USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1100 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 93 HIS : no HD1:sc= -2.06! K(o=-4!,f=-2.2) USER MOD Set 1.2: A 95 THR OG1 : rot 107:sc= -1.93! USER MOD Set 2.1: A 14 SER OG : rot 53:sc= 0.0295 USER MOD Set 2.2: A 27 ASN : amide:sc= -0.0981! K(o=0.65!,f=-0.39) USER MOD Set 2.3: A 76 THR OG1 : rot 120:sc= 0.723 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 150:sc= -1.48 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot -21:sc= -1.39 USER MOD Single : A 18 ASN : amide:sc= -1.69 X(o=-1.7,f=-2.1!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl 167:sc= -4.29! (180deg=-4.58!) USER MOD Single : A 40 GLN : amide:sc=-0.000897 X(o=-0.0009,f=-0.065) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 MET CE :methyl -144:sc= -3.95 (180deg=-5.18!) USER MOD Single : A 43 THR OG1 : rot 150:sc= -0.964 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot -30:sc= -1.89! USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -107:sc= -1.61 (180deg=-6.55!) USER MOD Single : A 51 THR OG1 : rot -1:sc= -1.07! USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc=-0.00239 X(o=-0.0024,f=-0.097) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 156:sc= 0.265 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 167:sc= -0.11 USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.551 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 15:sc= -1.51 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= 0 K(o=0,f=-2.2) USER MOD Single : A 88 GLN : amide:sc= -0.0761 X(o=-0.076,f=-0.0067) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -62:sc= 1.14 USER MOD Single : A 121 SER OG : rot 72:sc= 1.44 USER MOD Single : A 124 LYS NZ :NH3+ -171:sc= -0.0456 (180deg=-0.244) USER MOD Single : A 125 MET CE :methyl -117:sc= -0.56 (180deg=-2.98!) USER MOD Single : A 127 MET CE :methyl -143:sc= -4.49! (180deg=-7!) USER MOD Single : A 128 ASN : amide:sc=-0.00983 K(o=-0.0098,f=-0.89) USER MOD Single : A 133 SER OG : rot 180:sc=-0.00411 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.450 -15.394 13.344 1.00 0.00 N ATOM 2 CA GLY A 1 -17.891 -15.429 13.156 1.00 0.00 C ATOM 3 C GLY A 1 -18.246 -15.694 11.692 1.00 0.00 C ATOM 4 O GLY A 1 -17.716 -16.619 11.078 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.235 -15.213 14.345 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.041 -16.308 13.062 1.00 0.00 H new ATOM 0 H3 GLY A 1 -16.042 -14.637 12.760 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -18.325 -16.206 13.786 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -18.326 -14.481 13.474 1.00 0.00 H new ATOM 8 N SER A 2 -19.141 -14.866 11.174 1.00 0.00 N ATOM 9 CA SER A 2 -19.574 -14.999 9.793 1.00 0.00 C ATOM 10 C SER A 2 -20.306 -16.329 9.600 1.00 0.00 C ATOM 11 O SER A 2 -19.710 -17.311 9.162 1.00 0.00 O ATOM 12 CB SER A 2 -18.387 -14.902 8.833 1.00 0.00 C ATOM 13 OG SER A 2 -18.106 -13.554 8.466 1.00 0.00 O ATOM 0 H SER A 2 -19.579 -14.100 11.686 1.00 0.00 H new ATOM 0 HA SER A 2 -20.257 -14.180 9.568 1.00 0.00 H new ATOM 0 HB2 SER A 2 -17.506 -15.342 9.300 1.00 0.00 H new ATOM 0 HB3 SER A 2 -18.597 -15.486 7.937 1.00 0.00 H new ATOM 0 HG SER A 2 -17.148 -13.457 8.284 1.00 0.00 H new ATOM 19 N SER A 3 -21.587 -16.317 9.937 1.00 0.00 N ATOM 20 CA SER A 3 -22.407 -17.510 9.806 1.00 0.00 C ATOM 21 C SER A 3 -22.379 -18.007 8.360 1.00 0.00 C ATOM 22 O SER A 3 -23.084 -17.476 7.503 1.00 0.00 O ATOM 23 CB SER A 3 -23.847 -17.240 10.248 1.00 0.00 C ATOM 24 OG SER A 3 -23.956 -17.111 11.663 1.00 0.00 O ATOM 0 H SER A 3 -22.078 -15.500 10.301 1.00 0.00 H new ATOM 0 HA SER A 3 -21.995 -18.282 10.456 1.00 0.00 H new ATOM 0 HB2 SER A 3 -24.207 -16.328 9.772 1.00 0.00 H new ATOM 0 HB3 SER A 3 -24.489 -18.052 9.908 1.00 0.00 H new ATOM 0 HG SER A 3 -24.890 -16.938 11.905 1.00 0.00 H new ATOM 30 N GLY A 4 -21.558 -19.021 8.132 1.00 0.00 N ATOM 31 CA GLY A 4 -21.429 -19.597 6.804 1.00 0.00 C ATOM 32 C GLY A 4 -20.304 -18.919 6.019 1.00 0.00 C ATOM 33 O GLY A 4 -19.127 -19.185 6.259 1.00 0.00 O ATOM 0 H GLY A 4 -20.975 -19.459 8.845 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -21.228 -20.665 6.885 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -22.370 -19.490 6.264 1.00 0.00 H new ATOM 37 N SER A 5 -20.705 -18.055 5.098 1.00 0.00 N ATOM 38 CA SER A 5 -19.746 -17.337 4.277 1.00 0.00 C ATOM 39 C SER A 5 -20.046 -15.838 4.311 1.00 0.00 C ATOM 40 O SER A 5 -21.207 -15.433 4.283 1.00 0.00 O ATOM 41 CB SER A 5 -19.762 -17.849 2.835 1.00 0.00 C ATOM 42 OG SER A 5 -18.744 -17.245 2.042 1.00 0.00 O ATOM 0 H SER A 5 -21.682 -17.836 4.902 1.00 0.00 H new ATOM 0 HA SER A 5 -18.750 -17.511 4.685 1.00 0.00 H new ATOM 0 HB2 SER A 5 -19.629 -18.931 2.833 1.00 0.00 H new ATOM 0 HB3 SER A 5 -20.736 -17.647 2.390 1.00 0.00 H new ATOM 0 HG SER A 5 -18.787 -17.600 1.129 1.00 0.00 H new ATOM 48 N SER A 6 -18.980 -15.054 4.370 1.00 0.00 N ATOM 49 CA SER A 6 -19.115 -13.608 4.409 1.00 0.00 C ATOM 50 C SER A 6 -18.012 -12.957 3.571 1.00 0.00 C ATOM 51 O SER A 6 -18.291 -12.336 2.546 1.00 0.00 O ATOM 52 CB SER A 6 -19.065 -13.088 5.847 1.00 0.00 C ATOM 53 OG SER A 6 -19.387 -11.702 5.925 1.00 0.00 O ATOM 0 H SER A 6 -18.018 -15.393 4.392 1.00 0.00 H new ATOM 0 HA SER A 6 -20.086 -13.344 3.990 1.00 0.00 H new ATOM 0 HB2 SER A 6 -19.761 -13.657 6.463 1.00 0.00 H new ATOM 0 HB3 SER A 6 -18.069 -13.252 6.258 1.00 0.00 H new ATOM 0 HG SER A 6 -19.346 -11.409 6.859 1.00 0.00 H new ATOM 59 N GLY A 7 -16.783 -13.120 4.038 1.00 0.00 N ATOM 60 CA GLY A 7 -15.638 -12.556 3.345 1.00 0.00 C ATOM 61 C GLY A 7 -15.647 -11.028 3.423 1.00 0.00 C ATOM 62 O GLY A 7 -16.710 -10.411 3.445 1.00 0.00 O ATOM 0 H GLY A 7 -16.555 -13.635 4.888 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.717 -12.941 3.784 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -15.649 -12.870 2.301 1.00 0.00 H new ATOM 66 N LEU A 8 -14.449 -10.463 3.464 1.00 0.00 N ATOM 67 CA LEU A 8 -14.306 -9.019 3.540 1.00 0.00 C ATOM 68 C LEU A 8 -14.152 -8.451 2.127 1.00 0.00 C ATOM 69 O LEU A 8 -15.117 -7.964 1.541 1.00 0.00 O ATOM 70 CB LEU A 8 -13.161 -8.643 4.482 1.00 0.00 C ATOM 71 CG LEU A 8 -13.389 -8.938 5.966 1.00 0.00 C ATOM 72 CD1 LEU A 8 -12.103 -8.737 6.769 1.00 0.00 C ATOM 73 CD2 LEU A 8 -14.546 -8.105 6.519 1.00 0.00 C ATOM 0 H LEU A 8 -13.569 -10.979 3.446 1.00 0.00 H new ATOM 0 HA LEU A 8 -15.202 -8.569 3.969 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -12.264 -9.172 4.160 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.960 -7.578 4.370 1.00 0.00 H new ATOM 0 HG LEU A 8 -13.670 -9.986 6.066 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -12.293 -8.953 7.820 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -11.331 -9.409 6.394 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -11.767 -7.705 6.666 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -14.687 -8.334 7.575 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -14.319 -7.045 6.405 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -15.459 -8.341 5.972 1.00 0.00 H new ATOM 85 N GLY A 9 -12.930 -8.533 1.621 1.00 0.00 N ATOM 86 CA GLY A 9 -12.637 -8.033 0.289 1.00 0.00 C ATOM 87 C GLY A 9 -11.205 -8.381 -0.124 1.00 0.00 C ATOM 88 O GLY A 9 -10.536 -9.167 0.544 1.00 0.00 O ATOM 0 H GLY A 9 -12.132 -8.938 2.110 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -13.340 -8.460 -0.426 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.774 -6.952 0.264 1.00 0.00 H new ATOM 92 N THR A 10 -10.778 -7.778 -1.224 1.00 0.00 N ATOM 93 CA THR A 10 -9.438 -8.014 -1.734 1.00 0.00 C ATOM 94 C THR A 10 -8.703 -6.688 -1.936 1.00 0.00 C ATOM 95 O THR A 10 -9.329 -5.632 -2.011 1.00 0.00 O ATOM 96 CB THR A 10 -9.559 -8.843 -3.015 1.00 0.00 C ATOM 97 OG1 THR A 10 -9.857 -10.157 -2.551 1.00 0.00 O ATOM 98 CG2 THR A 10 -8.221 -8.998 -3.740 1.00 0.00 C ATOM 0 H THR A 10 -11.336 -7.127 -1.776 1.00 0.00 H new ATOM 0 HA THR A 10 -8.837 -8.577 -1.020 1.00 0.00 H new ATOM 0 HB THR A 10 -10.282 -8.375 -3.683 1.00 0.00 H new ATOM 0 HG1 THR A 10 -9.954 -10.760 -3.317 1.00 0.00 H new ATOM 0 HG21 THR A 10 -8.363 -9.594 -4.642 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.838 -8.014 -4.012 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.507 -9.496 -3.084 1.00 0.00 H new ATOM 106 N LEU A 11 -7.384 -6.785 -2.018 1.00 0.00 N ATOM 107 CA LEU A 11 -6.557 -5.606 -2.210 1.00 0.00 C ATOM 108 C LEU A 11 -5.773 -5.745 -3.517 1.00 0.00 C ATOM 109 O LEU A 11 -5.337 -6.840 -3.869 1.00 0.00 O ATOM 110 CB LEU A 11 -5.672 -5.367 -0.985 1.00 0.00 C ATOM 111 CG LEU A 11 -4.424 -4.513 -1.215 1.00 0.00 C ATOM 112 CD1 LEU A 11 -4.800 -3.115 -1.709 1.00 0.00 C ATOM 113 CD2 LEU A 11 -3.554 -4.462 0.043 1.00 0.00 C ATOM 0 H LEU A 11 -6.868 -7.662 -1.955 1.00 0.00 H new ATOM 0 HA LEU A 11 -7.179 -4.716 -2.304 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.276 -4.891 -0.212 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.359 -6.335 -0.594 1.00 0.00 H new ATOM 0 HG LEU A 11 -3.829 -4.982 -1.998 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -3.895 -2.528 -1.865 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -5.346 -3.196 -2.649 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -5.428 -2.623 -0.966 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -2.674 -3.848 -0.148 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.126 -4.030 0.864 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -3.242 -5.471 0.311 1.00 0.00 H new ATOM 125 N PHE A 12 -5.619 -4.620 -4.199 1.00 0.00 N ATOM 126 CA PHE A 12 -4.895 -4.602 -5.459 1.00 0.00 C ATOM 127 C PHE A 12 -3.789 -3.545 -5.442 1.00 0.00 C ATOM 128 O PHE A 12 -3.976 -2.455 -4.903 1.00 0.00 O ATOM 129 CB PHE A 12 -5.907 -4.247 -6.551 1.00 0.00 C ATOM 130 CG PHE A 12 -7.148 -5.141 -6.563 1.00 0.00 C ATOM 131 CD1 PHE A 12 -7.020 -6.485 -6.396 1.00 0.00 C ATOM 132 CD2 PHE A 12 -8.380 -4.592 -6.741 1.00 0.00 C ATOM 133 CE1 PHE A 12 -8.173 -7.315 -6.408 1.00 0.00 C ATOM 134 CE2 PHE A 12 -9.532 -5.422 -6.753 1.00 0.00 C ATOM 135 CZ PHE A 12 -9.404 -6.766 -6.586 1.00 0.00 C ATOM 0 H PHE A 12 -5.983 -3.714 -3.903 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.430 -5.572 -5.634 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -6.219 -3.211 -6.420 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.416 -4.311 -7.522 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -6.042 -6.921 -6.254 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.482 -3.525 -6.873 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -8.072 -8.382 -6.276 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -10.510 -4.986 -6.895 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.280 -7.397 -6.595 1.00 0.00 H new ATOM 145 N PHE A 13 -2.662 -3.904 -6.037 1.00 0.00 N ATOM 146 CA PHE A 13 -1.526 -3.000 -6.097 1.00 0.00 C ATOM 147 C PHE A 13 -0.442 -3.543 -7.031 1.00 0.00 C ATOM 148 O PHE A 13 -0.524 -4.682 -7.488 1.00 0.00 O ATOM 149 CB PHE A 13 -0.958 -2.901 -4.680 1.00 0.00 C ATOM 150 CG PHE A 13 -0.479 -4.236 -4.106 1.00 0.00 C ATOM 151 CD1 PHE A 13 -1.373 -5.232 -3.863 1.00 0.00 C ATOM 152 CD2 PHE A 13 0.841 -4.427 -3.839 1.00 0.00 C ATOM 153 CE1 PHE A 13 -0.928 -6.470 -3.331 1.00 0.00 C ATOM 154 CE2 PHE A 13 1.286 -5.666 -3.307 1.00 0.00 C ATOM 155 CZ PHE A 13 0.392 -6.661 -3.064 1.00 0.00 C ATOM 0 H PHE A 13 -2.511 -4.809 -6.482 1.00 0.00 H new ATOM 0 HA PHE A 13 -1.843 -2.029 -6.477 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -0.125 -2.198 -4.682 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -1.722 -2.487 -4.022 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -2.421 -5.081 -4.075 1.00 0.00 H new ATOM 0 HD2 PHE A 13 1.551 -3.636 -4.032 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -1.638 -7.261 -3.138 1.00 0.00 H new ATOM 0 HE2 PHE A 13 2.334 -5.818 -3.095 1.00 0.00 H new ATOM 0 HZ PHE A 13 0.730 -7.603 -2.659 1.00 0.00 H new ATOM 165 N SER A 14 0.549 -2.701 -7.287 1.00 0.00 N ATOM 166 CA SER A 14 1.648 -3.082 -8.158 1.00 0.00 C ATOM 167 C SER A 14 2.954 -2.464 -7.654 1.00 0.00 C ATOM 168 O SER A 14 3.089 -1.242 -7.609 1.00 0.00 O ATOM 169 CB SER A 14 1.381 -2.653 -9.602 1.00 0.00 C ATOM 170 OG SER A 14 0.333 -1.691 -9.687 1.00 0.00 O ATOM 0 H SER A 14 0.614 -1.757 -6.907 1.00 0.00 H new ATOM 0 HA SER A 14 1.737 -4.168 -8.141 1.00 0.00 H new ATOM 0 HB2 SER A 14 2.292 -2.236 -10.031 1.00 0.00 H new ATOM 0 HB3 SER A 14 1.120 -3.528 -10.198 1.00 0.00 H new ATOM 0 HG SER A 14 0.529 -0.940 -9.088 1.00 0.00 H new ATOM 176 N LEU A 15 3.881 -3.336 -7.287 1.00 0.00 N ATOM 177 CA LEU A 15 5.171 -2.891 -6.788 1.00 0.00 C ATOM 178 C LEU A 15 6.065 -2.506 -7.969 1.00 0.00 C ATOM 179 O LEU A 15 6.047 -3.166 -9.006 1.00 0.00 O ATOM 180 CB LEU A 15 5.786 -3.951 -5.872 1.00 0.00 C ATOM 181 CG LEU A 15 5.008 -4.264 -4.592 1.00 0.00 C ATOM 182 CD1 LEU A 15 4.959 -5.771 -4.334 1.00 0.00 C ATOM 183 CD2 LEU A 15 5.583 -3.496 -3.399 1.00 0.00 C ATOM 0 H LEU A 15 3.765 -4.349 -7.325 1.00 0.00 H new ATOM 0 HA LEU A 15 5.054 -1.999 -6.172 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.897 -4.874 -6.441 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.788 -3.625 -5.594 1.00 0.00 H new ATOM 0 HG LEU A 15 3.980 -3.927 -4.726 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.400 -5.965 -3.418 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.468 -6.268 -5.171 1.00 0.00 H new ATOM 0 HD13 LEU A 15 5.974 -6.155 -4.228 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.012 -3.736 -2.502 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.625 -3.779 -3.252 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.522 -2.425 -3.592 1.00 0.00 H new ATOM 195 N GLU A 16 6.825 -1.439 -7.771 1.00 0.00 N ATOM 196 CA GLU A 16 7.724 -0.959 -8.806 1.00 0.00 C ATOM 197 C GLU A 16 8.925 -0.247 -8.179 1.00 0.00 C ATOM 198 O GLU A 16 8.764 0.762 -7.493 1.00 0.00 O ATOM 199 CB GLU A 16 6.991 -0.039 -9.785 1.00 0.00 C ATOM 200 CG GLU A 16 7.983 0.754 -10.639 1.00 0.00 C ATOM 201 CD GLU A 16 7.553 0.769 -12.107 1.00 0.00 C ATOM 202 OE1 GLU A 16 6.766 1.674 -12.460 1.00 0.00 O ATOM 203 OE2 GLU A 16 8.020 -0.127 -12.844 1.00 0.00 O ATOM 0 H GLU A 16 6.837 -0.894 -6.909 1.00 0.00 H new ATOM 0 HA GLU A 16 8.089 -1.818 -9.369 1.00 0.00 H new ATOM 0 HB2 GLU A 16 6.342 -0.631 -10.430 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.350 0.648 -9.233 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.053 1.776 -10.266 1.00 0.00 H new ATOM 0 HG3 GLU A 16 8.976 0.314 -10.552 1.00 0.00 H new ATOM 210 N TYR A 17 10.101 -0.800 -8.436 1.00 0.00 N ATOM 211 CA TYR A 17 11.328 -0.231 -7.905 1.00 0.00 C ATOM 212 C TYR A 17 12.034 0.627 -8.956 1.00 0.00 C ATOM 213 O TYR A 17 12.225 0.193 -10.091 1.00 0.00 O ATOM 214 CB TYR A 17 12.223 -1.419 -7.548 1.00 0.00 C ATOM 215 CG TYR A 17 13.526 -1.027 -6.848 1.00 0.00 C ATOM 216 CD1 TYR A 17 13.548 -0.851 -5.479 1.00 0.00 C ATOM 217 CD2 TYR A 17 14.679 -0.849 -7.585 1.00 0.00 C ATOM 218 CE1 TYR A 17 14.775 -0.483 -4.820 1.00 0.00 C ATOM 219 CE2 TYR A 17 15.905 -0.481 -6.926 1.00 0.00 C ATOM 220 CZ TYR A 17 15.893 -0.316 -5.576 1.00 0.00 C ATOM 221 OH TYR A 17 17.051 0.032 -4.954 1.00 0.00 O ATOM 0 H TYR A 17 10.230 -1.636 -9.005 1.00 0.00 H new ATOM 0 HA TYR A 17 11.116 0.406 -7.046 1.00 0.00 H new ATOM 0 HB2 TYR A 17 11.667 -2.099 -6.903 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.462 -1.967 -8.459 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.645 -0.989 -4.902 1.00 0.00 H new ATOM 0 HD2 TYR A 17 14.662 -0.986 -8.656 1.00 0.00 H new ATOM 0 HE1 TYR A 17 14.806 -0.343 -3.750 1.00 0.00 H new ATOM 0 HE2 TYR A 17 16.814 -0.339 -7.491 1.00 0.00 H new ATOM 0 HH TYR A 17 16.847 0.437 -4.085 1.00 0.00 H new ATOM 231 N ASN A 18 12.402 1.830 -8.542 1.00 0.00 N ATOM 232 CA ASN A 18 13.083 2.753 -9.433 1.00 0.00 C ATOM 233 C ASN A 18 14.570 2.397 -9.491 1.00 0.00 C ATOM 234 O ASN A 18 15.366 2.908 -8.705 1.00 0.00 O ATOM 235 CB ASN A 18 12.962 4.194 -8.933 1.00 0.00 C ATOM 236 CG ASN A 18 13.135 5.190 -10.081 1.00 0.00 C ATOM 237 OD1 ASN A 18 13.247 4.827 -11.240 1.00 0.00 O ATOM 238 ND2 ASN A 18 13.151 6.463 -9.695 1.00 0.00 N ATOM 0 H ASN A 18 12.241 2.187 -7.600 1.00 0.00 H new ATOM 0 HA ASN A 18 12.621 2.673 -10.417 1.00 0.00 H new ATOM 0 HB2 ASN A 18 11.989 4.339 -8.465 1.00 0.00 H new ATOM 0 HB3 ASN A 18 13.715 4.381 -8.168 1.00 0.00 H new ATOM 0 HD21 ASN A 18 13.262 7.204 -10.387 1.00 0.00 H new ATOM 0 HD22 ASN A 18 13.052 6.698 -8.707 1.00 0.00 H new ATOM 245 N PHE A 19 14.900 1.522 -10.430 1.00 0.00 N ATOM 246 CA PHE A 19 16.277 1.091 -10.601 1.00 0.00 C ATOM 247 C PHE A 19 17.184 2.275 -10.944 1.00 0.00 C ATOM 248 O PHE A 19 18.259 2.426 -10.366 1.00 0.00 O ATOM 249 CB PHE A 19 16.294 0.097 -11.765 1.00 0.00 C ATOM 250 CG PHE A 19 16.366 -1.368 -11.331 1.00 0.00 C ATOM 251 CD1 PHE A 19 15.282 -1.965 -10.767 1.00 0.00 C ATOM 252 CD2 PHE A 19 17.515 -2.073 -11.509 1.00 0.00 C ATOM 253 CE1 PHE A 19 15.350 -3.325 -10.364 1.00 0.00 C ATOM 254 CE2 PHE A 19 17.583 -3.433 -11.106 1.00 0.00 C ATOM 255 CZ PHE A 19 16.499 -4.030 -10.542 1.00 0.00 C ATOM 0 H PHE A 19 14.237 1.100 -11.080 1.00 0.00 H new ATOM 0 HA PHE A 19 16.643 0.643 -9.678 1.00 0.00 H new ATOM 0 HB2 PHE A 19 15.397 0.243 -12.367 1.00 0.00 H new ATOM 0 HB3 PHE A 19 17.148 0.318 -12.406 1.00 0.00 H new ATOM 0 HD1 PHE A 19 14.370 -1.405 -10.626 1.00 0.00 H new ATOM 0 HD2 PHE A 19 18.376 -1.599 -11.957 1.00 0.00 H new ATOM 0 HE1 PHE A 19 14.489 -3.799 -9.916 1.00 0.00 H new ATOM 0 HE2 PHE A 19 18.495 -3.993 -11.247 1.00 0.00 H new ATOM 0 HZ PHE A 19 16.551 -5.064 -10.235 1.00 0.00 H new ATOM 265 N GLU A 20 16.716 3.085 -11.883 1.00 0.00 N ATOM 266 CA GLU A 20 17.471 4.250 -12.309 1.00 0.00 C ATOM 267 C GLU A 20 18.007 5.010 -11.094 1.00 0.00 C ATOM 268 O GLU A 20 19.193 5.331 -11.031 1.00 0.00 O ATOM 269 CB GLU A 20 16.619 5.162 -13.194 1.00 0.00 C ATOM 270 CG GLU A 20 17.497 6.128 -13.993 1.00 0.00 C ATOM 271 CD GLU A 20 17.426 5.823 -15.490 1.00 0.00 C ATOM 272 OE1 GLU A 20 17.892 4.726 -15.868 1.00 0.00 O ATOM 273 OE2 GLU A 20 16.908 6.693 -16.223 1.00 0.00 O ATOM 0 H GLU A 20 15.824 2.957 -12.360 1.00 0.00 H new ATOM 0 HA GLU A 20 18.319 3.911 -12.903 1.00 0.00 H new ATOM 0 HB2 GLU A 20 16.022 4.558 -13.877 1.00 0.00 H new ATOM 0 HB3 GLU A 20 15.921 5.726 -12.575 1.00 0.00 H new ATOM 0 HG2 GLU A 20 17.174 7.153 -13.811 1.00 0.00 H new ATOM 0 HG3 GLU A 20 18.530 6.054 -13.652 1.00 0.00 H new ATOM 280 N ARG A 21 17.107 5.275 -10.158 1.00 0.00 N ATOM 281 CA ARG A 21 17.474 5.991 -8.948 1.00 0.00 C ATOM 282 C ARG A 21 17.439 5.049 -7.743 1.00 0.00 C ATOM 283 O ARG A 21 17.295 5.495 -6.606 1.00 0.00 O ATOM 284 CB ARG A 21 16.529 7.167 -8.696 1.00 0.00 C ATOM 285 CG ARG A 21 16.291 7.965 -9.979 1.00 0.00 C ATOM 286 CD ARG A 21 15.038 8.835 -9.860 1.00 0.00 C ATOM 287 NE ARG A 21 15.417 10.222 -9.506 1.00 0.00 N ATOM 288 CZ ARG A 21 14.567 11.257 -9.509 1.00 0.00 C ATOM 289 NH1 ARG A 21 13.284 11.069 -9.847 1.00 0.00 N ATOM 290 NH2 ARG A 21 14.999 12.480 -9.174 1.00 0.00 N ATOM 0 H ARG A 21 16.124 5.007 -10.213 1.00 0.00 H new ATOM 0 HA ARG A 21 18.485 6.375 -9.083 1.00 0.00 H new ATOM 0 HB2 ARG A 21 15.578 6.798 -8.312 1.00 0.00 H new ATOM 0 HB3 ARG A 21 16.950 7.819 -7.931 1.00 0.00 H new ATOM 0 HG2 ARG A 21 17.157 8.594 -10.186 1.00 0.00 H new ATOM 0 HG3 ARG A 21 16.185 7.282 -10.822 1.00 0.00 H new ATOM 0 HD2 ARG A 21 14.490 8.828 -10.802 1.00 0.00 H new ATOM 0 HD3 ARG A 21 14.372 8.426 -9.100 1.00 0.00 H new ATOM 0 HE ARG A 21 16.386 10.400 -9.243 1.00 0.00 H new ATOM 0 HH11 ARG A 21 12.955 10.138 -10.102 1.00 0.00 H new ATOM 0 HH12 ARG A 21 12.636 11.857 -9.849 1.00 0.00 H new ATOM 0 HH21 ARG A 21 15.976 12.623 -8.917 1.00 0.00 H new ATOM 0 HH22 ARG A 21 14.351 13.268 -9.176 1.00 0.00 H new ATOM 304 N LYS A 22 17.573 3.763 -8.033 1.00 0.00 N ATOM 305 CA LYS A 22 17.558 2.754 -6.988 1.00 0.00 C ATOM 306 C LYS A 22 16.584 3.180 -5.888 1.00 0.00 C ATOM 307 O LYS A 22 17.001 3.521 -4.782 1.00 0.00 O ATOM 308 CB LYS A 22 18.977 2.486 -6.482 1.00 0.00 C ATOM 309 CG LYS A 22 19.600 1.290 -7.205 1.00 0.00 C ATOM 310 CD LYS A 22 20.069 0.229 -6.207 1.00 0.00 C ATOM 311 CE LYS A 22 20.736 -0.944 -6.928 1.00 0.00 C ATOM 312 NZ LYS A 22 22.007 -1.306 -6.262 1.00 0.00 N ATOM 0 H LYS A 22 17.693 3.397 -8.977 1.00 0.00 H new ATOM 0 HA LYS A 22 17.199 1.803 -7.382 1.00 0.00 H new ATOM 0 HB2 LYS A 22 19.595 3.371 -6.636 1.00 0.00 H new ATOM 0 HB3 LYS A 22 18.954 2.295 -5.409 1.00 0.00 H new ATOM 0 HG2 LYS A 22 18.872 0.854 -7.889 1.00 0.00 H new ATOM 0 HG3 LYS A 22 20.444 1.625 -7.809 1.00 0.00 H new ATOM 0 HD2 LYS A 22 20.771 0.673 -5.501 1.00 0.00 H new ATOM 0 HD3 LYS A 22 19.219 -0.131 -5.627 1.00 0.00 H new ATOM 0 HE2 LYS A 22 20.065 -1.803 -6.936 1.00 0.00 H new ATOM 0 HE3 LYS A 22 20.926 -0.679 -7.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 22.447 -2.104 -6.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 22.651 -0.490 -6.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 21.817 -1.579 -5.277 1.00 0.00 H new ATOM 326 N ALA A 23 15.304 3.148 -6.229 1.00 0.00 N ATOM 327 CA ALA A 23 14.267 3.527 -5.285 1.00 0.00 C ATOM 328 C ALA A 23 13.149 2.483 -5.316 1.00 0.00 C ATOM 329 O ALA A 23 13.141 1.602 -6.175 1.00 0.00 O ATOM 330 CB ALA A 23 13.762 4.932 -5.617 1.00 0.00 C ATOM 0 H ALA A 23 14.961 2.865 -7.147 1.00 0.00 H new ATOM 0 HA ALA A 23 14.664 3.555 -4.270 1.00 0.00 H new ATOM 0 HB1 ALA A 23 12.984 5.216 -4.908 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.588 5.640 -5.552 1.00 0.00 H new ATOM 0 HB3 ALA A 23 13.354 4.943 -6.628 1.00 0.00 H new ATOM 336 N PHE A 24 12.232 2.616 -4.369 1.00 0.00 N ATOM 337 CA PHE A 24 11.111 1.696 -4.278 1.00 0.00 C ATOM 338 C PHE A 24 9.780 2.439 -4.396 1.00 0.00 C ATOM 339 O PHE A 24 9.526 3.388 -3.656 1.00 0.00 O ATOM 340 CB PHE A 24 11.190 1.031 -2.902 1.00 0.00 C ATOM 341 CG PHE A 24 10.141 -0.060 -2.677 1.00 0.00 C ATOM 342 CD1 PHE A 24 9.754 -0.855 -3.710 1.00 0.00 C ATOM 343 CD2 PHE A 24 9.595 -0.234 -1.443 1.00 0.00 C ATOM 344 CE1 PHE A 24 8.780 -1.867 -3.501 1.00 0.00 C ATOM 345 CE2 PHE A 24 8.621 -1.246 -1.235 1.00 0.00 C ATOM 346 CZ PHE A 24 8.234 -2.041 -2.268 1.00 0.00 C ATOM 0 H PHE A 24 12.242 3.347 -3.658 1.00 0.00 H new ATOM 0 HA PHE A 24 11.162 0.967 -5.087 1.00 0.00 H new ATOM 0 HB2 PHE A 24 12.182 0.598 -2.775 1.00 0.00 H new ATOM 0 HB3 PHE A 24 11.075 1.795 -2.133 1.00 0.00 H new ATOM 0 HD1 PHE A 24 10.187 -0.717 -4.690 1.00 0.00 H new ATOM 0 HD2 PHE A 24 9.902 0.397 -0.622 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.473 -2.499 -4.322 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.187 -1.384 -0.256 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.493 -2.811 -2.109 1.00 0.00 H new ATOM 356 N VAL A 25 8.964 1.980 -5.334 1.00 0.00 N ATOM 357 CA VAL A 25 7.664 2.590 -5.559 1.00 0.00 C ATOM 358 C VAL A 25 6.569 1.546 -5.332 1.00 0.00 C ATOM 359 O VAL A 25 6.477 0.567 -6.070 1.00 0.00 O ATOM 360 CB VAL A 25 7.614 3.214 -6.955 1.00 0.00 C ATOM 361 CG1 VAL A 25 6.524 4.284 -7.039 1.00 0.00 C ATOM 362 CG2 VAL A 25 8.977 3.788 -7.349 1.00 0.00 C ATOM 0 H VAL A 25 9.178 1.193 -5.947 1.00 0.00 H new ATOM 0 HA VAL A 25 7.494 3.399 -4.849 1.00 0.00 H new ATOM 0 HB VAL A 25 7.365 2.425 -7.665 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.510 4.711 -8.042 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.555 3.834 -6.823 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.729 5.070 -6.312 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.913 4.225 -8.345 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.269 4.557 -6.633 1.00 0.00 H new ATOM 0 HG23 VAL A 25 9.721 2.991 -7.349 1.00 0.00 H new ATOM 372 N VAL A 26 5.767 1.791 -4.306 1.00 0.00 N ATOM 373 CA VAL A 26 4.682 0.884 -3.972 1.00 0.00 C ATOM 374 C VAL A 26 3.346 1.541 -4.327 1.00 0.00 C ATOM 375 O VAL A 26 2.791 2.296 -3.531 1.00 0.00 O ATOM 376 CB VAL A 26 4.775 0.476 -2.500 1.00 0.00 C ATOM 377 CG1 VAL A 26 3.560 -0.356 -2.084 1.00 0.00 C ATOM 378 CG2 VAL A 26 6.077 -0.277 -2.221 1.00 0.00 C ATOM 0 H VAL A 26 5.847 2.604 -3.695 1.00 0.00 H new ATOM 0 HA VAL A 26 4.758 -0.034 -4.555 1.00 0.00 H new ATOM 0 HB VAL A 26 4.779 1.386 -1.900 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.651 -0.633 -1.034 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.652 0.229 -2.228 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.511 -1.258 -2.694 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.118 -0.555 -1.168 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.116 -1.176 -2.836 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.926 0.363 -2.460 1.00 0.00 H new ATOM 388 N ASN A 27 2.870 1.229 -5.523 1.00 0.00 N ATOM 389 CA ASN A 27 1.610 1.779 -5.993 1.00 0.00 C ATOM 390 C ASN A 27 0.452 1.008 -5.356 1.00 0.00 C ATOM 391 O ASN A 27 0.399 -0.218 -5.437 1.00 0.00 O ATOM 392 CB ASN A 27 1.485 1.650 -7.513 1.00 0.00 C ATOM 393 CG ASN A 27 0.037 1.851 -7.963 1.00 0.00 C ATOM 394 OD1 ASN A 27 -0.634 0.935 -8.410 1.00 0.00 O ATOM 395 ND2 ASN A 27 -0.406 3.097 -7.821 1.00 0.00 N ATOM 0 H ASN A 27 3.334 0.602 -6.181 1.00 0.00 H new ATOM 0 HA ASN A 27 1.579 2.833 -5.717 1.00 0.00 H new ATOM 0 HB2 ASN A 27 2.126 2.386 -7.998 1.00 0.00 H new ATOM 0 HB3 ASN A 27 1.834 0.667 -7.828 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.360 3.333 -8.093 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.208 3.816 -7.440 1.00 0.00 H new ATOM 402 N ILE A 28 -0.447 1.759 -4.737 1.00 0.00 N ATOM 403 CA ILE A 28 -1.601 1.161 -4.087 1.00 0.00 C ATOM 404 C ILE A 28 -2.839 1.367 -4.963 1.00 0.00 C ATOM 405 O ILE A 28 -3.402 2.460 -5.001 1.00 0.00 O ATOM 406 CB ILE A 28 -1.757 1.706 -2.665 1.00 0.00 C ATOM 407 CG1 ILE A 28 -0.487 1.468 -1.846 1.00 0.00 C ATOM 408 CG2 ILE A 28 -2.996 1.119 -1.986 1.00 0.00 C ATOM 409 CD1 ILE A 28 -0.757 1.649 -0.351 1.00 0.00 C ATOM 0 H ILE A 28 -0.400 2.776 -4.672 1.00 0.00 H new ATOM 0 HA ILE A 28 -1.462 0.085 -3.979 1.00 0.00 H new ATOM 0 HB ILE A 28 -1.904 2.784 -2.726 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.113 0.461 -2.032 1.00 0.00 H new ATOM 0 HG13 ILE A 28 0.291 2.161 -2.165 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -3.084 1.522 -0.977 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -3.884 1.382 -2.560 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.904 0.034 -1.936 1.00 0.00 H new ATOM 0 HD11 ILE A 28 0.162 1.474 0.208 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -1.108 2.664 -0.165 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.518 0.938 -0.030 1.00 0.00 H new ATOM 421 N LYS A 29 -3.225 0.300 -5.646 1.00 0.00 N ATOM 422 CA LYS A 29 -4.385 0.350 -6.519 1.00 0.00 C ATOM 423 C LYS A 29 -5.630 0.671 -5.689 1.00 0.00 C ATOM 424 O LYS A 29 -5.586 1.522 -4.802 1.00 0.00 O ATOM 425 CB LYS A 29 -4.503 -0.943 -7.329 1.00 0.00 C ATOM 426 CG LYS A 29 -5.320 -0.720 -8.603 1.00 0.00 C ATOM 427 CD LYS A 29 -4.406 -0.547 -9.817 1.00 0.00 C ATOM 428 CE LYS A 29 -4.710 -1.599 -10.886 1.00 0.00 C ATOM 429 NZ LYS A 29 -4.788 -0.971 -12.224 1.00 0.00 N ATOM 0 H LYS A 29 -2.755 -0.605 -5.613 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.275 1.149 -7.252 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.508 -1.305 -7.589 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -4.974 -1.715 -6.721 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -5.988 -1.566 -8.764 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.948 0.164 -8.487 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -4.537 0.451 -10.236 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -3.364 -0.629 -9.507 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -3.934 -2.365 -10.882 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -5.652 -2.098 -10.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -4.995 -1.699 -12.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -5.544 -0.257 -12.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -3.880 -0.516 -12.447 1.00 0.00 H new ATOM 443 N GLU A 30 -6.710 -0.028 -6.006 1.00 0.00 N ATOM 444 CA GLU A 30 -7.964 0.172 -5.300 1.00 0.00 C ATOM 445 C GLU A 30 -8.359 -1.100 -4.548 1.00 0.00 C ATOM 446 O GLU A 30 -7.733 -2.145 -4.718 1.00 0.00 O ATOM 447 CB GLU A 30 -9.072 0.606 -6.263 1.00 0.00 C ATOM 448 CG GLU A 30 -9.372 -0.493 -7.284 1.00 0.00 C ATOM 449 CD GLU A 30 -10.100 0.076 -8.504 1.00 0.00 C ATOM 450 OE1 GLU A 30 -11.025 0.888 -8.284 1.00 0.00 O ATOM 451 OE2 GLU A 30 -9.716 -0.314 -9.627 1.00 0.00 O ATOM 0 H GLU A 30 -6.743 -0.733 -6.742 1.00 0.00 H new ATOM 0 HA GLU A 30 -7.825 0.972 -4.573 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -9.976 0.842 -5.701 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -8.772 1.517 -6.781 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -8.442 -0.966 -7.599 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -9.982 -1.268 -6.821 1.00 0.00 H new ATOM 458 N ALA A 31 -9.395 -0.970 -3.733 1.00 0.00 N ATOM 459 CA ALA A 31 -9.880 -2.097 -2.954 1.00 0.00 C ATOM 460 C ALA A 31 -11.330 -2.394 -3.343 1.00 0.00 C ATOM 461 O ALA A 31 -12.112 -1.476 -3.584 1.00 0.00 O ATOM 462 CB ALA A 31 -9.729 -1.790 -1.463 1.00 0.00 C ATOM 0 H ALA A 31 -9.912 -0.102 -3.595 1.00 0.00 H new ATOM 0 HA ALA A 31 -9.292 -2.990 -3.165 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -10.093 -2.635 -0.879 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -8.678 -1.615 -1.232 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -10.308 -0.901 -1.214 1.00 0.00 H new ATOM 468 N ARG A 32 -11.644 -3.680 -3.393 1.00 0.00 N ATOM 469 CA ARG A 32 -12.986 -4.109 -3.749 1.00 0.00 C ATOM 470 C ARG A 32 -13.538 -5.062 -2.686 1.00 0.00 C ATOM 471 O ARG A 32 -12.813 -5.914 -2.175 1.00 0.00 O ATOM 472 CB ARG A 32 -12.997 -4.811 -5.108 1.00 0.00 C ATOM 473 CG ARG A 32 -13.668 -3.938 -6.170 1.00 0.00 C ATOM 474 CD ARG A 32 -14.774 -4.708 -6.895 1.00 0.00 C ATOM 475 NE ARG A 32 -15.036 -4.094 -8.216 1.00 0.00 N ATOM 476 CZ ARG A 32 -16.187 -4.225 -8.890 1.00 0.00 C ATOM 477 NH1 ARG A 32 -17.189 -4.949 -8.371 1.00 0.00 N ATOM 478 NH2 ARG A 32 -16.336 -3.633 -10.082 1.00 0.00 N ATOM 0 H ARG A 32 -10.992 -4.439 -3.193 1.00 0.00 H new ATOM 0 HA ARG A 32 -13.614 -3.220 -3.807 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -11.975 -5.039 -5.412 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -13.525 -5.761 -5.026 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -14.087 -3.047 -5.702 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -12.924 -3.599 -6.891 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -14.480 -5.750 -7.021 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.684 -4.704 -6.296 1.00 0.00 H new ATOM 0 HE ARG A 32 -14.294 -3.536 -8.640 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -17.075 -5.400 -7.463 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -18.065 -5.049 -8.884 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -15.574 -3.082 -10.477 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -17.212 -3.733 -10.595 1.00 0.00 H new ATOM 492 N GLY A 33 -14.816 -4.886 -2.386 1.00 0.00 N ATOM 493 CA GLY A 33 -15.473 -5.719 -1.394 1.00 0.00 C ATOM 494 C GLY A 33 -15.219 -5.193 0.020 1.00 0.00 C ATOM 495 O GLY A 33 -14.487 -5.808 0.794 1.00 0.00 O ATOM 0 H GLY A 33 -15.414 -4.179 -2.813 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.545 -5.745 -1.589 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.109 -6.743 -1.476 1.00 0.00 H new ATOM 499 N LEU A 34 -15.838 -4.059 0.315 1.00 0.00 N ATOM 500 CA LEU A 34 -15.688 -3.443 1.623 1.00 0.00 C ATOM 501 C LEU A 34 -17.056 -3.361 2.303 1.00 0.00 C ATOM 502 O LEU A 34 -17.965 -2.702 1.800 1.00 0.00 O ATOM 503 CB LEU A 34 -14.980 -2.092 1.500 1.00 0.00 C ATOM 504 CG LEU A 34 -13.704 -2.077 0.655 1.00 0.00 C ATOM 505 CD1 LEU A 34 -12.890 -0.808 0.914 1.00 0.00 C ATOM 506 CD2 LEU A 34 -12.879 -3.345 0.886 1.00 0.00 C ATOM 0 H LEU A 34 -16.444 -3.551 -0.329 1.00 0.00 H new ATOM 0 HA LEU A 34 -15.050 -4.054 2.262 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.682 -1.374 1.075 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.733 -1.741 2.502 1.00 0.00 H new ATOM 0 HG LEU A 34 -13.990 -2.066 -0.397 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.989 -0.823 0.301 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -13.488 0.067 0.659 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -12.612 -0.763 1.967 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -11.978 -3.309 0.274 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -12.601 -3.412 1.938 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.470 -4.219 0.611 1.00 0.00 H new ATOM 518 N PRO A 35 -17.162 -4.057 3.466 1.00 0.00 N ATOM 519 CA PRO A 35 -18.403 -4.070 4.221 1.00 0.00 C ATOM 520 C PRO A 35 -18.611 -2.744 4.956 1.00 0.00 C ATOM 521 O PRO A 35 -17.730 -2.287 5.681 1.00 0.00 O ATOM 522 CB PRO A 35 -18.280 -5.257 5.162 1.00 0.00 C ATOM 523 CG PRO A 35 -16.797 -5.584 5.228 1.00 0.00 C ATOM 524 CD PRO A 35 -16.106 -4.849 4.092 1.00 0.00 C ATOM 0 HA PRO A 35 -19.281 -4.174 3.584 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -18.671 -5.014 6.150 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -18.852 -6.109 4.793 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -16.381 -5.279 6.188 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -16.639 -6.659 5.139 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -15.302 -4.214 4.463 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -15.660 -5.546 3.382 1.00 0.00 H new ATOM 532 N ALA A 36 -19.783 -2.163 4.742 1.00 0.00 N ATOM 533 CA ALA A 36 -20.118 -0.899 5.375 1.00 0.00 C ATOM 534 C ALA A 36 -19.740 -0.959 6.856 1.00 0.00 C ATOM 535 O ALA A 36 -19.617 -2.042 7.426 1.00 0.00 O ATOM 536 CB ALA A 36 -21.604 -0.601 5.164 1.00 0.00 C ATOM 0 H ALA A 36 -20.512 -2.545 4.139 1.00 0.00 H new ATOM 0 HA ALA A 36 -19.554 -0.082 4.924 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -21.856 0.347 5.639 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -21.815 -0.540 4.096 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -22.201 -1.398 5.606 1.00 0.00 H new ATOM 542 N MET A 37 -19.565 0.219 7.437 1.00 0.00 N ATOM 543 CA MET A 37 -19.202 0.314 8.841 1.00 0.00 C ATOM 544 C MET A 37 -20.303 1.008 9.645 1.00 0.00 C ATOM 545 O MET A 37 -20.661 0.558 10.733 1.00 0.00 O ATOM 546 CB MET A 37 -17.896 1.099 8.979 1.00 0.00 C ATOM 547 CG MET A 37 -16.685 0.168 8.891 1.00 0.00 C ATOM 548 SD MET A 37 -16.522 -0.767 10.403 1.00 0.00 S ATOM 549 CE MET A 37 -15.187 -1.861 9.948 1.00 0.00 C ATOM 0 H MET A 37 -19.668 1.115 6.961 1.00 0.00 H new ATOM 0 HA MET A 37 -19.072 -0.695 9.233 1.00 0.00 H new ATOM 0 HB2 MET A 37 -17.837 1.854 8.195 1.00 0.00 H new ATOM 0 HB3 MET A 37 -17.884 1.628 9.932 1.00 0.00 H new ATOM 0 HG2 MET A 37 -16.798 -0.510 8.045 1.00 0.00 H new ATOM 0 HG3 MET A 37 -15.781 0.750 8.714 1.00 0.00 H new ATOM 0 HE1 MET A 37 -14.801 -2.354 10.840 1.00 0.00 H new ATOM 0 HE2 MET A 37 -15.554 -2.612 9.248 1.00 0.00 H new ATOM 0 HE3 MET A 37 -14.390 -1.286 9.477 1.00 0.00 H new ATOM 559 N ASP A 38 -20.810 2.094 9.080 1.00 0.00 N ATOM 560 CA ASP A 38 -21.862 2.856 9.731 1.00 0.00 C ATOM 561 C ASP A 38 -23.189 2.598 9.015 1.00 0.00 C ATOM 562 O ASP A 38 -23.205 2.256 7.833 1.00 0.00 O ATOM 563 CB ASP A 38 -21.575 4.357 9.669 1.00 0.00 C ATOM 564 CG ASP A 38 -20.174 4.767 10.126 1.00 0.00 C ATOM 565 OD1 ASP A 38 -19.710 4.183 11.129 1.00 0.00 O ATOM 566 OD2 ASP A 38 -19.597 5.655 9.461 1.00 0.00 O ATOM 0 H ASP A 38 -20.511 2.465 8.178 1.00 0.00 H new ATOM 0 HA ASP A 38 -21.910 2.542 10.774 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -21.720 4.697 8.644 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -22.308 4.878 10.285 1.00 0.00 H new ATOM 571 N GLU A 39 -24.271 2.772 9.760 1.00 0.00 N ATOM 572 CA GLU A 39 -25.600 2.563 9.211 1.00 0.00 C ATOM 573 C GLU A 39 -26.239 3.903 8.843 1.00 0.00 C ATOM 574 O GLU A 39 -27.451 4.073 8.971 1.00 0.00 O ATOM 575 CB GLU A 39 -26.481 1.785 10.190 1.00 0.00 C ATOM 576 CG GLU A 39 -25.939 0.372 10.413 1.00 0.00 C ATOM 577 CD GLU A 39 -26.978 -0.682 10.024 1.00 0.00 C ATOM 578 OE1 GLU A 39 -27.048 -0.990 8.815 1.00 0.00 O ATOM 579 OE2 GLU A 39 -27.677 -1.156 10.945 1.00 0.00 O ATOM 0 H GLU A 39 -24.254 3.055 10.740 1.00 0.00 H new ATOM 0 HA GLU A 39 -25.508 1.966 8.304 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -26.528 2.314 11.142 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -27.499 1.731 9.804 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -25.033 0.229 9.824 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -25.662 0.246 11.460 1.00 0.00 H new ATOM 586 N GLN A 40 -25.396 4.821 8.393 1.00 0.00 N ATOM 587 CA GLN A 40 -25.864 6.141 8.006 1.00 0.00 C ATOM 588 C GLN A 40 -26.460 6.101 6.597 1.00 0.00 C ATOM 589 O GLN A 40 -27.679 6.072 6.436 1.00 0.00 O ATOM 590 CB GLN A 40 -24.736 7.170 8.094 1.00 0.00 C ATOM 591 CG GLN A 40 -24.533 7.639 9.537 1.00 0.00 C ATOM 592 CD GLN A 40 -24.826 9.135 9.673 1.00 0.00 C ATOM 593 OE1 GLN A 40 -25.844 9.638 9.225 1.00 0.00 O ATOM 594 NE2 GLN A 40 -23.881 9.815 10.316 1.00 0.00 N ATOM 0 H GLN A 40 -24.392 4.677 8.288 1.00 0.00 H new ATOM 0 HA GLN A 40 -26.645 6.446 8.702 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -23.811 6.734 7.716 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -24.968 8.025 7.459 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -25.187 7.075 10.202 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -23.509 7.435 9.849 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -23.053 9.332 10.666 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -23.984 10.820 10.460 1.00 0.00 H new ATOM 603 N SER A 41 -25.573 6.100 5.614 1.00 0.00 N ATOM 604 CA SER A 41 -25.996 6.064 4.224 1.00 0.00 C ATOM 605 C SER A 41 -25.338 4.884 3.507 1.00 0.00 C ATOM 606 O SER A 41 -24.919 5.007 2.357 1.00 0.00 O ATOM 607 CB SER A 41 -25.657 7.374 3.511 1.00 0.00 C ATOM 608 OG SER A 41 -26.794 7.940 2.863 1.00 0.00 O ATOM 0 H SER A 41 -24.563 6.124 5.752 1.00 0.00 H new ATOM 0 HA SER A 41 -27.078 5.938 4.199 1.00 0.00 H new ATOM 0 HB2 SER A 41 -25.259 8.087 4.233 1.00 0.00 H new ATOM 0 HB3 SER A 41 -24.873 7.194 2.775 1.00 0.00 H new ATOM 0 HG SER A 41 -26.536 8.776 2.421 1.00 0.00 H new ATOM 614 N MET A 42 -25.268 3.766 4.216 1.00 0.00 N ATOM 615 CA MET A 42 -24.668 2.565 3.661 1.00 0.00 C ATOM 616 C MET A 42 -23.368 2.891 2.924 1.00 0.00 C ATOM 617 O MET A 42 -23.268 2.690 1.715 1.00 0.00 O ATOM 618 CB MET A 42 -25.651 1.903 2.693 1.00 0.00 C ATOM 619 CG MET A 42 -25.402 0.396 2.604 1.00 0.00 C ATOM 620 SD MET A 42 -26.020 -0.413 4.071 1.00 0.00 S ATOM 621 CE MET A 42 -24.509 -1.138 4.684 1.00 0.00 C ATOM 0 H MET A 42 -25.617 3.667 5.169 1.00 0.00 H new ATOM 0 HA MET A 42 -24.438 1.885 4.481 1.00 0.00 H new ATOM 0 HB2 MET A 42 -26.673 2.087 3.024 1.00 0.00 H new ATOM 0 HB3 MET A 42 -25.551 2.351 1.704 1.00 0.00 H new ATOM 0 HG2 MET A 42 -25.894 -0.011 1.720 1.00 0.00 H new ATOM 0 HG3 MET A 42 -24.335 0.201 2.493 1.00 0.00 H new ATOM 0 HE1 MET A 42 -24.726 -2.108 5.131 1.00 0.00 H new ATOM 0 HE2 MET A 42 -23.807 -1.267 3.860 1.00 0.00 H new ATOM 0 HE3 MET A 42 -24.070 -0.483 5.436 1.00 0.00 H new ATOM 631 N THR A 43 -22.404 3.390 3.684 1.00 0.00 N ATOM 632 CA THR A 43 -21.113 3.746 3.119 1.00 0.00 C ATOM 633 C THR A 43 -20.146 4.172 4.224 1.00 0.00 C ATOM 634 O THR A 43 -20.569 4.661 5.271 1.00 0.00 O ATOM 635 CB THR A 43 -21.343 4.828 2.062 1.00 0.00 C ATOM 636 OG1 THR A 43 -20.080 4.956 1.415 1.00 0.00 O ATOM 637 CG2 THR A 43 -21.587 6.207 2.679 1.00 0.00 C ATOM 0 H THR A 43 -22.491 3.556 4.687 1.00 0.00 H new ATOM 0 HA THR A 43 -20.644 2.890 2.633 1.00 0.00 H new ATOM 0 HB THR A 43 -22.195 4.552 1.441 1.00 0.00 H new ATOM 0 HG1 THR A 43 -20.216 5.225 0.482 1.00 0.00 H new ATOM 0 HG21 THR A 43 -21.744 6.938 1.886 1.00 0.00 H new ATOM 0 HG22 THR A 43 -22.470 6.169 3.318 1.00 0.00 H new ATOM 0 HG23 THR A 43 -20.721 6.498 3.274 1.00 0.00 H new ATOM 645 N SER A 44 -18.864 3.970 3.955 1.00 0.00 N ATOM 646 CA SER A 44 -17.833 4.328 4.914 1.00 0.00 C ATOM 647 C SER A 44 -16.609 4.883 4.184 1.00 0.00 C ATOM 648 O SER A 44 -16.587 4.940 2.955 1.00 0.00 O ATOM 649 CB SER A 44 -17.438 3.124 5.772 1.00 0.00 C ATOM 650 OG SER A 44 -17.451 1.910 5.026 1.00 0.00 O ATOM 0 H SER A 44 -18.516 3.563 3.087 1.00 0.00 H new ATOM 0 HA SER A 44 -18.233 5.097 5.575 1.00 0.00 H new ATOM 0 HB2 SER A 44 -16.442 3.285 6.186 1.00 0.00 H new ATOM 0 HB3 SER A 44 -18.124 3.039 6.615 1.00 0.00 H new ATOM 0 HG SER A 44 -17.192 1.166 5.608 1.00 0.00 H new ATOM 656 N ASP A 45 -15.619 5.280 4.970 1.00 0.00 N ATOM 657 CA ASP A 45 -14.395 5.829 4.414 1.00 0.00 C ATOM 658 C ASP A 45 -13.221 4.917 4.775 1.00 0.00 C ATOM 659 O ASP A 45 -12.413 5.251 5.640 1.00 0.00 O ATOM 660 CB ASP A 45 -14.105 7.219 4.984 1.00 0.00 C ATOM 661 CG ASP A 45 -15.296 8.180 4.980 1.00 0.00 C ATOM 662 OD1 ASP A 45 -16.220 7.936 4.174 1.00 0.00 O ATOM 663 OD2 ASP A 45 -15.255 9.137 5.783 1.00 0.00 O ATOM 0 H ASP A 45 -15.640 5.232 5.989 1.00 0.00 H new ATOM 0 HA ASP A 45 -14.519 5.901 3.333 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -13.750 7.108 6.009 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -13.293 7.668 4.412 1.00 0.00 H new ATOM 668 N PRO A 46 -13.162 3.752 4.075 1.00 0.00 N ATOM 669 CA PRO A 46 -12.101 2.788 4.314 1.00 0.00 C ATOM 670 C PRO A 46 -10.781 3.263 3.701 1.00 0.00 C ATOM 671 O PRO A 46 -10.773 3.876 2.634 1.00 0.00 O ATOM 672 CB PRO A 46 -12.604 1.490 3.706 1.00 0.00 C ATOM 673 CG PRO A 46 -13.717 1.882 2.747 1.00 0.00 C ATOM 674 CD PRO A 46 -14.101 3.322 3.043 1.00 0.00 C ATOM 0 HA PRO A 46 -11.882 2.657 5.374 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -11.803 0.968 3.182 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -12.973 0.815 4.478 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -13.384 1.780 1.714 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -14.577 1.224 2.871 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -14.022 3.944 2.152 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -15.132 3.393 3.391 1.00 0.00 H new ATOM 682 N TYR A 47 -9.698 2.962 4.402 1.00 0.00 N ATOM 683 CA TYR A 47 -8.376 3.351 3.940 1.00 0.00 C ATOM 684 C TYR A 47 -7.323 2.328 4.370 1.00 0.00 C ATOM 685 O TYR A 47 -7.367 1.819 5.489 1.00 0.00 O ATOM 686 CB TYR A 47 -8.072 4.691 4.611 1.00 0.00 C ATOM 687 CG TYR A 47 -7.662 4.573 6.080 1.00 0.00 C ATOM 688 CD1 TYR A 47 -8.602 4.241 7.035 1.00 0.00 C ATOM 689 CD2 TYR A 47 -6.352 4.797 6.451 1.00 0.00 C ATOM 690 CE1 TYR A 47 -8.216 4.130 8.417 1.00 0.00 C ATOM 691 CE2 TYR A 47 -5.966 4.685 7.834 1.00 0.00 C ATOM 692 CZ TYR A 47 -6.917 4.357 8.749 1.00 0.00 C ATOM 693 OH TYR A 47 -6.552 4.252 10.055 1.00 0.00 O ATOM 0 H TYR A 47 -9.709 2.453 5.286 1.00 0.00 H new ATOM 0 HA TYR A 47 -8.352 3.414 2.852 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.273 5.188 4.060 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -8.953 5.329 4.541 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -9.627 4.065 6.745 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -5.616 5.056 5.704 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -8.942 3.872 9.174 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -4.944 4.858 8.138 1.00 0.00 H new ATOM 0 HH TYR A 47 -7.311 4.490 10.627 1.00 0.00 H new ATOM 703 N ILE A 48 -6.400 2.057 3.458 1.00 0.00 N ATOM 704 CA ILE A 48 -5.337 1.104 3.729 1.00 0.00 C ATOM 705 C ILE A 48 -4.124 1.847 4.293 1.00 0.00 C ATOM 706 O ILE A 48 -3.760 2.913 3.800 1.00 0.00 O ATOM 707 CB ILE A 48 -5.026 0.279 2.479 1.00 0.00 C ATOM 708 CG1 ILE A 48 -6.310 -0.263 1.847 1.00 0.00 C ATOM 709 CG2 ILE A 48 -4.027 -0.837 2.793 1.00 0.00 C ATOM 710 CD1 ILE A 48 -5.992 -1.219 0.695 1.00 0.00 C ATOM 0 H ILE A 48 -6.367 2.481 2.531 1.00 0.00 H new ATOM 0 HA ILE A 48 -5.652 0.386 4.486 1.00 0.00 H new ATOM 0 HB ILE A 48 -4.557 0.934 1.745 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -6.901 -0.781 2.602 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -6.917 0.565 1.481 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -3.823 -1.408 1.887 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -3.099 -0.401 3.164 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -4.446 -1.498 3.552 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -6.921 -1.590 0.263 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -5.422 -0.691 -0.069 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -5.406 -2.058 1.070 1.00 0.00 H new ATOM 722 N LYS A 49 -3.532 1.254 5.319 1.00 0.00 N ATOM 723 CA LYS A 49 -2.367 1.846 5.955 1.00 0.00 C ATOM 724 C LYS A 49 -1.107 1.122 5.477 1.00 0.00 C ATOM 725 O LYS A 49 -1.009 -0.099 5.586 1.00 0.00 O ATOM 726 CB LYS A 49 -2.533 1.852 7.476 1.00 0.00 C ATOM 727 CG LYS A 49 -3.222 3.134 7.948 1.00 0.00 C ATOM 728 CD LYS A 49 -2.820 3.477 9.384 1.00 0.00 C ATOM 729 CE LYS A 49 -3.126 4.941 9.704 1.00 0.00 C ATOM 730 NZ LYS A 49 -2.257 5.425 10.800 1.00 0.00 N ATOM 0 H LYS A 49 -3.837 0.370 5.726 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.264 2.891 5.664 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -3.118 0.986 7.785 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.557 1.763 7.952 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.957 3.958 7.286 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -4.304 3.013 7.889 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -3.354 2.830 10.079 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.756 3.285 9.523 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -2.975 5.553 8.815 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -4.173 5.046 9.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -2.478 6.420 11.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.421 4.852 11.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.260 5.343 10.515 1.00 0.00 H new ATOM 744 N MET A 50 -0.174 1.906 4.958 1.00 0.00 N ATOM 745 CA MET A 50 1.076 1.355 4.462 1.00 0.00 C ATOM 746 C MET A 50 2.179 1.464 5.517 1.00 0.00 C ATOM 747 O MET A 50 2.247 2.449 6.251 1.00 0.00 O ATOM 748 CB MET A 50 1.501 2.107 3.200 1.00 0.00 C ATOM 749 CG MET A 50 2.268 1.189 2.246 1.00 0.00 C ATOM 750 SD MET A 50 3.093 2.159 0.995 1.00 0.00 S ATOM 751 CE MET A 50 4.780 2.029 1.563 1.00 0.00 C ATOM 0 H MET A 50 -0.258 2.919 4.870 1.00 0.00 H new ATOM 0 HA MET A 50 0.921 0.301 4.232 1.00 0.00 H new ATOM 0 HB2 MET A 50 0.621 2.506 2.697 1.00 0.00 H new ATOM 0 HB3 MET A 50 2.126 2.958 3.472 1.00 0.00 H new ATOM 0 HG2 MET A 50 2.998 0.601 2.802 1.00 0.00 H new ATOM 0 HG3 MET A 50 1.582 0.484 1.777 1.00 0.00 H new ATOM 0 HE1 MET A 50 5.093 2.980 1.994 1.00 0.00 H new ATOM 0 HE2 MET A 50 4.850 1.247 2.319 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.429 1.781 0.723 1.00 0.00 H new ATOM 761 N THR A 51 3.017 0.438 5.559 1.00 0.00 N ATOM 762 CA THR A 51 4.113 0.406 6.512 1.00 0.00 C ATOM 763 C THR A 51 5.245 -0.483 5.992 1.00 0.00 C ATOM 764 O THR A 51 5.003 -1.601 5.540 1.00 0.00 O ATOM 765 CB THR A 51 3.554 -0.049 7.861 1.00 0.00 C ATOM 766 OG1 THR A 51 2.706 1.023 8.264 1.00 0.00 O ATOM 767 CG2 THR A 51 4.627 -0.105 8.951 1.00 0.00 C ATOM 0 H THR A 51 2.959 -0.377 4.948 1.00 0.00 H new ATOM 0 HA THR A 51 4.552 1.395 6.643 1.00 0.00 H new ATOM 0 HB THR A 51 3.096 -1.032 7.751 1.00 0.00 H new ATOM 0 HG1 THR A 51 2.731 1.732 7.588 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.177 -0.434 9.888 1.00 0.00 H new ATOM 0 HG22 THR A 51 5.408 -0.807 8.657 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.062 0.886 9.085 1.00 0.00 H new ATOM 775 N ILE A 52 6.456 0.047 6.074 1.00 0.00 N ATOM 776 CA ILE A 52 7.626 -0.684 5.617 1.00 0.00 C ATOM 777 C ILE A 52 8.195 -1.503 6.778 1.00 0.00 C ATOM 778 O ILE A 52 8.825 -0.954 7.680 1.00 0.00 O ATOM 779 CB ILE A 52 8.640 0.270 4.983 1.00 0.00 C ATOM 780 CG1 ILE A 52 8.122 0.814 3.650 1.00 0.00 C ATOM 781 CG2 ILE A 52 10.007 -0.403 4.835 1.00 0.00 C ATOM 782 CD1 ILE A 52 9.049 1.902 3.104 1.00 0.00 C ATOM 0 H ILE A 52 6.653 0.974 6.450 1.00 0.00 H new ATOM 0 HA ILE A 52 7.352 -1.389 4.832 1.00 0.00 H new ATOM 0 HB ILE A 52 8.771 1.122 5.650 1.00 0.00 H new ATOM 0 HG12 ILE A 52 8.044 0.002 2.927 1.00 0.00 H new ATOM 0 HG13 ILE A 52 7.119 1.219 3.784 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.710 0.296 4.382 1.00 0.00 H new ATOM 0 HG22 ILE A 52 10.374 -0.701 5.817 1.00 0.00 H new ATOM 0 HG23 ILE A 52 9.912 -1.284 4.200 1.00 0.00 H new ATOM 0 HD11 ILE A 52 8.658 2.271 2.156 1.00 0.00 H new ATOM 0 HD12 ILE A 52 9.106 2.724 3.818 1.00 0.00 H new ATOM 0 HD13 ILE A 52 10.045 1.487 2.948 1.00 0.00 H new ATOM 794 N LEU A 53 7.951 -2.804 6.717 1.00 0.00 N ATOM 795 CA LEU A 53 8.431 -3.705 7.752 1.00 0.00 C ATOM 796 C LEU A 53 9.818 -4.224 7.366 1.00 0.00 C ATOM 797 O LEU A 53 10.171 -4.247 6.188 1.00 0.00 O ATOM 798 CB LEU A 53 7.410 -4.814 8.013 1.00 0.00 C ATOM 799 CG LEU A 53 6.106 -4.379 8.685 1.00 0.00 C ATOM 800 CD1 LEU A 53 6.380 -3.713 10.035 1.00 0.00 C ATOM 801 CD2 LEU A 53 5.284 -3.481 7.759 1.00 0.00 C ATOM 0 H LEU A 53 7.427 -3.256 5.967 1.00 0.00 H new ATOM 0 HA LEU A 53 8.540 -3.175 8.698 1.00 0.00 H new ATOM 0 HB2 LEU A 53 7.165 -5.287 7.062 1.00 0.00 H new ATOM 0 HB3 LEU A 53 7.881 -5.575 8.636 1.00 0.00 H new ATOM 0 HG LEU A 53 5.510 -5.270 8.881 1.00 0.00 H new ATOM 0 HD11 LEU A 53 5.436 -3.414 10.491 1.00 0.00 H new ATOM 0 HD12 LEU A 53 6.893 -4.417 10.691 1.00 0.00 H new ATOM 0 HD13 LEU A 53 7.006 -2.833 9.886 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.363 -3.186 8.261 1.00 0.00 H new ATOM 0 HD22 LEU A 53 5.861 -2.591 7.509 1.00 0.00 H new ATOM 0 HD23 LEU A 53 5.041 -4.025 6.846 1.00 0.00 H new ATOM 813 N PRO A 54 10.586 -4.640 8.409 1.00 0.00 N ATOM 814 CA PRO A 54 10.091 -4.579 9.774 1.00 0.00 C ATOM 815 C PRO A 54 10.098 -3.141 10.297 1.00 0.00 C ATOM 816 O PRO A 54 9.100 -2.669 10.839 1.00 0.00 O ATOM 817 CB PRO A 54 11.003 -5.503 10.564 1.00 0.00 C ATOM 818 CG PRO A 54 12.251 -5.683 9.715 1.00 0.00 C ATOM 819 CD PRO A 54 11.940 -5.176 8.317 1.00 0.00 C ATOM 0 HA PRO A 54 9.052 -4.897 9.859 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.250 -5.072 11.534 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.519 -6.461 10.754 1.00 0.00 H new ATOM 0 HG2 PRO A 54 13.087 -5.131 10.144 1.00 0.00 H new ATOM 0 HG3 PRO A 54 12.544 -6.732 9.684 1.00 0.00 H new ATOM 0 HD2 PRO A 54 12.649 -4.408 8.007 1.00 0.00 H new ATOM 0 HD3 PRO A 54 11.999 -5.979 7.582 1.00 0.00 H new ATOM 827 N GLU A 55 11.235 -2.485 10.115 1.00 0.00 N ATOM 828 CA GLU A 55 11.386 -1.111 10.562 1.00 0.00 C ATOM 829 C GLU A 55 10.038 -0.552 11.024 1.00 0.00 C ATOM 830 O GLU A 55 9.825 -0.344 12.217 1.00 0.00 O ATOM 831 CB GLU A 55 11.992 -0.240 9.460 1.00 0.00 C ATOM 832 CG GLU A 55 11.464 -0.650 8.084 1.00 0.00 C ATOM 833 CD GLU A 55 12.615 -0.921 7.113 1.00 0.00 C ATOM 834 OE1 GLU A 55 13.236 -1.996 7.255 1.00 0.00 O ATOM 835 OE2 GLU A 55 12.849 -0.045 6.252 1.00 0.00 O ATOM 0 H GLU A 55 12.060 -2.880 9.664 1.00 0.00 H new ATOM 0 HA GLU A 55 12.072 -1.098 11.409 1.00 0.00 H new ATOM 0 HB2 GLU A 55 11.754 0.807 9.647 1.00 0.00 H new ATOM 0 HB3 GLU A 55 13.078 -0.328 9.478 1.00 0.00 H new ATOM 0 HG2 GLU A 55 10.846 -1.543 8.179 1.00 0.00 H new ATOM 0 HG3 GLU A 55 10.826 0.139 7.686 1.00 0.00 H new ATOM 842 N LYS A 56 9.164 -0.326 10.054 1.00 0.00 N ATOM 843 CA LYS A 56 7.843 0.204 10.346 1.00 0.00 C ATOM 844 C LYS A 56 7.885 1.732 10.279 1.00 0.00 C ATOM 845 O LYS A 56 6.852 2.391 10.385 1.00 0.00 O ATOM 846 CB LYS A 56 7.331 -0.338 11.682 1.00 0.00 C ATOM 847 CG LYS A 56 5.802 -0.375 11.710 1.00 0.00 C ATOM 848 CD LYS A 56 5.287 -0.756 13.099 1.00 0.00 C ATOM 849 CE LYS A 56 4.176 -1.803 13.004 1.00 0.00 C ATOM 850 NZ LYS A 56 3.195 -1.619 14.097 1.00 0.00 N ATOM 0 H LYS A 56 9.345 -0.500 9.065 1.00 0.00 H new ATOM 0 HA LYS A 56 7.125 -0.129 9.597 1.00 0.00 H new ATOM 0 HB2 LYS A 56 7.725 -1.341 11.847 1.00 0.00 H new ATOM 0 HB3 LYS A 56 7.698 0.287 12.496 1.00 0.00 H new ATOM 0 HG2 LYS A 56 5.406 0.600 11.427 1.00 0.00 H new ATOM 0 HG3 LYS A 56 5.439 -1.093 10.974 1.00 0.00 H new ATOM 0 HD2 LYS A 56 6.108 -1.146 13.701 1.00 0.00 H new ATOM 0 HD3 LYS A 56 4.912 0.132 13.608 1.00 0.00 H new ATOM 0 HE2 LYS A 56 3.674 -1.723 12.040 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.605 -2.803 13.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 2.448 -2.338 14.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 3.675 -1.718 15.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 2.772 -0.671 14.028 1.00 0.00 H new ATOM 864 N LYS A 57 9.091 2.252 10.103 1.00 0.00 N ATOM 865 CA LYS A 57 9.282 3.690 10.020 1.00 0.00 C ATOM 866 C LYS A 57 8.431 4.248 8.877 1.00 0.00 C ATOM 867 O LYS A 57 7.299 4.678 9.093 1.00 0.00 O ATOM 868 CB LYS A 57 10.769 4.027 9.901 1.00 0.00 C ATOM 869 CG LYS A 57 11.251 4.818 11.119 1.00 0.00 C ATOM 870 CD LYS A 57 11.276 6.319 10.823 1.00 0.00 C ATOM 871 CE LYS A 57 12.594 6.947 11.284 1.00 0.00 C ATOM 872 NZ LYS A 57 12.572 8.411 11.072 1.00 0.00 N ATOM 0 H LYS A 57 9.946 1.703 10.016 1.00 0.00 H new ATOM 0 HA LYS A 57 8.942 4.173 10.936 1.00 0.00 H new ATOM 0 HB2 LYS A 57 11.348 3.108 9.808 1.00 0.00 H new ATOM 0 HB3 LYS A 57 10.943 4.607 8.994 1.00 0.00 H new ATOM 0 HG2 LYS A 57 10.595 4.622 11.967 1.00 0.00 H new ATOM 0 HG3 LYS A 57 12.249 4.483 11.403 1.00 0.00 H new ATOM 0 HD2 LYS A 57 11.144 6.485 9.754 1.00 0.00 H new ATOM 0 HD3 LYS A 57 10.441 6.807 11.326 1.00 0.00 H new ATOM 0 HE2 LYS A 57 12.758 6.729 12.339 1.00 0.00 H new ATOM 0 HE3 LYS A 57 13.426 6.506 10.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 13.473 8.821 11.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 12.437 8.613 10.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 11.790 8.829 11.616 1.00 0.00 H new ATOM 886 N HIS A 58 9.009 4.222 7.685 1.00 0.00 N ATOM 887 CA HIS A 58 8.318 4.720 6.508 1.00 0.00 C ATOM 888 C HIS A 58 6.845 4.311 6.566 1.00 0.00 C ATOM 889 O HIS A 58 6.495 3.187 6.209 1.00 0.00 O ATOM 890 CB HIS A 58 9.015 4.249 5.230 1.00 0.00 C ATOM 891 CG HIS A 58 10.402 4.814 5.042 1.00 0.00 C ATOM 892 ND1 HIS A 58 10.806 6.013 5.603 1.00 0.00 N ATOM 893 CD2 HIS A 58 11.475 4.332 4.351 1.00 0.00 C ATOM 894 CE1 HIS A 58 12.066 6.233 5.258 1.00 0.00 C ATOM 895 NE2 HIS A 58 12.479 5.190 4.482 1.00 0.00 N ATOM 0 H HIS A 58 9.948 3.864 7.509 1.00 0.00 H new ATOM 0 HA HIS A 58 8.356 5.809 6.493 1.00 0.00 H new ATOM 0 HB2 HIS A 58 9.076 3.161 5.242 1.00 0.00 H new ATOM 0 HB3 HIS A 58 8.402 4.525 4.372 1.00 0.00 H new ATOM 0 HD2 HIS A 58 11.503 3.408 3.792 1.00 0.00 H new ATOM 0 HE1 HIS A 58 12.662 7.088 5.541 1.00 0.00 H new ATOM 0 HE2 HIS A 58 13.406 5.087 4.070 1.00 0.00 H new ATOM 903 N LYS A 59 6.022 5.246 7.018 1.00 0.00 N ATOM 904 CA LYS A 59 4.595 4.997 7.127 1.00 0.00 C ATOM 905 C LYS A 59 3.839 5.992 6.245 1.00 0.00 C ATOM 906 O LYS A 59 3.964 7.203 6.421 1.00 0.00 O ATOM 907 CB LYS A 59 4.158 5.019 8.593 1.00 0.00 C ATOM 908 CG LYS A 59 4.404 3.664 9.259 1.00 0.00 C ATOM 909 CD LYS A 59 4.231 3.759 10.777 1.00 0.00 C ATOM 910 CE LYS A 59 3.099 2.849 11.257 1.00 0.00 C ATOM 911 NZ LYS A 59 3.190 2.636 12.719 1.00 0.00 N ATOM 0 H LYS A 59 6.316 6.177 7.313 1.00 0.00 H new ATOM 0 HA LYS A 59 4.353 3.999 6.761 1.00 0.00 H new ATOM 0 HB2 LYS A 59 4.705 5.796 9.128 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.100 5.273 8.657 1.00 0.00 H new ATOM 0 HG2 LYS A 59 3.711 2.926 8.856 1.00 0.00 H new ATOM 0 HG3 LYS A 59 5.411 3.317 9.025 1.00 0.00 H new ATOM 0 HD2 LYS A 59 5.162 3.479 11.271 1.00 0.00 H new ATOM 0 HD3 LYS A 59 4.018 4.790 11.059 1.00 0.00 H new ATOM 0 HE2 LYS A 59 2.136 3.294 11.008 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.151 1.891 10.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 2.414 2.016 13.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.101 2.191 12.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 3.118 3.551 13.208 1.00 0.00 H new ATOM 925 N VAL A 60 3.070 5.445 5.315 1.00 0.00 N ATOM 926 CA VAL A 60 2.294 6.270 4.405 1.00 0.00 C ATOM 927 C VAL A 60 0.851 5.762 4.368 1.00 0.00 C ATOM 928 O VAL A 60 0.599 4.582 4.606 1.00 0.00 O ATOM 929 CB VAL A 60 2.956 6.293 3.025 1.00 0.00 C ATOM 930 CG1 VAL A 60 4.240 7.123 3.047 1.00 0.00 C ATOM 931 CG2 VAL A 60 3.229 4.873 2.525 1.00 0.00 C ATOM 0 H VAL A 60 2.968 4.440 5.172 1.00 0.00 H new ATOM 0 HA VAL A 60 2.266 7.302 4.754 1.00 0.00 H new ATOM 0 HB VAL A 60 2.264 6.766 2.329 1.00 0.00 H new ATOM 0 HG11 VAL A 60 4.690 7.123 2.054 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.007 8.147 3.339 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.940 6.692 3.763 1.00 0.00 H new ATOM 0 HG21 VAL A 60 3.700 4.917 1.543 1.00 0.00 H new ATOM 0 HG22 VAL A 60 3.893 4.363 3.223 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.289 4.326 2.453 1.00 0.00 H new ATOM 941 N LYS A 61 -0.057 6.679 4.068 1.00 0.00 N ATOM 942 CA LYS A 61 -1.468 6.338 3.996 1.00 0.00 C ATOM 943 C LYS A 61 -2.061 6.909 2.707 1.00 0.00 C ATOM 944 O LYS A 61 -1.429 7.723 2.035 1.00 0.00 O ATOM 945 CB LYS A 61 -2.194 6.796 5.263 1.00 0.00 C ATOM 946 CG LYS A 61 -2.388 8.314 5.265 1.00 0.00 C ATOM 947 CD LYS A 61 -2.964 8.791 6.600 1.00 0.00 C ATOM 948 CE LYS A 61 -1.931 9.602 7.384 1.00 0.00 C ATOM 949 NZ LYS A 61 -2.284 9.642 8.821 1.00 0.00 N ATOM 0 H LYS A 61 0.156 7.657 3.872 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.598 5.257 3.955 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -3.163 6.302 5.330 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.623 6.498 6.142 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -1.433 8.807 5.080 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -3.057 8.600 4.453 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -3.850 9.400 6.421 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -3.282 7.932 7.191 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -0.942 9.160 7.259 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -1.880 10.616 6.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -1.572 10.197 9.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -3.218 10.084 8.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -2.310 8.674 9.199 1.00 0.00 H new ATOM 963 N THR A 62 -3.270 6.461 2.400 1.00 0.00 N ATOM 964 CA THR A 62 -3.956 6.917 1.203 1.00 0.00 C ATOM 965 C THR A 62 -4.708 8.219 1.483 1.00 0.00 C ATOM 966 O THR A 62 -4.713 8.707 2.612 1.00 0.00 O ATOM 967 CB THR A 62 -4.862 5.784 0.716 1.00 0.00 C ATOM 968 OG1 THR A 62 -5.881 5.705 1.709 1.00 0.00 O ATOM 969 CG2 THR A 62 -4.175 4.418 0.777 1.00 0.00 C ATOM 0 H THR A 62 -3.792 5.787 2.960 1.00 0.00 H new ATOM 0 HA THR A 62 -3.249 7.152 0.407 1.00 0.00 H new ATOM 0 HB THR A 62 -5.178 5.986 -0.307 1.00 0.00 H new ATOM 0 HG1 THR A 62 -6.687 5.306 1.320 1.00 0.00 H new ATOM 0 HG21 THR A 62 -4.861 3.650 0.421 1.00 0.00 H new ATOM 0 HG22 THR A 62 -3.285 4.430 0.148 1.00 0.00 H new ATOM 0 HG23 THR A 62 -3.889 4.200 1.806 1.00 0.00 H new ATOM 977 N ARG A 63 -5.326 8.746 0.435 1.00 0.00 N ATOM 978 CA ARG A 63 -6.080 9.982 0.554 1.00 0.00 C ATOM 979 C ARG A 63 -7.383 9.737 1.317 1.00 0.00 C ATOM 980 O ARG A 63 -8.170 10.661 1.521 1.00 0.00 O ATOM 981 CB ARG A 63 -6.404 10.564 -0.823 1.00 0.00 C ATOM 982 CG ARG A 63 -6.531 12.087 -0.759 1.00 0.00 C ATOM 983 CD ARG A 63 -7.741 12.571 -1.561 1.00 0.00 C ATOM 984 NE ARG A 63 -7.637 14.027 -1.804 1.00 0.00 N ATOM 985 CZ ARG A 63 -7.923 14.964 -0.889 1.00 0.00 C ATOM 986 NH1 ARG A 63 -8.332 14.602 0.335 1.00 0.00 N ATOM 987 NH2 ARG A 63 -7.801 16.262 -1.198 1.00 0.00 N ATOM 0 H ARG A 63 -5.319 8.339 -0.500 1.00 0.00 H new ATOM 0 HA ARG A 63 -5.464 10.696 1.101 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.621 10.290 -1.531 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -7.334 10.133 -1.194 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.628 12.404 0.279 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -5.624 12.548 -1.149 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.795 12.038 -2.510 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.660 12.349 -1.018 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.328 14.337 -2.725 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -8.426 13.614 0.570 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -8.550 15.315 1.031 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -7.490 16.537 -2.130 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -8.019 16.975 -0.502 1.00 0.00 H new ATOM 1001 N VAL A 64 -7.572 8.489 1.717 1.00 0.00 N ATOM 1002 CA VAL A 64 -8.767 8.111 2.453 1.00 0.00 C ATOM 1003 C VAL A 64 -10.004 8.575 1.681 1.00 0.00 C ATOM 1004 O VAL A 64 -10.372 9.747 1.739 1.00 0.00 O ATOM 1005 CB VAL A 64 -8.704 8.671 3.875 1.00 0.00 C ATOM 1006 CG1 VAL A 64 -10.060 8.547 4.573 1.00 0.00 C ATOM 1007 CG2 VAL A 64 -7.605 7.984 4.688 1.00 0.00 C ATOM 0 H VAL A 64 -6.918 7.726 1.546 1.00 0.00 H new ATOM 0 HA VAL A 64 -8.831 7.027 2.548 1.00 0.00 H new ATOM 0 HB VAL A 64 -8.457 9.730 3.807 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -9.988 8.952 5.582 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.811 9.103 4.011 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -10.349 7.497 4.623 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -7.582 8.401 5.695 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -7.808 6.914 4.743 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -6.641 8.146 4.206 1.00 0.00 H new ATOM 1017 N LEU A 65 -10.611 7.632 0.976 1.00 0.00 N ATOM 1018 CA LEU A 65 -11.798 7.930 0.194 1.00 0.00 C ATOM 1019 C LEU A 65 -12.916 8.396 1.129 1.00 0.00 C ATOM 1020 O LEU A 65 -12.865 8.150 2.334 1.00 0.00 O ATOM 1021 CB LEU A 65 -12.183 6.730 -0.674 1.00 0.00 C ATOM 1022 CG LEU A 65 -11.570 6.691 -2.075 1.00 0.00 C ATOM 1023 CD1 LEU A 65 -11.634 8.068 -2.740 1.00 0.00 C ATOM 1024 CD2 LEU A 65 -10.142 6.142 -2.034 1.00 0.00 C ATOM 0 H LEU A 65 -10.303 6.661 0.930 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.601 8.747 -0.500 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -11.896 5.819 -0.148 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -13.268 6.712 -0.773 1.00 0.00 H new ATOM 0 HG LEU A 65 -12.161 6.009 -2.687 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -11.192 8.013 -3.735 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -12.674 8.384 -2.822 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.082 8.789 -2.137 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -9.730 6.125 -3.043 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -9.525 6.779 -1.401 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.153 5.130 -1.629 1.00 0.00 H new ATOM 1036 N ARG A 66 -13.899 9.060 0.540 1.00 0.00 N ATOM 1037 CA ARG A 66 -15.027 9.562 1.305 1.00 0.00 C ATOM 1038 C ARG A 66 -16.314 8.850 0.884 1.00 0.00 C ATOM 1039 O ARG A 66 -16.859 9.124 -0.185 1.00 0.00 O ATOM 1040 CB ARG A 66 -15.199 11.070 1.108 1.00 0.00 C ATOM 1041 CG ARG A 66 -13.943 11.827 1.544 1.00 0.00 C ATOM 1042 CD ARG A 66 -13.344 11.211 2.810 1.00 0.00 C ATOM 1043 NE ARG A 66 -12.454 12.188 3.476 1.00 0.00 N ATOM 1044 CZ ARG A 66 -12.888 13.218 4.215 1.00 0.00 C ATOM 1045 NH1 ARG A 66 -14.203 13.412 4.387 1.00 0.00 N ATOM 1046 NH2 ARG A 66 -12.008 14.054 4.782 1.00 0.00 N ATOM 0 H ARG A 66 -13.938 9.262 -0.459 1.00 0.00 H new ATOM 0 HA ARG A 66 -14.827 9.365 2.358 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -15.410 11.282 0.060 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -16.057 11.420 1.683 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -13.205 11.808 0.742 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -14.189 12.873 1.726 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -14.141 10.910 3.490 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -12.784 10.311 2.557 1.00 0.00 H new ATOM 0 HE ARG A 66 -11.447 12.070 3.366 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -14.873 12.776 3.955 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -14.534 14.196 4.950 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -11.007 13.907 4.651 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -12.339 14.838 5.344 1.00 0.00 H new ATOM 1060 N LYS A 67 -16.763 7.949 1.745 1.00 0.00 N ATOM 1061 CA LYS A 67 -17.976 7.195 1.476 1.00 0.00 C ATOM 1062 C LYS A 67 -17.809 6.420 0.167 1.00 0.00 C ATOM 1063 O LYS A 67 -17.821 7.008 -0.913 1.00 0.00 O ATOM 1064 CB LYS A 67 -19.195 8.119 1.492 1.00 0.00 C ATOM 1065 CG LYS A 67 -19.267 8.910 2.800 1.00 0.00 C ATOM 1066 CD LYS A 67 -20.561 9.721 2.879 1.00 0.00 C ATOM 1067 CE LYS A 67 -20.875 10.113 4.325 1.00 0.00 C ATOM 1068 NZ LYS A 67 -22.324 10.360 4.492 1.00 0.00 N ATOM 0 H LYS A 67 -16.309 7.724 2.630 1.00 0.00 H new ATOM 0 HA LYS A 67 -18.151 6.461 2.262 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -19.145 8.808 0.649 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -20.104 7.530 1.369 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -19.210 8.226 3.647 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -18.409 9.579 2.872 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -20.470 10.618 2.267 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -21.386 9.138 2.469 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -20.555 9.320 5.001 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -20.314 11.008 4.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -22.520 10.625 5.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -22.620 11.132 3.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -22.853 9.497 4.254 1.00 0.00 H new ATOM 1082 N THR A 68 -17.657 5.111 0.307 1.00 0.00 N ATOM 1083 CA THR A 68 -17.488 4.249 -0.850 1.00 0.00 C ATOM 1084 C THR A 68 -16.985 2.870 -0.419 1.00 0.00 C ATOM 1085 O THR A 68 -15.862 2.738 0.066 1.00 0.00 O ATOM 1086 CB THR A 68 -16.553 4.956 -1.834 1.00 0.00 C ATOM 1087 OG1 THR A 68 -16.021 3.899 -2.628 1.00 0.00 O ATOM 1088 CG2 THR A 68 -15.327 5.559 -1.146 1.00 0.00 C ATOM 0 H THR A 68 -17.647 4.627 1.205 1.00 0.00 H new ATOM 0 HA THR A 68 -18.439 4.071 -1.353 1.00 0.00 H new ATOM 0 HB THR A 68 -17.101 5.742 -2.354 1.00 0.00 H new ATOM 0 HG1 THR A 68 -15.575 4.274 -3.416 1.00 0.00 H new ATOM 0 HG21 THR A 68 -14.697 6.048 -1.889 1.00 0.00 H new ATOM 0 HG22 THR A 68 -15.649 6.290 -0.405 1.00 0.00 H new ATOM 0 HG23 THR A 68 -14.760 4.769 -0.654 1.00 0.00 H new ATOM 1096 N LEU A 69 -17.841 1.877 -0.611 1.00 0.00 N ATOM 1097 CA LEU A 69 -17.498 0.512 -0.248 1.00 0.00 C ATOM 1098 C LEU A 69 -16.472 -0.033 -1.244 1.00 0.00 C ATOM 1099 O LEU A 69 -15.962 -1.139 -1.072 1.00 0.00 O ATOM 1100 CB LEU A 69 -18.760 -0.345 -0.134 1.00 0.00 C ATOM 1101 CG LEU A 69 -19.701 -0.003 1.023 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -18.917 0.507 2.234 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -20.778 0.988 0.578 1.00 0.00 C ATOM 0 H LEU A 69 -18.771 1.990 -1.013 1.00 0.00 H new ATOM 0 HA LEU A 69 -17.032 0.485 0.737 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -19.318 -0.261 -1.067 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -18.459 -1.388 -0.035 1.00 0.00 H new ATOM 0 HG LEU A 69 -20.211 -0.916 1.331 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -19.609 0.743 3.042 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -18.220 -0.262 2.566 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -18.363 1.404 1.957 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -21.434 1.215 1.419 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -20.306 1.906 0.229 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -21.363 0.550 -0.231 1.00 0.00 H new ATOM 1115 N ASP A 70 -16.199 0.769 -2.263 1.00 0.00 N ATOM 1116 CA ASP A 70 -15.243 0.381 -3.286 1.00 0.00 C ATOM 1117 C ASP A 70 -14.442 1.609 -3.722 1.00 0.00 C ATOM 1118 O ASP A 70 -14.602 2.093 -4.842 1.00 0.00 O ATOM 1119 CB ASP A 70 -15.953 -0.183 -4.518 1.00 0.00 C ATOM 1120 CG ASP A 70 -17.197 0.592 -4.958 1.00 0.00 C ATOM 1121 OD1 ASP A 70 -17.093 1.835 -5.039 1.00 0.00 O ATOM 1122 OD2 ASP A 70 -18.224 -0.077 -5.204 1.00 0.00 O ATOM 0 H ASP A 70 -16.623 1.686 -2.402 1.00 0.00 H new ATOM 0 HA ASP A 70 -14.590 -0.384 -2.865 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -15.246 -0.207 -5.347 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -16.239 -1.215 -4.313 1.00 0.00 H new ATOM 1127 N PRO A 71 -13.577 2.092 -2.791 1.00 0.00 N ATOM 1128 CA PRO A 71 -12.751 3.255 -3.068 1.00 0.00 C ATOM 1129 C PRO A 71 -11.596 2.897 -4.006 1.00 0.00 C ATOM 1130 O PRO A 71 -11.296 1.721 -4.206 1.00 0.00 O ATOM 1131 CB PRO A 71 -12.281 3.737 -1.705 1.00 0.00 C ATOM 1132 CG PRO A 71 -12.475 2.565 -0.758 1.00 0.00 C ATOM 1133 CD PRO A 71 -13.361 1.545 -1.454 1.00 0.00 C ATOM 0 HA PRO A 71 -13.295 4.043 -3.589 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -11.235 4.043 -1.738 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -12.856 4.603 -1.377 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -11.514 2.121 -0.498 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -12.935 2.898 0.172 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -12.880 0.568 -1.499 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -14.304 1.412 -0.924 1.00 0.00 H new ATOM 1141 N ALA A 72 -10.980 3.932 -4.556 1.00 0.00 N ATOM 1142 CA ALA A 72 -9.865 3.742 -5.469 1.00 0.00 C ATOM 1143 C ALA A 72 -8.788 4.788 -5.177 1.00 0.00 C ATOM 1144 O ALA A 72 -8.936 5.954 -5.541 1.00 0.00 O ATOM 1145 CB ALA A 72 -10.369 3.810 -6.912 1.00 0.00 C ATOM 0 H ALA A 72 -11.232 4.906 -4.387 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.416 2.759 -5.327 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -9.533 3.668 -7.597 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -11.110 3.027 -7.076 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -10.824 4.784 -7.093 1.00 0.00 H new ATOM 1151 N PHE A 73 -7.729 4.335 -4.523 1.00 0.00 N ATOM 1152 CA PHE A 73 -6.628 5.218 -4.178 1.00 0.00 C ATOM 1153 C PHE A 73 -5.640 5.341 -5.340 1.00 0.00 C ATOM 1154 O PHE A 73 -5.262 6.447 -5.724 1.00 0.00 O ATOM 1155 CB PHE A 73 -5.912 4.593 -2.979 1.00 0.00 C ATOM 1156 CG PHE A 73 -6.850 3.912 -1.980 1.00 0.00 C ATOM 1157 CD1 PHE A 73 -7.502 4.654 -1.045 1.00 0.00 C ATOM 1158 CD2 PHE A 73 -7.031 2.565 -2.027 1.00 0.00 C ATOM 1159 CE1 PHE A 73 -8.372 4.021 -0.118 1.00 0.00 C ATOM 1160 CE2 PHE A 73 -7.901 1.933 -1.100 1.00 0.00 C ATOM 1161 CZ PHE A 73 -8.553 2.674 -0.165 1.00 0.00 C ATOM 0 H PHE A 73 -7.610 3.368 -4.223 1.00 0.00 H new ATOM 0 HA PHE A 73 -7.007 6.215 -3.951 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -5.190 3.861 -3.341 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -5.347 5.368 -2.461 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -7.358 5.724 -1.008 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -6.513 1.976 -2.769 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -8.890 4.610 0.625 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -8.045 0.863 -1.138 1.00 0.00 H new ATOM 0 HZ PHE A 73 -9.215 2.193 0.540 1.00 0.00 H new ATOM 1171 N ASP A 74 -5.249 4.190 -5.867 1.00 0.00 N ATOM 1172 CA ASP A 74 -4.311 4.155 -6.977 1.00 0.00 C ATOM 1173 C ASP A 74 -3.184 5.157 -6.719 1.00 0.00 C ATOM 1174 O ASP A 74 -2.762 5.870 -7.628 1.00 0.00 O ATOM 1175 CB ASP A 74 -4.997 4.542 -8.289 1.00 0.00 C ATOM 1176 CG ASP A 74 -4.607 3.689 -9.498 1.00 0.00 C ATOM 1177 OD1 ASP A 74 -3.431 3.267 -9.539 1.00 0.00 O ATOM 1178 OD2 ASP A 74 -5.493 3.480 -10.354 1.00 0.00 O ATOM 0 H ASP A 74 -5.564 3.275 -5.546 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.922 3.140 -7.059 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -6.076 4.477 -8.150 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.766 5.584 -8.509 1.00 0.00 H new ATOM 1183 N GLU A 75 -2.729 5.179 -5.475 1.00 0.00 N ATOM 1184 CA GLU A 75 -1.659 6.081 -5.085 1.00 0.00 C ATOM 1185 C GLU A 75 -0.298 5.419 -5.308 1.00 0.00 C ATOM 1186 O GLU A 75 -0.225 4.227 -5.606 1.00 0.00 O ATOM 1187 CB GLU A 75 -1.820 6.528 -3.631 1.00 0.00 C ATOM 1188 CG GLU A 75 -2.162 8.017 -3.549 1.00 0.00 C ATOM 1189 CD GLU A 75 -0.912 8.878 -3.739 1.00 0.00 C ATOM 1190 OE1 GLU A 75 -0.386 8.874 -4.874 1.00 0.00 O ATOM 1191 OE2 GLU A 75 -0.509 9.522 -2.746 1.00 0.00 O ATOM 0 H GLU A 75 -3.082 4.586 -4.724 1.00 0.00 H new ATOM 0 HA GLU A 75 -1.715 6.971 -5.712 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -2.606 5.944 -3.152 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -0.899 6.332 -3.083 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -2.899 8.267 -4.312 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -2.616 8.237 -2.583 1.00 0.00 H new ATOM 1198 N THR A 76 0.747 6.219 -5.154 1.00 0.00 N ATOM 1199 CA THR A 76 2.101 5.725 -5.335 1.00 0.00 C ATOM 1200 C THR A 76 3.061 6.438 -4.380 1.00 0.00 C ATOM 1201 O THR A 76 3.024 7.661 -4.256 1.00 0.00 O ATOM 1202 CB THR A 76 2.474 5.894 -6.809 1.00 0.00 C ATOM 1203 OG1 THR A 76 1.771 4.843 -7.468 1.00 0.00 O ATOM 1204 CG2 THR A 76 3.947 5.584 -7.080 1.00 0.00 C ATOM 0 H THR A 76 0.683 7.206 -4.906 1.00 0.00 H new ATOM 0 HA THR A 76 2.171 4.666 -5.087 1.00 0.00 H new ATOM 0 HB THR A 76 2.254 6.914 -7.124 1.00 0.00 H new ATOM 0 HG1 THR A 76 1.154 5.225 -8.127 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.158 5.719 -8.141 1.00 0.00 H new ATOM 0 HG22 THR A 76 4.574 6.258 -6.496 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.160 4.553 -6.796 1.00 0.00 H new ATOM 1212 N PHE A 77 3.898 5.642 -3.730 1.00 0.00 N ATOM 1213 CA PHE A 77 4.865 6.182 -2.790 1.00 0.00 C ATOM 1214 C PHE A 77 6.284 5.729 -3.143 1.00 0.00 C ATOM 1215 O PHE A 77 6.560 4.532 -3.201 1.00 0.00 O ATOM 1216 CB PHE A 77 4.498 5.639 -1.408 1.00 0.00 C ATOM 1217 CG PHE A 77 3.032 5.851 -1.025 1.00 0.00 C ATOM 1218 CD1 PHE A 77 2.550 7.111 -0.852 1.00 0.00 C ATOM 1219 CD2 PHE A 77 2.210 4.780 -0.858 1.00 0.00 C ATOM 1220 CE1 PHE A 77 1.190 7.309 -0.496 1.00 0.00 C ATOM 1221 CE2 PHE A 77 0.850 4.978 -0.503 1.00 0.00 C ATOM 1222 CZ PHE A 77 0.368 6.238 -0.330 1.00 0.00 C ATOM 0 H PHE A 77 3.926 4.628 -3.836 1.00 0.00 H new ATOM 0 HA PHE A 77 4.842 7.271 -2.818 1.00 0.00 H new ATOM 0 HB2 PHE A 77 4.720 4.572 -1.377 1.00 0.00 H new ATOM 0 HB3 PHE A 77 5.131 6.118 -0.661 1.00 0.00 H new ATOM 0 HD1 PHE A 77 3.202 7.961 -0.986 1.00 0.00 H new ATOM 0 HD2 PHE A 77 2.592 3.779 -0.995 1.00 0.00 H new ATOM 0 HE1 PHE A 77 0.808 8.310 -0.357 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.198 4.128 -0.370 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.667 6.388 -0.061 1.00 0.00 H new ATOM 1232 N THR A 78 7.145 6.711 -3.368 1.00 0.00 N ATOM 1233 CA THR A 78 8.528 6.428 -3.713 1.00 0.00 C ATOM 1234 C THR A 78 9.418 6.530 -2.474 1.00 0.00 C ATOM 1235 O THR A 78 9.108 7.270 -1.541 1.00 0.00 O ATOM 1236 CB THR A 78 8.939 7.381 -4.837 1.00 0.00 C ATOM 1237 OG1 THR A 78 8.531 6.712 -6.027 1.00 0.00 O ATOM 1238 CG2 THR A 78 10.458 7.499 -4.978 1.00 0.00 C ATOM 0 H THR A 78 6.912 7.703 -3.318 1.00 0.00 H new ATOM 0 HA THR A 78 8.645 5.406 -4.075 1.00 0.00 H new ATOM 0 HB THR A 78 8.514 8.367 -4.650 1.00 0.00 H new ATOM 0 HG1 THR A 78 8.758 7.262 -6.806 1.00 0.00 H new ATOM 0 HG21 THR A 78 10.696 8.187 -5.789 1.00 0.00 H new ATOM 0 HG22 THR A 78 10.882 7.876 -4.047 1.00 0.00 H new ATOM 0 HG23 THR A 78 10.880 6.519 -5.198 1.00 0.00 H new ATOM 1246 N PHE A 79 10.507 5.776 -2.503 1.00 0.00 N ATOM 1247 CA PHE A 79 11.445 5.772 -1.393 1.00 0.00 C ATOM 1248 C PHE A 79 12.884 5.624 -1.892 1.00 0.00 C ATOM 1249 O PHE A 79 13.167 4.782 -2.743 1.00 0.00 O ATOM 1250 CB PHE A 79 11.095 4.568 -0.516 1.00 0.00 C ATOM 1251 CG PHE A 79 9.615 4.481 -0.140 1.00 0.00 C ATOM 1252 CD1 PHE A 79 9.090 5.352 0.763 1.00 0.00 C ATOM 1253 CD2 PHE A 79 8.823 3.533 -0.710 1.00 0.00 C ATOM 1254 CE1 PHE A 79 7.716 5.271 1.112 1.00 0.00 C ATOM 1255 CE2 PHE A 79 7.449 3.453 -0.361 1.00 0.00 C ATOM 1256 CZ PHE A 79 6.925 4.323 0.542 1.00 0.00 C ATOM 0 H PHE A 79 10.761 5.163 -3.278 1.00 0.00 H new ATOM 0 HA PHE A 79 11.375 6.710 -0.843 1.00 0.00 H new ATOM 0 HB2 PHE A 79 11.381 3.655 -1.039 1.00 0.00 H new ATOM 0 HB3 PHE A 79 11.689 4.611 0.397 1.00 0.00 H new ATOM 0 HD1 PHE A 79 9.718 6.105 1.215 1.00 0.00 H new ATOM 0 HD2 PHE A 79 9.239 2.842 -1.428 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.299 5.962 1.830 1.00 0.00 H new ATOM 0 HE2 PHE A 79 6.820 2.700 -0.813 1.00 0.00 H new ATOM 0 HZ PHE A 79 5.880 4.261 0.807 1.00 0.00 H new ATOM 1266 N TYR A 80 13.756 6.455 -1.341 1.00 0.00 N ATOM 1267 CA TYR A 80 15.159 6.428 -1.719 1.00 0.00 C ATOM 1268 C TYR A 80 16.036 5.997 -0.541 1.00 0.00 C ATOM 1269 O TYR A 80 15.648 6.154 0.616 1.00 0.00 O ATOM 1270 CB TYR A 80 15.519 7.862 -2.109 1.00 0.00 C ATOM 1271 CG TYR A 80 14.748 8.390 -3.321 1.00 0.00 C ATOM 1272 CD1 TYR A 80 15.020 7.896 -4.580 1.00 0.00 C ATOM 1273 CD2 TYR A 80 13.781 9.360 -3.154 1.00 0.00 C ATOM 1274 CE1 TYR A 80 14.295 8.392 -5.721 1.00 0.00 C ATOM 1275 CE2 TYR A 80 13.055 9.856 -4.295 1.00 0.00 C ATOM 1276 CZ TYR A 80 13.348 9.348 -5.522 1.00 0.00 C ATOM 1277 OH TYR A 80 12.663 9.817 -6.599 1.00 0.00 O ATOM 0 H TYR A 80 13.518 7.152 -0.635 1.00 0.00 H new ATOM 0 HA TYR A 80 15.324 5.720 -2.531 1.00 0.00 H new ATOM 0 HB2 TYR A 80 15.331 8.517 -1.258 1.00 0.00 H new ATOM 0 HB3 TYR A 80 16.587 7.913 -2.321 1.00 0.00 H new ATOM 0 HD1 TYR A 80 15.777 7.137 -4.710 1.00 0.00 H new ATOM 0 HD2 TYR A 80 13.569 9.747 -2.168 1.00 0.00 H new ATOM 0 HE1 TYR A 80 14.498 8.014 -6.712 1.00 0.00 H new ATOM 0 HE2 TYR A 80 12.295 10.614 -4.179 1.00 0.00 H new ATOM 0 HH TYR A 80 12.018 10.495 -6.307 1.00 0.00 H new ATOM 1287 N GLY A 81 17.200 5.462 -0.877 1.00 0.00 N ATOM 1288 CA GLY A 81 18.135 5.007 0.138 1.00 0.00 C ATOM 1289 C GLY A 81 18.151 3.480 0.224 1.00 0.00 C ATOM 1290 O GLY A 81 19.002 2.901 0.898 1.00 0.00 O ATOM 0 H GLY A 81 17.517 5.333 -1.838 1.00 0.00 H new ATOM 0 HA2 GLY A 81 19.135 5.372 -0.094 1.00 0.00 H new ATOM 0 HA3 GLY A 81 17.859 5.426 1.106 1.00 0.00 H new ATOM 1294 N ILE A 82 17.200 2.870 -0.468 1.00 0.00 N ATOM 1295 CA ILE A 82 17.094 1.421 -0.479 1.00 0.00 C ATOM 1296 C ILE A 82 18.109 0.847 -1.469 1.00 0.00 C ATOM 1297 O ILE A 82 18.047 1.133 -2.664 1.00 0.00 O ATOM 1298 CB ILE A 82 15.653 0.991 -0.757 1.00 0.00 C ATOM 1299 CG1 ILE A 82 14.699 1.554 0.299 1.00 0.00 C ATOM 1300 CG2 ILE A 82 15.547 -0.531 -0.873 1.00 0.00 C ATOM 1301 CD1 ILE A 82 13.455 2.161 -0.353 1.00 0.00 C ATOM 0 H ILE A 82 16.496 3.353 -1.025 1.00 0.00 H new ATOM 0 HA ILE A 82 17.340 1.014 0.502 1.00 0.00 H new ATOM 0 HB ILE A 82 15.352 1.408 -1.718 1.00 0.00 H new ATOM 0 HG12 ILE A 82 14.403 0.762 0.987 1.00 0.00 H new ATOM 0 HG13 ILE A 82 15.212 2.313 0.889 1.00 0.00 H new ATOM 0 HG21 ILE A 82 14.512 -0.810 -1.071 1.00 0.00 H new ATOM 0 HG22 ILE A 82 16.179 -0.878 -1.690 1.00 0.00 H new ATOM 0 HG23 ILE A 82 15.875 -0.991 0.059 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.794 2.554 0.420 1.00 0.00 H new ATOM 0 HD12 ILE A 82 13.752 2.969 -1.021 1.00 0.00 H new ATOM 0 HD13 ILE A 82 12.931 1.393 -0.923 1.00 0.00 H new ATOM 1313 N PRO A 83 19.045 0.025 -0.922 1.00 0.00 N ATOM 1314 CA PRO A 83 20.072 -0.592 -1.744 1.00 0.00 C ATOM 1315 C PRO A 83 19.495 -1.743 -2.571 1.00 0.00 C ATOM 1316 O PRO A 83 20.239 -2.576 -3.085 1.00 0.00 O ATOM 1317 CB PRO A 83 21.142 -1.043 -0.764 1.00 0.00 C ATOM 1318 CG PRO A 83 20.470 -1.082 0.599 1.00 0.00 C ATOM 1319 CD PRO A 83 19.149 -0.337 0.488 1.00 0.00 C ATOM 0 HA PRO A 83 20.489 0.094 -2.481 1.00 0.00 H new ATOM 0 HB2 PRO A 83 21.532 -2.024 -1.035 1.00 0.00 H new ATOM 0 HB3 PRO A 83 21.986 -0.354 -0.763 1.00 0.00 H new ATOM 0 HG2 PRO A 83 20.302 -2.112 0.913 1.00 0.00 H new ATOM 0 HG3 PRO A 83 21.107 -0.619 1.352 1.00 0.00 H new ATOM 0 HD2 PRO A 83 18.313 -0.964 0.798 1.00 0.00 H new ATOM 0 HD3 PRO A 83 19.138 0.547 1.126 1.00 0.00 H new ATOM 1327 N TYR A 84 18.174 -1.752 -2.672 1.00 0.00 N ATOM 1328 CA TYR A 84 17.488 -2.786 -3.427 1.00 0.00 C ATOM 1329 C TYR A 84 17.645 -4.151 -2.754 1.00 0.00 C ATOM 1330 O TYR A 84 16.655 -4.787 -2.394 1.00 0.00 O ATOM 1331 CB TYR A 84 18.165 -2.827 -4.798 1.00 0.00 C ATOM 1332 CG TYR A 84 17.450 -3.713 -5.820 1.00 0.00 C ATOM 1333 CD1 TYR A 84 16.086 -3.598 -5.998 1.00 0.00 C ATOM 1334 CD2 TYR A 84 18.168 -4.626 -6.564 1.00 0.00 C ATOM 1335 CE1 TYR A 84 15.412 -4.431 -6.960 1.00 0.00 C ATOM 1336 CE2 TYR A 84 17.494 -5.460 -7.526 1.00 0.00 C ATOM 1337 CZ TYR A 84 16.150 -5.321 -7.676 1.00 0.00 C ATOM 1338 OH TYR A 84 15.513 -6.108 -8.585 1.00 0.00 O ATOM 0 H TYR A 84 17.560 -1.059 -2.243 1.00 0.00 H new ATOM 0 HA TYR A 84 16.422 -2.569 -3.493 1.00 0.00 H new ATOM 0 HB2 TYR A 84 18.226 -1.813 -5.192 1.00 0.00 H new ATOM 0 HB3 TYR A 84 19.188 -3.184 -4.676 1.00 0.00 H new ATOM 0 HD1 TYR A 84 15.524 -2.883 -5.416 1.00 0.00 H new ATOM 0 HD2 TYR A 84 19.235 -4.716 -6.425 1.00 0.00 H new ATOM 0 HE1 TYR A 84 14.345 -4.351 -7.109 1.00 0.00 H new ATOM 0 HE2 TYR A 84 18.044 -6.179 -8.115 1.00 0.00 H new ATOM 0 HH TYR A 84 14.619 -5.748 -8.760 1.00 0.00 H new ATOM 1348 N THR A 85 18.896 -4.562 -2.604 1.00 0.00 N ATOM 1349 CA THR A 85 19.194 -5.839 -1.980 1.00 0.00 C ATOM 1350 C THR A 85 18.532 -5.929 -0.604 1.00 0.00 C ATOM 1351 O THR A 85 18.377 -7.019 -0.056 1.00 0.00 O ATOM 1352 CB THR A 85 20.715 -5.999 -1.934 1.00 0.00 C ATOM 1353 OG1 THR A 85 21.157 -4.889 -1.157 1.00 0.00 O ATOM 1354 CG2 THR A 85 21.369 -5.781 -3.300 1.00 0.00 C ATOM 0 H THR A 85 19.715 -4.033 -2.904 1.00 0.00 H new ATOM 0 HA THR A 85 18.782 -6.667 -2.558 1.00 0.00 H new ATOM 0 HB THR A 85 20.964 -6.995 -1.567 1.00 0.00 H new ATOM 0 HG1 THR A 85 22.133 -4.915 -1.075 1.00 0.00 H new ATOM 0 HG21 THR A 85 22.448 -5.906 -3.211 1.00 0.00 H new ATOM 0 HG22 THR A 85 20.977 -6.508 -4.011 1.00 0.00 H new ATOM 0 HG23 THR A 85 21.149 -4.773 -3.652 1.00 0.00 H new ATOM 1362 N GLN A 86 18.159 -4.768 -0.086 1.00 0.00 N ATOM 1363 CA GLN A 86 17.517 -4.702 1.216 1.00 0.00 C ATOM 1364 C GLN A 86 16.013 -4.945 1.079 1.00 0.00 C ATOM 1365 O GLN A 86 15.341 -5.269 2.057 1.00 0.00 O ATOM 1366 CB GLN A 86 17.796 -3.361 1.897 1.00 0.00 C ATOM 1367 CG GLN A 86 17.364 -3.391 3.365 1.00 0.00 C ATOM 1368 CD GLN A 86 18.068 -2.293 4.166 1.00 0.00 C ATOM 1369 OE1 GLN A 86 18.652 -1.370 3.623 1.00 0.00 O ATOM 1370 NE2 GLN A 86 17.980 -2.445 5.484 1.00 0.00 N ATOM 0 H GLN A 86 18.289 -3.866 -0.544 1.00 0.00 H new ATOM 0 HA GLN A 86 17.936 -5.486 1.846 1.00 0.00 H new ATOM 0 HB2 GLN A 86 18.859 -3.130 1.832 1.00 0.00 H new ATOM 0 HB3 GLN A 86 17.265 -2.566 1.374 1.00 0.00 H new ATOM 0 HG2 GLN A 86 16.284 -3.260 3.433 1.00 0.00 H new ATOM 0 HG3 GLN A 86 17.595 -4.365 3.796 1.00 0.00 H new ATOM 0 HE21 GLN A 86 17.475 -3.242 5.873 1.00 0.00 H new ATOM 0 HE22 GLN A 86 18.417 -1.765 6.106 1.00 0.00 H new ATOM 1379 N ILE A 87 15.528 -4.779 -0.143 1.00 0.00 N ATOM 1380 CA ILE A 87 14.115 -4.977 -0.421 1.00 0.00 C ATOM 1381 C ILE A 87 13.677 -6.335 0.130 1.00 0.00 C ATOM 1382 O ILE A 87 12.610 -6.450 0.733 1.00 0.00 O ATOM 1383 CB ILE A 87 13.833 -4.798 -1.914 1.00 0.00 C ATOM 1384 CG1 ILE A 87 14.282 -3.417 -2.396 1.00 0.00 C ATOM 1385 CG2 ILE A 87 12.359 -5.064 -2.229 1.00 0.00 C ATOM 1386 CD1 ILE A 87 13.290 -2.336 -1.961 1.00 0.00 C ATOM 0 H ILE A 87 16.088 -4.510 -0.952 1.00 0.00 H new ATOM 0 HA ILE A 87 13.517 -4.220 0.085 1.00 0.00 H new ATOM 0 HB ILE A 87 14.418 -5.536 -2.463 1.00 0.00 H new ATOM 0 HG12 ILE A 87 15.270 -3.191 -1.995 1.00 0.00 H new ATOM 0 HG13 ILE A 87 14.371 -3.418 -3.482 1.00 0.00 H new ATOM 0 HG21 ILE A 87 12.185 -4.930 -3.297 1.00 0.00 H new ATOM 0 HG22 ILE A 87 12.105 -6.085 -1.945 1.00 0.00 H new ATOM 0 HG23 ILE A 87 11.736 -4.366 -1.670 1.00 0.00 H new ATOM 0 HD11 ILE A 87 13.632 -1.364 -2.316 1.00 0.00 H new ATOM 0 HD12 ILE A 87 12.309 -2.552 -2.383 1.00 0.00 H new ATOM 0 HD13 ILE A 87 13.222 -2.321 -0.873 1.00 0.00 H new ATOM 1398 N GLN A 88 14.521 -7.331 -0.097 1.00 0.00 N ATOM 1399 CA GLN A 88 14.234 -8.676 0.369 1.00 0.00 C ATOM 1400 C GLN A 88 14.176 -8.708 1.898 1.00 0.00 C ATOM 1401 O GLN A 88 13.747 -9.700 2.486 1.00 0.00 O ATOM 1402 CB GLN A 88 15.268 -9.672 -0.161 1.00 0.00 C ATOM 1403 CG GLN A 88 15.426 -9.544 -1.677 1.00 0.00 C ATOM 1404 CD GLN A 88 16.884 -9.747 -2.095 1.00 0.00 C ATOM 1405 OE1 GLN A 88 17.556 -10.671 -1.668 1.00 0.00 O ATOM 1406 NE2 GLN A 88 17.333 -8.834 -2.951 1.00 0.00 N ATOM 0 H GLN A 88 15.404 -7.233 -0.598 1.00 0.00 H new ATOM 0 HA GLN A 88 13.259 -8.973 -0.018 1.00 0.00 H new ATOM 0 HB2 GLN A 88 16.228 -9.497 0.324 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.963 -10.687 0.092 1.00 0.00 H new ATOM 0 HG2 GLN A 88 14.795 -10.280 -2.175 1.00 0.00 H new ATOM 0 HG3 GLN A 88 15.085 -8.561 -2.000 1.00 0.00 H new ATOM 0 HE21 GLN A 88 16.717 -8.086 -3.269 1.00 0.00 H new ATOM 0 HE22 GLN A 88 18.294 -8.882 -3.290 1.00 0.00 H new ATOM 1415 N GLU A 89 14.612 -7.610 2.497 1.00 0.00 N ATOM 1416 CA GLU A 89 14.615 -7.499 3.946 1.00 0.00 C ATOM 1417 C GLU A 89 13.525 -6.529 4.406 1.00 0.00 C ATOM 1418 O GLU A 89 13.472 -6.161 5.579 1.00 0.00 O ATOM 1419 CB GLU A 89 15.989 -7.065 4.460 1.00 0.00 C ATOM 1420 CG GLU A 89 16.940 -8.259 4.559 1.00 0.00 C ATOM 1421 CD GLU A 89 17.142 -8.680 6.017 1.00 0.00 C ATOM 1422 OE1 GLU A 89 17.200 -7.767 6.868 1.00 0.00 O ATOM 1423 OE2 GLU A 89 17.233 -9.905 6.246 1.00 0.00 O ATOM 0 H GLU A 89 14.966 -6.789 2.006 1.00 0.00 H new ATOM 0 HA GLU A 89 14.401 -8.481 4.367 1.00 0.00 H new ATOM 0 HB2 GLU A 89 16.411 -6.314 3.792 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.884 -6.597 5.439 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.539 -9.096 3.987 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.901 -8.001 4.115 1.00 0.00 H new ATOM 1430 N LEU A 90 12.683 -6.142 3.459 1.00 0.00 N ATOM 1431 CA LEU A 90 11.598 -5.222 3.753 1.00 0.00 C ATOM 1432 C LEU A 90 10.265 -5.967 3.664 1.00 0.00 C ATOM 1433 O LEU A 90 10.241 -7.186 3.496 1.00 0.00 O ATOM 1434 CB LEU A 90 11.677 -3.993 2.844 1.00 0.00 C ATOM 1435 CG LEU A 90 12.976 -3.189 2.916 1.00 0.00 C ATOM 1436 CD1 LEU A 90 12.914 -1.964 2.000 1.00 0.00 C ATOM 1437 CD2 LEU A 90 13.307 -2.808 4.360 1.00 0.00 C ATOM 0 H LEU A 90 12.730 -6.449 2.487 1.00 0.00 H new ATOM 0 HA LEU A 90 11.685 -4.844 4.771 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.530 -4.317 1.814 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.848 -3.329 3.090 1.00 0.00 H new ATOM 0 HG LEU A 90 13.788 -3.820 2.556 1.00 0.00 H new ATOM 0 HD11 LEU A 90 13.850 -1.410 2.070 1.00 0.00 H new ATOM 0 HD12 LEU A 90 12.760 -2.287 0.970 1.00 0.00 H new ATOM 0 HD13 LEU A 90 12.088 -1.322 2.307 1.00 0.00 H new ATOM 0 HD21 LEU A 90 14.235 -2.237 4.382 1.00 0.00 H new ATOM 0 HD22 LEU A 90 12.499 -2.203 4.771 1.00 0.00 H new ATOM 0 HD23 LEU A 90 13.423 -3.712 4.957 1.00 0.00 H new ATOM 1449 N ALA A 91 9.188 -5.205 3.782 1.00 0.00 N ATOM 1450 CA ALA A 91 7.854 -5.778 3.718 1.00 0.00 C ATOM 1451 C ALA A 91 6.817 -4.666 3.888 1.00 0.00 C ATOM 1452 O ALA A 91 7.075 -3.669 4.560 1.00 0.00 O ATOM 1453 CB ALA A 91 7.716 -6.871 4.779 1.00 0.00 C ATOM 0 H ALA A 91 9.212 -4.195 3.922 1.00 0.00 H new ATOM 0 HA ALA A 91 7.683 -6.243 2.747 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.715 -7.301 4.731 1.00 0.00 H new ATOM 0 HB2 ALA A 91 8.455 -7.651 4.596 1.00 0.00 H new ATOM 0 HB3 ALA A 91 7.879 -6.441 5.767 1.00 0.00 H new ATOM 1459 N LEU A 92 5.666 -4.874 3.266 1.00 0.00 N ATOM 1460 CA LEU A 92 4.588 -3.902 3.340 1.00 0.00 C ATOM 1461 C LEU A 92 3.410 -4.510 4.103 1.00 0.00 C ATOM 1462 O LEU A 92 3.107 -5.691 3.946 1.00 0.00 O ATOM 1463 CB LEU A 92 4.223 -3.400 1.942 1.00 0.00 C ATOM 1464 CG LEU A 92 5.393 -2.961 1.059 1.00 0.00 C ATOM 1465 CD1 LEU A 92 4.982 -2.918 -0.414 1.00 0.00 C ATOM 1466 CD2 LEU A 92 5.967 -1.625 1.534 1.00 0.00 C ATOM 0 H LEU A 92 5.456 -5.702 2.708 1.00 0.00 H new ATOM 0 HA LEU A 92 4.907 -3.021 3.896 1.00 0.00 H new ATOM 0 HB2 LEU A 92 3.680 -4.191 1.424 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.538 -2.559 2.047 1.00 0.00 H new ATOM 0 HG LEU A 92 6.187 -3.702 1.150 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.832 -2.603 -1.020 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.658 -3.910 -0.731 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.163 -2.211 -0.543 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.797 -1.336 0.889 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.191 -0.860 1.492 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.322 -1.726 2.560 1.00 0.00 H new ATOM 1478 N HIS A 93 2.777 -3.674 4.914 1.00 0.00 N ATOM 1479 CA HIS A 93 1.638 -4.115 5.702 1.00 0.00 C ATOM 1480 C HIS A 93 0.397 -3.315 5.301 1.00 0.00 C ATOM 1481 O HIS A 93 0.271 -2.142 5.650 1.00 0.00 O ATOM 1482 CB HIS A 93 1.945 -4.023 7.198 1.00 0.00 C ATOM 1483 CG HIS A 93 0.875 -4.619 8.082 1.00 0.00 C ATOM 1484 ND1 HIS A 93 0.132 -3.864 8.972 1.00 0.00 N ATOM 1485 CD2 HIS A 93 0.431 -5.903 8.201 1.00 0.00 C ATOM 1486 CE1 HIS A 93 -0.717 -4.668 9.595 1.00 0.00 C ATOM 1487 NE2 HIS A 93 -0.530 -5.931 9.116 1.00 0.00 N ATOM 0 H HIS A 93 3.031 -2.695 5.042 1.00 0.00 H new ATOM 0 HA HIS A 93 1.433 -5.166 5.496 1.00 0.00 H new ATOM 0 HB2 HIS A 93 2.890 -4.529 7.396 1.00 0.00 H new ATOM 0 HB3 HIS A 93 2.082 -2.976 7.467 1.00 0.00 H new ATOM 0 HD2 HIS A 93 0.799 -6.753 7.645 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -1.432 -4.375 10.350 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -1.044 -6.761 9.412 1.00 0.00 H new ATOM 1495 N PHE A 94 -0.488 -3.981 4.575 1.00 0.00 N ATOM 1496 CA PHE A 94 -1.715 -3.348 4.123 1.00 0.00 C ATOM 1497 C PHE A 94 -2.868 -3.637 5.086 1.00 0.00 C ATOM 1498 O PHE A 94 -3.459 -4.715 5.046 1.00 0.00 O ATOM 1499 CB PHE A 94 -2.048 -3.943 2.753 1.00 0.00 C ATOM 1500 CG PHE A 94 -1.015 -3.628 1.670 1.00 0.00 C ATOM 1501 CD1 PHE A 94 -0.532 -2.363 1.538 1.00 0.00 C ATOM 1502 CD2 PHE A 94 -0.580 -4.612 0.838 1.00 0.00 C ATOM 1503 CE1 PHE A 94 0.427 -2.071 0.532 1.00 0.00 C ATOM 1504 CE2 PHE A 94 0.379 -4.319 -0.168 1.00 0.00 C ATOM 1505 CZ PHE A 94 0.862 -3.055 -0.299 1.00 0.00 C ATOM 0 H PHE A 94 -0.380 -4.954 4.288 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.580 -2.267 4.075 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -2.139 -5.025 2.851 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -3.021 -3.569 2.433 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -0.878 -1.581 2.198 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.964 -5.616 0.942 1.00 0.00 H new ATOM 0 HE1 PHE A 94 0.811 -1.067 0.427 1.00 0.00 H new ATOM 0 HE2 PHE A 94 0.724 -5.100 -0.829 1.00 0.00 H new ATOM 0 HZ PHE A 94 1.592 -2.832 -1.064 1.00 0.00 H new ATOM 1515 N THR A 95 -3.154 -2.655 5.928 1.00 0.00 N ATOM 1516 CA THR A 95 -4.226 -2.791 6.900 1.00 0.00 C ATOM 1517 C THR A 95 -5.485 -2.075 6.408 1.00 0.00 C ATOM 1518 O THR A 95 -5.541 -0.846 6.397 1.00 0.00 O ATOM 1519 CB THR A 95 -3.715 -2.267 8.243 1.00 0.00 C ATOM 1520 OG1 THR A 95 -2.602 -3.106 8.542 1.00 0.00 O ATOM 1521 CG2 THR A 95 -4.698 -2.531 9.386 1.00 0.00 C ATOM 0 H THR A 95 -2.662 -1.762 5.957 1.00 0.00 H new ATOM 0 HA THR A 95 -4.513 -3.835 7.030 1.00 0.00 H new ATOM 0 HB THR A 95 -3.525 -1.196 8.167 1.00 0.00 H new ATOM 0 HG1 THR A 95 -1.770 -2.603 8.417 1.00 0.00 H new ATOM 0 HG21 THR A 95 -4.287 -2.140 10.317 1.00 0.00 H new ATOM 0 HG22 THR A 95 -5.646 -2.038 9.172 1.00 0.00 H new ATOM 0 HG23 THR A 95 -4.862 -3.604 9.485 1.00 0.00 H new ATOM 1529 N ILE A 96 -6.465 -2.874 6.012 1.00 0.00 N ATOM 1530 CA ILE A 96 -7.720 -2.332 5.520 1.00 0.00 C ATOM 1531 C ILE A 96 -8.616 -1.973 6.707 1.00 0.00 C ATOM 1532 O ILE A 96 -9.471 -2.762 7.105 1.00 0.00 O ATOM 1533 CB ILE A 96 -8.370 -3.300 4.529 1.00 0.00 C ATOM 1534 CG1 ILE A 96 -7.415 -3.633 3.381 1.00 0.00 C ATOM 1535 CG2 ILE A 96 -9.706 -2.751 4.023 1.00 0.00 C ATOM 1536 CD1 ILE A 96 -6.360 -4.649 3.824 1.00 0.00 C ATOM 0 H ILE A 96 -6.415 -3.893 6.022 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.545 -1.412 4.963 1.00 0.00 H new ATOM 0 HB ILE A 96 -8.582 -4.233 5.051 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.979 -4.033 2.538 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -6.926 -2.723 3.034 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.147 -3.458 3.320 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -10.383 -2.607 4.865 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -9.541 -1.797 3.522 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.694 -4.869 2.990 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.782 -4.236 4.651 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -6.852 -5.567 4.147 1.00 0.00 H new ATOM 1548 N LEU A 97 -8.389 -0.780 7.239 1.00 0.00 N ATOM 1549 CA LEU A 97 -9.165 -0.307 8.373 1.00 0.00 C ATOM 1550 C LEU A 97 -9.947 0.943 7.964 1.00 0.00 C ATOM 1551 O LEU A 97 -9.737 1.484 6.879 1.00 0.00 O ATOM 1552 CB LEU A 97 -8.262 -0.098 9.590 1.00 0.00 C ATOM 1553 CG LEU A 97 -7.619 1.285 9.718 1.00 0.00 C ATOM 1554 CD1 LEU A 97 -6.957 1.457 11.086 1.00 0.00 C ATOM 1555 CD2 LEU A 97 -6.640 1.542 8.571 1.00 0.00 C ATOM 0 H LEU A 97 -7.679 -0.128 6.906 1.00 0.00 H new ATOM 0 HA LEU A 97 -9.897 -1.057 8.674 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -8.847 -0.289 10.489 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -7.468 -0.845 9.561 1.00 0.00 H new ATOM 0 HG LEU A 97 -8.406 2.036 9.644 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -6.508 2.448 11.151 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -7.707 1.346 11.869 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -6.184 0.699 11.214 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -6.197 2.531 8.686 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -5.853 0.788 8.588 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -7.171 1.490 7.621 1.00 0.00 H new ATOM 1567 N SER A 98 -10.831 1.367 8.855 1.00 0.00 N ATOM 1568 CA SER A 98 -11.645 2.543 8.600 1.00 0.00 C ATOM 1569 C SER A 98 -11.294 3.648 9.599 1.00 0.00 C ATOM 1570 O SER A 98 -11.046 3.373 10.772 1.00 0.00 O ATOM 1571 CB SER A 98 -13.136 2.210 8.680 1.00 0.00 C ATOM 1572 OG SER A 98 -13.923 3.355 8.994 1.00 0.00 O ATOM 0 H SER A 98 -11.001 0.917 9.754 1.00 0.00 H new ATOM 0 HA SER A 98 -11.433 2.893 7.590 1.00 0.00 H new ATOM 0 HB2 SER A 98 -13.466 1.793 7.728 1.00 0.00 H new ATOM 0 HB3 SER A 98 -13.296 1.442 9.437 1.00 0.00 H new ATOM 0 HG SER A 98 -14.869 3.101 9.035 1.00 0.00 H new ATOM 1578 N PHE A 99 -11.286 4.874 9.098 1.00 0.00 N ATOM 1579 CA PHE A 99 -10.970 6.022 9.932 1.00 0.00 C ATOM 1580 C PHE A 99 -12.221 6.856 10.213 1.00 0.00 C ATOM 1581 O PHE A 99 -12.949 7.219 9.291 1.00 0.00 O ATOM 1582 CB PHE A 99 -9.965 6.876 9.156 1.00 0.00 C ATOM 1583 CG PHE A 99 -9.230 7.907 10.015 1.00 0.00 C ATOM 1584 CD1 PHE A 99 -8.819 7.578 11.269 1.00 0.00 C ATOM 1585 CD2 PHE A 99 -8.989 9.152 9.525 1.00 0.00 C ATOM 1586 CE1 PHE A 99 -8.136 8.534 12.066 1.00 0.00 C ATOM 1587 CE2 PHE A 99 -8.307 10.109 10.322 1.00 0.00 C ATOM 1588 CZ PHE A 99 -7.895 9.780 11.576 1.00 0.00 C ATOM 0 H PHE A 99 -11.493 5.098 8.125 1.00 0.00 H new ATOM 0 HA PHE A 99 -10.567 5.688 10.888 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -9.232 6.220 8.687 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -10.488 7.394 8.353 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -9.012 6.589 11.659 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -9.316 9.413 8.529 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -7.808 8.272 13.061 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -8.115 11.098 9.933 1.00 0.00 H new ATOM 0 HZ PHE A 99 -7.377 10.508 12.183 1.00 0.00 H new ATOM 1598 N ASP A 100 -12.432 7.136 11.491 1.00 0.00 N ATOM 1599 CA ASP A 100 -13.582 7.921 11.905 1.00 0.00 C ATOM 1600 C ASP A 100 -13.186 8.817 13.080 1.00 0.00 C ATOM 1601 O ASP A 100 -13.802 8.761 14.144 1.00 0.00 O ATOM 1602 CB ASP A 100 -14.728 7.018 12.365 1.00 0.00 C ATOM 1603 CG ASP A 100 -14.834 5.681 11.628 1.00 0.00 C ATOM 1604 OD1 ASP A 100 -15.226 5.717 10.442 1.00 0.00 O ATOM 1605 OD2 ASP A 100 -14.521 4.654 12.268 1.00 0.00 O ATOM 0 H ASP A 100 -11.826 6.833 12.253 1.00 0.00 H new ATOM 0 HA ASP A 100 -13.910 8.514 11.052 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -14.609 6.820 13.430 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -15.667 7.558 12.244 1.00 0.00 H new ATOM 1610 N ARG A 101 -12.161 9.624 12.849 1.00 0.00 N ATOM 1611 CA ARG A 101 -11.675 10.531 13.875 1.00 0.00 C ATOM 1612 C ARG A 101 -11.644 9.827 15.233 1.00 0.00 C ATOM 1613 O ARG A 101 -11.721 8.602 15.304 1.00 0.00 O ATOM 1614 CB ARG A 101 -12.560 11.775 13.973 1.00 0.00 C ATOM 1615 CG ARG A 101 -13.938 11.425 14.538 1.00 0.00 C ATOM 1616 CD ARG A 101 -14.702 12.688 14.943 1.00 0.00 C ATOM 1617 NE ARG A 101 -16.051 12.680 14.335 1.00 0.00 N ATOM 1618 CZ ARG A 101 -16.309 13.049 13.073 1.00 0.00 C ATOM 1619 NH1 ARG A 101 -15.311 13.457 12.277 1.00 0.00 N ATOM 1620 NH2 ARG A 101 -17.565 13.009 12.607 1.00 0.00 N ATOM 0 H ARG A 101 -11.653 9.669 11.966 1.00 0.00 H new ATOM 0 HA ARG A 101 -10.666 10.837 13.598 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -12.080 12.518 14.610 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -12.671 12.225 12.987 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -14.511 10.872 13.793 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -13.825 10.771 15.403 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -14.784 12.741 16.029 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -14.154 13.573 14.621 1.00 0.00 H new ATOM 0 HE ARG A 101 -16.834 12.374 14.913 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -14.355 13.487 12.632 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -15.507 13.738 11.316 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -18.324 12.698 13.213 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -17.762 13.290 11.646 1.00 0.00 H new ATOM 1634 N PHE A 102 -11.529 10.633 16.279 1.00 0.00 N ATOM 1635 CA PHE A 102 -11.486 10.103 17.631 1.00 0.00 C ATOM 1636 C PHE A 102 -10.392 9.043 17.770 1.00 0.00 C ATOM 1637 O PHE A 102 -10.424 8.231 18.693 1.00 0.00 O ATOM 1638 CB PHE A 102 -12.846 9.455 17.901 1.00 0.00 C ATOM 1639 CG PHE A 102 -13.815 10.344 18.682 1.00 0.00 C ATOM 1640 CD1 PHE A 102 -13.488 10.776 19.929 1.00 0.00 C ATOM 1641 CD2 PHE A 102 -15.005 10.703 18.129 1.00 0.00 C ATOM 1642 CE1 PHE A 102 -14.388 11.601 20.654 1.00 0.00 C ATOM 1643 CE2 PHE A 102 -15.905 11.528 18.854 1.00 0.00 C ATOM 1644 CZ PHE A 102 -15.577 11.960 20.101 1.00 0.00 C ATOM 0 H PHE A 102 -11.464 11.649 16.217 1.00 0.00 H new ATOM 0 HA PHE A 102 -11.270 10.904 18.338 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -13.304 9.185 16.949 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -12.692 8.529 18.455 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -12.543 10.492 20.368 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -15.265 10.360 17.138 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -14.128 11.943 21.645 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -16.850 11.812 18.415 1.00 0.00 H new ATOM 0 HZ PHE A 102 -16.261 12.588 20.652 1.00 0.00 H new ATOM 1654 N SER A 103 -9.450 9.085 16.839 1.00 0.00 N ATOM 1655 CA SER A 103 -8.348 8.138 16.846 1.00 0.00 C ATOM 1656 C SER A 103 -8.852 6.746 16.464 1.00 0.00 C ATOM 1657 O SER A 103 -8.395 6.164 15.481 1.00 0.00 O ATOM 1658 CB SER A 103 -7.665 8.098 18.215 1.00 0.00 C ATOM 1659 OG SER A 103 -7.353 9.403 18.694 1.00 0.00 O ATOM 0 H SER A 103 -9.427 9.760 16.075 1.00 0.00 H new ATOM 0 HA SER A 103 -7.612 8.465 16.112 1.00 0.00 H new ATOM 0 HB2 SER A 103 -8.316 7.595 18.930 1.00 0.00 H new ATOM 0 HB3 SER A 103 -6.751 7.509 18.147 1.00 0.00 H new ATOM 0 HG SER A 103 -6.920 9.335 19.571 1.00 0.00 H new ATOM 1665 N ARG A 104 -9.789 6.251 17.260 1.00 0.00 N ATOM 1666 CA ARG A 104 -10.361 4.937 17.017 1.00 0.00 C ATOM 1667 C ARG A 104 -10.543 4.708 15.515 1.00 0.00 C ATOM 1668 O ARG A 104 -10.884 5.632 14.779 1.00 0.00 O ATOM 1669 CB ARG A 104 -11.713 4.787 17.717 1.00 0.00 C ATOM 1670 CG ARG A 104 -12.749 5.741 17.119 1.00 0.00 C ATOM 1671 CD ARG A 104 -14.152 5.424 17.641 1.00 0.00 C ATOM 1672 NE ARG A 104 -14.968 4.818 16.565 1.00 0.00 N ATOM 1673 CZ ARG A 104 -16.166 4.251 16.760 1.00 0.00 C ATOM 1674 NH1 ARG A 104 -16.695 4.208 17.991 1.00 0.00 N ATOM 1675 NH2 ARG A 104 -16.835 3.727 15.725 1.00 0.00 N ATOM 0 H ARG A 104 -10.166 6.736 18.074 1.00 0.00 H new ATOM 0 HA ARG A 104 -9.672 4.195 17.420 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -12.063 3.759 17.623 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -11.599 4.989 18.782 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -12.488 6.770 17.368 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -12.735 5.663 16.032 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -14.088 4.741 18.488 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -14.629 6.335 18.001 1.00 0.00 H new ATOM 0 HE ARG A 104 -14.595 4.833 15.616 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -16.185 4.607 18.779 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -17.607 3.776 18.139 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -16.432 3.760 14.788 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -17.747 3.295 15.873 1.00 0.00 H new ATOM 1689 N ASP A 105 -10.308 3.470 15.105 1.00 0.00 N ATOM 1690 CA ASP A 105 -10.442 3.107 13.705 1.00 0.00 C ATOM 1691 C ASP A 105 -10.880 1.644 13.601 1.00 0.00 C ATOM 1692 O ASP A 105 -10.135 0.741 13.979 1.00 0.00 O ATOM 1693 CB ASP A 105 -9.110 3.255 12.967 1.00 0.00 C ATOM 1694 CG ASP A 105 -7.866 3.018 13.826 1.00 0.00 C ATOM 1695 OD1 ASP A 105 -7.913 2.075 14.646 1.00 0.00 O ATOM 1696 OD2 ASP A 105 -6.895 3.784 13.642 1.00 0.00 O ATOM 0 H ASP A 105 -10.026 2.706 15.718 1.00 0.00 H new ATOM 0 HA ASP A 105 -11.180 3.771 13.254 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -9.095 2.555 12.131 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -9.056 4.258 12.544 1.00 0.00 H new ATOM 1701 N ASP A 106 -12.087 1.456 13.087 1.00 0.00 N ATOM 1702 CA ASP A 106 -12.632 0.119 12.929 1.00 0.00 C ATOM 1703 C ASP A 106 -11.874 -0.608 11.817 1.00 0.00 C ATOM 1704 O ASP A 106 -12.035 -0.290 10.639 1.00 0.00 O ATOM 1705 CB ASP A 106 -14.111 0.170 12.537 1.00 0.00 C ATOM 1706 CG ASP A 106 -15.085 -0.266 13.633 1.00 0.00 C ATOM 1707 OD1 ASP A 106 -15.030 0.349 14.720 1.00 0.00 O ATOM 1708 OD2 ASP A 106 -15.863 -1.206 13.359 1.00 0.00 O ATOM 0 H ASP A 106 -12.702 2.207 12.775 1.00 0.00 H new ATOM 0 HA ASP A 106 -12.528 -0.402 13.881 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -14.357 1.189 12.237 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -14.262 -0.465 11.664 1.00 0.00 H new ATOM 1713 N ILE A 107 -11.064 -1.572 12.229 1.00 0.00 N ATOM 1714 CA ILE A 107 -10.280 -2.347 11.283 1.00 0.00 C ATOM 1715 C ILE A 107 -11.143 -3.478 10.718 1.00 0.00 C ATOM 1716 O ILE A 107 -11.896 -4.115 11.453 1.00 0.00 O ATOM 1717 CB ILE A 107 -8.981 -2.830 11.931 1.00 0.00 C ATOM 1718 CG1 ILE A 107 -8.085 -1.649 12.310 1.00 0.00 C ATOM 1719 CG2 ILE A 107 -8.257 -3.832 11.029 1.00 0.00 C ATOM 1720 CD1 ILE A 107 -7.164 -2.011 13.476 1.00 0.00 C ATOM 0 H ILE A 107 -10.934 -1.834 13.206 1.00 0.00 H new ATOM 0 HA ILE A 107 -9.976 -1.725 10.441 1.00 0.00 H new ATOM 0 HB ILE A 107 -9.234 -3.352 12.854 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -7.487 -1.351 11.449 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -8.702 -0.793 12.582 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -7.337 -4.159 11.514 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.901 -4.694 10.853 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -8.017 -3.358 10.077 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -6.538 -1.154 13.725 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -7.765 -2.285 14.343 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -6.531 -2.852 13.192 1.00 0.00 H new ATOM 1732 N ILE A 108 -11.004 -3.693 9.418 1.00 0.00 N ATOM 1733 CA ILE A 108 -11.761 -4.735 8.747 1.00 0.00 C ATOM 1734 C ILE A 108 -10.889 -5.985 8.610 1.00 0.00 C ATOM 1735 O ILE A 108 -11.333 -7.092 8.913 1.00 0.00 O ATOM 1736 CB ILE A 108 -12.314 -4.223 7.415 1.00 0.00 C ATOM 1737 CG1 ILE A 108 -13.451 -3.224 7.642 1.00 0.00 C ATOM 1738 CG2 ILE A 108 -12.742 -5.384 6.516 1.00 0.00 C ATOM 1739 CD1 ILE A 108 -13.332 -2.033 6.688 1.00 0.00 C ATOM 0 H ILE A 108 -10.378 -3.163 8.812 1.00 0.00 H new ATOM 0 HA ILE A 108 -12.631 -5.015 9.341 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.517 -3.691 6.896 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -14.410 -3.719 7.493 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -13.430 -2.872 8.673 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -13.131 -4.992 5.576 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -11.883 -6.024 6.314 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -13.517 -5.964 7.016 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -14.152 -1.338 6.870 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -12.382 -1.526 6.856 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -13.377 -2.386 5.658 1.00 0.00 H new ATOM 1751 N GLY A 109 -9.665 -5.767 8.155 1.00 0.00 N ATOM 1752 CA GLY A 109 -8.727 -6.862 7.975 1.00 0.00 C ATOM 1753 C GLY A 109 -7.295 -6.341 7.836 1.00 0.00 C ATOM 1754 O GLY A 109 -7.069 -5.131 7.823 1.00 0.00 O ATOM 0 H GLY A 109 -9.300 -4.848 7.905 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -8.789 -7.542 8.824 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -8.997 -7.435 7.088 1.00 0.00 H new ATOM 1758 N GLU A 110 -6.365 -7.279 7.735 1.00 0.00 N ATOM 1759 CA GLU A 110 -4.961 -6.929 7.598 1.00 0.00 C ATOM 1760 C GLU A 110 -4.324 -7.727 6.458 1.00 0.00 C ATOM 1761 O GLU A 110 -4.696 -8.874 6.216 1.00 0.00 O ATOM 1762 CB GLU A 110 -4.209 -7.153 8.911 1.00 0.00 C ATOM 1763 CG GLU A 110 -4.721 -6.213 10.004 1.00 0.00 C ATOM 1764 CD GLU A 110 -5.731 -6.922 10.908 1.00 0.00 C ATOM 1765 OE1 GLU A 110 -6.900 -7.032 10.478 1.00 0.00 O ATOM 1766 OE2 GLU A 110 -5.312 -7.338 12.010 1.00 0.00 O ATOM 0 H GLU A 110 -6.556 -8.281 7.745 1.00 0.00 H new ATOM 0 HA GLU A 110 -4.893 -5.868 7.356 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.329 -8.188 9.231 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.143 -6.989 8.756 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -3.883 -5.853 10.601 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -5.186 -5.339 9.548 1.00 0.00 H new ATOM 1773 N VAL A 111 -3.377 -7.088 5.789 1.00 0.00 N ATOM 1774 CA VAL A 111 -2.685 -7.724 4.680 1.00 0.00 C ATOM 1775 C VAL A 111 -1.189 -7.418 4.776 1.00 0.00 C ATOM 1776 O VAL A 111 -0.795 -6.394 5.331 1.00 0.00 O ATOM 1777 CB VAL A 111 -3.302 -7.279 3.353 1.00 0.00 C ATOM 1778 CG1 VAL A 111 -2.289 -7.389 2.212 1.00 0.00 C ATOM 1779 CG2 VAL A 111 -4.568 -8.079 3.042 1.00 0.00 C ATOM 0 H VAL A 111 -3.072 -6.136 5.993 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.800 -8.807 4.729 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.584 -6.230 3.450 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.754 -7.066 1.280 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.429 -6.755 2.427 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.962 -8.424 2.115 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -4.987 -7.743 2.093 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -4.321 -9.139 2.975 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.299 -7.926 3.836 1.00 0.00 H new ATOM 1789 N LEU A 112 -0.395 -8.326 4.225 1.00 0.00 N ATOM 1790 CA LEU A 112 1.049 -8.166 4.242 1.00 0.00 C ATOM 1791 C LEU A 112 1.636 -8.746 2.954 1.00 0.00 C ATOM 1792 O LEU A 112 1.153 -9.758 2.448 1.00 0.00 O ATOM 1793 CB LEU A 112 1.641 -8.773 5.515 1.00 0.00 C ATOM 1794 CG LEU A 112 3.166 -8.746 5.625 1.00 0.00 C ATOM 1795 CD1 LEU A 112 3.648 -7.436 6.251 1.00 0.00 C ATOM 1796 CD2 LEU A 112 3.683 -9.969 6.385 1.00 0.00 C ATOM 0 H LEU A 112 -0.725 -9.174 3.764 1.00 0.00 H new ATOM 0 HA LEU A 112 1.315 -7.109 4.268 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.225 -8.244 6.373 1.00 0.00 H new ATOM 0 HB3 LEU A 112 1.310 -9.809 5.588 1.00 0.00 H new ATOM 0 HG LEU A 112 3.581 -8.793 4.618 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.736 -7.443 6.317 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.328 -6.598 5.632 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.224 -7.332 7.250 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.770 -9.925 6.449 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.261 -9.978 7.390 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.387 -10.876 5.859 1.00 0.00 H new ATOM 1808 N ILE A 113 2.670 -8.081 2.460 1.00 0.00 N ATOM 1809 CA ILE A 113 3.328 -8.518 1.241 1.00 0.00 C ATOM 1810 C ILE A 113 4.842 -8.356 1.397 1.00 0.00 C ATOM 1811 O ILE A 113 5.375 -7.263 1.210 1.00 0.00 O ATOM 1812 CB ILE A 113 2.753 -7.784 0.028 1.00 0.00 C ATOM 1813 CG1 ILE A 113 2.670 -8.711 -1.186 1.00 0.00 C ATOM 1814 CG2 ILE A 113 3.552 -6.514 -0.274 1.00 0.00 C ATOM 1815 CD1 ILE A 113 1.489 -9.675 -1.060 1.00 0.00 C ATOM 0 H ILE A 113 3.068 -7.242 2.882 1.00 0.00 H new ATOM 0 HA ILE A 113 3.137 -9.576 1.064 1.00 0.00 H new ATOM 0 HB ILE A 113 1.735 -7.475 0.267 1.00 0.00 H new ATOM 0 HG12 ILE A 113 2.565 -8.118 -2.094 1.00 0.00 H new ATOM 0 HG13 ILE A 113 3.597 -9.276 -1.280 1.00 0.00 H new ATOM 0 HG21 ILE A 113 3.122 -6.011 -1.141 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.515 -5.847 0.588 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.589 -6.778 -0.484 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.453 -10.323 -1.936 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.610 -10.283 -0.164 1.00 0.00 H new ATOM 0 HD13 ILE A 113 0.561 -9.107 -0.990 1.00 0.00 H new ATOM 1827 N PRO A 114 5.508 -9.488 1.748 1.00 0.00 N ATOM 1828 CA PRO A 114 6.949 -9.482 1.931 1.00 0.00 C ATOM 1829 C PRO A 114 7.673 -9.431 0.584 1.00 0.00 C ATOM 1830 O PRO A 114 7.355 -10.197 -0.324 1.00 0.00 O ATOM 1831 CB PRO A 114 7.251 -10.745 2.721 1.00 0.00 C ATOM 1832 CG PRO A 114 6.037 -11.643 2.550 1.00 0.00 C ATOM 1833 CD PRO A 114 4.909 -10.799 1.978 1.00 0.00 C ATOM 0 HA PRO A 114 7.301 -8.600 2.466 1.00 0.00 H new ATOM 0 HB2 PRO A 114 8.153 -11.232 2.349 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.423 -10.516 3.773 1.00 0.00 H new ATOM 0 HG2 PRO A 114 6.268 -12.474 1.883 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.743 -12.074 3.507 1.00 0.00 H new ATOM 0 HD2 PRO A 114 4.525 -11.227 1.052 1.00 0.00 H new ATOM 0 HD3 PRO A 114 4.071 -10.735 2.672 1.00 0.00 H new ATOM 1841 N LEU A 115 8.634 -8.523 0.499 1.00 0.00 N ATOM 1842 CA LEU A 115 9.406 -8.363 -0.722 1.00 0.00 C ATOM 1843 C LEU A 115 10.605 -9.313 -0.690 1.00 0.00 C ATOM 1844 O LEU A 115 11.565 -9.131 -1.437 1.00 0.00 O ATOM 1845 CB LEU A 115 9.789 -6.895 -0.925 1.00 0.00 C ATOM 1846 CG LEU A 115 8.656 -5.879 -0.769 1.00 0.00 C ATOM 1847 CD1 LEU A 115 9.176 -4.449 -0.934 1.00 0.00 C ATOM 1848 CD2 LEU A 115 7.507 -6.185 -1.732 1.00 0.00 C ATOM 0 H LEU A 115 8.896 -7.891 1.255 1.00 0.00 H new ATOM 0 HA LEU A 115 8.806 -8.635 -1.591 1.00 0.00 H new ATOM 0 HB2 LEU A 115 10.576 -6.644 -0.214 1.00 0.00 H new ATOM 0 HB3 LEU A 115 10.214 -6.785 -1.923 1.00 0.00 H new ATOM 0 HG LEU A 115 8.259 -5.964 0.243 1.00 0.00 H new ATOM 0 HD11 LEU A 115 8.351 -3.746 -0.819 1.00 0.00 H new ATOM 0 HD12 LEU A 115 9.933 -4.247 -0.176 1.00 0.00 H new ATOM 0 HD13 LEU A 115 9.615 -4.334 -1.925 1.00 0.00 H new ATOM 0 HD21 LEU A 115 6.715 -5.448 -1.600 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.872 -6.146 -2.758 1.00 0.00 H new ATOM 0 HD23 LEU A 115 7.114 -7.180 -1.525 1.00 0.00 H new ATOM 1860 N SER A 116 10.510 -10.305 0.182 1.00 0.00 N ATOM 1861 CA SER A 116 11.575 -11.284 0.321 1.00 0.00 C ATOM 1862 C SER A 116 11.589 -12.217 -0.891 1.00 0.00 C ATOM 1863 O SER A 116 11.458 -13.431 -0.746 1.00 0.00 O ATOM 1864 CB SER A 116 11.416 -12.092 1.611 1.00 0.00 C ATOM 1865 OG SER A 116 12.270 -13.232 1.635 1.00 0.00 O ATOM 0 H SER A 116 9.712 -10.452 0.800 1.00 0.00 H new ATOM 0 HA SER A 116 12.525 -10.751 0.373 1.00 0.00 H new ATOM 0 HB2 SER A 116 11.637 -11.455 2.467 1.00 0.00 H new ATOM 0 HB3 SER A 116 10.379 -12.413 1.712 1.00 0.00 H new ATOM 0 HG SER A 116 12.028 -13.837 0.903 1.00 0.00 H new ATOM 1871 N GLY A 117 11.750 -11.614 -2.060 1.00 0.00 N ATOM 1872 CA GLY A 117 11.783 -12.376 -3.297 1.00 0.00 C ATOM 1873 C GLY A 117 11.228 -11.554 -4.462 1.00 0.00 C ATOM 1874 O GLY A 117 11.562 -11.807 -5.619 1.00 0.00 O ATOM 0 H GLY A 117 11.859 -10.607 -2.177 1.00 0.00 H new ATOM 0 HA2 GLY A 117 12.807 -12.677 -3.515 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.200 -13.290 -3.181 1.00 0.00 H new ATOM 1878 N ILE A 118 10.390 -10.588 -4.117 1.00 0.00 N ATOM 1879 CA ILE A 118 9.785 -9.728 -5.119 1.00 0.00 C ATOM 1880 C ILE A 118 10.879 -9.167 -6.031 1.00 0.00 C ATOM 1881 O ILE A 118 11.925 -8.729 -5.554 1.00 0.00 O ATOM 1882 CB ILE A 118 8.927 -8.650 -4.454 1.00 0.00 C ATOM 1883 CG1 ILE A 118 7.527 -9.181 -4.140 1.00 0.00 C ATOM 1884 CG2 ILE A 118 8.882 -7.381 -5.307 1.00 0.00 C ATOM 1885 CD1 ILE A 118 6.641 -9.162 -5.388 1.00 0.00 C ATOM 0 H ILE A 118 10.116 -10.382 -3.157 1.00 0.00 H new ATOM 0 HA ILE A 118 9.104 -10.300 -5.750 1.00 0.00 H new ATOM 0 HB ILE A 118 9.390 -8.382 -3.504 1.00 0.00 H new ATOM 0 HG12 ILE A 118 7.598 -10.198 -3.755 1.00 0.00 H new ATOM 0 HG13 ILE A 118 7.071 -8.575 -3.357 1.00 0.00 H new ATOM 0 HG21 ILE A 118 8.266 -6.631 -4.811 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.892 -6.993 -5.435 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.456 -7.614 -6.283 1.00 0.00 H new ATOM 0 HD11 ILE A 118 5.651 -9.544 -5.138 1.00 0.00 H new ATOM 0 HD12 ILE A 118 6.553 -8.140 -5.756 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.087 -9.788 -6.161 1.00 0.00 H new ATOM 1897 N GLU A 119 10.600 -9.200 -7.326 1.00 0.00 N ATOM 1898 CA GLU A 119 11.547 -8.700 -8.308 1.00 0.00 C ATOM 1899 C GLU A 119 10.873 -7.672 -9.219 1.00 0.00 C ATOM 1900 O GLU A 119 10.151 -8.037 -10.146 1.00 0.00 O ATOM 1901 CB GLU A 119 12.146 -9.847 -9.124 1.00 0.00 C ATOM 1902 CG GLU A 119 13.369 -10.439 -8.422 1.00 0.00 C ATOM 1903 CD GLU A 119 13.917 -11.641 -9.194 1.00 0.00 C ATOM 1904 OE1 GLU A 119 13.251 -12.698 -9.146 1.00 0.00 O ATOM 1905 OE2 GLU A 119 14.989 -11.476 -9.815 1.00 0.00 O ATOM 0 H GLU A 119 9.732 -9.565 -7.718 1.00 0.00 H new ATOM 0 HA GLU A 119 12.364 -8.208 -7.780 1.00 0.00 H new ATOM 0 HB2 GLU A 119 11.396 -10.624 -9.271 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.429 -9.486 -10.113 1.00 0.00 H new ATOM 0 HG2 GLU A 119 14.144 -9.678 -8.330 1.00 0.00 H new ATOM 0 HG3 GLU A 119 13.100 -10.744 -7.411 1.00 0.00 H new ATOM 1912 N LEU A 120 11.134 -6.407 -8.924 1.00 0.00 N ATOM 1913 CA LEU A 120 10.562 -5.323 -9.705 1.00 0.00 C ATOM 1914 C LEU A 120 11.520 -4.959 -10.842 1.00 0.00 C ATOM 1915 O LEU A 120 11.263 -4.024 -11.599 1.00 0.00 O ATOM 1916 CB LEU A 120 10.204 -4.142 -8.801 1.00 0.00 C ATOM 1917 CG LEU A 120 9.409 -4.481 -7.538 1.00 0.00 C ATOM 1918 CD1 LEU A 120 8.448 -5.644 -7.791 1.00 0.00 C ATOM 1919 CD2 LEU A 120 10.345 -4.756 -6.359 1.00 0.00 C ATOM 0 H LEU A 120 11.734 -6.108 -8.155 1.00 0.00 H new ATOM 0 HA LEU A 120 9.625 -5.638 -10.165 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.127 -3.645 -8.503 1.00 0.00 H new ATOM 0 HB3 LEU A 120 9.630 -3.423 -9.386 1.00 0.00 H new ATOM 0 HG LEU A 120 8.803 -3.615 -7.273 1.00 0.00 H new ATOM 0 HD11 LEU A 120 7.895 -5.865 -6.878 1.00 0.00 H new ATOM 0 HD12 LEU A 120 7.749 -5.373 -8.582 1.00 0.00 H new ATOM 0 HD13 LEU A 120 9.014 -6.525 -8.094 1.00 0.00 H new ATOM 0 HD21 LEU A 120 9.755 -4.994 -5.474 1.00 0.00 H new ATOM 0 HD22 LEU A 120 10.995 -5.597 -6.599 1.00 0.00 H new ATOM 0 HD23 LEU A 120 10.952 -3.872 -6.163 1.00 0.00 H new ATOM 1931 N SER A 121 12.603 -5.716 -10.925 1.00 0.00 N ATOM 1932 CA SER A 121 13.600 -5.485 -11.957 1.00 0.00 C ATOM 1933 C SER A 121 12.982 -5.699 -13.340 1.00 0.00 C ATOM 1934 O SER A 121 13.162 -4.878 -14.238 1.00 0.00 O ATOM 1935 CB SER A 121 14.810 -6.403 -11.769 1.00 0.00 C ATOM 1936 OG SER A 121 15.921 -5.991 -12.561 1.00 0.00 O ATOM 0 H SER A 121 12.813 -6.490 -10.295 1.00 0.00 H new ATOM 0 HA SER A 121 13.943 -4.454 -11.875 1.00 0.00 H new ATOM 0 HB2 SER A 121 15.098 -6.413 -10.718 1.00 0.00 H new ATOM 0 HB3 SER A 121 14.535 -7.424 -12.034 1.00 0.00 H new ATOM 0 HG SER A 121 16.300 -5.167 -12.189 1.00 0.00 H new ATOM 1942 N GLU A 122 12.266 -6.806 -13.468 1.00 0.00 N ATOM 1943 CA GLU A 122 11.620 -7.138 -14.726 1.00 0.00 C ATOM 1944 C GLU A 122 10.705 -5.995 -15.171 1.00 0.00 C ATOM 1945 O GLU A 122 10.846 -5.478 -16.278 1.00 0.00 O ATOM 1946 CB GLU A 122 10.842 -8.451 -14.614 1.00 0.00 C ATOM 1947 CG GLU A 122 11.635 -9.612 -15.216 1.00 0.00 C ATOM 1948 CD GLU A 122 10.734 -10.509 -16.067 1.00 0.00 C ATOM 1949 OE1 GLU A 122 9.983 -11.301 -15.457 1.00 0.00 O ATOM 1950 OE2 GLU A 122 10.816 -10.383 -17.308 1.00 0.00 O ATOM 0 H GLU A 122 12.119 -7.485 -12.721 1.00 0.00 H new ATOM 0 HA GLU A 122 12.392 -7.275 -15.483 1.00 0.00 H new ATOM 0 HB2 GLU A 122 10.623 -8.660 -13.567 1.00 0.00 H new ATOM 0 HB3 GLU A 122 9.885 -8.355 -15.127 1.00 0.00 H new ATOM 0 HG2 GLU A 122 12.449 -9.223 -15.828 1.00 0.00 H new ATOM 0 HG3 GLU A 122 12.089 -10.199 -14.418 1.00 0.00 H new ATOM 1957 N GLY A 123 9.788 -5.635 -14.285 1.00 0.00 N ATOM 1958 CA GLY A 123 8.850 -4.563 -14.572 1.00 0.00 C ATOM 1959 C GLY A 123 7.715 -4.537 -13.547 1.00 0.00 C ATOM 1960 O GLY A 123 7.418 -5.553 -12.919 1.00 0.00 O ATOM 0 H GLY A 123 9.675 -6.067 -13.368 1.00 0.00 H new ATOM 0 HA2 GLY A 123 9.373 -3.606 -14.565 1.00 0.00 H new ATOM 0 HA3 GLY A 123 8.438 -4.694 -15.573 1.00 0.00 H new ATOM 1964 N LYS A 124 7.112 -3.366 -13.409 1.00 0.00 N ATOM 1965 CA LYS A 124 6.015 -3.195 -12.470 1.00 0.00 C ATOM 1966 C LYS A 124 5.073 -4.397 -12.569 1.00 0.00 C ATOM 1967 O LYS A 124 4.423 -4.598 -13.594 1.00 0.00 O ATOM 1968 CB LYS A 124 5.322 -1.850 -12.695 1.00 0.00 C ATOM 1969 CG LYS A 124 3.982 -1.794 -11.960 1.00 0.00 C ATOM 1970 CD LYS A 124 3.511 -0.348 -11.787 1.00 0.00 C ATOM 1971 CE LYS A 124 3.449 0.034 -10.307 1.00 0.00 C ATOM 1972 NZ LYS A 124 3.959 1.409 -10.105 1.00 0.00 N ATOM 0 H LYS A 124 7.362 -2.526 -13.931 1.00 0.00 H new ATOM 0 HA LYS A 124 6.390 -3.167 -11.447 1.00 0.00 H new ATOM 0 HB2 LYS A 124 5.966 -1.042 -12.347 1.00 0.00 H new ATOM 0 HB3 LYS A 124 5.163 -1.693 -13.762 1.00 0.00 H new ATOM 0 HG2 LYS A 124 3.234 -2.360 -12.516 1.00 0.00 H new ATOM 0 HG3 LYS A 124 4.079 -2.268 -10.983 1.00 0.00 H new ATOM 0 HD2 LYS A 124 4.189 0.325 -12.312 1.00 0.00 H new ATOM 0 HD3 LYS A 124 2.527 -0.225 -12.240 1.00 0.00 H new ATOM 0 HE2 LYS A 124 2.421 -0.035 -9.950 1.00 0.00 H new ATOM 0 HE3 LYS A 124 4.039 -0.669 -9.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 4.054 1.598 -9.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 4.888 1.506 -10.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 3.294 2.091 -10.523 1.00 0.00 H new ATOM 1986 N MET A 125 5.029 -5.164 -11.489 1.00 0.00 N ATOM 1987 CA MET A 125 4.178 -6.340 -11.441 1.00 0.00 C ATOM 1988 C MET A 125 2.900 -6.060 -10.647 1.00 0.00 C ATOM 1989 O MET A 125 2.902 -5.237 -9.733 1.00 0.00 O ATOM 1990 CB MET A 125 4.940 -7.496 -10.792 1.00 0.00 C ATOM 1991 CG MET A 125 5.111 -7.265 -9.289 1.00 0.00 C ATOM 1992 SD MET A 125 5.660 -8.768 -8.499 1.00 0.00 S ATOM 1993 CE MET A 125 7.376 -8.769 -8.990 1.00 0.00 C ATOM 0 H MET A 125 5.569 -4.993 -10.641 1.00 0.00 H new ATOM 0 HA MET A 125 3.899 -6.605 -12.461 1.00 0.00 H new ATOM 0 HB2 MET A 125 4.404 -8.430 -10.961 1.00 0.00 H new ATOM 0 HB3 MET A 125 5.918 -7.600 -11.261 1.00 0.00 H new ATOM 0 HG2 MET A 125 5.834 -6.468 -9.115 1.00 0.00 H new ATOM 0 HG3 MET A 125 4.167 -6.939 -8.853 1.00 0.00 H new ATOM 0 HE1 MET A 125 7.576 -9.643 -9.610 1.00 0.00 H new ATOM 0 HE2 MET A 125 7.593 -7.864 -9.557 1.00 0.00 H new ATOM 0 HE3 MET A 125 8.008 -8.801 -8.103 1.00 0.00 H new ATOM 2003 N LEU A 126 1.841 -6.761 -11.024 1.00 0.00 N ATOM 2004 CA LEU A 126 0.560 -6.598 -10.358 1.00 0.00 C ATOM 2005 C LEU A 126 0.381 -7.713 -9.326 1.00 0.00 C ATOM 2006 O LEU A 126 0.692 -8.872 -9.599 1.00 0.00 O ATOM 2007 CB LEU A 126 -0.572 -6.523 -11.385 1.00 0.00 C ATOM 2008 CG LEU A 126 -1.821 -5.753 -10.950 1.00 0.00 C ATOM 2009 CD1 LEU A 126 -2.471 -6.407 -9.729 1.00 0.00 C ATOM 2010 CD2 LEU A 126 -1.499 -4.277 -10.707 1.00 0.00 C ATOM 0 H LEU A 126 1.844 -7.443 -11.782 1.00 0.00 H new ATOM 0 HA LEU A 126 0.530 -5.653 -9.815 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -0.183 -6.062 -12.293 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -0.868 -7.539 -11.645 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.547 -5.794 -11.762 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.356 -5.840 -9.441 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -2.759 -7.429 -9.974 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -1.762 -6.418 -8.901 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.404 -3.753 -10.399 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.746 -4.193 -9.923 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.117 -3.832 -11.626 1.00 0.00 H new ATOM 2022 N MET A 127 -0.119 -7.325 -8.162 1.00 0.00 N ATOM 2023 CA MET A 127 -0.342 -8.277 -7.088 1.00 0.00 C ATOM 2024 C MET A 127 -1.627 -7.950 -6.324 1.00 0.00 C ATOM 2025 O MET A 127 -2.049 -6.796 -6.278 1.00 0.00 O ATOM 2026 CB MET A 127 0.846 -8.250 -6.125 1.00 0.00 C ATOM 2027 CG MET A 127 2.149 -8.591 -6.851 1.00 0.00 C ATOM 2028 SD MET A 127 3.135 -9.691 -5.850 1.00 0.00 S ATOM 2029 CE MET A 127 3.219 -8.745 -4.339 1.00 0.00 C ATOM 0 H MET A 127 -0.376 -6.363 -7.939 1.00 0.00 H new ATOM 0 HA MET A 127 -0.443 -9.271 -7.524 1.00 0.00 H new ATOM 0 HB2 MET A 127 0.927 -7.263 -5.670 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.679 -8.962 -5.316 1.00 0.00 H new ATOM 0 HG2 MET A 127 1.929 -9.058 -7.811 1.00 0.00 H new ATOM 0 HG3 MET A 127 2.707 -7.679 -7.061 1.00 0.00 H new ATOM 0 HE1 MET A 127 4.204 -8.866 -3.889 1.00 0.00 H new ATOM 0 HE2 MET A 127 3.047 -7.691 -4.559 1.00 0.00 H new ATOM 0 HE3 MET A 127 2.457 -9.100 -3.645 1.00 0.00 H new ATOM 2039 N ASN A 128 -2.212 -8.987 -5.743 1.00 0.00 N ATOM 2040 CA ASN A 128 -3.440 -8.825 -4.984 1.00 0.00 C ATOM 2041 C ASN A 128 -3.320 -9.584 -3.661 1.00 0.00 C ATOM 2042 O ASN A 128 -2.413 -10.395 -3.486 1.00 0.00 O ATOM 2043 CB ASN A 128 -4.639 -9.391 -5.747 1.00 0.00 C ATOM 2044 CG ASN A 128 -4.244 -10.637 -6.543 1.00 0.00 C ATOM 2045 OD1 ASN A 128 -3.603 -11.547 -6.043 1.00 0.00 O ATOM 2046 ND2 ASN A 128 -4.661 -10.626 -7.805 1.00 0.00 N ATOM 0 H ASN A 128 -1.858 -9.943 -5.783 1.00 0.00 H new ATOM 0 HA ASN A 128 -3.593 -7.759 -4.813 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.436 -9.640 -5.046 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.035 -8.633 -6.423 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -4.448 -11.412 -8.419 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -5.194 -9.832 -8.159 1.00 0.00 H new ATOM 2053 N ARG A 129 -4.250 -9.293 -2.762 1.00 0.00 N ATOM 2054 CA ARG A 129 -4.260 -9.938 -1.460 1.00 0.00 C ATOM 2055 C ARG A 129 -5.689 -10.020 -0.919 1.00 0.00 C ATOM 2056 O ARG A 129 -6.502 -9.132 -1.168 1.00 0.00 O ATOM 2057 CB ARG A 129 -3.387 -9.176 -0.461 1.00 0.00 C ATOM 2058 CG ARG A 129 -2.046 -9.882 -0.254 1.00 0.00 C ATOM 2059 CD ARG A 129 -2.235 -11.217 0.469 1.00 0.00 C ATOM 2060 NE ARG A 129 -0.934 -11.910 0.600 1.00 0.00 N ATOM 2061 CZ ARG A 129 -0.755 -13.048 1.285 1.00 0.00 C ATOM 2062 NH1 ARG A 129 -1.792 -13.628 1.903 1.00 0.00 N ATOM 2063 NH2 ARG A 129 0.462 -13.606 1.350 1.00 0.00 N ATOM 0 H ARG A 129 -5.001 -8.619 -2.910 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.857 -10.943 -1.585 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -3.216 -8.162 -0.822 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -3.908 -9.091 0.492 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.567 -10.051 -1.219 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -1.380 -9.242 0.325 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -2.667 -11.048 1.455 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -2.936 -11.843 -0.083 1.00 0.00 H new ATOM 0 HE ARG A 129 -0.123 -11.496 0.140 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -2.718 -13.204 1.852 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -1.656 -14.494 2.424 1.00 0.00 H new ATOM 0 HH21 ARG A 129 1.251 -13.165 0.878 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.599 -14.472 1.871 1.00 0.00 H new ATOM 2077 N GLU A 130 -5.950 -11.095 -0.190 1.00 0.00 N ATOM 2078 CA GLU A 130 -7.267 -11.305 0.387 1.00 0.00 C ATOM 2079 C GLU A 130 -7.347 -10.663 1.774 1.00 0.00 C ATOM 2080 O GLU A 130 -6.401 -10.747 2.556 1.00 0.00 O ATOM 2081 CB GLU A 130 -7.605 -12.796 0.453 1.00 0.00 C ATOM 2082 CG GLU A 130 -7.055 -13.427 1.733 1.00 0.00 C ATOM 2083 CD GLU A 130 -6.702 -14.899 1.511 1.00 0.00 C ATOM 2084 OE1 GLU A 130 -7.605 -15.738 1.717 1.00 0.00 O ATOM 2085 OE2 GLU A 130 -5.535 -15.152 1.139 1.00 0.00 O ATOM 0 H GLU A 130 -5.272 -11.830 0.014 1.00 0.00 H new ATOM 0 HA GLU A 130 -8.005 -10.827 -0.257 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.686 -12.929 0.413 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.189 -13.306 -0.416 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.169 -12.882 2.060 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.793 -13.343 2.531 1.00 0.00 H new ATOM 2092 N ILE A 131 -8.484 -10.037 2.037 1.00 0.00 N ATOM 2093 CA ILE A 131 -8.700 -9.381 3.315 1.00 0.00 C ATOM 2094 C ILE A 131 -9.524 -10.298 4.221 1.00 0.00 C ATOM 2095 O ILE A 131 -10.650 -10.662 3.883 1.00 0.00 O ATOM 2096 CB ILE A 131 -9.321 -7.998 3.110 1.00 0.00 C ATOM 2097 CG1 ILE A 131 -8.315 -7.033 2.480 1.00 0.00 C ATOM 2098 CG2 ILE A 131 -9.894 -7.455 4.420 1.00 0.00 C ATOM 2099 CD1 ILE A 131 -8.970 -6.202 1.375 1.00 0.00 C ATOM 0 H ILE A 131 -9.266 -9.970 1.386 1.00 0.00 H new ATOM 0 HA ILE A 131 -7.749 -9.205 3.819 1.00 0.00 H new ATOM 0 HB ILE A 131 -10.152 -8.097 2.412 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -7.911 -6.371 3.246 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -7.476 -7.594 2.069 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -10.329 -6.471 4.246 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -10.664 -8.133 4.789 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -9.097 -7.374 5.160 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -8.233 -5.524 0.944 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -9.351 -6.865 0.598 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -9.793 -5.624 1.794 1.00 0.00 H new ATOM 2111 N ILE A 132 -8.932 -10.645 5.354 1.00 0.00 N ATOM 2112 CA ILE A 132 -9.598 -11.513 6.311 1.00 0.00 C ATOM 2113 C ILE A 132 -9.481 -10.906 7.711 1.00 0.00 C ATOM 2114 O ILE A 132 -9.020 -9.776 7.864 1.00 0.00 O ATOM 2115 CB ILE A 132 -9.053 -12.939 6.212 1.00 0.00 C ATOM 2116 CG1 ILE A 132 -7.531 -12.935 6.060 1.00 0.00 C ATOM 2117 CG2 ILE A 132 -9.739 -13.710 5.083 1.00 0.00 C ATOM 2118 CD1 ILE A 132 -6.848 -12.625 7.394 1.00 0.00 C ATOM 0 H ILE A 132 -7.999 -10.341 5.631 1.00 0.00 H new ATOM 0 HA ILE A 132 -10.661 -11.587 6.082 1.00 0.00 H new ATOM 0 HB ILE A 132 -9.282 -13.458 7.143 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -7.196 -13.905 5.693 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -7.238 -12.194 5.316 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -9.334 -14.721 5.034 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.811 -13.758 5.274 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -9.562 -13.202 4.135 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -5.766 -12.628 7.258 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -7.167 -11.644 7.747 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -7.124 -13.382 8.128 1.00 0.00 H new ATOM 2130 N SER A 133 -9.906 -11.683 8.696 1.00 0.00 N ATOM 2131 CA SER A 133 -9.854 -11.237 10.077 1.00 0.00 C ATOM 2132 C SER A 133 -8.550 -11.702 10.729 1.00 0.00 C ATOM 2133 O SER A 133 -8.545 -12.660 11.500 1.00 0.00 O ATOM 2134 CB SER A 133 -11.057 -11.754 10.869 1.00 0.00 C ATOM 2135 OG SER A 133 -10.916 -11.521 12.268 1.00 0.00 O ATOM 0 H SER A 133 -10.288 -12.620 8.565 1.00 0.00 H new ATOM 0 HA SER A 133 -9.889 -10.148 10.085 1.00 0.00 H new ATOM 0 HB2 SER A 133 -11.964 -11.267 10.510 1.00 0.00 H new ATOM 0 HB3 SER A 133 -11.177 -12.822 10.690 1.00 0.00 H new ATOM 0 HG SER A 133 -11.705 -11.864 12.738 1.00 0.00 H new ATOM 2141 N GLY A 134 -7.476 -11.001 10.396 1.00 0.00 N ATOM 2142 CA GLY A 134 -6.169 -11.330 10.939 1.00 0.00 C ATOM 2143 C GLY A 134 -5.687 -12.687 10.422 1.00 0.00 C ATOM 2144 O GLY A 134 -6.495 -13.553 10.092 1.00 0.00 O ATOM 0 H GLY A 134 -7.484 -10.206 9.757 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -5.452 -10.556 10.664 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -6.217 -11.348 12.028 1.00 0.00 H new ATOM 2148 N PRO A 135 -4.336 -12.833 10.367 1.00 0.00 N ATOM 2149 CA PRO A 135 -3.736 -14.070 9.897 1.00 0.00 C ATOM 2150 C PRO A 135 -3.847 -15.170 10.954 1.00 0.00 C ATOM 2151 O PRO A 135 -2.840 -15.744 11.366 1.00 0.00 O ATOM 2152 CB PRO A 135 -2.297 -13.708 9.565 1.00 0.00 C ATOM 2153 CG PRO A 135 -2.016 -12.405 10.296 1.00 0.00 C ATOM 2154 CD PRO A 135 -3.348 -11.829 10.751 1.00 0.00 C ATOM 0 HA PRO A 135 -4.243 -14.477 9.022 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -1.612 -14.492 9.888 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -2.162 -13.590 8.490 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -1.364 -12.580 11.152 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -1.500 -11.703 9.641 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -3.358 -11.655 11.827 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -3.550 -10.871 10.272 1.00 0.00 H new ATOM 2162 N SER A 136 -5.080 -15.432 11.363 1.00 0.00 N ATOM 2163 CA SER A 136 -5.335 -16.453 12.364 1.00 0.00 C ATOM 2164 C SER A 136 -4.789 -17.801 11.888 1.00 0.00 C ATOM 2165 O SER A 136 -5.094 -18.243 10.781 1.00 0.00 O ATOM 2166 CB SER A 136 -6.831 -16.565 12.668 1.00 0.00 C ATOM 2167 OG SER A 136 -7.222 -15.714 13.742 1.00 0.00 O ATOM 0 H SER A 136 -5.913 -14.955 11.019 1.00 0.00 H new ATOM 0 HA SER A 136 -4.825 -16.165 13.283 1.00 0.00 H new ATOM 0 HB2 SER A 136 -7.403 -16.309 11.776 1.00 0.00 H new ATOM 0 HB3 SER A 136 -7.074 -17.598 12.917 1.00 0.00 H new ATOM 0 HG SER A 136 -8.183 -15.813 13.904 1.00 0.00 H new ATOM 2173 N SER A 137 -3.990 -18.416 12.748 1.00 0.00 N ATOM 2174 CA SER A 137 -3.399 -19.705 12.430 1.00 0.00 C ATOM 2175 C SER A 137 -2.438 -19.561 11.247 1.00 0.00 C ATOM 2176 O SER A 137 -2.864 -19.289 10.126 1.00 0.00 O ATOM 2177 CB SER A 137 -4.477 -20.743 12.114 1.00 0.00 C ATOM 2178 OG SER A 137 -4.897 -21.447 13.280 1.00 0.00 O ATOM 0 H SER A 137 -3.738 -18.046 13.664 1.00 0.00 H new ATOM 0 HA SER A 137 -2.844 -20.052 13.302 1.00 0.00 H new ATOM 0 HB2 SER A 137 -5.336 -20.248 11.660 1.00 0.00 H new ATOM 0 HB3 SER A 137 -4.094 -21.452 11.380 1.00 0.00 H new ATOM 0 HG SER A 137 -5.587 -22.099 13.037 1.00 0.00 H new ATOM 2184 N GLY A 138 -1.159 -19.750 11.539 1.00 0.00 N ATOM 2185 CA GLY A 138 -0.135 -19.645 10.514 1.00 0.00 C ATOM 2186 C GLY A 138 0.041 -18.194 10.061 1.00 0.00 C ATOM 2187 O GLY A 138 1.152 -17.667 10.071 1.00 0.00 O ATOM 0 H GLY A 138 -0.809 -19.975 12.470 1.00 0.00 H new ATOM 0 HA2 GLY A 138 0.811 -20.027 10.899 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -0.405 -20.266 9.660 1.00 0.00 H new TER 2191 GLY A 138