USER MOD reduce.3.24.130724 H: found=0, std=0, add=947, rem=0, adj=25 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 22 ASN : amide:sc= 0.204 K(o=-0.93,f=-6.2) USER MOD Set 1.2: A 114 HIS : no HD1:sc= -1.13! C(o=-0.93!,f=-8.3!) USER MOD Single : A 1 MET CE :methyl 164:sc= -0.322 (180deg=-0.767) USER MOD Single : A 1 MET N :NH3+ -109:sc= 0.138 (180deg=0) USER MOD Single : A 6 SER OG : rot -170:sc= -0.417 USER MOD Single : A 8 SER OG : rot -89:sc= 1.27 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 1.27 (180deg=1.27) USER MOD Single : A 14 LYS NZ :NH3+ -154:sc= 1.29 (180deg=1.19) USER MOD Single : A 19 SER OG : rot 79:sc= 0.998 USER MOD Single : A 20 ASN : amide:sc= -1.77! C(o=-1.8!,f=-5.5!) USER MOD Single : A 21 LYS NZ :NH3+ -116:sc= 0.295 (180deg=-0.0663) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00132) USER MOD Single : A 28 THR OG1 : rot 132:sc= 0.121 USER MOD Single : A 29 THR OG1 : rot 48:sc= 1.26 USER MOD Single : A 33 SER OG : rot 101:sc= 1.28 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 97:sc= 1.08 USER MOD Single : A 44 SER OG : rot -9:sc= 0.307 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 HIS : no HE2:sc= 1.14 K(o=1.1,f=-4.4!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN :FLIP amide:sc= -0.407 F(o=-1.4!,f=-0.41) USER MOD Single : A 67 GLN : amide:sc= -0.651 X(o=-0.65,f=-0.24) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 79:sc= 1.24 USER MOD Single : A 74 MET CE :methyl -104:sc= -0.822 (180deg=-2.84!) USER MOD Single : A 80 ASN :FLIP amide:sc= -0.0177 F(o=-0.54,f=-0.018) USER MOD Single : A 88 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0338) USER MOD Single : A 92 ASN : amide:sc= -2.36! C(o=-2.4!,f=-4.7!) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= -0.0052 K(o=-0.0052,f=-0.96) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot -102:sc= 0.166 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) USER MOD Single : A 117 HIS : no HE2:sc= 1.11 K(o=1.1,f=-5.5!) USER MOD Single : A 118 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 119 HIS : no HD1:sc= 0 X(o=0,f=-0.024) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.380 -10.494 -10.324 1.00 0.00 N ATOM 2 CA MET A 1 0.981 -10.968 -9.004 1.00 0.00 C ATOM 3 C MET A 1 -0.316 -10.260 -8.608 1.00 0.00 C ATOM 4 O MET A 1 -0.646 -9.201 -9.175 1.00 0.00 O ATOM 5 CB MET A 1 2.103 -10.639 -8.000 1.00 0.00 C ATOM 6 CG MET A 1 1.940 -11.251 -6.618 1.00 0.00 C ATOM 7 SD MET A 1 3.283 -10.794 -5.507 1.00 0.00 S ATOM 8 CE MET A 1 2.862 -11.747 -4.050 1.00 0.00 C ATOM 0 H1 MET A 1 1.240 -11.252 -11.022 1.00 0.00 H new ATOM 0 H2 MET A 1 0.802 -9.670 -10.586 1.00 0.00 H new ATOM 0 H3 MET A 1 2.383 -10.221 -10.306 1.00 0.00 H new ATOM 0 HA MET A 1 0.815 -12.045 -9.009 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.052 -10.975 -8.418 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.167 -9.556 -7.894 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.991 -10.929 -6.190 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.897 -12.337 -6.706 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.726 -11.800 -3.387 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.034 -11.268 -3.529 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.570 -12.755 -4.346 1.00 0.00 H new ATOM 20 N PHE A 2 -1.069 -10.831 -7.681 1.00 0.00 N ATOM 21 CA PHE A 2 -2.275 -10.187 -7.205 1.00 0.00 C ATOM 22 C PHE A 2 -1.922 -9.254 -6.044 1.00 0.00 C ATOM 23 O PHE A 2 -0.914 -9.467 -5.343 1.00 0.00 O ATOM 24 CB PHE A 2 -3.330 -11.215 -6.733 1.00 0.00 C ATOM 25 CG PHE A 2 -3.870 -12.144 -7.799 1.00 0.00 C ATOM 26 CD1 PHE A 2 -4.834 -11.708 -8.688 1.00 0.00 C ATOM 27 CD2 PHE A 2 -3.430 -13.458 -7.891 1.00 0.00 C ATOM 28 CE1 PHE A 2 -5.345 -12.556 -9.650 1.00 0.00 C ATOM 29 CE2 PHE A 2 -3.936 -14.309 -8.850 1.00 0.00 C ATOM 30 CZ PHE A 2 -4.895 -13.859 -9.732 1.00 0.00 C ATOM 0 H PHE A 2 -0.866 -11.732 -7.248 1.00 0.00 H new ATOM 0 HA PHE A 2 -2.705 -9.624 -8.033 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -2.890 -11.820 -5.940 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -4.167 -10.672 -6.293 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -5.192 -10.691 -8.629 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -2.681 -13.818 -7.201 1.00 0.00 H new ATOM 0 HE1 PHE A 2 -6.097 -12.200 -10.339 1.00 0.00 H new ATOM 0 HE2 PHE A 2 -3.581 -15.327 -8.910 1.00 0.00 H new ATOM 0 HZ PHE A 2 -5.293 -14.523 -10.485 1.00 0.00 H new ATOM 40 N ALA A 3 -2.711 -8.236 -5.862 1.00 0.00 N ATOM 41 CA ALA A 3 -2.539 -7.306 -4.771 1.00 0.00 C ATOM 42 C ALA A 3 -3.893 -7.047 -4.147 1.00 0.00 C ATOM 43 O ALA A 3 -4.743 -6.398 -4.743 1.00 0.00 O ATOM 44 CB ALA A 3 -1.906 -6.010 -5.259 1.00 0.00 C ATOM 0 H ALA A 3 -3.502 -8.021 -6.470 1.00 0.00 H new ATOM 0 HA ALA A 3 -1.867 -7.731 -4.025 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -1.786 -5.325 -4.420 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -0.930 -6.223 -5.695 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -2.548 -5.553 -6.012 1.00 0.00 H new ATOM 50 N VAL A 4 -4.100 -7.564 -2.974 1.00 0.00 N ATOM 51 CA VAL A 4 -5.382 -7.472 -2.323 1.00 0.00 C ATOM 52 C VAL A 4 -5.411 -6.244 -1.423 1.00 0.00 C ATOM 53 O VAL A 4 -4.480 -6.001 -0.661 1.00 0.00 O ATOM 54 CB VAL A 4 -5.694 -8.755 -1.513 1.00 0.00 C ATOM 55 CG1 VAL A 4 -7.085 -8.690 -0.892 1.00 0.00 C ATOM 56 CG2 VAL A 4 -5.567 -9.989 -2.397 1.00 0.00 C ATOM 0 H VAL A 4 -3.390 -8.062 -2.438 1.00 0.00 H new ATOM 0 HA VAL A 4 -6.154 -7.373 -3.086 1.00 0.00 H new ATOM 0 HB VAL A 4 -4.966 -8.826 -0.705 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -7.276 -9.604 -0.330 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -7.144 -7.833 -0.222 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -7.831 -8.587 -1.680 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -5.790 -10.881 -1.811 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -6.269 -9.916 -3.227 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -4.551 -10.055 -2.786 1.00 0.00 H new ATOM 66 N ILE A 5 -6.449 -5.476 -1.539 1.00 0.00 N ATOM 67 CA ILE A 5 -6.595 -4.244 -0.807 1.00 0.00 C ATOM 68 C ILE A 5 -7.460 -4.462 0.439 1.00 0.00 C ATOM 69 O ILE A 5 -8.514 -5.099 0.366 1.00 0.00 O ATOM 70 CB ILE A 5 -7.259 -3.172 -1.717 1.00 0.00 C ATOM 71 CG1 ILE A 5 -6.457 -3.021 -3.025 1.00 0.00 C ATOM 72 CG2 ILE A 5 -7.349 -1.835 -0.991 1.00 0.00 C ATOM 73 CD1 ILE A 5 -7.094 -2.106 -4.050 1.00 0.00 C ATOM 0 H ILE A 5 -7.235 -5.686 -2.154 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.608 -3.902 -0.496 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.271 -3.498 -1.960 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -5.464 -2.642 -2.786 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -6.323 -4.007 -3.470 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.816 -1.097 -1.643 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.948 -1.951 -0.087 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -6.348 -1.499 -0.722 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.463 -2.058 -4.937 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -8.076 -2.493 -4.323 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -7.203 -1.107 -3.628 1.00 0.00 H new ATOM 85 N SER A 6 -7.001 -3.970 1.570 1.00 0.00 N ATOM 86 CA SER A 6 -7.766 -4.026 2.793 1.00 0.00 C ATOM 87 C SER A 6 -8.578 -2.725 2.936 1.00 0.00 C ATOM 88 O SER A 6 -8.144 -1.678 2.452 1.00 0.00 O ATOM 89 CB SER A 6 -6.818 -4.191 3.978 1.00 0.00 C ATOM 90 OG SER A 6 -5.982 -5.303 3.776 1.00 0.00 O ATOM 0 H SER A 6 -6.090 -3.522 1.665 1.00 0.00 H new ATOM 0 HA SER A 6 -8.449 -4.875 2.769 1.00 0.00 H new ATOM 0 HB2 SER A 6 -6.216 -3.291 4.100 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.390 -4.319 4.897 1.00 0.00 H new ATOM 0 HG SER A 6 -5.490 -5.496 4.601 1.00 0.00 H new ATOM 96 N PRO A 7 -9.767 -2.766 3.579 1.00 0.00 N ATOM 97 CA PRO A 7 -10.626 -1.576 3.784 1.00 0.00 C ATOM 98 C PRO A 7 -9.947 -0.400 4.532 1.00 0.00 C ATOM 99 O PRO A 7 -10.459 0.727 4.531 1.00 0.00 O ATOM 100 CB PRO A 7 -11.827 -2.123 4.560 1.00 0.00 C ATOM 101 CG PRO A 7 -11.855 -3.565 4.199 1.00 0.00 C ATOM 102 CD PRO A 7 -10.416 -3.980 4.112 1.00 0.00 C ATOM 0 HA PRO A 7 -10.888 -1.124 2.827 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -11.707 -1.982 5.634 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -12.751 -1.621 4.273 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -12.388 -4.148 4.950 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -12.368 -3.723 3.250 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -10.015 -4.261 5.086 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -10.280 -4.837 3.452 1.00 0.00 H new ATOM 110 N SER A 8 -8.822 -0.652 5.176 1.00 0.00 N ATOM 111 CA SER A 8 -8.045 0.413 5.785 1.00 0.00 C ATOM 112 C SER A 8 -7.286 1.221 4.722 1.00 0.00 C ATOM 113 O SER A 8 -6.962 2.382 4.925 1.00 0.00 O ATOM 114 CB SER A 8 -7.091 -0.160 6.833 1.00 0.00 C ATOM 115 OG SER A 8 -6.462 -1.348 6.362 1.00 0.00 O ATOM 0 H SER A 8 -8.426 -1.585 5.291 1.00 0.00 H new ATOM 0 HA SER A 8 -8.730 1.097 6.285 1.00 0.00 H new ATOM 0 HB2 SER A 8 -6.332 0.582 7.082 1.00 0.00 H new ATOM 0 HB3 SER A 8 -7.640 -0.375 7.750 1.00 0.00 H new ATOM 0 HG SER A 8 -7.017 -2.124 6.588 1.00 0.00 H new ATOM 121 N ALA A 9 -7.071 0.614 3.571 1.00 0.00 N ATOM 122 CA ALA A 9 -6.326 1.231 2.484 1.00 0.00 C ATOM 123 C ALA A 9 -7.258 2.011 1.554 1.00 0.00 C ATOM 124 O ALA A 9 -6.858 2.478 0.485 1.00 0.00 O ATOM 125 CB ALA A 9 -5.568 0.157 1.716 1.00 0.00 C ATOM 0 H ALA A 9 -7.408 -0.325 3.360 1.00 0.00 H new ATOM 0 HA ALA A 9 -5.612 1.941 2.902 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -5.009 0.618 0.901 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -4.877 -0.351 2.388 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -6.275 -0.566 1.308 1.00 0.00 H new ATOM 131 N PHE A 10 -8.492 2.174 1.979 1.00 0.00 N ATOM 132 CA PHE A 10 -9.479 2.891 1.197 1.00 0.00 C ATOM 133 C PHE A 10 -9.210 4.377 1.183 1.00 0.00 C ATOM 134 O PHE A 10 -8.538 4.918 2.063 1.00 0.00 O ATOM 135 CB PHE A 10 -10.896 2.632 1.686 1.00 0.00 C ATOM 136 CG PHE A 10 -11.449 1.267 1.393 1.00 0.00 C ATOM 137 CD1 PHE A 10 -10.720 0.327 0.687 1.00 0.00 C ATOM 138 CD2 PHE A 10 -12.723 0.937 1.809 1.00 0.00 C ATOM 139 CE1 PHE A 10 -11.245 -0.901 0.409 1.00 0.00 C ATOM 140 CE2 PHE A 10 -13.253 -0.296 1.536 1.00 0.00 C ATOM 141 CZ PHE A 10 -12.515 -1.217 0.833 1.00 0.00 C ATOM 0 H PHE A 10 -8.839 1.817 2.869 1.00 0.00 H new ATOM 0 HA PHE A 10 -9.393 2.510 0.179 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -10.923 2.790 2.764 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -11.556 3.375 1.238 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -9.722 0.568 0.352 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -13.309 1.660 2.357 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -10.664 -1.625 -0.144 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -14.249 -0.544 1.873 1.00 0.00 H new ATOM 0 HZ PHE A 10 -12.932 -2.189 0.613 1.00 0.00 H new ATOM 151 N GLY A 11 -9.714 5.021 0.163 1.00 0.00 N ATOM 152 CA GLY A 11 -9.563 6.442 0.006 1.00 0.00 C ATOM 153 C GLY A 11 -8.356 6.786 -0.825 1.00 0.00 C ATOM 154 O GLY A 11 -8.380 7.713 -1.616 1.00 0.00 O ATOM 0 H GLY A 11 -10.243 4.572 -0.585 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -10.457 6.853 -0.463 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -9.474 6.909 0.987 1.00 0.00 H new ATOM 158 N LYS A 12 -7.331 5.985 -0.700 1.00 0.00 N ATOM 159 CA LYS A 12 -6.079 6.213 -1.396 1.00 0.00 C ATOM 160 C LYS A 12 -5.938 5.206 -2.538 1.00 0.00 C ATOM 161 O LYS A 12 -4.856 4.985 -3.098 1.00 0.00 O ATOM 162 CB LYS A 12 -4.952 6.092 -0.386 1.00 0.00 C ATOM 163 CG LYS A 12 -5.109 7.070 0.772 1.00 0.00 C ATOM 164 CD LYS A 12 -4.113 6.835 1.880 1.00 0.00 C ATOM 165 CE LYS A 12 -2.688 7.133 1.457 1.00 0.00 C ATOM 166 NZ LYS A 12 -1.747 6.992 2.585 1.00 0.00 N ATOM 0 H LYS A 12 -7.335 5.151 -0.112 1.00 0.00 H new ATOM 0 HA LYS A 12 -6.047 7.209 -1.839 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -4.922 5.074 0.002 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -3.999 6.271 -0.884 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -4.996 8.088 0.399 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -6.119 6.989 1.175 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -4.372 7.460 2.735 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -4.181 5.798 2.210 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -2.397 6.457 0.653 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -2.630 8.146 1.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -0.782 7.203 2.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -2.010 7.655 3.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -1.785 6.018 2.949 1.00 0.00 H new ATOM 180 N LEU A 13 -7.083 4.639 -2.895 1.00 0.00 N ATOM 181 CA LEU A 13 -7.217 3.614 -3.930 1.00 0.00 C ATOM 182 C LEU A 13 -6.809 4.139 -5.297 1.00 0.00 C ATOM 183 O LEU A 13 -6.158 3.451 -6.075 1.00 0.00 O ATOM 184 CB LEU A 13 -8.679 3.148 -4.003 1.00 0.00 C ATOM 185 CG LEU A 13 -9.268 2.534 -2.733 1.00 0.00 C ATOM 186 CD1 LEU A 13 -10.743 2.217 -2.928 1.00 0.00 C ATOM 187 CD2 LEU A 13 -8.509 1.278 -2.358 1.00 0.00 C ATOM 0 H LEU A 13 -7.973 4.885 -2.461 1.00 0.00 H new ATOM 0 HA LEU A 13 -6.558 2.787 -3.664 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -9.295 4.002 -4.285 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.763 2.415 -4.806 1.00 0.00 H new ATOM 0 HG LEU A 13 -9.173 3.258 -1.923 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -11.145 1.781 -2.014 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -11.284 3.134 -3.161 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -10.858 1.509 -3.749 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -8.938 0.850 -1.452 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -8.580 0.554 -3.170 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -7.462 1.525 -2.182 1.00 0.00 H new ATOM 199 N LYS A 14 -7.175 5.365 -5.567 1.00 0.00 N ATOM 200 CA LYS A 14 -6.948 5.956 -6.866 1.00 0.00 C ATOM 201 C LYS A 14 -5.456 6.183 -7.116 1.00 0.00 C ATOM 202 O LYS A 14 -4.966 6.002 -8.244 1.00 0.00 O ATOM 203 CB LYS A 14 -7.784 7.240 -7.008 1.00 0.00 C ATOM 204 CG LYS A 14 -9.288 6.972 -6.846 1.00 0.00 C ATOM 205 CD LYS A 14 -10.161 8.226 -6.962 1.00 0.00 C ATOM 206 CE LYS A 14 -9.884 9.245 -5.857 1.00 0.00 C ATOM 207 NZ LYS A 14 -10.888 10.346 -5.845 1.00 0.00 N ATOM 0 H LYS A 14 -7.637 5.982 -4.898 1.00 0.00 H new ATOM 0 HA LYS A 14 -7.279 5.265 -7.641 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -7.463 7.965 -6.260 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -7.599 7.686 -7.985 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -9.602 6.252 -7.602 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -9.462 6.510 -5.874 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -9.991 8.693 -7.932 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -11.211 7.936 -6.928 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -9.888 8.741 -4.891 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.888 9.665 -5.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -10.463 11.199 -5.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -11.191 10.551 -6.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -11.712 10.058 -5.280 1.00 0.00 H new ATOM 221 N GLU A 15 -4.741 6.523 -6.063 1.00 0.00 N ATOM 222 CA GLU A 15 -3.319 6.741 -6.130 1.00 0.00 C ATOM 223 C GLU A 15 -2.569 5.457 -6.424 1.00 0.00 C ATOM 224 O GLU A 15 -1.814 5.395 -7.398 1.00 0.00 O ATOM 225 CB GLU A 15 -2.768 7.369 -4.861 1.00 0.00 C ATOM 226 CG GLU A 15 -3.337 8.737 -4.535 1.00 0.00 C ATOM 227 CD GLU A 15 -4.664 8.685 -3.819 1.00 0.00 C ATOM 228 OE1 GLU A 15 -5.712 8.517 -4.480 1.00 0.00 O ATOM 229 OE2 GLU A 15 -4.680 8.817 -2.590 1.00 0.00 O ATOM 0 H GLU A 15 -5.137 6.656 -5.133 1.00 0.00 H new ATOM 0 HA GLU A 15 -3.164 7.440 -6.952 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -2.966 6.699 -4.024 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -1.685 7.453 -4.953 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -2.622 9.281 -3.918 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.455 9.302 -5.460 1.00 0.00 H new ATOM 236 N ILE A 16 -2.798 4.423 -5.605 1.00 0.00 N ATOM 237 CA ILE A 16 -2.092 3.133 -5.754 1.00 0.00 C ATOM 238 C ILE A 16 -2.299 2.518 -7.126 1.00 0.00 C ATOM 239 O ILE A 16 -1.357 1.995 -7.730 1.00 0.00 O ATOM 240 CB ILE A 16 -2.440 2.096 -4.640 1.00 0.00 C ATOM 241 CG1 ILE A 16 -3.956 1.859 -4.528 1.00 0.00 C ATOM 242 CG2 ILE A 16 -1.862 2.535 -3.318 1.00 0.00 C ATOM 243 CD1 ILE A 16 -4.362 0.837 -3.482 1.00 0.00 C ATOM 0 H ILE A 16 -3.464 4.449 -4.833 1.00 0.00 H new ATOM 0 HA ILE A 16 -1.037 3.381 -5.641 1.00 0.00 H new ATOM 0 HB ILE A 16 -1.989 1.144 -4.920 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -4.442 2.807 -4.298 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -4.332 1.535 -5.498 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -2.112 1.803 -2.550 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -0.778 2.615 -3.403 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -2.277 3.505 -3.043 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -5.447 0.736 -3.474 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -3.909 -0.126 -3.719 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -4.021 1.166 -2.500 1.00 0.00 H new ATOM 255 N LEU A 17 -3.512 2.630 -7.622 1.00 0.00 N ATOM 256 CA LEU A 17 -3.874 2.131 -8.932 1.00 0.00 C ATOM 257 C LEU A 17 -3.042 2.773 -10.029 1.00 0.00 C ATOM 258 O LEU A 17 -2.348 2.082 -10.761 1.00 0.00 O ATOM 259 CB LEU A 17 -5.364 2.366 -9.182 1.00 0.00 C ATOM 260 CG LEU A 17 -6.333 1.213 -8.859 1.00 0.00 C ATOM 261 CD1 LEU A 17 -6.016 0.549 -7.552 1.00 0.00 C ATOM 262 CD2 LEU A 17 -7.727 1.740 -8.771 1.00 0.00 C ATOM 0 H LEU A 17 -4.283 3.074 -7.123 1.00 0.00 H new ATOM 0 HA LEU A 17 -3.669 1.061 -8.954 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -5.669 3.235 -8.599 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -5.491 2.627 -10.233 1.00 0.00 H new ATOM 0 HG LEU A 17 -6.229 0.481 -9.660 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -6.728 -0.256 -7.371 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -5.006 0.140 -7.587 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -6.083 1.280 -6.747 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -8.411 0.923 -8.542 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -7.783 2.491 -7.983 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -8.006 2.191 -9.723 1.00 0.00 H new ATOM 274 N GLY A 18 -3.045 4.092 -10.080 1.00 0.00 N ATOM 275 CA GLY A 18 -2.365 4.776 -11.162 1.00 0.00 C ATOM 276 C GLY A 18 -0.859 4.839 -10.993 1.00 0.00 C ATOM 277 O GLY A 18 -0.116 4.733 -11.972 1.00 0.00 O ATOM 0 H GLY A 18 -3.501 4.700 -9.400 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -2.596 4.272 -12.100 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -2.756 5.791 -11.241 1.00 0.00 H new ATOM 281 N SER A 19 -0.403 4.937 -9.761 1.00 0.00 N ATOM 282 CA SER A 19 1.021 5.113 -9.497 1.00 0.00 C ATOM 283 C SER A 19 1.797 3.810 -9.643 1.00 0.00 C ATOM 284 O SER A 19 3.022 3.819 -9.738 1.00 0.00 O ATOM 285 CB SER A 19 1.246 5.687 -8.096 1.00 0.00 C ATOM 286 OG SER A 19 0.473 6.864 -7.886 1.00 0.00 O ATOM 0 H SER A 19 -0.989 4.899 -8.927 1.00 0.00 H new ATOM 0 HA SER A 19 1.394 5.815 -10.243 1.00 0.00 H new ATOM 0 HB2 SER A 19 0.983 4.939 -7.348 1.00 0.00 H new ATOM 0 HB3 SER A 19 2.303 5.915 -7.960 1.00 0.00 H new ATOM 0 HG SER A 19 -0.452 6.615 -7.681 1.00 0.00 H new ATOM 292 N ASN A 20 1.109 2.697 -9.663 1.00 0.00 N ATOM 293 CA ASN A 20 1.813 1.442 -9.738 1.00 0.00 C ATOM 294 C ASN A 20 1.387 0.633 -10.944 1.00 0.00 C ATOM 295 O ASN A 20 2.196 0.401 -11.840 1.00 0.00 O ATOM 296 CB ASN A 20 1.596 0.651 -8.456 1.00 0.00 C ATOM 297 CG ASN A 20 2.373 -0.642 -8.411 1.00 0.00 C ATOM 298 OD1 ASN A 20 3.452 -0.759 -8.952 1.00 0.00 O ATOM 299 ND2 ASN A 20 1.831 -1.614 -7.754 1.00 0.00 N ATOM 0 H ASN A 20 0.092 2.632 -9.630 1.00 0.00 H new ATOM 0 HA ASN A 20 2.876 1.655 -9.852 1.00 0.00 H new ATOM 0 HB2 ASN A 20 1.882 1.268 -7.604 1.00 0.00 H new ATOM 0 HB3 ASN A 20 0.534 0.432 -8.348 1.00 0.00 H new ATOM 0 HD21 ASN A 20 2.312 -2.510 -7.680 1.00 0.00 H new ATOM 0 HD22 ASN A 20 0.922 -1.485 -7.310 1.00 0.00 H new ATOM 306 N LYS A 21 0.092 0.293 -11.013 1.00 0.00 N ATOM 307 CA LYS A 21 -0.468 -0.566 -12.083 1.00 0.00 C ATOM 308 C LYS A 21 0.197 -1.971 -12.096 1.00 0.00 C ATOM 309 O LYS A 21 0.901 -2.352 -11.154 1.00 0.00 O ATOM 310 CB LYS A 21 -0.310 0.091 -13.472 1.00 0.00 C ATOM 311 CG LYS A 21 -1.027 1.423 -13.642 1.00 0.00 C ATOM 312 CD LYS A 21 -0.808 1.998 -15.039 1.00 0.00 C ATOM 313 CE LYS A 21 0.649 2.388 -15.285 1.00 0.00 C ATOM 314 NZ LYS A 21 1.085 3.518 -14.433 1.00 0.00 N ATOM 0 H LYS A 21 -0.602 0.602 -10.332 1.00 0.00 H new ATOM 0 HA LYS A 21 -1.530 -0.684 -11.866 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.752 0.240 -13.667 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.679 -0.602 -14.228 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -2.094 1.289 -13.465 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -0.666 2.130 -12.895 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -1.116 1.264 -15.784 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -1.443 2.873 -15.173 1.00 0.00 H new ATOM 0 HE2 LYS A 21 1.289 1.526 -15.096 1.00 0.00 H new ATOM 0 HE3 LYS A 21 0.778 2.657 -16.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 1.321 4.334 -15.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 0.317 3.778 -13.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 1.923 3.237 -13.886 1.00 0.00 H new ATOM 328 N ASN A 22 -0.120 -2.745 -13.137 1.00 0.00 N ATOM 329 CA ASN A 22 0.463 -4.084 -13.466 1.00 0.00 C ATOM 330 C ASN A 22 0.157 -5.204 -12.436 1.00 0.00 C ATOM 331 O ASN A 22 0.348 -6.387 -12.719 1.00 0.00 O ATOM 332 CB ASN A 22 1.971 -3.980 -13.727 1.00 0.00 C ATOM 333 CG ASN A 22 2.595 -5.216 -14.373 1.00 0.00 C ATOM 334 OD1 ASN A 22 3.753 -5.554 -14.103 1.00 0.00 O ATOM 335 ND2 ASN A 22 1.885 -5.858 -15.267 1.00 0.00 N ATOM 0 H ASN A 22 -0.823 -2.457 -13.818 1.00 0.00 H new ATOM 0 HA ASN A 22 -0.045 -4.392 -14.380 1.00 0.00 H new ATOM 0 HB2 ASN A 22 2.156 -3.119 -14.369 1.00 0.00 H new ATOM 0 HB3 ASN A 22 2.477 -3.787 -12.781 1.00 0.00 H new ATOM 0 HD21 ASN A 22 2.286 -6.657 -15.759 1.00 0.00 H new ATOM 0 HD22 ASN A 22 0.931 -5.559 -15.472 1.00 0.00 H new ATOM 342 N TYR A 23 -0.305 -4.855 -11.271 1.00 0.00 N ATOM 343 CA TYR A 23 -0.755 -5.840 -10.315 1.00 0.00 C ATOM 344 C TYR A 23 -2.213 -6.030 -10.495 1.00 0.00 C ATOM 345 O TYR A 23 -2.921 -5.102 -10.897 1.00 0.00 O ATOM 346 CB TYR A 23 -0.498 -5.428 -8.860 1.00 0.00 C ATOM 347 CG TYR A 23 0.920 -5.573 -8.361 1.00 0.00 C ATOM 348 CD1 TYR A 23 1.842 -4.571 -8.541 1.00 0.00 C ATOM 349 CD2 TYR A 23 1.318 -6.712 -7.669 1.00 0.00 C ATOM 350 CE1 TYR A 23 3.127 -4.684 -8.055 1.00 0.00 C ATOM 351 CE2 TYR A 23 2.602 -6.832 -7.175 1.00 0.00 C ATOM 352 CZ TYR A 23 3.502 -5.811 -7.373 1.00 0.00 C ATOM 353 OH TYR A 23 4.785 -5.911 -6.877 1.00 0.00 O ATOM 0 H TYR A 23 -0.383 -3.889 -10.953 1.00 0.00 H new ATOM 0 HA TYR A 23 -0.193 -6.755 -10.499 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -0.797 -4.386 -8.742 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -1.149 -6.021 -8.217 1.00 0.00 H new ATOM 0 HD1 TYR A 23 1.554 -3.677 -9.074 1.00 0.00 H new ATOM 0 HD2 TYR A 23 0.612 -7.515 -7.516 1.00 0.00 H new ATOM 0 HE1 TYR A 23 3.837 -3.885 -8.212 1.00 0.00 H new ATOM 0 HE2 TYR A 23 2.897 -7.721 -6.637 1.00 0.00 H new ATOM 0 HH TYR A 23 4.892 -6.770 -6.418 1.00 0.00 H new ATOM 363 N LYS A 24 -2.681 -7.196 -10.227 1.00 0.00 N ATOM 364 CA LYS A 24 -4.079 -7.417 -10.296 1.00 0.00 C ATOM 365 C LYS A 24 -4.637 -7.135 -8.932 1.00 0.00 C ATOM 366 O LYS A 24 -4.489 -7.933 -8.005 1.00 0.00 O ATOM 367 CB LYS A 24 -4.410 -8.824 -10.800 1.00 0.00 C ATOM 368 CG LYS A 24 -5.909 -9.102 -11.010 1.00 0.00 C ATOM 369 CD LYS A 24 -6.585 -8.092 -11.958 1.00 0.00 C ATOM 370 CE LYS A 24 -5.948 -8.048 -13.353 1.00 0.00 C ATOM 371 NZ LYS A 24 -6.027 -9.341 -14.067 1.00 0.00 N ATOM 0 H LYS A 24 -2.121 -8.006 -9.960 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.541 -6.750 -11.024 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.890 -8.988 -11.744 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -4.017 -9.551 -10.089 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -6.033 -10.108 -11.412 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -6.415 -9.080 -10.045 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -7.640 -8.347 -12.056 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -6.537 -7.098 -11.513 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -6.443 -7.280 -13.948 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -4.902 -7.754 -13.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -5.596 -9.245 -15.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -5.517 -10.068 -13.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -7.023 -9.621 -14.169 1.00 0.00 H new ATOM 385 N PHE A 25 -5.185 -5.957 -8.800 1.00 0.00 N ATOM 386 CA PHE A 25 -5.700 -5.485 -7.550 1.00 0.00 C ATOM 387 C PHE A 25 -7.005 -6.175 -7.247 1.00 0.00 C ATOM 388 O PHE A 25 -7.878 -6.279 -8.105 1.00 0.00 O ATOM 389 CB PHE A 25 -5.886 -3.969 -7.586 1.00 0.00 C ATOM 390 CG PHE A 25 -4.620 -3.184 -7.831 1.00 0.00 C ATOM 391 CD1 PHE A 25 -3.739 -2.919 -6.796 1.00 0.00 C ATOM 392 CD2 PHE A 25 -4.317 -2.704 -9.099 1.00 0.00 C ATOM 393 CE1 PHE A 25 -2.580 -2.195 -7.017 1.00 0.00 C ATOM 394 CE2 PHE A 25 -3.161 -1.979 -9.327 1.00 0.00 C ATOM 395 CZ PHE A 25 -2.291 -1.724 -8.284 1.00 0.00 C ATOM 0 H PHE A 25 -5.286 -5.293 -9.568 1.00 0.00 H new ATOM 0 HA PHE A 25 -4.986 -5.718 -6.760 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -6.606 -3.723 -8.366 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -6.319 -3.647 -6.639 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -3.959 -3.282 -5.803 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -4.993 -2.900 -9.918 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -1.902 -1.998 -6.200 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -2.939 -1.613 -10.318 1.00 0.00 H new ATOM 0 HZ PHE A 25 -1.388 -1.158 -8.458 1.00 0.00 H new ATOM 405 N VAL A 26 -7.116 -6.670 -6.060 1.00 0.00 N ATOM 406 CA VAL A 26 -8.260 -7.424 -5.642 1.00 0.00 C ATOM 407 C VAL A 26 -8.890 -6.763 -4.430 1.00 0.00 C ATOM 408 O VAL A 26 -8.185 -6.329 -3.517 1.00 0.00 O ATOM 409 CB VAL A 26 -7.845 -8.867 -5.250 1.00 0.00 C ATOM 410 CG1 VAL A 26 -9.049 -9.726 -4.922 1.00 0.00 C ATOM 411 CG2 VAL A 26 -6.988 -9.524 -6.322 1.00 0.00 C ATOM 0 H VAL A 26 -6.404 -6.563 -5.337 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.969 -7.459 -6.469 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.238 -8.783 -4.349 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -8.718 -10.729 -4.652 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -9.593 -9.286 -4.086 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.704 -9.782 -5.792 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.720 -10.532 -6.006 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.548 -9.573 -7.256 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -6.081 -8.938 -6.473 1.00 0.00 H new ATOM 421 N ILE A 27 -10.181 -6.673 -4.430 1.00 0.00 N ATOM 422 CA ILE A 27 -10.908 -6.159 -3.315 1.00 0.00 C ATOM 423 C ILE A 27 -11.894 -7.238 -2.875 1.00 0.00 C ATOM 424 O ILE A 27 -12.280 -8.096 -3.677 1.00 0.00 O ATOM 425 CB ILE A 27 -11.644 -4.820 -3.661 1.00 0.00 C ATOM 426 CG1 ILE A 27 -12.246 -4.172 -2.408 1.00 0.00 C ATOM 427 CG2 ILE A 27 -12.727 -5.039 -4.707 1.00 0.00 C ATOM 428 CD1 ILE A 27 -11.233 -3.864 -1.335 1.00 0.00 C ATOM 0 H ILE A 27 -10.767 -6.958 -5.214 1.00 0.00 H new ATOM 0 HA ILE A 27 -10.220 -5.918 -2.505 1.00 0.00 H new ATOM 0 HB ILE A 27 -10.897 -4.142 -4.073 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -12.750 -3.249 -2.694 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -13.006 -4.836 -1.997 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -13.219 -4.091 -4.925 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -12.278 -5.433 -5.619 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -13.461 -5.750 -4.327 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -11.734 -3.408 -0.481 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -10.746 -4.786 -1.019 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.485 -3.175 -1.728 1.00 0.00 H new ATOM 440 N THR A 28 -12.257 -7.230 -1.639 1.00 0.00 N ATOM 441 CA THR A 28 -13.129 -8.219 -1.104 1.00 0.00 C ATOM 442 C THR A 28 -14.590 -7.787 -1.167 1.00 0.00 C ATOM 443 O THR A 28 -14.903 -6.600 -1.411 1.00 0.00 O ATOM 444 CB THR A 28 -12.729 -8.491 0.341 1.00 0.00 C ATOM 445 OG1 THR A 28 -12.622 -7.238 1.051 1.00 0.00 O ATOM 446 CG2 THR A 28 -11.401 -9.199 0.389 1.00 0.00 C ATOM 0 H THR A 28 -11.954 -6.529 -0.963 1.00 0.00 H new ATOM 0 HA THR A 28 -13.035 -9.124 -1.705 1.00 0.00 H new ATOM 0 HB THR A 28 -13.488 -9.121 0.806 1.00 0.00 H new ATOM 0 HG1 THR A 28 -13.106 -7.301 1.901 1.00 0.00 H new ATOM 0 HG21 THR A 28 -11.126 -9.388 1.427 1.00 0.00 H new ATOM 0 HG22 THR A 28 -11.474 -10.146 -0.145 1.00 0.00 H new ATOM 0 HG23 THR A 28 -10.639 -8.576 -0.080 1.00 0.00 H new ATOM 454 N THR A 29 -15.474 -8.736 -0.946 1.00 0.00 N ATOM 455 CA THR A 29 -16.887 -8.489 -0.888 1.00 0.00 C ATOM 456 C THR A 29 -17.244 -7.564 0.270 1.00 0.00 C ATOM 457 O THR A 29 -18.059 -6.648 0.117 1.00 0.00 O ATOM 458 CB THR A 29 -17.644 -9.808 -0.776 1.00 0.00 C ATOM 459 OG1 THR A 29 -16.806 -10.781 -0.114 1.00 0.00 O ATOM 460 CG2 THR A 29 -18.045 -10.313 -2.143 1.00 0.00 C ATOM 0 H THR A 29 -15.221 -9.713 -0.800 1.00 0.00 H new ATOM 0 HA THR A 29 -17.182 -7.988 -1.810 1.00 0.00 H new ATOM 0 HB THR A 29 -18.552 -9.648 -0.194 1.00 0.00 H new ATOM 0 HG1 THR A 29 -16.422 -10.385 0.696 1.00 0.00 H new ATOM 0 HG21 THR A 29 -18.584 -11.255 -2.039 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.688 -9.579 -2.628 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.153 -10.470 -2.749 1.00 0.00 H new ATOM 468 N LEU A 30 -16.614 -7.769 1.414 1.00 0.00 N ATOM 469 CA LEU A 30 -16.841 -6.897 2.543 1.00 0.00 C ATOM 470 C LEU A 30 -16.222 -5.537 2.267 1.00 0.00 C ATOM 471 O LEU A 30 -16.754 -4.509 2.681 1.00 0.00 O ATOM 472 CB LEU A 30 -16.292 -7.499 3.836 1.00 0.00 C ATOM 473 CG LEU A 30 -16.952 -8.800 4.310 1.00 0.00 C ATOM 474 CD1 LEU A 30 -16.300 -9.296 5.582 1.00 0.00 C ATOM 475 CD2 LEU A 30 -18.441 -8.602 4.530 1.00 0.00 C ATOM 0 H LEU A 30 -15.949 -8.524 1.581 1.00 0.00 H new ATOM 0 HA LEU A 30 -17.916 -6.778 2.679 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -15.226 -7.684 3.702 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -16.390 -6.757 4.628 1.00 0.00 H new ATOM 0 HG LEU A 30 -16.814 -9.550 3.531 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -16.782 -10.220 5.902 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -15.242 -9.484 5.399 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -16.405 -8.543 6.363 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -18.887 -9.538 4.866 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -18.598 -7.833 5.287 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -18.909 -8.292 3.596 1.00 0.00 H new ATOM 487 N GLY A 31 -15.130 -5.549 1.510 1.00 0.00 N ATOM 488 CA GLY A 31 -14.450 -4.336 1.127 1.00 0.00 C ATOM 489 C GLY A 31 -15.339 -3.416 0.314 1.00 0.00 C ATOM 490 O GLY A 31 -15.569 -2.270 0.702 1.00 0.00 O ATOM 0 H GLY A 31 -14.700 -6.401 1.150 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -14.110 -3.814 2.021 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -13.562 -4.587 0.547 1.00 0.00 H new ATOM 494 N VAL A 32 -15.871 -3.921 -0.793 1.00 0.00 N ATOM 495 CA VAL A 32 -16.744 -3.110 -1.646 1.00 0.00 C ATOM 496 C VAL A 32 -17.980 -2.622 -0.899 1.00 0.00 C ATOM 497 O VAL A 32 -18.352 -1.463 -1.015 1.00 0.00 O ATOM 498 CB VAL A 32 -17.157 -3.807 -2.984 1.00 0.00 C ATOM 499 CG1 VAL A 32 -15.959 -4.003 -3.877 1.00 0.00 C ATOM 500 CG2 VAL A 32 -17.843 -5.141 -2.745 1.00 0.00 C ATOM 0 H VAL A 32 -15.719 -4.875 -1.121 1.00 0.00 H new ATOM 0 HA VAL A 32 -16.136 -2.248 -1.921 1.00 0.00 H new ATOM 0 HB VAL A 32 -17.870 -3.146 -3.477 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -16.270 -4.489 -4.802 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -15.515 -3.035 -4.108 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -15.224 -4.627 -3.368 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -18.112 -5.588 -3.702 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -17.166 -5.807 -2.210 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -18.744 -4.986 -2.151 1.00 0.00 H new ATOM 510 N SER A 33 -18.561 -3.485 -0.083 1.00 0.00 N ATOM 511 CA SER A 33 -19.757 -3.151 0.666 1.00 0.00 C ATOM 512 C SER A 33 -19.477 -2.011 1.668 1.00 0.00 C ATOM 513 O SER A 33 -20.304 -1.096 1.844 1.00 0.00 O ATOM 514 CB SER A 33 -20.264 -4.398 1.384 1.00 0.00 C ATOM 515 OG SER A 33 -20.400 -5.479 0.468 1.00 0.00 O ATOM 0 H SER A 33 -18.218 -4.432 0.077 1.00 0.00 H new ATOM 0 HA SER A 33 -20.525 -2.799 -0.022 1.00 0.00 H new ATOM 0 HB2 SER A 33 -19.572 -4.673 2.180 1.00 0.00 H new ATOM 0 HB3 SER A 33 -21.225 -4.189 1.854 1.00 0.00 H new ATOM 0 HG SER A 33 -19.629 -6.078 0.552 1.00 0.00 H new ATOM 521 N PHE A 34 -18.298 -2.049 2.273 1.00 0.00 N ATOM 522 CA PHE A 34 -17.877 -1.045 3.231 1.00 0.00 C ATOM 523 C PHE A 34 -17.624 0.283 2.509 1.00 0.00 C ATOM 524 O PHE A 34 -17.983 1.355 3.008 1.00 0.00 O ATOM 525 CB PHE A 34 -16.607 -1.528 3.952 1.00 0.00 C ATOM 526 CG PHE A 34 -16.129 -0.640 5.067 1.00 0.00 C ATOM 527 CD1 PHE A 34 -16.743 -0.679 6.309 1.00 0.00 C ATOM 528 CD2 PHE A 34 -15.055 0.218 4.883 1.00 0.00 C ATOM 529 CE1 PHE A 34 -16.297 0.120 7.341 1.00 0.00 C ATOM 530 CE2 PHE A 34 -14.608 1.019 5.911 1.00 0.00 C ATOM 531 CZ PHE A 34 -15.228 0.969 7.141 1.00 0.00 C ATOM 0 H PHE A 34 -17.607 -2.781 2.110 1.00 0.00 H new ATOM 0 HA PHE A 34 -18.660 -0.889 3.973 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -16.794 -2.523 4.356 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -15.807 -1.626 3.218 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -17.580 -1.342 6.470 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -14.563 0.259 3.922 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -16.784 0.081 8.304 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -13.773 1.685 5.753 1.00 0.00 H new ATOM 0 HZ PHE A 34 -14.877 1.595 7.948 1.00 0.00 H new ATOM 541 N ALA A 35 -17.032 0.202 1.325 1.00 0.00 N ATOM 542 CA ALA A 35 -16.757 1.380 0.513 1.00 0.00 C ATOM 543 C ALA A 35 -18.056 2.044 0.066 1.00 0.00 C ATOM 544 O ALA A 35 -18.181 3.281 0.115 1.00 0.00 O ATOM 545 CB ALA A 35 -15.899 1.015 -0.690 1.00 0.00 C ATOM 0 H ALA A 35 -16.730 -0.676 0.902 1.00 0.00 H new ATOM 0 HA ALA A 35 -16.203 2.093 1.124 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -15.705 1.909 -1.283 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -14.953 0.594 -0.348 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -16.423 0.280 -1.301 1.00 0.00 H new ATOM 551 N ILE A 36 -19.024 1.215 -0.337 1.00 0.00 N ATOM 552 CA ILE A 36 -20.343 1.679 -0.773 1.00 0.00 C ATOM 553 C ILE A 36 -21.012 2.521 0.312 1.00 0.00 C ATOM 554 O ILE A 36 -21.389 3.662 0.070 1.00 0.00 O ATOM 555 CB ILE A 36 -21.287 0.480 -1.169 1.00 0.00 C ATOM 556 CG1 ILE A 36 -20.774 -0.259 -2.420 1.00 0.00 C ATOM 557 CG2 ILE A 36 -22.737 0.926 -1.371 1.00 0.00 C ATOM 558 CD1 ILE A 36 -20.701 0.595 -3.674 1.00 0.00 C ATOM 0 H ILE A 36 -18.914 0.201 -0.370 1.00 0.00 H new ATOM 0 HA ILE A 36 -20.184 2.295 -1.658 1.00 0.00 H new ATOM 0 HB ILE A 36 -21.268 -0.214 -0.329 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -19.781 -0.657 -2.209 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -21.425 -1.112 -2.614 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -23.348 0.065 -1.642 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -23.115 1.363 -0.447 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -22.782 1.668 -2.168 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -20.330 -0.007 -4.503 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -21.695 0.972 -3.916 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -20.026 1.434 -3.504 1.00 0.00 H new ATOM 570 N LYS A 37 -21.093 1.984 1.518 1.00 0.00 N ATOM 571 CA LYS A 37 -21.793 2.671 2.591 1.00 0.00 C ATOM 572 C LYS A 37 -21.038 3.895 3.112 1.00 0.00 C ATOM 573 O LYS A 37 -21.645 4.806 3.669 1.00 0.00 O ATOM 574 CB LYS A 37 -22.218 1.687 3.718 1.00 0.00 C ATOM 575 CG LYS A 37 -21.092 0.906 4.430 1.00 0.00 C ATOM 576 CD LYS A 37 -20.333 1.727 5.484 1.00 0.00 C ATOM 577 CE LYS A 37 -21.244 2.159 6.627 1.00 0.00 C ATOM 578 NZ LYS A 37 -20.508 2.867 7.693 1.00 0.00 N ATOM 0 H LYS A 37 -20.688 1.085 1.777 1.00 0.00 H new ATOM 0 HA LYS A 37 -22.712 3.070 2.163 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -22.767 2.252 4.471 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -22.914 0.964 3.292 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -21.521 0.026 4.909 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -20.383 0.548 3.683 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -19.508 1.136 5.880 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -19.897 2.608 5.014 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -22.029 2.808 6.238 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -21.735 1.282 7.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -21.169 3.141 8.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -19.776 2.241 8.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -20.060 3.719 7.299 1.00 0.00 H new ATOM 592 N SER A 38 -19.741 3.934 2.892 1.00 0.00 N ATOM 593 CA SER A 38 -18.930 5.034 3.379 1.00 0.00 C ATOM 594 C SER A 38 -18.857 6.195 2.372 1.00 0.00 C ATOM 595 O SER A 38 -18.620 7.341 2.759 1.00 0.00 O ATOM 596 CB SER A 38 -17.537 4.528 3.737 1.00 0.00 C ATOM 597 OG SER A 38 -17.628 3.454 4.666 1.00 0.00 O ATOM 0 H SER A 38 -19.224 3.219 2.380 1.00 0.00 H new ATOM 0 HA SER A 38 -19.407 5.432 4.275 1.00 0.00 H new ATOM 0 HB2 SER A 38 -17.020 4.197 2.836 1.00 0.00 H new ATOM 0 HB3 SER A 38 -16.946 5.339 4.164 1.00 0.00 H new ATOM 0 HG SER A 38 -17.570 2.601 4.187 1.00 0.00 H new ATOM 603 N GLY A 39 -19.078 5.907 1.096 1.00 0.00 N ATOM 604 CA GLY A 39 -19.020 6.959 0.096 1.00 0.00 C ATOM 605 C GLY A 39 -17.618 7.139 -0.441 1.00 0.00 C ATOM 606 O GLY A 39 -17.133 8.261 -0.609 1.00 0.00 O ATOM 0 H GLY A 39 -19.294 4.977 0.737 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -19.697 6.720 -0.724 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -19.366 7.896 0.532 1.00 0.00 H new ATOM 610 N ILE A 40 -16.954 6.044 -0.674 1.00 0.00 N ATOM 611 CA ILE A 40 -15.587 6.059 -1.155 1.00 0.00 C ATOM 612 C ILE A 40 -15.600 5.731 -2.649 1.00 0.00 C ATOM 613 O ILE A 40 -16.542 5.081 -3.119 1.00 0.00 O ATOM 614 CB ILE A 40 -14.743 5.013 -0.365 1.00 0.00 C ATOM 615 CG1 ILE A 40 -14.891 5.286 1.141 1.00 0.00 C ATOM 616 CG2 ILE A 40 -13.268 5.055 -0.774 1.00 0.00 C ATOM 617 CD1 ILE A 40 -14.201 4.287 2.036 1.00 0.00 C ATOM 0 H ILE A 40 -17.339 5.109 -0.538 1.00 0.00 H new ATOM 0 HA ILE A 40 -15.137 7.040 -1.004 1.00 0.00 H new ATOM 0 HB ILE A 40 -15.114 4.015 -0.599 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -14.496 6.279 1.356 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -15.952 5.304 1.390 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -12.711 4.313 -0.203 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -13.179 4.836 -1.838 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -12.863 6.047 -0.573 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -14.361 4.561 3.079 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -14.611 3.293 1.856 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -13.132 4.283 1.821 1.00 0.00 H new ATOM 629 N ASP A 41 -14.595 6.199 -3.391 1.00 0.00 N ATOM 630 CA ASP A 41 -14.503 5.946 -4.834 1.00 0.00 C ATOM 631 C ASP A 41 -14.118 4.499 -5.099 1.00 0.00 C ATOM 632 O ASP A 41 -12.936 4.172 -5.267 1.00 0.00 O ATOM 633 CB ASP A 41 -13.482 6.869 -5.554 1.00 0.00 C ATOM 634 CG ASP A 41 -13.807 8.345 -5.514 1.00 0.00 C ATOM 635 OD1 ASP A 41 -14.744 8.781 -6.210 1.00 0.00 O ATOM 636 OD2 ASP A 41 -13.084 9.115 -4.835 1.00 0.00 O ATOM 0 H ASP A 41 -13.829 6.758 -3.016 1.00 0.00 H new ATOM 0 HA ASP A 41 -15.493 6.162 -5.237 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -12.500 6.717 -5.105 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -13.408 6.558 -6.596 1.00 0.00 H new ATOM 641 N ILE A 42 -15.091 3.631 -5.084 1.00 0.00 N ATOM 642 CA ILE A 42 -14.854 2.233 -5.338 1.00 0.00 C ATOM 643 C ILE A 42 -15.065 1.947 -6.826 1.00 0.00 C ATOM 644 O ILE A 42 -14.427 1.061 -7.402 1.00 0.00 O ATOM 645 CB ILE A 42 -15.744 1.305 -4.433 1.00 0.00 C ATOM 646 CG1 ILE A 42 -15.404 -0.183 -4.629 1.00 0.00 C ATOM 647 CG2 ILE A 42 -17.230 1.551 -4.649 1.00 0.00 C ATOM 648 CD1 ILE A 42 -13.990 -0.554 -4.213 1.00 0.00 C ATOM 0 H ILE A 42 -16.065 3.868 -4.897 1.00 0.00 H new ATOM 0 HA ILE A 42 -13.821 2.003 -5.076 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.512 1.568 -3.401 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -16.110 -0.785 -4.057 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -15.543 -0.442 -5.679 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -17.806 0.888 -4.003 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -17.466 2.588 -4.408 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -17.484 1.354 -5.691 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -13.829 -1.619 -4.382 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -13.275 0.019 -4.803 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -13.851 -0.329 -3.156 1.00 0.00 H new ATOM 660 N ASP A 43 -15.913 2.756 -7.455 1.00 0.00 N ATOM 661 CA ASP A 43 -16.200 2.637 -8.889 1.00 0.00 C ATOM 662 C ASP A 43 -14.931 2.875 -9.678 1.00 0.00 C ATOM 663 O ASP A 43 -14.641 2.175 -10.632 1.00 0.00 O ATOM 664 CB ASP A 43 -17.295 3.643 -9.352 1.00 0.00 C ATOM 665 CG ASP A 43 -16.871 5.114 -9.298 1.00 0.00 C ATOM 666 OD1 ASP A 43 -16.247 5.610 -10.264 1.00 0.00 O ATOM 667 OD2 ASP A 43 -17.147 5.790 -8.287 1.00 0.00 O ATOM 0 H ASP A 43 -16.420 3.510 -6.992 1.00 0.00 H new ATOM 0 HA ASP A 43 -16.577 1.630 -9.070 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -17.585 3.399 -10.374 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -18.179 3.510 -8.729 1.00 0.00 H new ATOM 672 N SER A 44 -14.148 3.818 -9.204 1.00 0.00 N ATOM 673 CA SER A 44 -12.931 4.228 -9.835 1.00 0.00 C ATOM 674 C SER A 44 -11.852 3.163 -9.654 1.00 0.00 C ATOM 675 O SER A 44 -10.904 3.068 -10.448 1.00 0.00 O ATOM 676 CB SER A 44 -12.512 5.540 -9.212 1.00 0.00 C ATOM 677 OG SER A 44 -13.624 6.429 -9.186 1.00 0.00 O ATOM 0 H SER A 44 -14.353 4.329 -8.346 1.00 0.00 H new ATOM 0 HA SER A 44 -13.078 4.356 -10.907 1.00 0.00 H new ATOM 0 HB2 SER A 44 -12.142 5.373 -8.200 1.00 0.00 H new ATOM 0 HB3 SER A 44 -11.694 5.981 -9.782 1.00 0.00 H new ATOM 0 HG SER A 44 -14.360 6.048 -9.710 1.00 0.00 H new ATOM 683 N ALA A 45 -12.004 2.372 -8.613 1.00 0.00 N ATOM 684 CA ALA A 45 -11.087 1.313 -8.328 1.00 0.00 C ATOM 685 C ALA A 45 -11.358 0.151 -9.269 1.00 0.00 C ATOM 686 O ALA A 45 -10.456 -0.319 -9.995 1.00 0.00 O ATOM 687 CB ALA A 45 -11.202 0.887 -6.871 1.00 0.00 C ATOM 0 H ALA A 45 -12.771 2.453 -7.946 1.00 0.00 H new ATOM 0 HA ALA A 45 -10.066 1.659 -8.486 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.497 0.080 -6.671 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -10.975 1.735 -6.225 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -12.216 0.540 -6.672 1.00 0.00 H new ATOM 693 N LEU A 46 -12.617 -0.268 -9.300 1.00 0.00 N ATOM 694 CA LEU A 46 -13.071 -1.359 -10.157 1.00 0.00 C ATOM 695 C LEU A 46 -12.772 -1.026 -11.614 1.00 0.00 C ATOM 696 O LEU A 46 -12.318 -1.875 -12.386 1.00 0.00 O ATOM 697 CB LEU A 46 -14.574 -1.577 -9.968 1.00 0.00 C ATOM 698 CG LEU A 46 -15.046 -1.900 -8.544 1.00 0.00 C ATOM 699 CD1 LEU A 46 -16.554 -2.069 -8.504 1.00 0.00 C ATOM 700 CD2 LEU A 46 -14.355 -3.144 -8.004 1.00 0.00 C ATOM 0 H LEU A 46 -13.357 0.141 -8.729 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.544 -2.273 -9.885 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -15.094 -0.680 -10.304 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -14.886 -2.390 -10.623 1.00 0.00 H new ATOM 0 HG LEU A 46 -14.775 -1.060 -7.904 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -16.868 -2.298 -7.485 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -17.032 -1.146 -8.833 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -16.846 -2.885 -9.165 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -14.710 -3.348 -6.994 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -14.582 -3.994 -8.647 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -13.277 -2.982 -7.984 1.00 0.00 H new ATOM 712 N ASP A 47 -12.992 0.232 -11.952 1.00 0.00 N ATOM 713 CA ASP A 47 -12.719 0.789 -13.285 1.00 0.00 C ATOM 714 C ASP A 47 -11.278 0.543 -13.712 1.00 0.00 C ATOM 715 O ASP A 47 -11.014 0.122 -14.838 1.00 0.00 O ATOM 716 CB ASP A 47 -12.968 2.298 -13.275 1.00 0.00 C ATOM 717 CG ASP A 47 -12.735 2.949 -14.617 1.00 0.00 C ATOM 718 OD1 ASP A 47 -13.691 3.013 -15.420 1.00 0.00 O ATOM 719 OD2 ASP A 47 -11.610 3.410 -14.887 1.00 0.00 O ATOM 0 H ASP A 47 -13.374 0.918 -11.301 1.00 0.00 H new ATOM 0 HA ASP A 47 -13.385 0.292 -13.990 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -13.994 2.488 -12.960 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -12.316 2.762 -12.535 1.00 0.00 H new ATOM 724 N ARG A 48 -10.350 0.776 -12.801 1.00 0.00 N ATOM 725 CA ARG A 48 -8.933 0.652 -13.117 1.00 0.00 C ATOM 726 C ARG A 48 -8.433 -0.771 -13.064 1.00 0.00 C ATOM 727 O ARG A 48 -7.293 -1.041 -13.407 1.00 0.00 O ATOM 728 CB ARG A 48 -8.094 1.584 -12.278 1.00 0.00 C ATOM 729 CG ARG A 48 -8.416 3.018 -12.588 1.00 0.00 C ATOM 730 CD ARG A 48 -7.678 4.009 -11.720 1.00 0.00 C ATOM 731 NE ARG A 48 -7.876 5.397 -12.181 1.00 0.00 N ATOM 732 CZ ARG A 48 -9.061 6.052 -12.306 1.00 0.00 C ATOM 733 NH1 ARG A 48 -10.208 5.501 -11.888 1.00 0.00 N ATOM 734 NH2 ARG A 48 -9.080 7.267 -12.838 1.00 0.00 N ATOM 0 H ARG A 48 -10.548 1.051 -11.839 1.00 0.00 H new ATOM 0 HA ARG A 48 -8.823 0.961 -14.157 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.271 1.387 -11.221 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -7.037 1.396 -12.464 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.178 3.216 -13.633 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -9.488 3.174 -12.470 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -8.022 3.916 -10.690 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -6.614 3.773 -11.724 1.00 0.00 H new ATOM 0 HE ARG A 48 -7.037 5.919 -12.432 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -10.204 4.572 -11.466 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -11.086 6.010 -11.991 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -8.211 7.701 -13.149 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -9.964 7.767 -12.936 1.00 0.00 H new ATOM 748 N GLY A 49 -9.274 -1.681 -12.639 1.00 0.00 N ATOM 749 CA GLY A 49 -8.899 -3.065 -12.721 1.00 0.00 C ATOM 750 C GLY A 49 -8.978 -3.822 -11.434 1.00 0.00 C ATOM 751 O GLY A 49 -8.594 -4.991 -11.397 1.00 0.00 O ATOM 0 H GLY A 49 -10.196 -1.495 -12.244 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -9.540 -3.556 -13.453 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -7.878 -3.127 -13.099 1.00 0.00 H new ATOM 755 N VAL A 50 -9.474 -3.196 -10.389 1.00 0.00 N ATOM 756 CA VAL A 50 -9.637 -3.897 -9.131 1.00 0.00 C ATOM 757 C VAL A 50 -10.784 -4.913 -9.264 1.00 0.00 C ATOM 758 O VAL A 50 -11.897 -4.565 -9.687 1.00 0.00 O ATOM 759 CB VAL A 50 -9.899 -2.923 -7.947 1.00 0.00 C ATOM 760 CG1 VAL A 50 -10.037 -3.679 -6.643 1.00 0.00 C ATOM 761 CG2 VAL A 50 -8.776 -1.912 -7.825 1.00 0.00 C ATOM 0 H VAL A 50 -9.768 -2.219 -10.382 1.00 0.00 H new ATOM 0 HA VAL A 50 -8.706 -4.418 -8.907 1.00 0.00 H new ATOM 0 HB VAL A 50 -10.833 -2.399 -8.153 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -10.220 -2.974 -5.832 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -10.872 -4.376 -6.713 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -9.119 -4.232 -6.444 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -8.980 -1.241 -6.991 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -7.835 -2.433 -7.650 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.705 -1.334 -8.747 1.00 0.00 H new ATOM 771 N ILE A 51 -10.497 -6.155 -8.971 1.00 0.00 N ATOM 772 CA ILE A 51 -11.475 -7.213 -9.093 1.00 0.00 C ATOM 773 C ILE A 51 -12.078 -7.550 -7.746 1.00 0.00 C ATOM 774 O ILE A 51 -11.427 -7.409 -6.718 1.00 0.00 O ATOM 775 CB ILE A 51 -10.890 -8.498 -9.745 1.00 0.00 C ATOM 776 CG1 ILE A 51 -9.723 -9.065 -8.914 1.00 0.00 C ATOM 777 CG2 ILE A 51 -10.444 -8.204 -11.171 1.00 0.00 C ATOM 778 CD1 ILE A 51 -9.174 -10.382 -9.426 1.00 0.00 C ATOM 0 H ILE A 51 -9.582 -6.464 -8.642 1.00 0.00 H new ATOM 0 HA ILE A 51 -12.255 -6.835 -9.754 1.00 0.00 H new ATOM 0 HB ILE A 51 -11.674 -9.255 -9.771 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -8.917 -8.332 -8.894 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -10.057 -9.199 -7.885 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -10.036 -9.110 -11.619 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -11.298 -7.863 -11.756 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -9.678 -7.428 -11.160 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -8.356 -10.710 -8.784 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -9.964 -11.133 -9.419 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -8.806 -10.252 -10.444 1.00 0.00 H new ATOM 790 N VAL A 52 -13.306 -7.984 -7.754 1.00 0.00 N ATOM 791 CA VAL A 52 -13.999 -8.317 -6.530 1.00 0.00 C ATOM 792 C VAL A 52 -13.892 -9.808 -6.274 1.00 0.00 C ATOM 793 O VAL A 52 -14.309 -10.625 -7.105 1.00 0.00 O ATOM 794 CB VAL A 52 -15.502 -7.918 -6.579 1.00 0.00 C ATOM 795 CG1 VAL A 52 -16.177 -8.159 -5.232 1.00 0.00 C ATOM 796 CG2 VAL A 52 -15.673 -6.470 -7.008 1.00 0.00 C ATOM 0 H VAL A 52 -13.858 -8.118 -8.601 1.00 0.00 H new ATOM 0 HA VAL A 52 -13.527 -7.754 -5.725 1.00 0.00 H new ATOM 0 HB VAL A 52 -15.986 -8.551 -7.323 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -17.227 -7.872 -5.294 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -16.105 -9.215 -4.973 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -15.683 -7.562 -4.465 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -16.734 -6.221 -7.033 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -15.163 -5.818 -6.299 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -15.244 -6.332 -8.001 1.00 0.00 H new ATOM 806 N ARG A 53 -13.321 -10.160 -5.165 1.00 0.00 N ATOM 807 CA ARG A 53 -13.199 -11.533 -4.775 1.00 0.00 C ATOM 808 C ARG A 53 -14.043 -11.787 -3.558 1.00 0.00 C ATOM 809 O ARG A 53 -13.948 -11.069 -2.557 1.00 0.00 O ATOM 810 CB ARG A 53 -11.730 -11.885 -4.490 1.00 0.00 C ATOM 811 CG ARG A 53 -11.469 -13.285 -3.907 1.00 0.00 C ATOM 812 CD ARG A 53 -11.904 -14.404 -4.826 1.00 0.00 C ATOM 813 NE ARG A 53 -11.572 -15.727 -4.270 1.00 0.00 N ATOM 814 CZ ARG A 53 -12.038 -16.885 -4.738 1.00 0.00 C ATOM 815 NH1 ARG A 53 -13.044 -16.901 -5.612 1.00 0.00 N ATOM 816 NH2 ARG A 53 -11.543 -18.028 -4.283 1.00 0.00 N ATOM 0 H ARG A 53 -12.923 -9.499 -4.498 1.00 0.00 H new ATOM 0 HA ARG A 53 -13.548 -12.166 -5.591 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -11.168 -11.790 -5.419 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -11.328 -11.145 -3.798 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -10.405 -13.391 -3.695 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -11.994 -13.379 -2.957 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -12.979 -14.339 -4.994 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -11.422 -14.286 -5.796 1.00 0.00 H new ATOM 0 HE ARG A 53 -10.940 -15.759 -3.470 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -13.461 -16.025 -5.926 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -13.397 -17.790 -5.967 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -10.807 -18.020 -3.576 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -11.898 -18.915 -4.640 1.00 0.00 H new ATOM 830 N ALA A 54 -14.879 -12.766 -3.660 1.00 0.00 N ATOM 831 CA ALA A 54 -15.654 -13.205 -2.556 1.00 0.00 C ATOM 832 C ALA A 54 -14.926 -14.366 -1.962 1.00 0.00 C ATOM 833 O ALA A 54 -14.572 -15.302 -2.690 1.00 0.00 O ATOM 834 CB ALA A 54 -17.032 -13.641 -3.014 1.00 0.00 C ATOM 0 H ALA A 54 -15.042 -13.287 -4.522 1.00 0.00 H new ATOM 0 HA ALA A 54 -15.787 -12.402 -1.831 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -17.613 -13.975 -2.154 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -17.539 -12.802 -3.491 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -16.936 -14.460 -3.727 1.00 0.00 H new ATOM 840 N PHE A 55 -14.639 -14.302 -0.692 1.00 0.00 N ATOM 841 CA PHE A 55 -13.964 -15.383 -0.049 1.00 0.00 C ATOM 842 C PHE A 55 -14.971 -16.529 0.114 1.00 0.00 C ATOM 843 O PHE A 55 -15.856 -16.489 0.969 1.00 0.00 O ATOM 844 CB PHE A 55 -13.357 -14.918 1.292 1.00 0.00 C ATOM 845 CG PHE A 55 -12.299 -15.840 1.847 1.00 0.00 C ATOM 846 CD1 PHE A 55 -11.180 -16.151 1.095 1.00 0.00 C ATOM 847 CD2 PHE A 55 -12.422 -16.396 3.102 1.00 0.00 C ATOM 848 CE1 PHE A 55 -10.208 -16.997 1.583 1.00 0.00 C ATOM 849 CE2 PHE A 55 -11.452 -17.246 3.598 1.00 0.00 C ATOM 850 CZ PHE A 55 -10.345 -17.546 2.835 1.00 0.00 C ATOM 0 H PHE A 55 -14.863 -13.512 -0.087 1.00 0.00 H new ATOM 0 HA PHE A 55 -13.125 -15.738 -0.647 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -12.924 -13.927 1.157 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -14.158 -14.819 2.025 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -11.067 -15.724 0.110 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -13.287 -16.164 3.705 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -9.340 -17.228 0.983 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -11.562 -17.675 4.583 1.00 0.00 H new ATOM 0 HZ PHE A 55 -9.586 -18.211 3.220 1.00 0.00 H new ATOM 860 N SER A 56 -14.867 -17.499 -0.788 1.00 0.00 N ATOM 861 CA SER A 56 -15.775 -18.627 -0.872 1.00 0.00 C ATOM 862 C SER A 56 -15.637 -19.503 0.365 1.00 0.00 C ATOM 863 O SER A 56 -16.601 -20.130 0.820 1.00 0.00 O ATOM 864 CB SER A 56 -15.490 -19.426 -2.166 1.00 0.00 C ATOM 865 OG SER A 56 -16.449 -20.466 -2.394 1.00 0.00 O ATOM 0 H SER A 56 -14.132 -17.519 -1.494 1.00 0.00 H new ATOM 0 HA SER A 56 -16.804 -18.268 -0.911 1.00 0.00 H new ATOM 0 HB2 SER A 56 -15.489 -18.745 -3.017 1.00 0.00 H new ATOM 0 HB3 SER A 56 -14.493 -19.863 -2.107 1.00 0.00 H new ATOM 0 HG SER A 56 -16.227 -20.940 -3.223 1.00 0.00 H new ATOM 871 N HIS A 57 -14.452 -19.530 0.916 1.00 0.00 N ATOM 872 CA HIS A 57 -14.217 -20.251 2.140 1.00 0.00 C ATOM 873 C HIS A 57 -14.784 -19.383 3.256 1.00 0.00 C ATOM 874 O HIS A 57 -14.762 -18.172 3.141 1.00 0.00 O ATOM 875 CB HIS A 57 -12.698 -20.450 2.342 1.00 0.00 C ATOM 876 CG HIS A 57 -12.302 -21.375 3.470 1.00 0.00 C ATOM 877 ND1 HIS A 57 -12.394 -21.051 4.802 1.00 0.00 N ATOM 878 CD2 HIS A 57 -11.788 -22.627 3.437 1.00 0.00 C ATOM 879 CE1 HIS A 57 -11.957 -22.043 5.528 1.00 0.00 C ATOM 880 NE2 HIS A 57 -11.580 -23.019 4.732 1.00 0.00 N ATOM 0 H HIS A 57 -13.631 -19.059 0.535 1.00 0.00 H new ATOM 0 HA HIS A 57 -14.685 -21.235 2.126 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -12.274 -20.836 1.415 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -12.243 -19.475 2.519 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -12.750 -20.168 5.168 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -11.580 -23.210 2.552 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -11.912 -22.060 6.607 1.00 0.00 H new ATOM 889 N LYS A 58 -15.326 -19.974 4.288 1.00 0.00 N ATOM 890 CA LYS A 58 -15.802 -19.182 5.404 1.00 0.00 C ATOM 891 C LYS A 58 -14.590 -18.564 6.082 1.00 0.00 C ATOM 892 O LYS A 58 -13.631 -19.280 6.375 1.00 0.00 O ATOM 893 CB LYS A 58 -16.605 -20.031 6.385 1.00 0.00 C ATOM 894 CG LYS A 58 -17.836 -20.680 5.764 1.00 0.00 C ATOM 895 CD LYS A 58 -18.693 -21.403 6.798 1.00 0.00 C ATOM 896 CE LYS A 58 -17.954 -22.547 7.474 1.00 0.00 C ATOM 897 NZ LYS A 58 -18.818 -23.258 8.440 1.00 0.00 N ATOM 0 H LYS A 58 -15.450 -20.982 4.385 1.00 0.00 H new ATOM 0 HA LYS A 58 -16.474 -18.402 5.047 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -15.960 -20.810 6.791 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -16.917 -19.407 7.222 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -18.436 -19.916 5.268 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -17.523 -21.387 4.996 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -19.021 -20.690 7.555 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -19.590 -21.790 6.314 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -17.598 -23.248 6.719 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -17.075 -22.159 7.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -18.281 -24.032 8.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -19.137 -22.594 9.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -19.644 -23.649 7.944 1.00 0.00 H new ATOM 911 N PRO A 59 -14.573 -17.243 6.268 1.00 0.00 N ATOM 912 CA PRO A 59 -13.407 -16.551 6.804 1.00 0.00 C ATOM 913 C PRO A 59 -13.047 -16.987 8.222 1.00 0.00 C ATOM 914 O PRO A 59 -13.904 -16.995 9.117 1.00 0.00 O ATOM 915 CB PRO A 59 -13.808 -15.064 6.776 1.00 0.00 C ATOM 916 CG PRO A 59 -15.297 -15.065 6.707 1.00 0.00 C ATOM 917 CD PRO A 59 -15.681 -16.318 5.978 1.00 0.00 C ATOM 0 HA PRO A 59 -12.516 -16.773 6.217 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -13.455 -14.544 7.666 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -13.374 -14.555 5.916 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -15.733 -15.047 7.706 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -15.663 -14.182 6.183 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -16.634 -16.711 6.332 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -15.786 -16.142 4.907 1.00 0.00 H new ATOM 925 N PRO A 60 -11.794 -17.437 8.427 1.00 0.00 N ATOM 926 CA PRO A 60 -11.276 -17.726 9.757 1.00 0.00 C ATOM 927 C PRO A 60 -11.307 -16.467 10.613 1.00 0.00 C ATOM 928 O PRO A 60 -11.063 -15.351 10.118 1.00 0.00 O ATOM 929 CB PRO A 60 -9.828 -18.164 9.499 1.00 0.00 C ATOM 930 CG PRO A 60 -9.840 -18.646 8.096 1.00 0.00 C ATOM 931 CD PRO A 60 -10.813 -17.763 7.381 1.00 0.00 C ATOM 0 HA PRO A 60 -11.856 -18.482 10.287 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -9.132 -17.336 9.630 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -9.521 -18.951 10.188 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -8.848 -18.580 7.649 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -10.145 -19.691 8.042 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -10.332 -16.868 6.986 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -11.277 -18.274 6.537 1.00 0.00 H new ATOM 939 N LYS A 61 -11.613 -16.625 11.865 1.00 0.00 N ATOM 940 CA LYS A 61 -11.770 -15.497 12.724 1.00 0.00 C ATOM 941 C LYS A 61 -10.440 -15.047 13.305 1.00 0.00 C ATOM 942 O LYS A 61 -9.828 -15.750 14.120 1.00 0.00 O ATOM 943 CB LYS A 61 -12.787 -15.791 13.841 1.00 0.00 C ATOM 944 CG LYS A 61 -13.055 -14.607 14.766 1.00 0.00 C ATOM 945 CD LYS A 61 -13.603 -13.426 13.987 1.00 0.00 C ATOM 946 CE LYS A 61 -13.789 -12.206 14.860 1.00 0.00 C ATOM 947 NZ LYS A 61 -14.258 -11.057 14.068 1.00 0.00 N ATOM 0 H LYS A 61 -11.759 -17.529 12.314 1.00 0.00 H new ATOM 0 HA LYS A 61 -12.158 -14.677 12.119 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -13.727 -16.105 13.388 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -12.425 -16.629 14.436 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -13.765 -14.898 15.540 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -12.133 -14.319 15.271 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -12.924 -13.186 13.169 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -14.558 -13.700 13.539 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -14.508 -12.426 15.650 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -12.847 -11.956 15.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -14.378 -10.232 14.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -13.559 -10.835 13.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -15.169 -11.290 13.623 1.00 0.00 H new ATOM 961 N VAL A 62 -9.990 -13.903 12.863 1.00 0.00 N ATOM 962 CA VAL A 62 -8.824 -13.288 13.424 1.00 0.00 C ATOM 963 C VAL A 62 -9.295 -12.478 14.616 1.00 0.00 C ATOM 964 O VAL A 62 -9.809 -11.357 14.455 1.00 0.00 O ATOM 965 CB VAL A 62 -8.094 -12.359 12.406 1.00 0.00 C ATOM 966 CG1 VAL A 62 -6.825 -11.763 13.015 1.00 0.00 C ATOM 967 CG2 VAL A 62 -7.764 -13.113 11.120 1.00 0.00 C ATOM 0 H VAL A 62 -10.423 -13.375 12.105 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.104 -14.056 13.707 1.00 0.00 H new ATOM 0 HB VAL A 62 -8.771 -11.540 12.162 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -6.337 -11.120 12.282 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -7.085 -11.177 13.896 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.147 -12.567 13.301 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.255 -12.444 10.426 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -7.115 -13.958 11.350 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.685 -13.476 10.664 1.00 0.00 H new ATOM 977 N GLY A 63 -9.176 -13.065 15.795 1.00 0.00 N ATOM 978 CA GLY A 63 -9.670 -12.448 17.020 1.00 0.00 C ATOM 979 C GLY A 63 -8.800 -11.305 17.471 1.00 0.00 C ATOM 980 O GLY A 63 -8.113 -11.396 18.488 1.00 0.00 O ATOM 0 H GLY A 63 -8.738 -13.976 15.933 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -10.686 -12.088 16.859 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -9.719 -13.199 17.809 1.00 0.00 H new ATOM 984 N ASN A 64 -8.835 -10.239 16.707 1.00 0.00 N ATOM 985 CA ASN A 64 -8.027 -9.059 16.924 1.00 0.00 C ATOM 986 C ASN A 64 -8.394 -7.997 15.904 1.00 0.00 C ATOM 987 O ASN A 64 -8.486 -6.815 16.225 1.00 0.00 O ATOM 988 CB ASN A 64 -6.522 -9.411 16.811 1.00 0.00 C ATOM 989 CG ASN A 64 -5.608 -8.206 16.892 1.00 0.00 C ATOM 990 OD1 ASN A 64 -5.240 -7.690 15.759 1.00 0.00 O flip ATOM 991 ND2 ASN A 64 -5.211 -7.778 17.971 1.00 0.00 N flip ATOM 0 H ASN A 64 -9.444 -10.165 15.892 1.00 0.00 H new ATOM 0 HA ASN A 64 -8.218 -8.675 17.926 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -6.260 -10.109 17.606 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -6.348 -9.925 15.866 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -5.525 -8.213 18.839 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -4.567 -6.988 18.000 1.00 0.00 H new ATOM 998 N LEU A 65 -8.620 -8.425 14.675 1.00 0.00 N ATOM 999 CA LEU A 65 -8.914 -7.504 13.590 1.00 0.00 C ATOM 1000 C LEU A 65 -10.366 -7.572 13.179 1.00 0.00 C ATOM 1001 O LEU A 65 -11.017 -8.596 13.388 1.00 0.00 O ATOM 1002 CB LEU A 65 -8.044 -7.804 12.375 1.00 0.00 C ATOM 1003 CG LEU A 65 -6.557 -7.564 12.527 1.00 0.00 C ATOM 1004 CD1 LEU A 65 -5.859 -7.930 11.251 1.00 0.00 C ATOM 1005 CD2 LEU A 65 -6.275 -6.109 12.887 1.00 0.00 C ATOM 0 H LEU A 65 -8.606 -9.408 14.402 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.699 -6.501 13.959 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.194 -8.848 12.099 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.403 -7.199 11.542 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.181 -8.189 13.337 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.788 -7.757 11.360 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -6.036 -8.982 11.028 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.245 -7.317 10.437 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -5.200 -5.962 12.991 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -6.656 -5.459 12.099 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -6.767 -5.865 13.828 1.00 0.00 H new ATOM 1017 N PRO A 66 -10.901 -6.479 12.597 1.00 0.00 N ATOM 1018 CA PRO A 66 -12.251 -6.463 12.035 1.00 0.00 C ATOM 1019 C PRO A 66 -12.407 -7.522 10.930 1.00 0.00 C ATOM 1020 O PRO A 66 -11.441 -7.829 10.195 1.00 0.00 O ATOM 1021 CB PRO A 66 -12.378 -5.056 11.432 1.00 0.00 C ATOM 1022 CG PRO A 66 -11.381 -4.233 12.165 1.00 0.00 C ATOM 1023 CD PRO A 66 -10.245 -5.152 12.482 1.00 0.00 C ATOM 0 HA PRO A 66 -13.012 -6.686 12.783 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -12.172 -5.065 10.362 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -13.386 -4.661 11.559 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -11.046 -3.393 11.557 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -11.812 -3.816 13.075 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -9.489 -5.144 11.696 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -9.745 -4.869 13.408 1.00 0.00 H new ATOM 1031 N GLN A 67 -13.606 -8.056 10.811 1.00 0.00 N ATOM 1032 CA GLN A 67 -13.946 -9.106 9.854 1.00 0.00 C ATOM 1033 C GLN A 67 -13.608 -8.686 8.427 1.00 0.00 C ATOM 1034 O GLN A 67 -13.015 -9.454 7.670 1.00 0.00 O ATOM 1035 CB GLN A 67 -15.435 -9.431 9.955 1.00 0.00 C ATOM 1036 CG GLN A 67 -15.892 -10.586 9.070 1.00 0.00 C ATOM 1037 CD GLN A 67 -17.401 -10.772 9.072 1.00 0.00 C ATOM 1038 OE1 GLN A 67 -17.986 -11.240 8.091 1.00 0.00 O ATOM 1039 NE2 GLN A 67 -18.048 -10.417 10.155 1.00 0.00 N ATOM 0 H GLN A 67 -14.396 -7.769 11.389 1.00 0.00 H new ATOM 0 HA GLN A 67 -13.357 -9.990 10.096 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -15.673 -9.669 10.992 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -16.007 -8.541 9.693 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -15.554 -10.410 8.049 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -15.417 -11.507 9.409 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -17.538 -10.033 10.951 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -19.061 -10.525 10.202 1.00 0.00 H new ATOM 1048 N TYR A 68 -13.950 -7.454 8.072 1.00 0.00 N ATOM 1049 CA TYR A 68 -13.680 -6.958 6.726 1.00 0.00 C ATOM 1050 C TYR A 68 -12.180 -6.873 6.402 1.00 0.00 C ATOM 1051 O TYR A 68 -11.768 -7.152 5.267 1.00 0.00 O ATOM 1052 CB TYR A 68 -14.455 -5.662 6.394 1.00 0.00 C ATOM 1053 CG TYR A 68 -14.401 -4.556 7.432 1.00 0.00 C ATOM 1054 CD1 TYR A 68 -13.259 -3.804 7.629 1.00 0.00 C ATOM 1055 CD2 TYR A 68 -15.515 -4.263 8.204 1.00 0.00 C ATOM 1056 CE1 TYR A 68 -13.224 -2.795 8.565 1.00 0.00 C ATOM 1057 CE2 TYR A 68 -15.488 -3.251 9.139 1.00 0.00 C ATOM 1058 CZ TYR A 68 -14.339 -2.522 9.314 1.00 0.00 C ATOM 1059 OH TYR A 68 -14.303 -1.509 10.242 1.00 0.00 O ATOM 0 H TYR A 68 -14.410 -6.785 8.689 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.076 -7.714 6.048 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -14.071 -5.266 5.454 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -15.500 -5.923 6.227 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -12.379 -4.011 7.039 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.419 -4.838 8.070 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -12.321 -2.220 8.709 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -16.365 -3.033 9.730 1.00 0.00 H new ATOM 0 HH TYR A 68 -15.173 -1.443 10.688 1.00 0.00 H new ATOM 1069 N GLU A 69 -11.364 -6.544 7.404 1.00 0.00 N ATOM 1070 CA GLU A 69 -9.912 -6.513 7.223 1.00 0.00 C ATOM 1071 C GLU A 69 -9.425 -7.949 7.070 1.00 0.00 C ATOM 1072 O GLU A 69 -8.593 -8.260 6.226 1.00 0.00 O ATOM 1073 CB GLU A 69 -9.216 -5.886 8.438 1.00 0.00 C ATOM 1074 CG GLU A 69 -9.640 -4.467 8.788 1.00 0.00 C ATOM 1075 CD GLU A 69 -9.296 -3.433 7.738 1.00 0.00 C ATOM 1076 OE1 GLU A 69 -8.124 -3.034 7.636 1.00 0.00 O ATOM 1077 OE2 GLU A 69 -10.202 -2.936 7.079 1.00 0.00 O ATOM 0 H GLU A 69 -11.680 -6.297 8.342 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.676 -5.914 6.343 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.396 -6.523 9.304 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.141 -5.889 8.258 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.717 -4.454 8.954 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.169 -4.182 9.729 1.00 0.00 H new ATOM 1084 N SER A 70 -10.016 -8.826 7.867 1.00 0.00 N ATOM 1085 CA SER A 70 -9.657 -10.231 7.893 1.00 0.00 C ATOM 1086 C SER A 70 -9.941 -10.901 6.542 1.00 0.00 C ATOM 1087 O SER A 70 -9.123 -11.686 6.057 1.00 0.00 O ATOM 1088 CB SER A 70 -10.413 -10.939 9.017 1.00 0.00 C ATOM 1089 OG SER A 70 -10.199 -10.276 10.264 1.00 0.00 O ATOM 0 H SER A 70 -10.762 -8.579 8.517 1.00 0.00 H new ATOM 0 HA SER A 70 -8.586 -10.311 8.081 1.00 0.00 H new ATOM 0 HB2 SER A 70 -11.479 -10.960 8.789 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.082 -11.975 9.089 1.00 0.00 H new ATOM 0 HG SER A 70 -10.764 -9.477 10.311 1.00 0.00 H new ATOM 1095 N GLU A 71 -11.083 -10.562 5.924 1.00 0.00 N ATOM 1096 CA GLU A 71 -11.446 -11.116 4.622 1.00 0.00 C ATOM 1097 C GLU A 71 -10.389 -10.750 3.579 1.00 0.00 C ATOM 1098 O GLU A 71 -9.997 -11.587 2.764 1.00 0.00 O ATOM 1099 CB GLU A 71 -12.859 -10.659 4.187 1.00 0.00 C ATOM 1100 CG GLU A 71 -13.325 -11.267 2.862 1.00 0.00 C ATOM 1101 CD GLU A 71 -14.757 -10.923 2.499 1.00 0.00 C ATOM 1102 OE1 GLU A 71 -15.665 -11.615 2.966 1.00 0.00 O ATOM 1103 OE2 GLU A 71 -14.996 -9.967 1.711 1.00 0.00 O ATOM 0 H GLU A 71 -11.765 -9.908 6.308 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.478 -12.202 4.707 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.572 -10.923 4.968 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.869 -9.572 4.101 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.666 -10.924 2.064 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -13.224 -12.351 2.915 1.00 0.00 H new ATOM 1110 N ALA A 72 -9.887 -9.519 3.656 1.00 0.00 N ATOM 1111 CA ALA A 72 -8.848 -9.055 2.745 1.00 0.00 C ATOM 1112 C ALA A 72 -7.577 -9.874 2.925 1.00 0.00 C ATOM 1113 O ALA A 72 -6.996 -10.363 1.952 1.00 0.00 O ATOM 1114 CB ALA A 72 -8.575 -7.577 2.954 1.00 0.00 C ATOM 0 H ALA A 72 -10.185 -8.825 4.342 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.198 -9.192 1.722 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.797 -7.250 2.265 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -9.486 -7.009 2.768 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.246 -7.409 3.979 1.00 0.00 H new ATOM 1120 N ILE A 73 -7.179 -10.054 4.177 1.00 0.00 N ATOM 1121 CA ILE A 73 -6.000 -10.858 4.519 1.00 0.00 C ATOM 1122 C ILE A 73 -6.156 -12.287 3.989 1.00 0.00 C ATOM 1123 O ILE A 73 -5.235 -12.851 3.411 1.00 0.00 O ATOM 1124 CB ILE A 73 -5.782 -10.930 6.056 1.00 0.00 C ATOM 1125 CG1 ILE A 73 -5.683 -9.529 6.658 1.00 0.00 C ATOM 1126 CG2 ILE A 73 -4.523 -11.737 6.384 1.00 0.00 C ATOM 1127 CD1 ILE A 73 -5.540 -9.519 8.161 1.00 0.00 C ATOM 0 H ILE A 73 -7.657 -9.652 4.984 1.00 0.00 H new ATOM 0 HA ILE A 73 -5.140 -10.373 4.058 1.00 0.00 H new ATOM 0 HB ILE A 73 -6.643 -11.433 6.495 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.829 -9.014 6.218 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -6.573 -8.962 6.383 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -4.387 -11.776 7.465 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -4.628 -12.750 5.995 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -3.656 -11.261 5.926 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.476 -8.490 8.514 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -6.406 -10.004 8.612 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -4.635 -10.057 8.444 1.00 0.00 H new ATOM 1139 N MET A 74 -7.337 -12.846 4.167 1.00 0.00 N ATOM 1140 CA MET A 74 -7.616 -14.220 3.763 1.00 0.00 C ATOM 1141 C MET A 74 -7.594 -14.387 2.256 1.00 0.00 C ATOM 1142 O MET A 74 -7.087 -15.388 1.748 1.00 0.00 O ATOM 1143 CB MET A 74 -8.926 -14.716 4.355 1.00 0.00 C ATOM 1144 CG MET A 74 -8.988 -14.789 5.891 1.00 0.00 C ATOM 1145 SD MET A 74 -7.877 -16.015 6.672 1.00 0.00 S ATOM 1146 CE MET A 74 -6.267 -15.208 6.685 1.00 0.00 C ATOM 0 H MET A 74 -8.130 -12.367 4.593 1.00 0.00 H new ATOM 0 HA MET A 74 -6.813 -14.839 4.164 1.00 0.00 H new ATOM 0 HB2 MET A 74 -9.728 -14.063 4.010 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.129 -15.710 3.955 1.00 0.00 H new ATOM 0 HG2 MET A 74 -8.752 -13.804 6.293 1.00 0.00 H new ATOM 0 HG3 MET A 74 -10.013 -15.016 6.185 1.00 0.00 H new ATOM 0 HE1 MET A 74 -5.641 -15.633 5.901 1.00 0.00 H new ATOM 0 HE2 MET A 74 -6.394 -14.140 6.509 1.00 0.00 H new ATOM 0 HE3 MET A 74 -5.791 -15.362 7.653 1.00 0.00 H new ATOM 1156 N VAL A 75 -8.108 -13.408 1.541 1.00 0.00 N ATOM 1157 CA VAL A 75 -8.064 -13.441 0.092 1.00 0.00 C ATOM 1158 C VAL A 75 -6.609 -13.340 -0.398 1.00 0.00 C ATOM 1159 O VAL A 75 -6.188 -14.053 -1.321 1.00 0.00 O ATOM 1160 CB VAL A 75 -8.972 -12.352 -0.550 1.00 0.00 C ATOM 1161 CG1 VAL A 75 -8.716 -12.239 -2.041 1.00 0.00 C ATOM 1162 CG2 VAL A 75 -10.444 -12.693 -0.307 1.00 0.00 C ATOM 0 H VAL A 75 -8.559 -12.583 1.936 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.468 -14.399 -0.234 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.735 -11.395 -0.085 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -9.364 -11.471 -2.464 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.674 -11.969 -2.212 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -8.926 -13.195 -2.520 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -11.074 -11.927 -0.759 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -10.672 -13.661 -0.754 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -10.636 -12.735 0.765 1.00 0.00 H new ATOM 1172 N ALA A 76 -5.828 -12.503 0.264 1.00 0.00 N ATOM 1173 CA ALA A 76 -4.419 -12.372 -0.052 1.00 0.00 C ATOM 1174 C ALA A 76 -3.684 -13.662 0.287 1.00 0.00 C ATOM 1175 O ALA A 76 -2.710 -14.029 -0.370 1.00 0.00 O ATOM 1176 CB ALA A 76 -3.818 -11.204 0.695 1.00 0.00 C ATOM 0 H ALA A 76 -6.148 -11.904 1.025 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.315 -12.184 -1.121 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -2.760 -11.119 0.447 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.332 -10.286 0.410 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -3.928 -11.363 1.768 1.00 0.00 H new ATOM 1182 N PHE A 77 -4.177 -14.350 1.289 1.00 0.00 N ATOM 1183 CA PHE A 77 -3.619 -15.600 1.732 1.00 0.00 C ATOM 1184 C PHE A 77 -3.872 -16.691 0.688 1.00 0.00 C ATOM 1185 O PHE A 77 -2.940 -17.414 0.312 1.00 0.00 O ATOM 1186 CB PHE A 77 -4.216 -15.993 3.103 1.00 0.00 C ATOM 1187 CG PHE A 77 -3.574 -17.187 3.772 1.00 0.00 C ATOM 1188 CD1 PHE A 77 -2.497 -17.017 4.628 1.00 0.00 C ATOM 1189 CD2 PHE A 77 -4.051 -18.468 3.555 1.00 0.00 C ATOM 1190 CE1 PHE A 77 -1.910 -18.101 5.251 1.00 0.00 C ATOM 1191 CE2 PHE A 77 -3.467 -19.555 4.173 1.00 0.00 C ATOM 1192 CZ PHE A 77 -2.396 -19.371 5.023 1.00 0.00 C ATOM 0 H PHE A 77 -4.990 -14.050 1.826 1.00 0.00 H new ATOM 0 HA PHE A 77 -2.541 -15.488 1.850 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.138 -15.137 3.773 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.278 -16.199 2.972 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -2.112 -16.024 4.810 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -4.891 -18.619 2.893 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -1.072 -17.954 5.916 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -3.848 -20.549 3.991 1.00 0.00 H new ATOM 0 HZ PHE A 77 -1.939 -20.220 5.509 1.00 0.00 H new ATOM 1202 N GLU A 78 -5.113 -16.788 0.189 1.00 0.00 N ATOM 1203 CA GLU A 78 -5.451 -17.840 -0.778 1.00 0.00 C ATOM 1204 C GLU A 78 -4.761 -17.600 -2.128 1.00 0.00 C ATOM 1205 O GLU A 78 -4.262 -18.535 -2.764 1.00 0.00 O ATOM 1206 CB GLU A 78 -6.987 -18.026 -0.985 1.00 0.00 C ATOM 1207 CG GLU A 78 -7.690 -16.899 -1.747 1.00 0.00 C ATOM 1208 CD GLU A 78 -9.107 -17.246 -2.160 1.00 0.00 C ATOM 1209 OE1 GLU A 78 -9.330 -18.350 -2.710 1.00 0.00 O ATOM 1210 OE2 GLU A 78 -10.016 -16.419 -2.022 1.00 0.00 O ATOM 0 H GLU A 78 -5.883 -16.165 0.433 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.077 -18.767 -0.343 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -7.153 -18.961 -1.519 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.458 -18.129 -0.007 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -7.709 -16.005 -1.123 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -7.109 -16.654 -2.636 1.00 0.00 H new ATOM 1217 N LEU A 79 -4.695 -16.345 -2.541 1.00 0.00 N ATOM 1218 CA LEU A 79 -4.129 -15.994 -3.837 1.00 0.00 C ATOM 1219 C LEU A 79 -2.629 -15.897 -3.771 1.00 0.00 C ATOM 1220 O LEU A 79 -1.960 -15.821 -4.817 1.00 0.00 O ATOM 1221 CB LEU A 79 -4.702 -14.666 -4.343 1.00 0.00 C ATOM 1222 CG LEU A 79 -6.206 -14.632 -4.602 1.00 0.00 C ATOM 1223 CD1 LEU A 79 -6.640 -13.235 -5.007 1.00 0.00 C ATOM 1224 CD2 LEU A 79 -6.596 -15.638 -5.678 1.00 0.00 C ATOM 0 H LEU A 79 -5.027 -15.549 -1.997 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.399 -16.789 -4.532 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.463 -13.891 -3.615 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.190 -14.403 -5.268 1.00 0.00 H new ATOM 0 HG LEU A 79 -6.716 -14.906 -3.678 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -7.715 -13.226 -5.188 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -6.401 -12.534 -4.207 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -6.116 -12.941 -5.916 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -7.672 -15.594 -5.844 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -6.076 -15.399 -6.605 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -6.319 -16.642 -5.355 1.00 0.00 H new ATOM 1236 N ASN A 80 -2.107 -15.904 -2.542 1.00 0.00 N ATOM 1237 CA ASN A 80 -0.672 -15.743 -2.269 1.00 0.00 C ATOM 1238 C ASN A 80 -0.243 -14.423 -2.879 1.00 0.00 C ATOM 1239 O ASN A 80 0.586 -14.347 -3.805 1.00 0.00 O ATOM 1240 CB ASN A 80 0.142 -16.942 -2.813 1.00 0.00 C ATOM 1241 CG ASN A 80 1.647 -16.893 -2.540 1.00 0.00 C ATOM 1242 OD1 ASN A 80 2.042 -16.377 -1.410 1.00 0.00 O flip ATOM 1243 ND2 ASN A 80 2.444 -17.374 -3.347 1.00 0.00 N flip ATOM 0 H ASN A 80 -2.671 -16.022 -1.700 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.481 -15.728 -1.196 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -0.259 -17.858 -2.379 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -0.013 -17.005 -3.890 1.00 0.00 H new ATOM 0 HD21 ASN A 80 2.105 -17.771 -4.223 1.00 0.00 H new ATOM 0 HD22 ASN A 80 3.442 -17.375 -3.139 1.00 0.00 H new ATOM 1250 N ALA A 81 -0.887 -13.398 -2.403 1.00 0.00 N ATOM 1251 CA ALA A 81 -0.780 -12.087 -2.955 1.00 0.00 C ATOM 1252 C ALA A 81 -0.207 -11.121 -1.953 1.00 0.00 C ATOM 1253 O ALA A 81 0.053 -11.485 -0.805 1.00 0.00 O ATOM 1254 CB ALA A 81 -2.164 -11.632 -3.368 1.00 0.00 C ATOM 0 H ALA A 81 -1.515 -13.456 -1.601 1.00 0.00 H new ATOM 0 HA ALA A 81 -0.110 -12.113 -3.814 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.106 -10.630 -3.793 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.566 -12.319 -4.112 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -2.818 -11.618 -2.496 1.00 0.00 H new ATOM 1260 N LEU A 82 -0.015 -9.900 -2.388 1.00 0.00 N ATOM 1261 CA LEU A 82 0.448 -8.857 -1.511 1.00 0.00 C ATOM 1262 C LEU A 82 -0.747 -8.197 -0.922 1.00 0.00 C ATOM 1263 O LEU A 82 -1.759 -8.033 -1.606 1.00 0.00 O ATOM 1264 CB LEU A 82 1.285 -7.811 -2.258 1.00 0.00 C ATOM 1265 CG LEU A 82 2.617 -8.281 -2.826 1.00 0.00 C ATOM 1266 CD1 LEU A 82 3.336 -7.134 -3.511 1.00 0.00 C ATOM 1267 CD2 LEU A 82 3.481 -8.865 -1.726 1.00 0.00 C ATOM 0 H LEU A 82 -0.174 -9.604 -3.351 1.00 0.00 H new ATOM 0 HA LEU A 82 1.084 -9.297 -0.743 1.00 0.00 H new ATOM 0 HB2 LEU A 82 0.685 -7.418 -3.078 1.00 0.00 H new ATOM 0 HB3 LEU A 82 1.479 -6.981 -1.578 1.00 0.00 H new ATOM 0 HG LEU A 82 2.424 -9.058 -3.566 1.00 0.00 H new ATOM 0 HD11 LEU A 82 4.286 -7.487 -3.911 1.00 0.00 H new ATOM 0 HD12 LEU A 82 2.719 -6.752 -4.324 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.520 -6.337 -2.790 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.430 -9.197 -2.146 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.666 -8.105 -0.967 1.00 0.00 H new ATOM 0 HD23 LEU A 82 2.969 -9.713 -1.273 1.00 0.00 H new ATOM 1279 N LEU A 83 -0.671 -7.845 0.314 1.00 0.00 N ATOM 1280 CA LEU A 83 -1.776 -7.190 0.928 1.00 0.00 C ATOM 1281 C LEU A 83 -1.468 -5.721 1.103 1.00 0.00 C ATOM 1282 O LEU A 83 -0.447 -5.358 1.677 1.00 0.00 O ATOM 1283 CB LEU A 83 -2.130 -7.831 2.264 1.00 0.00 C ATOM 1284 CG LEU A 83 -3.395 -7.301 2.934 1.00 0.00 C ATOM 1285 CD1 LEU A 83 -4.628 -7.702 2.149 1.00 0.00 C ATOM 1286 CD2 LEU A 83 -3.490 -7.776 4.361 1.00 0.00 C ATOM 0 H LEU A 83 0.137 -7.997 0.917 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.643 -7.296 0.277 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -2.243 -8.905 2.113 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -1.292 -7.691 2.947 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.339 -6.213 2.946 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.517 -7.313 2.645 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -4.567 -7.292 1.141 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -4.688 -8.789 2.096 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -4.400 -7.384 4.815 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -3.515 -8.866 4.381 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -2.624 -7.422 4.921 1.00 0.00 H new ATOM 1298 N ILE A 84 -2.320 -4.899 0.581 1.00 0.00 N ATOM 1299 CA ILE A 84 -2.189 -3.476 0.696 1.00 0.00 C ATOM 1300 C ILE A 84 -3.066 -3.030 1.850 1.00 0.00 C ATOM 1301 O ILE A 84 -4.306 -3.113 1.770 1.00 0.00 O ATOM 1302 CB ILE A 84 -2.644 -2.760 -0.605 1.00 0.00 C ATOM 1303 CG1 ILE A 84 -1.874 -3.309 -1.818 1.00 0.00 C ATOM 1304 CG2 ILE A 84 -2.430 -1.252 -0.481 1.00 0.00 C ATOM 1305 CD1 ILE A 84 -2.336 -2.750 -3.150 1.00 0.00 C ATOM 0 H ILE A 84 -3.140 -5.198 0.054 1.00 0.00 H new ATOM 0 HA ILE A 84 -1.144 -3.218 0.866 1.00 0.00 H new ATOM 0 HB ILE A 84 -3.707 -2.952 -0.753 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -0.814 -3.089 -1.692 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -1.974 -4.394 -1.837 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -2.753 -0.762 -1.400 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -3.011 -0.870 0.358 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -1.373 -1.047 -0.313 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -1.743 -3.187 -3.953 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -3.388 -2.993 -3.301 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -2.210 -1.667 -3.154 1.00 0.00 H new ATOM 1317 N ALA A 85 -2.451 -2.599 2.916 1.00 0.00 N ATOM 1318 CA ALA A 85 -3.176 -2.196 4.097 1.00 0.00 C ATOM 1319 C ALA A 85 -2.558 -0.951 4.680 1.00 0.00 C ATOM 1320 O ALA A 85 -1.362 -0.750 4.575 1.00 0.00 O ATOM 1321 CB ALA A 85 -3.176 -3.320 5.125 1.00 0.00 C ATOM 0 H ALA A 85 -1.437 -2.516 2.995 1.00 0.00 H new ATOM 0 HA ALA A 85 -4.208 -1.980 3.822 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -3.726 -3.003 6.011 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -3.652 -4.203 4.699 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -2.149 -3.560 5.402 1.00 0.00 H new ATOM 1327 N GLU A 86 -3.371 -0.118 5.271 1.00 0.00 N ATOM 1328 CA GLU A 86 -2.881 1.107 5.883 1.00 0.00 C ATOM 1329 C GLU A 86 -2.783 0.989 7.379 1.00 0.00 C ATOM 1330 O GLU A 86 -1.938 1.634 8.008 1.00 0.00 O ATOM 1331 CB GLU A 86 -3.739 2.299 5.491 1.00 0.00 C ATOM 1332 CG GLU A 86 -3.449 2.814 4.098 1.00 0.00 C ATOM 1333 CD GLU A 86 -2.072 3.447 3.978 1.00 0.00 C ATOM 1334 OE1 GLU A 86 -1.042 2.729 4.011 1.00 0.00 O ATOM 1335 OE2 GLU A 86 -1.993 4.684 3.864 1.00 0.00 O ATOM 0 H GLU A 86 -4.379 -0.257 5.347 1.00 0.00 H new ATOM 0 HA GLU A 86 -1.873 1.272 5.502 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -4.790 2.018 5.555 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.580 3.104 6.209 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -3.529 1.991 3.388 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -4.206 3.548 3.822 1.00 0.00 H new ATOM 1342 N ASP A 87 -3.620 0.157 7.949 1.00 0.00 N ATOM 1343 CA ASP A 87 -3.624 -0.021 9.383 1.00 0.00 C ATOM 1344 C ASP A 87 -2.449 -0.869 9.791 1.00 0.00 C ATOM 1345 O ASP A 87 -2.309 -1.999 9.330 1.00 0.00 O ATOM 1346 CB ASP A 87 -4.915 -0.658 9.863 1.00 0.00 C ATOM 1347 CG ASP A 87 -4.929 -0.809 11.360 1.00 0.00 C ATOM 1348 OD1 ASP A 87 -5.347 0.128 12.052 1.00 0.00 O ATOM 1349 OD2 ASP A 87 -4.493 -1.852 11.872 1.00 0.00 O ATOM 0 H ASP A 87 -4.305 -0.406 7.446 1.00 0.00 H new ATOM 0 HA ASP A 87 -3.547 0.963 9.846 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.762 -0.048 9.549 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -5.036 -1.635 9.396 1.00 0.00 H new ATOM 1354 N LYS A 88 -1.621 -0.330 10.657 1.00 0.00 N ATOM 1355 CA LYS A 88 -0.392 -0.980 11.082 1.00 0.00 C ATOM 1356 C LYS A 88 -0.604 -2.315 11.769 1.00 0.00 C ATOM 1357 O LYS A 88 0.258 -3.202 11.665 1.00 0.00 O ATOM 1358 CB LYS A 88 0.441 -0.070 11.966 1.00 0.00 C ATOM 1359 CG LYS A 88 1.051 1.112 11.245 1.00 0.00 C ATOM 1360 CD LYS A 88 1.899 1.930 12.195 1.00 0.00 C ATOM 1361 CE LYS A 88 2.673 3.017 11.477 1.00 0.00 C ATOM 1362 NZ LYS A 88 1.801 3.970 10.764 1.00 0.00 N ATOM 0 H LYS A 88 -1.779 0.579 11.092 1.00 0.00 H new ATOM 0 HA LYS A 88 0.150 -1.186 10.159 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -0.184 0.299 12.779 1.00 0.00 H new ATOM 0 HB3 LYS A 88 1.240 -0.656 12.419 1.00 0.00 H new ATOM 0 HG2 LYS A 88 1.661 0.763 10.412 1.00 0.00 H new ATOM 0 HG3 LYS A 88 0.262 1.735 10.823 1.00 0.00 H new ATOM 0 HD2 LYS A 88 1.260 2.382 12.954 1.00 0.00 H new ATOM 0 HD3 LYS A 88 2.596 1.273 12.715 1.00 0.00 H new ATOM 0 HE2 LYS A 88 3.281 3.560 12.200 1.00 0.00 H new ATOM 0 HE3 LYS A 88 3.359 2.558 10.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 2.377 4.745 10.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 1.314 3.480 9.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 1.097 4.357 11.424 1.00 0.00 H new ATOM 1376 N ASP A 89 -1.729 -2.487 12.435 1.00 0.00 N ATOM 1377 CA ASP A 89 -1.981 -3.715 13.152 1.00 0.00 C ATOM 1378 C ASP A 89 -2.435 -4.768 12.178 1.00 0.00 C ATOM 1379 O ASP A 89 -2.016 -5.925 12.254 1.00 0.00 O ATOM 1380 CB ASP A 89 -2.993 -3.513 14.267 1.00 0.00 C ATOM 1381 CG ASP A 89 -3.095 -4.710 15.180 1.00 0.00 C ATOM 1382 OD1 ASP A 89 -2.186 -4.913 16.004 1.00 0.00 O ATOM 1383 OD2 ASP A 89 -4.094 -5.425 15.123 1.00 0.00 O ATOM 0 H ASP A 89 -2.477 -1.795 12.493 1.00 0.00 H new ATOM 0 HA ASP A 89 -1.058 -4.045 13.629 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -2.714 -2.637 14.852 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -3.971 -3.307 13.832 1.00 0.00 H new ATOM 1388 N VAL A 90 -3.255 -4.347 11.219 1.00 0.00 N ATOM 1389 CA VAL A 90 -3.667 -5.218 10.122 1.00 0.00 C ATOM 1390 C VAL A 90 -2.426 -5.699 9.374 1.00 0.00 C ATOM 1391 O VAL A 90 -2.284 -6.895 9.089 1.00 0.00 O ATOM 1392 CB VAL A 90 -4.634 -4.503 9.127 1.00 0.00 C ATOM 1393 CG1 VAL A 90 -4.972 -5.407 7.943 1.00 0.00 C ATOM 1394 CG2 VAL A 90 -5.911 -4.093 9.832 1.00 0.00 C ATOM 0 H VAL A 90 -3.648 -3.407 11.179 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.209 -6.061 10.551 1.00 0.00 H new ATOM 0 HB VAL A 90 -4.127 -3.614 8.753 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -5.647 -4.883 7.266 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -4.057 -5.668 7.412 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -5.454 -6.315 8.305 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.574 -3.596 9.124 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.406 -4.978 10.233 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.673 -3.410 10.647 1.00 0.00 H new ATOM 1404 N ILE A 91 -1.509 -4.764 9.121 1.00 0.00 N ATOM 1405 CA ILE A 91 -0.261 -5.055 8.446 1.00 0.00 C ATOM 1406 C ILE A 91 0.534 -6.124 9.194 1.00 0.00 C ATOM 1407 O ILE A 91 0.942 -7.130 8.595 1.00 0.00 O ATOM 1408 CB ILE A 91 0.602 -3.770 8.259 1.00 0.00 C ATOM 1409 CG1 ILE A 91 -0.122 -2.781 7.342 1.00 0.00 C ATOM 1410 CG2 ILE A 91 1.985 -4.105 7.693 1.00 0.00 C ATOM 1411 CD1 ILE A 91 0.553 -1.435 7.233 1.00 0.00 C ATOM 0 H ILE A 91 -1.619 -3.784 9.382 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.512 -5.440 7.458 1.00 0.00 H new ATOM 0 HB ILE A 91 0.744 -3.312 9.238 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -0.202 -3.217 6.346 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -1.138 -2.637 7.710 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.562 -3.188 7.575 1.00 0.00 H new ATOM 0 HG22 ILE A 91 2.506 -4.775 8.377 1.00 0.00 H new ATOM 0 HG23 ILE A 91 1.873 -4.591 6.724 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -0.022 -0.793 6.566 1.00 0.00 H new ATOM 0 HD12 ILE A 91 0.609 -0.975 8.220 1.00 0.00 H new ATOM 0 HD13 ILE A 91 1.559 -1.564 6.835 1.00 0.00 H new ATOM 1423 N ASN A 92 0.717 -5.953 10.508 1.00 0.00 N ATOM 1424 CA ASN A 92 1.511 -6.927 11.242 1.00 0.00 C ATOM 1425 C ASN A 92 0.813 -8.260 11.360 1.00 0.00 C ATOM 1426 O ASN A 92 1.428 -9.278 11.135 1.00 0.00 O ATOM 1427 CB ASN A 92 2.049 -6.458 12.618 1.00 0.00 C ATOM 1428 CG ASN A 92 1.002 -6.223 13.686 1.00 0.00 C ATOM 1429 OD1 ASN A 92 0.545 -5.109 13.873 1.00 0.00 O ATOM 1430 ND2 ASN A 92 0.625 -7.259 14.402 1.00 0.00 N ATOM 0 H ASN A 92 0.342 -5.182 11.060 1.00 0.00 H new ATOM 0 HA ASN A 92 2.399 -7.046 10.622 1.00 0.00 H new ATOM 0 HB2 ASN A 92 2.755 -7.203 12.985 1.00 0.00 H new ATOM 0 HB3 ASN A 92 2.608 -5.533 12.473 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -0.070 -7.143 15.140 1.00 0.00 H new ATOM 0 HD22 ASN A 92 1.027 -8.178 14.220 1.00 0.00 H new ATOM 1437 N LYS A 93 -0.480 -8.254 11.651 1.00 0.00 N ATOM 1438 CA LYS A 93 -1.226 -9.504 11.810 1.00 0.00 C ATOM 1439 C LYS A 93 -1.200 -10.328 10.542 1.00 0.00 C ATOM 1440 O LYS A 93 -1.006 -11.547 10.591 1.00 0.00 O ATOM 1441 CB LYS A 93 -2.666 -9.253 12.244 1.00 0.00 C ATOM 1442 CG LYS A 93 -2.817 -8.640 13.634 1.00 0.00 C ATOM 1443 CD LYS A 93 -2.272 -9.550 14.732 1.00 0.00 C ATOM 1444 CE LYS A 93 -3.059 -10.848 14.857 1.00 0.00 C ATOM 1445 NZ LYS A 93 -2.439 -11.763 15.832 1.00 0.00 N ATOM 0 H LYS A 93 -1.035 -7.408 11.782 1.00 0.00 H new ATOM 0 HA LYS A 93 -0.728 -10.068 12.599 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -3.140 -8.593 11.518 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.209 -10.198 12.218 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -2.295 -7.684 13.665 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -3.870 -8.434 13.825 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -1.227 -9.781 14.523 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.297 -9.020 15.684 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -4.082 -10.627 15.163 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -3.116 -11.336 13.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -2.999 -12.637 15.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -1.472 -11.993 15.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -2.408 -11.306 16.766 1.00 0.00 H new ATOM 1459 N ALA A 94 -1.362 -9.663 9.413 1.00 0.00 N ATOM 1460 CA ALA A 94 -1.320 -10.319 8.130 1.00 0.00 C ATOM 1461 C ALA A 94 0.063 -10.893 7.856 1.00 0.00 C ATOM 1462 O ALA A 94 0.188 -12.047 7.424 1.00 0.00 O ATOM 1463 CB ALA A 94 -1.711 -9.359 7.036 1.00 0.00 C ATOM 0 H ALA A 94 -1.525 -8.657 9.365 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.034 -11.142 8.148 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -1.674 -9.870 6.074 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -2.723 -8.995 7.215 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -1.019 -8.517 7.027 1.00 0.00 H new ATOM 1469 N LYS A 95 1.106 -10.119 8.157 1.00 0.00 N ATOM 1470 CA LYS A 95 2.458 -10.570 7.886 1.00 0.00 C ATOM 1471 C LYS A 95 2.864 -11.688 8.841 1.00 0.00 C ATOM 1472 O LYS A 95 3.696 -12.535 8.506 1.00 0.00 O ATOM 1473 CB LYS A 95 3.461 -9.397 7.828 1.00 0.00 C ATOM 1474 CG LYS A 95 3.865 -8.784 9.155 1.00 0.00 C ATOM 1475 CD LYS A 95 4.176 -7.288 9.013 1.00 0.00 C ATOM 1476 CE LYS A 95 5.187 -6.960 7.919 1.00 0.00 C ATOM 1477 NZ LYS A 95 6.530 -7.497 8.191 1.00 0.00 N ATOM 0 H LYS A 95 1.037 -9.194 8.581 1.00 0.00 H new ATOM 0 HA LYS A 95 2.479 -11.005 6.887 1.00 0.00 H new ATOM 0 HB2 LYS A 95 4.363 -9.744 7.324 1.00 0.00 H new ATOM 0 HB3 LYS A 95 3.031 -8.611 7.206 1.00 0.00 H new ATOM 0 HG2 LYS A 95 3.063 -8.923 9.880 1.00 0.00 H new ATOM 0 HG3 LYS A 95 4.740 -9.303 9.545 1.00 0.00 H new ATOM 0 HD2 LYS A 95 3.249 -6.754 8.807 1.00 0.00 H new ATOM 0 HD3 LYS A 95 4.554 -6.915 9.965 1.00 0.00 H new ATOM 0 HE2 LYS A 95 4.828 -7.359 6.970 1.00 0.00 H new ATOM 0 HE3 LYS A 95 5.252 -5.878 7.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 7.170 -7.241 7.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 6.890 -7.097 9.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 6.480 -8.533 8.272 1.00 0.00 H new ATOM 1491 N GLU A 96 2.235 -11.709 10.010 1.00 0.00 N ATOM 1492 CA GLU A 96 2.417 -12.779 10.973 1.00 0.00 C ATOM 1493 C GLU A 96 1.695 -14.047 10.512 1.00 0.00 C ATOM 1494 O GLU A 96 2.124 -15.149 10.808 1.00 0.00 O ATOM 1495 CB GLU A 96 1.922 -12.376 12.364 1.00 0.00 C ATOM 1496 CG GLU A 96 2.719 -11.263 13.021 1.00 0.00 C ATOM 1497 CD GLU A 96 2.256 -10.969 14.427 1.00 0.00 C ATOM 1498 OE1 GLU A 96 2.617 -11.738 15.340 1.00 0.00 O ATOM 1499 OE2 GLU A 96 1.541 -9.954 14.660 1.00 0.00 O ATOM 0 H GLU A 96 1.586 -10.983 10.313 1.00 0.00 H new ATOM 0 HA GLU A 96 3.487 -12.979 11.038 1.00 0.00 H new ATOM 0 HB2 GLU A 96 0.881 -12.063 12.288 1.00 0.00 H new ATOM 0 HB3 GLU A 96 1.945 -13.253 13.011 1.00 0.00 H new ATOM 0 HG2 GLU A 96 3.773 -11.539 13.040 1.00 0.00 H new ATOM 0 HG3 GLU A 96 2.637 -10.358 12.419 1.00 0.00 H new ATOM 1506 N LEU A 97 0.598 -13.881 9.778 1.00 0.00 N ATOM 1507 CA LEU A 97 -0.160 -15.019 9.257 1.00 0.00 C ATOM 1508 C LEU A 97 0.493 -15.591 8.009 1.00 0.00 C ATOM 1509 O LEU A 97 0.140 -16.678 7.553 1.00 0.00 O ATOM 1510 CB LEU A 97 -1.616 -14.637 8.961 1.00 0.00 C ATOM 1511 CG LEU A 97 -2.479 -14.243 10.163 1.00 0.00 C ATOM 1512 CD1 LEU A 97 -3.863 -13.829 9.705 1.00 0.00 C ATOM 1513 CD2 LEU A 97 -2.571 -15.391 11.158 1.00 0.00 C ATOM 0 H LEU A 97 0.213 -12.970 9.530 1.00 0.00 H new ATOM 0 HA LEU A 97 -0.158 -15.785 10.032 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -1.614 -13.806 8.256 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -2.094 -15.479 8.460 1.00 0.00 H new ATOM 0 HG LEU A 97 -2.008 -13.395 10.661 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -4.465 -13.552 10.570 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -3.783 -12.977 9.030 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -4.338 -14.661 9.184 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -3.188 -15.090 12.004 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -3.018 -16.258 10.672 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -1.572 -15.648 11.511 1.00 0.00 H new ATOM 1525 N GLY A 98 1.436 -14.858 7.463 1.00 0.00 N ATOM 1526 CA GLY A 98 2.155 -15.335 6.311 1.00 0.00 C ATOM 1527 C GLY A 98 1.838 -14.578 5.045 1.00 0.00 C ATOM 1528 O GLY A 98 2.183 -15.019 3.959 1.00 0.00 O ATOM 0 H GLY A 98 1.719 -13.937 7.797 1.00 0.00 H new ATOM 0 HA2 GLY A 98 3.225 -15.267 6.507 1.00 0.00 H new ATOM 0 HA3 GLY A 98 1.925 -16.390 6.161 1.00 0.00 H new ATOM 1532 N VAL A 99 1.183 -13.458 5.168 1.00 0.00 N ATOM 1533 CA VAL A 99 0.863 -12.642 4.011 1.00 0.00 C ATOM 1534 C VAL A 99 1.729 -11.401 4.053 1.00 0.00 C ATOM 1535 O VAL A 99 1.836 -10.778 5.090 1.00 0.00 O ATOM 1536 CB VAL A 99 -0.622 -12.199 4.032 1.00 0.00 C ATOM 1537 CG1 VAL A 99 -0.979 -11.425 2.776 1.00 0.00 C ATOM 1538 CG2 VAL A 99 -1.551 -13.386 4.224 1.00 0.00 C ATOM 0 H VAL A 99 0.855 -13.081 6.057 1.00 0.00 H new ATOM 0 HA VAL A 99 1.041 -13.227 3.109 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.755 -11.534 4.885 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -2.027 -11.127 2.818 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.351 -10.537 2.705 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.816 -12.055 1.902 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -2.585 -13.041 4.234 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -1.412 -14.093 3.406 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -1.323 -13.877 5.170 1.00 0.00 H new ATOM 1548 N ASN A 100 2.363 -11.043 2.966 1.00 0.00 N ATOM 1549 CA ASN A 100 3.158 -9.834 2.986 1.00 0.00 C ATOM 1550 C ASN A 100 2.255 -8.626 2.847 1.00 0.00 C ATOM 1551 O ASN A 100 1.783 -8.296 1.746 1.00 0.00 O ATOM 1552 CB ASN A 100 4.253 -9.818 1.918 1.00 0.00 C ATOM 1553 CG ASN A 100 5.190 -8.619 2.080 1.00 0.00 C ATOM 1554 OD1 ASN A 100 5.395 -8.118 3.188 1.00 0.00 O ATOM 1555 ND2 ASN A 100 5.789 -8.177 1.003 1.00 0.00 N ATOM 0 H ASN A 100 2.350 -11.550 2.081 1.00 0.00 H new ATOM 0 HA ASN A 100 3.672 -9.801 3.947 1.00 0.00 H new ATOM 0 HB2 ASN A 100 4.830 -10.741 1.976 1.00 0.00 H new ATOM 0 HB3 ASN A 100 3.795 -9.790 0.929 1.00 0.00 H new ATOM 0 HD21 ASN A 100 6.445 -7.398 1.067 1.00 0.00 H new ATOM 0 HD22 ASN A 100 5.600 -8.611 0.100 1.00 0.00 H new ATOM 1562 N ALA A 101 1.940 -8.042 3.967 1.00 0.00 N ATOM 1563 CA ALA A 101 1.133 -6.867 4.012 1.00 0.00 C ATOM 1564 C ALA A 101 2.025 -5.673 4.042 1.00 0.00 C ATOM 1565 O ALA A 101 2.965 -5.613 4.839 1.00 0.00 O ATOM 1566 CB ALA A 101 0.225 -6.884 5.220 1.00 0.00 C ATOM 0 H ALA A 101 2.242 -8.376 4.882 1.00 0.00 H new ATOM 0 HA ALA A 101 0.499 -6.829 3.126 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -0.381 -5.978 5.233 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -0.427 -7.756 5.173 1.00 0.00 H new ATOM 0 HB3 ALA A 101 0.827 -6.931 6.127 1.00 0.00 H new ATOM 1572 N ILE A 102 1.764 -4.756 3.176 1.00 0.00 N ATOM 1573 CA ILE A 102 2.547 -3.579 3.061 1.00 0.00 C ATOM 1574 C ILE A 102 1.667 -2.335 3.056 1.00 0.00 C ATOM 1575 O ILE A 102 0.522 -2.379 2.575 1.00 0.00 O ATOM 1576 CB ILE A 102 3.522 -3.627 1.817 1.00 0.00 C ATOM 1577 CG1 ILE A 102 2.832 -4.087 0.499 1.00 0.00 C ATOM 1578 CG2 ILE A 102 4.734 -4.498 2.108 1.00 0.00 C ATOM 1579 CD1 ILE A 102 1.912 -3.076 -0.154 1.00 0.00 C ATOM 0 H ILE A 102 0.987 -4.806 2.517 1.00 0.00 H new ATOM 0 HA ILE A 102 3.185 -3.524 3.943 1.00 0.00 H new ATOM 0 HB ILE A 102 3.844 -2.598 1.655 1.00 0.00 H new ATOM 0 HG12 ILE A 102 3.607 -4.360 -0.218 1.00 0.00 H new ATOM 0 HG13 ILE A 102 2.258 -4.990 0.708 1.00 0.00 H new ATOM 0 HG21 ILE A 102 5.388 -4.514 1.236 1.00 0.00 H new ATOM 0 HG22 ILE A 102 5.277 -4.093 2.962 1.00 0.00 H new ATOM 0 HG23 ILE A 102 4.407 -5.513 2.335 1.00 0.00 H new ATOM 0 HD11 ILE A 102 1.488 -3.504 -1.063 1.00 0.00 H new ATOM 0 HD12 ILE A 102 1.108 -2.817 0.535 1.00 0.00 H new ATOM 0 HD13 ILE A 102 2.477 -2.178 -0.405 1.00 0.00 H new ATOM 1591 N PRO A 103 2.141 -1.246 3.679 1.00 0.00 N ATOM 1592 CA PRO A 103 1.451 0.042 3.637 1.00 0.00 C ATOM 1593 C PRO A 103 1.342 0.557 2.202 1.00 0.00 C ATOM 1594 O PRO A 103 2.148 0.172 1.326 1.00 0.00 O ATOM 1595 CB PRO A 103 2.363 0.978 4.433 1.00 0.00 C ATOM 1596 CG PRO A 103 3.240 0.100 5.252 1.00 0.00 C ATOM 1597 CD PRO A 103 3.346 -1.206 4.522 1.00 0.00 C ATOM 0 HA PRO A 103 0.438 -0.027 4.033 1.00 0.00 H new ATOM 0 HB2 PRO A 103 2.954 1.607 3.767 1.00 0.00 H new ATOM 0 HB3 PRO A 103 1.779 1.646 5.066 1.00 0.00 H new ATOM 0 HG2 PRO A 103 4.224 0.550 5.384 1.00 0.00 H new ATOM 0 HG3 PRO A 103 2.820 -0.046 6.247 1.00 0.00 H new ATOM 0 HD2 PRO A 103 4.254 -1.254 3.921 1.00 0.00 H new ATOM 0 HD3 PRO A 103 3.376 -2.048 5.214 1.00 0.00 H new ATOM 1605 N ILE A 104 0.393 1.444 1.967 1.00 0.00 N ATOM 1606 CA ILE A 104 0.162 2.023 0.648 1.00 0.00 C ATOM 1607 C ILE A 104 1.415 2.649 0.053 1.00 0.00 C ATOM 1608 O ILE A 104 1.710 2.458 -1.129 1.00 0.00 O ATOM 1609 CB ILE A 104 -1.033 3.021 0.664 1.00 0.00 C ATOM 1610 CG1 ILE A 104 -2.346 2.239 0.598 1.00 0.00 C ATOM 1611 CG2 ILE A 104 -0.945 4.107 -0.412 1.00 0.00 C ATOM 1612 CD1 ILE A 104 -3.575 3.101 0.509 1.00 0.00 C ATOM 0 H ILE A 104 -0.244 1.787 2.686 1.00 0.00 H new ATOM 0 HA ILE A 104 -0.108 1.198 -0.011 1.00 0.00 H new ATOM 0 HB ILE A 104 -0.991 3.572 1.604 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -2.318 1.576 -0.267 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -2.423 1.606 1.482 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.812 4.764 -0.338 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -0.035 4.690 -0.267 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -0.925 3.642 -1.398 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.461 2.468 0.466 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.632 3.746 1.386 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -3.524 3.715 -0.390 1.00 0.00 H new ATOM 1624 N GLU A 105 2.178 3.323 0.870 1.00 0.00 N ATOM 1625 CA GLU A 105 3.385 3.960 0.398 1.00 0.00 C ATOM 1626 C GLU A 105 4.466 2.982 -0.037 1.00 0.00 C ATOM 1627 O GLU A 105 5.328 3.340 -0.816 1.00 0.00 O ATOM 1628 CB GLU A 105 3.922 4.962 1.373 1.00 0.00 C ATOM 1629 CG GLU A 105 3.068 6.192 1.512 1.00 0.00 C ATOM 1630 CD GLU A 105 3.690 7.186 2.429 1.00 0.00 C ATOM 1631 OE1 GLU A 105 4.766 7.719 2.094 1.00 0.00 O ATOM 1632 OE2 GLU A 105 3.110 7.476 3.497 1.00 0.00 O ATOM 0 H GLU A 105 1.989 3.447 1.865 1.00 0.00 H new ATOM 0 HA GLU A 105 3.082 4.499 -0.500 1.00 0.00 H new ATOM 0 HB2 GLU A 105 4.021 4.488 2.349 1.00 0.00 H new ATOM 0 HB3 GLU A 105 4.923 5.259 1.060 1.00 0.00 H new ATOM 0 HG2 GLU A 105 2.917 6.644 0.532 1.00 0.00 H new ATOM 0 HG3 GLU A 105 2.084 5.913 1.889 1.00 0.00 H new ATOM 1639 N GLU A 106 4.401 1.745 0.416 1.00 0.00 N ATOM 1640 CA GLU A 106 5.373 0.749 -0.024 1.00 0.00 C ATOM 1641 C GLU A 106 5.018 0.294 -1.419 1.00 0.00 C ATOM 1642 O GLU A 106 5.878 -0.018 -2.238 1.00 0.00 O ATOM 1643 CB GLU A 106 5.414 -0.442 0.918 1.00 0.00 C ATOM 1644 CG GLU A 106 5.861 -0.091 2.315 1.00 0.00 C ATOM 1645 CD GLU A 106 7.152 0.669 2.317 1.00 0.00 C ATOM 1646 OE1 GLU A 106 8.199 0.094 1.936 1.00 0.00 O ATOM 1647 OE2 GLU A 106 7.145 1.860 2.708 1.00 0.00 O ATOM 0 H GLU A 106 3.702 1.405 1.076 1.00 0.00 H new ATOM 0 HA GLU A 106 6.363 1.205 -0.021 1.00 0.00 H new ATOM 0 HB2 GLU A 106 4.422 -0.892 0.965 1.00 0.00 H new ATOM 0 HB3 GLU A 106 6.087 -1.196 0.509 1.00 0.00 H new ATOM 0 HG2 GLU A 106 5.089 0.504 2.804 1.00 0.00 H new ATOM 0 HG3 GLU A 106 5.977 -1.004 2.899 1.00 0.00 H new ATOM 1654 N LEU A 107 3.743 0.299 -1.683 1.00 0.00 N ATOM 1655 CA LEU A 107 3.207 -0.045 -2.978 1.00 0.00 C ATOM 1656 C LEU A 107 3.526 1.114 -3.951 1.00 0.00 C ATOM 1657 O LEU A 107 3.786 0.901 -5.126 1.00 0.00 O ATOM 1658 CB LEU A 107 1.674 -0.288 -2.798 1.00 0.00 C ATOM 1659 CG LEU A 107 0.844 -0.893 -3.956 1.00 0.00 C ATOM 1660 CD1 LEU A 107 0.644 0.082 -5.096 1.00 0.00 C ATOM 1661 CD2 LEU A 107 1.466 -2.194 -4.449 1.00 0.00 C ATOM 0 H LEU A 107 3.031 0.546 -0.996 1.00 0.00 H new ATOM 0 HA LEU A 107 3.646 -0.951 -3.395 1.00 0.00 H new ATOM 0 HB2 LEU A 107 1.549 -0.941 -1.934 1.00 0.00 H new ATOM 0 HB3 LEU A 107 1.222 0.670 -2.542 1.00 0.00 H new ATOM 0 HG LEU A 107 -0.145 -1.114 -3.556 1.00 0.00 H new ATOM 0 HD11 LEU A 107 0.056 -0.392 -5.882 1.00 0.00 H new ATOM 0 HD12 LEU A 107 0.118 0.965 -4.732 1.00 0.00 H new ATOM 0 HD13 LEU A 107 1.614 0.377 -5.497 1.00 0.00 H new ATOM 0 HD21 LEU A 107 0.865 -2.599 -5.263 1.00 0.00 H new ATOM 0 HD22 LEU A 107 2.477 -2.001 -4.807 1.00 0.00 H new ATOM 0 HD23 LEU A 107 1.502 -2.913 -3.631 1.00 0.00 H new ATOM 1673 N LEU A 108 3.546 2.327 -3.414 1.00 0.00 N ATOM 1674 CA LEU A 108 3.825 3.536 -4.191 1.00 0.00 C ATOM 1675 C LEU A 108 5.321 3.730 -4.439 1.00 0.00 C ATOM 1676 O LEU A 108 5.738 4.016 -5.551 1.00 0.00 O ATOM 1677 CB LEU A 108 3.290 4.776 -3.469 1.00 0.00 C ATOM 1678 CG LEU A 108 1.791 4.824 -3.183 1.00 0.00 C ATOM 1679 CD1 LEU A 108 1.457 6.068 -2.383 1.00 0.00 C ATOM 1680 CD2 LEU A 108 0.992 4.795 -4.475 1.00 0.00 C ATOM 0 H LEU A 108 3.369 2.505 -2.425 1.00 0.00 H new ATOM 0 HA LEU A 108 3.324 3.409 -5.151 1.00 0.00 H new ATOM 0 HB2 LEU A 108 3.818 4.869 -2.520 1.00 0.00 H new ATOM 0 HB3 LEU A 108 3.549 5.652 -4.064 1.00 0.00 H new ATOM 0 HG LEU A 108 1.522 3.944 -2.600 1.00 0.00 H new ATOM 0 HD11 LEU A 108 0.386 6.095 -2.183 1.00 0.00 H new ATOM 0 HD12 LEU A 108 2.002 6.051 -1.439 1.00 0.00 H new ATOM 0 HD13 LEU A 108 1.743 6.953 -2.951 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -0.073 4.830 -4.245 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.260 5.656 -5.088 1.00 0.00 H new ATOM 0 HD23 LEU A 108 1.215 3.878 -5.020 1.00 0.00 H new ATOM 1692 N ALA A 109 6.118 3.617 -3.397 1.00 0.00 N ATOM 1693 CA ALA A 109 7.549 3.861 -3.504 1.00 0.00 C ATOM 1694 C ALA A 109 8.253 2.752 -4.253 1.00 0.00 C ATOM 1695 O ALA A 109 9.072 3.008 -5.139 1.00 0.00 O ATOM 1696 CB ALA A 109 8.172 4.067 -2.132 1.00 0.00 C ATOM 0 H ALA A 109 5.802 3.357 -2.462 1.00 0.00 H new ATOM 0 HA ALA A 109 7.678 4.778 -4.079 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.241 4.247 -2.241 1.00 0.00 H new ATOM 0 HB2 ALA A 109 7.707 4.925 -1.646 1.00 0.00 H new ATOM 0 HB3 ALA A 109 8.015 3.176 -1.523 1.00 0.00 H new ATOM 1702 N SER A 110 7.906 1.536 -3.936 1.00 0.00 N ATOM 1703 CA SER A 110 8.516 0.372 -4.537 1.00 0.00 C ATOM 1704 C SER A 110 7.637 -0.140 -5.689 1.00 0.00 C ATOM 1705 O SER A 110 7.580 -1.340 -5.941 1.00 0.00 O ATOM 1706 CB SER A 110 8.641 -0.702 -3.453 1.00 0.00 C ATOM 1707 OG SER A 110 9.228 -0.161 -2.273 1.00 0.00 O ATOM 0 H SER A 110 7.186 1.318 -3.247 1.00 0.00 H new ATOM 0 HA SER A 110 9.498 0.619 -4.940 1.00 0.00 H new ATOM 0 HB2 SER A 110 7.656 -1.109 -3.222 1.00 0.00 H new ATOM 0 HB3 SER A 110 9.249 -1.528 -3.821 1.00 0.00 H new ATOM 0 HG SER A 110 9.298 -0.862 -1.592 1.00 0.00 H new ATOM 1713 N SER A 111 7.015 0.781 -6.410 1.00 0.00 N ATOM 1714 CA SER A 111 6.084 0.460 -7.469 1.00 0.00 C ATOM 1715 C SER A 111 6.722 -0.330 -8.633 1.00 0.00 C ATOM 1716 O SER A 111 7.389 0.252 -9.523 1.00 0.00 O ATOM 1717 CB SER A 111 5.401 1.742 -7.951 1.00 0.00 C ATOM 1718 OG SER A 111 6.363 2.750 -8.267 1.00 0.00 O ATOM 0 H SER A 111 7.148 1.783 -6.270 1.00 0.00 H new ATOM 0 HA SER A 111 5.333 -0.214 -7.056 1.00 0.00 H new ATOM 0 HB2 SER A 111 4.794 1.526 -8.830 1.00 0.00 H new ATOM 0 HB3 SER A 111 4.725 2.110 -7.179 1.00 0.00 H new ATOM 0 HG SER A 111 6.408 3.400 -7.535 1.00 0.00 H new ATOM 1724 N LEU A 112 6.564 -1.658 -8.561 1.00 0.00 N ATOM 1725 CA LEU A 112 6.999 -2.609 -9.576 1.00 0.00 C ATOM 1726 C LEU A 112 8.500 -2.774 -9.653 1.00 0.00 C ATOM 1727 O LEU A 112 9.222 -1.888 -10.116 1.00 0.00 O ATOM 1728 CB LEU A 112 6.411 -2.288 -10.953 1.00 0.00 C ATOM 1729 CG LEU A 112 4.911 -2.480 -11.088 1.00 0.00 C ATOM 1730 CD1 LEU A 112 4.428 -1.866 -12.377 1.00 0.00 C ATOM 1731 CD2 LEU A 112 4.574 -3.959 -11.064 1.00 0.00 C ATOM 0 H LEU A 112 6.114 -2.109 -7.765 1.00 0.00 H new ATOM 0 HA LEU A 112 6.603 -3.571 -9.252 1.00 0.00 H new ATOM 0 HB2 LEU A 112 6.650 -1.253 -11.198 1.00 0.00 H new ATOM 0 HB3 LEU A 112 6.907 -2.914 -11.695 1.00 0.00 H new ATOM 0 HG LEU A 112 4.415 -1.988 -10.251 1.00 0.00 H new ATOM 0 HD11 LEU A 112 3.351 -2.008 -12.466 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.655 -0.800 -12.380 1.00 0.00 H new ATOM 0 HD13 LEU A 112 4.928 -2.346 -13.218 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.496 -4.088 -11.161 1.00 0.00 H new ATOM 0 HD22 LEU A 112 5.076 -4.460 -11.892 1.00 0.00 H new ATOM 0 HD23 LEU A 112 4.908 -4.393 -10.121 1.00 0.00 H new ATOM 1743 N GLU A 113 8.962 -3.910 -9.213 1.00 0.00 N ATOM 1744 CA GLU A 113 10.353 -4.244 -9.328 1.00 0.00 C ATOM 1745 C GLU A 113 10.665 -4.671 -10.759 1.00 0.00 C ATOM 1746 O GLU A 113 11.665 -4.253 -11.343 1.00 0.00 O ATOM 1747 CB GLU A 113 10.798 -5.291 -8.258 1.00 0.00 C ATOM 1748 CG GLU A 113 9.708 -6.266 -7.745 1.00 0.00 C ATOM 1749 CD GLU A 113 9.090 -7.141 -8.806 1.00 0.00 C ATOM 1750 OE1 GLU A 113 8.110 -6.701 -9.454 1.00 0.00 O ATOM 1751 OE2 GLU A 113 9.562 -8.277 -9.018 1.00 0.00 O ATOM 0 H GLU A 113 8.389 -4.627 -8.767 1.00 0.00 H new ATOM 0 HA GLU A 113 10.947 -3.356 -9.114 1.00 0.00 H new ATOM 0 HB2 GLU A 113 11.613 -5.881 -8.677 1.00 0.00 H new ATOM 0 HB3 GLU A 113 11.203 -4.752 -7.402 1.00 0.00 H new ATOM 0 HG2 GLU A 113 10.144 -6.904 -6.977 1.00 0.00 H new ATOM 0 HG3 GLU A 113 8.918 -5.686 -7.267 1.00 0.00 H new ATOM 1758 N HIS A 114 9.761 -5.458 -11.332 1.00 0.00 N ATOM 1759 CA HIS A 114 9.857 -5.946 -12.709 1.00 0.00 C ATOM 1760 C HIS A 114 11.035 -6.850 -12.960 1.00 0.00 C ATOM 1761 O HIS A 114 11.883 -7.060 -12.072 1.00 0.00 O ATOM 1762 CB HIS A 114 9.736 -4.844 -13.774 1.00 0.00 C ATOM 1763 CG HIS A 114 8.320 -4.490 -14.095 1.00 0.00 C ATOM 1764 ND1 HIS A 114 7.894 -3.214 -14.366 1.00 0.00 N ATOM 1765 CD2 HIS A 114 7.234 -5.280 -14.249 1.00 0.00 C ATOM 1766 CE1 HIS A 114 6.614 -3.241 -14.670 1.00 0.00 C ATOM 1767 NE2 HIS A 114 6.196 -4.482 -14.604 1.00 0.00 N ATOM 0 H HIS A 114 8.925 -5.782 -10.846 1.00 0.00 H new ATOM 0 HA HIS A 114 8.971 -6.571 -12.822 1.00 0.00 H new ATOM 0 HB2 HIS A 114 10.257 -3.952 -13.426 1.00 0.00 H new ATOM 0 HB3 HIS A 114 10.238 -5.171 -14.685 1.00 0.00 H new ATOM 0 HD2 HIS A 114 7.199 -6.351 -14.114 1.00 0.00 H new ATOM 0 HE1 HIS A 114 6.009 -2.385 -14.930 1.00 0.00 H new ATOM 0 HE2 HIS A 114 5.244 -4.797 -14.790 1.00 0.00 H new ATOM 1776 N HIS A 115 11.061 -7.411 -14.176 1.00 0.00 N ATOM 1777 CA HIS A 115 12.035 -8.418 -14.598 1.00 0.00 C ATOM 1778 C HIS A 115 11.802 -9.697 -13.803 1.00 0.00 C ATOM 1779 O HIS A 115 10.962 -9.736 -12.889 1.00 0.00 O ATOM 1780 CB HIS A 115 13.516 -7.946 -14.464 1.00 0.00 C ATOM 1781 CG HIS A 115 13.910 -6.801 -15.363 1.00 0.00 C ATOM 1782 ND1 HIS A 115 14.558 -6.973 -16.566 1.00 0.00 N ATOM 1783 CD2 HIS A 115 13.756 -5.461 -15.218 1.00 0.00 C ATOM 1784 CE1 HIS A 115 14.784 -5.802 -17.116 1.00 0.00 C ATOM 1785 NE2 HIS A 115 14.310 -4.868 -16.326 1.00 0.00 N ATOM 0 H HIS A 115 10.391 -7.171 -14.906 1.00 0.00 H new ATOM 0 HA HIS A 115 11.880 -8.598 -15.662 1.00 0.00 H new ATOM 0 HB2 HIS A 115 13.695 -7.653 -13.430 1.00 0.00 H new ATOM 0 HB3 HIS A 115 14.170 -8.792 -14.673 1.00 0.00 H new ATOM 0 HD2 HIS A 115 13.286 -4.955 -14.387 1.00 0.00 H new ATOM 0 HE1 HIS A 115 15.278 -5.636 -18.062 1.00 0.00 H new ATOM 0 HE2 HIS A 115 14.347 -3.865 -16.505 1.00 0.00 H new ATOM 1794 N HIS A 116 12.477 -10.738 -14.145 1.00 0.00 N ATOM 1795 CA HIS A 116 12.364 -11.937 -13.375 1.00 0.00 C ATOM 1796 C HIS A 116 13.713 -12.571 -13.267 1.00 0.00 C ATOM 1797 O HIS A 116 14.511 -12.454 -14.204 1.00 0.00 O ATOM 1798 CB HIS A 116 11.265 -12.907 -13.900 1.00 0.00 C ATOM 1799 CG HIS A 116 11.473 -13.473 -15.271 1.00 0.00 C ATOM 1800 ND1 HIS A 116 10.991 -12.884 -16.416 1.00 0.00 N ATOM 1801 CD2 HIS A 116 12.096 -14.596 -15.667 1.00 0.00 C ATOM 1802 CE1 HIS A 116 11.316 -13.623 -17.453 1.00 0.00 C ATOM 1803 NE2 HIS A 116 11.986 -14.666 -17.026 1.00 0.00 N ATOM 0 H HIS A 116 13.109 -10.789 -14.944 1.00 0.00 H new ATOM 0 HA HIS A 116 12.020 -11.677 -12.374 1.00 0.00 H new ATOM 0 HB2 HIS A 116 11.178 -13.736 -13.198 1.00 0.00 H new ATOM 0 HB3 HIS A 116 10.311 -12.380 -13.890 1.00 0.00 H new ATOM 0 HD2 HIS A 116 12.592 -15.311 -15.028 1.00 0.00 H new ATOM 0 HE1 HIS A 116 11.072 -13.408 -18.483 1.00 0.00 H new ATOM 0 HE2 HIS A 116 12.364 -15.409 -17.614 1.00 0.00 H new ATOM 1812 N HIS A 117 13.987 -13.173 -12.116 1.00 0.00 N ATOM 1813 CA HIS A 117 15.290 -13.790 -11.824 1.00 0.00 C ATOM 1814 C HIS A 117 15.848 -14.626 -12.969 1.00 0.00 C ATOM 1815 O HIS A 117 15.206 -15.558 -13.464 1.00 0.00 O ATOM 1816 CB HIS A 117 15.311 -14.579 -10.485 1.00 0.00 C ATOM 1817 CG HIS A 117 14.313 -15.707 -10.348 1.00 0.00 C ATOM 1818 ND1 HIS A 117 14.653 -17.044 -10.412 1.00 0.00 N ATOM 1819 CD2 HIS A 117 12.992 -15.677 -10.071 1.00 0.00 C ATOM 1820 CE1 HIS A 117 13.585 -17.776 -10.180 1.00 0.00 C ATOM 1821 NE2 HIS A 117 12.561 -16.970 -9.966 1.00 0.00 N ATOM 0 H HIS A 117 13.315 -13.251 -11.352 1.00 0.00 H new ATOM 0 HA HIS A 117 15.964 -12.942 -11.706 1.00 0.00 H new ATOM 0 HB2 HIS A 117 16.311 -14.990 -10.348 1.00 0.00 H new ATOM 0 HB3 HIS A 117 15.142 -13.874 -9.671 1.00 0.00 H new ATOM 0 HD1 HIS A 117 15.586 -17.407 -10.608 1.00 0.00 H new ATOM 0 HD2 HIS A 117 12.385 -14.791 -9.954 1.00 0.00 H new ATOM 0 HE1 HIS A 117 13.551 -18.855 -10.167 1.00 0.00 H new ATOM 1830 N HIS A 118 17.036 -14.235 -13.399 1.00 0.00 N ATOM 1831 CA HIS A 118 17.762 -14.897 -14.476 1.00 0.00 C ATOM 1832 C HIS A 118 18.200 -16.264 -14.013 1.00 0.00 C ATOM 1833 O HIS A 118 18.248 -17.215 -14.781 1.00 0.00 O ATOM 1834 CB HIS A 118 18.982 -14.064 -14.903 1.00 0.00 C ATOM 1835 CG HIS A 118 18.642 -12.708 -15.458 1.00 0.00 C ATOM 1836 ND1 HIS A 118 18.821 -11.538 -14.756 1.00 0.00 N ATOM 1837 CD2 HIS A 118 18.149 -12.339 -16.660 1.00 0.00 C ATOM 1838 CE1 HIS A 118 18.456 -10.521 -15.497 1.00 0.00 C ATOM 1839 NE2 HIS A 118 18.044 -10.975 -16.659 1.00 0.00 N ATOM 0 H HIS A 118 17.533 -13.436 -13.005 1.00 0.00 H new ATOM 0 HA HIS A 118 17.104 -14.998 -15.339 1.00 0.00 H new ATOM 0 HB2 HIS A 118 19.640 -13.937 -14.043 1.00 0.00 H new ATOM 0 HB3 HIS A 118 19.543 -14.621 -15.654 1.00 0.00 H new ATOM 0 HD2 HIS A 118 17.886 -13.000 -17.473 1.00 0.00 H new ATOM 0 HE1 HIS A 118 18.488 -9.483 -15.202 1.00 0.00 H new ATOM 0 HE2 HIS A 118 17.702 -10.405 -17.433 1.00 0.00 H new ATOM 1848 N HIS A 119 18.523 -16.342 -12.754 1.00 0.00 N ATOM 1849 CA HIS A 119 18.867 -17.568 -12.100 1.00 0.00 C ATOM 1850 C HIS A 119 18.077 -17.624 -10.826 1.00 0.00 C ATOM 1851 O HIS A 119 18.491 -17.022 -9.837 1.00 0.00 O ATOM 1852 CB HIS A 119 20.384 -17.683 -11.813 1.00 0.00 C ATOM 1853 CG HIS A 119 21.239 -17.796 -13.039 1.00 0.00 C ATOM 1854 ND1 HIS A 119 22.364 -17.040 -13.250 1.00 0.00 N ATOM 1855 CD2 HIS A 119 21.132 -18.604 -14.118 1.00 0.00 C ATOM 1856 CE1 HIS A 119 22.904 -17.374 -14.403 1.00 0.00 C ATOM 1857 NE2 HIS A 119 22.176 -18.317 -14.942 1.00 0.00 N ATOM 1858 OXT HIS A 119 16.983 -18.215 -10.823 1.00 0.00 O ATOM 0 H HIS A 119 18.555 -15.530 -12.138 1.00 0.00 H new ATOM 0 HA HIS A 119 18.627 -18.408 -12.752 1.00 0.00 H new ATOM 0 HB2 HIS A 119 20.701 -16.810 -11.243 1.00 0.00 H new ATOM 0 HB3 HIS A 119 20.557 -18.555 -11.182 1.00 0.00 H new ATOM 0 HD2 HIS A 119 20.361 -19.340 -14.293 1.00 0.00 H new ATOM 0 HE1 HIS A 119 23.797 -16.942 -14.831 1.00 0.00 H new ATOM 0 HE2 HIS A 119 22.361 -18.766 -15.839 1.00 0.00 H new TER 1867 HIS A 119