USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 968 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 93 HIS : no HD1:sc= -0.371 X(o=-0.37,f=-0.43) USER MOD Set 1.2: A 95 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 14 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 27 ASN : amide:sc= -0.476 K(o=-0.64,f=-2.3!) USER MOD Set 2.3: A 76 THR OG1 : rot -1:sc= -0.162! USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot -17:sc= 0.431 USER MOD Single : A 18 ASN : amide:sc= -0.787 K(o=-0.79,f=-6.6!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl 172:sc= -2.35! (180deg=-2.39!) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 56:sc= -2.46 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 0:sc= -0.333 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl 139:sc= -0.761 (180deg=-3.59!) USER MOD Single : A 51 THR OG1 : rot 180:sc=-0.000803 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -0.535 X(o=-0.53,f=-0.29) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 150:sc= 1.93 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 THR OG1 : rot 180:sc= -0.494 USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 GLN : amide:sc= -0.0118 X(o=-0.012,f=0) USER MOD Single : A 98 SER OG : rot -90:sc= -5.16! USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 MET CE :methyl -163:sc= -2.1 (180deg=-2.54) USER MOD Single : A 127 MET CE :methyl -159:sc= -5.48! (180deg=-6.93!) USER MOD Single : A 128 ASN : amide:sc= -0.0505 X(o=-0.051,f=-0.44) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 66 N LEU A 8 -13.497 -10.061 4.527 1.00 0.00 N ATOM 67 CA LEU A 8 -13.487 -8.611 4.436 1.00 0.00 C ATOM 68 C LEU A 8 -13.554 -8.195 2.965 1.00 0.00 C ATOM 69 O LEU A 8 -14.612 -7.802 2.476 1.00 0.00 O ATOM 70 CB LEU A 8 -12.282 -8.035 5.183 1.00 0.00 C ATOM 71 CG LEU A 8 -12.409 -7.961 6.706 1.00 0.00 C ATOM 72 CD1 LEU A 8 -13.793 -7.454 7.116 1.00 0.00 C ATOM 73 CD2 LEU A 8 -12.078 -9.309 7.350 1.00 0.00 C ATOM 0 HA LEU A 8 -14.367 -8.193 4.926 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -11.407 -8.638 4.940 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.092 -7.031 4.805 1.00 0.00 H new ATOM 0 HG LEU A 8 -11.679 -7.240 7.075 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -13.857 -7.411 8.203 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -13.953 -6.458 6.703 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -14.557 -8.132 6.734 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -12.176 -9.229 8.433 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -12.766 -10.068 6.979 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -11.056 -9.591 7.098 1.00 0.00 H new ATOM 85 N GLY A 9 -12.412 -8.297 2.302 1.00 0.00 N ATOM 86 CA GLY A 9 -12.328 -7.936 0.897 1.00 0.00 C ATOM 87 C GLY A 9 -10.931 -8.219 0.341 1.00 0.00 C ATOM 88 O GLY A 9 -10.188 -9.025 0.899 1.00 0.00 O ATOM 0 H GLY A 9 -11.537 -8.624 2.711 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -13.070 -8.497 0.329 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.565 -6.879 0.775 1.00 0.00 H new ATOM 92 N THR A 10 -10.615 -7.541 -0.752 1.00 0.00 N ATOM 93 CA THR A 10 -9.320 -7.709 -1.390 1.00 0.00 C ATOM 94 C THR A 10 -8.560 -6.382 -1.411 1.00 0.00 C ATOM 95 O THR A 10 -9.101 -5.346 -1.027 1.00 0.00 O ATOM 96 CB THR A 10 -9.552 -8.298 -2.783 1.00 0.00 C ATOM 97 OG1 THR A 10 -10.165 -9.559 -2.529 1.00 0.00 O ATOM 98 CG2 THR A 10 -8.245 -8.656 -3.493 1.00 0.00 C ATOM 0 H THR A 10 -11.234 -6.874 -1.213 1.00 0.00 H new ATOM 0 HA THR A 10 -8.690 -8.400 -0.830 1.00 0.00 H new ATOM 0 HB THR A 10 -10.111 -7.585 -3.389 1.00 0.00 H new ATOM 0 HG1 THR A 10 -10.352 -10.009 -3.379 1.00 0.00 H new ATOM 0 HG21 THR A 10 -8.467 -9.070 -4.477 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.635 -7.760 -3.605 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.701 -9.394 -2.903 1.00 0.00 H new ATOM 106 N LEU A 11 -7.317 -6.456 -1.863 1.00 0.00 N ATOM 107 CA LEU A 11 -6.476 -5.273 -1.939 1.00 0.00 C ATOM 108 C LEU A 11 -5.577 -5.370 -3.174 1.00 0.00 C ATOM 109 O LEU A 11 -4.733 -6.260 -3.263 1.00 0.00 O ATOM 110 CB LEU A 11 -5.705 -5.079 -0.632 1.00 0.00 C ATOM 111 CG LEU A 11 -4.809 -3.841 -0.560 1.00 0.00 C ATOM 112 CD1 LEU A 11 -3.373 -4.225 -0.197 1.00 0.00 C ATOM 113 CD2 LEU A 11 -4.876 -3.039 -1.860 1.00 0.00 C ATOM 0 H LEU A 11 -6.872 -7.317 -2.180 1.00 0.00 H new ATOM 0 HA LEU A 11 -7.087 -4.378 -2.058 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.423 -5.032 0.187 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.087 -5.961 -0.463 1.00 0.00 H new ATOM 0 HG LEU A 11 -5.181 -3.196 0.235 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.757 -3.327 -0.152 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -3.363 -4.721 0.774 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.975 -4.901 -0.954 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -4.230 -2.165 -1.782 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.544 -3.663 -2.690 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -5.902 -2.717 -2.036 1.00 0.00 H new ATOM 125 N PHE A 12 -5.790 -4.441 -4.095 1.00 0.00 N ATOM 126 CA PHE A 12 -5.010 -4.411 -5.321 1.00 0.00 C ATOM 127 C PHE A 12 -3.887 -3.375 -5.230 1.00 0.00 C ATOM 128 O PHE A 12 -4.092 -2.276 -4.717 1.00 0.00 O ATOM 129 CB PHE A 12 -5.964 -4.014 -6.448 1.00 0.00 C ATOM 130 CG PHE A 12 -7.244 -4.851 -6.505 1.00 0.00 C ATOM 131 CD1 PHE A 12 -7.180 -6.201 -6.350 1.00 0.00 C ATOM 132 CD2 PHE A 12 -8.444 -4.246 -6.711 1.00 0.00 C ATOM 133 CE1 PHE A 12 -8.367 -6.978 -6.402 1.00 0.00 C ATOM 134 CE2 PHE A 12 -9.631 -5.023 -6.763 1.00 0.00 C ATOM 135 CZ PHE A 12 -9.568 -6.373 -6.608 1.00 0.00 C ATOM 0 H PHE A 12 -6.491 -3.704 -4.017 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.556 -5.386 -5.498 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -6.234 -2.965 -6.329 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.441 -4.103 -7.400 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -6.227 -6.681 -6.187 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.494 -3.174 -6.835 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -8.317 -8.050 -6.278 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -10.584 -4.542 -6.926 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.471 -6.964 -6.648 1.00 0.00 H new ATOM 145 N PHE A 13 -2.726 -3.763 -5.737 1.00 0.00 N ATOM 146 CA PHE A 13 -1.571 -2.882 -5.719 1.00 0.00 C ATOM 147 C PHE A 13 -0.478 -3.392 -6.661 1.00 0.00 C ATOM 148 O PHE A 13 -0.577 -4.498 -7.191 1.00 0.00 O ATOM 149 CB PHE A 13 -1.033 -2.878 -4.287 1.00 0.00 C ATOM 150 CG PHE A 13 -0.458 -4.221 -3.834 1.00 0.00 C ATOM 151 CD1 PHE A 13 -1.257 -5.320 -3.783 1.00 0.00 C ATOM 152 CD2 PHE A 13 0.853 -4.317 -3.484 1.00 0.00 C ATOM 153 CE1 PHE A 13 -0.723 -6.567 -3.363 1.00 0.00 C ATOM 154 CE2 PHE A 13 1.387 -5.564 -3.064 1.00 0.00 C ATOM 155 CZ PHE A 13 0.587 -6.663 -3.012 1.00 0.00 C ATOM 0 H PHE A 13 -2.561 -4.675 -6.163 1.00 0.00 H new ATOM 0 HA PHE A 13 -1.860 -1.884 -6.047 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -0.258 -2.116 -4.203 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -1.837 -2.591 -3.609 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -2.298 -5.245 -4.062 1.00 0.00 H new ATOM 0 HD2 PHE A 13 1.488 -3.444 -3.526 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -1.358 -7.440 -3.322 1.00 0.00 H new ATOM 0 HE2 PHE A 13 2.428 -5.640 -2.786 1.00 0.00 H new ATOM 0 HZ PHE A 13 0.992 -7.612 -2.692 1.00 0.00 H new ATOM 165 N SER A 14 0.540 -2.562 -6.839 1.00 0.00 N ATOM 166 CA SER A 14 1.650 -2.916 -7.707 1.00 0.00 C ATOM 167 C SER A 14 2.962 -2.393 -7.118 1.00 0.00 C ATOM 168 O SER A 14 2.984 -1.344 -6.477 1.00 0.00 O ATOM 169 CB SER A 14 1.444 -2.362 -9.119 1.00 0.00 C ATOM 170 OG SER A 14 0.487 -1.307 -9.143 1.00 0.00 O ATOM 0 H SER A 14 0.619 -1.646 -6.397 1.00 0.00 H new ATOM 0 HA SER A 14 1.697 -4.003 -7.776 1.00 0.00 H new ATOM 0 HB2 SER A 14 2.395 -1.998 -9.508 1.00 0.00 H new ATOM 0 HB3 SER A 14 1.116 -3.165 -9.779 1.00 0.00 H new ATOM 0 HG SER A 14 0.385 -0.979 -10.061 1.00 0.00 H new ATOM 176 N LEU A 15 4.023 -3.150 -7.357 1.00 0.00 N ATOM 177 CA LEU A 15 5.336 -2.776 -6.858 1.00 0.00 C ATOM 178 C LEU A 15 6.231 -2.384 -8.034 1.00 0.00 C ATOM 179 O LEU A 15 6.114 -2.945 -9.123 1.00 0.00 O ATOM 180 CB LEU A 15 5.916 -3.893 -5.988 1.00 0.00 C ATOM 181 CG LEU A 15 5.141 -4.220 -4.710 1.00 0.00 C ATOM 182 CD1 LEU A 15 5.212 -5.715 -4.394 1.00 0.00 C ATOM 183 CD2 LEU A 15 5.627 -3.363 -3.540 1.00 0.00 C ATOM 0 H LEU A 15 4.000 -4.020 -7.889 1.00 0.00 H new ATOM 0 HA LEU A 15 5.263 -1.903 -6.209 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.982 -4.799 -6.591 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.934 -3.619 -5.712 1.00 0.00 H new ATOM 0 HG LEU A 15 4.092 -3.975 -4.874 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.653 -5.921 -3.481 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.781 -6.282 -5.219 1.00 0.00 H new ATOM 0 HD13 LEU A 15 6.253 -6.009 -4.257 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.060 -3.615 -2.644 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.686 -3.553 -3.365 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.482 -2.309 -3.776 1.00 0.00 H new ATOM 195 N GLU A 16 7.106 -1.423 -7.776 1.00 0.00 N ATOM 196 CA GLU A 16 8.021 -0.949 -8.801 1.00 0.00 C ATOM 197 C GLU A 16 9.244 -0.292 -8.157 1.00 0.00 C ATOM 198 O GLU A 16 9.114 0.461 -7.194 1.00 0.00 O ATOM 199 CB GLU A 16 7.320 0.016 -9.758 1.00 0.00 C ATOM 200 CG GLU A 16 8.283 0.512 -10.839 1.00 0.00 C ATOM 201 CD GLU A 16 8.564 -0.584 -11.869 1.00 0.00 C ATOM 202 OE1 GLU A 16 9.080 -1.641 -11.446 1.00 0.00 O ATOM 203 OE2 GLU A 16 8.256 -0.341 -13.055 1.00 0.00 O ATOM 0 H GLU A 16 7.201 -0.960 -6.872 1.00 0.00 H new ATOM 0 HA GLU A 16 8.358 -1.806 -9.385 1.00 0.00 H new ATOM 0 HB2 GLU A 16 6.470 -0.482 -10.224 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.926 0.865 -9.200 1.00 0.00 H new ATOM 0 HG2 GLU A 16 7.858 1.384 -11.337 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.218 0.832 -10.379 1.00 0.00 H new ATOM 210 N TYR A 17 10.405 -0.601 -8.716 1.00 0.00 N ATOM 211 CA TYR A 17 11.650 -0.050 -8.209 1.00 0.00 C ATOM 212 C TYR A 17 12.271 0.920 -9.216 1.00 0.00 C ATOM 213 O TYR A 17 12.560 0.542 -10.351 1.00 0.00 O ATOM 214 CB TYR A 17 12.592 -1.241 -8.020 1.00 0.00 C ATOM 215 CG TYR A 17 13.829 -0.927 -7.175 1.00 0.00 C ATOM 216 CD1 TYR A 17 13.726 -0.852 -5.801 1.00 0.00 C ATOM 217 CD2 TYR A 17 15.048 -0.719 -7.788 1.00 0.00 C ATOM 218 CE1 TYR A 17 14.890 -0.557 -5.007 1.00 0.00 C ATOM 219 CE2 TYR A 17 16.212 -0.424 -6.994 1.00 0.00 C ATOM 220 CZ TYR A 17 16.076 -0.358 -5.642 1.00 0.00 C ATOM 221 OH TYR A 17 17.175 -0.079 -4.892 1.00 0.00 O ATOM 0 H TYR A 17 10.509 -1.226 -9.515 1.00 0.00 H new ATOM 0 HA TYR A 17 11.478 0.499 -7.283 1.00 0.00 H new ATOM 0 HB2 TYR A 17 12.041 -2.056 -7.551 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.914 -1.596 -8.999 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.772 -1.015 -5.321 1.00 0.00 H new ATOM 0 HD2 TYR A 17 15.129 -0.778 -8.863 1.00 0.00 H new ATOM 0 HE1 TYR A 17 14.823 -0.495 -3.931 1.00 0.00 H new ATOM 0 HE2 TYR A 17 17.172 -0.259 -7.461 1.00 0.00 H new ATOM 0 HH TYR A 17 16.896 0.204 -3.996 1.00 0.00 H new ATOM 231 N ASN A 18 12.456 2.152 -8.766 1.00 0.00 N ATOM 232 CA ASN A 18 13.037 3.180 -9.613 1.00 0.00 C ATOM 233 C ASN A 18 14.515 2.864 -9.850 1.00 0.00 C ATOM 234 O ASN A 18 15.391 3.506 -9.272 1.00 0.00 O ATOM 235 CB ASN A 18 12.948 4.556 -8.950 1.00 0.00 C ATOM 236 CG ASN A 18 13.298 5.666 -9.943 1.00 0.00 C ATOM 237 OD1 ASN A 18 13.928 5.446 -10.964 1.00 0.00 O ATOM 238 ND2 ASN A 18 12.855 6.869 -9.587 1.00 0.00 N ATOM 0 H ASN A 18 12.214 2.462 -7.825 1.00 0.00 H new ATOM 0 HA ASN A 18 12.483 3.196 -10.552 1.00 0.00 H new ATOM 0 HB2 ASN A 18 11.941 4.713 -8.563 1.00 0.00 H new ATOM 0 HB3 ASN A 18 13.627 4.598 -8.098 1.00 0.00 H new ATOM 0 HD21 ASN A 18 13.037 7.676 -10.183 1.00 0.00 H new ATOM 0 HD22 ASN A 18 12.333 6.984 -8.718 1.00 0.00 H new ATOM 245 N PHE A 19 14.747 1.875 -10.701 1.00 0.00 N ATOM 246 CA PHE A 19 16.104 1.467 -11.022 1.00 0.00 C ATOM 247 C PHE A 19 16.968 2.675 -11.390 1.00 0.00 C ATOM 248 O PHE A 19 18.096 2.803 -10.917 1.00 0.00 O ATOM 249 CB PHE A 19 16.016 0.531 -12.229 1.00 0.00 C ATOM 250 CG PHE A 19 16.058 -0.956 -11.868 1.00 0.00 C ATOM 251 CD1 PHE A 19 15.075 -1.497 -11.099 1.00 0.00 C ATOM 252 CD2 PHE A 19 17.078 -1.736 -12.316 1.00 0.00 C ATOM 253 CE1 PHE A 19 15.114 -2.876 -10.764 1.00 0.00 C ATOM 254 CE2 PHE A 19 17.117 -3.115 -11.981 1.00 0.00 C ATOM 255 CZ PHE A 19 16.134 -3.656 -11.212 1.00 0.00 C ATOM 0 H PHE A 19 14.018 1.344 -11.178 1.00 0.00 H new ATOM 0 HA PHE A 19 16.559 0.978 -10.160 1.00 0.00 H new ATOM 0 HB2 PHE A 19 15.092 0.737 -12.769 1.00 0.00 H new ATOM 0 HB3 PHE A 19 16.839 0.753 -12.909 1.00 0.00 H new ATOM 0 HD1 PHE A 19 14.265 -0.878 -10.743 1.00 0.00 H new ATOM 0 HD2 PHE A 19 17.858 -1.306 -12.927 1.00 0.00 H new ATOM 0 HE1 PHE A 19 14.334 -3.306 -10.153 1.00 0.00 H new ATOM 0 HE2 PHE A 19 17.927 -3.734 -12.337 1.00 0.00 H new ATOM 0 HZ PHE A 19 16.164 -4.705 -10.957 1.00 0.00 H new ATOM 265 N GLU A 20 16.405 3.530 -12.231 1.00 0.00 N ATOM 266 CA GLU A 20 17.110 4.723 -12.668 1.00 0.00 C ATOM 267 C GLU A 20 17.809 5.391 -11.483 1.00 0.00 C ATOM 268 O GLU A 20 18.999 5.692 -11.548 1.00 0.00 O ATOM 269 CB GLU A 20 16.158 5.698 -13.364 1.00 0.00 C ATOM 270 CG GLU A 20 16.903 6.948 -13.837 1.00 0.00 C ATOM 271 CD GLU A 20 16.300 7.486 -15.137 1.00 0.00 C ATOM 272 OE1 GLU A 20 16.509 6.824 -16.176 1.00 0.00 O ATOM 273 OE2 GLU A 20 15.645 8.548 -15.061 1.00 0.00 O ATOM 0 H GLU A 20 15.469 3.420 -12.621 1.00 0.00 H new ATOM 0 HA GLU A 20 17.869 4.428 -13.392 1.00 0.00 H new ATOM 0 HB2 GLU A 20 15.687 5.207 -14.216 1.00 0.00 H new ATOM 0 HB3 GLU A 20 15.359 5.983 -12.679 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.858 7.717 -13.065 1.00 0.00 H new ATOM 0 HG3 GLU A 20 17.956 6.712 -13.991 1.00 0.00 H new ATOM 280 N ARG A 21 17.038 5.604 -10.426 1.00 0.00 N ATOM 281 CA ARG A 21 17.568 6.231 -9.227 1.00 0.00 C ATOM 282 C ARG A 21 17.603 5.227 -8.074 1.00 0.00 C ATOM 283 O ARG A 21 17.557 5.614 -6.907 1.00 0.00 O ATOM 284 CB ARG A 21 16.723 7.439 -8.817 1.00 0.00 C ATOM 285 CG ARG A 21 16.411 8.325 -10.025 1.00 0.00 C ATOM 286 CD ARG A 21 15.265 9.290 -9.716 1.00 0.00 C ATOM 287 NE ARG A 21 15.806 10.589 -9.257 1.00 0.00 N ATOM 288 CZ ARG A 21 15.069 11.697 -9.099 1.00 0.00 C ATOM 289 NH1 ARG A 21 13.755 11.670 -9.361 1.00 0.00 N ATOM 290 NH2 ARG A 21 15.645 12.831 -8.679 1.00 0.00 N ATOM 0 H ARG A 21 16.051 5.353 -10.375 1.00 0.00 H new ATOM 0 HA ARG A 21 18.580 6.569 -9.450 1.00 0.00 H new ATOM 0 HB2 ARG A 21 15.793 7.099 -8.361 1.00 0.00 H new ATOM 0 HB3 ARG A 21 17.254 8.020 -8.063 1.00 0.00 H new ATOM 0 HG2 ARG A 21 17.300 8.889 -10.306 1.00 0.00 H new ATOM 0 HG3 ARG A 21 16.146 7.702 -10.879 1.00 0.00 H new ATOM 0 HD2 ARG A 21 14.652 9.436 -10.605 1.00 0.00 H new ATOM 0 HD3 ARG A 21 14.618 8.865 -8.949 1.00 0.00 H new ATOM 0 HE ARG A 21 16.803 10.644 -9.048 1.00 0.00 H new ATOM 0 HH11 ARG A 21 13.316 10.806 -9.680 1.00 0.00 H new ATOM 0 HH12 ARG A 21 13.194 12.513 -9.241 1.00 0.00 H new ATOM 0 HH21 ARG A 21 16.645 12.851 -8.479 1.00 0.00 H new ATOM 0 HH22 ARG A 21 15.084 13.674 -8.559 1.00 0.00 H new ATOM 304 N LYS A 22 17.685 3.956 -8.440 1.00 0.00 N ATOM 305 CA LYS A 22 17.726 2.893 -7.450 1.00 0.00 C ATOM 306 C LYS A 22 16.836 3.271 -6.265 1.00 0.00 C ATOM 307 O LYS A 22 17.331 3.506 -5.163 1.00 0.00 O ATOM 308 CB LYS A 22 19.172 2.581 -7.059 1.00 0.00 C ATOM 309 CG LYS A 22 19.688 1.349 -7.804 1.00 0.00 C ATOM 310 CD LYS A 22 20.492 1.753 -9.042 1.00 0.00 C ATOM 311 CE LYS A 22 20.625 0.580 -10.016 1.00 0.00 C ATOM 312 NZ LYS A 22 22.002 0.039 -9.990 1.00 0.00 N ATOM 0 H LYS A 22 17.724 3.638 -9.409 1.00 0.00 H new ATOM 0 HA LYS A 22 17.326 1.968 -7.867 1.00 0.00 H new ATOM 0 HB2 LYS A 22 19.806 3.438 -7.284 1.00 0.00 H new ATOM 0 HB3 LYS A 22 19.233 2.412 -5.984 1.00 0.00 H new ATOM 0 HG2 LYS A 22 20.313 0.753 -7.139 1.00 0.00 H new ATOM 0 HG3 LYS A 22 18.848 0.721 -8.101 1.00 0.00 H new ATOM 0 HD2 LYS A 22 20.003 2.590 -9.540 1.00 0.00 H new ATOM 0 HD3 LYS A 22 21.482 2.095 -8.741 1.00 0.00 H new ATOM 0 HE2 LYS A 22 19.915 -0.203 -9.750 1.00 0.00 H new ATOM 0 HE3 LYS A 22 20.376 0.907 -11.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 22.075 -0.756 -10.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 22.673 0.784 -10.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 22.227 -0.292 -9.030 1.00 0.00 H new ATOM 326 N ALA A 23 15.539 3.317 -6.530 1.00 0.00 N ATOM 327 CA ALA A 23 14.576 3.663 -5.499 1.00 0.00 C ATOM 328 C ALA A 23 13.436 2.642 -5.510 1.00 0.00 C ATOM 329 O ALA A 23 13.312 1.855 -6.447 1.00 0.00 O ATOM 330 CB ALA A 23 14.080 5.093 -5.721 1.00 0.00 C ATOM 0 H ALA A 23 15.132 3.120 -7.444 1.00 0.00 H new ATOM 0 HA ALA A 23 15.040 3.629 -4.513 1.00 0.00 H new ATOM 0 HB1 ALA A 23 13.357 5.352 -4.947 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.923 5.782 -5.675 1.00 0.00 H new ATOM 0 HB3 ALA A 23 13.605 5.166 -6.699 1.00 0.00 H new ATOM 336 N PHE A 24 12.632 2.690 -4.458 1.00 0.00 N ATOM 337 CA PHE A 24 11.506 1.779 -4.335 1.00 0.00 C ATOM 338 C PHE A 24 10.178 2.532 -4.438 1.00 0.00 C ATOM 339 O PHE A 24 10.011 3.589 -3.831 1.00 0.00 O ATOM 340 CB PHE A 24 11.605 1.130 -2.953 1.00 0.00 C ATOM 341 CG PHE A 24 10.528 0.077 -2.682 1.00 0.00 C ATOM 342 CD1 PHE A 24 9.950 -0.586 -3.718 1.00 0.00 C ATOM 343 CD2 PHE A 24 10.150 -0.195 -1.404 1.00 0.00 C ATOM 344 CE1 PHE A 24 8.951 -1.564 -3.466 1.00 0.00 C ATOM 345 CE2 PHE A 24 9.151 -1.172 -1.152 1.00 0.00 C ATOM 346 CZ PHE A 24 8.572 -1.836 -2.189 1.00 0.00 C ATOM 0 H PHE A 24 12.738 3.345 -3.683 1.00 0.00 H new ATOM 0 HA PHE A 24 11.536 1.039 -5.135 1.00 0.00 H new ATOM 0 HB2 PHE A 24 12.586 0.666 -2.850 1.00 0.00 H new ATOM 0 HB3 PHE A 24 11.538 1.908 -2.192 1.00 0.00 H new ATOM 0 HD1 PHE A 24 10.250 -0.369 -4.733 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.610 0.332 -0.581 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.492 -2.092 -4.289 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.851 -1.388 -0.137 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.812 -2.579 -1.998 1.00 0.00 H new ATOM 356 N VAL A 25 9.267 1.959 -5.211 1.00 0.00 N ATOM 357 CA VAL A 25 7.960 2.562 -5.401 1.00 0.00 C ATOM 358 C VAL A 25 6.875 1.528 -5.092 1.00 0.00 C ATOM 359 O VAL A 25 6.835 0.464 -5.707 1.00 0.00 O ATOM 360 CB VAL A 25 7.850 3.139 -6.814 1.00 0.00 C ATOM 361 CG1 VAL A 25 6.556 3.938 -6.981 1.00 0.00 C ATOM 362 CG2 VAL A 25 9.071 3.997 -7.152 1.00 0.00 C ATOM 0 H VAL A 25 9.409 1.083 -5.713 1.00 0.00 H new ATOM 0 HA VAL A 25 7.821 3.395 -4.712 1.00 0.00 H new ATOM 0 HB VAL A 25 7.822 2.305 -7.515 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.503 4.337 -7.994 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.701 3.287 -6.802 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.541 4.760 -6.266 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.968 4.395 -8.161 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.144 4.821 -6.443 1.00 0.00 H new ATOM 0 HG23 VAL A 25 9.972 3.387 -7.093 1.00 0.00 H new ATOM 372 N VAL A 26 6.024 1.877 -4.139 1.00 0.00 N ATOM 373 CA VAL A 26 4.942 0.993 -3.741 1.00 0.00 C ATOM 374 C VAL A 26 3.601 1.660 -4.055 1.00 0.00 C ATOM 375 O VAL A 26 3.093 2.446 -3.257 1.00 0.00 O ATOM 376 CB VAL A 26 5.091 0.615 -2.266 1.00 0.00 C ATOM 377 CG1 VAL A 26 3.891 -0.204 -1.786 1.00 0.00 C ATOM 378 CG2 VAL A 26 6.401 -0.137 -2.023 1.00 0.00 C ATOM 0 H VAL A 26 6.062 2.760 -3.630 1.00 0.00 H new ATOM 0 HA VAL A 26 4.982 0.062 -4.307 1.00 0.00 H new ATOM 0 HB VAL A 26 5.121 1.537 -1.685 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.022 -0.460 -0.735 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.979 0.381 -1.906 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.815 -1.118 -2.375 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.482 -0.394 -0.967 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.413 -1.049 -2.620 1.00 0.00 H new ATOM 0 HG23 VAL A 26 7.242 0.495 -2.308 1.00 0.00 H new ATOM 388 N ASN A 27 3.067 1.322 -5.219 1.00 0.00 N ATOM 389 CA ASN A 27 1.795 1.879 -5.648 1.00 0.00 C ATOM 390 C ASN A 27 0.657 1.156 -4.925 1.00 0.00 C ATOM 391 O ASN A 27 0.709 -0.058 -4.736 1.00 0.00 O ATOM 392 CB ASN A 27 1.592 1.694 -7.153 1.00 0.00 C ATOM 393 CG ASN A 27 0.121 1.871 -7.534 1.00 0.00 C ATOM 394 OD1 ASN A 27 -0.712 1.006 -7.317 1.00 0.00 O ATOM 395 ND2 ASN A 27 -0.151 3.037 -8.113 1.00 0.00 N ATOM 0 H ASN A 27 3.491 0.670 -5.878 1.00 0.00 H new ATOM 0 HA ASN A 27 1.796 2.943 -5.413 1.00 0.00 H new ATOM 0 HB2 ASN A 27 2.202 2.415 -7.697 1.00 0.00 H new ATOM 0 HB3 ASN A 27 1.931 0.702 -7.450 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.105 3.251 -8.405 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.594 3.717 -8.265 1.00 0.00 H new ATOM 402 N ILE A 28 -0.345 1.933 -4.540 1.00 0.00 N ATOM 403 CA ILE A 28 -1.494 1.382 -3.843 1.00 0.00 C ATOM 404 C ILE A 28 -2.753 1.607 -4.683 1.00 0.00 C ATOM 405 O ILE A 28 -3.316 2.701 -4.682 1.00 0.00 O ATOM 406 CB ILE A 28 -1.588 1.956 -2.428 1.00 0.00 C ATOM 407 CG1 ILE A 28 -0.294 1.712 -1.649 1.00 0.00 C ATOM 408 CG2 ILE A 28 -2.812 1.406 -1.692 1.00 0.00 C ATOM 409 CD1 ILE A 28 -0.503 1.943 -0.151 1.00 0.00 C ATOM 0 H ILE A 28 -0.385 2.940 -4.698 1.00 0.00 H new ATOM 0 HA ILE A 28 -1.383 0.305 -3.719 1.00 0.00 H new ATOM 0 HB ILE A 28 -1.718 3.035 -2.507 1.00 0.00 H new ATOM 0 HG12 ILE A 28 0.050 0.692 -1.819 1.00 0.00 H new ATOM 0 HG13 ILE A 28 0.487 2.377 -2.017 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.854 1.830 -0.689 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -3.716 1.675 -2.238 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.738 0.321 -1.624 1.00 0.00 H new ATOM 0 HD11 ILE A 28 0.432 1.763 0.379 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -0.823 2.971 0.017 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.267 1.260 0.219 1.00 0.00 H new ATOM 421 N LYS A 29 -3.157 0.555 -5.380 1.00 0.00 N ATOM 422 CA LYS A 29 -4.338 0.625 -6.223 1.00 0.00 C ATOM 423 C LYS A 29 -5.561 0.933 -5.355 1.00 0.00 C ATOM 424 O LYS A 29 -5.495 1.773 -4.459 1.00 0.00 O ATOM 425 CB LYS A 29 -4.480 -0.652 -7.054 1.00 0.00 C ATOM 426 CG LYS A 29 -5.195 -0.369 -8.376 1.00 0.00 C ATOM 427 CD LYS A 29 -4.529 -1.119 -9.531 1.00 0.00 C ATOM 428 CE LYS A 29 -3.095 -0.630 -9.748 1.00 0.00 C ATOM 429 NZ LYS A 29 -3.037 0.320 -10.881 1.00 0.00 N ATOM 0 H LYS A 29 -2.687 -0.350 -5.378 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.244 1.438 -6.943 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.494 -1.073 -7.252 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -5.037 -1.399 -6.488 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.241 -0.667 -8.299 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.183 0.702 -8.578 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -4.524 -2.188 -9.320 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -5.108 -0.976 -10.444 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -2.728 -0.147 -8.842 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -2.441 -1.479 -9.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -2.057 0.642 -11.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -3.367 -0.152 -11.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -3.646 1.139 -10.679 1.00 0.00 H new ATOM 443 N GLU A 30 -6.648 0.237 -5.653 1.00 0.00 N ATOM 444 CA GLU A 30 -7.884 0.426 -4.912 1.00 0.00 C ATOM 445 C GLU A 30 -8.222 -0.836 -4.115 1.00 0.00 C ATOM 446 O GLU A 30 -7.531 -1.848 -4.224 1.00 0.00 O ATOM 447 CB GLU A 30 -9.032 0.807 -5.848 1.00 0.00 C ATOM 448 CG GLU A 30 -9.427 -0.372 -6.740 1.00 0.00 C ATOM 449 CD GLU A 30 -10.922 -0.672 -6.622 1.00 0.00 C ATOM 450 OE1 GLU A 30 -11.298 -1.298 -5.608 1.00 0.00 O ATOM 451 OE2 GLU A 30 -11.657 -0.267 -7.550 1.00 0.00 O ATOM 0 H GLU A 30 -6.699 -0.459 -6.397 1.00 0.00 H new ATOM 0 HA GLU A 30 -7.743 1.249 -4.211 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -9.893 1.128 -5.261 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -8.735 1.653 -6.468 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -9.178 -0.147 -7.777 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -8.852 -1.254 -6.458 1.00 0.00 H new ATOM 458 N ALA A 31 -9.285 -0.734 -3.331 1.00 0.00 N ATOM 459 CA ALA A 31 -9.724 -1.854 -2.516 1.00 0.00 C ATOM 460 C ALA A 31 -11.214 -2.104 -2.759 1.00 0.00 C ATOM 461 O ALA A 31 -12.016 -1.172 -2.725 1.00 0.00 O ATOM 462 CB ALA A 31 -9.413 -1.568 -1.045 1.00 0.00 C ATOM 0 H ALA A 31 -9.855 0.107 -3.243 1.00 0.00 H new ATOM 0 HA ALA A 31 -9.188 -2.762 -2.792 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -9.742 -2.408 -0.433 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -8.339 -1.428 -0.921 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -9.936 -0.664 -0.732 1.00 0.00 H new ATOM 468 N ARG A 32 -11.538 -3.366 -2.998 1.00 0.00 N ATOM 469 CA ARG A 32 -12.917 -3.750 -3.247 1.00 0.00 C ATOM 470 C ARG A 32 -13.371 -4.791 -2.222 1.00 0.00 C ATOM 471 O ARG A 32 -12.620 -5.705 -1.885 1.00 0.00 O ATOM 472 CB ARG A 32 -13.084 -4.324 -4.655 1.00 0.00 C ATOM 473 CG ARG A 32 -13.707 -3.293 -5.598 1.00 0.00 C ATOM 474 CD ARG A 32 -14.795 -3.929 -6.464 1.00 0.00 C ATOM 475 NE ARG A 32 -14.858 -3.250 -7.778 1.00 0.00 N ATOM 476 CZ ARG A 32 -15.911 -3.308 -8.605 1.00 0.00 C ATOM 477 NH1 ARG A 32 -16.996 -4.014 -8.259 1.00 0.00 N ATOM 478 NH2 ARG A 32 -15.879 -2.660 -9.777 1.00 0.00 N ATOM 0 H ARG A 32 -10.869 -4.136 -3.025 1.00 0.00 H new ATOM 0 HA ARG A 32 -13.532 -2.854 -3.157 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -12.114 -4.636 -5.042 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -13.713 -5.213 -4.617 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -14.132 -2.474 -5.018 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -12.934 -2.864 -6.236 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -14.587 -4.990 -6.603 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.760 -3.857 -5.962 1.00 0.00 H new ATOM 0 HE ARG A 32 -14.049 -2.703 -8.073 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -17.020 -4.507 -7.366 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -17.798 -4.058 -8.888 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -15.053 -2.122 -10.040 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -16.681 -2.704 -10.406 1.00 0.00 H new ATOM 492 N GLY A 33 -14.599 -4.618 -1.754 1.00 0.00 N ATOM 493 CA GLY A 33 -15.162 -5.531 -0.775 1.00 0.00 C ATOM 494 C GLY A 33 -14.884 -5.047 0.650 1.00 0.00 C ATOM 495 O GLY A 33 -14.219 -5.734 1.424 1.00 0.00 O ATOM 0 H GLY A 33 -15.219 -3.859 -2.035 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.237 -5.618 -0.930 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -14.738 -6.526 -0.914 1.00 0.00 H new ATOM 499 N LEU A 34 -15.406 -3.868 0.953 1.00 0.00 N ATOM 500 CA LEU A 34 -15.222 -3.284 2.271 1.00 0.00 C ATOM 501 C LEU A 34 -16.579 -3.170 2.967 1.00 0.00 C ATOM 502 O LEU A 34 -17.504 -2.558 2.436 1.00 0.00 O ATOM 503 CB LEU A 34 -14.470 -1.956 2.168 1.00 0.00 C ATOM 504 CG LEU A 34 -13.192 -1.972 1.327 1.00 0.00 C ATOM 505 CD1 LEU A 34 -12.297 -0.779 1.667 1.00 0.00 C ATOM 506 CD2 LEU A 34 -12.453 -3.304 1.477 1.00 0.00 C ATOM 0 H LEU A 34 -15.957 -3.301 0.308 1.00 0.00 H new ATOM 0 HA LEU A 34 -14.599 -3.929 2.890 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.146 -1.210 1.751 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.214 -1.627 3.175 1.00 0.00 H new ATOM 0 HG LEU A 34 -13.472 -1.876 0.278 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.396 -0.814 1.055 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -12.835 0.148 1.467 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -12.022 -0.819 2.721 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -11.548 -3.289 0.869 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -12.185 -3.456 2.523 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.099 -4.118 1.146 1.00 0.00 H new ATOM 518 N PRO A 35 -16.657 -3.785 4.178 1.00 0.00 N ATOM 519 CA PRO A 35 -17.886 -3.759 4.953 1.00 0.00 C ATOM 520 C PRO A 35 -18.098 -2.387 5.597 1.00 0.00 C ATOM 521 O PRO A 35 -17.180 -1.829 6.195 1.00 0.00 O ATOM 522 CB PRO A 35 -17.733 -4.876 5.972 1.00 0.00 C ATOM 523 CG PRO A 35 -16.245 -5.181 6.035 1.00 0.00 C ATOM 524 CD PRO A 35 -15.582 -4.519 4.838 1.00 0.00 C ATOM 0 HA PRO A 35 -18.773 -3.917 4.340 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -18.111 -4.569 6.947 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -18.300 -5.758 5.673 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -15.817 -4.805 6.964 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -16.075 -6.258 6.018 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -14.779 -3.851 5.149 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -15.140 -5.259 4.171 1.00 0.00 H new ATOM 532 N ALA A 36 -19.315 -1.883 5.453 1.00 0.00 N ATOM 533 CA ALA A 36 -19.660 -0.588 6.014 1.00 0.00 C ATOM 534 C ALA A 36 -19.659 -0.681 7.541 1.00 0.00 C ATOM 535 O ALA A 36 -20.095 -1.683 8.105 1.00 0.00 O ATOM 536 CB ALA A 36 -21.011 -0.134 5.458 1.00 0.00 C ATOM 0 H ALA A 36 -20.074 -2.348 4.956 1.00 0.00 H new ATOM 0 HA ALA A 36 -18.922 0.162 5.730 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -21.270 0.838 5.879 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -20.950 -0.055 4.373 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -21.778 -0.861 5.726 1.00 0.00 H new ATOM 542 N MET A 37 -19.165 0.377 8.167 1.00 0.00 N ATOM 543 CA MET A 37 -19.102 0.427 9.617 1.00 0.00 C ATOM 544 C MET A 37 -20.354 1.088 10.198 1.00 0.00 C ATOM 545 O MET A 37 -20.872 0.651 11.224 1.00 0.00 O ATOM 546 CB MET A 37 -17.862 1.213 10.048 1.00 0.00 C ATOM 547 CG MET A 37 -16.592 0.382 9.857 1.00 0.00 C ATOM 548 SD MET A 37 -16.396 -0.755 11.219 1.00 0.00 S ATOM 549 CE MET A 37 -15.034 -1.735 10.611 1.00 0.00 C ATOM 0 H MET A 37 -18.804 1.207 7.696 1.00 0.00 H new ATOM 0 HA MET A 37 -19.045 -0.594 9.995 1.00 0.00 H new ATOM 0 HB2 MET A 37 -17.790 2.132 9.467 1.00 0.00 H new ATOM 0 HB3 MET A 37 -17.957 1.504 11.094 1.00 0.00 H new ATOM 0 HG2 MET A 37 -16.646 -0.169 8.918 1.00 0.00 H new ATOM 0 HG3 MET A 37 -15.724 1.038 9.793 1.00 0.00 H new ATOM 0 HE1 MET A 37 -14.687 -2.404 11.398 1.00 0.00 H new ATOM 0 HE2 MET A 37 -15.363 -2.323 9.754 1.00 0.00 H new ATOM 0 HE3 MET A 37 -14.219 -1.077 10.309 1.00 0.00 H new ATOM 614 N MET A 42 -25.185 3.177 4.259 1.00 0.00 N ATOM 615 CA MET A 42 -24.385 2.035 3.851 1.00 0.00 C ATOM 616 C MET A 42 -23.125 2.486 3.109 1.00 0.00 C ATOM 617 O MET A 42 -23.006 2.284 1.901 1.00 0.00 O ATOM 618 CB MET A 42 -25.216 1.128 2.942 1.00 0.00 C ATOM 619 CG MET A 42 -24.439 -0.136 2.570 1.00 0.00 C ATOM 620 SD MET A 42 -25.468 -1.576 2.802 1.00 0.00 S ATOM 621 CE MET A 42 -24.521 -2.436 4.048 1.00 0.00 C ATOM 0 HA MET A 42 -24.082 1.489 4.745 1.00 0.00 H new ATOM 0 HB2 MET A 42 -26.143 0.854 3.445 1.00 0.00 H new ATOM 0 HB3 MET A 42 -25.492 1.669 2.037 1.00 0.00 H new ATOM 0 HG2 MET A 42 -24.109 -0.078 1.533 1.00 0.00 H new ATOM 0 HG3 MET A 42 -23.543 -0.216 3.185 1.00 0.00 H new ATOM 0 HE1 MET A 42 -25.025 -3.366 4.311 1.00 0.00 H new ATOM 0 HE2 MET A 42 -23.527 -2.660 3.660 1.00 0.00 H new ATOM 0 HE3 MET A 42 -24.431 -1.808 4.935 1.00 0.00 H new ATOM 631 N THR A 43 -22.216 3.087 3.863 1.00 0.00 N ATOM 632 CA THR A 43 -20.969 3.567 3.292 1.00 0.00 C ATOM 633 C THR A 43 -19.986 3.946 4.401 1.00 0.00 C ATOM 634 O THR A 43 -20.356 3.997 5.573 1.00 0.00 O ATOM 635 CB THR A 43 -21.297 4.726 2.348 1.00 0.00 C ATOM 636 OG1 THR A 43 -20.039 5.077 1.779 1.00 0.00 O ATOM 637 CG2 THR A 43 -21.731 5.987 3.098 1.00 0.00 C ATOM 0 H THR A 43 -22.318 3.252 4.864 1.00 0.00 H new ATOM 0 HA THR A 43 -20.473 2.788 2.713 1.00 0.00 H new ATOM 0 HB THR A 43 -22.087 4.422 1.661 1.00 0.00 H new ATOM 0 HG1 THR A 43 -19.639 4.288 1.357 1.00 0.00 H new ATOM 0 HG21 THR A 43 -21.952 6.778 2.382 1.00 0.00 H new ATOM 0 HG22 THR A 43 -22.623 5.771 3.687 1.00 0.00 H new ATOM 0 HG23 THR A 43 -20.928 6.311 3.760 1.00 0.00 H new ATOM 645 N SER A 44 -18.752 4.202 3.991 1.00 0.00 N ATOM 646 CA SER A 44 -17.713 4.575 4.936 1.00 0.00 C ATOM 647 C SER A 44 -16.511 5.156 4.189 1.00 0.00 C ATOM 648 O SER A 44 -16.500 5.198 2.959 1.00 0.00 O ATOM 649 CB SER A 44 -17.282 3.376 5.783 1.00 0.00 C ATOM 650 OG SER A 44 -17.330 2.157 5.046 1.00 0.00 O ATOM 0 H SER A 44 -18.449 4.158 3.018 1.00 0.00 H new ATOM 0 HA SER A 44 -18.117 5.333 5.607 1.00 0.00 H new ATOM 0 HB2 SER A 44 -16.269 3.538 6.151 1.00 0.00 H new ATOM 0 HB3 SER A 44 -17.930 3.297 6.656 1.00 0.00 H new ATOM 0 HG SER A 44 -17.046 1.416 5.621 1.00 0.00 H new ATOM 656 N ASP A 45 -15.527 5.591 4.962 1.00 0.00 N ATOM 657 CA ASP A 45 -14.323 6.168 4.389 1.00 0.00 C ATOM 658 C ASP A 45 -13.107 5.359 4.846 1.00 0.00 C ATOM 659 O ASP A 45 -12.313 5.831 5.658 1.00 0.00 O ATOM 660 CB ASP A 45 -14.130 7.613 4.852 1.00 0.00 C ATOM 661 CG ASP A 45 -15.242 8.579 4.438 1.00 0.00 C ATOM 662 OD1 ASP A 45 -16.130 8.131 3.680 1.00 0.00 O ATOM 663 OD2 ASP A 45 -15.180 9.743 4.888 1.00 0.00 O ATOM 0 H ASP A 45 -15.539 5.555 5.981 1.00 0.00 H new ATOM 0 HA ASP A 45 -14.423 6.147 3.304 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -14.047 7.622 5.939 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -13.183 7.982 4.457 1.00 0.00 H new ATOM 668 N PRO A 46 -12.998 4.123 4.290 1.00 0.00 N ATOM 669 CA PRO A 46 -11.892 3.244 4.632 1.00 0.00 C ATOM 670 C PRO A 46 -10.599 3.701 3.955 1.00 0.00 C ATOM 671 O PRO A 46 -10.632 4.272 2.866 1.00 0.00 O ATOM 672 CB PRO A 46 -12.338 1.860 4.188 1.00 0.00 C ATOM 673 CG PRO A 46 -13.471 2.084 3.199 1.00 0.00 C ATOM 674 CD PRO A 46 -13.920 3.531 3.325 1.00 0.00 C ATOM 0 HA PRO A 46 -11.663 3.251 5.698 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -11.516 1.315 3.723 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -12.674 1.266 5.038 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -13.137 1.875 2.183 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -14.300 1.407 3.408 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -13.872 4.045 2.365 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -14.951 3.597 3.671 1.00 0.00 H new ATOM 682 N TYR A 47 -9.489 3.432 4.628 1.00 0.00 N ATOM 683 CA TYR A 47 -8.187 3.809 4.105 1.00 0.00 C ATOM 684 C TYR A 47 -7.143 2.732 4.407 1.00 0.00 C ATOM 685 O TYR A 47 -7.113 2.183 5.507 1.00 0.00 O ATOM 686 CB TYR A 47 -7.798 5.098 4.830 1.00 0.00 C ATOM 687 CG TYR A 47 -7.556 4.920 6.331 1.00 0.00 C ATOM 688 CD1 TYR A 47 -8.619 4.956 7.210 1.00 0.00 C ATOM 689 CD2 TYR A 47 -6.275 4.722 6.804 1.00 0.00 C ATOM 690 CE1 TYR A 47 -8.392 4.787 8.622 1.00 0.00 C ATOM 691 CE2 TYR A 47 -6.048 4.554 8.216 1.00 0.00 C ATOM 692 CZ TYR A 47 -7.117 4.595 9.055 1.00 0.00 C ATOM 693 OH TYR A 47 -6.902 4.436 10.389 1.00 0.00 O ATOM 0 H TYR A 47 -9.465 2.958 5.531 1.00 0.00 H new ATOM 0 HA TYR A 47 -8.230 3.935 3.023 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -6.895 5.502 4.372 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -8.586 5.836 4.685 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -9.621 5.111 6.839 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -5.443 4.693 6.116 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -9.215 4.812 9.321 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -5.051 4.399 8.600 1.00 0.00 H new ATOM 0 HH TYR A 47 -7.756 4.489 10.867 1.00 0.00 H new ATOM 703 N ILE A 48 -6.311 2.463 3.411 1.00 0.00 N ATOM 704 CA ILE A 48 -5.268 1.463 3.557 1.00 0.00 C ATOM 705 C ILE A 48 -3.981 2.139 4.034 1.00 0.00 C ATOM 706 O ILE A 48 -3.686 3.267 3.640 1.00 0.00 O ATOM 707 CB ILE A 48 -5.101 0.669 2.260 1.00 0.00 C ATOM 708 CG1 ILE A 48 -6.436 0.077 1.804 1.00 0.00 C ATOM 709 CG2 ILE A 48 -4.019 -0.402 2.407 1.00 0.00 C ATOM 710 CD1 ILE A 48 -6.244 -0.845 0.598 1.00 0.00 C ATOM 0 H ILE A 48 -6.339 2.921 2.500 1.00 0.00 H new ATOM 0 HA ILE A 48 -5.545 0.733 4.317 1.00 0.00 H new ATOM 0 HB ILE A 48 -4.770 1.355 1.480 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -6.890 -0.480 2.624 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -7.125 0.881 1.545 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -3.921 -0.951 1.471 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -3.068 0.072 2.651 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -4.295 -1.091 3.205 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -7.208 -1.252 0.294 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -5.813 -0.279 -0.228 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -5.574 -1.661 0.867 1.00 0.00 H new ATOM 722 N LYS A 49 -3.250 1.423 4.875 1.00 0.00 N ATOM 723 CA LYS A 49 -2.002 1.940 5.409 1.00 0.00 C ATOM 724 C LYS A 49 -0.828 1.227 4.733 1.00 0.00 C ATOM 725 O LYS A 49 -0.997 0.150 4.163 1.00 0.00 O ATOM 726 CB LYS A 49 -1.988 1.835 6.935 1.00 0.00 C ATOM 727 CG LYS A 49 -2.746 3.001 7.572 1.00 0.00 C ATOM 728 CD LYS A 49 -3.213 2.646 8.985 1.00 0.00 C ATOM 729 CE LYS A 49 -3.119 3.858 9.914 1.00 0.00 C ATOM 730 NZ LYS A 49 -1.826 3.861 10.634 1.00 0.00 N ATOM 0 H LYS A 49 -3.498 0.489 5.200 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.903 3.002 5.184 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.440 0.892 7.242 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -0.959 1.827 7.293 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.103 3.881 7.608 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -3.607 3.260 6.955 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -4.242 2.287 8.952 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -2.604 1.833 9.380 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.222 4.776 9.335 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -3.941 3.839 10.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -1.779 4.690 11.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.743 2.994 11.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.046 3.901 9.947 1.00 0.00 H new ATOM 744 N MET A 50 0.334 1.858 4.818 1.00 0.00 N ATOM 745 CA MET A 50 1.535 1.297 4.222 1.00 0.00 C ATOM 746 C MET A 50 2.726 1.416 5.174 1.00 0.00 C ATOM 747 O MET A 50 2.998 2.493 5.703 1.00 0.00 O ATOM 748 CB MET A 50 1.848 2.033 2.918 1.00 0.00 C ATOM 749 CG MET A 50 2.652 1.144 1.967 1.00 0.00 C ATOM 750 SD MET A 50 3.531 2.153 0.785 1.00 0.00 S ATOM 751 CE MET A 50 5.184 2.038 1.448 1.00 0.00 C ATOM 0 H MET A 50 0.469 2.752 5.290 1.00 0.00 H new ATOM 0 HA MET A 50 1.359 0.240 4.021 1.00 0.00 H new ATOM 0 HB2 MET A 50 0.919 2.340 2.437 1.00 0.00 H new ATOM 0 HB3 MET A 50 2.410 2.942 3.135 1.00 0.00 H new ATOM 0 HG2 MET A 50 3.357 0.535 2.533 1.00 0.00 H new ATOM 0 HG3 MET A 50 1.985 0.457 1.446 1.00 0.00 H new ATOM 0 HE1 MET A 50 5.897 1.923 0.631 1.00 0.00 H new ATOM 0 HE2 MET A 50 5.416 2.945 2.007 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.251 1.176 2.111 1.00 0.00 H new ATOM 761 N THR A 51 3.405 0.294 5.364 1.00 0.00 N ATOM 762 CA THR A 51 4.562 0.259 6.243 1.00 0.00 C ATOM 763 C THR A 51 5.649 -0.646 5.658 1.00 0.00 C ATOM 764 O THR A 51 5.355 -1.729 5.154 1.00 0.00 O ATOM 765 CB THR A 51 4.088 -0.180 7.630 1.00 0.00 C ATOM 766 OG1 THR A 51 3.407 0.963 8.141 1.00 0.00 O ATOM 767 CG2 THR A 51 5.247 -0.391 8.605 1.00 0.00 C ATOM 0 H THR A 51 3.176 -0.598 4.924 1.00 0.00 H new ATOM 0 HA THR A 51 5.019 1.244 6.336 1.00 0.00 H new ATOM 0 HB THR A 51 3.515 -1.103 7.543 1.00 0.00 H new ATOM 0 HG1 THR A 51 3.065 0.766 9.038 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.856 -0.702 9.574 1.00 0.00 H new ATOM 0 HG22 THR A 51 5.912 -1.163 8.218 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.801 0.541 8.719 1.00 0.00 H new ATOM 775 N ILE A 52 6.881 -0.167 5.745 1.00 0.00 N ATOM 776 CA ILE A 52 8.014 -0.919 5.231 1.00 0.00 C ATOM 777 C ILE A 52 8.588 -1.794 6.346 1.00 0.00 C ATOM 778 O ILE A 52 9.449 -1.352 7.106 1.00 0.00 O ATOM 779 CB ILE A 52 9.039 0.023 4.598 1.00 0.00 C ATOM 780 CG1 ILE A 52 8.473 0.685 3.339 1.00 0.00 C ATOM 781 CG2 ILE A 52 10.356 -0.706 4.320 1.00 0.00 C ATOM 782 CD1 ILE A 52 9.554 1.481 2.605 1.00 0.00 C ATOM 0 H ILE A 52 7.120 0.732 6.163 1.00 0.00 H new ATOM 0 HA ILE A 52 7.696 -1.589 4.432 1.00 0.00 H new ATOM 0 HB ILE A 52 9.256 0.819 5.310 1.00 0.00 H new ATOM 0 HG12 ILE A 52 8.064 -0.077 2.676 1.00 0.00 H new ATOM 0 HG13 ILE A 52 7.650 1.347 3.610 1.00 0.00 H new ATOM 0 HG21 ILE A 52 11.067 -0.013 3.870 1.00 0.00 H new ATOM 0 HG22 ILE A 52 10.764 -1.089 5.255 1.00 0.00 H new ATOM 0 HG23 ILE A 52 10.175 -1.536 3.636 1.00 0.00 H new ATOM 0 HD11 ILE A 52 9.126 1.941 1.715 1.00 0.00 H new ATOM 0 HD12 ILE A 52 9.944 2.258 3.263 1.00 0.00 H new ATOM 0 HD13 ILE A 52 10.364 0.812 2.314 1.00 0.00 H new ATOM 794 N LEU A 53 8.090 -3.020 6.410 1.00 0.00 N ATOM 795 CA LEU A 53 8.543 -3.961 7.420 1.00 0.00 C ATOM 796 C LEU A 53 9.809 -4.663 6.925 1.00 0.00 C ATOM 797 O LEU A 53 10.048 -4.745 5.722 1.00 0.00 O ATOM 798 CB LEU A 53 7.416 -4.922 7.801 1.00 0.00 C ATOM 799 CG LEU A 53 6.256 -4.316 8.594 1.00 0.00 C ATOM 800 CD1 LEU A 53 6.771 -3.508 9.787 1.00 0.00 C ATOM 801 CD2 LEU A 53 5.348 -3.483 7.688 1.00 0.00 C ATOM 0 H LEU A 53 7.377 -3.384 5.778 1.00 0.00 H new ATOM 0 HA LEU A 53 8.807 -3.437 8.338 1.00 0.00 H new ATOM 0 HB2 LEU A 53 7.015 -5.361 6.887 1.00 0.00 H new ATOM 0 HB3 LEU A 53 7.843 -5.737 8.385 1.00 0.00 H new ATOM 0 HG LEU A 53 5.652 -5.131 8.993 1.00 0.00 H new ATOM 0 HD11 LEU A 53 5.927 -3.088 10.334 1.00 0.00 H new ATOM 0 HD12 LEU A 53 7.343 -4.159 10.448 1.00 0.00 H new ATOM 0 HD13 LEU A 53 7.410 -2.700 9.431 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.532 -3.064 8.277 1.00 0.00 H new ATOM 0 HD22 LEU A 53 5.925 -2.674 7.240 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.939 -4.117 6.901 1.00 0.00 H new ATOM 813 N PRO A 54 10.608 -5.165 7.905 1.00 0.00 N ATOM 814 CA PRO A 54 10.251 -5.025 9.307 1.00 0.00 C ATOM 815 C PRO A 54 10.494 -3.595 9.794 1.00 0.00 C ATOM 816 O PRO A 54 9.873 -3.150 10.758 1.00 0.00 O ATOM 817 CB PRO A 54 11.103 -6.053 10.034 1.00 0.00 C ATOM 818 CG PRO A 54 12.235 -6.405 9.082 1.00 0.00 C ATOM 819 CD PRO A 54 11.867 -5.877 7.705 1.00 0.00 C ATOM 0 HA PRO A 54 9.192 -5.203 9.492 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.491 -5.648 10.969 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.517 -6.936 10.288 1.00 0.00 H new ATOM 0 HG2 PRO A 54 13.171 -5.963 9.423 1.00 0.00 H new ATOM 0 HG3 PRO A 54 12.385 -7.484 9.050 1.00 0.00 H new ATOM 0 HD2 PRO A 54 12.639 -5.214 7.316 1.00 0.00 H new ATOM 0 HD3 PRO A 54 11.753 -6.689 6.987 1.00 0.00 H new ATOM 827 N GLU A 55 11.399 -2.915 9.105 1.00 0.00 N ATOM 828 CA GLU A 55 11.731 -1.545 9.456 1.00 0.00 C ATOM 829 C GLU A 55 10.572 -0.894 10.213 1.00 0.00 C ATOM 830 O GLU A 55 10.681 -0.622 11.408 1.00 0.00 O ATOM 831 CB GLU A 55 12.096 -0.733 8.211 1.00 0.00 C ATOM 832 CG GLU A 55 13.612 -0.695 8.006 1.00 0.00 C ATOM 833 CD GLU A 55 14.018 -1.495 6.767 1.00 0.00 C ATOM 834 OE1 GLU A 55 13.623 -2.679 6.702 1.00 0.00 O ATOM 835 OE2 GLU A 55 14.715 -0.905 5.914 1.00 0.00 O ATOM 0 H GLU A 55 11.912 -3.287 8.306 1.00 0.00 H new ATOM 0 HA GLU A 55 12.603 -1.560 10.110 1.00 0.00 H new ATOM 0 HB2 GLU A 55 11.618 -1.170 7.334 1.00 0.00 H new ATOM 0 HB3 GLU A 55 11.713 0.283 8.310 1.00 0.00 H new ATOM 0 HG2 GLU A 55 13.942 0.338 7.900 1.00 0.00 H new ATOM 0 HG3 GLU A 55 14.112 -1.101 8.885 1.00 0.00 H new ATOM 842 N LYS A 56 9.487 -0.664 9.488 1.00 0.00 N ATOM 843 CA LYS A 56 8.309 -0.051 10.077 1.00 0.00 C ATOM 844 C LYS A 56 8.528 1.459 10.190 1.00 0.00 C ATOM 845 O LYS A 56 7.676 2.175 10.714 1.00 0.00 O ATOM 846 CB LYS A 56 7.963 -0.724 11.406 1.00 0.00 C ATOM 847 CG LYS A 56 6.451 -0.726 11.643 1.00 0.00 C ATOM 848 CD LYS A 56 6.130 -0.741 13.139 1.00 0.00 C ATOM 849 CE LYS A 56 4.812 -1.469 13.409 1.00 0.00 C ATOM 850 NZ LYS A 56 4.640 -1.710 14.859 1.00 0.00 N ATOM 0 H LYS A 56 9.399 -0.891 8.498 1.00 0.00 H new ATOM 0 HA LYS A 56 7.440 -0.200 9.436 1.00 0.00 H new ATOM 0 HB2 LYS A 56 8.336 -1.748 11.407 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.462 -0.202 12.223 1.00 0.00 H new ATOM 0 HG2 LYS A 56 6.006 0.155 11.181 1.00 0.00 H new ATOM 0 HG3 LYS A 56 6.005 -1.597 11.163 1.00 0.00 H new ATOM 0 HD2 LYS A 56 6.938 -1.230 13.683 1.00 0.00 H new ATOM 0 HD3 LYS A 56 6.068 0.281 13.512 1.00 0.00 H new ATOM 0 HE2 LYS A 56 3.979 -0.876 13.032 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.797 -2.418 12.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 3.740 -2.205 15.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 5.426 -2.294 15.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 4.633 -0.801 15.364 1.00 0.00 H new ATOM 864 N LYS A 57 9.674 1.898 9.691 1.00 0.00 N ATOM 865 CA LYS A 57 10.015 3.309 9.731 1.00 0.00 C ATOM 866 C LYS A 57 9.098 4.078 8.778 1.00 0.00 C ATOM 867 O LYS A 57 8.022 4.526 9.172 1.00 0.00 O ATOM 868 CB LYS A 57 11.505 3.508 9.444 1.00 0.00 C ATOM 869 CG LYS A 57 12.265 3.876 10.720 1.00 0.00 C ATOM 870 CD LYS A 57 12.273 5.391 10.936 1.00 0.00 C ATOM 871 CE LYS A 57 13.584 5.846 11.582 1.00 0.00 C ATOM 872 NZ LYS A 57 13.697 7.321 11.542 1.00 0.00 N ATOM 0 H LYS A 57 10.378 1.301 9.257 1.00 0.00 H new ATOM 0 HA LYS A 57 9.849 3.713 10.730 1.00 0.00 H new ATOM 0 HB2 LYS A 57 11.922 2.595 9.019 1.00 0.00 H new ATOM 0 HB3 LYS A 57 11.634 4.294 8.700 1.00 0.00 H new ATOM 0 HG2 LYS A 57 11.803 3.385 11.577 1.00 0.00 H new ATOM 0 HG3 LYS A 57 13.289 3.509 10.656 1.00 0.00 H new ATOM 0 HD2 LYS A 57 12.139 5.899 9.981 1.00 0.00 H new ATOM 0 HD3 LYS A 57 11.433 5.676 11.570 1.00 0.00 H new ATOM 0 HE2 LYS A 57 13.627 5.500 12.615 1.00 0.00 H new ATOM 0 HE3 LYS A 57 14.429 5.396 11.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 14.592 7.613 11.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 13.678 7.644 10.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 12.901 7.744 12.060 1.00 0.00 H new ATOM 886 N HIS A 58 9.557 4.208 7.541 1.00 0.00 N ATOM 887 CA HIS A 58 8.791 4.915 6.529 1.00 0.00 C ATOM 888 C HIS A 58 7.325 4.485 6.602 1.00 0.00 C ATOM 889 O HIS A 58 6.944 3.463 6.031 1.00 0.00 O ATOM 890 CB HIS A 58 9.402 4.707 5.142 1.00 0.00 C ATOM 891 CG HIS A 58 10.882 4.998 5.073 1.00 0.00 C ATOM 892 ND1 HIS A 58 11.471 6.052 5.748 1.00 0.00 N ATOM 893 CD2 HIS A 58 11.885 4.361 4.403 1.00 0.00 C ATOM 894 CE1 HIS A 58 12.770 6.042 5.488 1.00 0.00 C ATOM 895 NE2 HIS A 58 13.025 4.993 4.654 1.00 0.00 N ATOM 0 H HIS A 58 10.450 3.835 7.217 1.00 0.00 H new ATOM 0 HA HIS A 58 8.829 5.987 6.722 1.00 0.00 H new ATOM 0 HB2 HIS A 58 9.230 3.677 4.831 1.00 0.00 H new ATOM 0 HB3 HIS A 58 8.883 5.346 4.428 1.00 0.00 H new ATOM 0 HD2 HIS A 58 11.771 3.490 3.775 1.00 0.00 H new ATOM 0 HE1 HIS A 58 13.499 6.742 5.869 1.00 0.00 H new ATOM 0 HE2 HIS A 58 13.940 4.737 4.284 1.00 0.00 H new ATOM 903 N LYS A 59 6.541 5.286 7.308 1.00 0.00 N ATOM 904 CA LYS A 59 5.124 5.001 7.463 1.00 0.00 C ATOM 905 C LYS A 59 4.317 5.953 6.578 1.00 0.00 C ATOM 906 O LYS A 59 4.384 7.169 6.746 1.00 0.00 O ATOM 907 CB LYS A 59 4.726 5.049 8.940 1.00 0.00 C ATOM 908 CG LYS A 59 5.051 3.726 9.638 1.00 0.00 C ATOM 909 CD LYS A 59 5.211 3.928 11.146 1.00 0.00 C ATOM 910 CE LYS A 59 3.869 3.776 11.865 1.00 0.00 C ATOM 911 NZ LYS A 59 3.638 4.919 12.777 1.00 0.00 N ATOM 0 H LYS A 59 6.860 6.133 7.779 1.00 0.00 H new ATOM 0 HA LYS A 59 4.901 3.988 7.129 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.252 5.865 9.436 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.660 5.258 9.027 1.00 0.00 H new ATOM 0 HG2 LYS A 59 4.257 3.005 9.446 1.00 0.00 H new ATOM 0 HG3 LYS A 59 5.968 3.308 9.224 1.00 0.00 H new ATOM 0 HD2 LYS A 59 5.923 3.203 11.540 1.00 0.00 H new ATOM 0 HD3 LYS A 59 5.623 4.918 11.342 1.00 0.00 H new ATOM 0 HE2 LYS A 59 3.063 3.717 11.134 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.856 2.844 12.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 2.723 4.801 13.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.398 4.957 13.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 3.630 5.803 12.230 1.00 0.00 H new ATOM 925 N VAL A 60 3.573 5.363 5.654 1.00 0.00 N ATOM 926 CA VAL A 60 2.754 6.143 4.742 1.00 0.00 C ATOM 927 C VAL A 60 1.364 5.511 4.644 1.00 0.00 C ATOM 928 O VAL A 60 1.219 4.298 4.785 1.00 0.00 O ATOM 929 CB VAL A 60 3.452 6.265 3.386 1.00 0.00 C ATOM 930 CG1 VAL A 60 4.704 7.138 3.491 1.00 0.00 C ATOM 931 CG2 VAL A 60 3.792 4.886 2.818 1.00 0.00 C ATOM 0 H VAL A 60 3.520 4.354 5.517 1.00 0.00 H new ATOM 0 HA VAL A 60 2.624 7.158 5.118 1.00 0.00 H new ATOM 0 HB VAL A 60 2.761 6.750 2.696 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.181 7.209 2.514 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.425 8.135 3.831 1.00 0.00 H new ATOM 0 HG13 VAL A 60 5.399 6.693 4.203 1.00 0.00 H new ATOM 0 HG21 VAL A 60 4.287 5.002 1.854 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.455 4.362 3.506 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.876 4.310 2.688 1.00 0.00 H new ATOM 941 N LYS A 61 0.378 6.362 4.402 1.00 0.00 N ATOM 942 CA LYS A 61 -0.995 5.902 4.283 1.00 0.00 C ATOM 943 C LYS A 61 -1.640 6.548 3.056 1.00 0.00 C ATOM 944 O LYS A 61 -1.141 7.548 2.541 1.00 0.00 O ATOM 945 CB LYS A 61 -1.759 6.155 5.585 1.00 0.00 C ATOM 946 CG LYS A 61 -1.849 7.653 5.885 1.00 0.00 C ATOM 947 CD LYS A 61 -2.250 7.897 7.342 1.00 0.00 C ATOM 948 CE LYS A 61 -1.083 8.483 8.140 1.00 0.00 C ATOM 949 NZ LYS A 61 -1.309 9.921 8.407 1.00 0.00 N ATOM 0 H LYS A 61 0.503 7.368 4.285 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.024 4.824 4.128 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -2.762 5.734 5.510 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.260 5.645 6.409 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -0.888 8.126 5.684 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -2.578 8.118 5.221 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -3.100 8.578 7.380 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -2.572 6.960 7.796 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -0.972 7.945 9.082 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -0.153 8.351 7.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -0.508 10.303 8.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -1.392 10.433 7.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -2.185 10.039 8.954 1.00 0.00 H new ATOM 963 N THR A 62 -2.741 5.951 2.622 1.00 0.00 N ATOM 964 CA THR A 62 -3.459 6.455 1.464 1.00 0.00 C ATOM 965 C THR A 62 -4.543 7.444 1.899 1.00 0.00 C ATOM 966 O THR A 62 -4.894 7.508 3.076 1.00 0.00 O ATOM 967 CB THR A 62 -4.007 5.256 0.688 1.00 0.00 C ATOM 968 OG1 THR A 62 -5.090 4.790 1.488 1.00 0.00 O ATOM 969 CG2 THR A 62 -3.029 4.079 0.662 1.00 0.00 C ATOM 0 H THR A 62 -3.153 5.123 3.052 1.00 0.00 H new ATOM 0 HA THR A 62 -2.798 7.014 0.801 1.00 0.00 H new ATOM 0 HB THR A 62 -4.237 5.559 -0.333 1.00 0.00 H new ATOM 0 HG1 THR A 62 -5.772 4.386 0.912 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.467 3.255 0.099 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.099 4.390 0.187 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.824 3.753 1.682 1.00 0.00 H new ATOM 977 N ARG A 63 -5.042 8.191 0.925 1.00 0.00 N ATOM 978 CA ARG A 63 -6.079 9.173 1.192 1.00 0.00 C ATOM 979 C ARG A 63 -7.316 8.493 1.782 1.00 0.00 C ATOM 980 O ARG A 63 -7.446 7.272 1.720 1.00 0.00 O ATOM 981 CB ARG A 63 -6.475 9.917 -0.086 1.00 0.00 C ATOM 982 CG ARG A 63 -6.778 8.936 -1.220 1.00 0.00 C ATOM 983 CD ARG A 63 -7.656 9.589 -2.289 1.00 0.00 C ATOM 984 NE ARG A 63 -6.837 9.941 -3.471 1.00 0.00 N ATOM 985 CZ ARG A 63 -7.206 10.831 -4.402 1.00 0.00 C ATOM 986 NH1 ARG A 63 -8.382 11.465 -4.295 1.00 0.00 N ATOM 987 NH2 ARG A 63 -6.399 11.087 -5.441 1.00 0.00 N ATOM 0 H ARG A 63 -4.747 8.136 -0.050 1.00 0.00 H new ATOM 0 HA ARG A 63 -5.679 9.891 1.908 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -7.350 10.537 0.107 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.669 10.587 -0.386 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.845 8.594 -1.669 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.280 8.055 -0.820 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -8.456 8.908 -2.580 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.130 10.484 -1.885 1.00 0.00 H new ATOM 0 HE ARG A 63 -5.936 9.477 -3.584 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -8.996 11.270 -3.505 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -8.662 12.143 -5.004 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -5.504 10.604 -5.523 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -6.680 11.765 -6.150 1.00 0.00 H new ATOM 1001 N VAL A 64 -8.193 9.314 2.340 1.00 0.00 N ATOM 1002 CA VAL A 64 -9.415 8.807 2.941 1.00 0.00 C ATOM 1003 C VAL A 64 -10.606 9.175 2.053 1.00 0.00 C ATOM 1004 O VAL A 64 -11.088 10.306 2.094 1.00 0.00 O ATOM 1005 CB VAL A 64 -9.552 9.331 4.372 1.00 0.00 C ATOM 1006 CG1 VAL A 64 -10.997 9.221 4.861 1.00 0.00 C ATOM 1007 CG2 VAL A 64 -8.596 8.600 5.317 1.00 0.00 C ATOM 0 H VAL A 64 -8.082 10.327 2.389 1.00 0.00 H new ATOM 0 HA VAL A 64 -9.384 7.720 3.009 1.00 0.00 H new ATOM 0 HB VAL A 64 -9.279 10.386 4.370 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -11.066 9.600 5.881 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -11.647 9.807 4.211 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -11.310 8.177 4.840 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -8.713 8.991 6.328 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -8.824 7.534 5.312 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -7.569 8.753 4.986 1.00 0.00 H new ATOM 1017 N LEU A 65 -11.045 8.199 1.272 1.00 0.00 N ATOM 1018 CA LEU A 65 -12.169 8.407 0.376 1.00 0.00 C ATOM 1019 C LEU A 65 -13.391 8.838 1.190 1.00 0.00 C ATOM 1020 O LEU A 65 -13.407 8.702 2.412 1.00 0.00 O ATOM 1021 CB LEU A 65 -12.409 7.162 -0.481 1.00 0.00 C ATOM 1022 CG LEU A 65 -11.510 7.011 -1.710 1.00 0.00 C ATOM 1023 CD1 LEU A 65 -11.349 8.346 -2.438 1.00 0.00 C ATOM 1024 CD2 LEU A 65 -10.161 6.398 -1.331 1.00 0.00 C ATOM 0 H LEU A 65 -10.642 7.262 1.241 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.953 9.212 -0.326 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.281 6.281 0.149 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -13.447 7.168 -0.813 1.00 0.00 H new ATOM 0 HG LEU A 65 -11.992 6.322 -2.404 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.706 8.211 -3.307 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -12.326 8.704 -2.762 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -10.900 9.076 -1.764 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -9.542 6.302 -2.223 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -9.659 7.041 -0.608 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.319 5.413 -0.891 1.00 0.00 H new ATOM 1036 N ARG A 66 -14.386 9.348 0.478 1.00 0.00 N ATOM 1037 CA ARG A 66 -15.610 9.799 1.119 1.00 0.00 C ATOM 1038 C ARG A 66 -16.811 9.022 0.577 1.00 0.00 C ATOM 1039 O ARG A 66 -17.000 8.932 -0.635 1.00 0.00 O ATOM 1040 CB ARG A 66 -15.832 11.295 0.889 1.00 0.00 C ATOM 1041 CG ARG A 66 -14.670 12.116 1.453 1.00 0.00 C ATOM 1042 CD ARG A 66 -14.335 11.681 2.881 1.00 0.00 C ATOM 1043 NE ARG A 66 -13.731 12.810 3.625 1.00 0.00 N ATOM 1044 CZ ARG A 66 -13.755 12.928 4.959 1.00 0.00 C ATOM 1045 NH1 ARG A 66 -14.353 11.989 5.705 1.00 0.00 N ATOM 1046 NH2 ARG A 66 -13.181 13.986 5.548 1.00 0.00 N ATOM 0 H ARG A 66 -14.369 9.459 -0.536 1.00 0.00 H new ATOM 0 HA ARG A 66 -15.510 9.618 2.189 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -15.936 11.491 -0.178 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -16.764 11.605 1.362 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -13.793 11.996 0.817 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -14.929 13.175 1.443 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -15.238 11.342 3.388 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -13.645 10.837 2.861 1.00 0.00 H new ATOM 0 HE ARG A 66 -13.268 13.543 3.088 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -14.790 11.184 5.257 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -14.371 12.080 6.721 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -12.726 14.701 4.980 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -13.199 14.076 6.564 1.00 0.00 H new ATOM 1060 N LYS A 67 -17.591 8.481 1.501 1.00 0.00 N ATOM 1061 CA LYS A 67 -18.769 7.715 1.130 1.00 0.00 C ATOM 1062 C LYS A 67 -18.420 6.781 -0.031 1.00 0.00 C ATOM 1063 O LYS A 67 -18.625 7.127 -1.194 1.00 0.00 O ATOM 1064 CB LYS A 67 -19.945 8.648 0.837 1.00 0.00 C ATOM 1065 CG LYS A 67 -20.771 8.902 2.099 1.00 0.00 C ATOM 1066 CD LYS A 67 -21.312 10.334 2.122 1.00 0.00 C ATOM 1067 CE LYS A 67 -21.647 10.770 3.549 1.00 0.00 C ATOM 1068 NZ LYS A 67 -22.302 12.097 3.545 1.00 0.00 N ATOM 0 H LYS A 67 -17.431 8.558 2.505 1.00 0.00 H new ATOM 0 HA LYS A 67 -19.091 7.086 1.960 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -19.574 9.595 0.444 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -20.578 8.210 0.066 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -21.600 8.196 2.144 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -20.156 8.728 2.982 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -20.574 11.012 1.694 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -22.204 10.400 1.499 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -22.303 10.035 4.015 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -20.736 10.809 4.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -22.523 12.378 4.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -21.663 12.798 3.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -23.181 12.048 2.992 1.00 0.00 H new ATOM 1082 N THR A 68 -17.899 5.616 0.324 1.00 0.00 N ATOM 1083 CA THR A 68 -17.520 4.631 -0.674 1.00 0.00 C ATOM 1084 C THR A 68 -17.004 3.359 0.002 1.00 0.00 C ATOM 1085 O THR A 68 -16.276 3.428 0.991 1.00 0.00 O ATOM 1086 CB THR A 68 -16.499 5.277 -1.613 1.00 0.00 C ATOM 1087 OG1 THR A 68 -16.722 4.634 -2.865 1.00 0.00 O ATOM 1088 CG2 THR A 68 -15.058 4.906 -1.255 1.00 0.00 C ATOM 0 H THR A 68 -17.730 5.332 1.289 1.00 0.00 H new ATOM 0 HA THR A 68 -18.379 4.320 -1.269 1.00 0.00 H new ATOM 0 HB THR A 68 -16.613 6.361 -1.583 1.00 0.00 H new ATOM 0 HG1 THR A 68 -16.102 4.995 -3.533 1.00 0.00 H new ATOM 0 HG21 THR A 68 -14.374 5.390 -1.952 1.00 0.00 H new ATOM 0 HG22 THR A 68 -14.838 5.238 -0.240 1.00 0.00 H new ATOM 0 HG23 THR A 68 -14.934 3.825 -1.318 1.00 0.00 H new ATOM 1096 N LEU A 69 -17.401 2.226 -0.560 1.00 0.00 N ATOM 1097 CA LEU A 69 -16.989 0.940 -0.024 1.00 0.00 C ATOM 1098 C LEU A 69 -15.726 0.472 -0.750 1.00 0.00 C ATOM 1099 O LEU A 69 -14.966 -0.339 -0.221 1.00 0.00 O ATOM 1100 CB LEU A 69 -18.142 -0.062 -0.088 1.00 0.00 C ATOM 1101 CG LEU A 69 -19.272 0.149 0.922 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -20.046 -1.149 1.159 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -18.737 0.744 2.226 1.00 0.00 C ATOM 0 H LEU A 69 -18.004 2.172 -1.381 1.00 0.00 H new ATOM 0 HA LEU A 69 -16.736 1.031 1.032 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -18.568 -0.032 -1.091 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -17.735 -1.063 0.056 1.00 0.00 H new ATOM 0 HG LEU A 69 -19.974 0.870 0.503 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -20.843 -0.971 1.881 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -20.478 -1.492 0.219 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -19.369 -1.911 1.547 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -19.560 0.884 2.927 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -18.002 0.066 2.660 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -18.267 1.706 2.021 1.00 0.00 H new ATOM 1115 N ASP A 70 -15.540 1.002 -1.950 1.00 0.00 N ATOM 1116 CA ASP A 70 -14.383 0.648 -2.753 1.00 0.00 C ATOM 1117 C ASP A 70 -13.559 1.907 -3.035 1.00 0.00 C ATOM 1118 O ASP A 70 -13.755 2.565 -4.056 1.00 0.00 O ATOM 1119 CB ASP A 70 -14.806 0.050 -4.096 1.00 0.00 C ATOM 1120 CG ASP A 70 -15.922 -0.994 -4.015 1.00 0.00 C ATOM 1121 OD1 ASP A 70 -16.095 -1.556 -2.912 1.00 0.00 O ATOM 1122 OD2 ASP A 70 -16.577 -1.207 -5.059 1.00 0.00 O ATOM 0 H ASP A 70 -16.172 1.674 -2.385 1.00 0.00 H new ATOM 0 HA ASP A 70 -13.800 -0.088 -2.198 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -15.132 0.859 -4.750 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -13.934 -0.407 -4.564 1.00 0.00 H new ATOM 1127 N PRO A 71 -12.632 2.211 -2.088 1.00 0.00 N ATOM 1128 CA PRO A 71 -11.778 3.379 -2.225 1.00 0.00 C ATOM 1129 C PRO A 71 -10.685 3.140 -3.268 1.00 0.00 C ATOM 1130 O PRO A 71 -10.070 2.075 -3.295 1.00 0.00 O ATOM 1131 CB PRO A 71 -11.225 3.628 -0.831 1.00 0.00 C ATOM 1132 CG PRO A 71 -11.417 2.326 -0.069 1.00 0.00 C ATOM 1133 CD PRO A 71 -12.373 1.455 -0.867 1.00 0.00 C ATOM 0 HA PRO A 71 -12.317 4.254 -2.587 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -10.172 3.905 -0.872 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -11.751 4.448 -0.342 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -10.462 1.819 0.067 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -11.818 2.521 0.925 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -11.932 0.483 -1.089 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -13.294 1.268 -0.314 1.00 0.00 H new ATOM 1141 N ALA A 72 -10.476 4.148 -4.101 1.00 0.00 N ATOM 1142 CA ALA A 72 -9.467 4.061 -5.144 1.00 0.00 C ATOM 1143 C ALA A 72 -8.383 5.111 -4.888 1.00 0.00 C ATOM 1144 O ALA A 72 -8.512 6.257 -5.315 1.00 0.00 O ATOM 1145 CB ALA A 72 -10.131 4.230 -6.512 1.00 0.00 C ATOM 0 H ALA A 72 -10.988 5.030 -4.076 1.00 0.00 H new ATOM 0 HA ALA A 72 -8.987 3.082 -5.133 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -9.375 4.165 -7.294 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -10.871 3.443 -6.657 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -10.621 5.203 -6.561 1.00 0.00 H new ATOM 1151 N PHE A 73 -7.341 4.681 -4.193 1.00 0.00 N ATOM 1152 CA PHE A 73 -6.235 5.569 -3.875 1.00 0.00 C ATOM 1153 C PHE A 73 -5.247 5.653 -5.040 1.00 0.00 C ATOM 1154 O PHE A 73 -4.803 6.740 -5.405 1.00 0.00 O ATOM 1155 CB PHE A 73 -5.522 4.977 -2.658 1.00 0.00 C ATOM 1156 CG PHE A 73 -6.464 4.356 -1.625 1.00 0.00 C ATOM 1157 CD1 PHE A 73 -6.966 5.119 -0.617 1.00 0.00 C ATOM 1158 CD2 PHE A 73 -6.801 3.042 -1.715 1.00 0.00 C ATOM 1159 CE1 PHE A 73 -7.841 4.543 0.342 1.00 0.00 C ATOM 1160 CE2 PHE A 73 -7.675 2.465 -0.756 1.00 0.00 C ATOM 1161 CZ PHE A 73 -8.177 3.228 0.252 1.00 0.00 C ATOM 0 H PHE A 73 -7.239 3.729 -3.841 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.609 6.574 -3.678 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -4.819 4.216 -2.997 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -4.937 5.760 -2.176 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -6.699 6.163 -0.546 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -6.404 2.437 -2.516 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -8.239 5.149 1.142 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -7.941 1.421 -0.827 1.00 0.00 H new ATOM 0 HZ PHE A 73 -8.842 2.790 0.981 1.00 0.00 H new ATOM 1171 N ASP A 74 -4.932 4.490 -5.591 1.00 0.00 N ATOM 1172 CA ASP A 74 -4.004 4.418 -6.707 1.00 0.00 C ATOM 1173 C ASP A 74 -2.861 5.409 -6.479 1.00 0.00 C ATOM 1174 O ASP A 74 -2.462 6.124 -7.397 1.00 0.00 O ATOM 1175 CB ASP A 74 -4.694 4.787 -8.022 1.00 0.00 C ATOM 1176 CG ASP A 74 -6.101 4.211 -8.198 1.00 0.00 C ATOM 1177 OD1 ASP A 74 -6.323 3.091 -7.689 1.00 0.00 O ATOM 1178 OD2 ASP A 74 -6.922 4.903 -8.838 1.00 0.00 O ATOM 0 H ASP A 74 -5.303 3.590 -5.286 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.631 3.396 -6.770 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -4.751 5.873 -8.093 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.072 4.446 -8.850 1.00 0.00 H new ATOM 1183 N GLU A 75 -2.365 5.419 -5.251 1.00 0.00 N ATOM 1184 CA GLU A 75 -1.276 6.310 -4.890 1.00 0.00 C ATOM 1185 C GLU A 75 0.072 5.648 -5.187 1.00 0.00 C ATOM 1186 O GLU A 75 0.119 4.526 -5.689 1.00 0.00 O ATOM 1187 CB GLU A 75 -1.370 6.726 -3.421 1.00 0.00 C ATOM 1188 CG GLU A 75 -2.000 8.113 -3.283 1.00 0.00 C ATOM 1189 CD GLU A 75 -1.182 9.164 -4.037 1.00 0.00 C ATOM 1190 OE1 GLU A 75 -0.168 9.614 -3.461 1.00 0.00 O ATOM 1191 OE2 GLU A 75 -1.589 9.493 -5.172 1.00 0.00 O ATOM 0 H GLU A 75 -2.698 4.824 -4.493 1.00 0.00 H new ATOM 0 HA GLU A 75 -1.357 7.213 -5.495 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -1.964 5.997 -2.870 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -0.375 6.729 -2.976 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -3.019 8.094 -3.670 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -2.064 8.384 -2.229 1.00 0.00 H new ATOM 1198 N THR A 76 1.134 6.371 -4.864 1.00 0.00 N ATOM 1199 CA THR A 76 2.478 5.868 -5.090 1.00 0.00 C ATOM 1200 C THR A 76 3.480 6.605 -4.199 1.00 0.00 C ATOM 1201 O THR A 76 3.526 7.834 -4.196 1.00 0.00 O ATOM 1202 CB THR A 76 2.786 5.994 -6.583 1.00 0.00 C ATOM 1203 OG1 THR A 76 1.953 5.011 -7.193 1.00 0.00 O ATOM 1204 CG2 THR A 76 4.207 5.545 -6.929 1.00 0.00 C ATOM 0 H THR A 76 1.091 7.301 -4.448 1.00 0.00 H new ATOM 0 HA THR A 76 2.558 4.816 -4.815 1.00 0.00 H new ATOM 0 HB THR A 76 2.647 7.029 -6.896 1.00 0.00 H new ATOM 0 HG1 THR A 76 1.445 4.538 -6.501 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.373 5.655 -8.001 1.00 0.00 H new ATOM 0 HG22 THR A 76 4.925 6.159 -6.386 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.337 4.500 -6.647 1.00 0.00 H new ATOM 1212 N PHE A 77 4.258 5.823 -3.465 1.00 0.00 N ATOM 1213 CA PHE A 77 5.256 6.386 -2.572 1.00 0.00 C ATOM 1214 C PHE A 77 6.668 5.994 -3.011 1.00 0.00 C ATOM 1215 O PHE A 77 6.921 4.836 -3.341 1.00 0.00 O ATOM 1216 CB PHE A 77 4.989 5.809 -1.181 1.00 0.00 C ATOM 1217 CG PHE A 77 3.526 5.896 -0.742 1.00 0.00 C ATOM 1218 CD1 PHE A 77 3.019 7.076 -0.294 1.00 0.00 C ATOM 1219 CD2 PHE A 77 2.732 4.793 -0.798 1.00 0.00 C ATOM 1220 CE1 PHE A 77 1.661 7.157 0.113 1.00 0.00 C ATOM 1221 CE2 PHE A 77 1.374 4.874 -0.390 1.00 0.00 C ATOM 1222 CZ PHE A 77 0.867 6.054 0.057 1.00 0.00 C ATOM 0 H PHE A 77 4.217 4.804 -3.471 1.00 0.00 H new ATOM 0 HA PHE A 77 5.191 7.474 -2.580 1.00 0.00 H new ATOM 0 HB2 PHE A 77 5.301 4.765 -1.166 1.00 0.00 H new ATOM 0 HB3 PHE A 77 5.608 6.337 -0.455 1.00 0.00 H new ATOM 0 HD1 PHE A 77 3.650 7.952 -0.248 1.00 0.00 H new ATOM 0 HD2 PHE A 77 3.134 3.856 -1.153 1.00 0.00 H new ATOM 0 HE1 PHE A 77 1.259 8.095 0.467 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.744 3.998 -0.435 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.166 6.115 0.367 1.00 0.00 H new ATOM 1232 N THR A 78 7.552 6.981 -3.001 1.00 0.00 N ATOM 1233 CA THR A 78 8.932 6.754 -3.394 1.00 0.00 C ATOM 1234 C THR A 78 9.833 6.676 -2.160 1.00 0.00 C ATOM 1235 O THR A 78 9.482 7.190 -1.098 1.00 0.00 O ATOM 1236 CB THR A 78 9.334 7.861 -4.371 1.00 0.00 C ATOM 1237 OG1 THR A 78 8.712 7.486 -5.597 1.00 0.00 O ATOM 1238 CG2 THR A 78 10.830 7.844 -4.692 1.00 0.00 C ATOM 0 H THR A 78 7.339 7.940 -2.727 1.00 0.00 H new ATOM 0 HA THR A 78 9.046 5.796 -3.901 1.00 0.00 H new ATOM 0 HB THR A 78 9.064 8.830 -3.952 1.00 0.00 H new ATOM 0 HG1 THR A 78 8.920 8.151 -6.286 1.00 0.00 H new ATOM 0 HG21 THR A 78 11.062 8.649 -5.389 1.00 0.00 H new ATOM 0 HG22 THR A 78 11.401 7.983 -3.774 1.00 0.00 H new ATOM 0 HG23 THR A 78 11.095 6.887 -5.142 1.00 0.00 H new ATOM 1246 N PHE A 79 10.975 6.030 -2.340 1.00 0.00 N ATOM 1247 CA PHE A 79 11.928 5.879 -1.254 1.00 0.00 C ATOM 1248 C PHE A 79 13.346 5.678 -1.793 1.00 0.00 C ATOM 1249 O PHE A 79 13.586 4.782 -2.601 1.00 0.00 O ATOM 1250 CB PHE A 79 11.514 4.635 -0.466 1.00 0.00 C ATOM 1251 CG PHE A 79 10.028 4.593 -0.104 1.00 0.00 C ATOM 1252 CD1 PHE A 79 9.569 5.291 0.969 1.00 0.00 C ATOM 1253 CD2 PHE A 79 9.166 3.859 -0.857 1.00 0.00 C ATOM 1254 CE1 PHE A 79 8.190 5.252 1.305 1.00 0.00 C ATOM 1255 CE2 PHE A 79 7.786 3.820 -0.522 1.00 0.00 C ATOM 1256 CZ PHE A 79 7.328 4.517 0.552 1.00 0.00 C ATOM 0 H PHE A 79 11.262 5.605 -3.222 1.00 0.00 H new ATOM 0 HA PHE A 79 11.928 6.774 -0.632 1.00 0.00 H new ATOM 0 HB2 PHE A 79 11.760 3.749 -1.051 1.00 0.00 H new ATOM 0 HB3 PHE A 79 12.102 4.586 0.450 1.00 0.00 H new ATOM 0 HD1 PHE A 79 10.254 5.875 1.566 1.00 0.00 H new ATOM 0 HD2 PHE A 79 9.530 3.306 -1.710 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.826 5.806 2.158 1.00 0.00 H new ATOM 0 HE2 PHE A 79 7.101 3.237 -1.120 1.00 0.00 H new ATOM 0 HZ PHE A 79 6.279 4.487 0.807 1.00 0.00 H new ATOM 1266 N TYR A 80 14.249 6.527 -1.324 1.00 0.00 N ATOM 1267 CA TYR A 80 15.637 6.454 -1.749 1.00 0.00 C ATOM 1268 C TYR A 80 16.508 5.810 -0.668 1.00 0.00 C ATOM 1269 O TYR A 80 16.185 5.879 0.517 1.00 0.00 O ATOM 1270 CB TYR A 80 16.090 7.900 -1.958 1.00 0.00 C ATOM 1271 CG TYR A 80 15.276 8.663 -3.005 1.00 0.00 C ATOM 1272 CD1 TYR A 80 15.540 8.486 -4.348 1.00 0.00 C ATOM 1273 CD2 TYR A 80 14.277 9.527 -2.607 1.00 0.00 C ATOM 1274 CE1 TYR A 80 14.774 9.203 -5.334 1.00 0.00 C ATOM 1275 CE2 TYR A 80 13.510 10.245 -3.592 1.00 0.00 C ATOM 1276 CZ TYR A 80 13.796 10.047 -4.907 1.00 0.00 C ATOM 1277 OH TYR A 80 13.073 10.725 -5.838 1.00 0.00 O ATOM 0 H TYR A 80 14.047 7.269 -0.654 1.00 0.00 H new ATOM 0 HA TYR A 80 15.731 5.852 -2.653 1.00 0.00 H new ATOM 0 HB2 TYR A 80 16.028 8.430 -1.008 1.00 0.00 H new ATOM 0 HB3 TYR A 80 17.138 7.902 -2.256 1.00 0.00 H new ATOM 0 HD1 TYR A 80 16.322 7.809 -4.660 1.00 0.00 H new ATOM 0 HD2 TYR A 80 14.070 9.665 -1.556 1.00 0.00 H new ATOM 0 HE1 TYR A 80 14.971 9.074 -6.388 1.00 0.00 H new ATOM 0 HE2 TYR A 80 12.726 10.925 -3.293 1.00 0.00 H new ATOM 0 HH TYR A 80 12.409 11.289 -5.389 1.00 0.00 H new ATOM 1287 N GLY A 81 17.594 5.199 -1.116 1.00 0.00 N ATOM 1288 CA GLY A 81 18.514 4.543 -0.202 1.00 0.00 C ATOM 1289 C GLY A 81 18.266 3.034 -0.163 1.00 0.00 C ATOM 1290 O GLY A 81 19.167 2.245 -0.444 1.00 0.00 O ATOM 0 H GLY A 81 17.858 5.144 -2.100 1.00 0.00 H new ATOM 0 HA2 GLY A 81 19.541 4.738 -0.511 1.00 0.00 H new ATOM 0 HA3 GLY A 81 18.398 4.960 0.798 1.00 0.00 H new ATOM 1294 N ILE A 82 17.039 2.677 0.188 1.00 0.00 N ATOM 1295 CA ILE A 82 16.660 1.277 0.267 1.00 0.00 C ATOM 1296 C ILE A 82 17.185 0.540 -0.967 1.00 0.00 C ATOM 1297 O ILE A 82 16.688 0.742 -2.073 1.00 0.00 O ATOM 1298 CB ILE A 82 15.149 1.140 0.468 1.00 0.00 C ATOM 1299 CG1 ILE A 82 14.709 1.797 1.778 1.00 0.00 C ATOM 1300 CG2 ILE A 82 14.715 -0.324 0.386 1.00 0.00 C ATOM 1301 CD1 ILE A 82 13.712 2.928 1.516 1.00 0.00 C ATOM 0 H ILE A 82 16.294 3.334 0.421 1.00 0.00 H new ATOM 0 HA ILE A 82 17.118 0.808 1.138 1.00 0.00 H new ATOM 0 HB ILE A 82 14.647 1.669 -0.342 1.00 0.00 H new ATOM 0 HG12 ILE A 82 14.254 1.050 2.429 1.00 0.00 H new ATOM 0 HG13 ILE A 82 15.580 2.189 2.303 1.00 0.00 H new ATOM 0 HG21 ILE A 82 13.637 -0.393 0.532 1.00 0.00 H new ATOM 0 HG22 ILE A 82 14.975 -0.726 -0.593 1.00 0.00 H new ATOM 0 HG23 ILE A 82 15.224 -0.898 1.160 1.00 0.00 H new ATOM 0 HD11 ILE A 82 13.415 3.378 2.463 1.00 0.00 H new ATOM 0 HD12 ILE A 82 14.178 3.685 0.885 1.00 0.00 H new ATOM 0 HD13 ILE A 82 12.832 2.528 1.013 1.00 0.00 H new ATOM 1313 N PRO A 83 18.211 -0.321 -0.729 1.00 0.00 N ATOM 1314 CA PRO A 83 18.809 -1.089 -1.807 1.00 0.00 C ATOM 1315 C PRO A 83 17.896 -2.240 -2.233 1.00 0.00 C ATOM 1316 O PRO A 83 17.358 -2.955 -1.389 1.00 0.00 O ATOM 1317 CB PRO A 83 20.146 -1.562 -1.259 1.00 0.00 C ATOM 1318 CG PRO A 83 20.044 -1.438 0.252 1.00 0.00 C ATOM 1319 CD PRO A 83 18.826 -0.585 0.569 1.00 0.00 C ATOM 0 HA PRO A 83 18.951 -0.501 -2.714 1.00 0.00 H new ATOM 0 HB2 PRO A 83 20.347 -2.592 -1.554 1.00 0.00 H new ATOM 0 HB3 PRO A 83 20.964 -0.955 -1.646 1.00 0.00 H new ATOM 0 HG2 PRO A 83 19.950 -2.423 0.710 1.00 0.00 H new ATOM 0 HG3 PRO A 83 20.946 -0.981 0.659 1.00 0.00 H new ATOM 0 HD2 PRO A 83 18.139 -1.108 1.234 1.00 0.00 H new ATOM 0 HD3 PRO A 83 19.110 0.341 1.068 1.00 0.00 H new ATOM 1327 N TYR A 84 17.749 -2.384 -3.542 1.00 0.00 N ATOM 1328 CA TYR A 84 16.910 -3.436 -4.090 1.00 0.00 C ATOM 1329 C TYR A 84 17.218 -4.782 -3.430 1.00 0.00 C ATOM 1330 O TYR A 84 16.345 -5.643 -3.332 1.00 0.00 O ATOM 1331 CB TYR A 84 17.257 -3.520 -5.578 1.00 0.00 C ATOM 1332 CG TYR A 84 16.660 -4.737 -6.288 1.00 0.00 C ATOM 1333 CD1 TYR A 84 15.305 -4.986 -6.209 1.00 0.00 C ATOM 1334 CD2 TYR A 84 17.477 -5.585 -7.008 1.00 0.00 C ATOM 1335 CE1 TYR A 84 14.743 -6.130 -6.877 1.00 0.00 C ATOM 1336 CE2 TYR A 84 16.915 -6.730 -7.677 1.00 0.00 C ATOM 1337 CZ TYR A 84 15.576 -6.946 -7.578 1.00 0.00 C ATOM 1338 OH TYR A 84 15.045 -8.027 -8.210 1.00 0.00 O ATOM 0 H TYR A 84 18.197 -1.789 -4.239 1.00 0.00 H new ATOM 0 HA TYR A 84 15.856 -3.216 -3.918 1.00 0.00 H new ATOM 0 HB2 TYR A 84 16.907 -2.615 -6.074 1.00 0.00 H new ATOM 0 HB3 TYR A 84 18.341 -3.544 -5.687 1.00 0.00 H new ATOM 0 HD1 TYR A 84 14.666 -4.322 -5.646 1.00 0.00 H new ATOM 0 HD2 TYR A 84 18.537 -5.390 -7.070 1.00 0.00 H new ATOM 0 HE1 TYR A 84 13.684 -6.336 -6.823 1.00 0.00 H new ATOM 0 HE2 TYR A 84 17.542 -7.402 -8.244 1.00 0.00 H new ATOM 0 HH TYR A 84 15.756 -8.518 -8.672 1.00 0.00 H new ATOM 1348 N THR A 85 18.461 -4.921 -2.994 1.00 0.00 N ATOM 1349 CA THR A 85 18.895 -6.147 -2.346 1.00 0.00 C ATOM 1350 C THR A 85 18.236 -6.286 -0.972 1.00 0.00 C ATOM 1351 O THR A 85 18.107 -7.392 -0.451 1.00 0.00 O ATOM 1352 CB THR A 85 20.423 -6.136 -2.289 1.00 0.00 C ATOM 1353 OG1 THR A 85 20.739 -4.889 -1.675 1.00 0.00 O ATOM 1354 CG2 THR A 85 21.061 -6.041 -3.676 1.00 0.00 C ATOM 0 H THR A 85 19.182 -4.204 -3.077 1.00 0.00 H new ATOM 0 HA THR A 85 18.583 -7.025 -2.911 1.00 0.00 H new ATOM 0 HB THR A 85 20.773 -7.040 -1.790 1.00 0.00 H new ATOM 0 HG1 THR A 85 21.712 -4.800 -1.597 1.00 0.00 H new ATOM 0 HG21 THR A 85 22.147 -6.037 -3.578 1.00 0.00 H new ATOM 0 HG22 THR A 85 20.754 -6.897 -4.277 1.00 0.00 H new ATOM 0 HG23 THR A 85 20.737 -5.121 -4.163 1.00 0.00 H new ATOM 1362 N GLN A 86 17.836 -5.147 -0.426 1.00 0.00 N ATOM 1363 CA GLN A 86 17.193 -5.128 0.878 1.00 0.00 C ATOM 1364 C GLN A 86 15.695 -5.401 0.735 1.00 0.00 C ATOM 1365 O GLN A 86 15.039 -5.802 1.695 1.00 0.00 O ATOM 1366 CB GLN A 86 17.442 -3.798 1.592 1.00 0.00 C ATOM 1367 CG GLN A 86 17.738 -4.020 3.077 1.00 0.00 C ATOM 1368 CD GLN A 86 18.999 -3.266 3.503 1.00 0.00 C ATOM 1369 OE1 GLN A 86 20.112 -3.755 3.398 1.00 0.00 O ATOM 1370 NE2 GLN A 86 18.764 -2.050 3.989 1.00 0.00 N ATOM 0 H GLN A 86 17.944 -4.231 -0.862 1.00 0.00 H new ATOM 0 HA GLN A 86 17.630 -5.918 1.489 1.00 0.00 H new ATOM 0 HB2 GLN A 86 18.280 -3.281 1.124 1.00 0.00 H new ATOM 0 HB3 GLN A 86 16.569 -3.154 1.484 1.00 0.00 H new ATOM 0 HG2 GLN A 86 16.890 -3.685 3.675 1.00 0.00 H new ATOM 0 HG3 GLN A 86 17.864 -5.085 3.271 1.00 0.00 H new ATOM 0 HE21 GLN A 86 17.807 -1.701 4.049 1.00 0.00 H new ATOM 0 HE22 GLN A 86 19.540 -1.467 4.301 1.00 0.00 H new ATOM 1379 N ILE A 87 15.197 -5.173 -0.472 1.00 0.00 N ATOM 1380 CA ILE A 87 13.787 -5.390 -0.753 1.00 0.00 C ATOM 1381 C ILE A 87 13.386 -6.787 -0.276 1.00 0.00 C ATOM 1382 O ILE A 87 12.347 -6.955 0.361 1.00 0.00 O ATOM 1383 CB ILE A 87 13.491 -5.136 -2.232 1.00 0.00 C ATOM 1384 CG1 ILE A 87 13.917 -3.725 -2.642 1.00 0.00 C ATOM 1385 CG2 ILE A 87 12.019 -5.406 -2.550 1.00 0.00 C ATOM 1386 CD1 ILE A 87 12.917 -2.682 -2.138 1.00 0.00 C ATOM 0 H ILE A 87 15.744 -4.840 -1.266 1.00 0.00 H new ATOM 0 HA ILE A 87 13.174 -4.677 -0.202 1.00 0.00 H new ATOM 0 HB ILE A 87 14.082 -5.835 -2.824 1.00 0.00 H new ATOM 0 HG12 ILE A 87 14.907 -3.509 -2.240 1.00 0.00 H new ATOM 0 HG13 ILE A 87 13.994 -3.666 -3.728 1.00 0.00 H new ATOM 0 HG21 ILE A 87 11.835 -5.218 -3.608 1.00 0.00 H new ATOM 0 HG22 ILE A 87 11.781 -6.444 -2.319 1.00 0.00 H new ATOM 0 HG23 ILE A 87 11.390 -4.748 -1.950 1.00 0.00 H new ATOM 0 HD11 ILE A 87 13.243 -1.688 -2.443 1.00 0.00 H new ATOM 0 HD12 ILE A 87 11.934 -2.887 -2.561 1.00 0.00 H new ATOM 0 HD13 ILE A 87 12.861 -2.728 -1.050 1.00 0.00 H new ATOM 1398 N GLN A 88 14.230 -7.755 -0.603 1.00 0.00 N ATOM 1399 CA GLN A 88 13.977 -9.132 -0.217 1.00 0.00 C ATOM 1400 C GLN A 88 13.932 -9.256 1.308 1.00 0.00 C ATOM 1401 O GLN A 88 13.506 -10.281 1.839 1.00 0.00 O ATOM 1402 CB GLN A 88 15.027 -10.071 -0.813 1.00 0.00 C ATOM 1403 CG GLN A 88 15.098 -9.920 -2.333 1.00 0.00 C ATOM 1404 CD GLN A 88 16.524 -10.145 -2.841 1.00 0.00 C ATOM 1405 OE1 GLN A 88 17.170 -11.134 -2.535 1.00 0.00 O ATOM 1406 NE2 GLN A 88 16.977 -9.175 -3.630 1.00 0.00 N ATOM 0 H GLN A 88 15.091 -7.612 -1.132 1.00 0.00 H new ATOM 0 HA GLN A 88 13.006 -9.428 -0.615 1.00 0.00 H new ATOM 0 HB2 GLN A 88 16.002 -9.855 -0.377 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.784 -11.102 -0.557 1.00 0.00 H new ATOM 0 HG2 GLN A 88 14.423 -10.634 -2.805 1.00 0.00 H new ATOM 0 HG3 GLN A 88 14.759 -8.924 -2.619 1.00 0.00 H new ATOM 0 HE21 GLN A 88 16.383 -8.374 -3.846 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.918 -9.232 -4.019 1.00 0.00 H new ATOM 1415 N GLU A 89 14.378 -8.198 1.969 1.00 0.00 N ATOM 1416 CA GLU A 89 14.394 -8.175 3.422 1.00 0.00 C ATOM 1417 C GLU A 89 13.338 -7.203 3.949 1.00 0.00 C ATOM 1418 O GLU A 89 13.312 -6.895 5.140 1.00 0.00 O ATOM 1419 CB GLU A 89 15.784 -7.814 3.949 1.00 0.00 C ATOM 1420 CG GLU A 89 16.722 -9.022 3.896 1.00 0.00 C ATOM 1421 CD GLU A 89 16.874 -9.658 5.279 1.00 0.00 C ATOM 1422 OE1 GLU A 89 17.130 -8.890 6.232 1.00 0.00 O ATOM 1423 OE2 GLU A 89 16.732 -10.898 5.352 1.00 0.00 O ATOM 0 H GLU A 89 14.731 -7.350 1.525 1.00 0.00 H new ATOM 0 HA GLU A 89 14.152 -9.174 3.785 1.00 0.00 H new ATOM 0 HB2 GLU A 89 16.201 -6.999 3.357 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.706 -7.455 4.975 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.333 -9.759 3.194 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.699 -8.713 3.525 1.00 0.00 H new ATOM 1430 N LEU A 90 12.492 -6.746 3.038 1.00 0.00 N ATOM 1431 CA LEU A 90 11.436 -5.814 3.396 1.00 0.00 C ATOM 1432 C LEU A 90 10.090 -6.542 3.371 1.00 0.00 C ATOM 1433 O LEU A 90 10.034 -7.742 3.106 1.00 0.00 O ATOM 1434 CB LEU A 90 11.484 -4.578 2.496 1.00 0.00 C ATOM 1435 CG LEU A 90 12.747 -3.721 2.600 1.00 0.00 C ATOM 1436 CD1 LEU A 90 12.644 -2.482 1.709 1.00 0.00 C ATOM 1437 CD2 LEU A 90 13.045 -3.358 4.056 1.00 0.00 C ATOM 0 H LEU A 90 12.516 -7.004 2.051 1.00 0.00 H new ATOM 0 HA LEU A 90 11.581 -5.445 4.411 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.373 -4.902 1.461 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.623 -3.951 2.728 1.00 0.00 H new ATOM 0 HG LEU A 90 13.590 -4.309 2.236 1.00 0.00 H new ATOM 0 HD11 LEU A 90 13.555 -1.890 1.802 1.00 0.00 H new ATOM 0 HD12 LEU A 90 12.515 -2.790 0.671 1.00 0.00 H new ATOM 0 HD13 LEU A 90 11.788 -1.882 2.018 1.00 0.00 H new ATOM 0 HD21 LEU A 90 13.948 -2.749 4.102 1.00 0.00 H new ATOM 0 HD22 LEU A 90 12.207 -2.797 4.470 1.00 0.00 H new ATOM 0 HD23 LEU A 90 13.193 -4.269 4.635 1.00 0.00 H new ATOM 1449 N ALA A 91 9.039 -5.785 3.651 1.00 0.00 N ATOM 1450 CA ALA A 91 7.698 -6.342 3.663 1.00 0.00 C ATOM 1451 C ALA A 91 6.685 -5.219 3.898 1.00 0.00 C ATOM 1452 O ALA A 91 6.779 -4.489 4.883 1.00 0.00 O ATOM 1453 CB ALA A 91 7.610 -7.437 4.728 1.00 0.00 C ATOM 0 H ALA A 91 9.090 -4.790 3.871 1.00 0.00 H new ATOM 0 HA ALA A 91 7.465 -6.801 2.702 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.604 -7.855 4.737 1.00 0.00 H new ATOM 0 HB2 ALA A 91 8.328 -8.225 4.500 1.00 0.00 H new ATOM 0 HB3 ALA A 91 7.835 -7.012 5.706 1.00 0.00 H new ATOM 1459 N LEU A 92 5.740 -5.115 2.975 1.00 0.00 N ATOM 1460 CA LEU A 92 4.712 -4.093 3.068 1.00 0.00 C ATOM 1461 C LEU A 92 3.525 -4.641 3.864 1.00 0.00 C ATOM 1462 O LEU A 92 3.111 -5.782 3.661 1.00 0.00 O ATOM 1463 CB LEU A 92 4.335 -3.583 1.676 1.00 0.00 C ATOM 1464 CG LEU A 92 5.501 -3.162 0.778 1.00 0.00 C ATOM 1465 CD1 LEU A 92 5.063 -3.080 -0.686 1.00 0.00 C ATOM 1466 CD2 LEU A 92 6.123 -1.852 1.265 1.00 0.00 C ATOM 0 H LEU A 92 5.665 -5.722 2.159 1.00 0.00 H new ATOM 0 HA LEU A 92 5.087 -3.224 3.609 1.00 0.00 H new ATOM 0 HB2 LEU A 92 3.772 -4.364 1.165 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.665 -2.731 1.792 1.00 0.00 H new ATOM 0 HG LEU A 92 6.274 -3.928 0.840 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.910 -2.779 -1.303 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.704 -4.056 -1.014 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.263 -2.347 -0.786 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.949 -1.576 0.610 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.370 -1.064 1.251 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.494 -1.981 2.282 1.00 0.00 H new ATOM 1478 N HIS A 93 3.012 -3.803 4.752 1.00 0.00 N ATOM 1479 CA HIS A 93 1.881 -4.190 5.579 1.00 0.00 C ATOM 1480 C HIS A 93 0.688 -3.283 5.273 1.00 0.00 C ATOM 1481 O HIS A 93 0.669 -2.119 5.672 1.00 0.00 O ATOM 1482 CB HIS A 93 2.264 -4.185 7.060 1.00 0.00 C ATOM 1483 CG HIS A 93 1.216 -4.784 7.968 1.00 0.00 C ATOM 1484 ND1 HIS A 93 0.569 -4.054 8.949 1.00 0.00 N ATOM 1485 CD2 HIS A 93 0.710 -6.049 8.031 1.00 0.00 C ATOM 1486 CE1 HIS A 93 -0.286 -4.853 9.570 1.00 0.00 C ATOM 1487 NE2 HIS A 93 -0.197 -6.089 9.000 1.00 0.00 N ATOM 0 H HIS A 93 3.358 -2.858 4.917 1.00 0.00 H new ATOM 0 HA HIS A 93 1.586 -5.213 5.343 1.00 0.00 H new ATOM 0 HB2 HIS A 93 3.196 -4.736 7.185 1.00 0.00 H new ATOM 0 HB3 HIS A 93 2.456 -3.158 7.372 1.00 0.00 H new ATOM 0 HD2 HIS A 93 0.998 -6.877 7.400 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.939 -4.575 10.384 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -0.738 -6.909 9.273 1.00 0.00 H new ATOM 1495 N PHE A 94 -0.280 -3.849 4.567 1.00 0.00 N ATOM 1496 CA PHE A 94 -1.474 -3.106 4.203 1.00 0.00 C ATOM 1497 C PHE A 94 -2.584 -3.311 5.236 1.00 0.00 C ATOM 1498 O PHE A 94 -3.091 -4.421 5.397 1.00 0.00 O ATOM 1499 CB PHE A 94 -1.945 -3.650 2.853 1.00 0.00 C ATOM 1500 CG PHE A 94 -0.966 -3.395 1.704 1.00 0.00 C ATOM 1501 CD1 PHE A 94 -0.474 -2.145 1.495 1.00 0.00 C ATOM 1502 CD2 PHE A 94 -0.588 -4.419 0.893 1.00 0.00 C ATOM 1503 CE1 PHE A 94 0.434 -1.908 0.429 1.00 0.00 C ATOM 1504 CE2 PHE A 94 0.320 -4.183 -0.173 1.00 0.00 C ATOM 1505 CZ PHE A 94 0.812 -2.932 -0.382 1.00 0.00 C ATOM 0 H PHE A 94 -0.261 -4.814 4.237 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.249 -2.040 4.157 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -2.112 -4.723 2.943 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -2.906 -3.198 2.606 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -0.774 -1.332 2.140 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.978 -5.412 1.060 1.00 0.00 H new ATOM 0 HE1 PHE A 94 0.824 -0.915 0.263 1.00 0.00 H new ATOM 0 HE2 PHE A 94 0.620 -4.996 -0.817 1.00 0.00 H new ATOM 0 HZ PHE A 94 1.503 -2.752 -1.192 1.00 0.00 H new ATOM 1515 N THR A 95 -2.929 -2.224 5.910 1.00 0.00 N ATOM 1516 CA THR A 95 -3.970 -2.271 6.924 1.00 0.00 C ATOM 1517 C THR A 95 -5.220 -1.534 6.439 1.00 0.00 C ATOM 1518 O THR A 95 -5.178 -0.330 6.189 1.00 0.00 O ATOM 1519 CB THR A 95 -3.393 -1.700 8.220 1.00 0.00 C ATOM 1520 OG1 THR A 95 -2.168 -2.407 8.397 1.00 0.00 O ATOM 1521 CG2 THR A 95 -4.223 -2.079 9.448 1.00 0.00 C ATOM 0 H THR A 95 -2.507 -1.305 5.774 1.00 0.00 H new ATOM 0 HA THR A 95 -4.289 -3.295 7.117 1.00 0.00 H new ATOM 0 HB THR A 95 -3.334 -0.614 8.143 1.00 0.00 H new ATOM 0 HG1 THR A 95 -1.727 -2.097 9.215 1.00 0.00 H new ATOM 0 HG21 THR A 95 -3.770 -1.648 10.341 1.00 0.00 H new ATOM 0 HG22 THR A 95 -5.237 -1.695 9.335 1.00 0.00 H new ATOM 0 HG23 THR A 95 -4.255 -3.164 9.545 1.00 0.00 H new ATOM 1529 N ILE A 96 -6.303 -2.288 6.319 1.00 0.00 N ATOM 1530 CA ILE A 96 -7.563 -1.722 5.869 1.00 0.00 C ATOM 1531 C ILE A 96 -8.331 -1.174 7.073 1.00 0.00 C ATOM 1532 O ILE A 96 -8.996 -1.925 7.784 1.00 0.00 O ATOM 1533 CB ILE A 96 -8.350 -2.749 5.053 1.00 0.00 C ATOM 1534 CG1 ILE A 96 -7.559 -3.195 3.822 1.00 0.00 C ATOM 1535 CG2 ILE A 96 -9.733 -2.210 4.681 1.00 0.00 C ATOM 1536 CD1 ILE A 96 -6.481 -4.212 4.202 1.00 0.00 C ATOM 0 H ILE A 96 -6.334 -3.286 6.526 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.385 -0.883 5.196 1.00 0.00 H new ATOM 0 HB ILE A 96 -8.504 -3.632 5.673 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -8.236 -3.634 3.090 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.096 -2.329 3.349 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.272 -2.960 4.101 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -10.291 -1.983 5.589 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -9.622 -1.303 4.087 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.933 -4.513 3.309 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.791 -3.762 4.916 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -6.949 -5.087 4.652 1.00 0.00 H new ATOM 1548 N LEU A 97 -8.213 0.132 7.265 1.00 0.00 N ATOM 1549 CA LEU A 97 -8.888 0.789 8.372 1.00 0.00 C ATOM 1550 C LEU A 97 -10.286 1.222 7.926 1.00 0.00 C ATOM 1551 O LEU A 97 -10.734 0.862 6.838 1.00 0.00 O ATOM 1552 CB LEU A 97 -8.033 1.936 8.915 1.00 0.00 C ATOM 1553 CG LEU A 97 -6.796 1.529 9.718 1.00 0.00 C ATOM 1554 CD1 LEU A 97 -7.142 1.336 11.196 1.00 0.00 C ATOM 1555 CD2 LEU A 97 -6.137 0.286 9.117 1.00 0.00 C ATOM 0 H LEU A 97 -7.661 0.752 6.673 1.00 0.00 H new ATOM 0 HA LEU A 97 -9.018 0.097 9.204 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -7.710 2.551 8.075 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -8.661 2.564 9.547 1.00 0.00 H new ATOM 0 HG LEU A 97 -6.069 2.339 9.660 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -6.246 1.047 11.745 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -7.532 2.269 11.603 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -7.895 0.554 11.294 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -5.260 0.018 9.707 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -6.846 -0.542 9.125 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -5.834 0.495 8.091 1.00 0.00 H new ATOM 1567 N SER A 98 -10.937 1.989 8.789 1.00 0.00 N ATOM 1568 CA SER A 98 -12.275 2.474 8.497 1.00 0.00 C ATOM 1569 C SER A 98 -12.526 3.791 9.235 1.00 0.00 C ATOM 1570 O SER A 98 -12.793 3.793 10.436 1.00 0.00 O ATOM 1571 CB SER A 98 -13.333 1.439 8.885 1.00 0.00 C ATOM 1572 OG SER A 98 -14.214 1.146 7.804 1.00 0.00 O ATOM 0 H SER A 98 -10.563 2.286 9.690 1.00 0.00 H new ATOM 0 HA SER A 98 -12.350 2.646 7.423 1.00 0.00 H new ATOM 0 HB2 SER A 98 -12.841 0.522 9.211 1.00 0.00 H new ATOM 0 HB3 SER A 98 -13.910 1.810 9.732 1.00 0.00 H new ATOM 0 HG SER A 98 -14.980 1.756 7.832 1.00 0.00 H new ATOM 1701 N ASP A 106 -10.117 1.877 13.269 1.00 0.00 N ATOM 1702 CA ASP A 106 -10.833 0.613 13.258 1.00 0.00 C ATOM 1703 C ASP A 106 -10.299 -0.261 12.122 1.00 0.00 C ATOM 1704 O ASP A 106 -10.879 -0.300 11.038 1.00 0.00 O ATOM 1705 CB ASP A 106 -12.329 0.829 13.025 1.00 0.00 C ATOM 1706 CG ASP A 106 -13.172 0.947 14.297 1.00 0.00 C ATOM 1707 OD1 ASP A 106 -12.574 0.822 15.387 1.00 0.00 O ATOM 1708 OD2 ASP A 106 -14.395 1.161 14.150 1.00 0.00 O ATOM 0 HA ASP A 106 -10.685 0.133 14.226 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -12.462 1.735 12.434 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -12.712 0.000 12.429 1.00 0.00 H new ATOM 1713 N ILE A 107 -9.198 -0.941 12.409 1.00 0.00 N ATOM 1714 CA ILE A 107 -8.579 -1.813 11.424 1.00 0.00 C ATOM 1715 C ILE A 107 -9.571 -2.905 11.021 1.00 0.00 C ATOM 1716 O ILE A 107 -9.816 -3.839 11.783 1.00 0.00 O ATOM 1717 CB ILE A 107 -7.248 -2.354 11.950 1.00 0.00 C ATOM 1718 CG1 ILE A 107 -6.306 -1.212 12.335 1.00 0.00 C ATOM 1719 CG2 ILE A 107 -6.608 -3.309 10.940 1.00 0.00 C ATOM 1720 CD1 ILE A 107 -5.224 -1.697 13.303 1.00 0.00 C ATOM 0 H ILE A 107 -8.719 -0.906 13.309 1.00 0.00 H new ATOM 0 HA ILE A 107 -8.335 -1.255 10.520 1.00 0.00 H new ATOM 0 HB ILE A 107 -7.446 -2.927 12.856 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -5.840 -0.802 11.439 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -6.876 -0.405 12.796 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -5.663 -3.680 11.338 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -7.279 -4.148 10.757 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -6.425 -2.780 10.005 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -4.568 -0.866 13.561 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -5.692 -2.084 14.208 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -4.640 -2.487 12.830 1.00 0.00 H new ATOM 1732 N ILE A 108 -10.116 -2.752 9.823 1.00 0.00 N ATOM 1733 CA ILE A 108 -11.076 -3.714 9.309 1.00 0.00 C ATOM 1734 C ILE A 108 -10.388 -5.069 9.129 1.00 0.00 C ATOM 1735 O ILE A 108 -10.948 -6.106 9.480 1.00 0.00 O ATOM 1736 CB ILE A 108 -11.735 -3.185 8.033 1.00 0.00 C ATOM 1737 CG1 ILE A 108 -12.643 -1.993 8.340 1.00 0.00 C ATOM 1738 CG2 ILE A 108 -12.481 -4.300 7.298 1.00 0.00 C ATOM 1739 CD1 ILE A 108 -12.999 -1.232 7.061 1.00 0.00 C ATOM 0 H ILE A 108 -9.911 -1.976 9.193 1.00 0.00 H new ATOM 0 HA ILE A 108 -11.887 -3.860 10.022 1.00 0.00 H new ATOM 0 HB ILE A 108 -10.951 -2.829 7.365 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -13.554 -2.341 8.826 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -12.145 -1.322 9.040 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -12.940 -3.897 6.395 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -11.780 -5.090 7.027 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -13.255 -4.709 7.947 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -13.645 -0.389 7.307 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -12.087 -0.865 6.590 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -13.519 -1.899 6.373 1.00 0.00 H new ATOM 1751 N GLY A 109 -9.182 -5.016 8.581 1.00 0.00 N ATOM 1752 CA GLY A 109 -8.411 -6.226 8.350 1.00 0.00 C ATOM 1753 C GLY A 109 -6.918 -5.912 8.243 1.00 0.00 C ATOM 1754 O GLY A 109 -6.518 -4.750 8.296 1.00 0.00 O ATOM 0 H GLY A 109 -8.720 -4.154 8.290 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -8.581 -6.931 9.164 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -8.751 -6.709 7.434 1.00 0.00 H new ATOM 1758 N GLU A 110 -6.133 -6.969 8.093 1.00 0.00 N ATOM 1759 CA GLU A 110 -4.692 -6.821 7.978 1.00 0.00 C ATOM 1760 C GLU A 110 -4.177 -7.577 6.751 1.00 0.00 C ATOM 1761 O GLU A 110 -4.640 -8.678 6.457 1.00 0.00 O ATOM 1762 CB GLU A 110 -3.988 -7.297 9.250 1.00 0.00 C ATOM 1763 CG GLU A 110 -4.114 -6.260 10.368 1.00 0.00 C ATOM 1764 CD GLU A 110 -3.155 -6.573 11.518 1.00 0.00 C ATOM 1765 OE1 GLU A 110 -1.959 -6.781 11.219 1.00 0.00 O ATOM 1766 OE2 GLU A 110 -3.639 -6.598 12.670 1.00 0.00 O ATOM 0 H GLU A 110 -6.468 -7.931 8.048 1.00 0.00 H new ATOM 0 HA GLU A 110 -4.465 -5.763 7.851 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.420 -8.243 9.576 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -2.935 -7.483 9.039 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -3.901 -5.267 9.973 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -5.139 -6.243 10.739 1.00 0.00 H new ATOM 1773 N VAL A 111 -3.227 -6.955 6.069 1.00 0.00 N ATOM 1774 CA VAL A 111 -2.644 -7.556 4.881 1.00 0.00 C ATOM 1775 C VAL A 111 -1.125 -7.376 4.916 1.00 0.00 C ATOM 1776 O VAL A 111 -0.629 -6.348 5.374 1.00 0.00 O ATOM 1777 CB VAL A 111 -3.288 -6.962 3.626 1.00 0.00 C ATOM 1778 CG1 VAL A 111 -2.355 -7.089 2.419 1.00 0.00 C ATOM 1779 CG2 VAL A 111 -4.642 -7.615 3.343 1.00 0.00 C ATOM 0 H VAL A 111 -2.846 -6.041 6.316 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.843 -8.627 4.857 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.459 -5.901 3.807 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.836 -6.659 1.540 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.425 -6.557 2.620 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.138 -8.141 2.236 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -5.078 -7.175 2.446 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -4.505 -8.686 3.192 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.309 -7.450 4.189 1.00 0.00 H new ATOM 1789 N LEU A 112 -0.430 -8.391 4.426 1.00 0.00 N ATOM 1790 CA LEU A 112 1.023 -8.358 4.396 1.00 0.00 C ATOM 1791 C LEU A 112 1.513 -8.892 3.048 1.00 0.00 C ATOM 1792 O LEU A 112 0.879 -9.763 2.454 1.00 0.00 O ATOM 1793 CB LEU A 112 1.601 -9.104 5.600 1.00 0.00 C ATOM 1794 CG LEU A 112 3.127 -9.116 5.712 1.00 0.00 C ATOM 1795 CD1 LEU A 112 3.638 -7.838 6.379 1.00 0.00 C ATOM 1796 CD2 LEU A 112 3.614 -10.374 6.435 1.00 0.00 C ATOM 0 H LEU A 112 -0.845 -9.242 4.046 1.00 0.00 H new ATOM 0 HA LEU A 112 1.383 -7.333 4.483 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.193 -8.659 6.508 1.00 0.00 H new ATOM 0 HB3 LEU A 112 1.251 -10.136 5.565 1.00 0.00 H new ATOM 0 HG LEU A 112 3.543 -9.142 4.705 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.725 -7.872 6.446 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.338 -6.974 5.787 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.215 -7.756 7.380 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.702 -10.358 6.501 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.190 -10.404 7.439 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.298 -11.258 5.881 1.00 0.00 H new ATOM 1808 N ILE A 113 2.636 -8.347 2.605 1.00 0.00 N ATOM 1809 CA ILE A 113 3.219 -8.758 1.339 1.00 0.00 C ATOM 1810 C ILE A 113 4.744 -8.706 1.443 1.00 0.00 C ATOM 1811 O ILE A 113 5.348 -7.651 1.255 1.00 0.00 O ATOM 1812 CB ILE A 113 2.652 -7.919 0.191 1.00 0.00 C ATOM 1813 CG1 ILE A 113 2.675 -8.701 -1.123 1.00 0.00 C ATOM 1814 CG2 ILE A 113 3.387 -6.582 0.075 1.00 0.00 C ATOM 1815 CD1 ILE A 113 1.388 -9.510 -1.302 1.00 0.00 C ATOM 0 H ILE A 113 3.158 -7.624 3.100 1.00 0.00 H new ATOM 0 HA ILE A 113 2.950 -9.790 1.113 1.00 0.00 H new ATOM 0 HB ILE A 113 1.609 -7.695 0.414 1.00 0.00 H new ATOM 0 HG12 ILE A 113 2.795 -8.012 -1.959 1.00 0.00 H new ATOM 0 HG13 ILE A 113 3.535 -9.371 -1.137 1.00 0.00 H new ATOM 0 HG21 ILE A 113 2.965 -6.005 -0.748 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.275 -6.024 1.004 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.445 -6.764 -0.114 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.430 -10.057 -2.244 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.284 -10.215 -0.477 1.00 0.00 H new ATOM 0 HD13 ILE A 113 0.532 -8.835 -1.312 1.00 0.00 H new ATOM 1827 N PRO A 114 5.339 -9.890 1.751 1.00 0.00 N ATOM 1828 CA PRO A 114 6.783 -9.989 1.883 1.00 0.00 C ATOM 1829 C PRO A 114 7.462 -9.965 0.512 1.00 0.00 C ATOM 1830 O PRO A 114 7.206 -10.828 -0.327 1.00 0.00 O ATOM 1831 CB PRO A 114 7.020 -11.286 2.640 1.00 0.00 C ATOM 1832 CG PRO A 114 5.740 -12.092 2.497 1.00 0.00 C ATOM 1833 CD PRO A 114 4.657 -11.159 1.981 1.00 0.00 C ATOM 0 HA PRO A 114 7.215 -9.145 2.420 1.00 0.00 H new ATOM 0 HB2 PRO A 114 7.871 -11.828 2.228 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.243 -11.091 3.689 1.00 0.00 H new ATOM 0 HG2 PRO A 114 5.888 -12.924 1.808 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.450 -12.520 3.456 1.00 0.00 H new ATOM 0 HD2 PRO A 114 4.210 -11.540 1.063 1.00 0.00 H new ATOM 0 HD3 PRO A 114 3.851 -11.049 2.706 1.00 0.00 H new ATOM 1841 N LEU A 115 8.314 -8.968 0.327 1.00 0.00 N ATOM 1842 CA LEU A 115 9.031 -8.819 -0.928 1.00 0.00 C ATOM 1843 C LEU A 115 10.181 -9.827 -0.975 1.00 0.00 C ATOM 1844 O LEU A 115 10.945 -9.859 -1.939 1.00 0.00 O ATOM 1845 CB LEU A 115 9.477 -7.369 -1.123 1.00 0.00 C ATOM 1846 CG LEU A 115 8.441 -6.297 -0.776 1.00 0.00 C ATOM 1847 CD1 LEU A 115 9.014 -4.894 -0.983 1.00 0.00 C ATOM 1848 CD2 LEU A 115 7.147 -6.510 -1.563 1.00 0.00 C ATOM 0 H LEU A 115 8.524 -8.255 1.025 1.00 0.00 H new ATOM 0 HA LEU A 115 8.375 -9.042 -1.770 1.00 0.00 H new ATOM 0 HB2 LEU A 115 10.365 -7.198 -0.515 1.00 0.00 H new ATOM 0 HB3 LEU A 115 9.773 -7.237 -2.164 1.00 0.00 H new ATOM 0 HG LEU A 115 8.193 -6.391 0.281 1.00 0.00 H new ATOM 0 HD11 LEU A 115 8.258 -4.151 -0.729 1.00 0.00 H new ATOM 0 HD12 LEU A 115 9.885 -4.759 -0.342 1.00 0.00 H new ATOM 0 HD13 LEU A 115 9.308 -4.771 -2.025 1.00 0.00 H new ATOM 0 HD21 LEU A 115 6.428 -5.735 -1.298 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.358 -6.459 -2.631 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.731 -7.488 -1.322 1.00 0.00 H new ATOM 1860 N SER A 116 10.269 -10.626 0.078 1.00 0.00 N ATOM 1861 CA SER A 116 11.313 -11.632 0.170 1.00 0.00 C ATOM 1862 C SER A 116 11.151 -12.658 -0.954 1.00 0.00 C ATOM 1863 O SER A 116 10.399 -13.621 -0.817 1.00 0.00 O ATOM 1864 CB SER A 116 11.289 -12.329 1.531 1.00 0.00 C ATOM 1865 OG SER A 116 12.237 -13.392 1.604 1.00 0.00 O ATOM 0 H SER A 116 9.634 -10.597 0.875 1.00 0.00 H new ATOM 0 HA SER A 116 12.277 -11.134 0.064 1.00 0.00 H new ATOM 0 HB2 SER A 116 11.499 -11.601 2.315 1.00 0.00 H new ATOM 0 HB3 SER A 116 10.290 -12.721 1.720 1.00 0.00 H new ATOM 0 HG SER A 116 12.192 -13.811 2.489 1.00 0.00 H new ATOM 1871 N GLY A 117 11.870 -12.416 -2.041 1.00 0.00 N ATOM 1872 CA GLY A 117 11.816 -13.307 -3.188 1.00 0.00 C ATOM 1873 C GLY A 117 11.243 -12.589 -4.412 1.00 0.00 C ATOM 1874 O GLY A 117 11.529 -12.967 -5.547 1.00 0.00 O ATOM 0 H GLY A 117 12.493 -11.616 -2.151 1.00 0.00 H new ATOM 0 HA2 GLY A 117 12.816 -13.677 -3.414 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.202 -14.175 -2.950 1.00 0.00 H new ATOM 1878 N ILE A 118 10.444 -11.568 -4.140 1.00 0.00 N ATOM 1879 CA ILE A 118 9.828 -10.795 -5.205 1.00 0.00 C ATOM 1880 C ILE A 118 10.918 -10.078 -6.004 1.00 0.00 C ATOM 1881 O ILE A 118 11.889 -9.583 -5.432 1.00 0.00 O ATOM 1882 CB ILE A 118 8.763 -9.855 -4.637 1.00 0.00 C ATOM 1883 CG1 ILE A 118 7.631 -10.644 -3.976 1.00 0.00 C ATOM 1884 CG2 ILE A 118 8.243 -8.901 -5.715 1.00 0.00 C ATOM 1885 CD1 ILE A 118 6.278 -9.975 -4.225 1.00 0.00 C ATOM 0 H ILE A 118 10.209 -11.258 -3.197 1.00 0.00 H new ATOM 0 HA ILE A 118 9.303 -11.452 -5.899 1.00 0.00 H new ATOM 0 HB ILE A 118 9.225 -9.244 -3.861 1.00 0.00 H new ATOM 0 HG12 ILE A 118 7.615 -11.661 -4.367 1.00 0.00 H new ATOM 0 HG13 ILE A 118 7.812 -10.718 -2.904 1.00 0.00 H new ATOM 0 HG21 ILE A 118 7.487 -8.244 -5.285 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.068 -8.302 -6.100 1.00 0.00 H new ATOM 0 HG23 ILE A 118 7.803 -9.477 -6.529 1.00 0.00 H new ATOM 0 HD11 ILE A 118 5.491 -10.556 -3.744 1.00 0.00 H new ATOM 0 HD12 ILE A 118 6.289 -8.967 -3.811 1.00 0.00 H new ATOM 0 HD13 ILE A 118 6.089 -9.925 -5.297 1.00 0.00 H new ATOM 1897 N GLU A 119 10.722 -10.045 -7.314 1.00 0.00 N ATOM 1898 CA GLU A 119 11.676 -9.396 -8.197 1.00 0.00 C ATOM 1899 C GLU A 119 10.979 -8.325 -9.038 1.00 0.00 C ATOM 1900 O GLU A 119 9.899 -8.560 -9.578 1.00 0.00 O ATOM 1901 CB GLU A 119 12.381 -10.420 -9.090 1.00 0.00 C ATOM 1902 CG GLU A 119 11.508 -10.795 -10.289 1.00 0.00 C ATOM 1903 CD GLU A 119 11.904 -9.988 -11.528 1.00 0.00 C ATOM 1904 OE1 GLU A 119 11.718 -8.752 -11.483 1.00 0.00 O ATOM 1905 OE2 GLU A 119 12.383 -10.624 -12.491 1.00 0.00 O ATOM 0 H GLU A 119 9.917 -10.457 -7.785 1.00 0.00 H new ATOM 0 HA GLU A 119 12.436 -8.911 -7.584 1.00 0.00 H new ATOM 0 HB2 GLU A 119 13.329 -10.011 -9.440 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.613 -11.314 -8.511 1.00 0.00 H new ATOM 0 HG2 GLU A 119 11.608 -11.860 -10.497 1.00 0.00 H new ATOM 0 HG3 GLU A 119 10.460 -10.613 -10.052 1.00 0.00 H new ATOM 1912 N LEU A 120 11.624 -7.171 -9.122 1.00 0.00 N ATOM 1913 CA LEU A 120 11.079 -6.063 -9.887 1.00 0.00 C ATOM 1914 C LEU A 120 12.069 -5.671 -10.986 1.00 0.00 C ATOM 1915 O LEU A 120 11.961 -4.594 -11.570 1.00 0.00 O ATOM 1916 CB LEU A 120 10.700 -4.906 -8.960 1.00 0.00 C ATOM 1917 CG LEU A 120 9.687 -5.232 -7.861 1.00 0.00 C ATOM 1918 CD1 LEU A 120 9.917 -4.357 -6.627 1.00 0.00 C ATOM 1919 CD2 LEU A 120 8.254 -5.118 -8.385 1.00 0.00 C ATOM 0 H LEU A 120 12.519 -6.979 -8.673 1.00 0.00 H new ATOM 0 HA LEU A 120 10.154 -6.361 -10.382 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.609 -4.531 -8.489 1.00 0.00 H new ATOM 0 HB3 LEU A 120 10.298 -4.096 -9.568 1.00 0.00 H new ATOM 0 HG LEU A 120 9.836 -6.267 -7.555 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.184 -4.609 -5.861 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.921 -4.531 -6.240 1.00 0.00 H new ATOM 0 HD13 LEU A 120 9.810 -3.307 -6.900 1.00 0.00 H new ATOM 0 HD21 LEU A 120 7.554 -5.355 -7.584 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.074 -4.102 -8.735 1.00 0.00 H new ATOM 0 HD23 LEU A 120 8.112 -5.816 -9.210 1.00 0.00 H new ATOM 1931 N SER A 121 13.013 -6.568 -11.234 1.00 0.00 N ATOM 1932 CA SER A 121 14.022 -6.330 -12.252 1.00 0.00 C ATOM 1933 C SER A 121 13.351 -6.031 -13.594 1.00 0.00 C ATOM 1934 O SER A 121 13.708 -5.067 -14.270 1.00 0.00 O ATOM 1935 CB SER A 121 14.964 -7.528 -12.385 1.00 0.00 C ATOM 1936 OG SER A 121 16.331 -7.128 -12.444 1.00 0.00 O ATOM 0 H SER A 121 13.100 -7.460 -10.747 1.00 0.00 H new ATOM 0 HA SER A 121 14.616 -5.467 -11.950 1.00 0.00 H new ATOM 0 HB2 SER A 121 14.819 -8.199 -11.539 1.00 0.00 H new ATOM 0 HB3 SER A 121 14.711 -8.090 -13.284 1.00 0.00 H new ATOM 0 HG SER A 121 16.901 -7.921 -12.527 1.00 0.00 H new ATOM 1942 N GLU A 122 12.390 -6.875 -13.940 1.00 0.00 N ATOM 1943 CA GLU A 122 11.666 -6.714 -15.190 1.00 0.00 C ATOM 1944 C GLU A 122 10.993 -5.340 -15.239 1.00 0.00 C ATOM 1945 O GLU A 122 11.143 -4.606 -16.214 1.00 0.00 O ATOM 1946 CB GLU A 122 10.641 -7.834 -15.378 1.00 0.00 C ATOM 1947 CG GLU A 122 11.201 -8.945 -16.268 1.00 0.00 C ATOM 1948 CD GLU A 122 10.257 -9.241 -17.435 1.00 0.00 C ATOM 1949 OE1 GLU A 122 9.101 -9.620 -17.148 1.00 0.00 O ATOM 1950 OE2 GLU A 122 10.713 -9.080 -18.588 1.00 0.00 O ATOM 0 H GLU A 122 12.096 -7.673 -13.377 1.00 0.00 H new ATOM 0 HA GLU A 122 12.379 -6.778 -16.012 1.00 0.00 H new ATOM 0 HB2 GLU A 122 10.364 -8.245 -14.407 1.00 0.00 H new ATOM 0 HB3 GLU A 122 9.732 -7.429 -15.824 1.00 0.00 H new ATOM 0 HG2 GLU A 122 12.178 -8.651 -16.652 1.00 0.00 H new ATOM 0 HG3 GLU A 122 11.349 -9.849 -15.677 1.00 0.00 H new ATOM 1957 N GLY A 123 10.265 -5.035 -14.175 1.00 0.00 N ATOM 1958 CA GLY A 123 9.568 -3.763 -14.085 1.00 0.00 C ATOM 1959 C GLY A 123 8.529 -3.785 -12.961 1.00 0.00 C ATOM 1960 O GLY A 123 8.780 -4.335 -11.890 1.00 0.00 O ATOM 0 H GLY A 123 10.143 -5.647 -13.368 1.00 0.00 H new ATOM 0 HA2 GLY A 123 10.286 -2.963 -13.906 1.00 0.00 H new ATOM 0 HA3 GLY A 123 9.078 -3.545 -15.034 1.00 0.00 H new ATOM 1964 N LYS A 124 7.385 -3.181 -13.245 1.00 0.00 N ATOM 1965 CA LYS A 124 6.307 -3.124 -12.272 1.00 0.00 C ATOM 1966 C LYS A 124 5.418 -4.359 -12.430 1.00 0.00 C ATOM 1967 O LYS A 124 5.234 -4.857 -13.540 1.00 0.00 O ATOM 1968 CB LYS A 124 5.549 -1.800 -12.389 1.00 0.00 C ATOM 1969 CG LYS A 124 4.360 -1.763 -11.427 1.00 0.00 C ATOM 1970 CD LYS A 124 3.423 -0.600 -11.759 1.00 0.00 C ATOM 1971 CE LYS A 124 3.578 0.535 -10.745 1.00 0.00 C ATOM 1972 NZ LYS A 124 4.218 1.711 -11.377 1.00 0.00 N ATOM 0 H LYS A 124 7.181 -2.727 -14.135 1.00 0.00 H new ATOM 0 HA LYS A 124 6.707 -3.146 -11.258 1.00 0.00 H new ATOM 0 HB2 LYS A 124 6.223 -0.971 -12.173 1.00 0.00 H new ATOM 0 HB3 LYS A 124 5.198 -1.667 -13.412 1.00 0.00 H new ATOM 0 HG2 LYS A 124 3.812 -2.704 -11.484 1.00 0.00 H new ATOM 0 HG3 LYS A 124 4.719 -1.664 -10.403 1.00 0.00 H new ATOM 0 HD2 LYS A 124 3.639 -0.229 -12.761 1.00 0.00 H new ATOM 0 HD3 LYS A 124 2.391 -0.950 -11.764 1.00 0.00 H new ATOM 0 HE2 LYS A 124 2.601 0.814 -10.350 1.00 0.00 H new ATOM 0 HE3 LYS A 124 4.179 0.197 -9.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 4.316 2.472 -10.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 5.158 1.445 -11.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 3.630 2.043 -12.168 1.00 0.00 H new ATOM 1986 N MET A 125 4.890 -4.816 -11.305 1.00 0.00 N ATOM 1987 CA MET A 125 4.024 -5.983 -11.305 1.00 0.00 C ATOM 1988 C MET A 125 2.760 -5.728 -10.480 1.00 0.00 C ATOM 1989 O MET A 125 2.782 -4.947 -9.530 1.00 0.00 O ATOM 1990 CB MET A 125 4.780 -7.180 -10.724 1.00 0.00 C ATOM 1991 CG MET A 125 4.952 -7.038 -9.211 1.00 0.00 C ATOM 1992 SD MET A 125 5.502 -8.585 -8.511 1.00 0.00 S ATOM 1993 CE MET A 125 7.181 -8.619 -9.117 1.00 0.00 C ATOM 0 H MET A 125 5.045 -4.400 -10.387 1.00 0.00 H new ATOM 0 HA MET A 125 3.728 -6.193 -12.333 1.00 0.00 H new ATOM 0 HB2 MET A 125 4.239 -8.100 -10.947 1.00 0.00 H new ATOM 0 HB3 MET A 125 5.758 -7.262 -11.199 1.00 0.00 H new ATOM 0 HG2 MET A 125 5.675 -6.252 -8.991 1.00 0.00 H new ATOM 0 HG3 MET A 125 4.008 -6.739 -8.756 1.00 0.00 H new ATOM 0 HE1 MET A 125 7.576 -9.632 -9.038 1.00 0.00 H new ATOM 0 HE2 MET A 125 7.198 -8.304 -10.160 1.00 0.00 H new ATOM 0 HE3 MET A 125 7.796 -7.942 -8.524 1.00 0.00 H new ATOM 2003 N LEU A 126 1.689 -6.402 -10.874 1.00 0.00 N ATOM 2004 CA LEU A 126 0.419 -6.258 -10.183 1.00 0.00 C ATOM 2005 C LEU A 126 0.248 -7.414 -9.195 1.00 0.00 C ATOM 2006 O LEU A 126 0.585 -8.555 -9.504 1.00 0.00 O ATOM 2007 CB LEU A 126 -0.727 -6.135 -11.190 1.00 0.00 C ATOM 2008 CG LEU A 126 -1.923 -5.291 -10.743 1.00 0.00 C ATOM 2009 CD1 LEU A 126 -2.582 -5.890 -9.500 1.00 0.00 C ATOM 2010 CD2 LEU A 126 -1.516 -3.832 -10.530 1.00 0.00 C ATOM 0 H LEU A 126 1.675 -7.049 -11.663 1.00 0.00 H new ATOM 0 HA LEU A 126 0.403 -5.336 -9.602 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -0.331 -5.709 -12.112 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.083 -7.137 -11.429 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.667 -5.304 -11.540 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.429 -5.271 -9.203 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -2.930 -6.899 -9.723 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -1.858 -5.928 -8.686 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.384 -3.255 -10.213 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.744 -3.778 -9.762 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.129 -3.422 -11.463 1.00 0.00 H new ATOM 2022 N MET A 127 -0.276 -7.077 -8.026 1.00 0.00 N ATOM 2023 CA MET A 127 -0.497 -8.072 -6.990 1.00 0.00 C ATOM 2024 C MET A 127 -1.783 -7.780 -6.215 1.00 0.00 C ATOM 2025 O MET A 127 -2.193 -6.627 -6.095 1.00 0.00 O ATOM 2026 CB MET A 127 0.691 -8.076 -6.025 1.00 0.00 C ATOM 2027 CG MET A 127 1.991 -8.410 -6.759 1.00 0.00 C ATOM 2028 SD MET A 127 2.966 -9.546 -5.787 1.00 0.00 S ATOM 2029 CE MET A 127 3.041 -8.650 -4.245 1.00 0.00 C ATOM 0 H MET A 127 -0.554 -6.129 -7.773 1.00 0.00 H new ATOM 0 HA MET A 127 -0.595 -9.048 -7.465 1.00 0.00 H new ATOM 0 HB2 MET A 127 0.779 -7.100 -5.547 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.519 -8.805 -5.233 1.00 0.00 H new ATOM 0 HG2 MET A 127 1.767 -8.850 -7.731 1.00 0.00 H new ATOM 0 HG3 MET A 127 2.558 -7.498 -6.945 1.00 0.00 H new ATOM 0 HE1 MET A 127 3.889 -9.004 -3.659 1.00 0.00 H new ATOM 0 HE2 MET A 127 3.160 -7.586 -4.448 1.00 0.00 H new ATOM 0 HE3 MET A 127 2.120 -8.812 -3.685 1.00 0.00 H new ATOM 2039 N ASN A 128 -2.385 -8.846 -5.707 1.00 0.00 N ATOM 2040 CA ASN A 128 -3.617 -8.719 -4.947 1.00 0.00 C ATOM 2041 C ASN A 128 -3.531 -9.595 -3.695 1.00 0.00 C ATOM 2042 O ASN A 128 -2.946 -10.677 -3.729 1.00 0.00 O ATOM 2043 CB ASN A 128 -4.821 -9.184 -5.767 1.00 0.00 C ATOM 2044 CG ASN A 128 -4.456 -10.383 -6.646 1.00 0.00 C ATOM 2045 OD1 ASN A 128 -3.821 -10.257 -7.680 1.00 0.00 O ATOM 2046 ND2 ASN A 128 -4.893 -11.549 -6.179 1.00 0.00 N ATOM 0 H ASN A 128 -2.042 -9.801 -5.807 1.00 0.00 H new ATOM 0 HA ASN A 128 -3.744 -7.669 -4.684 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.638 -9.454 -5.098 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.178 -8.365 -6.392 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -4.702 -12.409 -6.694 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -5.419 -11.584 -5.306 1.00 0.00 H new ATOM 2053 N ARG A 129 -4.122 -9.095 -2.620 1.00 0.00 N ATOM 2054 CA ARG A 129 -4.119 -9.819 -1.360 1.00 0.00 C ATOM 2055 C ARG A 129 -5.523 -9.830 -0.752 1.00 0.00 C ATOM 2056 O ARG A 129 -6.276 -8.868 -0.901 1.00 0.00 O ATOM 2057 CB ARG A 129 -3.144 -9.188 -0.364 1.00 0.00 C ATOM 2058 CG ARG A 129 -1.769 -9.854 -0.446 1.00 0.00 C ATOM 2059 CD ARG A 129 -1.834 -11.305 0.034 1.00 0.00 C ATOM 2060 NE ARG A 129 -0.865 -12.131 -0.721 1.00 0.00 N ATOM 2061 CZ ARG A 129 -0.823 -13.470 -0.676 1.00 0.00 C ATOM 2062 NH1 ARG A 129 -1.695 -14.142 0.088 1.00 0.00 N ATOM 2063 NH2 ARG A 129 0.091 -14.136 -1.394 1.00 0.00 N ATOM 0 H ARG A 129 -4.606 -8.198 -2.595 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.800 -10.841 -1.565 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -3.048 -8.122 -0.569 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -3.539 -9.284 0.647 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.406 -9.823 -1.473 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -1.055 -9.298 0.161 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -1.614 -11.354 1.100 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -2.842 -11.697 -0.102 1.00 0.00 H new ATOM 0 HE ARG A 129 -0.187 -11.651 -1.313 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -2.390 -13.635 0.635 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -1.663 -15.161 0.122 1.00 0.00 H new ATOM 0 HH21 ARG A 129 0.755 -13.624 -1.975 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.123 -15.155 -1.360 1.00 0.00 H new ATOM 2077 N GLU A 130 -5.833 -10.928 -0.078 1.00 0.00 N ATOM 2078 CA GLU A 130 -7.133 -11.077 0.554 1.00 0.00 C ATOM 2079 C GLU A 130 -7.107 -10.489 1.966 1.00 0.00 C ATOM 2080 O GLU A 130 -6.107 -10.608 2.673 1.00 0.00 O ATOM 2081 CB GLU A 130 -7.566 -12.544 0.578 1.00 0.00 C ATOM 2082 CG GLU A 130 -6.911 -13.290 1.742 1.00 0.00 C ATOM 2083 CD GLU A 130 -6.442 -14.680 1.307 1.00 0.00 C ATOM 2084 OE1 GLU A 130 -5.708 -14.742 0.297 1.00 0.00 O ATOM 2085 OE2 GLU A 130 -6.828 -15.650 1.995 1.00 0.00 O ATOM 0 H GLU A 130 -5.206 -11.723 0.044 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.867 -10.526 -0.034 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.651 -12.605 0.666 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.295 -13.022 -0.363 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.063 -12.716 2.115 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.620 -13.382 2.565 1.00 0.00 H new ATOM 2092 N ILE A 131 -8.218 -9.869 2.335 1.00 0.00 N ATOM 2093 CA ILE A 131 -8.335 -9.263 3.651 1.00 0.00 C ATOM 2094 C ILE A 131 -9.153 -10.182 4.560 1.00 0.00 C ATOM 2095 O ILE A 131 -10.309 -10.482 4.266 1.00 0.00 O ATOM 2096 CB ILE A 131 -8.901 -7.845 3.539 1.00 0.00 C ATOM 2097 CG1 ILE A 131 -7.958 -6.940 2.744 1.00 0.00 C ATOM 2098 CG2 ILE A 131 -9.217 -7.271 4.921 1.00 0.00 C ATOM 2099 CD1 ILE A 131 -8.724 -6.153 1.678 1.00 0.00 C ATOM 0 H ILE A 131 -9.045 -9.773 1.746 1.00 0.00 H new ATOM 0 HA ILE A 131 -7.352 -9.154 4.109 1.00 0.00 H new ATOM 0 HB ILE A 131 -9.840 -7.894 2.988 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -7.455 -6.249 3.420 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -7.183 -7.543 2.270 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -9.618 -6.263 4.813 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -9.953 -7.903 5.418 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -8.306 -7.237 5.518 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -8.031 -5.517 1.127 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -9.206 -6.847 0.989 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -9.482 -5.533 2.158 1.00 0.00 H new ATOM 2111 N ILE A 132 -8.521 -10.603 5.645 1.00 0.00 N ATOM 2112 CA ILE A 132 -9.175 -11.482 6.599 1.00 0.00 C ATOM 2113 C ILE A 132 -8.913 -10.973 8.018 1.00 0.00 C ATOM 2114 O ILE A 132 -8.355 -9.892 8.201 1.00 0.00 O ATOM 2115 CB ILE A 132 -8.743 -12.932 6.376 1.00 0.00 C ATOM 2116 CG1 ILE A 132 -7.246 -13.017 6.070 1.00 0.00 C ATOM 2117 CG2 ILE A 132 -9.588 -13.596 5.287 1.00 0.00 C ATOM 2118 CD1 ILE A 132 -6.413 -12.661 7.304 1.00 0.00 C ATOM 0 H ILE A 132 -7.562 -10.352 5.885 1.00 0.00 H new ATOM 0 HA ILE A 132 -10.255 -11.470 6.450 1.00 0.00 H new ATOM 0 HB ILE A 132 -8.916 -13.485 7.299 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -6.996 -14.024 5.736 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -6.999 -12.340 5.252 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -9.259 -14.626 5.149 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.637 -13.586 5.584 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -9.471 -13.049 4.351 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -5.353 -12.729 7.059 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -6.648 -11.645 7.621 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -6.644 -13.355 8.112 1.00 0.00 H new ATOM 2130 N SER A 133 -9.329 -11.776 8.986 1.00 0.00 N ATOM 2131 CA SER A 133 -9.146 -11.421 10.383 1.00 0.00 C ATOM 2132 C SER A 133 -7.772 -11.889 10.867 1.00 0.00 C ATOM 2133 O SER A 133 -7.667 -12.884 11.583 1.00 0.00 O ATOM 2134 CB SER A 133 -10.249 -12.025 11.254 1.00 0.00 C ATOM 2135 OG SER A 133 -10.063 -11.726 12.635 1.00 0.00 O ATOM 0 H SER A 133 -9.792 -12.671 8.831 1.00 0.00 H new ATOM 0 HA SER A 133 -9.205 -10.336 10.470 1.00 0.00 H new ATOM 0 HB2 SER A 133 -11.217 -11.645 10.928 1.00 0.00 H new ATOM 0 HB3 SER A 133 -10.268 -13.106 11.117 1.00 0.00 H new ATOM 0 HG SER A 133 -10.788 -12.128 13.157 1.00 0.00 H new