USER MOD reduce.3.24.130724 H: found=0, std=0, add=912, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 915 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 3 SER OG : rot 169:sc= 0.829 USER MOD Set 1.2: A 101 HIS : no HE2:sc= -1.55 K(o=-0.72,f=-4.2) USER MOD Set 2.1: A 33 SER OG : rot -68:sc= 0.312 USER MOD Set 2.2: A 36 THR OG1 : rot -64:sc= -0.372 USER MOD Set 3.1: A 25 ASN : amide:sc= -0.604 K(o=-2,f=-7.7!) USER MOD Set 3.2: A 27 ASN : amide:sc= -1.37! X(o=-2!,f=-1.8) USER MOD Set 4.1: A 15 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 63 ASN : amide:sc= -1.05 K(o=-0.45,f=-2.8) USER MOD Set 4.3: A 64 SER OG : rot -42:sc= 0.598 USER MOD Set 5.1: A 10 GLN : amide:sc= -2.16 X(o=-3,f=-2.7) USER MOD Set 5.2: A 14 SER OG : rot -150:sc= -0.88 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot -100:sc= -0.697 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN :FLIP amide:sc= -2.4 F(o=-2.9,f=-2.4) USER MOD Single : A 53 GLN : amide:sc= -2.21 K(o=-2.2,f=-8.7!) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -137:sc= -0.0448 (180deg=-1.76!) USER MOD Single : A 60 CYS SG : rot 150:sc= -5.28! USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.0177 USER MOD Single : A 79 SER OG : rot -50:sc= -2.29 USER MOD Single : A 83 MET CE :methyl 150:sc= 0 (180deg=-0.607) USER MOD Single : A 84 CYS SG : rot -122:sc= 0.79 USER MOD Single : A 87 HIS :FLIP no HD1:sc= -0.0406 F(o=-0.63,f=-0.041) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 CYS SG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0.0457 USER MOD Single : A 131 HIS :FLIP no HE2:sc= -2.1 F(o=-4.7!,f=-2.1) USER MOD Single : A 140 TYR OH : rot 180:sc= -1.03 USER MOD Single : A 146 SER OG : rot -126:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 32 N SER A 3 6.199 4.825 10.845 1.00 0.00 N ATOM 33 CA SER A 3 5.064 4.545 9.975 1.00 0.00 C ATOM 34 C SER A 3 4.301 3.313 10.454 1.00 0.00 C ATOM 35 O SER A 3 4.881 2.410 11.057 1.00 0.00 O ATOM 36 CB SER A 3 5.537 4.337 8.535 1.00 0.00 C ATOM 37 OG SER A 3 6.463 3.269 8.451 1.00 0.00 O ATOM 0 HA SER A 3 4.392 5.403 10.010 1.00 0.00 H new ATOM 0 HB2 SER A 3 4.680 4.130 7.894 1.00 0.00 H new ATOM 0 HB3 SER A 3 5.999 5.252 8.165 1.00 0.00 H new ATOM 0 HG SER A 3 6.618 3.044 7.510 1.00 0.00 H new ATOM 43 N GLY A 4 3.000 3.282 10.183 1.00 0.00 N ATOM 44 CA GLY A 4 2.187 2.152 10.598 1.00 0.00 C ATOM 45 C GLY A 4 0.884 2.055 9.827 1.00 0.00 C ATOM 46 O GLY A 4 0.333 3.066 9.399 1.00 0.00 O ATOM 0 H GLY A 4 2.495 4.016 9.686 1.00 0.00 H new ATOM 0 HA2 GLY A 4 2.755 1.232 10.462 1.00 0.00 H new ATOM 0 HA3 GLY A 4 1.969 2.238 11.663 1.00 0.00 H new ATOM 50 N LEU A 5 0.387 0.834 9.653 1.00 0.00 N ATOM 51 CA LEU A 5 -0.859 0.615 8.930 1.00 0.00 C ATOM 52 C LEU A 5 -2.044 1.169 9.711 1.00 0.00 C ATOM 53 O LEU A 5 -2.233 0.849 10.884 1.00 0.00 O ATOM 54 CB LEU A 5 -1.065 -0.877 8.661 1.00 0.00 C ATOM 55 CG LEU A 5 -2.104 -1.204 7.583 1.00 0.00 C ATOM 56 CD1 LEU A 5 -3.505 -0.898 8.086 1.00 0.00 C ATOM 57 CD2 LEU A 5 -1.811 -0.429 6.305 1.00 0.00 C ATOM 0 H LEU A 5 0.828 -0.017 10.003 1.00 0.00 H new ATOM 0 HA LEU A 5 -0.793 1.142 7.978 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -0.110 -1.313 8.368 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -1.364 -1.360 9.591 1.00 0.00 H new ATOM 0 HG LEU A 5 -2.045 -2.269 7.358 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -4.231 -1.136 7.308 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -3.713 -1.498 8.972 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -3.578 0.160 8.339 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -2.559 -0.674 5.551 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -1.842 0.641 6.513 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.822 -0.698 5.935 1.00 0.00 H new ATOM 69 N GLU A 6 -2.843 2.001 9.051 1.00 0.00 N ATOM 70 CA GLU A 6 -4.012 2.600 9.683 1.00 0.00 C ATOM 71 C GLU A 6 -5.204 2.600 8.732 1.00 0.00 C ATOM 72 O GLU A 6 -5.039 2.680 7.514 1.00 0.00 O ATOM 73 CB GLU A 6 -3.700 4.029 10.132 1.00 0.00 C ATOM 74 CG GLU A 6 -3.214 4.124 11.570 1.00 0.00 C ATOM 75 CD GLU A 6 -4.242 3.620 12.565 1.00 0.00 C ATOM 76 OE1 GLU A 6 -5.451 3.745 12.285 1.00 0.00 O ATOM 77 OE2 GLU A 6 -3.835 3.102 13.627 1.00 0.00 O ATOM 0 H GLU A 6 -2.702 2.275 8.079 1.00 0.00 H new ATOM 0 HA GLU A 6 -4.269 2.001 10.557 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -2.941 4.450 9.473 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -4.596 4.640 10.019 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -2.295 3.548 11.678 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -2.969 5.161 11.800 1.00 0.00 H new ATOM 84 N VAL A 7 -6.404 2.510 9.296 1.00 0.00 N ATOM 85 CA VAL A 7 -7.624 2.500 8.499 1.00 0.00 C ATOM 86 C VAL A 7 -8.189 3.907 8.345 1.00 0.00 C ATOM 87 O VAL A 7 -8.842 4.427 9.251 1.00 0.00 O ATOM 88 CB VAL A 7 -8.700 1.594 9.128 1.00 0.00 C ATOM 89 CG1 VAL A 7 -9.884 1.437 8.186 1.00 0.00 C ATOM 90 CG2 VAL A 7 -8.111 0.239 9.488 1.00 0.00 C ATOM 0 H VAL A 7 -6.557 2.443 10.302 1.00 0.00 H new ATOM 0 HA VAL A 7 -7.358 2.107 7.518 1.00 0.00 H new ATOM 0 HB VAL A 7 -9.056 2.065 10.044 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -10.633 0.794 8.648 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -10.320 2.415 7.984 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -9.548 0.989 7.251 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -8.885 -0.388 9.931 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -7.726 -0.241 8.588 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -7.299 0.373 10.203 1.00 0.00 H new ATOM 100 N LEU A 8 -7.934 4.520 7.195 1.00 0.00 N ATOM 101 CA LEU A 8 -8.418 5.869 6.923 1.00 0.00 C ATOM 102 C LEU A 8 -9.879 5.847 6.491 1.00 0.00 C ATOM 103 O LEU A 8 -10.479 4.780 6.353 1.00 0.00 O ATOM 104 CB LEU A 8 -7.565 6.533 5.842 1.00 0.00 C ATOM 105 CG LEU A 8 -6.060 6.526 6.109 1.00 0.00 C ATOM 106 CD1 LEU A 8 -5.285 6.554 4.801 1.00 0.00 C ATOM 107 CD2 LEU A 8 -5.670 7.706 6.987 1.00 0.00 C ATOM 0 H LEU A 8 -7.395 4.105 6.435 1.00 0.00 H new ATOM 0 HA LEU A 8 -8.339 6.447 7.844 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.752 6.030 4.893 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.893 7.566 5.726 1.00 0.00 H new ATOM 0 HG LEU A 8 -5.808 5.606 6.637 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.216 6.549 5.012 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.542 5.677 4.207 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.541 7.456 4.246 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -4.595 7.686 7.167 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.936 8.636 6.485 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -6.199 7.642 7.938 1.00 0.00 H new ATOM 119 N PHE A 9 -10.447 7.029 6.277 1.00 0.00 N ATOM 120 CA PHE A 9 -11.839 7.141 5.860 1.00 0.00 C ATOM 121 C PHE A 9 -11.970 8.034 4.631 1.00 0.00 C ATOM 122 O PHE A 9 -11.534 9.185 4.635 1.00 0.00 O ATOM 123 CB PHE A 9 -12.693 7.691 7.003 1.00 0.00 C ATOM 124 CG PHE A 9 -13.374 6.617 7.806 1.00 0.00 C ATOM 125 CD1 PHE A 9 -12.637 5.766 8.614 1.00 0.00 C ATOM 126 CD2 PHE A 9 -14.749 6.460 7.752 1.00 0.00 C ATOM 127 CE1 PHE A 9 -13.259 4.779 9.354 1.00 0.00 C ATOM 128 CE2 PHE A 9 -15.377 5.473 8.488 1.00 0.00 C ATOM 129 CZ PHE A 9 -14.631 4.632 9.291 1.00 0.00 C ATOM 0 H PHE A 9 -9.965 7.922 6.385 1.00 0.00 H new ATOM 0 HA PHE A 9 -12.195 6.145 5.599 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -12.063 8.285 7.665 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -13.448 8.362 6.593 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -11.564 5.876 8.666 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -15.337 7.116 7.128 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -12.673 4.123 9.981 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -16.450 5.359 8.435 1.00 0.00 H new ATOM 0 HZ PHE A 9 -15.120 3.861 9.868 1.00 0.00 H new ATOM 139 N GLN A 10 -12.575 7.492 3.580 1.00 0.00 N ATOM 140 CA GLN A 10 -12.768 8.228 2.337 1.00 0.00 C ATOM 141 C GLN A 10 -13.979 9.151 2.430 1.00 0.00 C ATOM 142 O GLN A 10 -15.018 8.779 2.974 1.00 0.00 O ATOM 143 CB GLN A 10 -12.945 7.255 1.169 1.00 0.00 C ATOM 144 CG GLN A 10 -12.238 7.699 -0.098 1.00 0.00 C ATOM 145 CD GLN A 10 -12.990 8.792 -0.832 1.00 0.00 C ATOM 146 OE1 GLN A 10 -14.186 8.669 -1.094 1.00 0.00 O ATOM 147 NE2 GLN A 10 -12.288 9.866 -1.171 1.00 0.00 N ATOM 0 H GLN A 10 -12.942 6.540 3.565 1.00 0.00 H new ATOM 0 HA GLN A 10 -11.882 8.839 2.165 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -12.568 6.275 1.462 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -14.009 7.138 0.961 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -11.239 8.056 0.154 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -12.113 6.842 -0.759 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -11.298 9.924 -0.933 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -12.739 10.633 -1.670 1.00 0.00 H new ATOM 156 N GLY A 11 -13.836 10.356 1.888 1.00 0.00 N ATOM 157 CA GLY A 11 -14.922 11.317 1.910 1.00 0.00 C ATOM 158 C GLY A 11 -15.314 11.774 0.517 1.00 0.00 C ATOM 159 O GLY A 11 -16.308 11.303 -0.035 1.00 0.00 O ATOM 0 H GLY A 11 -12.984 10.684 1.433 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -15.788 10.873 2.401 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -14.627 12.182 2.504 1.00 0.00 H new ATOM 163 N PRO A 12 -14.541 12.695 -0.084 1.00 0.00 N ATOM 164 CA PRO A 12 -14.821 13.206 -1.429 1.00 0.00 C ATOM 165 C PRO A 12 -14.544 12.163 -2.507 1.00 0.00 C ATOM 166 O PRO A 12 -14.378 10.981 -2.212 1.00 0.00 O ATOM 167 CB PRO A 12 -13.859 14.388 -1.566 1.00 0.00 C ATOM 168 CG PRO A 12 -12.730 14.062 -0.651 1.00 0.00 C ATOM 169 CD PRO A 12 -13.333 13.307 0.502 1.00 0.00 C ATOM 0 HA PRO A 12 -15.869 13.478 -1.556 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -13.516 14.502 -2.594 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -14.340 15.325 -1.284 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -11.977 13.460 -1.160 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -12.233 14.969 -0.306 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -12.649 12.553 0.890 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -13.580 13.970 1.331 1.00 0.00 H new ATOM 177 N GLY A 13 -14.496 12.609 -3.760 1.00 0.00 N ATOM 178 CA GLY A 13 -14.239 11.698 -4.861 1.00 0.00 C ATOM 179 C GLY A 13 -12.833 11.132 -4.826 1.00 0.00 C ATOM 180 O GLY A 13 -11.874 11.811 -5.189 1.00 0.00 O ATOM 0 H GLY A 13 -14.630 13.583 -4.031 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -14.958 10.880 -4.827 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -14.394 12.220 -5.805 1.00 0.00 H new ATOM 184 N SER A 14 -12.712 9.881 -4.391 1.00 0.00 N ATOM 185 CA SER A 14 -11.412 9.223 -4.312 1.00 0.00 C ATOM 186 C SER A 14 -10.872 8.917 -5.708 1.00 0.00 C ATOM 187 O SER A 14 -11.593 8.403 -6.563 1.00 0.00 O ATOM 188 CB SER A 14 -11.520 7.933 -3.494 1.00 0.00 C ATOM 189 OG SER A 14 -10.596 7.929 -2.421 1.00 0.00 O ATOM 0 H SER A 14 -13.497 9.304 -4.088 1.00 0.00 H new ATOM 0 HA SER A 14 -10.717 9.900 -3.816 1.00 0.00 H new ATOM 0 HB2 SER A 14 -12.533 7.829 -3.106 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.336 7.074 -4.139 1.00 0.00 H new ATOM 0 HG SER A 14 -10.331 7.007 -2.221 1.00 0.00 H new ATOM 195 N THR A 15 -9.603 9.242 -5.930 1.00 0.00 N ATOM 196 CA THR A 15 -8.968 9.008 -7.222 1.00 0.00 C ATOM 197 C THR A 15 -8.504 7.566 -7.356 1.00 0.00 C ATOM 198 O THR A 15 -7.433 7.205 -6.873 1.00 0.00 O ATOM 199 CB THR A 15 -7.779 9.953 -7.406 1.00 0.00 C ATOM 200 OG1 THR A 15 -8.181 11.302 -7.243 1.00 0.00 O ATOM 201 CG2 THR A 15 -7.122 9.832 -8.764 1.00 0.00 C ATOM 0 H THR A 15 -8.994 9.668 -5.232 1.00 0.00 H new ATOM 0 HA THR A 15 -9.709 9.203 -7.998 1.00 0.00 H new ATOM 0 HB THR A 15 -7.057 9.660 -6.644 1.00 0.00 H new ATOM 0 HG1 THR A 15 -7.407 11.891 -7.363 1.00 0.00 H new ATOM 0 HG21 THR A 15 -6.287 10.529 -8.828 1.00 0.00 H new ATOM 0 HG22 THR A 15 -6.756 8.814 -8.902 1.00 0.00 H new ATOM 0 HG23 THR A 15 -7.849 10.065 -9.542 1.00 0.00 H new ATOM 209 N VAL A 16 -9.307 6.749 -8.033 1.00 0.00 N ATOM 210 CA VAL A 16 -8.957 5.353 -8.242 1.00 0.00 C ATOM 211 C VAL A 16 -8.002 5.224 -9.419 1.00 0.00 C ATOM 212 O VAL A 16 -8.379 5.442 -10.571 1.00 0.00 O ATOM 213 CB VAL A 16 -10.199 4.471 -8.493 1.00 0.00 C ATOM 214 CG1 VAL A 16 -9.794 3.022 -8.724 1.00 0.00 C ATOM 215 CG2 VAL A 16 -11.174 4.574 -7.329 1.00 0.00 C ATOM 0 H VAL A 16 -10.198 7.030 -8.442 1.00 0.00 H new ATOM 0 HA VAL A 16 -8.476 5.003 -7.329 1.00 0.00 H new ATOM 0 HB VAL A 16 -10.697 4.834 -9.392 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -10.685 2.419 -8.899 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -9.139 2.961 -9.593 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -9.268 2.647 -7.846 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -12.042 3.945 -7.525 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -10.684 4.241 -6.414 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -11.494 5.609 -7.213 1.00 0.00 H new ATOM 225 N VAL A 17 -6.762 4.875 -9.116 1.00 0.00 N ATOM 226 CA VAL A 17 -5.734 4.720 -10.138 1.00 0.00 C ATOM 227 C VAL A 17 -5.450 3.249 -10.403 1.00 0.00 C ATOM 228 O VAL A 17 -4.983 2.877 -11.479 1.00 0.00 O ATOM 229 CB VAL A 17 -4.424 5.426 -9.730 1.00 0.00 C ATOM 230 CG1 VAL A 17 -4.377 6.836 -10.299 1.00 0.00 C ATOM 231 CG2 VAL A 17 -4.282 5.456 -8.217 1.00 0.00 C ATOM 0 H VAL A 17 -6.440 4.692 -8.166 1.00 0.00 H new ATOM 0 HA VAL A 17 -6.114 5.184 -11.048 1.00 0.00 H new ATOM 0 HB VAL A 17 -3.588 4.861 -10.142 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -3.446 7.318 -10.001 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.430 6.791 -11.387 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -5.221 7.410 -9.918 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -3.352 5.958 -7.949 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -5.124 5.996 -7.783 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -4.268 4.436 -7.833 1.00 0.00 H new ATOM 241 N ALA A 18 -5.745 2.418 -9.414 1.00 0.00 N ATOM 242 CA ALA A 18 -5.537 0.985 -9.533 1.00 0.00 C ATOM 243 C ALA A 18 -6.727 0.220 -8.971 1.00 0.00 C ATOM 244 O ALA A 18 -7.330 0.633 -7.981 1.00 0.00 O ATOM 245 CB ALA A 18 -4.254 0.569 -8.823 1.00 0.00 C ATOM 0 H ALA A 18 -6.131 2.714 -8.517 1.00 0.00 H new ATOM 0 HA ALA A 18 -5.441 0.742 -10.591 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -4.115 -0.508 -8.923 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -3.406 1.087 -9.271 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -4.322 0.829 -7.767 1.00 0.00 H new ATOM 251 N THR A 19 -7.060 -0.897 -9.603 1.00 0.00 N ATOM 252 CA THR A 19 -8.177 -1.715 -9.156 1.00 0.00 C ATOM 253 C THR A 19 -7.836 -3.196 -9.239 1.00 0.00 C ATOM 254 O THR A 19 -7.759 -3.767 -10.326 1.00 0.00 O ATOM 255 CB THR A 19 -9.425 -1.421 -9.989 1.00 0.00 C ATOM 256 OG1 THR A 19 -9.705 -0.032 -9.999 1.00 0.00 O ATOM 257 CG2 THR A 19 -10.658 -2.136 -9.483 1.00 0.00 C ATOM 0 H THR A 19 -6.574 -1.256 -10.425 1.00 0.00 H new ATOM 0 HA THR A 19 -8.379 -1.464 -8.115 1.00 0.00 H new ATOM 0 HB THR A 19 -9.199 -1.783 -10.992 1.00 0.00 H new ATOM 0 HG1 THR A 19 -10.506 0.136 -10.538 1.00 0.00 H new ATOM 0 HG21 THR A 19 -11.509 -1.886 -10.116 1.00 0.00 H new ATOM 0 HG22 THR A 19 -10.490 -3.213 -9.509 1.00 0.00 H new ATOM 0 HG23 THR A 19 -10.864 -1.825 -8.459 1.00 0.00 H new ATOM 265 N ALA A 20 -7.642 -3.813 -8.081 1.00 0.00 N ATOM 266 CA ALA A 20 -7.323 -5.235 -8.017 1.00 0.00 C ATOM 267 C ALA A 20 -8.573 -6.039 -7.676 1.00 0.00 C ATOM 268 O ALA A 20 -9.226 -5.779 -6.666 1.00 0.00 O ATOM 269 CB ALA A 20 -6.221 -5.490 -6.996 1.00 0.00 C ATOM 0 H ALA A 20 -7.700 -3.352 -7.173 1.00 0.00 H new ATOM 0 HA ALA A 20 -6.961 -5.557 -8.993 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -5.996 -6.556 -6.962 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -5.325 -4.939 -7.282 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -6.552 -5.157 -6.012 1.00 0.00 H new ATOM 275 N ARG A 21 -8.919 -7.005 -8.526 1.00 0.00 N ATOM 276 CA ARG A 21 -10.110 -7.818 -8.297 1.00 0.00 C ATOM 277 C ARG A 21 -9.850 -9.298 -8.545 1.00 0.00 C ATOM 278 O ARG A 21 -9.205 -9.674 -9.524 1.00 0.00 O ATOM 279 CB ARG A 21 -11.260 -7.351 -9.197 1.00 0.00 C ATOM 280 CG ARG A 21 -11.291 -5.849 -9.434 1.00 0.00 C ATOM 281 CD ARG A 21 -10.287 -5.431 -10.492 1.00 0.00 C ATOM 282 NE ARG A 21 -10.931 -5.119 -11.767 1.00 0.00 N ATOM 283 CZ ARG A 21 -10.265 -4.846 -12.886 1.00 0.00 C ATOM 284 NH1 ARG A 21 -8.937 -4.840 -12.893 1.00 0.00 N ATOM 285 NH2 ARG A 21 -10.928 -4.575 -14.002 1.00 0.00 N ATOM 0 H ARG A 21 -8.397 -7.241 -9.370 1.00 0.00 H new ATOM 0 HA ARG A 21 -10.383 -7.690 -7.249 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -11.184 -7.858 -10.159 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -12.205 -7.657 -8.749 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -12.292 -5.549 -9.743 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -11.076 -5.328 -8.501 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -9.734 -4.559 -10.142 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -9.561 -6.231 -10.639 1.00 0.00 H new ATOM 0 HE ARG A 21 -11.950 -5.110 -11.801 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -8.422 -5.046 -12.037 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -8.432 -4.630 -13.754 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -11.948 -4.576 -14.002 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -10.418 -4.366 -14.860 1.00 0.00 H new ATOM 299 N GLY A 22 -10.377 -10.136 -7.655 1.00 0.00 N ATOM 300 CA GLY A 22 -10.212 -11.567 -7.795 1.00 0.00 C ATOM 301 C GLY A 22 -11.211 -12.348 -6.966 1.00 0.00 C ATOM 302 O GLY A 22 -11.324 -12.143 -5.755 1.00 0.00 O ATOM 0 H GLY A 22 -10.916 -9.845 -6.839 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -10.321 -11.842 -8.844 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -9.201 -11.844 -7.497 1.00 0.00 H new ATOM 306 N ILE A 23 -11.932 -13.255 -7.616 1.00 0.00 N ATOM 307 CA ILE A 23 -12.914 -14.079 -6.923 1.00 0.00 C ATOM 308 C ILE A 23 -12.202 -15.180 -6.153 1.00 0.00 C ATOM 309 O ILE A 23 -11.439 -15.957 -6.726 1.00 0.00 O ATOM 310 CB ILE A 23 -13.938 -14.699 -7.899 1.00 0.00 C ATOM 311 CG1 ILE A 23 -14.857 -13.604 -8.463 1.00 0.00 C ATOM 312 CG2 ILE A 23 -14.748 -15.791 -7.204 1.00 0.00 C ATOM 313 CD1 ILE A 23 -16.210 -13.519 -7.783 1.00 0.00 C ATOM 0 H ILE A 23 -11.855 -13.437 -8.617 1.00 0.00 H new ATOM 0 HA ILE A 23 -13.463 -13.437 -6.234 1.00 0.00 H new ATOM 0 HB ILE A 23 -13.401 -15.159 -8.729 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -14.355 -12.641 -8.371 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -15.008 -13.784 -9.527 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -15.464 -16.216 -7.907 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -14.076 -16.574 -6.852 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -15.283 -15.363 -6.356 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -16.797 -12.722 -8.239 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -16.735 -14.468 -7.897 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -16.072 -13.306 -6.723 1.00 0.00 H new ATOM 325 N PHE A 24 -12.429 -15.223 -4.849 1.00 0.00 N ATOM 326 CA PHE A 24 -11.779 -16.211 -4.004 1.00 0.00 C ATOM 327 C PHE A 24 -12.791 -17.100 -3.291 1.00 0.00 C ATOM 328 O PHE A 24 -13.847 -16.644 -2.851 1.00 0.00 O ATOM 329 CB PHE A 24 -10.861 -15.497 -3.011 1.00 0.00 C ATOM 330 CG PHE A 24 -10.075 -14.387 -3.660 1.00 0.00 C ATOM 331 CD1 PHE A 24 -9.537 -14.560 -4.928 1.00 0.00 C ATOM 332 CD2 PHE A 24 -9.888 -13.173 -3.019 1.00 0.00 C ATOM 333 CE1 PHE A 24 -8.829 -13.547 -5.541 1.00 0.00 C ATOM 334 CE2 PHE A 24 -9.177 -12.156 -3.631 1.00 0.00 C ATOM 335 CZ PHE A 24 -8.649 -12.345 -4.893 1.00 0.00 C ATOM 0 H PHE A 24 -13.056 -14.588 -4.355 1.00 0.00 H new ATOM 0 HA PHE A 24 -11.180 -16.871 -4.632 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -11.458 -15.089 -2.196 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -10.172 -16.219 -2.571 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -9.675 -15.500 -5.441 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -10.301 -13.019 -2.033 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -8.416 -13.696 -6.528 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -9.035 -11.214 -3.122 1.00 0.00 H new ATOM 0 HZ PHE A 24 -8.095 -11.551 -5.372 1.00 0.00 H new ATOM 345 N ASN A 25 -12.453 -18.379 -3.206 1.00 0.00 N ATOM 346 CA ASN A 25 -13.305 -19.379 -2.577 1.00 0.00 C ATOM 347 C ASN A 25 -12.638 -19.952 -1.334 1.00 0.00 C ATOM 348 O ASN A 25 -11.449 -19.734 -1.104 1.00 0.00 O ATOM 349 CB ASN A 25 -13.629 -20.501 -3.564 1.00 0.00 C ATOM 350 CG ASN A 25 -12.384 -21.200 -4.076 1.00 0.00 C ATOM 351 OD1 ASN A 25 -11.280 -20.663 -3.993 1.00 0.00 O ATOM 352 ND2 ASN A 25 -12.558 -22.403 -4.609 1.00 0.00 N ATOM 0 H ASN A 25 -11.578 -18.754 -3.572 1.00 0.00 H new ATOM 0 HA ASN A 25 -14.234 -18.894 -2.278 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -14.278 -21.230 -3.080 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -14.184 -20.090 -4.407 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -11.757 -22.921 -4.971 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -13.492 -22.809 -4.657 1.00 0.00 H new ATOM 359 N SER A 26 -13.413 -20.675 -0.529 1.00 0.00 N ATOM 360 CA SER A 26 -12.899 -21.272 0.705 1.00 0.00 C ATOM 361 C SER A 26 -11.516 -21.888 0.494 1.00 0.00 C ATOM 362 O SER A 26 -10.713 -21.956 1.424 1.00 0.00 O ATOM 363 CB SER A 26 -13.865 -22.344 1.212 1.00 0.00 C ATOM 364 OG SER A 26 -13.575 -23.610 0.644 1.00 0.00 O ATOM 0 H SER A 26 -14.400 -20.863 -0.708 1.00 0.00 H new ATOM 0 HA SER A 26 -12.810 -20.478 1.446 1.00 0.00 H new ATOM 0 HB2 SER A 26 -13.803 -22.408 2.298 1.00 0.00 H new ATOM 0 HB3 SER A 26 -14.888 -22.059 0.967 1.00 0.00 H new ATOM 0 HG SER A 26 -14.194 -23.787 -0.095 1.00 0.00 H new ATOM 370 N ASN A 27 -11.230 -22.314 -0.734 1.00 0.00 N ATOM 371 CA ASN A 27 -9.930 -22.890 -1.051 1.00 0.00 C ATOM 372 C ASN A 27 -8.834 -21.896 -0.675 1.00 0.00 C ATOM 373 O ASN A 27 -7.857 -22.247 -0.013 1.00 0.00 O ATOM 374 CB ASN A 27 -9.873 -23.259 -2.541 1.00 0.00 C ATOM 375 CG ASN A 27 -8.565 -22.880 -3.207 1.00 0.00 C ATOM 376 OD1 ASN A 27 -7.602 -23.648 -3.198 1.00 0.00 O ATOM 377 ND2 ASN A 27 -8.530 -21.691 -3.786 1.00 0.00 N ATOM 0 H ASN A 27 -11.878 -22.271 -1.520 1.00 0.00 H new ATOM 0 HA ASN A 27 -9.774 -23.804 -0.477 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -10.028 -24.333 -2.648 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -10.693 -22.765 -3.061 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -7.679 -21.375 -4.251 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -9.354 -21.090 -3.767 1.00 0.00 H new ATOM 384 N GLY A 28 -9.029 -20.644 -1.078 1.00 0.00 N ATOM 385 CA GLY A 28 -8.079 -19.598 -0.754 1.00 0.00 C ATOM 386 C GLY A 28 -7.299 -19.085 -1.949 1.00 0.00 C ATOM 387 O GLY A 28 -7.571 -19.452 -3.091 1.00 0.00 O ATOM 0 H GLY A 28 -9.832 -20.336 -1.626 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.613 -18.765 -0.296 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.378 -19.975 -0.010 1.00 0.00 H new ATOM 391 N GLY A 29 -6.333 -18.219 -1.666 1.00 0.00 N ATOM 392 CA GLY A 29 -5.512 -17.637 -2.711 1.00 0.00 C ATOM 393 C GLY A 29 -5.086 -16.223 -2.364 1.00 0.00 C ATOM 394 O GLY A 29 -5.415 -15.723 -1.289 1.00 0.00 O ATOM 0 H GLY A 29 -6.102 -17.907 -0.723 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -4.628 -18.256 -2.867 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -6.067 -17.631 -3.649 1.00 0.00 H new ATOM 398 N VAL A 30 -4.362 -15.572 -3.267 1.00 0.00 N ATOM 399 CA VAL A 30 -3.912 -14.206 -3.024 1.00 0.00 C ATOM 400 C VAL A 30 -4.281 -13.295 -4.185 1.00 0.00 C ATOM 401 O VAL A 30 -4.505 -13.750 -5.307 1.00 0.00 O ATOM 402 CB VAL A 30 -2.383 -14.120 -2.765 1.00 0.00 C ATOM 403 CG1 VAL A 30 -1.841 -15.442 -2.248 1.00 0.00 C ATOM 404 CG2 VAL A 30 -1.624 -13.685 -4.014 1.00 0.00 C ATOM 0 H VAL A 30 -4.076 -15.962 -4.165 1.00 0.00 H new ATOM 0 HA VAL A 30 -4.424 -13.872 -2.122 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.229 -13.360 -1.999 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.768 -15.353 -2.075 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -2.339 -15.699 -1.313 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.026 -16.224 -2.984 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -0.558 -13.636 -3.793 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -1.797 -14.405 -4.814 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.974 -12.702 -4.329 1.00 0.00 H new ATOM 414 N LEU A 31 -4.330 -12.003 -3.903 1.00 0.00 N ATOM 415 CA LEU A 31 -4.655 -11.012 -4.912 1.00 0.00 C ATOM 416 C LEU A 31 -3.551 -9.972 -4.987 1.00 0.00 C ATOM 417 O LEU A 31 -3.412 -9.137 -4.094 1.00 0.00 O ATOM 418 CB LEU A 31 -5.985 -10.345 -4.576 1.00 0.00 C ATOM 419 CG LEU A 31 -6.616 -9.537 -5.713 1.00 0.00 C ATOM 420 CD1 LEU A 31 -6.664 -10.358 -6.994 1.00 0.00 C ATOM 421 CD2 LEU A 31 -8.011 -9.070 -5.324 1.00 0.00 C ATOM 0 H LEU A 31 -4.147 -11.616 -2.977 1.00 0.00 H new ATOM 0 HA LEU A 31 -4.743 -11.503 -5.881 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.691 -11.115 -4.264 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.836 -9.684 -3.722 1.00 0.00 H new ATOM 0 HG LEU A 31 -5.997 -8.659 -5.894 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -7.116 -9.765 -7.789 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -5.652 -10.641 -7.283 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -7.259 -11.256 -6.828 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -8.445 -8.497 -6.144 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -8.639 -9.936 -5.114 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.950 -8.442 -4.435 1.00 0.00 H new ATOM 433 N SER A 32 -2.760 -10.034 -6.046 1.00 0.00 N ATOM 434 CA SER A 32 -1.658 -9.105 -6.220 1.00 0.00 C ATOM 435 C SER A 32 -2.054 -7.945 -7.133 1.00 0.00 C ATOM 436 O SER A 32 -2.816 -8.121 -8.083 1.00 0.00 O ATOM 437 CB SER A 32 -0.437 -9.835 -6.785 1.00 0.00 C ATOM 438 OG SER A 32 -0.430 -9.807 -8.204 1.00 0.00 O ATOM 0 H SER A 32 -2.861 -10.717 -6.796 1.00 0.00 H new ATOM 0 HA SER A 32 -1.404 -8.692 -5.244 1.00 0.00 H new ATOM 0 HB2 SER A 32 0.474 -9.372 -6.406 1.00 0.00 H new ATOM 0 HB3 SER A 32 -0.437 -10.869 -6.440 1.00 0.00 H new ATOM 0 HG SER A 32 0.362 -10.279 -8.537 1.00 0.00 H new ATOM 444 N SER A 33 -1.520 -6.762 -6.842 1.00 0.00 N ATOM 445 CA SER A 33 -1.803 -5.574 -7.635 1.00 0.00 C ATOM 446 C SER A 33 -0.499 -4.910 -8.054 1.00 0.00 C ATOM 447 O SER A 33 0.055 -4.095 -7.322 1.00 0.00 O ATOM 448 CB SER A 33 -2.660 -4.591 -6.838 1.00 0.00 C ATOM 449 OG SER A 33 -1.960 -4.103 -5.708 1.00 0.00 O ATOM 0 H SER A 33 -0.886 -6.602 -6.059 1.00 0.00 H new ATOM 0 HA SER A 33 -2.356 -5.871 -8.526 1.00 0.00 H new ATOM 0 HB2 SER A 33 -2.952 -3.757 -7.477 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.578 -5.082 -6.516 1.00 0.00 H new ATOM 0 HG SER A 33 -1.830 -4.831 -5.065 1.00 0.00 H new ATOM 455 N ILE A 34 -0.013 -5.270 -9.234 1.00 0.00 N ATOM 456 CA ILE A 34 1.234 -4.718 -9.748 1.00 0.00 C ATOM 457 C ILE A 34 1.124 -3.215 -9.979 1.00 0.00 C ATOM 458 O ILE A 34 2.116 -2.490 -9.893 1.00 0.00 O ATOM 459 CB ILE A 34 1.637 -5.408 -11.060 1.00 0.00 C ATOM 460 CG1 ILE A 34 2.995 -4.879 -11.540 1.00 0.00 C ATOM 461 CG2 ILE A 34 0.554 -5.218 -12.111 1.00 0.00 C ATOM 462 CD1 ILE A 34 2.922 -3.593 -12.339 1.00 0.00 C ATOM 0 H ILE A 34 -0.464 -5.943 -9.854 1.00 0.00 H new ATOM 0 HA ILE A 34 2.001 -4.900 -8.995 1.00 0.00 H new ATOM 0 HB ILE A 34 1.741 -6.479 -10.885 1.00 0.00 H new ATOM 0 HG12 ILE A 34 3.635 -4.717 -10.673 1.00 0.00 H new ATOM 0 HG13 ILE A 34 3.474 -5.645 -12.151 1.00 0.00 H new ATOM 0 HG21 ILE A 34 0.853 -5.712 -13.035 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -0.380 -5.652 -11.754 1.00 0.00 H new ATOM 0 HG23 ILE A 34 0.412 -4.154 -12.298 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.926 -3.292 -12.637 1.00 0.00 H new ATOM 0 HD12 ILE A 34 2.312 -3.751 -13.228 1.00 0.00 H new ATOM 0 HD13 ILE A 34 2.475 -2.809 -11.727 1.00 0.00 H new ATOM 474 N GLU A 35 -0.084 -2.750 -10.276 1.00 0.00 N ATOM 475 CA GLU A 35 -0.322 -1.331 -10.523 1.00 0.00 C ATOM 476 C GLU A 35 0.175 -0.475 -9.359 1.00 0.00 C ATOM 477 O GLU A 35 0.466 0.709 -9.528 1.00 0.00 O ATOM 478 CB GLU A 35 -1.812 -1.078 -10.756 1.00 0.00 C ATOM 479 CG GLU A 35 -2.399 -1.909 -11.886 1.00 0.00 C ATOM 480 CD GLU A 35 -3.123 -1.065 -12.916 1.00 0.00 C ATOM 481 OE1 GLU A 35 -2.472 -0.194 -13.532 1.00 0.00 O ATOM 482 OE2 GLU A 35 -4.338 -1.275 -13.110 1.00 0.00 O ATOM 0 H GLU A 35 -0.916 -3.335 -10.352 1.00 0.00 H new ATOM 0 HA GLU A 35 0.235 -1.048 -11.416 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -2.357 -1.293 -9.837 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -1.963 -0.021 -10.977 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -1.600 -2.466 -12.375 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -3.091 -2.642 -11.471 1.00 0.00 H new ATOM 489 N THR A 36 0.264 -1.078 -8.177 1.00 0.00 N ATOM 490 CA THR A 36 0.722 -0.365 -6.990 1.00 0.00 C ATOM 491 C THR A 36 1.760 -1.177 -6.225 1.00 0.00 C ATOM 492 O THR A 36 2.759 -0.636 -5.748 1.00 0.00 O ATOM 493 CB THR A 36 -0.464 -0.047 -6.082 1.00 0.00 C ATOM 494 OG1 THR A 36 -1.092 -1.238 -5.641 1.00 0.00 O ATOM 495 CG2 THR A 36 -1.516 0.804 -6.759 1.00 0.00 C ATOM 0 H THR A 36 0.025 -2.057 -8.016 1.00 0.00 H new ATOM 0 HA THR A 36 1.190 0.565 -7.313 1.00 0.00 H new ATOM 0 HB THR A 36 -0.049 0.511 -5.243 1.00 0.00 H new ATOM 0 HG1 THR A 36 -1.471 -1.712 -6.410 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.332 0.996 -6.063 1.00 0.00 H new ATOM 0 HG22 THR A 36 -1.074 1.751 -7.069 1.00 0.00 H new ATOM 0 HG23 THR A 36 -1.901 0.280 -7.634 1.00 0.00 H new ATOM 503 N GLY A 37 1.518 -2.476 -6.109 1.00 0.00 N ATOM 504 CA GLY A 37 2.435 -3.344 -5.397 1.00 0.00 C ATOM 505 C GLY A 37 1.816 -3.938 -4.151 1.00 0.00 C ATOM 506 O GLY A 37 2.524 -4.367 -3.239 1.00 0.00 O ATOM 0 H GLY A 37 0.700 -2.945 -6.497 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.757 -4.148 -6.058 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.327 -2.780 -5.123 1.00 0.00 H new ATOM 510 N VAL A 38 0.492 -3.952 -4.106 1.00 0.00 N ATOM 511 CA VAL A 38 -0.231 -4.481 -2.962 1.00 0.00 C ATOM 512 C VAL A 38 -0.744 -5.893 -3.244 1.00 0.00 C ATOM 513 O VAL A 38 -1.381 -6.139 -4.267 1.00 0.00 O ATOM 514 CB VAL A 38 -1.413 -3.561 -2.609 1.00 0.00 C ATOM 515 CG1 VAL A 38 -2.289 -4.172 -1.523 1.00 0.00 C ATOM 516 CG2 VAL A 38 -0.912 -2.187 -2.190 1.00 0.00 C ATOM 0 H VAL A 38 -0.105 -3.600 -4.854 1.00 0.00 H new ATOM 0 HA VAL A 38 0.458 -4.524 -2.118 1.00 0.00 H new ATOM 0 HB VAL A 38 -2.028 -3.448 -3.502 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -3.114 -3.496 -1.298 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -2.686 -5.126 -1.870 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -1.695 -4.331 -0.623 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -1.761 -1.550 -1.944 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.267 -2.286 -1.317 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -0.348 -1.740 -3.009 1.00 0.00 H new ATOM 526 N SER A 39 -0.458 -6.817 -2.331 1.00 0.00 N ATOM 527 CA SER A 39 -0.890 -8.202 -2.485 1.00 0.00 C ATOM 528 C SER A 39 -1.606 -8.694 -1.230 1.00 0.00 C ATOM 529 O SER A 39 -1.113 -8.523 -0.117 1.00 0.00 O ATOM 530 CB SER A 39 0.309 -9.104 -2.790 1.00 0.00 C ATOM 531 OG SER A 39 1.423 -8.343 -3.221 1.00 0.00 O ATOM 0 H SER A 39 0.070 -6.632 -1.478 1.00 0.00 H new ATOM 0 HA SER A 39 -1.589 -8.245 -3.320 1.00 0.00 H new ATOM 0 HB2 SER A 39 0.576 -9.673 -1.899 1.00 0.00 H new ATOM 0 HB3 SER A 39 0.038 -9.826 -3.560 1.00 0.00 H new ATOM 0 HG SER A 39 2.176 -8.942 -3.408 1.00 0.00 H new ATOM 537 N ILE A 40 -2.772 -9.309 -1.417 1.00 0.00 N ATOM 538 CA ILE A 40 -3.552 -9.825 -0.298 1.00 0.00 C ATOM 539 C ILE A 40 -3.627 -11.347 -0.332 1.00 0.00 C ATOM 540 O ILE A 40 -4.259 -11.927 -1.214 1.00 0.00 O ATOM 541 CB ILE A 40 -4.984 -9.251 -0.301 1.00 0.00 C ATOM 542 CG1 ILE A 40 -4.944 -7.723 -0.298 1.00 0.00 C ATOM 543 CG2 ILE A 40 -5.770 -9.769 0.897 1.00 0.00 C ATOM 544 CD1 ILE A 40 -6.314 -7.083 -0.373 1.00 0.00 C ATOM 0 H ILE A 40 -3.196 -9.461 -2.332 1.00 0.00 H new ATOM 0 HA ILE A 40 -3.043 -9.511 0.613 1.00 0.00 H new ATOM 0 HB ILE A 40 -5.488 -9.582 -1.209 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -4.442 -7.382 0.607 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -4.345 -7.381 -1.142 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -6.778 -9.354 0.878 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -5.825 -10.857 0.853 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -5.270 -9.468 1.818 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -6.210 -5.998 -0.367 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -6.811 -7.394 -1.292 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -6.909 -7.395 0.485 1.00 0.00 H new ATOM 556 N ILE A 41 -2.989 -11.984 0.640 1.00 0.00 N ATOM 557 CA ILE A 41 -2.985 -13.437 0.740 1.00 0.00 C ATOM 558 C ILE A 41 -4.096 -13.910 1.672 1.00 0.00 C ATOM 559 O ILE A 41 -4.226 -13.420 2.794 1.00 0.00 O ATOM 560 CB ILE A 41 -1.628 -13.956 1.258 1.00 0.00 C ATOM 561 CG1 ILE A 41 -0.505 -13.569 0.294 1.00 0.00 C ATOM 562 CG2 ILE A 41 -1.669 -15.466 1.458 1.00 0.00 C ATOM 563 CD1 ILE A 41 -0.160 -12.095 0.326 1.00 0.00 C ATOM 0 H ILE A 41 -2.463 -11.513 1.376 1.00 0.00 H new ATOM 0 HA ILE A 41 -3.154 -13.837 -0.260 1.00 0.00 H new ATOM 0 HB ILE A 41 -1.428 -13.492 2.224 1.00 0.00 H new ATOM 0 HG12 ILE A 41 0.386 -14.148 0.537 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -0.797 -13.843 -0.720 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -0.702 -15.811 1.824 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -2.442 -15.716 2.185 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -1.893 -15.953 0.509 1.00 0.00 H new ATOM 0 HD11 ILE A 41 0.644 -11.894 -0.382 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -1.038 -11.510 0.054 1.00 0.00 H new ATOM 0 HD13 ILE A 41 0.163 -11.819 1.330 1.00 0.00 H new ATOM 575 N ILE A 42 -4.899 -14.860 1.203 1.00 0.00 N ATOM 576 CA ILE A 42 -5.998 -15.388 2.002 1.00 0.00 C ATOM 577 C ILE A 42 -5.760 -16.848 2.385 1.00 0.00 C ATOM 578 O ILE A 42 -5.683 -17.719 1.519 1.00 0.00 O ATOM 579 CB ILE A 42 -7.341 -15.284 1.255 1.00 0.00 C ATOM 580 CG1 ILE A 42 -7.638 -13.828 0.889 1.00 0.00 C ATOM 581 CG2 ILE A 42 -8.465 -15.866 2.100 1.00 0.00 C ATOM 582 CD1 ILE A 42 -7.622 -13.568 -0.600 1.00 0.00 C ATOM 0 H ILE A 42 -4.809 -15.278 0.277 1.00 0.00 H new ATOM 0 HA ILE A 42 -6.042 -14.781 2.906 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.271 -15.861 0.333 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -8.614 -13.553 1.288 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -6.903 -13.183 1.371 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -9.407 -15.785 1.558 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -8.256 -16.915 2.310 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -8.538 -15.316 3.038 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -7.840 -12.517 -0.788 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -6.638 -13.812 -1.001 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -8.376 -14.188 -1.086 1.00 0.00 H new ATOM 594 N PRO A 43 -5.651 -17.137 3.694 1.00 0.00 N ATOM 595 CA PRO A 43 -5.433 -18.499 4.180 1.00 0.00 C ATOM 596 C PRO A 43 -6.627 -19.402 3.900 1.00 0.00 C ATOM 597 O PRO A 43 -7.778 -18.986 4.028 1.00 0.00 O ATOM 598 CB PRO A 43 -5.242 -18.325 5.689 1.00 0.00 C ATOM 599 CG PRO A 43 -5.887 -17.024 6.016 1.00 0.00 C ATOM 600 CD PRO A 43 -5.736 -16.164 4.794 1.00 0.00 C ATOM 0 HA PRO A 43 -4.584 -18.974 3.687 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -5.704 -19.143 6.241 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -4.185 -18.318 5.954 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -6.939 -17.163 6.267 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -5.412 -16.560 6.880 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -6.585 -15.492 4.670 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -4.842 -15.542 4.849 1.00 0.00 H new ATOM 608 N GLN A 44 -6.342 -20.637 3.514 1.00 0.00 N ATOM 609 CA GLN A 44 -7.391 -21.607 3.213 1.00 0.00 C ATOM 610 C GLN A 44 -8.322 -21.795 4.407 1.00 0.00 C ATOM 611 O GLN A 44 -8.075 -22.632 5.274 1.00 0.00 O ATOM 612 CB GLN A 44 -6.772 -22.949 2.818 1.00 0.00 C ATOM 613 CG GLN A 44 -7.792 -23.972 2.342 1.00 0.00 C ATOM 614 CD GLN A 44 -8.493 -24.672 3.489 1.00 0.00 C ATOM 615 OE1 GLN A 44 -9.740 -24.290 3.741 1.00 0.00 O flip ATOM 616 NE2 GLN A 44 -7.922 -25.546 4.142 1.00 0.00 N flip ATOM 0 H GLN A 44 -5.393 -20.994 3.401 1.00 0.00 H new ATOM 0 HA GLN A 44 -7.977 -21.223 2.378 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -6.040 -22.784 2.028 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -6.232 -23.357 3.673 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -8.534 -23.476 1.716 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -7.293 -24.714 1.718 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -6.963 -25.809 3.914 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -8.408 -26.007 4.911 1.00 0.00 H new ATOM 625 N GLY A 45 -9.395 -21.009 4.444 1.00 0.00 N ATOM 626 CA GLY A 45 -10.346 -21.107 5.536 1.00 0.00 C ATOM 627 C GLY A 45 -11.088 -19.808 5.787 1.00 0.00 C ATOM 628 O GLY A 45 -12.183 -19.813 6.350 1.00 0.00 O ATOM 0 H GLY A 45 -9.622 -20.308 3.739 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -11.066 -21.895 5.315 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -9.820 -21.401 6.444 1.00 0.00 H new ATOM 632 N ALA A 46 -10.493 -18.694 5.374 1.00 0.00 N ATOM 633 CA ALA A 46 -11.108 -17.383 5.562 1.00 0.00 C ATOM 634 C ALA A 46 -12.511 -17.341 4.965 1.00 0.00 C ATOM 635 O ALA A 46 -13.405 -16.681 5.495 1.00 0.00 O ATOM 636 CB ALA A 46 -10.237 -16.297 4.949 1.00 0.00 C ATOM 0 H ALA A 46 -9.586 -18.672 4.907 1.00 0.00 H new ATOM 0 HA ALA A 46 -11.194 -17.202 6.633 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -10.709 -15.326 5.097 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -9.258 -16.302 5.428 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -10.119 -16.484 3.882 1.00 0.00 H new ATOM 642 N ILE A 47 -12.698 -18.051 3.860 1.00 0.00 N ATOM 643 CA ILE A 47 -13.985 -18.106 3.186 1.00 0.00 C ATOM 644 C ILE A 47 -14.625 -19.481 3.380 1.00 0.00 C ATOM 645 O ILE A 47 -13.941 -20.502 3.344 1.00 0.00 O ATOM 646 CB ILE A 47 -13.828 -17.801 1.674 1.00 0.00 C ATOM 647 CG1 ILE A 47 -13.449 -16.327 1.476 1.00 0.00 C ATOM 648 CG2 ILE A 47 -15.100 -18.134 0.899 1.00 0.00 C ATOM 649 CD1 ILE A 47 -13.425 -15.897 0.024 1.00 0.00 C ATOM 0 H ILE A 47 -11.966 -18.601 3.410 1.00 0.00 H new ATOM 0 HA ILE A 47 -14.633 -17.347 3.625 1.00 0.00 H new ATOM 0 HB ILE A 47 -13.031 -18.433 1.282 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -14.158 -15.702 2.020 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -12.467 -16.151 1.915 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -14.953 -17.907 -0.157 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -15.329 -19.193 1.014 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -15.928 -17.539 1.286 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -13.149 -14.844 -0.039 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -12.696 -16.496 -0.521 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -14.413 -16.040 -0.414 1.00 0.00 H new ATOM 661 N PRO A 48 -15.952 -19.525 3.586 1.00 0.00 N ATOM 662 CA PRO A 48 -16.674 -20.781 3.777 1.00 0.00 C ATOM 663 C PRO A 48 -16.756 -21.586 2.487 1.00 0.00 C ATOM 664 O PRO A 48 -16.659 -21.033 1.392 1.00 0.00 O ATOM 665 CB PRO A 48 -18.066 -20.335 4.229 1.00 0.00 C ATOM 666 CG PRO A 48 -18.223 -18.955 3.691 1.00 0.00 C ATOM 667 CD PRO A 48 -16.843 -18.359 3.638 1.00 0.00 C ATOM 0 HA PRO A 48 -16.180 -21.436 4.495 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -18.838 -21.000 3.842 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -18.151 -20.347 5.316 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -18.676 -18.974 2.700 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -18.878 -18.362 4.329 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -16.717 -17.722 2.763 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -16.641 -17.742 4.513 1.00 0.00 H new ATOM 675 N GLU A 49 -16.921 -22.892 2.627 1.00 0.00 N ATOM 676 CA GLU A 49 -17.001 -23.784 1.475 1.00 0.00 C ATOM 677 C GLU A 49 -18.352 -23.673 0.772 1.00 0.00 C ATOM 678 O GLU A 49 -19.385 -23.494 1.415 1.00 0.00 O ATOM 679 CB GLU A 49 -16.759 -25.230 1.910 1.00 0.00 C ATOM 680 CG GLU A 49 -15.375 -25.468 2.491 1.00 0.00 C ATOM 681 CD GLU A 49 -15.229 -26.848 3.102 1.00 0.00 C ATOM 682 OE1 GLU A 49 -16.031 -27.739 2.753 1.00 0.00 O ATOM 683 OE2 GLU A 49 -14.312 -27.037 3.928 1.00 0.00 O ATOM 0 H GLU A 49 -17.003 -23.361 3.529 1.00 0.00 H new ATOM 0 HA GLU A 49 -16.228 -23.483 0.768 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -17.508 -25.507 2.652 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -16.902 -25.887 1.052 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -14.629 -25.341 1.707 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -15.170 -24.714 3.251 1.00 0.00 H new ATOM 690 N GLY A 50 -18.330 -23.792 -0.552 1.00 0.00 N ATOM 691 CA GLY A 50 -19.554 -23.715 -1.330 1.00 0.00 C ATOM 692 C GLY A 50 -19.970 -22.289 -1.638 1.00 0.00 C ATOM 693 O GLY A 50 -21.152 -22.014 -1.841 1.00 0.00 O ATOM 0 H GLY A 50 -17.484 -23.941 -1.102 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -19.419 -24.259 -2.265 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -20.356 -24.212 -0.785 1.00 0.00 H new ATOM 697 N VAL A 51 -19.001 -21.379 -1.675 1.00 0.00 N ATOM 698 CA VAL A 51 -19.290 -19.979 -1.962 1.00 0.00 C ATOM 699 C VAL A 51 -18.145 -19.312 -2.722 1.00 0.00 C ATOM 700 O VAL A 51 -17.000 -19.756 -2.660 1.00 0.00 O ATOM 701 CB VAL A 51 -19.560 -19.186 -0.668 1.00 0.00 C ATOM 702 CG1 VAL A 51 -18.379 -19.291 0.278 1.00 0.00 C ATOM 703 CG2 VAL A 51 -19.870 -17.730 -0.984 1.00 0.00 C ATOM 0 H VAL A 51 -18.015 -21.584 -1.511 1.00 0.00 H new ATOM 0 HA VAL A 51 -20.184 -19.968 -2.585 1.00 0.00 H new ATOM 0 HB VAL A 51 -20.431 -19.619 -0.176 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -18.588 -18.725 1.186 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -18.210 -20.337 0.534 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -17.489 -18.887 -0.205 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -20.057 -17.188 -0.057 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -19.022 -17.281 -1.501 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -20.753 -17.676 -1.621 1.00 0.00 H new ATOM 713 N GLU A 52 -18.472 -18.233 -3.425 1.00 0.00 N ATOM 714 CA GLU A 52 -17.485 -17.481 -4.191 1.00 0.00 C ATOM 715 C GLU A 52 -17.628 -15.987 -3.910 1.00 0.00 C ATOM 716 O GLU A 52 -18.593 -15.355 -4.339 1.00 0.00 O ATOM 717 CB GLU A 52 -17.652 -17.752 -5.688 1.00 0.00 C ATOM 718 CG GLU A 52 -16.580 -18.664 -6.260 1.00 0.00 C ATOM 719 CD GLU A 52 -17.124 -19.620 -7.304 1.00 0.00 C ATOM 720 OE1 GLU A 52 -17.235 -19.214 -8.480 1.00 0.00 O ATOM 721 OE2 GLU A 52 -17.438 -20.774 -6.945 1.00 0.00 O ATOM 0 H GLU A 52 -19.419 -17.858 -3.480 1.00 0.00 H new ATOM 0 HA GLU A 52 -16.490 -17.804 -3.887 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -18.630 -18.200 -5.861 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -17.636 -16.804 -6.225 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -15.791 -18.057 -6.704 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -16.125 -19.236 -5.451 1.00 0.00 H new ATOM 728 N GLN A 53 -16.668 -15.431 -3.180 1.00 0.00 N ATOM 729 CA GLN A 53 -16.699 -14.015 -2.834 1.00 0.00 C ATOM 730 C GLN A 53 -15.707 -13.217 -3.672 1.00 0.00 C ATOM 731 O GLN A 53 -14.500 -13.452 -3.612 1.00 0.00 O ATOM 732 CB GLN A 53 -16.386 -13.822 -1.350 1.00 0.00 C ATOM 733 CG GLN A 53 -17.368 -14.519 -0.423 1.00 0.00 C ATOM 734 CD GLN A 53 -18.810 -14.151 -0.718 1.00 0.00 C ATOM 735 OE1 GLN A 53 -19.690 -15.012 -0.741 1.00 0.00 O ATOM 736 NE2 GLN A 53 -19.058 -12.867 -0.946 1.00 0.00 N ATOM 0 H GLN A 53 -15.861 -15.938 -2.817 1.00 0.00 H new ATOM 0 HA GLN A 53 -17.703 -13.647 -3.044 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -15.382 -14.195 -1.148 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -16.381 -12.756 -1.124 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -17.246 -15.598 -0.516 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -17.134 -14.259 0.609 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -18.298 -12.188 -0.917 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -20.009 -12.560 -1.150 1.00 0.00 H new ATOM 745 N GLU A 54 -16.220 -12.262 -4.443 1.00 0.00 N ATOM 746 CA GLU A 54 -15.369 -11.423 -5.274 1.00 0.00 C ATOM 747 C GLU A 54 -14.682 -10.369 -4.422 1.00 0.00 C ATOM 748 O GLU A 54 -15.291 -9.363 -4.056 1.00 0.00 O ATOM 749 CB GLU A 54 -16.185 -10.742 -6.376 1.00 0.00 C ATOM 750 CG GLU A 54 -15.347 -10.286 -7.560 1.00 0.00 C ATOM 751 CD GLU A 54 -16.064 -10.459 -8.885 1.00 0.00 C ATOM 752 OE1 GLU A 54 -17.302 -10.626 -8.873 1.00 0.00 O ATOM 753 OE2 GLU A 54 -15.386 -10.428 -9.934 1.00 0.00 O ATOM 0 H GLU A 54 -17.216 -12.052 -4.508 1.00 0.00 H new ATOM 0 HA GLU A 54 -14.616 -12.059 -5.740 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -16.951 -11.432 -6.728 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -16.702 -9.880 -5.954 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -15.081 -9.237 -7.429 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -14.415 -10.851 -7.579 1.00 0.00 H new ATOM 760 N ILE A 55 -13.414 -10.596 -4.107 1.00 0.00 N ATOM 761 CA ILE A 55 -12.661 -9.650 -3.299 1.00 0.00 C ATOM 762 C ILE A 55 -11.769 -8.793 -4.180 1.00 0.00 C ATOM 763 O ILE A 55 -10.867 -9.295 -4.849 1.00 0.00 O ATOM 764 CB ILE A 55 -11.805 -10.368 -2.235 1.00 0.00 C ATOM 765 CG1 ILE A 55 -12.703 -11.206 -1.321 1.00 0.00 C ATOM 766 CG2 ILE A 55 -10.998 -9.360 -1.424 1.00 0.00 C ATOM 767 CD1 ILE A 55 -11.951 -11.912 -0.213 1.00 0.00 C ATOM 0 H ILE A 55 -12.889 -11.421 -4.397 1.00 0.00 H new ATOM 0 HA ILE A 55 -13.381 -9.014 -2.784 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.103 -11.032 -2.739 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -13.461 -10.560 -0.879 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -13.228 -11.948 -1.923 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -10.401 -9.887 -0.679 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -10.339 -8.802 -2.089 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -11.676 -8.669 -0.923 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -12.651 -12.486 0.394 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -11.211 -12.585 -0.647 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -11.448 -11.175 0.413 1.00 0.00 H new ATOM 779 N TYR A 56 -12.032 -7.496 -4.178 1.00 0.00 N ATOM 780 CA TYR A 56 -11.259 -6.564 -4.982 1.00 0.00 C ATOM 781 C TYR A 56 -10.943 -5.300 -4.203 1.00 0.00 C ATOM 782 O TYR A 56 -11.804 -4.742 -3.526 1.00 0.00 O ATOM 783 CB TYR A 56 -12.017 -6.207 -6.258 1.00 0.00 C ATOM 784 CG TYR A 56 -13.418 -5.697 -6.019 1.00 0.00 C ATOM 785 CD1 TYR A 56 -14.475 -6.579 -5.842 1.00 0.00 C ATOM 786 CD2 TYR A 56 -13.683 -4.336 -5.979 1.00 0.00 C ATOM 787 CE1 TYR A 56 -15.759 -6.118 -5.631 1.00 0.00 C ATOM 788 CE2 TYR A 56 -14.963 -3.866 -5.769 1.00 0.00 C ATOM 789 CZ TYR A 56 -16.000 -4.761 -5.596 1.00 0.00 C ATOM 790 OH TYR A 56 -17.278 -4.296 -5.386 1.00 0.00 O ATOM 0 H TYR A 56 -12.775 -7.065 -3.628 1.00 0.00 H new ATOM 0 HA TYR A 56 -10.320 -7.051 -5.246 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -11.454 -5.449 -6.803 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -12.067 -7.088 -6.897 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -14.290 -7.643 -5.870 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -12.874 -3.633 -6.114 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -16.571 -6.817 -5.494 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -15.153 -2.803 -5.740 1.00 0.00 H new ATOM 0 HH TYR A 56 -17.274 -3.316 -5.389 1.00 0.00 H new ATOM 800 N PHE A 57 -9.705 -4.846 -4.313 1.00 0.00 N ATOM 801 CA PHE A 57 -9.278 -3.635 -3.627 1.00 0.00 C ATOM 802 C PHE A 57 -8.821 -2.594 -4.635 1.00 0.00 C ATOM 803 O PHE A 57 -7.925 -2.845 -5.441 1.00 0.00 O ATOM 804 CB PHE A 57 -8.149 -3.939 -2.644 1.00 0.00 C ATOM 805 CG PHE A 57 -7.053 -4.778 -3.228 1.00 0.00 C ATOM 806 CD1 PHE A 57 -7.168 -6.154 -3.268 1.00 0.00 C ATOM 807 CD2 PHE A 57 -5.904 -4.190 -3.734 1.00 0.00 C ATOM 808 CE1 PHE A 57 -6.164 -6.933 -3.801 1.00 0.00 C ATOM 809 CE2 PHE A 57 -4.893 -4.964 -4.269 1.00 0.00 C ATOM 810 CZ PHE A 57 -5.023 -6.338 -4.304 1.00 0.00 C ATOM 0 H PHE A 57 -8.978 -5.296 -4.870 1.00 0.00 H new ATOM 0 HA PHE A 57 -10.127 -3.242 -3.068 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -7.726 -3.000 -2.289 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -8.563 -4.451 -1.775 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -8.057 -6.626 -2.876 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -5.798 -3.115 -3.710 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -6.269 -8.008 -3.826 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -4.002 -4.495 -4.659 1.00 0.00 H new ATOM 0 HZ PHE A 57 -4.235 -6.946 -4.723 1.00 0.00 H new ATOM 820 N LYS A 58 -9.441 -1.425 -4.584 1.00 0.00 N ATOM 821 CA LYS A 58 -9.095 -0.348 -5.493 1.00 0.00 C ATOM 822 C LYS A 58 -8.110 0.610 -4.837 1.00 0.00 C ATOM 823 O LYS A 58 -8.392 1.187 -3.787 1.00 0.00 O ATOM 824 CB LYS A 58 -10.353 0.404 -5.929 1.00 0.00 C ATOM 825 CG LYS A 58 -11.261 -0.400 -6.848 1.00 0.00 C ATOM 826 CD LYS A 58 -12.681 -0.464 -6.311 1.00 0.00 C ATOM 827 CE LYS A 58 -13.696 -0.608 -7.435 1.00 0.00 C ATOM 828 NZ LYS A 58 -15.095 -0.628 -6.923 1.00 0.00 N ATOM 0 H LYS A 58 -10.185 -1.200 -3.923 1.00 0.00 H new ATOM 0 HA LYS A 58 -8.622 -0.781 -6.375 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -10.916 0.697 -5.043 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -10.058 1.322 -6.437 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -11.266 0.050 -7.841 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -10.867 -1.410 -6.958 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -12.774 -1.306 -5.625 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -12.896 0.439 -5.739 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -13.579 0.217 -8.138 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -13.498 -1.527 -7.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -15.635 -1.367 -7.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -15.088 -0.827 -5.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -15.540 0.297 -7.092 1.00 0.00 H new ATOM 842 N VAL A 59 -6.957 0.775 -5.468 1.00 0.00 N ATOM 843 CA VAL A 59 -5.927 1.663 -4.955 1.00 0.00 C ATOM 844 C VAL A 59 -6.131 3.072 -5.495 1.00 0.00 C ATOM 845 O VAL A 59 -6.166 3.284 -6.707 1.00 0.00 O ATOM 846 CB VAL A 59 -4.521 1.160 -5.337 1.00 0.00 C ATOM 847 CG1 VAL A 59 -3.448 2.133 -4.875 1.00 0.00 C ATOM 848 CG2 VAL A 59 -4.278 -0.226 -4.756 1.00 0.00 C ATOM 0 H VAL A 59 -6.712 0.304 -6.339 1.00 0.00 H new ATOM 0 HA VAL A 59 -6.006 1.677 -3.868 1.00 0.00 H new ATOM 0 HB VAL A 59 -4.466 1.095 -6.424 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -2.466 1.753 -5.158 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -3.610 3.103 -5.344 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -3.497 2.241 -3.791 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -3.281 -0.568 -5.034 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -4.357 -0.184 -3.670 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -5.022 -0.920 -5.147 1.00 0.00 H new ATOM 858 N CYS A 60 -6.288 4.031 -4.589 1.00 0.00 N ATOM 859 CA CYS A 60 -6.514 5.415 -4.981 1.00 0.00 C ATOM 860 C CYS A 60 -5.342 6.305 -4.590 1.00 0.00 C ATOM 861 O CYS A 60 -4.462 5.900 -3.831 1.00 0.00 O ATOM 862 CB CYS A 60 -7.798 5.940 -4.338 1.00 0.00 C ATOM 863 SG CYS A 60 -9.289 5.032 -4.813 1.00 0.00 S ATOM 0 H CYS A 60 -6.263 3.875 -3.581 1.00 0.00 H new ATOM 0 HA CYS A 60 -6.612 5.441 -6.066 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -7.691 5.900 -3.254 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -7.923 6.989 -4.607 1.00 0.00 H new ATOM 0 HG CYS A 60 -10.149 5.070 -3.839 1.00 0.00 H new ATOM 869 N ARG A 61 -5.344 7.525 -5.116 1.00 0.00 N ATOM 870 CA ARG A 61 -4.289 8.488 -4.824 1.00 0.00 C ATOM 871 C ARG A 61 -4.576 9.223 -3.519 1.00 0.00 C ATOM 872 O ARG A 61 -5.727 9.319 -3.091 1.00 0.00 O ATOM 873 CB ARG A 61 -4.157 9.492 -5.970 1.00 0.00 C ATOM 874 CG ARG A 61 -3.832 8.850 -7.308 1.00 0.00 C ATOM 875 CD ARG A 61 -2.342 8.587 -7.451 1.00 0.00 C ATOM 876 NE ARG A 61 -1.881 7.539 -6.544 1.00 0.00 N ATOM 877 CZ ARG A 61 -0.615 7.397 -6.153 1.00 0.00 C ATOM 878 NH1 ARG A 61 0.321 8.228 -6.595 1.00 0.00 N ATOM 879 NH2 ARG A 61 -0.286 6.420 -5.319 1.00 0.00 N ATOM 0 H ARG A 61 -6.066 7.871 -5.748 1.00 0.00 H new ATOM 0 HA ARG A 61 -3.350 7.944 -4.717 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -5.089 10.051 -6.061 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -3.377 10.212 -5.723 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -4.379 7.912 -7.406 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -4.167 9.500 -8.116 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -2.122 8.299 -8.479 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -1.791 9.506 -7.252 1.00 0.00 H new ATOM 0 HE ARG A 61 -2.570 6.876 -6.188 1.00 0.00 H new ATOM 0 HH11 ARG A 61 0.073 8.980 -7.238 1.00 0.00 H new ATOM 0 HH12 ARG A 61 1.288 8.114 -6.292 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -1.002 5.778 -4.978 1.00 0.00 H new ATOM 0 HH22 ARG A 61 0.683 6.310 -5.019 1.00 0.00 H new ATOM 893 N ASP A 62 -3.526 9.739 -2.889 1.00 0.00 N ATOM 894 CA ASP A 62 -3.675 10.465 -1.632 1.00 0.00 C ATOM 895 C ASP A 62 -3.917 11.950 -1.886 1.00 0.00 C ATOM 896 O ASP A 62 -2.976 12.719 -2.073 1.00 0.00 O ATOM 897 CB ASP A 62 -2.430 10.279 -0.761 1.00 0.00 C ATOM 898 CG ASP A 62 -1.167 10.764 -1.444 1.00 0.00 C ATOM 899 OD1 ASP A 62 -0.822 10.216 -2.512 1.00 0.00 O ATOM 900 OD2 ASP A 62 -0.521 11.691 -0.910 1.00 0.00 O ATOM 0 H ASP A 62 -2.566 9.669 -3.226 1.00 0.00 H new ATOM 0 HA ASP A 62 -4.540 10.060 -1.107 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -2.562 10.819 0.177 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -2.321 9.224 -0.509 1.00 0.00 H new ATOM 905 N ASN A 63 -5.187 12.344 -1.892 1.00 0.00 N ATOM 906 CA ASN A 63 -5.553 13.737 -2.122 1.00 0.00 C ATOM 907 C ASN A 63 -6.981 14.011 -1.656 1.00 0.00 C ATOM 908 O ASN A 63 -7.243 15.008 -0.981 1.00 0.00 O ATOM 909 CB ASN A 63 -5.408 14.086 -3.607 1.00 0.00 C ATOM 910 CG ASN A 63 -6.404 13.346 -4.481 1.00 0.00 C ATOM 911 OD1 ASN A 63 -7.304 13.950 -5.063 1.00 0.00 O ATOM 912 ND2 ASN A 63 -6.246 12.031 -4.577 1.00 0.00 N ATOM 0 H ASN A 63 -5.979 11.719 -1.740 1.00 0.00 H new ATOM 0 HA ASN A 63 -4.877 14.365 -1.542 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -5.542 15.160 -3.739 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -4.396 13.849 -3.935 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -6.885 11.481 -5.151 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -5.485 11.571 -4.077 1.00 0.00 H new ATOM 919 N SER A 64 -7.897 13.121 -2.019 1.00 0.00 N ATOM 920 CA SER A 64 -9.298 13.267 -1.637 1.00 0.00 C ATOM 921 C SER A 64 -9.635 12.361 -0.458 1.00 0.00 C ATOM 922 O SER A 64 -10.711 11.764 -0.405 1.00 0.00 O ATOM 923 CB SER A 64 -10.210 12.944 -2.825 1.00 0.00 C ATOM 924 OG SER A 64 -9.489 12.976 -4.046 1.00 0.00 O ATOM 0 H SER A 64 -7.696 12.291 -2.577 1.00 0.00 H new ATOM 0 HA SER A 64 -9.462 14.302 -1.335 1.00 0.00 H new ATOM 0 HB2 SER A 64 -10.656 11.959 -2.688 1.00 0.00 H new ATOM 0 HB3 SER A 64 -11.029 13.662 -2.864 1.00 0.00 H new ATOM 0 HG SER A 64 -8.879 13.743 -4.046 1.00 0.00 H new ATOM 930 N ILE A 65 -8.705 12.262 0.486 1.00 0.00 N ATOM 931 CA ILE A 65 -8.894 11.429 1.666 1.00 0.00 C ATOM 932 C ILE A 65 -8.777 12.251 2.944 1.00 0.00 C ATOM 933 O ILE A 65 -8.377 13.414 2.909 1.00 0.00 O ATOM 934 CB ILE A 65 -7.872 10.277 1.712 1.00 0.00 C ATOM 935 CG1 ILE A 65 -6.446 10.829 1.698 1.00 0.00 C ATOM 936 CG2 ILE A 65 -8.092 9.329 0.543 1.00 0.00 C ATOM 937 CD1 ILE A 65 -5.469 10.000 2.504 1.00 0.00 C ATOM 0 H ILE A 65 -7.810 12.751 0.456 1.00 0.00 H new ATOM 0 HA ILE A 65 -9.898 11.010 1.599 1.00 0.00 H new ATOM 0 HB ILE A 65 -8.015 9.720 2.638 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -6.097 10.886 0.667 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -6.455 11.847 2.088 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -7.363 8.520 0.588 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -9.098 8.914 0.596 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -7.973 9.873 -0.394 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -4.478 10.450 2.449 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -5.794 9.964 3.544 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -5.431 8.988 2.100 1.00 0.00 H new ATOM 949 N LEU A 66 -9.134 11.639 4.070 1.00 0.00 N ATOM 950 CA LEU A 66 -9.074 12.315 5.364 1.00 0.00 C ATOM 951 C LEU A 66 -8.019 11.674 6.268 1.00 0.00 C ATOM 952 O LEU A 66 -8.324 10.764 7.038 1.00 0.00 O ATOM 953 CB LEU A 66 -10.442 12.265 6.048 1.00 0.00 C ATOM 954 CG LEU A 66 -10.518 12.982 7.397 1.00 0.00 C ATOM 955 CD1 LEU A 66 -11.867 13.663 7.565 1.00 0.00 C ATOM 956 CD2 LEU A 66 -10.267 12.004 8.535 1.00 0.00 C ATOM 0 H LEU A 66 -9.468 10.676 4.113 1.00 0.00 H new ATOM 0 HA LEU A 66 -8.795 13.354 5.191 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.182 12.703 5.379 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.721 11.221 6.192 1.00 0.00 H new ATOM 0 HG LEU A 66 -9.742 13.747 7.424 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -11.902 14.168 8.531 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.007 14.394 6.768 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -12.660 12.917 7.517 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -10.325 12.531 9.487 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -11.020 11.216 8.510 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -9.276 11.563 8.424 1.00 0.00 H new ATOM 968 N PRO A 67 -6.761 12.143 6.184 1.00 0.00 N ATOM 969 CA PRO A 67 -5.658 11.617 6.991 1.00 0.00 C ATOM 970 C PRO A 67 -5.655 12.185 8.409 1.00 0.00 C ATOM 971 O PRO A 67 -5.394 13.372 8.606 1.00 0.00 O ATOM 972 CB PRO A 67 -4.398 12.074 6.234 1.00 0.00 C ATOM 973 CG PRO A 67 -4.879 12.815 5.023 1.00 0.00 C ATOM 974 CD PRO A 67 -6.300 13.214 5.301 1.00 0.00 C ATOM 0 HA PRO A 67 -5.729 10.536 7.111 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -3.779 12.715 6.861 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -3.785 11.219 5.948 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -4.260 13.692 4.834 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -4.820 12.186 4.135 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -6.361 14.191 5.781 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -6.892 13.270 4.388 1.00 0.00 H new ATOM 982 N PRO A 68 -5.944 11.347 9.421 1.00 0.00 N ATOM 983 CA PRO A 68 -5.967 11.783 10.823 1.00 0.00 C ATOM 984 C PRO A 68 -4.616 12.317 11.287 1.00 0.00 C ATOM 985 O PRO A 68 -4.533 13.052 12.271 1.00 0.00 O ATOM 986 CB PRO A 68 -6.330 10.509 11.597 1.00 0.00 C ATOM 987 CG PRO A 68 -6.947 9.603 10.587 1.00 0.00 C ATOM 988 CD PRO A 68 -6.268 9.917 9.286 1.00 0.00 C ATOM 0 HA PRO A 68 -6.669 12.603 10.977 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -5.446 10.055 12.046 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -7.024 10.725 12.409 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -6.804 8.558 10.860 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -8.022 9.770 10.517 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -5.373 9.312 9.141 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -6.921 9.729 8.434 1.00 0.00 H new ATOM 996 N LEU A 69 -3.557 11.941 10.573 1.00 0.00 N ATOM 997 CA LEU A 69 -2.208 12.381 10.916 1.00 0.00 C ATOM 998 C LEU A 69 -2.107 13.904 10.908 1.00 0.00 C ATOM 999 O LEU A 69 -3.075 14.599 10.592 1.00 0.00 O ATOM 1000 CB LEU A 69 -1.193 11.788 9.936 1.00 0.00 C ATOM 1001 CG LEU A 69 -1.536 11.975 8.455 1.00 0.00 C ATOM 1002 CD1 LEU A 69 -0.764 13.149 7.873 1.00 0.00 C ATOM 1003 CD2 LEU A 69 -1.244 10.703 7.674 1.00 0.00 C ATOM 0 H LEU A 69 -3.608 11.334 9.755 1.00 0.00 H new ATOM 0 HA LEU A 69 -1.985 12.028 11.923 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.219 12.239 10.128 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.095 10.721 10.139 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.601 12.190 8.373 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.020 13.267 6.820 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.024 14.059 8.414 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.306 12.964 7.967 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.494 10.855 6.624 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.186 10.456 7.763 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.842 9.885 8.074 1.00 0.00 H new ATOM 1015 N ASP A 70 -0.931 14.416 11.258 1.00 0.00 N ATOM 1016 CA ASP A 70 -0.703 15.856 11.295 1.00 0.00 C ATOM 1017 C ASP A 70 0.416 16.257 10.339 1.00 0.00 C ATOM 1018 O ASP A 70 1.593 16.009 10.604 1.00 0.00 O ATOM 1019 CB ASP A 70 -0.357 16.304 12.717 1.00 0.00 C ATOM 1020 CG ASP A 70 -1.509 16.107 13.683 1.00 0.00 C ATOM 1021 OD1 ASP A 70 -1.764 14.950 14.076 1.00 0.00 O ATOM 1022 OD2 ASP A 70 -2.159 17.111 14.043 1.00 0.00 O ATOM 0 H ASP A 70 -0.121 13.854 11.520 1.00 0.00 H new ATOM 0 HA ASP A 70 -1.622 16.350 10.978 1.00 0.00 H new ATOM 0 HB2 ASP A 70 0.509 15.745 13.070 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -0.073 17.356 12.704 1.00 0.00 H new ATOM 1027 N LYS A 71 0.040 16.877 9.224 1.00 0.00 N ATOM 1028 CA LYS A 71 1.009 17.314 8.226 1.00 0.00 C ATOM 1029 C LYS A 71 1.871 18.453 8.763 1.00 0.00 C ATOM 1030 O LYS A 71 3.019 18.622 8.352 1.00 0.00 O ATOM 1031 CB LYS A 71 0.291 17.764 6.952 1.00 0.00 C ATOM 1032 CG LYS A 71 -0.804 16.808 6.502 1.00 0.00 C ATOM 1033 CD LYS A 71 -0.440 16.112 5.201 1.00 0.00 C ATOM 1034 CE LYS A 71 -1.641 15.998 4.274 1.00 0.00 C ATOM 1035 NZ LYS A 71 -1.787 17.199 3.404 1.00 0.00 N ATOM 0 H LYS A 71 -0.930 17.088 8.990 1.00 0.00 H new ATOM 0 HA LYS A 71 1.658 16.469 7.994 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -0.144 18.749 7.118 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.022 17.870 6.150 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -0.978 16.062 7.278 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -1.737 17.357 6.373 1.00 0.00 H new ATOM 0 HD2 LYS A 71 0.355 16.665 4.701 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -0.050 15.117 5.416 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -1.536 15.109 3.652 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -2.546 15.867 4.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -2.616 17.082 2.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -1.913 18.044 3.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -0.934 17.310 2.819 1.00 0.00 H new ATOM 1049 N GLU A 72 1.311 19.233 9.685 1.00 0.00 N ATOM 1050 CA GLU A 72 2.030 20.357 10.277 1.00 0.00 C ATOM 1051 C GLU A 72 3.344 19.896 10.900 1.00 0.00 C ATOM 1052 O GLU A 72 4.339 20.619 10.880 1.00 0.00 O ATOM 1053 CB GLU A 72 1.163 21.042 11.336 1.00 0.00 C ATOM 1054 CG GLU A 72 0.451 20.070 12.264 1.00 0.00 C ATOM 1055 CD GLU A 72 0.391 20.567 13.694 1.00 0.00 C ATOM 1056 OE1 GLU A 72 1.357 21.226 14.135 1.00 0.00 O ATOM 1057 OE2 GLU A 72 -0.621 20.297 14.375 1.00 0.00 O ATOM 0 H GLU A 72 0.362 19.107 10.038 1.00 0.00 H new ATOM 0 HA GLU A 72 2.256 21.070 9.484 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.789 21.707 11.931 1.00 0.00 H new ATOM 0 HB3 GLU A 72 0.420 21.665 10.838 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -0.562 19.901 11.899 1.00 0.00 H new ATOM 0 HG3 GLU A 72 0.963 19.108 12.239 1.00 0.00 H new ATOM 1064 N LYS A 73 3.339 18.685 11.445 1.00 0.00 N ATOM 1065 CA LYS A 73 4.531 18.122 12.068 1.00 0.00 C ATOM 1066 C LYS A 73 5.417 17.445 11.027 1.00 0.00 C ATOM 1067 O LYS A 73 6.623 17.293 11.225 1.00 0.00 O ATOM 1068 CB LYS A 73 4.141 17.112 13.147 1.00 0.00 C ATOM 1069 CG LYS A 73 3.303 17.706 14.265 1.00 0.00 C ATOM 1070 CD LYS A 73 3.481 16.935 15.565 1.00 0.00 C ATOM 1071 CE LYS A 73 2.142 16.622 16.214 1.00 0.00 C ATOM 1072 NZ LYS A 73 2.203 15.389 17.045 1.00 0.00 N ATOM 0 H LYS A 73 2.523 18.074 11.468 1.00 0.00 H new ATOM 0 HA LYS A 73 5.090 18.938 12.527 1.00 0.00 H new ATOM 0 HB2 LYS A 73 3.587 16.295 12.684 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.047 16.681 13.573 1.00 0.00 H new ATOM 0 HG2 LYS A 73 3.584 18.748 14.417 1.00 0.00 H new ATOM 0 HG3 LYS A 73 2.252 17.698 13.977 1.00 0.00 H new ATOM 0 HD2 LYS A 73 4.017 16.007 15.368 1.00 0.00 H new ATOM 0 HD3 LYS A 73 4.093 17.517 16.254 1.00 0.00 H new ATOM 0 HE2 LYS A 73 1.834 17.463 16.835 1.00 0.00 H new ATOM 0 HE3 LYS A 73 1.383 16.502 15.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 1.271 15.210 17.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 2.472 14.581 16.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 2.909 15.513 17.799 1.00 0.00 H new ATOM 1086 N GLY A 74 4.806 17.033 9.922 1.00 0.00 N ATOM 1087 CA GLY A 74 5.546 16.369 8.865 1.00 0.00 C ATOM 1088 C GLY A 74 4.969 15.007 8.521 1.00 0.00 C ATOM 1089 O GLY A 74 5.493 14.307 7.654 1.00 0.00 O ATOM 0 H GLY A 74 3.809 17.147 9.739 1.00 0.00 H new ATOM 0 HA2 GLY A 74 5.544 16.997 7.974 1.00 0.00 H new ATOM 0 HA3 GLY A 74 6.586 16.253 9.171 1.00 0.00 H new ATOM 1093 N GLU A 75 3.888 14.629 9.201 1.00 0.00 N ATOM 1094 CA GLU A 75 3.245 13.346 8.960 1.00 0.00 C ATOM 1095 C GLU A 75 2.663 13.287 7.555 1.00 0.00 C ATOM 1096 O GLU A 75 2.465 14.318 6.912 1.00 0.00 O ATOM 1097 CB GLU A 75 2.141 13.103 9.993 1.00 0.00 C ATOM 1098 CG GLU A 75 2.628 13.173 11.431 1.00 0.00 C ATOM 1099 CD GLU A 75 1.721 12.428 12.390 1.00 0.00 C ATOM 1100 OE1 GLU A 75 1.009 11.507 11.939 1.00 0.00 O ATOM 1101 OE2 GLU A 75 1.724 12.767 13.591 1.00 0.00 O ATOM 0 H GLU A 75 3.442 15.195 9.922 1.00 0.00 H new ATOM 0 HA GLU A 75 4.000 12.565 9.055 1.00 0.00 H new ATOM 0 HB2 GLU A 75 1.351 13.841 9.849 1.00 0.00 H new ATOM 0 HB3 GLU A 75 1.698 12.123 9.815 1.00 0.00 H new ATOM 0 HG2 GLU A 75 3.634 12.757 11.491 1.00 0.00 H new ATOM 0 HG3 GLU A 75 2.696 14.217 11.737 1.00 0.00 H new ATOM 1108 N THR A 76 2.387 12.076 7.079 1.00 0.00 N ATOM 1109 CA THR A 76 1.824 11.897 5.742 1.00 0.00 C ATOM 1110 C THR A 76 1.553 10.426 5.441 1.00 0.00 C ATOM 1111 O THR A 76 1.705 9.563 6.307 1.00 0.00 O ATOM 1112 CB THR A 76 2.772 12.473 4.688 1.00 0.00 C ATOM 1113 OG1 THR A 76 2.201 12.382 3.396 1.00 0.00 O ATOM 1114 CG2 THR A 76 4.115 11.776 4.648 1.00 0.00 C ATOM 0 H THR A 76 2.542 11.209 7.594 1.00 0.00 H new ATOM 0 HA THR A 76 0.874 12.431 5.709 1.00 0.00 H new ATOM 0 HB THR A 76 2.928 13.512 4.977 1.00 0.00 H new ATOM 0 HG1 THR A 76 2.822 12.757 2.737 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.739 12.233 3.880 1.00 0.00 H new ATOM 0 HG22 THR A 76 4.604 11.872 5.617 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.970 10.720 4.418 1.00 0.00 H new ATOM 1122 N LEU A 77 1.150 10.151 4.202 1.00 0.00 N ATOM 1123 CA LEU A 77 0.855 8.788 3.772 1.00 0.00 C ATOM 1124 C LEU A 77 1.915 8.287 2.794 1.00 0.00 C ATOM 1125 O LEU A 77 1.944 8.694 1.633 1.00 0.00 O ATOM 1126 CB LEU A 77 -0.529 8.728 3.118 1.00 0.00 C ATOM 1127 CG LEU A 77 -1.398 7.545 3.548 1.00 0.00 C ATOM 1128 CD1 LEU A 77 -2.381 7.970 4.629 1.00 0.00 C ATOM 1129 CD2 LEU A 77 -2.139 6.964 2.352 1.00 0.00 C ATOM 0 H LEU A 77 1.020 10.857 3.477 1.00 0.00 H new ATOM 0 HA LEU A 77 0.863 8.143 4.651 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.061 9.652 3.345 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.401 8.691 2.036 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.748 6.772 3.958 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -2.991 7.116 4.923 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.832 8.339 5.495 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -3.025 8.761 4.244 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.752 6.123 2.677 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.778 7.730 1.912 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.419 6.622 1.609 1.00 0.00 H new ATOM 1141 N LEU A 78 2.789 7.409 3.274 1.00 0.00 N ATOM 1142 CA LEU A 78 3.855 6.858 2.444 1.00 0.00 C ATOM 1143 C LEU A 78 3.446 5.530 1.808 1.00 0.00 C ATOM 1144 O LEU A 78 4.298 4.753 1.378 1.00 0.00 O ATOM 1145 CB LEU A 78 5.123 6.664 3.279 1.00 0.00 C ATOM 1146 CG LEU A 78 5.432 7.793 4.262 1.00 0.00 C ATOM 1147 CD1 LEU A 78 6.410 7.323 5.327 1.00 0.00 C ATOM 1148 CD2 LEU A 78 5.983 9.004 3.524 1.00 0.00 C ATOM 0 H LEU A 78 2.781 7.063 4.234 1.00 0.00 H new ATOM 0 HA LEU A 78 4.050 7.569 1.641 1.00 0.00 H new ATOM 0 HB2 LEU A 78 5.033 5.732 3.837 1.00 0.00 H new ATOM 0 HB3 LEU A 78 5.970 6.550 2.603 1.00 0.00 H new ATOM 0 HG LEU A 78 4.505 8.084 4.756 1.00 0.00 H new ATOM 0 HD11 LEU A 78 6.617 8.141 6.017 1.00 0.00 H new ATOM 0 HD12 LEU A 78 5.977 6.487 5.875 1.00 0.00 H new ATOM 0 HD13 LEU A 78 7.338 7.004 4.853 1.00 0.00 H new ATOM 0 HD21 LEU A 78 6.198 9.799 4.238 1.00 0.00 H new ATOM 0 HD22 LEU A 78 6.900 8.727 3.003 1.00 0.00 H new ATOM 0 HD23 LEU A 78 5.247 9.355 2.801 1.00 0.00 H new ATOM 1160 N SER A 79 2.141 5.275 1.741 1.00 0.00 N ATOM 1161 CA SER A 79 1.637 4.042 1.145 1.00 0.00 C ATOM 1162 C SER A 79 0.410 4.315 0.280 1.00 0.00 C ATOM 1163 O SER A 79 -0.331 5.268 0.524 1.00 0.00 O ATOM 1164 CB SER A 79 1.283 3.021 2.224 1.00 0.00 C ATOM 1165 OG SER A 79 2.446 2.551 2.882 1.00 0.00 O ATOM 0 H SER A 79 1.417 5.903 2.091 1.00 0.00 H new ATOM 0 HA SER A 79 2.429 3.635 0.516 1.00 0.00 H new ATOM 0 HB2 SER A 79 0.608 3.474 2.950 1.00 0.00 H new ATOM 0 HB3 SER A 79 0.751 2.182 1.775 1.00 0.00 H new ATOM 0 HG SER A 79 3.107 2.269 2.216 1.00 0.00 H new ATOM 1171 N PRO A 80 0.170 3.475 -0.742 1.00 0.00 N ATOM 1172 CA PRO A 80 -0.982 3.629 -1.635 1.00 0.00 C ATOM 1173 C PRO A 80 -2.291 3.251 -0.955 1.00 0.00 C ATOM 1174 O PRO A 80 -2.438 2.138 -0.448 1.00 0.00 O ATOM 1175 CB PRO A 80 -0.673 2.662 -2.777 1.00 0.00 C ATOM 1176 CG PRO A 80 0.184 1.611 -2.160 1.00 0.00 C ATOM 1177 CD PRO A 80 0.997 2.307 -1.102 1.00 0.00 C ATOM 0 HA PRO A 80 -1.117 4.661 -1.958 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -1.586 2.235 -3.193 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -0.156 3.166 -3.594 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -0.424 0.817 -1.726 1.00 0.00 H new ATOM 0 HG3 PRO A 80 0.829 1.147 -2.905 1.00 0.00 H new ATOM 0 HD2 PRO A 80 1.174 1.661 -0.242 1.00 0.00 H new ATOM 0 HD3 PRO A 80 1.974 2.609 -1.480 1.00 0.00 H new ATOM 1185 N LEU A 81 -3.240 4.182 -0.944 1.00 0.00 N ATOM 1186 CA LEU A 81 -4.537 3.941 -0.324 1.00 0.00 C ATOM 1187 C LEU A 81 -5.230 2.742 -0.962 1.00 0.00 C ATOM 1188 O LEU A 81 -4.872 2.320 -2.061 1.00 0.00 O ATOM 1189 CB LEU A 81 -5.419 5.184 -0.440 1.00 0.00 C ATOM 1190 CG LEU A 81 -5.109 6.289 0.574 1.00 0.00 C ATOM 1191 CD1 LEU A 81 -4.769 7.592 -0.136 1.00 0.00 C ATOM 1192 CD2 LEU A 81 -6.282 6.489 1.521 1.00 0.00 C ATOM 0 H LEU A 81 -3.135 5.109 -1.357 1.00 0.00 H new ATOM 0 HA LEU A 81 -4.374 3.721 0.731 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -5.315 5.593 -1.445 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -6.461 4.885 -0.323 1.00 0.00 H new ATOM 0 HG LEU A 81 -4.242 5.982 1.159 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.552 8.363 0.603 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -3.896 7.443 -0.772 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.615 7.904 -0.749 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -6.043 7.278 2.234 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -7.167 6.771 0.950 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.478 5.561 2.058 1.00 0.00 H new ATOM 1204 N VAL A 82 -6.215 2.191 -0.262 1.00 0.00 N ATOM 1205 CA VAL A 82 -6.949 1.034 -0.761 1.00 0.00 C ATOM 1206 C VAL A 82 -8.430 1.121 -0.404 1.00 0.00 C ATOM 1207 O VAL A 82 -8.793 1.532 0.699 1.00 0.00 O ATOM 1208 CB VAL A 82 -6.359 -0.278 -0.197 1.00 0.00 C ATOM 1209 CG1 VAL A 82 -7.259 -1.465 -0.512 1.00 0.00 C ATOM 1210 CG2 VAL A 82 -4.958 -0.507 -0.741 1.00 0.00 C ATOM 0 H VAL A 82 -6.523 2.526 0.651 1.00 0.00 H new ATOM 0 HA VAL A 82 -6.851 1.032 -1.847 1.00 0.00 H new ATOM 0 HB VAL A 82 -6.299 -0.183 0.887 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -6.818 -2.374 -0.103 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -8.241 -1.305 -0.067 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -7.363 -1.566 -1.592 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -4.557 -1.435 -0.334 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -4.996 -0.574 -1.828 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -4.315 0.324 -0.451 1.00 0.00 H new ATOM 1220 N MET A 83 -9.278 0.726 -1.347 1.00 0.00 N ATOM 1221 CA MET A 83 -10.722 0.749 -1.142 1.00 0.00 C ATOM 1222 C MET A 83 -11.288 -0.668 -1.152 1.00 0.00 C ATOM 1223 O MET A 83 -11.312 -1.329 -2.189 1.00 0.00 O ATOM 1224 CB MET A 83 -11.398 1.593 -2.225 1.00 0.00 C ATOM 1225 CG MET A 83 -11.894 2.941 -1.725 1.00 0.00 C ATOM 1226 SD MET A 83 -13.262 3.585 -2.706 1.00 0.00 S ATOM 1227 CE MET A 83 -14.138 4.548 -1.476 1.00 0.00 C ATOM 0 H MET A 83 -8.989 0.385 -2.264 1.00 0.00 H new ATOM 0 HA MET A 83 -10.924 1.196 -0.169 1.00 0.00 H new ATOM 0 HB2 MET A 83 -10.693 1.754 -3.041 1.00 0.00 H new ATOM 0 HB3 MET A 83 -12.239 1.035 -2.636 1.00 0.00 H new ATOM 0 HG2 MET A 83 -12.211 2.845 -0.686 1.00 0.00 H new ATOM 0 HG3 MET A 83 -11.071 3.656 -1.743 1.00 0.00 H new ATOM 0 HE1 MET A 83 -14.638 5.387 -1.959 1.00 0.00 H new ATOM 0 HE2 MET A 83 -14.879 3.920 -0.982 1.00 0.00 H new ATOM 0 HE3 MET A 83 -13.431 4.924 -0.737 1.00 0.00 H new ATOM 1237 N CYS A 84 -11.741 -1.128 0.010 1.00 0.00 N ATOM 1238 CA CYS A 84 -12.304 -2.469 0.136 1.00 0.00 C ATOM 1239 C CYS A 84 -13.434 -2.689 -0.868 1.00 0.00 C ATOM 1240 O CYS A 84 -14.418 -1.949 -0.880 1.00 0.00 O ATOM 1241 CB CYS A 84 -12.820 -2.695 1.558 1.00 0.00 C ATOM 1242 SG CYS A 84 -11.626 -2.282 2.850 1.00 0.00 S ATOM 0 H CYS A 84 -11.729 -0.592 0.878 1.00 0.00 H new ATOM 0 HA CYS A 84 -11.512 -3.187 -0.077 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -13.720 -2.098 1.706 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -13.109 -3.740 1.666 1.00 0.00 H new ATOM 0 HG CYS A 84 -11.409 -3.328 3.591 1.00 0.00 H new ATOM 1248 N GLY A 85 -13.286 -3.711 -1.705 1.00 0.00 N ATOM 1249 CA GLY A 85 -14.301 -4.012 -2.697 1.00 0.00 C ATOM 1250 C GLY A 85 -15.660 -4.255 -2.073 1.00 0.00 C ATOM 1251 O GLY A 85 -16.481 -3.341 -1.995 1.00 0.00 O ATOM 0 H GLY A 85 -12.480 -4.336 -1.714 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -14.371 -3.186 -3.404 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -14.001 -4.893 -3.265 1.00 0.00 H new ATOM 1255 N PRO A 86 -15.927 -5.486 -1.607 1.00 0.00 N ATOM 1256 CA PRO A 86 -17.205 -5.823 -0.978 1.00 0.00 C ATOM 1257 C PRO A 86 -17.399 -5.082 0.337 1.00 0.00 C ATOM 1258 O PRO A 86 -16.499 -5.035 1.174 1.00 0.00 O ATOM 1259 CB PRO A 86 -17.106 -7.331 -0.733 1.00 0.00 C ATOM 1260 CG PRO A 86 -15.645 -7.621 -0.705 1.00 0.00 C ATOM 1261 CD PRO A 86 -15.007 -6.637 -1.646 1.00 0.00 C ATOM 0 HA PRO A 86 -18.054 -5.542 -1.601 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -17.582 -7.610 0.207 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -17.605 -7.893 -1.523 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -15.245 -7.512 0.303 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -15.445 -8.646 -1.018 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -14.004 -6.361 -1.321 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -14.915 -7.045 -2.653 1.00 0.00 H new ATOM 1269 N HIS A 87 -18.577 -4.497 0.511 1.00 0.00 N ATOM 1270 CA HIS A 87 -18.880 -3.751 1.725 1.00 0.00 C ATOM 1271 C HIS A 87 -19.475 -4.661 2.791 1.00 0.00 C ATOM 1272 O HIS A 87 -20.250 -5.567 2.487 1.00 0.00 O ATOM 1273 CB HIS A 87 -19.842 -2.602 1.420 1.00 0.00 C ATOM 1274 CG HIS A 87 -21.113 -3.043 0.763 1.00 0.00 C ATOM 1275 ND1 HIS A 87 -21.394 -3.318 -0.533 1.00 0.00 N flip ATOM 1276 CD2 HIS A 87 -22.287 -3.250 1.459 1.00 0.00 C flip ATOM 1277 CE1 HIS A 87 -22.716 -3.681 -0.595 1.00 0.00 C flip ATOM 1278 NE2 HIS A 87 -23.232 -3.633 0.618 1.00 0.00 N flip ATOM 0 H HIS A 87 -19.336 -4.524 -0.170 1.00 0.00 H new ATOM 0 HA HIS A 87 -17.946 -3.339 2.108 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -20.083 -2.085 2.349 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -19.340 -1.881 0.775 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -22.413 -3.119 2.524 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -23.248 -3.961 -1.492 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -24.197 -3.854 0.865 1.00 0.00 H new ATOM 1287 N GLY A 88 -19.098 -4.417 4.042 1.00 0.00 N ATOM 1288 CA GLY A 88 -19.597 -5.226 5.135 1.00 0.00 C ATOM 1289 C GLY A 88 -19.306 -6.698 4.929 1.00 0.00 C ATOM 1290 O GLY A 88 -20.220 -7.522 4.892 1.00 0.00 O ATOM 0 H GLY A 88 -18.456 -3.673 4.317 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -19.143 -4.894 6.069 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -20.673 -5.079 5.233 1.00 0.00 H new ATOM 1294 N LEU A 89 -18.025 -7.030 4.794 1.00 0.00 N ATOM 1295 CA LEU A 89 -17.613 -8.410 4.587 1.00 0.00 C ATOM 1296 C LEU A 89 -17.009 -8.975 5.863 1.00 0.00 C ATOM 1297 O LEU A 89 -16.306 -8.276 6.584 1.00 0.00 O ATOM 1298 CB LEU A 89 -16.600 -8.487 3.444 1.00 0.00 C ATOM 1299 CG LEU A 89 -16.097 -9.892 3.111 1.00 0.00 C ATOM 1300 CD1 LEU A 89 -17.265 -10.835 2.867 1.00 0.00 C ATOM 1301 CD2 LEU A 89 -15.180 -9.850 1.898 1.00 0.00 C ATOM 0 H LEU A 89 -17.256 -6.360 4.825 1.00 0.00 H new ATOM 0 HA LEU A 89 -18.488 -9.004 4.323 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -17.053 -8.060 2.549 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -15.743 -7.863 3.697 1.00 0.00 H new ATOM 0 HG LEU A 89 -15.529 -10.267 3.962 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -16.887 -11.830 2.632 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -17.885 -10.885 3.762 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -17.862 -10.467 2.032 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -14.829 -10.857 1.672 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -15.727 -9.456 1.042 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -14.326 -9.207 2.110 1.00 0.00 H new ATOM 1313 N LYS A 90 -17.289 -10.237 6.146 1.00 0.00 N ATOM 1314 CA LYS A 90 -16.764 -10.868 7.349 1.00 0.00 C ATOM 1315 C LYS A 90 -16.279 -12.285 7.067 1.00 0.00 C ATOM 1316 O LYS A 90 -17.074 -13.205 6.879 1.00 0.00 O ATOM 1317 CB LYS A 90 -17.822 -10.880 8.451 1.00 0.00 C ATOM 1318 CG LYS A 90 -17.979 -9.538 9.147 1.00 0.00 C ATOM 1319 CD LYS A 90 -17.753 -9.651 10.648 1.00 0.00 C ATOM 1320 CE LYS A 90 -18.964 -10.243 11.351 1.00 0.00 C ATOM 1321 NZ LYS A 90 -18.629 -10.742 12.714 1.00 0.00 N ATOM 0 H LYS A 90 -17.871 -10.841 5.566 1.00 0.00 H new ATOM 0 HA LYS A 90 -15.909 -10.281 7.686 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -18.780 -11.174 8.022 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -17.558 -11.636 9.190 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -17.271 -8.825 8.725 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -18.978 -9.145 8.958 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -16.879 -10.274 10.840 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -17.538 -8.665 11.060 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -19.746 -9.488 11.424 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -19.366 -11.062 10.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -19.482 -11.137 13.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -17.901 -11.481 12.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -18.270 -9.956 13.293 1.00 0.00 H new ATOM 1335 N PHE A 91 -14.962 -12.447 7.045 1.00 0.00 N ATOM 1336 CA PHE A 91 -14.342 -13.742 6.793 1.00 0.00 C ATOM 1337 C PHE A 91 -14.318 -14.592 8.057 1.00 0.00 C ATOM 1338 O PHE A 91 -14.435 -14.076 9.169 1.00 0.00 O ATOM 1339 CB PHE A 91 -12.904 -13.556 6.298 1.00 0.00 C ATOM 1340 CG PHE A 91 -12.761 -12.550 5.193 1.00 0.00 C ATOM 1341 CD1 PHE A 91 -13.224 -12.837 3.923 1.00 0.00 C ATOM 1342 CD2 PHE A 91 -12.152 -11.324 5.422 1.00 0.00 C ATOM 1343 CE1 PHE A 91 -13.089 -11.924 2.897 1.00 0.00 C ATOM 1344 CE2 PHE A 91 -12.016 -10.405 4.399 1.00 0.00 C ATOM 1345 CZ PHE A 91 -12.484 -10.706 3.135 1.00 0.00 C ATOM 0 H PHE A 91 -14.297 -11.689 7.200 1.00 0.00 H new ATOM 0 HA PHE A 91 -14.935 -14.248 6.031 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -12.279 -13.249 7.137 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -12.523 -14.517 5.952 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -13.698 -13.788 3.731 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -11.781 -11.086 6.408 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -13.456 -12.162 1.910 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -11.544 -9.452 4.588 1.00 0.00 H new ATOM 0 HZ PHE A 91 -12.377 -9.990 2.334 1.00 0.00 H new ATOM 1355 N LEU A 92 -14.135 -15.895 7.879 1.00 0.00 N ATOM 1356 CA LEU A 92 -14.058 -16.816 9.006 1.00 0.00 C ATOM 1357 C LEU A 92 -12.653 -16.785 9.606 1.00 0.00 C ATOM 1358 O LEU A 92 -12.445 -17.180 10.754 1.00 0.00 O ATOM 1359 CB LEU A 92 -14.409 -18.238 8.562 1.00 0.00 C ATOM 1360 CG LEU A 92 -15.566 -18.338 7.565 1.00 0.00 C ATOM 1361 CD1 LEU A 92 -15.721 -19.769 7.071 1.00 0.00 C ATOM 1362 CD2 LEU A 92 -16.858 -17.848 8.199 1.00 0.00 C ATOM 0 H LEU A 92 -14.037 -16.337 6.965 1.00 0.00 H new ATOM 0 HA LEU A 92 -14.777 -16.503 9.763 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -13.524 -18.692 8.115 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -14.658 -18.827 9.445 1.00 0.00 H new ATOM 0 HG LEU A 92 -15.341 -17.702 6.709 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -16.548 -19.822 6.363 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -14.801 -20.086 6.579 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -15.925 -20.426 7.917 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -17.670 -17.926 7.476 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -17.089 -18.458 9.072 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -16.742 -16.808 8.504 1.00 0.00 H new ATOM 1374 N LYS A 93 -11.698 -16.300 8.816 1.00 0.00 N ATOM 1375 CA LYS A 93 -10.310 -16.193 9.244 1.00 0.00 C ATOM 1376 C LYS A 93 -9.699 -14.900 8.714 1.00 0.00 C ATOM 1377 O LYS A 93 -10.098 -14.403 7.661 1.00 0.00 O ATOM 1378 CB LYS A 93 -9.500 -17.393 8.747 1.00 0.00 C ATOM 1379 CG LYS A 93 -10.155 -18.733 9.038 1.00 0.00 C ATOM 1380 CD LYS A 93 -9.146 -19.751 9.545 1.00 0.00 C ATOM 1381 CE LYS A 93 -8.094 -20.063 8.493 1.00 0.00 C ATOM 1382 NZ LYS A 93 -6.846 -20.604 9.101 1.00 0.00 N ATOM 0 H LYS A 93 -11.866 -15.972 7.865 1.00 0.00 H new ATOM 0 HA LYS A 93 -10.284 -16.182 10.334 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -9.349 -17.298 7.672 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -8.514 -17.372 9.211 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -10.943 -18.600 9.780 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -10.630 -19.111 8.133 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -8.662 -19.369 10.443 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -9.663 -20.668 9.827 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -8.494 -20.785 7.782 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -7.862 -19.158 7.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -6.153 -20.804 8.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -6.450 -19.905 9.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -7.063 -21.481 9.616 1.00 0.00 H new ATOM 1396 N PRO A 94 -8.724 -14.333 9.437 1.00 0.00 N ATOM 1397 CA PRO A 94 -8.067 -13.089 9.030 1.00 0.00 C ATOM 1398 C PRO A 94 -7.178 -13.276 7.808 1.00 0.00 C ATOM 1399 O PRO A 94 -6.325 -14.165 7.775 1.00 0.00 O ATOM 1400 CB PRO A 94 -7.225 -12.717 10.249 1.00 0.00 C ATOM 1401 CG PRO A 94 -6.962 -14.013 10.933 1.00 0.00 C ATOM 1402 CD PRO A 94 -8.187 -14.855 10.706 1.00 0.00 C ATOM 0 HA PRO A 94 -8.788 -12.324 8.743 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -6.296 -12.228 9.955 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -7.757 -12.025 10.902 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -6.074 -14.497 10.525 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -6.783 -13.863 11.998 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -7.940 -15.914 10.633 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -8.904 -14.750 11.520 1.00 0.00 H new ATOM 1410 N VAL A 95 -7.380 -12.430 6.805 1.00 0.00 N ATOM 1411 CA VAL A 95 -6.593 -12.496 5.579 1.00 0.00 C ATOM 1412 C VAL A 95 -5.371 -11.592 5.673 1.00 0.00 C ATOM 1413 O VAL A 95 -5.448 -10.482 6.201 1.00 0.00 O ATOM 1414 CB VAL A 95 -7.428 -12.098 4.346 1.00 0.00 C ATOM 1415 CG1 VAL A 95 -8.562 -13.087 4.131 1.00 0.00 C ATOM 1416 CG2 VAL A 95 -7.966 -10.681 4.493 1.00 0.00 C ATOM 0 H VAL A 95 -8.082 -11.690 6.816 1.00 0.00 H new ATOM 0 HA VAL A 95 -6.271 -13.531 5.461 1.00 0.00 H new ATOM 0 HB VAL A 95 -6.781 -12.123 3.469 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -9.142 -12.791 3.257 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -8.150 -14.084 3.973 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -9.208 -13.096 5.009 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -8.552 -10.421 3.612 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -8.598 -10.622 5.379 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -7.134 -9.984 4.594 1.00 0.00 H new ATOM 1426 N GLU A 96 -4.242 -12.071 5.166 1.00 0.00 N ATOM 1427 CA GLU A 96 -3.006 -11.299 5.204 1.00 0.00 C ATOM 1428 C GLU A 96 -2.935 -10.330 4.031 1.00 0.00 C ATOM 1429 O GLU A 96 -2.934 -10.739 2.876 1.00 0.00 O ATOM 1430 CB GLU A 96 -1.793 -12.229 5.183 1.00 0.00 C ATOM 1431 CG GLU A 96 -0.574 -11.655 5.885 1.00 0.00 C ATOM 1432 CD GLU A 96 0.363 -12.728 6.400 1.00 0.00 C ATOM 1433 OE1 GLU A 96 -0.096 -13.875 6.594 1.00 0.00 O ATOM 1434 OE2 GLU A 96 1.557 -12.425 6.609 1.00 0.00 O ATOM 0 H GLU A 96 -4.156 -12.987 4.725 1.00 0.00 H new ATOM 0 HA GLU A 96 -2.997 -10.725 6.131 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -2.062 -13.174 5.655 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -1.534 -12.452 4.148 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -0.034 -11.007 5.195 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -0.899 -11.032 6.718 1.00 0.00 H new ATOM 1441 N LEU A 97 -2.868 -9.042 4.341 1.00 0.00 N ATOM 1442 CA LEU A 97 -2.789 -8.015 3.311 1.00 0.00 C ATOM 1443 C LEU A 97 -1.435 -7.317 3.366 1.00 0.00 C ATOM 1444 O LEU A 97 -0.998 -6.880 4.429 1.00 0.00 O ATOM 1445 CB LEU A 97 -3.920 -7.001 3.487 1.00 0.00 C ATOM 1446 CG LEU A 97 -3.858 -5.781 2.566 1.00 0.00 C ATOM 1447 CD1 LEU A 97 -5.256 -5.278 2.262 1.00 0.00 C ATOM 1448 CD2 LEU A 97 -3.023 -4.673 3.189 1.00 0.00 C ATOM 0 H LEU A 97 -2.867 -8.684 5.296 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.896 -8.488 2.335 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -4.870 -7.510 3.324 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -3.917 -6.655 4.521 1.00 0.00 H new ATOM 0 HG LEU A 97 -3.383 -6.083 1.633 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -5.196 -4.410 1.606 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -5.827 -6.066 1.770 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -5.752 -4.997 3.191 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -2.994 -3.817 2.515 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -3.467 -4.373 4.138 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -2.009 -5.034 3.361 1.00 0.00 H new ATOM 1460 N ARG A 98 -0.771 -7.225 2.219 1.00 0.00 N ATOM 1461 CA ARG A 98 0.539 -6.590 2.151 1.00 0.00 C ATOM 1462 C ARG A 98 0.526 -5.389 1.211 1.00 0.00 C ATOM 1463 O ARG A 98 -0.039 -5.445 0.119 1.00 0.00 O ATOM 1464 CB ARG A 98 1.589 -7.601 1.687 1.00 0.00 C ATOM 1465 CG ARG A 98 1.640 -8.858 2.541 1.00 0.00 C ATOM 1466 CD ARG A 98 2.653 -9.857 2.004 1.00 0.00 C ATOM 1467 NE ARG A 98 3.751 -10.080 2.940 1.00 0.00 N ATOM 1468 CZ ARG A 98 4.922 -10.612 2.596 1.00 0.00 C ATOM 1469 NH1 ARG A 98 5.150 -10.977 1.341 1.00 0.00 N ATOM 1470 NH2 ARG A 98 5.868 -10.780 3.511 1.00 0.00 N ATOM 0 H ARG A 98 -1.117 -7.580 1.328 1.00 0.00 H new ATOM 0 HA ARG A 98 0.792 -6.236 3.150 1.00 0.00 H new ATOM 0 HB2 ARG A 98 1.381 -7.881 0.654 1.00 0.00 H new ATOM 0 HB3 ARG A 98 2.569 -7.125 1.697 1.00 0.00 H new ATOM 0 HG2 ARG A 98 1.898 -8.592 3.566 1.00 0.00 H new ATOM 0 HG3 ARG A 98 0.653 -9.319 2.570 1.00 0.00 H new ATOM 0 HD2 ARG A 98 2.154 -10.804 1.798 1.00 0.00 H new ATOM 0 HD3 ARG A 98 3.052 -9.495 1.057 1.00 0.00 H new ATOM 0 HE ARG A 98 3.613 -9.813 3.915 1.00 0.00 H new ATOM 0 HH11 ARG A 98 4.426 -10.851 0.634 1.00 0.00 H new ATOM 0 HH12 ARG A 98 6.049 -11.384 1.084 1.00 0.00 H new ATOM 0 HH21 ARG A 98 5.698 -10.502 4.477 1.00 0.00 H new ATOM 0 HH22 ARG A 98 6.765 -11.188 3.248 1.00 0.00 H new ATOM 1484 N LEU A 99 1.162 -4.301 1.643 1.00 0.00 N ATOM 1485 CA LEU A 99 1.233 -3.087 0.841 1.00 0.00 C ATOM 1486 C LEU A 99 2.684 -2.689 0.592 1.00 0.00 C ATOM 1487 O LEU A 99 3.553 -2.906 1.435 1.00 0.00 O ATOM 1488 CB LEU A 99 0.491 -1.941 1.531 1.00 0.00 C ATOM 1489 CG LEU A 99 -1.013 -2.164 1.719 1.00 0.00 C ATOM 1490 CD1 LEU A 99 -1.391 -2.062 3.188 1.00 0.00 C ATOM 1491 CD2 LEU A 99 -1.811 -1.163 0.894 1.00 0.00 C ATOM 0 H LEU A 99 1.635 -4.238 2.545 1.00 0.00 H new ATOM 0 HA LEU A 99 0.755 -3.289 -0.118 1.00 0.00 H new ATOM 0 HB2 LEU A 99 0.943 -1.772 2.508 1.00 0.00 H new ATOM 0 HB3 LEU A 99 0.638 -1.031 0.950 1.00 0.00 H new ATOM 0 HG LEU A 99 -1.254 -3.168 1.371 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.463 -2.223 3.300 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -0.849 -2.818 3.756 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -1.132 -1.072 3.562 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -2.877 -1.338 1.041 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -1.562 -0.150 1.211 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.566 -1.284 -0.161 1.00 0.00 H new ATOM 1503 N PRO A 100 2.962 -2.101 -0.583 1.00 0.00 N ATOM 1504 CA PRO A 100 4.309 -1.673 -0.956 1.00 0.00 C ATOM 1505 C PRO A 100 4.712 -0.358 -0.295 1.00 0.00 C ATOM 1506 O PRO A 100 4.486 0.719 -0.846 1.00 0.00 O ATOM 1507 CB PRO A 100 4.201 -1.497 -2.469 1.00 0.00 C ATOM 1508 CG PRO A 100 2.784 -1.109 -2.701 1.00 0.00 C ATOM 1509 CD PRO A 100 1.978 -1.812 -1.643 1.00 0.00 C ATOM 0 HA PRO A 100 5.069 -2.387 -0.640 1.00 0.00 H new ATOM 0 HB2 PRO A 100 4.886 -0.729 -2.829 1.00 0.00 H new ATOM 0 HB3 PRO A 100 4.451 -2.419 -2.994 1.00 0.00 H new ATOM 0 HG2 PRO A 100 2.660 -0.028 -2.631 1.00 0.00 H new ATOM 0 HG3 PRO A 100 2.458 -1.403 -3.699 1.00 0.00 H new ATOM 0 HD2 PRO A 100 1.167 -1.184 -1.275 1.00 0.00 H new ATOM 0 HD3 PRO A 100 1.524 -2.726 -2.027 1.00 0.00 H new ATOM 1517 N HIS A 101 5.316 -0.454 0.884 1.00 0.00 N ATOM 1518 CA HIS A 101 5.758 0.727 1.615 1.00 0.00 C ATOM 1519 C HIS A 101 7.278 0.857 1.558 1.00 0.00 C ATOM 1520 O HIS A 101 8.003 -0.026 2.013 1.00 0.00 O ATOM 1521 CB HIS A 101 5.289 0.662 3.070 1.00 0.00 C ATOM 1522 CG HIS A 101 5.744 1.825 3.900 1.00 0.00 C ATOM 1523 ND1 HIS A 101 6.224 2.996 3.356 1.00 0.00 N ATOM 1524 CD2 HIS A 101 5.788 1.989 5.244 1.00 0.00 C ATOM 1525 CE1 HIS A 101 6.548 3.831 4.328 1.00 0.00 C ATOM 1526 NE2 HIS A 101 6.292 3.245 5.482 1.00 0.00 N ATOM 0 H HIS A 101 5.511 -1.338 1.354 1.00 0.00 H new ATOM 0 HA HIS A 101 5.317 1.605 1.144 1.00 0.00 H new ATOM 0 HB2 HIS A 101 4.200 0.616 3.090 1.00 0.00 H new ATOM 0 HB3 HIS A 101 5.656 -0.260 3.520 1.00 0.00 H new ATOM 0 HD1 HIS A 101 6.315 3.189 2.359 1.00 0.00 H new ATOM 0 HD2 HIS A 101 5.484 1.268 5.989 1.00 0.00 H new ATOM 0 HE1 HIS A 101 6.953 4.824 4.199 1.00 0.00 H new ATOM 1863 N CYS A 124 7.200 -4.192 3.290 1.00 0.00 N ATOM 1864 CA CYS A 124 5.784 -4.418 3.028 1.00 0.00 C ATOM 1865 C CYS A 124 4.962 -4.296 4.308 1.00 0.00 C ATOM 1866 O CYS A 124 5.329 -4.841 5.349 1.00 0.00 O ATOM 1867 CB CYS A 124 5.574 -5.801 2.407 1.00 0.00 C ATOM 1868 SG CYS A 124 5.563 -5.802 0.598 1.00 0.00 S ATOM 0 HA CYS A 124 5.446 -3.654 2.328 1.00 0.00 H new ATOM 0 HB2 CYS A 124 6.363 -6.468 2.756 1.00 0.00 H new ATOM 0 HB3 CYS A 124 4.629 -6.209 2.766 1.00 0.00 H new ATOM 0 HG CYS A 124 5.382 -7.015 0.166 1.00 0.00 H new ATOM 1874 N VAL A 125 3.846 -3.577 4.220 1.00 0.00 N ATOM 1875 CA VAL A 125 2.967 -3.384 5.368 1.00 0.00 C ATOM 1876 C VAL A 125 1.950 -4.516 5.466 1.00 0.00 C ATOM 1877 O VAL A 125 1.069 -4.644 4.617 1.00 0.00 O ATOM 1878 CB VAL A 125 2.213 -2.042 5.284 1.00 0.00 C ATOM 1879 CG1 VAL A 125 1.623 -1.674 6.637 1.00 0.00 C ATOM 1880 CG2 VAL A 125 3.130 -0.938 4.776 1.00 0.00 C ATOM 0 H VAL A 125 3.530 -3.119 3.365 1.00 0.00 H new ATOM 0 HA VAL A 125 3.599 -3.379 6.256 1.00 0.00 H new ATOM 0 HB VAL A 125 1.394 -2.154 4.574 1.00 0.00 H new ATOM 0 HG11 VAL A 125 1.095 -0.724 6.557 1.00 0.00 H new ATOM 0 HG12 VAL A 125 0.927 -2.451 6.954 1.00 0.00 H new ATOM 0 HG13 VAL A 125 2.424 -1.583 7.371 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.577 -0.000 4.725 1.00 0.00 H new ATOM 0 HG22 VAL A 125 3.974 -0.825 5.456 1.00 0.00 H new ATOM 0 HG23 VAL A 125 3.497 -1.198 3.783 1.00 0.00 H new ATOM 1890 N SER A 126 2.083 -5.341 6.500 1.00 0.00 N ATOM 1891 CA SER A 126 1.177 -6.468 6.694 1.00 0.00 C ATOM 1892 C SER A 126 0.019 -6.105 7.618 1.00 0.00 C ATOM 1893 O SER A 126 0.204 -5.449 8.643 1.00 0.00 O ATOM 1894 CB SER A 126 1.938 -7.669 7.261 1.00 0.00 C ATOM 1895 OG SER A 126 3.084 -7.254 7.983 1.00 0.00 O ATOM 0 H SER A 126 2.806 -5.251 7.214 1.00 0.00 H new ATOM 0 HA SER A 126 0.762 -6.729 5.720 1.00 0.00 H new ATOM 0 HB2 SER A 126 1.281 -8.244 7.914 1.00 0.00 H new ATOM 0 HB3 SER A 126 2.237 -8.331 6.448 1.00 0.00 H new ATOM 0 HG SER A 126 3.551 -8.040 8.336 1.00 0.00 H new ATOM 1901 N VAL A 127 -1.177 -6.556 7.248 1.00 0.00 N ATOM 1902 CA VAL A 127 -2.379 -6.306 8.034 1.00 0.00 C ATOM 1903 C VAL A 127 -3.355 -7.469 7.882 1.00 0.00 C ATOM 1904 O VAL A 127 -3.594 -7.948 6.774 1.00 0.00 O ATOM 1905 CB VAL A 127 -3.071 -4.991 7.619 1.00 0.00 C ATOM 1906 CG1 VAL A 127 -3.368 -4.989 6.132 1.00 0.00 C ATOM 1907 CG2 VAL A 127 -4.344 -4.771 8.425 1.00 0.00 C ATOM 0 H VAL A 127 -1.338 -7.101 6.401 1.00 0.00 H new ATOM 0 HA VAL A 127 -2.076 -6.213 9.077 1.00 0.00 H new ATOM 0 HB VAL A 127 -2.390 -4.167 7.832 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -3.856 -4.053 5.860 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -2.436 -5.088 5.575 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -4.025 -5.824 5.891 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -4.814 -3.838 8.115 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -5.032 -5.599 8.252 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -4.099 -4.719 9.486 1.00 0.00 H new ATOM 1917 N LEU A 128 -3.896 -7.935 9.001 1.00 0.00 N ATOM 1918 CA LEU A 128 -4.823 -9.060 8.987 1.00 0.00 C ATOM 1919 C LEU A 128 -6.276 -8.604 9.060 1.00 0.00 C ATOM 1920 O LEU A 128 -6.669 -7.880 9.974 1.00 0.00 O ATOM 1921 CB LEU A 128 -4.517 -10.004 10.150 1.00 0.00 C ATOM 1922 CG LEU A 128 -3.284 -10.888 9.960 1.00 0.00 C ATOM 1923 CD1 LEU A 128 -2.987 -11.668 11.230 1.00 0.00 C ATOM 1924 CD2 LEU A 128 -3.480 -11.832 8.782 1.00 0.00 C ATOM 0 H LEU A 128 -3.709 -7.552 9.928 1.00 0.00 H new ATOM 0 HA LEU A 128 -4.688 -9.584 8.041 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -4.383 -9.410 11.054 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -5.383 -10.645 10.315 1.00 0.00 H new ATOM 0 HG LEU A 128 -2.429 -10.247 9.745 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -2.106 -12.292 11.076 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -2.801 -10.973 12.049 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -3.840 -12.300 11.477 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -2.592 -12.453 8.662 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -4.346 -12.468 8.966 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -3.642 -11.252 7.874 1.00 0.00 H new ATOM 1936 N ILE A 129 -7.072 -9.039 8.083 1.00 0.00 N ATOM 1937 CA ILE A 129 -8.481 -8.684 8.032 1.00 0.00 C ATOM 1938 C ILE A 129 -9.378 -9.901 8.102 1.00 0.00 C ATOM 1939 O ILE A 129 -9.459 -10.690 7.162 1.00 0.00 O ATOM 1940 CB ILE A 129 -8.819 -7.919 6.749 1.00 0.00 C ATOM 1941 CG1 ILE A 129 -7.830 -6.781 6.551 1.00 0.00 C ATOM 1942 CG2 ILE A 129 -10.246 -7.387 6.805 1.00 0.00 C ATOM 1943 CD1 ILE A 129 -7.099 -6.826 5.228 1.00 0.00 C ATOM 0 H ILE A 129 -6.760 -9.638 7.318 1.00 0.00 H new ATOM 0 HA ILE A 129 -8.660 -8.053 8.902 1.00 0.00 H new ATOM 0 HB ILE A 129 -8.745 -8.600 5.901 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -8.362 -5.833 6.629 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -7.099 -6.803 7.359 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -10.469 -6.846 5.885 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -10.941 -8.220 6.914 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -10.350 -6.714 7.656 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -6.413 -5.982 5.163 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -6.537 -7.757 5.154 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -7.820 -6.772 4.412 1.00 0.00 H new ATOM 1955 N ASP A 130 -10.093 -10.011 9.201 1.00 0.00 N ATOM 1956 CA ASP A 130 -11.038 -11.095 9.381 1.00 0.00 C ATOM 1957 C ASP A 130 -12.376 -10.654 8.817 1.00 0.00 C ATOM 1958 O ASP A 130 -13.096 -11.430 8.197 1.00 0.00 O ATOM 1959 CB ASP A 130 -11.177 -11.455 10.862 1.00 0.00 C ATOM 1960 CG ASP A 130 -11.475 -10.245 11.725 1.00 0.00 C ATOM 1961 OD1 ASP A 130 -12.586 -9.685 11.599 1.00 0.00 O ATOM 1962 OD2 ASP A 130 -10.600 -9.856 12.527 1.00 0.00 O ATOM 0 H ASP A 130 -10.038 -9.362 9.986 1.00 0.00 H new ATOM 0 HA ASP A 130 -10.683 -11.984 8.859 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -11.974 -12.188 10.982 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -10.256 -11.926 11.207 1.00 0.00 H new ATOM 1967 N HIS A 131 -12.671 -9.375 9.023 1.00 0.00 N ATOM 1968 CA HIS A 131 -13.894 -8.765 8.527 1.00 0.00 C ATOM 1969 C HIS A 131 -13.598 -7.371 7.975 1.00 0.00 C ATOM 1970 O HIS A 131 -12.921 -6.571 8.622 1.00 0.00 O ATOM 1971 CB HIS A 131 -14.964 -8.723 9.633 1.00 0.00 C ATOM 1972 CG HIS A 131 -15.592 -7.379 9.856 1.00 0.00 C ATOM 1973 ND1 HIS A 131 -16.306 -6.583 9.025 1.00 0.00 N flip ATOM 1974 CD2 HIS A 131 -15.518 -6.707 11.057 1.00 0.00 C flip ATOM 1975 CE1 HIS A 131 -16.647 -5.458 9.733 1.00 0.00 C flip ATOM 1976 NE2 HIS A 131 -16.160 -5.556 10.956 1.00 0.00 N flip ATOM 0 H HIS A 131 -12.068 -8.734 9.539 1.00 0.00 H new ATOM 0 HA HIS A 131 -14.290 -9.371 7.712 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -15.749 -9.438 9.386 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -14.512 -9.056 10.568 1.00 0.00 H new ATOM 0 HD1 HIS A 131 -16.546 -6.782 8.054 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -15.014 -7.065 11.943 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -17.221 -4.627 9.351 1.00 0.00 H new ATOM 1985 N PHE A 132 -14.101 -7.083 6.782 1.00 0.00 N ATOM 1986 CA PHE A 132 -13.880 -5.785 6.159 1.00 0.00 C ATOM 1987 C PHE A 132 -15.061 -4.854 6.408 1.00 0.00 C ATOM 1988 O PHE A 132 -16.217 -5.242 6.249 1.00 0.00 O ATOM 1989 CB PHE A 132 -13.651 -5.949 4.655 1.00 0.00 C ATOM 1990 CG PHE A 132 -12.210 -6.176 4.281 1.00 0.00 C ATOM 1991 CD1 PHE A 132 -11.212 -5.318 4.726 1.00 0.00 C ATOM 1992 CD2 PHE A 132 -11.854 -7.243 3.471 1.00 0.00 C ATOM 1993 CE1 PHE A 132 -9.892 -5.525 4.368 1.00 0.00 C ATOM 1994 CE2 PHE A 132 -10.538 -7.451 3.108 1.00 0.00 C ATOM 1995 CZ PHE A 132 -9.557 -6.592 3.557 1.00 0.00 C ATOM 0 H PHE A 132 -14.663 -7.729 6.228 1.00 0.00 H new ATOM 0 HA PHE A 132 -12.991 -5.342 6.607 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -14.247 -6.788 4.296 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -14.014 -5.058 4.142 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -11.469 -4.481 5.358 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -12.617 -7.921 3.119 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -9.124 -4.853 4.722 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -10.277 -8.285 2.473 1.00 0.00 H new ATOM 0 HZ PHE A 132 -8.527 -6.753 3.275 1.00 0.00 H new ATOM 2048 N VAL A 138 -14.371 4.013 3.615 1.00 0.00 N ATOM 2049 CA VAL A 138 -13.444 3.208 4.399 1.00 0.00 C ATOM 2050 C VAL A 138 -12.292 2.707 3.531 1.00 0.00 C ATOM 2051 O VAL A 138 -12.486 1.871 2.649 1.00 0.00 O ATOM 2052 CB VAL A 138 -14.154 2.004 5.048 1.00 0.00 C ATOM 2053 CG1 VAL A 138 -15.262 2.474 5.982 1.00 0.00 C ATOM 2054 CG2 VAL A 138 -14.706 1.065 3.987 1.00 0.00 C ATOM 0 HA VAL A 138 -13.050 3.849 5.188 1.00 0.00 H new ATOM 0 HB VAL A 138 -13.420 1.454 5.637 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -15.751 1.609 6.430 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -14.835 3.097 6.768 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -15.993 3.052 5.417 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -15.203 0.223 4.469 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -15.422 1.601 3.364 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -13.889 0.697 3.366 1.00 0.00 H new ATOM 2064 N VAL A 139 -11.096 3.229 3.780 1.00 0.00 N ATOM 2065 CA VAL A 139 -9.920 2.836 3.011 1.00 0.00 C ATOM 2066 C VAL A 139 -8.719 2.582 3.915 1.00 0.00 C ATOM 2067 O VAL A 139 -8.696 3.000 5.072 1.00 0.00 O ATOM 2068 CB VAL A 139 -9.539 3.915 1.981 1.00 0.00 C ATOM 2069 CG1 VAL A 139 -10.508 3.907 0.809 1.00 0.00 C ATOM 2070 CG2 VAL A 139 -9.495 5.288 2.636 1.00 0.00 C ATOM 0 H VAL A 139 -10.915 3.923 4.505 1.00 0.00 H new ATOM 0 HA VAL A 139 -10.183 1.914 2.493 1.00 0.00 H new ATOM 0 HB VAL A 139 -8.544 3.687 1.599 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -10.220 4.677 0.093 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -10.483 2.932 0.322 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -11.517 4.106 1.170 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -9.224 6.037 1.892 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -10.475 5.525 3.050 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -8.754 5.286 3.436 1.00 0.00 H new ATOM 2080 N TYR A 140 -7.717 1.900 3.368 1.00 0.00 N ATOM 2081 CA TYR A 140 -6.501 1.596 4.109 1.00 0.00 C ATOM 2082 C TYR A 140 -5.400 2.583 3.744 1.00 0.00 C ATOM 2083 O TYR A 140 -5.445 3.209 2.685 1.00 0.00 O ATOM 2084 CB TYR A 140 -6.037 0.169 3.808 1.00 0.00 C ATOM 2085 CG TYR A 140 -6.592 -0.870 4.756 1.00 0.00 C ATOM 2086 CD1 TYR A 140 -7.935 -1.220 4.724 1.00 0.00 C ATOM 2087 CD2 TYR A 140 -5.771 -1.504 5.680 1.00 0.00 C ATOM 2088 CE1 TYR A 140 -8.445 -2.173 5.585 1.00 0.00 C ATOM 2089 CE2 TYR A 140 -6.272 -2.458 6.544 1.00 0.00 C ATOM 2090 CZ TYR A 140 -7.609 -2.789 6.493 1.00 0.00 C ATOM 2091 OH TYR A 140 -8.113 -3.738 7.352 1.00 0.00 O ATOM 0 H TYR A 140 -7.725 1.547 2.411 1.00 0.00 H new ATOM 0 HA TYR A 140 -6.716 1.681 5.174 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -6.328 -0.090 2.790 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -4.948 0.136 3.846 1.00 0.00 H new ATOM 0 HD1 TYR A 140 -8.592 -0.739 4.014 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -4.723 -1.247 5.724 1.00 0.00 H new ATOM 0 HE1 TYR A 140 -9.492 -2.434 5.547 1.00 0.00 H new ATOM 0 HE2 TYR A 140 -5.620 -2.942 7.256 1.00 0.00 H new ATOM 0 HH TYR A 140 -7.394 -4.075 7.926 1.00 0.00 H new ATOM 2101 N GLY A 141 -4.412 2.723 4.620 1.00 0.00 N ATOM 2102 CA GLY A 141 -3.323 3.640 4.352 1.00 0.00 C ATOM 2103 C GLY A 141 -2.278 3.653 5.448 1.00 0.00 C ATOM 2104 O GLY A 141 -2.589 3.433 6.617 1.00 0.00 O ATOM 0 H GLY A 141 -4.346 2.221 5.505 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -2.849 3.367 3.409 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -3.724 4.646 4.228 1.00 0.00 H new ATOM 2108 N VAL A 142 -1.036 3.918 5.061 1.00 0.00 N ATOM 2109 CA VAL A 142 0.069 3.970 6.010 1.00 0.00 C ATOM 2110 C VAL A 142 0.174 5.355 6.635 1.00 0.00 C ATOM 2111 O VAL A 142 0.199 6.364 5.929 1.00 0.00 O ATOM 2112 CB VAL A 142 1.403 3.606 5.324 1.00 0.00 C ATOM 2113 CG1 VAL A 142 1.945 4.781 4.525 1.00 0.00 C ATOM 2114 CG2 VAL A 142 2.430 3.137 6.336 1.00 0.00 C ATOM 0 H VAL A 142 -0.769 4.101 4.094 1.00 0.00 H new ATOM 0 HA VAL A 142 -0.131 3.240 6.794 1.00 0.00 H new ATOM 0 HB VAL A 142 1.204 2.785 4.635 1.00 0.00 H new ATOM 0 HG11 VAL A 142 2.885 4.497 4.052 1.00 0.00 H new ATOM 0 HG12 VAL A 142 1.224 5.063 3.758 1.00 0.00 H new ATOM 0 HG13 VAL A 142 2.115 5.627 5.191 1.00 0.00 H new ATOM 0 HG21 VAL A 142 3.359 2.888 5.823 1.00 0.00 H new ATOM 0 HG22 VAL A 142 2.617 3.931 7.060 1.00 0.00 H new ATOM 0 HG23 VAL A 142 2.054 2.255 6.854 1.00 0.00 H new ATOM 2124 N VAL A 143 0.237 5.403 7.958 1.00 0.00 N ATOM 2125 CA VAL A 143 0.339 6.671 8.663 1.00 0.00 C ATOM 2126 C VAL A 143 1.781 6.967 9.048 1.00 0.00 C ATOM 2127 O VAL A 143 2.382 6.249 9.848 1.00 0.00 O ATOM 2128 CB VAL A 143 -0.541 6.685 9.931 1.00 0.00 C ATOM 2129 CG1 VAL A 143 -0.072 5.631 10.926 1.00 0.00 C ATOM 2130 CG2 VAL A 143 -0.542 8.067 10.565 1.00 0.00 C ATOM 0 H VAL A 143 0.219 4.581 8.562 1.00 0.00 H new ATOM 0 HA VAL A 143 -0.016 7.444 7.981 1.00 0.00 H new ATOM 0 HB VAL A 143 -1.563 6.443 9.641 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -0.707 5.659 11.812 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -0.133 4.644 10.467 1.00 0.00 H new ATOM 0 HG13 VAL A 143 0.960 5.835 11.212 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -1.168 8.057 11.458 1.00 0.00 H new ATOM 0 HG22 VAL A 143 0.476 8.342 10.839 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -0.936 8.793 9.854 1.00 0.00 H new ATOM 2140 N ARG A 144 2.328 8.032 8.473 1.00 0.00 N ATOM 2141 CA ARG A 144 3.698 8.436 8.754 1.00 0.00 C ATOM 2142 C ARG A 144 3.721 9.481 9.862 1.00 0.00 C ATOM 2143 O ARG A 144 3.325 10.628 9.650 1.00 0.00 O ATOM 2144 CB ARG A 144 4.360 8.993 7.491 1.00 0.00 C ATOM 2145 CG ARG A 144 5.785 9.476 7.707 1.00 0.00 C ATOM 2146 CD ARG A 144 6.205 10.469 6.637 1.00 0.00 C ATOM 2147 NE ARG A 144 7.655 10.490 6.448 1.00 0.00 N ATOM 2148 CZ ARG A 144 8.503 11.081 7.286 1.00 0.00 C ATOM 2149 NH1 ARG A 144 8.054 11.701 8.370 1.00 0.00 N ATOM 2150 NH2 ARG A 144 9.806 11.052 7.040 1.00 0.00 N ATOM 0 H ARG A 144 1.841 8.632 7.807 1.00 0.00 H new ATOM 0 HA ARG A 144 4.258 7.560 9.083 1.00 0.00 H new ATOM 0 HB2 ARG A 144 4.361 8.221 6.722 1.00 0.00 H new ATOM 0 HB3 ARG A 144 3.760 9.820 7.112 1.00 0.00 H new ATOM 0 HG2 ARG A 144 5.867 9.941 8.689 1.00 0.00 H new ATOM 0 HG3 ARG A 144 6.464 8.623 7.700 1.00 0.00 H new ATOM 0 HD2 ARG A 144 5.720 10.213 5.695 1.00 0.00 H new ATOM 0 HD3 ARG A 144 5.861 11.466 6.912 1.00 0.00 H new ATOM 0 HE ARG A 144 8.039 10.024 5.626 1.00 0.00 H new ATOM 0 HH11 ARG A 144 7.053 11.727 8.565 1.00 0.00 H new ATOM 0 HH12 ARG A 144 8.710 12.152 9.008 1.00 0.00 H new ATOM 0 HH21 ARG A 144 10.158 10.577 6.209 1.00 0.00 H new ATOM 0 HH22 ARG A 144 10.456 11.505 7.682 1.00 0.00 H new ATOM 2164 N ARG A 145 4.175 9.072 11.041 1.00 0.00 N ATOM 2165 CA ARG A 145 4.243 9.966 12.191 1.00 0.00 C ATOM 2166 C ARG A 145 5.398 10.951 12.056 1.00 0.00 C ATOM 2167 O ARG A 145 6.309 10.751 11.253 1.00 0.00 O ATOM 2168 CB ARG A 145 4.394 9.154 13.480 1.00 0.00 C ATOM 2169 CG ARG A 145 3.417 7.994 13.586 1.00 0.00 C ATOM 2170 CD ARG A 145 2.205 8.360 14.431 1.00 0.00 C ATOM 2171 NE ARG A 145 2.272 7.772 15.766 1.00 0.00 N ATOM 2172 CZ ARG A 145 1.216 7.626 16.566 1.00 0.00 C ATOM 2173 NH1 ARG A 145 0.014 8.021 16.167 1.00 0.00 N ATOM 2174 NH2 ARG A 145 1.365 7.082 17.765 1.00 0.00 N ATOM 0 H ARG A 145 4.502 8.124 11.226 1.00 0.00 H new ATOM 0 HA ARG A 145 3.315 10.536 12.231 1.00 0.00 H new ATOM 0 HB2 ARG A 145 5.412 8.768 13.539 1.00 0.00 H new ATOM 0 HB3 ARG A 145 4.254 9.816 14.335 1.00 0.00 H new ATOM 0 HG2 ARG A 145 3.091 7.700 12.589 1.00 0.00 H new ATOM 0 HG3 ARG A 145 3.920 7.132 14.024 1.00 0.00 H new ATOM 0 HD2 ARG A 145 2.136 9.445 14.515 1.00 0.00 H new ATOM 0 HD3 ARG A 145 1.298 8.021 13.930 1.00 0.00 H new ATOM 0 HE ARG A 145 3.180 7.455 16.106 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -0.105 8.439 15.244 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -0.791 7.907 16.783 1.00 0.00 H new ATOM 0 HH21 ARG A 145 2.287 6.775 18.075 1.00 0.00 H new ATOM 0 HH22 ARG A 145 0.558 6.970 18.378 1.00 0.00 H new ATOM 2188 N SER A 146 5.351 12.019 12.846 1.00 0.00 N ATOM 2189 CA SER A 146 6.391 13.041 12.816 1.00 0.00 C ATOM 2190 C SER A 146 6.472 13.774 14.151 1.00 0.00 C ATOM 2191 O SER A 146 7.386 13.461 14.943 1.00 0.00 O ATOM 2192 CB SER A 146 6.119 14.039 11.689 1.00 0.00 C ATOM 2193 OG SER A 146 7.320 14.642 11.240 1.00 0.00 O ATOM 2194 OXT SER A 146 5.621 14.655 14.394 1.00 0.00 O ATOM 0 H SER A 146 4.603 12.199 13.515 1.00 0.00 H new ATOM 0 HA SER A 146 7.346 12.548 12.635 1.00 0.00 H new ATOM 0 HB2 SER A 146 5.632 13.529 10.858 1.00 0.00 H new ATOM 0 HB3 SER A 146 5.431 14.809 12.039 1.00 0.00 H new ATOM 0 HG SER A 146 7.231 15.617 11.280 1.00 0.00 H new