USER MOD reduce.3.24.130724 H: found=0, std=0, add=947, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 947 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 14 LYS NZ :NH3+ -178:sc= 0.834 (180deg=0.713) USER MOD Set 1.2: A 44 SER OG : rot -144:sc= 1.05 USER MOD Set 2.1: A 23 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 118 HIS : no HE2:sc= -0.246 X(o=-0.25,f=-0.25) USER MOD Set 3.1: A 20 ASN : amide:sc= -0.699 X(o=-0.41,f=-0.63) USER MOD Set 3.2: A 22 ASN : amide:sc= 0.292 X(o=-0.41,f=-0.63) USER MOD Single : A 1 MET CE :methyl -153:sc= 0 (180deg=-0.291) USER MOD Single : A 1 MET N :NH3+ 131:sc= 0.0822 (180deg=0) USER MOD Single : A 6 SER OG : rot 79:sc= -0.397 USER MOD Single : A 8 SER OG : rot -90:sc= 1.19 USER MOD Single : A 12 LYS NZ :NH3+ -173:sc= 1.26 (180deg=1.22) USER MOD Single : A 19 SER OG : rot 85:sc= 0.0693 USER MOD Single : A 21 LYS NZ :NH3+ -143:sc= -0.321 (180deg=-2.01!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0183 USER MOD Single : A 29 THR OG1 : rot 170:sc= -0.118 USER MOD Single : A 33 SER OG : rot 83:sc= 0.418 USER MOD Single : A 37 LYS NZ :NH3+ 140:sc= -0.678 (180deg=-2.69!) USER MOD Single : A 38 SER OG : rot 86:sc= 0.00875 USER MOD Single : A 56 SER OG : rot 180:sc= 0.127 USER MOD Single : A 57 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ -156:sc= 1.24 (180deg=0.927) USER MOD Single : A 64 ASN : amide:sc= 0.223 X(o=0.22,f=-0.12) USER MOD Single : A 67 GLN : amide:sc= -0.944 K(o=-0.94,f=-0.18) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 75:sc= 0.704 USER MOD Single : A 74 MET CE :methyl -112:sc= -0.605 (180deg=-2.44!) USER MOD Single : A 80 ASN : amide:sc= -1.13 K(o=-1.1,f=-0.047) USER MOD Single : A 88 LYS NZ :NH3+ 172:sc= 1.24 (180deg=1.13) USER MOD Single : A 92 ASN : amide:sc= -1.06 K(o=-1.1,f=0) USER MOD Single : A 93 LYS NZ :NH3+ -164:sc= 1.25 (180deg=1.06) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= -0.258 X(o=-0.26,f=0) USER MOD Single : A 110 SER OG : rot 90:sc= 1.25 USER MOD Single : A 111 SER OG : rot 9:sc= 0.0805 USER MOD Single : A 114 HIS : no HE2:sc= 0.356 K(o=0.36,f=-1.6) USER MOD Single : A 115 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=-0.063) USER MOD Single : A 117 HIS : no HD1:sc=-0.00015 X(o=-0.00015,f=-0.32) USER MOD Single : A 119 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.411 -11.246 -10.308 1.00 0.00 N ATOM 2 CA MET A 1 0.260 -11.375 -8.867 1.00 0.00 C ATOM 3 C MET A 1 -0.884 -10.493 -8.444 1.00 0.00 C ATOM 4 O MET A 1 -1.076 -9.404 -9.010 1.00 0.00 O ATOM 5 CB MET A 1 1.556 -10.941 -8.145 1.00 0.00 C ATOM 6 CG MET A 1 1.563 -11.214 -6.640 1.00 0.00 C ATOM 7 SD MET A 1 3.070 -10.644 -5.823 1.00 0.00 S ATOM 8 CE MET A 1 2.806 -11.276 -4.164 1.00 0.00 C ATOM 0 H1 MET A 1 1.409 -11.067 -10.538 1.00 0.00 H new ATOM 0 H2 MET A 1 0.102 -12.125 -10.770 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.170 -10.453 -10.648 1.00 0.00 H new ATOM 0 HA MET A 1 0.062 -12.414 -8.603 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.401 -11.458 -8.600 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.709 -9.874 -8.309 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.702 -10.725 -6.184 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.448 -12.285 -6.470 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.341 -10.652 -3.448 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.741 -11.261 -3.934 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.176 -12.299 -4.101 1.00 0.00 H new ATOM 20 N PHE A 2 -1.650 -10.946 -7.494 1.00 0.00 N ATOM 21 CA PHE A 2 -2.767 -10.195 -7.007 1.00 0.00 C ATOM 22 C PHE A 2 -2.305 -9.273 -5.896 1.00 0.00 C ATOM 23 O PHE A 2 -1.323 -9.568 -5.193 1.00 0.00 O ATOM 24 CB PHE A 2 -3.868 -11.126 -6.468 1.00 0.00 C ATOM 25 CG PHE A 2 -4.411 -12.124 -7.460 1.00 0.00 C ATOM 26 CD1 PHE A 2 -5.220 -11.717 -8.505 1.00 0.00 C ATOM 27 CD2 PHE A 2 -4.114 -13.472 -7.338 1.00 0.00 C ATOM 28 CE1 PHE A 2 -5.721 -12.632 -9.410 1.00 0.00 C ATOM 29 CE2 PHE A 2 -4.610 -14.388 -8.236 1.00 0.00 C ATOM 30 CZ PHE A 2 -5.414 -13.970 -9.274 1.00 0.00 C ATOM 0 H PHE A 2 -1.516 -11.847 -7.036 1.00 0.00 H new ATOM 0 HA PHE A 2 -3.178 -9.615 -7.833 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -3.473 -11.670 -5.610 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -4.693 -10.513 -6.105 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -5.463 -10.670 -8.615 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -3.485 -13.808 -6.527 1.00 0.00 H new ATOM 0 HE1 PHE A 2 -6.351 -12.301 -10.222 1.00 0.00 H new ATOM 0 HE2 PHE A 2 -4.369 -15.435 -8.128 1.00 0.00 H new ATOM 0 HZ PHE A 2 -5.803 -14.689 -9.980 1.00 0.00 H new ATOM 40 N ALA A 3 -2.967 -8.170 -5.767 1.00 0.00 N ATOM 41 CA ALA A 3 -2.717 -7.234 -4.709 1.00 0.00 C ATOM 42 C ALA A 3 -4.034 -6.946 -4.033 1.00 0.00 C ATOM 43 O ALA A 3 -4.891 -6.294 -4.602 1.00 0.00 O ATOM 44 CB ALA A 3 -2.085 -5.957 -5.247 1.00 0.00 C ATOM 0 H ALA A 3 -3.711 -7.885 -6.403 1.00 0.00 H new ATOM 0 HA ALA A 3 -2.011 -7.654 -3.992 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -1.906 -5.265 -4.424 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -1.139 -6.196 -5.732 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -2.757 -5.495 -5.970 1.00 0.00 H new ATOM 50 N VAL A 4 -4.197 -7.438 -2.843 1.00 0.00 N ATOM 51 CA VAL A 4 -5.457 -7.333 -2.149 1.00 0.00 C ATOM 52 C VAL A 4 -5.466 -6.082 -1.292 1.00 0.00 C ATOM 53 O VAL A 4 -4.538 -5.828 -0.524 1.00 0.00 O ATOM 54 CB VAL A 4 -5.749 -8.594 -1.279 1.00 0.00 C ATOM 55 CG1 VAL A 4 -7.112 -8.493 -0.599 1.00 0.00 C ATOM 56 CG2 VAL A 4 -5.689 -9.856 -2.129 1.00 0.00 C ATOM 0 H VAL A 4 -3.467 -7.923 -2.322 1.00 0.00 H new ATOM 0 HA VAL A 4 -6.248 -7.267 -2.896 1.00 0.00 H new ATOM 0 HB VAL A 4 -4.982 -8.647 -0.507 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -7.287 -9.387 0.000 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -7.133 -7.614 0.045 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -7.891 -8.406 -1.356 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -5.895 -10.725 -1.505 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -6.433 -9.795 -2.924 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -4.696 -9.952 -2.568 1.00 0.00 H new ATOM 66 N ILE A 5 -6.491 -5.306 -1.457 1.00 0.00 N ATOM 67 CA ILE A 5 -6.646 -4.059 -0.769 1.00 0.00 C ATOM 68 C ILE A 5 -7.468 -4.269 0.497 1.00 0.00 C ATOM 69 O ILE A 5 -8.578 -4.815 0.442 1.00 0.00 O ATOM 70 CB ILE A 5 -7.364 -3.032 -1.690 1.00 0.00 C ATOM 71 CG1 ILE A 5 -6.606 -2.917 -3.031 1.00 0.00 C ATOM 72 CG2 ILE A 5 -7.453 -1.666 -1.001 1.00 0.00 C ATOM 73 CD1 ILE A 5 -7.265 -2.022 -4.055 1.00 0.00 C ATOM 0 H ILE A 5 -7.262 -5.525 -2.088 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.661 -3.675 -0.502 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.379 -3.378 -1.887 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -5.602 -2.542 -2.834 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -6.496 -3.914 -3.457 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.958 -0.959 -1.659 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -8.015 -1.763 -0.072 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -6.449 -1.303 -0.781 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.662 -2.003 -4.963 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -8.259 -2.405 -4.287 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -7.350 -1.012 -3.654 1.00 0.00 H new ATOM 85 N SER A 6 -6.918 -3.883 1.624 1.00 0.00 N ATOM 86 CA SER A 6 -7.635 -3.961 2.872 1.00 0.00 C ATOM 87 C SER A 6 -8.449 -2.670 3.054 1.00 0.00 C ATOM 88 O SER A 6 -8.046 -1.619 2.558 1.00 0.00 O ATOM 89 CB SER A 6 -6.646 -4.152 4.018 1.00 0.00 C ATOM 90 OG SER A 6 -5.806 -5.255 3.749 1.00 0.00 O ATOM 0 H SER A 6 -5.972 -3.510 1.701 1.00 0.00 H new ATOM 0 HA SER A 6 -8.317 -4.812 2.868 1.00 0.00 H new ATOM 0 HB2 SER A 6 -6.047 -3.251 4.147 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.185 -4.313 4.952 1.00 0.00 H new ATOM 0 HG SER A 6 -5.105 -4.986 3.119 1.00 0.00 H new ATOM 96 N PRO A 7 -9.610 -2.728 3.727 1.00 0.00 N ATOM 97 CA PRO A 7 -10.478 -1.553 3.953 1.00 0.00 C ATOM 98 C PRO A 7 -9.802 -0.401 4.715 1.00 0.00 C ATOM 99 O PRO A 7 -10.268 0.743 4.668 1.00 0.00 O ATOM 100 CB PRO A 7 -11.665 -2.119 4.723 1.00 0.00 C ATOM 101 CG PRO A 7 -11.657 -3.559 4.364 1.00 0.00 C ATOM 102 CD PRO A 7 -10.216 -3.939 4.285 1.00 0.00 C ATOM 0 HA PRO A 7 -10.755 -1.088 3.007 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -11.553 -1.973 5.797 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -12.599 -1.638 4.431 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -12.180 -4.154 5.113 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -12.161 -3.730 3.413 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -9.805 -4.186 5.264 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -10.058 -4.807 3.644 1.00 0.00 H new ATOM 110 N SER A 8 -8.725 -0.693 5.411 1.00 0.00 N ATOM 111 CA SER A 8 -7.931 0.336 6.046 1.00 0.00 C ATOM 112 C SER A 8 -7.202 1.194 4.997 1.00 0.00 C ATOM 113 O SER A 8 -6.809 2.323 5.268 1.00 0.00 O ATOM 114 CB SER A 8 -6.951 -0.298 7.041 1.00 0.00 C ATOM 115 OG SER A 8 -6.339 -1.467 6.490 1.00 0.00 O ATOM 0 H SER A 8 -8.377 -1.641 5.552 1.00 0.00 H new ATOM 0 HA SER A 8 -8.593 1.002 6.600 1.00 0.00 H new ATOM 0 HB2 SER A 8 -6.182 0.426 7.310 1.00 0.00 H new ATOM 0 HB3 SER A 8 -7.478 -0.558 7.959 1.00 0.00 H new ATOM 0 HG SER A 8 -6.885 -2.253 6.702 1.00 0.00 H new ATOM 121 N ALA A 9 -7.077 0.660 3.797 1.00 0.00 N ATOM 122 CA ALA A 9 -6.385 1.314 2.703 1.00 0.00 C ATOM 123 C ALA A 9 -7.381 1.991 1.749 1.00 0.00 C ATOM 124 O ALA A 9 -7.024 2.416 0.642 1.00 0.00 O ATOM 125 CB ALA A 9 -5.543 0.276 1.963 1.00 0.00 C ATOM 0 H ALA A 9 -7.459 -0.253 3.551 1.00 0.00 H new ATOM 0 HA ALA A 9 -5.735 2.094 3.100 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -5.017 0.756 1.137 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -4.818 -0.161 2.650 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -6.192 -0.508 1.573 1.00 0.00 H new ATOM 131 N PHE A 10 -8.618 2.121 2.188 1.00 0.00 N ATOM 132 CA PHE A 10 -9.659 2.715 1.364 1.00 0.00 C ATOM 133 C PHE A 10 -9.502 4.209 1.179 1.00 0.00 C ATOM 134 O PHE A 10 -8.882 4.900 1.984 1.00 0.00 O ATOM 135 CB PHE A 10 -11.060 2.375 1.848 1.00 0.00 C ATOM 136 CG PHE A 10 -11.516 0.973 1.546 1.00 0.00 C ATOM 137 CD1 PHE A 10 -10.706 0.072 0.857 1.00 0.00 C ATOM 138 CD2 PHE A 10 -12.766 0.562 1.948 1.00 0.00 C ATOM 139 CE1 PHE A 10 -11.147 -1.200 0.587 1.00 0.00 C ATOM 140 CE2 PHE A 10 -13.208 -0.709 1.679 1.00 0.00 C ATOM 141 CZ PHE A 10 -12.398 -1.590 1.002 1.00 0.00 C ATOM 0 H PHE A 10 -8.930 1.823 3.112 1.00 0.00 H new ATOM 0 HA PHE A 10 -9.528 2.258 0.383 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -11.103 2.530 2.926 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -11.764 3.075 1.397 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -9.722 0.377 0.532 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -13.407 1.248 2.482 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -10.514 -1.891 0.051 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -14.192 -1.017 1.999 1.00 0.00 H new ATOM 0 HZ PHE A 10 -12.746 -2.591 0.796 1.00 0.00 H new ATOM 151 N GLY A 11 -10.043 4.686 0.068 1.00 0.00 N ATOM 152 CA GLY A 11 -9.954 6.075 -0.309 1.00 0.00 C ATOM 153 C GLY A 11 -8.700 6.341 -1.111 1.00 0.00 C ATOM 154 O GLY A 11 -8.694 7.140 -2.042 1.00 0.00 O ATOM 0 H GLY A 11 -10.558 4.110 -0.597 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -10.830 6.353 -0.895 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -9.957 6.699 0.585 1.00 0.00 H new ATOM 158 N LYS A 12 -7.658 5.609 -0.787 1.00 0.00 N ATOM 159 CA LYS A 12 -6.361 5.793 -1.380 1.00 0.00 C ATOM 160 C LYS A 12 -6.058 4.712 -2.425 1.00 0.00 C ATOM 161 O LYS A 12 -4.918 4.598 -2.923 1.00 0.00 O ATOM 162 CB LYS A 12 -5.333 5.796 -0.274 1.00 0.00 C ATOM 163 CG LYS A 12 -5.583 6.874 0.772 1.00 0.00 C ATOM 164 CD LYS A 12 -4.672 6.723 1.966 1.00 0.00 C ATOM 165 CE LYS A 12 -3.209 6.878 1.599 1.00 0.00 C ATOM 166 NZ LYS A 12 -2.345 6.830 2.788 1.00 0.00 N ATOM 0 H LYS A 12 -7.692 4.861 -0.095 1.00 0.00 H new ATOM 0 HA LYS A 12 -6.334 6.745 -1.911 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -5.329 4.821 0.212 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -4.343 5.941 -0.707 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -5.434 7.856 0.324 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -6.622 6.828 1.100 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -4.936 7.467 2.718 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -4.829 5.744 2.418 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -2.921 6.087 0.907 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -3.062 7.825 1.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -1.367 7.057 2.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -2.679 7.523 3.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -2.377 5.876 3.202 1.00 0.00 H new ATOM 180 N LEU A 13 -7.103 3.948 -2.798 1.00 0.00 N ATOM 181 CA LEU A 13 -6.992 2.903 -3.842 1.00 0.00 C ATOM 182 C LEU A 13 -6.549 3.552 -5.141 1.00 0.00 C ATOM 183 O LEU A 13 -5.829 2.970 -5.938 1.00 0.00 O ATOM 184 CB LEU A 13 -8.339 2.171 -4.138 1.00 0.00 C ATOM 185 CG LEU A 13 -9.063 1.405 -3.017 1.00 0.00 C ATOM 186 CD1 LEU A 13 -9.817 2.332 -2.104 1.00 0.00 C ATOM 187 CD2 LEU A 13 -10.007 0.369 -3.602 1.00 0.00 C ATOM 0 H LEU A 13 -8.035 4.033 -2.393 1.00 0.00 H new ATOM 0 HA LEU A 13 -6.279 2.170 -3.466 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -9.035 2.917 -4.522 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.152 1.463 -4.945 1.00 0.00 H new ATOM 0 HG LEU A 13 -8.300 0.900 -2.425 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -10.314 1.752 -1.326 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -9.122 3.035 -1.644 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -10.562 2.882 -2.679 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -10.510 -0.162 -2.794 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -10.749 0.865 -4.227 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -9.440 -0.340 -4.205 1.00 0.00 H new ATOM 199 N LYS A 14 -6.977 4.784 -5.305 1.00 0.00 N ATOM 200 CA LYS A 14 -6.724 5.576 -6.485 1.00 0.00 C ATOM 201 C LYS A 14 -5.219 5.771 -6.714 1.00 0.00 C ATOM 202 O LYS A 14 -4.742 5.667 -7.856 1.00 0.00 O ATOM 203 CB LYS A 14 -7.446 6.913 -6.337 1.00 0.00 C ATOM 204 CG LYS A 14 -8.939 6.739 -6.037 1.00 0.00 C ATOM 205 CD LYS A 14 -9.657 8.061 -5.801 1.00 0.00 C ATOM 206 CE LYS A 14 -9.708 8.918 -7.049 1.00 0.00 C ATOM 207 NZ LYS A 14 -10.434 8.245 -8.145 1.00 0.00 N ATOM 0 H LYS A 14 -7.526 5.275 -4.600 1.00 0.00 H new ATOM 0 HA LYS A 14 -7.105 5.055 -7.363 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -6.981 7.487 -5.535 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -7.327 7.491 -7.254 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -9.413 6.218 -6.869 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -9.056 6.106 -5.157 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -10.672 7.864 -5.456 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -9.151 8.610 -5.006 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -10.194 9.866 -6.819 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.693 9.150 -7.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -10.419 8.847 -8.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -9.976 7.336 -8.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -11.419 8.077 -7.857 1.00 0.00 H new ATOM 221 N GLU A 15 -4.467 5.987 -5.625 1.00 0.00 N ATOM 222 CA GLU A 15 -3.026 6.181 -5.721 1.00 0.00 C ATOM 223 C GLU A 15 -2.329 4.902 -6.142 1.00 0.00 C ATOM 224 O GLU A 15 -1.656 4.874 -7.160 1.00 0.00 O ATOM 225 CB GLU A 15 -2.410 6.710 -4.412 1.00 0.00 C ATOM 226 CG GLU A 15 -2.797 8.136 -4.062 1.00 0.00 C ATOM 227 CD GLU A 15 -2.091 8.648 -2.816 1.00 0.00 C ATOM 228 OE1 GLU A 15 -0.896 9.041 -2.902 1.00 0.00 O ATOM 229 OE2 GLU A 15 -2.712 8.678 -1.734 1.00 0.00 O ATOM 0 H GLU A 15 -4.837 6.030 -4.675 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.871 6.941 -6.487 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -2.710 6.055 -3.594 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -1.324 6.650 -4.487 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -2.561 8.789 -4.902 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.875 8.189 -3.911 1.00 0.00 H new ATOM 236 N ILE A 16 -2.536 3.827 -5.385 1.00 0.00 N ATOM 237 CA ILE A 16 -1.856 2.543 -5.663 1.00 0.00 C ATOM 238 C ILE A 16 -2.159 2.014 -7.063 1.00 0.00 C ATOM 239 O ILE A 16 -1.280 1.488 -7.752 1.00 0.00 O ATOM 240 CB ILE A 16 -2.178 1.451 -4.601 1.00 0.00 C ATOM 241 CG1 ILE A 16 -3.695 1.256 -4.459 1.00 0.00 C ATOM 242 CG2 ILE A 16 -1.558 1.822 -3.273 1.00 0.00 C ATOM 243 CD1 ILE A 16 -4.112 0.217 -3.449 1.00 0.00 C ATOM 0 H ILE A 16 -3.161 3.808 -4.579 1.00 0.00 H new ATOM 0 HA ILE A 16 -0.790 2.765 -5.605 1.00 0.00 H new ATOM 0 HB ILE A 16 -1.750 0.505 -4.934 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -4.145 2.210 -4.183 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -4.103 0.980 -5.431 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -1.788 1.052 -2.536 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -0.477 1.904 -3.386 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -1.961 2.778 -2.938 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -5.200 0.152 -3.421 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -3.698 -0.751 -3.731 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -3.740 0.498 -2.464 1.00 0.00 H new ATOM 255 N LEU A 17 -3.380 2.205 -7.484 1.00 0.00 N ATOM 256 CA LEU A 17 -3.832 1.741 -8.760 1.00 0.00 C ATOM 257 C LEU A 17 -3.250 2.582 -9.891 1.00 0.00 C ATOM 258 O LEU A 17 -2.696 2.046 -10.838 1.00 0.00 O ATOM 259 CB LEU A 17 -5.356 1.775 -8.775 1.00 0.00 C ATOM 260 CG LEU A 17 -6.076 1.317 -10.035 1.00 0.00 C ATOM 261 CD1 LEU A 17 -5.697 -0.108 -10.412 1.00 0.00 C ATOM 262 CD2 LEU A 17 -7.558 1.414 -9.798 1.00 0.00 C ATOM 0 H LEU A 17 -4.094 2.693 -6.942 1.00 0.00 H new ATOM 0 HA LEU A 17 -3.488 0.719 -8.919 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -5.710 1.160 -7.948 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -5.668 2.799 -8.568 1.00 0.00 H new ATOM 0 HG LEU A 17 -5.780 1.959 -10.865 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -6.231 -0.399 -11.316 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -4.623 -0.164 -10.591 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -5.965 -0.783 -9.599 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -8.091 1.089 -10.691 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -7.835 0.776 -8.958 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -7.824 2.447 -9.572 1.00 0.00 H new ATOM 274 N GLY A 18 -3.321 3.889 -9.752 1.00 0.00 N ATOM 275 CA GLY A 18 -2.906 4.767 -10.826 1.00 0.00 C ATOM 276 C GLY A 18 -1.419 5.007 -10.893 1.00 0.00 C ATOM 277 O GLY A 18 -0.873 5.206 -11.973 1.00 0.00 O ATOM 0 H GLY A 18 -3.659 4.364 -8.915 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -3.237 4.343 -11.774 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -3.412 5.726 -10.712 1.00 0.00 H new ATOM 281 N SER A 19 -0.760 4.995 -9.769 1.00 0.00 N ATOM 282 CA SER A 19 0.653 5.284 -9.738 1.00 0.00 C ATOM 283 C SER A 19 1.507 4.046 -9.961 1.00 0.00 C ATOM 284 O SER A 19 2.653 4.156 -10.378 1.00 0.00 O ATOM 285 CB SER A 19 1.012 5.946 -8.422 1.00 0.00 C ATOM 286 OG SER A 19 0.188 7.080 -8.207 1.00 0.00 O ATOM 0 H SER A 19 -1.175 4.789 -8.860 1.00 0.00 H new ATOM 0 HA SER A 19 0.866 5.965 -10.562 1.00 0.00 H new ATOM 0 HB2 SER A 19 0.889 5.237 -7.604 1.00 0.00 H new ATOM 0 HB3 SER A 19 2.060 6.245 -8.430 1.00 0.00 H new ATOM 0 HG SER A 19 -0.657 6.798 -7.798 1.00 0.00 H new ATOM 292 N ASN A 20 0.966 2.878 -9.702 1.00 0.00 N ATOM 293 CA ASN A 20 1.769 1.676 -9.851 1.00 0.00 C ATOM 294 C ASN A 20 1.263 0.777 -10.949 1.00 0.00 C ATOM 295 O ASN A 20 2.012 0.477 -11.888 1.00 0.00 O ATOM 296 CB ASN A 20 1.861 0.883 -8.543 1.00 0.00 C ATOM 297 CG ASN A 20 2.764 -0.354 -8.658 1.00 0.00 C ATOM 298 OD1 ASN A 20 3.750 -0.378 -9.404 1.00 0.00 O ATOM 299 ND2 ASN A 20 2.428 -1.389 -7.939 1.00 0.00 N ATOM 0 H ASN A 20 0.004 2.730 -9.396 1.00 0.00 H new ATOM 0 HA ASN A 20 2.766 2.021 -10.125 1.00 0.00 H new ATOM 0 HB2 ASN A 20 2.242 1.533 -7.756 1.00 0.00 H new ATOM 0 HB3 ASN A 20 0.861 0.570 -8.242 1.00 0.00 H new ATOM 0 HD21 ASN A 20 2.983 -2.243 -7.984 1.00 0.00 H new ATOM 0 HD22 ASN A 20 1.610 -1.344 -7.331 1.00 0.00 H new ATOM 306 N LYS A 21 -0.030 0.382 -10.864 1.00 0.00 N ATOM 307 CA LYS A 21 -0.595 -0.641 -11.755 1.00 0.00 C ATOM 308 C LYS A 21 0.223 -1.931 -11.497 1.00 0.00 C ATOM 309 O LYS A 21 0.516 -2.222 -10.337 1.00 0.00 O ATOM 310 CB LYS A 21 -0.528 -0.170 -13.241 1.00 0.00 C ATOM 311 CG LYS A 21 -1.300 1.128 -13.511 1.00 0.00 C ATOM 312 CD LYS A 21 -1.209 1.646 -14.964 1.00 0.00 C ATOM 313 CE LYS A 21 -2.014 0.818 -15.990 1.00 0.00 C ATOM 314 NZ LYS A 21 -1.410 -0.494 -16.328 1.00 0.00 N ATOM 0 H LYS A 21 -0.694 0.759 -10.187 1.00 0.00 H new ATOM 0 HA LYS A 21 -1.651 -0.824 -11.557 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.516 -0.027 -13.521 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.924 -0.958 -13.881 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -2.349 0.969 -13.262 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -0.927 1.902 -12.840 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -1.561 2.677 -14.992 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -0.162 1.658 -15.267 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -3.017 0.652 -15.598 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -2.122 1.401 -16.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -1.560 -0.695 -17.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -0.390 -0.468 -16.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -1.856 -1.239 -15.756 1.00 0.00 H new ATOM 328 N ASN A 22 0.521 -2.726 -12.529 1.00 0.00 N ATOM 329 CA ASN A 22 1.479 -3.899 -12.431 1.00 0.00 C ATOM 330 C ASN A 22 0.961 -5.099 -11.627 1.00 0.00 C ATOM 331 O ASN A 22 1.540 -6.188 -11.688 1.00 0.00 O ATOM 332 CB ASN A 22 2.842 -3.460 -11.841 1.00 0.00 C ATOM 333 CG ASN A 22 3.613 -2.499 -12.717 1.00 0.00 C ATOM 334 OD1 ASN A 22 3.564 -2.578 -13.949 1.00 0.00 O ATOM 335 ND2 ASN A 22 4.269 -1.546 -12.107 1.00 0.00 N ATOM 0 H ASN A 22 0.124 -2.601 -13.460 1.00 0.00 H new ATOM 0 HA ASN A 22 1.588 -4.236 -13.462 1.00 0.00 H new ATOM 0 HB2 ASN A 22 2.672 -2.994 -10.870 1.00 0.00 H new ATOM 0 HB3 ASN A 22 3.453 -4.346 -11.667 1.00 0.00 H new ATOM 0 HD21 ASN A 22 4.761 -0.837 -12.651 1.00 0.00 H new ATOM 0 HD22 ASN A 22 4.288 -1.512 -11.088 1.00 0.00 H new ATOM 342 N TYR A 23 -0.088 -4.920 -10.888 1.00 0.00 N ATOM 343 CA TYR A 23 -0.665 -5.985 -10.098 1.00 0.00 C ATOM 344 C TYR A 23 -2.136 -6.067 -10.384 1.00 0.00 C ATOM 345 O TYR A 23 -2.740 -5.086 -10.837 1.00 0.00 O ATOM 346 CB TYR A 23 -0.490 -5.727 -8.586 1.00 0.00 C ATOM 347 CG TYR A 23 0.924 -5.809 -8.028 1.00 0.00 C ATOM 348 CD1 TYR A 23 1.749 -4.691 -7.980 1.00 0.00 C ATOM 349 CD2 TYR A 23 1.412 -7.000 -7.506 1.00 0.00 C ATOM 350 CE1 TYR A 23 3.024 -4.762 -7.436 1.00 0.00 C ATOM 351 CE2 TYR A 23 2.677 -7.077 -6.953 1.00 0.00 C ATOM 352 CZ TYR A 23 3.479 -5.955 -6.922 1.00 0.00 C ATOM 353 OH TYR A 23 4.745 -6.026 -6.355 1.00 0.00 O ATOM 0 H TYR A 23 -0.578 -4.029 -10.809 1.00 0.00 H new ATOM 0 HA TYR A 23 -0.155 -6.911 -10.363 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -0.884 -4.735 -8.364 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -1.109 -6.444 -8.047 1.00 0.00 H new ATOM 0 HD1 TYR A 23 1.392 -3.751 -8.373 1.00 0.00 H new ATOM 0 HD2 TYR A 23 0.791 -7.883 -7.533 1.00 0.00 H new ATOM 0 HE1 TYR A 23 3.655 -3.886 -7.416 1.00 0.00 H new ATOM 0 HE2 TYR A 23 3.036 -8.011 -6.547 1.00 0.00 H new ATOM 0 HH TYR A 23 4.911 -6.939 -6.039 1.00 0.00 H new ATOM 363 N LYS A 24 -2.716 -7.212 -10.154 1.00 0.00 N ATOM 364 CA LYS A 24 -4.139 -7.343 -10.265 1.00 0.00 C ATOM 365 C LYS A 24 -4.693 -7.005 -8.907 1.00 0.00 C ATOM 366 O LYS A 24 -4.584 -7.794 -7.969 1.00 0.00 O ATOM 367 CB LYS A 24 -4.557 -8.770 -10.666 1.00 0.00 C ATOM 368 CG LYS A 24 -6.067 -8.987 -10.913 1.00 0.00 C ATOM 369 CD LYS A 24 -6.538 -8.641 -12.349 1.00 0.00 C ATOM 370 CE LYS A 24 -6.416 -7.165 -12.721 1.00 0.00 C ATOM 371 NZ LYS A 24 -6.928 -6.907 -14.088 1.00 0.00 N ATOM 0 H LYS A 24 -2.225 -8.066 -9.889 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.521 -6.682 -11.043 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.017 -9.045 -11.572 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -4.234 -9.456 -9.883 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -6.311 -10.029 -10.705 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -6.630 -8.380 -10.203 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.958 -9.230 -13.059 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -7.579 -8.945 -12.459 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -6.970 -6.560 -12.003 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -5.372 -6.857 -12.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -6.831 -5.896 -14.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -6.382 -7.466 -14.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -7.931 -7.178 -14.140 1.00 0.00 H new ATOM 385 N PHE A 25 -5.210 -5.826 -8.783 1.00 0.00 N ATOM 386 CA PHE A 25 -5.716 -5.365 -7.525 1.00 0.00 C ATOM 387 C PHE A 25 -7.036 -6.032 -7.223 1.00 0.00 C ATOM 388 O PHE A 25 -7.950 -6.045 -8.047 1.00 0.00 O ATOM 389 CB PHE A 25 -5.838 -3.847 -7.517 1.00 0.00 C ATOM 390 CG PHE A 25 -4.517 -3.124 -7.604 1.00 0.00 C ATOM 391 CD1 PHE A 25 -3.950 -2.826 -8.831 1.00 0.00 C ATOM 392 CD2 PHE A 25 -3.843 -2.745 -6.454 1.00 0.00 C ATOM 393 CE1 PHE A 25 -2.740 -2.168 -8.912 1.00 0.00 C ATOM 394 CE2 PHE A 25 -2.631 -2.084 -6.532 1.00 0.00 C ATOM 395 CZ PHE A 25 -2.081 -1.796 -7.762 1.00 0.00 C ATOM 0 H PHE A 25 -5.295 -5.155 -9.546 1.00 0.00 H new ATOM 0 HA PHE A 25 -5.013 -5.637 -6.738 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -6.465 -3.539 -8.354 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -6.350 -3.539 -6.605 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -4.462 -3.113 -9.738 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -4.269 -2.968 -5.487 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -2.310 -1.945 -9.877 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -2.115 -1.793 -5.629 1.00 0.00 H new ATOM 0 HZ PHE A 25 -1.135 -1.279 -7.824 1.00 0.00 H new ATOM 405 N VAL A 26 -7.099 -6.612 -6.073 1.00 0.00 N ATOM 406 CA VAL A 26 -8.235 -7.349 -5.623 1.00 0.00 C ATOM 407 C VAL A 26 -8.832 -6.659 -4.423 1.00 0.00 C ATOM 408 O VAL A 26 -8.139 -6.357 -3.451 1.00 0.00 O ATOM 409 CB VAL A 26 -7.840 -8.803 -5.238 1.00 0.00 C ATOM 410 CG1 VAL A 26 -9.030 -9.581 -4.703 1.00 0.00 C ATOM 411 CG2 VAL A 26 -7.237 -9.528 -6.425 1.00 0.00 C ATOM 0 H VAL A 26 -6.336 -6.586 -5.396 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.963 -7.393 -6.433 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.094 -8.738 -4.446 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -8.717 -10.592 -4.444 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -9.420 -9.084 -3.815 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.808 -9.626 -5.465 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.968 -10.543 -6.133 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.964 -9.564 -7.237 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -6.345 -8.998 -6.760 1.00 0.00 H new ATOM 421 N ILE A 27 -10.079 -6.396 -4.505 1.00 0.00 N ATOM 422 CA ILE A 27 -10.798 -5.785 -3.453 1.00 0.00 C ATOM 423 C ILE A 27 -11.806 -6.861 -2.967 1.00 0.00 C ATOM 424 O ILE A 27 -12.249 -7.707 -3.760 1.00 0.00 O ATOM 425 CB ILE A 27 -11.485 -4.479 -4.010 1.00 0.00 C ATOM 426 CG1 ILE A 27 -11.680 -3.367 -2.952 1.00 0.00 C ATOM 427 CG2 ILE A 27 -12.773 -4.759 -4.764 1.00 0.00 C ATOM 428 CD1 ILE A 27 -12.522 -3.720 -1.766 1.00 0.00 C ATOM 0 H ILE A 27 -10.645 -6.605 -5.327 1.00 0.00 H new ATOM 0 HA ILE A 27 -10.181 -5.466 -2.613 1.00 0.00 H new ATOM 0 HB ILE A 27 -10.767 -4.087 -4.730 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -10.697 -3.059 -2.594 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -12.126 -2.502 -3.443 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -13.197 -3.821 -5.122 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -12.563 -5.409 -5.613 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -13.485 -5.248 -4.099 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -12.585 -2.862 -1.096 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -13.523 -3.995 -2.099 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -12.072 -4.560 -1.237 1.00 0.00 H new ATOM 440 N THR A 28 -12.089 -6.892 -1.700 1.00 0.00 N ATOM 441 CA THR A 28 -12.962 -7.895 -1.152 1.00 0.00 C ATOM 442 C THR A 28 -14.436 -7.510 -1.275 1.00 0.00 C ATOM 443 O THR A 28 -14.777 -6.327 -1.458 1.00 0.00 O ATOM 444 CB THR A 28 -12.604 -8.151 0.317 1.00 0.00 C ATOM 445 OG1 THR A 28 -12.539 -6.892 1.026 1.00 0.00 O ATOM 446 CG2 THR A 28 -11.267 -8.851 0.419 1.00 0.00 C ATOM 0 H THR A 28 -11.725 -6.228 -1.017 1.00 0.00 H new ATOM 0 HA THR A 28 -12.817 -8.807 -1.731 1.00 0.00 H new ATOM 0 HB THR A 28 -13.372 -8.786 0.759 1.00 0.00 H new ATOM 0 HG1 THR A 28 -12.312 -7.057 1.965 1.00 0.00 H new ATOM 0 HG21 THR A 28 -11.027 -9.026 1.468 1.00 0.00 H new ATOM 0 HG22 THR A 28 -11.315 -9.805 -0.106 1.00 0.00 H new ATOM 0 HG23 THR A 28 -10.495 -8.227 -0.031 1.00 0.00 H new ATOM 454 N THR A 29 -15.302 -8.499 -1.179 1.00 0.00 N ATOM 455 CA THR A 29 -16.726 -8.300 -1.223 1.00 0.00 C ATOM 456 C THR A 29 -17.213 -7.425 -0.081 1.00 0.00 C ATOM 457 O THR A 29 -18.006 -6.509 -0.292 1.00 0.00 O ATOM 458 CB THR A 29 -17.416 -9.645 -1.185 1.00 0.00 C ATOM 459 OG1 THR A 29 -16.530 -10.581 -0.537 1.00 0.00 O ATOM 460 CG2 THR A 29 -17.762 -10.114 -2.585 1.00 0.00 C ATOM 0 H THR A 29 -15.027 -9.475 -1.067 1.00 0.00 H new ATOM 0 HA THR A 29 -16.970 -7.781 -2.150 1.00 0.00 H new ATOM 0 HB THR A 29 -18.351 -9.569 -0.631 1.00 0.00 H new ATOM 0 HG1 THR A 29 -17.012 -11.415 -0.355 1.00 0.00 H new ATOM 0 HG21 THR A 29 -18.257 -11.083 -2.532 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.428 -9.391 -3.057 1.00 0.00 H new ATOM 0 HG23 THR A 29 -16.850 -10.205 -3.174 1.00 0.00 H new ATOM 468 N LEU A 30 -16.719 -7.678 1.126 1.00 0.00 N ATOM 469 CA LEU A 30 -17.100 -6.852 2.258 1.00 0.00 C ATOM 470 C LEU A 30 -16.574 -5.447 2.062 1.00 0.00 C ATOM 471 O LEU A 30 -17.215 -4.475 2.455 1.00 0.00 O ATOM 472 CB LEU A 30 -16.606 -7.420 3.591 1.00 0.00 C ATOM 473 CG LEU A 30 -17.139 -8.797 3.997 1.00 0.00 C ATOM 474 CD1 LEU A 30 -16.653 -9.149 5.383 1.00 0.00 C ATOM 475 CD2 LEU A 30 -18.658 -8.842 3.942 1.00 0.00 C ATOM 0 H LEU A 30 -16.067 -8.433 1.341 1.00 0.00 H new ATOM 0 HA LEU A 30 -18.189 -6.839 2.303 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -15.518 -7.475 3.554 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -16.863 -6.711 4.378 1.00 0.00 H new ATOM 0 HG LEU A 30 -16.760 -9.531 3.286 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -17.036 -10.130 5.665 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -15.563 -9.169 5.392 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -17.008 -8.403 6.094 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -19.004 -9.833 4.236 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -19.069 -8.097 4.624 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -18.992 -8.628 2.927 1.00 0.00 H new ATOM 487 N GLY A 31 -15.427 -5.364 1.401 1.00 0.00 N ATOM 488 CA GLY A 31 -14.806 -4.111 1.099 1.00 0.00 C ATOM 489 C GLY A 31 -15.652 -3.243 0.187 1.00 0.00 C ATOM 490 O GLY A 31 -15.865 -2.075 0.483 1.00 0.00 O ATOM 0 H GLY A 31 -14.910 -6.176 1.064 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -14.611 -3.574 2.027 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -13.840 -4.293 0.627 1.00 0.00 H new ATOM 494 N VAL A 32 -16.155 -3.809 -0.916 1.00 0.00 N ATOM 495 CA VAL A 32 -16.986 -3.024 -1.837 1.00 0.00 C ATOM 496 C VAL A 32 -18.262 -2.543 -1.169 1.00 0.00 C ATOM 497 O VAL A 32 -18.636 -1.390 -1.316 1.00 0.00 O ATOM 498 CB VAL A 32 -17.307 -3.720 -3.205 1.00 0.00 C ATOM 499 CG1 VAL A 32 -16.047 -3.951 -3.997 1.00 0.00 C ATOM 500 CG2 VAL A 32 -18.066 -5.028 -3.035 1.00 0.00 C ATOM 0 H VAL A 32 -16.007 -4.781 -1.188 1.00 0.00 H new ATOM 0 HA VAL A 32 -16.364 -2.165 -2.090 1.00 0.00 H new ATOM 0 HB VAL A 32 -17.957 -3.038 -3.754 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -16.295 -4.435 -4.942 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -15.561 -2.995 -4.195 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -15.372 -4.590 -3.428 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -18.261 -5.465 -4.014 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -17.470 -5.720 -2.441 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -19.012 -4.837 -2.528 1.00 0.00 H new ATOM 510 N SER A 33 -18.885 -3.405 -0.384 1.00 0.00 N ATOM 511 CA SER A 33 -20.096 -3.055 0.323 1.00 0.00 C ATOM 512 C SER A 33 -19.808 -1.946 1.358 1.00 0.00 C ATOM 513 O SER A 33 -20.618 -1.028 1.551 1.00 0.00 O ATOM 514 CB SER A 33 -20.654 -4.304 0.988 1.00 0.00 C ATOM 515 OG SER A 33 -20.778 -5.355 0.032 1.00 0.00 O ATOM 0 H SER A 33 -18.565 -4.360 -0.222 1.00 0.00 H new ATOM 0 HA SER A 33 -20.838 -2.666 -0.374 1.00 0.00 H new ATOM 0 HB2 SER A 33 -19.998 -4.617 1.801 1.00 0.00 H new ATOM 0 HB3 SER A 33 -21.627 -4.087 1.429 1.00 0.00 H new ATOM 0 HG SER A 33 -19.912 -5.799 -0.080 1.00 0.00 H new ATOM 521 N PHE A 34 -18.630 -2.014 1.975 1.00 0.00 N ATOM 522 CA PHE A 34 -18.204 -1.018 2.936 1.00 0.00 C ATOM 523 C PHE A 34 -17.967 0.314 2.222 1.00 0.00 C ATOM 524 O PHE A 34 -18.397 1.369 2.687 1.00 0.00 O ATOM 525 CB PHE A 34 -16.938 -1.484 3.676 1.00 0.00 C ATOM 526 CG PHE A 34 -16.484 -0.561 4.775 1.00 0.00 C ATOM 527 CD1 PHE A 34 -17.179 -0.499 5.973 1.00 0.00 C ATOM 528 CD2 PHE A 34 -15.371 0.245 4.611 1.00 0.00 C ATOM 529 CE1 PHE A 34 -16.769 0.345 6.984 1.00 0.00 C ATOM 530 CE2 PHE A 34 -14.958 1.091 5.617 1.00 0.00 C ATOM 531 CZ PHE A 34 -15.656 1.141 6.806 1.00 0.00 C ATOM 0 H PHE A 34 -17.952 -2.760 1.819 1.00 0.00 H new ATOM 0 HA PHE A 34 -18.988 -0.880 3.681 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -17.123 -2.471 4.100 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -16.129 -1.594 2.953 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -18.052 -1.119 6.116 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -14.819 0.210 3.683 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -17.318 0.383 7.913 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -14.088 1.715 5.475 1.00 0.00 H new ATOM 0 HZ PHE A 34 -15.332 1.802 7.596 1.00 0.00 H new ATOM 541 N ALA A 35 -17.324 0.247 1.067 1.00 0.00 N ATOM 542 CA ALA A 35 -17.060 1.424 0.255 1.00 0.00 C ATOM 543 C ALA A 35 -18.366 2.077 -0.196 1.00 0.00 C ATOM 544 O ALA A 35 -18.476 3.304 -0.249 1.00 0.00 O ATOM 545 CB ALA A 35 -16.191 1.070 -0.941 1.00 0.00 C ATOM 0 H ALA A 35 -16.971 -0.622 0.667 1.00 0.00 H new ATOM 0 HA ALA A 35 -16.517 2.144 0.867 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -16.006 1.966 -1.534 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -15.242 0.663 -0.593 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -16.701 0.327 -1.554 1.00 0.00 H new ATOM 551 N ILE A 36 -19.350 1.258 -0.508 1.00 0.00 N ATOM 552 CA ILE A 36 -20.667 1.741 -0.886 1.00 0.00 C ATOM 553 C ILE A 36 -21.339 2.469 0.289 1.00 0.00 C ATOM 554 O ILE A 36 -21.747 3.626 0.158 1.00 0.00 O ATOM 555 CB ILE A 36 -21.594 0.591 -1.397 1.00 0.00 C ATOM 556 CG1 ILE A 36 -21.037 -0.062 -2.681 1.00 0.00 C ATOM 557 CG2 ILE A 36 -23.019 1.086 -1.623 1.00 0.00 C ATOM 558 CD1 ILE A 36 -20.878 0.881 -3.861 1.00 0.00 C ATOM 0 H ILE A 36 -19.262 0.242 -0.507 1.00 0.00 H new ATOM 0 HA ILE A 36 -20.521 2.442 -1.708 1.00 0.00 H new ATOM 0 HB ILE A 36 -21.617 -0.170 -0.617 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -20.067 -0.504 -2.455 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -21.699 -0.877 -2.973 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -23.638 0.262 -1.978 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -23.425 1.467 -0.686 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -23.014 1.883 -2.367 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -20.481 0.332 -4.715 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -21.848 1.305 -4.121 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -20.191 1.684 -3.595 1.00 0.00 H new ATOM 570 N LYS A 37 -21.403 1.812 1.441 1.00 0.00 N ATOM 571 CA LYS A 37 -22.109 2.366 2.606 1.00 0.00 C ATOM 572 C LYS A 37 -21.421 3.613 3.190 1.00 0.00 C ATOM 573 O LYS A 37 -22.085 4.511 3.701 1.00 0.00 O ATOM 574 CB LYS A 37 -22.330 1.297 3.695 1.00 0.00 C ATOM 575 CG LYS A 37 -21.048 0.743 4.302 1.00 0.00 C ATOM 576 CD LYS A 37 -21.265 -0.374 5.342 1.00 0.00 C ATOM 577 CE LYS A 37 -21.854 0.108 6.686 1.00 0.00 C ATOM 578 NZ LYS A 37 -23.268 0.545 6.615 1.00 0.00 N ATOM 0 H LYS A 37 -20.979 0.898 1.600 1.00 0.00 H new ATOM 0 HA LYS A 37 -23.084 2.689 2.241 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -22.938 1.727 4.491 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -22.901 0.473 3.267 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -20.418 0.358 3.500 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -20.501 1.560 4.773 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -21.931 -1.125 4.916 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -20.311 -0.865 5.533 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -21.772 -0.699 7.414 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -21.249 0.935 7.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -23.776 0.216 7.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -23.309 1.583 6.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -23.714 0.142 5.766 1.00 0.00 H new ATOM 592 N SER A 38 -20.110 3.671 3.110 1.00 0.00 N ATOM 593 CA SER A 38 -19.386 4.801 3.647 1.00 0.00 C ATOM 594 C SER A 38 -19.229 5.941 2.619 1.00 0.00 C ATOM 595 O SER A 38 -18.851 7.061 2.979 1.00 0.00 O ATOM 596 CB SER A 38 -18.034 4.340 4.178 1.00 0.00 C ATOM 597 OG SER A 38 -18.207 3.343 5.182 1.00 0.00 O ATOM 0 H SER A 38 -19.526 2.953 2.681 1.00 0.00 H new ATOM 0 HA SER A 38 -19.969 5.214 4.470 1.00 0.00 H new ATOM 0 HB2 SER A 38 -17.432 3.942 3.361 1.00 0.00 H new ATOM 0 HB3 SER A 38 -17.489 5.189 4.590 1.00 0.00 H new ATOM 0 HG SER A 38 -18.284 2.463 4.759 1.00 0.00 H new ATOM 603 N GLY A 39 -19.538 5.666 1.358 1.00 0.00 N ATOM 604 CA GLY A 39 -19.417 6.686 0.327 1.00 0.00 C ATOM 605 C GLY A 39 -17.976 6.879 -0.111 1.00 0.00 C ATOM 606 O GLY A 39 -17.512 8.003 -0.318 1.00 0.00 O ATOM 0 H GLY A 39 -19.869 4.759 1.029 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -20.024 6.406 -0.534 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -19.812 7.630 0.702 1.00 0.00 H new ATOM 610 N ILE A 40 -17.279 5.787 -0.244 1.00 0.00 N ATOM 611 CA ILE A 40 -15.889 5.789 -0.640 1.00 0.00 C ATOM 612 C ILE A 40 -15.823 5.531 -2.139 1.00 0.00 C ATOM 613 O ILE A 40 -16.631 4.755 -2.666 1.00 0.00 O ATOM 614 CB ILE A 40 -15.112 4.675 0.122 1.00 0.00 C ATOM 615 CG1 ILE A 40 -15.263 4.875 1.642 1.00 0.00 C ATOM 616 CG2 ILE A 40 -13.637 4.655 -0.282 1.00 0.00 C ATOM 617 CD1 ILE A 40 -14.615 3.799 2.493 1.00 0.00 C ATOM 0 H ILE A 40 -17.660 4.855 -0.080 1.00 0.00 H new ATOM 0 HA ILE A 40 -15.434 6.750 -0.400 1.00 0.00 H new ATOM 0 HB ILE A 40 -15.539 3.709 -0.149 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -14.833 5.840 1.912 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -16.325 4.920 1.885 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -13.120 3.867 0.266 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -13.555 4.466 -1.352 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -13.183 5.618 -0.048 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -14.773 4.025 3.548 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -15.060 2.832 2.258 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -13.545 3.766 2.286 1.00 0.00 H new ATOM 629 N ASP A 41 -14.904 6.191 -2.823 1.00 0.00 N ATOM 630 CA ASP A 41 -14.753 6.016 -4.266 1.00 0.00 C ATOM 631 C ASP A 41 -14.246 4.619 -4.588 1.00 0.00 C ATOM 632 O ASP A 41 -13.114 4.253 -4.238 1.00 0.00 O ATOM 633 CB ASP A 41 -13.825 7.074 -4.865 1.00 0.00 C ATOM 634 CG ASP A 41 -13.689 6.966 -6.365 1.00 0.00 C ATOM 635 OD1 ASP A 41 -14.627 6.511 -7.040 1.00 0.00 O ATOM 636 OD2 ASP A 41 -12.638 7.363 -6.910 1.00 0.00 O ATOM 0 H ASP A 41 -14.249 6.853 -2.407 1.00 0.00 H new ATOM 0 HA ASP A 41 -15.737 6.142 -4.718 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -14.203 8.065 -4.611 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -12.839 6.983 -4.410 1.00 0.00 H new ATOM 641 N ILE A 42 -15.092 3.843 -5.215 1.00 0.00 N ATOM 642 CA ILE A 42 -14.782 2.472 -5.532 1.00 0.00 C ATOM 643 C ILE A 42 -14.939 2.190 -7.045 1.00 0.00 C ATOM 644 O ILE A 42 -14.250 1.321 -7.595 1.00 0.00 O ATOM 645 CB ILE A 42 -15.685 1.497 -4.685 1.00 0.00 C ATOM 646 CG1 ILE A 42 -15.316 0.020 -4.901 1.00 0.00 C ATOM 647 CG2 ILE A 42 -17.170 1.722 -4.958 1.00 0.00 C ATOM 648 CD1 ILE A 42 -13.929 -0.349 -4.413 1.00 0.00 C ATOM 0 H ILE A 42 -16.017 4.144 -5.521 1.00 0.00 H new ATOM 0 HA ILE A 42 -13.738 2.295 -5.273 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.490 1.734 -3.639 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -16.048 -0.605 -4.389 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -15.389 -0.210 -5.964 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -17.760 1.031 -4.355 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -17.436 2.747 -4.700 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -17.376 1.549 -6.014 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -13.746 -1.407 -4.602 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -13.186 0.248 -4.943 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -13.856 -0.154 -3.343 1.00 0.00 H new ATOM 660 N ASP A 43 -15.795 2.959 -7.731 1.00 0.00 N ATOM 661 CA ASP A 43 -16.078 2.679 -9.146 1.00 0.00 C ATOM 662 C ASP A 43 -14.877 2.946 -10.017 1.00 0.00 C ATOM 663 O ASP A 43 -14.630 2.204 -10.954 1.00 0.00 O ATOM 664 CB ASP A 43 -17.326 3.415 -9.708 1.00 0.00 C ATOM 665 CG ASP A 43 -17.111 4.877 -10.089 1.00 0.00 C ATOM 666 OD1 ASP A 43 -16.705 5.164 -11.254 1.00 0.00 O ATOM 667 OD2 ASP A 43 -17.365 5.763 -9.261 1.00 0.00 O ATOM 0 H ASP A 43 -16.293 3.760 -7.342 1.00 0.00 H new ATOM 0 HA ASP A 43 -16.313 1.615 -9.175 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -17.678 2.876 -10.588 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -18.121 3.365 -8.964 1.00 0.00 H new ATOM 672 N SER A 44 -14.101 3.967 -9.679 1.00 0.00 N ATOM 673 CA SER A 44 -12.917 4.300 -10.451 1.00 0.00 C ATOM 674 C SER A 44 -11.902 3.167 -10.341 1.00 0.00 C ATOM 675 O SER A 44 -11.245 2.797 -11.312 1.00 0.00 O ATOM 676 CB SER A 44 -12.322 5.610 -9.953 1.00 0.00 C ATOM 677 OG SER A 44 -11.974 5.504 -8.585 1.00 0.00 O ATOM 0 H SER A 44 -14.271 4.575 -8.878 1.00 0.00 H new ATOM 0 HA SER A 44 -13.188 4.426 -11.499 1.00 0.00 H new ATOM 0 HB2 SER A 44 -11.440 5.863 -10.541 1.00 0.00 H new ATOM 0 HB3 SER A 44 -13.040 6.419 -10.091 1.00 0.00 H new ATOM 0 HG SER A 44 -12.142 6.359 -8.137 1.00 0.00 H new ATOM 683 N ALA A 45 -11.814 2.607 -9.146 1.00 0.00 N ATOM 684 CA ALA A 45 -10.938 1.495 -8.873 1.00 0.00 C ATOM 685 C ALA A 45 -11.346 0.272 -9.700 1.00 0.00 C ATOM 686 O ALA A 45 -10.523 -0.309 -10.439 1.00 0.00 O ATOM 687 CB ALA A 45 -10.951 1.180 -7.382 1.00 0.00 C ATOM 0 H ALA A 45 -12.354 2.917 -8.338 1.00 0.00 H new ATOM 0 HA ALA A 45 -9.922 1.764 -9.160 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.287 0.339 -7.182 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -10.611 2.052 -6.823 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -11.964 0.924 -7.073 1.00 0.00 H new ATOM 693 N LEU A 46 -12.617 -0.084 -9.615 1.00 0.00 N ATOM 694 CA LEU A 46 -13.168 -1.229 -10.341 1.00 0.00 C ATOM 695 C LEU A 46 -12.990 -1.047 -11.849 1.00 0.00 C ATOM 696 O LEU A 46 -12.643 -1.992 -12.581 1.00 0.00 O ATOM 697 CB LEU A 46 -14.655 -1.388 -10.009 1.00 0.00 C ATOM 698 CG LEU A 46 -15.000 -1.653 -8.536 1.00 0.00 C ATOM 699 CD1 LEU A 46 -16.503 -1.640 -8.328 1.00 0.00 C ATOM 700 CD2 LEU A 46 -14.415 -2.983 -8.072 1.00 0.00 C ATOM 0 H LEU A 46 -13.301 0.410 -9.042 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.631 -2.126 -10.034 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -15.174 -0.483 -10.324 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -15.053 -2.208 -10.606 1.00 0.00 H new ATOM 0 HG LEU A 46 -14.559 -0.855 -7.938 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -16.727 -1.830 -7.278 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -16.901 -0.667 -8.614 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -16.962 -2.415 -8.942 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -14.673 -3.149 -7.026 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -14.823 -3.791 -8.679 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -13.331 -2.961 -8.179 1.00 0.00 H new ATOM 712 N ASP A 47 -13.192 0.171 -12.292 1.00 0.00 N ATOM 713 CA ASP A 47 -13.064 0.526 -13.693 1.00 0.00 C ATOM 714 C ASP A 47 -11.623 0.427 -14.162 1.00 0.00 C ATOM 715 O ASP A 47 -11.364 -0.030 -15.262 1.00 0.00 O ATOM 716 CB ASP A 47 -13.581 1.940 -13.940 1.00 0.00 C ATOM 717 CG ASP A 47 -13.576 2.325 -15.399 1.00 0.00 C ATOM 718 OD1 ASP A 47 -12.562 2.868 -15.902 1.00 0.00 O ATOM 719 OD2 ASP A 47 -14.598 2.115 -16.070 1.00 0.00 O ATOM 0 H ASP A 47 -13.452 0.952 -11.690 1.00 0.00 H new ATOM 0 HA ASP A 47 -13.664 -0.184 -14.262 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -14.596 2.022 -13.552 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -12.968 2.647 -13.381 1.00 0.00 H new ATOM 724 N ARG A 48 -10.689 0.821 -13.314 1.00 0.00 N ATOM 725 CA ARG A 48 -9.277 0.841 -13.681 1.00 0.00 C ATOM 726 C ARG A 48 -8.547 -0.484 -13.448 1.00 0.00 C ATOM 727 O ARG A 48 -7.328 -0.570 -13.654 1.00 0.00 O ATOM 728 CB ARG A 48 -8.544 2.000 -13.032 1.00 0.00 C ATOM 729 CG ARG A 48 -9.009 3.347 -13.509 1.00 0.00 C ATOM 730 CD ARG A 48 -8.198 4.455 -12.901 1.00 0.00 C ATOM 731 NE ARG A 48 -8.665 5.762 -13.380 1.00 0.00 N ATOM 732 CZ ARG A 48 -7.908 6.846 -13.558 1.00 0.00 C ATOM 733 NH1 ARG A 48 -6.654 6.879 -13.102 1.00 0.00 N ATOM 734 NH2 ARG A 48 -8.432 7.913 -14.152 1.00 0.00 N ATOM 0 H ARG A 48 -10.880 1.133 -12.362 1.00 0.00 H new ATOM 0 HA ARG A 48 -9.267 0.991 -14.761 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.673 1.942 -11.951 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -7.477 1.902 -13.231 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.936 3.395 -14.595 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -10.060 3.482 -13.254 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -8.272 4.413 -11.814 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -7.146 4.324 -13.154 1.00 0.00 H new ATOM 0 HE ARG A 48 -9.658 5.849 -13.596 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -6.268 6.071 -12.613 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -6.082 7.712 -13.242 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -9.402 7.897 -14.466 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -7.864 8.748 -14.294 1.00 0.00 H new ATOM 748 N GLY A 49 -9.265 -1.506 -13.018 1.00 0.00 N ATOM 749 CA GLY A 49 -8.646 -2.820 -12.961 1.00 0.00 C ATOM 750 C GLY A 49 -8.704 -3.515 -11.623 1.00 0.00 C ATOM 751 O GLY A 49 -8.152 -4.613 -11.479 1.00 0.00 O ATOM 0 H GLY A 49 -10.238 -1.460 -12.714 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -9.125 -3.459 -13.702 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -7.601 -2.721 -13.253 1.00 0.00 H new ATOM 755 N VAL A 50 -9.337 -2.909 -10.647 1.00 0.00 N ATOM 756 CA VAL A 50 -9.511 -3.562 -9.363 1.00 0.00 C ATOM 757 C VAL A 50 -10.693 -4.522 -9.460 1.00 0.00 C ATOM 758 O VAL A 50 -11.783 -4.130 -9.875 1.00 0.00 O ATOM 759 CB VAL A 50 -9.735 -2.538 -8.211 1.00 0.00 C ATOM 760 CG1 VAL A 50 -9.962 -3.237 -6.888 1.00 0.00 C ATOM 761 CG2 VAL A 50 -8.548 -1.601 -8.098 1.00 0.00 C ATOM 0 H VAL A 50 -9.738 -1.973 -10.711 1.00 0.00 H new ATOM 0 HA VAL A 50 -8.599 -4.109 -9.124 1.00 0.00 H new ATOM 0 HB VAL A 50 -10.628 -1.961 -8.451 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -10.115 -2.494 -6.105 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -10.843 -3.875 -6.960 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -9.092 -3.847 -6.644 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -8.720 -0.892 -7.289 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -7.647 -2.178 -7.889 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.422 -1.059 -9.035 1.00 0.00 H new ATOM 771 N ILE A 51 -10.464 -5.768 -9.138 1.00 0.00 N ATOM 772 CA ILE A 51 -11.498 -6.783 -9.222 1.00 0.00 C ATOM 773 C ILE A 51 -11.981 -7.138 -7.837 1.00 0.00 C ATOM 774 O ILE A 51 -11.267 -6.940 -6.861 1.00 0.00 O ATOM 775 CB ILE A 51 -11.005 -8.075 -9.936 1.00 0.00 C ATOM 776 CG1 ILE A 51 -9.853 -8.744 -9.156 1.00 0.00 C ATOM 777 CG2 ILE A 51 -10.570 -7.748 -11.353 1.00 0.00 C ATOM 778 CD1 ILE A 51 -9.415 -10.080 -9.719 1.00 0.00 C ATOM 0 H ILE A 51 -9.562 -6.114 -8.811 1.00 0.00 H new ATOM 0 HA ILE A 51 -12.311 -6.363 -9.814 1.00 0.00 H new ATOM 0 HB ILE A 51 -11.833 -8.783 -9.971 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -8.997 -8.069 -9.145 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -10.163 -8.883 -8.120 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -10.226 -8.657 -11.847 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -11.412 -7.331 -11.905 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -9.759 -7.021 -11.326 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -8.603 -10.481 -9.113 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -10.255 -10.774 -9.705 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -9.071 -9.947 -10.745 1.00 0.00 H new ATOM 790 N VAL A 52 -13.169 -7.662 -7.749 1.00 0.00 N ATOM 791 CA VAL A 52 -13.719 -8.040 -6.475 1.00 0.00 C ATOM 792 C VAL A 52 -13.709 -9.566 -6.309 1.00 0.00 C ATOM 793 O VAL A 52 -14.153 -10.311 -7.197 1.00 0.00 O ATOM 794 CB VAL A 52 -15.149 -7.434 -6.245 1.00 0.00 C ATOM 795 CG1 VAL A 52 -16.131 -7.849 -7.330 1.00 0.00 C ATOM 796 CG2 VAL A 52 -15.685 -7.788 -4.864 1.00 0.00 C ATOM 0 H VAL A 52 -13.780 -7.839 -8.547 1.00 0.00 H new ATOM 0 HA VAL A 52 -13.079 -7.617 -5.701 1.00 0.00 H new ATOM 0 HB VAL A 52 -15.044 -6.351 -6.302 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -17.106 -7.405 -7.127 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -15.770 -7.504 -8.299 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -16.222 -8.935 -7.342 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -16.676 -7.354 -4.736 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -15.748 -8.872 -4.765 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -15.014 -7.392 -4.101 1.00 0.00 H new ATOM 806 N ARG A 53 -13.160 -10.024 -5.209 1.00 0.00 N ATOM 807 CA ARG A 53 -13.107 -11.442 -4.920 1.00 0.00 C ATOM 808 C ARG A 53 -13.897 -11.702 -3.650 1.00 0.00 C ATOM 809 O ARG A 53 -13.805 -10.925 -2.691 1.00 0.00 O ATOM 810 CB ARG A 53 -11.654 -11.915 -4.713 1.00 0.00 C ATOM 811 CG ARG A 53 -11.462 -13.448 -4.671 1.00 0.00 C ATOM 812 CD ARG A 53 -11.359 -14.065 -6.078 1.00 0.00 C ATOM 813 NE ARG A 53 -12.512 -13.763 -6.938 1.00 0.00 N ATOM 814 CZ ARG A 53 -12.431 -13.364 -8.218 1.00 0.00 C ATOM 815 NH1 ARG A 53 -11.260 -13.413 -8.864 1.00 0.00 N ATOM 816 NH2 ARG A 53 -13.527 -12.976 -8.866 1.00 0.00 N ATOM 0 H ARG A 53 -12.740 -9.432 -4.493 1.00 0.00 H new ATOM 0 HA ARG A 53 -13.528 -11.990 -5.763 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -11.039 -11.509 -5.516 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -11.280 -11.492 -3.780 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -10.559 -13.683 -4.107 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -12.298 -13.902 -4.138 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -10.452 -13.701 -6.560 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -11.259 -15.146 -5.985 1.00 0.00 H new ATOM 0 HE ARG A 53 -13.443 -13.864 -6.533 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -10.427 -13.754 -8.384 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -11.201 -13.110 -9.836 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -14.429 -12.981 -8.391 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -13.464 -12.673 -9.838 1.00 0.00 H new ATOM 830 N ALA A 54 -14.671 -12.751 -3.652 1.00 0.00 N ATOM 831 CA ALA A 54 -15.439 -13.141 -2.503 1.00 0.00 C ATOM 832 C ALA A 54 -14.767 -14.326 -1.857 1.00 0.00 C ATOM 833 O ALA A 54 -14.478 -15.325 -2.538 1.00 0.00 O ATOM 834 CB ALA A 54 -16.852 -13.512 -2.926 1.00 0.00 C ATOM 0 H ALA A 54 -14.788 -13.365 -4.458 1.00 0.00 H new ATOM 0 HA ALA A 54 -15.495 -12.314 -1.795 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -17.429 -13.807 -2.049 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -17.327 -12.653 -3.401 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -16.814 -14.342 -3.631 1.00 0.00 H new ATOM 840 N PHE A 55 -14.485 -14.231 -0.580 1.00 0.00 N ATOM 841 CA PHE A 55 -13.840 -15.315 0.109 1.00 0.00 C ATOM 842 C PHE A 55 -14.893 -16.362 0.472 1.00 0.00 C ATOM 843 O PHE A 55 -15.715 -16.164 1.377 1.00 0.00 O ATOM 844 CB PHE A 55 -13.087 -14.791 1.336 1.00 0.00 C ATOM 845 CG PHE A 55 -12.182 -15.782 1.991 1.00 0.00 C ATOM 846 CD1 PHE A 55 -11.143 -16.363 1.285 1.00 0.00 C ATOM 847 CD2 PHE A 55 -12.351 -16.115 3.311 1.00 0.00 C ATOM 848 CE1 PHE A 55 -10.298 -17.260 1.894 1.00 0.00 C ATOM 849 CE2 PHE A 55 -11.510 -17.014 3.925 1.00 0.00 C ATOM 850 CZ PHE A 55 -10.486 -17.586 3.217 1.00 0.00 C ATOM 0 H PHE A 55 -14.692 -13.417 -0.002 1.00 0.00 H new ATOM 0 HA PHE A 55 -13.097 -15.788 -0.534 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -12.497 -13.924 1.039 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -13.815 -14.445 2.070 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -10.995 -16.109 0.246 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -13.155 -15.666 3.875 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -9.489 -17.707 1.335 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -11.657 -17.269 4.964 1.00 0.00 H new ATOM 0 HZ PHE A 55 -9.826 -18.293 3.698 1.00 0.00 H new ATOM 860 N SER A 56 -14.888 -17.444 -0.280 1.00 0.00 N ATOM 861 CA SER A 56 -15.866 -18.514 -0.175 1.00 0.00 C ATOM 862 C SER A 56 -15.648 -19.415 1.054 1.00 0.00 C ATOM 863 O SER A 56 -16.545 -20.167 1.474 1.00 0.00 O ATOM 864 CB SER A 56 -15.803 -19.311 -1.462 1.00 0.00 C ATOM 865 OG SER A 56 -14.438 -19.527 -1.833 1.00 0.00 O ATOM 0 H SER A 56 -14.186 -17.610 -1.001 1.00 0.00 H new ATOM 0 HA SER A 56 -16.856 -18.080 -0.032 1.00 0.00 H new ATOM 0 HB2 SER A 56 -16.310 -20.267 -1.333 1.00 0.00 H new ATOM 0 HB3 SER A 56 -16.325 -18.778 -2.256 1.00 0.00 H new ATOM 0 HG SER A 56 -14.403 -20.044 -2.665 1.00 0.00 H new ATOM 871 N HIS A 57 -14.477 -19.326 1.606 1.00 0.00 N ATOM 872 CA HIS A 57 -14.084 -20.087 2.778 1.00 0.00 C ATOM 873 C HIS A 57 -14.433 -19.243 4.010 1.00 0.00 C ATOM 874 O HIS A 57 -14.629 -18.047 3.878 1.00 0.00 O ATOM 875 CB HIS A 57 -12.563 -20.341 2.667 1.00 0.00 C ATOM 876 CG HIS A 57 -11.919 -21.196 3.727 1.00 0.00 C ATOM 877 ND1 HIS A 57 -11.780 -22.552 3.606 1.00 0.00 N ATOM 878 CD2 HIS A 57 -11.302 -20.864 4.887 1.00 0.00 C ATOM 879 CE1 HIS A 57 -11.106 -23.017 4.635 1.00 0.00 C ATOM 880 NE2 HIS A 57 -10.801 -22.014 5.427 1.00 0.00 N ATOM 0 H HIS A 57 -13.743 -18.711 1.255 1.00 0.00 H new ATOM 0 HA HIS A 57 -14.596 -21.046 2.858 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -12.369 -20.803 1.699 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -12.060 -19.374 2.664 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -11.221 -19.872 5.307 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -10.846 -24.052 4.801 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -10.277 -22.083 6.300 1.00 0.00 H new ATOM 889 N LYS A 58 -14.564 -19.852 5.169 1.00 0.00 N ATOM 890 CA LYS A 58 -14.825 -19.081 6.380 1.00 0.00 C ATOM 891 C LYS A 58 -13.562 -18.382 6.861 1.00 0.00 C ATOM 892 O LYS A 58 -12.552 -19.039 7.137 1.00 0.00 O ATOM 893 CB LYS A 58 -15.366 -19.939 7.518 1.00 0.00 C ATOM 894 CG LYS A 58 -16.757 -20.508 7.309 1.00 0.00 C ATOM 895 CD LYS A 58 -17.245 -21.229 8.568 1.00 0.00 C ATOM 896 CE LYS A 58 -17.334 -20.278 9.766 1.00 0.00 C ATOM 897 NZ LYS A 58 -17.811 -20.953 10.985 1.00 0.00 N ATOM 0 H LYS A 58 -14.497 -20.861 5.305 1.00 0.00 H new ATOM 0 HA LYS A 58 -15.584 -18.347 6.110 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -14.676 -20.766 7.684 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -15.371 -19.340 8.429 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -17.448 -19.705 7.053 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -16.749 -21.201 6.468 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -18.224 -21.669 8.379 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -16.567 -22.049 8.804 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -16.352 -19.844 9.955 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -18.006 -19.455 9.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -17.854 -20.268 11.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -18.759 -21.346 10.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -17.157 -21.722 11.234 1.00 0.00 H new ATOM 911 N PRO A 59 -13.575 -17.059 6.930 1.00 0.00 N ATOM 912 CA PRO A 59 -12.460 -16.315 7.456 1.00 0.00 C ATOM 913 C PRO A 59 -12.558 -16.178 8.984 1.00 0.00 C ATOM 914 O PRO A 59 -13.589 -15.729 9.514 1.00 0.00 O ATOM 915 CB PRO A 59 -12.601 -14.946 6.783 1.00 0.00 C ATOM 916 CG PRO A 59 -14.059 -14.789 6.497 1.00 0.00 C ATOM 917 CD PRO A 59 -14.669 -16.173 6.474 1.00 0.00 C ATOM 0 HA PRO A 59 -11.501 -16.795 7.261 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -12.241 -14.150 7.435 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -12.014 -14.897 5.866 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -14.535 -14.173 7.260 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -14.210 -14.287 5.541 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -15.535 -16.238 7.133 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -15.009 -16.442 5.474 1.00 0.00 H new ATOM 925 N PRO A 60 -11.521 -16.594 9.717 1.00 0.00 N ATOM 926 CA PRO A 60 -11.496 -16.442 11.158 1.00 0.00 C ATOM 927 C PRO A 60 -11.428 -14.965 11.544 1.00 0.00 C ATOM 928 O PRO A 60 -10.658 -14.184 10.956 1.00 0.00 O ATOM 929 CB PRO A 60 -10.222 -17.176 11.592 1.00 0.00 C ATOM 930 CG PRO A 60 -9.370 -17.222 10.373 1.00 0.00 C ATOM 931 CD PRO A 60 -10.313 -17.258 9.206 1.00 0.00 C ATOM 0 HA PRO A 60 -12.391 -16.841 11.636 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -9.721 -16.650 12.404 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -10.448 -18.179 11.954 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -8.718 -16.350 10.320 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -8.726 -18.101 10.381 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -9.903 -16.734 8.343 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -10.521 -18.280 8.890 1.00 0.00 H new ATOM 939 N LYS A 61 -12.243 -14.585 12.489 1.00 0.00 N ATOM 940 CA LYS A 61 -12.290 -13.240 12.952 1.00 0.00 C ATOM 941 C LYS A 61 -11.040 -12.945 13.773 1.00 0.00 C ATOM 942 O LYS A 61 -10.825 -13.536 14.846 1.00 0.00 O ATOM 943 CB LYS A 61 -13.615 -13.018 13.737 1.00 0.00 C ATOM 944 CG LYS A 61 -13.862 -11.620 14.323 1.00 0.00 C ATOM 945 CD LYS A 61 -13.163 -11.417 15.666 1.00 0.00 C ATOM 946 CE LYS A 61 -13.384 -10.019 16.230 1.00 0.00 C ATOM 947 NZ LYS A 61 -12.804 -8.964 15.370 1.00 0.00 N ATOM 0 H LYS A 61 -12.896 -15.212 12.959 1.00 0.00 H new ATOM 0 HA LYS A 61 -12.292 -12.535 12.121 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -14.445 -13.256 13.072 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -13.646 -13.737 14.556 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -13.512 -10.867 13.617 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -14.934 -11.466 14.448 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -13.530 -12.156 16.379 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -12.094 -11.593 15.546 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -14.453 -9.842 16.346 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -12.941 -9.957 17.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -12.610 -8.118 15.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -11.918 -9.308 14.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -13.477 -8.724 14.614 1.00 0.00 H new ATOM 961 N VAL A 62 -10.192 -12.096 13.237 1.00 0.00 N ATOM 962 CA VAL A 62 -9.009 -11.667 13.934 1.00 0.00 C ATOM 963 C VAL A 62 -9.464 -10.797 15.095 1.00 0.00 C ATOM 964 O VAL A 62 -10.341 -9.970 14.913 1.00 0.00 O ATOM 965 CB VAL A 62 -8.061 -10.872 12.994 1.00 0.00 C ATOM 966 CG1 VAL A 62 -6.806 -10.418 13.725 1.00 0.00 C ATOM 967 CG2 VAL A 62 -7.685 -11.707 11.775 1.00 0.00 C ATOM 0 H VAL A 62 -10.306 -11.687 12.309 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.447 -12.530 14.292 1.00 0.00 H new ATOM 0 HB VAL A 62 -8.599 -9.985 12.661 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -6.165 -9.865 13.038 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -7.084 -9.775 14.560 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.269 -11.289 14.101 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.021 -11.131 11.130 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -7.178 -12.616 12.099 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.587 -11.972 11.223 1.00 0.00 H new ATOM 977 N GLY A 63 -8.896 -11.018 16.273 1.00 0.00 N ATOM 978 CA GLY A 63 -9.319 -10.334 17.498 1.00 0.00 C ATOM 979 C GLY A 63 -9.508 -8.832 17.348 1.00 0.00 C ATOM 980 O GLY A 63 -10.626 -8.326 17.491 1.00 0.00 O ATOM 0 H GLY A 63 -8.129 -11.676 16.411 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -10.256 -10.773 17.839 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -8.579 -10.518 18.276 1.00 0.00 H new ATOM 984 N ASN A 64 -8.444 -8.146 17.016 1.00 0.00 N ATOM 985 CA ASN A 64 -8.464 -6.683 16.882 1.00 0.00 C ATOM 986 C ASN A 64 -9.151 -6.238 15.602 1.00 0.00 C ATOM 987 O ASN A 64 -9.887 -5.258 15.585 1.00 0.00 O ATOM 988 CB ASN A 64 -7.028 -6.134 16.870 1.00 0.00 C ATOM 989 CG ASN A 64 -6.951 -4.617 16.695 1.00 0.00 C ATOM 990 OD1 ASN A 64 -7.791 -3.862 17.200 1.00 0.00 O ATOM 991 ND2 ASN A 64 -5.985 -4.170 15.943 1.00 0.00 N ATOM 0 H ASN A 64 -7.535 -8.569 16.828 1.00 0.00 H new ATOM 0 HA ASN A 64 -9.021 -6.295 17.735 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -6.536 -6.409 17.803 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -6.472 -6.612 16.064 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -5.905 -3.171 15.756 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -5.309 -4.820 15.542 1.00 0.00 H new ATOM 998 N LEU A 65 -8.947 -6.972 14.557 1.00 0.00 N ATOM 999 CA LEU A 65 -9.355 -6.527 13.252 1.00 0.00 C ATOM 1000 C LEU A 65 -10.800 -6.885 12.934 1.00 0.00 C ATOM 1001 O LEU A 65 -11.245 -8.002 13.191 1.00 0.00 O ATOM 1002 CB LEU A 65 -8.404 -7.082 12.203 1.00 0.00 C ATOM 1003 CG LEU A 65 -6.921 -6.802 12.461 1.00 0.00 C ATOM 1004 CD1 LEU A 65 -6.067 -7.421 11.383 1.00 0.00 C ATOM 1005 CD2 LEU A 65 -6.656 -5.305 12.570 1.00 0.00 C ATOM 0 H LEU A 65 -8.498 -7.888 14.576 1.00 0.00 H new ATOM 0 HA LEU A 65 -9.307 -5.438 13.241 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.549 -8.160 12.137 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.674 -6.665 11.233 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.653 -7.258 13.414 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -5.017 -7.210 11.585 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -6.225 -8.499 11.368 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.342 -7.001 10.415 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -5.595 -5.136 12.753 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -6.946 -4.815 11.640 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -7.237 -4.892 13.394 1.00 0.00 H new ATOM 1017 N PRO A 66 -11.572 -5.914 12.417 1.00 0.00 N ATOM 1018 CA PRO A 66 -12.953 -6.139 11.986 1.00 0.00 C ATOM 1019 C PRO A 66 -13.051 -7.201 10.868 1.00 0.00 C ATOM 1020 O PRO A 66 -12.024 -7.596 10.263 1.00 0.00 O ATOM 1021 CB PRO A 66 -13.391 -4.771 11.449 1.00 0.00 C ATOM 1022 CG PRO A 66 -12.486 -3.795 12.105 1.00 0.00 C ATOM 1023 CD PRO A 66 -11.175 -4.498 12.261 1.00 0.00 C ATOM 0 HA PRO A 66 -13.574 -6.513 12.800 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -13.301 -4.725 10.364 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -14.434 -4.567 11.691 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -12.378 -2.894 11.501 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -12.881 -3.484 13.072 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -10.533 -4.352 11.392 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -10.624 -4.136 13.129 1.00 0.00 H new ATOM 1031 N GLN A 67 -14.277 -7.627 10.578 1.00 0.00 N ATOM 1032 CA GLN A 67 -14.561 -8.652 9.563 1.00 0.00 C ATOM 1033 C GLN A 67 -13.961 -8.294 8.224 1.00 0.00 C ATOM 1034 O GLN A 67 -13.267 -9.095 7.621 1.00 0.00 O ATOM 1035 CB GLN A 67 -16.070 -8.858 9.401 1.00 0.00 C ATOM 1036 CG GLN A 67 -16.737 -9.508 10.597 1.00 0.00 C ATOM 1037 CD GLN A 67 -16.317 -10.956 10.804 1.00 0.00 C ATOM 1038 OE1 GLN A 67 -16.259 -11.433 11.932 1.00 0.00 O ATOM 1039 NE2 GLN A 67 -16.073 -11.682 9.728 1.00 0.00 N ATOM 0 H GLN A 67 -15.113 -7.271 11.042 1.00 0.00 H new ATOM 0 HA GLN A 67 -14.104 -9.578 9.913 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -16.540 -7.892 9.217 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -16.249 -9.473 8.519 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -16.499 -8.936 11.493 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -17.819 -9.465 10.470 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -16.129 -11.257 8.802 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -15.828 -12.668 9.823 1.00 0.00 H new ATOM 1048 N TYR A 68 -14.190 -7.072 7.797 1.00 0.00 N ATOM 1049 CA TYR A 68 -13.720 -6.616 6.506 1.00 0.00 C ATOM 1050 C TYR A 68 -12.178 -6.601 6.361 1.00 0.00 C ATOM 1051 O TYR A 68 -11.664 -6.843 5.265 1.00 0.00 O ATOM 1052 CB TYR A 68 -14.392 -5.288 6.089 1.00 0.00 C ATOM 1053 CG TYR A 68 -14.372 -4.173 7.129 1.00 0.00 C ATOM 1054 CD1 TYR A 68 -13.188 -3.591 7.548 1.00 0.00 C ATOM 1055 CD2 TYR A 68 -15.553 -3.703 7.679 1.00 0.00 C ATOM 1056 CE1 TYR A 68 -13.177 -2.578 8.478 1.00 0.00 C ATOM 1057 CE2 TYR A 68 -15.551 -2.685 8.610 1.00 0.00 C ATOM 1058 CZ TYR A 68 -14.356 -2.127 9.003 1.00 0.00 C ATOM 1059 OH TYR A 68 -14.342 -1.114 9.931 1.00 0.00 O ATOM 0 H TYR A 68 -14.703 -6.370 8.330 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.041 -7.370 5.787 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -13.902 -4.924 5.186 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -15.430 -5.495 5.828 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -12.253 -3.940 7.136 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.492 -4.141 7.374 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -12.241 -2.141 8.792 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -16.481 -2.328 9.028 1.00 0.00 H new ATOM 0 HH TYR A 68 -15.260 -0.908 10.205 1.00 0.00 H new ATOM 1069 N GLU A 69 -11.449 -6.364 7.456 1.00 0.00 N ATOM 1070 CA GLU A 69 -9.980 -6.394 7.393 1.00 0.00 C ATOM 1071 C GLU A 69 -9.529 -7.853 7.330 1.00 0.00 C ATOM 1072 O GLU A 69 -8.656 -8.223 6.540 1.00 0.00 O ATOM 1073 CB GLU A 69 -9.325 -5.726 8.616 1.00 0.00 C ATOM 1074 CG GLU A 69 -9.661 -4.251 8.863 1.00 0.00 C ATOM 1075 CD GLU A 69 -9.302 -3.304 7.726 1.00 0.00 C ATOM 1076 OE1 GLU A 69 -8.169 -3.349 7.199 1.00 0.00 O ATOM 1077 OE2 GLU A 69 -10.138 -2.458 7.392 1.00 0.00 O ATOM 0 H GLU A 69 -11.837 -6.154 8.376 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.670 -5.838 6.508 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.608 -6.292 9.504 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.244 -5.815 8.513 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.730 -4.167 9.061 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.143 -3.923 9.764 1.00 0.00 H new ATOM 1084 N SER A 70 -10.176 -8.686 8.146 1.00 0.00 N ATOM 1085 CA SER A 70 -9.880 -10.114 8.215 1.00 0.00 C ATOM 1086 C SER A 70 -10.146 -10.777 6.850 1.00 0.00 C ATOM 1087 O SER A 70 -9.363 -11.621 6.391 1.00 0.00 O ATOM 1088 CB SER A 70 -10.734 -10.764 9.314 1.00 0.00 C ATOM 1089 OG SER A 70 -10.554 -10.094 10.568 1.00 0.00 O ATOM 0 H SER A 70 -10.920 -8.388 8.777 1.00 0.00 H new ATOM 0 HA SER A 70 -8.828 -10.255 8.461 1.00 0.00 H new ATOM 0 HB2 SER A 70 -11.786 -10.733 9.029 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.463 -11.815 9.417 1.00 0.00 H new ATOM 0 HG SER A 70 -11.035 -9.240 10.555 1.00 0.00 H new ATOM 1095 N GLU A 71 -11.237 -10.344 6.211 1.00 0.00 N ATOM 1096 CA GLU A 71 -11.646 -10.782 4.878 1.00 0.00 C ATOM 1097 C GLU A 71 -10.481 -10.574 3.897 1.00 0.00 C ATOM 1098 O GLU A 71 -10.057 -11.501 3.205 1.00 0.00 O ATOM 1099 CB GLU A 71 -12.853 -9.921 4.453 1.00 0.00 C ATOM 1100 CG GLU A 71 -13.514 -10.267 3.121 1.00 0.00 C ATOM 1101 CD GLU A 71 -14.288 -11.573 3.124 1.00 0.00 C ATOM 1102 OE1 GLU A 71 -14.732 -12.030 4.207 1.00 0.00 O ATOM 1103 OE2 GLU A 71 -14.500 -12.138 2.037 1.00 0.00 O ATOM 0 H GLU A 71 -11.875 -9.661 6.619 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.917 -11.838 4.880 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.610 -9.988 5.235 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.530 -8.881 4.411 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -14.191 -9.459 2.845 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.745 -10.317 2.350 1.00 0.00 H new ATOM 1110 N ALA A 72 -9.920 -9.364 3.916 1.00 0.00 N ATOM 1111 CA ALA A 72 -8.826 -8.987 3.028 1.00 0.00 C ATOM 1112 C ALA A 72 -7.590 -9.845 3.265 1.00 0.00 C ATOM 1113 O ALA A 72 -7.017 -10.397 2.312 1.00 0.00 O ATOM 1114 CB ALA A 72 -8.498 -7.514 3.186 1.00 0.00 C ATOM 0 H ALA A 72 -10.213 -8.620 4.549 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.154 -9.163 2.003 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.680 -7.250 2.516 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -9.376 -6.917 2.939 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.202 -7.316 4.216 1.00 0.00 H new ATOM 1120 N ILE A 73 -7.198 -9.979 4.528 1.00 0.00 N ATOM 1121 CA ILE A 73 -6.038 -10.793 4.898 1.00 0.00 C ATOM 1122 C ILE A 73 -6.213 -12.243 4.427 1.00 0.00 C ATOM 1123 O ILE A 73 -5.304 -12.826 3.836 1.00 0.00 O ATOM 1124 CB ILE A 73 -5.771 -10.787 6.435 1.00 0.00 C ATOM 1125 CG1 ILE A 73 -5.543 -9.359 6.940 1.00 0.00 C ATOM 1126 CG2 ILE A 73 -4.563 -11.671 6.782 1.00 0.00 C ATOM 1127 CD1 ILE A 73 -5.277 -9.272 8.428 1.00 0.00 C ATOM 0 H ILE A 73 -7.666 -9.534 5.317 1.00 0.00 H new ATOM 0 HA ILE A 73 -5.179 -10.343 4.400 1.00 0.00 H new ATOM 0 HB ILE A 73 -6.652 -11.194 6.931 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.700 -8.924 6.404 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -6.418 -8.755 6.701 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -4.395 -11.652 7.859 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -4.758 -12.695 6.463 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -3.677 -11.294 6.270 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.126 -8.230 8.710 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -6.130 -9.676 8.974 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -4.384 -9.848 8.672 1.00 0.00 H new ATOM 1139 N MET A 74 -7.389 -12.800 4.659 1.00 0.00 N ATOM 1140 CA MET A 74 -7.669 -14.181 4.292 1.00 0.00 C ATOM 1141 C MET A 74 -7.642 -14.405 2.792 1.00 0.00 C ATOM 1142 O MET A 74 -7.148 -15.438 2.331 1.00 0.00 O ATOM 1143 CB MET A 74 -8.973 -14.667 4.892 1.00 0.00 C ATOM 1144 CG MET A 74 -8.992 -14.801 6.420 1.00 0.00 C ATOM 1145 SD MET A 74 -7.873 -16.076 7.095 1.00 0.00 S ATOM 1146 CE MET A 74 -6.305 -15.209 7.244 1.00 0.00 C ATOM 0 H MET A 74 -8.170 -12.316 5.102 1.00 0.00 H new ATOM 0 HA MET A 74 -6.861 -14.777 4.716 1.00 0.00 H new ATOM 0 HB2 MET A 74 -9.766 -13.981 4.596 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.212 -15.637 4.457 1.00 0.00 H new ATOM 0 HG2 MET A 74 -8.728 -13.838 6.858 1.00 0.00 H new ATOM 0 HG3 MET A 74 -10.010 -15.027 6.738 1.00 0.00 H new ATOM 0 HE1 MET A 74 -5.593 -15.619 6.528 1.00 0.00 H new ATOM 0 HE2 MET A 74 -6.455 -14.149 7.041 1.00 0.00 H new ATOM 0 HE3 MET A 74 -5.915 -15.333 8.254 1.00 0.00 H new ATOM 1156 N VAL A 75 -8.145 -13.446 2.030 1.00 0.00 N ATOM 1157 CA VAL A 75 -8.104 -13.537 0.575 1.00 0.00 C ATOM 1158 C VAL A 75 -6.651 -13.513 0.092 1.00 0.00 C ATOM 1159 O VAL A 75 -6.248 -14.328 -0.752 1.00 0.00 O ATOM 1160 CB VAL A 75 -8.936 -12.409 -0.116 1.00 0.00 C ATOM 1161 CG1 VAL A 75 -8.779 -12.450 -1.633 1.00 0.00 C ATOM 1162 CG2 VAL A 75 -10.403 -12.554 0.236 1.00 0.00 C ATOM 0 H VAL A 75 -8.585 -12.599 2.390 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.564 -14.484 0.291 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.559 -11.453 0.246 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -9.371 -11.652 -2.082 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.729 -12.314 -1.894 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -9.124 -13.413 -2.009 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -10.974 -11.763 -0.251 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -10.765 -13.524 -0.104 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -10.527 -12.479 1.316 1.00 0.00 H new ATOM 1172 N ALA A 76 -5.858 -12.625 0.677 1.00 0.00 N ATOM 1173 CA ALA A 76 -4.448 -12.505 0.330 1.00 0.00 C ATOM 1174 C ALA A 76 -3.675 -13.753 0.743 1.00 0.00 C ATOM 1175 O ALA A 76 -2.752 -14.172 0.061 1.00 0.00 O ATOM 1176 CB ALA A 76 -3.846 -11.268 0.967 1.00 0.00 C ATOM 0 H ALA A 76 -6.169 -11.974 1.398 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.374 -12.406 -0.753 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -2.793 -11.195 0.696 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.374 -10.383 0.612 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -3.938 -11.335 2.051 1.00 0.00 H new ATOM 1182 N PHE A 77 -4.079 -14.346 1.847 1.00 0.00 N ATOM 1183 CA PHE A 77 -3.466 -15.564 2.360 1.00 0.00 C ATOM 1184 C PHE A 77 -3.769 -16.750 1.439 1.00 0.00 C ATOM 1185 O PHE A 77 -2.905 -17.592 1.184 1.00 0.00 O ATOM 1186 CB PHE A 77 -3.988 -15.845 3.787 1.00 0.00 C ATOM 1187 CG PHE A 77 -3.390 -17.055 4.466 1.00 0.00 C ATOM 1188 CD1 PHE A 77 -2.192 -16.959 5.144 1.00 0.00 C ATOM 1189 CD2 PHE A 77 -4.038 -18.280 4.435 1.00 0.00 C ATOM 1190 CE1 PHE A 77 -1.648 -18.057 5.779 1.00 0.00 C ATOM 1191 CE2 PHE A 77 -3.498 -19.383 5.065 1.00 0.00 C ATOM 1192 CZ PHE A 77 -2.300 -19.270 5.739 1.00 0.00 C ATOM 0 H PHE A 77 -4.847 -13.998 2.421 1.00 0.00 H new ATOM 0 HA PHE A 77 -2.385 -15.428 2.394 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -3.795 -14.969 4.406 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.070 -15.971 3.742 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.673 -16.012 5.178 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -4.978 -18.373 3.911 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -0.711 -17.965 6.308 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -4.012 -20.332 5.030 1.00 0.00 H new ATOM 0 HZ PHE A 77 -1.874 -20.130 6.234 1.00 0.00 H new ATOM 1202 N GLU A 78 -4.982 -16.788 0.936 1.00 0.00 N ATOM 1203 CA GLU A 78 -5.462 -17.877 0.095 1.00 0.00 C ATOM 1204 C GLU A 78 -4.814 -17.802 -1.294 1.00 0.00 C ATOM 1205 O GLU A 78 -4.252 -18.781 -1.786 1.00 0.00 O ATOM 1206 CB GLU A 78 -7.001 -17.778 0.016 1.00 0.00 C ATOM 1207 CG GLU A 78 -7.754 -19.016 -0.478 1.00 0.00 C ATOM 1208 CD GLU A 78 -7.665 -19.273 -1.959 1.00 0.00 C ATOM 1209 OE1 GLU A 78 -8.458 -18.688 -2.719 1.00 0.00 O ATOM 1210 OE2 GLU A 78 -6.845 -20.094 -2.392 1.00 0.00 O ATOM 0 H GLU A 78 -5.676 -16.058 1.097 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.187 -18.842 0.520 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -7.375 -17.528 1.009 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.253 -16.944 -0.639 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -7.370 -19.889 0.050 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -8.805 -18.915 -0.206 1.00 0.00 H new ATOM 1217 N LEU A 79 -4.842 -16.626 -1.886 1.00 0.00 N ATOM 1218 CA LEU A 79 -4.323 -16.432 -3.241 1.00 0.00 C ATOM 1219 C LEU A 79 -2.804 -16.350 -3.244 1.00 0.00 C ATOM 1220 O LEU A 79 -2.161 -16.614 -4.274 1.00 0.00 O ATOM 1221 CB LEU A 79 -4.883 -15.133 -3.842 1.00 0.00 C ATOM 1222 CG LEU A 79 -6.403 -15.034 -3.993 1.00 0.00 C ATOM 1223 CD1 LEU A 79 -6.791 -13.661 -4.519 1.00 0.00 C ATOM 1224 CD2 LEU A 79 -6.915 -16.108 -4.927 1.00 0.00 C ATOM 0 H LEU A 79 -5.219 -15.782 -1.455 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.636 -17.289 -3.837 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.550 -14.302 -3.221 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.435 -14.995 -4.826 1.00 0.00 H new ATOM 0 HG LEU A 79 -6.856 -15.179 -3.012 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -7.875 -13.604 -4.622 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -6.452 -12.895 -3.822 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -6.325 -13.499 -5.491 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -7.997 -16.022 -5.022 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -6.454 -15.988 -5.907 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -6.663 -17.090 -4.526 1.00 0.00 H new ATOM 1236 N ASN A 80 -2.258 -16.017 -2.079 1.00 0.00 N ATOM 1237 CA ASN A 80 -0.846 -15.692 -1.883 1.00 0.00 C ATOM 1238 C ASN A 80 -0.575 -14.421 -2.644 1.00 0.00 C ATOM 1239 O ASN A 80 0.054 -14.410 -3.718 1.00 0.00 O ATOM 1240 CB ASN A 80 0.141 -16.805 -2.287 1.00 0.00 C ATOM 1241 CG ASN A 80 1.580 -16.487 -1.883 1.00 0.00 C ATOM 1242 OD1 ASN A 80 2.536 -16.808 -2.601 1.00 0.00 O ATOM 1243 ND2 ASN A 80 1.758 -15.941 -0.708 1.00 0.00 N ATOM 0 H ASN A 80 -2.801 -15.964 -1.217 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.673 -15.573 -0.813 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -0.164 -17.743 -1.823 1.00 0.00 H new ATOM 0 HB3 ASN A 80 0.094 -16.953 -3.366 1.00 0.00 H new ATOM 0 HD21 ASN A 80 2.702 -15.770 -0.363 1.00 0.00 H new ATOM 0 HD22 ASN A 80 0.952 -15.686 -0.137 1.00 0.00 H new ATOM 1250 N ALA A 81 -1.144 -13.374 -2.139 1.00 0.00 N ATOM 1251 CA ALA A 81 -1.135 -12.110 -2.794 1.00 0.00 C ATOM 1252 C ALA A 81 -0.425 -11.068 -1.972 1.00 0.00 C ATOM 1253 O ALA A 81 -0.092 -11.292 -0.807 1.00 0.00 O ATOM 1254 CB ALA A 81 -2.562 -11.682 -3.073 1.00 0.00 C ATOM 0 H ALA A 81 -1.635 -13.375 -1.245 1.00 0.00 H new ATOM 0 HA ALA A 81 -0.591 -12.209 -3.733 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.560 -10.714 -3.575 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.045 -12.421 -3.712 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -3.108 -11.602 -2.133 1.00 0.00 H new ATOM 1260 N LEU A 82 -0.210 -9.942 -2.581 1.00 0.00 N ATOM 1261 CA LEU A 82 0.423 -8.825 -1.958 1.00 0.00 C ATOM 1262 C LEU A 82 -0.692 -8.085 -1.235 1.00 0.00 C ATOM 1263 O LEU A 82 -1.682 -7.727 -1.855 1.00 0.00 O ATOM 1264 CB LEU A 82 1.057 -7.952 -3.081 1.00 0.00 C ATOM 1265 CG LEU A 82 2.112 -6.888 -2.703 1.00 0.00 C ATOM 1266 CD1 LEU A 82 1.548 -5.791 -1.827 1.00 0.00 C ATOM 1267 CD2 LEU A 82 3.315 -7.538 -2.048 1.00 0.00 C ATOM 0 H LEU A 82 -0.478 -9.772 -3.550 1.00 0.00 H new ATOM 0 HA LEU A 82 1.213 -9.096 -1.258 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.516 -8.628 -3.802 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.245 -7.440 -3.597 1.00 0.00 H new ATOM 0 HG LEU A 82 2.429 -6.413 -3.631 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.333 -5.072 -1.593 1.00 0.00 H new ATOM 0 HD12 LEU A 82 0.738 -5.285 -2.353 1.00 0.00 H new ATOM 0 HD13 LEU A 82 1.165 -6.224 -0.903 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.046 -6.772 -1.789 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.000 -8.059 -1.144 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.765 -8.251 -2.739 1.00 0.00 H new ATOM 1279 N LEU A 83 -0.570 -7.895 0.047 1.00 0.00 N ATOM 1280 CA LEU A 83 -1.627 -7.239 0.773 1.00 0.00 C ATOM 1281 C LEU A 83 -1.282 -5.783 0.995 1.00 0.00 C ATOM 1282 O LEU A 83 -0.205 -5.454 1.504 1.00 0.00 O ATOM 1283 CB LEU A 83 -1.916 -7.933 2.110 1.00 0.00 C ATOM 1284 CG LEU A 83 -3.133 -7.402 2.885 1.00 0.00 C ATOM 1285 CD1 LEU A 83 -4.421 -7.688 2.136 1.00 0.00 C ATOM 1286 CD2 LEU A 83 -3.195 -7.989 4.273 1.00 0.00 C ATOM 0 H LEU A 83 0.235 -8.178 0.606 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.533 -7.303 0.170 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -2.063 -8.997 1.922 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -1.035 -7.840 2.745 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.018 -6.322 2.976 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.266 -7.302 2.706 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -4.390 -7.204 1.160 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -4.534 -8.764 2.003 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -4.066 -7.595 4.796 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -3.273 -9.074 4.206 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -2.291 -7.723 4.821 1.00 0.00 H new ATOM 1298 N ILE A 84 -2.163 -4.926 0.591 1.00 0.00 N ATOM 1299 CA ILE A 84 -1.984 -3.519 0.762 1.00 0.00 C ATOM 1300 C ILE A 84 -2.900 -3.068 1.881 1.00 0.00 C ATOM 1301 O ILE A 84 -4.140 -3.142 1.756 1.00 0.00 O ATOM 1302 CB ILE A 84 -2.312 -2.752 -0.542 1.00 0.00 C ATOM 1303 CG1 ILE A 84 -1.469 -3.313 -1.702 1.00 0.00 C ATOM 1304 CG2 ILE A 84 -2.039 -1.259 -0.359 1.00 0.00 C ATOM 1305 CD1 ILE A 84 -1.769 -2.695 -3.048 1.00 0.00 C ATOM 0 H ILE A 84 -3.035 -5.184 0.129 1.00 0.00 H new ATOM 0 HA ILE A 84 -0.944 -3.307 1.009 1.00 0.00 H new ATOM 0 HB ILE A 84 -3.368 -2.884 -0.777 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -0.414 -3.163 -1.474 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -1.631 -4.389 -1.766 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -2.273 -0.730 -1.283 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -2.660 -0.872 0.448 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -0.988 -1.109 -0.112 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -1.131 -3.148 -3.807 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -2.815 -2.868 -3.303 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -1.578 -1.623 -3.007 1.00 0.00 H new ATOM 1317 N ALA A 85 -2.315 -2.638 2.964 1.00 0.00 N ATOM 1318 CA ALA A 85 -3.065 -2.253 4.127 1.00 0.00 C ATOM 1319 C ALA A 85 -2.446 -1.037 4.755 1.00 0.00 C ATOM 1320 O ALA A 85 -1.242 -0.876 4.728 1.00 0.00 O ATOM 1321 CB ALA A 85 -3.100 -3.394 5.127 1.00 0.00 C ATOM 0 H ALA A 85 -1.304 -2.544 3.065 1.00 0.00 H new ATOM 0 HA ALA A 85 -4.086 -2.017 3.827 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -3.671 -3.091 6.005 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -3.571 -4.264 4.670 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -2.083 -3.647 5.426 1.00 0.00 H new ATOM 1327 N GLU A 86 -3.262 -0.187 5.306 1.00 0.00 N ATOM 1328 CA GLU A 86 -2.772 1.015 5.940 1.00 0.00 C ATOM 1329 C GLU A 86 -2.606 0.842 7.423 1.00 0.00 C ATOM 1330 O GLU A 86 -1.739 1.471 8.030 1.00 0.00 O ATOM 1331 CB GLU A 86 -3.684 2.196 5.653 1.00 0.00 C ATOM 1332 CG GLU A 86 -3.526 2.770 4.266 1.00 0.00 C ATOM 1333 CD GLU A 86 -2.172 3.399 4.057 1.00 0.00 C ATOM 1334 OE1 GLU A 86 -1.212 2.689 3.715 1.00 0.00 O ATOM 1335 OE2 GLU A 86 -2.045 4.631 4.214 1.00 0.00 O ATOM 0 H GLU A 86 -4.275 -0.299 5.332 1.00 0.00 H new ATOM 0 HA GLU A 86 -1.789 1.217 5.514 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -4.719 1.884 5.790 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.487 2.980 6.384 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -3.675 1.980 3.529 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -4.301 3.517 4.094 1.00 0.00 H new ATOM 1342 N ASP A 87 -3.405 -0.012 8.020 1.00 0.00 N ATOM 1343 CA ASP A 87 -3.341 -0.158 9.456 1.00 0.00 C ATOM 1344 C ASP A 87 -2.244 -1.107 9.849 1.00 0.00 C ATOM 1345 O ASP A 87 -2.194 -2.250 9.388 1.00 0.00 O ATOM 1346 CB ASP A 87 -4.661 -0.605 10.065 1.00 0.00 C ATOM 1347 CG ASP A 87 -4.631 -0.536 11.584 1.00 0.00 C ATOM 1348 OD1 ASP A 87 -4.119 -1.460 12.242 1.00 0.00 O ATOM 1349 OD2 ASP A 87 -5.108 0.478 12.151 1.00 0.00 O ATOM 0 H ASP A 87 -4.090 -0.602 7.549 1.00 0.00 H new ATOM 0 HA ASP A 87 -3.122 0.832 9.855 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.467 0.024 9.688 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -4.880 -1.626 9.751 1.00 0.00 H new ATOM 1354 N LYS A 88 -1.370 -0.605 10.682 1.00 0.00 N ATOM 1355 CA LYS A 88 -0.216 -1.309 11.242 1.00 0.00 C ATOM 1356 C LYS A 88 -0.528 -2.713 11.776 1.00 0.00 C ATOM 1357 O LYS A 88 0.292 -3.618 11.638 1.00 0.00 O ATOM 1358 CB LYS A 88 0.449 -0.475 12.371 1.00 0.00 C ATOM 1359 CG LYS A 88 -0.394 -0.243 13.654 1.00 0.00 C ATOM 1360 CD LYS A 88 -1.625 0.596 13.388 1.00 0.00 C ATOM 1361 CE LYS A 88 -2.510 0.755 14.597 1.00 0.00 C ATOM 1362 NZ LYS A 88 -3.731 1.507 14.250 1.00 0.00 N ATOM 0 H LYS A 88 -1.436 0.357 11.014 1.00 0.00 H new ATOM 0 HA LYS A 88 0.468 -1.434 10.402 1.00 0.00 H new ATOM 0 HB2 LYS A 88 1.377 -0.970 12.658 1.00 0.00 H new ATOM 0 HB3 LYS A 88 0.720 0.498 11.961 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -0.695 -1.206 14.067 1.00 0.00 H new ATOM 0 HG3 LYS A 88 0.222 0.248 14.407 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -1.316 1.582 13.040 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -2.200 0.140 12.583 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -2.779 -0.226 14.989 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -1.967 1.276 15.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -4.389 1.491 15.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -3.481 2.492 14.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -4.185 1.069 13.423 1.00 0.00 H new ATOM 1376 N ASP A 89 -1.692 -2.906 12.371 1.00 0.00 N ATOM 1377 CA ASP A 89 -1.998 -4.203 12.970 1.00 0.00 C ATOM 1378 C ASP A 89 -2.428 -5.185 11.906 1.00 0.00 C ATOM 1379 O ASP A 89 -2.099 -6.362 11.973 1.00 0.00 O ATOM 1380 CB ASP A 89 -3.038 -4.093 14.083 1.00 0.00 C ATOM 1381 CG ASP A 89 -3.161 -5.370 14.910 1.00 0.00 C ATOM 1382 OD1 ASP A 89 -2.206 -5.696 15.675 1.00 0.00 O ATOM 1383 OD2 ASP A 89 -4.224 -6.011 14.895 1.00 0.00 O ATOM 0 H ASP A 89 -2.427 -2.204 12.454 1.00 0.00 H new ATOM 0 HA ASP A 89 -1.086 -4.576 13.435 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -2.773 -3.265 14.740 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -4.007 -3.855 13.645 1.00 0.00 H new ATOM 1388 N VAL A 90 -3.110 -4.676 10.884 1.00 0.00 N ATOM 1389 CA VAL A 90 -3.506 -5.490 9.728 1.00 0.00 C ATOM 1390 C VAL A 90 -2.237 -5.980 9.038 1.00 0.00 C ATOM 1391 O VAL A 90 -2.084 -7.172 8.734 1.00 0.00 O ATOM 1392 CB VAL A 90 -4.362 -4.669 8.712 1.00 0.00 C ATOM 1393 CG1 VAL A 90 -4.788 -5.526 7.526 1.00 0.00 C ATOM 1394 CG2 VAL A 90 -5.586 -4.085 9.388 1.00 0.00 C ATOM 0 H VAL A 90 -3.403 -3.701 10.829 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.115 -6.325 10.075 1.00 0.00 H new ATOM 0 HB VAL A 90 -3.738 -3.855 8.343 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -5.382 -4.925 6.838 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -3.903 -5.900 7.011 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -5.384 -6.367 7.880 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.167 -3.517 8.661 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.198 -4.891 9.792 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.274 -3.426 10.198 1.00 0.00 H new ATOM 1404 N ILE A 91 -1.311 -5.046 8.858 1.00 0.00 N ATOM 1405 CA ILE A 91 -0.011 -5.317 8.274 1.00 0.00 C ATOM 1406 C ILE A 91 0.737 -6.354 9.122 1.00 0.00 C ATOM 1407 O ILE A 91 1.283 -7.333 8.596 1.00 0.00 O ATOM 1408 CB ILE A 91 0.826 -4.003 8.178 1.00 0.00 C ATOM 1409 CG1 ILE A 91 0.117 -2.984 7.278 1.00 0.00 C ATOM 1410 CG2 ILE A 91 2.236 -4.278 7.663 1.00 0.00 C ATOM 1411 CD1 ILE A 91 0.780 -1.623 7.246 1.00 0.00 C ATOM 0 H ILE A 91 -1.447 -4.069 9.118 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.155 -5.714 7.269 1.00 0.00 H new ATOM 0 HB ILE A 91 0.913 -3.587 9.182 1.00 0.00 H new ATOM 0 HG12 ILE A 91 0.074 -3.379 6.263 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -0.912 -2.868 7.619 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.792 -3.342 7.608 1.00 0.00 H new ATOM 0 HG22 ILE A 91 2.744 -4.963 8.342 1.00 0.00 H new ATOM 0 HG23 ILE A 91 2.180 -4.726 6.671 1.00 0.00 H new ATOM 0 HD11 ILE A 91 0.219 -0.960 6.588 1.00 0.00 H new ATOM 0 HD12 ILE A 91 0.799 -1.204 8.252 1.00 0.00 H new ATOM 0 HD13 ILE A 91 1.800 -1.724 6.875 1.00 0.00 H new ATOM 1423 N ASN A 92 0.724 -6.143 10.434 1.00 0.00 N ATOM 1424 CA ASN A 92 1.375 -7.035 11.393 1.00 0.00 C ATOM 1425 C ASN A 92 0.812 -8.452 11.317 1.00 0.00 C ATOM 1426 O ASN A 92 1.562 -9.411 11.154 1.00 0.00 O ATOM 1427 CB ASN A 92 1.247 -6.482 12.833 1.00 0.00 C ATOM 1428 CG ASN A 92 1.819 -7.416 13.900 1.00 0.00 C ATOM 1429 OD1 ASN A 92 3.012 -7.360 14.229 1.00 0.00 O ATOM 1430 ND2 ASN A 92 0.978 -8.223 14.483 1.00 0.00 N ATOM 0 H ASN A 92 0.260 -5.345 10.867 1.00 0.00 H new ATOM 0 HA ASN A 92 2.431 -7.081 11.128 1.00 0.00 H new ATOM 0 HB2 ASN A 92 1.758 -5.521 12.891 1.00 0.00 H new ATOM 0 HB3 ASN A 92 0.195 -6.297 13.050 1.00 0.00 H new ATOM 0 HD21 ASN A 92 1.296 -8.834 15.235 1.00 0.00 H new ATOM 0 HD22 ASN A 92 0.002 -8.243 14.187 1.00 0.00 H new ATOM 1437 N LYS A 93 -0.505 -8.573 11.391 1.00 0.00 N ATOM 1438 CA LYS A 93 -1.151 -9.880 11.389 1.00 0.00 C ATOM 1439 C LYS A 93 -0.908 -10.628 10.106 1.00 0.00 C ATOM 1440 O LYS A 93 -0.638 -11.829 10.123 1.00 0.00 O ATOM 1441 CB LYS A 93 -2.661 -9.788 11.668 1.00 0.00 C ATOM 1442 CG LYS A 93 -3.026 -9.176 13.020 1.00 0.00 C ATOM 1443 CD LYS A 93 -2.245 -9.810 14.162 1.00 0.00 C ATOM 1444 CE LYS A 93 -2.438 -11.315 14.242 1.00 0.00 C ATOM 1445 NZ LYS A 93 -1.570 -11.897 15.269 1.00 0.00 N ATOM 0 H LYS A 93 -1.148 -7.784 11.453 1.00 0.00 H new ATOM 0 HA LYS A 93 -0.692 -10.439 12.204 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -3.127 -9.197 10.880 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.089 -10.789 11.611 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -2.830 -8.104 12.998 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -4.094 -9.301 13.198 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -1.185 -9.590 14.037 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.556 -9.358 15.104 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -3.480 -11.541 14.469 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -2.218 -11.766 13.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -1.510 -12.926 15.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -0.619 -11.482 15.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -1.964 -11.697 16.211 1.00 0.00 H new ATOM 1459 N ALA A 94 -0.982 -9.922 9.005 1.00 0.00 N ATOM 1460 CA ALA A 94 -0.778 -10.515 7.715 1.00 0.00 C ATOM 1461 C ALA A 94 0.638 -11.056 7.568 1.00 0.00 C ATOM 1462 O ALA A 94 0.821 -12.201 7.151 1.00 0.00 O ATOM 1463 CB ALA A 94 -1.090 -9.522 6.633 1.00 0.00 C ATOM 0 H ALA A 94 -1.185 -8.923 8.982 1.00 0.00 H new ATOM 0 HA ALA A 94 -1.459 -11.360 7.618 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -0.931 -9.984 5.659 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -2.129 -9.204 6.719 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.436 -8.656 6.735 1.00 0.00 H new ATOM 1469 N LYS A 95 1.641 -10.269 7.967 1.00 0.00 N ATOM 1470 CA LYS A 95 3.026 -10.715 7.826 1.00 0.00 C ATOM 1471 C LYS A 95 3.352 -11.877 8.763 1.00 0.00 C ATOM 1472 O LYS A 95 4.232 -12.686 8.461 1.00 0.00 O ATOM 1473 CB LYS A 95 4.054 -9.580 7.962 1.00 0.00 C ATOM 1474 CG LYS A 95 4.046 -8.872 9.299 1.00 0.00 C ATOM 1475 CD LYS A 95 5.191 -7.882 9.433 1.00 0.00 C ATOM 1476 CE LYS A 95 5.119 -6.766 8.413 1.00 0.00 C ATOM 1477 NZ LYS A 95 6.220 -5.793 8.573 1.00 0.00 N ATOM 0 H LYS A 95 1.524 -9.344 8.380 1.00 0.00 H new ATOM 0 HA LYS A 95 3.110 -11.078 6.802 1.00 0.00 H new ATOM 0 HB2 LYS A 95 5.050 -9.988 7.789 1.00 0.00 H new ATOM 0 HB3 LYS A 95 3.870 -8.846 7.177 1.00 0.00 H new ATOM 0 HG2 LYS A 95 3.099 -8.348 9.425 1.00 0.00 H new ATOM 0 HG3 LYS A 95 4.111 -9.610 10.099 1.00 0.00 H new ATOM 0 HD2 LYS A 95 5.181 -7.454 10.435 1.00 0.00 H new ATOM 0 HD3 LYS A 95 6.138 -8.410 9.322 1.00 0.00 H new ATOM 0 HE2 LYS A 95 5.154 -7.190 7.410 1.00 0.00 H new ATOM 0 HE3 LYS A 95 4.164 -6.250 8.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 6.131 -5.047 7.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 6.173 -5.368 9.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 7.132 -6.279 8.457 1.00 0.00 H new ATOM 1491 N GLU A 96 2.633 -11.979 9.883 1.00 0.00 N ATOM 1492 CA GLU A 96 2.800 -13.115 10.793 1.00 0.00 C ATOM 1493 C GLU A 96 2.267 -14.385 10.139 1.00 0.00 C ATOM 1494 O GLU A 96 2.740 -15.488 10.410 1.00 0.00 O ATOM 1495 CB GLU A 96 2.088 -12.900 12.136 1.00 0.00 C ATOM 1496 CG GLU A 96 2.631 -11.759 12.976 1.00 0.00 C ATOM 1497 CD GLU A 96 1.972 -11.694 14.331 1.00 0.00 C ATOM 1498 OE1 GLU A 96 0.847 -11.201 14.442 1.00 0.00 O ATOM 1499 OE2 GLU A 96 2.571 -12.170 15.332 1.00 0.00 O ATOM 0 H GLU A 96 1.936 -11.296 10.180 1.00 0.00 H new ATOM 0 HA GLU A 96 3.867 -13.210 10.995 1.00 0.00 H new ATOM 0 HB2 GLU A 96 1.031 -12.718 11.944 1.00 0.00 H new ATOM 0 HB3 GLU A 96 2.153 -13.821 12.716 1.00 0.00 H new ATOM 0 HG2 GLU A 96 3.707 -11.881 13.101 1.00 0.00 H new ATOM 0 HG3 GLU A 96 2.476 -10.816 12.451 1.00 0.00 H new ATOM 1506 N LEU A 97 1.293 -14.218 9.266 1.00 0.00 N ATOM 1507 CA LEU A 97 0.688 -15.332 8.554 1.00 0.00 C ATOM 1508 C LEU A 97 1.450 -15.625 7.261 1.00 0.00 C ATOM 1509 O LEU A 97 1.088 -16.514 6.499 1.00 0.00 O ATOM 1510 CB LEU A 97 -0.787 -15.038 8.256 1.00 0.00 C ATOM 1511 CG LEU A 97 -1.690 -14.807 9.478 1.00 0.00 C ATOM 1512 CD1 LEU A 97 -3.096 -14.453 9.041 1.00 0.00 C ATOM 1513 CD2 LEU A 97 -1.711 -16.036 10.377 1.00 0.00 C ATOM 0 H LEU A 97 0.897 -13.308 9.029 1.00 0.00 H new ATOM 0 HA LEU A 97 0.743 -16.216 9.189 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.839 -14.155 7.619 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.194 -15.870 7.681 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.281 -13.972 10.047 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -3.721 -14.293 9.920 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -3.072 -13.543 8.442 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -3.508 -15.268 8.446 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -2.357 -15.848 11.235 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -2.091 -16.890 9.817 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -0.700 -16.250 10.724 1.00 0.00 H new ATOM 1525 N GLY A 98 2.490 -14.855 7.008 1.00 0.00 N ATOM 1526 CA GLY A 98 3.317 -15.089 5.842 1.00 0.00 C ATOM 1527 C GLY A 98 2.846 -14.317 4.636 1.00 0.00 C ATOM 1528 O GLY A 98 3.332 -14.527 3.514 1.00 0.00 O ATOM 0 H GLY A 98 2.780 -14.068 7.589 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.346 -14.810 6.069 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.319 -16.154 5.610 1.00 0.00 H new ATOM 1532 N VAL A 99 1.905 -13.439 4.855 1.00 0.00 N ATOM 1533 CA VAL A 99 1.367 -12.614 3.811 1.00 0.00 C ATOM 1534 C VAL A 99 2.149 -11.321 3.795 1.00 0.00 C ATOM 1535 O VAL A 99 2.338 -10.688 4.837 1.00 0.00 O ATOM 1536 CB VAL A 99 -0.132 -12.310 4.053 1.00 0.00 C ATOM 1537 CG1 VAL A 99 -0.714 -11.454 2.936 1.00 0.00 C ATOM 1538 CG2 VAL A 99 -0.922 -13.596 4.204 1.00 0.00 C ATOM 0 H VAL A 99 1.488 -13.276 5.771 1.00 0.00 H new ATOM 0 HA VAL A 99 1.450 -13.135 2.857 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.208 -11.744 4.981 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.767 -11.260 3.138 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.174 -10.509 2.883 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.618 -11.980 1.986 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.973 -13.360 4.373 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.826 -14.191 3.296 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.536 -14.163 5.052 1.00 0.00 H new ATOM 1548 N ASN A 100 2.629 -10.937 2.655 1.00 0.00 N ATOM 1549 CA ASN A 100 3.412 -9.738 2.569 1.00 0.00 C ATOM 1550 C ASN A 100 2.508 -8.529 2.510 1.00 0.00 C ATOM 1551 O ASN A 100 2.020 -8.147 1.430 1.00 0.00 O ATOM 1552 CB ASN A 100 4.347 -9.756 1.366 1.00 0.00 C ATOM 1553 CG ASN A 100 5.356 -8.619 1.411 1.00 0.00 C ATOM 1554 OD1 ASN A 100 6.448 -8.773 1.953 1.00 0.00 O ATOM 1555 ND2 ASN A 100 5.003 -7.480 0.879 1.00 0.00 N ATOM 0 H ASN A 100 2.496 -11.431 1.773 1.00 0.00 H new ATOM 0 HA ASN A 100 4.030 -9.683 3.465 1.00 0.00 H new ATOM 0 HB2 ASN A 100 4.876 -10.709 1.332 1.00 0.00 H new ATOM 0 HB3 ASN A 100 3.761 -9.684 0.450 1.00 0.00 H new ATOM 0 HD21 ASN A 100 5.641 -6.685 0.906 1.00 0.00 H new ATOM 0 HD22 ASN A 100 4.089 -7.385 0.436 1.00 0.00 H new ATOM 1562 N ALA A 101 2.236 -7.976 3.657 1.00 0.00 N ATOM 1563 CA ALA A 101 1.414 -6.805 3.759 1.00 0.00 C ATOM 1564 C ALA A 101 2.277 -5.593 3.908 1.00 0.00 C ATOM 1565 O ALA A 101 3.215 -5.588 4.709 1.00 0.00 O ATOM 1566 CB ALA A 101 0.471 -6.914 4.931 1.00 0.00 C ATOM 0 H ALA A 101 2.580 -8.326 4.551 1.00 0.00 H new ATOM 0 HA ALA A 101 0.821 -6.717 2.849 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -0.143 -6.015 4.989 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -0.172 -7.784 4.801 1.00 0.00 H new ATOM 0 HB3 ALA A 101 1.045 -7.021 5.851 1.00 0.00 H new ATOM 1572 N ILE A 102 1.989 -4.590 3.144 1.00 0.00 N ATOM 1573 CA ILE A 102 2.717 -3.354 3.190 1.00 0.00 C ATOM 1574 C ILE A 102 1.759 -2.175 3.131 1.00 0.00 C ATOM 1575 O ILE A 102 0.616 -2.329 2.667 1.00 0.00 O ATOM 1576 CB ILE A 102 3.828 -3.251 2.068 1.00 0.00 C ATOM 1577 CG1 ILE A 102 3.336 -3.691 0.667 1.00 0.00 C ATOM 1578 CG2 ILE A 102 5.085 -3.999 2.452 1.00 0.00 C ATOM 1579 CD1 ILE A 102 2.365 -2.746 -0.004 1.00 0.00 C ATOM 0 H ILE A 102 1.233 -4.601 2.460 1.00 0.00 H new ATOM 0 HA ILE A 102 3.248 -3.329 4.142 1.00 0.00 H new ATOM 0 HB ILE A 102 4.065 -2.190 1.995 1.00 0.00 H new ATOM 0 HG12 ILE A 102 4.203 -3.815 0.018 1.00 0.00 H new ATOM 0 HG13 ILE A 102 2.862 -4.669 0.757 1.00 0.00 H new ATOM 0 HG21 ILE A 102 5.823 -3.904 1.655 1.00 0.00 H new ATOM 0 HG22 ILE A 102 5.490 -3.581 3.374 1.00 0.00 H new ATOM 0 HG23 ILE A 102 4.849 -5.052 2.604 1.00 0.00 H new ATOM 0 HD11 ILE A 102 2.083 -3.146 -0.978 1.00 0.00 H new ATOM 0 HD12 ILE A 102 1.475 -2.638 0.616 1.00 0.00 H new ATOM 0 HD13 ILE A 102 2.836 -1.772 -0.134 1.00 0.00 H new ATOM 1591 N PRO A 103 2.172 -1.007 3.641 1.00 0.00 N ATOM 1592 CA PRO A 103 1.376 0.200 3.539 1.00 0.00 C ATOM 1593 C PRO A 103 1.346 0.711 2.103 1.00 0.00 C ATOM 1594 O PRO A 103 2.238 0.377 1.284 1.00 0.00 O ATOM 1595 CB PRO A 103 2.103 1.217 4.434 1.00 0.00 C ATOM 1596 CG PRO A 103 3.116 0.442 5.199 1.00 0.00 C ATOM 1597 CD PRO A 103 3.416 -0.780 4.390 1.00 0.00 C ATOM 0 HA PRO A 103 0.341 0.031 3.838 1.00 0.00 H new ATOM 0 HB2 PRO A 103 2.578 1.994 3.835 1.00 0.00 H new ATOM 0 HB3 PRO A 103 1.404 1.715 5.106 1.00 0.00 H new ATOM 0 HG2 PRO A 103 4.018 1.033 5.358 1.00 0.00 H new ATOM 0 HG3 PRO A 103 2.735 0.171 6.184 1.00 0.00 H new ATOM 0 HD2 PRO A 103 4.263 -0.622 3.723 1.00 0.00 H new ATOM 0 HD3 PRO A 103 3.664 -1.631 5.024 1.00 0.00 H new ATOM 1605 N ILE A 104 0.367 1.539 1.811 1.00 0.00 N ATOM 1606 CA ILE A 104 0.174 2.127 0.494 1.00 0.00 C ATOM 1607 C ILE A 104 1.421 2.853 0.006 1.00 0.00 C ATOM 1608 O ILE A 104 1.840 2.683 -1.142 1.00 0.00 O ATOM 1609 CB ILE A 104 -1.058 3.079 0.503 1.00 0.00 C ATOM 1610 CG1 ILE A 104 -2.349 2.260 0.531 1.00 0.00 C ATOM 1611 CG2 ILE A 104 -1.048 4.096 -0.642 1.00 0.00 C ATOM 1612 CD1 ILE A 104 -3.593 3.092 0.577 1.00 0.00 C ATOM 0 H ILE A 104 -0.333 1.831 2.492 1.00 0.00 H new ATOM 0 HA ILE A 104 -0.016 1.315 -0.207 1.00 0.00 H new ATOM 0 HB ILE A 104 -1.000 3.677 1.413 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -2.382 1.622 -0.352 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -2.331 1.601 1.399 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.934 4.727 -0.576 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -0.155 4.716 -0.570 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.048 3.569 -1.596 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.466 2.440 0.595 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.584 3.711 1.474 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -3.636 3.732 -0.305 1.00 0.00 H new ATOM 1624 N GLU A 105 2.039 3.596 0.898 1.00 0.00 N ATOM 1625 CA GLU A 105 3.198 4.381 0.576 1.00 0.00 C ATOM 1626 C GLU A 105 4.361 3.495 0.144 1.00 0.00 C ATOM 1627 O GLU A 105 5.062 3.828 -0.791 1.00 0.00 O ATOM 1628 CB GLU A 105 3.536 5.285 1.754 1.00 0.00 C ATOM 1629 CG GLU A 105 4.585 6.354 1.490 1.00 0.00 C ATOM 1630 CD GLU A 105 6.009 5.863 1.559 1.00 0.00 C ATOM 1631 OE1 GLU A 105 6.361 5.179 2.534 1.00 0.00 O ATOM 1632 OE2 GLU A 105 6.818 6.210 0.675 1.00 0.00 O ATOM 0 H GLU A 105 1.745 3.669 1.872 1.00 0.00 H new ATOM 0 HA GLU A 105 2.985 5.021 -0.280 1.00 0.00 H new ATOM 0 HB2 GLU A 105 2.621 5.775 2.085 1.00 0.00 H new ATOM 0 HB3 GLU A 105 3.880 4.661 2.579 1.00 0.00 H new ATOM 0 HG2 GLU A 105 4.409 6.782 0.503 1.00 0.00 H new ATOM 0 HG3 GLU A 105 4.456 7.159 2.214 1.00 0.00 H new ATOM 1639 N GLU A 106 4.506 2.329 0.763 1.00 0.00 N ATOM 1640 CA GLU A 106 5.587 1.430 0.388 1.00 0.00 C ATOM 1641 C GLU A 106 5.333 0.814 -0.976 1.00 0.00 C ATOM 1642 O GLU A 106 6.267 0.576 -1.737 1.00 0.00 O ATOM 1643 CB GLU A 106 5.866 0.351 1.430 1.00 0.00 C ATOM 1644 CG GLU A 106 6.366 0.889 2.757 1.00 0.00 C ATOM 1645 CD GLU A 106 7.155 -0.142 3.524 1.00 0.00 C ATOM 1646 OE1 GLU A 106 8.345 -0.334 3.183 1.00 0.00 O ATOM 1647 OE2 GLU A 106 6.623 -0.775 4.457 1.00 0.00 O ATOM 0 H GLU A 106 3.902 1.990 1.511 1.00 0.00 H new ATOM 0 HA GLU A 106 6.487 2.043 0.336 1.00 0.00 H new ATOM 0 HB2 GLU A 106 4.953 -0.219 1.602 1.00 0.00 H new ATOM 0 HB3 GLU A 106 6.605 -0.344 1.030 1.00 0.00 H new ATOM 0 HG2 GLU A 106 6.990 1.765 2.581 1.00 0.00 H new ATOM 0 HG3 GLU A 106 5.518 1.217 3.358 1.00 0.00 H new ATOM 1654 N LEU A 107 4.069 0.587 -1.290 1.00 0.00 N ATOM 1655 CA LEU A 107 3.674 0.079 -2.599 1.00 0.00 C ATOM 1656 C LEU A 107 4.027 1.143 -3.643 1.00 0.00 C ATOM 1657 O LEU A 107 4.679 0.859 -4.652 1.00 0.00 O ATOM 1658 CB LEU A 107 2.144 -0.245 -2.588 1.00 0.00 C ATOM 1659 CG LEU A 107 1.503 -0.957 -3.816 1.00 0.00 C ATOM 1660 CD1 LEU A 107 1.376 -0.043 -5.022 1.00 0.00 C ATOM 1661 CD2 LEU A 107 2.273 -2.224 -4.179 1.00 0.00 C ATOM 0 H LEU A 107 3.290 0.747 -0.652 1.00 0.00 H new ATOM 0 HA LEU A 107 4.200 -0.843 -2.845 1.00 0.00 H new ATOM 0 HB2 LEU A 107 1.947 -0.863 -1.712 1.00 0.00 H new ATOM 0 HB3 LEU A 107 1.612 0.695 -2.441 1.00 0.00 H new ATOM 0 HG LEU A 107 0.492 -1.235 -3.520 1.00 0.00 H new ATOM 0 HD11 LEU A 107 0.923 -0.591 -5.848 1.00 0.00 H new ATOM 0 HD12 LEU A 107 0.749 0.811 -4.767 1.00 0.00 H new ATOM 0 HD13 LEU A 107 2.365 0.308 -5.318 1.00 0.00 H new ATOM 0 HD21 LEU A 107 1.804 -2.701 -5.040 1.00 0.00 H new ATOM 0 HD22 LEU A 107 3.303 -1.966 -4.424 1.00 0.00 H new ATOM 0 HD23 LEU A 107 2.263 -2.911 -3.333 1.00 0.00 H new ATOM 1673 N LEU A 108 3.640 2.375 -3.346 1.00 0.00 N ATOM 1674 CA LEU A 108 3.900 3.536 -4.203 1.00 0.00 C ATOM 1675 C LEU A 108 5.398 3.788 -4.345 1.00 0.00 C ATOM 1676 O LEU A 108 5.873 4.258 -5.378 1.00 0.00 O ATOM 1677 CB LEU A 108 3.251 4.780 -3.596 1.00 0.00 C ATOM 1678 CG LEU A 108 1.741 4.747 -3.410 1.00 0.00 C ATOM 1679 CD1 LEU A 108 1.284 5.975 -2.646 1.00 0.00 C ATOM 1680 CD2 LEU A 108 1.043 4.669 -4.754 1.00 0.00 C ATOM 0 H LEU A 108 3.130 2.606 -2.493 1.00 0.00 H new ATOM 0 HA LEU A 108 3.479 3.329 -5.187 1.00 0.00 H new ATOM 0 HB2 LEU A 108 3.709 4.961 -2.624 1.00 0.00 H new ATOM 0 HB3 LEU A 108 3.496 5.633 -4.228 1.00 0.00 H new ATOM 0 HG LEU A 108 1.478 3.859 -2.835 1.00 0.00 H new ATOM 0 HD11 LEU A 108 0.202 5.942 -2.518 1.00 0.00 H new ATOM 0 HD12 LEU A 108 1.765 5.995 -1.668 1.00 0.00 H new ATOM 0 HD13 LEU A 108 1.556 6.872 -3.202 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -0.036 4.646 -4.603 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.307 5.541 -5.352 1.00 0.00 H new ATOM 0 HD23 LEU A 108 1.356 3.764 -5.274 1.00 0.00 H new ATOM 1692 N ALA A 109 6.129 3.498 -3.302 1.00 0.00 N ATOM 1693 CA ALA A 109 7.555 3.698 -3.287 1.00 0.00 C ATOM 1694 C ALA A 109 8.301 2.572 -3.968 1.00 0.00 C ATOM 1695 O ALA A 109 9.480 2.697 -4.199 1.00 0.00 O ATOM 1696 CB ALA A 109 8.051 3.869 -1.871 1.00 0.00 C ATOM 0 H ALA A 109 5.752 3.115 -2.435 1.00 0.00 H new ATOM 0 HA ALA A 109 7.754 4.609 -3.851 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.131 4.019 -1.879 1.00 0.00 H new ATOM 0 HB2 ALA A 109 7.568 4.735 -1.418 1.00 0.00 H new ATOM 0 HB3 ALA A 109 7.813 2.977 -1.292 1.00 0.00 H new ATOM 1702 N SER A 110 7.608 1.484 -4.280 1.00 0.00 N ATOM 1703 CA SER A 110 8.219 0.321 -4.928 1.00 0.00 C ATOM 1704 C SER A 110 7.747 0.194 -6.379 1.00 0.00 C ATOM 1705 O SER A 110 7.853 -0.877 -7.002 1.00 0.00 O ATOM 1706 CB SER A 110 7.838 -0.946 -4.160 1.00 0.00 C ATOM 1707 OG SER A 110 8.255 -0.876 -2.800 1.00 0.00 O ATOM 0 H SER A 110 6.611 1.379 -4.094 1.00 0.00 H new ATOM 0 HA SER A 110 9.301 0.451 -4.924 1.00 0.00 H new ATOM 0 HB2 SER A 110 6.758 -1.089 -4.204 1.00 0.00 H new ATOM 0 HB3 SER A 110 8.294 -1.813 -4.637 1.00 0.00 H new ATOM 0 HG SER A 110 7.544 -0.470 -2.260 1.00 0.00 H new ATOM 1713 N SER A 111 7.274 1.279 -6.928 1.00 0.00 N ATOM 1714 CA SER A 111 6.681 1.252 -8.238 1.00 0.00 C ATOM 1715 C SER A 111 7.692 1.481 -9.382 1.00 0.00 C ATOM 1716 O SER A 111 7.409 1.127 -10.524 1.00 0.00 O ATOM 1717 CB SER A 111 5.581 2.309 -8.300 1.00 0.00 C ATOM 1718 OG SER A 111 4.674 2.159 -7.213 1.00 0.00 O ATOM 0 H SER A 111 7.288 2.198 -6.486 1.00 0.00 H new ATOM 0 HA SER A 111 6.277 0.251 -8.389 1.00 0.00 H new ATOM 0 HB2 SER A 111 6.025 3.304 -8.274 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.042 2.225 -9.244 1.00 0.00 H new ATOM 0 HG SER A 111 5.030 1.503 -6.578 1.00 0.00 H new ATOM 1724 N LEU A 112 8.869 2.016 -9.100 1.00 0.00 N ATOM 1725 CA LEU A 112 9.727 2.448 -10.211 1.00 0.00 C ATOM 1726 C LEU A 112 11.135 1.870 -10.209 1.00 0.00 C ATOM 1727 O LEU A 112 11.732 1.725 -11.276 1.00 0.00 O ATOM 1728 CB LEU A 112 9.804 3.978 -10.260 1.00 0.00 C ATOM 1729 CG LEU A 112 8.492 4.733 -10.508 1.00 0.00 C ATOM 1730 CD1 LEU A 112 8.723 6.233 -10.423 1.00 0.00 C ATOM 1731 CD2 LEU A 112 7.908 4.369 -11.868 1.00 0.00 C ATOM 0 H LEU A 112 9.246 2.160 -8.163 1.00 0.00 H new ATOM 0 HA LEU A 112 9.246 2.049 -11.104 1.00 0.00 H new ATOM 0 HB2 LEU A 112 10.222 4.327 -9.316 1.00 0.00 H new ATOM 0 HB3 LEU A 112 10.509 4.257 -11.043 1.00 0.00 H new ATOM 0 HG LEU A 112 7.779 4.441 -9.737 1.00 0.00 H new ATOM 0 HD11 LEU A 112 7.784 6.756 -10.601 1.00 0.00 H new ATOM 0 HD12 LEU A 112 9.098 6.488 -9.432 1.00 0.00 H new ATOM 0 HD13 LEU A 112 9.453 6.532 -11.175 1.00 0.00 H new ATOM 0 HD21 LEU A 112 6.978 4.916 -12.023 1.00 0.00 H new ATOM 0 HD22 LEU A 112 8.619 4.632 -12.651 1.00 0.00 H new ATOM 0 HD23 LEU A 112 7.709 3.298 -11.904 1.00 0.00 H new ATOM 1743 N GLU A 113 11.651 1.529 -9.050 1.00 0.00 N ATOM 1744 CA GLU A 113 13.051 1.121 -8.906 1.00 0.00 C ATOM 1745 C GLU A 113 13.354 -0.138 -9.688 1.00 0.00 C ATOM 1746 O GLU A 113 14.409 -0.237 -10.325 1.00 0.00 O ATOM 1747 CB GLU A 113 13.457 0.863 -7.438 1.00 0.00 C ATOM 1748 CG GLU A 113 12.864 1.795 -6.400 1.00 0.00 C ATOM 1749 CD GLU A 113 11.466 1.382 -6.032 1.00 0.00 C ATOM 1750 OE1 GLU A 113 11.316 0.576 -5.083 1.00 0.00 O ATOM 1751 OE2 GLU A 113 10.494 1.834 -6.715 1.00 0.00 O ATOM 0 H GLU A 113 11.124 1.523 -8.177 1.00 0.00 H new ATOM 0 HA GLU A 113 13.625 1.961 -9.297 1.00 0.00 H new ATOM 0 HB2 GLU A 113 13.176 -0.158 -7.180 1.00 0.00 H new ATOM 0 HB3 GLU A 113 14.543 0.922 -7.369 1.00 0.00 H new ATOM 0 HG2 GLU A 113 13.492 1.797 -5.509 1.00 0.00 H new ATOM 0 HG3 GLU A 113 12.855 2.814 -6.786 1.00 0.00 H new ATOM 1758 N HIS A 114 12.420 -1.104 -9.641 1.00 0.00 N ATOM 1759 CA HIS A 114 12.624 -2.430 -10.235 1.00 0.00 C ATOM 1760 C HIS A 114 13.763 -3.127 -9.511 1.00 0.00 C ATOM 1761 O HIS A 114 14.163 -2.675 -8.435 1.00 0.00 O ATOM 1762 CB HIS A 114 12.897 -2.346 -11.747 1.00 0.00 C ATOM 1763 CG HIS A 114 11.733 -1.897 -12.550 1.00 0.00 C ATOM 1764 ND1 HIS A 114 11.492 -0.589 -12.867 1.00 0.00 N ATOM 1765 CD2 HIS A 114 10.742 -2.600 -13.112 1.00 0.00 C ATOM 1766 CE1 HIS A 114 10.404 -0.508 -13.582 1.00 0.00 C ATOM 1767 NE2 HIS A 114 9.931 -1.715 -13.748 1.00 0.00 N ATOM 0 H HIS A 114 11.511 -0.986 -9.193 1.00 0.00 H new ATOM 0 HA HIS A 114 11.709 -3.010 -10.118 1.00 0.00 H new ATOM 0 HB2 HIS A 114 13.728 -1.661 -11.918 1.00 0.00 H new ATOM 0 HB3 HIS A 114 13.214 -3.326 -12.103 1.00 0.00 H new ATOM 0 HD1 HIS A 114 12.073 0.201 -12.588 1.00 0.00 H new ATOM 0 HD2 HIS A 114 10.612 -3.671 -13.068 1.00 0.00 H new ATOM 0 HE1 HIS A 114 9.969 0.401 -13.970 1.00 0.00 H new ATOM 1776 N HIS A 115 14.268 -4.221 -10.076 1.00 0.00 N ATOM 1777 CA HIS A 115 15.363 -5.021 -9.488 1.00 0.00 C ATOM 1778 C HIS A 115 14.980 -5.559 -8.120 1.00 0.00 C ATOM 1779 O HIS A 115 14.378 -6.622 -8.015 1.00 0.00 O ATOM 1780 CB HIS A 115 16.717 -4.268 -9.414 1.00 0.00 C ATOM 1781 CG HIS A 115 17.305 -3.899 -10.732 1.00 0.00 C ATOM 1782 ND1 HIS A 115 18.111 -4.739 -11.460 1.00 0.00 N ATOM 1783 CD2 HIS A 115 17.209 -2.760 -11.450 1.00 0.00 C ATOM 1784 CE1 HIS A 115 18.483 -4.136 -12.567 1.00 0.00 C ATOM 1785 NE2 HIS A 115 17.951 -2.931 -12.587 1.00 0.00 N ATOM 0 H HIS A 115 13.931 -4.589 -10.966 1.00 0.00 H new ATOM 0 HA HIS A 115 15.512 -5.857 -10.172 1.00 0.00 H new ATOM 0 HB2 HIS A 115 16.579 -3.360 -8.828 1.00 0.00 H new ATOM 0 HB3 HIS A 115 17.432 -4.889 -8.875 1.00 0.00 H new ATOM 0 HD2 HIS A 115 16.650 -1.877 -11.178 1.00 0.00 H new ATOM 0 HE1 HIS A 115 19.118 -4.558 -13.332 1.00 0.00 H new ATOM 0 HE2 HIS A 115 18.072 -2.240 -13.327 1.00 0.00 H new ATOM 1794 N HIS A 116 15.260 -4.795 -7.088 1.00 0.00 N ATOM 1795 CA HIS A 116 14.937 -5.203 -5.763 1.00 0.00 C ATOM 1796 C HIS A 116 13.881 -4.291 -5.171 1.00 0.00 C ATOM 1797 O HIS A 116 14.078 -3.088 -5.032 1.00 0.00 O ATOM 1798 CB HIS A 116 16.188 -5.327 -4.827 1.00 0.00 C ATOM 1799 CG HIS A 116 16.949 -4.048 -4.519 1.00 0.00 C ATOM 1800 ND1 HIS A 116 16.654 -3.224 -3.453 1.00 0.00 N ATOM 1801 CD2 HIS A 116 18.011 -3.488 -5.130 1.00 0.00 C ATOM 1802 CE1 HIS A 116 17.500 -2.221 -3.428 1.00 0.00 C ATOM 1803 NE2 HIS A 116 18.336 -2.353 -4.434 1.00 0.00 N ATOM 0 H HIS A 116 15.714 -3.884 -7.155 1.00 0.00 H new ATOM 0 HA HIS A 116 14.528 -6.211 -5.834 1.00 0.00 H new ATOM 0 HB2 HIS A 116 15.863 -5.763 -3.883 1.00 0.00 H new ATOM 0 HB3 HIS A 116 16.883 -6.033 -5.282 1.00 0.00 H new ATOM 0 HD2 HIS A 116 18.514 -3.865 -6.008 1.00 0.00 H new ATOM 0 HE1 HIS A 116 17.508 -1.421 -2.702 1.00 0.00 H new ATOM 0 HE2 HIS A 116 19.100 -1.716 -4.659 1.00 0.00 H new ATOM 1812 N HIS A 117 12.740 -4.854 -4.940 1.00 0.00 N ATOM 1813 CA HIS A 117 11.659 -4.218 -4.200 1.00 0.00 C ATOM 1814 C HIS A 117 10.868 -5.331 -3.553 1.00 0.00 C ATOM 1815 O HIS A 117 9.685 -5.216 -3.260 1.00 0.00 O ATOM 1816 CB HIS A 117 10.790 -3.253 -5.065 1.00 0.00 C ATOM 1817 CG HIS A 117 10.047 -3.842 -6.228 1.00 0.00 C ATOM 1818 ND1 HIS A 117 8.675 -3.945 -6.265 1.00 0.00 N ATOM 1819 CD2 HIS A 117 10.482 -4.275 -7.432 1.00 0.00 C ATOM 1820 CE1 HIS A 117 8.303 -4.407 -7.432 1.00 0.00 C ATOM 1821 NE2 HIS A 117 9.378 -4.617 -8.161 1.00 0.00 N ATOM 0 H HIS A 117 12.512 -5.794 -5.263 1.00 0.00 H new ATOM 0 HA HIS A 117 12.065 -3.552 -3.439 1.00 0.00 H new ATOM 0 HB2 HIS A 117 10.062 -2.776 -4.408 1.00 0.00 H new ATOM 0 HB3 HIS A 117 11.440 -2.465 -5.446 1.00 0.00 H new ATOM 0 HD2 HIS A 117 11.510 -4.339 -7.757 1.00 0.00 H new ATOM 0 HE1 HIS A 117 7.285 -4.586 -7.744 1.00 0.00 H new ATOM 0 HE2 HIS A 117 9.386 -4.977 -9.115 1.00 0.00 H new ATOM 1830 N HIS A 118 11.633 -6.388 -3.301 1.00 0.00 N ATOM 1831 CA HIS A 118 11.289 -7.673 -2.696 1.00 0.00 C ATOM 1832 C HIS A 118 12.566 -8.465 -2.658 1.00 0.00 C ATOM 1833 O HIS A 118 13.049 -8.939 -3.691 1.00 0.00 O ATOM 1834 CB HIS A 118 10.211 -8.490 -3.447 1.00 0.00 C ATOM 1835 CG HIS A 118 8.813 -8.051 -3.208 1.00 0.00 C ATOM 1836 ND1 HIS A 118 7.946 -7.719 -4.212 1.00 0.00 N ATOM 1837 CD2 HIS A 118 8.128 -7.892 -2.055 1.00 0.00 C ATOM 1838 CE1 HIS A 118 6.797 -7.372 -3.699 1.00 0.00 C ATOM 1839 NE2 HIS A 118 6.875 -7.462 -2.387 1.00 0.00 N ATOM 0 H HIS A 118 12.623 -6.363 -3.543 1.00 0.00 H new ATOM 0 HA HIS A 118 10.854 -7.476 -1.716 1.00 0.00 H new ATOM 0 HB2 HIS A 118 10.415 -8.436 -4.516 1.00 0.00 H new ATOM 0 HB3 HIS A 118 10.302 -9.537 -3.157 1.00 0.00 H new ATOM 0 HD1 HIS A 118 8.164 -7.739 -5.208 1.00 0.00 H new ATOM 0 HD2 HIS A 118 8.501 -8.071 -1.057 1.00 0.00 H new ATOM 0 HE1 HIS A 118 5.926 -7.062 -4.258 1.00 0.00 H new ATOM 1848 N HIS A 119 13.143 -8.527 -1.509 1.00 0.00 N ATOM 1849 CA HIS A 119 14.401 -9.174 -1.300 1.00 0.00 C ATOM 1850 C HIS A 119 14.412 -9.717 0.109 1.00 0.00 C ATOM 1851 O HIS A 119 14.682 -8.949 1.052 1.00 0.00 O ATOM 1852 CB HIS A 119 15.537 -8.155 -1.521 1.00 0.00 C ATOM 1853 CG HIS A 119 16.931 -8.680 -1.361 1.00 0.00 C ATOM 1854 ND1 HIS A 119 17.609 -9.324 -2.363 1.00 0.00 N ATOM 1855 CD2 HIS A 119 17.789 -8.606 -0.324 1.00 0.00 C ATOM 1856 CE1 HIS A 119 18.818 -9.626 -1.954 1.00 0.00 C ATOM 1857 NE2 HIS A 119 18.952 -9.199 -0.723 1.00 0.00 N ATOM 1858 OXT HIS A 119 14.119 -10.890 0.297 1.00 0.00 O ATOM 0 H HIS A 119 12.746 -8.119 -0.662 1.00 0.00 H new ATOM 0 HA HIS A 119 14.549 -9.995 -2.001 1.00 0.00 H new ATOM 0 HB2 HIS A 119 15.438 -7.743 -2.525 1.00 0.00 H new ATOM 0 HB3 HIS A 119 15.399 -7.329 -0.823 1.00 0.00 H new ATOM 0 HD2 HIS A 119 17.593 -8.161 0.641 1.00 0.00 H new ATOM 0 HE1 HIS A 119 19.573 -10.138 -2.532 1.00 0.00 H new ATOM 0 HE2 HIS A 119 19.792 -9.294 -0.153 1.00 0.00 H new TER 1867 HIS A 119