USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1062 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 101 SER OG : rot 180:sc= 0.0124 USER MOD Set 1.2: A 102 MET CE :methyl 160:sc= -0.209 (180deg=-0.876) USER MOD Single : A 24 SER OG : rot -140:sc= 0 USER MOD Single : A 30 THR OG1 : rot -40:sc= 0.457 USER MOD Single : A 32 ASN : amide:sc= 0.0368 K(o=0.037,f=-1.2) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -1.38 K(o=-1.4,f=-4.2) USER MOD Single : A 47 GLN : amide:sc= -0.0851 K(o=-0.085,f=-3.1!) USER MOD Single : A 52 GLN :FLIP amide:sc= 0 F(o=-0.73,f=0) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.447 USER MOD Single : A 64 LYS NZ :NH3+ 165:sc= 0.892 (180deg=0.732) USER MOD Single : A 66 THR OG1 : rot -160:sc= 0.0205 USER MOD Single : A 70 ASN : amide:sc= 0.00324 K(o=0.0032,f=-3.2!) USER MOD Single : A 74 ASN : amide:sc= 0.823 K(o=0.82,f=-0.18) USER MOD Single : A 79 GLN : amide:sc= -0.341 X(o=-0.34,f=0) USER MOD Single : A 86 THR OG1 : rot -137:sc= 0.17 USER MOD Single : A 92 GLN : amide:sc=-0.00614 X(o=-0.0061,f=-0.015) USER MOD Single : A 97 HIS : no HD1:sc= -0.358 K(o=-0.36,f=-2.2!) USER MOD Single : A 104 THR OG1 : rot 180:sc=0.000421 USER MOD Single : A 112 SER OG : rot -60:sc= 0.0167 USER MOD Single : A 113 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 115 SER OG : rot -135:sc= 0.44 USER MOD Single : A 116 MET CE :methyl 164:sc= -0.0383 (180deg=-0.347) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0.00835 USER MOD Single : A 122 THR OG1 : rot 180:sc= 0.038 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0.00952 USER MOD Single : A 124 HIS : no HD1:sc= -0.0387 X(o=-0.039,f=-0.017) USER MOD Single : A 133 HIS : no HD1:sc= -0.082 X(o=-0.082,f=0) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 157 HIS : no HE2:sc= -0.29 K(o=-0.29,f=-0.8) USER MOD Single : A 158 HIS : no HE2:sc= -0.626 K(o=-0.63,f=-1.9) USER MOD Single : A 160 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 138 N SER A 24 15.644 5.687 -6.930 1.00 0.00 N ATOM 139 CA SER A 24 14.470 6.578 -6.911 1.00 0.00 C ATOM 140 C SER A 24 14.776 7.923 -6.225 1.00 0.00 C ATOM 141 O SER A 24 15.601 7.998 -5.306 1.00 0.00 O ATOM 142 CB SER A 24 13.303 5.866 -6.207 1.00 0.00 C ATOM 143 OG SER A 24 12.142 6.677 -6.113 1.00 0.00 O ATOM 0 HA SER A 24 14.197 6.803 -7.942 1.00 0.00 H new ATOM 0 HB2 SER A 24 13.060 4.952 -6.750 1.00 0.00 H new ATOM 0 HB3 SER A 24 13.615 5.569 -5.206 1.00 0.00 H new ATOM 0 HG SER A 24 11.722 6.547 -5.237 1.00 0.00 H new ATOM 149 N GLY A 25 14.076 8.988 -6.639 1.00 0.00 N ATOM 150 CA GLY A 25 14.122 10.313 -6.009 1.00 0.00 C ATOM 151 C GLY A 25 13.442 11.411 -6.830 1.00 0.00 C ATOM 152 O GLY A 25 13.296 11.289 -8.047 1.00 0.00 O ATOM 0 H GLY A 25 13.447 8.950 -7.441 1.00 0.00 H new ATOM 0 HA2 GLY A 25 13.646 10.256 -5.030 1.00 0.00 H new ATOM 0 HA3 GLY A 25 15.163 10.589 -5.841 1.00 0.00 H new ATOM 156 N VAL A 26 13.054 12.497 -6.159 1.00 0.00 N ATOM 157 CA VAL A 26 12.557 13.734 -6.795 1.00 0.00 C ATOM 158 C VAL A 26 13.734 14.542 -7.362 1.00 0.00 C ATOM 159 O VAL A 26 14.771 14.671 -6.712 1.00 0.00 O ATOM 160 CB VAL A 26 11.704 14.603 -5.836 1.00 0.00 C ATOM 161 CG1 VAL A 26 10.418 13.870 -5.421 1.00 0.00 C ATOM 162 CG2 VAL A 26 12.452 15.055 -4.569 1.00 0.00 C ATOM 0 H VAL A 26 13.074 12.550 -5.141 1.00 0.00 H new ATOM 0 HA VAL A 26 11.896 13.436 -7.609 1.00 0.00 H new ATOM 0 HB VAL A 26 11.463 15.499 -6.408 1.00 0.00 H new ATOM 0 HG11 VAL A 26 9.839 14.503 -4.748 1.00 0.00 H new ATOM 0 HG12 VAL A 26 9.825 13.645 -6.308 1.00 0.00 H new ATOM 0 HG13 VAL A 26 10.677 12.941 -4.912 1.00 0.00 H new ATOM 0 HG21 VAL A 26 11.788 15.658 -3.950 1.00 0.00 H new ATOM 0 HG22 VAL A 26 12.777 14.180 -4.007 1.00 0.00 H new ATOM 0 HG23 VAL A 26 13.322 15.648 -4.852 1.00 0.00 H new ATOM 172 N ASP A 27 13.584 15.091 -8.572 1.00 0.00 N ATOM 173 CA ASP A 27 14.667 15.819 -9.261 1.00 0.00 C ATOM 174 C ASP A 27 14.824 17.282 -8.786 1.00 0.00 C ATOM 175 O ASP A 27 15.857 17.907 -9.035 1.00 0.00 O ATOM 176 CB ASP A 27 14.436 15.724 -10.778 1.00 0.00 C ATOM 177 CG ASP A 27 15.667 16.157 -11.594 1.00 0.00 C ATOM 178 OD1 ASP A 27 15.572 17.150 -12.355 1.00 0.00 O ATOM 179 OD2 ASP A 27 16.717 15.476 -11.503 1.00 0.00 O1- ATOM 0 H ASP A 27 12.715 15.046 -9.103 1.00 0.00 H new ATOM 0 HA ASP A 27 15.614 15.346 -9.004 1.00 0.00 H new ATOM 0 HB2 ASP A 27 14.175 14.698 -11.038 1.00 0.00 H new ATOM 0 HB3 ASP A 27 13.586 16.348 -11.052 1.00 0.00 H new ATOM 184 N LEU A 28 13.823 17.806 -8.061 1.00 0.00 N ATOM 185 CA LEU A 28 13.813 19.154 -7.462 1.00 0.00 C ATOM 186 C LEU A 28 12.842 19.352 -6.275 1.00 0.00 C ATOM 187 O LEU A 28 12.963 20.356 -5.571 1.00 0.00 O ATOM 188 CB LEU A 28 13.566 20.224 -8.551 1.00 0.00 C ATOM 189 CG LEU A 28 12.224 20.087 -9.311 1.00 0.00 C ATOM 190 CD1 LEU A 28 11.515 21.444 -9.418 1.00 0.00 C ATOM 191 CD2 LEU A 28 12.443 19.517 -10.720 1.00 0.00 C ATOM 0 H LEU A 28 12.967 17.286 -7.868 1.00 0.00 H new ATOM 0 HA LEU A 28 14.805 19.273 -7.027 1.00 0.00 H new ATOM 0 HB2 LEU A 28 13.604 21.209 -8.086 1.00 0.00 H new ATOM 0 HB3 LEU A 28 14.381 20.181 -9.273 1.00 0.00 H new ATOM 0 HG LEU A 28 11.598 19.399 -8.743 1.00 0.00 H new ATOM 0 HD11 LEU A 28 10.575 21.322 -9.956 1.00 0.00 H new ATOM 0 HD12 LEU A 28 11.314 21.829 -8.418 1.00 0.00 H new ATOM 0 HD13 LEU A 28 12.152 22.146 -9.956 1.00 0.00 H new ATOM 0 HD21 LEU A 28 11.484 19.431 -11.231 1.00 0.00 H new ATOM 0 HD22 LEU A 28 13.097 20.182 -11.284 1.00 0.00 H new ATOM 0 HD23 LEU A 28 12.904 18.532 -10.646 1.00 0.00 H new ATOM 203 N GLY A 29 11.898 18.426 -6.031 1.00 0.00 N ATOM 204 CA GLY A 29 10.953 18.483 -4.895 1.00 0.00 C ATOM 205 C GLY A 29 9.456 18.405 -5.229 1.00 0.00 C ATOM 206 O GLY A 29 8.645 18.493 -4.307 1.00 0.00 O ATOM 0 H GLY A 29 11.766 17.606 -6.623 1.00 0.00 H new ATOM 0 HA2 GLY A 29 11.191 17.665 -4.215 1.00 0.00 H new ATOM 0 HA3 GLY A 29 11.131 19.411 -4.352 1.00 0.00 H new ATOM 210 N THR A 30 9.079 18.247 -6.510 1.00 0.00 N ATOM 211 CA THR A 30 7.676 18.296 -6.982 1.00 0.00 C ATOM 212 C THR A 30 7.282 17.168 -7.947 1.00 0.00 C ATOM 213 O THR A 30 6.198 17.219 -8.525 1.00 0.00 O ATOM 214 CB THR A 30 7.400 19.697 -7.556 1.00 0.00 C ATOM 215 OG1 THR A 30 6.012 19.895 -7.659 1.00 0.00 O ATOM 216 CG2 THR A 30 8.036 19.939 -8.927 1.00 0.00 C ATOM 0 H THR A 30 9.748 18.079 -7.261 1.00 0.00 H new ATOM 0 HA THR A 30 7.031 18.116 -6.122 1.00 0.00 H new ATOM 0 HB THR A 30 7.855 20.406 -6.865 1.00 0.00 H new ATOM 0 HG1 THR A 30 5.586 19.069 -7.970 1.00 0.00 H new ATOM 0 HG21 THR A 30 7.797 20.947 -9.266 1.00 0.00 H new ATOM 0 HG22 THR A 30 9.118 19.828 -8.851 1.00 0.00 H new ATOM 0 HG23 THR A 30 7.646 19.214 -9.642 1.00 0.00 H new ATOM 224 N GLU A 31 8.123 16.146 -8.134 1.00 0.00 N ATOM 225 CA GLU A 31 7.902 15.083 -9.132 1.00 0.00 C ATOM 226 C GLU A 31 6.577 14.333 -8.903 1.00 0.00 C ATOM 227 O GLU A 31 5.861 14.010 -9.849 1.00 0.00 O ATOM 228 CB GLU A 31 9.080 14.091 -9.094 1.00 0.00 C ATOM 229 CG GLU A 31 9.316 13.371 -10.429 1.00 0.00 C ATOM 230 CD GLU A 31 9.856 14.316 -11.516 1.00 0.00 C ATOM 231 OE1 GLU A 31 10.872 15.006 -11.269 1.00 0.00 O ATOM 232 OE2 GLU A 31 9.281 14.354 -12.629 1.00 0.00 O1- ATOM 0 H GLU A 31 8.982 16.028 -7.597 1.00 0.00 H new ATOM 0 HA GLU A 31 7.840 15.556 -10.112 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.987 14.627 -8.814 1.00 0.00 H new ATOM 0 HB3 GLU A 31 8.895 13.349 -8.317 1.00 0.00 H new ATOM 0 HG2 GLU A 31 10.021 12.554 -10.278 1.00 0.00 H new ATOM 0 HG3 GLU A 31 8.381 12.926 -10.769 1.00 0.00 H new ATOM 239 N ASN A 32 6.213 14.106 -7.637 1.00 0.00 N ATOM 240 CA ASN A 32 4.963 13.460 -7.230 1.00 0.00 C ATOM 241 C ASN A 32 3.693 14.283 -7.536 1.00 0.00 C ATOM 242 O ASN A 32 2.597 13.726 -7.565 1.00 0.00 O ATOM 243 CB ASN A 32 5.052 13.117 -5.735 1.00 0.00 C ATOM 244 CG ASN A 32 5.244 14.351 -4.855 1.00 0.00 C ATOM 245 OD1 ASN A 32 6.341 14.882 -4.737 1.00 0.00 O ATOM 246 ND2 ASN A 32 4.189 14.858 -4.243 1.00 0.00 N ATOM 0 H ASN A 32 6.797 14.375 -6.845 1.00 0.00 H new ATOM 0 HA ASN A 32 4.856 12.555 -7.829 1.00 0.00 H new ATOM 0 HB2 ASN A 32 4.143 12.598 -5.431 1.00 0.00 H new ATOM 0 HB3 ASN A 32 5.882 12.429 -5.574 1.00 0.00 H new ATOM 0 HD21 ASN A 32 4.286 15.696 -3.669 1.00 0.00 H new ATOM 0 HD22 ASN A 32 3.277 14.412 -4.344 1.00 0.00 H new ATOM 253 N LEU A 33 3.799 15.594 -7.786 1.00 0.00 N ATOM 254 CA LEU A 33 2.637 16.459 -8.040 1.00 0.00 C ATOM 255 C LEU A 33 1.978 16.186 -9.410 1.00 0.00 C ATOM 256 O LEU A 33 0.844 16.597 -9.647 1.00 0.00 O ATOM 257 CB LEU A 33 3.079 17.928 -7.884 1.00 0.00 C ATOM 258 CG LEU A 33 1.948 18.878 -7.435 1.00 0.00 C ATOM 259 CD1 LEU A 33 1.631 18.698 -5.940 1.00 0.00 C ATOM 260 CD2 LEU A 33 2.352 20.336 -7.690 1.00 0.00 C ATOM 0 H LEU A 33 4.692 16.086 -7.818 1.00 0.00 H new ATOM 0 HA LEU A 33 1.861 16.235 -7.308 1.00 0.00 H new ATOM 0 HB2 LEU A 33 3.891 17.978 -7.159 1.00 0.00 H new ATOM 0 HB3 LEU A 33 3.479 18.280 -8.835 1.00 0.00 H new ATOM 0 HG LEU A 33 1.058 18.632 -8.015 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.831 19.380 -5.653 1.00 0.00 H new ATOM 0 HD12 LEU A 33 1.316 17.671 -5.756 1.00 0.00 H new ATOM 0 HD13 LEU A 33 2.522 18.915 -5.350 1.00 0.00 H new ATOM 0 HD21 LEU A 33 1.547 20.998 -7.370 1.00 0.00 H new ATOM 0 HD22 LEU A 33 3.257 20.566 -7.128 1.00 0.00 H new ATOM 0 HD23 LEU A 33 2.539 20.481 -8.754 1.00 0.00 H new ATOM 272 N TYR A 34 2.662 15.461 -10.303 1.00 0.00 N ATOM 273 CA TYR A 34 2.195 15.131 -11.658 1.00 0.00 C ATOM 274 C TYR A 34 1.020 14.129 -11.696 1.00 0.00 C ATOM 275 O TYR A 34 0.241 14.145 -12.652 1.00 0.00 O ATOM 276 CB TYR A 34 3.389 14.590 -12.466 1.00 0.00 C ATOM 277 CG TYR A 34 4.338 15.652 -13.006 1.00 0.00 C ATOM 278 CD1 TYR A 34 5.113 16.449 -12.136 1.00 0.00 C ATOM 279 CD2 TYR A 34 4.449 15.841 -14.399 1.00 0.00 C ATOM 280 CE1 TYR A 34 5.979 17.432 -12.651 1.00 0.00 C ATOM 281 CE2 TYR A 34 5.321 16.815 -14.922 1.00 0.00 C ATOM 282 CZ TYR A 34 6.089 17.617 -14.047 1.00 0.00 C ATOM 283 OH TYR A 34 6.932 18.567 -14.543 1.00 0.00 O ATOM 0 H TYR A 34 3.584 15.075 -10.098 1.00 0.00 H new ATOM 0 HA TYR A 34 1.802 16.048 -12.098 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.956 13.906 -11.834 1.00 0.00 H new ATOM 0 HB3 TYR A 34 3.007 14.007 -13.304 1.00 0.00 H new ATOM 0 HD1 TYR A 34 5.041 16.304 -11.068 1.00 0.00 H new ATOM 0 HD2 TYR A 34 3.860 15.234 -15.070 1.00 0.00 H new ATOM 0 HE1 TYR A 34 6.560 18.045 -11.978 1.00 0.00 H new ATOM 0 HE2 TYR A 34 5.403 16.949 -15.990 1.00 0.00 H new ATOM 0 HH TYR A 34 6.889 18.563 -15.522 1.00 0.00 H new ATOM 293 N PHE A 35 0.876 13.270 -10.675 1.00 0.00 N ATOM 294 CA PHE A 35 -0.185 12.249 -10.587 1.00 0.00 C ATOM 295 C PHE A 35 -0.519 11.863 -9.127 1.00 0.00 C ATOM 296 O PHE A 35 -0.941 10.740 -8.859 1.00 0.00 O ATOM 297 CB PHE A 35 0.179 11.037 -11.481 1.00 0.00 C ATOM 298 CG PHE A 35 -0.988 10.318 -12.131 1.00 0.00 C ATOM 299 CD1 PHE A 35 -1.282 8.984 -11.785 1.00 0.00 C ATOM 300 CD2 PHE A 35 -1.733 10.956 -13.141 1.00 0.00 C ATOM 301 CE1 PHE A 35 -2.318 8.295 -12.440 1.00 0.00 C ATOM 302 CE2 PHE A 35 -2.770 10.266 -13.796 1.00 0.00 C ATOM 303 CZ PHE A 35 -3.062 8.936 -13.447 1.00 0.00 C ATOM 0 H PHE A 35 1.504 13.264 -9.871 1.00 0.00 H new ATOM 0 HA PHE A 35 -1.111 12.675 -10.973 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.853 11.379 -12.267 1.00 0.00 H new ATOM 0 HB3 PHE A 35 0.733 10.318 -10.877 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.710 8.489 -11.014 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -1.508 11.977 -13.414 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -2.542 7.274 -12.170 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.342 10.759 -14.568 1.00 0.00 H new ATOM 0 HZ PHE A 35 -3.857 8.407 -13.952 1.00 0.00 H new ATOM 313 N GLN A 36 -0.304 12.786 -8.180 1.00 0.00 N ATOM 314 CA GLN A 36 -0.583 12.652 -6.738 1.00 0.00 C ATOM 315 C GLN A 36 0.350 11.618 -6.064 1.00 0.00 C ATOM 316 O GLN A 36 1.397 11.253 -6.600 1.00 0.00 O ATOM 317 CB GLN A 36 -2.087 12.358 -6.482 1.00 0.00 C ATOM 318 CG GLN A 36 -3.083 13.227 -7.275 1.00 0.00 C ATOM 319 CD GLN A 36 -2.850 14.728 -7.101 1.00 0.00 C ATOM 320 OE1 GLN A 36 -2.316 15.405 -7.970 1.00 0.00 O ATOM 321 NE2 GLN A 36 -3.210 15.306 -5.972 1.00 0.00 N ATOM 0 H GLN A 36 0.091 13.698 -8.409 1.00 0.00 H new ATOM 0 HA GLN A 36 -0.363 13.610 -6.267 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -2.279 11.311 -6.718 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -2.287 12.487 -5.418 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -3.011 12.976 -8.333 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -4.098 12.985 -6.958 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -3.656 14.757 -5.237 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -3.042 16.303 -5.833 1.00 0.00 H new ATOM 330 N SER A 37 -0.022 11.088 -4.893 1.00 0.00 N ATOM 331 CA SER A 37 0.722 9.992 -4.241 1.00 0.00 C ATOM 332 C SER A 37 0.823 8.738 -5.139 1.00 0.00 C ATOM 333 O SER A 37 1.771 7.954 -5.027 1.00 0.00 O ATOM 334 CB SER A 37 0.071 9.666 -2.887 1.00 0.00 C ATOM 335 OG SER A 37 0.915 8.882 -2.055 1.00 0.00 O ATOM 0 H SER A 37 -0.840 11.400 -4.370 1.00 0.00 H new ATOM 0 HA SER A 37 1.746 10.326 -4.073 1.00 0.00 H new ATOM 0 HB2 SER A 37 -0.179 10.595 -2.374 1.00 0.00 H new ATOM 0 HB3 SER A 37 -0.865 9.133 -3.056 1.00 0.00 H new ATOM 0 HG SER A 37 0.461 8.701 -1.206 1.00 0.00 H new ATOM 341 N MET A 38 -0.083 8.593 -6.119 1.00 0.00 N ATOM 342 CA MET A 38 0.003 7.563 -7.155 1.00 0.00 C ATOM 343 C MET A 38 1.249 7.707 -8.048 1.00 0.00 C ATOM 344 O MET A 38 1.811 6.683 -8.427 1.00 0.00 O ATOM 345 CB MET A 38 -1.307 7.487 -7.956 1.00 0.00 C ATOM 346 CG MET A 38 -1.435 6.128 -8.652 1.00 0.00 C ATOM 347 SD MET A 38 -3.078 5.789 -9.328 1.00 0.00 S ATOM 348 CE MET A 38 -3.025 3.978 -9.275 1.00 0.00 C ATOM 0 H MET A 38 -0.901 9.195 -6.211 1.00 0.00 H new ATOM 0 HA MET A 38 0.133 6.605 -6.652 1.00 0.00 H new ATOM 0 HB2 MET A 38 -2.156 7.642 -7.290 1.00 0.00 H new ATOM 0 HB3 MET A 38 -1.333 8.285 -8.698 1.00 0.00 H new ATOM 0 HG2 MET A 38 -0.705 6.077 -9.460 1.00 0.00 H new ATOM 0 HG3 MET A 38 -1.179 5.343 -7.940 1.00 0.00 H new ATOM 0 HE1 MET A 38 -3.963 3.575 -9.657 1.00 0.00 H new ATOM 0 HE2 MET A 38 -2.199 3.620 -9.890 1.00 0.00 H new ATOM 0 HE3 MET A 38 -2.881 3.648 -8.246 1.00 0.00 H new ATOM 358 N ARG A 39 1.771 8.916 -8.312 1.00 0.00 N ATOM 359 CA ARG A 39 3.103 9.066 -8.932 1.00 0.00 C ATOM 360 C ARG A 39 4.208 8.621 -7.968 1.00 0.00 C ATOM 361 O ARG A 39 5.088 7.855 -8.365 1.00 0.00 O ATOM 362 CB ARG A 39 3.354 10.510 -9.412 1.00 0.00 C ATOM 363 CG ARG A 39 4.743 10.747 -10.039 1.00 0.00 C ATOM 364 CD ARG A 39 5.111 9.821 -11.209 1.00 0.00 C ATOM 365 NE ARG A 39 4.301 10.087 -12.411 1.00 0.00 N ATOM 366 CZ ARG A 39 4.117 9.261 -13.437 1.00 0.00 C ATOM 367 NH1 ARG A 39 4.598 8.035 -13.447 1.00 0.00 N1+ ATOM 368 NH2 ARG A 39 3.442 9.668 -14.489 1.00 0.00 N ATOM 0 H ARG A 39 1.299 9.797 -8.109 1.00 0.00 H new ATOM 0 HA ARG A 39 3.125 8.419 -9.809 1.00 0.00 H new ATOM 0 HB2 ARG A 39 2.590 10.773 -10.144 1.00 0.00 H new ATOM 0 HB3 ARG A 39 3.232 11.186 -8.566 1.00 0.00 H new ATOM 0 HG2 ARG A 39 4.794 11.779 -10.386 1.00 0.00 H new ATOM 0 HG3 ARG A 39 5.497 10.636 -9.260 1.00 0.00 H new ATOM 0 HD2 ARG A 39 6.167 9.946 -11.450 1.00 0.00 H new ATOM 0 HD3 ARG A 39 4.975 8.783 -10.904 1.00 0.00 H new ATOM 0 HE ARG A 39 3.836 10.993 -12.461 1.00 0.00 H new ATOM 0 HH11 ARG A 39 5.132 7.690 -12.649 1.00 0.00 H new ATOM 0 HH12 ARG A 39 4.436 7.430 -14.252 1.00 0.00 H new ATOM 0 HH21 ARG A 39 3.062 10.614 -14.516 1.00 0.00 H new ATOM 0 HH22 ARG A 39 3.299 9.038 -15.278 1.00 0.00 H new ATOM 382 N ALA A 40 4.163 9.076 -6.711 1.00 0.00 N ATOM 383 CA ALA A 40 5.186 8.773 -5.704 1.00 0.00 C ATOM 384 C ALA A 40 5.398 7.259 -5.551 1.00 0.00 C ATOM 385 O ALA A 40 6.525 6.785 -5.663 1.00 0.00 O ATOM 386 CB ALA A 40 4.801 9.432 -4.371 1.00 0.00 C ATOM 0 H ALA A 40 3.410 9.669 -6.361 1.00 0.00 H new ATOM 0 HA ALA A 40 6.139 9.185 -6.035 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.560 9.208 -3.622 1.00 0.00 H new ATOM 0 HB2 ALA A 40 4.731 10.511 -4.505 1.00 0.00 H new ATOM 0 HB3 ALA A 40 3.838 9.045 -4.039 1.00 0.00 H new ATOM 392 N GLN A 41 4.318 6.496 -5.368 1.00 0.00 N ATOM 393 CA GLN A 41 4.377 5.042 -5.176 1.00 0.00 C ATOM 394 C GLN A 41 4.801 4.265 -6.438 1.00 0.00 C ATOM 395 O GLN A 41 5.527 3.277 -6.317 1.00 0.00 O ATOM 396 CB GLN A 41 3.029 4.565 -4.620 1.00 0.00 C ATOM 397 CG GLN A 41 1.903 4.594 -5.668 1.00 0.00 C ATOM 398 CD GLN A 41 0.499 4.474 -5.083 1.00 0.00 C ATOM 399 OE1 GLN A 41 0.235 4.793 -3.937 1.00 0.00 O ATOM 400 NE2 GLN A 41 -0.457 3.982 -5.845 1.00 0.00 N ATOM 0 H GLN A 41 3.370 6.871 -5.348 1.00 0.00 H new ATOM 0 HA GLN A 41 5.167 4.827 -4.456 1.00 0.00 H new ATOM 0 HB2 GLN A 41 3.138 3.549 -4.240 1.00 0.00 H new ATOM 0 HB3 GLN A 41 2.748 5.193 -3.775 1.00 0.00 H new ATOM 0 HG2 GLN A 41 1.971 5.524 -6.232 1.00 0.00 H new ATOM 0 HG3 GLN A 41 2.060 3.780 -6.376 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -0.253 3.710 -6.807 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -1.401 3.873 -5.473 1.00 0.00 H new ATOM 409 N LEU A 42 4.402 4.715 -7.641 1.00 0.00 N ATOM 410 CA LEU A 42 4.826 4.108 -8.912 1.00 0.00 C ATOM 411 C LEU A 42 6.342 4.214 -9.089 1.00 0.00 C ATOM 412 O LEU A 42 6.986 3.247 -9.489 1.00 0.00 O ATOM 413 CB LEU A 42 4.095 4.778 -10.102 1.00 0.00 C ATOM 414 CG LEU A 42 2.948 3.972 -10.746 1.00 0.00 C ATOM 415 CD1 LEU A 42 3.473 2.713 -11.453 1.00 0.00 C ATOM 416 CD2 LEU A 42 1.848 3.576 -9.756 1.00 0.00 C ATOM 0 H LEU A 42 3.775 5.511 -7.758 1.00 0.00 H new ATOM 0 HA LEU A 42 4.559 3.051 -8.889 1.00 0.00 H new ATOM 0 HB2 LEU A 42 3.693 5.732 -9.762 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.832 5.000 -10.874 1.00 0.00 H new ATOM 0 HG LEU A 42 2.503 4.646 -11.478 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.638 2.169 -11.895 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.174 3.001 -12.236 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.980 2.074 -10.730 1.00 0.00 H new ATOM 0 HD21 LEU A 42 1.075 3.012 -10.278 1.00 0.00 H new ATOM 0 HD22 LEU A 42 2.275 2.960 -8.965 1.00 0.00 H new ATOM 0 HD23 LEU A 42 1.410 4.474 -9.320 1.00 0.00 H new ATOM 428 N ILE A 43 6.921 5.375 -8.773 1.00 0.00 N ATOM 429 CA ILE A 43 8.371 5.600 -8.867 1.00 0.00 C ATOM 430 C ILE A 43 9.117 4.918 -7.707 1.00 0.00 C ATOM 431 O ILE A 43 10.094 4.217 -7.965 1.00 0.00 O ATOM 432 CB ILE A 43 8.654 7.116 -9.004 1.00 0.00 C ATOM 433 CG1 ILE A 43 7.966 7.738 -10.246 1.00 0.00 C ATOM 434 CG2 ILE A 43 10.160 7.412 -9.064 1.00 0.00 C ATOM 435 CD1 ILE A 43 8.306 7.108 -11.607 1.00 0.00 C ATOM 0 H ILE A 43 6.400 6.188 -8.444 1.00 0.00 H new ATOM 0 HA ILE A 43 8.764 5.127 -9.767 1.00 0.00 H new ATOM 0 HB ILE A 43 8.233 7.574 -8.109 1.00 0.00 H new ATOM 0 HG12 ILE A 43 6.887 7.680 -10.103 1.00 0.00 H new ATOM 0 HG13 ILE A 43 8.225 8.796 -10.286 1.00 0.00 H new ATOM 0 HG21 ILE A 43 10.316 8.486 -9.160 1.00 0.00 H new ATOM 0 HG22 ILE A 43 10.637 7.056 -8.151 1.00 0.00 H new ATOM 0 HG23 ILE A 43 10.597 6.904 -9.924 1.00 0.00 H new ATOM 0 HD11 ILE A 43 7.763 7.630 -12.395 1.00 0.00 H new ATOM 0 HD12 ILE A 43 9.378 7.190 -11.788 1.00 0.00 H new ATOM 0 HD13 ILE A 43 8.018 6.057 -11.603 1.00 0.00 H new ATOM 447 N GLU A 44 8.618 5.024 -6.469 1.00 0.00 N ATOM 448 CA GLU A 44 9.217 4.451 -5.250 1.00 0.00 C ATOM 449 C GLU A 44 9.574 2.964 -5.392 1.00 0.00 C ATOM 450 O GLU A 44 10.667 2.567 -4.985 1.00 0.00 O ATOM 451 CB GLU A 44 8.247 4.661 -4.070 1.00 0.00 C ATOM 452 CG GLU A 44 8.634 4.004 -2.733 1.00 0.00 C ATOM 453 CD GLU A 44 9.965 4.500 -2.139 1.00 0.00 C ATOM 454 OE1 GLU A 44 10.300 5.700 -2.280 1.00 0.00 O ATOM 455 OE2 GLU A 44 10.655 3.700 -1.465 1.00 0.00 O1- ATOM 0 H GLU A 44 7.753 5.530 -6.278 1.00 0.00 H new ATOM 0 HA GLU A 44 10.158 4.971 -5.069 1.00 0.00 H new ATOM 0 HB2 GLU A 44 8.140 5.733 -3.904 1.00 0.00 H new ATOM 0 HB3 GLU A 44 7.267 4.284 -4.363 1.00 0.00 H new ATOM 0 HG2 GLU A 44 7.838 4.185 -2.010 1.00 0.00 H new ATOM 0 HG3 GLU A 44 8.695 2.925 -2.877 1.00 0.00 H new ATOM 462 N ARG A 45 8.687 2.140 -5.972 1.00 0.00 N ATOM 463 CA ARG A 45 8.982 0.726 -6.249 1.00 0.00 C ATOM 464 C ARG A 45 9.497 0.511 -7.680 1.00 0.00 C ATOM 465 O ARG A 45 10.474 -0.214 -7.880 1.00 0.00 O ATOM 466 CB ARG A 45 7.740 -0.126 -5.925 1.00 0.00 C ATOM 467 CG ARG A 45 7.955 -1.648 -5.999 1.00 0.00 C ATOM 468 CD ARG A 45 9.068 -2.162 -5.069 1.00 0.00 C ATOM 469 NE ARG A 45 9.228 -3.627 -5.171 1.00 0.00 N ATOM 470 CZ ARG A 45 10.375 -4.297 -5.232 1.00 0.00 C ATOM 471 NH1 ARG A 45 11.541 -3.716 -5.040 1.00 0.00 N1+ ATOM 472 NH2 ARG A 45 10.374 -5.585 -5.495 1.00 0.00 N ATOM 0 H ARG A 45 7.753 2.432 -6.260 1.00 0.00 H new ATOM 0 HA ARG A 45 9.797 0.400 -5.602 1.00 0.00 H new ATOM 0 HB2 ARG A 45 7.396 0.128 -4.923 1.00 0.00 H new ATOM 0 HB3 ARG A 45 6.942 0.146 -6.615 1.00 0.00 H new ATOM 0 HG2 ARG A 45 7.021 -2.151 -5.746 1.00 0.00 H new ATOM 0 HG3 ARG A 45 8.196 -1.922 -7.026 1.00 0.00 H new ATOM 0 HD2 ARG A 45 10.009 -1.674 -5.323 1.00 0.00 H new ATOM 0 HD3 ARG A 45 8.836 -1.892 -4.039 1.00 0.00 H new ATOM 0 HE ARG A 45 8.372 -4.181 -5.197 1.00 0.00 H new ATOM 0 HH11 ARG A 45 11.586 -2.718 -4.836 1.00 0.00 H new ATOM 0 HH12 ARG A 45 12.399 -4.264 -5.095 1.00 0.00 H new ATOM 0 HH21 ARG A 45 9.492 -6.073 -5.653 1.00 0.00 H new ATOM 0 HH22 ARG A 45 11.255 -6.097 -5.541 1.00 0.00 H new ATOM 486 N GLY A 46 8.895 1.162 -8.682 1.00 0.00 N ATOM 487 CA GLY A 46 9.177 0.905 -10.100 1.00 0.00 C ATOM 488 C GLY A 46 10.553 1.378 -10.565 1.00 0.00 C ATOM 489 O GLY A 46 11.142 0.751 -11.443 1.00 0.00 O ATOM 0 H GLY A 46 8.194 1.887 -8.531 1.00 0.00 H new ATOM 0 HA2 GLY A 46 9.092 -0.166 -10.287 1.00 0.00 H new ATOM 0 HA3 GLY A 46 8.414 1.396 -10.704 1.00 0.00 H new ATOM 493 N GLN A 47 11.088 2.447 -9.969 1.00 0.00 N ATOM 494 CA GLN A 47 12.428 2.976 -10.253 1.00 0.00 C ATOM 495 C GLN A 47 13.510 2.378 -9.327 1.00 0.00 C ATOM 496 O GLN A 47 14.700 2.582 -9.562 1.00 0.00 O ATOM 497 CB GLN A 47 12.354 4.514 -10.210 1.00 0.00 C ATOM 498 CG GLN A 47 13.491 5.220 -10.966 1.00 0.00 C ATOM 499 CD GLN A 47 13.231 6.725 -11.086 1.00 0.00 C ATOM 500 OE1 GLN A 47 13.564 7.522 -10.220 1.00 0.00 O ATOM 501 NE2 GLN A 47 12.588 7.177 -12.145 1.00 0.00 N ATOM 0 H GLN A 47 10.590 2.983 -9.258 1.00 0.00 H new ATOM 0 HA GLN A 47 12.744 2.671 -11.251 1.00 0.00 H new ATOM 0 HB2 GLN A 47 11.400 4.833 -10.630 1.00 0.00 H new ATOM 0 HB3 GLN A 47 12.368 4.838 -9.170 1.00 0.00 H new ATOM 0 HG2 GLN A 47 14.435 5.052 -10.447 1.00 0.00 H new ATOM 0 HG3 GLN A 47 13.593 4.786 -11.961 1.00 0.00 H new ATOM 0 HE21 GLN A 47 12.300 6.532 -12.881 1.00 0.00 H new ATOM 0 HE22 GLN A 47 12.379 8.172 -12.228 1.00 0.00 H new ATOM 510 N LEU A 48 13.119 1.591 -8.312 1.00 0.00 N ATOM 511 CA LEU A 48 14.023 0.704 -7.564 1.00 0.00 C ATOM 512 C LEU A 48 14.242 -0.629 -8.296 1.00 0.00 C ATOM 513 O LEU A 48 15.369 -1.118 -8.347 1.00 0.00 O ATOM 514 CB LEU A 48 13.474 0.475 -6.138 1.00 0.00 C ATOM 515 CG LEU A 48 14.266 1.230 -5.052 1.00 0.00 C ATOM 516 CD1 LEU A 48 14.246 2.751 -5.254 1.00 0.00 C ATOM 517 CD2 LEU A 48 13.701 0.885 -3.666 1.00 0.00 C ATOM 0 H LEU A 48 12.154 1.553 -7.984 1.00 0.00 H new ATOM 0 HA LEU A 48 14.996 1.189 -7.491 1.00 0.00 H new ATOM 0 HB2 LEU A 48 12.431 0.790 -6.103 1.00 0.00 H new ATOM 0 HB3 LEU A 48 13.492 -0.592 -5.916 1.00 0.00 H new ATOM 0 HG LEU A 48 15.305 0.909 -5.129 1.00 0.00 H new ATOM 0 HD11 LEU A 48 14.819 3.231 -4.461 1.00 0.00 H new ATOM 0 HD12 LEU A 48 14.688 2.996 -6.220 1.00 0.00 H new ATOM 0 HD13 LEU A 48 13.217 3.108 -5.225 1.00 0.00 H new ATOM 0 HD21 LEU A 48 14.263 1.420 -2.901 1.00 0.00 H new ATOM 0 HD22 LEU A 48 12.652 1.178 -3.617 1.00 0.00 H new ATOM 0 HD23 LEU A 48 13.786 -0.188 -3.495 1.00 0.00 H new ATOM 529 N ILE A 49 13.188 -1.219 -8.874 1.00 0.00 N ATOM 530 CA ILE A 49 13.290 -2.465 -9.664 1.00 0.00 C ATOM 531 C ILE A 49 13.992 -2.208 -11.003 1.00 0.00 C ATOM 532 O ILE A 49 14.949 -2.902 -11.348 1.00 0.00 O ATOM 533 CB ILE A 49 11.892 -3.079 -9.903 1.00 0.00 C ATOM 534 CG1 ILE A 49 11.195 -3.451 -8.579 1.00 0.00 C ATOM 535 CG2 ILE A 49 11.990 -4.331 -10.803 1.00 0.00 C ATOM 536 CD1 ILE A 49 9.682 -3.558 -8.762 1.00 0.00 C ATOM 0 H ILE A 49 12.239 -0.851 -8.811 1.00 0.00 H new ATOM 0 HA ILE A 49 13.888 -3.175 -9.092 1.00 0.00 H new ATOM 0 HB ILE A 49 11.293 -2.319 -10.404 1.00 0.00 H new ATOM 0 HG12 ILE A 49 11.588 -4.399 -8.212 1.00 0.00 H new ATOM 0 HG13 ILE A 49 11.420 -2.699 -7.823 1.00 0.00 H new ATOM 0 HG21 ILE A 49 10.994 -4.747 -10.958 1.00 0.00 H new ATOM 0 HG22 ILE A 49 12.422 -4.055 -11.765 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.623 -5.076 -10.322 1.00 0.00 H new ATOM 0 HD11 ILE A 49 9.218 -3.822 -7.811 1.00 0.00 H new ATOM 0 HD12 ILE A 49 9.288 -2.601 -9.105 1.00 0.00 H new ATOM 0 HD13 ILE A 49 9.458 -4.328 -9.501 1.00 0.00 H new ATOM 548 N ALA A 50 13.500 -1.221 -11.753 1.00 0.00 N ATOM 549 CA ALA A 50 13.920 -0.890 -13.113 1.00 0.00 C ATOM 550 C ALA A 50 13.746 0.626 -13.325 1.00 0.00 C ATOM 551 O ALA A 50 14.300 1.408 -12.555 1.00 0.00 O ATOM 552 CB ALA A 50 13.142 -1.792 -14.093 1.00 0.00 C ATOM 0 H ALA A 50 12.764 -0.603 -11.412 1.00 0.00 H new ATOM 0 HA ALA A 50 14.975 -1.092 -13.297 1.00 0.00 H new ATOM 0 HB1 ALA A 50 13.441 -1.561 -15.115 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.362 -2.838 -13.878 1.00 0.00 H new ATOM 0 HB3 ALA A 50 12.072 -1.616 -13.979 1.00 0.00 H new ATOM 558 N GLU A 51 12.959 1.049 -14.318 1.00 0.00 N ATOM 559 CA GLU A 51 12.657 2.454 -14.612 1.00 0.00 C ATOM 560 C GLU A 51 11.196 2.585 -15.074 1.00 0.00 C ATOM 561 O GLU A 51 10.897 2.417 -16.251 1.00 0.00 O ATOM 562 CB GLU A 51 13.659 2.987 -15.661 1.00 0.00 C ATOM 563 CG GLU A 51 14.846 3.707 -15.008 1.00 0.00 C ATOM 564 CD GLU A 51 16.059 3.716 -15.941 1.00 0.00 C ATOM 565 OE1 GLU A 51 16.865 2.760 -15.865 1.00 0.00 O ATOM 566 OE2 GLU A 51 16.210 4.671 -16.739 1.00 0.00 O1- ATOM 0 H GLU A 51 12.500 0.403 -14.960 1.00 0.00 H new ATOM 0 HA GLU A 51 12.767 3.062 -13.714 1.00 0.00 H new ATOM 0 HB2 GLU A 51 14.026 2.158 -16.266 1.00 0.00 H new ATOM 0 HB3 GLU A 51 13.147 3.672 -16.337 1.00 0.00 H new ATOM 0 HG2 GLU A 51 14.564 4.731 -14.761 1.00 0.00 H new ATOM 0 HG3 GLU A 51 15.106 3.213 -14.072 1.00 0.00 H new ATOM 573 N GLN A 52 10.295 2.889 -14.126 1.00 0.00 N ATOM 574 CA GLN A 52 8.849 3.180 -14.279 1.00 0.00 C ATOM 575 C GLN A 52 8.005 2.156 -15.081 1.00 0.00 C ATOM 576 O GLN A 52 6.866 2.448 -15.449 1.00 0.00 O ATOM 577 CB GLN A 52 8.613 4.657 -14.676 1.00 0.00 C ATOM 578 CG GLN A 52 8.930 5.055 -16.135 1.00 0.00 C ATOM 579 CD GLN A 52 10.061 6.084 -16.271 1.00 0.00 C ATOM 580 OE1 GLN A 52 11.225 5.855 -15.693 1.00 0.00 O flip ATOM 581 NE2 GLN A 52 9.916 7.128 -16.895 1.00 0.00 N flip ATOM 0 H GLN A 52 10.577 2.944 -13.147 1.00 0.00 H new ATOM 0 HA GLN A 52 8.435 3.035 -13.281 1.00 0.00 H new ATOM 0 HB2 GLN A 52 7.568 4.897 -14.480 1.00 0.00 H new ATOM 0 HB3 GLN A 52 9.213 5.284 -14.017 1.00 0.00 H new ATOM 0 HG2 GLN A 52 9.199 4.159 -16.695 1.00 0.00 H new ATOM 0 HG3 GLN A 52 8.028 5.459 -16.594 1.00 0.00 H new ATOM 0 HE21 GLN A 52 9.026 7.330 -17.351 1.00 0.00 H new ATOM 0 HE22 GLN A 52 10.685 7.795 -16.958 1.00 0.00 H new ATOM 590 N LEU A 53 8.540 0.952 -15.328 1.00 0.00 N ATOM 591 CA LEU A 53 7.923 -0.132 -16.117 1.00 0.00 C ATOM 592 C LEU A 53 7.807 -1.458 -15.332 1.00 0.00 C ATOM 593 O LEU A 53 7.533 -2.512 -15.912 1.00 0.00 O ATOM 594 CB LEU A 53 8.739 -0.301 -17.419 1.00 0.00 C ATOM 595 CG LEU A 53 8.642 0.893 -18.396 1.00 0.00 C ATOM 596 CD1 LEU A 53 9.684 0.726 -19.511 1.00 0.00 C ATOM 597 CD2 LEU A 53 7.242 1.016 -19.020 1.00 0.00 C ATOM 0 H LEU A 53 9.458 0.692 -14.968 1.00 0.00 H new ATOM 0 HA LEU A 53 6.895 0.143 -16.353 1.00 0.00 H new ATOM 0 HB2 LEU A 53 9.786 -0.457 -17.159 1.00 0.00 H new ATOM 0 HB3 LEU A 53 8.400 -1.202 -17.931 1.00 0.00 H new ATOM 0 HG LEU A 53 8.834 1.803 -17.828 1.00 0.00 H new ATOM 0 HD11 LEU A 53 9.617 1.567 -20.201 1.00 0.00 H new ATOM 0 HD12 LEU A 53 10.682 0.694 -19.074 1.00 0.00 H new ATOM 0 HD13 LEU A 53 9.494 -0.202 -20.051 1.00 0.00 H new ATOM 0 HD21 LEU A 53 7.220 1.868 -19.699 1.00 0.00 H new ATOM 0 HD22 LEU A 53 7.008 0.106 -19.572 1.00 0.00 H new ATOM 0 HD23 LEU A 53 6.504 1.162 -18.231 1.00 0.00 H new ATOM 609 N ALA A 54 8.020 -1.420 -14.013 1.00 0.00 N ATOM 610 CA ALA A 54 7.810 -2.537 -13.086 1.00 0.00 C ATOM 611 C ALA A 54 6.515 -2.340 -12.259 1.00 0.00 C ATOM 612 O ALA A 54 6.050 -1.199 -12.133 1.00 0.00 O ATOM 613 CB ALA A 54 9.067 -2.663 -12.218 1.00 0.00 C ATOM 0 H ALA A 54 8.356 -0.579 -13.544 1.00 0.00 H new ATOM 0 HA ALA A 54 7.663 -3.471 -13.628 1.00 0.00 H new ATOM 0 HB1 ALA A 54 8.943 -3.487 -11.516 1.00 0.00 H new ATOM 0 HB2 ALA A 54 9.931 -2.855 -12.854 1.00 0.00 H new ATOM 0 HB3 ALA A 54 9.222 -1.736 -11.666 1.00 0.00 H new ATOM 619 N PRO A 55 5.912 -3.415 -11.708 1.00 0.00 N ATOM 620 CA PRO A 55 4.588 -3.348 -11.099 1.00 0.00 C ATOM 621 C PRO A 55 4.649 -2.743 -9.692 1.00 0.00 C ATOM 622 O PRO A 55 5.570 -3.026 -8.925 1.00 0.00 O ATOM 623 CB PRO A 55 4.071 -4.788 -11.093 1.00 0.00 C ATOM 624 CG PRO A 55 5.338 -5.640 -11.022 1.00 0.00 C ATOM 625 CD PRO A 55 6.419 -4.783 -11.681 1.00 0.00 C ATOM 0 HA PRO A 55 3.916 -2.695 -11.655 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.418 -4.973 -10.240 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.493 -5.008 -11.991 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.597 -5.880 -9.991 1.00 0.00 H new ATOM 0 HG3 PRO A 55 5.209 -6.587 -11.547 1.00 0.00 H new ATOM 0 HD2 PRO A 55 7.352 -4.839 -11.120 1.00 0.00 H new ATOM 0 HD3 PRO A 55 6.632 -5.137 -12.690 1.00 0.00 H new ATOM 633 N LEU A 56 3.646 -1.928 -9.342 1.00 0.00 N ATOM 634 CA LEU A 56 3.546 -1.308 -8.016 1.00 0.00 C ATOM 635 C LEU A 56 3.149 -2.305 -6.915 1.00 0.00 C ATOM 636 O LEU A 56 3.648 -2.183 -5.798 1.00 0.00 O ATOM 637 CB LEU A 56 2.623 -0.063 -8.047 1.00 0.00 C ATOM 638 CG LEU A 56 1.096 -0.309 -8.137 1.00 0.00 C ATOM 639 CD1 LEU A 56 0.297 0.947 -7.760 1.00 0.00 C ATOM 640 CD2 LEU A 56 0.660 -0.759 -9.539 1.00 0.00 C ATOM 0 H LEU A 56 2.882 -1.680 -9.970 1.00 0.00 H new ATOM 0 HA LEU A 56 4.547 -0.967 -7.751 1.00 0.00 H new ATOM 0 HB2 LEU A 56 2.817 0.523 -7.148 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.916 0.552 -8.898 1.00 0.00 H new ATOM 0 HG LEU A 56 0.884 -1.107 -7.426 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.770 0.736 -7.835 1.00 0.00 H new ATOM 0 HD12 LEU A 56 0.538 1.238 -6.738 1.00 0.00 H new ATOM 0 HD13 LEU A 56 0.555 1.760 -8.439 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -0.418 -0.919 -9.551 1.00 0.00 H new ATOM 0 HD22 LEU A 56 0.921 0.010 -10.266 1.00 0.00 H new ATOM 0 HD23 LEU A 56 1.167 -1.689 -9.797 1.00 0.00 H new ATOM 652 N ALA A 57 2.271 -3.276 -7.215 1.00 0.00 N ATOM 653 CA ALA A 57 1.695 -4.182 -6.214 1.00 0.00 C ATOM 654 C ALA A 57 2.136 -5.645 -6.362 1.00 0.00 C ATOM 655 O ALA A 57 2.446 -6.252 -5.345 1.00 0.00 O ATOM 656 CB ALA A 57 0.164 -4.056 -6.225 1.00 0.00 C ATOM 0 H ALA A 57 1.941 -3.453 -8.164 1.00 0.00 H new ATOM 0 HA ALA A 57 2.086 -3.869 -5.246 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -0.262 -4.729 -5.481 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -0.118 -3.030 -5.989 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -0.216 -4.319 -7.212 1.00 0.00 H new ATOM 662 N ALA A 58 2.202 -6.218 -7.574 1.00 0.00 N ATOM 663 CA ALA A 58 2.459 -7.659 -7.780 1.00 0.00 C ATOM 664 C ALA A 58 3.687 -8.179 -7.002 1.00 0.00 C ATOM 665 O ALA A 58 3.585 -9.096 -6.184 1.00 0.00 O ATOM 666 CB ALA A 58 2.618 -7.928 -9.288 1.00 0.00 C ATOM 0 H ALA A 58 2.079 -5.697 -8.443 1.00 0.00 H new ATOM 0 HA ALA A 58 1.604 -8.206 -7.384 1.00 0.00 H new ATOM 0 HB1 ALA A 58 2.808 -8.989 -9.450 1.00 0.00 H new ATOM 0 HB2 ALA A 58 1.704 -7.639 -9.807 1.00 0.00 H new ATOM 0 HB3 ALA A 58 3.455 -7.346 -9.675 1.00 0.00 H new ATOM 672 N THR A 59 4.837 -7.541 -7.245 1.00 0.00 N ATOM 673 CA THR A 59 6.136 -7.811 -6.610 1.00 0.00 C ATOM 674 C THR A 59 6.169 -7.378 -5.147 1.00 0.00 C ATOM 675 O THR A 59 6.631 -8.140 -4.301 1.00 0.00 O ATOM 676 CB THR A 59 7.241 -7.149 -7.443 1.00 0.00 C ATOM 677 OG1 THR A 59 8.492 -7.367 -6.834 1.00 0.00 O ATOM 678 CG2 THR A 59 7.081 -5.636 -7.590 1.00 0.00 C ATOM 0 H THR A 59 4.892 -6.783 -7.925 1.00 0.00 H new ATOM 0 HA THR A 59 6.305 -8.888 -6.591 1.00 0.00 H new ATOM 0 HB THR A 59 7.170 -7.603 -8.432 1.00 0.00 H new ATOM 0 HG1 THR A 59 9.195 -6.944 -7.370 1.00 0.00 H new ATOM 0 HG21 THR A 59 7.900 -5.240 -8.191 1.00 0.00 H new ATOM 0 HG22 THR A 59 6.132 -5.416 -8.079 1.00 0.00 H new ATOM 0 HG23 THR A 59 7.097 -5.171 -6.604 1.00 0.00 H new ATOM 686 N ALA A 60 5.640 -6.192 -4.829 1.00 0.00 N ATOM 687 CA ALA A 60 5.626 -5.644 -3.472 1.00 0.00 C ATOM 688 C ALA A 60 4.806 -6.510 -2.506 1.00 0.00 C ATOM 689 O ALA A 60 5.223 -6.714 -1.370 1.00 0.00 O ATOM 690 CB ALA A 60 5.092 -4.210 -3.532 1.00 0.00 C ATOM 0 H ALA A 60 5.204 -5.579 -5.518 1.00 0.00 H new ATOM 0 HA ALA A 60 6.643 -5.641 -3.080 1.00 0.00 H new ATOM 0 HB1 ALA A 60 5.075 -3.786 -2.528 1.00 0.00 H new ATOM 0 HB2 ALA A 60 5.739 -3.607 -4.170 1.00 0.00 H new ATOM 0 HB3 ALA A 60 4.082 -4.215 -3.941 1.00 0.00 H new ATOM 696 N LEU A 61 3.675 -7.058 -2.955 1.00 0.00 N ATOM 697 CA LEU A 61 2.838 -7.988 -2.199 1.00 0.00 C ATOM 698 C LEU A 61 3.547 -9.341 -2.058 1.00 0.00 C ATOM 699 O LEU A 61 3.631 -9.863 -0.949 1.00 0.00 O ATOM 700 CB LEU A 61 1.471 -8.079 -2.915 1.00 0.00 C ATOM 701 CG LEU A 61 0.290 -8.699 -2.142 1.00 0.00 C ATOM 702 CD1 LEU A 61 0.499 -10.178 -1.791 1.00 0.00 C ATOM 703 CD2 LEU A 61 -0.053 -7.883 -0.886 1.00 0.00 C ATOM 0 H LEU A 61 3.306 -6.859 -3.885 1.00 0.00 H new ATOM 0 HA LEU A 61 2.666 -7.639 -1.181 1.00 0.00 H new ATOM 0 HB2 LEU A 61 1.183 -7.071 -3.214 1.00 0.00 H new ATOM 0 HB3 LEU A 61 1.611 -8.655 -3.830 1.00 0.00 H new ATOM 0 HG LEU A 61 -0.560 -8.661 -2.824 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -0.370 -10.549 -1.248 1.00 0.00 H new ATOM 0 HD12 LEU A 61 0.628 -10.755 -2.707 1.00 0.00 H new ATOM 0 HD13 LEU A 61 1.387 -10.282 -1.168 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -0.890 -8.350 -0.366 1.00 0.00 H new ATOM 0 HD22 LEU A 61 0.813 -7.852 -0.225 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -0.326 -6.868 -1.175 1.00 0.00 H new ATOM 715 N ALA A 62 4.130 -9.874 -3.139 1.00 0.00 N ATOM 716 CA ALA A 62 4.858 -11.148 -3.125 1.00 0.00 C ATOM 717 C ALA A 62 6.040 -11.173 -2.131 1.00 0.00 C ATOM 718 O ALA A 62 6.264 -12.205 -1.495 1.00 0.00 O ATOM 719 CB ALA A 62 5.312 -11.464 -4.557 1.00 0.00 C ATOM 0 H ALA A 62 4.109 -9.428 -4.056 1.00 0.00 H new ATOM 0 HA ALA A 62 4.181 -11.923 -2.767 1.00 0.00 H new ATOM 0 HB1 ALA A 62 5.856 -12.409 -4.566 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.440 -11.541 -5.207 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.963 -10.667 -4.916 1.00 0.00 H new ATOM 725 N ARG A 63 6.752 -10.046 -1.956 1.00 0.00 N ATOM 726 CA ARG A 63 7.795 -9.868 -0.925 1.00 0.00 C ATOM 727 C ARG A 63 7.291 -9.199 0.377 1.00 0.00 C ATOM 728 O ARG A 63 8.073 -8.966 1.299 1.00 0.00 O ATOM 729 CB ARG A 63 9.011 -9.136 -1.525 1.00 0.00 C ATOM 730 CG ARG A 63 8.805 -7.620 -1.655 1.00 0.00 C ATOM 731 CD ARG A 63 10.028 -6.877 -2.202 1.00 0.00 C ATOM 732 NE ARG A 63 11.113 -6.842 -1.206 1.00 0.00 N ATOM 733 CZ ARG A 63 12.132 -5.992 -1.155 1.00 0.00 C ATOM 734 NH1 ARG A 63 12.326 -5.068 -2.074 1.00 0.00 N1+ ATOM 735 NH2 ARG A 63 12.986 -6.065 -0.158 1.00 0.00 N ATOM 0 H ARG A 63 6.618 -9.218 -2.536 1.00 0.00 H new ATOM 0 HA ARG A 63 8.103 -10.866 -0.613 1.00 0.00 H new ATOM 0 HB2 ARG A 63 9.884 -9.325 -0.900 1.00 0.00 H new ATOM 0 HB3 ARG A 63 9.227 -9.552 -2.509 1.00 0.00 H new ATOM 0 HG2 ARG A 63 7.954 -7.433 -2.310 1.00 0.00 H new ATOM 0 HG3 ARG A 63 8.550 -7.212 -0.677 1.00 0.00 H new ATOM 0 HD2 ARG A 63 10.379 -7.366 -3.111 1.00 0.00 H new ATOM 0 HD3 ARG A 63 9.748 -5.860 -2.476 1.00 0.00 H new ATOM 0 HE ARG A 63 11.078 -7.550 -0.473 1.00 0.00 H new ATOM 0 HH11 ARG A 63 11.681 -4.987 -2.860 1.00 0.00 H new ATOM 0 HH12 ARG A 63 13.121 -4.433 -1.999 1.00 0.00 H new ATOM 0 HH21 ARG A 63 12.863 -6.771 0.568 1.00 0.00 H new ATOM 0 HH22 ARG A 63 13.772 -5.416 -0.111 1.00 0.00 H new ATOM 749 N LYS A 64 6.000 -8.848 0.446 1.00 0.00 N ATOM 750 CA LYS A 64 5.285 -8.315 1.619 1.00 0.00 C ATOM 751 C LYS A 64 5.810 -6.937 2.118 1.00 0.00 C ATOM 752 O LYS A 64 5.949 -6.701 3.319 1.00 0.00 O ATOM 753 CB LYS A 64 5.217 -9.432 2.692 1.00 0.00 C ATOM 754 CG LYS A 64 3.902 -9.497 3.489 1.00 0.00 C ATOM 755 CD LYS A 64 2.637 -9.838 2.672 1.00 0.00 C ATOM 756 CE LYS A 64 2.723 -11.101 1.798 1.00 0.00 C ATOM 757 NZ LYS A 64 2.856 -12.351 2.593 1.00 0.00 N1+ ATOM 0 H LYS A 64 5.387 -8.933 -0.365 1.00 0.00 H new ATOM 0 HA LYS A 64 4.265 -8.057 1.335 1.00 0.00 H new ATOM 0 HB2 LYS A 64 5.374 -10.393 2.203 1.00 0.00 H new ATOM 0 HB3 LYS A 64 6.041 -9.292 3.392 1.00 0.00 H new ATOM 0 HG2 LYS A 64 4.014 -10.241 4.278 1.00 0.00 H new ATOM 0 HG3 LYS A 64 3.748 -8.535 3.978 1.00 0.00 H new ATOM 0 HD2 LYS A 64 1.802 -9.954 3.363 1.00 0.00 H new ATOM 0 HD3 LYS A 64 2.403 -8.990 2.029 1.00 0.00 H new ATOM 0 HE2 LYS A 64 1.831 -11.166 1.175 1.00 0.00 H new ATOM 0 HE3 LYS A 64 3.576 -11.013 1.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 2.656 -13.171 1.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 3.824 -12.424 2.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 2.181 -12.333 3.384 1.00 0.00 H new ATOM 771 N ASP A 65 6.137 -6.023 1.195 1.00 0.00 N ATOM 772 CA ASP A 65 6.867 -4.767 1.443 1.00 0.00 C ATOM 773 C ASP A 65 5.966 -3.571 1.819 1.00 0.00 C ATOM 774 O ASP A 65 5.730 -2.652 1.025 1.00 0.00 O ATOM 775 CB ASP A 65 7.799 -4.452 0.252 1.00 0.00 C ATOM 776 CG ASP A 65 9.215 -4.124 0.741 1.00 0.00 C ATOM 777 OD1 ASP A 65 9.954 -5.069 1.094 1.00 0.00 O ATOM 778 OD2 ASP A 65 9.565 -2.923 0.792 1.00 0.00 O1- ATOM 0 H ASP A 65 5.891 -6.141 0.212 1.00 0.00 H new ATOM 0 HA ASP A 65 7.475 -4.929 2.333 1.00 0.00 H new ATOM 0 HB2 ASP A 65 7.832 -5.305 -0.426 1.00 0.00 H new ATOM 0 HB3 ASP A 65 7.401 -3.610 -0.315 1.00 0.00 H new ATOM 783 N THR A 66 5.491 -3.557 3.071 1.00 0.00 N ATOM 784 CA THR A 66 4.612 -2.518 3.652 1.00 0.00 C ATOM 785 C THR A 66 5.110 -1.082 3.469 1.00 0.00 C ATOM 786 O THR A 66 4.292 -0.169 3.412 1.00 0.00 O ATOM 787 CB THR A 66 4.335 -2.826 5.127 1.00 0.00 C ATOM 788 OG1 THR A 66 4.037 -4.199 5.237 1.00 0.00 O ATOM 789 CG2 THR A 66 3.115 -2.062 5.639 1.00 0.00 C ATOM 0 H THR A 66 5.714 -4.296 3.738 1.00 0.00 H new ATOM 0 HA THR A 66 3.682 -2.562 3.085 1.00 0.00 H new ATOM 0 HB THR A 66 5.211 -2.537 5.708 1.00 0.00 H new ATOM 0 HG1 THR A 66 3.558 -4.364 6.076 1.00 0.00 H new ATOM 0 HG21 THR A 66 2.948 -2.304 6.688 1.00 0.00 H new ATOM 0 HG22 THR A 66 3.288 -0.991 5.537 1.00 0.00 H new ATOM 0 HG23 THR A 66 2.238 -2.345 5.057 1.00 0.00 H new ATOM 797 N ALA A 67 6.418 -0.874 3.283 1.00 0.00 N ATOM 798 CA ALA A 67 7.018 0.424 2.958 1.00 0.00 C ATOM 799 C ALA A 67 6.360 1.109 1.745 1.00 0.00 C ATOM 800 O ALA A 67 6.088 2.308 1.801 1.00 0.00 O ATOM 801 CB ALA A 67 8.517 0.210 2.714 1.00 0.00 C ATOM 0 H ALA A 67 7.106 -1.623 3.356 1.00 0.00 H new ATOM 0 HA ALA A 67 6.854 1.097 3.799 1.00 0.00 H new ATOM 0 HB1 ALA A 67 8.986 1.163 2.470 1.00 0.00 H new ATOM 0 HB2 ALA A 67 8.977 -0.201 3.613 1.00 0.00 H new ATOM 0 HB3 ALA A 67 8.655 -0.485 1.886 1.00 0.00 H new ATOM 807 N VAL A 68 6.065 0.353 0.682 1.00 0.00 N ATOM 808 CA VAL A 68 5.267 0.833 -0.467 1.00 0.00 C ATOM 809 C VAL A 68 3.816 0.336 -0.409 1.00 0.00 C ATOM 810 O VAL A 68 2.924 1.045 -0.881 1.00 0.00 O ATOM 811 CB VAL A 68 5.948 0.509 -1.819 1.00 0.00 C ATOM 812 CG1 VAL A 68 6.089 -0.999 -2.085 1.00 0.00 C ATOM 813 CG2 VAL A 68 5.208 1.182 -2.989 1.00 0.00 C ATOM 0 H VAL A 68 6.372 -0.615 0.588 1.00 0.00 H new ATOM 0 HA VAL A 68 5.224 1.920 -0.393 1.00 0.00 H new ATOM 0 HB VAL A 68 6.957 0.916 -1.746 1.00 0.00 H new ATOM 0 HG11 VAL A 68 6.574 -1.155 -3.049 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.692 -1.453 -1.298 1.00 0.00 H new ATOM 0 HG13 VAL A 68 5.101 -1.460 -2.097 1.00 0.00 H new ATOM 0 HG21 VAL A 68 5.709 0.937 -3.926 1.00 0.00 H new ATOM 0 HG22 VAL A 68 4.179 0.824 -3.023 1.00 0.00 H new ATOM 0 HG23 VAL A 68 5.211 2.263 -2.848 1.00 0.00 H new ATOM 823 N LEU A 69 3.546 -0.821 0.219 1.00 0.00 N ATOM 824 CA LEU A 69 2.185 -1.348 0.343 1.00 0.00 C ATOM 825 C LEU A 69 1.256 -0.374 1.088 1.00 0.00 C ATOM 826 O LEU A 69 0.120 -0.210 0.664 1.00 0.00 O ATOM 827 CB LEU A 69 2.182 -2.771 0.947 1.00 0.00 C ATOM 828 CG LEU A 69 1.533 -3.872 0.080 1.00 0.00 C ATOM 829 CD1 LEU A 69 0.116 -3.517 -0.396 1.00 0.00 C ATOM 830 CD2 LEU A 69 2.426 -4.226 -1.116 1.00 0.00 C ATOM 0 H LEU A 69 4.260 -1.409 0.649 1.00 0.00 H new ATOM 0 HA LEU A 69 1.774 -1.440 -0.662 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.213 -3.059 1.153 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.663 -2.737 1.905 1.00 0.00 H new ATOM 0 HG LEU A 69 1.435 -4.744 0.726 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.280 -4.334 -1.000 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -0.529 -3.358 0.468 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.151 -2.607 -0.995 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.946 -5.004 -1.711 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.577 -3.340 -1.732 1.00 0.00 H new ATOM 0 HD23 LEU A 69 3.390 -4.587 -0.756 1.00 0.00 H new ATOM 842 N ASN A 70 1.745 0.365 2.094 1.00 0.00 N ATOM 843 CA ASN A 70 1.019 1.471 2.742 1.00 0.00 C ATOM 844 C ASN A 70 0.426 2.466 1.723 1.00 0.00 C ATOM 845 O ASN A 70 -0.782 2.714 1.716 1.00 0.00 O ATOM 846 CB ASN A 70 1.966 2.200 3.724 1.00 0.00 C ATOM 847 CG ASN A 70 1.471 3.605 4.092 1.00 0.00 C ATOM 848 OD1 ASN A 70 0.332 3.808 4.477 1.00 0.00 O ATOM 849 ND2 ASN A 70 2.279 4.630 3.902 1.00 0.00 N ATOM 0 H ASN A 70 2.673 0.209 2.489 1.00 0.00 H new ATOM 0 HA ASN A 70 0.177 1.044 3.286 1.00 0.00 H new ATOM 0 HB2 ASN A 70 2.068 1.606 4.632 1.00 0.00 H new ATOM 0 HB3 ASN A 70 2.958 2.274 3.278 1.00 0.00 H new ATOM 0 HD21 ASN A 70 1.949 5.579 4.077 1.00 0.00 H new ATOM 0 HD22 ASN A 70 3.234 4.474 3.580 1.00 0.00 H new ATOM 856 N ARG A 71 1.277 3.033 0.860 1.00 0.00 N ATOM 857 CA ARG A 71 0.888 4.055 -0.119 1.00 0.00 C ATOM 858 C ARG A 71 -0.084 3.491 -1.158 1.00 0.00 C ATOM 859 O ARG A 71 -1.190 4.018 -1.305 1.00 0.00 O ATOM 860 CB ARG A 71 2.151 4.644 -0.767 1.00 0.00 C ATOM 861 CG ARG A 71 2.785 5.731 0.120 1.00 0.00 C ATOM 862 CD ARG A 71 4.319 5.757 0.042 1.00 0.00 C ATOM 863 NE ARG A 71 4.933 5.010 1.159 1.00 0.00 N ATOM 864 CZ ARG A 71 5.154 5.474 2.384 1.00 0.00 C ATOM 865 NH1 ARG A 71 4.821 6.692 2.756 1.00 0.00 N1+ ATOM 866 NH2 ARG A 71 5.702 4.681 3.275 1.00 0.00 N ATOM 0 H ARG A 71 2.267 2.792 0.821 1.00 0.00 H new ATOM 0 HA ARG A 71 0.356 4.858 0.392 1.00 0.00 H new ATOM 0 HB2 ARG A 71 2.875 3.849 -0.944 1.00 0.00 H new ATOM 0 HB3 ARG A 71 1.899 5.067 -1.739 1.00 0.00 H new ATOM 0 HG2 ARG A 71 2.396 6.705 -0.176 1.00 0.00 H new ATOM 0 HG3 ARG A 71 2.483 5.568 1.155 1.00 0.00 H new ATOM 0 HD2 ARG A 71 4.643 5.327 -0.906 1.00 0.00 H new ATOM 0 HD3 ARG A 71 4.667 6.790 0.059 1.00 0.00 H new ATOM 0 HE ARG A 71 5.214 4.047 0.972 1.00 0.00 H new ATOM 0 HH11 ARG A 71 4.373 7.324 2.092 1.00 0.00 H new ATOM 0 HH12 ARG A 71 5.011 7.004 3.708 1.00 0.00 H new ATOM 0 HH21 ARG A 71 5.951 3.725 3.022 1.00 0.00 H new ATOM 0 HH22 ARG A 71 5.879 5.021 4.220 1.00 0.00 H new ATOM 880 N ILE A 72 0.262 2.368 -1.803 1.00 0.00 N ATOM 881 CA ILE A 72 -0.617 1.755 -2.822 1.00 0.00 C ATOM 882 C ILE A 72 -1.932 1.262 -2.212 1.00 0.00 C ATOM 883 O ILE A 72 -2.947 1.270 -2.902 1.00 0.00 O ATOM 884 CB ILE A 72 0.091 0.675 -3.683 1.00 0.00 C ATOM 885 CG1 ILE A 72 0.159 -0.689 -2.977 1.00 0.00 C ATOM 886 CG2 ILE A 72 1.473 1.159 -4.155 1.00 0.00 C ATOM 887 CD1 ILE A 72 1.074 -1.709 -3.666 1.00 0.00 C ATOM 0 H ILE A 72 1.135 1.866 -1.643 1.00 0.00 H new ATOM 0 HA ILE A 72 -0.870 2.550 -3.524 1.00 0.00 H new ATOM 0 HB ILE A 72 -0.520 0.520 -4.572 1.00 0.00 H new ATOM 0 HG12 ILE A 72 0.506 -0.539 -1.954 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -0.847 -1.104 -2.915 1.00 0.00 H new ATOM 0 HG21 ILE A 72 1.945 0.382 -4.756 1.00 0.00 H new ATOM 0 HG22 ILE A 72 1.357 2.061 -4.755 1.00 0.00 H new ATOM 0 HG23 ILE A 72 2.097 1.377 -3.289 1.00 0.00 H new ATOM 0 HD11 ILE A 72 1.065 -2.643 -3.105 1.00 0.00 H new ATOM 0 HD12 ILE A 72 0.717 -1.891 -4.680 1.00 0.00 H new ATOM 0 HD13 ILE A 72 2.091 -1.318 -3.704 1.00 0.00 H new ATOM 899 N ALA A 73 -1.958 0.910 -0.923 1.00 0.00 N ATOM 900 CA ALA A 73 -3.194 0.566 -0.237 1.00 0.00 C ATOM 901 C ALA A 73 -4.098 1.773 0.019 1.00 0.00 C ATOM 902 O ALA A 73 -5.292 1.709 -0.262 1.00 0.00 O ATOM 903 CB ALA A 73 -2.896 -0.199 1.054 1.00 0.00 C ATOM 0 H ALA A 73 -1.126 0.858 -0.335 1.00 0.00 H new ATOM 0 HA ALA A 73 -3.756 -0.086 -0.906 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -3.832 -0.448 1.554 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -2.356 -1.116 0.817 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -2.287 0.421 1.712 1.00 0.00 H new ATOM 909 N ASN A 74 -3.537 2.880 0.508 1.00 0.00 N ATOM 910 CA ASN A 74 -4.291 4.116 0.719 1.00 0.00 C ATOM 911 C ASN A 74 -4.822 4.708 -0.604 1.00 0.00 C ATOM 912 O ASN A 74 -5.959 5.175 -0.642 1.00 0.00 O ATOM 913 CB ASN A 74 -3.422 5.125 1.480 1.00 0.00 C ATOM 914 CG ASN A 74 -3.481 4.898 2.986 1.00 0.00 C ATOM 915 OD1 ASN A 74 -4.313 5.467 3.682 1.00 0.00 O ATOM 916 ND2 ASN A 74 -2.620 4.062 3.532 1.00 0.00 N ATOM 0 H ASN A 74 -2.553 2.945 0.768 1.00 0.00 H new ATOM 0 HA ASN A 74 -5.169 3.882 1.320 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -2.389 5.045 1.140 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -3.755 6.137 1.251 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -2.646 3.888 4.537 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -1.928 3.590 2.950 1.00 0.00 H new ATOM 923 N GLU A 75 -4.042 4.647 -1.691 1.00 0.00 N ATOM 924 CA GLU A 75 -4.470 5.119 -3.013 1.00 0.00 C ATOM 925 C GLU A 75 -5.382 4.097 -3.724 1.00 0.00 C ATOM 926 O GLU A 75 -6.557 4.376 -3.956 1.00 0.00 O ATOM 927 CB GLU A 75 -3.248 5.453 -3.886 1.00 0.00 C ATOM 928 CG GLU A 75 -2.437 6.666 -3.409 1.00 0.00 C ATOM 929 CD GLU A 75 -3.175 7.997 -3.616 1.00 0.00 C ATOM 930 OE1 GLU A 75 -3.203 8.499 -4.764 1.00 0.00 O ATOM 931 OE2 GLU A 75 -3.674 8.575 -2.626 1.00 0.00 O1- ATOM 0 H GLU A 75 -3.095 4.268 -1.678 1.00 0.00 H new ATOM 0 HA GLU A 75 -5.056 6.026 -2.862 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -2.592 4.583 -3.918 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -3.585 5.636 -4.906 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -2.203 6.547 -2.351 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -1.488 6.695 -3.944 1.00 0.00 H new ATOM 938 N ALA A 76 -4.862 2.917 -4.092 1.00 0.00 N ATOM 939 CA ALA A 76 -5.533 1.975 -4.992 1.00 0.00 C ATOM 940 C ALA A 76 -6.405 0.943 -4.260 1.00 0.00 C ATOM 941 O ALA A 76 -7.545 0.729 -4.673 1.00 0.00 O ATOM 942 CB ALA A 76 -4.476 1.301 -5.880 1.00 0.00 C ATOM 0 H ALA A 76 -3.952 2.588 -3.768 1.00 0.00 H new ATOM 0 HA ALA A 76 -6.231 2.539 -5.610 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -4.963 0.597 -6.555 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -3.953 2.059 -6.462 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -3.761 0.768 -5.254 1.00 0.00 H new ATOM 948 N LEU A 77 -5.926 0.328 -3.166 1.00 0.00 N ATOM 949 CA LEU A 77 -6.704 -0.685 -2.417 1.00 0.00 C ATOM 950 C LEU A 77 -7.807 -0.041 -1.529 1.00 0.00 C ATOM 951 O LEU A 77 -8.483 -0.719 -0.758 1.00 0.00 O ATOM 952 CB LEU A 77 -5.811 -1.671 -1.630 1.00 0.00 C ATOM 953 CG LEU A 77 -4.794 -2.582 -2.378 1.00 0.00 C ATOM 954 CD1 LEU A 77 -4.357 -2.155 -3.788 1.00 0.00 C ATOM 955 CD2 LEU A 77 -3.516 -2.826 -1.556 1.00 0.00 C ATOM 0 H LEU A 77 -5.002 0.512 -2.776 1.00 0.00 H new ATOM 0 HA LEU A 77 -7.219 -1.286 -3.167 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -5.246 -1.085 -0.905 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.474 -2.325 -1.064 1.00 0.00 H new ATOM 0 HG LEU A 77 -5.387 -3.488 -2.503 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.649 -2.882 -4.185 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -5.229 -2.105 -4.440 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -3.882 -1.175 -3.741 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.838 -3.467 -2.120 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.028 -1.873 -1.350 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -3.776 -3.311 -0.615 1.00 0.00 H new ATOM 967 N ASP A 78 -8.018 1.269 -1.657 1.00 0.00 N ATOM 968 CA ASP A 78 -9.126 2.038 -1.082 1.00 0.00 C ATOM 969 C ASP A 78 -10.310 2.218 -2.057 1.00 0.00 C ATOM 970 O ASP A 78 -11.404 2.600 -1.636 1.00 0.00 O ATOM 971 CB ASP A 78 -8.547 3.394 -0.665 1.00 0.00 C ATOM 972 CG ASP A 78 -9.588 4.317 -0.020 1.00 0.00 C ATOM 973 OD1 ASP A 78 -10.018 4.021 1.120 1.00 0.00 O ATOM 974 OD2 ASP A 78 -9.953 5.334 -0.653 1.00 0.00 O1- ATOM 0 H ASP A 78 -7.384 1.858 -2.196 1.00 0.00 H new ATOM 0 HA ASP A 78 -9.541 1.498 -0.231 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.728 3.233 0.036 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -8.125 3.887 -1.540 1.00 0.00 H new ATOM 979 N GLN A 79 -10.113 1.928 -3.349 1.00 0.00 N ATOM 980 CA GLN A 79 -11.125 2.118 -4.393 1.00 0.00 C ATOM 981 C GLN A 79 -12.380 1.247 -4.152 1.00 0.00 C ATOM 982 O GLN A 79 -12.266 0.138 -3.616 1.00 0.00 O ATOM 983 CB GLN A 79 -10.503 1.806 -5.768 1.00 0.00 C ATOM 984 CG GLN A 79 -9.486 2.877 -6.215 1.00 0.00 C ATOM 985 CD GLN A 79 -8.678 2.523 -7.473 1.00 0.00 C ATOM 986 OE1 GLN A 79 -7.702 3.181 -7.809 1.00 0.00 O ATOM 987 NE2 GLN A 79 -9.027 1.501 -8.231 1.00 0.00 N ATOM 0 H GLN A 79 -9.234 1.550 -3.702 1.00 0.00 H new ATOM 0 HA GLN A 79 -11.453 3.157 -4.365 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -10.009 0.835 -5.727 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -11.296 1.729 -6.512 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -10.020 3.810 -6.395 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -8.791 3.061 -5.395 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -9.835 0.932 -7.979 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -8.488 1.280 -9.069 1.00 0.00 H new ATOM 996 N PRO A 80 -13.581 1.690 -4.585 1.00 0.00 N ATOM 997 CA PRO A 80 -14.848 1.004 -4.307 1.00 0.00 C ATOM 998 C PRO A 80 -14.956 -0.402 -4.927 1.00 0.00 C ATOM 999 O PRO A 80 -15.826 -1.175 -4.532 1.00 0.00 O ATOM 1000 CB PRO A 80 -15.944 1.948 -4.821 1.00 0.00 C ATOM 1001 CG PRO A 80 -15.239 2.772 -5.896 1.00 0.00 C ATOM 1002 CD PRO A 80 -13.833 2.920 -5.323 1.00 0.00 C ATOM 0 HA PRO A 80 -14.940 0.808 -3.239 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -16.789 1.395 -5.231 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -16.334 2.580 -4.023 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -15.234 2.263 -6.860 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -15.720 3.738 -6.048 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -13.099 3.059 -6.116 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -13.765 3.790 -4.670 1.00 0.00 H new ATOM 1010 N ASP A 81 -14.061 -0.764 -5.854 1.00 0.00 N ATOM 1011 CA ASP A 81 -13.931 -2.113 -6.425 1.00 0.00 C ATOM 1012 C ASP A 81 -13.234 -3.121 -5.474 1.00 0.00 C ATOM 1013 O ASP A 81 -13.254 -4.327 -5.723 1.00 0.00 O ATOM 1014 CB ASP A 81 -13.161 -1.961 -7.750 1.00 0.00 C ATOM 1015 CG ASP A 81 -13.179 -3.198 -8.668 1.00 0.00 C ATOM 1016 OD1 ASP A 81 -14.188 -3.943 -8.673 1.00 0.00 O ATOM 1017 OD2 ASP A 81 -12.229 -3.352 -9.470 1.00 0.00 O1- ATOM 0 H ASP A 81 -13.385 -0.106 -6.241 1.00 0.00 H new ATOM 0 HA ASP A 81 -14.923 -2.535 -6.587 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -13.578 -1.116 -8.298 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -12.124 -1.713 -7.522 1.00 0.00 H new ATOM 1022 N VAL A 82 -12.621 -2.645 -4.383 1.00 0.00 N ATOM 1023 CA VAL A 82 -11.775 -3.440 -3.468 1.00 0.00 C ATOM 1024 C VAL A 82 -12.598 -4.100 -2.355 1.00 0.00 C ATOM 1025 O VAL A 82 -13.557 -3.509 -1.855 1.00 0.00 O ATOM 1026 CB VAL A 82 -10.661 -2.571 -2.839 1.00 0.00 C ATOM 1027 CG1 VAL A 82 -9.755 -3.410 -1.917 1.00 0.00 C ATOM 1028 CG2 VAL A 82 -9.797 -1.911 -3.926 1.00 0.00 C ATOM 0 H VAL A 82 -12.699 -1.668 -4.099 1.00 0.00 H new ATOM 0 HA VAL A 82 -11.319 -4.225 -4.071 1.00 0.00 H new ATOM 0 HB VAL A 82 -11.152 -1.797 -2.250 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.981 -2.773 -1.489 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -10.353 -3.843 -1.115 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -9.289 -4.209 -2.494 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -9.021 -1.306 -3.457 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -9.333 -2.683 -4.540 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -10.423 -1.276 -4.553 1.00 0.00 H new ATOM 1038 N ARG A 83 -12.191 -5.310 -1.937 1.00 0.00 N ATOM 1039 CA ARG A 83 -12.811 -6.033 -0.820 1.00 0.00 C ATOM 1040 C ARG A 83 -12.277 -5.529 0.537 1.00 0.00 C ATOM 1041 O ARG A 83 -13.053 -4.945 1.294 1.00 0.00 O ATOM 1042 CB ARG A 83 -12.655 -7.561 -0.965 1.00 0.00 C ATOM 1043 CG ARG A 83 -12.816 -8.145 -2.381 1.00 0.00 C ATOM 1044 CD ARG A 83 -14.185 -7.891 -3.020 1.00 0.00 C ATOM 1045 NE ARG A 83 -14.274 -8.583 -4.319 1.00 0.00 N ATOM 1046 CZ ARG A 83 -15.381 -8.926 -4.968 1.00 0.00 C ATOM 1047 NH1 ARG A 83 -16.580 -8.607 -4.527 1.00 0.00 N1+ ATOM 1048 NH2 ARG A 83 -15.291 -9.612 -6.087 1.00 0.00 N ATOM 0 H ARG A 83 -11.417 -5.815 -2.369 1.00 0.00 H new ATOM 0 HA ARG A 83 -13.880 -5.822 -0.850 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -11.669 -7.838 -0.593 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -13.387 -8.040 -0.315 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -12.044 -7.722 -3.025 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -12.642 -9.220 -2.339 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -14.975 -8.243 -2.357 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -14.338 -6.821 -3.158 1.00 0.00 H new ATOM 0 HE ARG A 83 -13.390 -8.824 -4.768 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -16.681 -8.079 -3.660 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -17.408 -8.888 -5.052 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -14.376 -9.877 -6.451 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -16.137 -9.879 -6.591 1.00 0.00 H new ATOM 1062 N ALA A 84 -10.981 -5.710 0.845 1.00 0.00 N ATOM 1063 CA ALA A 84 -10.375 -5.394 2.155 1.00 0.00 C ATOM 1064 C ALA A 84 -8.842 -5.568 2.197 1.00 0.00 C ATOM 1065 O ALA A 84 -8.327 -6.544 1.657 1.00 0.00 O ATOM 1066 CB ALA A 84 -11.002 -6.308 3.220 1.00 0.00 C ATOM 0 H ALA A 84 -10.309 -6.088 0.177 1.00 0.00 H new ATOM 0 HA ALA A 84 -10.576 -4.340 2.346 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -10.564 -6.086 4.193 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -12.078 -6.137 3.259 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.809 -7.350 2.964 1.00 0.00 H new ATOM 1072 N VAL A 85 -8.122 -4.681 2.900 1.00 0.00 N ATOM 1073 CA VAL A 85 -6.672 -4.793 3.188 1.00 0.00 C ATOM 1074 C VAL A 85 -6.288 -4.119 4.523 1.00 0.00 C ATOM 1075 O VAL A 85 -6.963 -3.180 4.954 1.00 0.00 O ATOM 1076 CB VAL A 85 -5.794 -4.210 2.051 1.00 0.00 C ATOM 1077 CG1 VAL A 85 -6.016 -4.868 0.678 1.00 0.00 C ATOM 1078 CG2 VAL A 85 -5.997 -2.701 1.870 1.00 0.00 C ATOM 0 H VAL A 85 -8.538 -3.839 3.298 1.00 0.00 H new ATOM 0 HA VAL A 85 -6.476 -5.862 3.264 1.00 0.00 H new ATOM 0 HB VAL A 85 -4.779 -4.427 2.384 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -5.363 -4.401 -0.059 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -5.787 -5.932 0.743 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -7.055 -4.738 0.376 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -5.359 -2.342 1.062 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -7.040 -2.501 1.625 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -5.736 -2.185 2.794 1.00 0.00 H new ATOM 1088 N THR A 86 -5.188 -4.558 5.158 1.00 0.00 N ATOM 1089 CA THR A 86 -4.733 -4.096 6.496 1.00 0.00 C ATOM 1090 C THR A 86 -3.247 -4.378 6.687 1.00 0.00 C ATOM 1091 O THR A 86 -2.767 -5.362 6.140 1.00 0.00 O ATOM 1092 CB THR A 86 -5.497 -4.771 7.654 1.00 0.00 C ATOM 1093 OG1 THR A 86 -6.722 -5.320 7.236 1.00 0.00 O ATOM 1094 CG2 THR A 86 -5.809 -3.761 8.760 1.00 0.00 C ATOM 0 H THR A 86 -4.570 -5.261 4.752 1.00 0.00 H new ATOM 0 HA THR A 86 -4.932 -3.025 6.524 1.00 0.00 H new ATOM 0 HB THR A 86 -4.846 -5.565 8.019 1.00 0.00 H new ATOM 0 HG1 THR A 86 -7.414 -5.120 7.901 1.00 0.00 H new ATOM 0 HG21 THR A 86 -6.348 -4.259 9.566 1.00 0.00 H new ATOM 0 HG22 THR A 86 -4.878 -3.347 9.148 1.00 0.00 H new ATOM 0 HG23 THR A 86 -6.423 -2.957 8.355 1.00 0.00 H new ATOM 1102 N PHE A 87 -2.516 -3.562 7.460 1.00 0.00 N ATOM 1103 CA PHE A 87 -1.053 -3.664 7.599 1.00 0.00 C ATOM 1104 C PHE A 87 -0.577 -3.221 8.996 1.00 0.00 C ATOM 1105 O PHE A 87 -0.909 -2.114 9.430 1.00 0.00 O ATOM 1106 CB PHE A 87 -0.370 -2.799 6.517 1.00 0.00 C ATOM 1107 CG PHE A 87 -0.879 -2.981 5.095 1.00 0.00 C ATOM 1108 CD1 PHE A 87 -0.194 -3.804 4.184 1.00 0.00 C ATOM 1109 CD2 PHE A 87 -2.077 -2.360 4.691 1.00 0.00 C ATOM 1110 CE1 PHE A 87 -0.748 -4.063 2.919 1.00 0.00 C ATOM 1111 CE2 PHE A 87 -2.625 -2.613 3.428 1.00 0.00 C ATOM 1112 CZ PHE A 87 -1.972 -3.484 2.546 1.00 0.00 C ATOM 0 H PHE A 87 -2.925 -2.807 8.011 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.777 -4.711 7.471 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -0.487 -1.751 6.792 1.00 0.00 H new ATOM 0 HB3 PHE A 87 0.698 -3.015 6.529 1.00 0.00 H new ATOM 0 HD1 PHE A 87 0.757 -4.237 4.456 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -2.579 -1.680 5.364 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -0.229 -4.712 2.229 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -3.549 -2.138 3.134 1.00 0.00 H new ATOM 0 HZ PHE A 87 -2.408 -3.709 1.584 1.00 0.00 H new ATOM 1122 N LEU A 88 0.237 -4.039 9.681 1.00 0.00 N ATOM 1123 CA LEU A 88 0.697 -3.802 11.062 1.00 0.00 C ATOM 1124 C LEU A 88 2.018 -4.529 11.377 1.00 0.00 C ATOM 1125 O LEU A 88 2.258 -5.635 10.891 1.00 0.00 O ATOM 1126 CB LEU A 88 -0.448 -4.186 12.024 1.00 0.00 C ATOM 1127 CG LEU A 88 -0.143 -4.084 13.537 1.00 0.00 C ATOM 1128 CD1 LEU A 88 -1.327 -3.468 14.292 1.00 0.00 C ATOM 1129 CD2 LEU A 88 0.167 -5.467 14.127 1.00 0.00 C ATOM 0 H LEU A 88 0.603 -4.904 9.283 1.00 0.00 H new ATOM 0 HA LEU A 88 0.932 -2.746 11.192 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.305 -3.549 11.805 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.748 -5.211 11.805 1.00 0.00 H new ATOM 0 HG LEU A 88 0.730 -3.441 13.652 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -1.089 -3.407 15.354 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -1.524 -2.468 13.906 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -2.211 -4.091 14.154 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.378 -5.369 15.192 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -0.692 -6.123 13.986 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.035 -5.892 13.622 1.00 0.00 H new ATOM 1141 N ASP A 89 2.868 -3.913 12.207 1.00 0.00 N ATOM 1142 CA ASP A 89 4.173 -4.446 12.638 1.00 0.00 C ATOM 1143 C ASP A 89 4.212 -4.898 14.119 1.00 0.00 C ATOM 1144 O ASP A 89 3.293 -4.632 14.896 1.00 0.00 O ATOM 1145 CB ASP A 89 5.258 -3.387 12.353 1.00 0.00 C ATOM 1146 CG ASP A 89 6.697 -3.937 12.355 1.00 0.00 C ATOM 1147 OD1 ASP A 89 6.874 -5.171 12.207 1.00 0.00 O ATOM 1148 OD2 ASP A 89 7.635 -3.126 12.536 1.00 0.00 O1- ATOM 0 H ASP A 89 2.663 -3.000 12.612 1.00 0.00 H new ATOM 0 HA ASP A 89 4.361 -5.353 12.063 1.00 0.00 H new ATOM 0 HB2 ASP A 89 5.058 -2.930 11.384 1.00 0.00 H new ATOM 0 HB3 ASP A 89 5.183 -2.597 13.100 1.00 0.00 H new ATOM 1153 N ALA A 90 5.322 -5.535 14.518 1.00 0.00 N ATOM 1154 CA ALA A 90 5.637 -6.055 15.858 1.00 0.00 C ATOM 1155 C ALA A 90 5.352 -5.078 17.014 1.00 0.00 C ATOM 1156 O ALA A 90 4.981 -5.499 18.111 1.00 0.00 O ATOM 1157 CB ALA A 90 7.134 -6.405 15.862 1.00 0.00 C ATOM 0 H ALA A 90 6.082 -5.714 13.862 1.00 0.00 H new ATOM 0 HA ALA A 90 4.988 -6.913 16.036 1.00 0.00 H new ATOM 0 HB1 ALA A 90 7.414 -6.796 16.840 1.00 0.00 H new ATOM 0 HB2 ALA A 90 7.334 -7.158 15.100 1.00 0.00 H new ATOM 0 HB3 ALA A 90 7.718 -5.509 15.649 1.00 0.00 H new ATOM 1163 N ARG A 91 5.495 -3.772 16.757 1.00 0.00 N ATOM 1164 CA ARG A 91 5.256 -2.677 17.708 1.00 0.00 C ATOM 1165 C ARG A 91 3.766 -2.490 18.085 1.00 0.00 C ATOM 1166 O ARG A 91 3.455 -1.605 18.880 1.00 0.00 O ATOM 1167 CB ARG A 91 5.850 -1.390 17.087 1.00 0.00 C ATOM 1168 CG ARG A 91 6.293 -0.318 18.097 1.00 0.00 C ATOM 1169 CD ARG A 91 7.597 -0.695 18.812 1.00 0.00 C ATOM 1170 NE ARG A 91 7.923 0.280 19.867 1.00 0.00 N ATOM 1171 CZ ARG A 91 9.117 0.490 20.412 1.00 0.00 C ATOM 1172 NH1 ARG A 91 10.196 -0.153 20.012 1.00 0.00 N1+ ATOM 1173 NH2 ARG A 91 9.241 1.364 21.386 1.00 0.00 N ATOM 0 H ARG A 91 5.793 -3.434 15.842 1.00 0.00 H new ATOM 0 HA ARG A 91 5.744 -2.920 18.652 1.00 0.00 H new ATOM 0 HB2 ARG A 91 6.708 -1.665 16.474 1.00 0.00 H new ATOM 0 HB3 ARG A 91 5.108 -0.952 16.419 1.00 0.00 H new ATOM 0 HG2 ARG A 91 6.426 0.632 17.580 1.00 0.00 H new ATOM 0 HG3 ARG A 91 5.505 -0.171 18.836 1.00 0.00 H new ATOM 0 HD2 ARG A 91 7.502 -1.689 19.248 1.00 0.00 H new ATOM 0 HD3 ARG A 91 8.412 -0.740 18.089 1.00 0.00 H new ATOM 0 HE ARG A 91 7.154 0.853 20.215 1.00 0.00 H new ATOM 0 HH11 ARG A 91 10.132 -0.839 19.260 1.00 0.00 H new ATOM 0 HH12 ARG A 91 11.095 0.035 20.455 1.00 0.00 H new ATOM 0 HH21 ARG A 91 8.424 1.876 21.719 1.00 0.00 H new ATOM 0 HH22 ARG A 91 10.154 1.530 21.809 1.00 0.00 H new ATOM 1187 N GLN A 92 2.847 -3.254 17.471 1.00 0.00 N ATOM 1188 CA GLN A 92 1.387 -3.034 17.448 1.00 0.00 C ATOM 1189 C GLN A 92 1.035 -1.740 16.680 1.00 0.00 C ATOM 1190 O GLN A 92 -0.031 -1.156 16.871 1.00 0.00 O ATOM 1191 CB GLN A 92 0.755 -3.107 18.860 1.00 0.00 C ATOM 1192 CG GLN A 92 0.831 -4.508 19.493 1.00 0.00 C ATOM 1193 CD GLN A 92 -0.249 -5.444 18.946 1.00 0.00 C ATOM 1194 OE1 GLN A 92 -0.074 -6.121 17.942 1.00 0.00 O ATOM 1195 NE2 GLN A 92 -1.413 -5.498 19.563 1.00 0.00 N ATOM 0 H GLN A 92 3.115 -4.088 16.948 1.00 0.00 H new ATOM 0 HA GLN A 92 0.934 -3.857 16.896 1.00 0.00 H new ATOM 0 HB2 GLN A 92 1.259 -2.394 19.513 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -0.289 -2.800 18.799 1.00 0.00 H new ATOM 0 HG2 GLN A 92 1.814 -4.939 19.303 1.00 0.00 H new ATOM 0 HG3 GLN A 92 0.724 -4.423 20.574 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -1.572 -4.939 20.401 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -2.154 -6.099 19.202 1.00 0.00 H new ATOM 1204 N GLU A 93 1.934 -1.278 15.804 1.00 0.00 N ATOM 1205 CA GLU A 93 1.748 -0.088 14.979 1.00 0.00 C ATOM 1206 C GLU A 93 1.064 -0.486 13.671 1.00 0.00 C ATOM 1207 O GLU A 93 1.655 -1.181 12.843 1.00 0.00 O ATOM 1208 CB GLU A 93 3.108 0.588 14.730 1.00 0.00 C ATOM 1209 CG GLU A 93 2.996 1.883 13.916 1.00 0.00 C ATOM 1210 CD GLU A 93 4.381 2.520 13.723 1.00 0.00 C ATOM 1211 OE1 GLU A 93 4.879 3.192 14.657 1.00 0.00 O ATOM 1212 OE2 GLU A 93 4.986 2.341 12.640 1.00 0.00 O1- ATOM 0 H GLU A 93 2.832 -1.736 15.648 1.00 0.00 H new ATOM 0 HA GLU A 93 1.110 0.632 15.491 1.00 0.00 H new ATOM 0 HB2 GLU A 93 3.579 0.808 15.688 1.00 0.00 H new ATOM 0 HB3 GLU A 93 3.763 -0.108 14.206 1.00 0.00 H new ATOM 0 HG2 GLU A 93 2.548 1.671 12.945 1.00 0.00 H new ATOM 0 HG3 GLU A 93 2.335 2.584 14.426 1.00 0.00 H new ATOM 1219 N ARG A 94 -0.172 -0.017 13.479 1.00 0.00 N ATOM 1220 CA ARG A 94 -0.868 -0.037 12.190 1.00 0.00 C ATOM 1221 C ARG A 94 -0.142 0.923 11.233 1.00 0.00 C ATOM 1222 O ARG A 94 0.014 2.105 11.548 1.00 0.00 O ATOM 1223 CB ARG A 94 -2.346 0.371 12.389 1.00 0.00 C ATOM 1224 CG ARG A 94 -3.356 -0.725 12.010 1.00 0.00 C ATOM 1225 CD ARG A 94 -4.765 -0.317 12.467 1.00 0.00 C ATOM 1226 NE ARG A 94 -5.809 -1.161 11.854 1.00 0.00 N ATOM 1227 CZ ARG A 94 -7.005 -0.757 11.432 1.00 0.00 C ATOM 1228 NH1 ARG A 94 -7.392 0.497 11.495 1.00 0.00 N1+ ATOM 1229 NH2 ARG A 94 -7.854 -1.611 10.910 1.00 0.00 N ATOM 0 H ARG A 94 -0.727 0.395 14.229 1.00 0.00 H new ATOM 0 HA ARG A 94 -0.858 -1.039 11.761 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -2.499 0.646 13.433 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -2.550 1.260 11.792 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -3.346 -0.884 10.932 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -3.073 -1.669 12.475 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -4.830 -0.391 13.553 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -4.943 0.726 12.207 1.00 0.00 H new ATOM 0 HE ARG A 94 -5.593 -2.152 11.743 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -6.766 1.205 11.879 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -8.318 0.762 11.160 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -7.600 -2.595 10.825 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -8.768 -1.291 10.590 1.00 0.00 H new ATOM 1243 N LEU A 95 0.299 0.427 10.073 1.00 0.00 N ATOM 1244 CA LEU A 95 0.879 1.254 9.003 1.00 0.00 C ATOM 1245 C LEU A 95 -0.204 1.749 8.040 1.00 0.00 C ATOM 1246 O LEU A 95 -0.113 2.876 7.557 1.00 0.00 O ATOM 1247 CB LEU A 95 1.973 0.486 8.229 1.00 0.00 C ATOM 1248 CG LEU A 95 3.253 0.233 9.056 1.00 0.00 C ATOM 1249 CD1 LEU A 95 3.200 -1.138 9.737 1.00 0.00 C ATOM 1250 CD2 LEU A 95 4.524 0.301 8.193 1.00 0.00 C ATOM 0 H LEU A 95 0.265 -0.567 9.846 1.00 0.00 H new ATOM 0 HA LEU A 95 1.341 2.120 9.477 1.00 0.00 H new ATOM 0 HB2 LEU A 95 1.569 -0.471 7.899 1.00 0.00 H new ATOM 0 HB3 LEU A 95 2.235 1.048 7.333 1.00 0.00 H new ATOM 0 HG LEU A 95 3.295 1.023 9.806 1.00 0.00 H new ATOM 0 HD11 LEU A 95 4.112 -1.293 10.313 1.00 0.00 H new ATOM 0 HD12 LEU A 95 2.338 -1.180 10.403 1.00 0.00 H new ATOM 0 HD13 LEU A 95 3.112 -1.917 8.980 1.00 0.00 H new ATOM 0 HD21 LEU A 95 5.398 0.117 8.818 1.00 0.00 H new ATOM 0 HD22 LEU A 95 4.472 -0.455 7.409 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.604 1.289 7.740 1.00 0.00 H new ATOM 1262 N ALA A 96 -1.223 0.922 7.779 1.00 0.00 N ATOM 1263 CA ALA A 96 -2.272 1.171 6.792 1.00 0.00 C ATOM 1264 C ALA A 96 -3.470 0.228 6.966 1.00 0.00 C ATOM 1265 O ALA A 96 -3.411 -0.771 7.683 1.00 0.00 O ATOM 1266 CB ALA A 96 -1.663 1.058 5.384 1.00 0.00 C ATOM 0 H ALA A 96 -1.341 0.034 8.266 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.662 2.178 6.941 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -2.436 1.242 4.638 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -0.867 1.795 5.272 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -1.254 0.058 5.244 1.00 0.00 H new ATOM 1272 N HIS A 97 -4.554 0.545 6.265 1.00 0.00 N ATOM 1273 CA HIS A 97 -5.853 -0.125 6.315 1.00 0.00 C ATOM 1274 C HIS A 97 -6.790 0.514 5.276 1.00 0.00 C ATOM 1275 O HIS A 97 -6.894 1.740 5.217 1.00 0.00 O ATOM 1276 CB HIS A 97 -6.431 -0.064 7.744 1.00 0.00 C ATOM 1277 CG HIS A 97 -6.240 1.257 8.453 1.00 0.00 C ATOM 1278 ND1 HIS A 97 -6.930 2.422 8.225 1.00 0.00 N ATOM 1279 CD2 HIS A 97 -5.316 1.526 9.427 1.00 0.00 C ATOM 1280 CE1 HIS A 97 -6.460 3.360 9.065 1.00 0.00 C ATOM 1281 NE2 HIS A 97 -5.478 2.855 9.834 1.00 0.00 N ATOM 0 H HIS A 97 -4.551 1.324 5.606 1.00 0.00 H new ATOM 0 HA HIS A 97 -5.742 -1.180 6.065 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -7.498 -0.284 7.698 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -5.969 -0.850 8.341 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -4.586 0.831 9.815 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -6.820 4.377 9.116 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -4.958 3.341 10.564 1.00 0.00 H new ATOM 1289 N ALA A 98 -7.464 -0.303 4.458 1.00 0.00 N ATOM 1290 CA ALA A 98 -8.310 0.143 3.347 1.00 0.00 C ATOM 1291 C ALA A 98 -9.363 -0.916 2.968 1.00 0.00 C ATOM 1292 O ALA A 98 -9.204 -2.111 3.243 1.00 0.00 O ATOM 1293 CB ALA A 98 -7.432 0.610 2.176 1.00 0.00 C ATOM 0 H ALA A 98 -7.435 -1.318 4.554 1.00 0.00 H new ATOM 0 HA ALA A 98 -8.895 1.007 3.662 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -8.067 0.940 1.354 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -6.801 1.437 2.502 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -6.804 -0.215 1.840 1.00 0.00 H new ATOM 1299 N GLY A 99 -10.477 -0.455 2.395 1.00 0.00 N ATOM 1300 CA GLY A 99 -11.715 -1.232 2.245 1.00 0.00 C ATOM 1301 C GLY A 99 -12.613 -1.155 3.497 1.00 0.00 C ATOM 1302 O GLY A 99 -12.111 -0.883 4.595 1.00 0.00 O ATOM 0 H GLY A 99 -10.548 0.488 2.014 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -12.269 -0.865 1.381 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -11.465 -2.274 2.044 1.00 0.00 H new ATOM 1306 N PRO A 100 -13.933 -1.393 3.352 1.00 0.00 N ATOM 1307 CA PRO A 100 -14.952 -1.042 4.347 1.00 0.00 C ATOM 1308 C PRO A 100 -14.843 -1.790 5.681 1.00 0.00 C ATOM 1309 O PRO A 100 -15.171 -1.220 6.720 1.00 0.00 O ATOM 1310 CB PRO A 100 -16.300 -1.326 3.666 1.00 0.00 C ATOM 1311 CG PRO A 100 -15.960 -2.334 2.569 1.00 0.00 C ATOM 1312 CD PRO A 100 -14.574 -1.872 2.136 1.00 0.00 C ATOM 0 HA PRO A 100 -14.825 0.002 4.635 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -17.024 -1.734 4.371 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -16.736 -0.417 3.251 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -15.951 -3.358 2.944 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -16.676 -2.301 1.748 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -14.009 -2.690 1.689 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -14.638 -1.082 1.388 1.00 0.00 H new ATOM 1320 N SER A 101 -14.385 -3.044 5.691 1.00 0.00 N ATOM 1321 CA SER A 101 -14.273 -3.854 6.916 1.00 0.00 C ATOM 1322 C SER A 101 -13.022 -3.546 7.762 1.00 0.00 C ATOM 1323 O SER A 101 -12.939 -3.990 8.911 1.00 0.00 O ATOM 1324 CB SER A 101 -14.317 -5.342 6.537 1.00 0.00 C ATOM 1325 OG SER A 101 -13.389 -5.646 5.505 1.00 0.00 O ATOM 0 H SER A 101 -14.079 -3.532 4.849 1.00 0.00 H new ATOM 0 HA SER A 101 -15.120 -3.592 7.550 1.00 0.00 H new ATOM 0 HB2 SER A 101 -14.097 -5.949 7.415 1.00 0.00 H new ATOM 0 HB3 SER A 101 -15.323 -5.606 6.212 1.00 0.00 H new ATOM 0 HG SER A 101 -13.441 -6.600 5.289 1.00 0.00 H new ATOM 1331 N MET A 102 -12.062 -2.779 7.219 1.00 0.00 N ATOM 1332 CA MET A 102 -10.744 -2.527 7.830 1.00 0.00 C ATOM 1333 C MET A 102 -10.497 -1.044 8.134 1.00 0.00 C ATOM 1334 O MET A 102 -9.956 -0.712 9.192 1.00 0.00 O ATOM 1335 CB MET A 102 -9.640 -3.047 6.894 1.00 0.00 C ATOM 1336 CG MET A 102 -9.831 -4.507 6.468 1.00 0.00 C ATOM 1337 SD MET A 102 -9.890 -5.735 7.800 1.00 0.00 S ATOM 1338 CE MET A 102 -10.050 -7.193 6.742 1.00 0.00 C ATOM 0 H MET A 102 -12.182 -2.306 6.323 1.00 0.00 H new ATOM 0 HA MET A 102 -10.727 -3.056 8.783 1.00 0.00 H new ATOM 0 HB2 MET A 102 -9.605 -2.419 6.003 1.00 0.00 H new ATOM 0 HB3 MET A 102 -8.676 -2.946 7.393 1.00 0.00 H new ATOM 0 HG2 MET A 102 -10.757 -4.578 5.897 1.00 0.00 H new ATOM 0 HG3 MET A 102 -9.019 -4.775 5.792 1.00 0.00 H new ATOM 0 HE1 MET A 102 -9.754 -8.081 7.300 1.00 0.00 H new ATOM 0 HE2 MET A 102 -11.086 -7.296 6.419 1.00 0.00 H new ATOM 0 HE3 MET A 102 -9.407 -7.081 5.869 1.00 0.00 H new ATOM 1348 N LEU A 103 -10.886 -0.147 7.221 1.00 0.00 N ATOM 1349 CA LEU A 103 -10.802 1.307 7.382 1.00 0.00 C ATOM 1350 C LEU A 103 -12.156 1.800 7.922 1.00 0.00 C ATOM 1351 O LEU A 103 -13.100 2.010 7.161 1.00 0.00 O ATOM 1352 CB LEU A 103 -10.402 1.916 6.016 1.00 0.00 C ATOM 1353 CG LEU A 103 -9.782 3.334 6.013 1.00 0.00 C ATOM 1354 CD1 LEU A 103 -9.585 3.829 4.573 1.00 0.00 C ATOM 1355 CD2 LEU A 103 -10.592 4.378 6.782 1.00 0.00 C ATOM 0 H LEU A 103 -11.280 -0.423 6.322 1.00 0.00 H new ATOM 0 HA LEU A 103 -10.043 1.619 8.099 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -9.692 1.239 5.542 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -11.291 1.938 5.386 1.00 0.00 H new ATOM 0 HG LEU A 103 -8.827 3.228 6.528 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -9.148 4.828 4.588 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -8.918 3.149 4.043 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -10.549 3.862 4.065 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -10.086 5.342 6.729 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -11.585 4.464 6.342 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -10.682 4.073 7.824 1.00 0.00 H new ATOM 1367 N THR A 104 -12.257 1.985 9.244 1.00 0.00 N ATOM 1368 CA THR A 104 -13.497 2.392 9.942 1.00 0.00 C ATOM 1369 C THR A 104 -14.029 3.747 9.464 1.00 0.00 C ATOM 1370 O THR A 104 -15.238 3.946 9.388 1.00 0.00 O ATOM 1371 CB THR A 104 -13.249 2.408 11.458 1.00 0.00 C ATOM 1372 OG1 THR A 104 -12.595 1.213 11.826 1.00 0.00 O ATOM 1373 CG2 THR A 104 -14.537 2.516 12.275 1.00 0.00 C ATOM 0 H THR A 104 -11.467 1.855 9.877 1.00 0.00 H new ATOM 0 HA THR A 104 -14.268 1.660 9.702 1.00 0.00 H new ATOM 0 HB THR A 104 -12.644 3.289 11.673 1.00 0.00 H new ATOM 0 HG1 THR A 104 -12.431 1.214 12.792 1.00 0.00 H new ATOM 0 HG21 THR A 104 -14.294 2.522 13.338 1.00 0.00 H new ATOM 0 HG22 THR A 104 -15.056 3.439 12.016 1.00 0.00 H new ATOM 0 HG23 THR A 104 -15.180 1.664 12.055 1.00 0.00 H new ATOM 1381 N VAL A 105 -13.125 4.652 9.088 1.00 0.00 N ATOM 1382 CA VAL A 105 -13.392 6.023 8.599 1.00 0.00 C ATOM 1383 C VAL A 105 -13.704 6.054 7.080 1.00 0.00 C ATOM 1384 O VAL A 105 -13.426 7.044 6.407 1.00 0.00 O ATOM 1385 CB VAL A 105 -12.233 6.998 8.976 1.00 0.00 C ATOM 1386 CG1 VAL A 105 -12.705 8.465 9.049 1.00 0.00 C ATOM 1387 CG2 VAL A 105 -11.584 6.674 10.339 1.00 0.00 C ATOM 0 H VAL A 105 -12.127 4.445 9.115 1.00 0.00 H new ATOM 0 HA VAL A 105 -14.291 6.374 9.106 1.00 0.00 H new ATOM 0 HB VAL A 105 -11.504 6.863 8.177 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -11.864 9.105 9.314 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -13.100 8.769 8.080 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -13.485 8.559 9.805 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -10.786 7.389 10.541 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -12.337 6.739 11.125 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -11.170 5.666 10.315 1.00 0.00 H new ATOM 1397 N ALA A 106 -14.233 4.963 6.504 1.00 0.00 N ATOM 1398 CA ALA A 106 -14.575 4.850 5.078 1.00 0.00 C ATOM 1399 C ALA A 106 -16.093 5.045 4.825 1.00 0.00 C ATOM 1400 O ALA A 106 -16.854 4.077 4.940 1.00 0.00 O ATOM 1401 CB ALA A 106 -14.077 3.496 4.547 1.00 0.00 C ATOM 0 H ALA A 106 -14.440 4.114 7.030 1.00 0.00 H new ATOM 0 HA ALA A 106 -14.076 5.652 4.533 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -14.327 3.405 3.490 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -12.996 3.432 4.671 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -14.554 2.689 5.103 1.00 0.00 H new ATOM 1407 N PRO A 107 -16.547 6.259 4.441 1.00 0.00 N ATOM 1408 CA PRO A 107 -17.920 6.509 3.995 1.00 0.00 C ATOM 1409 C PRO A 107 -18.201 6.009 2.563 1.00 0.00 C ATOM 1410 O PRO A 107 -19.371 5.898 2.197 1.00 0.00 O ATOM 1411 CB PRO A 107 -18.092 8.031 4.082 1.00 0.00 C ATOM 1412 CG PRO A 107 -16.687 8.554 3.799 1.00 0.00 C ATOM 1413 CD PRO A 107 -15.821 7.522 4.516 1.00 0.00 C ATOM 0 HA PRO A 107 -18.627 5.962 4.619 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -18.813 8.398 3.352 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -18.447 8.341 5.065 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -16.474 8.596 2.731 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -16.537 9.559 4.194 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -14.843 7.438 4.042 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -15.649 7.811 5.553 1.00 0.00 H new ATOM 1421 N ALA A 108 -17.154 5.727 1.767 1.00 0.00 N ATOM 1422 CA ALA A 108 -17.187 5.273 0.363 1.00 0.00 C ATOM 1423 C ALA A 108 -17.583 6.390 -0.635 1.00 0.00 C ATOM 1424 O ALA A 108 -17.907 7.517 -0.248 1.00 0.00 O ATOM 1425 CB ALA A 108 -18.044 3.997 0.219 1.00 0.00 C ATOM 0 H ALA A 108 -16.197 5.816 2.110 1.00 0.00 H new ATOM 0 HA ALA A 108 -16.166 5.011 0.086 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -18.054 3.681 -0.824 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -17.621 3.203 0.835 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -19.063 4.205 0.545 1.00 0.00 H new ATOM 1431 N GLY A 109 -17.536 6.074 -1.938 1.00 0.00 N ATOM 1432 CA GLY A 109 -17.907 6.979 -3.042 1.00 0.00 C ATOM 1433 C GLY A 109 -16.755 7.807 -3.630 1.00 0.00 C ATOM 1434 O GLY A 109 -16.974 8.555 -4.582 1.00 0.00 O ATOM 0 H GLY A 109 -17.231 5.157 -2.264 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -18.351 6.386 -3.842 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -18.678 7.662 -2.686 1.00 0.00 H new ATOM 1438 N ASP A 110 -15.537 7.666 -3.100 1.00 0.00 N ATOM 1439 CA ASP A 110 -14.297 8.263 -3.619 1.00 0.00 C ATOM 1440 C ASP A 110 -13.324 7.175 -4.109 1.00 0.00 C ATOM 1441 O ASP A 110 -13.271 6.080 -3.546 1.00 0.00 O ATOM 1442 CB ASP A 110 -13.625 9.112 -2.527 1.00 0.00 C ATOM 1443 CG ASP A 110 -14.379 10.425 -2.265 1.00 0.00 C ATOM 1444 OD1 ASP A 110 -14.254 11.354 -3.098 1.00 0.00 O ATOM 1445 OD2 ASP A 110 -15.069 10.537 -1.224 1.00 0.00 O1- ATOM 0 H ASP A 110 -15.378 7.109 -2.261 1.00 0.00 H new ATOM 0 HA ASP A 110 -14.554 8.900 -4.465 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -13.571 8.536 -1.603 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -12.600 9.337 -2.823 1.00 0.00 H new ATOM 1450 N ALA A 111 -12.542 7.485 -5.151 1.00 0.00 N ATOM 1451 CA ALA A 111 -11.537 6.579 -5.715 1.00 0.00 C ATOM 1452 C ALA A 111 -10.251 6.562 -4.866 1.00 0.00 C ATOM 1453 O ALA A 111 -9.982 5.577 -4.185 1.00 0.00 O ATOM 1454 CB ALA A 111 -11.298 6.965 -7.184 1.00 0.00 C ATOM 0 H ALA A 111 -12.591 8.384 -5.631 1.00 0.00 H new ATOM 0 HA ALA A 111 -11.901 5.552 -5.691 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -10.552 6.300 -7.618 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -12.231 6.876 -7.740 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -10.941 7.994 -7.236 1.00 0.00 H new ATOM 1460 N SER A 112 -9.474 7.651 -4.899 1.00 0.00 N ATOM 1461 CA SER A 112 -8.244 7.824 -4.093 1.00 0.00 C ATOM 1462 C SER A 112 -8.305 9.027 -3.125 1.00 0.00 C ATOM 1463 O SER A 112 -7.439 9.176 -2.266 1.00 0.00 O ATOM 1464 CB SER A 112 -7.035 8.023 -5.024 1.00 0.00 C ATOM 1465 OG SER A 112 -6.883 6.964 -5.961 1.00 0.00 O ATOM 0 H SER A 112 -9.679 8.454 -5.494 1.00 0.00 H new ATOM 0 HA SER A 112 -8.147 6.918 -3.494 1.00 0.00 H new ATOM 0 HB2 SER A 112 -7.147 8.965 -5.561 1.00 0.00 H new ATOM 0 HB3 SER A 112 -6.129 8.104 -4.424 1.00 0.00 H new ATOM 0 HG SER A 112 -6.757 6.119 -5.482 1.00 0.00 H new ATOM 1471 N HIS A 113 -9.303 9.915 -3.236 1.00 0.00 N ATOM 1472 CA HIS A 113 -9.332 11.201 -2.511 1.00 0.00 C ATOM 1473 C HIS A 113 -9.683 11.066 -1.007 1.00 0.00 C ATOM 1474 O HIS A 113 -9.587 12.030 -0.243 1.00 0.00 O ATOM 1475 CB HIS A 113 -10.296 12.148 -3.251 1.00 0.00 C ATOM 1476 CG HIS A 113 -10.018 13.613 -3.008 1.00 0.00 C ATOM 1477 ND1 HIS A 113 -9.142 14.400 -3.722 1.00 0.00 N ATOM 1478 CD2 HIS A 113 -10.597 14.417 -2.061 1.00 0.00 C ATOM 1479 CE1 HIS A 113 -9.188 15.644 -3.216 1.00 0.00 C ATOM 1480 NE2 HIS A 113 -10.066 15.708 -2.196 1.00 0.00 N ATOM 0 H HIS A 113 -10.117 9.765 -3.832 1.00 0.00 H new ATOM 0 HA HIS A 113 -8.324 11.617 -2.510 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -10.236 11.949 -4.321 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -11.317 11.926 -2.942 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -11.335 14.109 -1.335 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -8.603 16.477 -3.577 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -10.297 16.528 -1.636 1.00 0.00 H new ATOM 1488 N LEU A 114 -10.079 9.862 -0.574 1.00 0.00 N ATOM 1489 CA LEU A 114 -10.442 9.516 0.804 1.00 0.00 C ATOM 1490 C LEU A 114 -9.241 9.648 1.759 1.00 0.00 C ATOM 1491 O LEU A 114 -9.367 10.177 2.863 1.00 0.00 O ATOM 1492 CB LEU A 114 -10.983 8.068 0.762 1.00 0.00 C ATOM 1493 CG LEU A 114 -12.046 7.642 1.791 1.00 0.00 C ATOM 1494 CD1 LEU A 114 -11.513 7.568 3.228 1.00 0.00 C ATOM 1495 CD2 LEU A 114 -13.290 8.538 1.710 1.00 0.00 C ATOM 0 H LEU A 114 -10.158 9.066 -1.206 1.00 0.00 H new ATOM 0 HA LEU A 114 -11.197 10.201 1.190 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -11.400 7.900 -0.231 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -10.132 7.395 0.869 1.00 0.00 H new ATOM 0 HG LEU A 114 -12.331 6.625 1.521 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -12.316 7.262 3.899 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -10.702 6.842 3.278 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -11.142 8.548 3.529 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -14.022 8.212 2.449 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -13.008 9.572 1.911 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -13.725 8.468 0.713 1.00 0.00 H new ATOM 1507 N SER A 115 -8.063 9.191 1.335 1.00 0.00 N ATOM 1508 CA SER A 115 -6.842 9.156 2.146 1.00 0.00 C ATOM 1509 C SER A 115 -6.062 10.486 2.099 1.00 0.00 C ATOM 1510 O SER A 115 -4.987 10.583 1.500 1.00 0.00 O ATOM 1511 CB SER A 115 -5.972 7.959 1.726 1.00 0.00 C ATOM 1512 OG SER A 115 -5.630 8.001 0.349 1.00 0.00 O ATOM 0 H SER A 115 -7.926 8.825 0.393 1.00 0.00 H new ATOM 0 HA SER A 115 -7.132 9.025 3.188 1.00 0.00 H new ATOM 0 HB2 SER A 115 -5.061 7.946 2.325 1.00 0.00 H new ATOM 0 HB3 SER A 115 -6.505 7.032 1.938 1.00 0.00 H new ATOM 0 HG SER A 115 -5.746 7.111 -0.044 1.00 0.00 H new ATOM 1518 N MET A 116 -6.581 11.528 2.763 1.00 0.00 N ATOM 1519 CA MET A 116 -5.856 12.800 2.945 1.00 0.00 C ATOM 1520 C MET A 116 -4.535 12.634 3.720 1.00 0.00 C ATOM 1521 O MET A 116 -3.594 13.397 3.503 1.00 0.00 O ATOM 1522 CB MET A 116 -6.751 13.831 3.651 1.00 0.00 C ATOM 1523 CG MET A 116 -7.777 14.447 2.692 1.00 0.00 C ATOM 1524 SD MET A 116 -8.765 15.796 3.398 1.00 0.00 S ATOM 1525 CE MET A 116 -7.475 17.049 3.655 1.00 0.00 C ATOM 0 H MET A 116 -7.508 11.517 3.188 1.00 0.00 H new ATOM 0 HA MET A 116 -5.599 13.156 1.947 1.00 0.00 H new ATOM 0 HB2 MET A 116 -7.271 13.353 4.481 1.00 0.00 H new ATOM 0 HB3 MET A 116 -6.131 14.620 4.076 1.00 0.00 H new ATOM 0 HG2 MET A 116 -7.253 14.821 1.813 1.00 0.00 H new ATOM 0 HG3 MET A 116 -8.451 13.662 2.351 1.00 0.00 H new ATOM 0 HE1 MET A 116 -7.939 18.023 3.811 1.00 0.00 H new ATOM 0 HE2 MET A 116 -6.881 16.786 4.530 1.00 0.00 H new ATOM 0 HE3 MET A 116 -6.829 17.092 2.778 1.00 0.00 H new ATOM 1535 N SER A 117 -4.446 11.631 4.597 1.00 0.00 N ATOM 1536 CA SER A 117 -3.218 11.252 5.311 1.00 0.00 C ATOM 1537 C SER A 117 -2.731 9.856 4.872 1.00 0.00 C ATOM 1538 O SER A 117 -3.238 8.834 5.342 1.00 0.00 O ATOM 1539 CB SER A 117 -3.454 11.297 6.832 1.00 0.00 C ATOM 1540 OG SER A 117 -3.775 12.614 7.264 1.00 0.00 O ATOM 0 H SER A 117 -5.244 11.044 4.838 1.00 0.00 H new ATOM 0 HA SER A 117 -2.437 11.969 5.059 1.00 0.00 H new ATOM 0 HB2 SER A 117 -4.263 10.617 7.097 1.00 0.00 H new ATOM 0 HB3 SER A 117 -2.562 10.948 7.352 1.00 0.00 H new ATOM 0 HG SER A 117 -3.922 12.614 8.233 1.00 0.00 H new ATOM 1546 N THR A 118 -1.726 9.815 3.983 1.00 0.00 N ATOM 1547 CA THR A 118 -1.019 8.594 3.528 1.00 0.00 C ATOM 1548 C THR A 118 0.205 8.244 4.390 1.00 0.00 C ATOM 1549 O THR A 118 0.916 7.280 4.101 1.00 0.00 O ATOM 1550 CB THR A 118 -0.596 8.755 2.058 1.00 0.00 C ATOM 1551 OG1 THR A 118 0.175 9.936 1.951 1.00 0.00 O ATOM 1552 CG2 THR A 118 -1.803 8.851 1.120 1.00 0.00 C ATOM 0 H THR A 118 -1.365 10.660 3.541 1.00 0.00 H new ATOM 0 HA THR A 118 -1.721 7.767 3.632 1.00 0.00 H new ATOM 0 HB THR A 118 -0.022 7.877 1.762 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.458 10.059 1.021 1.00 0.00 H new ATOM 0 HG21 THR A 118 -1.457 8.964 0.092 1.00 0.00 H new ATOM 0 HG22 THR A 118 -2.402 7.944 1.204 1.00 0.00 H new ATOM 0 HG23 THR A 118 -2.410 9.713 1.395 1.00 0.00 H new ATOM 1560 N GLU A 119 0.470 9.035 5.432 1.00 0.00 N ATOM 1561 CA GLU A 119 1.647 8.959 6.300 1.00 0.00 C ATOM 1562 C GLU A 119 1.428 8.009 7.494 1.00 0.00 C ATOM 1563 O GLU A 119 0.306 7.836 7.975 1.00 0.00 O ATOM 1564 CB GLU A 119 1.993 10.392 6.745 1.00 0.00 C ATOM 1565 CG GLU A 119 3.354 10.516 7.437 1.00 0.00 C ATOM 1566 CD GLU A 119 3.761 11.991 7.571 1.00 0.00 C ATOM 1567 OE1 GLU A 119 4.543 12.486 6.724 1.00 0.00 O ATOM 1568 OE2 GLU A 119 3.303 12.667 8.522 1.00 0.00 O1- ATOM 0 H GLU A 119 -0.164 9.785 5.707 1.00 0.00 H new ATOM 0 HA GLU A 119 2.487 8.532 5.752 1.00 0.00 H new ATOM 0 HB2 GLU A 119 1.979 11.046 5.873 1.00 0.00 H new ATOM 0 HB3 GLU A 119 1.218 10.748 7.423 1.00 0.00 H new ATOM 0 HG2 GLU A 119 3.310 10.055 8.423 1.00 0.00 H new ATOM 0 HG3 GLU A 119 4.109 9.975 6.866 1.00 0.00 H new ATOM 1575 N LEU A 120 2.519 7.416 7.997 1.00 0.00 N ATOM 1576 CA LEU A 120 2.549 6.342 9.008 1.00 0.00 C ATOM 1577 C LEU A 120 2.196 6.785 10.451 1.00 0.00 C ATOM 1578 O LEU A 120 2.501 6.082 11.414 1.00 0.00 O ATOM 1579 CB LEU A 120 3.937 5.660 8.939 1.00 0.00 C ATOM 1580 CG LEU A 120 4.312 5.037 7.576 1.00 0.00 C ATOM 1581 CD1 LEU A 120 5.718 4.425 7.658 1.00 0.00 C ATOM 1582 CD2 LEU A 120 3.309 3.959 7.147 1.00 0.00 C ATOM 0 H LEU A 120 3.456 7.684 7.696 1.00 0.00 H new ATOM 0 HA LEU A 120 1.753 5.639 8.761 1.00 0.00 H new ATOM 0 HB2 LEU A 120 4.696 6.396 9.202 1.00 0.00 H new ATOM 0 HB3 LEU A 120 3.975 4.878 9.698 1.00 0.00 H new ATOM 0 HG LEU A 120 4.291 5.831 6.830 1.00 0.00 H new ATOM 0 HD11 LEU A 120 5.980 3.986 6.695 1.00 0.00 H new ATOM 0 HD12 LEU A 120 6.439 5.202 7.911 1.00 0.00 H new ATOM 0 HD13 LEU A 120 5.734 3.652 8.426 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.609 3.546 6.184 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.289 3.164 7.892 1.00 0.00 H new ATOM 0 HD23 LEU A 120 2.316 4.400 7.060 1.00 0.00 H new ATOM 1594 N ASP A 121 1.560 7.945 10.621 1.00 0.00 N ATOM 1595 CA ASP A 121 1.144 8.512 11.916 1.00 0.00 C ATOM 1596 C ASP A 121 -0.154 7.878 12.476 1.00 0.00 C ATOM 1597 O ASP A 121 -0.518 8.098 13.634 1.00 0.00 O ATOM 1598 CB ASP A 121 0.987 10.031 11.726 1.00 0.00 C ATOM 1599 CG ASP A 121 0.816 10.791 13.053 1.00 0.00 C ATOM 1600 OD1 ASP A 121 -0.236 11.449 13.240 1.00 0.00 O ATOM 1601 OD2 ASP A 121 1.755 10.767 13.885 1.00 0.00 O1- ATOM 0 H ASP A 121 1.308 8.543 9.834 1.00 0.00 H new ATOM 0 HA ASP A 121 1.908 8.288 12.660 1.00 0.00 H new ATOM 0 HB2 ASP A 121 1.861 10.418 11.203 1.00 0.00 H new ATOM 0 HB3 ASP A 121 0.123 10.224 11.090 1.00 0.00 H new ATOM 1606 N THR A 122 -0.853 7.084 11.654 1.00 0.00 N ATOM 1607 CA THR A 122 -2.165 6.458 11.903 1.00 0.00 C ATOM 1608 C THR A 122 -2.055 5.141 12.692 1.00 0.00 C ATOM 1609 O THR A 122 -2.589 4.102 12.296 1.00 0.00 O ATOM 1610 CB THR A 122 -2.916 6.312 10.566 1.00 0.00 C ATOM 1611 OG1 THR A 122 -2.042 5.773 9.592 1.00 0.00 O ATOM 1612 CG2 THR A 122 -3.403 7.677 10.065 1.00 0.00 C ATOM 0 H THR A 122 -0.493 6.843 10.730 1.00 0.00 H new ATOM 0 HA THR A 122 -2.751 7.109 12.552 1.00 0.00 H new ATOM 0 HB THR A 122 -3.772 5.656 10.726 1.00 0.00 H new ATOM 0 HG1 THR A 122 -2.519 5.678 8.741 1.00 0.00 H new ATOM 0 HG21 THR A 122 -3.931 7.551 9.120 1.00 0.00 H new ATOM 0 HG22 THR A 122 -4.077 8.115 10.801 1.00 0.00 H new ATOM 0 HG23 THR A 122 -2.548 8.337 9.918 1.00 0.00 H new ATOM 1620 N THR A 123 -1.352 5.202 13.831 1.00 0.00 N ATOM 1621 CA THR A 123 -1.094 4.107 14.789 1.00 0.00 C ATOM 1622 C THR A 123 -2.392 3.476 15.309 1.00 0.00 C ATOM 1623 O THR A 123 -3.454 4.093 15.287 1.00 0.00 O ATOM 1624 CB THR A 123 -0.228 4.660 15.937 1.00 0.00 C ATOM 1625 OG1 THR A 123 0.881 5.326 15.372 1.00 0.00 O ATOM 1626 CG2 THR A 123 0.344 3.601 16.885 1.00 0.00 C ATOM 0 H THR A 123 -0.917 6.074 14.132 1.00 0.00 H new ATOM 0 HA THR A 123 -0.559 3.304 14.281 1.00 0.00 H new ATOM 0 HB THR A 123 -0.889 5.301 16.520 1.00 0.00 H new ATOM 0 HG1 THR A 123 1.445 5.687 16.087 1.00 0.00 H new ATOM 0 HG21 THR A 123 0.938 4.088 17.658 1.00 0.00 H new ATOM 0 HG22 THR A 123 -0.473 3.049 17.349 1.00 0.00 H new ATOM 0 HG23 THR A 123 0.974 2.912 16.323 1.00 0.00 H new ATOM 1634 N HIS A 124 -2.317 2.249 15.834 1.00 0.00 N ATOM 1635 CA HIS A 124 -3.474 1.506 16.363 1.00 0.00 C ATOM 1636 C HIS A 124 -4.261 2.276 17.450 1.00 0.00 C ATOM 1637 O HIS A 124 -5.473 2.100 17.563 1.00 0.00 O ATOM 1638 CB HIS A 124 -2.966 0.148 16.881 1.00 0.00 C ATOM 1639 CG HIS A 124 -4.001 -0.734 17.544 1.00 0.00 C ATOM 1640 ND1 HIS A 124 -3.807 -1.480 18.686 1.00 0.00 N ATOM 1641 CD2 HIS A 124 -5.290 -0.961 17.136 1.00 0.00 C ATOM 1642 CE1 HIS A 124 -4.951 -2.128 18.963 1.00 0.00 C ATOM 1643 NE2 HIS A 124 -5.890 -1.843 18.044 1.00 0.00 N ATOM 0 H HIS A 124 -1.440 1.733 15.906 1.00 0.00 H new ATOM 0 HA HIS A 124 -4.193 1.364 15.557 1.00 0.00 H new ATOM 0 HB2 HIS A 124 -2.532 -0.399 16.044 1.00 0.00 H new ATOM 0 HB3 HIS A 124 -2.162 0.330 17.594 1.00 0.00 H new ATOM 0 HD2 HIS A 124 -5.762 -0.533 16.264 1.00 0.00 H new ATOM 0 HE1 HIS A 124 -5.096 -2.786 19.807 1.00 0.00 H new ATOM 0 HE2 HIS A 124 -6.846 -2.197 18.014 1.00 0.00 H new ATOM 1651 N PHE A 125 -3.610 3.191 18.184 1.00 0.00 N ATOM 1652 CA PHE A 125 -4.223 4.077 19.185 1.00 0.00 C ATOM 1653 C PHE A 125 -5.435 4.893 18.679 1.00 0.00 C ATOM 1654 O PHE A 125 -6.226 5.369 19.496 1.00 0.00 O ATOM 1655 CB PHE A 125 -3.134 5.010 19.757 1.00 0.00 C ATOM 1656 CG PHE A 125 -2.835 4.772 21.225 1.00 0.00 C ATOM 1657 CD1 PHE A 125 -3.731 5.238 22.207 1.00 0.00 C ATOM 1658 CD2 PHE A 125 -1.666 4.090 21.615 1.00 0.00 C ATOM 1659 CE1 PHE A 125 -3.459 5.026 23.570 1.00 0.00 C ATOM 1660 CE2 PHE A 125 -1.394 3.880 22.979 1.00 0.00 C ATOM 1661 CZ PHE A 125 -2.290 4.348 23.957 1.00 0.00 C ATOM 0 H PHE A 125 -2.605 3.340 18.093 1.00 0.00 H new ATOM 0 HA PHE A 125 -4.635 3.432 19.961 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -2.217 4.878 19.183 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -3.448 6.045 19.623 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -4.629 5.760 21.912 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -0.978 3.728 20.866 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -4.149 5.384 24.320 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -0.496 3.359 23.276 1.00 0.00 H new ATOM 0 HZ PHE A 125 -2.080 4.187 25.004 1.00 0.00 H new ATOM 1671 N LEU A 126 -5.610 5.048 17.358 1.00 0.00 N ATOM 1672 CA LEU A 126 -6.781 5.692 16.745 1.00 0.00 C ATOM 1673 C LEU A 126 -8.098 4.912 16.954 1.00 0.00 C ATOM 1674 O LEU A 126 -9.166 5.527 16.899 1.00 0.00 O ATOM 1675 CB LEU A 126 -6.515 5.889 15.233 1.00 0.00 C ATOM 1676 CG LEU A 126 -5.834 7.222 14.853 1.00 0.00 C ATOM 1677 CD1 LEU A 126 -4.422 7.402 15.431 1.00 0.00 C ATOM 1678 CD2 LEU A 126 -5.766 7.328 13.322 1.00 0.00 C ATOM 0 H LEU A 126 -4.928 4.723 16.673 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.917 6.651 17.244 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.892 5.068 14.880 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.464 5.820 14.701 1.00 0.00 H new ATOM 0 HG LEU A 126 -6.444 8.013 15.290 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -4.019 8.364 15.114 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.467 7.368 16.520 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -3.776 6.602 15.070 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -5.287 8.266 13.043 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -5.188 6.493 12.925 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.775 7.300 12.910 1.00 0.00 H new ATOM 1690 N LEU A 127 -8.052 3.588 17.166 1.00 0.00 N ATOM 1691 CA LEU A 127 -9.221 2.687 17.134 1.00 0.00 C ATOM 1692 C LEU A 127 -9.194 1.623 18.262 1.00 0.00 C ATOM 1693 O LEU A 127 -8.130 1.347 18.820 1.00 0.00 O ATOM 1694 CB LEU A 127 -9.286 2.038 15.729 1.00 0.00 C ATOM 1695 CG LEU A 127 -9.885 2.959 14.640 1.00 0.00 C ATOM 1696 CD1 LEU A 127 -9.562 2.407 13.248 1.00 0.00 C ATOM 1697 CD2 LEU A 127 -11.409 3.105 14.788 1.00 0.00 C ATOM 0 H LEU A 127 -7.180 3.099 17.370 1.00 0.00 H new ATOM 0 HA LEU A 127 -10.124 3.269 17.320 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -8.280 1.743 15.429 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -9.881 1.127 15.788 1.00 0.00 H new ATOM 0 HG LEU A 127 -9.435 3.944 14.764 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -9.988 3.063 12.489 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -8.481 2.356 13.118 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -9.987 1.408 13.145 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -11.790 3.760 14.004 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -11.878 2.125 14.702 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -11.640 3.534 15.763 1.00 0.00 H new ATOM 1709 N PRO A 128 -10.349 1.006 18.607 1.00 0.00 N ATOM 1710 CA PRO A 128 -10.465 0.051 19.716 1.00 0.00 C ATOM 1711 C PRO A 128 -10.108 -1.406 19.353 1.00 0.00 C ATOM 1712 O PRO A 128 -10.126 -2.262 20.237 1.00 0.00 O ATOM 1713 CB PRO A 128 -11.929 0.162 20.157 1.00 0.00 C ATOM 1714 CG PRO A 128 -12.661 0.432 18.846 1.00 0.00 C ATOM 1715 CD PRO A 128 -11.680 1.335 18.100 1.00 0.00 C ATOM 0 HA PRO A 128 -9.747 0.297 20.499 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -12.278 -0.754 20.633 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -12.075 0.969 20.875 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -12.864 -0.488 18.297 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -13.620 0.923 19.010 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -11.738 1.167 17.025 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -11.912 2.386 18.272 1.00 0.00 H new ATOM 1723 N VAL A 129 -9.802 -1.713 18.085 1.00 0.00 N ATOM 1724 CA VAL A 129 -9.558 -3.074 17.567 1.00 0.00 C ATOM 1725 C VAL A 129 -8.792 -3.007 16.235 1.00 0.00 C ATOM 1726 O VAL A 129 -8.851 -1.992 15.536 1.00 0.00 O ATOM 1727 CB VAL A 129 -10.881 -3.880 17.446 1.00 0.00 C ATOM 1728 CG1 VAL A 129 -11.824 -3.333 16.358 1.00 0.00 C ATOM 1729 CG2 VAL A 129 -10.643 -5.382 17.214 1.00 0.00 C ATOM 0 H VAL A 129 -9.713 -0.998 17.363 1.00 0.00 H new ATOM 0 HA VAL A 129 -8.934 -3.612 18.281 1.00 0.00 H new ATOM 0 HB VAL A 129 -11.369 -3.753 18.412 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -12.730 -3.939 16.323 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -12.086 -2.301 16.589 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -11.324 -3.372 15.390 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -11.602 -5.895 17.137 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -10.081 -5.523 16.291 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -10.077 -5.794 18.049 1.00 0.00 H new ATOM 1739 N LEU A 130 -8.076 -4.085 15.895 1.00 0.00 N ATOM 1740 CA LEU A 130 -7.226 -4.205 14.705 1.00 0.00 C ATOM 1741 C LEU A 130 -7.565 -5.445 13.851 1.00 0.00 C ATOM 1742 O LEU A 130 -8.035 -6.468 14.356 1.00 0.00 O ATOM 1743 CB LEU A 130 -5.740 -4.120 15.121 1.00 0.00 C ATOM 1744 CG LEU A 130 -5.274 -4.926 16.361 1.00 0.00 C ATOM 1745 CD1 LEU A 130 -5.559 -6.434 16.304 1.00 0.00 C ATOM 1746 CD2 LEU A 130 -3.769 -4.717 16.579 1.00 0.00 C ATOM 0 H LEU A 130 -8.073 -4.931 16.464 1.00 0.00 H new ATOM 0 HA LEU A 130 -7.431 -3.365 14.041 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -5.138 -4.441 14.271 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -5.505 -3.071 15.299 1.00 0.00 H new ATOM 0 HG LEU A 130 -5.864 -4.537 17.191 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -5.196 -6.908 17.216 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -6.633 -6.598 16.213 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -5.051 -6.868 15.443 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -3.445 -5.285 17.451 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -3.223 -5.059 15.700 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -3.568 -3.658 16.741 1.00 0.00 H new ATOM 1758 N GLY A 131 -7.354 -5.334 12.531 1.00 0.00 N ATOM 1759 CA GLY A 131 -7.740 -6.348 11.535 1.00 0.00 C ATOM 1760 C GLY A 131 -9.212 -6.754 11.672 1.00 0.00 C ATOM 1761 O GLY A 131 -10.073 -5.905 11.915 1.00 0.00 O ATOM 0 H GLY A 131 -6.901 -4.520 12.116 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -7.563 -5.958 10.533 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -7.108 -7.229 11.650 1.00 0.00 H new ATOM 1765 N ARG A 132 -9.479 -8.064 11.574 1.00 0.00 N ATOM 1766 CA ARG A 132 -10.720 -8.690 12.079 1.00 0.00 C ATOM 1767 C ARG A 132 -10.491 -9.531 13.353 1.00 0.00 C ATOM 1768 O ARG A 132 -11.418 -10.178 13.836 1.00 0.00 O ATOM 1769 CB ARG A 132 -11.401 -9.544 10.988 1.00 0.00 C ATOM 1770 CG ARG A 132 -11.403 -8.898 9.592 1.00 0.00 C ATOM 1771 CD ARG A 132 -12.617 -9.302 8.747 1.00 0.00 C ATOM 1772 NE ARG A 132 -13.806 -8.526 9.145 1.00 0.00 N ATOM 1773 CZ ARG A 132 -15.059 -8.730 8.760 1.00 0.00 C ATOM 1774 NH1 ARG A 132 -15.398 -9.726 7.968 1.00 0.00 N1+ ATOM 1775 NH2 ARG A 132 -16.003 -7.913 9.175 1.00 0.00 N ATOM 0 H ARG A 132 -8.838 -8.728 11.140 1.00 0.00 H new ATOM 0 HA ARG A 132 -11.384 -7.870 12.350 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -10.896 -10.508 10.929 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -12.431 -9.741 11.286 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -11.387 -7.813 9.700 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -10.491 -9.180 9.066 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -12.404 -9.136 7.691 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -12.814 -10.367 8.868 1.00 0.00 H new ATOM 0 HE ARG A 132 -13.648 -7.748 9.786 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -14.686 -10.373 7.629 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -16.372 -9.850 7.694 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -15.768 -7.131 9.787 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -16.970 -8.061 8.885 1.00 0.00 H new ATOM 1789 N HIS A 133 -9.251 -9.583 13.859 1.00 0.00 N ATOM 1790 CA HIS A 133 -8.807 -10.408 14.997 1.00 0.00 C ATOM 1791 C HIS A 133 -9.103 -11.924 14.799 1.00 0.00 C ATOM 1792 O HIS A 133 -9.414 -12.648 15.747 1.00 0.00 O ATOM 1793 CB HIS A 133 -9.373 -9.800 16.299 1.00 0.00 C ATOM 1794 CG HIS A 133 -8.666 -10.181 17.584 1.00 0.00 C ATOM 1795 ND1 HIS A 133 -9.045 -9.776 18.845 1.00 0.00 N ATOM 1796 CD2 HIS A 133 -7.532 -10.939 17.738 1.00 0.00 C ATOM 1797 CE1 HIS A 133 -8.169 -10.278 19.732 1.00 0.00 C ATOM 1798 NE2 HIS A 133 -7.221 -10.999 19.104 1.00 0.00 N ATOM 0 H HIS A 133 -8.492 -9.025 13.469 1.00 0.00 H new ATOM 0 HA HIS A 133 -7.720 -10.382 15.068 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -9.352 -8.714 16.206 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -10.420 -10.092 16.385 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -6.974 -11.409 16.942 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -8.219 -10.124 20.800 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -6.437 -11.489 19.534 1.00 0.00 H new ATOM 1806 N HIS A 134 -9.043 -12.410 13.549 1.00 0.00 N ATOM 1807 CA HIS A 134 -9.497 -13.758 13.151 1.00 0.00 C ATOM 1808 C HIS A 134 -9.007 -14.205 11.750 1.00 0.00 C ATOM 1809 O HIS A 134 -8.651 -15.369 11.571 1.00 0.00 O ATOM 1810 CB HIS A 134 -11.039 -13.790 13.211 1.00 0.00 C ATOM 1811 CG HIS A 134 -11.643 -15.129 12.862 1.00 0.00 C ATOM 1812 ND1 HIS A 134 -11.752 -16.221 13.696 1.00 0.00 N ATOM 1813 CD2 HIS A 134 -12.198 -15.486 11.661 1.00 0.00 C ATOM 1814 CE1 HIS A 134 -12.354 -17.209 13.012 1.00 0.00 C ATOM 1815 NE2 HIS A 134 -12.649 -16.810 11.760 1.00 0.00 N ATOM 0 H HIS A 134 -8.671 -11.868 12.769 1.00 0.00 H new ATOM 0 HA HIS A 134 -9.056 -14.467 13.851 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -11.358 -13.510 14.215 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -11.434 -13.037 12.529 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -12.275 -14.855 10.788 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -12.571 -18.189 13.412 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -13.107 -17.359 11.032 1.00 0.00 H new ATOM 1823 N SER A 135 -8.986 -13.310 10.751 1.00 0.00 N ATOM 1824 CA SER A 135 -8.725 -13.665 9.338 1.00 0.00 C ATOM 1825 C SER A 135 -7.324 -14.269 9.090 1.00 0.00 C ATOM 1826 O SER A 135 -7.204 -15.279 8.385 1.00 0.00 O ATOM 1827 CB SER A 135 -8.940 -12.412 8.469 1.00 0.00 C ATOM 1828 OG SER A 135 -8.884 -12.697 7.079 1.00 0.00 O ATOM 0 H SER A 135 -9.150 -12.314 10.896 1.00 0.00 H new ATOM 0 HA SER A 135 -9.427 -14.453 9.065 1.00 0.00 H new ATOM 0 HB2 SER A 135 -9.908 -11.971 8.707 1.00 0.00 H new ATOM 0 HB3 SER A 135 -8.181 -11.669 8.715 1.00 0.00 H new ATOM 0 HG SER A 135 -9.027 -11.872 6.570 1.00 0.00 H new ATOM 1834 N LEU A 136 -6.279 -13.693 9.710 1.00 0.00 N ATOM 1835 CA LEU A 136 -4.904 -14.227 9.762 1.00 0.00 C ATOM 1836 C LEU A 136 -4.254 -14.358 8.358 1.00 0.00 C ATOM 1837 O LEU A 136 -4.614 -13.629 7.434 1.00 0.00 O ATOM 1838 CB LEU A 136 -4.921 -15.542 10.591 1.00 0.00 C ATOM 1839 CG LEU A 136 -3.792 -15.639 11.636 1.00 0.00 C ATOM 1840 CD1 LEU A 136 -4.070 -14.716 12.835 1.00 0.00 C ATOM 1841 CD2 LEU A 136 -3.662 -17.087 12.128 1.00 0.00 C ATOM 0 H LEU A 136 -6.371 -12.808 10.209 1.00 0.00 H new ATOM 0 HA LEU A 136 -4.250 -13.517 10.269 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -5.881 -15.626 11.100 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -4.846 -16.390 9.910 1.00 0.00 H new ATOM 0 HG LEU A 136 -2.862 -15.324 11.162 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -3.258 -14.804 13.557 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -4.140 -13.684 12.491 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -5.009 -15.006 13.307 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -2.863 -17.150 12.866 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -4.601 -17.403 12.582 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -3.430 -17.738 11.285 1.00 0.00 H new ATOM 1853 N SER A 137 -3.275 -15.259 8.191 1.00 0.00 N ATOM 1854 CA SER A 137 -2.776 -15.749 6.882 1.00 0.00 C ATOM 1855 C SER A 137 -1.940 -14.711 6.085 1.00 0.00 C ATOM 1856 O SER A 137 -1.755 -14.832 4.870 1.00 0.00 O ATOM 1857 CB SER A 137 -3.957 -16.307 6.056 1.00 0.00 C ATOM 1858 OG SER A 137 -3.562 -17.339 5.157 1.00 0.00 O ATOM 0 H SER A 137 -2.789 -15.684 8.981 1.00 0.00 H new ATOM 0 HA SER A 137 -2.068 -16.552 7.091 1.00 0.00 H new ATOM 0 HB2 SER A 137 -4.718 -16.693 6.734 1.00 0.00 H new ATOM 0 HB3 SER A 137 -4.415 -15.495 5.491 1.00 0.00 H new ATOM 0 HG SER A 137 -4.345 -17.658 4.661 1.00 0.00 H new ATOM 1864 N GLY A 138 -1.453 -13.659 6.759 1.00 0.00 N ATOM 1865 CA GLY A 138 -0.970 -12.424 6.126 1.00 0.00 C ATOM 1866 C GLY A 138 0.545 -12.302 5.970 1.00 0.00 C ATOM 1867 O GLY A 138 1.090 -12.555 4.895 1.00 0.00 O ATOM 0 H GLY A 138 -1.383 -13.643 7.776 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -1.425 -12.343 5.139 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -1.325 -11.576 6.711 1.00 0.00 H new ATOM 1871 N ALA A 139 1.225 -11.856 7.033 1.00 0.00 N ATOM 1872 CA ALA A 139 2.682 -11.661 7.084 1.00 0.00 C ATOM 1873 C ALA A 139 3.269 -12.415 8.291 1.00 0.00 C ATOM 1874 O ALA A 139 3.801 -11.823 9.231 1.00 0.00 O ATOM 1875 CB ALA A 139 3.033 -10.162 7.047 1.00 0.00 C ATOM 0 H ALA A 139 0.764 -11.613 7.910 1.00 0.00 H new ATOM 0 HA ALA A 139 3.148 -12.090 6.197 1.00 0.00 H new ATOM 0 HB1 ALA A 139 4.116 -10.041 7.086 1.00 0.00 H new ATOM 0 HB2 ALA A 139 2.651 -9.722 6.126 1.00 0.00 H new ATOM 0 HB3 ALA A 139 2.581 -9.661 7.903 1.00 0.00 H new ATOM 1881 N THR A 140 3.121 -13.746 8.247 1.00 0.00 N ATOM 1882 CA THR A 140 3.696 -14.712 9.202 1.00 0.00 C ATOM 1883 C THR A 140 5.229 -14.795 9.107 1.00 0.00 C ATOM 1884 O THR A 140 5.895 -15.192 10.064 1.00 0.00 O ATOM 1885 CB THR A 140 2.997 -16.067 9.008 1.00 0.00 C ATOM 1886 OG1 THR A 140 3.361 -16.938 10.053 1.00 0.00 O ATOM 1887 CG2 THR A 140 3.309 -16.739 7.665 1.00 0.00 C ATOM 0 H THR A 140 2.575 -14.201 7.516 1.00 0.00 H new ATOM 0 HA THR A 140 3.511 -14.370 10.220 1.00 0.00 H new ATOM 0 HB THR A 140 1.926 -15.863 9.017 1.00 0.00 H new ATOM 0 HG1 THR A 140 2.914 -17.801 9.930 1.00 0.00 H new ATOM 0 HG21 THR A 140 2.780 -17.690 7.602 1.00 0.00 H new ATOM 0 HG22 THR A 140 2.988 -16.090 6.850 1.00 0.00 H new ATOM 0 HG23 THR A 140 4.382 -16.915 7.587 1.00 0.00 H new ATOM 1895 N GLU A 141 5.798 -14.360 7.977 1.00 0.00 N ATOM 1896 CA GLU A 141 7.235 -14.143 7.781 1.00 0.00 C ATOM 1897 C GLU A 141 7.805 -13.071 8.744 1.00 0.00 C ATOM 1898 O GLU A 141 7.066 -12.179 9.178 1.00 0.00 O ATOM 1899 CB GLU A 141 7.491 -13.710 6.325 1.00 0.00 C ATOM 1900 CG GLU A 141 7.223 -14.804 5.282 1.00 0.00 C ATOM 1901 CD GLU A 141 8.219 -15.969 5.399 1.00 0.00 C ATOM 1902 OE1 GLU A 141 7.849 -17.032 5.950 1.00 0.00 O ATOM 1903 OE2 GLU A 141 9.374 -15.831 4.933 1.00 0.00 O1- ATOM 0 H GLU A 141 5.251 -14.142 7.145 1.00 0.00 H new ATOM 0 HA GLU A 141 7.743 -15.083 7.998 1.00 0.00 H new ATOM 0 HB2 GLU A 141 6.863 -12.848 6.099 1.00 0.00 H new ATOM 0 HB3 GLU A 141 8.527 -13.383 6.233 1.00 0.00 H new ATOM 0 HG2 GLU A 141 6.208 -15.181 5.405 1.00 0.00 H new ATOM 0 HG3 GLU A 141 7.284 -14.374 4.282 1.00 0.00 H new ATOM 1910 N PRO A 142 9.115 -13.125 9.066 1.00 0.00 N ATOM 1911 CA PRO A 142 9.769 -12.176 9.965 1.00 0.00 C ATOM 1912 C PRO A 142 10.003 -10.804 9.308 1.00 0.00 C ATOM 1913 O PRO A 142 9.731 -10.589 8.125 1.00 0.00 O ATOM 1914 CB PRO A 142 11.084 -12.860 10.366 1.00 0.00 C ATOM 1915 CG PRO A 142 11.433 -13.682 9.129 1.00 0.00 C ATOM 1916 CD PRO A 142 10.063 -14.152 8.648 1.00 0.00 C ATOM 0 HA PRO A 142 9.147 -11.951 10.831 1.00 0.00 H new ATOM 0 HB2 PRO A 142 11.862 -12.133 10.601 1.00 0.00 H new ATOM 0 HB3 PRO A 142 10.959 -13.489 11.247 1.00 0.00 H new ATOM 0 HG2 PRO A 142 11.945 -13.084 8.375 1.00 0.00 H new ATOM 0 HG3 PRO A 142 12.088 -14.519 9.370 1.00 0.00 H new ATOM 0 HD2 PRO A 142 10.051 -14.276 7.565 1.00 0.00 H new ATOM 0 HD3 PRO A 142 9.808 -15.119 9.082 1.00 0.00 H new ATOM 1924 N ASP A 143 10.574 -9.880 10.087 1.00 0.00 N ATOM 1925 CA ASP A 143 10.948 -8.516 9.681 1.00 0.00 C ATOM 1926 C ASP A 143 12.003 -8.449 8.552 1.00 0.00 C ATOM 1927 O ASP A 143 12.240 -7.380 7.990 1.00 0.00 O ATOM 1928 CB ASP A 143 11.428 -7.748 10.924 1.00 0.00 C ATOM 1929 CG ASP A 143 12.754 -8.288 11.491 1.00 0.00 C ATOM 1930 OD1 ASP A 143 12.727 -9.329 12.191 1.00 0.00 O ATOM 1931 OD2 ASP A 143 13.813 -7.656 11.260 1.00 0.00 O1- ATOM 0 H ASP A 143 10.800 -10.069 11.064 1.00 0.00 H new ATOM 0 HA ASP A 143 10.058 -8.054 9.255 1.00 0.00 H new ATOM 0 HB2 ASP A 143 11.550 -6.695 10.669 1.00 0.00 H new ATOM 0 HB3 ASP A 143 10.661 -7.802 11.696 1.00 0.00 H new ATOM 1936 N ASP A 144 12.601 -9.590 8.186 1.00 0.00 N ATOM 1937 CA ASP A 144 13.479 -9.752 7.019 1.00 0.00 C ATOM 1938 C ASP A 144 12.764 -9.440 5.685 1.00 0.00 C ATOM 1939 O ASP A 144 13.413 -9.029 4.722 1.00 0.00 O ATOM 1940 CB ASP A 144 14.024 -11.189 7.014 1.00 0.00 C ATOM 1941 CG ASP A 144 15.145 -11.389 5.979 1.00 0.00 C ATOM 1942 OD1 ASP A 144 14.937 -12.145 5.000 1.00 0.00 O ATOM 1943 OD2 ASP A 144 16.246 -10.818 6.170 1.00 0.00 O1- ATOM 0 H ASP A 144 12.483 -10.456 8.712 1.00 0.00 H new ATOM 0 HA ASP A 144 14.294 -9.033 7.102 1.00 0.00 H new ATOM 0 HB2 ASP A 144 14.402 -11.435 8.006 1.00 0.00 H new ATOM 0 HB3 ASP A 144 13.210 -11.882 6.802 1.00 0.00 H new ATOM 1948 N GLU A 145 11.431 -9.589 5.647 1.00 0.00 N ATOM 1949 CA GLU A 145 10.578 -9.106 4.555 1.00 0.00 C ATOM 1950 C GLU A 145 10.346 -7.591 4.712 1.00 0.00 C ATOM 1951 O GLU A 145 10.935 -6.801 3.971 1.00 0.00 O ATOM 1952 CB GLU A 145 9.250 -9.888 4.519 1.00 0.00 C ATOM 1953 CG GLU A 145 9.384 -11.381 4.184 1.00 0.00 C ATOM 1954 CD GLU A 145 9.792 -11.660 2.726 1.00 0.00 C ATOM 1955 OE1 GLU A 145 10.989 -11.518 2.382 1.00 0.00 O ATOM 1956 OE2 GLU A 145 8.923 -12.083 1.928 1.00 0.00 O1- ATOM 0 H GLU A 145 10.909 -10.057 6.388 1.00 0.00 H new ATOM 0 HA GLU A 145 11.077 -9.276 3.601 1.00 0.00 H new ATOM 0 HB2 GLU A 145 8.762 -9.791 5.489 1.00 0.00 H new ATOM 0 HB3 GLU A 145 8.592 -9.424 3.784 1.00 0.00 H new ATOM 0 HG2 GLU A 145 10.123 -11.827 4.849 1.00 0.00 H new ATOM 0 HG3 GLU A 145 8.434 -11.875 4.386 1.00 0.00 H new ATOM 1963 N ARG A 146 9.542 -7.186 5.711 1.00 0.00 N ATOM 1964 CA ARG A 146 9.350 -5.783 6.129 1.00 0.00 C ATOM 1965 C ARG A 146 8.687 -5.669 7.509 1.00 0.00 C ATOM 1966 O ARG A 146 9.236 -5.000 8.383 1.00 0.00 O ATOM 1967 CB ARG A 146 8.557 -4.980 5.069 1.00 0.00 C ATOM 1968 CG ARG A 146 8.418 -3.482 5.401 1.00 0.00 C ATOM 1969 CD ARG A 146 9.750 -2.719 5.353 1.00 0.00 C ATOM 1970 NE ARG A 146 9.624 -1.391 5.980 1.00 0.00 N ATOM 1971 CZ ARG A 146 10.532 -0.422 5.956 1.00 0.00 C ATOM 1972 NH1 ARG A 146 11.654 -0.530 5.274 1.00 0.00 N1+ ATOM 1973 NH2 ARG A 146 10.317 0.689 6.625 1.00 0.00 N ATOM 0 H ARG A 146 8.992 -7.842 6.266 1.00 0.00 H new ATOM 0 HA ARG A 146 10.345 -5.346 6.213 1.00 0.00 H new ATOM 0 HB2 ARG A 146 9.051 -5.084 4.103 1.00 0.00 H new ATOM 0 HB3 ARG A 146 7.562 -5.414 4.967 1.00 0.00 H new ATOM 0 HG2 ARG A 146 7.721 -3.025 4.698 1.00 0.00 H new ATOM 0 HG3 ARG A 146 7.983 -3.377 6.395 1.00 0.00 H new ATOM 0 HD2 ARG A 146 10.521 -3.295 5.865 1.00 0.00 H new ATOM 0 HD3 ARG A 146 10.071 -2.607 4.317 1.00 0.00 H new ATOM 0 HE ARG A 146 8.756 -1.198 6.480 1.00 0.00 H new ATOM 0 HH11 ARG A 146 11.848 -1.378 4.742 1.00 0.00 H new ATOM 0 HH12 ARG A 146 12.329 0.235 5.278 1.00 0.00 H new ATOM 0 HH21 ARG A 146 9.456 0.804 7.159 1.00 0.00 H new ATOM 0 HH22 ARG A 146 11.011 1.436 6.610 1.00 0.00 H new ATOM 1987 N VAL A 147 7.525 -6.304 7.701 1.00 0.00 N ATOM 1988 CA VAL A 147 6.780 -6.321 8.978 1.00 0.00 C ATOM 1989 C VAL A 147 6.604 -7.747 9.501 1.00 0.00 C ATOM 1990 O VAL A 147 6.440 -8.684 8.720 1.00 0.00 O ATOM 1991 CB VAL A 147 5.403 -5.617 8.899 1.00 0.00 C ATOM 1992 CG1 VAL A 147 5.564 -4.131 8.543 1.00 0.00 C ATOM 1993 CG2 VAL A 147 4.416 -6.278 7.920 1.00 0.00 C ATOM 0 H VAL A 147 7.062 -6.833 6.962 1.00 0.00 H new ATOM 0 HA VAL A 147 7.391 -5.751 9.678 1.00 0.00 H new ATOM 0 HB VAL A 147 4.973 -5.718 9.895 1.00 0.00 H new ATOM 0 HG11 VAL A 147 4.582 -3.660 8.494 1.00 0.00 H new ATOM 0 HG12 VAL A 147 6.166 -3.637 9.306 1.00 0.00 H new ATOM 0 HG13 VAL A 147 6.059 -4.040 7.576 1.00 0.00 H new ATOM 0 HG21 VAL A 147 3.476 -5.726 7.923 1.00 0.00 H new ATOM 0 HG22 VAL A 147 4.839 -6.269 6.915 1.00 0.00 H new ATOM 0 HG23 VAL A 147 4.233 -7.308 8.228 1.00 0.00 H new ATOM 2003 N LEU A 148 6.629 -7.887 10.830 1.00 0.00 N ATOM 2004 CA LEU A 148 6.477 -9.163 11.546 1.00 0.00 C ATOM 2005 C LEU A 148 5.039 -9.403 12.054 1.00 0.00 C ATOM 2006 O LEU A 148 4.692 -10.538 12.385 1.00 0.00 O ATOM 2007 CB LEU A 148 7.550 -9.166 12.657 1.00 0.00 C ATOM 2008 CG LEU A 148 7.539 -10.363 13.636 1.00 0.00 C ATOM 2009 CD1 LEU A 148 8.968 -10.672 14.107 1.00 0.00 C ATOM 2010 CD2 LEU A 148 6.681 -10.095 14.889 1.00 0.00 C ATOM 0 H LEU A 148 6.759 -7.094 11.458 1.00 0.00 H new ATOM 0 HA LEU A 148 6.636 -10.009 10.877 1.00 0.00 H new ATOM 0 HB2 LEU A 148 8.530 -9.125 12.182 1.00 0.00 H new ATOM 0 HB3 LEU A 148 7.439 -8.251 13.239 1.00 0.00 H new ATOM 0 HG LEU A 148 7.110 -11.203 13.089 1.00 0.00 H new ATOM 0 HD11 LEU A 148 8.949 -11.516 14.796 1.00 0.00 H new ATOM 0 HD12 LEU A 148 9.589 -10.920 13.246 1.00 0.00 H new ATOM 0 HD13 LEU A 148 9.381 -9.800 14.613 1.00 0.00 H new ATOM 0 HD21 LEU A 148 6.708 -10.967 15.542 1.00 0.00 H new ATOM 0 HD22 LEU A 148 7.076 -9.230 15.422 1.00 0.00 H new ATOM 0 HD23 LEU A 148 5.652 -9.898 14.590 1.00 0.00 H new ATOM 2022 N GLY A 149 4.199 -8.358 12.109 1.00 0.00 N ATOM 2023 CA GLY A 149 2.835 -8.405 12.654 1.00 0.00 C ATOM 2024 C GLY A 149 1.873 -9.172 11.744 1.00 0.00 C ATOM 2025 O GLY A 149 1.640 -10.362 11.959 1.00 0.00 O ATOM 0 H GLY A 149 4.457 -7.433 11.766 1.00 0.00 H new ATOM 0 HA2 GLY A 149 2.855 -8.875 13.637 1.00 0.00 H new ATOM 0 HA3 GLY A 149 2.467 -7.389 12.794 1.00 0.00 H new ATOM 2029 N TRP A 150 1.332 -8.492 10.727 1.00 0.00 N ATOM 2030 CA TRP A 150 0.488 -9.066 9.667 1.00 0.00 C ATOM 2031 C TRP A 150 0.205 -8.075 8.519 1.00 0.00 C ATOM 2032 O TRP A 150 0.372 -6.862 8.656 1.00 0.00 O ATOM 2033 CB TRP A 150 -0.806 -9.706 10.222 1.00 0.00 C ATOM 2034 CG TRP A 150 -1.547 -8.950 11.279 1.00 0.00 C ATOM 2035 CD1 TRP A 150 -1.659 -9.347 12.567 1.00 0.00 C ATOM 2036 CD2 TRP A 150 -2.276 -7.686 11.184 1.00 0.00 C ATOM 2037 NE1 TRP A 150 -2.399 -8.428 13.277 1.00 0.00 N ATOM 2038 CE2 TRP A 150 -2.793 -7.378 12.478 1.00 0.00 C ATOM 2039 CE3 TRP A 150 -2.548 -6.755 10.155 1.00 0.00 C ATOM 2040 CZ2 TRP A 150 -3.518 -6.212 12.740 1.00 0.00 C ATOM 2041 CZ3 TRP A 150 -3.248 -5.564 10.420 1.00 0.00 C ATOM 2042 CH2 TRP A 150 -3.739 -5.289 11.706 1.00 0.00 C ATOM 0 H TRP A 150 1.474 -7.488 10.613 1.00 0.00 H new ATOM 0 HA TRP A 150 1.072 -9.875 9.229 1.00 0.00 H new ATOM 0 HB2 TRP A 150 -1.486 -9.871 9.386 1.00 0.00 H new ATOM 0 HB3 TRP A 150 -0.552 -10.687 10.624 1.00 0.00 H new ATOM 0 HD1 TRP A 150 -1.232 -10.250 12.977 1.00 0.00 H new ATOM 0 HE1 TRP A 150 -2.626 -8.514 14.268 1.00 0.00 H new ATOM 0 HE3 TRP A 150 -2.213 -6.962 9.149 1.00 0.00 H new ATOM 0 HZ2 TRP A 150 -3.905 -6.023 13.730 1.00 0.00 H new ATOM 0 HZ3 TRP A 150 -3.410 -4.852 9.624 1.00 0.00 H new ATOM 0 HH2 TRP A 150 -4.282 -4.375 11.898 1.00 0.00 H new ATOM 2053 N VAL A 151 -0.253 -8.620 7.387 1.00 0.00 N ATOM 2054 CA VAL A 151 -0.710 -7.904 6.186 1.00 0.00 C ATOM 2055 C VAL A 151 -1.910 -8.658 5.597 1.00 0.00 C ATOM 2056 O VAL A 151 -1.751 -9.771 5.105 1.00 0.00 O ATOM 2057 CB VAL A 151 0.417 -7.777 5.133 1.00 0.00 C ATOM 2058 CG1 VAL A 151 -0.109 -7.311 3.765 1.00 0.00 C ATOM 2059 CG2 VAL A 151 1.529 -6.835 5.623 1.00 0.00 C ATOM 0 H VAL A 151 -0.319 -9.632 7.276 1.00 0.00 H new ATOM 0 HA VAL A 151 -1.000 -6.891 6.466 1.00 0.00 H new ATOM 0 HB VAL A 151 0.833 -8.776 5.002 1.00 0.00 H new ATOM 0 HG11 VAL A 151 0.721 -7.238 3.062 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -0.839 -8.030 3.392 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -0.582 -6.335 3.870 1.00 0.00 H new ATOM 0 HG21 VAL A 151 2.307 -6.765 4.863 1.00 0.00 H new ATOM 0 HG22 VAL A 151 1.112 -5.845 5.808 1.00 0.00 H new ATOM 0 HG23 VAL A 151 1.957 -7.227 6.546 1.00 0.00 H new ATOM 2069 N GLU A 152 -3.103 -8.070 5.657 1.00 0.00 N ATOM 2070 CA GLU A 152 -4.323 -8.610 5.049 1.00 0.00 C ATOM 2071 C GLU A 152 -4.428 -8.155 3.584 1.00 0.00 C ATOM 2072 O GLU A 152 -4.048 -7.029 3.248 1.00 0.00 O ATOM 2073 CB GLU A 152 -5.567 -8.188 5.857 1.00 0.00 C ATOM 2074 CG GLU A 152 -6.527 -9.349 6.147 1.00 0.00 C ATOM 2075 CD GLU A 152 -7.145 -9.946 4.873 1.00 0.00 C ATOM 2076 OE1 GLU A 152 -6.517 -10.844 4.265 1.00 0.00 O ATOM 2077 OE2 GLU A 152 -8.249 -9.509 4.476 1.00 0.00 O1- ATOM 0 H GLU A 152 -3.255 -7.185 6.140 1.00 0.00 H new ATOM 0 HA GLU A 152 -4.273 -9.699 5.065 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -5.246 -7.747 6.801 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -6.102 -7.412 5.309 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -5.992 -10.131 6.686 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -7.325 -8.999 6.802 1.00 0.00 H new ATOM 2084 N LEU A 153 -4.957 -9.024 2.719 1.00 0.00 N ATOM 2085 CA LEU A 153 -5.018 -8.826 1.271 1.00 0.00 C ATOM 2086 C LEU A 153 -6.235 -9.529 0.646 1.00 0.00 C ATOM 2087 O LEU A 153 -6.298 -10.758 0.581 1.00 0.00 O ATOM 2088 CB LEU A 153 -3.668 -9.211 0.625 1.00 0.00 C ATOM 2089 CG LEU A 153 -3.206 -10.677 0.837 1.00 0.00 C ATOM 2090 CD1 LEU A 153 -3.227 -11.461 -0.486 1.00 0.00 C ATOM 2091 CD2 LEU A 153 -1.797 -10.729 1.448 1.00 0.00 C ATOM 0 H LEU A 153 -5.366 -9.910 3.017 1.00 0.00 H new ATOM 0 HA LEU A 153 -5.174 -7.768 1.063 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -3.734 -9.023 -0.447 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -2.897 -8.548 1.018 1.00 0.00 H new ATOM 0 HG LEU A 153 -3.907 -11.141 1.531 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -2.899 -12.485 -0.307 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -4.240 -11.470 -0.888 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -2.557 -10.985 -1.202 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -1.498 -11.768 1.586 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -1.092 -10.234 0.780 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -1.800 -10.221 2.413 1.00 0.00 H new ATOM 2103 N GLU A 154 -7.190 -8.741 0.147 1.00 0.00 N ATOM 2104 CA GLU A 154 -8.377 -9.227 -0.557 1.00 0.00 C ATOM 2105 C GLU A 154 -8.831 -8.186 -1.598 1.00 0.00 C ATOM 2106 O GLU A 154 -9.384 -7.134 -1.263 1.00 0.00 O ATOM 2107 CB GLU A 154 -9.482 -9.569 0.463 1.00 0.00 C ATOM 2108 CG GLU A 154 -10.603 -10.430 -0.131 1.00 0.00 C ATOM 2109 CD GLU A 154 -10.212 -11.913 -0.221 1.00 0.00 C ATOM 2110 OE1 GLU A 154 -10.482 -12.674 0.739 1.00 0.00 O ATOM 2111 OE2 GLU A 154 -9.669 -12.336 -1.269 1.00 0.00 O1- ATOM 0 H GLU A 154 -7.158 -7.724 0.223 1.00 0.00 H new ATOM 0 HA GLU A 154 -8.144 -10.143 -1.101 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -9.038 -10.094 1.309 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -9.909 -8.644 0.851 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -11.499 -10.329 0.481 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -10.853 -10.061 -1.126 1.00 0.00 H new ATOM 2118 N LEU A 155 -8.584 -8.499 -2.874 1.00 0.00 N ATOM 2119 CA LEU A 155 -8.848 -7.666 -4.054 1.00 0.00 C ATOM 2120 C LEU A 155 -8.663 -8.465 -5.356 1.00 0.00 C ATOM 2121 O LEU A 155 -8.177 -9.596 -5.347 1.00 0.00 O ATOM 2122 CB LEU A 155 -8.000 -6.369 -4.050 1.00 0.00 C ATOM 2123 CG LEU A 155 -6.472 -6.534 -4.224 1.00 0.00 C ATOM 2124 CD1 LEU A 155 -5.918 -5.278 -4.907 1.00 0.00 C ATOM 2125 CD2 LEU A 155 -5.753 -6.746 -2.881 1.00 0.00 C ATOM 0 H LEU A 155 -8.169 -9.396 -3.127 1.00 0.00 H new ATOM 0 HA LEU A 155 -9.893 -7.358 -4.005 1.00 0.00 H new ATOM 0 HB2 LEU A 155 -8.365 -5.722 -4.848 1.00 0.00 H new ATOM 0 HB3 LEU A 155 -8.181 -5.848 -3.110 1.00 0.00 H new ATOM 0 HG LEU A 155 -6.293 -7.421 -4.832 1.00 0.00 H new ATOM 0 HD11 LEU A 155 -4.841 -5.380 -5.037 1.00 0.00 H new ATOM 0 HD12 LEU A 155 -6.391 -5.155 -5.881 1.00 0.00 H new ATOM 0 HD13 LEU A 155 -6.128 -4.405 -4.289 1.00 0.00 H new ATOM 0 HD21 LEU A 155 -4.683 -6.857 -3.055 1.00 0.00 H new ATOM 0 HD22 LEU A 155 -5.929 -5.886 -2.235 1.00 0.00 H new ATOM 0 HD23 LEU A 155 -6.137 -7.646 -2.400 1.00 0.00 H new ATOM 2137 N SER A 156 -9.016 -7.857 -6.485 1.00 0.00 N ATOM 2138 CA SER A 156 -9.006 -8.485 -7.816 1.00 0.00 C ATOM 2139 C SER A 156 -8.656 -7.469 -8.926 1.00 0.00 C ATOM 2140 O SER A 156 -9.296 -7.409 -9.974 1.00 0.00 O ATOM 2141 CB SER A 156 -10.338 -9.229 -8.054 1.00 0.00 C ATOM 2142 OG SER A 156 -11.484 -8.424 -7.781 1.00 0.00 O ATOM 0 H SER A 156 -9.327 -6.886 -6.507 1.00 0.00 H new ATOM 0 HA SER A 156 -8.211 -9.230 -7.855 1.00 0.00 H new ATOM 0 HB2 SER A 156 -10.378 -9.569 -9.089 1.00 0.00 H new ATOM 0 HB3 SER A 156 -10.368 -10.119 -7.425 1.00 0.00 H new ATOM 0 HG SER A 156 -12.297 -8.944 -7.950 1.00 0.00 H new ATOM 2148 N HIS A 157 -7.638 -6.630 -8.692 1.00 0.00 N ATOM 2149 CA HIS A 157 -7.191 -5.598 -9.641 1.00 0.00 C ATOM 2150 C HIS A 157 -6.229 -6.139 -10.720 1.00 0.00 C ATOM 2151 O HIS A 157 -6.564 -6.151 -11.905 1.00 0.00 O ATOM 2152 CB HIS A 157 -6.549 -4.436 -8.858 1.00 0.00 C ATOM 2153 CG HIS A 157 -7.511 -3.551 -8.100 1.00 0.00 C ATOM 2154 ND1 HIS A 157 -7.150 -2.460 -7.340 1.00 0.00 N ATOM 2155 CD2 HIS A 157 -8.882 -3.597 -8.105 1.00 0.00 C ATOM 2156 CE1 HIS A 157 -8.272 -1.865 -6.906 1.00 0.00 C ATOM 2157 NE2 HIS A 157 -9.358 -2.523 -7.344 1.00 0.00 N ATOM 0 H HIS A 157 -7.095 -6.648 -7.829 1.00 0.00 H new ATOM 0 HA HIS A 157 -8.068 -5.243 -10.182 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -5.830 -4.851 -8.151 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -5.987 -3.817 -9.557 1.00 0.00 H new ATOM 0 HD1 HIS A 157 -6.196 -2.157 -7.142 1.00 0.00 H new ATOM 0 HD2 HIS A 157 -9.489 -4.334 -8.609 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -8.298 -0.979 -6.289 1.00 0.00 H new ATOM 2165 N HIS A 158 -5.016 -6.562 -10.346 1.00 0.00 N ATOM 2166 CA HIS A 158 -4.009 -7.024 -11.310 1.00 0.00 C ATOM 2167 C HIS A 158 -4.482 -8.265 -12.101 1.00 0.00 C ATOM 2168 O HIS A 158 -4.965 -9.248 -11.528 1.00 0.00 O ATOM 2169 CB HIS A 158 -2.673 -7.283 -10.591 1.00 0.00 C ATOM 2170 CG HIS A 158 -1.845 -6.058 -10.264 1.00 0.00 C ATOM 2171 ND1 HIS A 158 -2.052 -4.754 -10.664 1.00 0.00 N ATOM 2172 CD2 HIS A 158 -0.643 -6.079 -9.610 1.00 0.00 C ATOM 2173 CE1 HIS A 158 -0.993 -4.024 -10.276 1.00 0.00 C ATOM 2174 NE2 HIS A 158 -0.091 -4.791 -9.635 1.00 0.00 N ATOM 0 H HIS A 158 -4.706 -6.594 -9.375 1.00 0.00 H new ATOM 0 HA HIS A 158 -3.860 -6.234 -12.046 1.00 0.00 H new ATOM 0 HB2 HIS A 158 -2.880 -7.815 -9.663 1.00 0.00 H new ATOM 0 HB3 HIS A 158 -2.072 -7.948 -11.212 1.00 0.00 H new ATOM 0 HD1 HIS A 158 -2.868 -4.405 -11.167 1.00 0.00 H new ATOM 0 HD2 HIS A 158 -0.193 -6.946 -9.150 1.00 0.00 H new ATOM 0 HE1 HIS A 158 -0.880 -2.965 -10.454 1.00 0.00 H new ATOM 2182 N GLY A 159 -4.329 -8.210 -13.432 1.00 0.00 N ATOM 2183 CA GLY A 159 -4.739 -9.256 -14.381 1.00 0.00 C ATOM 2184 C GLY A 159 -6.124 -9.052 -15.014 1.00 0.00 C ATOM 2185 O GLY A 159 -6.462 -9.800 -15.935 1.00 0.00 O ATOM 0 H GLY A 159 -3.901 -7.408 -13.894 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -3.997 -9.314 -15.177 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -4.729 -10.217 -13.866 1.00 0.00 H new ATOM 2189 N THR A 160 -6.912 -8.059 -14.566 1.00 0.00 N ATOM 2190 CA THR A 160 -8.259 -7.731 -15.090 1.00 0.00 C ATOM 2191 C THR A 160 -8.493 -6.210 -15.138 1.00 0.00 C ATOM 2192 O THR A 160 -7.560 -5.425 -14.951 1.00 0.00 O ATOM 2193 CB THR A 160 -9.367 -8.457 -14.300 1.00 0.00 C ATOM 2194 OG1 THR A 160 -9.387 -8.005 -12.971 1.00 0.00 O ATOM 2195 CG2 THR A 160 -9.246 -9.983 -14.294 1.00 0.00 C ATOM 0 H THR A 160 -6.625 -7.441 -13.807 1.00 0.00 H new ATOM 0 HA THR A 160 -8.306 -8.095 -16.116 1.00 0.00 H new ATOM 0 HB THR A 160 -10.294 -8.215 -14.819 1.00 0.00 H new ATOM 0 HG1 THR A 160 -10.095 -8.470 -12.478 1.00 0.00 H new ATOM 0 HG21 THR A 160 -10.065 -10.411 -13.716 1.00 0.00 H new ATOM 0 HG22 THR A 160 -9.291 -10.356 -15.317 1.00 0.00 H new ATOM 0 HG23 THR A 160 -8.296 -10.271 -13.844 1.00 0.00 H new ATOM 2203 N LEU A 161 -9.725 -5.784 -15.442 1.00 0.00 N ATOM 2204 CA LEU A 161 -10.130 -4.375 -15.553 1.00 0.00 C ATOM 2205 C LEU A 161 -10.435 -3.762 -14.173 1.00 0.00 C ATOM 2206 O LEU A 161 -10.940 -4.442 -13.275 1.00 0.00 O ATOM 2207 CB LEU A 161 -11.357 -4.252 -16.486 1.00 0.00 C ATOM 2208 CG LEU A 161 -11.110 -4.344 -18.009 1.00 0.00 C ATOM 2209 CD1 LEU A 161 -10.220 -3.198 -18.514 1.00 0.00 C ATOM 2210 CD2 LEU A 161 -10.533 -5.693 -18.465 1.00 0.00 C ATOM 0 H LEU A 161 -10.493 -6.430 -15.624 1.00 0.00 H new ATOM 0 HA LEU A 161 -9.298 -3.816 -15.981 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -12.066 -5.033 -16.213 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -11.840 -3.297 -16.281 1.00 0.00 H new ATOM 0 HG LEU A 161 -12.100 -4.254 -18.457 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -10.071 -3.300 -19.589 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -10.702 -2.243 -18.303 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -9.255 -3.237 -18.009 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -10.388 -5.680 -19.545 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -9.576 -5.865 -17.972 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -11.225 -6.493 -18.202 1.00 0.00 H new ATOM 2222 N LEU A 162 -10.155 -2.461 -14.022 1.00 0.00 N ATOM 2223 CA LEU A 162 -10.331 -1.694 -12.777 1.00 0.00 C ATOM 2224 C LEU A 162 -11.608 -0.831 -12.798 1.00 0.00 C ATOM 2225 O LEU A 162 -12.239 -0.661 -13.847 1.00 0.00 O ATOM 2226 CB LEU A 162 -9.084 -0.812 -12.534 1.00 0.00 C ATOM 2227 CG LEU A 162 -7.714 -1.518 -12.635 1.00 0.00 C ATOM 2228 CD1 LEU A 162 -6.607 -0.541 -12.216 1.00 0.00 C ATOM 2229 CD2 LEU A 162 -7.633 -2.775 -11.763 1.00 0.00 C ATOM 0 H LEU A 162 -9.788 -1.893 -14.786 1.00 0.00 H new ATOM 0 HA LEU A 162 -10.445 -2.405 -11.958 1.00 0.00 H new ATOM 0 HB2 LEU A 162 -9.100 0.008 -13.252 1.00 0.00 H new ATOM 0 HB3 LEU A 162 -9.167 -0.368 -11.542 1.00 0.00 H new ATOM 0 HG LEU A 162 -7.585 -1.830 -13.671 1.00 0.00 H new ATOM 0 HD11 LEU A 162 -5.639 -1.036 -12.286 1.00 0.00 H new ATOM 0 HD12 LEU A 162 -6.619 0.327 -12.875 1.00 0.00 H new ATOM 0 HD13 LEU A 162 -6.776 -0.219 -11.189 1.00 0.00 H new ATOM 0 HD21 LEU A 162 -6.649 -3.231 -11.872 1.00 0.00 H new ATOM 0 HD22 LEU A 162 -7.794 -2.505 -10.719 1.00 0.00 H new ATOM 0 HD23 LEU A 162 -8.399 -3.485 -12.076 1.00 0.00 H new ATOM 2241 N ARG A 163 -11.953 -0.241 -11.644 1.00 0.00 N ATOM 2242 CA ARG A 163 -13.086 0.683 -11.458 1.00 0.00 C ATOM 2243 C ARG A 163 -12.871 1.583 -10.229 1.00 0.00 C ATOM 2244 O ARG A 163 -12.363 1.137 -9.198 1.00 0.00 O ATOM 2245 CB ARG A 163 -14.399 -0.131 -11.402 1.00 0.00 C ATOM 2246 CG ARG A 163 -15.686 0.685 -11.165 1.00 0.00 C ATOM 2247 CD ARG A 163 -16.076 0.842 -9.681 1.00 0.00 C ATOM 2248 NE ARG A 163 -17.299 0.087 -9.337 1.00 0.00 N ATOM 2249 CZ ARG A 163 -17.415 -1.221 -9.126 1.00 0.00 C ATOM 2250 NH1 ARG A 163 -16.388 -2.035 -9.211 1.00 0.00 N1+ ATOM 2251 NH2 ARG A 163 -18.584 -1.741 -8.825 1.00 0.00 N ATOM 0 H ARG A 163 -11.432 -0.399 -10.781 1.00 0.00 H new ATOM 0 HA ARG A 163 -13.157 1.363 -12.307 1.00 0.00 H new ATOM 0 HB2 ARG A 163 -14.505 -0.678 -12.339 1.00 0.00 H new ATOM 0 HB3 ARG A 163 -14.311 -0.873 -10.608 1.00 0.00 H new ATOM 0 HG2 ARG A 163 -15.559 1.676 -11.602 1.00 0.00 H new ATOM 0 HG3 ARG A 163 -16.509 0.206 -11.696 1.00 0.00 H new ATOM 0 HD2 ARG A 163 -15.253 0.500 -9.054 1.00 0.00 H new ATOM 0 HD3 ARG A 163 -16.229 1.898 -9.458 1.00 0.00 H new ATOM 0 HE ARG A 163 -18.156 0.634 -9.251 1.00 0.00 H new ATOM 0 HH11 ARG A 163 -15.465 -1.669 -9.445 1.00 0.00 H new ATOM 0 HH12 ARG A 163 -16.513 -3.033 -9.043 1.00 0.00 H new ATOM 0 HH21 ARG A 163 -19.406 -1.141 -8.753 1.00 0.00 H new ATOM 0 HH22 ARG A 163 -18.670 -2.745 -8.664 1.00 0.00 H new ATOM 2265 N GLY A 164 -13.279 2.852 -10.339 1.00 0.00 N ATOM 2266 CA GLY A 164 -13.199 3.865 -9.275 1.00 0.00 C ATOM 2267 C GLY A 164 -14.030 5.114 -9.577 1.00 0.00 C ATOM 2268 O GLY A 164 -15.238 5.009 -9.818 1.00 0.00 O ATOM 0 H GLY A 164 -13.688 3.217 -11.199 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -13.539 3.427 -8.337 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -12.158 4.154 -9.133 1.00 0.00 H new