USER MOD reduce.3.24.130724 H: found=0, std=0, add=1017, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1017 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 100 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 102 THR OG1 : rot -50:sc= 0.792 USER MOD Set 1.3: A 111 ASN : amide:sc= 0.495 K(o=1.3,f=0.36) USER MOD Set 1.4: A 113 MET CE :methyl 163:sc= 0 (180deg=0) USER MOD Set 2.1: A 81 THR OG1 : rot -117:sc= 0.631 USER MOD Set 2.2: A 93 THR OG1 : rot 180:sc= 0.568 USER MOD Set 3.1: A 19 MET CE :methyl -179:sc=-0.00919 (180deg=-0.0156) USER MOD Set 3.2: A 74 MET CE :methyl 166:sc= -0.0313 (180deg=-0.281) USER MOD Set 4.1: A 47 HIS : no HD1:sc= 0 X(o=0.62,f=0.62) USER MOD Set 4.2: A 64 THR OG1 : rot 84:sc= 0.145 USER MOD Set 4.3: A 69 CYS SG : rot 180:sc= 0.471 USER MOD Single : A 2 SER OG : rot 31:sc= 0.334 USER MOD Single : A 4 SER OG : rot 180:sc= 0.0269 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot 157:sc= 0.211 USER MOD Single : A 8 GLN : amide:sc=0.000557 X(o=0.00056,f=0) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=-0.05) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 0.0147 X(o=0.015,f=0) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ -148:sc= -0.0851 (180deg=-1.19) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot -54:sc= 0.526 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : A 61 ASN : amide:sc= -0.0383 X(o=-0.038,f=0) USER MOD Single : A 73 THR OG1 : rot -170:sc= 0.00429 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 179:sc= 0.0113 (180deg=0.0113) USER MOD Single : A 84 GLN : amide:sc= -0.499 X(o=-0.5,f=0) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=-0.0057) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot 39:sc= 0.121 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot -130:sc= -0.253 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 11.685 -10.293 -3.978 1.00 0.00 N ATOM 2 CA SER A 2 11.450 -10.559 -2.552 1.00 0.00 C ATOM 3 C SER A 2 10.567 -9.434 -1.956 1.00 0.00 C ATOM 4 O SER A 2 11.026 -8.303 -1.772 1.00 0.00 O ATOM 5 CB SER A 2 12.782 -10.756 -1.792 1.00 0.00 C ATOM 6 OG SER A 2 13.601 -9.587 -1.801 1.00 0.00 O ATOM 0 HA SER A 2 10.907 -11.497 -2.439 1.00 0.00 H new ATOM 0 HB2 SER A 2 12.569 -11.037 -0.761 1.00 0.00 H new ATOM 0 HB3 SER A 2 13.332 -11.583 -2.240 1.00 0.00 H new ATOM 0 HG SER A 2 13.032 -8.789 -1.828 1.00 0.00 H new ATOM 12 N PHE A 3 9.298 -9.756 -1.657 1.00 0.00 N ATOM 13 CA PHE A 3 8.303 -8.758 -1.160 1.00 0.00 C ATOM 14 C PHE A 3 8.268 -8.487 0.381 1.00 0.00 C ATOM 15 O PHE A 3 7.542 -7.572 0.779 1.00 0.00 O ATOM 16 CB PHE A 3 6.896 -9.158 -1.695 1.00 0.00 C ATOM 17 CG PHE A 3 6.627 -8.835 -3.174 1.00 0.00 C ATOM 18 CD1 PHE A 3 6.263 -7.537 -3.549 1.00 0.00 C ATOM 19 CD2 PHE A 3 6.706 -9.835 -4.151 1.00 0.00 C ATOM 20 CE1 PHE A 3 5.987 -7.242 -4.881 1.00 0.00 C ATOM 21 CE2 PHE A 3 6.423 -9.539 -5.481 1.00 0.00 C ATOM 22 CZ PHE A 3 6.059 -8.245 -5.841 1.00 0.00 C ATOM 0 H PHE A 3 8.924 -10.701 -1.747 1.00 0.00 H new ATOM 0 HA PHE A 3 8.635 -7.798 -1.554 1.00 0.00 H new ATOM 0 HB2 PHE A 3 6.762 -10.230 -1.546 1.00 0.00 H new ATOM 0 HB3 PHE A 3 6.141 -8.656 -1.090 1.00 0.00 H new ATOM 0 HD1 PHE A 3 6.196 -6.760 -2.801 1.00 0.00 H new ATOM 0 HD2 PHE A 3 6.988 -10.839 -3.871 1.00 0.00 H new ATOM 0 HE1 PHE A 3 5.718 -6.236 -5.168 1.00 0.00 H new ATOM 0 HE2 PHE A 3 6.486 -10.312 -6.232 1.00 0.00 H new ATOM 0 HZ PHE A 3 5.831 -8.019 -6.872 1.00 0.00 H new ATOM 32 N SER A 4 9.042 -9.189 1.243 1.00 0.00 N ATOM 33 CA SER A 4 9.112 -8.889 2.701 1.00 0.00 C ATOM 34 C SER A 4 9.945 -7.600 2.964 1.00 0.00 C ATOM 35 O SER A 4 11.177 -7.618 2.863 1.00 0.00 O ATOM 36 CB SER A 4 9.698 -10.089 3.478 1.00 0.00 C ATOM 37 OG SER A 4 8.836 -11.217 3.423 1.00 0.00 O ATOM 0 H SER A 4 9.631 -9.971 0.956 1.00 0.00 H new ATOM 0 HA SER A 4 8.098 -8.713 3.060 1.00 0.00 H new ATOM 0 HB2 SER A 4 10.671 -10.353 3.063 1.00 0.00 H new ATOM 0 HB3 SER A 4 9.862 -9.805 4.518 1.00 0.00 H new ATOM 0 HG SER A 4 9.236 -11.959 3.922 1.00 0.00 H new ATOM 43 N GLY A 5 9.258 -6.489 3.278 1.00 0.00 N ATOM 44 CA GLY A 5 9.914 -5.172 3.414 1.00 0.00 C ATOM 45 C GLY A 5 8.939 -4.046 3.814 1.00 0.00 C ATOM 46 O GLY A 5 7.760 -4.042 3.443 1.00 0.00 O ATOM 0 H GLY A 5 8.251 -6.473 3.443 1.00 0.00 H new ATOM 0 HA2 GLY A 5 10.704 -5.242 4.162 1.00 0.00 H new ATOM 0 HA3 GLY A 5 10.391 -4.912 2.469 1.00 0.00 H new ATOM 50 N LYS A 6 9.481 -3.067 4.556 1.00 0.00 N ATOM 51 CA LYS A 6 8.722 -1.883 5.037 1.00 0.00 C ATOM 52 C LYS A 6 9.112 -0.692 4.123 1.00 0.00 C ATOM 53 O LYS A 6 10.258 -0.234 4.150 1.00 0.00 O ATOM 54 CB LYS A 6 9.025 -1.579 6.532 1.00 0.00 C ATOM 55 CG LYS A 6 8.570 -2.638 7.568 1.00 0.00 C ATOM 56 CD LYS A 6 9.598 -3.755 7.849 1.00 0.00 C ATOM 57 CE LYS A 6 9.127 -4.750 8.924 1.00 0.00 C ATOM 58 NZ LYS A 6 10.122 -5.818 9.135 1.00 0.00 N ATOM 0 H LYS A 6 10.459 -3.067 4.844 1.00 0.00 H new ATOM 0 HA LYS A 6 7.650 -2.070 4.983 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.101 -1.440 6.639 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.554 -0.630 6.788 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.339 -2.132 8.506 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.645 -3.095 7.216 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.800 -4.296 6.925 1.00 0.00 H new ATOM 0 HD3 LYS A 6 10.538 -3.304 8.166 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.953 -4.221 9.861 1.00 0.00 H new ATOM 0 HE3 LYS A 6 8.176 -5.190 8.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 9.778 -6.474 9.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 10.269 -6.336 8.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 11.022 -5.398 9.444 1.00 0.00 H new ATOM 72 N TYR A 7 8.170 -0.235 3.280 1.00 0.00 N ATOM 73 CA TYR A 7 8.489 0.635 2.116 1.00 0.00 C ATOM 74 C TYR A 7 7.888 2.042 2.378 1.00 0.00 C ATOM 75 O TYR A 7 6.674 2.226 2.261 1.00 0.00 O ATOM 76 CB TYR A 7 7.959 0.019 0.781 1.00 0.00 C ATOM 77 CG TYR A 7 8.340 -1.442 0.444 1.00 0.00 C ATOM 78 CD1 TYR A 7 9.642 -1.766 0.046 1.00 0.00 C ATOM 79 CD2 TYR A 7 7.378 -2.457 0.520 1.00 0.00 C ATOM 80 CE1 TYR A 7 9.978 -3.086 -0.249 1.00 0.00 C ATOM 81 CE2 TYR A 7 7.715 -3.775 0.228 1.00 0.00 C ATOM 82 CZ TYR A 7 9.017 -4.090 -0.150 1.00 0.00 C ATOM 83 OH TYR A 7 9.346 -5.393 -0.405 1.00 0.00 O ATOM 0 H TYR A 7 7.178 -0.450 3.377 1.00 0.00 H new ATOM 0 HA TYR A 7 9.570 0.718 2.005 1.00 0.00 H new ATOM 0 HB2 TYR A 7 6.871 0.084 0.794 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.306 0.650 -0.037 1.00 0.00 H new ATOM 0 HD1 TYR A 7 10.389 -0.990 -0.033 1.00 0.00 H new ATOM 0 HD2 TYR A 7 6.366 -2.215 0.808 1.00 0.00 H new ATOM 0 HE1 TYR A 7 10.984 -3.331 -0.555 1.00 0.00 H new ATOM 0 HE2 TYR A 7 6.968 -4.552 0.295 1.00 0.00 H new ATOM 0 HH TYR A 7 8.705 -5.985 0.041 1.00 0.00 H new ATOM 93 N GLN A 8 8.732 3.035 2.723 1.00 0.00 N ATOM 94 CA GLN A 8 8.266 4.416 3.035 1.00 0.00 C ATOM 95 C GLN A 8 8.278 5.317 1.767 1.00 0.00 C ATOM 96 O GLN A 8 9.231 5.304 0.984 1.00 0.00 O ATOM 97 CB GLN A 8 9.088 4.992 4.217 1.00 0.00 C ATOM 98 CG GLN A 8 8.606 6.383 4.690 1.00 0.00 C ATOM 99 CD GLN A 8 9.108 6.810 6.074 1.00 0.00 C ATOM 100 OE1 GLN A 8 10.306 6.959 6.312 1.00 0.00 O ATOM 101 NE2 GLN A 8 8.194 7.046 7.002 1.00 0.00 N ATOM 0 H GLN A 8 9.742 2.914 2.795 1.00 0.00 H new ATOM 0 HA GLN A 8 7.225 4.386 3.356 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.040 4.296 5.055 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.135 5.061 3.920 1.00 0.00 H new ATOM 0 HG2 GLN A 8 8.923 7.128 3.960 1.00 0.00 H new ATOM 0 HG3 GLN A 8 7.516 6.389 4.698 1.00 0.00 H new ATOM 0 HE21 GLN A 8 7.205 6.918 6.788 1.00 0.00 H new ATOM 0 HE22 GLN A 8 8.479 7.356 7.931 1.00 0.00 H new ATOM 110 N LEU A 9 7.203 6.115 1.607 1.00 0.00 N ATOM 111 CA LEU A 9 6.926 6.880 0.364 1.00 0.00 C ATOM 112 C LEU A 9 7.890 8.085 0.185 1.00 0.00 C ATOM 113 O LEU A 9 7.903 9.012 1.000 1.00 0.00 O ATOM 114 CB LEU A 9 5.428 7.301 0.356 1.00 0.00 C ATOM 115 CG LEU A 9 4.888 8.019 -0.916 1.00 0.00 C ATOM 116 CD1 LEU A 9 5.067 7.202 -2.209 1.00 0.00 C ATOM 117 CD2 LEU A 9 3.403 8.393 -0.734 1.00 0.00 C ATOM 0 H LEU A 9 6.500 6.250 2.333 1.00 0.00 H new ATOM 0 HA LEU A 9 7.113 6.240 -0.498 1.00 0.00 H new ATOM 0 HB2 LEU A 9 4.827 6.406 0.518 1.00 0.00 H new ATOM 0 HB3 LEU A 9 5.259 7.957 1.210 1.00 0.00 H new ATOM 0 HG LEU A 9 5.490 8.921 -1.031 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.668 7.765 -3.053 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.127 7.006 -2.372 1.00 0.00 H new ATOM 0 HD13 LEU A 9 4.533 6.256 -2.119 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.041 8.894 -1.632 1.00 0.00 H new ATOM 0 HD22 LEU A 9 2.819 7.489 -0.562 1.00 0.00 H new ATOM 0 HD23 LEU A 9 3.298 9.061 0.121 1.00 0.00 H new ATOM 129 N GLN A 10 8.679 8.044 -0.901 1.00 0.00 N ATOM 130 CA GLN A 10 9.673 9.099 -1.235 1.00 0.00 C ATOM 131 C GLN A 10 9.119 10.062 -2.325 1.00 0.00 C ATOM 132 O GLN A 10 8.983 11.258 -2.051 1.00 0.00 O ATOM 133 CB GLN A 10 11.055 8.498 -1.620 1.00 0.00 C ATOM 134 CG GLN A 10 11.706 7.564 -0.571 1.00 0.00 C ATOM 135 CD GLN A 10 13.213 7.353 -0.797 1.00 0.00 C ATOM 136 OE1 GLN A 10 13.657 6.981 -1.883 1.00 0.00 O ATOM 137 NE2 GLN A 10 14.030 7.570 0.223 1.00 0.00 N ATOM 0 H GLN A 10 8.652 7.282 -1.578 1.00 0.00 H new ATOM 0 HA GLN A 10 9.842 9.692 -0.336 1.00 0.00 H new ATOM 0 HB2 GLN A 10 10.940 7.942 -2.551 1.00 0.00 H new ATOM 0 HB3 GLN A 10 11.742 9.319 -1.822 1.00 0.00 H new ATOM 0 HG2 GLN A 10 11.550 7.981 0.424 1.00 0.00 H new ATOM 0 HG3 GLN A 10 11.203 6.597 -0.594 1.00 0.00 H new ATOM 0 HE21 GLN A 10 13.655 7.878 1.120 1.00 0.00 H new ATOM 0 HE22 GLN A 10 15.034 7.429 0.111 1.00 0.00 H new ATOM 146 N SER A 11 8.816 9.552 -3.539 1.00 0.00 N ATOM 147 CA SER A 11 8.312 10.367 -4.676 1.00 0.00 C ATOM 148 C SER A 11 6.908 9.864 -5.111 1.00 0.00 C ATOM 149 O SER A 11 6.584 8.677 -5.013 1.00 0.00 O ATOM 150 CB SER A 11 9.320 10.287 -5.848 1.00 0.00 C ATOM 151 OG SER A 11 10.545 10.926 -5.509 1.00 0.00 O ATOM 0 H SER A 11 8.913 8.562 -3.763 1.00 0.00 H new ATOM 0 HA SER A 11 8.215 11.408 -4.369 1.00 0.00 H new ATOM 0 HB2 SER A 11 9.507 9.243 -6.101 1.00 0.00 H new ATOM 0 HB3 SER A 11 8.893 10.758 -6.733 1.00 0.00 H new ATOM 0 HG SER A 11 11.167 10.862 -6.263 1.00 0.00 H new ATOM 157 N GLN A 12 6.079 10.797 -5.609 1.00 0.00 N ATOM 158 CA GLN A 12 4.701 10.499 -6.085 1.00 0.00 C ATOM 159 C GLN A 12 4.377 11.355 -7.338 1.00 0.00 C ATOM 160 O GLN A 12 4.626 12.565 -7.388 1.00 0.00 O ATOM 161 CB GLN A 12 3.630 10.652 -4.969 1.00 0.00 C ATOM 162 CG GLN A 12 3.547 12.019 -4.239 1.00 0.00 C ATOM 163 CD GLN A 12 3.609 11.893 -2.708 1.00 0.00 C ATOM 164 OE1 GLN A 12 4.672 11.680 -2.126 1.00 0.00 O ATOM 165 NE2 GLN A 12 2.479 11.997 -2.033 1.00 0.00 N ATOM 0 H GLN A 12 6.337 11.780 -5.696 1.00 0.00 H new ATOM 0 HA GLN A 12 4.666 9.447 -6.370 1.00 0.00 H new ATOM 0 HB2 GLN A 12 2.654 10.446 -5.409 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.812 9.881 -4.220 1.00 0.00 H new ATOM 0 HG2 GLN A 12 4.365 12.655 -4.578 1.00 0.00 H new ATOM 0 HG3 GLN A 12 2.619 12.517 -4.519 1.00 0.00 H new ATOM 0 HE21 GLN A 12 1.604 12.174 -2.527 1.00 0.00 H new ATOM 0 HE22 GLN A 12 2.481 11.901 -1.018 1.00 0.00 H new ATOM 174 N GLU A 13 3.794 10.683 -8.342 1.00 0.00 N ATOM 175 CA GLU A 13 3.430 11.291 -9.647 1.00 0.00 C ATOM 176 C GLU A 13 2.003 11.911 -9.582 1.00 0.00 C ATOM 177 O GLU A 13 1.888 13.138 -9.659 1.00 0.00 O ATOM 178 CB GLU A 13 3.647 10.227 -10.760 1.00 0.00 C ATOM 179 CG GLU A 13 3.445 10.732 -12.204 1.00 0.00 C ATOM 180 CD GLU A 13 3.745 9.659 -13.254 1.00 0.00 C ATOM 181 OE1 GLU A 13 2.912 8.747 -13.449 1.00 0.00 O ATOM 182 OE2 GLU A 13 4.820 9.722 -13.892 1.00 0.00 O ATOM 0 H GLU A 13 3.557 9.693 -8.278 1.00 0.00 H new ATOM 0 HA GLU A 13 4.075 12.134 -9.895 1.00 0.00 H new ATOM 0 HB2 GLU A 13 4.659 9.832 -10.669 1.00 0.00 H new ATOM 0 HB3 GLU A 13 2.963 9.397 -10.584 1.00 0.00 H new ATOM 0 HG2 GLU A 13 2.417 11.074 -12.324 1.00 0.00 H new ATOM 0 HG3 GLU A 13 4.090 11.593 -12.377 1.00 0.00 H new ATOM 189 N ASN A 14 0.946 11.083 -9.456 1.00 0.00 N ATOM 190 CA ASN A 14 -0.465 11.555 -9.492 1.00 0.00 C ATOM 191 C ASN A 14 -1.204 11.186 -8.169 1.00 0.00 C ATOM 192 O ASN A 14 -2.137 10.377 -8.165 1.00 0.00 O ATOM 193 CB ASN A 14 -1.134 10.984 -10.779 1.00 0.00 C ATOM 194 CG ASN A 14 -0.806 11.683 -12.119 1.00 0.00 C ATOM 195 OD1 ASN A 14 -0.010 12.618 -12.207 1.00 0.00 O ATOM 196 ND2 ASN A 14 -1.419 11.229 -13.200 1.00 0.00 N ATOM 0 H ASN A 14 1.038 10.075 -9.327 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.518 12.642 -9.547 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -0.853 9.935 -10.868 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.215 11.013 -10.639 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -1.232 11.654 -14.108 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -2.078 10.454 -13.125 1.00 0.00 H new ATOM 203 N PHE A 15 -0.816 11.835 -7.050 1.00 0.00 N ATOM 204 CA PHE A 15 -1.533 11.723 -5.745 1.00 0.00 C ATOM 205 C PHE A 15 -2.853 12.559 -5.719 1.00 0.00 C ATOM 206 O PHE A 15 -3.910 11.991 -5.434 1.00 0.00 O ATOM 207 CB PHE A 15 -0.541 12.066 -4.594 1.00 0.00 C ATOM 208 CG PHE A 15 -0.993 11.698 -3.166 1.00 0.00 C ATOM 209 CD1 PHE A 15 -1.828 12.558 -2.442 1.00 0.00 C ATOM 210 CD2 PHE A 15 -0.516 10.534 -2.550 1.00 0.00 C ATOM 211 CE1 PHE A 15 -2.181 12.256 -1.131 1.00 0.00 C ATOM 212 CE2 PHE A 15 -0.855 10.245 -1.230 1.00 0.00 C ATOM 213 CZ PHE A 15 -1.687 11.107 -0.521 1.00 0.00 C ATOM 0 H PHE A 15 -0.003 12.450 -7.017 1.00 0.00 H new ATOM 0 HA PHE A 15 -1.870 10.697 -5.599 1.00 0.00 H new ATOM 0 HB2 PHE A 15 0.403 11.560 -4.795 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -0.341 13.137 -4.624 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -2.200 13.461 -2.904 1.00 0.00 H new ATOM 0 HD2 PHE A 15 0.119 9.856 -3.102 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -2.840 12.915 -0.585 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -0.473 9.353 -0.757 1.00 0.00 H new ATOM 0 HZ PHE A 15 -1.949 10.884 0.503 1.00 0.00 H new ATOM 223 N GLU A 16 -2.806 13.878 -6.021 1.00 0.00 N ATOM 224 CA GLU A 16 -4.013 14.757 -6.067 1.00 0.00 C ATOM 225 C GLU A 16 -5.089 14.352 -7.122 1.00 0.00 C ATOM 226 O GLU A 16 -6.266 14.244 -6.762 1.00 0.00 O ATOM 227 CB GLU A 16 -3.605 16.248 -6.253 1.00 0.00 C ATOM 228 CG GLU A 16 -2.837 16.887 -5.075 1.00 0.00 C ATOM 229 CD GLU A 16 -2.479 18.352 -5.330 1.00 0.00 C ATOM 230 OE1 GLU A 16 -3.312 19.239 -5.041 1.00 0.00 O ATOM 231 OE2 GLU A 16 -1.361 18.624 -5.822 1.00 0.00 O ATOM 0 H GLU A 16 -1.938 14.367 -6.240 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.495 14.618 -5.099 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -2.990 16.328 -7.149 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -4.507 16.832 -6.433 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -3.442 16.817 -4.171 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -1.924 16.321 -4.892 1.00 0.00 H new ATOM 238 N ALA A 17 -4.692 14.107 -8.390 1.00 0.00 N ATOM 239 CA ALA A 17 -5.602 13.593 -9.450 1.00 0.00 C ATOM 240 C ALA A 17 -6.287 12.217 -9.179 1.00 0.00 C ATOM 241 O ALA A 17 -7.473 12.076 -9.488 1.00 0.00 O ATOM 242 CB ALA A 17 -4.823 13.559 -10.779 1.00 0.00 C ATOM 0 H ALA A 17 -3.736 14.258 -8.712 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.443 14.286 -9.479 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -5.471 13.185 -11.571 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.487 14.565 -11.030 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -3.959 12.903 -10.677 1.00 0.00 H new ATOM 248 N PHE A 18 -5.571 11.230 -8.596 1.00 0.00 N ATOM 249 CA PHE A 18 -6.154 9.912 -8.213 1.00 0.00 C ATOM 250 C PHE A 18 -7.200 10.003 -7.060 1.00 0.00 C ATOM 251 O PHE A 18 -8.314 9.503 -7.233 1.00 0.00 O ATOM 252 CB PHE A 18 -4.987 8.928 -7.920 1.00 0.00 C ATOM 253 CG PHE A 18 -5.377 7.459 -7.662 1.00 0.00 C ATOM 254 CD1 PHE A 18 -5.699 7.040 -6.365 1.00 0.00 C ATOM 255 CD2 PHE A 18 -5.385 6.526 -8.705 1.00 0.00 C ATOM 256 CE1 PHE A 18 -6.032 5.712 -6.118 1.00 0.00 C ATOM 257 CE2 PHE A 18 -5.717 5.198 -8.453 1.00 0.00 C ATOM 258 CZ PHE A 18 -6.041 4.793 -7.161 1.00 0.00 C ATOM 0 H PHE A 18 -4.579 11.317 -8.376 1.00 0.00 H new ATOM 0 HA PHE A 18 -6.740 9.527 -9.048 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.297 8.955 -8.764 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -4.441 9.294 -7.050 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.689 7.751 -5.552 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -5.133 6.837 -9.708 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -6.283 5.395 -5.117 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -5.723 4.481 -9.261 1.00 0.00 H new ATOM 0 HZ PHE A 18 -6.300 3.762 -6.969 1.00 0.00 H new ATOM 268 N MET A 19 -6.845 10.629 -5.917 1.00 0.00 N ATOM 269 CA MET A 19 -7.738 10.795 -4.740 1.00 0.00 C ATOM 270 C MET A 19 -9.065 11.567 -5.028 1.00 0.00 C ATOM 271 O MET A 19 -10.129 11.024 -4.723 1.00 0.00 O ATOM 272 CB MET A 19 -6.925 11.431 -3.585 1.00 0.00 C ATOM 273 CG MET A 19 -6.011 10.483 -2.788 1.00 0.00 C ATOM 274 SD MET A 19 -4.719 9.744 -3.806 1.00 0.00 S ATOM 275 CE MET A 19 -3.936 8.689 -2.577 1.00 0.00 C ATOM 0 H MET A 19 -5.921 11.039 -5.780 1.00 0.00 H new ATOM 0 HA MET A 19 -8.083 9.802 -4.452 1.00 0.00 H new ATOM 0 HB2 MET A 19 -6.310 12.230 -4.000 1.00 0.00 H new ATOM 0 HB3 MET A 19 -7.625 11.895 -2.890 1.00 0.00 H new ATOM 0 HG2 MET A 19 -5.551 11.033 -1.967 1.00 0.00 H new ATOM 0 HG3 MET A 19 -6.614 9.692 -2.343 1.00 0.00 H new ATOM 0 HE1 MET A 19 -3.095 8.164 -3.031 1.00 0.00 H new ATOM 0 HE2 MET A 19 -3.578 9.300 -1.748 1.00 0.00 H new ATOM 0 HE3 MET A 19 -4.660 7.963 -2.206 1.00 0.00 H new ATOM 285 N LYS A 20 -9.030 12.772 -5.640 1.00 0.00 N ATOM 286 CA LYS A 20 -10.263 13.480 -6.111 1.00 0.00 C ATOM 287 C LYS A 20 -11.149 12.698 -7.135 1.00 0.00 C ATOM 288 O LYS A 20 -12.379 12.769 -7.027 1.00 0.00 O ATOM 289 CB LYS A 20 -9.925 14.883 -6.690 1.00 0.00 C ATOM 290 CG LYS A 20 -9.366 15.951 -5.719 1.00 0.00 C ATOM 291 CD LYS A 20 -10.263 16.366 -4.530 1.00 0.00 C ATOM 292 CE LYS A 20 -11.589 17.050 -4.918 1.00 0.00 C ATOM 293 NZ LYS A 20 -12.348 17.468 -3.726 1.00 0.00 N ATOM 0 H LYS A 20 -8.166 13.282 -5.824 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.865 13.570 -5.206 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -9.200 14.748 -7.492 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -10.831 15.285 -7.144 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -8.423 15.581 -5.317 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -9.137 16.846 -6.297 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -10.489 15.479 -3.939 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -9.698 17.041 -3.887 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -11.383 17.919 -5.543 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -12.193 16.365 -5.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -13.234 17.925 -4.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -12.565 16.635 -3.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -11.781 18.140 -3.171 1.00 0.00 H new ATOM 307 N ALA A 21 -10.553 11.956 -8.094 1.00 0.00 N ATOM 308 CA ALA A 21 -11.309 11.085 -9.035 1.00 0.00 C ATOM 309 C ALA A 21 -12.030 9.841 -8.423 1.00 0.00 C ATOM 310 O ALA A 21 -13.072 9.450 -8.959 1.00 0.00 O ATOM 311 CB ALA A 21 -10.358 10.672 -10.172 1.00 0.00 C ATOM 0 H ALA A 21 -9.544 11.940 -8.241 1.00 0.00 H new ATOM 0 HA ALA A 21 -12.144 11.687 -9.393 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -10.889 10.032 -10.876 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -10.001 11.563 -10.689 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.509 10.129 -9.757 1.00 0.00 H new ATOM 317 N ILE A 22 -11.520 9.240 -7.322 1.00 0.00 N ATOM 318 CA ILE A 22 -12.239 8.168 -6.564 1.00 0.00 C ATOM 319 C ILE A 22 -13.314 8.765 -5.591 1.00 0.00 C ATOM 320 O ILE A 22 -14.483 8.383 -5.694 1.00 0.00 O ATOM 321 CB ILE A 22 -11.277 7.094 -5.929 1.00 0.00 C ATOM 322 CG1 ILE A 22 -10.233 7.645 -4.913 1.00 0.00 C ATOM 323 CG2 ILE A 22 -10.581 6.251 -7.028 1.00 0.00 C ATOM 324 CD1 ILE A 22 -9.427 6.608 -4.116 1.00 0.00 C ATOM 0 H ILE A 22 -10.608 9.476 -6.931 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.807 7.586 -7.289 1.00 0.00 H new ATOM 0 HB ILE A 22 -11.934 6.459 -5.335 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -9.530 8.276 -5.457 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -10.755 8.287 -4.204 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -9.923 5.518 -6.562 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -11.335 5.736 -7.623 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -9.995 6.906 -7.673 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.737 7.120 -3.446 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -10.108 5.989 -3.532 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -8.864 5.978 -4.804 1.00 0.00 H new ATOM 336 N GLY A 23 -12.943 9.700 -4.692 1.00 0.00 N ATOM 337 CA GLY A 23 -13.906 10.474 -3.872 1.00 0.00 C ATOM 338 C GLY A 23 -13.352 10.842 -2.480 1.00 0.00 C ATOM 339 O GLY A 23 -13.865 10.343 -1.476 1.00 0.00 O ATOM 0 H GLY A 23 -11.969 9.942 -4.512 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -14.175 11.387 -4.403 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.821 9.894 -3.751 1.00 0.00 H new ATOM 343 N LEU A 24 -12.323 11.712 -2.431 1.00 0.00 N ATOM 344 CA LEU A 24 -11.614 12.084 -1.172 1.00 0.00 C ATOM 345 C LEU A 24 -11.716 13.623 -0.877 1.00 0.00 C ATOM 346 O LEU A 24 -11.848 14.416 -1.818 1.00 0.00 O ATOM 347 CB LEU A 24 -10.120 11.643 -1.273 1.00 0.00 C ATOM 348 CG LEU A 24 -9.686 10.250 -0.736 1.00 0.00 C ATOM 349 CD1 LEU A 24 -9.328 10.254 0.759 1.00 0.00 C ATOM 350 CD2 LEU A 24 -10.660 9.100 -1.037 1.00 0.00 C ATOM 0 H LEU A 24 -11.954 12.181 -3.258 1.00 0.00 H new ATOM 0 HA LEU A 24 -12.095 11.567 -0.341 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -9.839 11.688 -2.325 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -9.524 12.392 -0.752 1.00 0.00 H new ATOM 0 HG LEU A 24 -8.781 10.050 -1.310 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -9.035 9.250 1.066 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -8.501 10.943 0.933 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -10.194 10.572 1.340 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -10.267 8.172 -0.621 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -11.629 9.317 -0.588 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -10.776 8.994 -2.116 1.00 0.00 H new ATOM 362 N PRO A 25 -11.608 14.094 0.404 1.00 0.00 N ATOM 363 CA PRO A 25 -11.609 15.541 0.745 1.00 0.00 C ATOM 364 C PRO A 25 -10.266 16.260 0.437 1.00 0.00 C ATOM 365 O PRO A 25 -9.191 15.663 0.534 1.00 0.00 O ATOM 366 CB PRO A 25 -11.881 15.517 2.263 1.00 0.00 C ATOM 367 CG PRO A 25 -11.345 14.179 2.771 1.00 0.00 C ATOM 368 CD PRO A 25 -11.427 13.221 1.581 1.00 0.00 C ATOM 0 HA PRO A 25 -12.338 16.098 0.156 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -11.384 16.350 2.761 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -12.947 15.613 2.469 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -10.319 14.277 3.124 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.937 13.813 3.610 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -10.521 12.622 1.493 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -12.260 12.526 1.690 1.00 0.00 H new ATOM 376 N GLU A 26 -10.342 17.573 0.159 1.00 0.00 N ATOM 377 CA GLU A 26 -9.139 18.449 0.033 1.00 0.00 C ATOM 378 C GLU A 26 -8.186 18.482 1.281 1.00 0.00 C ATOM 379 O GLU A 26 -6.969 18.512 1.093 1.00 0.00 O ATOM 380 CB GLU A 26 -9.610 19.867 -0.396 1.00 0.00 C ATOM 381 CG GLU A 26 -8.489 20.805 -0.901 1.00 0.00 C ATOM 382 CD GLU A 26 -9.003 22.186 -1.314 1.00 0.00 C ATOM 383 OE1 GLU A 26 -9.448 22.345 -2.472 1.00 0.00 O ATOM 384 OE2 GLU A 26 -8.958 23.121 -0.483 1.00 0.00 O ATOM 0 H GLU A 26 -11.224 18.064 0.015 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.501 18.008 -0.733 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.357 19.762 -1.183 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.105 20.341 0.452 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -7.741 20.922 -0.117 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -7.990 20.340 -1.751 1.00 0.00 H new ATOM 391 N GLU A 27 -8.718 18.441 2.525 1.00 0.00 N ATOM 392 CA GLU A 27 -7.897 18.375 3.765 1.00 0.00 C ATOM 393 C GLU A 27 -7.045 17.075 3.908 1.00 0.00 C ATOM 394 O GLU A 27 -5.832 17.205 4.084 1.00 0.00 O ATOM 395 CB GLU A 27 -8.808 18.636 4.998 1.00 0.00 C ATOM 396 CG GLU A 27 -8.042 18.881 6.317 1.00 0.00 C ATOM 397 CD GLU A 27 -8.967 19.142 7.509 1.00 0.00 C ATOM 398 OE1 GLU A 27 -9.479 18.165 8.100 1.00 0.00 O ATOM 399 OE2 GLU A 27 -9.185 20.323 7.861 1.00 0.00 O ATOM 0 H GLU A 27 -9.723 18.452 2.701 1.00 0.00 H new ATOM 0 HA GLU A 27 -7.146 19.163 3.700 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -9.438 19.501 4.792 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -9.472 17.782 5.131 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -7.416 18.015 6.533 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -7.374 19.733 6.190 1.00 0.00 H new ATOM 406 N LEU A 28 -7.630 15.855 3.829 1.00 0.00 N ATOM 407 CA LEU A 28 -6.836 14.585 3.914 1.00 0.00 C ATOM 408 C LEU A 28 -5.850 14.289 2.730 1.00 0.00 C ATOM 409 O LEU A 28 -4.868 13.572 2.937 1.00 0.00 O ATOM 410 CB LEU A 28 -7.742 13.347 4.171 1.00 0.00 C ATOM 411 CG LEU A 28 -8.640 13.339 5.444 1.00 0.00 C ATOM 412 CD1 LEU A 28 -9.524 12.075 5.469 1.00 0.00 C ATOM 413 CD2 LEU A 28 -7.844 13.441 6.762 1.00 0.00 C ATOM 0 H LEU A 28 -8.633 15.714 3.708 1.00 0.00 H new ATOM 0 HA LEU A 28 -6.192 14.769 4.774 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -8.392 13.226 3.305 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -7.099 12.468 4.212 1.00 0.00 H new ATOM 0 HG LEU A 28 -9.260 14.233 5.380 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -10.146 12.084 6.364 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -10.161 12.059 4.585 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.890 11.188 5.476 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.534 13.430 7.606 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.161 12.595 6.841 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -7.274 14.370 6.772 1.00 0.00 H new ATOM 425 N ILE A 29 -6.080 14.853 1.527 1.00 0.00 N ATOM 426 CA ILE A 29 -5.106 14.838 0.392 1.00 0.00 C ATOM 427 C ILE A 29 -3.866 15.730 0.718 1.00 0.00 C ATOM 428 O ILE A 29 -2.739 15.234 0.663 1.00 0.00 O ATOM 429 CB ILE A 29 -5.816 15.223 -0.959 1.00 0.00 C ATOM 430 CG1 ILE A 29 -6.991 14.264 -1.305 1.00 0.00 C ATOM 431 CG2 ILE A 29 -4.837 15.273 -2.163 1.00 0.00 C ATOM 432 CD1 ILE A 29 -7.927 14.728 -2.432 1.00 0.00 C ATOM 0 H ILE A 29 -6.949 15.337 1.304 1.00 0.00 H new ATOM 0 HA ILE A 29 -4.728 13.825 0.258 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.210 16.225 -0.790 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.574 13.295 -1.581 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.586 14.110 -0.405 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -5.384 15.544 -3.066 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -4.063 16.016 -1.972 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.376 14.295 -2.298 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -8.707 13.983 -2.587 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.383 15.679 -2.158 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.356 14.851 -3.352 1.00 0.00 H new ATOM 444 N GLN A 30 -4.074 17.019 1.054 1.00 0.00 N ATOM 445 CA GLN A 30 -2.982 17.954 1.444 1.00 0.00 C ATOM 446 C GLN A 30 -2.208 17.627 2.764 1.00 0.00 C ATOM 447 O GLN A 30 -1.039 18.007 2.875 1.00 0.00 O ATOM 448 CB GLN A 30 -3.544 19.406 1.427 1.00 0.00 C ATOM 449 CG GLN A 30 -3.451 20.167 0.080 1.00 0.00 C ATOM 450 CD GLN A 30 -3.927 19.454 -1.203 1.00 0.00 C ATOM 451 OE1 GLN A 30 -3.125 19.026 -2.032 1.00 0.00 O ATOM 452 NE2 GLN A 30 -5.224 19.309 -1.396 1.00 0.00 N ATOM 0 H GLN A 30 -5.000 17.447 1.065 1.00 0.00 H new ATOM 0 HA GLN A 30 -2.198 17.829 0.697 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -4.591 19.370 1.727 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -3.015 19.986 2.184 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -4.025 21.088 0.180 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -2.410 20.454 -0.067 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -5.885 19.665 -0.706 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -5.565 18.840 -2.235 1.00 0.00 H new ATOM 461 N LYS A 31 -2.820 16.909 3.729 1.00 0.00 N ATOM 462 CA LYS A 31 -2.113 16.339 4.904 1.00 0.00 C ATOM 463 C LYS A 31 -1.266 15.090 4.516 1.00 0.00 C ATOM 464 O LYS A 31 -0.045 15.126 4.689 1.00 0.00 O ATOM 465 CB LYS A 31 -3.146 16.036 6.027 1.00 0.00 C ATOM 466 CG LYS A 31 -3.713 17.253 6.794 1.00 0.00 C ATOM 467 CD LYS A 31 -2.726 17.885 7.798 1.00 0.00 C ATOM 468 CE LYS A 31 -3.331 19.086 8.548 1.00 0.00 C ATOM 469 NZ LYS A 31 -2.382 19.645 9.527 1.00 0.00 N ATOM 0 H LYS A 31 -3.820 16.706 3.719 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.400 17.071 5.284 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.981 15.493 5.584 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.678 15.367 6.749 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -4.017 18.013 6.074 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -4.611 16.944 7.330 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -2.415 17.130 8.520 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -1.830 18.207 7.267 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -3.614 19.858 7.832 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -4.242 18.776 9.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -2.821 20.452 10.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -2.131 18.915 10.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -1.523 19.963 9.035 1.00 0.00 H new ATOM 483 N GLY A 32 -1.887 14.018 3.976 1.00 0.00 N ATOM 484 CA GLY A 32 -1.165 12.789 3.566 1.00 0.00 C ATOM 485 C GLY A 32 -0.177 12.832 2.369 1.00 0.00 C ATOM 486 O GLY A 32 0.578 11.868 2.213 1.00 0.00 O ATOM 0 H GLY A 32 -2.893 13.978 3.812 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -0.608 12.436 4.434 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -1.916 12.032 3.339 1.00 0.00 H new ATOM 490 N LYS A 33 -0.143 13.908 1.552 1.00 0.00 N ATOM 491 CA LYS A 33 0.912 14.108 0.518 1.00 0.00 C ATOM 492 C LYS A 33 2.321 14.460 1.100 1.00 0.00 C ATOM 493 O LYS A 33 3.313 13.848 0.694 1.00 0.00 O ATOM 494 CB LYS A 33 0.419 15.072 -0.598 1.00 0.00 C ATOM 495 CG LYS A 33 0.314 16.574 -0.255 1.00 0.00 C ATOM 496 CD LYS A 33 -0.325 17.439 -1.359 1.00 0.00 C ATOM 497 CE LYS A 33 0.525 17.666 -2.624 1.00 0.00 C ATOM 498 NZ LYS A 33 1.722 18.496 -2.391 1.00 0.00 N ATOM 0 H LYS A 33 -0.834 14.657 1.585 1.00 0.00 H new ATOM 0 HA LYS A 33 1.081 13.141 0.045 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.090 14.969 -1.451 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -0.564 14.733 -0.924 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -0.269 16.685 0.659 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.313 16.956 -0.044 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.265 16.975 -1.657 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.571 18.412 -0.933 1.00 0.00 H new ATOM 0 HE2 LYS A 33 0.835 16.700 -3.021 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -0.093 18.140 -3.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 2.246 18.608 -3.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 1.433 19.431 -2.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 2.332 18.035 -1.686 1.00 0.00 H new ATOM 512 N ASP A 34 2.396 15.402 2.066 1.00 0.00 N ATOM 513 CA ASP A 34 3.629 15.684 2.851 1.00 0.00 C ATOM 514 C ASP A 34 4.041 14.558 3.859 1.00 0.00 C ATOM 515 O ASP A 34 5.243 14.334 4.029 1.00 0.00 O ATOM 516 CB ASP A 34 3.448 17.064 3.543 1.00 0.00 C ATOM 517 CG ASP A 34 4.732 17.665 4.135 1.00 0.00 C ATOM 518 OD1 ASP A 34 5.517 18.278 3.379 1.00 0.00 O ATOM 519 OD2 ASP A 34 4.961 17.519 5.356 1.00 0.00 O ATOM 0 H ASP A 34 1.605 15.991 2.327 1.00 0.00 H new ATOM 0 HA ASP A 34 4.470 15.709 2.158 1.00 0.00 H new ATOM 0 HB2 ASP A 34 3.036 17.766 2.818 1.00 0.00 H new ATOM 0 HB3 ASP A 34 2.712 16.960 4.340 1.00 0.00 H new ATOM 524 N ILE A 35 3.080 13.857 4.507 1.00 0.00 N ATOM 525 CA ILE A 35 3.363 12.726 5.440 1.00 0.00 C ATOM 526 C ILE A 35 3.792 11.491 4.582 1.00 0.00 C ATOM 527 O ILE A 35 3.072 11.068 3.670 1.00 0.00 O ATOM 528 CB ILE A 35 2.128 12.412 6.363 1.00 0.00 C ATOM 529 CG1 ILE A 35 1.611 13.631 7.194 1.00 0.00 C ATOM 530 CG2 ILE A 35 2.405 11.229 7.332 1.00 0.00 C ATOM 531 CD1 ILE A 35 0.151 13.509 7.666 1.00 0.00 C ATOM 0 H ILE A 35 2.085 14.055 4.402 1.00 0.00 H new ATOM 0 HA ILE A 35 4.173 12.994 6.119 1.00 0.00 H new ATOM 0 HB ILE A 35 1.343 12.141 5.657 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.252 13.758 8.066 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.710 14.534 6.591 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.524 11.050 7.948 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.633 10.332 6.756 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.252 11.474 7.972 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.123 14.398 8.234 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.505 13.415 6.800 1.00 0.00 H new ATOM 0 HD13 ILE A 35 0.045 12.627 8.298 1.00 0.00 H new ATOM 543 N LYS A 36 4.965 10.920 4.912 1.00 0.00 N ATOM 544 CA LYS A 36 5.533 9.760 4.178 1.00 0.00 C ATOM 545 C LYS A 36 4.947 8.453 4.779 1.00 0.00 C ATOM 546 O LYS A 36 5.312 8.046 5.888 1.00 0.00 O ATOM 547 CB LYS A 36 7.082 9.760 4.218 1.00 0.00 C ATOM 548 CG LYS A 36 7.803 10.943 3.526 1.00 0.00 C ATOM 549 CD LYS A 36 8.043 12.229 4.351 1.00 0.00 C ATOM 550 CE LYS A 36 9.111 12.158 5.463 1.00 0.00 C ATOM 551 NZ LYS A 36 8.627 11.544 6.713 1.00 0.00 N ATOM 0 H LYS A 36 5.546 11.241 5.686 1.00 0.00 H new ATOM 0 HA LYS A 36 5.255 9.830 3.126 1.00 0.00 H new ATOM 0 HB2 LYS A 36 7.394 9.737 5.262 1.00 0.00 H new ATOM 0 HB3 LYS A 36 7.433 8.835 3.760 1.00 0.00 H new ATOM 0 HG2 LYS A 36 8.771 10.585 3.176 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.225 11.216 2.643 1.00 0.00 H new ATOM 0 HD2 LYS A 36 8.323 13.026 3.662 1.00 0.00 H new ATOM 0 HD3 LYS A 36 7.097 12.520 4.808 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.966 11.590 5.097 1.00 0.00 H new ATOM 0 HE3 LYS A 36 9.466 13.166 5.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 9.113 11.977 7.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 7.602 11.698 6.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 8.823 10.523 6.697 1.00 0.00 H new ATOM 565 N GLY A 37 4.013 7.826 4.045 1.00 0.00 N ATOM 566 CA GLY A 37 3.274 6.643 4.540 1.00 0.00 C ATOM 567 C GLY A 37 4.017 5.316 4.299 1.00 0.00 C ATOM 568 O GLY A 37 4.438 5.028 3.173 1.00 0.00 O ATOM 0 H GLY A 37 3.748 8.116 3.104 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.089 6.759 5.608 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.301 6.600 4.051 1.00 0.00 H new ATOM 572 N VAL A 38 4.144 4.505 5.366 1.00 0.00 N ATOM 573 CA VAL A 38 4.862 3.200 5.307 1.00 0.00 C ATOM 574 C VAL A 38 3.848 2.126 4.816 1.00 0.00 C ATOM 575 O VAL A 38 2.890 1.783 5.518 1.00 0.00 O ATOM 576 CB VAL A 38 5.548 2.790 6.656 1.00 0.00 C ATOM 577 CG1 VAL A 38 6.465 1.552 6.487 1.00 0.00 C ATOM 578 CG2 VAL A 38 6.396 3.903 7.316 1.00 0.00 C ATOM 0 H VAL A 38 3.761 4.724 6.286 1.00 0.00 H new ATOM 0 HA VAL A 38 5.694 3.291 4.608 1.00 0.00 H new ATOM 0 HB VAL A 38 4.703 2.571 7.309 1.00 0.00 H new ATOM 0 HG11 VAL A 38 6.920 1.303 7.446 1.00 0.00 H new ATOM 0 HG12 VAL A 38 5.874 0.707 6.135 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.247 1.775 5.761 1.00 0.00 H new ATOM 0 HG21 VAL A 38 6.831 3.528 8.243 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.194 4.204 6.637 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.762 4.762 7.534 1.00 0.00 H new ATOM 588 N SER A 39 4.103 1.595 3.610 1.00 0.00 N ATOM 589 CA SER A 39 3.347 0.454 3.052 1.00 0.00 C ATOM 590 C SER A 39 4.186 -0.823 3.268 1.00 0.00 C ATOM 591 O SER A 39 5.247 -1.012 2.668 1.00 0.00 O ATOM 592 CB SER A 39 3.040 0.691 1.565 1.00 0.00 C ATOM 593 OG SER A 39 2.193 -0.331 1.051 1.00 0.00 O ATOM 0 H SER A 39 4.837 1.941 2.992 1.00 0.00 H new ATOM 0 HA SER A 39 2.387 0.343 3.557 1.00 0.00 H new ATOM 0 HB2 SER A 39 2.562 1.662 1.439 1.00 0.00 H new ATOM 0 HB3 SER A 39 3.970 0.717 0.997 1.00 0.00 H new ATOM 0 HG SER A 39 2.010 -0.158 0.104 1.00 0.00 H new ATOM 599 N GLU A 40 3.665 -1.689 4.136 1.00 0.00 N ATOM 600 CA GLU A 40 4.252 -3.017 4.413 1.00 0.00 C ATOM 601 C GLU A 40 3.684 -4.073 3.428 1.00 0.00 C ATOM 602 O GLU A 40 2.554 -3.967 2.942 1.00 0.00 O ATOM 603 CB GLU A 40 3.936 -3.407 5.879 1.00 0.00 C ATOM 604 CG GLU A 40 4.701 -2.637 6.976 1.00 0.00 C ATOM 605 CD GLU A 40 3.881 -1.566 7.704 1.00 0.00 C ATOM 606 OE1 GLU A 40 3.834 -0.411 7.230 1.00 0.00 O ATOM 607 OE2 GLU A 40 3.274 -1.879 8.752 1.00 0.00 O ATOM 0 H GLU A 40 2.820 -1.497 4.674 1.00 0.00 H new ATOM 0 HA GLU A 40 5.333 -2.979 4.275 1.00 0.00 H new ATOM 0 HB2 GLU A 40 2.868 -3.268 6.046 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.142 -4.470 6.001 1.00 0.00 H new ATOM 0 HG2 GLU A 40 5.071 -3.352 7.711 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.573 -2.163 6.526 1.00 0.00 H new ATOM 614 N ILE A 41 4.499 -5.104 3.161 1.00 0.00 N ATOM 615 CA ILE A 41 4.043 -6.356 2.491 1.00 0.00 C ATOM 616 C ILE A 41 4.854 -7.486 3.202 1.00 0.00 C ATOM 617 O ILE A 41 6.080 -7.398 3.331 1.00 0.00 O ATOM 618 CB ILE A 41 4.231 -6.402 0.927 1.00 0.00 C ATOM 619 CG1 ILE A 41 3.659 -5.174 0.158 1.00 0.00 C ATOM 620 CG2 ILE A 41 3.623 -7.703 0.330 1.00 0.00 C ATOM 621 CD1 ILE A 41 4.128 -5.042 -1.298 1.00 0.00 C ATOM 0 H ILE A 41 5.491 -5.105 3.398 1.00 0.00 H new ATOM 0 HA ILE A 41 2.962 -6.455 2.592 1.00 0.00 H new ATOM 0 HB ILE A 41 5.312 -6.379 0.786 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.571 -5.233 0.169 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.935 -4.267 0.696 1.00 0.00 H new ATOM 0 HG21 ILE A 41 3.766 -7.709 -0.751 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.119 -8.570 0.767 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.557 -7.743 0.555 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.676 -4.158 -1.747 1.00 0.00 H new ATOM 0 HD12 ILE A 41 5.214 -4.947 -1.323 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.828 -5.927 -1.859 1.00 0.00 H new ATOM 633 N VAL A 42 4.160 -8.555 3.630 1.00 0.00 N ATOM 634 CA VAL A 42 4.793 -9.725 4.304 1.00 0.00 C ATOM 635 C VAL A 42 4.583 -10.931 3.341 1.00 0.00 C ATOM 636 O VAL A 42 3.463 -11.433 3.199 1.00 0.00 O ATOM 637 CB VAL A 42 4.212 -9.964 5.742 1.00 0.00 C ATOM 638 CG1 VAL A 42 4.883 -11.160 6.461 1.00 0.00 C ATOM 639 CG2 VAL A 42 4.308 -8.728 6.670 1.00 0.00 C ATOM 0 H VAL A 42 3.149 -8.642 3.524 1.00 0.00 H new ATOM 0 HA VAL A 42 5.856 -9.563 4.480 1.00 0.00 H new ATOM 0 HB VAL A 42 3.159 -10.181 5.563 1.00 0.00 H new ATOM 0 HG11 VAL A 42 4.444 -11.282 7.451 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.725 -12.069 5.880 1.00 0.00 H new ATOM 0 HG13 VAL A 42 5.952 -10.973 6.558 1.00 0.00 H new ATOM 0 HG21 VAL A 42 3.886 -8.972 7.645 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.353 -8.442 6.788 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.752 -7.899 6.231 1.00 0.00 H new ATOM 649 N GLN A 43 5.676 -11.400 2.710 1.00 0.00 N ATOM 650 CA GLN A 43 5.634 -12.541 1.757 1.00 0.00 C ATOM 651 C GLN A 43 5.554 -13.895 2.516 1.00 0.00 C ATOM 652 O GLN A 43 6.478 -14.275 3.243 1.00 0.00 O ATOM 653 CB GLN A 43 6.863 -12.461 0.809 1.00 0.00 C ATOM 654 CG GLN A 43 6.938 -13.564 -0.275 1.00 0.00 C ATOM 655 CD GLN A 43 8.010 -13.307 -1.351 1.00 0.00 C ATOM 656 OE1 GLN A 43 9.181 -13.078 -1.050 1.00 0.00 O ATOM 657 NE2 GLN A 43 7.641 -13.361 -2.621 1.00 0.00 N ATOM 0 H GLN A 43 6.608 -11.007 2.840 1.00 0.00 H new ATOM 0 HA GLN A 43 4.733 -12.479 1.147 1.00 0.00 H new ATOM 0 HB2 GLN A 43 6.857 -11.489 0.315 1.00 0.00 H new ATOM 0 HB3 GLN A 43 7.770 -12.506 1.412 1.00 0.00 H new ATOM 0 HG2 GLN A 43 7.142 -14.520 0.207 1.00 0.00 H new ATOM 0 HG3 GLN A 43 5.965 -13.652 -0.759 1.00 0.00 H new ATOM 0 HE21 GLN A 43 6.668 -13.551 -2.862 1.00 0.00 H new ATOM 0 HE22 GLN A 43 8.329 -13.212 -3.359 1.00 0.00 H new ATOM 666 N ASN A 44 4.444 -14.617 2.289 1.00 0.00 N ATOM 667 CA ASN A 44 4.285 -16.032 2.730 1.00 0.00 C ATOM 668 C ASN A 44 3.801 -16.888 1.514 1.00 0.00 C ATOM 669 O ASN A 44 2.701 -17.452 1.533 1.00 0.00 O ATOM 670 CB ASN A 44 3.320 -16.122 3.951 1.00 0.00 C ATOM 671 CG ASN A 44 3.764 -15.396 5.239 1.00 0.00 C ATOM 672 OD1 ASN A 44 4.819 -15.680 5.806 1.00 0.00 O ATOM 673 ND2 ASN A 44 2.972 -14.450 5.721 1.00 0.00 N ATOM 0 H ASN A 44 3.630 -14.248 1.798 1.00 0.00 H new ATOM 0 HA ASN A 44 5.241 -16.432 3.068 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.352 -15.721 3.650 1.00 0.00 H new ATOM 0 HB3 ASN A 44 3.169 -17.175 4.189 1.00 0.00 H new ATOM 0 HD21 ASN A 44 3.234 -13.949 6.570 1.00 0.00 H new ATOM 0 HD22 ASN A 44 2.100 -14.223 5.243 1.00 0.00 H new ATOM 680 N GLY A 45 4.627 -16.980 0.446 1.00 0.00 N ATOM 681 CA GLY A 45 4.268 -17.704 -0.797 1.00 0.00 C ATOM 682 C GLY A 45 3.164 -17.007 -1.626 1.00 0.00 C ATOM 683 O GLY A 45 3.389 -15.940 -2.204 1.00 0.00 O ATOM 0 H GLY A 45 5.555 -16.558 0.421 1.00 0.00 H new ATOM 0 HA2 GLY A 45 5.160 -17.812 -1.414 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.936 -18.709 -0.538 1.00 0.00 H new ATOM 687 N LYS A 46 1.969 -17.618 -1.626 1.00 0.00 N ATOM 688 CA LYS A 46 0.728 -17.002 -2.178 1.00 0.00 C ATOM 689 C LYS A 46 0.119 -15.877 -1.282 1.00 0.00 C ATOM 690 O LYS A 46 -0.295 -14.851 -1.825 1.00 0.00 O ATOM 691 CB LYS A 46 -0.332 -18.105 -2.447 1.00 0.00 C ATOM 692 CG LYS A 46 -0.031 -19.040 -3.639 1.00 0.00 C ATOM 693 CD LYS A 46 -1.088 -20.154 -3.813 1.00 0.00 C ATOM 694 CE LYS A 46 -0.974 -20.955 -5.126 1.00 0.00 C ATOM 695 NZ LYS A 46 0.243 -21.785 -5.208 1.00 0.00 N ATOM 0 H LYS A 46 1.824 -18.553 -1.246 1.00 0.00 H new ATOM 0 HA LYS A 46 1.018 -16.515 -3.109 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -0.435 -18.713 -1.548 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -1.295 -17.625 -2.619 1.00 0.00 H new ATOM 0 HG2 LYS A 46 0.020 -18.449 -4.553 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.949 -19.495 -3.498 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -1.008 -20.845 -2.974 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.080 -19.705 -3.763 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -1.849 -21.597 -5.227 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -0.988 -20.262 -5.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 0.255 -22.295 -6.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 1.084 -21.176 -5.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 0.249 -22.470 -4.425 1.00 0.00 H new ATOM 709 N HIS A 47 0.054 -16.061 0.057 1.00 0.00 N ATOM 710 CA HIS A 47 -0.517 -15.058 0.997 1.00 0.00 C ATOM 711 C HIS A 47 0.445 -13.852 1.186 1.00 0.00 C ATOM 712 O HIS A 47 1.591 -14.013 1.612 1.00 0.00 O ATOM 713 CB HIS A 47 -0.822 -15.722 2.370 1.00 0.00 C ATOM 714 CG HIS A 47 -2.136 -16.504 2.423 1.00 0.00 C ATOM 715 ND1 HIS A 47 -2.280 -17.841 2.098 1.00 0.00 N ATOM 716 CD2 HIS A 47 -3.372 -15.979 2.844 1.00 0.00 C ATOM 717 CE1 HIS A 47 -3.614 -18.003 2.361 1.00 0.00 C ATOM 718 NE2 HIS A 47 -4.365 -16.948 2.821 1.00 0.00 N ATOM 0 H HIS A 47 0.394 -16.905 0.519 1.00 0.00 H new ATOM 0 HA HIS A 47 -1.446 -14.684 0.567 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -0.003 -16.396 2.622 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -0.845 -14.947 3.136 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.528 -14.954 3.146 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -4.079 -18.966 2.206 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -5.353 -16.894 3.070 1.00 0.00 H new ATOM 726 N PHE A 48 -0.059 -12.653 0.864 1.00 0.00 N ATOM 727 CA PHE A 48 0.711 -11.386 0.959 1.00 0.00 C ATOM 728 C PHE A 48 -0.061 -10.434 1.901 1.00 0.00 C ATOM 729 O PHE A 48 -0.995 -9.742 1.477 1.00 0.00 O ATOM 730 CB PHE A 48 0.900 -10.758 -0.448 1.00 0.00 C ATOM 731 CG PHE A 48 1.921 -11.448 -1.363 1.00 0.00 C ATOM 732 CD1 PHE A 48 3.286 -11.236 -1.152 1.00 0.00 C ATOM 733 CD2 PHE A 48 1.510 -12.257 -2.430 1.00 0.00 C ATOM 734 CE1 PHE A 48 4.222 -11.809 -2.002 1.00 0.00 C ATOM 735 CE2 PHE A 48 2.457 -12.829 -3.279 1.00 0.00 C ATOM 736 CZ PHE A 48 3.813 -12.593 -3.070 1.00 0.00 C ATOM 0 H PHE A 48 -1.014 -12.524 0.529 1.00 0.00 H new ATOM 0 HA PHE A 48 1.707 -11.572 1.360 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.065 -10.752 -0.954 1.00 0.00 H new ATOM 0 HB3 PHE A 48 1.200 -9.718 -0.322 1.00 0.00 H new ATOM 0 HD1 PHE A 48 3.614 -10.624 -0.325 1.00 0.00 H new ATOM 0 HD2 PHE A 48 0.458 -12.438 -2.595 1.00 0.00 H new ATOM 0 HE1 PHE A 48 5.275 -11.643 -1.830 1.00 0.00 H new ATOM 0 HE2 PHE A 48 2.138 -13.455 -4.099 1.00 0.00 H new ATOM 0 HZ PHE A 48 4.545 -13.020 -3.739 1.00 0.00 H new ATOM 746 N LYS A 49 0.350 -10.399 3.184 1.00 0.00 N ATOM 747 CA LYS A 49 -0.298 -9.550 4.214 1.00 0.00 C ATOM 748 C LYS A 49 0.303 -8.122 4.163 1.00 0.00 C ATOM 749 O LYS A 49 1.382 -7.853 4.700 1.00 0.00 O ATOM 750 CB LYS A 49 -0.141 -10.211 5.602 1.00 0.00 C ATOM 751 CG LYS A 49 -1.012 -9.596 6.721 1.00 0.00 C ATOM 752 CD LYS A 49 -0.819 -10.244 8.112 1.00 0.00 C ATOM 753 CE LYS A 49 0.540 -10.007 8.806 1.00 0.00 C ATOM 754 NZ LYS A 49 0.770 -8.596 9.177 1.00 0.00 N ATOM 0 H LYS A 49 1.132 -10.951 3.537 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.366 -9.459 4.017 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -0.385 -11.270 5.513 1.00 0.00 H new ATOM 0 HB3 LYS A 49 0.905 -10.149 5.901 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.788 -8.532 6.795 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.061 -9.682 6.436 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -1.606 -9.876 8.771 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.966 -11.319 8.010 1.00 0.00 H new ATOM 0 HE2 LYS A 49 0.594 -10.624 9.703 1.00 0.00 H new ATOM 0 HE3 LYS A 49 1.340 -10.336 8.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 1.698 -8.505 9.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 0.748 -8.004 8.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 0.026 -8.284 9.833 1.00 0.00 H new ATOM 768 N PHE A 50 -0.448 -7.225 3.514 1.00 0.00 N ATOM 769 CA PHE A 50 -0.103 -5.783 3.449 1.00 0.00 C ATOM 770 C PHE A 50 -0.697 -5.031 4.665 1.00 0.00 C ATOM 771 O PHE A 50 -1.857 -5.250 5.027 1.00 0.00 O ATOM 772 CB PHE A 50 -0.472 -5.131 2.081 1.00 0.00 C ATOM 773 CG PHE A 50 -1.956 -4.847 1.753 1.00 0.00 C ATOM 774 CD1 PHE A 50 -2.579 -3.680 2.216 1.00 0.00 C ATOM 775 CD2 PHE A 50 -2.681 -5.733 0.951 1.00 0.00 C ATOM 776 CE1 PHE A 50 -3.908 -3.414 1.895 1.00 0.00 C ATOM 777 CE2 PHE A 50 -4.006 -5.459 0.618 1.00 0.00 C ATOM 778 CZ PHE A 50 -4.617 -4.299 1.088 1.00 0.00 C ATOM 0 H PHE A 50 -1.307 -7.466 3.020 1.00 0.00 H new ATOM 0 HA PHE A 50 0.982 -5.697 3.510 1.00 0.00 H new ATOM 0 HB2 PHE A 50 0.065 -4.185 2.014 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -0.081 -5.776 1.295 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.025 -2.982 2.826 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -2.212 -6.635 0.587 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.387 -2.523 2.272 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -4.559 -6.146 -0.005 1.00 0.00 H new ATOM 0 HZ PHE A 50 -5.643 -4.086 0.826 1.00 0.00 H new ATOM 788 N THR A 51 0.100 -4.121 5.246 1.00 0.00 N ATOM 789 CA THR A 51 -0.376 -3.218 6.329 1.00 0.00 C ATOM 790 C THR A 51 -0.003 -1.771 5.896 1.00 0.00 C ATOM 791 O THR A 51 1.088 -1.284 6.207 1.00 0.00 O ATOM 792 CB THR A 51 0.200 -3.646 7.716 1.00 0.00 C ATOM 793 OG1 THR A 51 0.038 -5.046 7.934 1.00 0.00 O ATOM 794 CG2 THR A 51 -0.475 -2.929 8.894 1.00 0.00 C ATOM 0 H THR A 51 1.078 -3.984 4.991 1.00 0.00 H new ATOM 0 HA THR A 51 -1.456 -3.275 6.466 1.00 0.00 H new ATOM 0 HB THR A 51 1.254 -3.371 7.679 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.409 -5.286 8.809 1.00 0.00 H new ATOM 0 HG21 THR A 51 -0.031 -3.269 9.830 1.00 0.00 H new ATOM 0 HG22 THR A 51 -0.333 -1.853 8.795 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.541 -3.155 8.895 1.00 0.00 H new ATOM 802 N ILE A 52 -0.912 -1.097 5.160 1.00 0.00 N ATOM 803 CA ILE A 52 -0.657 0.269 4.612 1.00 0.00 C ATOM 804 C ILE A 52 -1.156 1.340 5.624 1.00 0.00 C ATOM 805 O ILE A 52 -2.342 1.404 5.959 1.00 0.00 O ATOM 806 CB ILE A 52 -1.157 0.454 3.136 1.00 0.00 C ATOM 807 CG1 ILE A 52 -0.628 1.782 2.507 1.00 0.00 C ATOM 808 CG2 ILE A 52 -2.687 0.308 2.943 1.00 0.00 C ATOM 809 CD1 ILE A 52 -0.700 1.881 0.974 1.00 0.00 C ATOM 0 H ILE A 52 -1.832 -1.470 4.927 1.00 0.00 H new ATOM 0 HA ILE A 52 0.419 0.413 4.510 1.00 0.00 H new ATOM 0 HB ILE A 52 -0.723 -0.385 2.593 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -1.194 2.612 2.931 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.410 1.916 2.811 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -2.937 0.452 1.892 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -3.000 -0.688 3.257 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -3.203 1.057 3.544 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -0.306 2.845 0.653 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -0.108 1.081 0.530 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -1.737 1.787 0.652 1.00 0.00 H new ATOM 821 N THR A 53 -0.207 2.172 6.081 1.00 0.00 N ATOM 822 CA THR A 53 -0.465 3.241 7.084 1.00 0.00 C ATOM 823 C THR A 53 -0.510 4.596 6.322 1.00 0.00 C ATOM 824 O THR A 53 0.529 5.126 5.915 1.00 0.00 O ATOM 825 CB THR A 53 0.581 3.221 8.240 1.00 0.00 C ATOM 826 OG1 THR A 53 1.907 3.441 7.764 1.00 0.00 O ATOM 827 CG2 THR A 53 0.583 1.924 9.072 1.00 0.00 C ATOM 0 H THR A 53 0.764 2.130 5.771 1.00 0.00 H new ATOM 0 HA THR A 53 -1.422 3.076 7.580 1.00 0.00 H new ATOM 0 HB THR A 53 0.266 4.038 8.889 1.00 0.00 H new ATOM 0 HG1 THR A 53 2.113 2.793 7.058 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.339 1.994 9.854 1.00 0.00 H new ATOM 0 HG22 THR A 53 -0.397 1.782 9.527 1.00 0.00 H new ATOM 0 HG23 THR A 53 0.808 1.077 8.424 1.00 0.00 H new ATOM 835 N ALA A 54 -1.731 5.122 6.106 1.00 0.00 N ATOM 836 CA ALA A 54 -1.952 6.352 5.298 1.00 0.00 C ATOM 837 C ALA A 54 -2.267 7.565 6.212 1.00 0.00 C ATOM 838 O ALA A 54 -3.428 7.942 6.409 1.00 0.00 O ATOM 839 CB ALA A 54 -3.063 6.054 4.270 1.00 0.00 C ATOM 0 H ALA A 54 -2.589 4.716 6.480 1.00 0.00 H new ATOM 0 HA ALA A 54 -1.049 6.629 4.755 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -3.245 6.941 3.663 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -2.752 5.232 3.626 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -3.979 5.778 4.793 1.00 0.00 H new ATOM 845 N GLY A 55 -1.204 8.161 6.787 1.00 0.00 N ATOM 846 CA GLY A 55 -1.322 9.264 7.773 1.00 0.00 C ATOM 847 C GLY A 55 -2.097 8.930 9.070 1.00 0.00 C ATOM 848 O GLY A 55 -3.144 9.531 9.326 1.00 0.00 O ATOM 0 H GLY A 55 -0.240 7.895 6.585 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -0.319 9.590 8.046 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -1.811 10.109 7.288 1.00 0.00 H new ATOM 852 N SER A 56 -1.605 7.939 9.842 1.00 0.00 N ATOM 853 CA SER A 56 -2.356 7.292 10.958 1.00 0.00 C ATOM 854 C SER A 56 -3.753 6.708 10.552 1.00 0.00 C ATOM 855 O SER A 56 -4.794 7.123 11.072 1.00 0.00 O ATOM 856 CB SER A 56 -2.391 8.181 12.226 1.00 0.00 C ATOM 857 OG SER A 56 -1.081 8.515 12.674 1.00 0.00 O ATOM 0 H SER A 56 -0.668 7.556 9.714 1.00 0.00 H new ATOM 0 HA SER A 56 -1.782 6.404 11.221 1.00 0.00 H new ATOM 0 HB2 SER A 56 -2.947 9.095 12.014 1.00 0.00 H new ATOM 0 HB3 SER A 56 -2.925 7.660 13.021 1.00 0.00 H new ATOM 0 HG SER A 56 -1.142 9.078 13.474 1.00 0.00 H new ATOM 863 N LYS A 57 -3.755 5.747 9.605 1.00 0.00 N ATOM 864 CA LYS A 57 -4.989 5.071 9.127 1.00 0.00 C ATOM 865 C LYS A 57 -4.558 3.662 8.648 1.00 0.00 C ATOM 866 O LYS A 57 -4.055 3.498 7.532 1.00 0.00 O ATOM 867 CB LYS A 57 -5.697 5.920 8.031 1.00 0.00 C ATOM 868 CG LYS A 57 -7.040 5.383 7.476 1.00 0.00 C ATOM 869 CD LYS A 57 -8.150 5.050 8.498 1.00 0.00 C ATOM 870 CE LYS A 57 -8.640 6.247 9.335 1.00 0.00 C ATOM 871 NZ LYS A 57 -9.687 5.842 10.289 1.00 0.00 N ATOM 0 H LYS A 57 -2.906 5.415 9.148 1.00 0.00 H new ATOM 0 HA LYS A 57 -5.734 4.967 9.915 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -5.874 6.916 8.437 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -5.008 6.034 7.195 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -7.435 6.121 6.778 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -6.830 4.481 6.901 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -9.000 4.626 7.964 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -7.782 4.279 9.174 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -7.800 6.682 9.877 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -9.028 7.021 8.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -9.996 6.670 10.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -10.497 5.449 9.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -9.308 5.121 10.935 1.00 0.00 H new ATOM 885 N VAL A 58 -4.738 2.655 9.524 1.00 0.00 N ATOM 886 CA VAL A 58 -4.123 1.310 9.344 1.00 0.00 C ATOM 887 C VAL A 58 -5.153 0.426 8.575 1.00 0.00 C ATOM 888 O VAL A 58 -6.148 -0.025 9.154 1.00 0.00 O ATOM 889 CB VAL A 58 -3.685 0.685 10.718 1.00 0.00 C ATOM 890 CG1 VAL A 58 -2.911 -0.639 10.529 1.00 0.00 C ATOM 891 CG2 VAL A 58 -2.825 1.611 11.617 1.00 0.00 C ATOM 0 H VAL A 58 -5.304 2.740 10.368 1.00 0.00 H new ATOM 0 HA VAL A 58 -3.204 1.381 8.763 1.00 0.00 H new ATOM 0 HB VAL A 58 -4.634 0.517 11.227 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -2.627 -1.037 11.503 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.545 -1.360 10.013 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -2.014 -0.455 9.937 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -2.574 1.090 12.541 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -1.909 1.880 11.091 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -3.387 2.515 11.852 1.00 0.00 H new ATOM 901 N ILE A 59 -4.896 0.202 7.273 1.00 0.00 N ATOM 902 CA ILE A 59 -5.798 -0.583 6.383 1.00 0.00 C ATOM 903 C ILE A 59 -5.035 -1.905 6.073 1.00 0.00 C ATOM 904 O ILE A 59 -4.082 -1.913 5.288 1.00 0.00 O ATOM 905 CB ILE A 59 -6.221 0.233 5.109 1.00 0.00 C ATOM 906 CG1 ILE A 59 -6.832 1.645 5.378 1.00 0.00 C ATOM 907 CG2 ILE A 59 -7.162 -0.573 4.176 1.00 0.00 C ATOM 908 CD1 ILE A 59 -8.026 1.724 6.347 1.00 0.00 C ATOM 0 H ILE A 59 -4.063 0.555 6.802 1.00 0.00 H new ATOM 0 HA ILE A 59 -6.751 -0.811 6.860 1.00 0.00 H new ATOM 0 HB ILE A 59 -5.268 0.410 4.610 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -6.041 2.287 5.765 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -7.145 2.065 4.422 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -7.425 0.035 3.311 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -6.655 -1.479 3.842 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -8.068 -0.843 4.718 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -8.350 2.761 6.442 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -8.848 1.121 5.961 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -7.727 1.347 7.325 1.00 0.00 H new ATOM 920 N GLN A 60 -5.458 -3.006 6.724 1.00 0.00 N ATOM 921 CA GLN A 60 -4.718 -4.293 6.702 1.00 0.00 C ATOM 922 C GLN A 60 -5.616 -5.395 6.082 1.00 0.00 C ATOM 923 O GLN A 60 -6.686 -5.719 6.608 1.00 0.00 O ATOM 924 CB GLN A 60 -4.262 -4.631 8.148 1.00 0.00 C ATOM 925 CG GLN A 60 -3.179 -5.726 8.297 1.00 0.00 C ATOM 926 CD GLN A 60 -3.687 -7.176 8.291 1.00 0.00 C ATOM 927 OE1 GLN A 60 -3.805 -7.818 7.247 1.00 0.00 O ATOM 928 NE2 GLN A 60 -3.981 -7.725 9.459 1.00 0.00 N ATOM 0 H GLN A 60 -6.315 -3.034 7.277 1.00 0.00 H new ATOM 0 HA GLN A 60 -3.825 -4.223 6.080 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -3.887 -3.717 8.609 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -5.138 -4.939 8.718 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -2.459 -5.610 7.487 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -2.641 -5.554 9.229 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -3.879 -7.183 10.317 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -4.309 -8.690 9.501 1.00 0.00 H new ATOM 937 N ASN A 61 -5.137 -5.977 4.970 1.00 0.00 N ATOM 938 CA ASN A 61 -5.787 -7.145 4.305 1.00 0.00 C ATOM 939 C ASN A 61 -4.686 -8.075 3.709 1.00 0.00 C ATOM 940 O ASN A 61 -3.634 -7.613 3.253 1.00 0.00 O ATOM 941 CB ASN A 61 -6.777 -6.726 3.178 1.00 0.00 C ATOM 942 CG ASN A 61 -8.048 -5.965 3.600 1.00 0.00 C ATOM 943 OD1 ASN A 61 -9.067 -6.563 3.948 1.00 0.00 O ATOM 944 ND2 ASN A 61 -8.021 -4.641 3.564 1.00 0.00 N ATOM 0 H ASN A 61 -4.290 -5.660 4.498 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.368 -7.668 5.064 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -6.234 -6.106 2.465 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -7.084 -7.627 2.647 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -8.849 -4.107 3.826 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -7.172 -4.156 3.274 1.00 0.00 H new ATOM 951 N GLU A 62 -4.961 -9.396 3.681 1.00 0.00 N ATOM 952 CA GLU A 62 -4.068 -10.410 3.051 1.00 0.00 C ATOM 953 C GLU A 62 -4.700 -10.963 1.745 1.00 0.00 C ATOM 954 O GLU A 62 -5.808 -11.512 1.765 1.00 0.00 O ATOM 955 CB GLU A 62 -3.614 -11.524 4.042 1.00 0.00 C ATOM 956 CG GLU A 62 -4.649 -12.488 4.671 1.00 0.00 C ATOM 957 CD GLU A 62 -5.545 -11.860 5.744 1.00 0.00 C ATOM 958 OE1 GLU A 62 -5.060 -11.615 6.871 1.00 0.00 O ATOM 959 OE2 GLU A 62 -6.735 -11.601 5.461 1.00 0.00 O ATOM 0 H GLU A 62 -5.805 -9.796 4.092 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.144 -9.905 2.770 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -2.879 -12.137 3.521 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -3.094 -11.031 4.863 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.281 -12.887 3.878 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.118 -13.332 5.110 1.00 0.00 H new ATOM 966 N PHE A 63 -3.970 -10.820 0.621 1.00 0.00 N ATOM 967 CA PHE A 63 -4.394 -11.350 -0.702 1.00 0.00 C ATOM 968 C PHE A 63 -3.645 -12.659 -1.052 1.00 0.00 C ATOM 969 O PHE A 63 -2.419 -12.750 -0.949 1.00 0.00 O ATOM 970 CB PHE A 63 -4.280 -10.302 -1.839 1.00 0.00 C ATOM 971 CG PHE A 63 -2.917 -9.663 -2.172 1.00 0.00 C ATOM 972 CD1 PHE A 63 -1.997 -10.317 -3.000 1.00 0.00 C ATOM 973 CD2 PHE A 63 -2.640 -8.367 -1.730 1.00 0.00 C ATOM 974 CE1 PHE A 63 -0.828 -9.672 -3.392 1.00 0.00 C ATOM 975 CE2 PHE A 63 -1.462 -7.729 -2.111 1.00 0.00 C ATOM 976 CZ PHE A 63 -0.559 -8.380 -2.943 1.00 0.00 C ATOM 0 H PHE A 63 -3.072 -10.337 0.598 1.00 0.00 H new ATOM 0 HA PHE A 63 -5.455 -11.585 -0.614 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -4.647 -10.773 -2.751 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -4.968 -9.491 -1.600 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.195 -11.324 -3.335 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -3.344 -7.857 -1.089 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.128 -10.173 -4.045 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -1.251 -6.730 -1.760 1.00 0.00 H new ATOM 0 HZ PHE A 63 0.353 -7.884 -3.242 1.00 0.00 H new ATOM 986 N THR A 64 -4.417 -13.642 -1.529 1.00 0.00 N ATOM 987 CA THR A 64 -3.884 -14.942 -2.009 1.00 0.00 C ATOM 988 C THR A 64 -3.774 -14.864 -3.561 1.00 0.00 C ATOM 989 O THR A 64 -4.732 -14.495 -4.249 1.00 0.00 O ATOM 990 CB THR A 64 -4.818 -16.103 -1.543 1.00 0.00 C ATOM 991 OG1 THR A 64 -5.028 -16.039 -0.136 1.00 0.00 O ATOM 992 CG2 THR A 64 -4.279 -17.513 -1.843 1.00 0.00 C ATOM 0 H THR A 64 -5.432 -13.568 -1.597 1.00 0.00 H new ATOM 0 HA THR A 64 -2.897 -15.145 -1.592 1.00 0.00 H new ATOM 0 HB THR A 64 -5.737 -15.957 -2.111 1.00 0.00 H new ATOM 0 HG1 THR A 64 -5.751 -15.407 0.058 1.00 0.00 H new ATOM 0 HG21 THR A 64 -4.990 -18.258 -1.486 1.00 0.00 H new ATOM 0 HG22 THR A 64 -4.141 -17.629 -2.918 1.00 0.00 H new ATOM 0 HG23 THR A 64 -3.323 -17.652 -1.338 1.00 0.00 H new ATOM 1000 N VAL A 65 -2.607 -15.256 -4.102 1.00 0.00 N ATOM 1001 CA VAL A 65 -2.384 -15.353 -5.575 1.00 0.00 C ATOM 1002 C VAL A 65 -2.964 -16.723 -6.049 1.00 0.00 C ATOM 1003 O VAL A 65 -2.529 -17.787 -5.596 1.00 0.00 O ATOM 1004 CB VAL A 65 -0.870 -15.155 -5.919 1.00 0.00 C ATOM 1005 CG1 VAL A 65 -0.462 -15.461 -7.380 1.00 0.00 C ATOM 1006 CG2 VAL A 65 -0.370 -13.727 -5.594 1.00 0.00 C ATOM 0 H VAL A 65 -1.792 -15.515 -3.546 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.901 -14.558 -6.112 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.397 -15.900 -5.279 1.00 0.00 H new ATOM 0 HG11 VAL A 65 0.607 -15.290 -7.503 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -0.692 -16.501 -7.612 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -1.014 -14.808 -8.056 1.00 0.00 H new ATOM 0 HG21 VAL A 65 0.686 -13.644 -5.852 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.943 -13.001 -6.171 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.501 -13.529 -4.530 1.00 0.00 H new ATOM 1016 N GLY A 66 -3.956 -16.664 -6.948 1.00 0.00 N ATOM 1017 CA GLY A 66 -4.746 -17.857 -7.352 1.00 0.00 C ATOM 1018 C GLY A 66 -6.063 -18.186 -6.589 1.00 0.00 C ATOM 1019 O GLY A 66 -6.715 -19.166 -6.959 1.00 0.00 O ATOM 0 H GLY A 66 -4.239 -15.803 -7.416 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -4.997 -17.744 -8.407 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.093 -18.726 -7.271 1.00 0.00 H new ATOM 1023 N GLU A 67 -6.484 -17.386 -5.584 1.00 0.00 N ATOM 1024 CA GLU A 67 -7.851 -17.442 -5.002 1.00 0.00 C ATOM 1025 C GLU A 67 -8.303 -15.998 -4.622 1.00 0.00 C ATOM 1026 O GLU A 67 -7.531 -15.215 -4.057 1.00 0.00 O ATOM 1027 CB GLU A 67 -7.851 -18.402 -3.779 1.00 0.00 C ATOM 1028 CG GLU A 67 -9.249 -18.722 -3.211 1.00 0.00 C ATOM 1029 CD GLU A 67 -9.202 -19.705 -2.040 1.00 0.00 C ATOM 1030 OE1 GLU A 67 -8.986 -19.264 -0.889 1.00 0.00 O ATOM 1031 OE2 GLU A 67 -9.383 -20.923 -2.262 1.00 0.00 O ATOM 0 H GLU A 67 -5.887 -16.681 -5.151 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.565 -17.834 -5.726 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.368 -19.336 -4.067 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -7.245 -17.961 -2.988 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.724 -17.797 -2.884 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.872 -19.137 -4.003 1.00 0.00 H new ATOM 1038 N GLU A 68 -9.579 -15.663 -4.911 1.00 0.00 N ATOM 1039 CA GLU A 68 -10.136 -14.300 -4.679 1.00 0.00 C ATOM 1040 C GLU A 68 -10.316 -13.982 -3.170 1.00 0.00 C ATOM 1041 O GLU A 68 -11.026 -14.687 -2.444 1.00 0.00 O ATOM 1042 CB GLU A 68 -11.496 -14.098 -5.403 1.00 0.00 C ATOM 1043 CG GLU A 68 -11.404 -13.980 -6.937 1.00 0.00 C ATOM 1044 CD GLU A 68 -12.760 -13.712 -7.590 1.00 0.00 C ATOM 1045 OE1 GLU A 68 -13.481 -14.682 -7.911 1.00 0.00 O ATOM 1046 OE2 GLU A 68 -13.114 -12.527 -7.784 1.00 0.00 O ATOM 0 H GLU A 68 -10.252 -16.319 -5.308 1.00 0.00 H new ATOM 0 HA GLU A 68 -9.402 -13.611 -5.096 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -12.150 -14.934 -5.156 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -11.969 -13.197 -5.012 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -10.716 -13.175 -7.195 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -10.985 -14.900 -7.344 1.00 0.00 H new ATOM 1053 N CYS A 69 -9.676 -12.882 -2.749 1.00 0.00 N ATOM 1054 CA CYS A 69 -9.849 -12.298 -1.394 1.00 0.00 C ATOM 1055 C CYS A 69 -10.638 -10.961 -1.471 1.00 0.00 C ATOM 1056 O CYS A 69 -10.562 -10.215 -2.453 1.00 0.00 O ATOM 1057 CB CYS A 69 -8.466 -12.081 -0.745 1.00 0.00 C ATOM 1058 SG CYS A 69 -7.634 -13.678 -0.445 1.00 0.00 S ATOM 0 H CYS A 69 -9.020 -12.364 -3.334 1.00 0.00 H new ATOM 0 HA CYS A 69 -10.424 -12.990 -0.778 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -7.848 -11.460 -1.394 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -8.581 -11.543 0.196 1.00 0.00 H new ATOM 0 HG CYS A 69 -6.473 -13.467 0.099 1.00 0.00 H new ATOM 1064 N GLU A 70 -11.367 -10.661 -0.381 1.00 0.00 N ATOM 1065 CA GLU A 70 -12.107 -9.380 -0.210 1.00 0.00 C ATOM 1066 C GLU A 70 -11.146 -8.279 0.332 1.00 0.00 C ATOM 1067 O GLU A 70 -10.585 -8.420 1.423 1.00 0.00 O ATOM 1068 CB GLU A 70 -13.405 -9.607 0.614 1.00 0.00 C ATOM 1069 CG GLU A 70 -13.286 -10.078 2.075 1.00 0.00 C ATOM 1070 CD GLU A 70 -13.355 -8.974 3.137 1.00 0.00 C ATOM 1071 OE1 GLU A 70 -14.469 -8.478 3.413 1.00 0.00 O ATOM 1072 OE2 GLU A 70 -12.304 -8.606 3.706 1.00 0.00 O ATOM 0 H GLU A 70 -11.465 -11.295 0.412 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.457 -9.002 -1.171 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -13.963 -8.671 0.614 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -14.011 -10.339 0.080 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -14.082 -10.796 2.272 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -12.341 -10.609 2.190 1.00 0.00 H new ATOM 1079 N LEU A 71 -10.902 -7.232 -0.479 1.00 0.00 N ATOM 1080 CA LEU A 71 -9.749 -6.307 -0.280 1.00 0.00 C ATOM 1081 C LEU A 71 -10.234 -4.837 -0.348 1.00 0.00 C ATOM 1082 O LEU A 71 -10.858 -4.423 -1.332 1.00 0.00 O ATOM 1083 CB LEU A 71 -8.647 -6.533 -1.359 1.00 0.00 C ATOM 1084 CG LEU A 71 -8.005 -7.944 -1.462 1.00 0.00 C ATOM 1085 CD1 LEU A 71 -7.112 -8.051 -2.711 1.00 0.00 C ATOM 1086 CD2 LEU A 71 -7.240 -8.367 -0.194 1.00 0.00 C ATOM 0 H LEU A 71 -11.485 -6.998 -1.283 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.321 -6.514 0.701 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.077 -6.290 -2.331 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -7.848 -5.815 -1.175 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.832 -8.647 -1.559 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.674 -9.048 -2.761 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.712 -7.873 -3.604 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.317 -7.308 -2.654 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.819 -9.362 -0.338 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.436 -7.657 -0.000 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.923 -8.382 0.655 1.00 0.00 H new ATOM 1098 N GLU A 72 -9.881 -4.038 0.679 1.00 0.00 N ATOM 1099 CA GLU A 72 -10.168 -2.581 0.695 1.00 0.00 C ATOM 1100 C GLU A 72 -9.139 -1.794 -0.159 1.00 0.00 C ATOM 1101 O GLU A 72 -7.922 -1.988 -0.053 1.00 0.00 O ATOM 1102 CB GLU A 72 -10.234 -2.056 2.157 1.00 0.00 C ATOM 1103 CG GLU A 72 -10.716 -0.589 2.279 1.00 0.00 C ATOM 1104 CD GLU A 72 -11.048 -0.141 3.701 1.00 0.00 C ATOM 1105 OE1 GLU A 72 -11.971 -0.710 4.324 1.00 0.00 O ATOM 1106 OE2 GLU A 72 -10.401 0.808 4.191 1.00 0.00 O ATOM 0 H GLU A 72 -9.396 -4.373 1.511 1.00 0.00 H new ATOM 0 HA GLU A 72 -11.145 -2.418 0.240 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -10.903 -2.696 2.732 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -9.245 -2.141 2.608 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -9.944 0.067 1.877 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -11.601 -0.459 1.656 1.00 0.00 H new ATOM 1113 N THR A 73 -9.677 -0.866 -0.968 1.00 0.00 N ATOM 1114 CA THR A 73 -8.870 0.056 -1.811 1.00 0.00 C ATOM 1115 C THR A 73 -8.249 1.196 -0.942 1.00 0.00 C ATOM 1116 O THR A 73 -7.051 1.129 -0.652 1.00 0.00 O ATOM 1117 CB THR A 73 -9.659 0.538 -3.071 1.00 0.00 C ATOM 1118 OG1 THR A 73 -10.823 1.276 -2.711 1.00 0.00 O ATOM 1119 CG2 THR A 73 -10.087 -0.596 -4.016 1.00 0.00 C ATOM 0 H THR A 73 -10.683 -0.727 -1.062 1.00 0.00 H new ATOM 0 HA THR A 73 -8.022 -0.490 -2.224 1.00 0.00 H new ATOM 0 HB THR A 73 -8.950 1.172 -3.604 1.00 0.00 H new ATOM 0 HG1 THR A 73 -11.374 1.426 -3.507 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.629 -0.178 -4.864 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.203 -1.124 -4.374 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.733 -1.292 -3.480 1.00 0.00 H new ATOM 1127 N MET A 74 -9.047 2.201 -0.515 1.00 0.00 N ATOM 1128 CA MET A 74 -8.544 3.398 0.181 1.00 0.00 C ATOM 1129 C MET A 74 -9.355 3.624 1.495 1.00 0.00 C ATOM 1130 O MET A 74 -8.838 3.325 2.575 1.00 0.00 O ATOM 1131 CB MET A 74 -8.588 4.525 -0.879 1.00 0.00 C ATOM 1132 CG MET A 74 -7.913 5.822 -0.450 1.00 0.00 C ATOM 1133 SD MET A 74 -6.132 5.608 -0.186 1.00 0.00 S ATOM 1134 CE MET A 74 -5.521 5.256 -1.850 1.00 0.00 C ATOM 0 H MET A 74 -10.059 2.201 -0.646 1.00 0.00 H new ATOM 0 HA MET A 74 -7.519 3.328 0.544 1.00 0.00 H new ATOM 0 HB2 MET A 74 -8.112 4.167 -1.792 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.629 4.736 -1.124 1.00 0.00 H new ATOM 0 HG2 MET A 74 -8.077 6.585 -1.211 1.00 0.00 H new ATOM 0 HG3 MET A 74 -8.374 6.184 0.469 1.00 0.00 H new ATOM 0 HE1 MET A 74 -4.435 5.352 -1.867 1.00 0.00 H new ATOM 0 HE2 MET A 74 -5.800 4.241 -2.133 1.00 0.00 H new ATOM 0 HE3 MET A 74 -5.958 5.963 -2.555 1.00 0.00 H new ATOM 1144 N THR A 75 -10.594 4.156 1.405 1.00 0.00 N ATOM 1145 CA THR A 75 -11.380 4.623 2.585 1.00 0.00 C ATOM 1146 C THR A 75 -12.323 3.525 3.162 1.00 0.00 C ATOM 1147 O THR A 75 -12.165 3.176 4.336 1.00 0.00 O ATOM 1148 CB THR A 75 -12.121 5.968 2.297 1.00 0.00 C ATOM 1149 OG1 THR A 75 -12.962 5.863 1.149 1.00 0.00 O ATOM 1150 CG2 THR A 75 -11.185 7.176 2.108 1.00 0.00 C ATOM 0 H THR A 75 -11.083 4.277 0.518 1.00 0.00 H new ATOM 0 HA THR A 75 -10.657 4.828 3.375 1.00 0.00 H new ATOM 0 HB THR A 75 -12.715 6.149 3.193 1.00 0.00 H new ATOM 0 HG1 THR A 75 -13.414 6.719 0.995 1.00 0.00 H new ATOM 0 HG21 THR A 75 -11.779 8.069 1.912 1.00 0.00 H new ATOM 0 HG22 THR A 75 -10.594 7.324 3.012 1.00 0.00 H new ATOM 0 HG23 THR A 75 -10.519 6.992 1.265 1.00 0.00 H new ATOM 1158 N GLY A 76 -13.295 3.004 2.381 1.00 0.00 N ATOM 1159 CA GLY A 76 -14.274 2.022 2.898 1.00 0.00 C ATOM 1160 C GLY A 76 -15.033 1.252 1.803 1.00 0.00 C ATOM 1161 O GLY A 76 -16.211 1.522 1.554 1.00 0.00 O ATOM 0 H GLY A 76 -13.422 3.245 1.398 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -13.753 1.307 3.535 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -14.996 2.542 3.527 1.00 0.00 H new ATOM 1165 N GLU A 77 -14.361 0.250 1.214 1.00 0.00 N ATOM 1166 CA GLU A 77 -15.009 -0.822 0.405 1.00 0.00 C ATOM 1167 C GLU A 77 -14.357 -2.201 0.743 1.00 0.00 C ATOM 1168 O GLU A 77 -13.315 -2.273 1.400 1.00 0.00 O ATOM 1169 CB GLU A 77 -14.993 -0.474 -1.115 1.00 0.00 C ATOM 1170 CG GLU A 77 -13.616 -0.438 -1.821 1.00 0.00 C ATOM 1171 CD GLU A 77 -13.727 -0.129 -3.318 1.00 0.00 C ATOM 1172 OE1 GLU A 77 -13.704 1.064 -3.694 1.00 0.00 O ATOM 1173 OE2 GLU A 77 -13.831 -1.077 -4.125 1.00 0.00 O ATOM 0 H GLU A 77 -13.348 0.151 1.279 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.064 -0.895 0.669 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -15.619 -1.200 -1.634 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -15.463 0.501 -1.243 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -12.988 0.314 -1.344 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -13.119 -1.399 -1.688 1.00 0.00 H new ATOM 1180 N LYS A 78 -14.956 -3.315 0.282 1.00 0.00 N ATOM 1181 CA LYS A 78 -14.245 -4.622 0.205 1.00 0.00 C ATOM 1182 C LYS A 78 -14.717 -5.314 -1.096 1.00 0.00 C ATOM 1183 O LYS A 78 -15.865 -5.763 -1.201 1.00 0.00 O ATOM 1184 CB LYS A 78 -14.418 -5.555 1.440 1.00 0.00 C ATOM 1185 CG LYS A 78 -13.719 -5.123 2.752 1.00 0.00 C ATOM 1186 CD LYS A 78 -14.594 -4.282 3.702 1.00 0.00 C ATOM 1187 CE LYS A 78 -13.820 -3.792 4.936 1.00 0.00 C ATOM 1188 NZ LYS A 78 -14.673 -2.960 5.803 1.00 0.00 N ATOM 0 H LYS A 78 -15.923 -3.345 -0.042 1.00 0.00 H new ATOM 0 HA LYS A 78 -13.174 -4.419 0.200 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -15.484 -5.655 1.642 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -14.050 -6.545 1.171 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -13.387 -6.016 3.281 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -12.826 -4.551 2.500 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -14.990 -3.423 3.161 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -15.448 -4.876 4.025 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -13.449 -4.648 5.500 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -12.950 -3.218 4.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -14.125 -2.643 6.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -15.007 -2.132 5.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -15.490 -3.517 6.124 1.00 0.00 H new ATOM 1202 N VAL A 79 -13.805 -5.368 -2.082 1.00 0.00 N ATOM 1203 CA VAL A 79 -14.101 -5.828 -3.464 1.00 0.00 C ATOM 1204 C VAL A 79 -13.274 -7.116 -3.765 1.00 0.00 C ATOM 1205 O VAL A 79 -12.065 -7.181 -3.508 1.00 0.00 O ATOM 1206 CB VAL A 79 -13.901 -4.637 -4.462 1.00 0.00 C ATOM 1207 CG1 VAL A 79 -12.449 -4.136 -4.650 1.00 0.00 C ATOM 1208 CG2 VAL A 79 -14.535 -4.927 -5.835 1.00 0.00 C ATOM 0 H VAL A 79 -12.832 -5.093 -1.949 1.00 0.00 H new ATOM 0 HA VAL A 79 -15.143 -6.125 -3.585 1.00 0.00 H new ATOM 0 HB VAL A 79 -14.424 -3.818 -3.969 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -12.438 -3.311 -5.363 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -12.055 -3.794 -3.693 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -11.829 -4.950 -5.027 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -14.374 -4.076 -6.497 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -14.075 -5.816 -6.268 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -15.605 -5.095 -5.714 1.00 0.00 H new ATOM 1218 N LYS A 80 -13.953 -8.135 -4.322 1.00 0.00 N ATOM 1219 CA LYS A 80 -13.374 -9.491 -4.516 1.00 0.00 C ATOM 1220 C LYS A 80 -12.552 -9.534 -5.836 1.00 0.00 C ATOM 1221 O LYS A 80 -13.101 -9.431 -6.937 1.00 0.00 O ATOM 1222 CB LYS A 80 -14.486 -10.579 -4.498 1.00 0.00 C ATOM 1223 CG LYS A 80 -15.058 -10.978 -3.113 1.00 0.00 C ATOM 1224 CD LYS A 80 -15.832 -9.914 -2.299 1.00 0.00 C ATOM 1225 CE LYS A 80 -17.104 -9.369 -2.979 1.00 0.00 C ATOM 1226 NZ LYS A 80 -17.786 -8.377 -2.128 1.00 0.00 N ATOM 0 H LYS A 80 -14.915 -8.050 -4.651 1.00 0.00 H new ATOM 0 HA LYS A 80 -12.699 -9.708 -3.688 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -15.312 -10.230 -5.118 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -14.089 -11.477 -4.972 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -15.722 -11.829 -3.262 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -14.227 -11.325 -2.499 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -16.109 -10.345 -1.337 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -15.163 -9.079 -2.093 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -16.841 -8.913 -3.933 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -17.784 -10.193 -3.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -18.628 -8.017 -2.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -18.073 -8.825 -1.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -17.139 -7.588 -1.928 1.00 0.00 H new ATOM 1240 N THR A 81 -11.226 -9.678 -5.681 1.00 0.00 N ATOM 1241 CA THR A 81 -10.263 -9.746 -6.812 1.00 0.00 C ATOM 1242 C THR A 81 -9.105 -10.723 -6.448 1.00 0.00 C ATOM 1243 O THR A 81 -8.711 -10.854 -5.282 1.00 0.00 O ATOM 1244 CB THR A 81 -9.771 -8.330 -7.248 1.00 0.00 C ATOM 1245 OG1 THR A 81 -8.990 -8.449 -8.434 1.00 0.00 O ATOM 1246 CG2 THR A 81 -8.946 -7.533 -6.218 1.00 0.00 C ATOM 0 H THR A 81 -10.781 -9.752 -4.766 1.00 0.00 H new ATOM 0 HA THR A 81 -10.768 -10.147 -7.691 1.00 0.00 H new ATOM 0 HB THR A 81 -10.691 -7.763 -7.386 1.00 0.00 H new ATOM 0 HG1 THR A 81 -8.073 -8.155 -8.253 1.00 0.00 H new ATOM 0 HG21 THR A 81 -8.666 -6.569 -6.643 1.00 0.00 H new ATOM 0 HG22 THR A 81 -9.542 -7.374 -5.319 1.00 0.00 H new ATOM 0 HG23 THR A 81 -8.046 -8.092 -5.962 1.00 0.00 H new ATOM 1254 N VAL A 82 -8.549 -11.374 -7.487 1.00 0.00 N ATOM 1255 CA VAL A 82 -7.362 -12.256 -7.351 1.00 0.00 C ATOM 1256 C VAL A 82 -6.165 -11.589 -8.085 1.00 0.00 C ATOM 1257 O VAL A 82 -6.269 -11.094 -9.214 1.00 0.00 O ATOM 1258 CB VAL A 82 -7.646 -13.733 -7.772 1.00 0.00 C ATOM 1259 CG1 VAL A 82 -8.032 -14.003 -9.236 1.00 0.00 C ATOM 1260 CG2 VAL A 82 -6.466 -14.649 -7.427 1.00 0.00 C ATOM 0 H VAL A 82 -8.903 -11.308 -8.441 1.00 0.00 H new ATOM 0 HA VAL A 82 -7.095 -12.354 -6.299 1.00 0.00 H new ATOM 0 HB VAL A 82 -8.540 -13.953 -7.188 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.198 -15.071 -9.377 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -8.945 -13.459 -9.478 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -7.227 -13.671 -9.892 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -6.696 -15.670 -7.733 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -5.574 -14.306 -7.950 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -6.288 -14.624 -6.352 1.00 0.00 H new ATOM 1270 N VAL A 83 -5.015 -11.639 -7.404 1.00 0.00 N ATOM 1271 CA VAL A 83 -3.738 -11.063 -7.889 1.00 0.00 C ATOM 1272 C VAL A 83 -2.950 -12.186 -8.637 1.00 0.00 C ATOM 1273 O VAL A 83 -2.916 -13.337 -8.192 1.00 0.00 O ATOM 1274 CB VAL A 83 -2.950 -10.445 -6.681 1.00 0.00 C ATOM 1275 CG1 VAL A 83 -1.704 -9.667 -7.150 1.00 0.00 C ATOM 1276 CG2 VAL A 83 -3.784 -9.522 -5.748 1.00 0.00 C ATOM 0 H VAL A 83 -4.935 -12.084 -6.490 1.00 0.00 H new ATOM 0 HA VAL A 83 -3.904 -10.249 -8.595 1.00 0.00 H new ATOM 0 HB VAL A 83 -2.664 -11.318 -6.094 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.186 -9.254 -6.284 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -1.035 -10.340 -7.687 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -2.009 -8.856 -7.811 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.149 -9.146 -4.946 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -4.177 -8.683 -6.323 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.611 -10.089 -5.321 1.00 0.00 H new ATOM 1286 N GLN A 84 -2.317 -11.837 -9.770 1.00 0.00 N ATOM 1287 CA GLN A 84 -1.426 -12.762 -10.529 1.00 0.00 C ATOM 1288 C GLN A 84 0.032 -12.249 -10.415 1.00 0.00 C ATOM 1289 O GLN A 84 0.325 -11.069 -10.634 1.00 0.00 O ATOM 1290 CB GLN A 84 -1.849 -12.882 -12.018 1.00 0.00 C ATOM 1291 CG GLN A 84 -2.965 -13.901 -12.357 1.00 0.00 C ATOM 1292 CD GLN A 84 -4.319 -13.714 -11.645 1.00 0.00 C ATOM 1293 OE1 GLN A 84 -4.961 -12.668 -11.744 1.00 0.00 O ATOM 1294 NE2 GLN A 84 -4.773 -14.721 -10.914 1.00 0.00 N ATOM 0 H GLN A 84 -2.401 -10.912 -10.193 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.507 -13.760 -10.099 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -2.175 -11.899 -12.357 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -0.965 -13.143 -12.600 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -3.140 -13.868 -13.432 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -2.595 -14.900 -12.125 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -4.232 -15.582 -10.840 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -5.664 -14.635 -10.425 1.00 0.00 H new ATOM 1303 N LEU A 85 0.946 -13.181 -10.112 1.00 0.00 N ATOM 1304 CA LEU A 85 2.394 -12.899 -9.999 1.00 0.00 C ATOM 1305 C LEU A 85 3.066 -13.201 -11.366 1.00 0.00 C ATOM 1306 O LEU A 85 3.249 -14.363 -11.745 1.00 0.00 O ATOM 1307 CB LEU A 85 2.963 -13.735 -8.815 1.00 0.00 C ATOM 1308 CG LEU A 85 4.490 -13.632 -8.562 1.00 0.00 C ATOM 1309 CD1 LEU A 85 4.987 -12.202 -8.262 1.00 0.00 C ATOM 1310 CD2 LEU A 85 4.927 -14.591 -7.439 1.00 0.00 C ATOM 0 H LEU A 85 0.707 -14.157 -9.937 1.00 0.00 H new ATOM 0 HA LEU A 85 2.599 -11.852 -9.776 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.446 -13.432 -7.905 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.716 -14.783 -8.988 1.00 0.00 H new ATOM 0 HG LEU A 85 4.958 -13.925 -9.502 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.064 -12.218 -8.097 1.00 0.00 H new ATOM 0 HD12 LEU A 85 4.759 -11.553 -9.107 1.00 0.00 H new ATOM 0 HD13 LEU A 85 4.489 -11.824 -7.369 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.002 -14.500 -7.281 1.00 0.00 H new ATOM 0 HD22 LEU A 85 4.402 -14.337 -6.518 1.00 0.00 H new ATOM 0 HD23 LEU A 85 4.687 -15.616 -7.722 1.00 0.00 H new ATOM 1322 N GLU A 86 3.461 -12.127 -12.069 1.00 0.00 N ATOM 1323 CA GLU A 86 4.289 -12.214 -13.295 1.00 0.00 C ATOM 1324 C GLU A 86 5.784 -12.212 -12.887 1.00 0.00 C ATOM 1325 O GLU A 86 6.305 -11.241 -12.327 1.00 0.00 O ATOM 1326 CB GLU A 86 3.954 -11.041 -14.252 1.00 0.00 C ATOM 1327 CG GLU A 86 2.731 -11.325 -15.141 1.00 0.00 C ATOM 1328 CD GLU A 86 2.414 -10.159 -16.080 1.00 0.00 C ATOM 1329 OE1 GLU A 86 1.737 -9.201 -15.646 1.00 0.00 O ATOM 1330 OE2 GLU A 86 2.846 -10.193 -17.254 1.00 0.00 O ATOM 0 H GLU A 86 3.218 -11.171 -11.808 1.00 0.00 H new ATOM 0 HA GLU A 86 4.074 -13.138 -13.831 1.00 0.00 H new ATOM 0 HB2 GLU A 86 3.769 -10.141 -13.665 1.00 0.00 H new ATOM 0 HB3 GLU A 86 4.818 -10.837 -14.885 1.00 0.00 H new ATOM 0 HG2 GLU A 86 2.913 -12.224 -15.730 1.00 0.00 H new ATOM 0 HG3 GLU A 86 1.865 -11.527 -14.511 1.00 0.00 H new ATOM 1337 N GLY A 87 6.436 -13.353 -13.156 1.00 0.00 N ATOM 1338 CA GLY A 87 7.842 -13.590 -12.761 1.00 0.00 C ATOM 1339 C GLY A 87 8.035 -13.774 -11.241 1.00 0.00 C ATOM 1340 O GLY A 87 7.473 -14.691 -10.635 1.00 0.00 O ATOM 0 H GLY A 87 6.010 -14.137 -13.651 1.00 0.00 H new ATOM 0 HA2 GLY A 87 8.210 -14.478 -13.275 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.451 -12.751 -13.097 1.00 0.00 H new ATOM 1344 N ASP A 88 8.832 -12.869 -10.658 1.00 0.00 N ATOM 1345 CA ASP A 88 9.020 -12.753 -9.179 1.00 0.00 C ATOM 1346 C ASP A 88 8.771 -11.317 -8.597 1.00 0.00 C ATOM 1347 O ASP A 88 8.801 -11.170 -7.371 1.00 0.00 O ATOM 1348 CB ASP A 88 10.442 -13.253 -8.791 1.00 0.00 C ATOM 1349 CG ASP A 88 10.676 -14.763 -8.967 1.00 0.00 C ATOM 1350 OD1 ASP A 88 10.273 -15.545 -8.078 1.00 0.00 O ATOM 1351 OD2 ASP A 88 11.255 -15.171 -9.998 1.00 0.00 O ATOM 0 H ASP A 88 9.374 -12.187 -11.189 1.00 0.00 H new ATOM 0 HA ASP A 88 8.252 -13.383 -8.729 1.00 0.00 H new ATOM 0 HB2 ASP A 88 11.175 -12.715 -9.392 1.00 0.00 H new ATOM 0 HB3 ASP A 88 10.630 -12.991 -7.750 1.00 0.00 H new ATOM 1356 N ASN A 89 8.524 -10.279 -9.431 1.00 0.00 N ATOM 1357 CA ASN A 89 8.404 -8.859 -8.986 1.00 0.00 C ATOM 1358 C ASN A 89 7.081 -8.106 -9.338 1.00 0.00 C ATOM 1359 O ASN A 89 6.891 -7.018 -8.788 1.00 0.00 O ATOM 1360 CB ASN A 89 9.655 -8.055 -9.443 1.00 0.00 C ATOM 1361 CG ASN A 89 9.822 -7.764 -10.954 1.00 0.00 C ATOM 1362 OD1 ASN A 89 9.941 -8.675 -11.772 1.00 0.00 O ATOM 1363 ND2 ASN A 89 9.849 -6.500 -11.352 1.00 0.00 N ATOM 0 H ASN A 89 8.401 -10.398 -10.437 1.00 0.00 H new ATOM 0 HA ASN A 89 8.354 -8.922 -7.899 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.647 -7.100 -8.918 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.540 -8.596 -9.108 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.969 -6.279 -12.341 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.750 -5.748 -10.670 1.00 0.00 H new ATOM 1370 N LYS A 90 6.201 -8.606 -10.233 1.00 0.00 N ATOM 1371 CA LYS A 90 5.093 -7.811 -10.815 1.00 0.00 C ATOM 1372 C LYS A 90 3.716 -8.419 -10.406 1.00 0.00 C ATOM 1373 O LYS A 90 3.201 -9.319 -11.073 1.00 0.00 O ATOM 1374 CB LYS A 90 5.383 -7.793 -12.342 1.00 0.00 C ATOM 1375 CG LYS A 90 4.468 -6.872 -13.159 1.00 0.00 C ATOM 1376 CD LYS A 90 4.747 -6.948 -14.672 1.00 0.00 C ATOM 1377 CE LYS A 90 3.814 -6.041 -15.492 1.00 0.00 C ATOM 1378 NZ LYS A 90 4.069 -6.178 -16.936 1.00 0.00 N ATOM 0 H LYS A 90 6.237 -9.567 -10.572 1.00 0.00 H new ATOM 0 HA LYS A 90 5.036 -6.786 -10.448 1.00 0.00 H new ATOM 0 HB2 LYS A 90 6.417 -7.486 -12.498 1.00 0.00 H new ATOM 0 HB3 LYS A 90 5.291 -8.808 -12.727 1.00 0.00 H new ATOM 0 HG2 LYS A 90 3.428 -7.140 -12.971 1.00 0.00 H new ATOM 0 HG3 LYS A 90 4.598 -5.844 -12.821 1.00 0.00 H new ATOM 0 HD2 LYS A 90 5.782 -6.664 -14.861 1.00 0.00 H new ATOM 0 HD3 LYS A 90 4.633 -7.979 -15.007 1.00 0.00 H new ATOM 0 HE2 LYS A 90 2.776 -6.295 -15.278 1.00 0.00 H new ATOM 0 HE3 LYS A 90 3.956 -5.003 -15.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 3.425 -5.554 -17.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 5.053 -5.912 -17.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.909 -7.164 -17.225 1.00 0.00 H new ATOM 1392 N LEU A 91 3.116 -7.900 -9.316 1.00 0.00 N ATOM 1393 CA LEU A 91 1.795 -8.367 -8.800 1.00 0.00 C ATOM 1394 C LEU A 91 0.649 -7.493 -9.398 1.00 0.00 C ATOM 1395 O LEU A 91 0.481 -6.329 -9.022 1.00 0.00 O ATOM 1396 CB LEU A 91 1.803 -8.335 -7.239 1.00 0.00 C ATOM 1397 CG LEU A 91 2.559 -9.483 -6.514 1.00 0.00 C ATOM 1398 CD1 LEU A 91 2.798 -9.139 -5.029 1.00 0.00 C ATOM 1399 CD2 LEU A 91 1.830 -10.838 -6.606 1.00 0.00 C ATOM 0 H LEU A 91 3.525 -7.147 -8.763 1.00 0.00 H new ATOM 0 HA LEU A 91 1.616 -9.396 -9.112 1.00 0.00 H new ATOM 0 HB2 LEU A 91 2.240 -7.388 -6.922 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.769 -8.340 -6.895 1.00 0.00 H new ATOM 0 HG LEU A 91 3.513 -9.581 -7.031 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.329 -9.960 -4.546 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.394 -8.229 -4.958 1.00 0.00 H new ATOM 0 HD13 LEU A 91 1.840 -8.985 -4.533 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.408 -11.598 -6.081 1.00 0.00 H new ATOM 0 HD22 LEU A 91 0.844 -10.752 -6.150 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.722 -11.123 -7.653 1.00 0.00 H new ATOM 1411 N VAL A 92 -0.127 -8.073 -10.336 1.00 0.00 N ATOM 1412 CA VAL A 92 -1.144 -7.337 -11.151 1.00 0.00 C ATOM 1413 C VAL A 92 -2.590 -7.690 -10.683 1.00 0.00 C ATOM 1414 O VAL A 92 -2.923 -8.871 -10.548 1.00 0.00 O ATOM 1415 CB VAL A 92 -0.955 -7.568 -12.694 1.00 0.00 C ATOM 1416 CG1 VAL A 92 0.374 -6.988 -13.220 1.00 0.00 C ATOM 1417 CG2 VAL A 92 -1.093 -9.028 -13.195 1.00 0.00 C ATOM 0 H VAL A 92 -0.074 -9.067 -10.558 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.988 -6.272 -10.982 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.804 -7.023 -13.107 1.00 0.00 H new ATOM 0 HG11 VAL A 92 0.454 -7.175 -14.291 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.400 -5.914 -13.036 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.208 -7.465 -12.705 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.942 -9.058 -14.274 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.345 -9.653 -12.706 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.089 -9.402 -12.958 1.00 0.00 H new ATOM 1427 N THR A 93 -3.452 -6.671 -10.457 1.00 0.00 N ATOM 1428 CA THR A 93 -4.855 -6.895 -9.980 1.00 0.00 C ATOM 1429 C THR A 93 -5.822 -5.748 -10.397 1.00 0.00 C ATOM 1430 O THR A 93 -5.446 -4.575 -10.387 1.00 0.00 O ATOM 1431 CB THR A 93 -4.896 -7.176 -8.447 1.00 0.00 C ATOM 1432 OG1 THR A 93 -6.196 -7.606 -8.061 1.00 0.00 O ATOM 1433 CG2 THR A 93 -4.468 -6.028 -7.512 1.00 0.00 C ATOM 0 H THR A 93 -3.212 -5.689 -10.593 1.00 0.00 H new ATOM 0 HA THR A 93 -5.221 -7.790 -10.483 1.00 0.00 H new ATOM 0 HB THR A 93 -4.139 -7.949 -8.316 1.00 0.00 H new ATOM 0 HG1 THR A 93 -6.210 -7.781 -7.097 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.543 -6.356 -6.475 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.438 -5.746 -7.730 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.120 -5.169 -7.669 1.00 0.00 H new ATOM 1441 N THR A 94 -7.090 -6.101 -10.692 1.00 0.00 N ATOM 1442 CA THR A 94 -8.169 -5.112 -10.985 1.00 0.00 C ATOM 1443 C THR A 94 -9.178 -5.113 -9.806 1.00 0.00 C ATOM 1444 O THR A 94 -9.935 -6.070 -9.621 1.00 0.00 O ATOM 1445 CB THR A 94 -8.878 -5.366 -12.348 1.00 0.00 C ATOM 1446 OG1 THR A 94 -9.336 -6.710 -12.465 1.00 0.00 O ATOM 1447 CG2 THR A 94 -7.996 -5.028 -13.559 1.00 0.00 C ATOM 0 H THR A 94 -7.402 -7.071 -10.736 1.00 0.00 H new ATOM 0 HA THR A 94 -7.713 -4.127 -11.081 1.00 0.00 H new ATOM 0 HB THR A 94 -9.733 -4.690 -12.354 1.00 0.00 H new ATOM 0 HG1 THR A 94 -9.696 -7.009 -11.604 1.00 0.00 H new ATOM 0 HG21 THR A 94 -8.548 -5.227 -14.478 1.00 0.00 H new ATOM 0 HG22 THR A 94 -7.717 -3.975 -13.524 1.00 0.00 H new ATOM 0 HG23 THR A 94 -7.096 -5.642 -13.536 1.00 0.00 H new ATOM 1455 N PHE A 95 -9.189 -4.015 -9.029 1.00 0.00 N ATOM 1456 CA PHE A 95 -10.055 -3.876 -7.822 1.00 0.00 C ATOM 1457 C PHE A 95 -11.532 -3.588 -8.226 1.00 0.00 C ATOM 1458 O PHE A 95 -12.313 -4.532 -8.378 1.00 0.00 O ATOM 1459 CB PHE A 95 -9.441 -2.869 -6.801 1.00 0.00 C ATOM 1460 CG PHE A 95 -8.143 -3.277 -6.080 1.00 0.00 C ATOM 1461 CD1 PHE A 95 -8.186 -4.133 -4.971 1.00 0.00 C ATOM 1462 CD2 PHE A 95 -6.919 -2.714 -6.463 1.00 0.00 C ATOM 1463 CE1 PHE A 95 -7.022 -4.423 -4.263 1.00 0.00 C ATOM 1464 CE2 PHE A 95 -5.760 -3.001 -5.746 1.00 0.00 C ATOM 1465 CZ PHE A 95 -5.811 -3.855 -4.649 1.00 0.00 C ATOM 0 H PHE A 95 -8.605 -3.198 -9.210 1.00 0.00 H new ATOM 0 HA PHE A 95 -10.089 -4.826 -7.289 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -9.252 -1.933 -7.327 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -10.195 -2.661 -6.041 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -9.125 -4.569 -4.664 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -6.874 -2.055 -7.317 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -7.059 -5.089 -3.414 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -4.820 -2.560 -6.042 1.00 0.00 H new ATOM 0 HZ PHE A 95 -4.910 -4.078 -4.096 1.00 0.00 H new ATOM 1475 N LYS A 96 -11.886 -2.307 -8.414 1.00 0.00 N ATOM 1476 CA LYS A 96 -13.217 -1.873 -8.917 1.00 0.00 C ATOM 1477 C LYS A 96 -13.002 -1.247 -10.325 1.00 0.00 C ATOM 1478 O LYS A 96 -13.277 -1.918 -11.324 1.00 0.00 O ATOM 1479 CB LYS A 96 -13.917 -1.003 -7.836 1.00 0.00 C ATOM 1480 CG LYS A 96 -15.378 -0.631 -8.167 1.00 0.00 C ATOM 1481 CD LYS A 96 -16.112 0.039 -6.988 1.00 0.00 C ATOM 1482 CE LYS A 96 -17.563 0.414 -7.341 1.00 0.00 C ATOM 1483 NZ LYS A 96 -18.258 1.008 -6.185 1.00 0.00 N ATOM 0 H LYS A 96 -11.256 -1.528 -8.222 1.00 0.00 H new ATOM 0 HA LYS A 96 -13.925 -2.687 -9.073 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -13.897 -1.538 -6.887 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -13.344 -0.086 -7.697 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -15.390 0.042 -9.025 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -15.919 -1.531 -8.460 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -16.111 -0.636 -6.132 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -15.570 0.936 -6.688 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -17.567 1.119 -8.172 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -18.100 -0.474 -7.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -19.233 1.250 -6.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -18.274 0.325 -5.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -17.758 1.869 -5.884 1.00 0.00 H new ATOM 1497 N ASN A 97 -12.450 -0.018 -10.413 1.00 0.00 N ATOM 1498 CA ASN A 97 -11.713 0.438 -11.625 1.00 0.00 C ATOM 1499 C ASN A 97 -10.327 1.006 -11.181 1.00 0.00 C ATOM 1500 O ASN A 97 -10.052 2.198 -11.334 1.00 0.00 O ATOM 1501 CB ASN A 97 -12.612 1.419 -12.436 1.00 0.00 C ATOM 1502 CG ASN A 97 -12.077 1.807 -13.826 1.00 0.00 C ATOM 1503 OD1 ASN A 97 -11.281 2.736 -13.975 1.00 0.00 O ATOM 1504 ND2 ASN A 97 -12.512 1.123 -14.868 1.00 0.00 N ATOM 0 H ASN A 97 -12.497 0.677 -9.668 1.00 0.00 H new ATOM 0 HA ASN A 97 -11.494 -0.380 -12.312 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -13.597 0.967 -12.557 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -12.748 2.328 -11.851 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -12.189 1.362 -15.806 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -13.171 0.356 -14.735 1.00 0.00 H new ATOM 1511 N ILE A 98 -9.451 0.140 -10.628 1.00 0.00 N ATOM 1512 CA ILE A 98 -8.070 0.518 -10.222 1.00 0.00 C ATOM 1513 C ILE A 98 -7.207 -0.688 -10.696 1.00 0.00 C ATOM 1514 O ILE A 98 -7.188 -1.736 -10.040 1.00 0.00 O ATOM 1515 CB ILE A 98 -7.899 0.844 -8.688 1.00 0.00 C ATOM 1516 CG1 ILE A 98 -8.793 1.998 -8.127 1.00 0.00 C ATOM 1517 CG2 ILE A 98 -6.423 1.191 -8.370 1.00 0.00 C ATOM 1518 CD1 ILE A 98 -10.193 1.587 -7.644 1.00 0.00 C ATOM 0 H ILE A 98 -9.675 -0.839 -10.449 1.00 0.00 H new ATOM 0 HA ILE A 98 -7.766 1.461 -10.675 1.00 0.00 H new ATOM 0 HB ILE A 98 -8.229 -0.070 -8.194 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -8.267 2.468 -7.296 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -8.905 2.755 -8.903 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -6.322 1.413 -7.308 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -5.787 0.343 -8.625 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -6.120 2.061 -8.953 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -10.724 2.465 -7.277 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -10.749 1.147 -8.472 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -10.101 0.856 -6.840 1.00 0.00 H new ATOM 1530 N LYS A 99 -6.480 -0.516 -11.818 1.00 0.00 N ATOM 1531 CA LYS A 99 -5.600 -1.577 -12.376 1.00 0.00 C ATOM 1532 C LYS A 99 -4.169 -1.385 -11.791 1.00 0.00 C ATOM 1533 O LYS A 99 -3.367 -0.586 -12.283 1.00 0.00 O ATOM 1534 CB LYS A 99 -5.719 -1.564 -13.926 1.00 0.00 C ATOM 1535 CG LYS A 99 -5.144 -2.806 -14.656 1.00 0.00 C ATOM 1536 CD LYS A 99 -3.687 -2.689 -15.143 1.00 0.00 C ATOM 1537 CE LYS A 99 -3.532 -1.882 -16.447 1.00 0.00 C ATOM 1538 NZ LYS A 99 -2.116 -1.697 -16.809 1.00 0.00 N ATOM 0 H LYS A 99 -6.481 0.348 -12.361 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.898 -2.584 -12.083 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.772 -1.465 -14.190 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -5.211 -0.676 -14.303 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -5.214 -3.662 -13.985 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -5.777 -3.023 -15.516 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -3.089 -2.219 -14.362 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -3.283 -3.690 -15.295 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -4.050 -2.396 -17.257 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -4.008 -0.908 -16.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -2.052 -1.150 -17.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -1.627 -1.185 -16.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -1.668 -2.626 -16.944 1.00 0.00 H new ATOM 1552 N SER A 100 -3.904 -2.113 -10.691 1.00 0.00 N ATOM 1553 CA SER A 100 -2.725 -1.906 -9.817 1.00 0.00 C ATOM 1554 C SER A 100 -1.575 -2.859 -10.220 1.00 0.00 C ATOM 1555 O SER A 100 -1.664 -4.073 -10.014 1.00 0.00 O ATOM 1556 CB SER A 100 -3.178 -2.146 -8.360 1.00 0.00 C ATOM 1557 OG SER A 100 -2.142 -1.819 -7.442 1.00 0.00 O ATOM 0 H SER A 100 -4.508 -2.872 -10.376 1.00 0.00 H new ATOM 0 HA SER A 100 -2.340 -0.891 -9.921 1.00 0.00 H new ATOM 0 HB2 SER A 100 -4.061 -1.544 -8.146 1.00 0.00 H new ATOM 0 HB3 SER A 100 -3.465 -3.190 -8.232 1.00 0.00 H new ATOM 0 HG SER A 100 -2.454 -1.978 -6.527 1.00 0.00 H new ATOM 1563 N VAL A 101 -0.500 -2.282 -10.781 1.00 0.00 N ATOM 1564 CA VAL A 101 0.676 -3.048 -11.280 1.00 0.00 C ATOM 1565 C VAL A 101 1.819 -2.780 -10.256 1.00 0.00 C ATOM 1566 O VAL A 101 2.464 -1.727 -10.297 1.00 0.00 O ATOM 1567 CB VAL A 101 1.037 -2.619 -12.748 1.00 0.00 C ATOM 1568 CG1 VAL A 101 2.316 -3.298 -13.291 1.00 0.00 C ATOM 1569 CG2 VAL A 101 -0.103 -2.870 -13.761 1.00 0.00 C ATOM 0 H VAL A 101 -0.412 -1.273 -10.906 1.00 0.00 H new ATOM 0 HA VAL A 101 0.482 -4.119 -11.345 1.00 0.00 H new ATOM 0 HB VAL A 101 1.209 -1.546 -12.659 1.00 0.00 H new ATOM 0 HG11 VAL A 101 2.505 -2.956 -14.309 1.00 0.00 H new ATOM 0 HG12 VAL A 101 3.163 -3.037 -12.657 1.00 0.00 H new ATOM 0 HG13 VAL A 101 2.182 -4.380 -13.291 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.215 -2.551 -14.753 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -0.344 -3.933 -13.782 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -0.985 -2.304 -13.463 1.00 0.00 H new ATOM 1579 N THR A 102 2.057 -3.740 -9.346 1.00 0.00 N ATOM 1580 CA THR A 102 3.001 -3.558 -8.208 1.00 0.00 C ATOM 1581 C THR A 102 4.382 -4.158 -8.603 1.00 0.00 C ATOM 1582 O THR A 102 4.646 -5.341 -8.379 1.00 0.00 O ATOM 1583 CB THR A 102 2.392 -4.163 -6.906 1.00 0.00 C ATOM 1584 OG1 THR A 102 1.089 -3.642 -6.661 1.00 0.00 O ATOM 1585 CG2 THR A 102 3.227 -3.901 -5.641 1.00 0.00 C ATOM 0 H THR A 102 1.611 -4.657 -9.369 1.00 0.00 H new ATOM 0 HA THR A 102 3.163 -2.502 -7.992 1.00 0.00 H new ATOM 0 HB THR A 102 2.370 -5.237 -7.091 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.110 -2.664 -6.725 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.735 -4.354 -4.780 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.219 -4.336 -5.763 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.319 -2.827 -5.482 1.00 0.00 H new ATOM 1593 N GLU A 103 5.255 -3.311 -9.180 1.00 0.00 N ATOM 1594 CA GLU A 103 6.626 -3.694 -9.600 1.00 0.00 C ATOM 1595 C GLU A 103 7.622 -3.510 -8.429 1.00 0.00 C ATOM 1596 O GLU A 103 7.536 -2.526 -7.695 1.00 0.00 O ATOM 1597 CB GLU A 103 7.047 -2.787 -10.789 1.00 0.00 C ATOM 1598 CG GLU A 103 6.526 -3.264 -12.160 1.00 0.00 C ATOM 1599 CD GLU A 103 6.942 -2.342 -13.308 1.00 0.00 C ATOM 1600 OE1 GLU A 103 8.098 -2.443 -13.776 1.00 0.00 O ATOM 1601 OE2 GLU A 103 6.116 -1.511 -13.746 1.00 0.00 O ATOM 0 H GLU A 103 5.032 -2.334 -9.371 1.00 0.00 H new ATOM 0 HA GLU A 103 6.636 -4.742 -9.899 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.684 -1.775 -10.606 1.00 0.00 H new ATOM 0 HB3 GLU A 103 8.135 -2.734 -10.824 1.00 0.00 H new ATOM 0 HG2 GLU A 103 6.899 -4.270 -12.355 1.00 0.00 H new ATOM 0 HG3 GLU A 103 5.438 -3.328 -12.128 1.00 0.00 H new ATOM 1608 N LEU A 104 8.592 -4.431 -8.294 1.00 0.00 N ATOM 1609 CA LEU A 104 9.702 -4.296 -7.314 1.00 0.00 C ATOM 1610 C LEU A 104 11.025 -4.340 -8.123 1.00 0.00 C ATOM 1611 O LEU A 104 11.467 -5.402 -8.575 1.00 0.00 O ATOM 1612 CB LEU A 104 9.587 -5.374 -6.197 1.00 0.00 C ATOM 1613 CG LEU A 104 10.152 -4.973 -4.806 1.00 0.00 C ATOM 1614 CD1 LEU A 104 9.878 -6.091 -3.787 1.00 0.00 C ATOM 1615 CD2 LEU A 104 11.648 -4.607 -4.783 1.00 0.00 C ATOM 0 H LEU A 104 8.636 -5.284 -8.851 1.00 0.00 H new ATOM 0 HA LEU A 104 9.664 -3.350 -6.774 1.00 0.00 H new ATOM 0 HB2 LEU A 104 8.536 -5.636 -6.079 1.00 0.00 H new ATOM 0 HB3 LEU A 104 10.104 -6.273 -6.532 1.00 0.00 H new ATOM 0 HG LEU A 104 9.626 -4.056 -4.540 1.00 0.00 H new ATOM 0 HD11 LEU A 104 10.277 -5.803 -2.814 1.00 0.00 H new ATOM 0 HD12 LEU A 104 8.803 -6.253 -3.705 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.359 -7.011 -4.118 1.00 0.00 H new ATOM 0 HD21 LEU A 104 11.942 -4.343 -3.767 1.00 0.00 H new ATOM 0 HD22 LEU A 104 12.236 -5.460 -5.121 1.00 0.00 H new ATOM 0 HD23 LEU A 104 11.825 -3.759 -5.444 1.00 0.00 H new ATOM 1627 N ASN A 105 11.639 -3.160 -8.326 1.00 0.00 N ATOM 1628 CA ASN A 105 12.772 -2.985 -9.277 1.00 0.00 C ATOM 1629 C ASN A 105 14.114 -3.441 -8.635 1.00 0.00 C ATOM 1630 O ASN A 105 14.530 -4.582 -8.861 1.00 0.00 O ATOM 1631 CB ASN A 105 12.755 -1.550 -9.886 1.00 0.00 C ATOM 1632 CG ASN A 105 11.631 -1.256 -10.905 1.00 0.00 C ATOM 1633 OD1 ASN A 105 11.847 -1.282 -12.115 1.00 0.00 O ATOM 1634 ND2 ASN A 105 10.422 -0.964 -10.448 1.00 0.00 N ATOM 0 H ASN A 105 11.373 -2.302 -7.843 1.00 0.00 H new ATOM 0 HA ASN A 105 12.654 -3.647 -10.135 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.674 -0.832 -9.070 1.00 0.00 H new ATOM 0 HB3 ASN A 105 13.714 -1.373 -10.373 1.00 0.00 H new ATOM 0 HD21 ASN A 105 9.666 -0.760 -11.101 1.00 0.00 H new ATOM 0 HD22 ASN A 105 10.248 -0.944 -9.443 1.00 0.00 H new ATOM 1641 N GLY A 106 14.757 -2.580 -7.829 1.00 0.00 N ATOM 1642 CA GLY A 106 15.999 -2.928 -7.099 1.00 0.00 C ATOM 1643 C GLY A 106 15.678 -3.334 -5.650 1.00 0.00 C ATOM 1644 O GLY A 106 15.160 -4.431 -5.417 1.00 0.00 O ATOM 0 H GLY A 106 14.437 -1.626 -7.662 1.00 0.00 H new ATOM 0 HA2 GLY A 106 16.509 -3.746 -7.607 1.00 0.00 H new ATOM 0 HA3 GLY A 106 16.680 -2.077 -7.102 1.00 0.00 H new ATOM 1648 N ASP A 107 15.943 -2.421 -4.701 1.00 0.00 N ATOM 1649 CA ASP A 107 15.294 -2.456 -3.354 1.00 0.00 C ATOM 1650 C ASP A 107 14.320 -1.237 -3.201 1.00 0.00 C ATOM 1651 O ASP A 107 14.401 -0.458 -2.246 1.00 0.00 O ATOM 1652 CB ASP A 107 16.378 -2.533 -2.241 1.00 0.00 C ATOM 1653 CG ASP A 107 17.219 -3.822 -2.226 1.00 0.00 C ATOM 1654 OD1 ASP A 107 16.749 -4.852 -1.694 1.00 0.00 O ATOM 1655 OD2 ASP A 107 18.350 -3.807 -2.759 1.00 0.00 O ATOM 0 H ASP A 107 16.597 -1.648 -4.828 1.00 0.00 H new ATOM 0 HA ASP A 107 14.685 -3.354 -3.249 1.00 0.00 H new ATOM 0 HB2 ASP A 107 17.050 -1.682 -2.353 1.00 0.00 H new ATOM 0 HB3 ASP A 107 15.888 -2.428 -1.273 1.00 0.00 H new ATOM 1660 N ILE A 108 13.386 -1.095 -4.166 1.00 0.00 N ATOM 1661 CA ILE A 108 12.425 0.032 -4.271 1.00 0.00 C ATOM 1662 C ILE A 108 11.150 -0.551 -4.946 1.00 0.00 C ATOM 1663 O ILE A 108 11.249 -1.272 -5.947 1.00 0.00 O ATOM 1664 CB ILE A 108 12.952 1.301 -5.012 1.00 0.00 C ATOM 1665 CG1 ILE A 108 13.290 1.126 -6.516 1.00 0.00 C ATOM 1666 CG2 ILE A 108 14.120 1.999 -4.283 1.00 0.00 C ATOM 1667 CD1 ILE A 108 12.165 1.582 -7.455 1.00 0.00 C ATOM 0 H ILE A 108 13.274 -1.778 -4.915 1.00 0.00 H new ATOM 0 HA ILE A 108 12.227 0.415 -3.270 1.00 0.00 H new ATOM 0 HB ILE A 108 12.078 1.951 -4.981 1.00 0.00 H new ATOM 0 HG12 ILE A 108 14.194 1.690 -6.745 1.00 0.00 H new ATOM 0 HG13 ILE A 108 13.511 0.077 -6.710 1.00 0.00 H new ATOM 0 HG21 ILE A 108 14.435 2.872 -4.854 1.00 0.00 H new ATOM 0 HG22 ILE A 108 13.795 2.312 -3.291 1.00 0.00 H new ATOM 0 HG23 ILE A 108 14.956 1.306 -4.188 1.00 0.00 H new ATOM 0 HD11 ILE A 108 12.471 1.430 -8.490 1.00 0.00 H new ATOM 0 HD12 ILE A 108 11.265 1.001 -7.254 1.00 0.00 H new ATOM 0 HD13 ILE A 108 11.959 2.639 -7.289 1.00 0.00 H new ATOM 1679 N ILE A 109 9.957 -0.202 -4.438 1.00 0.00 N ATOM 1680 CA ILE A 109 8.670 -0.715 -4.989 1.00 0.00 C ATOM 1681 C ILE A 109 7.941 0.438 -5.745 1.00 0.00 C ATOM 1682 O ILE A 109 7.582 1.456 -5.145 1.00 0.00 O ATOM 1683 CB ILE A 109 7.871 -1.471 -3.869 1.00 0.00 C ATOM 1684 CG1 ILE A 109 6.897 -2.533 -4.451 1.00 0.00 C ATOM 1685 CG2 ILE A 109 7.149 -0.551 -2.851 1.00 0.00 C ATOM 1686 CD1 ILE A 109 6.458 -3.597 -3.441 1.00 0.00 C ATOM 0 H ILE A 109 9.846 0.432 -3.647 1.00 0.00 H new ATOM 0 HA ILE A 109 8.814 -1.481 -5.751 1.00 0.00 H new ATOM 0 HB ILE A 109 8.642 -1.989 -3.299 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.012 -2.027 -4.837 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.377 -3.026 -5.297 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.625 -1.162 -2.116 1.00 0.00 H new ATOM 0 HG22 ILE A 109 7.882 0.077 -2.344 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.432 0.080 -3.376 1.00 0.00 H new ATOM 0 HD11 ILE A 109 5.780 -4.300 -3.925 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.333 -4.132 -3.073 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.948 -3.117 -2.606 1.00 0.00 H new ATOM 1698 N THR A 110 7.738 0.266 -7.067 1.00 0.00 N ATOM 1699 CA THR A 110 7.019 1.250 -7.918 1.00 0.00 C ATOM 1700 C THR A 110 5.602 0.670 -8.184 1.00 0.00 C ATOM 1701 O THR A 110 5.411 -0.174 -9.066 1.00 0.00 O ATOM 1702 CB THR A 110 7.848 1.526 -9.205 1.00 0.00 C ATOM 1703 OG1 THR A 110 9.135 2.034 -8.860 1.00 0.00 O ATOM 1704 CG2 THR A 110 7.208 2.542 -10.166 1.00 0.00 C ATOM 0 H THR A 110 8.065 -0.554 -7.578 1.00 0.00 H new ATOM 0 HA THR A 110 6.900 2.220 -7.436 1.00 0.00 H new ATOM 0 HB THR A 110 7.901 0.564 -9.714 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.650 2.203 -9.677 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.851 2.675 -11.036 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.234 2.174 -10.488 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.085 3.497 -9.656 1.00 0.00 H new ATOM 1712 N ASN A 111 4.616 1.145 -7.403 1.00 0.00 N ATOM 1713 CA ASN A 111 3.199 0.713 -7.525 1.00 0.00 C ATOM 1714 C ASN A 111 2.457 1.706 -8.458 1.00 0.00 C ATOM 1715 O ASN A 111 2.330 2.894 -8.150 1.00 0.00 O ATOM 1716 CB ASN A 111 2.575 0.589 -6.109 1.00 0.00 C ATOM 1717 CG ASN A 111 1.107 0.107 -6.073 1.00 0.00 C ATOM 1718 OD1 ASN A 111 0.699 -0.799 -6.801 1.00 0.00 O ATOM 1719 ND2 ASN A 111 0.286 0.707 -5.229 1.00 0.00 N ATOM 0 H ASN A 111 4.771 1.837 -6.670 1.00 0.00 H new ATOM 0 HA ASN A 111 3.114 -0.274 -7.981 1.00 0.00 H new ATOM 0 HB2 ASN A 111 3.181 -0.101 -5.522 1.00 0.00 H new ATOM 0 HB3 ASN A 111 2.633 1.561 -5.618 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -0.692 0.421 -5.178 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.630 1.457 -4.629 1.00 0.00 H new ATOM 1726 N THR A 112 1.986 1.185 -9.603 1.00 0.00 N ATOM 1727 CA THR A 112 1.432 2.011 -10.707 1.00 0.00 C ATOM 1728 C THR A 112 -0.089 1.696 -10.813 1.00 0.00 C ATOM 1729 O THR A 112 -0.504 0.741 -11.478 1.00 0.00 O ATOM 1730 CB THR A 112 2.233 1.751 -12.018 1.00 0.00 C ATOM 1731 OG1 THR A 112 3.635 1.902 -11.796 1.00 0.00 O ATOM 1732 CG2 THR A 112 1.861 2.707 -13.161 1.00 0.00 C ATOM 0 H THR A 112 1.975 0.184 -9.796 1.00 0.00 H new ATOM 0 HA THR A 112 1.536 3.079 -10.515 1.00 0.00 H new ATOM 0 HB THR A 112 1.976 0.732 -12.306 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.119 1.733 -12.631 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.456 2.469 -14.042 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.803 2.597 -13.398 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.059 3.734 -12.855 1.00 0.00 H new ATOM 1740 N MET A 113 -0.900 2.525 -10.136 1.00 0.00 N ATOM 1741 CA MET A 113 -2.376 2.362 -10.067 1.00 0.00 C ATOM 1742 C MET A 113 -3.041 3.222 -11.173 1.00 0.00 C ATOM 1743 O MET A 113 -3.221 4.436 -11.029 1.00 0.00 O ATOM 1744 CB MET A 113 -2.891 2.733 -8.653 1.00 0.00 C ATOM 1745 CG MET A 113 -2.603 1.692 -7.562 1.00 0.00 C ATOM 1746 SD MET A 113 -3.395 2.213 -6.024 1.00 0.00 S ATOM 1747 CE MET A 113 -3.688 0.618 -5.231 1.00 0.00 C ATOM 0 H MET A 113 -0.557 3.333 -9.616 1.00 0.00 H new ATOM 0 HA MET A 113 -2.643 1.320 -10.243 1.00 0.00 H new ATOM 0 HB2 MET A 113 -2.442 3.681 -8.357 1.00 0.00 H new ATOM 0 HB3 MET A 113 -3.968 2.893 -8.706 1.00 0.00 H new ATOM 0 HG2 MET A 113 -2.978 0.715 -7.866 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.528 1.589 -7.415 1.00 0.00 H new ATOM 0 HE1 MET A 113 -3.886 0.770 -4.170 1.00 0.00 H new ATOM 0 HE2 MET A 113 -4.547 0.134 -5.695 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.808 -0.014 -5.349 1.00 0.00 H new ATOM 1757 N THR A 114 -3.393 2.555 -12.285 1.00 0.00 N ATOM 1758 CA THR A 114 -3.926 3.218 -13.503 1.00 0.00 C ATOM 1759 C THR A 114 -5.480 3.281 -13.415 1.00 0.00 C ATOM 1760 O THR A 114 -6.176 2.270 -13.555 1.00 0.00 O ATOM 1761 CB THR A 114 -3.416 2.539 -14.809 1.00 0.00 C ATOM 1762 OG1 THR A 114 -3.757 1.161 -14.847 1.00 0.00 O ATOM 1763 CG2 THR A 114 -1.901 2.653 -15.046 1.00 0.00 C ATOM 0 H THR A 114 -3.319 1.541 -12.372 1.00 0.00 H new ATOM 0 HA THR A 114 -3.548 4.239 -13.549 1.00 0.00 H new ATOM 0 HB THR A 114 -3.919 3.094 -15.601 1.00 0.00 H new ATOM 0 HG1 THR A 114 -2.961 0.633 -15.065 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.640 2.151 -15.978 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.621 3.704 -15.109 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.367 2.184 -14.219 1.00 0.00 H new ATOM 1771 N LEU A 115 -5.989 4.500 -13.168 1.00 0.00 N ATOM 1772 CA LEU A 115 -7.441 4.798 -13.050 1.00 0.00 C ATOM 1773 C LEU A 115 -7.908 5.439 -14.389 1.00 0.00 C ATOM 1774 O LEU A 115 -8.004 6.665 -14.508 1.00 0.00 O ATOM 1775 CB LEU A 115 -7.581 5.706 -11.789 1.00 0.00 C ATOM 1776 CG LEU A 115 -8.958 6.341 -11.453 1.00 0.00 C ATOM 1777 CD1 LEU A 115 -10.061 5.313 -11.151 1.00 0.00 C ATOM 1778 CD2 LEU A 115 -8.803 7.312 -10.268 1.00 0.00 C ATOM 0 H LEU A 115 -5.401 5.324 -13.042 1.00 0.00 H new ATOM 0 HA LEU A 115 -8.083 3.929 -12.906 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -7.274 5.116 -10.926 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.862 6.519 -11.891 1.00 0.00 H new ATOM 0 HG LEU A 115 -9.280 6.874 -12.347 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -10.992 5.834 -10.926 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -10.206 4.669 -12.019 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -9.768 4.706 -10.294 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -9.770 7.757 -10.033 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -8.433 6.769 -9.399 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.096 8.099 -10.532 1.00 0.00 H new ATOM 1790 N GLY A 116 -8.148 4.592 -15.413 1.00 0.00 N ATOM 1791 CA GLY A 116 -8.410 5.059 -16.795 1.00 0.00 C ATOM 1792 C GLY A 116 -7.144 5.604 -17.492 1.00 0.00 C ATOM 1793 O GLY A 116 -6.295 4.830 -17.941 1.00 0.00 O ATOM 0 H GLY A 116 -8.166 3.577 -15.310 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.816 4.235 -17.381 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -9.171 5.839 -16.772 1.00 0.00 H new ATOM 1797 N ASP A 117 -7.034 6.942 -17.529 1.00 0.00 N ATOM 1798 CA ASP A 117 -5.790 7.659 -17.951 1.00 0.00 C ATOM 1799 C ASP A 117 -4.933 8.263 -16.782 1.00 0.00 C ATOM 1800 O ASP A 117 -3.835 8.755 -17.059 1.00 0.00 O ATOM 1801 CB ASP A 117 -6.163 8.774 -18.972 1.00 0.00 C ATOM 1802 CG ASP A 117 -6.663 8.275 -20.338 1.00 0.00 C ATOM 1803 OD1 ASP A 117 -5.827 7.888 -21.183 1.00 0.00 O ATOM 1804 OD2 ASP A 117 -7.893 8.268 -20.567 1.00 0.00 O ATOM 0 H ASP A 117 -7.796 7.569 -17.270 1.00 0.00 H new ATOM 0 HA ASP A 117 -5.150 6.901 -18.403 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.934 9.405 -18.530 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -5.288 9.404 -19.132 1.00 0.00 H new ATOM 1809 N ILE A 118 -5.385 8.231 -15.507 1.00 0.00 N ATOM 1810 CA ILE A 118 -4.669 8.845 -14.351 1.00 0.00 C ATOM 1811 C ILE A 118 -3.668 7.776 -13.818 1.00 0.00 C ATOM 1812 O ILE A 118 -4.062 6.828 -13.130 1.00 0.00 O ATOM 1813 CB ILE A 118 -5.692 9.349 -13.269 1.00 0.00 C ATOM 1814 CG1 ILE A 118 -6.673 10.444 -13.800 1.00 0.00 C ATOM 1815 CG2 ILE A 118 -4.980 9.872 -11.993 1.00 0.00 C ATOM 1816 CD1 ILE A 118 -7.904 10.709 -12.919 1.00 0.00 C ATOM 0 H ILE A 118 -6.260 7.778 -15.244 1.00 0.00 H new ATOM 0 HA ILE A 118 -4.110 9.734 -14.643 1.00 0.00 H new ATOM 0 HB ILE A 118 -6.284 8.469 -13.016 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -6.121 11.377 -13.914 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -7.014 10.151 -14.793 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -5.725 10.210 -11.273 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -4.387 9.070 -11.553 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.327 10.704 -12.256 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -8.519 11.484 -13.376 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -8.487 9.793 -12.824 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -7.581 11.038 -11.931 1.00 0.00 H new ATOM 1828 N VAL A 119 -2.376 7.958 -14.135 1.00 0.00 N ATOM 1829 CA VAL A 119 -1.310 6.972 -13.809 1.00 0.00 C ATOM 1830 C VAL A 119 -0.689 7.403 -12.444 1.00 0.00 C ATOM 1831 O VAL A 119 0.201 8.259 -12.411 1.00 0.00 O ATOM 1832 CB VAL A 119 -0.265 6.871 -14.980 1.00 0.00 C ATOM 1833 CG1 VAL A 119 0.824 5.810 -14.704 1.00 0.00 C ATOM 1834 CG2 VAL A 119 -0.875 6.558 -16.369 1.00 0.00 C ATOM 0 H VAL A 119 -2.033 8.786 -14.622 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.709 5.963 -13.707 1.00 0.00 H new ATOM 0 HB VAL A 119 0.164 7.872 -15.012 1.00 0.00 H new ATOM 0 HG11 VAL A 119 1.521 5.778 -15.541 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.363 6.070 -13.793 1.00 0.00 H new ATOM 0 HG13 VAL A 119 0.357 4.832 -14.583 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -0.080 6.508 -17.113 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.397 5.602 -16.330 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.579 7.344 -16.643 1.00 0.00 H new ATOM 1844 N PHE A 120 -1.156 6.793 -11.333 1.00 0.00 N ATOM 1845 CA PHE A 120 -0.614 7.064 -9.972 1.00 0.00 C ATOM 1846 C PHE A 120 0.632 6.183 -9.720 1.00 0.00 C ATOM 1847 O PHE A 120 0.527 5.046 -9.250 1.00 0.00 O ATOM 1848 CB PHE A 120 -1.725 6.890 -8.898 1.00 0.00 C ATOM 1849 CG PHE A 120 -1.363 7.095 -7.402 1.00 0.00 C ATOM 1850 CD1 PHE A 120 -0.366 7.989 -6.980 1.00 0.00 C ATOM 1851 CD2 PHE A 120 -2.076 6.376 -6.436 1.00 0.00 C ATOM 1852 CE1 PHE A 120 -0.093 8.157 -5.626 1.00 0.00 C ATOM 1853 CE2 PHE A 120 -1.803 6.548 -5.081 1.00 0.00 C ATOM 1854 CZ PHE A 120 -0.811 7.437 -4.678 1.00 0.00 C ATOM 0 H PHE A 120 -1.910 6.106 -11.346 1.00 0.00 H new ATOM 0 HA PHE A 120 -0.286 8.101 -9.900 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -2.529 7.585 -9.140 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -2.131 5.884 -9.004 1.00 0.00 H new ATOM 0 HD1 PHE A 120 0.194 8.551 -7.713 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -2.844 5.682 -6.744 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.676 8.847 -5.312 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -2.361 5.991 -4.343 1.00 0.00 H new ATOM 0 HZ PHE A 120 -0.599 7.568 -3.627 1.00 0.00 H new ATOM 1864 N LYS A 121 1.805 6.762 -10.014 1.00 0.00 N ATOM 1865 CA LYS A 121 3.106 6.065 -9.840 1.00 0.00 C ATOM 1866 C LYS A 121 3.741 6.531 -8.502 1.00 0.00 C ATOM 1867 O LYS A 121 4.286 7.634 -8.406 1.00 0.00 O ATOM 1868 CB LYS A 121 3.990 6.300 -11.090 1.00 0.00 C ATOM 1869 CG LYS A 121 5.246 5.403 -11.129 1.00 0.00 C ATOM 1870 CD LYS A 121 6.090 5.524 -12.415 1.00 0.00 C ATOM 1871 CE LYS A 121 6.863 6.852 -12.546 1.00 0.00 C ATOM 1872 NZ LYS A 121 7.660 6.887 -13.784 1.00 0.00 N ATOM 0 H LYS A 121 1.889 7.712 -10.374 1.00 0.00 H new ATOM 0 HA LYS A 121 2.984 4.984 -9.767 1.00 0.00 H new ATOM 0 HB2 LYS A 121 3.396 6.120 -11.986 1.00 0.00 H new ATOM 0 HB3 LYS A 121 4.298 7.345 -11.117 1.00 0.00 H new ATOM 0 HG2 LYS A 121 5.876 5.647 -10.274 1.00 0.00 H new ATOM 0 HG3 LYS A 121 4.937 4.364 -11.011 1.00 0.00 H new ATOM 0 HD2 LYS A 121 6.801 4.699 -12.447 1.00 0.00 H new ATOM 0 HD3 LYS A 121 5.433 5.413 -13.278 1.00 0.00 H new ATOM 0 HE2 LYS A 121 6.161 7.686 -12.539 1.00 0.00 H new ATOM 0 HE3 LYS A 121 7.519 6.980 -11.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 8.169 7.792 -13.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 8.345 6.105 -13.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 7.030 6.789 -14.605 1.00 0.00 H new ATOM 1886 N ARG A 122 3.644 5.660 -7.483 1.00 0.00 N ATOM 1887 CA ARG A 122 4.158 5.926 -6.114 1.00 0.00 C ATOM 1888 C ARG A 122 5.435 5.072 -5.874 1.00 0.00 C ATOM 1889 O ARG A 122 5.418 3.845 -6.013 1.00 0.00 O ATOM 1890 CB ARG A 122 3.031 5.731 -5.059 1.00 0.00 C ATOM 1891 CG ARG A 122 2.478 4.307 -4.804 1.00 0.00 C ATOM 1892 CD ARG A 122 1.407 4.201 -3.695 1.00 0.00 C ATOM 1893 NE ARG A 122 1.882 4.548 -2.328 1.00 0.00 N ATOM 1894 CZ ARG A 122 2.534 3.709 -1.494 1.00 0.00 C ATOM 1895 NH1 ARG A 122 2.875 2.461 -1.810 1.00 0.00 N ATOM 1896 NH2 ARG A 122 2.855 4.155 -0.294 1.00 0.00 N ATOM 0 H ARG A 122 3.205 4.744 -7.579 1.00 0.00 H new ATOM 0 HA ARG A 122 4.462 6.967 -6.006 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.400 6.115 -4.108 1.00 0.00 H new ATOM 0 HB3 ARG A 122 2.192 6.362 -5.353 1.00 0.00 H new ATOM 0 HG2 ARG A 122 2.053 3.929 -5.734 1.00 0.00 H new ATOM 0 HG3 ARG A 122 3.311 3.653 -4.545 1.00 0.00 H new ATOM 0 HD2 ARG A 122 0.574 4.856 -3.951 1.00 0.00 H new ATOM 0 HD3 ARG A 122 1.019 3.182 -3.681 1.00 0.00 H new ATOM 0 HE ARG A 122 1.701 5.495 -1.994 1.00 0.00 H new ATOM 0 HH11 ARG A 122 2.644 2.087 -2.730 1.00 0.00 H new ATOM 0 HH12 ARG A 122 3.367 1.880 -1.132 1.00 0.00 H new ATOM 0 HH21 ARG A 122 2.610 5.107 -0.021 1.00 0.00 H new ATOM 0 HH22 ARG A 122 3.348 3.548 0.361 1.00 0.00 H new ATOM 1910 N ILE A 123 6.546 5.751 -5.541 1.00 0.00 N ATOM 1911 CA ILE A 123 7.899 5.133 -5.459 1.00 0.00 C ATOM 1912 C ILE A 123 8.263 5.139 -3.947 1.00 0.00 C ATOM 1913 O ILE A 123 8.548 6.197 -3.376 1.00 0.00 O ATOM 1914 CB ILE A 123 8.964 5.869 -6.354 1.00 0.00 C ATOM 1915 CG1 ILE A 123 8.579 6.013 -7.863 1.00 0.00 C ATOM 1916 CG2 ILE A 123 10.334 5.148 -6.274 1.00 0.00 C ATOM 1917 CD1 ILE A 123 7.794 7.287 -8.220 1.00 0.00 C ATOM 0 H ILE A 123 6.541 6.747 -5.319 1.00 0.00 H new ATOM 0 HA ILE A 123 7.896 4.119 -5.858 1.00 0.00 H new ATOM 0 HB ILE A 123 9.011 6.877 -5.941 1.00 0.00 H new ATOM 0 HG12 ILE A 123 9.492 5.989 -8.458 1.00 0.00 H new ATOM 0 HG13 ILE A 123 7.986 5.146 -8.154 1.00 0.00 H new ATOM 0 HG21 ILE A 123 11.058 5.671 -6.899 1.00 0.00 H new ATOM 0 HG22 ILE A 123 10.683 5.143 -5.241 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.226 4.122 -6.625 1.00 0.00 H new ATOM 0 HD11 ILE A 123 7.576 7.293 -9.288 1.00 0.00 H new ATOM 0 HD12 ILE A 123 6.860 7.308 -7.658 1.00 0.00 H new ATOM 0 HD13 ILE A 123 8.390 8.164 -7.967 1.00 0.00 H new ATOM 1929 N SER A 124 8.248 3.949 -3.327 1.00 0.00 N ATOM 1930 CA SER A 124 8.481 3.783 -1.872 1.00 0.00 C ATOM 1931 C SER A 124 9.736 2.897 -1.658 1.00 0.00 C ATOM 1932 O SER A 124 9.775 1.746 -2.107 1.00 0.00 O ATOM 1933 CB SER A 124 7.223 3.160 -1.224 1.00 0.00 C ATOM 1934 OG SER A 124 6.083 3.999 -1.361 1.00 0.00 O ATOM 0 H SER A 124 8.074 3.070 -3.815 1.00 0.00 H new ATOM 0 HA SER A 124 8.662 4.748 -1.398 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.019 2.193 -1.684 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.413 2.976 -0.167 1.00 0.00 H new ATOM 0 HG SER A 124 5.309 3.570 -0.941 1.00 0.00 H new ATOM 1940 N LYS A 125 10.767 3.434 -0.982 1.00 0.00 N ATOM 1941 CA LYS A 125 12.072 2.744 -0.815 1.00 0.00 C ATOM 1942 C LYS A 125 12.089 1.864 0.467 1.00 0.00 C ATOM 1943 O LYS A 125 11.590 2.254 1.528 1.00 0.00 O ATOM 1944 CB LYS A 125 13.199 3.811 -0.828 1.00 0.00 C ATOM 1945 CG LYS A 125 14.639 3.251 -0.734 1.00 0.00 C ATOM 1946 CD LYS A 125 15.726 4.156 -1.354 1.00 0.00 C ATOM 1947 CE LYS A 125 17.056 3.436 -1.657 1.00 0.00 C ATOM 1948 NZ LYS A 125 17.795 3.022 -0.449 1.00 0.00 N ATOM 0 H LYS A 125 10.727 4.351 -0.537 1.00 0.00 H new ATOM 0 HA LYS A 125 12.238 2.055 -1.643 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.113 4.396 -1.744 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.038 4.496 0.004 1.00 0.00 H new ATOM 0 HG2 LYS A 125 14.881 3.083 0.315 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.669 2.280 -1.228 1.00 0.00 H new ATOM 0 HD2 LYS A 125 15.340 4.586 -2.279 1.00 0.00 H new ATOM 0 HD3 LYS A 125 15.922 4.986 -0.675 1.00 0.00 H new ATOM 0 HE2 LYS A 125 16.852 2.556 -2.267 1.00 0.00 H new ATOM 0 HE3 LYS A 125 17.689 4.095 -2.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 18.677 2.546 -0.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 18.021 3.860 0.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 17.210 2.368 0.109 1.00 0.00 H new ATOM 1962 N ARG A 126 12.738 0.692 0.346 1.00 0.00 N ATOM 1963 CA ARG A 126 12.903 -0.281 1.449 1.00 0.00 C ATOM 1964 C ARG A 126 13.811 0.269 2.591 1.00 0.00 C ATOM 1965 O ARG A 126 14.949 0.691 2.356 1.00 0.00 O ATOM 1966 CB ARG A 126 13.500 -1.568 0.819 1.00 0.00 C ATOM 1967 CG ARG A 126 13.380 -2.830 1.698 1.00 0.00 C ATOM 1968 CD ARG A 126 14.242 -4.027 1.243 1.00 0.00 C ATOM 1969 NE ARG A 126 13.952 -4.506 -0.134 1.00 0.00 N ATOM 1970 CZ ARG A 126 13.210 -5.585 -0.444 1.00 0.00 C ATOM 1971 NH1 ARG A 126 12.561 -6.325 0.448 1.00 0.00 N ATOM 1972 NH2 ARG A 126 13.124 -5.926 -1.714 1.00 0.00 N ATOM 0 H ARG A 126 13.168 0.388 -0.527 1.00 0.00 H new ATOM 0 HA ARG A 126 11.941 -0.485 1.920 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.002 -1.755 -0.132 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.553 -1.394 0.599 1.00 0.00 H new ATOM 0 HG2 ARG A 126 13.657 -2.570 2.720 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.336 -3.141 1.720 1.00 0.00 H new ATOM 0 HD2 ARG A 126 15.293 -3.745 1.302 1.00 0.00 H new ATOM 0 HD3 ARG A 126 14.093 -4.852 1.940 1.00 0.00 H new ATOM 0 HE ARG A 126 14.348 -3.973 -0.908 1.00 0.00 H new ATOM 0 HH11 ARG A 126 12.608 -6.087 1.439 1.00 0.00 H new ATOM 0 HH12 ARG A 126 12.016 -7.131 0.142 1.00 0.00 H new ATOM 0 HH21 ARG A 126 13.611 -5.378 -2.423 1.00 0.00 H new ATOM 0 HH22 ARG A 126 12.571 -6.738 -1.988 1.00 0.00 H new ATOM 1986 N ILE A 127 13.261 0.259 3.814 1.00 0.00 N ATOM 1987 CA ILE A 127 13.928 0.805 5.027 1.00 0.00 C ATOM 1988 C ILE A 127 13.908 -0.277 6.127 1.00 0.00 C ATOM 1989 O ILE A 127 12.878 -0.857 6.482 1.00 0.00 O ATOM 1990 CB ILE A 127 13.358 2.188 5.501 1.00 0.00 C ATOM 1991 CG1 ILE A 127 11.818 2.217 5.758 1.00 0.00 C ATOM 1992 CG2 ILE A 127 13.785 3.331 4.544 1.00 0.00 C ATOM 1993 CD1 ILE A 127 11.328 3.360 6.657 1.00 0.00 C ATOM 0 H ILE A 127 12.336 -0.128 4.001 1.00 0.00 H new ATOM 0 HA ILE A 127 14.963 1.039 4.776 1.00 0.00 H new ATOM 0 HB ILE A 127 13.809 2.351 6.480 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.307 2.286 4.798 1.00 0.00 H new ATOM 0 HG13 ILE A 127 11.523 1.269 6.209 1.00 0.00 H new ATOM 0 HG21 ILE A 127 13.374 4.276 4.900 1.00 0.00 H new ATOM 0 HG22 ILE A 127 14.873 3.395 4.517 1.00 0.00 H new ATOM 0 HG23 ILE A 127 13.408 3.126 3.542 1.00 0.00 H new ATOM 0 HD11 ILE A 127 10.246 3.293 6.774 1.00 0.00 H new ATOM 0 HD12 ILE A 127 11.804 3.284 7.634 1.00 0.00 H new ATOM 0 HD13 ILE A 127 11.585 4.317 6.202 1.00 0.00 H new TER 2005 ILE A 127