USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 908 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 25:sc= 0.886 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.176 X(o=-0.18,f=0.31) USER MOD Single : A 15 LYS NZ :NH3+ -113:sc=-0.00919 (180deg=-1.6) USER MOD Single : A 18 SER OG : rot 1:sc= -0.541 USER MOD Single : A 21 SER OG : rot 89:sc= 0.351 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 178:sc= -1.93 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 CYS SG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -0.233 K(o=-0.23,f=-1.9!) USER MOD Single : A 43 THR OG1 : rot 28:sc= 0.388 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= -3.09! C(o=-3.1!,f=-4.3!) USER MOD Single : A 49 CYS SG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 86:sc= 1.89 USER MOD Single : A 57 SER OG : rot 92:sc= 1.99 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -0.829 X(o=-0.83,f=-0.82) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 86:sc= 0.00296 USER MOD Single : A 82 THR OG1 : rot -79:sc= 0.874! USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= -0.739 K(o=-0.74,f=-0.0021) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 75:sc= -7.76! USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot -62:sc= 1.14 USER MOD Single : A 101 ASN : amide:sc= -0.381 K(o=-0.38,f=-2.5!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 MET CE :methyl -138:sc= -0.758 (180deg=-3.66!) USER MOD Single : A 107 SER OG : rot -24:sc= 0.0882 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.791 21.516 -6.159 1.00 0.00 N ATOM 2 CA GLY A 1 3.154 21.209 -5.756 1.00 0.00 C ATOM 3 C GLY A 1 3.808 20.234 -6.737 1.00 0.00 C ATOM 4 O GLY A 1 4.161 20.613 -7.853 1.00 0.00 O ATOM 0 H1 GLY A 1 1.369 22.179 -5.478 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.798 21.948 -7.105 1.00 0.00 H new ATOM 0 H3 GLY A 1 1.230 20.640 -6.183 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.738 22.128 -5.707 1.00 0.00 H new ATOM 0 HA3 GLY A 1 3.153 20.778 -4.755 1.00 0.00 H new ATOM 8 N SER A 2 3.953 18.997 -6.284 1.00 0.00 N ATOM 9 CA SER A 2 4.559 17.965 -7.107 1.00 0.00 C ATOM 10 C SER A 2 6.025 18.307 -7.379 1.00 0.00 C ATOM 11 O SER A 2 6.328 19.362 -7.935 1.00 0.00 O ATOM 12 CB SER A 2 3.800 17.795 -8.425 1.00 0.00 C ATOM 13 OG SER A 2 4.039 16.521 -9.017 1.00 0.00 O ATOM 0 H SER A 2 3.661 18.687 -5.357 1.00 0.00 H new ATOM 0 HA SER A 2 4.507 17.021 -6.565 1.00 0.00 H new ATOM 0 HB2 SER A 2 2.732 17.917 -8.247 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.099 18.580 -9.120 1.00 0.00 H new ATOM 0 HG SER A 2 3.536 16.450 -9.855 1.00 0.00 H new ATOM 19 N SER A 3 6.897 17.394 -6.975 1.00 0.00 N ATOM 20 CA SER A 3 8.324 17.586 -7.167 1.00 0.00 C ATOM 21 C SER A 3 9.061 16.257 -6.982 1.00 0.00 C ATOM 22 O SER A 3 8.722 15.475 -6.095 1.00 0.00 O ATOM 23 CB SER A 3 8.874 18.638 -6.204 1.00 0.00 C ATOM 24 OG SER A 3 8.646 18.285 -4.841 1.00 0.00 O ATOM 0 H SER A 3 6.642 16.520 -6.516 1.00 0.00 H new ATOM 0 HA SER A 3 8.486 17.945 -8.183 1.00 0.00 H new ATOM 0 HB2 SER A 3 9.944 18.760 -6.373 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.406 19.600 -6.413 1.00 0.00 H new ATOM 0 HG SER A 3 9.013 18.981 -4.257 1.00 0.00 H new ATOM 30 N GLY A 4 10.054 16.044 -7.831 1.00 0.00 N ATOM 31 CA GLY A 4 10.841 14.824 -7.771 1.00 0.00 C ATOM 32 C GLY A 4 11.816 14.858 -6.591 1.00 0.00 C ATOM 33 O GLY A 4 11.807 15.800 -5.801 1.00 0.00 O ATOM 0 H GLY A 4 10.332 16.696 -8.565 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.178 13.964 -7.675 1.00 0.00 H new ATOM 0 HA3 GLY A 4 11.395 14.698 -8.701 1.00 0.00 H new ATOM 37 N SER A 5 12.632 13.818 -6.510 1.00 0.00 N ATOM 38 CA SER A 5 13.610 13.716 -5.441 1.00 0.00 C ATOM 39 C SER A 5 14.590 12.577 -5.733 1.00 0.00 C ATOM 40 O SER A 5 14.221 11.406 -5.671 1.00 0.00 O ATOM 41 CB SER A 5 12.928 13.494 -4.089 1.00 0.00 C ATOM 42 OG SER A 5 12.255 12.240 -4.030 1.00 0.00 O ATOM 0 H SER A 5 12.636 13.038 -7.168 1.00 0.00 H new ATOM 0 HA SER A 5 14.160 14.656 -5.391 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.673 13.543 -3.295 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.214 14.297 -3.907 1.00 0.00 H new ATOM 0 HG SER A 5 12.667 11.617 -4.665 1.00 0.00 H new ATOM 48 N SER A 6 15.818 12.962 -6.046 1.00 0.00 N ATOM 49 CA SER A 6 16.853 11.988 -6.348 1.00 0.00 C ATOM 50 C SER A 6 16.405 11.090 -7.502 1.00 0.00 C ATOM 51 O SER A 6 15.238 11.110 -7.892 1.00 0.00 O ATOM 52 CB SER A 6 17.191 11.143 -5.118 1.00 0.00 C ATOM 53 OG SER A 6 18.571 10.791 -5.074 1.00 0.00 O ATOM 0 H SER A 6 16.120 13.935 -6.097 1.00 0.00 H new ATOM 0 HA SER A 6 17.754 12.527 -6.643 1.00 0.00 H new ATOM 0 HB2 SER A 6 16.929 11.696 -4.216 1.00 0.00 H new ATOM 0 HB3 SER A 6 16.586 10.236 -5.124 1.00 0.00 H new ATOM 0 HG SER A 6 18.746 10.254 -4.273 1.00 0.00 H new ATOM 59 N GLY A 7 17.355 10.324 -8.017 1.00 0.00 N ATOM 60 CA GLY A 7 17.073 9.420 -9.119 1.00 0.00 C ATOM 61 C GLY A 7 17.636 8.025 -8.843 1.00 0.00 C ATOM 62 O GLY A 7 18.188 7.775 -7.772 1.00 0.00 O ATOM 0 H GLY A 7 18.322 10.311 -7.691 1.00 0.00 H new ATOM 0 HA2 GLY A 7 15.996 9.357 -9.275 1.00 0.00 H new ATOM 0 HA3 GLY A 7 17.506 9.815 -10.038 1.00 0.00 H new ATOM 66 N LEU A 8 17.477 7.151 -9.827 1.00 0.00 N ATOM 67 CA LEU A 8 17.964 5.787 -9.702 1.00 0.00 C ATOM 68 C LEU A 8 17.082 5.026 -8.710 1.00 0.00 C ATOM 69 O LEU A 8 17.513 4.721 -7.599 1.00 0.00 O ATOM 70 CB LEU A 8 19.450 5.779 -9.337 1.00 0.00 C ATOM 71 CG LEU A 8 20.351 6.688 -10.175 1.00 0.00 C ATOM 72 CD1 LEU A 8 21.689 6.929 -9.475 1.00 0.00 C ATOM 73 CD2 LEU A 8 20.534 6.128 -11.587 1.00 0.00 C ATOM 0 H LEU A 8 17.018 7.361 -10.714 1.00 0.00 H new ATOM 0 HA LEU A 8 17.893 5.267 -10.657 1.00 0.00 H new ATOM 0 HB2 LEU A 8 19.548 6.068 -8.291 1.00 0.00 H new ATOM 0 HB3 LEU A 8 19.819 4.757 -9.422 1.00 0.00 H new ATOM 0 HG LEU A 8 19.861 7.657 -10.275 1.00 0.00 H new ATOM 0 HD11 LEU A 8 22.311 7.578 -10.092 1.00 0.00 H new ATOM 0 HD12 LEU A 8 21.514 7.404 -8.510 1.00 0.00 H new ATOM 0 HD13 LEU A 8 22.197 5.977 -9.324 1.00 0.00 H new ATOM 0 HD21 LEU A 8 21.179 6.793 -12.162 1.00 0.00 H new ATOM 0 HD22 LEU A 8 20.991 5.140 -11.530 1.00 0.00 H new ATOM 0 HD23 LEU A 8 19.563 6.051 -12.077 1.00 0.00 H new ATOM 85 N ASN A 9 15.865 4.738 -9.148 1.00 0.00 N ATOM 86 CA ASN A 9 14.920 4.017 -8.312 1.00 0.00 C ATOM 87 C ASN A 9 14.025 3.147 -9.196 1.00 0.00 C ATOM 88 O ASN A 9 13.894 3.399 -10.393 1.00 0.00 O ATOM 89 CB ASN A 9 14.022 4.984 -7.536 1.00 0.00 C ATOM 90 CG ASN A 9 13.163 5.818 -8.489 1.00 0.00 C ATOM 91 OD1 ASN A 9 11.998 5.538 -8.721 1.00 0.00 O ATOM 92 ND2 ASN A 9 13.801 6.855 -9.025 1.00 0.00 N ATOM 0 H ASN A 9 15.512 4.991 -10.071 1.00 0.00 H new ATOM 0 HA ASN A 9 15.488 3.408 -7.608 1.00 0.00 H new ATOM 0 HB2 ASN A 9 13.379 4.424 -6.857 1.00 0.00 H new ATOM 0 HB3 ASN A 9 14.636 5.643 -6.922 1.00 0.00 H new ATOM 0 HD21 ASN A 9 13.314 7.473 -9.674 1.00 0.00 H new ATOM 0 HD22 ASN A 9 14.777 7.032 -8.787 1.00 0.00 H new ATOM 99 N ASP A 10 13.432 2.139 -8.573 1.00 0.00 N ATOM 100 CA ASP A 10 12.553 1.230 -9.288 1.00 0.00 C ATOM 101 C ASP A 10 11.196 1.902 -9.503 1.00 0.00 C ATOM 102 O ASP A 10 10.837 2.830 -8.780 1.00 0.00 O ATOM 103 CB ASP A 10 12.323 -0.055 -8.490 1.00 0.00 C ATOM 104 CG ASP A 10 12.364 -1.344 -9.314 1.00 0.00 C ATOM 105 OD1 ASP A 10 13.267 -1.440 -10.173 1.00 0.00 O ATOM 106 OD2 ASP A 10 11.492 -2.204 -9.065 1.00 0.00 O ATOM 0 H ASP A 10 13.543 1.932 -7.580 1.00 0.00 H new ATOM 0 HA ASP A 10 13.024 0.984 -10.240 1.00 0.00 H new ATOM 0 HB2 ASP A 10 13.078 -0.118 -7.706 1.00 0.00 H new ATOM 0 HB3 ASP A 10 11.354 0.011 -7.995 1.00 0.00 H new ATOM 111 N GLU A 11 10.478 1.408 -10.501 1.00 0.00 N ATOM 112 CA GLU A 11 9.168 1.950 -10.820 1.00 0.00 C ATOM 113 C GLU A 11 8.141 1.503 -9.778 1.00 0.00 C ATOM 114 O GLU A 11 7.581 2.329 -9.059 1.00 0.00 O ATOM 115 CB GLU A 11 8.734 1.540 -12.228 1.00 0.00 C ATOM 116 CG GLU A 11 7.211 1.588 -12.369 1.00 0.00 C ATOM 117 CD GLU A 11 6.796 1.591 -13.841 1.00 0.00 C ATOM 118 OE1 GLU A 11 6.969 2.654 -14.477 1.00 0.00 O ATOM 119 OE2 GLU A 11 6.314 0.533 -14.298 1.00 0.00 O ATOM 0 H GLU A 11 10.779 0.638 -11.099 1.00 0.00 H new ATOM 0 HA GLU A 11 9.231 3.038 -10.797 1.00 0.00 H new ATOM 0 HB2 GLU A 11 9.192 2.204 -12.961 1.00 0.00 H new ATOM 0 HB3 GLU A 11 9.091 0.533 -12.444 1.00 0.00 H new ATOM 0 HG2 GLU A 11 6.768 0.729 -11.865 1.00 0.00 H new ATOM 0 HG3 GLU A 11 6.825 2.481 -11.877 1.00 0.00 H new ATOM 126 N LEU A 12 7.924 0.197 -9.730 1.00 0.00 N ATOM 127 CA LEU A 12 6.973 -0.370 -8.787 1.00 0.00 C ATOM 128 C LEU A 12 7.534 -0.249 -7.369 1.00 0.00 C ATOM 129 O LEU A 12 6.833 0.181 -6.455 1.00 0.00 O ATOM 130 CB LEU A 12 6.613 -1.802 -9.186 1.00 0.00 C ATOM 131 CG LEU A 12 5.298 -1.975 -9.948 1.00 0.00 C ATOM 132 CD1 LEU A 12 5.128 -3.419 -10.429 1.00 0.00 C ATOM 133 CD2 LEU A 12 4.110 -1.510 -9.103 1.00 0.00 C ATOM 0 H LEU A 12 8.390 -0.485 -10.328 1.00 0.00 H new ATOM 0 HA LEU A 12 6.036 0.187 -8.808 1.00 0.00 H new ATOM 0 HB2 LEU A 12 7.421 -2.201 -9.800 1.00 0.00 H new ATOM 0 HB3 LEU A 12 6.569 -2.410 -8.282 1.00 0.00 H new ATOM 0 HG LEU A 12 5.331 -1.342 -10.835 1.00 0.00 H new ATOM 0 HD11 LEU A 12 4.185 -3.514 -10.968 1.00 0.00 H new ATOM 0 HD12 LEU A 12 5.953 -3.681 -11.092 1.00 0.00 H new ATOM 0 HD13 LEU A 12 5.125 -4.091 -9.570 1.00 0.00 H new ATOM 0 HD21 LEU A 12 3.187 -1.644 -9.668 1.00 0.00 H new ATOM 0 HD22 LEU A 12 4.063 -2.098 -8.187 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.232 -0.456 -8.852 1.00 0.00 H new ATOM 145 N LEU A 13 8.794 -0.635 -7.230 1.00 0.00 N ATOM 146 CA LEU A 13 9.457 -0.575 -5.938 1.00 0.00 C ATOM 147 C LEU A 13 9.524 0.880 -5.471 1.00 0.00 C ATOM 148 O LEU A 13 9.687 1.790 -6.283 1.00 0.00 O ATOM 149 CB LEU A 13 10.822 -1.262 -6.005 1.00 0.00 C ATOM 150 CG LEU A 13 11.053 -2.392 -4.999 1.00 0.00 C ATOM 151 CD1 LEU A 13 12.465 -2.969 -5.137 1.00 0.00 C ATOM 152 CD2 LEU A 13 10.762 -1.924 -3.572 1.00 0.00 C ATOM 0 H LEU A 13 9.373 -0.990 -7.991 1.00 0.00 H new ATOM 0 HA LEU A 13 8.885 -1.124 -5.190 1.00 0.00 H new ATOM 0 HB2 LEU A 13 10.956 -1.663 -7.010 1.00 0.00 H new ATOM 0 HB3 LEU A 13 11.594 -0.507 -5.858 1.00 0.00 H new ATOM 0 HG LEU A 13 10.353 -3.197 -5.223 1.00 0.00 H new ATOM 0 HD11 LEU A 13 12.603 -3.770 -4.411 1.00 0.00 H new ATOM 0 HD12 LEU A 13 12.600 -3.364 -6.144 1.00 0.00 H new ATOM 0 HD13 LEU A 13 13.198 -2.184 -4.955 1.00 0.00 H new ATOM 0 HD21 LEU A 13 10.934 -2.746 -2.877 1.00 0.00 H new ATOM 0 HD22 LEU A 13 11.420 -1.093 -3.320 1.00 0.00 H new ATOM 0 HD23 LEU A 13 9.724 -1.599 -3.500 1.00 0.00 H new ATOM 164 N GLY A 14 9.393 1.055 -4.165 1.00 0.00 N ATOM 165 CA GLY A 14 9.437 2.385 -3.579 1.00 0.00 C ATOM 166 C GLY A 14 8.236 3.220 -4.028 1.00 0.00 C ATOM 167 O GLY A 14 8.251 4.445 -3.915 1.00 0.00 O ATOM 0 H GLY A 14 9.256 0.298 -3.495 1.00 0.00 H new ATOM 0 HA2 GLY A 14 9.445 2.308 -2.492 1.00 0.00 H new ATOM 0 HA3 GLY A 14 10.361 2.884 -3.870 1.00 0.00 H new ATOM 171 N LYS A 15 7.226 2.525 -4.530 1.00 0.00 N ATOM 172 CA LYS A 15 6.020 3.188 -4.996 1.00 0.00 C ATOM 173 C LYS A 15 4.797 2.498 -4.390 1.00 0.00 C ATOM 174 O LYS A 15 4.858 1.324 -4.027 1.00 0.00 O ATOM 175 CB LYS A 15 5.998 3.247 -6.525 1.00 0.00 C ATOM 176 CG LYS A 15 4.783 2.508 -7.085 1.00 0.00 C ATOM 177 CD LYS A 15 4.546 2.874 -8.552 1.00 0.00 C ATOM 178 CE LYS A 15 3.755 1.778 -9.270 1.00 0.00 C ATOM 179 NZ LYS A 15 2.950 2.356 -10.369 1.00 0.00 N ATOM 0 H LYS A 15 7.218 1.509 -4.624 1.00 0.00 H new ATOM 0 HA LYS A 15 6.001 4.225 -4.659 1.00 0.00 H new ATOM 0 HB2 LYS A 15 5.978 4.287 -6.852 1.00 0.00 H new ATOM 0 HB3 LYS A 15 6.912 2.805 -6.923 1.00 0.00 H new ATOM 0 HG2 LYS A 15 4.934 1.432 -6.995 1.00 0.00 H new ATOM 0 HG3 LYS A 15 3.899 2.756 -6.497 1.00 0.00 H new ATOM 0 HD2 LYS A 15 4.004 3.818 -8.612 1.00 0.00 H new ATOM 0 HD3 LYS A 15 5.503 3.024 -9.052 1.00 0.00 H new ATOM 0 HE2 LYS A 15 4.439 1.029 -9.668 1.00 0.00 H new ATOM 0 HE3 LYS A 15 3.102 1.269 -8.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 1.939 2.267 -10.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 3.192 3.361 -10.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 3.153 1.847 -11.253 1.00 0.00 H new ATOM 193 N VAL A 16 3.714 3.256 -4.300 1.00 0.00 N ATOM 194 CA VAL A 16 2.478 2.731 -3.745 1.00 0.00 C ATOM 195 C VAL A 16 1.838 1.773 -4.750 1.00 0.00 C ATOM 196 O VAL A 16 1.778 2.068 -5.943 1.00 0.00 O ATOM 197 CB VAL A 16 1.554 3.883 -3.345 1.00 0.00 C ATOM 198 CG1 VAL A 16 0.105 3.407 -3.220 1.00 0.00 C ATOM 199 CG2 VAL A 16 2.027 4.541 -2.046 1.00 0.00 C ATOM 0 H VAL A 16 3.667 4.229 -4.602 1.00 0.00 H new ATOM 0 HA VAL A 16 2.679 2.162 -2.837 1.00 0.00 H new ATOM 0 HB VAL A 16 1.594 4.633 -4.135 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -0.530 4.246 -2.935 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -0.230 3.007 -4.177 1.00 0.00 H new ATOM 0 HG13 VAL A 16 0.042 2.629 -2.459 1.00 0.00 H new ATOM 0 HG21 VAL A 16 1.353 5.356 -1.785 1.00 0.00 H new ATOM 0 HG22 VAL A 16 2.031 3.802 -1.244 1.00 0.00 H new ATOM 0 HG23 VAL A 16 3.035 4.933 -2.183 1.00 0.00 H new ATOM 209 N VAL A 17 1.374 0.645 -4.232 1.00 0.00 N ATOM 210 CA VAL A 17 0.741 -0.358 -5.071 1.00 0.00 C ATOM 211 C VAL A 17 -0.505 -0.895 -4.363 1.00 0.00 C ATOM 212 O VAL A 17 -0.632 -0.773 -3.146 1.00 0.00 O ATOM 213 CB VAL A 17 1.746 -1.456 -5.425 1.00 0.00 C ATOM 214 CG1 VAL A 17 2.801 -0.937 -6.404 1.00 0.00 C ATOM 215 CG2 VAL A 17 2.401 -2.027 -4.165 1.00 0.00 C ATOM 0 H VAL A 17 1.424 0.404 -3.242 1.00 0.00 H new ATOM 0 HA VAL A 17 0.417 0.083 -6.014 1.00 0.00 H new ATOM 0 HB VAL A 17 1.202 -2.264 -5.915 1.00 0.00 H new ATOM 0 HG11 VAL A 17 3.503 -1.737 -6.640 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.314 -0.600 -7.319 1.00 0.00 H new ATOM 0 HG13 VAL A 17 3.338 -0.104 -5.952 1.00 0.00 H new ATOM 0 HG21 VAL A 17 3.111 -2.805 -4.445 1.00 0.00 H new ATOM 0 HG22 VAL A 17 2.925 -1.232 -3.635 1.00 0.00 H new ATOM 0 HG23 VAL A 17 1.634 -2.451 -3.517 1.00 0.00 H new ATOM 225 N SER A 18 -1.393 -1.479 -5.156 1.00 0.00 N ATOM 226 CA SER A 18 -2.623 -2.034 -4.621 1.00 0.00 C ATOM 227 C SER A 18 -2.507 -3.556 -4.512 1.00 0.00 C ATOM 228 O SER A 18 -2.153 -4.226 -5.481 1.00 0.00 O ATOM 229 CB SER A 18 -3.823 -1.654 -5.491 1.00 0.00 C ATOM 230 OG SER A 18 -3.599 -1.948 -6.868 1.00 0.00 O ATOM 0 H SER A 18 -1.284 -1.579 -6.165 1.00 0.00 H new ATOM 0 HA SER A 18 -2.782 -1.616 -3.627 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.706 -2.191 -5.145 1.00 0.00 H new ATOM 0 HB3 SER A 18 -4.031 -0.590 -5.377 1.00 0.00 H new ATOM 0 HG SER A 18 -2.711 -2.349 -6.977 1.00 0.00 H new ATOM 236 N VAL A 19 -2.811 -4.058 -3.324 1.00 0.00 N ATOM 237 CA VAL A 19 -2.745 -5.488 -3.076 1.00 0.00 C ATOM 238 C VAL A 19 -4.151 -6.082 -3.167 1.00 0.00 C ATOM 239 O VAL A 19 -5.087 -5.567 -2.557 1.00 0.00 O ATOM 240 CB VAL A 19 -2.068 -5.755 -1.731 1.00 0.00 C ATOM 241 CG1 VAL A 19 -1.853 -7.254 -1.513 1.00 0.00 C ATOM 242 CG2 VAL A 19 -0.748 -4.990 -1.619 1.00 0.00 C ATOM 0 H VAL A 19 -3.104 -3.499 -2.522 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.135 -5.980 -3.834 1.00 0.00 H new ATOM 0 HB VAL A 19 -2.732 -5.394 -0.945 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -1.370 -7.416 -0.549 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -2.815 -7.765 -1.527 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -1.220 -7.650 -2.307 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -0.288 -5.198 -0.653 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -0.076 -5.306 -2.417 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -0.939 -3.920 -1.707 1.00 0.00 H new ATOM 252 N VAL A 20 -4.256 -7.158 -3.934 1.00 0.00 N ATOM 253 CA VAL A 20 -5.534 -7.829 -4.112 1.00 0.00 C ATOM 254 C VAL A 20 -5.674 -8.935 -3.065 1.00 0.00 C ATOM 255 O VAL A 20 -4.772 -9.754 -2.897 1.00 0.00 O ATOM 256 CB VAL A 20 -5.658 -8.343 -5.547 1.00 0.00 C ATOM 257 CG1 VAL A 20 -7.070 -8.866 -5.821 1.00 0.00 C ATOM 258 CG2 VAL A 20 -5.269 -7.260 -6.554 1.00 0.00 C ATOM 0 H VAL A 20 -3.478 -7.582 -4.439 1.00 0.00 H new ATOM 0 HA VAL A 20 -6.358 -7.132 -3.959 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.963 -9.174 -5.666 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -7.132 -9.226 -6.848 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -7.294 -9.684 -5.136 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -7.791 -8.062 -5.674 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -5.366 -7.653 -7.566 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -5.926 -6.399 -6.434 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -4.237 -6.956 -6.381 1.00 0.00 H new ATOM 268 N SER A 21 -6.813 -8.924 -2.388 1.00 0.00 N ATOM 269 CA SER A 21 -7.083 -9.917 -1.362 1.00 0.00 C ATOM 270 C SER A 21 -7.429 -11.260 -2.011 1.00 0.00 C ATOM 271 O SER A 21 -8.377 -11.351 -2.788 1.00 0.00 O ATOM 272 CB SER A 21 -8.220 -9.464 -0.443 1.00 0.00 C ATOM 273 OG SER A 21 -7.879 -8.288 0.286 1.00 0.00 O ATOM 0 H SER A 21 -7.559 -8.243 -2.530 1.00 0.00 H new ATOM 0 HA SER A 21 -6.185 -10.034 -0.755 1.00 0.00 H new ATOM 0 HB2 SER A 21 -9.114 -9.276 -1.038 1.00 0.00 H new ATOM 0 HB3 SER A 21 -8.464 -10.265 0.255 1.00 0.00 H new ATOM 0 HG SER A 21 -8.123 -7.496 -0.238 1.00 0.00 H new ATOM 279 N ALA A 22 -6.640 -12.267 -1.666 1.00 0.00 N ATOM 280 CA ALA A 22 -6.850 -13.599 -2.205 1.00 0.00 C ATOM 281 C ALA A 22 -8.206 -14.128 -1.734 1.00 0.00 C ATOM 282 O ALA A 22 -8.783 -15.015 -2.361 1.00 0.00 O ATOM 283 CB ALA A 22 -5.693 -14.509 -1.785 1.00 0.00 C ATOM 0 H ALA A 22 -5.855 -12.187 -1.020 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.866 -13.573 -3.295 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.851 -15.509 -2.190 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -4.756 -14.106 -2.169 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.647 -14.561 -0.697 1.00 0.00 H new ATOM 289 N THR A 23 -8.676 -13.560 -0.633 1.00 0.00 N ATOM 290 CA THR A 23 -9.954 -13.962 -0.070 1.00 0.00 C ATOM 291 C THR A 23 -11.086 -13.122 -0.664 1.00 0.00 C ATOM 292 O THR A 23 -12.220 -13.588 -0.768 1.00 0.00 O ATOM 293 CB THR A 23 -9.854 -13.857 1.453 1.00 0.00 C ATOM 294 OG1 THR A 23 -8.966 -14.911 1.816 1.00 0.00 O ATOM 295 CG2 THR A 23 -11.167 -14.219 2.152 1.00 0.00 C ATOM 0 H THR A 23 -8.195 -12.824 -0.116 1.00 0.00 H new ATOM 0 HA THR A 23 -10.191 -14.995 -0.324 1.00 0.00 H new ATOM 0 HB THR A 23 -9.563 -12.843 1.729 1.00 0.00 H new ATOM 0 HG1 THR A 23 -8.843 -14.915 2.788 1.00 0.00 H new ATOM 0 HG21 THR A 23 -11.042 -14.128 3.231 1.00 0.00 H new ATOM 0 HG22 THR A 23 -11.955 -13.543 1.820 1.00 0.00 H new ATOM 0 HG23 THR A 23 -11.441 -15.244 1.904 1.00 0.00 H new ATOM 303 N GLU A 24 -10.740 -11.899 -1.037 1.00 0.00 N ATOM 304 CA GLU A 24 -11.713 -10.990 -1.618 1.00 0.00 C ATOM 305 C GLU A 24 -11.049 -10.109 -2.678 1.00 0.00 C ATOM 306 O GLU A 24 -10.757 -8.941 -2.425 1.00 0.00 O ATOM 307 CB GLU A 24 -12.381 -10.139 -0.537 1.00 0.00 C ATOM 308 CG GLU A 24 -11.378 -9.747 0.550 1.00 0.00 C ATOM 309 CD GLU A 24 -12.094 -9.174 1.776 1.00 0.00 C ATOM 310 OE1 GLU A 24 -13.306 -8.896 1.647 1.00 0.00 O ATOM 311 OE2 GLU A 24 -11.412 -9.027 2.813 1.00 0.00 O ATOM 0 H GLU A 24 -9.799 -11.516 -0.948 1.00 0.00 H new ATOM 0 HA GLU A 24 -12.491 -11.581 -2.101 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -12.805 -9.241 -0.986 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -13.207 -10.693 -0.092 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -10.792 -10.619 0.841 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -10.678 -9.010 0.156 1.00 0.00 H new ATOM 318 N ARG A 25 -10.832 -10.700 -3.843 1.00 0.00 N ATOM 319 CA ARG A 25 -10.209 -9.984 -4.942 1.00 0.00 C ATOM 320 C ARG A 25 -10.675 -8.527 -4.958 1.00 0.00 C ATOM 321 O ARG A 25 -9.918 -7.633 -5.335 1.00 0.00 O ATOM 322 CB ARG A 25 -10.546 -10.634 -6.285 1.00 0.00 C ATOM 323 CG ARG A 25 -9.941 -12.035 -6.383 1.00 0.00 C ATOM 324 CD ARG A 25 -8.431 -11.967 -6.617 1.00 0.00 C ATOM 325 NE ARG A 25 -7.932 -13.274 -7.100 1.00 0.00 N ATOM 326 CZ ARG A 25 -8.201 -13.778 -8.311 1.00 0.00 C ATOM 327 NH1 ARG A 25 -8.963 -13.090 -9.171 1.00 0.00 N ATOM 328 NH2 ARG A 25 -7.705 -14.973 -8.664 1.00 0.00 N ATOM 0 H ARG A 25 -11.077 -11.668 -4.050 1.00 0.00 H new ATOM 0 HA ARG A 25 -9.130 -10.023 -4.793 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -11.628 -10.692 -6.404 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -10.169 -10.014 -7.098 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -10.146 -12.588 -5.466 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -10.414 -12.583 -7.198 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -8.203 -11.190 -7.346 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -7.924 -11.695 -5.692 1.00 0.00 H new ATOM 0 HE ARG A 25 -7.347 -13.825 -6.472 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -9.340 -12.180 -8.904 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -9.167 -13.476 -10.093 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -7.123 -15.497 -8.010 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -7.909 -15.358 -9.586 1.00 0.00 H new ATOM 342 N THR A 26 -11.918 -8.331 -4.542 1.00 0.00 N ATOM 343 CA THR A 26 -12.493 -6.998 -4.504 1.00 0.00 C ATOM 344 C THR A 26 -11.686 -6.095 -3.570 1.00 0.00 C ATOM 345 O THR A 26 -11.070 -5.128 -4.016 1.00 0.00 O ATOM 346 CB THR A 26 -13.964 -7.129 -4.100 1.00 0.00 C ATOM 347 OG1 THR A 26 -14.652 -7.283 -5.339 1.00 0.00 O ATOM 348 CG2 THR A 26 -14.529 -5.832 -3.519 1.00 0.00 C ATOM 0 H THR A 26 -12.543 -9.074 -4.228 1.00 0.00 H new ATOM 0 HA THR A 26 -12.450 -6.521 -5.483 1.00 0.00 H new ATOM 0 HB THR A 26 -14.070 -7.930 -3.369 1.00 0.00 H new ATOM 0 HG1 THR A 26 -15.613 -7.377 -5.170 1.00 0.00 H new ATOM 0 HG21 THR A 26 -15.575 -5.979 -3.249 1.00 0.00 H new ATOM 0 HG22 THR A 26 -13.961 -5.553 -2.632 1.00 0.00 H new ATOM 0 HG23 THR A 26 -14.455 -5.038 -4.262 1.00 0.00 H new ATOM 356 N GLU A 27 -11.714 -6.442 -2.292 1.00 0.00 N ATOM 357 CA GLU A 27 -10.991 -5.676 -1.292 1.00 0.00 C ATOM 358 C GLU A 27 -9.512 -5.576 -1.666 1.00 0.00 C ATOM 359 O GLU A 27 -8.869 -6.587 -1.947 1.00 0.00 O ATOM 360 CB GLU A 27 -11.165 -6.288 0.100 1.00 0.00 C ATOM 361 CG GLU A 27 -12.022 -5.389 0.992 1.00 0.00 C ATOM 362 CD GLU A 27 -11.157 -4.362 1.728 1.00 0.00 C ATOM 363 OE1 GLU A 27 -10.116 -4.785 2.273 1.00 0.00 O ATOM 364 OE2 GLU A 27 -11.558 -3.178 1.726 1.00 0.00 O ATOM 0 H GLU A 27 -12.227 -7.244 -1.926 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.407 -4.669 -1.264 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -11.630 -7.270 0.014 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -10.188 -6.437 0.560 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.768 -4.874 0.386 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.564 -5.998 1.715 1.00 0.00 H new ATOM 371 N TRP A 28 -9.014 -4.348 -1.658 1.00 0.00 N ATOM 372 CA TRP A 28 -7.621 -4.103 -1.994 1.00 0.00 C ATOM 373 C TRP A 28 -7.092 -3.016 -1.055 1.00 0.00 C ATOM 374 O TRP A 28 -7.820 -2.089 -0.701 1.00 0.00 O ATOM 375 CB TRP A 28 -7.468 -3.742 -3.473 1.00 0.00 C ATOM 376 CG TRP A 28 -7.936 -2.327 -3.819 1.00 0.00 C ATOM 377 CD1 TRP A 28 -9.135 -1.944 -4.280 1.00 0.00 C ATOM 378 CD2 TRP A 28 -7.160 -1.115 -3.712 1.00 0.00 C ATOM 379 NE1 TRP A 28 -9.188 -0.578 -4.477 1.00 0.00 N ATOM 380 CE2 TRP A 28 -7.949 -0.059 -4.121 1.00 0.00 C ATOM 381 CE3 TRP A 28 -5.835 -0.917 -3.285 1.00 0.00 C ATOM 382 CZ2 TRP A 28 -7.503 1.268 -4.143 1.00 0.00 C ATOM 383 CZ3 TRP A 28 -5.404 0.415 -3.313 1.00 0.00 C ATOM 384 CH2 TRP A 28 -6.186 1.489 -3.721 1.00 0.00 C ATOM 0 H TRP A 28 -9.550 -3.512 -1.424 1.00 0.00 H new ATOM 0 HA TRP A 28 -7.026 -5.005 -1.852 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -6.420 -3.847 -3.756 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -8.033 -4.457 -4.071 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -9.956 -2.619 -4.473 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -9.989 -0.048 -4.820 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -5.200 -1.728 -2.961 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -8.140 2.077 -4.468 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -4.393 0.622 -2.995 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -5.780 2.490 -3.713 1.00 0.00 H new ATOM 395 N TYR A 29 -5.831 -3.167 -0.679 1.00 0.00 N ATOM 396 CA TYR A 29 -5.198 -2.209 0.212 1.00 0.00 C ATOM 397 C TYR A 29 -3.845 -1.756 -0.343 1.00 0.00 C ATOM 398 O TYR A 29 -3.135 -2.538 -0.973 1.00 0.00 O ATOM 399 CB TYR A 29 -4.971 -2.948 1.533 1.00 0.00 C ATOM 400 CG TYR A 29 -3.545 -3.468 1.718 1.00 0.00 C ATOM 401 CD1 TYR A 29 -2.592 -2.671 2.320 1.00 0.00 C ATOM 402 CD2 TYR A 29 -3.211 -4.735 1.285 1.00 0.00 C ATOM 403 CE1 TYR A 29 -1.249 -3.162 2.494 1.00 0.00 C ATOM 404 CE2 TYR A 29 -1.869 -5.226 1.460 1.00 0.00 C ATOM 405 CZ TYR A 29 -0.954 -4.415 2.055 1.00 0.00 C ATOM 406 OH TYR A 29 0.314 -4.878 2.221 1.00 0.00 O ATOM 0 H TYR A 29 -5.231 -3.937 -0.974 1.00 0.00 H new ATOM 0 HA TYR A 29 -5.822 -1.323 0.330 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -5.212 -2.278 2.358 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -5.663 -3.788 1.591 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -2.853 -1.680 2.660 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -3.957 -5.359 0.815 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -0.493 -2.549 2.963 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -1.595 -6.216 1.126 1.00 0.00 H new ATOM 0 HH TYR A 29 0.372 -5.799 1.891 1.00 0.00 H new ATOM 416 N PRO A 30 -3.522 -0.461 -0.082 1.00 0.00 N ATOM 417 CA PRO A 30 -2.267 0.105 -0.549 1.00 0.00 C ATOM 418 C PRO A 30 -1.093 -0.394 0.296 1.00 0.00 C ATOM 419 O PRO A 30 -1.252 -0.677 1.481 1.00 0.00 O ATOM 420 CB PRO A 30 -2.461 1.611 -0.465 1.00 0.00 C ATOM 421 CG PRO A 30 -3.634 1.829 0.477 1.00 0.00 C ATOM 422 CD PRO A 30 -4.339 0.494 0.661 1.00 0.00 C ATOM 0 HA PRO A 30 -2.022 -0.196 -1.567 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -1.562 2.100 -0.089 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -2.666 2.034 -1.449 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -3.287 2.213 1.436 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -4.320 2.570 0.067 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -4.405 0.223 1.715 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.358 0.528 0.276 1.00 0.00 H new ATOM 430 N ALA A 31 0.061 -0.488 -0.350 1.00 0.00 N ATOM 431 CA ALA A 31 1.261 -0.947 0.327 1.00 0.00 C ATOM 432 C ALA A 31 2.489 -0.547 -0.494 1.00 0.00 C ATOM 433 O ALA A 31 2.476 -0.631 -1.721 1.00 0.00 O ATOM 434 CB ALA A 31 1.175 -2.460 0.546 1.00 0.00 C ATOM 0 H ALA A 31 0.189 -0.254 -1.334 1.00 0.00 H new ATOM 0 HA ALA A 31 1.352 -0.479 1.307 1.00 0.00 H new ATOM 0 HB1 ALA A 31 2.075 -2.806 1.054 1.00 0.00 H new ATOM 0 HB2 ALA A 31 0.302 -2.690 1.157 1.00 0.00 H new ATOM 0 HB3 ALA A 31 1.086 -2.963 -0.417 1.00 0.00 H new ATOM 440 N LEU A 32 3.521 -0.118 0.218 1.00 0.00 N ATOM 441 CA LEU A 32 4.755 0.297 -0.428 1.00 0.00 C ATOM 442 C LEU A 32 5.727 -0.883 -0.469 1.00 0.00 C ATOM 443 O LEU A 32 6.168 -1.364 0.573 1.00 0.00 O ATOM 444 CB LEU A 32 5.326 1.542 0.255 1.00 0.00 C ATOM 445 CG LEU A 32 6.525 2.195 -0.436 1.00 0.00 C ATOM 446 CD1 LEU A 32 6.174 2.611 -1.866 1.00 0.00 C ATOM 447 CD2 LEU A 32 7.058 3.369 0.387 1.00 0.00 C ATOM 0 H LEU A 32 3.528 -0.049 1.236 1.00 0.00 H new ATOM 0 HA LEU A 32 4.564 0.588 -1.461 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.531 2.283 0.338 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.619 1.273 1.270 1.00 0.00 H new ATOM 0 HG LEU A 32 7.325 1.458 -0.502 1.00 0.00 H new ATOM 0 HD11 LEU A 32 7.043 3.072 -2.334 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.877 1.732 -2.438 1.00 0.00 H new ATOM 0 HD13 LEU A 32 5.351 3.325 -1.845 1.00 0.00 H new ATOM 0 HD21 LEU A 32 7.910 3.816 -0.126 1.00 0.00 H new ATOM 0 HD22 LEU A 32 6.273 4.116 0.506 1.00 0.00 H new ATOM 0 HD23 LEU A 32 7.371 3.013 1.368 1.00 0.00 H new ATOM 459 N VAL A 33 6.032 -1.316 -1.683 1.00 0.00 N ATOM 460 CA VAL A 33 6.945 -2.431 -1.872 1.00 0.00 C ATOM 461 C VAL A 33 8.321 -2.059 -1.318 1.00 0.00 C ATOM 462 O VAL A 33 8.687 -0.885 -1.294 1.00 0.00 O ATOM 463 CB VAL A 33 6.983 -2.831 -3.349 1.00 0.00 C ATOM 464 CG1 VAL A 33 8.072 -3.875 -3.606 1.00 0.00 C ATOM 465 CG2 VAL A 33 5.617 -3.337 -3.816 1.00 0.00 C ATOM 0 H VAL A 33 5.663 -0.915 -2.546 1.00 0.00 H new ATOM 0 HA VAL A 33 6.599 -3.305 -1.320 1.00 0.00 H new ATOM 0 HB VAL A 33 7.227 -1.942 -3.931 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.078 -4.142 -4.663 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.043 -3.463 -3.330 1.00 0.00 H new ATOM 0 HG13 VAL A 33 7.872 -4.764 -3.008 1.00 0.00 H new ATOM 0 HG21 VAL A 33 5.672 -3.614 -4.869 1.00 0.00 H new ATOM 0 HG22 VAL A 33 5.330 -4.207 -3.226 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.874 -2.550 -3.687 1.00 0.00 H new ATOM 475 N ILE A 34 9.045 -3.081 -0.886 1.00 0.00 N ATOM 476 CA ILE A 34 10.374 -2.876 -0.333 1.00 0.00 C ATOM 477 C ILE A 34 11.146 -4.197 -0.369 1.00 0.00 C ATOM 478 O ILE A 34 10.638 -5.204 -0.860 1.00 0.00 O ATOM 479 CB ILE A 34 10.282 -2.254 1.062 1.00 0.00 C ATOM 480 CG1 ILE A 34 9.225 -2.963 1.911 1.00 0.00 C ATOM 481 CG2 ILE A 34 10.032 -0.747 0.974 1.00 0.00 C ATOM 482 CD1 ILE A 34 9.272 -2.479 3.361 1.00 0.00 C ATOM 0 H ILE A 34 8.737 -4.053 -0.907 1.00 0.00 H new ATOM 0 HA ILE A 34 10.934 -2.163 -0.938 1.00 0.00 H new ATOM 0 HB ILE A 34 11.241 -2.393 1.562 1.00 0.00 H new ATOM 0 HG12 ILE A 34 8.235 -2.779 1.494 1.00 0.00 H new ATOM 0 HG13 ILE A 34 9.389 -4.040 1.878 1.00 0.00 H new ATOM 0 HG21 ILE A 34 9.971 -0.329 1.979 1.00 0.00 H new ATOM 0 HG22 ILE A 34 10.851 -0.273 0.433 1.00 0.00 H new ATOM 0 HG23 ILE A 34 9.096 -0.564 0.447 1.00 0.00 H new ATOM 0 HD11 ILE A 34 8.511 -2.999 3.943 1.00 0.00 H new ATOM 0 HD12 ILE A 34 10.256 -2.687 3.782 1.00 0.00 H new ATOM 0 HD13 ILE A 34 9.083 -1.406 3.393 1.00 0.00 H new ATOM 494 N SER A 35 12.361 -4.149 0.158 1.00 0.00 N ATOM 495 CA SER A 35 13.207 -5.329 0.193 1.00 0.00 C ATOM 496 C SER A 35 13.553 -5.682 1.641 1.00 0.00 C ATOM 497 O SER A 35 13.868 -4.801 2.441 1.00 0.00 O ATOM 498 CB SER A 35 14.485 -5.114 -0.620 1.00 0.00 C ATOM 499 OG SER A 35 15.352 -6.244 -0.562 1.00 0.00 O ATOM 0 H SER A 35 12.779 -3.312 0.564 1.00 0.00 H new ATOM 0 HA SER A 35 12.658 -6.157 -0.255 1.00 0.00 H new ATOM 0 HB2 SER A 35 14.224 -4.910 -1.659 1.00 0.00 H new ATOM 0 HB3 SER A 35 15.010 -4.235 -0.245 1.00 0.00 H new ATOM 0 HG SER A 35 16.155 -6.068 -1.095 1.00 0.00 H new ATOM 505 N PRO A 36 13.482 -7.006 1.943 1.00 0.00 N ATOM 506 CA PRO A 36 13.785 -7.487 3.280 1.00 0.00 C ATOM 507 C PRO A 36 15.292 -7.473 3.540 1.00 0.00 C ATOM 508 O PRO A 36 15.991 -8.432 3.214 1.00 0.00 O ATOM 509 CB PRO A 36 13.184 -8.881 3.343 1.00 0.00 C ATOM 510 CG PRO A 36 12.977 -9.311 1.900 1.00 0.00 C ATOM 511 CD PRO A 36 13.113 -8.077 1.022 1.00 0.00 C ATOM 0 HA PRO A 36 13.365 -6.852 4.060 1.00 0.00 H new ATOM 0 HB2 PRO A 36 13.849 -9.570 3.864 1.00 0.00 H new ATOM 0 HB3 PRO A 36 12.240 -8.875 3.888 1.00 0.00 H new ATOM 0 HG2 PRO A 36 13.712 -10.064 1.617 1.00 0.00 H new ATOM 0 HG3 PRO A 36 11.993 -9.763 1.774 1.00 0.00 H new ATOM 0 HD2 PRO A 36 13.874 -8.219 0.254 1.00 0.00 H new ATOM 0 HD3 PRO A 36 12.179 -7.852 0.507 1.00 0.00 H new ATOM 519 N SER A 37 15.750 -6.376 4.125 1.00 0.00 N ATOM 520 CA SER A 37 17.163 -6.225 4.432 1.00 0.00 C ATOM 521 C SER A 37 17.424 -6.605 5.891 1.00 0.00 C ATOM 522 O SER A 37 18.241 -7.481 6.171 1.00 0.00 O ATOM 523 CB SER A 37 17.636 -4.795 4.163 1.00 0.00 C ATOM 524 OG SER A 37 19.056 -4.705 4.103 1.00 0.00 O ATOM 0 H SER A 37 15.168 -5.583 4.395 1.00 0.00 H new ATOM 0 HA SER A 37 17.728 -6.893 3.782 1.00 0.00 H new ATOM 0 HB2 SER A 37 17.210 -4.443 3.223 1.00 0.00 H new ATOM 0 HB3 SER A 37 17.264 -4.136 4.948 1.00 0.00 H new ATOM 0 HG SER A 37 19.318 -3.777 3.928 1.00 0.00 H new ATOM 530 N CYS A 38 16.716 -5.927 6.782 1.00 0.00 N ATOM 531 CA CYS A 38 16.861 -6.183 8.205 1.00 0.00 C ATOM 532 C CYS A 38 16.054 -7.435 8.554 1.00 0.00 C ATOM 533 O CYS A 38 16.595 -8.395 9.099 1.00 0.00 O ATOM 534 CB CYS A 38 16.433 -4.976 9.043 1.00 0.00 C ATOM 535 SG CYS A 38 17.810 -3.776 9.161 1.00 0.00 S ATOM 0 H CYS A 38 16.040 -5.200 6.546 1.00 0.00 H new ATOM 0 HA CYS A 38 17.912 -6.353 8.441 1.00 0.00 H new ATOM 0 HB2 CYS A 38 15.562 -4.500 8.592 1.00 0.00 H new ATOM 0 HB3 CYS A 38 16.137 -5.302 10.040 1.00 0.00 H new ATOM 0 HG CYS A 38 17.436 -2.754 9.872 1.00 0.00 H new ATOM 541 N ASN A 39 14.772 -7.384 8.223 1.00 0.00 N ATOM 542 CA ASN A 39 13.884 -8.502 8.494 1.00 0.00 C ATOM 543 C ASN A 39 14.540 -9.797 8.012 1.00 0.00 C ATOM 544 O ASN A 39 15.160 -9.825 6.950 1.00 0.00 O ATOM 545 CB ASN A 39 12.554 -8.342 7.755 1.00 0.00 C ATOM 546 CG ASN A 39 11.417 -8.035 8.731 1.00 0.00 C ATOM 547 OD1 ASN A 39 11.629 -7.646 9.868 1.00 0.00 O ATOM 548 ND2 ASN A 39 10.202 -8.232 8.226 1.00 0.00 N ATOM 0 H ASN A 39 14.327 -6.586 7.770 1.00 0.00 H new ATOM 0 HA ASN A 39 13.698 -8.532 9.568 1.00 0.00 H new ATOM 0 HB2 ASN A 39 12.636 -7.539 7.022 1.00 0.00 H new ATOM 0 HB3 ASN A 39 12.328 -9.255 7.204 1.00 0.00 H new ATOM 0 HD21 ASN A 39 9.377 -8.056 8.799 1.00 0.00 H new ATOM 0 HD22 ASN A 39 10.096 -8.559 7.266 1.00 0.00 H new ATOM 555 N ASP A 40 14.382 -10.839 8.815 1.00 0.00 N ATOM 556 CA ASP A 40 14.952 -12.133 8.483 1.00 0.00 C ATOM 557 C ASP A 40 13.922 -13.228 8.771 1.00 0.00 C ATOM 558 O ASP A 40 13.500 -13.942 7.862 1.00 0.00 O ATOM 559 CB ASP A 40 16.195 -12.421 9.329 1.00 0.00 C ATOM 560 CG ASP A 40 17.525 -12.298 8.583 1.00 0.00 C ATOM 561 OD1 ASP A 40 17.547 -12.678 7.393 1.00 0.00 O ATOM 562 OD2 ASP A 40 18.491 -11.826 9.221 1.00 0.00 O ATOM 0 H ASP A 40 13.867 -10.813 9.695 1.00 0.00 H new ATOM 0 HA ASP A 40 15.228 -12.119 7.429 1.00 0.00 H new ATOM 0 HB2 ASP A 40 16.206 -11.736 10.177 1.00 0.00 H new ATOM 0 HB3 ASP A 40 16.115 -13.429 9.735 1.00 0.00 H new ATOM 567 N ASP A 41 13.545 -13.324 10.038 1.00 0.00 N ATOM 568 CA ASP A 41 12.572 -14.319 10.455 1.00 0.00 C ATOM 569 C ASP A 41 11.405 -14.331 9.467 1.00 0.00 C ATOM 570 O ASP A 41 11.058 -15.379 8.923 1.00 0.00 O ATOM 571 CB ASP A 41 12.014 -13.994 11.843 1.00 0.00 C ATOM 572 CG ASP A 41 12.816 -14.567 13.012 1.00 0.00 C ATOM 573 OD1 ASP A 41 14.062 -14.543 12.913 1.00 0.00 O ATOM 574 OD2 ASP A 41 12.166 -15.016 13.981 1.00 0.00 O ATOM 0 H ASP A 41 13.896 -12.729 10.789 1.00 0.00 H new ATOM 0 HA ASP A 41 13.071 -15.288 10.484 1.00 0.00 H new ATOM 0 HB2 ASP A 41 11.963 -12.911 11.953 1.00 0.00 H new ATOM 0 HB3 ASP A 41 10.992 -14.369 11.904 1.00 0.00 H new ATOM 579 N ILE A 42 10.831 -13.154 9.264 1.00 0.00 N ATOM 580 CA ILE A 42 9.709 -13.017 8.350 1.00 0.00 C ATOM 581 C ILE A 42 10.201 -13.211 6.914 1.00 0.00 C ATOM 582 O ILE A 42 10.116 -12.297 6.096 1.00 0.00 O ATOM 583 CB ILE A 42 8.992 -11.685 8.579 1.00 0.00 C ATOM 584 CG1 ILE A 42 8.552 -11.543 10.037 1.00 0.00 C ATOM 585 CG2 ILE A 42 7.821 -11.519 7.608 1.00 0.00 C ATOM 586 CD1 ILE A 42 7.598 -12.671 10.434 1.00 0.00 C ATOM 0 H ILE A 42 11.121 -12.287 9.716 1.00 0.00 H new ATOM 0 HA ILE A 42 8.965 -13.791 8.540 1.00 0.00 H new ATOM 0 HB ILE A 42 9.696 -10.878 8.375 1.00 0.00 H new ATOM 0 HG12 ILE A 42 9.427 -11.556 10.687 1.00 0.00 H new ATOM 0 HG13 ILE A 42 8.062 -10.580 10.181 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.328 -10.564 7.792 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.192 -11.545 6.583 1.00 0.00 H new ATOM 0 HG23 ILE A 42 7.108 -12.330 7.756 1.00 0.00 H new ATOM 0 HD11 ILE A 42 7.300 -12.546 11.475 1.00 0.00 H new ATOM 0 HD12 ILE A 42 6.714 -12.640 9.798 1.00 0.00 H new ATOM 0 HD13 ILE A 42 8.099 -13.631 10.312 1.00 0.00 H new ATOM 598 N THR A 43 10.703 -14.409 6.651 1.00 0.00 N ATOM 599 CA THR A 43 11.206 -14.736 5.329 1.00 0.00 C ATOM 600 C THR A 43 10.157 -14.414 4.263 1.00 0.00 C ATOM 601 O THR A 43 8.985 -14.755 4.417 1.00 0.00 O ATOM 602 CB THR A 43 11.635 -16.205 5.335 1.00 0.00 C ATOM 603 OG1 THR A 43 12.938 -16.184 5.911 1.00 0.00 O ATOM 604 CG2 THR A 43 11.860 -16.755 3.926 1.00 0.00 C ATOM 0 H THR A 43 10.772 -15.165 7.332 1.00 0.00 H new ATOM 0 HA THR A 43 12.076 -14.129 5.077 1.00 0.00 H new ATOM 0 HB THR A 43 10.876 -16.802 5.841 1.00 0.00 H new ATOM 0 HG1 THR A 43 13.018 -15.413 6.510 1.00 0.00 H new ATOM 0 HG21 THR A 43 12.163 -17.800 3.987 1.00 0.00 H new ATOM 0 HG22 THR A 43 10.936 -16.678 3.353 1.00 0.00 H new ATOM 0 HG23 THR A 43 12.642 -16.179 3.431 1.00 0.00 H new ATOM 612 N VAL A 44 10.615 -13.759 3.206 1.00 0.00 N ATOM 613 CA VAL A 44 9.730 -13.387 2.115 1.00 0.00 C ATOM 614 C VAL A 44 9.866 -14.408 0.983 1.00 0.00 C ATOM 615 O VAL A 44 10.942 -14.563 0.409 1.00 0.00 O ATOM 616 CB VAL A 44 10.026 -11.955 1.667 1.00 0.00 C ATOM 617 CG1 VAL A 44 9.189 -11.580 0.443 1.00 0.00 C ATOM 618 CG2 VAL A 44 9.800 -10.965 2.811 1.00 0.00 C ATOM 0 H VAL A 44 11.587 -13.476 3.082 1.00 0.00 H new ATOM 0 HA VAL A 44 8.691 -13.402 2.444 1.00 0.00 H new ATOM 0 HB VAL A 44 11.077 -11.903 1.382 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.418 -10.557 0.145 1.00 0.00 H new ATOM 0 HG12 VAL A 44 9.421 -12.258 -0.378 1.00 0.00 H new ATOM 0 HG13 VAL A 44 8.130 -11.657 0.689 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.018 -9.954 2.466 1.00 0.00 H new ATOM 0 HG22 VAL A 44 8.762 -11.020 3.141 1.00 0.00 H new ATOM 0 HG23 VAL A 44 10.459 -11.214 3.643 1.00 0.00 H new ATOM 628 N LYS A 45 8.759 -15.077 0.697 1.00 0.00 N ATOM 629 CA LYS A 45 8.741 -16.079 -0.357 1.00 0.00 C ATOM 630 C LYS A 45 9.324 -15.476 -1.636 1.00 0.00 C ATOM 631 O LYS A 45 9.329 -14.258 -1.808 1.00 0.00 O ATOM 632 CB LYS A 45 7.331 -16.648 -0.531 1.00 0.00 C ATOM 633 CG LYS A 45 7.244 -18.073 0.018 1.00 0.00 C ATOM 634 CD LYS A 45 7.407 -18.086 1.539 1.00 0.00 C ATOM 635 CE LYS A 45 8.016 -19.407 2.014 1.00 0.00 C ATOM 636 NZ LYS A 45 6.954 -20.339 2.452 1.00 0.00 N ATOM 0 H LYS A 45 7.868 -14.946 1.176 1.00 0.00 H new ATOM 0 HA LYS A 45 9.370 -16.927 -0.088 1.00 0.00 H new ATOM 0 HB2 LYS A 45 6.612 -16.011 -0.016 1.00 0.00 H new ATOM 0 HB3 LYS A 45 7.061 -16.644 -1.587 1.00 0.00 H new ATOM 0 HG2 LYS A 45 6.284 -18.512 -0.252 1.00 0.00 H new ATOM 0 HG3 LYS A 45 8.017 -18.690 -0.439 1.00 0.00 H new ATOM 0 HD2 LYS A 45 8.043 -17.256 1.847 1.00 0.00 H new ATOM 0 HD3 LYS A 45 6.437 -17.937 2.014 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.594 -19.858 1.208 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.707 -19.221 2.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 7.384 -21.230 2.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 6.419 -19.913 3.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 6.311 -20.530 1.658 1.00 0.00 H new ATOM 650 N LYS A 46 9.800 -16.358 -2.503 1.00 0.00 N ATOM 651 CA LYS A 46 10.383 -15.928 -3.763 1.00 0.00 C ATOM 652 C LYS A 46 9.315 -15.223 -4.601 1.00 0.00 C ATOM 653 O LYS A 46 9.600 -14.227 -5.265 1.00 0.00 O ATOM 654 CB LYS A 46 11.044 -17.109 -4.477 1.00 0.00 C ATOM 655 CG LYS A 46 12.040 -16.624 -5.533 1.00 0.00 C ATOM 656 CD LYS A 46 12.367 -17.737 -6.530 1.00 0.00 C ATOM 657 CE LYS A 46 13.879 -17.955 -6.632 1.00 0.00 C ATOM 658 NZ LYS A 46 14.174 -19.176 -7.415 1.00 0.00 N ATOM 0 H LYS A 46 9.794 -17.368 -2.358 1.00 0.00 H new ATOM 0 HA LYS A 46 11.179 -15.204 -3.587 1.00 0.00 H new ATOM 0 HB2 LYS A 46 11.557 -17.737 -3.749 1.00 0.00 H new ATOM 0 HB3 LYS A 46 10.280 -17.727 -4.949 1.00 0.00 H new ATOM 0 HG2 LYS A 46 11.625 -15.767 -6.063 1.00 0.00 H new ATOM 0 HG3 LYS A 46 12.955 -16.286 -5.047 1.00 0.00 H new ATOM 0 HD2 LYS A 46 11.883 -18.663 -6.219 1.00 0.00 H new ATOM 0 HD3 LYS A 46 11.966 -17.481 -7.511 1.00 0.00 H new ATOM 0 HE2 LYS A 46 14.346 -17.091 -7.105 1.00 0.00 H new ATOM 0 HE3 LYS A 46 14.308 -18.043 -5.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 15.204 -19.310 -7.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 13.744 -20.000 -6.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 13.781 -19.077 -8.373 1.00 0.00 H new ATOM 672 N ASP A 47 8.108 -15.765 -4.541 1.00 0.00 N ATOM 673 CA ASP A 47 6.996 -15.199 -5.286 1.00 0.00 C ATOM 674 C ASP A 47 6.249 -14.200 -4.400 1.00 0.00 C ATOM 675 O ASP A 47 5.075 -13.917 -4.631 1.00 0.00 O ATOM 676 CB ASP A 47 6.006 -16.288 -5.709 1.00 0.00 C ATOM 677 CG ASP A 47 5.782 -17.394 -4.676 1.00 0.00 C ATOM 678 OD1 ASP A 47 6.088 -17.135 -3.492 1.00 0.00 O ATOM 679 OD2 ASP A 47 5.308 -18.473 -5.094 1.00 0.00 O ATOM 0 H ASP A 47 7.875 -16.590 -3.988 1.00 0.00 H new ATOM 0 HA ASP A 47 7.398 -14.712 -6.174 1.00 0.00 H new ATOM 0 HB2 ASP A 47 5.047 -15.820 -5.932 1.00 0.00 H new ATOM 0 HB3 ASP A 47 6.362 -16.742 -6.634 1.00 0.00 H new ATOM 684 N GLN A 48 6.962 -13.693 -3.405 1.00 0.00 N ATOM 685 CA GLN A 48 6.383 -12.731 -2.484 1.00 0.00 C ATOM 686 C GLN A 48 7.327 -11.542 -2.293 1.00 0.00 C ATOM 687 O GLN A 48 8.538 -11.672 -2.468 1.00 0.00 O ATOM 688 CB GLN A 48 6.052 -13.388 -1.142 1.00 0.00 C ATOM 689 CG GLN A 48 4.577 -13.790 -1.078 1.00 0.00 C ATOM 690 CD GLN A 48 4.411 -15.162 -0.421 1.00 0.00 C ATOM 691 OE1 GLN A 48 4.630 -16.199 -1.025 1.00 0.00 O ATOM 692 NE2 GLN A 48 4.012 -15.110 0.848 1.00 0.00 N ATOM 0 H GLN A 48 7.936 -13.931 -3.217 1.00 0.00 H new ATOM 0 HA GLN A 48 5.451 -12.364 -2.913 1.00 0.00 H new ATOM 0 HB2 GLN A 48 6.679 -14.268 -0.999 1.00 0.00 H new ATOM 0 HB3 GLN A 48 6.280 -12.699 -0.329 1.00 0.00 H new ATOM 0 HG2 GLN A 48 4.017 -13.043 -0.515 1.00 0.00 H new ATOM 0 HG3 GLN A 48 4.158 -13.811 -2.084 1.00 0.00 H new ATOM 0 HE21 GLN A 48 3.846 -14.208 1.294 1.00 0.00 H new ATOM 0 HE22 GLN A 48 3.872 -15.972 1.374 1.00 0.00 H new ATOM 701 N CYS A 49 6.738 -10.411 -1.938 1.00 0.00 N ATOM 702 CA CYS A 49 7.511 -9.199 -1.722 1.00 0.00 C ATOM 703 C CYS A 49 6.995 -8.519 -0.453 1.00 0.00 C ATOM 704 O CYS A 49 5.805 -8.592 -0.145 1.00 0.00 O ATOM 705 CB CYS A 49 7.452 -8.267 -2.934 1.00 0.00 C ATOM 706 SG CYS A 49 9.000 -8.397 -3.900 1.00 0.00 S ATOM 0 H CYS A 49 5.734 -10.307 -1.794 1.00 0.00 H new ATOM 0 HA CYS A 49 8.563 -9.454 -1.593 1.00 0.00 H new ATOM 0 HB2 CYS A 49 6.599 -8.527 -3.561 1.00 0.00 H new ATOM 0 HB3 CYS A 49 7.304 -7.238 -2.605 1.00 0.00 H new ATOM 0 HG CYS A 49 8.938 -7.603 -4.928 1.00 0.00 H new ATOM 712 N LEU A 50 7.913 -7.873 0.250 1.00 0.00 N ATOM 713 CA LEU A 50 7.565 -7.180 1.479 1.00 0.00 C ATOM 714 C LEU A 50 7.056 -5.777 1.142 1.00 0.00 C ATOM 715 O LEU A 50 7.810 -4.942 0.644 1.00 0.00 O ATOM 716 CB LEU A 50 8.747 -7.189 2.451 1.00 0.00 C ATOM 717 CG LEU A 50 8.451 -6.696 3.869 1.00 0.00 C ATOM 718 CD1 LEU A 50 7.495 -7.647 4.592 1.00 0.00 C ATOM 719 CD2 LEU A 50 9.746 -6.479 4.655 1.00 0.00 C ATOM 0 H LEU A 50 8.898 -7.815 -0.008 1.00 0.00 H new ATOM 0 HA LEU A 50 6.755 -7.698 1.993 1.00 0.00 H new ATOM 0 HB2 LEU A 50 9.133 -8.207 2.514 1.00 0.00 H new ATOM 0 HB3 LEU A 50 9.542 -6.572 2.031 1.00 0.00 H new ATOM 0 HG LEU A 50 7.951 -5.730 3.797 1.00 0.00 H new ATOM 0 HD11 LEU A 50 7.301 -7.273 5.597 1.00 0.00 H new ATOM 0 HD12 LEU A 50 6.557 -7.708 4.041 1.00 0.00 H new ATOM 0 HD13 LEU A 50 7.945 -8.638 4.654 1.00 0.00 H new ATOM 0 HD21 LEU A 50 9.508 -6.129 5.659 1.00 0.00 H new ATOM 0 HD22 LEU A 50 10.295 -7.419 4.719 1.00 0.00 H new ATOM 0 HD23 LEU A 50 10.359 -5.735 4.147 1.00 0.00 H new ATOM 731 N VAL A 51 5.781 -5.561 1.427 1.00 0.00 N ATOM 732 CA VAL A 51 5.162 -4.274 1.161 1.00 0.00 C ATOM 733 C VAL A 51 4.837 -3.585 2.488 1.00 0.00 C ATOM 734 O VAL A 51 4.638 -4.249 3.503 1.00 0.00 O ATOM 735 CB VAL A 51 3.934 -4.458 0.266 1.00 0.00 C ATOM 736 CG1 VAL A 51 4.278 -5.290 -0.972 1.00 0.00 C ATOM 737 CG2 VAL A 51 2.777 -5.087 1.045 1.00 0.00 C ATOM 0 H VAL A 51 5.159 -6.256 1.840 1.00 0.00 H new ATOM 0 HA VAL A 51 5.849 -3.625 0.618 1.00 0.00 H new ATOM 0 HB VAL A 51 3.614 -3.472 -0.071 1.00 0.00 H new ATOM 0 HG11 VAL A 51 3.388 -5.406 -1.591 1.00 0.00 H new ATOM 0 HG12 VAL A 51 5.056 -4.785 -1.545 1.00 0.00 H new ATOM 0 HG13 VAL A 51 4.635 -6.272 -0.663 1.00 0.00 H new ATOM 0 HG21 VAL A 51 1.917 -5.207 0.386 1.00 0.00 H new ATOM 0 HG22 VAL A 51 3.082 -6.062 1.425 1.00 0.00 H new ATOM 0 HG23 VAL A 51 2.507 -4.441 1.880 1.00 0.00 H new ATOM 747 N ARG A 52 4.792 -2.262 2.435 1.00 0.00 N ATOM 748 CA ARG A 52 4.494 -1.476 3.621 1.00 0.00 C ATOM 749 C ARG A 52 3.127 -0.802 3.481 1.00 0.00 C ATOM 750 O ARG A 52 2.950 0.087 2.650 1.00 0.00 O ATOM 751 CB ARG A 52 5.560 -0.405 3.853 1.00 0.00 C ATOM 752 CG ARG A 52 5.327 0.322 5.179 1.00 0.00 C ATOM 753 CD ARG A 52 6.071 -0.370 6.323 1.00 0.00 C ATOM 754 NE ARG A 52 6.739 0.638 7.176 1.00 0.00 N ATOM 755 CZ ARG A 52 7.072 0.435 8.458 1.00 0.00 C ATOM 756 NH1 ARG A 52 6.800 -0.740 9.042 1.00 0.00 N ATOM 757 NH2 ARG A 52 7.675 1.407 9.155 1.00 0.00 N ATOM 0 H ARG A 52 4.957 -1.715 1.590 1.00 0.00 H new ATOM 0 HA ARG A 52 4.484 -2.154 4.474 1.00 0.00 H new ATOM 0 HB2 ARG A 52 6.548 -0.865 3.855 1.00 0.00 H new ATOM 0 HB3 ARG A 52 5.544 0.313 3.033 1.00 0.00 H new ATOM 0 HG2 ARG A 52 5.663 1.356 5.095 1.00 0.00 H new ATOM 0 HG3 ARG A 52 4.260 0.351 5.399 1.00 0.00 H new ATOM 0 HD2 ARG A 52 5.373 -0.957 6.919 1.00 0.00 H new ATOM 0 HD3 ARG A 52 6.809 -1.064 5.921 1.00 0.00 H new ATOM 0 HE ARG A 52 6.960 1.544 6.762 1.00 0.00 H new ATOM 0 HH11 ARG A 52 6.340 -1.479 8.511 1.00 0.00 H new ATOM 0 HH12 ARG A 52 7.053 -0.895 10.018 1.00 0.00 H new ATOM 0 HH21 ARG A 52 7.881 2.301 8.710 1.00 0.00 H new ATOM 0 HH22 ARG A 52 7.929 1.253 10.131 1.00 0.00 H new ATOM 771 N SER A 53 2.194 -1.254 4.306 1.00 0.00 N ATOM 772 CA SER A 53 0.848 -0.707 4.286 1.00 0.00 C ATOM 773 C SER A 53 0.880 0.777 4.660 1.00 0.00 C ATOM 774 O SER A 53 1.776 1.220 5.377 1.00 0.00 O ATOM 775 CB SER A 53 -0.073 -1.474 5.235 1.00 0.00 C ATOM 776 OG SER A 53 -1.436 -1.415 4.821 1.00 0.00 O ATOM 0 H SER A 53 2.344 -1.993 4.993 1.00 0.00 H new ATOM 0 HA SER A 53 0.452 -0.812 3.276 1.00 0.00 H new ATOM 0 HB2 SER A 53 0.245 -2.515 5.286 1.00 0.00 H new ATOM 0 HB3 SER A 53 0.019 -1.063 6.240 1.00 0.00 H new ATOM 0 HG SER A 53 -1.611 -2.125 4.169 1.00 0.00 H new ATOM 782 N PHE A 54 -0.108 1.503 4.159 1.00 0.00 N ATOM 783 CA PHE A 54 -0.205 2.926 4.431 1.00 0.00 C ATOM 784 C PHE A 54 -1.367 3.225 5.380 1.00 0.00 C ATOM 785 O PHE A 54 -1.803 4.370 5.492 1.00 0.00 O ATOM 786 CB PHE A 54 -0.460 3.622 3.094 1.00 0.00 C ATOM 787 CG PHE A 54 0.790 3.785 2.227 1.00 0.00 C ATOM 788 CD1 PHE A 54 1.696 4.758 2.515 1.00 0.00 C ATOM 789 CD2 PHE A 54 0.997 2.956 1.169 1.00 0.00 C ATOM 790 CE1 PHE A 54 2.856 4.909 1.711 1.00 0.00 C ATOM 791 CE2 PHE A 54 2.157 3.107 0.365 1.00 0.00 C ATOM 792 CZ PHE A 54 3.063 4.080 0.653 1.00 0.00 C ATOM 0 H PHE A 54 -0.849 1.131 3.565 1.00 0.00 H new ATOM 0 HA PHE A 54 0.713 3.278 4.902 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -1.204 3.053 2.537 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -0.888 4.606 3.285 1.00 0.00 H new ATOM 0 HD1 PHE A 54 1.533 5.416 3.356 1.00 0.00 H new ATOM 0 HD2 PHE A 54 0.279 2.183 0.940 1.00 0.00 H new ATOM 0 HE1 PHE A 54 3.574 5.682 1.940 1.00 0.00 H new ATOM 0 HE2 PHE A 54 2.320 2.449 -0.476 1.00 0.00 H new ATOM 0 HZ PHE A 54 3.946 4.194 0.042 1.00 0.00 H new ATOM 802 N ILE A 55 -1.838 2.176 6.037 1.00 0.00 N ATOM 803 CA ILE A 55 -2.942 2.312 6.972 1.00 0.00 C ATOM 804 C ILE A 55 -2.393 2.363 8.399 1.00 0.00 C ATOM 805 O ILE A 55 -2.529 3.375 9.085 1.00 0.00 O ATOM 806 CB ILE A 55 -3.973 1.204 6.749 1.00 0.00 C ATOM 807 CG1 ILE A 55 -4.587 1.301 5.350 1.00 0.00 C ATOM 808 CG2 ILE A 55 -5.039 1.218 7.846 1.00 0.00 C ATOM 809 CD1 ILE A 55 -5.422 0.059 5.032 1.00 0.00 C ATOM 0 H ILE A 55 -1.475 1.228 5.941 1.00 0.00 H new ATOM 0 HA ILE A 55 -3.473 3.248 6.801 1.00 0.00 H new ATOM 0 HB ILE A 55 -3.462 0.243 6.810 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -5.213 2.191 5.284 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -3.796 1.412 4.608 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -5.759 0.421 7.664 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -4.565 1.064 8.816 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -5.553 2.179 7.842 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -5.847 0.153 4.033 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -4.788 -0.827 5.075 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -6.227 -0.035 5.761 1.00 0.00 H new ATOM 821 N ASP A 56 -1.783 1.258 8.804 1.00 0.00 N ATOM 822 CA ASP A 56 -1.213 1.164 10.137 1.00 0.00 C ATOM 823 C ASP A 56 0.312 1.251 10.043 1.00 0.00 C ATOM 824 O ASP A 56 0.992 1.415 11.055 1.00 0.00 O ATOM 825 CB ASP A 56 -1.571 -0.169 10.796 1.00 0.00 C ATOM 826 CG ASP A 56 -1.218 -0.273 12.281 1.00 0.00 C ATOM 827 OD1 ASP A 56 -1.205 0.792 12.937 1.00 0.00 O ATOM 828 OD2 ASP A 56 -0.970 -1.413 12.729 1.00 0.00 O ATOM 0 H ASP A 56 -1.671 0.421 8.232 1.00 0.00 H new ATOM 0 HA ASP A 56 -1.616 1.982 10.734 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -2.642 -0.338 10.680 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -1.062 -0.970 10.260 1.00 0.00 H new ATOM 833 N SER A 57 0.804 1.135 8.818 1.00 0.00 N ATOM 834 CA SER A 57 2.235 1.198 8.578 1.00 0.00 C ATOM 835 C SER A 57 2.910 -0.070 9.104 1.00 0.00 C ATOM 836 O SER A 57 3.862 0.004 9.880 1.00 0.00 O ATOM 837 CB SER A 57 2.850 2.437 9.234 1.00 0.00 C ATOM 838 OG SER A 57 4.179 2.677 8.780 1.00 0.00 O ATOM 0 H SER A 57 0.237 0.998 7.981 1.00 0.00 H new ATOM 0 HA SER A 57 2.398 1.270 7.503 1.00 0.00 H new ATOM 0 HB2 SER A 57 2.230 3.307 9.018 1.00 0.00 H new ATOM 0 HB3 SER A 57 2.854 2.310 10.317 1.00 0.00 H new ATOM 0 HG SER A 57 4.158 3.288 8.014 1.00 0.00 H new ATOM 844 N LYS A 58 2.391 -1.205 8.660 1.00 0.00 N ATOM 845 CA LYS A 58 2.932 -2.488 9.076 1.00 0.00 C ATOM 846 C LYS A 58 3.547 -3.195 7.866 1.00 0.00 C ATOM 847 O LYS A 58 3.276 -2.826 6.723 1.00 0.00 O ATOM 848 CB LYS A 58 1.862 -3.314 9.791 1.00 0.00 C ATOM 849 CG LYS A 58 1.637 -2.806 11.216 1.00 0.00 C ATOM 850 CD LYS A 58 1.596 -3.966 12.213 1.00 0.00 C ATOM 851 CE LYS A 58 1.804 -3.466 13.644 1.00 0.00 C ATOM 852 NZ LYS A 58 1.454 -4.524 14.618 1.00 0.00 N ATOM 0 H LYS A 58 1.602 -1.263 8.016 1.00 0.00 H new ATOM 0 HA LYS A 58 3.732 -2.346 9.803 1.00 0.00 H new ATOM 0 HB2 LYS A 58 0.927 -3.266 9.232 1.00 0.00 H new ATOM 0 HB3 LYS A 58 2.164 -4.361 9.818 1.00 0.00 H new ATOM 0 HG2 LYS A 58 2.434 -2.115 11.489 1.00 0.00 H new ATOM 0 HG3 LYS A 58 0.702 -2.248 11.263 1.00 0.00 H new ATOM 0 HD2 LYS A 58 0.638 -4.480 12.139 1.00 0.00 H new ATOM 0 HD3 LYS A 58 2.368 -4.693 11.962 1.00 0.00 H new ATOM 0 HE2 LYS A 58 2.842 -3.164 13.783 1.00 0.00 H new ATOM 0 HE3 LYS A 58 1.189 -2.583 13.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 1.601 -4.169 15.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 0.457 -4.792 14.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 2.058 -5.355 14.460 1.00 0.00 H new ATOM 866 N PHE A 59 4.363 -4.197 8.157 1.00 0.00 N ATOM 867 CA PHE A 59 5.019 -4.957 7.106 1.00 0.00 C ATOM 868 C PHE A 59 4.219 -6.214 6.759 1.00 0.00 C ATOM 869 O PHE A 59 4.021 -7.083 7.607 1.00 0.00 O ATOM 870 CB PHE A 59 6.390 -5.373 7.644 1.00 0.00 C ATOM 871 CG PHE A 59 7.386 -4.217 7.767 1.00 0.00 C ATOM 872 CD1 PHE A 59 7.955 -3.688 6.651 1.00 0.00 C ATOM 873 CD2 PHE A 59 7.703 -3.720 8.992 1.00 0.00 C ATOM 874 CE1 PHE A 59 8.879 -2.616 6.765 1.00 0.00 C ATOM 875 CE2 PHE A 59 8.628 -2.649 9.106 1.00 0.00 C ATOM 876 CZ PHE A 59 9.195 -2.119 7.990 1.00 0.00 C ATOM 0 H PHE A 59 4.585 -4.500 9.105 1.00 0.00 H new ATOM 0 HA PHE A 59 5.102 -4.350 6.204 1.00 0.00 H new ATOM 0 HB2 PHE A 59 6.260 -5.833 8.623 1.00 0.00 H new ATOM 0 HB3 PHE A 59 6.811 -6.134 6.987 1.00 0.00 H new ATOM 0 HD1 PHE A 59 7.704 -4.083 5.678 1.00 0.00 H new ATOM 0 HD2 PHE A 59 7.251 -4.140 9.879 1.00 0.00 H new ATOM 0 HE1 PHE A 59 9.331 -2.196 5.879 1.00 0.00 H new ATOM 0 HE2 PHE A 59 8.881 -2.255 10.079 1.00 0.00 H new ATOM 0 HZ PHE A 59 9.897 -1.303 8.077 1.00 0.00 H new ATOM 886 N TYR A 60 3.780 -6.271 5.510 1.00 0.00 N ATOM 887 CA TYR A 60 3.006 -7.407 5.040 1.00 0.00 C ATOM 888 C TYR A 60 3.738 -8.143 3.917 1.00 0.00 C ATOM 889 O TYR A 60 4.519 -7.540 3.182 1.00 0.00 O ATOM 890 CB TYR A 60 1.700 -6.829 4.490 1.00 0.00 C ATOM 891 CG TYR A 60 0.777 -6.243 5.560 1.00 0.00 C ATOM 892 CD1 TYR A 60 0.959 -4.945 5.993 1.00 0.00 C ATOM 893 CD2 TYR A 60 -0.235 -7.012 6.094 1.00 0.00 C ATOM 894 CE1 TYR A 60 0.091 -4.393 6.999 1.00 0.00 C ATOM 895 CE2 TYR A 60 -1.104 -6.460 7.102 1.00 0.00 C ATOM 896 CZ TYR A 60 -0.898 -5.178 7.505 1.00 0.00 C ATOM 897 OH TYR A 60 -1.718 -4.657 8.457 1.00 0.00 O ATOM 0 H TYR A 60 3.946 -5.549 4.809 1.00 0.00 H new ATOM 0 HA TYR A 60 2.840 -8.119 5.848 1.00 0.00 H new ATOM 0 HB2 TYR A 60 1.937 -6.051 3.764 1.00 0.00 H new ATOM 0 HB3 TYR A 60 1.165 -7.613 3.954 1.00 0.00 H new ATOM 0 HD1 TYR A 60 1.753 -4.343 5.576 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -0.376 -8.028 5.757 1.00 0.00 H new ATOM 0 HE1 TYR A 60 0.222 -3.378 7.345 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -1.901 -7.051 7.528 1.00 0.00 H new ATOM 0 HH TYR A 60 -2.378 -5.330 8.725 1.00 0.00 H new ATOM 907 N SER A 61 3.460 -9.434 3.818 1.00 0.00 N ATOM 908 CA SER A 61 4.083 -10.259 2.797 1.00 0.00 C ATOM 909 C SER A 61 3.015 -10.824 1.858 1.00 0.00 C ATOM 910 O SER A 61 2.346 -11.801 2.189 1.00 0.00 O ATOM 911 CB SER A 61 4.893 -11.394 3.424 1.00 0.00 C ATOM 912 OG SER A 61 4.368 -11.789 4.688 1.00 0.00 O ATOM 0 H SER A 61 2.811 -9.930 4.429 1.00 0.00 H new ATOM 0 HA SER A 61 4.768 -9.635 2.224 1.00 0.00 H new ATOM 0 HB2 SER A 61 4.899 -12.251 2.750 1.00 0.00 H new ATOM 0 HB3 SER A 61 5.929 -11.077 3.545 1.00 0.00 H new ATOM 0 HG SER A 61 4.912 -12.517 5.055 1.00 0.00 H new ATOM 918 N ILE A 62 2.888 -10.184 0.704 1.00 0.00 N ATOM 919 CA ILE A 62 1.914 -10.611 -0.285 1.00 0.00 C ATOM 920 C ILE A 62 2.645 -11.127 -1.526 1.00 0.00 C ATOM 921 O ILE A 62 3.873 -11.110 -1.579 1.00 0.00 O ATOM 922 CB ILE A 62 0.920 -9.485 -0.580 1.00 0.00 C ATOM 923 CG1 ILE A 62 1.175 -8.278 0.326 1.00 0.00 C ATOM 924 CG2 ILE A 62 -0.522 -9.984 -0.478 1.00 0.00 C ATOM 925 CD1 ILE A 62 0.973 -8.646 1.798 1.00 0.00 C ATOM 0 H ILE A 62 3.444 -9.373 0.433 1.00 0.00 H new ATOM 0 HA ILE A 62 1.318 -11.438 0.101 1.00 0.00 H new ATOM 0 HB ILE A 62 1.073 -9.155 -1.608 1.00 0.00 H new ATOM 0 HG12 ILE A 62 2.191 -7.913 0.175 1.00 0.00 H new ATOM 0 HG13 ILE A 62 0.501 -7.466 0.054 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -1.207 -9.164 -0.692 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.681 -10.787 -1.198 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -0.707 -10.358 0.529 1.00 0.00 H new ATOM 0 HD11 ILE A 62 1.160 -7.771 2.421 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -0.051 -8.988 1.950 1.00 0.00 H new ATOM 0 HD13 ILE A 62 1.666 -9.442 2.072 1.00 0.00 H new ATOM 937 N ALA A 63 1.858 -11.572 -2.494 1.00 0.00 N ATOM 938 CA ALA A 63 2.416 -12.092 -3.732 1.00 0.00 C ATOM 939 C ALA A 63 2.295 -11.029 -4.826 1.00 0.00 C ATOM 940 O ALA A 63 1.256 -10.384 -4.959 1.00 0.00 O ATOM 941 CB ALA A 63 1.706 -13.396 -4.104 1.00 0.00 C ATOM 0 H ALA A 63 0.839 -11.584 -2.447 1.00 0.00 H new ATOM 0 HA ALA A 63 3.475 -12.321 -3.610 1.00 0.00 H new ATOM 0 HB1 ALA A 63 2.124 -13.786 -5.032 1.00 0.00 H new ATOM 0 HB2 ALA A 63 1.846 -14.127 -3.307 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.641 -13.205 -4.238 1.00 0.00 H new ATOM 947 N ARG A 64 3.372 -10.881 -5.584 1.00 0.00 N ATOM 948 CA ARG A 64 3.399 -9.907 -6.662 1.00 0.00 C ATOM 949 C ARG A 64 2.236 -10.150 -7.626 1.00 0.00 C ATOM 950 O ARG A 64 1.867 -9.263 -8.394 1.00 0.00 O ATOM 951 CB ARG A 64 4.717 -9.981 -7.437 1.00 0.00 C ATOM 952 CG ARG A 64 5.869 -9.399 -6.615 1.00 0.00 C ATOM 953 CD ARG A 64 6.246 -8.002 -7.111 1.00 0.00 C ATOM 954 NE ARG A 64 6.866 -8.091 -8.452 1.00 0.00 N ATOM 955 CZ ARG A 64 8.104 -8.550 -8.678 1.00 0.00 C ATOM 956 NH1 ARG A 64 8.862 -8.964 -7.654 1.00 0.00 N ATOM 957 NH2 ARG A 64 8.585 -8.595 -9.928 1.00 0.00 N ATOM 0 H ARG A 64 4.232 -11.419 -5.473 1.00 0.00 H new ATOM 0 HA ARG A 64 3.306 -8.916 -6.217 1.00 0.00 H new ATOM 0 HB2 ARG A 64 4.935 -11.018 -7.692 1.00 0.00 H new ATOM 0 HB3 ARG A 64 4.623 -9.435 -8.375 1.00 0.00 H new ATOM 0 HG2 ARG A 64 5.583 -9.351 -5.564 1.00 0.00 H new ATOM 0 HG3 ARG A 64 6.735 -10.058 -6.679 1.00 0.00 H new ATOM 0 HD2 ARG A 64 5.359 -7.370 -7.153 1.00 0.00 H new ATOM 0 HD3 ARG A 64 6.938 -7.533 -6.412 1.00 0.00 H new ATOM 0 HE ARG A 64 6.316 -7.784 -9.254 1.00 0.00 H new ATOM 0 HH11 ARG A 64 8.496 -8.930 -6.702 1.00 0.00 H new ATOM 0 HH12 ARG A 64 9.805 -9.314 -7.826 1.00 0.00 H new ATOM 0 HH21 ARG A 64 8.008 -8.280 -10.708 1.00 0.00 H new ATOM 0 HH22 ARG A 64 9.528 -8.945 -10.099 1.00 0.00 H new ATOM 971 N LYS A 65 1.689 -11.355 -7.552 1.00 0.00 N ATOM 972 CA LYS A 65 0.575 -11.724 -8.408 1.00 0.00 C ATOM 973 C LYS A 65 -0.716 -11.124 -7.846 1.00 0.00 C ATOM 974 O LYS A 65 -1.752 -11.142 -8.508 1.00 0.00 O ATOM 975 CB LYS A 65 0.519 -13.242 -8.590 1.00 0.00 C ATOM 976 CG LYS A 65 0.288 -13.946 -7.250 1.00 0.00 C ATOM 977 CD LYS A 65 -0.833 -14.983 -7.362 1.00 0.00 C ATOM 978 CE LYS A 65 -0.301 -16.306 -7.916 1.00 0.00 C ATOM 979 NZ LYS A 65 -0.963 -16.635 -9.198 1.00 0.00 N ATOM 0 H LYS A 65 1.997 -12.088 -6.913 1.00 0.00 H new ATOM 0 HA LYS A 65 0.710 -11.311 -9.408 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.282 -13.500 -9.283 1.00 0.00 H new ATOM 0 HB3 LYS A 65 1.450 -13.593 -9.034 1.00 0.00 H new ATOM 0 HG2 LYS A 65 1.208 -14.433 -6.928 1.00 0.00 H new ATOM 0 HG3 LYS A 65 0.033 -13.210 -6.488 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -1.280 -15.148 -6.382 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.621 -14.603 -8.012 1.00 0.00 H new ATOM 0 HE2 LYS A 65 0.777 -16.238 -8.064 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.474 -17.105 -7.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -0.590 -17.536 -9.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -1.988 -16.720 -9.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -0.776 -15.880 -9.889 1.00 0.00 H new ATOM 993 N ASP A 66 -0.610 -10.607 -6.631 1.00 0.00 N ATOM 994 CA ASP A 66 -1.754 -10.003 -5.972 1.00 0.00 C ATOM 995 C ASP A 66 -1.655 -8.480 -6.080 1.00 0.00 C ATOM 996 O ASP A 66 -2.661 -7.780 -5.982 1.00 0.00 O ATOM 997 CB ASP A 66 -1.793 -10.370 -4.487 1.00 0.00 C ATOM 998 CG ASP A 66 -1.217 -11.746 -4.146 1.00 0.00 C ATOM 999 OD1 ASP A 66 -1.447 -12.673 -4.952 1.00 0.00 O ATOM 1000 OD2 ASP A 66 -0.560 -11.839 -3.087 1.00 0.00 O ATOM 0 H ASP A 66 0.252 -10.594 -6.086 1.00 0.00 H new ATOM 0 HA ASP A 66 -2.656 -10.373 -6.459 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -1.243 -9.614 -3.927 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -2.827 -10.331 -4.145 1.00 0.00 H new ATOM 1005 N ILE A 67 -0.431 -8.012 -6.280 1.00 0.00 N ATOM 1006 CA ILE A 67 -0.187 -6.585 -6.402 1.00 0.00 C ATOM 1007 C ILE A 67 -0.390 -6.159 -7.857 1.00 0.00 C ATOM 1008 O ILE A 67 -0.177 -6.950 -8.775 1.00 0.00 O ATOM 1009 CB ILE A 67 1.193 -6.228 -5.844 1.00 0.00 C ATOM 1010 CG1 ILE A 67 1.446 -6.936 -4.512 1.00 0.00 C ATOM 1011 CG2 ILE A 67 1.363 -4.712 -5.729 1.00 0.00 C ATOM 1012 CD1 ILE A 67 2.931 -6.899 -4.144 1.00 0.00 C ATOM 0 H ILE A 67 0.402 -8.596 -6.360 1.00 0.00 H new ATOM 0 HA ILE A 67 -0.904 -6.024 -5.802 1.00 0.00 H new ATOM 0 HB ILE A 67 1.947 -6.584 -6.546 1.00 0.00 H new ATOM 0 HG12 ILE A 67 0.861 -6.459 -3.726 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.109 -7.971 -4.576 1.00 0.00 H new ATOM 0 HG21 ILE A 67 2.352 -4.486 -5.330 1.00 0.00 H new ATOM 0 HG22 ILE A 67 1.257 -4.258 -6.714 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.602 -4.310 -5.061 1.00 0.00 H new ATOM 0 HD11 ILE A 67 3.083 -7.409 -3.193 1.00 0.00 H new ATOM 0 HD12 ILE A 67 3.511 -7.398 -4.920 1.00 0.00 H new ATOM 0 HD13 ILE A 67 3.258 -5.863 -4.056 1.00 0.00 H new ATOM 1024 N LYS A 68 -0.801 -4.911 -8.023 1.00 0.00 N ATOM 1025 CA LYS A 68 -1.036 -4.371 -9.351 1.00 0.00 C ATOM 1026 C LYS A 68 -1.033 -2.843 -9.284 1.00 0.00 C ATOM 1027 O LYS A 68 -1.609 -2.257 -8.368 1.00 0.00 O ATOM 1028 CB LYS A 68 -2.317 -4.957 -9.949 1.00 0.00 C ATOM 1029 CG LYS A 68 -3.489 -4.820 -8.976 1.00 0.00 C ATOM 1030 CD LYS A 68 -4.326 -3.579 -9.298 1.00 0.00 C ATOM 1031 CE LYS A 68 -5.342 -3.874 -10.404 1.00 0.00 C ATOM 1032 NZ LYS A 68 -6.163 -2.677 -10.685 1.00 0.00 N ATOM 0 H LYS A 68 -0.977 -4.258 -7.260 1.00 0.00 H new ATOM 0 HA LYS A 68 -0.233 -4.663 -10.028 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -2.553 -4.447 -10.883 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -2.162 -6.008 -10.191 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -4.116 -5.710 -9.029 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -3.113 -4.755 -7.955 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -4.847 -3.244 -8.401 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -3.671 -2.765 -9.609 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -4.822 -4.187 -11.310 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -5.985 -4.701 -10.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -6.847 -2.894 -11.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -6.673 -2.396 -9.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -5.547 -1.898 -10.992 1.00 0.00 H new ATOM 1046 N GLU A 69 -0.379 -2.240 -10.265 1.00 0.00 N ATOM 1047 CA GLU A 69 -0.293 -0.791 -10.329 1.00 0.00 C ATOM 1048 C GLU A 69 -1.618 -0.161 -9.893 1.00 0.00 C ATOM 1049 O GLU A 69 -2.687 -0.709 -10.157 1.00 0.00 O ATOM 1050 CB GLU A 69 0.099 -0.326 -11.733 1.00 0.00 C ATOM 1051 CG GLU A 69 1.619 -0.321 -11.903 1.00 0.00 C ATOM 1052 CD GLU A 69 2.095 -1.590 -12.613 1.00 0.00 C ATOM 1053 OE1 GLU A 69 2.268 -2.605 -11.904 1.00 0.00 O ATOM 1054 OE2 GLU A 69 2.276 -1.517 -13.847 1.00 0.00 O ATOM 0 H GLU A 69 0.097 -2.729 -11.023 1.00 0.00 H new ATOM 0 HA GLU A 69 0.487 -0.462 -9.642 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -0.352 -0.983 -12.477 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -0.294 0.675 -11.912 1.00 0.00 H new ATOM 0 HG2 GLU A 69 1.922 0.556 -12.476 1.00 0.00 H new ATOM 0 HG3 GLU A 69 2.098 -0.245 -10.927 1.00 0.00 H new ATOM 1061 N VAL A 70 -1.504 0.981 -9.231 1.00 0.00 N ATOM 1062 CA VAL A 70 -2.679 1.691 -8.756 1.00 0.00 C ATOM 1063 C VAL A 70 -2.417 3.198 -8.812 1.00 0.00 C ATOM 1064 O VAL A 70 -1.300 3.647 -8.559 1.00 0.00 O ATOM 1065 CB VAL A 70 -3.056 1.201 -7.356 1.00 0.00 C ATOM 1066 CG1 VAL A 70 -2.195 1.880 -6.289 1.00 0.00 C ATOM 1067 CG2 VAL A 70 -4.545 1.420 -7.081 1.00 0.00 C ATOM 0 H VAL A 70 -0.616 1.432 -9.012 1.00 0.00 H new ATOM 0 HA VAL A 70 -3.535 1.486 -9.399 1.00 0.00 H new ATOM 0 HB VAL A 70 -2.862 0.129 -7.312 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -2.482 1.515 -5.303 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -1.145 1.651 -6.469 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -2.344 2.959 -6.334 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -4.786 1.063 -6.080 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -4.776 2.483 -7.153 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -5.135 0.870 -7.814 1.00 0.00 H new ATOM 1077 N ASP A 71 -3.466 3.936 -9.146 1.00 0.00 N ATOM 1078 CA ASP A 71 -3.363 5.382 -9.239 1.00 0.00 C ATOM 1079 C ASP A 71 -4.023 6.016 -8.012 1.00 0.00 C ATOM 1080 O ASP A 71 -5.187 6.409 -8.061 1.00 0.00 O ATOM 1081 CB ASP A 71 -4.081 5.907 -10.484 1.00 0.00 C ATOM 1082 CG ASP A 71 -3.707 5.203 -11.790 1.00 0.00 C ATOM 1083 OD1 ASP A 71 -2.526 4.810 -11.906 1.00 0.00 O ATOM 1084 OD2 ASP A 71 -4.611 5.073 -12.643 1.00 0.00 O ATOM 0 H ASP A 71 -4.391 3.560 -9.355 1.00 0.00 H new ATOM 0 HA ASP A 71 -2.306 5.641 -9.296 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -5.156 5.812 -10.332 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -3.866 6.971 -10.588 1.00 0.00 H new ATOM 1089 N ILE A 72 -3.249 6.095 -6.939 1.00 0.00 N ATOM 1090 CA ILE A 72 -3.742 6.674 -5.701 1.00 0.00 C ATOM 1091 C ILE A 72 -3.858 8.191 -5.863 1.00 0.00 C ATOM 1092 O ILE A 72 -4.809 8.800 -5.376 1.00 0.00 O ATOM 1093 CB ILE A 72 -2.866 6.247 -4.523 1.00 0.00 C ATOM 1094 CG1 ILE A 72 -2.718 4.725 -4.472 1.00 0.00 C ATOM 1095 CG2 ILE A 72 -3.401 6.814 -3.206 1.00 0.00 C ATOM 1096 CD1 ILE A 72 -3.994 4.034 -4.960 1.00 0.00 C ATOM 0 H ILE A 72 -2.284 5.767 -6.902 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.741 6.299 -5.477 1.00 0.00 H new ATOM 0 HB ILE A 72 -1.870 6.663 -4.672 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.874 4.417 -5.090 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.498 4.411 -3.452 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.759 6.495 -2.385 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.411 7.903 -3.256 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -4.414 6.449 -3.038 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.863 2.953 -4.914 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -4.831 4.325 -4.325 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -4.198 4.331 -5.989 1.00 0.00 H new ATOM 1108 N LEU A 73 -2.876 8.757 -6.550 1.00 0.00 N ATOM 1109 CA LEU A 73 -2.856 10.191 -6.782 1.00 0.00 C ATOM 1110 C LEU A 73 -3.979 10.563 -7.753 1.00 0.00 C ATOM 1111 O LEU A 73 -4.230 11.742 -7.996 1.00 0.00 O ATOM 1112 CB LEU A 73 -1.468 10.639 -7.247 1.00 0.00 C ATOM 1113 CG LEU A 73 -0.717 11.581 -6.304 1.00 0.00 C ATOM 1114 CD1 LEU A 73 0.439 12.275 -7.027 1.00 0.00 C ATOM 1115 CD2 LEU A 73 -1.672 12.586 -5.655 1.00 0.00 C ATOM 0 H LEU A 73 -2.089 8.248 -6.953 1.00 0.00 H new ATOM 0 HA LEU A 73 -3.046 10.729 -5.853 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -0.856 9.751 -7.406 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -1.572 11.131 -8.214 1.00 0.00 H new ATOM 0 HG LEU A 73 -0.284 10.984 -5.501 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.956 12.939 -6.334 1.00 0.00 H new ATOM 0 HD12 LEU A 73 1.137 11.526 -7.400 1.00 0.00 H new ATOM 0 HD13 LEU A 73 0.049 12.856 -7.863 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -1.112 13.243 -4.990 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -2.156 13.181 -6.430 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -2.430 12.051 -5.083 1.00 0.00 H new ATOM 1127 N ASN A 74 -4.624 9.534 -8.281 1.00 0.00 N ATOM 1128 CA ASN A 74 -5.714 9.737 -9.220 1.00 0.00 C ATOM 1129 C ASN A 74 -7.048 9.594 -8.484 1.00 0.00 C ATOM 1130 O ASN A 74 -8.111 9.787 -9.075 1.00 0.00 O ATOM 1131 CB ASN A 74 -5.678 8.696 -10.340 1.00 0.00 C ATOM 1132 CG ASN A 74 -6.950 8.758 -11.188 1.00 0.00 C ATOM 1133 OD1 ASN A 74 -7.204 9.711 -11.905 1.00 0.00 O ATOM 1134 ND2 ASN A 74 -7.734 7.689 -11.067 1.00 0.00 N ATOM 0 H ASN A 74 -4.413 8.557 -8.077 1.00 0.00 H new ATOM 0 HA ASN A 74 -5.607 10.733 -9.650 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -4.807 8.867 -10.972 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -5.571 7.699 -9.912 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -8.606 7.634 -11.593 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -7.462 6.925 -10.449 1.00 0.00 H new ATOM 1141 N LEU A 75 -6.950 9.256 -7.207 1.00 0.00 N ATOM 1142 CA LEU A 75 -8.136 9.084 -6.385 1.00 0.00 C ATOM 1143 C LEU A 75 -8.704 10.458 -6.025 1.00 0.00 C ATOM 1144 O LEU A 75 -7.973 11.446 -5.991 1.00 0.00 O ATOM 1145 CB LEU A 75 -7.823 8.208 -5.170 1.00 0.00 C ATOM 1146 CG LEU A 75 -7.721 6.706 -5.434 1.00 0.00 C ATOM 1147 CD1 LEU A 75 -7.536 5.930 -4.128 1.00 0.00 C ATOM 1148 CD2 LEU A 75 -8.927 6.206 -6.231 1.00 0.00 C ATOM 0 H LEU A 75 -6.067 9.097 -6.721 1.00 0.00 H new ATOM 0 HA LEU A 75 -8.911 8.554 -6.938 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -6.881 8.545 -4.737 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -8.596 8.373 -4.419 1.00 0.00 H new ATOM 0 HG LEU A 75 -6.835 6.527 -6.043 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -7.466 4.864 -4.345 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -6.622 6.260 -3.635 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -8.388 6.112 -3.473 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -8.829 5.134 -6.405 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -9.840 6.400 -5.669 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -8.972 6.726 -7.188 1.00 0.00 H new ATOM 1160 N PRO A 76 -10.037 10.476 -5.755 1.00 0.00 N ATOM 1161 CA PRO A 76 -10.711 11.711 -5.397 1.00 0.00 C ATOM 1162 C PRO A 76 -10.380 12.121 -3.961 1.00 0.00 C ATOM 1163 O PRO A 76 -10.155 11.268 -3.104 1.00 0.00 O ATOM 1164 CB PRO A 76 -12.189 11.428 -5.608 1.00 0.00 C ATOM 1165 CG PRO A 76 -12.326 9.914 -5.628 1.00 0.00 C ATOM 1166 CD PRO A 76 -10.934 9.324 -5.783 1.00 0.00 C ATOM 0 HA PRO A 76 -10.390 12.556 -6.005 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -12.788 11.864 -4.808 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -12.540 11.864 -6.543 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -12.791 9.560 -4.708 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -12.968 9.599 -6.451 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -10.708 8.626 -4.977 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -10.840 8.772 -6.718 1.00 0.00 H new ATOM 1174 N GLU A 77 -10.361 13.428 -3.741 1.00 0.00 N ATOM 1175 CA GLU A 77 -10.062 13.962 -2.423 1.00 0.00 C ATOM 1176 C GLU A 77 -10.877 13.228 -1.355 1.00 0.00 C ATOM 1177 O GLU A 77 -10.443 13.111 -0.211 1.00 0.00 O ATOM 1178 CB GLU A 77 -10.319 15.468 -2.370 1.00 0.00 C ATOM 1179 CG GLU A 77 -9.129 16.248 -2.934 1.00 0.00 C ATOM 1180 CD GLU A 77 -8.828 17.482 -2.081 1.00 0.00 C ATOM 1181 OE1 GLU A 77 -9.455 18.528 -2.355 1.00 0.00 O ATOM 1182 OE2 GLU A 77 -7.979 17.352 -1.174 1.00 0.00 O ATOM 0 H GLU A 77 -10.548 14.133 -4.454 1.00 0.00 H new ATOM 0 HA GLU A 77 -9.004 13.801 -2.219 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -11.218 15.707 -2.939 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -10.503 15.773 -1.340 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.251 15.603 -2.970 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.342 16.553 -3.959 1.00 0.00 H new ATOM 1189 N SER A 78 -12.042 12.753 -1.770 1.00 0.00 N ATOM 1190 CA SER A 78 -12.921 12.035 -0.863 1.00 0.00 C ATOM 1191 C SER A 78 -12.225 10.775 -0.346 1.00 0.00 C ATOM 1192 O SER A 78 -11.940 10.663 0.846 1.00 0.00 O ATOM 1193 CB SER A 78 -14.240 11.668 -1.550 1.00 0.00 C ATOM 1194 OG SER A 78 -15.292 12.562 -1.196 1.00 0.00 O ATOM 0 H SER A 78 -12.397 12.851 -2.721 1.00 0.00 H new ATOM 0 HA SER A 78 -13.149 12.688 -0.020 1.00 0.00 H new ATOM 0 HB2 SER A 78 -14.102 11.681 -2.631 1.00 0.00 H new ATOM 0 HB3 SER A 78 -14.521 10.651 -1.276 1.00 0.00 H new ATOM 0 HG SER A 78 -16.116 12.296 -1.655 1.00 0.00 H new ATOM 1200 N GLU A 79 -11.969 9.857 -1.268 1.00 0.00 N ATOM 1201 CA GLU A 79 -11.311 8.610 -0.920 1.00 0.00 C ATOM 1202 C GLU A 79 -10.104 8.881 -0.020 1.00 0.00 C ATOM 1203 O GLU A 79 -9.981 8.292 1.054 1.00 0.00 O ATOM 1204 CB GLU A 79 -10.896 7.841 -2.176 1.00 0.00 C ATOM 1205 CG GLU A 79 -12.105 7.170 -2.832 1.00 0.00 C ATOM 1206 CD GLU A 79 -11.704 5.858 -3.508 1.00 0.00 C ATOM 1207 OE1 GLU A 79 -11.290 4.941 -2.767 1.00 0.00 O ATOM 1208 OE2 GLU A 79 -11.821 5.801 -4.752 1.00 0.00 O ATOM 0 H GLU A 79 -12.206 9.953 -2.255 1.00 0.00 H new ATOM 0 HA GLU A 79 -12.018 7.989 -0.370 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -10.424 8.522 -2.885 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -10.153 7.087 -1.916 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -12.870 6.977 -2.080 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -12.544 7.843 -3.568 1.00 0.00 H new ATOM 1215 N LEU A 80 -9.243 9.771 -0.490 1.00 0.00 N ATOM 1216 CA LEU A 80 -8.050 10.126 0.260 1.00 0.00 C ATOM 1217 C LEU A 80 -8.448 10.543 1.677 1.00 0.00 C ATOM 1218 O LEU A 80 -8.062 9.897 2.650 1.00 0.00 O ATOM 1219 CB LEU A 80 -7.242 11.188 -0.489 1.00 0.00 C ATOM 1220 CG LEU A 80 -6.912 10.874 -1.950 1.00 0.00 C ATOM 1221 CD1 LEU A 80 -6.049 11.976 -2.567 1.00 0.00 C ATOM 1222 CD2 LEU A 80 -6.261 9.496 -2.079 1.00 0.00 C ATOM 0 H LEU A 80 -9.347 10.257 -1.381 1.00 0.00 H new ATOM 0 HA LEU A 80 -7.390 9.264 0.355 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -7.795 12.127 -0.456 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -6.307 11.350 0.047 1.00 0.00 H new ATOM 0 HG LEU A 80 -7.845 10.844 -2.513 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -5.829 11.728 -3.605 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -6.586 12.924 -2.526 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -5.116 12.063 -2.010 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -6.036 9.296 -3.127 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -5.338 9.474 -1.499 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -6.944 8.734 -1.703 1.00 0.00 H new ATOM 1234 N SER A 81 -9.216 11.620 1.748 1.00 0.00 N ATOM 1235 CA SER A 81 -9.671 12.131 3.031 1.00 0.00 C ATOM 1236 C SER A 81 -10.148 10.976 3.914 1.00 0.00 C ATOM 1237 O SER A 81 -9.628 10.772 5.011 1.00 0.00 O ATOM 1238 CB SER A 81 -10.791 13.157 2.848 1.00 0.00 C ATOM 1239 OG SER A 81 -10.282 14.463 2.592 1.00 0.00 O ATOM 0 H SER A 81 -9.535 12.153 0.939 1.00 0.00 H new ATOM 0 HA SER A 81 -8.833 12.630 3.518 1.00 0.00 H new ATOM 0 HB2 SER A 81 -11.433 12.850 2.022 1.00 0.00 H new ATOM 0 HB3 SER A 81 -11.412 13.179 3.743 1.00 0.00 H new ATOM 0 HG SER A 81 -10.111 14.565 1.632 1.00 0.00 H new ATOM 1245 N THR A 82 -11.133 10.250 3.405 1.00 0.00 N ATOM 1246 CA THR A 82 -11.686 9.122 4.134 1.00 0.00 C ATOM 1247 C THR A 82 -10.643 8.010 4.266 1.00 0.00 C ATOM 1248 O THR A 82 -9.965 7.907 5.287 1.00 0.00 O ATOM 1249 CB THR A 82 -12.963 8.677 3.419 1.00 0.00 C ATOM 1250 OG1 THR A 82 -12.505 8.203 2.155 1.00 0.00 O ATOM 1251 CG2 THR A 82 -13.877 9.852 3.067 1.00 0.00 C ATOM 0 H THR A 82 -11.562 10.422 2.496 1.00 0.00 H new ATOM 0 HA THR A 82 -11.949 9.400 5.155 1.00 0.00 H new ATOM 0 HB THR A 82 -13.505 7.972 4.049 1.00 0.00 H new ATOM 0 HG1 THR A 82 -12.331 8.965 1.564 1.00 0.00 H new ATOM 0 HG21 THR A 82 -14.768 9.481 2.561 1.00 0.00 H new ATOM 0 HG22 THR A 82 -14.168 10.373 3.979 1.00 0.00 H new ATOM 0 HG23 THR A 82 -13.347 10.541 2.409 1.00 0.00 H new ATOM 1259 N LYS A 83 -10.548 7.206 3.217 1.00 0.00 N ATOM 1260 CA LYS A 83 -9.599 6.105 3.203 1.00 0.00 C ATOM 1261 C LYS A 83 -8.218 6.621 3.610 1.00 0.00 C ATOM 1262 O LYS A 83 -7.629 7.446 2.913 1.00 0.00 O ATOM 1263 CB LYS A 83 -9.616 5.400 1.844 1.00 0.00 C ATOM 1264 CG LYS A 83 -10.541 4.182 1.870 1.00 0.00 C ATOM 1265 CD LYS A 83 -12.010 4.608 1.858 1.00 0.00 C ATOM 1266 CE LYS A 83 -12.774 3.976 3.023 1.00 0.00 C ATOM 1267 NZ LYS A 83 -14.205 3.819 2.680 1.00 0.00 N ATOM 0 H LYS A 83 -11.112 7.295 2.372 1.00 0.00 H new ATOM 0 HA LYS A 83 -9.884 5.348 3.933 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -9.947 6.096 1.073 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -8.606 5.088 1.579 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -10.336 3.547 1.008 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.339 3.586 2.760 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -12.078 5.694 1.921 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -12.470 4.314 0.915 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -12.343 3.004 3.264 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -12.673 4.599 3.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -14.709 3.389 3.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -14.617 4.751 2.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -14.297 3.207 1.844 1.00 0.00 H new ATOM 1281 N PRO A 84 -7.729 6.103 4.768 1.00 0.00 N ATOM 1282 CA PRO A 84 -6.428 6.503 5.277 1.00 0.00 C ATOM 1283 C PRO A 84 -5.300 5.856 4.470 1.00 0.00 C ATOM 1284 O PRO A 84 -4.409 6.546 3.979 1.00 0.00 O ATOM 1285 CB PRO A 84 -6.430 6.083 6.737 1.00 0.00 C ATOM 1286 CG PRO A 84 -7.540 5.052 6.873 1.00 0.00 C ATOM 1287 CD PRO A 84 -8.398 5.125 5.621 1.00 0.00 C ATOM 0 HA PRO A 84 -6.252 7.575 5.185 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -5.467 5.660 7.023 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -6.609 6.938 7.389 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -7.121 4.053 6.991 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -8.141 5.252 7.760 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -8.466 4.154 5.131 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -9.416 5.436 5.856 1.00 0.00 H new ATOM 1295 N GLY A 85 -5.378 4.538 4.358 1.00 0.00 N ATOM 1296 CA GLY A 85 -4.375 3.790 3.618 1.00 0.00 C ATOM 1297 C GLY A 85 -4.055 4.470 2.286 1.00 0.00 C ATOM 1298 O GLY A 85 -2.916 4.435 1.824 1.00 0.00 O ATOM 0 H GLY A 85 -6.119 3.969 4.767 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -3.467 3.705 4.214 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -4.733 2.777 3.436 1.00 0.00 H new ATOM 1302 N LEU A 86 -5.082 5.073 1.705 1.00 0.00 N ATOM 1303 CA LEU A 86 -4.926 5.759 0.434 1.00 0.00 C ATOM 1304 C LEU A 86 -4.265 7.120 0.672 1.00 0.00 C ATOM 1305 O LEU A 86 -3.254 7.440 0.050 1.00 0.00 O ATOM 1306 CB LEU A 86 -6.267 5.846 -0.297 1.00 0.00 C ATOM 1307 CG LEU A 86 -6.981 4.517 -0.548 1.00 0.00 C ATOM 1308 CD1 LEU A 86 -8.451 4.745 -0.910 1.00 0.00 C ATOM 1309 CD2 LEU A 86 -6.251 3.693 -1.610 1.00 0.00 C ATOM 0 H LEU A 86 -6.026 5.101 2.091 1.00 0.00 H new ATOM 0 HA LEU A 86 -4.267 5.194 -0.225 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -6.932 6.490 0.280 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -6.104 6.335 -1.257 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.962 3.939 0.376 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -8.936 3.784 -1.084 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -8.951 5.262 -0.091 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.513 5.351 -1.814 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -6.780 2.753 -1.769 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -6.217 4.253 -2.545 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -5.235 3.485 -1.274 1.00 0.00 H new ATOM 1321 N GLN A 87 -4.865 7.882 1.574 1.00 0.00 N ATOM 1322 CA GLN A 87 -4.347 9.200 1.902 1.00 0.00 C ATOM 1323 C GLN A 87 -2.818 9.182 1.915 1.00 0.00 C ATOM 1324 O GLN A 87 -2.179 9.695 0.997 1.00 0.00 O ATOM 1325 CB GLN A 87 -4.901 9.687 3.243 1.00 0.00 C ATOM 1326 CG GLN A 87 -4.547 11.157 3.480 1.00 0.00 C ATOM 1327 CD GLN A 87 -5.807 11.999 3.685 1.00 0.00 C ATOM 1328 OE1 GLN A 87 -6.318 12.141 4.784 1.00 0.00 O ATOM 1329 NE2 GLN A 87 -6.279 12.548 2.569 1.00 0.00 N ATOM 0 H GLN A 87 -5.704 7.613 2.088 1.00 0.00 H new ATOM 0 HA GLN A 87 -4.675 9.900 1.134 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -5.984 9.562 3.260 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -4.497 9.077 4.051 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -3.902 11.243 4.354 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -3.984 11.541 2.629 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -5.803 12.389 1.681 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -7.117 13.128 2.601 1.00 0.00 H new ATOM 1338 N LYS A 88 -2.273 8.585 2.965 1.00 0.00 N ATOM 1339 CA LYS A 88 -0.830 8.494 3.108 1.00 0.00 C ATOM 1340 C LYS A 88 -0.214 8.080 1.771 1.00 0.00 C ATOM 1341 O LYS A 88 0.658 8.770 1.245 1.00 0.00 O ATOM 1342 CB LYS A 88 -0.465 7.563 4.267 1.00 0.00 C ATOM 1343 CG LYS A 88 -0.052 8.363 5.504 1.00 0.00 C ATOM 1344 CD LYS A 88 -0.059 7.482 6.755 1.00 0.00 C ATOM 1345 CE LYS A 88 -0.989 8.056 7.825 1.00 0.00 C ATOM 1346 NZ LYS A 88 -1.800 6.980 8.438 1.00 0.00 N ATOM 0 H LYS A 88 -2.805 8.160 3.724 1.00 0.00 H new ATOM 0 HA LYS A 88 -0.411 9.467 3.365 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -1.316 6.927 4.509 1.00 0.00 H new ATOM 0 HB3 LYS A 88 0.350 6.905 3.966 1.00 0.00 H new ATOM 0 HG2 LYS A 88 0.943 8.781 5.355 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -0.733 9.203 5.642 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -0.380 6.474 6.492 1.00 0.00 H new ATOM 0 HD3 LYS A 88 0.953 7.401 7.153 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -0.402 8.560 8.593 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -1.644 8.806 7.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -2.426 7.387 9.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -2.374 6.517 7.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -1.171 6.279 8.879 1.00 0.00 H new ATOM 1360 N ALA A 89 -0.691 6.956 1.258 1.00 0.00 N ATOM 1361 CA ALA A 89 -0.198 6.442 -0.009 1.00 0.00 C ATOM 1362 C ALA A 89 -0.127 7.584 -1.024 1.00 0.00 C ATOM 1363 O ALA A 89 0.897 7.776 -1.679 1.00 0.00 O ATOM 1364 CB ALA A 89 -1.097 5.297 -0.481 1.00 0.00 C ATOM 0 H ALA A 89 -1.414 6.386 1.697 1.00 0.00 H new ATOM 0 HA ALA A 89 0.808 6.039 0.106 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -0.727 4.912 -1.431 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -1.090 4.499 0.262 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -2.115 5.663 -0.610 1.00 0.00 H new ATOM 1370 N SER A 90 -1.228 8.315 -1.124 1.00 0.00 N ATOM 1371 CA SER A 90 -1.304 9.432 -2.049 1.00 0.00 C ATOM 1372 C SER A 90 -0.264 10.492 -1.675 1.00 0.00 C ATOM 1373 O SER A 90 0.490 10.954 -2.529 1.00 0.00 O ATOM 1374 CB SER A 90 -2.706 10.045 -2.059 1.00 0.00 C ATOM 1375 OG SER A 90 -3.692 9.130 -1.587 1.00 0.00 O ATOM 0 H SER A 90 -2.075 8.155 -0.579 1.00 0.00 H new ATOM 0 HA SER A 90 -1.092 9.061 -3.052 1.00 0.00 H new ATOM 0 HB2 SER A 90 -2.715 10.940 -1.437 1.00 0.00 H new ATOM 0 HB3 SER A 90 -2.958 10.358 -3.072 1.00 0.00 H new ATOM 0 HG SER A 90 -3.620 9.045 -0.613 1.00 0.00 H new ATOM 1381 N ILE A 91 -0.259 10.844 -0.398 1.00 0.00 N ATOM 1382 CA ILE A 91 0.676 11.841 0.099 1.00 0.00 C ATOM 1383 C ILE A 91 2.090 11.480 -0.358 1.00 0.00 C ATOM 1384 O ILE A 91 2.853 12.351 -0.773 1.00 0.00 O ATOM 1385 CB ILE A 91 0.539 11.993 1.615 1.00 0.00 C ATOM 1386 CG1 ILE A 91 -0.795 12.646 1.982 1.00 0.00 C ATOM 1387 CG2 ILE A 91 1.731 12.756 2.198 1.00 0.00 C ATOM 1388 CD1 ILE A 91 -0.823 13.042 3.460 1.00 0.00 C ATOM 0 H ILE A 91 -0.886 10.458 0.307 1.00 0.00 H new ATOM 0 HA ILE A 91 0.447 12.821 -0.319 1.00 0.00 H new ATOM 0 HB ILE A 91 0.543 10.998 2.061 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -0.955 13.528 1.362 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -1.612 11.956 1.771 1.00 0.00 H new ATOM 0 HG21 ILE A 91 1.610 12.851 3.277 1.00 0.00 H new ATOM 0 HG22 ILE A 91 2.651 12.213 1.983 1.00 0.00 H new ATOM 0 HG23 ILE A 91 1.782 13.748 1.750 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -1.782 13.504 3.695 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -0.687 12.154 4.077 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -0.020 13.751 3.662 1.00 0.00 H new ATOM 1400 N PHE A 92 2.397 10.194 -0.267 1.00 0.00 N ATOM 1401 CA PHE A 92 3.706 9.707 -0.666 1.00 0.00 C ATOM 1402 C PHE A 92 3.870 9.756 -2.186 1.00 0.00 C ATOM 1403 O PHE A 92 4.980 9.622 -2.700 1.00 0.00 O ATOM 1404 CB PHE A 92 3.803 8.252 -0.202 1.00 0.00 C ATOM 1405 CG PHE A 92 5.077 7.537 -0.657 1.00 0.00 C ATOM 1406 CD1 PHE A 92 6.258 7.787 -0.031 1.00 0.00 C ATOM 1407 CD2 PHE A 92 5.028 6.651 -1.687 1.00 0.00 C ATOM 1408 CE1 PHE A 92 7.440 7.124 -0.454 1.00 0.00 C ATOM 1409 CE2 PHE A 92 6.209 5.987 -2.111 1.00 0.00 C ATOM 1410 CZ PHE A 92 7.390 6.237 -1.485 1.00 0.00 C ATOM 0 H PHE A 92 1.761 9.475 0.077 1.00 0.00 H new ATOM 0 HA PHE A 92 4.484 10.329 -0.223 1.00 0.00 H new ATOM 0 HB2 PHE A 92 3.752 8.224 0.886 1.00 0.00 H new ATOM 0 HB3 PHE A 92 2.938 7.704 -0.575 1.00 0.00 H new ATOM 0 HD1 PHE A 92 6.297 8.490 0.788 1.00 0.00 H new ATOM 0 HD2 PHE A 92 4.090 6.452 -2.183 1.00 0.00 H new ATOM 0 HE1 PHE A 92 8.378 7.323 0.042 1.00 0.00 H new ATOM 0 HE2 PHE A 92 6.170 5.284 -2.930 1.00 0.00 H new ATOM 0 HZ PHE A 92 8.289 5.731 -1.806 1.00 0.00 H new ATOM 1420 N LEU A 93 2.748 9.950 -2.864 1.00 0.00 N ATOM 1421 CA LEU A 93 2.753 10.019 -4.315 1.00 0.00 C ATOM 1422 C LEU A 93 2.876 11.480 -4.751 1.00 0.00 C ATOM 1423 O LEU A 93 3.084 11.764 -5.931 1.00 0.00 O ATOM 1424 CB LEU A 93 1.526 9.307 -4.889 1.00 0.00 C ATOM 1425 CG LEU A 93 1.543 7.779 -4.816 1.00 0.00 C ATOM 1426 CD1 LEU A 93 0.639 7.169 -5.890 1.00 0.00 C ATOM 1427 CD2 LEU A 93 2.974 7.241 -4.897 1.00 0.00 C ATOM 0 H LEU A 93 1.829 10.062 -2.435 1.00 0.00 H new ATOM 0 HA LEU A 93 3.617 9.492 -4.719 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.642 9.666 -4.362 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.416 9.600 -5.933 1.00 0.00 H new ATOM 0 HG LEU A 93 1.141 7.479 -3.848 1.00 0.00 H new ATOM 0 HD11 LEU A 93 0.669 6.082 -5.816 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -0.384 7.515 -5.743 1.00 0.00 H new ATOM 0 HD13 LEU A 93 0.988 7.476 -6.876 1.00 0.00 H new ATOM 0 HD21 LEU A 93 2.957 6.152 -4.843 1.00 0.00 H new ATOM 0 HD22 LEU A 93 3.426 7.550 -5.839 1.00 0.00 H new ATOM 0 HD23 LEU A 93 3.559 7.637 -4.067 1.00 0.00 H new ATOM 1439 N LYS A 94 2.743 12.368 -3.778 1.00 0.00 N ATOM 1440 CA LYS A 94 2.836 13.793 -4.046 1.00 0.00 C ATOM 1441 C LYS A 94 4.054 14.366 -3.318 1.00 0.00 C ATOM 1442 O LYS A 94 4.903 15.009 -3.931 1.00 0.00 O ATOM 1443 CB LYS A 94 1.522 14.493 -3.694 1.00 0.00 C ATOM 1444 CG LYS A 94 0.582 13.547 -2.942 1.00 0.00 C ATOM 1445 CD LYS A 94 -0.582 14.316 -2.316 1.00 0.00 C ATOM 1446 CE LYS A 94 -1.395 15.047 -3.386 1.00 0.00 C ATOM 1447 NZ LYS A 94 -2.332 16.008 -2.760 1.00 0.00 N ATOM 0 H LYS A 94 2.571 12.128 -2.802 1.00 0.00 H new ATOM 0 HA LYS A 94 2.988 13.971 -5.111 1.00 0.00 H new ATOM 0 HB2 LYS A 94 1.726 15.371 -3.082 1.00 0.00 H new ATOM 0 HB3 LYS A 94 1.038 14.845 -4.605 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.197 12.791 -3.626 1.00 0.00 H new ATOM 0 HG3 LYS A 94 1.135 13.021 -2.164 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.227 13.626 -1.772 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -0.200 15.034 -1.591 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -0.724 15.574 -4.064 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -1.951 14.325 -3.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -2.876 16.495 -3.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.984 15.497 -2.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -1.795 16.707 -2.208 1.00 0.00 H new ATOM 1461 N THR A 95 4.098 14.112 -2.017 1.00 0.00 N ATOM 1462 CA THR A 95 5.196 14.595 -1.198 1.00 0.00 C ATOM 1463 C THR A 95 6.431 13.712 -1.387 1.00 0.00 C ATOM 1464 O THR A 95 7.526 14.068 -0.955 1.00 0.00 O ATOM 1465 CB THR A 95 4.712 14.661 0.252 1.00 0.00 C ATOM 1466 OG1 THR A 95 4.692 13.299 0.672 1.00 0.00 O ATOM 1467 CG2 THR A 95 3.252 15.106 0.362 1.00 0.00 C ATOM 0 H THR A 95 3.391 13.578 -1.511 1.00 0.00 H new ATOM 0 HA THR A 95 5.502 15.597 -1.499 1.00 0.00 H new ATOM 0 HB THR A 95 5.344 15.347 0.816 1.00 0.00 H new ATOM 0 HG1 THR A 95 4.059 12.795 0.119 1.00 0.00 H new ATOM 0 HG21 THR A 95 2.959 15.136 1.411 1.00 0.00 H new ATOM 0 HG22 THR A 95 3.140 16.098 -0.075 1.00 0.00 H new ATOM 0 HG23 THR A 95 2.615 14.401 -0.172 1.00 0.00 H new ATOM 1475 N ARG A 96 6.213 12.575 -2.032 1.00 0.00 N ATOM 1476 CA ARG A 96 7.294 11.638 -2.284 1.00 0.00 C ATOM 1477 C ARG A 96 8.252 11.600 -1.092 1.00 0.00 C ATOM 1478 O ARG A 96 9.457 11.789 -1.252 1.00 0.00 O ATOM 1479 CB ARG A 96 8.074 12.022 -3.544 1.00 0.00 C ATOM 1480 CG ARG A 96 7.160 12.036 -4.771 1.00 0.00 C ATOM 1481 CD ARG A 96 6.763 10.615 -5.176 1.00 0.00 C ATOM 1482 NE ARG A 96 7.766 10.056 -6.110 1.00 0.00 N ATOM 1483 CZ ARG A 96 7.927 8.747 -6.342 1.00 0.00 C ATOM 1484 NH1 ARG A 96 7.152 7.854 -5.711 1.00 0.00 N ATOM 1485 NH2 ARG A 96 8.863 8.329 -7.205 1.00 0.00 N ATOM 0 H ARG A 96 5.303 12.282 -2.388 1.00 0.00 H new ATOM 0 HA ARG A 96 6.851 10.653 -2.431 1.00 0.00 H new ATOM 0 HB2 ARG A 96 8.526 13.005 -3.411 1.00 0.00 H new ATOM 0 HB3 ARG A 96 8.889 11.315 -3.701 1.00 0.00 H new ATOM 0 HG2 ARG A 96 6.265 12.620 -4.555 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.668 12.526 -5.602 1.00 0.00 H new ATOM 0 HD2 ARG A 96 6.687 9.984 -4.291 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.780 10.623 -5.647 1.00 0.00 H new ATOM 0 HE ARG A 96 8.372 10.708 -6.608 1.00 0.00 H new ATOM 0 HH11 ARG A 96 6.439 8.171 -5.054 1.00 0.00 H new ATOM 0 HH12 ARG A 96 7.275 6.857 -5.888 1.00 0.00 H new ATOM 0 HH21 ARG A 96 9.453 9.008 -7.686 1.00 0.00 H new ATOM 0 HH22 ARG A 96 8.985 7.332 -7.381 1.00 0.00 H new ATOM 1499 N VAL A 97 7.680 11.356 0.078 1.00 0.00 N ATOM 1500 CA VAL A 97 8.468 11.291 1.297 1.00 0.00 C ATOM 1501 C VAL A 97 7.607 10.723 2.427 1.00 0.00 C ATOM 1502 O VAL A 97 6.700 11.394 2.918 1.00 0.00 O ATOM 1503 CB VAL A 97 9.045 12.671 1.622 1.00 0.00 C ATOM 1504 CG1 VAL A 97 7.932 13.664 1.964 1.00 0.00 C ATOM 1505 CG2 VAL A 97 10.069 12.584 2.755 1.00 0.00 C ATOM 0 H VAL A 97 6.680 11.201 0.208 1.00 0.00 H new ATOM 0 HA VAL A 97 9.317 10.620 1.166 1.00 0.00 H new ATOM 0 HB VAL A 97 9.559 13.037 0.733 1.00 0.00 H new ATOM 0 HG11 VAL A 97 8.369 14.636 2.191 1.00 0.00 H new ATOM 0 HG12 VAL A 97 7.256 13.759 1.114 1.00 0.00 H new ATOM 0 HG13 VAL A 97 7.377 13.304 2.831 1.00 0.00 H new ATOM 0 HG21 VAL A 97 10.463 13.578 2.966 1.00 0.00 H new ATOM 0 HG22 VAL A 97 9.589 12.187 3.649 1.00 0.00 H new ATOM 0 HG23 VAL A 97 10.885 11.925 2.458 1.00 0.00 H new ATOM 1515 N VAL A 98 7.921 9.493 2.806 1.00 0.00 N ATOM 1516 CA VAL A 98 7.187 8.826 3.868 1.00 0.00 C ATOM 1517 C VAL A 98 7.358 9.611 5.170 1.00 0.00 C ATOM 1518 O VAL A 98 8.259 10.440 5.285 1.00 0.00 O ATOM 1519 CB VAL A 98 7.639 7.369 3.983 1.00 0.00 C ATOM 1520 CG1 VAL A 98 6.833 6.469 3.045 1.00 0.00 C ATOM 1521 CG2 VAL A 98 9.139 7.240 3.713 1.00 0.00 C ATOM 0 H VAL A 98 8.674 8.941 2.396 1.00 0.00 H new ATOM 0 HA VAL A 98 6.121 8.803 3.640 1.00 0.00 H new ATOM 0 HB VAL A 98 7.452 7.039 5.005 1.00 0.00 H new ATOM 0 HG11 VAL A 98 7.174 5.439 3.147 1.00 0.00 H new ATOM 0 HG12 VAL A 98 5.776 6.528 3.304 1.00 0.00 H new ATOM 0 HG13 VAL A 98 6.974 6.798 2.015 1.00 0.00 H new ATOM 0 HG21 VAL A 98 9.436 6.195 3.801 1.00 0.00 H new ATOM 0 HG22 VAL A 98 9.360 7.597 2.707 1.00 0.00 H new ATOM 0 HG23 VAL A 98 9.692 7.836 4.439 1.00 0.00 H new ATOM 1531 N PRO A 99 6.456 9.314 6.144 1.00 0.00 N ATOM 1532 CA PRO A 99 6.498 9.981 7.433 1.00 0.00 C ATOM 1533 C PRO A 99 7.649 9.449 8.289 1.00 0.00 C ATOM 1534 O PRO A 99 8.069 8.303 8.126 1.00 0.00 O ATOM 1535 CB PRO A 99 5.133 9.731 8.051 1.00 0.00 C ATOM 1536 CG PRO A 99 4.544 8.550 7.297 1.00 0.00 C ATOM 1537 CD PRO A 99 5.374 8.337 6.042 1.00 0.00 C ATOM 0 HA PRO A 99 6.691 11.050 7.347 1.00 0.00 H new ATOM 0 HB2 PRO A 99 5.220 9.511 9.115 1.00 0.00 H new ATOM 0 HB3 PRO A 99 4.496 10.610 7.959 1.00 0.00 H new ATOM 0 HG2 PRO A 99 4.557 7.655 7.919 1.00 0.00 H new ATOM 0 HG3 PRO A 99 3.503 8.743 7.038 1.00 0.00 H new ATOM 0 HD2 PRO A 99 5.762 7.320 5.992 1.00 0.00 H new ATOM 0 HD3 PRO A 99 4.780 8.496 5.142 1.00 0.00 H new ATOM 1545 N ASP A 100 8.126 10.303 9.182 1.00 0.00 N ATOM 1546 CA ASP A 100 9.219 9.932 10.063 1.00 0.00 C ATOM 1547 C ASP A 100 8.894 8.598 10.739 1.00 0.00 C ATOM 1548 O ASP A 100 9.797 7.848 11.106 1.00 0.00 O ATOM 1549 CB ASP A 100 9.425 10.980 11.158 1.00 0.00 C ATOM 1550 CG ASP A 100 10.862 11.113 11.665 1.00 0.00 C ATOM 1551 OD1 ASP A 100 11.766 11.164 10.803 1.00 0.00 O ATOM 1552 OD2 ASP A 100 11.025 11.161 12.904 1.00 0.00 O ATOM 0 H ASP A 100 7.775 11.252 9.314 1.00 0.00 H new ATOM 0 HA ASP A 100 10.125 9.857 9.462 1.00 0.00 H new ATOM 0 HB2 ASP A 100 9.099 11.948 10.779 1.00 0.00 H new ATOM 0 HB3 ASP A 100 8.780 10.734 12.001 1.00 0.00 H new ATOM 1557 N ASN A 101 7.601 8.346 10.885 1.00 0.00 N ATOM 1558 CA ASN A 101 7.146 7.116 11.510 1.00 0.00 C ATOM 1559 C ASN A 101 7.663 5.919 10.710 1.00 0.00 C ATOM 1560 O ASN A 101 7.706 4.800 11.219 1.00 0.00 O ATOM 1561 CB ASN A 101 5.618 7.044 11.535 1.00 0.00 C ATOM 1562 CG ASN A 101 5.109 6.658 12.925 1.00 0.00 C ATOM 1563 OD1 ASN A 101 5.868 6.352 13.830 1.00 0.00 O ATOM 1564 ND2 ASN A 101 3.785 6.691 13.044 1.00 0.00 N ATOM 0 H ASN A 101 6.855 8.972 10.581 1.00 0.00 H new ATOM 0 HA ASN A 101 7.525 7.097 12.532 1.00 0.00 H new ATOM 0 HB2 ASN A 101 5.200 8.008 11.246 1.00 0.00 H new ATOM 0 HB3 ASN A 101 5.273 6.315 10.802 1.00 0.00 H new ATOM 0 HD21 ASN A 101 3.347 6.451 13.933 1.00 0.00 H new ATOM 0 HD22 ASN A 101 3.208 6.956 12.246 1.00 0.00 H new ATOM 1571 N TRP A 102 8.041 6.196 9.471 1.00 0.00 N ATOM 1572 CA TRP A 102 8.553 5.155 8.595 1.00 0.00 C ATOM 1573 C TRP A 102 10.081 5.189 8.665 1.00 0.00 C ATOM 1574 O TRP A 102 10.709 4.209 9.064 1.00 0.00 O ATOM 1575 CB TRP A 102 8.016 5.323 7.172 1.00 0.00 C ATOM 1576 CG TRP A 102 6.505 5.115 7.049 1.00 0.00 C ATOM 1577 CD1 TRP A 102 5.549 5.477 7.916 1.00 0.00 C ATOM 1578 CD2 TRP A 102 5.811 4.479 5.956 1.00 0.00 C ATOM 1579 NE1 TRP A 102 4.295 5.122 7.463 1.00 0.00 N ATOM 1580 CE2 TRP A 102 4.459 4.495 6.233 1.00 0.00 C ATOM 1581 CE3 TRP A 102 6.308 3.908 4.771 1.00 0.00 C ATOM 1582 CZ2 TRP A 102 3.494 3.956 5.374 1.00 0.00 C ATOM 1583 CZ3 TRP A 102 5.331 3.373 3.924 1.00 0.00 C ATOM 1584 CH2 TRP A 102 3.967 3.382 4.188 1.00 0.00 C ATOM 0 H TRP A 102 8.003 7.126 9.053 1.00 0.00 H new ATOM 0 HA TRP A 102 8.211 4.173 8.921 1.00 0.00 H new ATOM 0 HB2 TRP A 102 8.265 6.323 6.816 1.00 0.00 H new ATOM 0 HB3 TRP A 102 8.524 4.616 6.517 1.00 0.00 H new ATOM 0 HD1 TRP A 102 5.737 5.983 8.852 1.00 0.00 H new ATOM 0 HE1 TRP A 102 3.410 5.289 7.942 1.00 0.00 H new ATOM 0 HE3 TRP A 102 7.361 3.884 4.533 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 2.441 3.982 5.613 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 5.660 2.921 3.000 1.00 0.00 H new ATOM 0 HH2 TRP A 102 3.275 2.948 3.482 1.00 0.00 H new ATOM 1595 N LYS A 103 10.635 6.325 8.270 1.00 0.00 N ATOM 1596 CA LYS A 103 12.077 6.499 8.282 1.00 0.00 C ATOM 1597 C LYS A 103 12.711 5.546 7.266 1.00 0.00 C ATOM 1598 O LYS A 103 13.631 4.801 7.597 1.00 0.00 O ATOM 1599 CB LYS A 103 12.625 6.334 9.702 1.00 0.00 C ATOM 1600 CG LYS A 103 13.686 7.394 10.006 1.00 0.00 C ATOM 1601 CD LYS A 103 14.070 7.375 11.487 1.00 0.00 C ATOM 1602 CE LYS A 103 15.537 6.978 11.667 1.00 0.00 C ATOM 1603 NZ LYS A 103 15.895 6.958 13.104 1.00 0.00 N ATOM 0 H LYS A 103 10.111 7.135 7.939 1.00 0.00 H new ATOM 0 HA LYS A 103 12.340 7.512 7.978 1.00 0.00 H new ATOM 0 HB2 LYS A 103 11.810 6.413 10.422 1.00 0.00 H new ATOM 0 HB3 LYS A 103 13.056 5.339 9.816 1.00 0.00 H new ATOM 0 HG2 LYS A 103 14.570 7.214 9.395 1.00 0.00 H new ATOM 0 HG3 LYS A 103 13.308 8.380 9.737 1.00 0.00 H new ATOM 0 HD2 LYS A 103 13.899 8.359 11.923 1.00 0.00 H new ATOM 0 HD3 LYS A 103 13.431 6.673 12.023 1.00 0.00 H new ATOM 0 HE2 LYS A 103 15.711 5.995 11.229 1.00 0.00 H new ATOM 0 HE3 LYS A 103 16.178 7.681 11.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 16.893 6.687 13.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 15.748 7.903 13.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 15.295 6.270 13.602 1.00 0.00 H new ATOM 1617 N MET A 104 12.192 5.602 6.048 1.00 0.00 N ATOM 1618 CA MET A 104 12.695 4.754 4.981 1.00 0.00 C ATOM 1619 C MET A 104 14.102 5.180 4.559 1.00 0.00 C ATOM 1620 O MET A 104 14.518 6.308 4.820 1.00 0.00 O ATOM 1621 CB MET A 104 11.753 4.837 3.777 1.00 0.00 C ATOM 1622 CG MET A 104 10.549 3.911 3.958 1.00 0.00 C ATOM 1623 SD MET A 104 10.987 2.242 3.500 1.00 0.00 S ATOM 1624 CE MET A 104 9.473 1.397 3.924 1.00 0.00 C ATOM 0 H MET A 104 11.428 6.221 5.777 1.00 0.00 H new ATOM 0 HA MET A 104 12.742 3.729 5.348 1.00 0.00 H new ATOM 0 HB2 MET A 104 11.411 5.864 3.649 1.00 0.00 H new ATOM 0 HB3 MET A 104 12.292 4.565 2.870 1.00 0.00 H new ATOM 0 HG2 MET A 104 10.213 3.936 4.995 1.00 0.00 H new ATOM 0 HG3 MET A 104 9.717 4.259 3.345 1.00 0.00 H new ATOM 0 HE1 MET A 104 9.709 0.452 4.414 1.00 0.00 H new ATOM 0 HE2 MET A 104 8.886 2.020 4.599 1.00 0.00 H new ATOM 0 HE3 MET A 104 8.899 1.202 3.018 1.00 0.00 H new ATOM 1634 N ASP A 105 14.798 4.254 3.914 1.00 0.00 N ATOM 1635 CA ASP A 105 16.150 4.519 3.454 1.00 0.00 C ATOM 1636 C ASP A 105 16.617 3.364 2.566 1.00 0.00 C ATOM 1637 O ASP A 105 17.717 2.842 2.748 1.00 0.00 O ATOM 1638 CB ASP A 105 17.119 4.634 4.631 1.00 0.00 C ATOM 1639 CG ASP A 105 17.174 6.012 5.293 1.00 0.00 C ATOM 1640 OD1 ASP A 105 16.824 6.989 4.597 1.00 0.00 O ATOM 1641 OD2 ASP A 105 17.564 6.057 6.480 1.00 0.00 O ATOM 0 H ASP A 105 14.450 3.319 3.700 1.00 0.00 H new ATOM 0 HA ASP A 105 16.141 5.459 2.902 1.00 0.00 H new ATOM 0 HB2 ASP A 105 16.841 3.897 5.384 1.00 0.00 H new ATOM 0 HB3 ASP A 105 18.119 4.374 4.285 1.00 0.00 H new ATOM 1646 N ILE A 106 15.760 2.998 1.625 1.00 0.00 N ATOM 1647 CA ILE A 106 16.071 1.915 0.709 1.00 0.00 C ATOM 1648 C ILE A 106 16.503 2.499 -0.638 1.00 0.00 C ATOM 1649 O ILE A 106 17.235 1.859 -1.390 1.00 0.00 O ATOM 1650 CB ILE A 106 14.894 0.942 0.609 1.00 0.00 C ATOM 1651 CG1 ILE A 106 15.055 0.009 -0.593 1.00 0.00 C ATOM 1652 CG2 ILE A 106 13.563 1.695 0.576 1.00 0.00 C ATOM 1653 CD1 ILE A 106 14.286 -1.297 -0.379 1.00 0.00 C ATOM 0 H ILE A 106 14.849 3.433 1.477 1.00 0.00 H new ATOM 0 HA ILE A 106 16.909 1.328 1.085 1.00 0.00 H new ATOM 0 HB ILE A 106 14.889 0.318 1.502 1.00 0.00 H new ATOM 0 HG12 ILE A 106 14.694 0.505 -1.494 1.00 0.00 H new ATOM 0 HG13 ILE A 106 16.111 -0.208 -0.751 1.00 0.00 H new ATOM 0 HG21 ILE A 106 12.743 0.981 0.505 1.00 0.00 H new ATOM 0 HG22 ILE A 106 13.455 2.282 1.488 1.00 0.00 H new ATOM 0 HG23 ILE A 106 13.542 2.359 -0.288 1.00 0.00 H new ATOM 0 HD11 ILE A 106 14.417 -1.943 -1.247 1.00 0.00 H new ATOM 0 HD12 ILE A 106 14.666 -1.802 0.509 1.00 0.00 H new ATOM 0 HD13 ILE A 106 13.227 -1.078 -0.246 1.00 0.00 H new ATOM 1665 N SER A 107 16.030 3.708 -0.900 1.00 0.00 N ATOM 1666 CA SER A 107 16.358 4.387 -2.143 1.00 0.00 C ATOM 1667 C SER A 107 17.866 4.630 -2.224 1.00 0.00 C ATOM 1668 O SER A 107 18.395 4.920 -3.296 1.00 0.00 O ATOM 1669 CB SER A 107 15.598 5.709 -2.266 1.00 0.00 C ATOM 1670 OG SER A 107 16.010 6.457 -3.407 1.00 0.00 O ATOM 0 H SER A 107 15.422 4.235 -0.273 1.00 0.00 H new ATOM 0 HA SER A 107 16.055 3.748 -2.972 1.00 0.00 H new ATOM 0 HB2 SER A 107 14.529 5.508 -2.331 1.00 0.00 H new ATOM 0 HB3 SER A 107 15.756 6.303 -1.366 1.00 0.00 H new ATOM 0 HG SER A 107 16.921 6.197 -3.657 1.00 0.00 H new ATOM 1676 N GLU A 108 18.516 4.504 -1.077 1.00 0.00 N ATOM 1677 CA GLU A 108 19.953 4.707 -1.004 1.00 0.00 C ATOM 1678 C GLU A 108 20.680 3.361 -1.004 1.00 0.00 C ATOM 1679 O GLU A 108 21.874 3.296 -1.296 1.00 0.00 O ATOM 1680 CB GLU A 108 20.329 5.534 0.227 1.00 0.00 C ATOM 1681 CG GLU A 108 19.772 4.899 1.503 1.00 0.00 C ATOM 1682 CD GLU A 108 20.458 5.472 2.745 1.00 0.00 C ATOM 1683 OE1 GLU A 108 20.598 6.714 2.794 1.00 0.00 O ATOM 1684 OE2 GLU A 108 20.827 4.657 3.617 1.00 0.00 O ATOM 0 H GLU A 108 18.074 4.264 -0.190 1.00 0.00 H new ATOM 0 HA GLU A 108 20.266 5.267 -1.885 1.00 0.00 H new ATOM 0 HB2 GLU A 108 21.414 5.613 0.299 1.00 0.00 H new ATOM 0 HB3 GLU A 108 19.942 6.547 0.121 1.00 0.00 H new ATOM 0 HG2 GLU A 108 18.698 5.075 1.562 1.00 0.00 H new ATOM 0 HG3 GLU A 108 19.916 3.819 1.469 1.00 0.00 H new ATOM 1691 N ILE A 109 19.931 2.319 -0.674 1.00 0.00 N ATOM 1692 CA ILE A 109 20.489 0.979 -0.633 1.00 0.00 C ATOM 1693 C ILE A 109 20.757 0.497 -2.060 1.00 0.00 C ATOM 1694 O ILE A 109 21.661 -0.304 -2.289 1.00 0.00 O ATOM 1695 CB ILE A 109 19.582 0.046 0.172 1.00 0.00 C ATOM 1696 CG1 ILE A 109 19.426 0.538 1.612 1.00 0.00 C ATOM 1697 CG2 ILE A 109 20.087 -1.397 0.111 1.00 0.00 C ATOM 1698 CD1 ILE A 109 18.396 -0.302 2.370 1.00 0.00 C ATOM 0 H ILE A 109 18.942 2.376 -0.432 1.00 0.00 H new ATOM 0 HA ILE A 109 21.447 0.981 -0.113 1.00 0.00 H new ATOM 0 HB ILE A 109 18.591 0.060 -0.281 1.00 0.00 H new ATOM 0 HG12 ILE A 109 20.388 0.489 2.123 1.00 0.00 H new ATOM 0 HG13 ILE A 109 19.118 1.584 1.611 1.00 0.00 H new ATOM 0 HG21 ILE A 109 19.424 -2.039 0.691 1.00 0.00 H new ATOM 0 HG22 ILE A 109 20.102 -1.734 -0.926 1.00 0.00 H new ATOM 0 HG23 ILE A 109 21.095 -1.448 0.524 1.00 0.00 H new ATOM 0 HD11 ILE A 109 18.304 0.069 3.391 1.00 0.00 H new ATOM 0 HD12 ILE A 109 17.430 -0.231 1.870 1.00 0.00 H new ATOM 0 HD13 ILE A 109 18.719 -1.343 2.390 1.00 0.00 H new ATOM 1710 N LEU A 110 19.954 1.008 -2.982 1.00 0.00 N ATOM 1711 CA LEU A 110 20.093 0.640 -4.381 1.00 0.00 C ATOM 1712 C LEU A 110 21.501 0.997 -4.860 1.00 0.00 C ATOM 1713 O LEU A 110 22.284 0.115 -5.208 1.00 0.00 O ATOM 1714 CB LEU A 110 18.979 1.277 -5.215 1.00 0.00 C ATOM 1715 CG LEU A 110 17.628 0.560 -5.188 1.00 0.00 C ATOM 1716 CD1 LEU A 110 16.477 1.554 -5.361 1.00 0.00 C ATOM 1717 CD2 LEU A 110 17.580 -0.559 -6.232 1.00 0.00 C ATOM 0 H LEU A 110 19.206 1.673 -2.788 1.00 0.00 H new ATOM 0 HA LEU A 110 19.977 -0.437 -4.506 1.00 0.00 H new ATOM 0 HB2 LEU A 110 18.832 2.300 -4.868 1.00 0.00 H new ATOM 0 HB3 LEU A 110 19.316 1.337 -6.250 1.00 0.00 H new ATOM 0 HG LEU A 110 17.508 0.094 -4.210 1.00 0.00 H new ATOM 0 HD11 LEU A 110 15.528 1.019 -5.338 1.00 0.00 H new ATOM 0 HD12 LEU A 110 16.502 2.284 -4.552 1.00 0.00 H new ATOM 0 HD13 LEU A 110 16.581 2.068 -6.316 1.00 0.00 H new ATOM 0 HD21 LEU A 110 16.609 -1.053 -6.192 1.00 0.00 H new ATOM 0 HD22 LEU A 110 17.732 -0.137 -7.225 1.00 0.00 H new ATOM 0 HD23 LEU A 110 18.365 -1.285 -6.023 1.00 0.00 H new ATOM 1729 N GLU A 111 21.780 2.292 -4.865 1.00 0.00 N ATOM 1730 CA GLU A 111 23.080 2.777 -5.295 1.00 0.00 C ATOM 1731 C GLU A 111 23.561 1.991 -6.517 1.00 0.00 C ATOM 1732 O GLU A 111 24.461 1.160 -6.410 1.00 0.00 O ATOM 1733 CB GLU A 111 24.100 2.698 -4.157 1.00 0.00 C ATOM 1734 CG GLU A 111 24.390 4.086 -3.584 1.00 0.00 C ATOM 1735 CD GLU A 111 25.013 3.985 -2.190 1.00 0.00 C ATOM 1736 OE1 GLU A 111 26.029 3.265 -2.074 1.00 0.00 O ATOM 1737 OE2 GLU A 111 24.461 4.629 -1.272 1.00 0.00 O ATOM 0 H GLU A 111 21.127 3.021 -4.578 1.00 0.00 H new ATOM 0 HA GLU A 111 22.980 3.825 -5.576 1.00 0.00 H new ATOM 0 HB2 GLU A 111 23.721 2.047 -3.369 1.00 0.00 H new ATOM 0 HB3 GLU A 111 25.024 2.251 -4.523 1.00 0.00 H new ATOM 0 HG2 GLU A 111 25.065 4.624 -4.250 1.00 0.00 H new ATOM 0 HG3 GLU A 111 23.466 4.662 -3.532 1.00 0.00 H new ATOM 1744 N SER A 112 22.938 2.281 -7.650 1.00 0.00 N ATOM 1745 CA SER A 112 23.292 1.613 -8.890 1.00 0.00 C ATOM 1746 C SER A 112 23.555 2.648 -9.986 1.00 0.00 C ATOM 1747 O SER A 112 23.215 3.819 -9.833 1.00 0.00 O ATOM 1748 CB SER A 112 22.190 0.645 -9.328 1.00 0.00 C ATOM 1749 OG SER A 112 22.509 -0.706 -9.008 1.00 0.00 O ATOM 0 H SER A 112 22.190 2.970 -7.735 1.00 0.00 H new ATOM 0 HA SER A 112 24.200 1.035 -8.720 1.00 0.00 H new ATOM 0 HB2 SER A 112 21.252 0.920 -8.845 1.00 0.00 H new ATOM 0 HB3 SER A 112 22.034 0.736 -10.403 1.00 0.00 H new ATOM 0 HG SER A 112 21.781 -1.292 -9.302 1.00 0.00 H new ATOM 1755 N GLY A 113 24.158 2.177 -11.068 1.00 0.00 N ATOM 1756 CA GLY A 113 24.471 3.047 -12.189 1.00 0.00 C ATOM 1757 C GLY A 113 23.263 3.200 -13.117 1.00 0.00 C ATOM 1758 O GLY A 113 22.413 2.314 -13.188 1.00 0.00 O ATOM 0 H GLY A 113 24.438 1.204 -11.192 1.00 0.00 H new ATOM 0 HA2 GLY A 113 24.777 4.026 -11.820 1.00 0.00 H new ATOM 0 HA3 GLY A 113 25.314 2.639 -12.747 1.00 0.00 H new ATOM 1762 N PRO A 114 23.227 4.361 -13.825 1.00 0.00 N ATOM 1763 CA PRO A 114 22.139 4.642 -14.746 1.00 0.00 C ATOM 1764 C PRO A 114 22.282 3.823 -16.030 1.00 0.00 C ATOM 1765 O PRO A 114 23.227 3.050 -16.176 1.00 0.00 O ATOM 1766 CB PRO A 114 22.205 6.141 -14.987 1.00 0.00 C ATOM 1767 CG PRO A 114 23.600 6.570 -14.566 1.00 0.00 C ATOM 1768 CD PRO A 114 24.217 5.433 -13.768 1.00 0.00 C ATOM 0 HA PRO A 114 21.165 4.359 -14.346 1.00 0.00 H new ATOM 0 HB2 PRO A 114 22.024 6.376 -16.036 1.00 0.00 H new ATOM 0 HB3 PRO A 114 21.444 6.664 -14.407 1.00 0.00 H new ATOM 0 HG2 PRO A 114 24.210 6.797 -15.441 1.00 0.00 H new ATOM 0 HG3 PRO A 114 23.555 7.478 -13.964 1.00 0.00 H new ATOM 0 HD2 PRO A 114 25.168 5.118 -14.198 1.00 0.00 H new ATOM 0 HD3 PRO A 114 24.417 5.734 -12.739 1.00 0.00 H new ATOM 1776 N SER A 115 21.329 4.020 -16.930 1.00 0.00 N ATOM 1777 CA SER A 115 21.338 3.310 -18.198 1.00 0.00 C ATOM 1778 C SER A 115 20.778 4.206 -19.304 1.00 0.00 C ATOM 1779 O SER A 115 19.815 4.940 -19.085 1.00 0.00 O ATOM 1780 CB SER A 115 20.532 2.013 -18.107 1.00 0.00 C ATOM 1781 OG SER A 115 20.542 1.292 -19.336 1.00 0.00 O ATOM 0 H SER A 115 20.546 4.661 -16.806 1.00 0.00 H new ATOM 0 HA SER A 115 22.369 3.050 -18.438 1.00 0.00 H new ATOM 0 HB2 SER A 115 20.942 1.386 -17.315 1.00 0.00 H new ATOM 0 HB3 SER A 115 19.503 2.244 -17.830 1.00 0.00 H new ATOM 0 HG SER A 115 20.018 0.470 -19.237 1.00 0.00 H new ATOM 1787 N SER A 116 21.406 4.118 -20.468 1.00 0.00 N ATOM 1788 CA SER A 116 20.982 4.912 -21.608 1.00 0.00 C ATOM 1789 C SER A 116 19.724 4.303 -22.231 1.00 0.00 C ATOM 1790 O SER A 116 19.672 3.100 -22.484 1.00 0.00 O ATOM 1791 CB SER A 116 22.096 5.013 -22.653 1.00 0.00 C ATOM 1792 OG SER A 116 23.014 6.062 -22.352 1.00 0.00 O ATOM 0 H SER A 116 22.205 3.509 -20.646 1.00 0.00 H new ATOM 0 HA SER A 116 20.756 5.919 -21.258 1.00 0.00 H new ATOM 0 HB2 SER A 116 22.632 4.065 -22.705 1.00 0.00 H new ATOM 0 HB3 SER A 116 21.657 5.185 -23.636 1.00 0.00 H new ATOM 0 HG SER A 116 23.711 6.094 -23.040 1.00 0.00 H new ATOM 1798 N GLY A 117 18.741 5.161 -22.461 1.00 0.00 N ATOM 1799 CA GLY A 117 17.488 4.723 -23.051 1.00 0.00 C ATOM 1800 C GLY A 117 16.318 4.967 -22.094 1.00 0.00 C ATOM 1801 O GLY A 117 16.410 5.799 -21.194 1.00 0.00 O ATOM 0 H GLY A 117 18.787 6.158 -22.249 1.00 0.00 H new ATOM 0 HA2 GLY A 117 17.316 5.256 -23.986 1.00 0.00 H new ATOM 0 HA3 GLY A 117 17.548 3.662 -23.296 1.00 0.00 H new TER 1805 GLY A 117