USER MOD reduce.3.24.130724 H: found=0, std=0, add=992, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 993 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 102 LYS NZ :NH3+ 143:sc= -0.137 (180deg=-1.89!) USER MOD Set 1.2: A 109 THR OG1 : rot 180:sc= -2.07! USER MOD Set 2.1: A 32 SER OG : rot -130:sc= -0.708 USER MOD Set 2.2: A 92 HIS : no HD1:sc= -0.73 K(o=-1.4,f=-4.6!) USER MOD Single : A 4 THR OG1 : rot 49:sc= 0.0372 USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= -3.73! K(o=-3.7!,f=0.87) USER MOD Single : A 20 THR OG1 : rot 71:sc= 0.0741 USER MOD Single : A 21 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.205) USER MOD Single : A 23 THR OG1 : rot 180:sc= -1.69! USER MOD Single : A 26 LYS NZ :NH3+ -148:sc= -3.97! (180deg=-5.86!) USER MOD Single : A 27 CYS SG : rot 111:sc= -6.31! USER MOD Single : A 30 SER OG : rot 115:sc= 1.27 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 34 MET CE :methyl -148:sc= -0.99 (180deg=-4.28!) USER MOD Single : A 36 ASN : amide:sc= -0.243 X(o=-0.24,f=-0.62) USER MOD Single : A 40 GLN : amide:sc= -0.265 K(o=-0.26,f=0.48) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 176:sc= -1.31 (180deg=-1.57) USER MOD Single : A 56 GLN : amide:sc= -0.451 X(o=-0.45,f=-0.87) USER MOD Single : A 59 GLN : amide:sc= -1.95 X(o=-2,f=-1.6) USER MOD Single : A 62 LYS NZ :NH3+ 168:sc= -1.1 (180deg=-1.87) USER MOD Single : A 66 THR OG1 : rot 180:sc= -0.0627 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -1.28 K(o=-1.3,f=-0.012) USER MOD Single : A 82 SER OG : rot 180:sc= -0.248 USER MOD Single : A 93 THR OG1 : rot 28:sc= 0.841 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 77:sc= 0.0147 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 HIS : no HD1:sc= -0.323 X(o=-0.32,f=-0.04) USER MOD Single : A 111 GLN : amide:sc= -2.34! K(o=-2.3!,f=-0.85) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 10:sc= -4.82! USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 MET CE :methyl -155:sc= -0.212 (180deg=-0.91) USER MOD Single : A 124 THR OG1 : rot 38:sc= -0.809 USER MOD ----------------------------------------------------------------- ATOM 21 N LEU A 3 -15.773 3.757 14.478 1.00 0.00 N ATOM 22 CA LEU A 3 -14.759 4.578 13.777 1.00 0.00 C ATOM 23 C LEU A 3 -13.555 4.916 14.676 1.00 0.00 C ATOM 24 O LEU A 3 -13.001 6.019 14.607 1.00 0.00 O ATOM 25 CB LEU A 3 -15.388 5.867 13.200 1.00 0.00 C ATOM 26 CG LEU A 3 -16.202 5.686 11.915 1.00 0.00 C ATOM 27 CD1 LEU A 3 -17.623 5.231 12.226 1.00 0.00 C ATOM 28 CD2 LEU A 3 -16.222 6.980 11.115 1.00 0.00 C ATOM 0 HA LEU A 3 -14.384 3.975 12.950 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -16.034 6.307 13.960 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -14.590 6.584 13.006 1.00 0.00 H new ATOM 0 HG LEU A 3 -15.723 4.911 11.317 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -18.178 5.110 11.296 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -17.592 4.279 12.756 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -18.116 5.978 12.849 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -16.804 6.836 10.205 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -16.674 7.771 11.714 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -15.202 7.261 10.853 1.00 0.00 H new ATOM 40 N THR A 4 -13.168 3.947 15.521 1.00 0.00 N ATOM 41 CA THR A 4 -12.024 4.080 16.436 1.00 0.00 C ATOM 42 C THR A 4 -11.515 2.699 16.855 1.00 0.00 C ATOM 43 O THR A 4 -12.091 2.057 17.743 1.00 0.00 O ATOM 44 CB THR A 4 -12.366 4.893 17.715 1.00 0.00 C ATOM 45 OG1 THR A 4 -13.670 4.541 18.193 1.00 0.00 O ATOM 46 CG2 THR A 4 -12.300 6.393 17.464 1.00 0.00 C ATOM 0 H THR A 4 -13.642 3.046 15.589 1.00 0.00 H new ATOM 0 HA THR A 4 -11.255 4.623 15.887 1.00 0.00 H new ATOM 0 HB THR A 4 -11.620 4.643 18.470 1.00 0.00 H new ATOM 0 HG1 THR A 4 -13.747 3.565 18.245 1.00 0.00 H new ATOM 0 HG21 THR A 4 -12.546 6.927 18.382 1.00 0.00 H new ATOM 0 HG22 THR A 4 -11.294 6.665 17.144 1.00 0.00 H new ATOM 0 HG23 THR A 4 -13.013 6.663 16.685 1.00 0.00 H new ATOM 54 N GLY A 5 -10.446 2.238 16.195 1.00 0.00 N ATOM 55 CA GLY A 5 -9.875 0.936 16.513 1.00 0.00 C ATOM 56 C GLY A 5 -8.362 0.892 16.380 1.00 0.00 C ATOM 57 O GLY A 5 -7.656 1.642 17.059 1.00 0.00 O ATOM 0 H GLY A 5 -9.969 2.743 15.449 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -10.151 0.666 17.532 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -10.312 0.185 15.855 1.00 0.00 H new ATOM 61 N ALA A 6 -7.870 0.008 15.500 1.00 0.00 N ATOM 62 CA ALA A 6 -6.428 -0.161 15.285 1.00 0.00 C ATOM 63 C ALA A 6 -5.984 0.224 13.863 1.00 0.00 C ATOM 64 O ALA A 6 -4.796 0.120 13.533 1.00 0.00 O ATOM 65 CB ALA A 6 -6.028 -1.598 15.597 1.00 0.00 C ATOM 0 H ALA A 6 -8.452 -0.601 14.925 1.00 0.00 H new ATOM 0 HA ALA A 6 -5.917 0.523 15.963 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -4.957 -1.721 15.436 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -6.268 -1.825 16.636 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -6.573 -2.278 14.942 1.00 0.00 H new ATOM 71 N LEU A 7 -6.931 0.679 13.035 1.00 0.00 N ATOM 72 CA LEU A 7 -6.630 1.085 11.662 1.00 0.00 C ATOM 73 C LEU A 7 -6.650 2.606 11.591 1.00 0.00 C ATOM 74 O LEU A 7 -7.512 3.211 10.940 1.00 0.00 O ATOM 75 CB LEU A 7 -7.645 0.469 10.682 1.00 0.00 C ATOM 76 CG LEU A 7 -7.133 0.140 9.274 1.00 0.00 C ATOM 77 CD1 LEU A 7 -8.114 -0.787 8.573 1.00 0.00 C ATOM 78 CD2 LEU A 7 -6.926 1.403 8.440 1.00 0.00 C ATOM 0 H LEU A 7 -7.913 0.775 13.294 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.642 0.724 11.375 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -8.032 -0.448 11.126 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -8.485 1.157 10.586 1.00 0.00 H new ATOM 0 HG LEU A 7 -6.167 -0.355 9.376 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -7.746 -1.018 7.573 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -8.215 -1.710 9.145 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -9.086 -0.299 8.498 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -6.563 1.129 7.449 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.872 1.936 8.345 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -6.195 2.046 8.929 1.00 0.00 H new ATOM 90 N ALA A 8 -5.679 3.230 12.290 1.00 0.00 N ATOM 91 CA ALA A 8 -5.573 4.700 12.388 1.00 0.00 C ATOM 92 C ALA A 8 -6.849 5.270 13.034 1.00 0.00 C ATOM 93 O ALA A 8 -7.231 6.424 12.801 1.00 0.00 O ATOM 94 CB ALA A 8 -5.300 5.336 11.019 1.00 0.00 C ATOM 0 H ALA A 8 -4.950 2.731 12.800 1.00 0.00 H new ATOM 0 HA ALA A 8 -4.722 4.948 13.023 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -5.228 6.418 11.128 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -4.363 4.949 10.618 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -6.114 5.094 10.336 1.00 0.00 H new ATOM 100 N MET A 9 -7.492 4.414 13.872 1.00 0.00 N ATOM 101 CA MET A 9 -8.747 4.719 14.589 1.00 0.00 C ATOM 102 C MET A 9 -9.952 4.652 13.631 1.00 0.00 C ATOM 103 O MET A 9 -10.845 5.500 13.675 1.00 0.00 O ATOM 104 CB MET A 9 -8.689 6.079 15.326 1.00 0.00 C ATOM 105 CG MET A 9 -7.740 6.092 16.516 1.00 0.00 C ATOM 106 SD MET A 9 -7.725 7.677 17.376 1.00 0.00 S ATOM 107 CE MET A 9 -6.538 7.345 18.675 1.00 0.00 C ATOM 0 H MET A 9 -7.141 3.476 14.068 1.00 0.00 H new ATOM 0 HA MET A 9 -8.875 3.955 15.356 1.00 0.00 H new ATOM 0 HB2 MET A 9 -8.383 6.851 14.620 1.00 0.00 H new ATOM 0 HB3 MET A 9 -9.690 6.339 15.669 1.00 0.00 H new ATOM 0 HG2 MET A 9 -8.029 5.307 17.215 1.00 0.00 H new ATOM 0 HG3 MET A 9 -6.732 5.859 16.174 1.00 0.00 H new ATOM 0 HE1 MET A 9 -6.419 8.234 19.295 1.00 0.00 H new ATOM 0 HE2 MET A 9 -6.894 6.518 19.290 1.00 0.00 H new ATOM 0 HE3 MET A 9 -5.578 7.080 18.232 1.00 0.00 H new ATOM 117 N ARG A 10 -9.949 3.631 12.746 1.00 0.00 N ATOM 118 CA ARG A 10 -11.034 3.417 11.758 1.00 0.00 C ATOM 119 C ARG A 10 -11.195 1.927 11.403 1.00 0.00 C ATOM 120 O ARG A 10 -11.920 1.577 10.465 1.00 0.00 O ATOM 121 CB ARG A 10 -10.785 4.224 10.466 1.00 0.00 C ATOM 122 CG ARG A 10 -10.740 5.737 10.647 1.00 0.00 C ATOM 123 CD ARG A 10 -9.784 6.379 9.656 1.00 0.00 C ATOM 124 NE ARG A 10 -9.755 7.840 9.786 1.00 0.00 N ATOM 125 CZ ARG A 10 -8.924 8.650 9.114 1.00 0.00 C ATOM 126 NH1 ARG A 10 -8.035 8.162 8.250 1.00 0.00 N ATOM 127 NH2 ARG A 10 -8.985 9.960 9.310 1.00 0.00 N ATOM 0 H ARG A 10 -9.203 2.937 12.695 1.00 0.00 H new ATOM 0 HA ARG A 10 -11.954 3.767 12.226 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -9.841 3.898 10.029 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -11.569 3.983 9.749 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -11.739 6.152 10.514 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -10.429 5.975 11.664 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -8.781 5.982 9.811 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -10.080 6.111 8.642 1.00 0.00 H new ATOM 0 HE ARG A 10 -10.414 8.271 10.434 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -7.978 7.156 8.090 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -7.411 8.794 7.748 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -9.661 10.346 9.969 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -8.356 10.582 8.802 1.00 0.00 H new ATOM 141 N LEU A 11 -10.533 1.049 12.173 1.00 0.00 N ATOM 142 CA LEU A 11 -10.604 -0.421 11.982 1.00 0.00 C ATOM 143 C LEU A 11 -12.050 -0.945 12.077 1.00 0.00 C ATOM 144 O LEU A 11 -12.320 -2.089 11.701 1.00 0.00 O ATOM 145 CB LEU A 11 -9.684 -1.083 13.044 1.00 0.00 C ATOM 146 CG LEU A 11 -9.561 -2.636 13.105 1.00 0.00 C ATOM 147 CD1 LEU A 11 -10.681 -3.252 13.934 1.00 0.00 C ATOM 148 CD2 LEU A 11 -9.512 -3.269 11.714 1.00 0.00 C ATOM 0 H LEU A 11 -9.932 1.331 12.947 1.00 0.00 H new ATOM 0 HA LEU A 11 -10.262 -0.678 10.980 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -8.680 -0.683 12.899 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -10.023 -0.745 14.023 1.00 0.00 H new ATOM 0 HG LEU A 11 -8.612 -2.852 13.596 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -10.564 -4.336 13.955 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -10.637 -2.862 14.951 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -11.644 -2.999 13.490 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -9.426 -4.351 11.810 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -10.424 -3.024 11.170 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -8.650 -2.884 11.169 1.00 0.00 H new ATOM 160 N ASN A 12 -12.975 -0.097 12.556 1.00 0.00 N ATOM 161 CA ASN A 12 -14.383 -0.473 12.678 1.00 0.00 C ATOM 162 C ASN A 12 -14.993 -0.757 11.324 1.00 0.00 C ATOM 163 O ASN A 12 -14.632 -0.162 10.307 1.00 0.00 O ATOM 164 CB ASN A 12 -15.192 0.606 13.391 1.00 0.00 C ATOM 165 CG ASN A 12 -14.892 0.665 14.876 1.00 0.00 C ATOM 166 OD1 ASN A 12 -15.672 0.181 15.696 1.00 0.00 O ATOM 167 ND2 ASN A 12 -13.752 1.241 15.229 1.00 0.00 N ATOM 0 H ASN A 12 -12.767 0.853 12.864 1.00 0.00 H new ATOM 0 HA ASN A 12 -14.417 -1.383 13.277 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -14.977 1.575 12.941 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -16.255 0.416 13.245 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -13.492 1.296 16.214 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -13.135 1.629 14.516 1.00 0.00 H new ATOM 174 N ASP A 13 -15.920 -1.688 11.369 1.00 0.00 N ATOM 175 CA ASP A 13 -16.671 -2.197 10.220 1.00 0.00 C ATOM 176 C ASP A 13 -17.195 -1.121 9.251 1.00 0.00 C ATOM 177 O ASP A 13 -17.409 -1.425 8.080 1.00 0.00 O ATOM 178 CB ASP A 13 -17.816 -3.057 10.762 1.00 0.00 C ATOM 179 CG ASP A 13 -18.578 -3.823 9.689 1.00 0.00 C ATOM 180 OD1 ASP A 13 -18.183 -4.968 9.383 1.00 0.00 O ATOM 181 OD2 ASP A 13 -19.567 -3.276 9.158 1.00 0.00 O ATOM 0 H ASP A 13 -16.191 -2.138 12.243 1.00 0.00 H new ATOM 0 HA ASP A 13 -15.981 -2.779 9.609 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -17.413 -3.767 11.484 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -18.514 -2.416 11.301 1.00 0.00 H new ATOM 186 N GLU A 14 -17.387 0.119 9.715 1.00 0.00 N ATOM 187 CA GLU A 14 -17.875 1.189 8.833 1.00 0.00 C ATOM 188 C GLU A 14 -16.789 1.622 7.855 1.00 0.00 C ATOM 189 O GLU A 14 -16.982 1.596 6.629 1.00 0.00 O ATOM 190 CB GLU A 14 -18.359 2.395 9.648 1.00 0.00 C ATOM 191 CG GLU A 14 -19.781 2.236 10.150 1.00 0.00 C ATOM 192 CD GLU A 14 -20.231 3.392 11.020 1.00 0.00 C ATOM 193 OE1 GLU A 14 -20.773 4.374 10.470 1.00 0.00 O ATOM 194 OE2 GLU A 14 -20.042 3.316 12.253 1.00 0.00 O ATOM 0 H GLU A 14 -17.216 0.405 10.679 1.00 0.00 H new ATOM 0 HA GLU A 14 -18.718 0.793 8.267 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -17.693 2.543 10.498 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -18.295 3.292 9.033 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -20.454 2.146 9.297 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -19.859 1.309 10.717 1.00 0.00 H new ATOM 201 N ASP A 15 -15.616 1.916 8.410 1.00 0.00 N ATOM 202 CA ASP A 15 -14.487 2.377 7.621 1.00 0.00 C ATOM 203 C ASP A 15 -13.760 1.202 7.018 1.00 0.00 C ATOM 204 O ASP A 15 -13.128 1.335 5.988 1.00 0.00 O ATOM 205 CB ASP A 15 -13.532 3.183 8.486 1.00 0.00 C ATOM 206 CG ASP A 15 -14.030 4.592 8.748 1.00 0.00 C ATOM 207 OD1 ASP A 15 -15.130 4.737 9.319 1.00 0.00 O ATOM 208 OD2 ASP A 15 -13.318 5.551 8.381 1.00 0.00 O ATOM 0 H ASP A 15 -15.426 1.841 9.409 1.00 0.00 H new ATOM 0 HA ASP A 15 -14.862 3.014 6.820 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -13.388 2.670 9.437 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -12.558 3.231 7.999 1.00 0.00 H new ATOM 213 N LEU A 16 -13.904 0.048 7.670 1.00 0.00 N ATOM 214 CA LEU A 16 -13.281 -1.196 7.240 1.00 0.00 C ATOM 215 C LEU A 16 -14.017 -1.778 6.043 1.00 0.00 C ATOM 216 O LEU A 16 -13.394 -2.371 5.175 1.00 0.00 O ATOM 217 CB LEU A 16 -13.260 -2.166 8.411 1.00 0.00 C ATOM 218 CG LEU A 16 -12.870 -3.613 8.097 1.00 0.00 C ATOM 219 CD1 LEU A 16 -11.928 -4.119 9.154 1.00 0.00 C ATOM 220 CD2 LEU A 16 -14.104 -4.503 8.017 1.00 0.00 C ATOM 0 H LEU A 16 -14.462 -0.046 8.519 1.00 0.00 H new ATOM 0 HA LEU A 16 -12.256 -1.006 6.922 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -12.567 -1.781 9.159 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -14.250 -2.171 8.866 1.00 0.00 H new ATOM 0 HG LEU A 16 -12.373 -3.641 7.127 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -11.650 -5.149 8.931 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -11.033 -3.497 9.171 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -12.417 -4.078 10.127 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -13.801 -5.526 7.793 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -14.631 -4.481 8.971 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -14.764 -4.139 7.230 1.00 0.00 H new ATOM 232 N ASP A 17 -15.349 -1.660 6.051 1.00 0.00 N ATOM 233 CA ASP A 17 -16.175 -2.107 4.922 1.00 0.00 C ATOM 234 C ASP A 17 -15.973 -1.140 3.748 1.00 0.00 C ATOM 235 O ASP A 17 -15.532 -1.537 2.640 1.00 0.00 O ATOM 236 CB ASP A 17 -17.653 -2.163 5.322 1.00 0.00 C ATOM 237 CG ASP A 17 -18.405 -3.277 4.621 1.00 0.00 C ATOM 238 OD1 ASP A 17 -18.947 -3.029 3.523 1.00 0.00 O ATOM 239 OD2 ASP A 17 -18.452 -4.398 5.170 1.00 0.00 O ATOM 0 H ASP A 17 -15.879 -1.259 6.825 1.00 0.00 H new ATOM 0 HA ASP A 17 -15.872 -3.111 4.626 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -17.729 -2.301 6.401 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -18.125 -1.208 5.089 1.00 0.00 H new ATOM 244 N PHE A 18 -16.221 0.163 4.015 1.00 0.00 N ATOM 245 CA PHE A 18 -16.037 1.185 2.990 1.00 0.00 C ATOM 246 C PHE A 18 -14.547 1.277 2.593 1.00 0.00 C ATOM 247 O PHE A 18 -14.211 1.869 1.568 1.00 0.00 O ATOM 248 CB PHE A 18 -16.641 2.539 3.419 1.00 0.00 C ATOM 249 CG PHE A 18 -18.153 2.529 3.484 1.00 0.00 C ATOM 250 CD1 PHE A 18 -18.913 2.481 2.320 1.00 0.00 C ATOM 251 CD2 PHE A 18 -18.813 2.568 4.701 1.00 0.00 C ATOM 252 CE1 PHE A 18 -20.293 2.470 2.376 1.00 0.00 C ATOM 253 CE2 PHE A 18 -20.193 2.558 4.761 1.00 0.00 C ATOM 254 CZ PHE A 18 -20.934 2.508 3.598 1.00 0.00 C ATOM 0 H PHE A 18 -16.542 0.515 4.917 1.00 0.00 H new ATOM 0 HA PHE A 18 -16.589 0.893 2.097 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -16.244 2.812 4.397 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -16.320 3.310 2.719 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -18.418 2.452 1.361 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -18.241 2.607 5.616 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -20.870 2.432 1.464 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -20.692 2.589 5.718 1.00 0.00 H new ATOM 0 HZ PHE A 18 -22.013 2.499 3.644 1.00 0.00 H new ATOM 264 N LEU A 19 -13.665 0.723 3.461 1.00 0.00 N ATOM 265 CA LEU A 19 -12.224 0.607 3.188 1.00 0.00 C ATOM 266 C LEU A 19 -11.956 -0.703 2.417 1.00 0.00 C ATOM 267 O LEU A 19 -11.053 -0.778 1.585 1.00 0.00 O ATOM 268 CB LEU A 19 -11.404 0.552 4.501 1.00 0.00 C ATOM 269 CG LEU A 19 -9.935 1.075 4.490 1.00 0.00 C ATOM 270 CD1 LEU A 19 -9.235 0.909 3.143 1.00 0.00 C ATOM 271 CD2 LEU A 19 -9.877 2.528 4.932 1.00 0.00 C ATOM 0 H LEU A 19 -13.940 0.346 4.368 1.00 0.00 H new ATOM 0 HA LEU A 19 -11.924 1.481 2.609 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -11.950 1.118 5.256 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -11.383 -0.486 4.834 1.00 0.00 H new ATOM 0 HG LEU A 19 -9.393 0.452 5.201 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -8.218 1.295 3.212 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -9.205 -0.147 2.876 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -9.782 1.461 2.378 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -8.843 2.872 4.917 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -10.473 3.139 4.253 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -10.274 2.617 5.943 1.00 0.00 H new ATOM 283 N THR A 20 -12.757 -1.744 2.729 1.00 0.00 N ATOM 284 CA THR A 20 -12.602 -3.078 2.127 1.00 0.00 C ATOM 285 C THR A 20 -13.035 -3.118 0.659 1.00 0.00 C ATOM 286 O THR A 20 -12.758 -4.096 -0.040 1.00 0.00 O ATOM 287 CB THR A 20 -13.340 -4.181 2.948 1.00 0.00 C ATOM 288 OG1 THR A 20 -12.659 -5.431 2.795 1.00 0.00 O ATOM 289 CG2 THR A 20 -14.805 -4.364 2.544 1.00 0.00 C ATOM 0 H THR A 20 -13.522 -1.681 3.400 1.00 0.00 H new ATOM 0 HA THR A 20 -11.534 -3.293 2.156 1.00 0.00 H new ATOM 0 HB THR A 20 -13.330 -3.850 3.986 1.00 0.00 H new ATOM 0 HG1 THR A 20 -11.804 -5.398 3.273 1.00 0.00 H new ATOM 0 HG21 THR A 20 -15.256 -5.146 3.155 1.00 0.00 H new ATOM 0 HG22 THR A 20 -15.344 -3.429 2.696 1.00 0.00 H new ATOM 0 HG23 THR A 20 -14.860 -4.648 1.493 1.00 0.00 H new ATOM 297 N LYS A 21 -13.741 -2.057 0.225 1.00 0.00 N ATOM 298 CA LYS A 21 -14.210 -1.897 -1.182 1.00 0.00 C ATOM 299 C LYS A 21 -13.260 -2.491 -2.248 1.00 0.00 C ATOM 300 O LYS A 21 -13.720 -3.039 -3.253 1.00 0.00 O ATOM 301 CB LYS A 21 -14.416 -0.398 -1.513 1.00 0.00 C ATOM 302 CG LYS A 21 -13.421 0.573 -0.874 1.00 0.00 C ATOM 303 CD LYS A 21 -12.071 0.589 -1.573 1.00 0.00 C ATOM 304 CE LYS A 21 -10.987 1.038 -0.623 1.00 0.00 C ATOM 305 NZ LYS A 21 -9.639 1.018 -1.255 1.00 0.00 N ATOM 0 H LYS A 21 -14.007 -1.282 0.832 1.00 0.00 H new ATOM 0 HA LYS A 21 -15.144 -2.456 -1.229 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -14.369 -0.276 -2.595 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -15.421 -0.113 -1.203 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -13.843 1.578 -0.888 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -13.279 0.302 0.172 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -11.840 -0.406 -1.953 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -12.108 1.258 -2.433 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -11.207 2.047 -0.274 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -10.984 0.391 0.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -8.910 1.117 -0.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -9.504 0.117 -1.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -9.560 1.806 -1.930 1.00 0.00 H new ATOM 319 N TRP A 22 -11.940 -2.374 -2.010 1.00 0.00 N ATOM 320 CA TRP A 22 -10.905 -2.851 -2.943 1.00 0.00 C ATOM 321 C TRP A 22 -9.525 -2.803 -2.264 1.00 0.00 C ATOM 322 O TRP A 22 -9.419 -2.378 -1.111 1.00 0.00 O ATOM 323 CB TRP A 22 -10.910 -1.981 -4.219 1.00 0.00 C ATOM 324 CG TRP A 22 -10.644 -2.741 -5.490 1.00 0.00 C ATOM 325 CD1 TRP A 22 -9.580 -2.578 -6.329 1.00 0.00 C ATOM 326 CD2 TRP A 22 -11.462 -3.769 -6.078 1.00 0.00 C ATOM 327 NE1 TRP A 22 -9.681 -3.437 -7.395 1.00 0.00 N ATOM 328 CE2 TRP A 22 -10.824 -4.180 -7.264 1.00 0.00 C ATOM 329 CE3 TRP A 22 -12.667 -4.385 -5.716 1.00 0.00 C ATOM 330 CZ2 TRP A 22 -11.348 -5.173 -8.088 1.00 0.00 C ATOM 331 CZ3 TRP A 22 -13.185 -5.370 -6.535 1.00 0.00 C ATOM 332 CH2 TRP A 22 -12.526 -5.756 -7.709 1.00 0.00 C ATOM 0 H TRP A 22 -11.562 -1.946 -1.165 1.00 0.00 H new ATOM 0 HA TRP A 22 -11.119 -3.883 -3.222 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -11.877 -1.485 -4.302 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -10.158 -1.199 -4.114 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -8.775 -1.875 -6.176 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -9.012 -3.510 -8.162 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -13.182 -4.095 -4.812 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -10.842 -5.472 -8.994 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -14.114 -5.850 -6.265 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -12.957 -6.530 -8.328 1.00 0.00 H new ATOM 343 N THR A 23 -8.474 -3.228 -2.981 1.00 0.00 N ATOM 344 CA THR A 23 -7.110 -3.235 -2.437 1.00 0.00 C ATOM 345 C THR A 23 -6.277 -2.102 -3.037 1.00 0.00 C ATOM 346 O THR A 23 -6.776 -1.332 -3.861 1.00 0.00 O ATOM 347 CB THR A 23 -6.399 -4.584 -2.659 1.00 0.00 C ATOM 348 OG1 THR A 23 -7.327 -5.594 -3.081 1.00 0.00 O ATOM 349 CG2 THR A 23 -5.741 -5.010 -1.365 1.00 0.00 C ATOM 0 H THR A 23 -8.544 -3.571 -3.939 1.00 0.00 H new ATOM 0 HA THR A 23 -7.202 -3.081 -1.362 1.00 0.00 H new ATOM 0 HB THR A 23 -5.651 -4.462 -3.443 1.00 0.00 H new ATOM 0 HG1 THR A 23 -6.851 -6.440 -3.217 1.00 0.00 H new ATOM 0 HG21 THR A 23 -5.235 -5.964 -1.511 1.00 0.00 H new ATOM 0 HG22 THR A 23 -5.014 -4.256 -1.061 1.00 0.00 H new ATOM 0 HG23 THR A 23 -6.499 -5.117 -0.589 1.00 0.00 H new ATOM 357 N ASP A 24 -5.006 -2.012 -2.629 1.00 0.00 N ATOM 358 CA ASP A 24 -4.119 -0.953 -3.104 1.00 0.00 C ATOM 359 C ASP A 24 -2.931 -1.523 -3.886 1.00 0.00 C ATOM 360 O ASP A 24 -1.958 -0.811 -4.163 1.00 0.00 O ATOM 361 CB ASP A 24 -3.631 -0.126 -1.913 1.00 0.00 C ATOM 362 CG ASP A 24 -4.743 0.682 -1.267 1.00 0.00 C ATOM 363 OD1 ASP A 24 -5.398 0.157 -0.342 1.00 0.00 O ATOM 364 OD2 ASP A 24 -4.956 1.839 -1.686 1.00 0.00 O ATOM 0 H ASP A 24 -4.572 -2.661 -1.972 1.00 0.00 H new ATOM 0 HA ASP A 24 -4.679 -0.313 -3.786 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.191 -0.791 -1.170 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -2.842 0.549 -2.243 1.00 0.00 H new ATOM 369 N PHE A 25 -3.032 -2.799 -4.272 1.00 0.00 N ATOM 370 CA PHE A 25 -1.967 -3.465 -5.012 1.00 0.00 C ATOM 371 C PHE A 25 -2.396 -3.706 -6.464 1.00 0.00 C ATOM 372 O PHE A 25 -2.385 -4.820 -6.996 1.00 0.00 O ATOM 373 CB PHE A 25 -1.602 -4.738 -4.248 1.00 0.00 C ATOM 374 CG PHE A 25 -0.354 -5.492 -4.658 1.00 0.00 C ATOM 375 CD1 PHE A 25 -0.323 -6.255 -5.818 1.00 0.00 C ATOM 376 CD2 PHE A 25 0.778 -5.464 -3.858 1.00 0.00 C ATOM 377 CE1 PHE A 25 0.809 -6.963 -6.173 1.00 0.00 C ATOM 378 CE2 PHE A 25 1.915 -6.167 -4.210 1.00 0.00 C ATOM 379 CZ PHE A 25 1.930 -6.917 -5.368 1.00 0.00 C ATOM 0 H PHE A 25 -3.843 -3.388 -4.082 1.00 0.00 H new ATOM 0 HA PHE A 25 -1.072 -2.847 -5.082 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -1.500 -4.475 -3.195 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -2.445 -5.425 -4.325 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -1.197 -6.295 -6.452 1.00 0.00 H new ATOM 0 HD2 PHE A 25 0.771 -4.885 -2.947 1.00 0.00 H new ATOM 0 HE1 PHE A 25 0.817 -7.551 -7.079 1.00 0.00 H new ATOM 0 HE2 PHE A 25 2.791 -6.129 -3.579 1.00 0.00 H new ATOM 0 HZ PHE A 25 2.817 -7.467 -5.644 1.00 0.00 H new ATOM 389 N LYS A 26 -2.794 -2.599 -7.062 1.00 0.00 N ATOM 390 CA LYS A 26 -3.135 -2.495 -8.464 1.00 0.00 C ATOM 391 C LYS A 26 -2.295 -1.333 -8.972 1.00 0.00 C ATOM 392 O LYS A 26 -2.399 -0.894 -10.122 1.00 0.00 O ATOM 393 CB LYS A 26 -4.667 -2.296 -8.701 1.00 0.00 C ATOM 394 CG LYS A 26 -5.201 -0.845 -8.681 1.00 0.00 C ATOM 395 CD LYS A 26 -5.482 -0.310 -7.270 1.00 0.00 C ATOM 396 CE LYS A 26 -4.202 -0.043 -6.475 1.00 0.00 C ATOM 397 NZ LYS A 26 -4.184 1.270 -5.781 1.00 0.00 N ATOM 0 H LYS A 26 -2.892 -1.715 -6.563 1.00 0.00 H new ATOM 0 HA LYS A 26 -2.919 -3.415 -9.007 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.920 -2.736 -9.666 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -5.203 -2.864 -7.941 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -4.476 -0.194 -9.169 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.118 -0.797 -9.268 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.058 0.612 -7.343 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -6.098 -1.029 -6.729 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -4.074 -0.834 -5.737 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -3.349 -0.097 -7.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -3.208 1.627 -5.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -4.778 1.946 -6.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -4.554 1.157 -4.815 1.00 0.00 H new ATOM 411 N CYS A 27 -1.443 -0.868 -8.042 1.00 0.00 N ATOM 412 CA CYS A 27 -0.550 0.232 -8.252 1.00 0.00 C ATOM 413 C CYS A 27 0.857 -0.182 -7.863 1.00 0.00 C ATOM 414 O CYS A 27 1.110 -0.651 -6.713 1.00 0.00 O ATOM 415 CB CYS A 27 -0.997 1.446 -7.427 1.00 0.00 C ATOM 416 SG CYS A 27 0.131 2.860 -7.508 1.00 0.00 S ATOM 0 H CYS A 27 -1.372 -1.272 -7.108 1.00 0.00 H new ATOM 0 HA CYS A 27 -0.564 0.512 -9.305 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -1.982 1.762 -7.772 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -1.106 1.143 -6.386 1.00 0.00 H new ATOM 0 HG CYS A 27 -0.430 3.825 -8.175 1.00 0.00 H new ATOM 422 N PHE A 28 1.746 -0.038 -8.854 1.00 0.00 N ATOM 423 CA PHE A 28 3.156 -0.330 -8.700 1.00 0.00 C ATOM 424 C PHE A 28 3.865 0.942 -8.298 1.00 0.00 C ATOM 425 O PHE A 28 3.813 1.935 -9.019 1.00 0.00 O ATOM 426 CB PHE A 28 3.743 -0.883 -10.006 1.00 0.00 C ATOM 427 CG PHE A 28 3.268 -2.268 -10.349 1.00 0.00 C ATOM 428 CD1 PHE A 28 3.976 -3.381 -9.926 1.00 0.00 C ATOM 429 CD2 PHE A 28 2.114 -2.456 -11.094 1.00 0.00 C ATOM 430 CE1 PHE A 28 3.543 -4.656 -10.239 1.00 0.00 C ATOM 431 CE2 PHE A 28 1.676 -3.729 -11.410 1.00 0.00 C ATOM 432 CZ PHE A 28 2.392 -4.830 -10.982 1.00 0.00 C ATOM 0 H PHE A 28 1.494 0.287 -9.787 1.00 0.00 H new ATOM 0 HA PHE A 28 3.292 -1.090 -7.931 1.00 0.00 H new ATOM 0 HB2 PHE A 28 3.486 -0.209 -10.823 1.00 0.00 H new ATOM 0 HB3 PHE A 28 4.830 -0.891 -9.930 1.00 0.00 H new ATOM 0 HD1 PHE A 28 4.877 -3.251 -9.345 1.00 0.00 H new ATOM 0 HD2 PHE A 28 1.551 -1.599 -11.431 1.00 0.00 H new ATOM 0 HE1 PHE A 28 4.104 -5.515 -9.903 1.00 0.00 H new ATOM 0 HE2 PHE A 28 0.775 -3.862 -11.991 1.00 0.00 H new ATOM 0 HZ PHE A 28 2.052 -5.825 -11.228 1.00 0.00 H new ATOM 442 N VAL A 29 4.552 0.907 -7.167 1.00 0.00 N ATOM 443 CA VAL A 29 5.247 2.089 -6.697 1.00 0.00 C ATOM 444 C VAL A 29 6.736 1.979 -7.031 1.00 0.00 C ATOM 445 O VAL A 29 7.385 0.944 -6.785 1.00 0.00 O ATOM 446 CB VAL A 29 4.935 2.354 -5.191 1.00 0.00 C ATOM 447 CG1 VAL A 29 6.071 3.063 -4.450 1.00 0.00 C ATOM 448 CG2 VAL A 29 3.663 3.180 -5.079 1.00 0.00 C ATOM 0 H VAL A 29 4.641 0.086 -6.568 1.00 0.00 H new ATOM 0 HA VAL A 29 4.884 2.975 -7.218 1.00 0.00 H new ATOM 0 HB VAL A 29 4.812 1.380 -4.717 1.00 0.00 H new ATOM 0 HG11 VAL A 29 5.787 3.216 -3.409 1.00 0.00 H new ATOM 0 HG12 VAL A 29 6.972 2.451 -4.494 1.00 0.00 H new ATOM 0 HG13 VAL A 29 6.264 4.028 -4.918 1.00 0.00 H new ATOM 0 HG21 VAL A 29 3.442 3.367 -4.028 1.00 0.00 H new ATOM 0 HG22 VAL A 29 3.799 4.130 -5.596 1.00 0.00 H new ATOM 0 HG23 VAL A 29 2.835 2.636 -5.533 1.00 0.00 H new ATOM 458 N SER A 30 7.239 3.125 -7.531 1.00 0.00 N ATOM 459 CA SER A 30 8.603 3.332 -8.063 1.00 0.00 C ATOM 460 C SER A 30 9.665 2.350 -7.613 1.00 0.00 C ATOM 461 O SER A 30 10.210 2.419 -6.512 1.00 0.00 O ATOM 462 CB SER A 30 9.055 4.774 -7.792 1.00 0.00 C ATOM 463 OG SER A 30 8.737 5.176 -6.470 1.00 0.00 O ATOM 0 H SER A 30 6.677 3.975 -7.578 1.00 0.00 H new ATOM 0 HA SER A 30 8.509 3.138 -9.132 1.00 0.00 H new ATOM 0 HB2 SER A 30 10.130 4.856 -7.950 1.00 0.00 H new ATOM 0 HB3 SER A 30 8.576 5.447 -8.504 1.00 0.00 H new ATOM 0 HG SER A 30 9.564 5.330 -5.967 1.00 0.00 H new ATOM 469 N ALA A 31 9.944 1.438 -8.549 1.00 0.00 N ATOM 470 CA ALA A 31 10.956 0.409 -8.402 1.00 0.00 C ATOM 471 C ALA A 31 12.322 0.993 -8.711 1.00 0.00 C ATOM 472 O ALA A 31 13.310 0.625 -8.070 1.00 0.00 O ATOM 473 CB ALA A 31 10.630 -0.742 -9.306 1.00 0.00 C ATOM 0 H ALA A 31 9.458 1.401 -9.445 1.00 0.00 H new ATOM 0 HA ALA A 31 10.973 0.040 -7.376 1.00 0.00 H new ATOM 0 HB1 ALA A 31 11.389 -1.516 -9.197 1.00 0.00 H new ATOM 0 HB2 ALA A 31 9.655 -1.150 -9.039 1.00 0.00 H new ATOM 0 HB3 ALA A 31 10.608 -0.398 -10.340 1.00 0.00 H new ATOM 479 N SER A 32 12.354 1.884 -9.738 1.00 0.00 N ATOM 480 CA SER A 32 13.550 2.654 -10.135 1.00 0.00 C ATOM 481 C SER A 32 14.199 2.173 -11.440 1.00 0.00 C ATOM 482 O SER A 32 14.193 2.902 -12.437 1.00 0.00 O ATOM 483 CB SER A 32 14.571 2.674 -9.004 1.00 0.00 C ATOM 484 OG SER A 32 15.349 3.858 -9.037 1.00 0.00 O ATOM 0 H SER A 32 11.538 2.085 -10.316 1.00 0.00 H new ATOM 0 HA SER A 32 13.201 3.667 -10.333 1.00 0.00 H new ATOM 0 HB2 SER A 32 14.057 2.600 -8.045 1.00 0.00 H new ATOM 0 HB3 SER A 32 15.224 1.805 -9.084 1.00 0.00 H new ATOM 0 HG SER A 32 16.300 3.626 -8.984 1.00 0.00 H new ATOM 490 N ASN A 33 14.752 0.957 -11.428 1.00 0.00 N ATOM 491 CA ASN A 33 15.412 0.378 -12.595 1.00 0.00 C ATOM 492 C ASN A 33 14.414 -0.500 -13.318 1.00 0.00 C ATOM 493 O ASN A 33 14.555 -0.802 -14.506 1.00 0.00 O ATOM 494 CB ASN A 33 16.638 -0.424 -12.165 1.00 0.00 C ATOM 495 CG ASN A 33 17.893 0.424 -12.103 1.00 0.00 C ATOM 496 OD1 ASN A 33 18.212 1.008 -11.068 1.00 0.00 O ATOM 497 ND2 ASN A 33 18.614 0.496 -13.217 1.00 0.00 N ATOM 0 H ASN A 33 14.753 0.349 -10.609 1.00 0.00 H new ATOM 0 HA ASN A 33 15.755 1.166 -13.265 1.00 0.00 H new ATOM 0 HB2 ASN A 33 16.454 -0.867 -11.186 1.00 0.00 H new ATOM 0 HB3 ASN A 33 16.793 -1.247 -12.863 1.00 0.00 H new ATOM 0 HD21 ASN A 33 19.469 1.052 -13.236 1.00 0.00 H new ATOM 0 HD22 ASN A 33 18.312 -0.005 -14.053 1.00 0.00 H new ATOM 504 N MET A 34 13.400 -0.899 -12.548 1.00 0.00 N ATOM 505 CA MET A 34 12.295 -1.691 -13.028 1.00 0.00 C ATOM 506 C MET A 34 11.215 -0.731 -13.556 1.00 0.00 C ATOM 507 O MET A 34 10.598 -0.972 -14.596 1.00 0.00 O ATOM 508 CB MET A 34 11.775 -2.548 -11.872 1.00 0.00 C ATOM 509 CG MET A 34 10.687 -3.557 -12.221 1.00 0.00 C ATOM 510 SD MET A 34 11.154 -4.683 -13.548 1.00 0.00 S ATOM 511 CE MET A 34 10.454 -3.817 -14.947 1.00 0.00 C ATOM 0 H MET A 34 13.334 -0.670 -11.556 1.00 0.00 H new ATOM 0 HA MET A 34 12.594 -2.357 -13.837 1.00 0.00 H new ATOM 0 HB2 MET A 34 12.617 -3.088 -11.439 1.00 0.00 H new ATOM 0 HB3 MET A 34 11.391 -1.883 -11.098 1.00 0.00 H new ATOM 0 HG2 MET A 34 10.441 -4.137 -11.332 1.00 0.00 H new ATOM 0 HG3 MET A 34 9.784 -3.020 -12.511 1.00 0.00 H new ATOM 0 HE1 MET A 34 10.133 -4.539 -15.698 1.00 0.00 H new ATOM 0 HE2 MET A 34 9.597 -3.229 -14.619 1.00 0.00 H new ATOM 0 HE3 MET A 34 11.205 -3.155 -15.378 1.00 0.00 H new ATOM 521 N ARG A 35 11.026 0.376 -12.824 1.00 0.00 N ATOM 522 CA ARG A 35 10.072 1.402 -13.201 1.00 0.00 C ATOM 523 C ARG A 35 10.814 2.716 -13.375 1.00 0.00 C ATOM 524 O ARG A 35 11.506 3.178 -12.461 1.00 0.00 O ATOM 525 CB ARG A 35 8.942 1.537 -12.150 1.00 0.00 C ATOM 526 CG ARG A 35 8.194 2.874 -12.148 1.00 0.00 C ATOM 527 CD ARG A 35 7.394 3.080 -13.427 1.00 0.00 C ATOM 528 NE ARG A 35 6.044 2.515 -13.330 1.00 0.00 N ATOM 529 CZ ARG A 35 5.322 2.077 -14.372 1.00 0.00 C ATOM 530 NH1 ARG A 35 5.803 2.127 -15.613 1.00 0.00 N ATOM 531 NH2 ARG A 35 4.109 1.583 -14.167 1.00 0.00 N ATOM 0 H ARG A 35 11.532 0.575 -11.961 1.00 0.00 H new ATOM 0 HA ARG A 35 9.597 1.122 -14.141 1.00 0.00 H new ATOM 0 HB2 ARG A 35 8.220 0.738 -12.315 1.00 0.00 H new ATOM 0 HB3 ARG A 35 9.371 1.380 -11.160 1.00 0.00 H new ATOM 0 HG2 ARG A 35 7.523 2.913 -11.290 1.00 0.00 H new ATOM 0 HG3 ARG A 35 8.908 3.689 -12.031 1.00 0.00 H new ATOM 0 HD2 ARG A 35 7.326 4.146 -13.644 1.00 0.00 H new ATOM 0 HD3 ARG A 35 7.921 2.618 -14.262 1.00 0.00 H new ATOM 0 HE ARG A 35 5.624 2.450 -12.403 1.00 0.00 H new ATOM 0 HH11 ARG A 35 6.736 2.503 -15.784 1.00 0.00 H new ATOM 0 HH12 ARG A 35 5.239 1.789 -16.393 1.00 0.00 H new ATOM 0 HH21 ARG A 35 3.730 1.538 -13.221 1.00 0.00 H new ATOM 0 HH22 ARG A 35 3.555 1.248 -14.955 1.00 0.00 H new ATOM 545 N ASN A 36 10.645 3.305 -14.556 1.00 0.00 N ATOM 546 CA ASN A 36 11.279 4.583 -14.914 1.00 0.00 C ATOM 547 C ASN A 36 10.841 5.072 -16.326 1.00 0.00 C ATOM 548 O ASN A 36 11.276 6.140 -16.771 1.00 0.00 O ATOM 549 CB ASN A 36 12.828 4.456 -14.811 1.00 0.00 C ATOM 550 CG ASN A 36 13.574 5.766 -15.025 1.00 0.00 C ATOM 551 OD1 ASN A 36 13.937 6.111 -16.150 1.00 0.00 O ATOM 552 ND2 ASN A 36 13.803 6.500 -13.942 1.00 0.00 N ATOM 0 H ASN A 36 10.064 2.913 -15.297 1.00 0.00 H new ATOM 0 HA ASN A 36 10.944 5.339 -14.204 1.00 0.00 H new ATOM 0 HB2 ASN A 36 13.085 4.060 -13.828 1.00 0.00 H new ATOM 0 HB3 ASN A 36 13.172 3.730 -15.547 1.00 0.00 H new ATOM 0 HD21 ASN A 36 14.298 7.388 -14.023 1.00 0.00 H new ATOM 0 HD22 ASN A 36 13.484 6.175 -13.029 1.00 0.00 H new ATOM 559 N ALA A 37 9.967 4.304 -17.017 1.00 0.00 N ATOM 560 CA ALA A 37 9.502 4.658 -18.361 1.00 0.00 C ATOM 561 C ALA A 37 8.237 5.533 -18.341 1.00 0.00 C ATOM 562 O ALA A 37 8.288 6.692 -18.765 1.00 0.00 O ATOM 563 CB ALA A 37 9.278 3.395 -19.187 1.00 0.00 C ATOM 0 H ALA A 37 9.574 3.434 -16.657 1.00 0.00 H new ATOM 0 HA ALA A 37 10.284 5.258 -18.827 1.00 0.00 H new ATOM 0 HB1 ALA A 37 8.933 3.669 -20.184 1.00 0.00 H new ATOM 0 HB2 ALA A 37 10.214 2.841 -19.266 1.00 0.00 H new ATOM 0 HB3 ALA A 37 8.527 2.771 -18.702 1.00 0.00 H new ATOM 569 N ALA A 38 7.107 4.983 -17.852 1.00 0.00 N ATOM 570 CA ALA A 38 5.844 5.730 -17.812 1.00 0.00 C ATOM 571 C ALA A 38 5.454 6.129 -16.391 1.00 0.00 C ATOM 572 O ALA A 38 5.160 7.302 -16.140 1.00 0.00 O ATOM 573 CB ALA A 38 4.733 4.915 -18.464 1.00 0.00 C ATOM 0 H ALA A 38 7.048 4.034 -17.484 1.00 0.00 H new ATOM 0 HA ALA A 38 5.990 6.653 -18.373 1.00 0.00 H new ATOM 0 HB1 ALA A 38 3.800 5.478 -18.429 1.00 0.00 H new ATOM 0 HB2 ALA A 38 4.994 4.709 -19.502 1.00 0.00 H new ATOM 0 HB3 ALA A 38 4.609 3.974 -17.928 1.00 0.00 H new ATOM 579 N GLY A 39 5.450 5.158 -15.461 1.00 0.00 N ATOM 580 CA GLY A 39 5.116 5.438 -14.072 1.00 0.00 C ATOM 581 C GLY A 39 3.674 5.815 -13.846 1.00 0.00 C ATOM 582 O GLY A 39 3.377 6.593 -12.935 1.00 0.00 O ATOM 0 H GLY A 39 5.674 4.182 -15.654 1.00 0.00 H new ATOM 0 HA2 GLY A 39 5.349 4.560 -13.470 1.00 0.00 H new ATOM 0 HA3 GLY A 39 5.752 6.248 -13.713 1.00 0.00 H new ATOM 586 N GLN A 40 2.776 5.294 -14.686 1.00 0.00 N ATOM 587 CA GLN A 40 1.362 5.562 -14.509 1.00 0.00 C ATOM 588 C GLN A 40 0.788 4.564 -13.520 1.00 0.00 C ATOM 589 O GLN A 40 0.214 3.524 -13.868 1.00 0.00 O ATOM 590 CB GLN A 40 0.615 5.575 -15.834 1.00 0.00 C ATOM 591 CG GLN A 40 0.329 6.988 -16.294 1.00 0.00 C ATOM 592 CD GLN A 40 -0.677 7.051 -17.427 1.00 0.00 C ATOM 593 OE1 GLN A 40 -1.882 7.145 -17.197 1.00 0.00 O ATOM 594 NE2 GLN A 40 -0.185 6.998 -18.659 1.00 0.00 N ATOM 0 H GLN A 40 3.005 4.695 -15.480 1.00 0.00 H new ATOM 0 HA GLN A 40 1.235 6.564 -14.099 1.00 0.00 H new ATOM 0 HB2 GLN A 40 1.204 5.057 -16.591 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -0.322 5.028 -15.730 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -0.044 7.570 -15.451 1.00 0.00 H new ATOM 0 HG3 GLN A 40 1.260 7.455 -16.616 1.00 0.00 H new ATOM 0 HE21 GLN A 40 0.822 6.920 -18.803 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -0.814 7.035 -19.461 1.00 0.00 H new ATOM 603 N PHE A 41 1.002 4.930 -12.269 1.00 0.00 N ATOM 604 CA PHE A 41 0.598 4.157 -11.112 1.00 0.00 C ATOM 605 C PHE A 41 -0.147 5.062 -10.130 1.00 0.00 C ATOM 606 O PHE A 41 -1.074 4.626 -9.431 1.00 0.00 O ATOM 607 CB PHE A 41 1.851 3.522 -10.475 1.00 0.00 C ATOM 608 CG PHE A 41 2.810 4.495 -9.816 1.00 0.00 C ATOM 609 CD1 PHE A 41 2.652 4.860 -8.486 1.00 0.00 C ATOM 610 CD2 PHE A 41 3.868 5.032 -10.529 1.00 0.00 C ATOM 611 CE1 PHE A 41 3.531 5.741 -7.885 1.00 0.00 C ATOM 612 CE2 PHE A 41 4.749 5.915 -9.934 1.00 0.00 C ATOM 613 CZ PHE A 41 4.580 6.270 -8.611 1.00 0.00 C ATOM 0 H PHE A 41 1.476 5.800 -12.025 1.00 0.00 H new ATOM 0 HA PHE A 41 -0.081 3.355 -11.401 1.00 0.00 H new ATOM 0 HB2 PHE A 41 1.530 2.794 -9.730 1.00 0.00 H new ATOM 0 HB3 PHE A 41 2.391 2.972 -11.246 1.00 0.00 H new ATOM 0 HD1 PHE A 41 1.832 4.451 -7.914 1.00 0.00 H new ATOM 0 HD2 PHE A 41 4.007 4.757 -11.564 1.00 0.00 H new ATOM 0 HE1 PHE A 41 3.398 6.015 -6.849 1.00 0.00 H new ATOM 0 HE2 PHE A 41 5.569 6.327 -10.504 1.00 0.00 H new ATOM 0 HZ PHE A 41 5.267 6.960 -8.144 1.00 0.00 H new ATOM 623 N ILE A 42 0.278 6.344 -10.100 1.00 0.00 N ATOM 624 CA ILE A 42 -0.326 7.375 -9.249 1.00 0.00 C ATOM 625 C ILE A 42 -1.834 7.493 -9.494 1.00 0.00 C ATOM 626 O ILE A 42 -2.560 8.027 -8.651 1.00 0.00 O ATOM 627 CB ILE A 42 0.347 8.772 -9.433 1.00 0.00 C ATOM 628 CG1 ILE A 42 0.590 9.124 -10.917 1.00 0.00 C ATOM 629 CG2 ILE A 42 1.658 8.826 -8.663 1.00 0.00 C ATOM 630 CD1 ILE A 42 -0.563 9.860 -11.571 1.00 0.00 C ATOM 0 H ILE A 42 1.052 6.687 -10.669 1.00 0.00 H new ATOM 0 HA ILE A 42 -0.157 7.053 -8.222 1.00 0.00 H new ATOM 0 HB ILE A 42 -0.345 9.515 -9.036 1.00 0.00 H new ATOM 0 HG12 ILE A 42 1.489 9.736 -10.992 1.00 0.00 H new ATOM 0 HG13 ILE A 42 0.783 8.205 -11.471 1.00 0.00 H new ATOM 0 HG21 ILE A 42 2.119 9.804 -8.798 1.00 0.00 H new ATOM 0 HG22 ILE A 42 1.465 8.659 -7.603 1.00 0.00 H new ATOM 0 HG23 ILE A 42 2.331 8.053 -9.035 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -0.316 10.072 -12.611 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -1.460 9.242 -11.529 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -0.743 10.797 -11.043 1.00 0.00 H new ATOM 642 N GLU A 43 -2.296 6.989 -10.661 1.00 0.00 N ATOM 643 CA GLU A 43 -3.717 7.003 -10.996 1.00 0.00 C ATOM 644 C GLU A 43 -4.505 6.164 -9.982 1.00 0.00 C ATOM 645 O GLU A 43 -5.358 6.700 -9.260 1.00 0.00 O ATOM 646 CB GLU A 43 -3.946 6.490 -12.430 1.00 0.00 C ATOM 647 CG GLU A 43 -4.545 7.535 -13.358 1.00 0.00 C ATOM 648 CD GLU A 43 -4.867 6.980 -14.731 1.00 0.00 C ATOM 649 OE1 GLU A 43 -5.986 6.457 -14.913 1.00 0.00 O ATOM 650 OE2 GLU A 43 -4.000 7.068 -15.626 1.00 0.00 O ATOM 0 H GLU A 43 -1.700 6.572 -11.376 1.00 0.00 H new ATOM 0 HA GLU A 43 -4.076 8.031 -10.949 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -2.996 6.151 -12.842 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -4.606 5.623 -12.397 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -5.454 7.935 -12.910 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -3.848 8.367 -13.461 1.00 0.00 H new ATOM 657 N ALA A 44 -4.193 4.851 -9.903 1.00 0.00 N ATOM 658 CA ALA A 44 -4.846 3.956 -8.945 1.00 0.00 C ATOM 659 C ALA A 44 -4.444 4.276 -7.503 1.00 0.00 C ATOM 660 O ALA A 44 -5.230 4.056 -6.579 1.00 0.00 O ATOM 661 CB ALA A 44 -4.505 2.514 -9.261 1.00 0.00 C ATOM 0 H ALA A 44 -3.495 4.397 -10.492 1.00 0.00 H new ATOM 0 HA ALA A 44 -5.922 4.108 -9.036 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -4.996 1.858 -8.542 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -4.848 2.271 -10.267 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -3.426 2.374 -9.202 1.00 0.00 H new ATOM 667 N ALA A 45 -3.216 4.796 -7.319 1.00 0.00 N ATOM 668 CA ALA A 45 -2.714 5.157 -5.985 1.00 0.00 C ATOM 669 C ALA A 45 -3.494 6.333 -5.388 1.00 0.00 C ATOM 670 O ALA A 45 -3.891 6.289 -4.217 1.00 0.00 O ATOM 671 CB ALA A 45 -1.228 5.484 -6.039 1.00 0.00 C ATOM 0 H ALA A 45 -2.557 4.974 -8.077 1.00 0.00 H new ATOM 0 HA ALA A 45 -2.861 4.293 -5.337 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -0.877 5.748 -5.041 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -0.677 4.615 -6.399 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -1.064 6.323 -6.715 1.00 0.00 H new ATOM 677 N TYR A 46 -3.741 7.367 -6.215 1.00 0.00 N ATOM 678 CA TYR A 46 -4.481 8.557 -5.778 1.00 0.00 C ATOM 679 C TYR A 46 -5.972 8.249 -5.640 1.00 0.00 C ATOM 680 O TYR A 46 -6.629 8.710 -4.698 1.00 0.00 O ATOM 681 CB TYR A 46 -4.273 9.708 -6.766 1.00 0.00 C ATOM 682 CG TYR A 46 -3.752 10.973 -6.122 1.00 0.00 C ATOM 683 CD1 TYR A 46 -4.625 11.934 -5.628 1.00 0.00 C ATOM 684 CD2 TYR A 46 -2.387 11.207 -6.009 1.00 0.00 C ATOM 685 CE1 TYR A 46 -4.153 13.092 -5.038 1.00 0.00 C ATOM 686 CE2 TYR A 46 -1.907 12.362 -5.421 1.00 0.00 C ATOM 687 CZ TYR A 46 -2.794 13.300 -4.938 1.00 0.00 C ATOM 688 OH TYR A 46 -2.319 14.451 -4.352 1.00 0.00 O ATOM 0 H TYR A 46 -3.437 7.398 -7.188 1.00 0.00 H new ATOM 0 HA TYR A 46 -4.097 8.855 -4.802 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -3.574 9.390 -7.539 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -5.219 9.926 -7.261 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -5.690 11.774 -5.706 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -1.690 10.474 -6.387 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -4.845 13.829 -4.658 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -0.843 12.529 -5.340 1.00 0.00 H new ATOM 0 HH TYR A 46 -1.339 14.442 -4.360 1.00 0.00 H new ATOM 698 N ALA A 47 -6.490 7.437 -6.578 1.00 0.00 N ATOM 699 CA ALA A 47 -7.898 7.038 -6.582 1.00 0.00 C ATOM 700 C ALA A 47 -8.234 6.114 -5.412 1.00 0.00 C ATOM 701 O ALA A 47 -9.257 6.305 -4.743 1.00 0.00 O ATOM 702 CB ALA A 47 -8.243 6.372 -7.895 1.00 0.00 C ATOM 0 H ALA A 47 -5.945 7.045 -7.346 1.00 0.00 H new ATOM 0 HA ALA A 47 -8.498 7.940 -6.465 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -9.293 6.078 -7.889 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -8.066 7.069 -8.714 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -7.620 5.488 -8.029 1.00 0.00 H new ATOM 708 N LYS A 48 -7.363 5.120 -5.153 1.00 0.00 N ATOM 709 CA LYS A 48 -7.578 4.190 -4.043 1.00 0.00 C ATOM 710 C LYS A 48 -7.407 4.909 -2.713 1.00 0.00 C ATOM 711 O LYS A 48 -8.201 4.701 -1.796 1.00 0.00 O ATOM 712 CB LYS A 48 -6.662 2.970 -4.129 1.00 0.00 C ATOM 713 CG LYS A 48 -7.096 1.951 -5.184 1.00 0.00 C ATOM 714 CD LYS A 48 -8.307 1.100 -4.762 1.00 0.00 C ATOM 715 CE LYS A 48 -9.661 1.718 -5.153 1.00 0.00 C ATOM 716 NZ LYS A 48 -9.566 2.678 -6.295 1.00 0.00 N ATOM 0 H LYS A 48 -6.516 4.946 -5.694 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.601 3.821 -4.114 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -5.648 3.302 -4.352 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.630 2.481 -3.155 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -7.338 2.478 -6.107 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.258 1.290 -5.404 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -8.223 0.113 -5.217 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -8.281 0.957 -3.682 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -10.355 0.919 -5.416 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -10.081 2.233 -4.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -10.519 3.006 -6.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -8.982 3.492 -6.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -9.131 2.204 -7.112 1.00 0.00 H new ATOM 730 N ALA A 49 -6.363 5.761 -2.618 1.00 0.00 N ATOM 731 CA ALA A 49 -6.135 6.583 -1.416 1.00 0.00 C ATOM 732 C ALA A 49 -7.397 7.406 -1.120 1.00 0.00 C ATOM 733 O ALA A 49 -7.835 7.519 0.036 1.00 0.00 O ATOM 734 CB ALA A 49 -4.927 7.492 -1.605 1.00 0.00 C ATOM 0 H ALA A 49 -5.671 5.895 -3.355 1.00 0.00 H new ATOM 0 HA ALA A 49 -5.926 5.930 -0.568 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -4.777 8.090 -0.706 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -4.040 6.885 -1.789 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -5.098 8.152 -2.455 1.00 0.00 H new ATOM 740 N LEU A 50 -8.000 7.950 -2.200 1.00 0.00 N ATOM 741 CA LEU A 50 -9.252 8.703 -2.099 1.00 0.00 C ATOM 742 C LEU A 50 -10.377 7.761 -1.657 1.00 0.00 C ATOM 743 O LEU A 50 -11.289 8.167 -0.930 1.00 0.00 O ATOM 744 CB LEU A 50 -9.595 9.379 -3.434 1.00 0.00 C ATOM 745 CG LEU A 50 -8.827 10.677 -3.725 1.00 0.00 C ATOM 746 CD1 LEU A 50 -8.718 10.913 -5.223 1.00 0.00 C ATOM 747 CD2 LEU A 50 -9.502 11.870 -3.056 1.00 0.00 C ATOM 0 H LEU A 50 -7.633 7.877 -3.149 1.00 0.00 H new ATOM 0 HA LEU A 50 -9.135 9.491 -1.355 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -9.402 8.672 -4.241 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -10.663 9.596 -3.449 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.823 10.571 -3.313 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -8.171 11.837 -5.407 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -8.189 10.080 -5.685 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -9.717 10.991 -5.653 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -8.940 12.777 -3.277 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -10.519 11.972 -3.435 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -9.531 11.714 -1.978 1.00 0.00 H new ATOM 759 N ARG A 51 -10.290 6.483 -2.096 1.00 0.00 N ATOM 760 CA ARG A 51 -11.257 5.455 -1.689 1.00 0.00 C ATOM 761 C ARG A 51 -11.082 5.154 -0.192 1.00 0.00 C ATOM 762 O ARG A 51 -12.037 4.778 0.494 1.00 0.00 O ATOM 763 CB ARG A 51 -11.116 4.178 -2.524 1.00 0.00 C ATOM 764 CG ARG A 51 -11.905 4.192 -3.841 1.00 0.00 C ATOM 765 CD ARG A 51 -12.869 3.007 -3.911 1.00 0.00 C ATOM 766 NE ARG A 51 -14.040 3.245 -4.761 1.00 0.00 N ATOM 767 CZ ARG A 51 -15.246 2.681 -4.559 1.00 0.00 C ATOM 768 NH1 ARG A 51 -15.454 1.857 -3.533 1.00 0.00 N ATOM 769 NH2 ARG A 51 -16.234 2.909 -5.410 1.00 0.00 N ATOM 0 H ARG A 51 -9.562 6.148 -2.728 1.00 0.00 H new ATOM 0 HA ARG A 51 -12.262 5.838 -1.866 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -10.061 4.019 -2.748 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -11.446 3.329 -1.926 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -12.462 5.125 -3.926 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -11.215 4.155 -4.684 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -12.332 2.135 -4.285 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -13.207 2.765 -2.903 1.00 0.00 H new ATOM 0 HE ARG A 51 -13.934 3.877 -5.555 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -14.694 1.645 -2.887 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -16.373 1.438 -3.394 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -16.082 3.512 -6.219 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -17.148 2.482 -5.257 1.00 0.00 H new ATOM 783 N ILE A 52 -9.836 5.331 0.305 1.00 0.00 N ATOM 784 CA ILE A 52 -9.529 5.188 1.737 1.00 0.00 C ATOM 785 C ILE A 52 -10.236 6.338 2.457 1.00 0.00 C ATOM 786 O ILE A 52 -10.720 6.194 3.583 1.00 0.00 O ATOM 787 CB ILE A 52 -7.979 5.216 2.003 1.00 0.00 C ATOM 788 CG1 ILE A 52 -7.378 3.802 1.957 1.00 0.00 C ATOM 789 CG2 ILE A 52 -7.623 5.864 3.343 1.00 0.00 C ATOM 790 CD1 ILE A 52 -7.337 3.179 0.578 1.00 0.00 C ATOM 0 H ILE A 52 -9.029 5.573 -0.270 1.00 0.00 H new ATOM 0 HA ILE A 52 -9.879 4.225 2.108 1.00 0.00 H new ATOM 0 HB ILE A 52 -7.552 5.823 1.205 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -6.364 3.839 2.355 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -7.955 3.154 2.617 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -6.541 5.856 3.475 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -7.983 6.893 3.357 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -8.091 5.305 4.153 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -6.898 2.183 0.641 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -8.350 3.104 0.182 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -6.734 3.800 -0.084 1.00 0.00 H new ATOM 802 N GLU A 53 -10.271 7.483 1.755 1.00 0.00 N ATOM 803 CA GLU A 53 -10.955 8.685 2.225 1.00 0.00 C ATOM 804 C GLU A 53 -12.465 8.562 2.004 1.00 0.00 C ATOM 805 O GLU A 53 -13.224 9.357 2.541 1.00 0.00 O ATOM 806 CB GLU A 53 -10.399 9.934 1.525 1.00 0.00 C ATOM 807 CG GLU A 53 -10.410 11.193 2.389 1.00 0.00 C ATOM 808 CD GLU A 53 -9.223 11.271 3.334 1.00 0.00 C ATOM 809 OE1 GLU A 53 -8.234 11.950 2.988 1.00 0.00 O ATOM 810 OE2 GLU A 53 -9.285 10.654 4.417 1.00 0.00 O ATOM 0 H GLU A 53 -9.823 7.595 0.845 1.00 0.00 H new ATOM 0 HA GLU A 53 -10.774 8.790 3.295 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -9.376 9.734 1.208 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -10.982 10.121 0.623 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -10.412 12.071 1.743 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -11.332 11.222 2.969 1.00 0.00 H new ATOM 817 N LEU A 54 -12.890 7.613 1.146 1.00 0.00 N ATOM 818 CA LEU A 54 -14.318 7.358 0.944 1.00 0.00 C ATOM 819 C LEU A 54 -14.816 6.429 2.042 1.00 0.00 C ATOM 820 O LEU A 54 -15.985 6.465 2.430 1.00 0.00 O ATOM 821 CB LEU A 54 -14.629 6.810 -0.478 1.00 0.00 C ATOM 822 CG LEU A 54 -14.637 5.265 -0.745 1.00 0.00 C ATOM 823 CD1 LEU A 54 -15.645 4.492 0.111 1.00 0.00 C ATOM 824 CD2 LEU A 54 -14.971 5.001 -2.195 1.00 0.00 C ATOM 0 H LEU A 54 -12.270 7.022 0.592 1.00 0.00 H new ATOM 0 HA LEU A 54 -14.855 8.304 1.010 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -15.609 7.192 -0.764 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -13.903 7.252 -1.160 1.00 0.00 H new ATOM 0 HG LEU A 54 -13.639 4.915 -0.482 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -15.590 3.431 -0.132 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -15.412 4.635 1.166 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -16.651 4.859 -0.091 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -14.976 3.926 -2.377 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -15.955 5.412 -2.422 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -14.224 5.474 -2.832 1.00 0.00 H new ATOM 836 N ALA A 55 -13.888 5.583 2.510 1.00 0.00 N ATOM 837 CA ALA A 55 -14.122 4.621 3.597 1.00 0.00 C ATOM 838 C ALA A 55 -14.699 5.291 4.843 1.00 0.00 C ATOM 839 O ALA A 55 -15.202 4.637 5.761 1.00 0.00 O ATOM 840 CB ALA A 55 -12.829 3.913 3.941 1.00 0.00 C ATOM 0 H ALA A 55 -12.939 5.547 2.138 1.00 0.00 H new ATOM 0 HA ALA A 55 -14.858 3.898 3.246 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -13.007 3.201 4.747 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -12.460 3.382 3.063 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -12.087 4.645 4.261 1.00 0.00 H new ATOM 846 N GLN A 56 -14.606 6.606 4.823 1.00 0.00 N ATOM 847 CA GLN A 56 -15.091 7.476 5.878 1.00 0.00 C ATOM 848 C GLN A 56 -16.414 8.111 5.502 1.00 0.00 C ATOM 849 O GLN A 56 -16.729 9.219 5.942 1.00 0.00 O ATOM 850 CB GLN A 56 -14.014 8.510 6.280 1.00 0.00 C ATOM 851 CG GLN A 56 -13.578 9.453 5.176 1.00 0.00 C ATOM 852 CD GLN A 56 -12.786 10.637 5.697 1.00 0.00 C ATOM 853 OE1 GLN A 56 -11.559 10.591 5.772 1.00 0.00 O ATOM 854 NE2 GLN A 56 -13.486 11.702 6.069 1.00 0.00 N ATOM 0 H GLN A 56 -14.178 7.114 4.049 1.00 0.00 H new ATOM 0 HA GLN A 56 -15.286 6.871 6.764 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -14.395 9.102 7.112 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -13.138 7.974 6.645 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -12.972 8.905 4.454 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -14.458 9.815 4.644 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -14.503 11.697 5.990 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -13.007 12.525 6.434 1.00 0.00 H new ATOM 863 N LEU A 57 -17.183 7.384 4.676 1.00 0.00 N ATOM 864 CA LEU A 57 -18.502 7.820 4.242 1.00 0.00 C ATOM 865 C LEU A 57 -19.402 8.046 5.430 1.00 0.00 C ATOM 866 O LEU A 57 -20.196 7.190 5.847 1.00 0.00 O ATOM 867 CB LEU A 57 -19.148 6.827 3.259 1.00 0.00 C ATOM 868 CG LEU A 57 -20.668 7.021 2.998 1.00 0.00 C ATOM 869 CD1 LEU A 57 -20.947 8.166 2.031 1.00 0.00 C ATOM 870 CD2 LEU A 57 -21.298 5.728 2.507 1.00 0.00 C ATOM 0 H LEU A 57 -16.901 6.481 4.296 1.00 0.00 H new ATOM 0 HA LEU A 57 -18.371 8.763 3.711 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -18.624 6.896 2.306 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -18.990 5.817 3.637 1.00 0.00 H new ATOM 0 HG LEU A 57 -21.126 7.291 3.949 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -22.022 8.262 1.881 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -20.554 9.095 2.444 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -20.464 7.961 1.076 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -22.362 5.886 2.330 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -20.818 5.419 1.578 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -21.166 4.950 3.260 1.00 0.00 H new ATOM 882 N VAL A 58 -19.197 9.203 5.994 1.00 0.00 N ATOM 883 CA VAL A 58 -20.002 9.680 7.066 1.00 0.00 C ATOM 884 C VAL A 58 -21.188 10.335 6.368 1.00 0.00 C ATOM 885 O VAL A 58 -22.266 10.507 6.944 1.00 0.00 O ATOM 886 CB VAL A 58 -19.211 10.676 7.961 1.00 0.00 C ATOM 887 CG1 VAL A 58 -20.080 11.276 9.067 1.00 0.00 C ATOM 888 CG2 VAL A 58 -17.986 9.995 8.572 1.00 0.00 C ATOM 0 H VAL A 58 -18.455 9.844 5.713 1.00 0.00 H new ATOM 0 HA VAL A 58 -20.320 8.891 7.748 1.00 0.00 H new ATOM 0 HB VAL A 58 -18.886 11.493 7.316 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -19.483 11.965 9.665 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -20.917 11.814 8.621 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -20.460 10.478 9.704 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -17.446 10.708 9.195 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -18.306 9.150 9.182 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -17.332 9.640 7.776 1.00 0.00 H new ATOM 898 N GLN A 59 -20.932 10.699 5.081 1.00 0.00 N ATOM 899 CA GLN A 59 -21.963 11.313 4.221 1.00 0.00 C ATOM 900 C GLN A 59 -21.644 11.321 2.708 1.00 0.00 C ATOM 901 O GLN A 59 -22.451 10.829 1.914 1.00 0.00 O ATOM 902 CB GLN A 59 -22.254 12.759 4.681 1.00 0.00 C ATOM 903 CG GLN A 59 -20.994 13.528 5.099 1.00 0.00 C ATOM 904 CD GLN A 59 -20.967 14.971 4.613 1.00 0.00 C ATOM 905 OE1 GLN A 59 -22.007 15.618 4.458 1.00 0.00 O ATOM 906 NE2 GLN A 59 -19.767 15.488 4.378 1.00 0.00 N ATOM 0 H GLN A 59 -20.027 10.576 4.627 1.00 0.00 H new ATOM 0 HA GLN A 59 -22.837 10.672 4.341 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -22.748 13.298 3.873 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -22.950 12.733 5.519 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -20.918 13.519 6.186 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -20.117 13.008 4.713 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -18.931 14.921 4.518 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -19.681 16.452 4.057 1.00 0.00 H new ATOM 915 N VAL A 60 -20.483 11.878 2.312 1.00 0.00 N ATOM 916 CA VAL A 60 -20.121 11.993 0.878 1.00 0.00 C ATOM 917 C VAL A 60 -18.818 11.288 0.496 1.00 0.00 C ATOM 918 O VAL A 60 -18.556 11.009 -0.696 1.00 0.00 O ATOM 919 CB VAL A 60 -20.027 13.473 0.419 1.00 0.00 C ATOM 920 CG1 VAL A 60 -21.411 14.028 0.126 1.00 0.00 C ATOM 921 CG2 VAL A 60 -19.304 14.358 1.438 1.00 0.00 C ATOM 0 H VAL A 60 -19.784 12.253 2.954 1.00 0.00 H new ATOM 0 HA VAL A 60 -20.937 11.486 0.363 1.00 0.00 H new ATOM 0 HB VAL A 60 -19.433 13.485 -0.495 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -21.326 15.066 -0.194 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -21.878 13.441 -0.665 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -22.022 13.975 1.027 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -19.266 15.383 1.068 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -19.841 14.334 2.386 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -18.290 13.988 1.586 1.00 0.00 H new ATOM 931 N ASP A 61 -17.995 11.011 1.502 1.00 0.00 N ATOM 932 CA ASP A 61 -16.674 10.414 1.290 1.00 0.00 C ATOM 933 C ASP A 61 -16.714 9.267 0.273 1.00 0.00 C ATOM 934 O ASP A 61 -15.957 9.288 -0.714 1.00 0.00 O ATOM 935 CB ASP A 61 -16.062 9.971 2.624 1.00 0.00 C ATOM 936 CG ASP A 61 -16.175 11.044 3.696 1.00 0.00 C ATOM 937 OD1 ASP A 61 -17.259 11.166 4.304 1.00 0.00 O ATOM 938 OD2 ASP A 61 -15.181 11.765 3.919 1.00 0.00 O ATOM 0 H ASP A 61 -18.219 11.191 2.481 1.00 0.00 H new ATOM 0 HA ASP A 61 -16.030 11.181 0.861 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -16.561 9.064 2.967 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -15.012 9.720 2.474 1.00 0.00 H new ATOM 943 N LYS A 62 -17.615 8.290 0.492 1.00 0.00 N ATOM 944 CA LYS A 62 -17.778 7.139 -0.438 1.00 0.00 C ATOM 945 C LYS A 62 -17.929 7.590 -1.907 1.00 0.00 C ATOM 946 O LYS A 62 -17.374 6.960 -2.816 1.00 0.00 O ATOM 947 CB LYS A 62 -18.992 6.274 -0.041 1.00 0.00 C ATOM 948 CG LYS A 62 -19.792 5.687 -1.216 1.00 0.00 C ATOM 949 CD LYS A 62 -21.267 6.090 -1.166 1.00 0.00 C ATOM 950 CE LYS A 62 -21.508 7.542 -1.572 1.00 0.00 C ATOM 951 NZ LYS A 62 -21.810 7.668 -3.025 1.00 0.00 N ATOM 0 H LYS A 62 -18.241 8.268 1.297 1.00 0.00 H new ATOM 0 HA LYS A 62 -16.867 6.546 -0.357 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -18.643 5.453 0.586 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -19.664 6.878 0.569 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -19.356 6.025 -2.156 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -19.713 4.600 -1.201 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -21.838 5.436 -1.825 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -21.645 5.934 -0.156 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -22.337 7.949 -0.992 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -20.628 8.138 -1.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -22.164 8.625 -3.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -20.944 7.498 -3.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -22.533 6.969 -3.291 1.00 0.00 H new ATOM 965 N VAL A 63 -18.669 8.692 -2.120 1.00 0.00 N ATOM 966 CA VAL A 63 -18.929 9.212 -3.466 1.00 0.00 C ATOM 967 C VAL A 63 -17.647 9.764 -4.109 1.00 0.00 C ATOM 968 O VAL A 63 -17.381 9.514 -5.303 1.00 0.00 O ATOM 969 CB VAL A 63 -20.098 10.258 -3.460 1.00 0.00 C ATOM 970 CG1 VAL A 63 -19.666 11.663 -3.056 1.00 0.00 C ATOM 971 CG2 VAL A 63 -20.816 10.280 -4.806 1.00 0.00 C ATOM 0 H VAL A 63 -19.097 9.238 -1.372 1.00 0.00 H new ATOM 0 HA VAL A 63 -19.259 8.381 -4.089 1.00 0.00 H new ATOM 0 HB VAL A 63 -20.791 9.923 -2.688 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -20.529 12.329 -3.076 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -19.248 11.640 -2.049 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -18.911 12.026 -3.754 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -21.622 11.013 -4.776 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -20.109 10.549 -5.591 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -21.230 9.293 -5.014 1.00 0.00 H new ATOM 981 N ARG A 64 -16.831 10.478 -3.306 1.00 0.00 N ATOM 982 CA ARG A 64 -15.555 11.030 -3.848 1.00 0.00 C ATOM 983 C ARG A 64 -14.629 9.895 -4.280 1.00 0.00 C ATOM 984 O ARG A 64 -14.076 9.909 -5.394 1.00 0.00 O ATOM 985 CB ARG A 64 -14.764 11.966 -2.892 1.00 0.00 C ATOM 986 CG ARG A 64 -15.263 12.070 -1.463 1.00 0.00 C ATOM 987 CD ARG A 64 -16.535 12.885 -1.391 1.00 0.00 C ATOM 988 NE ARG A 64 -16.335 14.297 -1.750 1.00 0.00 N ATOM 989 CZ ARG A 64 -17.297 15.113 -2.206 1.00 0.00 C ATOM 990 NH1 ARG A 64 -18.546 14.682 -2.371 1.00 0.00 N ATOM 991 NH2 ARG A 64 -17.001 16.372 -2.502 1.00 0.00 N ATOM 0 H ARG A 64 -17.013 10.684 -2.324 1.00 0.00 H new ATOM 0 HA ARG A 64 -15.870 11.648 -4.689 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -13.728 11.627 -2.866 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -14.761 12.967 -3.324 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -15.443 11.072 -1.063 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -14.497 12.530 -0.839 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -17.278 12.448 -2.058 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -16.940 12.827 -0.381 1.00 0.00 H new ATOM 0 HE ARG A 64 -15.397 14.684 -1.645 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -18.785 13.716 -2.149 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -19.263 15.318 -2.719 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -16.047 16.713 -2.382 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -17.727 16.999 -2.849 1.00 0.00 H new ATOM 1005 N GLY A 65 -14.501 8.891 -3.398 1.00 0.00 N ATOM 1006 CA GLY A 65 -13.651 7.745 -3.679 1.00 0.00 C ATOM 1007 C GLY A 65 -14.126 6.900 -4.849 1.00 0.00 C ATOM 1008 O GLY A 65 -13.297 6.376 -5.593 1.00 0.00 O ATOM 0 H GLY A 65 -14.974 8.858 -2.495 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -12.640 8.096 -3.884 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -13.597 7.118 -2.789 1.00 0.00 H new ATOM 1012 N THR A 66 -15.459 6.761 -5.017 1.00 0.00 N ATOM 1013 CA THR A 66 -16.010 5.963 -6.123 1.00 0.00 C ATOM 1014 C THR A 66 -15.723 6.627 -7.486 1.00 0.00 C ATOM 1015 O THR A 66 -15.295 5.951 -8.438 1.00 0.00 O ATOM 1016 CB THR A 66 -17.531 5.652 -5.944 1.00 0.00 C ATOM 1017 OG1 THR A 66 -17.925 4.631 -6.868 1.00 0.00 O ATOM 1018 CG2 THR A 66 -18.427 6.868 -6.146 1.00 0.00 C ATOM 0 H THR A 66 -16.160 7.185 -4.409 1.00 0.00 H new ATOM 0 HA THR A 66 -15.497 5.001 -6.102 1.00 0.00 H new ATOM 0 HB THR A 66 -17.658 5.324 -4.913 1.00 0.00 H new ATOM 0 HG1 THR A 66 -18.879 4.436 -6.753 1.00 0.00 H new ATOM 0 HG21 THR A 66 -19.469 6.579 -6.007 1.00 0.00 H new ATOM 0 HG22 THR A 66 -18.164 7.638 -5.421 1.00 0.00 H new ATOM 0 HG23 THR A 66 -18.290 7.257 -7.155 1.00 0.00 H new ATOM 1026 N LEU A 67 -15.929 7.961 -7.559 1.00 0.00 N ATOM 1027 CA LEU A 67 -15.666 8.723 -8.794 1.00 0.00 C ATOM 1028 C LEU A 67 -14.168 8.681 -9.141 1.00 0.00 C ATOM 1029 O LEU A 67 -13.790 8.535 -10.314 1.00 0.00 O ATOM 1030 CB LEU A 67 -16.141 10.177 -8.636 1.00 0.00 C ATOM 1031 CG LEU A 67 -16.431 10.932 -9.943 1.00 0.00 C ATOM 1032 CD1 LEU A 67 -17.861 10.687 -10.408 1.00 0.00 C ATOM 1033 CD2 LEU A 67 -16.177 12.421 -9.762 1.00 0.00 C ATOM 0 H LEU A 67 -16.274 8.526 -6.783 1.00 0.00 H new ATOM 0 HA LEU A 67 -16.222 8.264 -9.611 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -17.046 10.180 -8.029 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -15.383 10.729 -8.080 1.00 0.00 H new ATOM 0 HG LEU A 67 -15.757 10.554 -10.711 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -18.041 11.232 -11.335 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -18.010 9.621 -10.579 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -18.557 11.032 -9.643 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -16.387 12.942 -10.696 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -16.826 12.808 -8.977 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -15.136 12.581 -9.483 1.00 0.00 H new ATOM 1045 N ALA A 68 -13.324 8.774 -8.097 1.00 0.00 N ATOM 1046 CA ALA A 68 -11.866 8.719 -8.252 1.00 0.00 C ATOM 1047 C ALA A 68 -11.447 7.306 -8.666 1.00 0.00 C ATOM 1048 O ALA A 68 -10.582 7.117 -9.535 1.00 0.00 O ATOM 1049 CB ALA A 68 -11.178 9.126 -6.958 1.00 0.00 C ATOM 0 H ALA A 68 -13.634 8.888 -7.132 1.00 0.00 H new ATOM 0 HA ALA A 68 -11.562 9.420 -9.030 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -10.097 9.080 -7.090 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -11.468 10.143 -6.696 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -11.475 8.447 -6.159 1.00 0.00 H new ATOM 1055 N LYS A 69 -12.124 6.320 -8.048 1.00 0.00 N ATOM 1056 CA LYS A 69 -11.916 4.901 -8.310 1.00 0.00 C ATOM 1057 C LYS A 69 -12.038 4.615 -9.796 1.00 0.00 C ATOM 1058 O LYS A 69 -11.158 3.997 -10.368 1.00 0.00 O ATOM 1059 CB LYS A 69 -12.925 4.090 -7.498 1.00 0.00 C ATOM 1060 CG LYS A 69 -13.528 2.916 -8.246 1.00 0.00 C ATOM 1061 CD LYS A 69 -12.943 1.581 -7.807 1.00 0.00 C ATOM 1062 CE LYS A 69 -13.869 0.831 -6.861 1.00 0.00 C ATOM 1063 NZ LYS A 69 -13.597 -0.633 -6.859 1.00 0.00 N ATOM 0 H LYS A 69 -12.840 6.500 -7.344 1.00 0.00 H new ATOM 0 HA LYS A 69 -10.910 4.612 -8.005 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -12.435 3.719 -6.598 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -13.729 4.751 -7.174 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -14.607 2.905 -8.089 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -13.362 3.047 -9.315 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -12.747 0.966 -8.685 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -11.984 1.750 -7.316 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -13.751 1.223 -5.851 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -14.905 1.007 -7.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -14.249 -1.106 -6.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -13.735 -1.013 -7.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -12.617 -0.804 -6.557 1.00 0.00 H new ATOM 1077 N LEU A 70 -13.140 5.082 -10.400 1.00 0.00 N ATOM 1078 CA LEU A 70 -13.378 4.913 -11.833 1.00 0.00 C ATOM 1079 C LEU A 70 -12.301 5.677 -12.628 1.00 0.00 C ATOM 1080 O LEU A 70 -11.689 5.125 -13.576 1.00 0.00 O ATOM 1081 CB LEU A 70 -14.819 5.384 -12.147 1.00 0.00 C ATOM 1082 CG LEU A 70 -15.068 6.067 -13.502 1.00 0.00 C ATOM 1083 CD1 LEU A 70 -16.437 5.688 -14.047 1.00 0.00 C ATOM 1084 CD2 LEU A 70 -14.956 7.579 -13.359 1.00 0.00 C ATOM 0 H LEU A 70 -13.882 5.582 -9.911 1.00 0.00 H new ATOM 0 HA LEU A 70 -13.299 3.868 -12.131 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -15.477 4.517 -12.082 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -15.125 6.075 -11.362 1.00 0.00 H new ATOM 0 HG LEU A 70 -14.310 5.725 -14.206 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -16.596 6.181 -15.006 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -16.489 4.608 -14.181 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -17.208 6.004 -13.345 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -15.134 8.050 -14.326 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -15.696 7.932 -12.641 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -13.957 7.838 -13.008 1.00 0.00 H new ATOM 1096 N GLU A 71 -12.029 6.926 -12.165 1.00 0.00 N ATOM 1097 CA GLU A 71 -11.029 7.817 -12.785 1.00 0.00 C ATOM 1098 C GLU A 71 -9.726 7.061 -13.081 1.00 0.00 C ATOM 1099 O GLU A 71 -9.124 7.236 -14.145 1.00 0.00 O ATOM 1100 CB GLU A 71 -10.810 9.054 -11.870 1.00 0.00 C ATOM 1101 CG GLU A 71 -9.394 9.261 -11.310 1.00 0.00 C ATOM 1102 CD GLU A 71 -8.485 10.004 -12.272 1.00 0.00 C ATOM 1103 OE1 GLU A 71 -8.496 11.253 -12.254 1.00 0.00 O ATOM 1104 OE2 GLU A 71 -7.762 9.337 -13.041 1.00 0.00 O ATOM 0 H GLU A 71 -12.497 7.335 -11.356 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.397 8.171 -13.748 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -11.086 9.946 -12.433 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -11.500 8.981 -11.030 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -9.456 9.816 -10.374 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -8.955 8.291 -11.078 1.00 0.00 H new ATOM 1111 N ALA A 72 -9.312 6.227 -12.122 1.00 0.00 N ATOM 1112 CA ALA A 72 -8.116 5.407 -12.277 1.00 0.00 C ATOM 1113 C ALA A 72 -8.455 4.047 -12.875 1.00 0.00 C ATOM 1114 O ALA A 72 -7.784 3.587 -13.783 1.00 0.00 O ATOM 1115 CB ALA A 72 -7.420 5.223 -10.951 1.00 0.00 C ATOM 0 H ALA A 72 -9.792 6.105 -11.230 1.00 0.00 H new ATOM 0 HA ALA A 72 -7.446 5.928 -12.960 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -6.530 4.608 -11.089 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -7.131 6.196 -10.554 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.095 4.732 -10.251 1.00 0.00 H new ATOM 1121 N PHE A 73 -9.540 3.434 -12.387 1.00 0.00 N ATOM 1122 CA PHE A 73 -10.002 2.106 -12.841 1.00 0.00 C ATOM 1123 C PHE A 73 -10.251 2.051 -14.359 1.00 0.00 C ATOM 1124 O PHE A 73 -10.657 1.015 -14.894 1.00 0.00 O ATOM 1125 CB PHE A 73 -11.293 1.742 -12.084 1.00 0.00 C ATOM 1126 CG PHE A 73 -11.220 0.519 -11.201 1.00 0.00 C ATOM 1127 CD1 PHE A 73 -10.318 0.447 -10.144 1.00 0.00 C ATOM 1128 CD2 PHE A 73 -12.072 -0.555 -11.419 1.00 0.00 C ATOM 1129 CE1 PHE A 73 -10.268 -0.669 -9.332 1.00 0.00 C ATOM 1130 CE2 PHE A 73 -12.022 -1.673 -10.610 1.00 0.00 C ATOM 1131 CZ PHE A 73 -11.120 -1.731 -9.566 1.00 0.00 C ATOM 0 H PHE A 73 -10.129 3.843 -11.662 1.00 0.00 H new ATOM 0 HA PHE A 73 -9.212 1.386 -12.626 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -11.582 2.594 -11.468 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -12.089 1.592 -12.814 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -9.649 1.274 -9.956 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -12.783 -0.516 -12.231 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -9.563 -0.711 -8.515 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -12.689 -2.502 -10.794 1.00 0.00 H new ATOM 0 HZ PHE A 73 -11.081 -2.605 -8.933 1.00 0.00 H new ATOM 1141 N ALA A 74 -10.025 3.191 -15.031 1.00 0.00 N ATOM 1142 CA ALA A 74 -10.169 3.310 -16.485 1.00 0.00 C ATOM 1143 C ALA A 74 -9.612 2.119 -17.300 1.00 0.00 C ATOM 1144 O ALA A 74 -10.406 1.404 -17.919 1.00 0.00 O ATOM 1145 CB ALA A 74 -9.542 4.619 -16.956 1.00 0.00 C ATOM 0 H ALA A 74 -9.736 4.057 -14.577 1.00 0.00 H new ATOM 0 HA ALA A 74 -11.242 3.302 -16.678 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.650 4.706 -18.037 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -10.044 5.457 -16.473 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.484 4.630 -16.695 1.00 0.00 H new ATOM 1151 N ASP A 75 -8.279 1.889 -17.317 1.00 0.00 N ATOM 1152 CA ASP A 75 -7.735 0.770 -18.110 1.00 0.00 C ATOM 1153 C ASP A 75 -6.631 -0.042 -17.430 1.00 0.00 C ATOM 1154 O ASP A 75 -6.835 -1.212 -17.092 1.00 0.00 O ATOM 1155 CB ASP A 75 -7.272 1.270 -19.493 1.00 0.00 C ATOM 1156 CG ASP A 75 -7.423 0.220 -20.580 1.00 0.00 C ATOM 1157 OD1 ASP A 75 -8.498 0.172 -21.215 1.00 0.00 O ATOM 1158 OD2 ASP A 75 -6.466 -0.553 -20.796 1.00 0.00 O ATOM 0 H ASP A 75 -7.586 2.441 -16.811 1.00 0.00 H new ATOM 0 HA ASP A 75 -8.563 0.070 -18.218 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -7.848 2.154 -19.766 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -6.228 1.576 -19.433 1.00 0.00 H new ATOM 1163 N THR A 76 -5.477 0.585 -17.237 1.00 0.00 N ATOM 1164 CA THR A 76 -4.303 -0.094 -16.675 1.00 0.00 C ATOM 1165 C THR A 76 -4.126 0.294 -15.216 1.00 0.00 C ATOM 1166 O THR A 76 -3.009 0.432 -14.702 1.00 0.00 O ATOM 1167 CB THR A 76 -3.031 0.241 -17.500 1.00 0.00 C ATOM 1168 OG1 THR A 76 -3.350 0.288 -18.897 1.00 0.00 O ATOM 1169 CG2 THR A 76 -1.924 -0.789 -17.281 1.00 0.00 C ATOM 0 H THR A 76 -5.323 1.568 -17.461 1.00 0.00 H new ATOM 0 HA THR A 76 -4.460 -1.171 -16.728 1.00 0.00 H new ATOM 0 HB THR A 76 -2.672 1.212 -17.160 1.00 0.00 H new ATOM 0 HG1 THR A 76 -2.543 0.502 -19.410 1.00 0.00 H new ATOM 0 HG21 THR A 76 -1.052 -0.518 -17.876 1.00 0.00 H new ATOM 0 HG22 THR A 76 -1.651 -0.811 -16.226 1.00 0.00 H new ATOM 0 HG23 THR A 76 -2.278 -1.774 -17.585 1.00 0.00 H new ATOM 1177 N VAL A 77 -5.268 0.446 -14.560 1.00 0.00 N ATOM 1178 CA VAL A 77 -5.335 0.841 -13.161 1.00 0.00 C ATOM 1179 C VAL A 77 -6.668 0.376 -12.553 1.00 0.00 C ATOM 1180 O VAL A 77 -7.327 1.123 -11.819 1.00 0.00 O ATOM 1181 CB VAL A 77 -5.158 2.381 -13.014 1.00 0.00 C ATOM 1182 CG1 VAL A 77 -3.716 2.691 -12.637 1.00 0.00 C ATOM 1183 CG2 VAL A 77 -5.542 3.135 -14.298 1.00 0.00 C ATOM 0 H VAL A 77 -6.182 0.297 -14.988 1.00 0.00 H new ATOM 0 HA VAL A 77 -4.520 0.363 -12.618 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.832 2.721 -12.227 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.591 3.769 -12.534 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -3.475 2.205 -11.691 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -3.049 2.321 -13.416 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.402 4.205 -14.147 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.910 2.799 -15.120 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.586 2.936 -14.538 1.00 0.00 H new ATOM 1193 N ALA A 78 -7.052 -0.892 -12.854 1.00 0.00 N ATOM 1194 CA ALA A 78 -8.323 -1.452 -12.367 1.00 0.00 C ATOM 1195 C ALA A 78 -8.257 -2.964 -12.021 1.00 0.00 C ATOM 1196 O ALA A 78 -8.432 -3.309 -10.849 1.00 0.00 O ATOM 1197 CB ALA A 78 -9.439 -1.203 -13.384 1.00 0.00 C ATOM 0 H ALA A 78 -6.501 -1.533 -13.425 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.537 -0.932 -11.433 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -10.373 -1.623 -13.010 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -9.559 -0.131 -13.537 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -9.181 -1.678 -14.331 1.00 0.00 H new ATOM 1203 N PRO A 79 -8.005 -3.900 -13.006 1.00 0.00 N ATOM 1204 CA PRO A 79 -8.001 -5.347 -12.748 1.00 0.00 C ATOM 1205 C PRO A 79 -6.602 -5.958 -12.540 1.00 0.00 C ATOM 1206 O PRO A 79 -6.304 -7.042 -13.060 1.00 0.00 O ATOM 1207 CB PRO A 79 -8.647 -5.880 -14.044 1.00 0.00 C ATOM 1208 CG PRO A 79 -8.432 -4.819 -15.101 1.00 0.00 C ATOM 1209 CD PRO A 79 -7.711 -3.668 -14.438 1.00 0.00 C ATOM 0 HA PRO A 79 -8.514 -5.602 -11.821 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -8.192 -6.824 -14.344 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -9.710 -6.071 -13.897 1.00 0.00 H new ATOM 0 HG2 PRO A 79 -7.845 -5.215 -15.930 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -9.385 -4.489 -15.515 1.00 0.00 H new ATOM 0 HD2 PRO A 79 -6.640 -3.686 -14.642 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -8.084 -2.703 -14.779 1.00 0.00 H new ATOM 1217 N GLN A 80 -5.760 -5.277 -11.762 1.00 0.00 N ATOM 1218 CA GLN A 80 -4.400 -5.756 -11.521 1.00 0.00 C ATOM 1219 C GLN A 80 -4.066 -5.782 -10.020 1.00 0.00 C ATOM 1220 O GLN A 80 -3.359 -4.917 -9.512 1.00 0.00 O ATOM 1221 CB GLN A 80 -3.409 -4.892 -12.341 1.00 0.00 C ATOM 1222 CG GLN A 80 -3.462 -3.384 -12.082 1.00 0.00 C ATOM 1223 CD GLN A 80 -2.421 -2.627 -12.883 1.00 0.00 C ATOM 1224 OE1 GLN A 80 -1.314 -2.377 -12.405 1.00 0.00 O ATOM 1225 NE2 GLN A 80 -2.767 -2.268 -14.112 1.00 0.00 N ATOM 0 H GLN A 80 -5.993 -4.402 -11.293 1.00 0.00 H new ATOM 0 HA GLN A 80 -4.312 -6.789 -11.857 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -2.397 -5.241 -12.135 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -3.597 -5.066 -13.401 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -4.454 -3.009 -12.333 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -3.309 -3.194 -11.020 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -3.695 -2.496 -14.468 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -2.105 -1.764 -14.702 1.00 0.00 H new ATOM 1234 N LEU A 81 -4.552 -6.822 -9.319 1.00 0.00 N ATOM 1235 CA LEU A 81 -4.336 -6.956 -7.861 1.00 0.00 C ATOM 1236 C LEU A 81 -4.614 -8.376 -7.347 1.00 0.00 C ATOM 1237 O LEU A 81 -5.081 -9.244 -8.091 1.00 0.00 O ATOM 1238 CB LEU A 81 -5.223 -5.941 -7.080 1.00 0.00 C ATOM 1239 CG LEU A 81 -6.734 -6.259 -6.954 1.00 0.00 C ATOM 1240 CD1 LEU A 81 -7.417 -5.195 -6.120 1.00 0.00 C ATOM 1241 CD2 LEU A 81 -7.417 -6.375 -8.314 1.00 0.00 C ATOM 0 H LEU A 81 -5.095 -7.580 -9.733 1.00 0.00 H new ATOM 0 HA LEU A 81 -3.282 -6.741 -7.686 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -4.815 -5.843 -6.074 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -5.123 -4.968 -7.561 1.00 0.00 H new ATOM 0 HG LEU A 81 -6.824 -7.228 -6.463 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -8.479 -5.425 -6.036 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.971 -5.170 -5.126 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -7.293 -4.223 -6.598 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -8.474 -6.599 -8.172 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -7.314 -5.434 -8.854 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.951 -7.176 -8.888 1.00 0.00 H new ATOM 1253 N SER A 82 -4.312 -8.577 -6.056 1.00 0.00 N ATOM 1254 CA SER A 82 -4.538 -9.844 -5.369 1.00 0.00 C ATOM 1255 C SER A 82 -5.807 -9.732 -4.480 1.00 0.00 C ATOM 1256 O SER A 82 -6.348 -8.629 -4.347 1.00 0.00 O ATOM 1257 CB SER A 82 -3.296 -10.198 -4.537 1.00 0.00 C ATOM 1258 OG SER A 82 -2.892 -11.538 -4.761 1.00 0.00 O ATOM 0 H SER A 82 -3.902 -7.857 -5.461 1.00 0.00 H new ATOM 0 HA SER A 82 -4.703 -10.643 -6.092 1.00 0.00 H new ATOM 0 HB2 SER A 82 -2.480 -9.522 -4.792 1.00 0.00 H new ATOM 0 HB3 SER A 82 -3.511 -10.053 -3.478 1.00 0.00 H new ATOM 0 HG SER A 82 -2.099 -11.735 -4.220 1.00 0.00 H new ATOM 1264 N PRO A 83 -6.319 -10.857 -3.858 1.00 0.00 N ATOM 1265 CA PRO A 83 -7.548 -10.846 -3.012 1.00 0.00 C ATOM 1266 C PRO A 83 -7.700 -9.685 -2.020 1.00 0.00 C ATOM 1267 O PRO A 83 -8.811 -9.164 -1.872 1.00 0.00 O ATOM 1268 CB PRO A 83 -7.462 -12.175 -2.266 1.00 0.00 C ATOM 1269 CG PRO A 83 -6.781 -13.089 -3.217 1.00 0.00 C ATOM 1270 CD PRO A 83 -5.774 -12.243 -3.953 1.00 0.00 C ATOM 0 HA PRO A 83 -8.423 -10.710 -3.648 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -6.898 -12.074 -1.339 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -8.452 -12.545 -1.999 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -6.292 -13.908 -2.690 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -7.495 -13.536 -3.908 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -4.786 -12.314 -3.498 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -5.671 -12.560 -4.991 1.00 0.00 H new ATOM 1278 N GLY A 84 -6.621 -9.277 -1.347 1.00 0.00 N ATOM 1279 CA GLY A 84 -6.749 -8.183 -0.395 1.00 0.00 C ATOM 1280 C GLY A 84 -5.490 -7.889 0.403 1.00 0.00 C ATOM 1281 O GLY A 84 -4.503 -8.618 0.305 1.00 0.00 O ATOM 0 H GLY A 84 -5.685 -9.672 -1.440 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -7.040 -7.282 -0.934 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -7.557 -8.415 0.299 1.00 0.00 H new ATOM 1285 N ASP A 85 -5.560 -6.813 1.230 1.00 0.00 N ATOM 1286 CA ASP A 85 -4.443 -6.338 2.107 1.00 0.00 C ATOM 1287 C ASP A 85 -3.068 -6.248 1.398 1.00 0.00 C ATOM 1288 O ASP A 85 -2.069 -6.805 1.873 1.00 0.00 O ATOM 1289 CB ASP A 85 -4.333 -7.173 3.412 1.00 0.00 C ATOM 1290 CG ASP A 85 -4.327 -8.682 3.209 1.00 0.00 C ATOM 1291 OD1 ASP A 85 -5.418 -9.289 3.236 1.00 0.00 O ATOM 1292 OD2 ASP A 85 -3.231 -9.252 3.024 1.00 0.00 O ATOM 0 H ASP A 85 -6.400 -6.241 1.312 1.00 0.00 H new ATOM 0 HA ASP A 85 -4.715 -5.315 2.368 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -3.419 -6.887 3.933 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -5.166 -6.912 4.064 1.00 0.00 H new ATOM 1297 N ILE A 86 -3.034 -5.557 0.249 1.00 0.00 N ATOM 1298 CA ILE A 86 -1.790 -5.381 -0.525 1.00 0.00 C ATOM 1299 C ILE A 86 -1.731 -4.053 -1.308 1.00 0.00 C ATOM 1300 O ILE A 86 -2.762 -3.530 -1.745 1.00 0.00 O ATOM 1301 CB ILE A 86 -1.480 -6.581 -1.488 1.00 0.00 C ATOM 1302 CG1 ILE A 86 -2.677 -7.528 -1.674 1.00 0.00 C ATOM 1303 CG2 ILE A 86 -0.285 -7.364 -0.971 1.00 0.00 C ATOM 1304 CD1 ILE A 86 -3.542 -7.209 -2.871 1.00 0.00 C ATOM 0 H ILE A 86 -3.851 -5.110 -0.167 1.00 0.00 H new ATOM 0 HA ILE A 86 -1.013 -5.352 0.239 1.00 0.00 H new ATOM 0 HB ILE A 86 -1.258 -6.151 -2.465 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -2.306 -8.549 -1.770 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -3.294 -7.496 -0.776 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -0.076 -8.195 -1.644 1.00 0.00 H new ATOM 0 HG22 ILE A 86 0.585 -6.709 -0.921 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -0.506 -7.750 0.024 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -4.362 -7.924 -2.928 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -3.946 -6.201 -2.770 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -2.943 -7.271 -3.780 1.00 0.00 H new ATOM 1316 N VAL A 87 -0.498 -3.501 -1.403 1.00 0.00 N ATOM 1317 CA VAL A 87 -0.159 -2.288 -2.199 1.00 0.00 C ATOM 1318 C VAL A 87 1.284 -2.477 -2.743 1.00 0.00 C ATOM 1319 O VAL A 87 2.158 -2.865 -1.962 1.00 0.00 O ATOM 1320 CB VAL A 87 -0.295 -0.973 -1.357 1.00 0.00 C ATOM 1321 CG1 VAL A 87 0.523 -1.013 -0.063 1.00 0.00 C ATOM 1322 CG2 VAL A 87 0.062 0.268 -2.176 1.00 0.00 C ATOM 0 H VAL A 87 0.310 -3.893 -0.919 1.00 0.00 H new ATOM 0 HA VAL A 87 -0.862 -2.177 -3.024 1.00 0.00 H new ATOM 0 HB VAL A 87 -1.346 -0.907 -1.077 1.00 0.00 H new ATOM 0 HG11 VAL A 87 0.391 -0.077 0.480 1.00 0.00 H new ATOM 0 HG12 VAL A 87 0.183 -1.843 0.557 1.00 0.00 H new ATOM 0 HG13 VAL A 87 1.578 -1.148 -0.303 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.046 1.157 -1.555 1.00 0.00 H new ATOM 0 HG22 VAL A 87 1.092 0.191 -2.524 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -0.606 0.342 -3.034 1.00 0.00 H new ATOM 1332 N VAL A 88 1.561 -2.215 -4.055 1.00 0.00 N ATOM 1333 CA VAL A 88 2.920 -2.467 -4.574 1.00 0.00 C ATOM 1334 C VAL A 88 3.852 -1.249 -4.448 1.00 0.00 C ATOM 1335 O VAL A 88 3.528 -0.161 -4.919 1.00 0.00 O ATOM 1336 CB VAL A 88 2.929 -2.932 -6.057 1.00 0.00 C ATOM 1337 CG1 VAL A 88 4.107 -3.858 -6.337 1.00 0.00 C ATOM 1338 CG2 VAL A 88 1.631 -3.601 -6.483 1.00 0.00 C ATOM 0 H VAL A 88 0.893 -1.849 -4.734 1.00 0.00 H new ATOM 0 HA VAL A 88 3.295 -3.272 -3.942 1.00 0.00 H new ATOM 0 HB VAL A 88 3.034 -2.025 -6.652 1.00 0.00 H new ATOM 0 HG11 VAL A 88 4.087 -4.167 -7.382 1.00 0.00 H new ATOM 0 HG12 VAL A 88 5.040 -3.332 -6.132 1.00 0.00 H new ATOM 0 HG13 VAL A 88 4.038 -4.738 -5.697 1.00 0.00 H new ATOM 0 HG21 VAL A 88 1.703 -3.902 -7.528 1.00 0.00 H new ATOM 0 HG22 VAL A 88 1.455 -4.480 -5.864 1.00 0.00 H new ATOM 0 HG23 VAL A 88 0.804 -2.901 -6.363 1.00 0.00 H new ATOM 1348 N ALA A 89 5.002 -1.468 -3.776 1.00 0.00 N ATOM 1349 CA ALA A 89 6.057 -0.464 -3.585 1.00 0.00 C ATOM 1350 C ALA A 89 7.409 -1.179 -3.531 1.00 0.00 C ATOM 1351 O ALA A 89 7.768 -1.765 -2.501 1.00 0.00 O ATOM 1352 CB ALA A 89 5.817 0.347 -2.308 1.00 0.00 C ATOM 0 H ALA A 89 5.222 -2.366 -3.345 1.00 0.00 H new ATOM 0 HA ALA A 89 6.047 0.237 -4.419 1.00 0.00 H new ATOM 0 HB1 ALA A 89 6.612 1.083 -2.190 1.00 0.00 H new ATOM 0 HB2 ALA A 89 4.857 0.858 -2.377 1.00 0.00 H new ATOM 0 HB3 ALA A 89 5.811 -0.322 -1.448 1.00 0.00 H new ATOM 1358 N LEU A 90 8.150 -1.151 -4.647 1.00 0.00 N ATOM 1359 CA LEU A 90 9.449 -1.839 -4.708 1.00 0.00 C ATOM 1360 C LEU A 90 10.562 -0.931 -5.201 1.00 0.00 C ATOM 1361 O LEU A 90 10.318 -0.056 -6.015 1.00 0.00 O ATOM 1362 CB LEU A 90 9.369 -3.119 -5.581 1.00 0.00 C ATOM 1363 CG LEU A 90 9.048 -3.000 -7.106 1.00 0.00 C ATOM 1364 CD1 LEU A 90 8.642 -4.357 -7.657 1.00 0.00 C ATOM 1365 CD2 LEU A 90 7.946 -1.989 -7.422 1.00 0.00 C ATOM 0 H LEU A 90 7.880 -0.670 -5.505 1.00 0.00 H new ATOM 0 HA LEU A 90 9.693 -2.130 -3.686 1.00 0.00 H new ATOM 0 HB2 LEU A 90 10.324 -3.636 -5.489 1.00 0.00 H new ATOM 0 HB3 LEU A 90 8.612 -3.767 -5.139 1.00 0.00 H new ATOM 0 HG LEU A 90 9.961 -2.641 -7.580 1.00 0.00 H new ATOM 0 HD11 LEU A 90 8.420 -4.266 -8.720 1.00 0.00 H new ATOM 0 HD12 LEU A 90 9.458 -5.066 -7.516 1.00 0.00 H new ATOM 0 HD13 LEU A 90 7.757 -4.713 -7.130 1.00 0.00 H new ATOM 0 HD21 LEU A 90 7.777 -1.960 -8.498 1.00 0.00 H new ATOM 0 HD22 LEU A 90 7.026 -2.284 -6.918 1.00 0.00 H new ATOM 0 HD23 LEU A 90 8.248 -1.001 -7.075 1.00 0.00 H new ATOM 1377 N GLY A 91 11.773 -1.123 -4.655 1.00 0.00 N ATOM 1378 CA GLY A 91 12.938 -0.338 -5.074 1.00 0.00 C ATOM 1379 C GLY A 91 12.948 1.080 -4.525 1.00 0.00 C ATOM 1380 O GLY A 91 12.883 1.278 -3.311 1.00 0.00 O ATOM 0 H GLY A 91 11.967 -1.811 -3.927 1.00 0.00 H new ATOM 0 HA2 GLY A 91 13.845 -0.850 -4.752 1.00 0.00 H new ATOM 0 HA3 GLY A 91 12.965 -0.297 -6.163 1.00 0.00 H new ATOM 1384 N HIS A 92 13.025 2.068 -5.437 1.00 0.00 N ATOM 1385 CA HIS A 92 13.033 3.506 -5.058 1.00 0.00 C ATOM 1386 C HIS A 92 11.700 3.905 -4.442 1.00 0.00 C ATOM 1387 O HIS A 92 10.847 4.532 -5.082 1.00 0.00 O ATOM 1388 CB HIS A 92 13.334 4.410 -6.254 1.00 0.00 C ATOM 1389 CG HIS A 92 14.776 4.810 -6.353 1.00 0.00 C ATOM 1390 ND1 HIS A 92 15.820 3.907 -6.304 1.00 0.00 N ATOM 1391 CD2 HIS A 92 15.347 6.031 -6.492 1.00 0.00 C ATOM 1392 CE1 HIS A 92 16.966 4.556 -6.408 1.00 0.00 C ATOM 1393 NE2 HIS A 92 16.707 5.844 -6.524 1.00 0.00 N ATOM 0 H HIS A 92 13.083 1.903 -6.442 1.00 0.00 H new ATOM 0 HA HIS A 92 13.828 3.638 -4.324 1.00 0.00 H new ATOM 0 HB2 HIS A 92 13.044 3.896 -7.170 1.00 0.00 H new ATOM 0 HB3 HIS A 92 12.720 5.308 -6.184 1.00 0.00 H new ATOM 0 HD2 HIS A 92 14.829 6.976 -6.564 1.00 0.00 H new ATOM 0 HE1 HIS A 92 17.949 4.108 -6.399 1.00 0.00 H new ATOM 0 HE2 HIS A 92 17.404 6.582 -6.622 1.00 0.00 H new ATOM 1402 N THR A 93 11.536 3.516 -3.190 1.00 0.00 N ATOM 1403 CA THR A 93 10.306 3.752 -2.455 1.00 0.00 C ATOM 1404 C THR A 93 10.637 4.311 -1.060 1.00 0.00 C ATOM 1405 O THR A 93 11.276 3.616 -0.266 1.00 0.00 O ATOM 1406 CB THR A 93 9.490 2.423 -2.378 1.00 0.00 C ATOM 1407 OG1 THR A 93 10.110 1.503 -1.467 1.00 0.00 O ATOM 1408 CG2 THR A 93 9.409 1.774 -3.765 1.00 0.00 C ATOM 0 H THR A 93 12.253 3.027 -2.654 1.00 0.00 H new ATOM 0 HA THR A 93 9.692 4.493 -2.967 1.00 0.00 H new ATOM 0 HB THR A 93 8.487 2.660 -2.023 1.00 0.00 H new ATOM 0 HG1 THR A 93 10.601 2.002 -0.781 1.00 0.00 H new ATOM 0 HG21 THR A 93 8.838 0.848 -3.701 1.00 0.00 H new ATOM 0 HG22 THR A 93 8.917 2.456 -4.458 1.00 0.00 H new ATOM 0 HG23 THR A 93 10.415 1.556 -4.124 1.00 0.00 H new ATOM 1416 N PRO A 94 10.222 5.583 -0.736 1.00 0.00 N ATOM 1417 CA PRO A 94 10.538 6.217 0.566 1.00 0.00 C ATOM 1418 C PRO A 94 9.879 5.521 1.769 1.00 0.00 C ATOM 1419 O PRO A 94 8.842 5.961 2.282 1.00 0.00 O ATOM 1420 CB PRO A 94 10.034 7.661 0.400 1.00 0.00 C ATOM 1421 CG PRO A 94 9.005 7.606 -0.675 1.00 0.00 C ATOM 1422 CD PRO A 94 9.416 6.491 -1.598 1.00 0.00 C ATOM 0 HA PRO A 94 11.603 6.153 0.790 1.00 0.00 H new ATOM 0 HB2 PRO A 94 9.609 8.037 1.331 1.00 0.00 H new ATOM 0 HB3 PRO A 94 10.849 8.332 0.128 1.00 0.00 H new ATOM 0 HG2 PRO A 94 8.016 7.420 -0.257 1.00 0.00 H new ATOM 0 HG3 PRO A 94 8.951 8.554 -1.210 1.00 0.00 H new ATOM 0 HD2 PRO A 94 8.549 5.979 -2.015 1.00 0.00 H new ATOM 0 HD3 PRO A 94 10.000 6.865 -2.439 1.00 0.00 H new ATOM 1430 N VAL A 95 10.507 4.419 2.199 1.00 0.00 N ATOM 1431 CA VAL A 95 10.032 3.617 3.336 1.00 0.00 C ATOM 1432 C VAL A 95 11.180 2.837 3.985 1.00 0.00 C ATOM 1433 O VAL A 95 11.335 2.851 5.209 1.00 0.00 O ATOM 1434 CB VAL A 95 8.903 2.609 2.944 1.00 0.00 C ATOM 1435 CG1 VAL A 95 7.556 3.310 2.872 1.00 0.00 C ATOM 1436 CG2 VAL A 95 9.191 1.892 1.621 1.00 0.00 C ATOM 0 H VAL A 95 11.359 4.058 1.769 1.00 0.00 H new ATOM 0 HA VAL A 95 9.619 4.335 4.045 1.00 0.00 H new ATOM 0 HB VAL A 95 8.874 1.852 3.728 1.00 0.00 H new ATOM 0 HG11 VAL A 95 6.785 2.590 2.598 1.00 0.00 H new ATOM 0 HG12 VAL A 95 7.319 3.743 3.844 1.00 0.00 H new ATOM 0 HG13 VAL A 95 7.597 4.101 2.123 1.00 0.00 H new ATOM 0 HG21 VAL A 95 8.376 1.204 1.395 1.00 0.00 H new ATOM 0 HG22 VAL A 95 9.278 2.627 0.820 1.00 0.00 H new ATOM 0 HG23 VAL A 95 10.124 1.335 1.705 1.00 0.00 H new ATOM 1446 N GLY A 96 11.978 2.169 3.142 1.00 0.00 N ATOM 1447 CA GLY A 96 13.090 1.361 3.617 1.00 0.00 C ATOM 1448 C GLY A 96 14.410 2.094 3.656 1.00 0.00 C ATOM 1449 O GLY A 96 14.847 2.665 2.653 1.00 0.00 O ATOM 0 H GLY A 96 11.868 2.177 2.128 1.00 0.00 H new ATOM 0 HA2 GLY A 96 12.859 0.996 4.618 1.00 0.00 H new ATOM 0 HA3 GLY A 96 13.191 0.486 2.974 1.00 0.00 H new ATOM 1453 N GLY A 97 15.037 2.067 4.838 1.00 0.00 N ATOM 1454 CA GLY A 97 16.350 2.681 5.033 1.00 0.00 C ATOM 1455 C GLY A 97 17.467 1.725 4.631 1.00 0.00 C ATOM 1456 O GLY A 97 18.651 1.997 4.848 1.00 0.00 O ATOM 0 H GLY A 97 14.653 1.625 5.673 1.00 0.00 H new ATOM 0 HA2 GLY A 97 16.419 3.595 4.443 1.00 0.00 H new ATOM 0 HA3 GLY A 97 16.470 2.967 6.078 1.00 0.00 H new ATOM 1460 N ILE A 98 17.047 0.600 4.039 1.00 0.00 N ATOM 1461 CA ILE A 98 17.928 -0.459 3.557 1.00 0.00 C ATOM 1462 C ILE A 98 18.385 -0.128 2.113 1.00 0.00 C ATOM 1463 O ILE A 98 17.944 0.878 1.550 1.00 0.00 O ATOM 1464 CB ILE A 98 17.190 -1.858 3.679 1.00 0.00 C ATOM 1465 CG1 ILE A 98 17.813 -2.976 2.822 1.00 0.00 C ATOM 1466 CG2 ILE A 98 15.698 -1.743 3.357 1.00 0.00 C ATOM 1467 CD1 ILE A 98 19.042 -3.618 3.437 1.00 0.00 C ATOM 0 H ILE A 98 16.059 0.401 3.880 1.00 0.00 H new ATOM 0 HA ILE A 98 18.829 -0.526 4.167 1.00 0.00 H new ATOM 0 HB ILE A 98 17.320 -2.144 4.723 1.00 0.00 H new ATOM 0 HG12 ILE A 98 17.062 -3.747 2.649 1.00 0.00 H new ATOM 0 HG13 ILE A 98 18.080 -2.566 1.848 1.00 0.00 H new ATOM 0 HG21 ILE A 98 15.229 -2.722 3.452 1.00 0.00 H new ATOM 0 HG22 ILE A 98 15.228 -1.047 4.052 1.00 0.00 H new ATOM 0 HG23 ILE A 98 15.573 -1.378 2.338 1.00 0.00 H new ATOM 0 HD11 ILE A 98 19.419 -4.394 2.771 1.00 0.00 H new ATOM 0 HD12 ILE A 98 19.812 -2.861 3.585 1.00 0.00 H new ATOM 0 HD13 ILE A 98 18.779 -4.060 4.398 1.00 0.00 H new ATOM 1479 N PHE A 99 19.287 -0.943 1.542 1.00 0.00 N ATOM 1480 CA PHE A 99 19.778 -0.715 0.180 1.00 0.00 C ATOM 1481 C PHE A 99 19.749 -2.003 -0.654 1.00 0.00 C ATOM 1482 O PHE A 99 20.708 -2.786 -0.659 1.00 0.00 O ATOM 1483 CB PHE A 99 21.200 -0.133 0.215 1.00 0.00 C ATOM 1484 CG PHE A 99 21.272 1.267 0.762 1.00 0.00 C ATOM 1485 CD1 PHE A 99 21.151 2.361 -0.081 1.00 0.00 C ATOM 1486 CD2 PHE A 99 21.462 1.487 2.117 1.00 0.00 C ATOM 1487 CE1 PHE A 99 21.216 3.648 0.419 1.00 0.00 C ATOM 1488 CE2 PHE A 99 21.529 2.772 2.622 1.00 0.00 C ATOM 1489 CZ PHE A 99 21.406 3.854 1.771 1.00 0.00 C ATOM 0 H PHE A 99 19.687 -1.761 2.002 1.00 0.00 H new ATOM 0 HA PHE A 99 19.111 0.004 -0.297 1.00 0.00 H new ATOM 0 HB2 PHE A 99 21.833 -0.782 0.820 1.00 0.00 H new ATOM 0 HB3 PHE A 99 21.610 -0.140 -0.795 1.00 0.00 H new ATOM 0 HD1 PHE A 99 21.004 2.206 -1.140 1.00 0.00 H new ATOM 0 HD2 PHE A 99 21.559 0.645 2.786 1.00 0.00 H new ATOM 0 HE1 PHE A 99 21.118 4.492 -0.248 1.00 0.00 H new ATOM 0 HE2 PHE A 99 21.677 2.930 3.680 1.00 0.00 H new ATOM 0 HZ PHE A 99 21.458 4.859 2.163 1.00 0.00 H new ATOM 1499 N ASP A 100 18.618 -2.212 -1.351 1.00 0.00 N ATOM 1500 CA ASP A 100 18.409 -3.361 -2.239 1.00 0.00 C ATOM 1501 C ASP A 100 17.336 -3.041 -3.278 1.00 0.00 C ATOM 1502 O ASP A 100 16.200 -2.746 -2.931 1.00 0.00 O ATOM 1503 CB ASP A 100 17.969 -4.613 -1.455 1.00 0.00 C ATOM 1504 CG ASP A 100 19.081 -5.222 -0.622 1.00 0.00 C ATOM 1505 OD1 ASP A 100 19.806 -6.095 -1.145 1.00 0.00 O ATOM 1506 OD2 ASP A 100 19.226 -4.827 0.554 1.00 0.00 O ATOM 0 H ASP A 100 17.818 -1.580 -1.311 1.00 0.00 H new ATOM 0 HA ASP A 100 19.362 -3.564 -2.728 1.00 0.00 H new ATOM 0 HB2 ASP A 100 17.137 -4.350 -0.801 1.00 0.00 H new ATOM 0 HB3 ASP A 100 17.599 -5.361 -2.156 1.00 0.00 H new ATOM 1511 N LEU A 101 17.685 -3.159 -4.555 1.00 0.00 N ATOM 1512 CA LEU A 101 16.737 -2.909 -5.644 1.00 0.00 C ATOM 1513 C LEU A 101 16.477 -4.206 -6.406 1.00 0.00 C ATOM 1514 O LEU A 101 17.416 -4.871 -6.849 1.00 0.00 O ATOM 1515 CB LEU A 101 17.277 -1.831 -6.589 1.00 0.00 C ATOM 1516 CG LEU A 101 16.416 -0.571 -6.770 1.00 0.00 C ATOM 1517 CD1 LEU A 101 16.397 0.287 -5.507 1.00 0.00 C ATOM 1518 CD2 LEU A 101 16.948 0.239 -7.940 1.00 0.00 C ATOM 0 H LEU A 101 18.619 -3.427 -4.865 1.00 0.00 H new ATOM 0 HA LEU A 101 15.798 -2.551 -5.222 1.00 0.00 H new ATOM 0 HB2 LEU A 101 18.258 -1.523 -6.227 1.00 0.00 H new ATOM 0 HB3 LEU A 101 17.427 -2.283 -7.569 1.00 0.00 H new ATOM 0 HG LEU A 101 15.391 -0.885 -6.969 1.00 0.00 H new ATOM 0 HD11 LEU A 101 15.778 1.168 -5.675 1.00 0.00 H new ATOM 0 HD12 LEU A 101 15.987 -0.292 -4.680 1.00 0.00 H new ATOM 0 HD13 LEU A 101 17.413 0.598 -5.263 1.00 0.00 H new ATOM 0 HD21 LEU A 101 16.339 1.133 -8.070 1.00 0.00 H new ATOM 0 HD22 LEU A 101 17.980 0.529 -7.743 1.00 0.00 H new ATOM 0 HD23 LEU A 101 16.907 -0.363 -8.848 1.00 0.00 H new ATOM 1530 N LYS A 102 15.213 -4.628 -6.446 1.00 0.00 N ATOM 1531 CA LYS A 102 14.844 -5.843 -7.169 1.00 0.00 C ATOM 1532 C LYS A 102 14.412 -5.552 -8.611 1.00 0.00 C ATOM 1533 O LYS A 102 13.367 -4.942 -8.861 1.00 0.00 O ATOM 1534 CB LYS A 102 13.772 -6.643 -6.389 1.00 0.00 C ATOM 1535 CG LYS A 102 12.409 -5.953 -6.241 1.00 0.00 C ATOM 1536 CD LYS A 102 11.386 -6.481 -7.245 1.00 0.00 C ATOM 1537 CE LYS A 102 10.285 -7.286 -6.563 1.00 0.00 C ATOM 1538 NZ LYS A 102 10.767 -8.615 -6.090 1.00 0.00 N ATOM 0 H LYS A 102 14.435 -4.151 -5.991 1.00 0.00 H new ATOM 0 HA LYS A 102 15.735 -6.466 -7.241 1.00 0.00 H new ATOM 0 HB2 LYS A 102 13.623 -7.600 -6.889 1.00 0.00 H new ATOM 0 HB3 LYS A 102 14.159 -6.861 -5.394 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.034 -6.105 -5.229 1.00 0.00 H new ATOM 0 HG3 LYS A 102 12.530 -4.879 -6.379 1.00 0.00 H new ATOM 0 HD2 LYS A 102 10.943 -5.645 -7.786 1.00 0.00 H new ATOM 0 HD3 LYS A 102 11.890 -7.106 -7.982 1.00 0.00 H new ATOM 0 HE2 LYS A 102 9.896 -6.721 -5.716 1.00 0.00 H new ATOM 0 HE3 LYS A 102 9.458 -7.428 -7.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 10.312 -8.847 -5.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 10.527 -9.342 -6.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 11.799 -8.585 -5.962 1.00 0.00 H new ATOM 1552 N VAL A 103 15.269 -5.959 -9.552 1.00 0.00 N ATOM 1553 CA VAL A 103 15.005 -5.791 -10.983 1.00 0.00 C ATOM 1554 C VAL A 103 15.520 -7.034 -11.740 1.00 0.00 C ATOM 1555 O VAL A 103 16.667 -7.065 -12.209 1.00 0.00 O ATOM 1556 CB VAL A 103 15.641 -4.483 -11.573 1.00 0.00 C ATOM 1557 CG1 VAL A 103 15.233 -4.270 -13.031 1.00 0.00 C ATOM 1558 CG2 VAL A 103 15.250 -3.253 -10.755 1.00 0.00 C ATOM 0 H VAL A 103 16.159 -6.411 -9.345 1.00 0.00 H new ATOM 0 HA VAL A 103 13.928 -5.690 -11.113 1.00 0.00 H new ATOM 0 HB VAL A 103 16.722 -4.612 -11.524 1.00 0.00 H new ATOM 0 HG11 VAL A 103 15.691 -3.355 -13.407 1.00 0.00 H new ATOM 0 HG12 VAL A 103 15.568 -5.117 -13.630 1.00 0.00 H new ATOM 0 HG13 VAL A 103 14.148 -4.186 -13.097 1.00 0.00 H new ATOM 0 HG21 VAL A 103 15.708 -2.365 -11.191 1.00 0.00 H new ATOM 0 HG22 VAL A 103 14.166 -3.142 -10.760 1.00 0.00 H new ATOM 0 HG23 VAL A 103 15.597 -3.373 -9.729 1.00 0.00 H new ATOM 1568 N GLY A 104 14.673 -8.078 -11.796 1.00 0.00 N ATOM 1569 CA GLY A 104 15.000 -9.331 -12.495 1.00 0.00 C ATOM 1570 C GLY A 104 16.322 -9.960 -12.090 1.00 0.00 C ATOM 1571 O GLY A 104 16.408 -10.614 -11.048 1.00 0.00 O ATOM 0 H GLY A 104 13.750 -8.076 -11.361 1.00 0.00 H new ATOM 0 HA2 GLY A 104 14.201 -10.050 -12.315 1.00 0.00 H new ATOM 0 HA3 GLY A 104 15.019 -9.138 -13.568 1.00 0.00 H new ATOM 1575 N SER A 105 17.354 -9.764 -12.929 1.00 0.00 N ATOM 1576 CA SER A 105 18.700 -10.297 -12.661 1.00 0.00 C ATOM 1577 C SER A 105 19.417 -9.441 -11.599 1.00 0.00 C ATOM 1578 O SER A 105 20.627 -9.559 -11.374 1.00 0.00 O ATOM 1579 CB SER A 105 19.515 -10.347 -13.960 1.00 0.00 C ATOM 1580 OG SER A 105 19.544 -9.080 -14.598 1.00 0.00 O ATOM 0 H SER A 105 17.281 -9.239 -13.800 1.00 0.00 H new ATOM 0 HA SER A 105 18.606 -11.311 -12.272 1.00 0.00 H new ATOM 0 HB2 SER A 105 20.533 -10.670 -13.741 1.00 0.00 H new ATOM 0 HB3 SER A 105 19.084 -11.087 -14.634 1.00 0.00 H new ATOM 0 HG SER A 105 20.071 -9.141 -15.422 1.00 0.00 H new ATOM 1586 N THR A 106 18.615 -8.599 -10.950 1.00 0.00 N ATOM 1587 CA THR A 106 19.046 -7.695 -9.895 1.00 0.00 C ATOM 1588 C THR A 106 17.962 -7.704 -8.816 1.00 0.00 C ATOM 1589 O THR A 106 17.736 -6.716 -8.121 1.00 0.00 O ATOM 1590 CB THR A 106 19.212 -6.260 -10.444 1.00 0.00 C ATOM 1591 OG1 THR A 106 19.678 -6.297 -11.797 1.00 0.00 O ATOM 1592 CG2 THR A 106 20.181 -5.439 -9.597 1.00 0.00 C ATOM 0 H THR A 106 17.618 -8.528 -11.153 1.00 0.00 H new ATOM 0 HA THR A 106 20.007 -8.017 -9.494 1.00 0.00 H new ATOM 0 HB THR A 106 18.233 -5.782 -10.404 1.00 0.00 H new ATOM 0 HG1 THR A 106 18.934 -6.526 -12.393 1.00 0.00 H new ATOM 0 HG21 THR A 106 20.271 -4.437 -10.016 1.00 0.00 H new ATOM 0 HG22 THR A 106 19.806 -5.374 -8.576 1.00 0.00 H new ATOM 0 HG23 THR A 106 21.159 -5.920 -9.594 1.00 0.00 H new ATOM 1600 N LYS A 107 17.309 -8.859 -8.692 1.00 0.00 N ATOM 1601 CA LYS A 107 16.197 -9.061 -7.772 1.00 0.00 C ATOM 1602 C LYS A 107 16.618 -9.042 -6.282 1.00 0.00 C ATOM 1603 O LYS A 107 16.896 -10.087 -5.681 1.00 0.00 O ATOM 1604 CB LYS A 107 15.500 -10.377 -8.165 1.00 0.00 C ATOM 1605 CG LYS A 107 14.039 -10.503 -7.721 1.00 0.00 C ATOM 1606 CD LYS A 107 13.080 -9.776 -8.665 1.00 0.00 C ATOM 1607 CE LYS A 107 12.542 -10.700 -9.752 1.00 0.00 C ATOM 1608 NZ LYS A 107 11.611 -9.991 -10.673 1.00 0.00 N ATOM 0 H LYS A 107 17.543 -9.690 -9.236 1.00 0.00 H new ATOM 0 HA LYS A 107 15.504 -8.224 -7.862 1.00 0.00 H new ATOM 0 HB2 LYS A 107 15.543 -10.482 -9.249 1.00 0.00 H new ATOM 0 HB3 LYS A 107 16.064 -11.208 -7.742 1.00 0.00 H new ATOM 0 HG2 LYS A 107 13.766 -11.557 -7.671 1.00 0.00 H new ATOM 0 HG3 LYS A 107 13.931 -10.098 -6.715 1.00 0.00 H new ATOM 0 HD2 LYS A 107 12.248 -9.366 -8.092 1.00 0.00 H new ATOM 0 HD3 LYS A 107 13.595 -8.933 -9.127 1.00 0.00 H new ATOM 0 HE2 LYS A 107 13.374 -11.112 -10.323 1.00 0.00 H new ATOM 0 HE3 LYS A 107 12.025 -11.541 -9.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 11.268 -10.654 -11.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 10.804 -9.620 -10.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 12.111 -9.204 -11.133 1.00 0.00 H new ATOM 1622 N HIS A 108 16.663 -7.821 -5.710 1.00 0.00 N ATOM 1623 CA HIS A 108 16.987 -7.607 -4.292 1.00 0.00 C ATOM 1624 C HIS A 108 16.125 -6.447 -3.806 1.00 0.00 C ATOM 1625 O HIS A 108 16.409 -5.311 -4.103 1.00 0.00 O ATOM 1626 CB HIS A 108 18.482 -7.295 -4.064 1.00 0.00 C ATOM 1627 CG HIS A 108 19.441 -8.252 -4.721 1.00 0.00 C ATOM 1628 ND1 HIS A 108 20.404 -7.845 -5.621 1.00 0.00 N ATOM 1629 CD2 HIS A 108 19.587 -9.595 -4.601 1.00 0.00 C ATOM 1630 CE1 HIS A 108 21.099 -8.893 -6.025 1.00 0.00 C ATOM 1631 NE2 HIS A 108 20.624 -9.966 -5.421 1.00 0.00 N ATOM 0 H HIS A 108 16.475 -6.959 -6.221 1.00 0.00 H new ATOM 0 HA HIS A 108 16.783 -8.521 -3.735 1.00 0.00 H new ATOM 0 HB2 HIS A 108 18.688 -6.289 -4.431 1.00 0.00 H new ATOM 0 HB3 HIS A 108 18.677 -7.289 -2.992 1.00 0.00 H new ATOM 0 HD2 HIS A 108 18.998 -10.250 -3.977 1.00 0.00 H new ATOM 0 HE1 HIS A 108 21.917 -8.875 -6.730 1.00 0.00 H new ATOM 0 HE2 HIS A 108 20.971 -10.917 -5.544 1.00 0.00 H new ATOM 1640 N THR A 109 15.085 -6.737 -3.044 1.00 0.00 N ATOM 1641 CA THR A 109 14.139 -5.696 -2.611 1.00 0.00 C ATOM 1642 C THR A 109 14.403 -5.098 -1.229 1.00 0.00 C ATOM 1643 O THR A 109 14.585 -5.814 -0.246 1.00 0.00 O ATOM 1644 CB THR A 109 12.687 -6.237 -2.630 1.00 0.00 C ATOM 1645 OG1 THR A 109 12.548 -7.283 -3.598 1.00 0.00 O ATOM 1646 CG2 THR A 109 11.670 -5.131 -2.924 1.00 0.00 C ATOM 0 H THR A 109 14.866 -7.675 -2.709 1.00 0.00 H new ATOM 0 HA THR A 109 14.286 -4.892 -3.333 1.00 0.00 H new ATOM 0 HB THR A 109 12.483 -6.633 -1.635 1.00 0.00 H new ATOM 0 HG1 THR A 109 11.625 -7.612 -3.593 1.00 0.00 H new ATOM 0 HG21 THR A 109 10.665 -5.553 -2.928 1.00 0.00 H new ATOM 0 HG22 THR A 109 11.737 -4.361 -2.155 1.00 0.00 H new ATOM 0 HG23 THR A 109 11.883 -4.691 -3.898 1.00 0.00 H new ATOM 1654 N LEU A 110 14.425 -3.756 -1.201 1.00 0.00 N ATOM 1655 CA LEU A 110 14.563 -2.984 0.036 1.00 0.00 C ATOM 1656 C LEU A 110 13.205 -2.312 0.377 1.00 0.00 C ATOM 1657 O LEU A 110 12.871 -1.258 -0.173 1.00 0.00 O ATOM 1658 CB LEU A 110 15.704 -1.922 -0.141 1.00 0.00 C ATOM 1659 CG LEU A 110 15.360 -0.559 -0.827 1.00 0.00 C ATOM 1660 CD1 LEU A 110 16.596 0.307 -0.961 1.00 0.00 C ATOM 1661 CD2 LEU A 110 14.732 -0.736 -2.206 1.00 0.00 C ATOM 0 H LEU A 110 14.347 -3.179 -2.038 1.00 0.00 H new ATOM 0 HA LEU A 110 14.834 -3.638 0.865 1.00 0.00 H new ATOM 0 HB2 LEU A 110 16.108 -1.702 0.847 1.00 0.00 H new ATOM 0 HB3 LEU A 110 16.504 -2.389 -0.715 1.00 0.00 H new ATOM 0 HG LEU A 110 14.630 -0.073 -0.179 1.00 0.00 H new ATOM 0 HD11 LEU A 110 16.330 1.249 -1.441 1.00 0.00 H new ATOM 0 HD12 LEU A 110 17.009 0.507 0.028 1.00 0.00 H new ATOM 0 HD13 LEU A 110 17.340 -0.211 -1.566 1.00 0.00 H new ATOM 0 HD21 LEU A 110 14.514 0.242 -2.635 1.00 0.00 H new ATOM 0 HD22 LEU A 110 15.425 -1.271 -2.855 1.00 0.00 H new ATOM 0 HD23 LEU A 110 13.807 -1.306 -2.114 1.00 0.00 H new ATOM 1673 N GLN A 111 12.383 -2.918 1.249 1.00 0.00 N ATOM 1674 CA GLN A 111 11.101 -2.281 1.590 1.00 0.00 C ATOM 1675 C GLN A 111 10.678 -2.570 3.032 1.00 0.00 C ATOM 1676 O GLN A 111 10.055 -3.594 3.331 1.00 0.00 O ATOM 1677 CB GLN A 111 10.014 -2.707 0.576 1.00 0.00 C ATOM 1678 CG GLN A 111 8.781 -1.804 0.551 1.00 0.00 C ATOM 1679 CD GLN A 111 7.528 -2.520 1.016 1.00 0.00 C ATOM 1680 OE1 GLN A 111 6.808 -3.119 0.216 1.00 0.00 O ATOM 1681 NE2 GLN A 111 7.261 -2.461 2.314 1.00 0.00 N ATOM 0 H GLN A 111 12.570 -3.807 1.712 1.00 0.00 H new ATOM 0 HA GLN A 111 11.231 -1.201 1.524 1.00 0.00 H new ATOM 0 HB2 GLN A 111 10.454 -2.728 -0.421 1.00 0.00 H new ATOM 0 HB3 GLN A 111 9.699 -3.725 0.807 1.00 0.00 H new ATOM 0 HG2 GLN A 111 8.957 -0.936 1.187 1.00 0.00 H new ATOM 0 HG3 GLN A 111 8.628 -1.431 -0.462 1.00 0.00 H new ATOM 0 HE21 GLN A 111 7.886 -1.953 2.941 1.00 0.00 H new ATOM 0 HE22 GLN A 111 6.431 -2.923 2.686 1.00 0.00 H new ATOM 1690 N ALA A 112 11.044 -1.638 3.912 1.00 0.00 N ATOM 1691 CA ALA A 112 10.706 -1.706 5.334 1.00 0.00 C ATOM 1692 C ALA A 112 9.743 -0.592 5.725 1.00 0.00 C ATOM 1693 O ALA A 112 10.137 0.579 5.778 1.00 0.00 O ATOM 1694 CB ALA A 112 11.969 -1.669 6.188 1.00 0.00 C ATOM 0 H ALA A 112 11.585 -0.812 3.658 1.00 0.00 H new ATOM 0 HA ALA A 112 10.201 -2.654 5.518 1.00 0.00 H new ATOM 0 HB1 ALA A 112 11.697 -1.721 7.242 1.00 0.00 H new ATOM 0 HB2 ALA A 112 12.604 -2.518 5.935 1.00 0.00 H new ATOM 0 HB3 ALA A 112 12.510 -0.742 5.998 1.00 0.00 H new ATOM 1700 N ILE A 113 8.479 -0.943 5.983 1.00 0.00 N ATOM 1701 CA ILE A 113 7.499 0.065 6.388 1.00 0.00 C ATOM 1702 C ILE A 113 6.888 -0.244 7.767 1.00 0.00 C ATOM 1703 O ILE A 113 7.147 0.494 8.723 1.00 0.00 O ATOM 1704 CB ILE A 113 6.404 0.345 5.285 1.00 0.00 C ATOM 1705 CG1 ILE A 113 5.307 1.307 5.790 1.00 0.00 C ATOM 1706 CG2 ILE A 113 5.779 -0.922 4.708 1.00 0.00 C ATOM 1707 CD1 ILE A 113 5.683 2.774 5.731 1.00 0.00 C ATOM 0 H ILE A 113 8.118 -1.895 5.920 1.00 0.00 H new ATOM 0 HA ILE A 113 8.050 0.999 6.492 1.00 0.00 H new ATOM 0 HB ILE A 113 6.941 0.829 4.470 1.00 0.00 H new ATOM 0 HG12 ILE A 113 4.405 1.152 5.198 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.061 1.049 6.820 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.036 -0.652 3.957 1.00 0.00 H new ATOM 0 HG22 ILE A 113 6.555 -1.533 4.247 1.00 0.00 H new ATOM 0 HG23 ILE A 113 5.298 -1.487 5.507 1.00 0.00 H new ATOM 0 HD11 ILE A 113 4.855 3.377 6.104 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.565 2.948 6.347 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.899 3.053 4.700 1.00 0.00 H new ATOM 1719 N GLU A 114 6.088 -1.319 7.879 1.00 0.00 N ATOM 1720 CA GLU A 114 5.432 -1.666 9.169 1.00 0.00 C ATOM 1721 C GLU A 114 4.952 -3.125 9.128 1.00 0.00 C ATOM 1722 O GLU A 114 5.313 -3.853 8.215 1.00 0.00 O ATOM 1723 CB GLU A 114 4.270 -0.637 9.423 1.00 0.00 C ATOM 1724 CG GLU A 114 3.063 -1.112 10.244 1.00 0.00 C ATOM 1725 CD GLU A 114 3.273 -0.989 11.740 1.00 0.00 C ATOM 1726 OE1 GLU A 114 3.741 -1.969 12.358 1.00 0.00 O ATOM 1727 OE2 GLU A 114 2.971 0.088 12.296 1.00 0.00 O ATOM 0 H GLU A 114 5.878 -1.957 7.112 1.00 0.00 H new ATOM 0 HA GLU A 114 6.129 -1.595 10.004 1.00 0.00 H new ATOM 0 HB2 GLU A 114 4.695 0.232 9.924 1.00 0.00 H new ATOM 0 HB3 GLU A 114 3.904 -0.298 8.454 1.00 0.00 H new ATOM 0 HG2 GLU A 114 2.186 -0.532 9.958 1.00 0.00 H new ATOM 0 HG3 GLU A 114 2.851 -2.152 9.998 1.00 0.00 H new ATOM 1734 N THR A 115 4.234 -3.579 10.162 1.00 0.00 N ATOM 1735 CA THR A 115 3.663 -4.918 10.144 1.00 0.00 C ATOM 1736 C THR A 115 2.151 -4.825 10.392 1.00 0.00 C ATOM 1737 O THR A 115 1.660 -5.060 11.503 1.00 0.00 O ATOM 1738 CB THR A 115 4.328 -5.847 11.191 1.00 0.00 C ATOM 1739 OG1 THR A 115 5.367 -5.154 11.894 1.00 0.00 O ATOM 1740 CG2 THR A 115 4.903 -7.086 10.521 1.00 0.00 C ATOM 0 H THR A 115 4.040 -3.043 11.008 1.00 0.00 H new ATOM 0 HA THR A 115 3.852 -5.357 9.164 1.00 0.00 H new ATOM 0 HB THR A 115 3.561 -6.153 11.903 1.00 0.00 H new ATOM 0 HG1 THR A 115 5.774 -5.755 12.552 1.00 0.00 H new ATOM 0 HG21 THR A 115 5.365 -7.725 11.273 1.00 0.00 H new ATOM 0 HG22 THR A 115 4.104 -7.633 10.021 1.00 0.00 H new ATOM 0 HG23 THR A 115 5.652 -6.788 9.788 1.00 0.00 H new ATOM 1748 N ARG A 116 1.429 -4.448 9.324 1.00 0.00 N ATOM 1749 CA ARG A 116 -0.035 -4.321 9.345 1.00 0.00 C ATOM 1750 C ARG A 116 -0.639 -4.948 8.106 1.00 0.00 C ATOM 1751 O ARG A 116 -0.268 -4.576 6.997 1.00 0.00 O ATOM 1752 CB ARG A 116 -0.469 -2.855 9.468 1.00 0.00 C ATOM 1753 CG ARG A 116 -0.268 -2.266 10.859 1.00 0.00 C ATOM 1754 CD ARG A 116 -0.935 -0.903 11.000 1.00 0.00 C ATOM 1755 NE ARG A 116 -0.242 0.144 10.236 1.00 0.00 N ATOM 1756 CZ ARG A 116 -0.560 1.447 10.263 1.00 0.00 C ATOM 1757 NH1 ARG A 116 -1.564 1.896 11.013 1.00 0.00 N ATOM 1758 NH2 ARG A 116 0.137 2.305 9.530 1.00 0.00 N ATOM 0 H ARG A 116 1.846 -4.223 8.421 1.00 0.00 H new ATOM 0 HA ARG A 116 -0.402 -4.852 10.223 1.00 0.00 H new ATOM 0 HB2 ARG A 116 0.091 -2.259 8.747 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -1.522 -2.774 9.199 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -0.675 -2.949 11.605 1.00 0.00 H new ATOM 0 HG3 ARG A 116 0.799 -2.171 11.063 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -1.969 -0.971 10.662 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -0.962 -0.622 12.053 1.00 0.00 H new ATOM 0 HE ARG A 116 0.537 -0.141 9.642 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -2.107 1.245 11.581 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -1.790 2.891 11.020 1.00 0.00 H new ATOM 0 HH21 ARG A 116 0.908 1.972 8.951 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -0.098 3.297 9.545 1.00 0.00 H new ATOM 1772 N VAL A 117 -1.554 -5.900 8.307 1.00 0.00 N ATOM 1773 CA VAL A 117 -2.219 -6.603 7.214 1.00 0.00 C ATOM 1774 C VAL A 117 -3.753 -6.572 7.384 1.00 0.00 C ATOM 1775 O VAL A 117 -4.308 -7.444 8.065 1.00 0.00 O ATOM 1776 CB VAL A 117 -1.726 -8.089 7.140 1.00 0.00 C ATOM 1777 CG1 VAL A 117 -2.297 -8.814 5.931 1.00 0.00 C ATOM 1778 CG2 VAL A 117 -0.201 -8.184 7.130 1.00 0.00 C ATOM 0 H VAL A 117 -1.853 -6.203 9.234 1.00 0.00 H new ATOM 0 HA VAL A 117 -1.963 -6.092 6.286 1.00 0.00 H new ATOM 0 HB VAL A 117 -2.094 -8.578 8.042 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -1.931 -9.841 5.916 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -3.385 -8.817 5.989 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -1.984 -8.304 5.020 1.00 0.00 H new ATOM 0 HG21 VAL A 117 0.098 -9.231 7.078 1.00 0.00 H new ATOM 0 HG22 VAL A 117 0.191 -7.651 6.264 1.00 0.00 H new ATOM 0 HG23 VAL A 117 0.197 -7.738 8.041 1.00 0.00 H new ATOM 1788 N LEU A 118 -4.448 -5.572 6.800 1.00 0.00 N ATOM 1789 CA LEU A 118 -5.906 -5.551 6.895 1.00 0.00 C ATOM 1790 C LEU A 118 -6.513 -5.859 5.526 1.00 0.00 C ATOM 1791 O LEU A 118 -6.317 -5.104 4.570 1.00 0.00 O ATOM 1792 CB LEU A 118 -6.414 -4.204 7.453 1.00 0.00 C ATOM 1793 CG LEU A 118 -6.303 -3.967 8.985 1.00 0.00 C ATOM 1794 CD1 LEU A 118 -7.032 -5.043 9.788 1.00 0.00 C ATOM 1795 CD2 LEU A 118 -4.846 -3.859 9.433 1.00 0.00 C ATOM 0 H LEU A 118 -4.034 -4.800 6.278 1.00 0.00 H new ATOM 0 HA LEU A 118 -6.225 -6.321 7.598 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -5.868 -3.406 6.950 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -7.462 -4.099 7.173 1.00 0.00 H new ATOM 0 HG LEU A 118 -6.793 -3.015 9.187 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -6.927 -4.836 10.853 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -8.089 -5.043 9.521 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -6.601 -6.019 9.564 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -4.808 -3.693 10.510 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -4.321 -4.782 9.189 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -4.369 -3.024 8.920 1.00 0.00 H new ATOM 1807 N ALA A 119 -7.233 -6.998 5.440 1.00 0.00 N ATOM 1808 CA ALA A 119 -7.864 -7.475 4.188 1.00 0.00 C ATOM 1809 C ALA A 119 -8.765 -6.426 3.536 1.00 0.00 C ATOM 1810 O ALA A 119 -9.810 -6.057 4.086 1.00 0.00 O ATOM 1811 CB ALA A 119 -8.643 -8.757 4.454 1.00 0.00 C ATOM 0 H ALA A 119 -7.394 -7.614 6.237 1.00 0.00 H new ATOM 0 HA ALA A 119 -7.059 -7.674 3.480 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -9.104 -9.101 3.528 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -7.965 -9.524 4.829 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -9.418 -8.564 5.196 1.00 0.00 H new ATOM 1817 N GLY A 120 -8.334 -5.939 2.357 1.00 0.00 N ATOM 1818 CA GLY A 120 -9.084 -4.925 1.643 1.00 0.00 C ATOM 1819 C GLY A 120 -8.655 -3.536 2.059 1.00 0.00 C ATOM 1820 O GLY A 120 -8.905 -2.555 1.356 1.00 0.00 O ATOM 0 H GLY A 120 -7.476 -6.237 1.894 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -8.937 -5.048 0.570 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -10.149 -5.053 1.836 1.00 0.00 H new ATOM 1824 N SER A 121 -8.012 -3.477 3.223 1.00 0.00 N ATOM 1825 CA SER A 121 -7.491 -2.253 3.767 1.00 0.00 C ATOM 1826 C SER A 121 -5.970 -2.253 3.607 1.00 0.00 C ATOM 1827 O SER A 121 -5.417 -3.109 2.907 1.00 0.00 O ATOM 1828 CB SER A 121 -7.953 -2.029 5.218 1.00 0.00 C ATOM 1829 OG SER A 121 -7.759 -0.678 5.592 1.00 0.00 O ATOM 0 H SER A 121 -7.843 -4.293 3.811 1.00 0.00 H new ATOM 0 HA SER A 121 -7.890 -1.403 3.214 1.00 0.00 H new ATOM 0 HB2 SER A 121 -9.006 -2.293 5.316 1.00 0.00 H new ATOM 0 HB3 SER A 121 -7.396 -2.683 5.889 1.00 0.00 H new ATOM 0 HG SER A 121 -7.523 -0.150 4.801 1.00 0.00 H new ATOM 1835 N LYS A 122 -5.301 -1.303 4.247 1.00 0.00 N ATOM 1836 CA LYS A 122 -3.862 -1.125 4.110 1.00 0.00 C ATOM 1837 C LYS A 122 -3.042 -2.237 4.753 1.00 0.00 C ATOM 1838 O LYS A 122 -3.463 -2.888 5.725 1.00 0.00 O ATOM 1839 CB LYS A 122 -3.455 0.233 4.688 1.00 0.00 C ATOM 1840 CG LYS A 122 -4.096 1.414 3.954 1.00 0.00 C ATOM 1841 CD LYS A 122 -3.121 2.135 3.020 1.00 0.00 C ATOM 1842 CE LYS A 122 -3.115 1.534 1.620 1.00 0.00 C ATOM 1843 NZ LYS A 122 -2.164 2.239 0.716 1.00 0.00 N ATOM 0 H LYS A 122 -5.742 -0.633 4.877 1.00 0.00 H new ATOM 0 HA LYS A 122 -3.642 -1.167 3.043 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -3.735 0.272 5.741 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -2.370 0.330 4.643 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -4.948 1.057 3.376 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -4.482 2.124 4.686 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -3.391 3.189 2.960 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -2.116 2.086 3.439 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -2.846 0.479 1.679 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -4.119 1.583 1.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -2.190 1.800 -0.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -2.436 3.240 0.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -1.201 2.170 1.103 1.00 0.00 H new ATOM 1857 N MET A 123 -1.885 -2.467 4.134 1.00 0.00 N ATOM 1858 CA MET A 123 -0.917 -3.439 4.599 1.00 0.00 C ATOM 1859 C MET A 123 0.485 -2.906 4.357 1.00 0.00 C ATOM 1860 O MET A 123 0.901 -2.681 3.215 1.00 0.00 O ATOM 1861 CB MET A 123 -1.102 -4.818 3.943 1.00 0.00 C ATOM 1862 CG MET A 123 -0.144 -5.891 4.482 1.00 0.00 C ATOM 1863 SD MET A 123 1.492 -5.873 3.707 1.00 0.00 S ATOM 1864 CE MET A 123 1.140 -6.520 2.076 1.00 0.00 C ATOM 0 H MET A 123 -1.598 -1.975 3.288 1.00 0.00 H new ATOM 0 HA MET A 123 -1.075 -3.587 5.667 1.00 0.00 H new ATOM 0 HB2 MET A 123 -2.129 -5.149 4.098 1.00 0.00 H new ATOM 0 HB3 MET A 123 -0.957 -4.721 2.867 1.00 0.00 H new ATOM 0 HG2 MET A 123 -0.027 -5.752 5.557 1.00 0.00 H new ATOM 0 HG3 MET A 123 -0.594 -6.873 4.334 1.00 0.00 H new ATOM 0 HE1 MET A 123 2.041 -6.973 1.662 1.00 0.00 H new ATOM 0 HE2 MET A 123 0.354 -7.272 2.145 1.00 0.00 H new ATOM 0 HE3 MET A 123 0.811 -5.709 1.426 1.00 0.00 H new ATOM 1874 N THR A 124 1.186 -2.705 5.456 1.00 0.00 N ATOM 1875 CA THR A 124 2.551 -2.216 5.440 1.00 0.00 C ATOM 1876 C THR A 124 3.432 -3.280 6.056 1.00 0.00 C ATOM 1877 O THR A 124 3.110 -3.796 7.127 1.00 0.00 O ATOM 1878 CB THR A 124 2.657 -0.881 6.201 1.00 0.00 C ATOM 1879 OG1 THR A 124 1.975 -0.981 7.454 1.00 0.00 O ATOM 1880 CG2 THR A 124 2.046 0.255 5.386 1.00 0.00 C ATOM 0 H THR A 124 0.821 -2.878 6.393 1.00 0.00 H new ATOM 0 HA THR A 124 2.876 -2.021 4.418 1.00 0.00 H new ATOM 0 HB THR A 124 3.712 -0.667 6.371 1.00 0.00 H new ATOM 0 HG1 THR A 124 2.115 -1.874 7.833 1.00 0.00 H new ATOM 0 HG21 THR A 124 2.132 1.189 5.942 1.00 0.00 H new ATOM 0 HG22 THR A 124 2.575 0.348 4.438 1.00 0.00 H new ATOM 0 HG23 THR A 124 0.994 0.041 5.195 1.00 0.00 H new ATOM 1888 N VAL A 125 4.496 -3.657 5.340 1.00 0.00 N ATOM 1889 CA VAL A 125 5.396 -4.712 5.801 1.00 0.00 C ATOM 1890 C VAL A 125 6.876 -4.319 5.698 1.00 0.00 C ATOM 1891 O VAL A 125 7.249 -3.445 4.910 1.00 0.00 O ATOM 1892 CB VAL A 125 5.090 -6.039 5.047 1.00 0.00 C ATOM 1893 CG1 VAL A 125 5.566 -6.024 3.592 1.00 0.00 C ATOM 1894 CG2 VAL A 125 5.639 -7.255 5.792 1.00 0.00 C ATOM 0 H VAL A 125 4.752 -3.247 4.442 1.00 0.00 H new ATOM 0 HA VAL A 125 5.210 -4.866 6.864 1.00 0.00 H new ATOM 0 HB VAL A 125 4.004 -6.122 5.020 1.00 0.00 H new ATOM 0 HG11 VAL A 125 5.324 -6.976 3.120 1.00 0.00 H new ATOM 0 HG12 VAL A 125 5.069 -5.216 3.055 1.00 0.00 H new ATOM 0 HG13 VAL A 125 6.645 -5.869 3.564 1.00 0.00 H new ATOM 0 HG21 VAL A 125 5.404 -8.161 5.233 1.00 0.00 H new ATOM 0 HG22 VAL A 125 6.720 -7.161 5.894 1.00 0.00 H new ATOM 0 HG23 VAL A 125 5.185 -7.311 6.781 1.00 0.00 H new ATOM 1904 N ALA A 126 7.704 -4.972 6.513 1.00 0.00 N ATOM 1905 CA ALA A 126 9.135 -4.738 6.483 1.00 0.00 C ATOM 1906 C ALA A 126 9.842 -5.994 5.997 1.00 0.00 C ATOM 1907 O ALA A 126 9.938 -6.995 6.719 1.00 0.00 O ATOM 1908 CB ALA A 126 9.644 -4.297 7.850 1.00 0.00 C ATOM 0 H ALA A 126 7.403 -5.665 7.199 1.00 0.00 H new ATOM 0 HA ALA A 126 9.353 -3.927 5.788 1.00 0.00 H new ATOM 0 HB1 ALA A 126 10.720 -4.128 7.801 1.00 0.00 H new ATOM 0 HB2 ALA A 126 9.145 -3.374 8.144 1.00 0.00 H new ATOM 0 HB3 ALA A 126 9.432 -5.073 8.585 1.00 0.00 H new ATOM 1914 N ARG A 127 10.320 -5.932 4.749 1.00 0.00 N ATOM 1915 CA ARG A 127 11.009 -7.059 4.119 1.00 0.00 C ATOM 1916 C ARG A 127 12.114 -6.596 3.169 1.00 0.00 C ATOM 1917 O ARG A 127 11.935 -5.652 2.382 1.00 0.00 O ATOM 1918 CB ARG A 127 10.006 -7.937 3.352 1.00 0.00 C ATOM 1919 CG ARG A 127 10.358 -9.419 3.347 1.00 0.00 C ATOM 1920 CD ARG A 127 9.330 -10.233 2.578 1.00 0.00 C ATOM 1921 NE ARG A 127 9.658 -11.663 2.566 1.00 0.00 N ATOM 1922 CZ ARG A 127 8.918 -12.611 1.971 1.00 0.00 C ATOM 1923 NH1 ARG A 127 7.793 -12.304 1.328 1.00 0.00 N ATOM 1924 NH2 ARG A 127 9.310 -13.876 2.023 1.00 0.00 N ATOM 0 H ARG A 127 10.240 -5.107 4.154 1.00 0.00 H new ATOM 0 HA ARG A 127 11.472 -7.640 4.917 1.00 0.00 H new ATOM 0 HB2 ARG A 127 9.017 -7.810 3.792 1.00 0.00 H new ATOM 0 HB3 ARG A 127 9.944 -7.585 2.322 1.00 0.00 H new ATOM 0 HG2 ARG A 127 11.342 -9.559 2.900 1.00 0.00 H new ATOM 0 HG3 ARG A 127 10.419 -9.783 4.373 1.00 0.00 H new ATOM 0 HD2 ARG A 127 8.346 -10.090 3.026 1.00 0.00 H new ATOM 0 HD3 ARG A 127 9.270 -9.866 1.553 1.00 0.00 H new ATOM 0 HE ARG A 127 10.509 -11.958 3.044 1.00 0.00 H new ATOM 0 HH11 ARG A 127 7.480 -11.334 1.282 1.00 0.00 H new ATOM 0 HH12 ARG A 127 7.244 -13.039 0.882 1.00 0.00 H new ATOM 0 HH21 ARG A 127 10.169 -14.124 2.513 1.00 0.00 H new ATOM 0 HH22 ARG A 127 8.752 -14.602 1.573 1.00 0.00 H new ATOM 1938 N VAL A 128 13.263 -7.256 3.288 1.00 0.00 N ATOM 1939 CA VAL A 128 14.412 -7.000 2.426 1.00 0.00 C ATOM 1940 C VAL A 128 14.822 -8.305 1.725 1.00 0.00 C ATOM 1941 O VAL A 128 15.451 -9.176 2.337 1.00 0.00 O ATOM 1942 CB VAL A 128 15.614 -6.339 3.191 1.00 0.00 C ATOM 1943 CG1 VAL A 128 15.904 -7.025 4.521 1.00 0.00 C ATOM 1944 CG2 VAL A 128 16.880 -6.294 2.332 1.00 0.00 C ATOM 0 H VAL A 128 13.423 -7.983 3.985 1.00 0.00 H new ATOM 0 HA VAL A 128 14.116 -6.269 1.673 1.00 0.00 H new ATOM 0 HB VAL A 128 15.307 -5.315 3.405 1.00 0.00 H new ATOM 0 HG11 VAL A 128 16.743 -6.530 5.010 1.00 0.00 H new ATOM 0 HG12 VAL A 128 15.024 -6.964 5.161 1.00 0.00 H new ATOM 0 HG13 VAL A 128 16.153 -8.071 4.344 1.00 0.00 H new ATOM 0 HG21 VAL A 128 17.687 -5.830 2.898 1.00 0.00 H new ATOM 0 HG22 VAL A 128 17.168 -7.308 2.055 1.00 0.00 H new ATOM 0 HG23 VAL A 128 16.688 -5.712 1.431 1.00 0.00 H new ATOM 1954 N VAL A 129 14.448 -8.429 0.445 1.00 0.00 N ATOM 1955 CA VAL A 129 14.771 -9.619 -0.353 1.00 0.00 C ATOM 1956 C VAL A 129 16.210 -9.515 -0.870 1.00 0.00 C ATOM 1957 O VAL A 129 16.496 -8.740 -1.784 1.00 0.00 O ATOM 1958 CB VAL A 129 13.775 -9.831 -1.541 1.00 0.00 C ATOM 1959 CG1 VAL A 129 13.955 -11.205 -2.185 1.00 0.00 C ATOM 1960 CG2 VAL A 129 12.326 -9.664 -1.088 1.00 0.00 C ATOM 0 H VAL A 129 13.920 -7.718 -0.061 1.00 0.00 H new ATOM 0 HA VAL A 129 14.674 -10.490 0.296 1.00 0.00 H new ATOM 0 HB VAL A 129 14.002 -9.066 -2.283 1.00 0.00 H new ATOM 0 HG11 VAL A 129 13.247 -11.318 -3.006 1.00 0.00 H new ATOM 0 HG12 VAL A 129 14.972 -11.297 -2.567 1.00 0.00 H new ATOM 0 HG13 VAL A 129 13.775 -11.982 -1.442 1.00 0.00 H new ATOM 0 HG21 VAL A 129 11.659 -9.818 -1.937 1.00 0.00 H new ATOM 0 HG22 VAL A 129 12.101 -10.396 -0.312 1.00 0.00 H new ATOM 0 HG23 VAL A 129 12.182 -8.659 -0.691 1.00 0.00 H new