077 16.751 1.00 0.00 H new ATOM 0 HD3 LYS B 15 -7.421 -10.501 17.774 1.00 0.00 H new ATOM 0 HE2 LYS B 15 -8.374 -9.245 19.668 1.00 0.00 H new ATOM 0 HE3 LYS B 15 -9.652 -8.600 18.656 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 -10.567 -10.434 19.809 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 -10.311 -10.988 18.224 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 -9.239 -11.435 19.463 1.00 0.00 H new ATOM 1200 N ASP B 16 -3.474 -6.590 18.500 1.00 0.00 N ATOM 1201 CA ASP B 16 -2.108 -6.540 19.094 1.00 0.00 C ATOM 1202 C ASP B 16 -2.202 -6.414 20.621 1.00 0.00 C ATOM 1203 O ASP B 16 -3.280 -6.353 21.188 1.00 0.00 O ATOM 1204 CB ASP B 16 -1.361 -5.330 18.524 1.00 0.00 C ATOM 1205 CG ASP B 16 -0.624 -5.737 17.243 1.00 0.00 C ATOM 1206 OD1 ASP B 16 -1.255 -5.751 16.197 1.00 0.00 O ATOM 1207 OD2 ASP B 16 0.559 -6.024 17.329 1.00 0.00 O ATOM 0 H ASP B 16 -4.146 -5.944 18.914 1.00 0.00 H new ATOM 0 HA ASP B 16 -1.572 -7.457 18.849 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -2.063 -4.524 18.311 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -0.651 -4.949 19.258 1.00 0.00 H new ATOM 1212 N GLN B 17 -1.068 -6.373 21.282 1.00 0.00 N ATOM 1213 CA GLN B 17 -1.046 -6.248 22.772 1.00 0.00 C ATOM 1214 C GLN B 17 -1.797 -4.991 23.198 1.00 0.00 C ATOM 1215 O GLN B 17 -2.553 -5.004 24.153 1.00 0.00 O ATOM 1216 CB GLN B 17 0.405 -6.148 23.249 1.00 0.00 C ATOM 1217 CG GLN B 17 0.819 -7.456 23.929 1.00 0.00 C ATOM 1218 CD GLN B 17 1.116 -8.517 22.864 1.00 0.00 C ATOM 1219 OE1 GLN B 17 0.279 -9.347 22.568 1.00 0.00 O ATOM 1220 NE2 GLN B 17 2.280 -8.526 22.273 1.00 0.00 N ATOM 0 H GLN B 17 -0.147 -6.422 20.845 1.00 0.00 H new ATOM 0 HA GLN B 17 -1.524 -7.123 23.212 1.00 0.00 H new ATOM 0 HB2 GLN B 17 1.062 -5.943 22.404 1.00 0.00 H new ATOM 0 HB3 GLN B 17 0.512 -5.316 23.945 1.00 0.00 H new ATOM 0 HG2 GLN B 17 1.700 -7.292 24.549 1.00 0.00 H new ATOM 0 HG3 GLN B 17 0.024 -7.802 24.590 1.00 0.00 H new ATOM 0 HE21 GLN B 17 2.983 -7.830 22.521 1.00 0.00 H new ATOM 0 HE22 GLN B 17 2.486 -9.229 21.564 1.00 0.00 H new ATOM 1229 N ASN B 18 -1.582 -3.909 22.498 1.00 0.00 N ATOM 1230 CA ASN B 18 -2.265 -2.633 22.849 1.00 0.00 C ATOM 1231 C ASN B 18 -3.785 -2.794 22.719 1.00 0.00 C ATOM 1232 O ASN B 18 -4.518 -2.499 23.646 1.00 0.00 O ATOM 1233 CB ASN B 18 -1.786 -1.517 21.917 1.00 0.00 C ATOM 1234 CG ASN B 18 -0.327 -1.171 22.230 1.00 0.00 C ATOM 1235 OD1 ASN B 18 -0.052 -0.421 23.145 1.00 0.00 O ATOM 1236 ND2 ASN B 18 0.626 -1.690 21.503 1.00 0.00 N ATOM 0 H ASN B 18 -0.958 -3.856 21.693 1.00 0.00 H new ATOM 0 HA ASN B 18 -2.022 -2.375 23.880 1.00 0.00 H new ATOM 0 HB2 ASN B 18 -1.880 -1.833 20.878 1.00 0.00 H new ATOM 0 HB3 ASN B 18 -2.413 -0.634 22.039 1.00 0.00 H new ATOM 0 HD21 ASN B 18 1.600 -1.465 21.704 1.00 0.00 H new ATOM 0 HD22 ASN B 18 0.396 -2.320 20.735 1.00 0.00 H new ATOM 1243 N GLU B 19 -4.262 -3.261 21.582 1.00 0.00 N ATOM 1244 CA GLU B 19 -5.738 -3.440 21.392 1.00 0.00 C ATOM 1245 C GLU B 19 -6.006 -3.977 19.979 1.00 0.00 C ATOM 1246 O GLU B 19 -5.997 -5.174 19.753 1.00 0.00 O ATOM 1247 CB GLU B 19 -6.450 -2.089 21.603 1.00 0.00 C ATOM 1248 CG GLU B 19 -7.959 -2.242 21.364 1.00 0.00 C ATOM 1249 CD GLU B 19 -8.495 -0.994 20.652 1.00 0.00 C ATOM 1250 OE1 GLU B 19 -8.858 -0.052 21.339 1.00 0.00 O ATOM 1251 OE2 GLU B 19 -8.535 -1.001 19.431 1.00 0.00 O ATOM 0 H GLU B 19 -3.690 -3.525 20.780 1.00 0.00 H new ATOM 0 HA GLU B 19 -6.123 -4.155 22.119 1.00 0.00 H new ATOM 0 HB2 GLU B 19 -6.269 -1.729 22.616 1.00 0.00 H new ATOM 0 HB3 GLU B 19 -6.040 -1.343 20.922 1.00 0.00 H new ATOM 0 HG2 GLU B 19 -8.154 -3.129 20.761 1.00 0.00 H new ATOM 0 HG3 GLU B 19 -8.476 -2.382 22.314 1.00 0.00 H new ATOM 1258 N GLU B 20 -6.245 -3.101 19.035 1.00 0.00 N ATOM 1259 CA GLU B 20 -6.518 -3.535 17.637 1.00 0.00 C ATOM 1260 C GLU B 20 -5.654 -2.719 16.671 1.00 0.00 C ATOM 1261 O GLU B 20 -5.478 -1.524 16.838 1.00 0.00 O ATOM 1262 CB GLU B 20 -7.995 -3.309 17.321 1.00 0.00 C ATOM 1263 CG GLU B 20 -8.425 -4.231 16.175 1.00 0.00 C ATOM 1264 CD GLU B 20 -9.922 -4.050 15.899 1.00 0.00 C ATOM 1265 OE1 GLU B 20 -10.271 -3.086 15.237 1.00 0.00 O ATOM 1266 OE2 GLU B 20 -10.693 -4.880 16.353 1.00 0.00 O ATOM 0 H GLU B 20 -6.262 -2.091 19.179 1.00 0.00 H new ATOM 0 HA GLU B 20 -6.279 -4.593 17.527 1.00 0.00 H new ATOM 0 HB2 GLU B 20 -8.600 -3.506 18.206 1.00 0.00 H new ATOM 0 HB3 GLU B 20 -8.163 -2.268 17.045 1.00 0.00 H new ATOM 0 HG2 GLU B 20 -7.850 -4.004 15.277 1.00 0.00 H new ATOM 0 HG3 GLU B 20 -8.216 -5.269 16.433 1.00 0.00 H new ATOM 1273 N LYS B 21 -5.119 -3.361 15.664 1.00 0.00 N ATOM 1274 CA LYS B 21 -4.266 -2.650 14.670 1.00 0.00 C ATOM 1275 C LYS B 21 -4.825 -2.864 13.257 1.00 0.00 C ATOM 1276 O LYS B 21 -5.729 -3.652 13.043 1.00 0.00 O ATOM 1277 CB LYS B 21 -2.837 -3.198 14.740 1.00 0.00 C ATOM 1278 CG LYS B 21 -2.110 -2.586 15.939 1.00 0.00 C ATOM 1279 CD LYS B 21 -0.607 -2.533 15.653 1.00 0.00 C ATOM 1280 CE LYS B 21 0.165 -2.443 16.972 1.00 0.00 C ATOM 1281 NZ LYS B 21 1.556 -1.979 16.705 1.00 0.00 N ATOM 0 H LYS B 21 -5.239 -4.358 15.488 1.00 0.00 H new ATOM 0 HA LYS B 21 -4.262 -1.584 14.898 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -2.857 -4.284 14.830 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -2.302 -2.964 13.820 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -2.489 -1.583 16.134 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -2.300 -3.179 16.834 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -0.300 -3.421 15.101 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -0.376 -1.672 15.026 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -0.335 -1.753 17.652 1.00 0.00 H new ATOM 0 HE3 LYS B 21 0.183 -3.417 17.462 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 2.230 -2.604 17.191 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 1.739 -2.002 15.682 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 1.671 -1.007 17.055 1.00 0.00 H new ATOM 1295 N ILE B 22 -4.279 -2.167 12.296 1.00 0.00 N ATOM 1296 CA ILE B 22 -4.737 -2.305 10.884 1.00 0.00 C ATOM 1297 C ILE B 22 -3.511 -2.538 10.000 1.00 0.00 C ATOM 1298 O ILE B 22 -2.604 -1.724 9.960 1.00 0.00 O ATOM 1299 CB ILE B 22 -5.462 -1.024 10.445 1.00 0.00 C ATOM 1300 CG1 ILE B 22 -6.871 -0.991 11.053 1.00 0.00 C ATOM 1301 CG2 ILE B 22 -5.560 -0.977 8.915 1.00 0.00 C ATOM 1302 CD1 ILE B 22 -7.724 -2.122 10.473 1.00 0.00 C ATOM 0 H ILE B 22 -3.522 -1.497 12.433 1.00 0.00 H new ATOM 0 HA ILE B 22 -5.427 -3.144 10.794 1.00 0.00 H new ATOM 0 HB ILE B 22 -4.898 -0.159 10.794 1.00 0.00 H new ATOM 0 HG12 ILE B 22 -6.810 -1.091 12.137 1.00 0.00 H new ATOM 0 HG13 ILE B 22 -7.341 -0.029 10.848 1.00 0.00 H new ATOM 0 HG21 ILE B 22 -6.075 -0.066 8.611 1.00 0.00 H new ATOM 0 HG22 ILE B 22 -4.558 -0.988 8.486 1.00 0.00 H new ATOM 0 HG23 ILE B 22 -6.116 -1.844 8.559 1.00 0.00 H new ATOM 0 HD11 ILE B 22 -8.721 -2.088 10.912 1.00 0.00 H new ATOM 0 HD12 ILE B 22 -7.799 -2.003 9.392 1.00 0.00 H new ATOM 0 HD13 ILE B 22 -7.260 -3.081 10.701 1.00 0.00 H new ATOM 1314 N LEU B 23 -3.471 -3.642 9.297 1.00 0.00 N ATOM 1315 CA LEU B 23 -2.297 -3.924 8.426 1.00 0.00 C ATOM 1316 C LEU B 23 -2.619 -3.546 6.977 1.00 0.00 C ATOM 1317 O LEU B 23 -3.436 -4.175 6.329 1.00 0.00 O ATOM 1318 CB LEU B 23 -1.939 -5.416 8.501 1.00 0.00 C ATOM 1319 CG LEU B 23 -0.415 -5.617 8.611 1.00 0.00 C ATOM 1320 CD1 LEU B 23 0.344 -4.394 8.076 1.00 0.00 C ATOM 1321 CD2 LEU B 23 -0.039 -5.851 10.076 1.00 0.00 C ATOM 0 H LEU B 23 -4.199 -4.356 9.290 1.00 0.00 H new ATOM 0 HA LEU B 23 -1.450 -3.332 8.771 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -2.431 -5.868 9.362 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -2.313 -5.928 7.614 1.00 0.00 H new ATOM 0 HG LEU B 23 -0.137 -6.483 8.010 1.00 0.00 H new ATOM 0 HD11 LEU B 23 1.417 -4.564 8.166 1.00 0.00 H new ATOM 0 HD12 LEU B 23 0.088 -4.237 7.028 1.00 0.00 H new ATOM 0 HD13 LEU B 23 0.066 -3.512 8.654 1.00 0.00 H new ATOM 0 HD21 LEU B 23 1.039 -5.994 10.157 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -0.336 -4.987 10.670 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -0.551 -6.739 10.446 1.00 0.00 H new ATOM 1333 N LEU B 24 -1.970 -2.527 6.467 1.00 0.00 N ATOM 1334 CA LEU B 24 -2.213 -2.098 5.060 1.00 0.00 C ATOM 1335 C LEU B 24 -0.999 -2.485 4.207 1.00 0.00 C ATOM 1336 O LEU B 24 -0.055 -1.727 4.073 1.00 0.00 O ATOM 1337 CB LEU B 24 -2.425 -0.576 5.000 1.00 0.00 C ATOM 1338 CG LEU B 24 -3.403 -0.130 6.093 1.00 0.00 C ATOM 1339 CD1 LEU B 24 -3.396 1.397 6.191 1.00 0.00 C ATOM 1340 CD2 LEU B 24 -4.815 -0.609 5.746 1.00 0.00 C ATOM 0 H LEU B 24 -1.278 -1.972 6.971 1.00 0.00 H new ATOM 0 HA LEU B 24 -3.108 -2.590 4.678 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -1.471 -0.064 5.126 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -2.811 -0.294 4.020 1.00 0.00 H new ATOM 0 HG LEU B 24 -3.098 -0.560 7.047 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -4.091 1.715 6.968 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -2.392 1.741 6.439 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -3.700 1.824 5.235 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -5.509 -0.291 6.524 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -5.120 -0.181 4.791 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -4.823 -1.697 5.675 1.00 0.00 H new ATOM 1352 N GLY B 25 -1.021 -3.666 3.635 1.00 0.00 N ATOM 1353 CA GLY B 25 0.118 -4.127 2.789 1.00 0.00 C ATOM 1354 C GLY B 25 -0.426 -4.656 1.465 1.00 0.00 C ATOM 1355 O GLY B 25 -1.257 -5.541 1.444 1.00 0.00 O ATOM 0 H GLY B 25 -1.788 -4.333 3.721 1.00 0.00 H new ATOM 0 HA2 GLY B 25 0.810 -3.304 2.609 1.00 0.00 H new ATOM 0 HA3 GLY B 25 0.678 -4.908 3.304 1.00 0.00 H new ATOM 1359 N ALA B 26 0.028 -4.107 0.365 1.00 0.00 N ATOM 1360 CA ALA B 26 -0.458 -4.549 -0.978 1.00 0.00 C ATOM 1361 C ALA B 26 -0.291 -6.065 -1.140 1.00 0.00 C ATOM 1362 O ALA B 26 0.784 -6.563 -1.430 1.00 0.00 O ATOM 1363 CB ALA B 26 0.329 -3.829 -2.072 1.00 0.00 C ATOM 0 H ALA B 26 0.724 -3.362 0.341 1.00 0.00 H new ATOM 0 HA ALA B 26 -1.516 -4.302 -1.063 1.00 0.00 H new ATOM 0 HB1 ALA B 26 -0.027 -4.153 -3.050 1.00 0.00 H new ATOM 0 HB2 ALA B 26 0.188 -2.753 -1.973 1.00 0.00 H new ATOM 0 HB3 ALA B 26 1.388 -4.067 -1.975 1.00 0.00 H new ATOM 1369 N GLY B 27 -1.364 -6.787 -0.962 1.00 0.00 N ATOM 1370 CA GLY B 27 -1.332 -8.273 -1.108 1.00 0.00 C ATOM 1371 C GLY B 27 -1.239 -8.966 0.260 1.00 0.00 C ATOM 1372 O GLY B 27 -1.103 -10.174 0.326 1.00 0.00 O ATOM 0 H GLY B 27 -2.277 -6.404 -0.717 1.00 0.00 H new ATOM 0 HA2 GLY B 27 -2.229 -8.609 -1.628 1.00 0.00 H new ATOM 0 HA3 GLY B 27 -0.480 -8.562 -1.723 1.00 0.00 H new ATOM 1376 N ILE B 28 -1.314 -8.226 1.347 1.00 0.00 N ATOM 1377 CA ILE B 28 -1.234 -8.849 2.695 1.00 0.00 C ATOM 1378 C ILE B 28 -2.380 -9.858 2.862 1.00 0.00 C ATOM 1379 O ILE B 28 -2.194 -10.924 3.422 1.00 0.00 O ATOM 1380 CB ILE B 28 -1.310 -7.734 3.751 1.00 0.00 C ATOM 1381 CG1 ILE B 28 -0.348 -8.057 4.886 1.00 0.00 C ATOM 1382 CG2 ILE B 28 -2.730 -7.597 4.312 1.00 0.00 C ATOM 1383 CD1 ILE B 28 0.222 -6.757 5.449 1.00 0.00 C ATOM 0 H ILE B 28 -1.428 -7.212 1.349 1.00 0.00 H new ATOM 0 HA ILE B 28 -0.295 -9.388 2.818 1.00 0.00 H new ATOM 0 HB ILE B 28 -1.037 -6.790 3.278 1.00 0.00 H new ATOM 0 HG12 ILE B 28 -0.865 -8.611 5.670 1.00 0.00 H new ATOM 0 HG13 ILE B 28 0.459 -8.695 4.524 1.00 0.00 H new ATOM 0 HG21 ILE B 28 -2.752 -6.801 5.056 1.00 0.00 H new ATOM 0 HG22 ILE B 28 -3.419 -7.356 3.503 1.00 0.00 H new ATOM 0 HG23 ILE B 28 -3.030 -8.536 4.777 1.00 0.00 H new ATOM 0 HD11 ILE B 28 0.911 -6.984 6.262 1.00 0.00 H new ATOM 0 HD12 ILE B 28 0.753 -6.222 4.662 1.00 0.00 H new ATOM 0 HD13 ILE B 28 -0.591 -6.136 5.825 1.00 0.00 H new ATOM 1395 N ALA B 29 -3.554 -9.537 2.356 1.00 0.00 N ATOM 1396 CA ALA B 29 -4.705 -10.486 2.455 1.00 0.00 C ATOM 1397 C ALA B 29 -4.335 -11.768 1.707 1.00 0.00 C ATOM 1398 O ALA B 29 -4.625 -12.862 2.157 1.00 0.00 O ATOM 1399 CB ALA B 29 -5.952 -9.861 1.826 1.00 0.00 C ATOM 0 H ALA B 29 -3.759 -8.658 1.880 1.00 0.00 H new ATOM 0 HA ALA B 29 -4.918 -10.708 3.501 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -6.786 -10.558 1.902 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -6.201 -8.939 2.351 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -5.758 -9.640 0.776 1.00 0.00 H new ATOM 1405 N PHE B 30 -3.664 -11.634 0.581 1.00 0.00 N ATOM 1406 CA PHE B 30 -3.233 -12.832 -0.187 1.00 0.00 C ATOM 1407 C PHE B 30 -2.164 -13.560 0.632 1.00 0.00 C ATOM 1408 O PHE B 30 -1.327 -12.936 1.263 1.00 0.00 O ATOM 1409 CB PHE B 30 -2.647 -12.398 -1.537 1.00 0.00 C ATOM 1410 CG PHE B 30 -2.382 -13.615 -2.393 1.00 0.00 C ATOM 1411 CD1 PHE B 30 -3.424 -14.201 -3.121 1.00 0.00 C ATOM 1412 CD2 PHE B 30 -1.092 -14.157 -2.457 1.00 0.00 C ATOM 1413 CE1 PHE B 30 -3.177 -15.329 -3.913 1.00 0.00 C ATOM 1414 CE2 PHE B 30 -0.845 -15.285 -3.249 1.00 0.00 C ATOM 1415 CZ PHE B 30 -1.888 -15.871 -3.977 1.00 0.00 C ATOM 0 H PHE B 30 -3.400 -10.740 0.168 1.00 0.00 H new ATOM 0 HA PHE B 30 -4.082 -13.490 -0.371 1.00 0.00 H new ATOM 0 HB2 PHE B 30 -3.339 -11.727 -2.046 1.00 0.00 H new ATOM 0 HB3 PHE B 30 -1.722 -11.843 -1.381 1.00 0.00 H new ATOM 0 HD1 PHE B 30 -4.419 -13.783 -3.072 1.00 0.00 H new ATOM 0 HD2 PHE B 30 -0.288 -13.705 -1.895 1.00 0.00 H new ATOM 0 HE1 PHE B 30 -3.981 -15.781 -4.475 1.00 0.00 H new ATOM 0 HE2 PHE B 30 0.150 -15.703 -3.298 1.00 0.00 H new ATOM 0 HZ PHE B 30 -1.698 -16.741 -4.588 1.00 0.00 H new ATOM 1425 N ASN B 31 -2.201 -14.869 0.639 1.00 0.00 N ATOM 1426 CA ASN B 31 -1.204 -15.662 1.428 1.00 0.00 C ATOM 1427 C ASN B 31 -1.504 -15.520 2.929 1.00 0.00 C ATOM 1428 O ASN B 31 -0.617 -15.582 3.761 1.00 0.00 O ATOM 1429 CB ASN B 31 0.215 -15.162 1.121 1.00 0.00 C ATOM 1430 CG ASN B 31 1.233 -16.259 1.445 1.00 0.00 C ATOM 1431 OD1 ASN B 31 1.929 -16.184 2.438 1.00 0.00 O ATOM 1432 ND2 ASN B 31 1.351 -17.283 0.642 1.00 0.00 N ATOM 0 H ASN B 31 -2.884 -15.428 0.128 1.00 0.00 H new ATOM 0 HA ASN B 31 -1.275 -16.714 1.150 1.00 0.00 H new ATOM 0 HB2 ASN B 31 0.292 -14.880 0.071 1.00 0.00 H new ATOM 0 HB3 ASN B 31 0.430 -14.269 1.707 1.00 0.00 H new ATOM 0 HD21 ASN B 31 2.027 -18.018 0.849 1.00 0.00 H new ATOM 0 HD22 ASN B 31 0.767 -17.347 -0.192 1.00 0.00 H new ATOM 1439 N LYS B 32 -2.757 -15.338 3.272 1.00 0.00 N ATOM 1440 CA LYS B 32 -3.152 -15.195 4.710 1.00 0.00 C ATOM 1441 C LYS B 32 -4.679 -15.317 4.842 1.00 0.00 C ATOM 1442 O LYS B 32 -5.399 -15.289 3.858 1.00 0.00 O ATOM 1443 CB LYS B 32 -2.698 -13.828 5.236 1.00 0.00 C ATOM 1444 CG LYS B 32 -1.897 -14.016 6.528 1.00 0.00 C ATOM 1445 CD LYS B 32 -0.401 -13.862 6.237 1.00 0.00 C ATOM 1446 CE LYS B 32 0.318 -15.187 6.509 1.00 0.00 C ATOM 1447 NZ LYS B 32 1.652 -15.180 5.842 1.00 0.00 N ATOM 0 H LYS B 32 -3.531 -15.282 2.610 1.00 0.00 H new ATOM 0 HA LYS B 32 -2.676 -15.983 5.294 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -2.087 -13.323 4.487 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -3.564 -13.193 5.422 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -2.210 -13.282 7.271 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -2.095 -15.001 6.950 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -0.252 -13.563 5.200 1.00 0.00 H new ATOM 0 HD3 LYS B 32 0.021 -13.074 6.860 1.00 0.00 H new ATOM 0 HE2 LYS B 32 0.438 -15.333 7.582 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -0.280 -16.019 6.139 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 2.051 -16.141 5.853 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 1.547 -14.860 4.858 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 2.290 -14.535 6.349 1.00 0.00 H new ATOM 1461 N LYS B 33 -5.177 -15.455 6.051 1.00 0.00 N ATOM 1462 CA LYS B 33 -6.655 -15.584 6.250 1.00 0.00 C ATOM 1463 C LYS B 33 -7.048 -15.131 7.665 1.00 0.00 C ATOM 1464 O LYS B 33 -6.205 -14.815 8.487 1.00 0.00 O ATOM 1465 CB LYS B 33 -7.072 -17.047 6.043 1.00 0.00 C ATOM 1466 CG LYS B 33 -6.285 -17.955 6.996 1.00 0.00 C ATOM 1467 CD LYS B 33 -6.976 -19.319 7.091 1.00 0.00 C ATOM 1468 CE LYS B 33 -7.786 -19.397 8.389 1.00 0.00 C ATOM 1469 NZ LYS B 33 -9.117 -18.752 8.190 1.00 0.00 N ATOM 0 H LYS B 33 -4.622 -15.484 6.906 1.00 0.00 H new ATOM 0 HA LYS B 33 -7.165 -14.949 5.526 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -8.142 -17.158 6.222 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -6.889 -17.344 5.010 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -5.263 -18.078 6.637 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -6.223 -17.497 7.983 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -7.631 -19.466 6.232 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -6.233 -20.116 7.066 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -7.916 -20.438 8.686 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -7.247 -18.900 9.196 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -9.858 -19.346 8.614 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -9.121 -17.817 8.645 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -9.301 -18.643 7.172 1.00 0.00 H new ATOM 1483 N LYS B 34 -8.332 -15.103 7.947 1.00 0.00 N ATOM 1484 CA LYS B 34 -8.818 -14.680 9.296 1.00 0.00 C ATOM 1485 C LYS B 34 -8.231 -15.593 10.372 1.00 0.00 C ATOM 1486 O LYS B 34 -8.248 -16.805 10.249 1.00 0.00 O ATOM 1487 CB LYS B 34 -10.350 -14.757 9.333 1.00 0.00 C ATOM 1488 CG LYS B 34 -10.889 -13.865 10.456 1.00 0.00 C ATOM 1489 CD LYS B 34 -11.190 -14.719 11.692 1.00 0.00 C ATOM 1490 CE LYS B 34 -11.266 -13.823 12.931 1.00 0.00 C ATOM 1491 NZ LYS B 34 -9.932 -13.773 13.596 1.00 0.00 N ATOM 0 H LYS B 34 -9.069 -15.359 7.290 1.00 0.00 H new ATOM 0 HA LYS B 34 -8.499 -13.655 9.488 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -10.762 -14.440 8.375 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -10.667 -15.788 9.491 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -10.159 -13.094 10.703 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -11.793 -13.354 10.126 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -12.132 -15.251 11.558 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -10.414 -15.473 11.823 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -11.580 -12.818 12.647 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -12.015 -14.207 13.624 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -10.020 -13.293 14.514 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -9.581 -14.741 13.743 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -9.264 -13.250 12.995 1.00 0.00 H new ATOM 1505 N ASN B 35 -7.707 -14.995 11.418 1.00 0.00 N ATOM 1506 CA ASN B 35 -7.092 -15.760 12.550 1.00 0.00 C ATOM 1507 C ASN B 35 -5.619 -16.082 12.246 1.00 0.00 C ATOM 1508 O ASN B 35 -4.869 -16.438 13.136 1.00 0.00 O ATOM 1509 CB ASN B 35 -7.864 -17.061 12.813 1.00 0.00 C ATOM 1510 CG ASN B 35 -7.614 -17.529 14.251 1.00 0.00 C ATOM 1511 OD1 ASN B 35 -7.041 -18.579 14.467 1.00 0.00 O ATOM 1512 ND2 ASN B 35 -8.021 -16.792 15.250 1.00 0.00 N ATOM 0 H ASN B 35 -7.680 -13.982 11.536 1.00 0.00 H new ATOM 0 HA ASN B 35 -7.143 -15.137 13.443 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -8.930 -16.901 12.653 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -7.548 -17.831 12.110 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -7.858 -17.098 16.209 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -8.502 -15.911 15.071 1.00 0.00 H new ATOM 1519 N ASP B 36 -5.194 -15.952 11.008 1.00 0.00 N ATOM 1520 CA ASP B 36 -3.773 -16.239 10.665 1.00 0.00 C ATOM 1521 C ASP B 36 -2.926 -14.995 10.947 1.00 0.00 C ATOM 1522 O ASP B 36 -3.395 -13.874 10.844 1.00 0.00 O ATOM 1523 CB ASP B 36 -3.663 -16.609 9.183 1.00 0.00 C ATOM 1524 CG ASP B 36 -2.358 -17.372 8.934 1.00 0.00 C ATOM 1525 OD1 ASP B 36 -2.377 -18.588 9.035 1.00 0.00 O ATOM 1526 OD2 ASP B 36 -1.363 -16.729 8.644 1.00 0.00 O ATOM 0 H ASP B 36 -5.776 -15.659 10.224 1.00 0.00 H new ATOM 0 HA ASP B 36 -3.414 -17.072 11.269 1.00 0.00 H new ATOM 0 HB2 ASP B 36 -4.515 -17.221 8.887 1.00 0.00 H new ATOM 0 HB3 ASP B 36 -3.690 -15.708 8.571 1.00 0.00 H new ATOM 1531 N ILE B 37 -1.682 -15.190 11.299 1.00 0.00 N ATOM 1532 CA ILE B 37 -0.785 -14.032 11.591 1.00 0.00 C ATOM 1533 C ILE B 37 -0.509 -13.265 10.295 1.00 0.00 C ATOM 1534 O ILE B 37 -0.419 -13.841 9.226 1.00 0.00 O ATOM 1535 CB ILE B 37 0.543 -14.525 12.183 1.00 0.00 C ATOM 1536 CG1 ILE B 37 0.276 -15.509 13.334 1.00 0.00 C ATOM 1537 CG2 ILE B 37 1.348 -13.331 12.708 1.00 0.00 C ATOM 1538 CD1 ILE B 37 -0.477 -14.802 14.467 1.00 0.00 C ATOM 0 H ILE B 37 -1.246 -16.107 11.397 1.00 0.00 H new ATOM 0 HA ILE B 37 -1.274 -13.377 12.313 1.00 0.00 H new ATOM 0 HB ILE B 37 1.110 -15.033 11.403 1.00 0.00 H new ATOM 0 HG12 ILE B 37 -0.308 -16.355 12.971 1.00 0.00 H new ATOM 0 HG13 ILE B 37 1.219 -15.909 13.707 1.00 0.00 H new ATOM 0 HG21 ILE B 37 2.290 -13.684 13.128 1.00 0.00 H new ATOM 0 HG22 ILE B 37 1.551 -12.641 11.889 1.00 0.00 H new ATOM 0 HG23 ILE B 37 0.776 -12.818 13.481 1.00 0.00 H new ATOM 0 HD11 ILE B 37 -0.661 -15.508 15.277 1.00 0.00 H new ATOM 0 HD12 ILE B 37 0.122 -13.971 14.839 1.00 0.00 H new ATOM 0 HD13 ILE B 37 -1.428 -14.424 14.092 1.00 0.00 H new ATOM 1550 N VAL B 38 -0.376 -11.968 10.392 1.00 0.00 N ATOM 1551 CA VAL B 38 -0.107 -11.136 9.182 1.00 0.00 C ATOM 1552 C VAL B 38 1.349 -11.311 8.745 1.00 0.00 C ATOM 1553 O VAL B 38 2.259 -11.328 9.557 1.00 0.00 O ATOM 1554 CB VAL B 38 -0.377 -9.653 9.486 1.00 0.00 C ATOM 1555 CG1 VAL B 38 0.601 -9.141 10.546 1.00 0.00 C ATOM 1556 CG2 VAL B 38 -0.196 -8.834 8.206 1.00 0.00 C ATOM 0 H VAL B 38 -0.443 -11.445 11.265 1.00 0.00 H new ATOM 0 HA VAL B 38 -0.769 -11.461 8.379 1.00 0.00 H new ATOM 0 HB VAL B 38 -1.396 -9.550 9.859 1.00 0.00 H new ATOM 0 HG11 VAL B 38 0.398 -8.090 10.751 1.00 0.00 H new ATOM 0 HG12 VAL B 38 0.480 -9.719 11.462 1.00 0.00 H new ATOM 0 HG13 VAL B 38 1.622 -9.249 10.181 1.00 0.00 H new ATOM 0 HG21 VAL B 38 -0.387 -7.782 8.417 1.00 0.00 H new ATOM 0 HG22 VAL B 38 0.824 -8.952 7.840 1.00 0.00 H new ATOM 0 HG23 VAL B 38 -0.896 -9.184 7.448 1.00 0.00 H new ATOM 1566 N ASP B 39 1.568 -11.422 7.461 1.00 0.00 N ATOM 1567 CA ASP B 39 2.953 -11.572 6.940 1.00 0.00 C ATOM 1568 C ASP B 39 3.683 -10.239 7.144 1.00 0.00 C ATOM 1569 O ASP B 39 3.193 -9.206 6.726 1.00 0.00 O ATOM 1570 CB ASP B 39 2.905 -11.916 5.447 1.00 0.00 C ATOM 1571 CG ASP B 39 4.275 -12.428 4.989 1.00 0.00 C ATOM 1572 OD1 ASP B 39 5.089 -11.610 4.592 1.00 0.00 O ATOM 1573 OD2 ASP B 39 4.486 -13.628 5.043 1.00 0.00 O ATOM 0 H ASP B 39 0.839 -11.415 6.748 1.00 0.00 H new ATOM 0 HA ASP B 39 3.475 -12.372 7.466 1.00 0.00 H new ATOM 0 HB2 ASP B 39 2.143 -12.674 5.263 1.00 0.00 H new ATOM 0 HB3 ASP B 39 2.624 -11.035 4.870 1.00 0.00 H new ATOM 1578 N PRO B 40 4.825 -10.296 7.792 1.00 0.00 N ATOM 1579 CA PRO B 40 5.629 -9.094 8.082 1.00 0.00 C ATOM 1580 C PRO B 40 6.269 -8.543 6.804 1.00 0.00 C ATOM 1581 O PRO B 40 6.352 -7.342 6.621 1.00 0.00 O ATOM 1582 CB PRO B 40 6.679 -9.587 9.079 1.00 0.00 C ATOM 1583 CG PRO B 40 6.769 -11.119 8.891 1.00 0.00 C ATOM 1584 CD PRO B 40 5.427 -11.558 8.274 1.00 0.00 C ATOM 0 HA PRO B 40 5.037 -8.271 8.483 1.00 0.00 H new ATOM 0 HB2 PRO B 40 7.644 -9.115 8.893 1.00 0.00 H new ATOM 0 HB3 PRO B 40 6.393 -9.337 10.101 1.00 0.00 H new ATOM 0 HG2 PRO B 40 7.602 -11.383 8.239 1.00 0.00 H new ATOM 0 HG3 PRO B 40 6.941 -11.618 9.845 1.00 0.00 H new ATOM 0 HD2 PRO B 40 5.575 -12.266 7.459 1.00 0.00 H new ATOM 0 HD3 PRO B 40 4.790 -12.048 9.011 1.00 0.00 H new ATOM 1592 N SER B 41 6.694 -9.406 5.908 1.00 0.00 N ATOM 1593 CA SER B 41 7.294 -8.924 4.628 1.00 0.00 C ATOM 1594 C SER B 41 6.227 -8.137 3.854 1.00 0.00 C ATOM 1595 O SER B 41 6.534 -7.218 3.116 1.00 0.00 O ATOM 1596 CB SER B 41 7.763 -10.119 3.792 1.00 0.00 C ATOM 1597 OG SER B 41 8.859 -9.722 2.978 1.00 0.00 O ATOM 0 H SER B 41 6.650 -10.420 6.011 1.00 0.00 H new ATOM 0 HA SER B 41 8.151 -8.284 4.837 1.00 0.00 H new ATOM 0 HB2 SER B 41 8.059 -10.940 4.445 1.00 0.00 H new ATOM 0 HB3 SER B 41 6.946 -10.485 3.169 1.00 0.00 H new ATOM 0 HG SER B 41 9.162 -10.485 2.443 1.00 0.00 H new ATOM 1603 N LYS B 42 4.972 -8.492 4.036 1.00 0.00 N ATOM 1604 CA LYS B 42 3.861 -7.779 3.341 1.00 0.00 C ATOM 1605 C LYS B 42 3.445 -6.536 4.145 1.00 0.00 C ATOM 1606 O LYS B 42 2.860 -5.618 3.599 1.00 0.00 O ATOM 1607 CB LYS B 42 2.660 -8.721 3.201 1.00 0.00 C ATOM 1608 CG LYS B 42 3.080 -9.993 2.457 1.00 0.00 C ATOM 1609 CD LYS B 42 3.223 -9.699 0.961 1.00 0.00 C ATOM 1610 CE LYS B 42 1.839 -9.538 0.329 1.00 0.00 C ATOM 1611 NZ LYS B 42 1.945 -9.677 -1.152 1.00 0.00 N ATOM 0 H LYS B 42 4.674 -9.254 4.644 1.00 0.00 H new ATOM 0 HA LYS B 42 4.201 -7.466 2.354 1.00 0.00 H new ATOM 0 HB2 LYS B 42 2.271 -8.977 4.186 1.00 0.00 H new ATOM 0 HB3 LYS B 42 1.856 -8.222 2.661 1.00 0.00 H new ATOM 0 HG2 LYS B 42 4.025 -10.363 2.856 1.00 0.00 H new ATOM 0 HG3 LYS B 42 2.339 -10.777 2.613 1.00 0.00 H new ATOM 0 HD2 LYS B 42 3.808 -8.791 0.814 1.00 0.00 H new ATOM 0 HD3 LYS B 42 3.764 -10.509 0.472 1.00 0.00 H new ATOM 0 HE2 LYS B 42 1.157 -10.289 0.727 1.00 0.00 H new ATOM 0 HE3 LYS B 42 1.423 -8.563 0.584 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 1.108 -10.177 -1.515 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 2.000 -8.734 -1.586 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 2.801 -10.218 -1.390 1.00 0.00 H new ATOM 1625 N ILE B 43 3.739 -6.498 5.434 1.00 0.00 N ATOM 1626 CA ILE B 43 3.358 -5.310 6.270 1.00 0.00 C ATOM 1627 C ILE B 43 3.947 -4.037 5.651 1.00 0.00 C ATOM 1628 O ILE B 43 5.143 -3.806 5.692 1.00 0.00 O ATOM 1629 CB ILE B 43 3.894 -5.478 7.701 1.00 0.00 C ATOM 1630 CG1 ILE B 43 3.081 -6.554 8.431 1.00 0.00 C ATOM 1631 CG2 ILE B 43 3.769 -4.148 8.457 1.00 0.00 C ATOM 1632 CD1 ILE B 43 3.699 -6.828 9.805 1.00 0.00 C ATOM 0 H ILE B 43 4.226 -7.240 5.938 1.00 0.00 H new ATOM 0 HA ILE B 43 2.271 -5.233 6.303 1.00 0.00 H new ATOM 0 HB ILE B 43 4.941 -5.777 7.660 1.00 0.00 H new ATOM 0 HG12 ILE B 43 2.048 -6.227 8.546 1.00 0.00 H new ATOM 0 HG13 ILE B 43 3.062 -7.471 7.841 1.00 0.00 H new ATOM 0 HG21 ILE B 43 4.149 -4.269 9.471 1.00 0.00 H new ATOM 0 HG22 ILE B 43 4.347 -3.381 7.942 1.00 0.00 H new ATOM 0 HG23 ILE B 43 2.722 -3.848 8.496 1.00 0.00 H new ATOM 0 HD11 ILE B 43 3.118 -7.593 10.319 1.00 0.00 H new ATOM 0 HD12 ILE B 43 4.725 -7.175 9.680 1.00 0.00 H new ATOM 0 HD13 ILE B 43 3.695 -5.912 10.395 1.00 0.00 H new ATOM 1644 N GLU B 44 3.103 -3.215 5.085 1.00 0.00 N ATOM 1645 CA GLU B 44 3.574 -1.945 4.463 1.00 0.00 C ATOM 1646 C GLU B 44 3.186 -0.767 5.362 1.00 0.00 C ATOM 1647 O GLU B 44 3.878 0.234 5.414 1.00 0.00 O ATOM 1648 CB GLU B 44 2.921 -1.778 3.090 1.00 0.00 C ATOM 1649 CG GLU B 44 3.586 -2.725 2.087 1.00 0.00 C ATOM 1650 CD GLU B 44 3.519 -2.120 0.681 1.00 0.00 C ATOM 1651 OE1 GLU B 44 2.549 -2.383 -0.011 1.00 0.00 O ATOM 1652 OE2 GLU B 44 4.440 -1.405 0.319 1.00 0.00 O ATOM 0 H GLU B 44 2.097 -3.372 5.027 1.00 0.00 H new ATOM 0 HA GLU B 44 4.657 -1.973 4.347 1.00 0.00 H new ATOM 0 HB2 GLU B 44 1.854 -1.992 3.155 1.00 0.00 H new ATOM 0 HB3 GLU B 44 3.020 -0.746 2.752 1.00 0.00 H new ATOM 0 HG2 GLU B 44 4.624 -2.898 2.369 1.00 0.00 H new ATOM 0 HG3 GLU B 44 3.086 -3.694 2.101 1.00 0.00 H new ATOM 1659 N LYS B 45 2.084 -0.883 6.070 1.00 0.00 N ATOM 1660 CA LYS B 45 1.641 0.224 6.972 1.00 0.00 C ATOM 1661 C LYS B 45 0.901 -0.357 8.183 1.00 0.00 C ATOM 1662 O LYS B 45 -0.063 -1.089 8.041 1.00 0.00 O ATOM 1663 CB LYS B 45 0.709 1.171 6.206 1.00 0.00 C ATOM 1664 CG LYS B 45 1.532 2.294 5.570 1.00 0.00 C ATOM 1665 CD LYS B 45 0.605 3.433 5.136 1.00 0.00 C ATOM 1666 CE LYS B 45 1.290 4.779 5.399 1.00 0.00 C ATOM 1667 NZ LYS B 45 1.165 5.649 4.195 1.00 0.00 N ATOM 0 H LYS B 45 1.473 -1.700 6.060 1.00 0.00 H new ATOM 0 HA LYS B 45 2.515 0.776 7.317 1.00 0.00 H new ATOM 0 HB2 LYS B 45 0.168 0.621 5.436 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -0.036 1.590 6.882 1.00 0.00 H new ATOM 0 HG2 LYS B 45 2.270 2.664 6.281 1.00 0.00 H new ATOM 0 HG3 LYS B 45 2.082 1.912 4.710 1.00 0.00 H new ATOM 0 HD2 LYS B 45 0.364 3.336 4.077 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -0.336 3.379 5.683 1.00 0.00 H new ATOM 0 HE2 LYS B 45 0.836 5.267 6.261 1.00 0.00 H new ATOM 0 HE3 LYS B 45 2.342 4.622 5.639 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 1.844 6.434 4.262 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 1.365 5.091 3.341 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 0.199 6.030 4.141 1.00 0.00 H new ATOM 1681 N THR B 46 1.350 -0.034 9.374 1.00 0.00 N ATOM 1682 CA THR B 46 0.688 -0.557 10.607 1.00 0.00 C ATOM 1683 C THR B 46 -0.090 0.577 11.287 1.00 0.00 C ATOM 1684 O THR B 46 0.482 1.557 11.733 1.00 0.00 O ATOM 1685 CB THR B 46 1.750 -1.111 11.568 1.00 0.00 C ATOM 1686 OG1 THR B 46 2.500 -2.126 10.911 1.00 0.00 O ATOM 1687 CG2 THR B 46 1.070 -1.704 12.805 1.00 0.00 C ATOM 0 H THR B 46 2.152 0.573 9.543 1.00 0.00 H new ATOM 0 HA THR B 46 -0.002 -1.358 10.339 1.00 0.00 H new ATOM 0 HB THR B 46 2.415 -0.303 11.873 1.00 0.00 H new ATOM 0 HG1 THR B 46 3.179 -2.479 11.523 1.00 0.00 H new ATOM 0 HG21 THR B 46 1.827 -2.096 13.484 1.00 0.00 H new ATOM 0 HG22 THR B 46 0.495 -0.928 13.311 1.00 0.00 H new ATOM 0 HG23 THR B 46 0.402 -2.511 12.502 1.00 0.00 H new ATOM 1695 N PHE B 47 -1.393 0.445 11.362 1.00 0.00 N ATOM 1696 CA PHE B 47 -2.237 1.497 12.001 1.00 0.00 C ATOM 1697 C PHE B 47 -2.812 0.977 13.322 1.00 0.00 C ATOM 1698 O PHE B 47 -3.038 -0.205 13.490 1.00 0.00 O ATOM 1699 CB PHE B 47 -3.388 1.859 11.065 1.00 0.00 C ATOM 1700 CG PHE B 47 -2.963 2.956 10.119 1.00 0.00 C ATOM 1701 CD1 PHE B 47 -2.019 2.697 9.117 1.00 0.00 C ATOM 1702 CD2 PHE B 47 -3.520 4.233 10.241 1.00 0.00 C ATOM 1703 CE1 PHE B 47 -1.632 3.718 8.242 1.00 0.00 C ATOM 1704 CE2 PHE B 47 -3.133 5.252 9.366 1.00 0.00 C ATOM 1705 CZ PHE B 47 -2.191 4.995 8.367 1.00 0.00 C ATOM 0 H PHE B 47 -1.911 -0.357 11.003 1.00 0.00 H new ATOM 0 HA PHE B 47 -1.623 2.376 12.196 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -3.697 0.980 10.499 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -4.251 2.184 11.646 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -1.590 1.710 9.020 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -4.250 4.432 11.012 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -0.902 3.521 7.471 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -3.562 6.238 9.462 1.00 0.00 H new ATOM 0 HZ PHE B 47 -1.894 5.783 7.690 1.00 0.00 H new ATOM 1715 N ILE B 48 -3.042 1.859 14.261 1.00 0.00 N ATOM 1716 CA ILE B 48 -3.601 1.442 15.584 1.00 0.00 C ATOM 1717 C ILE B 48 -4.759 2.369 15.973 1.00 0.00 C ATOM 1718 O ILE B 48 -4.697 3.571 15.780 1.00 0.00 O ATOM 1719 CB ILE B 48 -2.508 1.519 16.656 1.00 0.00 C ATOM 1720 CG1 ILE B 48 -1.130 1.393 15.988 1.00 0.00 C ATOM 1721 CG2 ILE B 48 -2.711 0.387 17.670 1.00 0.00 C ATOM 1722 CD1 ILE B 48 -0.068 1.066 17.032 1.00 0.00 C ATOM 0 H ILE B 48 -2.865 2.859 14.167 1.00 0.00 H new ATOM 0 HA ILE B 48 -3.965 0.417 15.509 1.00 0.00 H new ATOM 0 HB ILE B 48 -2.564 2.476 17.175 1.00 0.00 H new ATOM 0 HG12 ILE B 48 -1.156 0.612 15.228 1.00 0.00 H new ATOM 0 HG13 ILE B 48 -0.877 2.324 15.480 1.00 0.00 H new ATOM 0 HG21 ILE B 48 -1.935 0.439 18.434 1.00 0.00 H new ATOM 0 HG22 ILE B 48 -3.689 0.490 18.139 1.00 0.00 H new ATOM 0 HG23 ILE B 48 -2.653 -0.574 17.159 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.904 0.979 16.547 1.00 0.00 H new ATOM 0 HD12 ILE B 48 -0.032 1.861 17.776 1.00 0.00 H new ATOM 0 HD13 ILE B 48 -0.316 0.123 17.520 1.00 0.00 H new ATOM 1734 N ARG B 49 -5.814 1.815 16.523 1.00 0.00 N ATOM 1735 CA ARG B 49 -6.984 2.643 16.932 1.00 0.00 C ATOM 1736 C ARG B 49 -6.629 3.457 18.180 1.00 0.00 C ATOM 1737 O ARG B 49 -6.245 2.910 19.199 1.00 0.00 O ATOM 1738 CB ARG B 49 -8.173 1.730 17.246 1.00 0.00 C ATOM 1739 CG ARG B 49 -9.477 2.485 16.989 1.00 0.00 C ATOM 1740 CD ARG B 49 -10.656 1.665 17.516 1.00 0.00 C ATOM 1741 NE ARG B 49 -11.475 2.506 18.436 1.00 0.00 N ATOM 1742 CZ ARG B 49 -12.485 3.193 17.972 1.00 0.00 C ATOM 1743 NH1 ARG B 49 -13.670 2.645 17.897 1.00 0.00 N ATOM 1744 NH2 ARG B 49 -12.309 4.429 17.583 1.00 0.00 N ATOM 0 H ARG B 49 -5.911 0.816 16.706 1.00 0.00 H new ATOM 0 HA ARG B 49 -7.246 3.320 16.119 1.00 0.00 H new ATOM 0 HB2 ARG B 49 -8.131 0.834 16.627 1.00 0.00 H new ATOM 0 HB3 ARG B 49 -8.129 1.402 18.284 1.00 0.00 H new ATOM 0 HG2 ARG B 49 -9.449 3.458 17.480 1.00 0.00 H new ATOM 0 HG3 ARG B 49 -9.598 2.670 15.922 1.00 0.00 H new ATOM 0 HD2 ARG B 49 -11.268 1.313 16.686 1.00 0.00 H new ATOM 0 HD3 ARG B 49 -10.293 0.781 18.041 1.00 0.00 H new ATOM 0 HE ARG B 49 -11.246 2.545 19.429 1.00 0.00 H new ATOM 0 HH11 ARG B 49 -13.806 1.681 18.201 1.00 0.00 H new ATOM 0 HH12 ARG B 49 -14.458 3.182 17.535 1.00 0.00 H new ATOM 0 HH21 ARG B 49 -11.384 4.855 17.642 1.00 0.00 H new ATOM 0 HH22 ARG B 49 -13.096 4.967 17.221 1.00 0.00 H new