USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 802 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 73 ASN : amide:sc= -4.16! C(o=-4.2!,f=-9.1!) USER MOD Set 1.2: A 97 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 14 CYS SG : rot 180:sc= 0 USER MOD Set 2.2: A 16 GLN : amide:sc= -0.0867 K(o=-0.087,f=-2.9!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot -11:sc= 0.447 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 162:sc= -0.203 (180deg=-0.313) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS :FLIP no HE2:sc= -0.0468 F(o=-0.57,f=-0.047) USER MOD Single : A 37 ASN : amide:sc=-0.00593 K(o=-0.0059,f=-1.6) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= -0.0609 USER MOD Single : A 54 THR OG1 : rot 22:sc= 0.409! USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 GLN : amide:sc= -0.333 K(o=-0.33,f=-3.7!) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 HIS : no HE2:sc= -4.9! C(o=-4.9!,f=-11!) USER MOD Single : A 87 GLN : amide:sc= -3.3! C(o=-3.3!,f=-3.6!) USER MOD Single : A 91 SER OG : rot -49:sc= 0.905 USER MOD Single : A 95 THR OG1 : rot -23:sc= -1.03 USER MOD Single : A 101 CYS SG : rot 30:sc= 0.147 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.747 25.754 -2.544 1.00 0.00 N ATOM 2 CA GLY A 1 -12.414 25.565 -2.002 1.00 0.00 C ATOM 3 C GLY A 1 -12.192 26.347 -0.723 1.00 0.00 C ATOM 4 O GLY A 1 -11.291 27.183 -0.647 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.848 25.199 -3.418 1.00 0.00 H new ATOM 0 H2 GLY A 1 -14.453 25.437 -1.849 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.896 26.761 -2.755 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -12.251 24.505 -1.809 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -11.677 25.871 -2.744 1.00 0.00 H new ATOM 8 N SER A 2 -13.016 26.078 0.284 1.00 0.00 N ATOM 9 CA SER A 2 -12.908 26.768 1.565 1.00 0.00 C ATOM 10 C SER A 2 -12.876 25.770 2.718 1.00 0.00 C ATOM 11 O SER A 2 -13.267 24.612 2.563 1.00 0.00 O ATOM 12 CB SER A 2 -14.079 27.736 1.746 1.00 0.00 C ATOM 13 OG SER A 2 -13.771 29.013 1.212 1.00 0.00 O ATOM 0 H SER A 2 -13.766 25.388 0.238 1.00 0.00 H new ATOM 0 HA SER A 2 -11.975 27.332 1.569 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.965 27.336 1.253 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.318 27.829 2.805 1.00 0.00 H new ATOM 0 HG SER A 2 -14.535 29.613 1.338 1.00 0.00 H new ATOM 19 N SER A 3 -12.408 26.227 3.875 1.00 0.00 N ATOM 20 CA SER A 3 -12.321 25.374 5.055 1.00 0.00 C ATOM 21 C SER A 3 -11.859 23.970 4.677 1.00 0.00 C ATOM 22 O SER A 3 -12.384 22.976 5.179 1.00 0.00 O ATOM 23 CB SER A 3 -13.676 25.305 5.762 1.00 0.00 C ATOM 24 OG SER A 3 -14.600 24.531 5.017 1.00 0.00 O ATOM 0 H SER A 3 -12.083 27.183 4.021 1.00 0.00 H new ATOM 0 HA SER A 3 -11.587 25.809 5.734 1.00 0.00 H new ATOM 0 HB2 SER A 3 -13.551 24.872 6.754 1.00 0.00 H new ATOM 0 HB3 SER A 3 -14.069 26.312 5.901 1.00 0.00 H new ATOM 0 HG SER A 3 -14.235 24.355 4.125 1.00 0.00 H new ATOM 30 N GLY A 4 -10.873 23.897 3.788 1.00 0.00 N ATOM 31 CA GLY A 4 -10.357 22.611 3.358 1.00 0.00 C ATOM 32 C GLY A 4 -11.457 21.649 2.957 1.00 0.00 C ATOM 33 O GLY A 4 -12.571 22.066 2.641 1.00 0.00 O ATOM 0 H GLY A 4 -10.423 24.705 3.358 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.682 22.758 2.515 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.770 22.171 4.164 1.00 0.00 H new ATOM 37 N SER A 5 -11.145 20.357 2.967 1.00 0.00 N ATOM 38 CA SER A 5 -12.114 19.333 2.596 1.00 0.00 C ATOM 39 C SER A 5 -12.406 18.408 3.774 1.00 0.00 C ATOM 40 O SER A 5 -11.597 18.283 4.694 1.00 0.00 O ATOM 41 CB SER A 5 -11.598 18.518 1.409 1.00 0.00 C ATOM 42 OG SER A 5 -10.406 17.828 1.744 1.00 0.00 O ATOM 0 H SER A 5 -10.228 19.995 3.228 1.00 0.00 H new ATOM 0 HA SER A 5 -13.040 19.832 2.310 1.00 0.00 H new ATOM 0 HB2 SER A 5 -12.360 17.804 1.096 1.00 0.00 H new ATOM 0 HB3 SER A 5 -11.414 19.179 0.562 1.00 0.00 H new ATOM 0 HG SER A 5 -10.097 17.313 0.969 1.00 0.00 H new ATOM 48 N SER A 6 -13.567 17.762 3.738 1.00 0.00 N ATOM 49 CA SER A 6 -13.968 16.852 4.804 1.00 0.00 C ATOM 50 C SER A 6 -12.903 15.784 5.036 1.00 0.00 C ATOM 51 O SER A 6 -12.886 14.753 4.366 1.00 0.00 O ATOM 52 CB SER A 6 -15.304 16.190 4.462 1.00 0.00 C ATOM 53 OG SER A 6 -16.392 17.035 4.792 1.00 0.00 O ATOM 0 H SER A 6 -14.246 17.852 2.982 1.00 0.00 H new ATOM 0 HA SER A 6 -14.082 17.432 5.720 1.00 0.00 H new ATOM 0 HB2 SER A 6 -15.334 15.952 3.399 1.00 0.00 H new ATOM 0 HB3 SER A 6 -15.395 15.247 5.002 1.00 0.00 H new ATOM 0 HG SER A 6 -17.234 16.589 4.562 1.00 0.00 H new ATOM 59 N GLY A 7 -12.015 16.041 5.992 1.00 0.00 N ATOM 60 CA GLY A 7 -10.958 15.094 6.296 1.00 0.00 C ATOM 61 C GLY A 7 -9.664 15.418 5.577 1.00 0.00 C ATOM 62 O GLY A 7 -9.562 15.304 4.355 1.00 0.00 O ATOM 0 H GLY A 7 -12.009 16.888 6.561 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -10.780 15.086 7.371 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -11.282 14.091 6.019 1.00 0.00 H new ATOM 66 N PRO A 8 -8.645 15.835 6.343 1.00 0.00 N ATOM 67 CA PRO A 8 -7.333 16.187 5.792 1.00 0.00 C ATOM 68 C PRO A 8 -6.575 14.969 5.277 1.00 0.00 C ATOM 69 O PRO A 8 -6.837 13.841 5.693 1.00 0.00 O ATOM 70 CB PRO A 8 -6.602 16.806 6.986 1.00 0.00 C ATOM 71 CG PRO A 8 -7.255 16.207 8.183 1.00 0.00 C ATOM 72 CD PRO A 8 -8.695 15.995 7.806 1.00 0.00 C ATOM 0 HA PRO A 8 -7.417 16.853 4.933 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -5.537 16.577 6.960 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -6.694 17.892 6.987 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -6.780 15.265 8.456 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -7.171 16.868 9.046 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -9.112 15.113 8.293 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -9.315 16.843 8.096 1.00 0.00 H new ATOM 80 N GLY A 9 -5.633 15.204 4.369 1.00 0.00 N ATOM 81 CA GLY A 9 -4.851 14.115 3.812 1.00 0.00 C ATOM 82 C GLY A 9 -3.360 14.375 3.886 1.00 0.00 C ATOM 83 O GLY A 9 -2.568 13.448 4.063 1.00 0.00 O ATOM 0 H GLY A 9 -5.397 16.129 4.009 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -5.083 13.194 4.347 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -5.139 13.960 2.772 1.00 0.00 H new ATOM 87 N LEU A 10 -2.974 15.639 3.749 1.00 0.00 N ATOM 88 CA LEU A 10 -1.566 16.019 3.799 1.00 0.00 C ATOM 89 C LEU A 10 -1.090 16.154 5.242 1.00 0.00 C ATOM 90 O LEU A 10 -0.317 17.055 5.569 1.00 0.00 O ATOM 91 CB LEU A 10 -1.346 17.335 3.052 1.00 0.00 C ATOM 92 CG LEU A 10 -2.341 18.455 3.356 1.00 0.00 C ATOM 93 CD1 LEU A 10 -3.567 18.336 2.465 1.00 0.00 C ATOM 94 CD2 LEU A 10 -2.743 18.427 4.824 1.00 0.00 C ATOM 0 H LEU A 10 -3.616 16.418 3.602 1.00 0.00 H new ATOM 0 HA LEU A 10 -0.985 15.233 3.316 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -0.343 17.696 3.280 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -1.375 17.131 1.982 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.858 19.410 3.149 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -4.264 19.142 2.696 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.265 18.405 1.420 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -4.052 17.376 2.640 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -3.452 19.231 5.023 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -3.207 17.469 5.056 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.858 18.561 5.446 1.00 0.00 H new ATOM 106 N ARG A 11 -1.555 15.252 6.100 1.00 0.00 N ATOM 107 CA ARG A 11 -1.177 15.270 7.508 1.00 0.00 C ATOM 108 C ARG A 11 -0.347 14.040 7.864 1.00 0.00 C ATOM 109 O ARG A 11 -0.402 13.022 7.173 1.00 0.00 O ATOM 110 CB ARG A 11 -2.423 15.332 8.393 1.00 0.00 C ATOM 111 CG ARG A 11 -3.255 16.587 8.186 1.00 0.00 C ATOM 112 CD ARG A 11 -2.535 17.824 8.698 1.00 0.00 C ATOM 113 NE ARG A 11 -2.642 17.959 10.148 1.00 0.00 N ATOM 114 CZ ARG A 11 -1.775 17.426 11.002 1.00 0.00 C ATOM 115 NH1 ARG A 11 -0.742 16.726 10.553 1.00 0.00 N ATOM 116 NH2 ARG A 11 -1.940 17.593 12.308 1.00 0.00 N ATOM 0 H ARG A 11 -2.194 14.499 5.845 1.00 0.00 H new ATOM 0 HA ARG A 11 -0.571 16.159 7.684 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -3.043 14.458 8.194 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -2.119 15.276 9.438 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -3.477 16.707 7.126 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -4.210 16.481 8.701 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -1.483 17.774 8.415 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -2.952 18.710 8.220 1.00 0.00 H new ATOM 0 HE ARG A 11 -3.425 18.492 10.526 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -0.612 16.596 9.550 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -0.078 16.318 11.211 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -2.733 18.131 12.657 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -1.274 17.183 12.963 1.00 0.00 H new ATOM 130 N GLU A 12 0.419 14.141 8.945 1.00 0.00 N ATOM 131 CA GLU A 12 1.261 13.037 9.391 1.00 0.00 C ATOM 132 C GLU A 12 0.410 11.868 9.880 1.00 0.00 C ATOM 133 O GLU A 12 -0.229 11.948 10.931 1.00 0.00 O ATOM 134 CB GLU A 12 2.201 13.500 10.505 1.00 0.00 C ATOM 135 CG GLU A 12 3.239 12.462 10.897 1.00 0.00 C ATOM 136 CD GLU A 12 3.967 12.819 12.178 1.00 0.00 C ATOM 137 OE1 GLU A 12 4.707 13.825 12.180 1.00 0.00 O ATOM 138 OE2 GLU A 12 3.796 12.092 13.179 1.00 0.00 O ATOM 0 H GLU A 12 0.474 14.976 9.528 1.00 0.00 H new ATOM 0 HA GLU A 12 1.856 12.701 8.542 1.00 0.00 H new ATOM 0 HB2 GLU A 12 2.711 14.408 10.184 1.00 0.00 H new ATOM 0 HB3 GLU A 12 1.610 13.760 11.383 1.00 0.00 H new ATOM 0 HG2 GLU A 12 2.752 11.494 11.018 1.00 0.00 H new ATOM 0 HG3 GLU A 12 3.963 12.355 10.090 1.00 0.00 H new ATOM 145 N LEU A 13 0.406 10.784 9.112 1.00 0.00 N ATOM 146 CA LEU A 13 -0.367 9.599 9.466 1.00 0.00 C ATOM 147 C LEU A 13 0.553 8.415 9.752 1.00 0.00 C ATOM 148 O LEU A 13 1.683 8.363 9.265 1.00 0.00 O ATOM 149 CB LEU A 13 -1.338 9.243 8.340 1.00 0.00 C ATOM 150 CG LEU A 13 -2.427 10.275 8.042 1.00 0.00 C ATOM 151 CD1 LEU A 13 -2.896 10.156 6.600 1.00 0.00 C ATOM 152 CD2 LEU A 13 -3.597 10.107 9.001 1.00 0.00 C ATOM 0 H LEU A 13 0.929 10.701 8.240 1.00 0.00 H new ATOM 0 HA LEU A 13 -0.935 9.823 10.369 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.762 9.078 7.429 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.820 8.297 8.588 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.006 11.270 8.184 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.671 10.898 6.407 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.055 10.327 5.928 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -3.299 9.158 6.430 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -4.362 10.849 8.775 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -4.017 9.107 8.891 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -3.250 10.244 10.025 1.00 0.00 H new ATOM 164 N CYS A 14 0.060 7.468 10.543 1.00 0.00 N ATOM 165 CA CYS A 14 0.837 6.284 10.893 1.00 0.00 C ATOM 166 C CYS A 14 -0.032 5.032 10.851 1.00 0.00 C ATOM 167 O CYS A 14 -1.243 5.098 11.063 1.00 0.00 O ATOM 168 CB CYS A 14 1.454 6.446 12.283 1.00 0.00 C ATOM 169 SG CYS A 14 0.242 6.652 13.609 1.00 0.00 S ATOM 0 H CYS A 14 -0.873 7.497 10.954 1.00 0.00 H new ATOM 0 HA CYS A 14 1.636 6.174 10.160 1.00 0.00 H new ATOM 0 HB2 CYS A 14 2.069 5.573 12.500 1.00 0.00 H new ATOM 0 HB3 CYS A 14 2.119 7.310 12.275 1.00 0.00 H new ATOM 0 HG CYS A 14 0.860 6.779 14.746 1.00 0.00 H new ATOM 175 N ILE A 15 0.594 3.893 10.576 1.00 0.00 N ATOM 176 CA ILE A 15 -0.123 2.625 10.506 1.00 0.00 C ATOM 177 C ILE A 15 0.332 1.675 11.608 1.00 0.00 C ATOM 178 O ILE A 15 1.490 1.260 11.644 1.00 0.00 O ATOM 179 CB ILE A 15 0.074 1.942 9.140 1.00 0.00 C ATOM 180 CG1 ILE A 15 -0.406 2.858 8.012 1.00 0.00 C ATOM 181 CG2 ILE A 15 -0.665 0.613 9.101 1.00 0.00 C ATOM 182 CD1 ILE A 15 -0.350 2.213 6.645 1.00 0.00 C ATOM 0 H ILE A 15 1.596 3.822 10.398 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.181 2.852 10.640 1.00 0.00 H new ATOM 0 HB ILE A 15 1.137 1.749 8.997 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -1.431 3.167 8.217 1.00 0.00 H new ATOM 0 HG13 ILE A 15 0.204 3.761 8.004 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -0.516 0.142 8.129 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -0.280 -0.041 9.884 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -1.729 0.784 9.262 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -0.705 2.919 5.895 1.00 0.00 H new ATOM 0 HD12 ILE A 15 0.678 1.929 6.419 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -0.983 1.325 6.635 1.00 0.00 H new ATOM 194 N GLN A 16 -0.588 1.333 12.504 1.00 0.00 N ATOM 195 CA GLN A 16 -0.281 0.430 13.607 1.00 0.00 C ATOM 196 C GLN A 16 -0.491 -1.024 13.195 1.00 0.00 C ATOM 197 O GLN A 16 -1.592 -1.419 12.812 1.00 0.00 O ATOM 198 CB GLN A 16 -1.152 0.759 14.821 1.00 0.00 C ATOM 199 CG GLN A 16 -0.537 1.796 15.746 1.00 0.00 C ATOM 200 CD GLN A 16 -0.945 3.212 15.388 1.00 0.00 C ATOM 201 OE1 GLN A 16 -1.606 3.443 14.375 1.00 0.00 O ATOM 202 NE2 GLN A 16 -0.552 4.170 16.220 1.00 0.00 N ATOM 0 H GLN A 16 -1.552 1.667 12.488 1.00 0.00 H new ATOM 0 HA GLN A 16 0.767 0.566 13.873 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.121 1.121 14.476 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -1.336 -0.156 15.385 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -0.836 1.584 16.773 1.00 0.00 H new ATOM 0 HG3 GLN A 16 0.549 1.714 15.707 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -0.005 3.934 17.048 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -0.797 5.142 16.031 1.00 0.00 H new ATOM 211 N LYS A 17 0.573 -1.816 13.275 1.00 0.00 N ATOM 212 CA LYS A 17 0.507 -3.226 12.912 1.00 0.00 C ATOM 213 C LYS A 17 1.102 -4.100 14.011 1.00 0.00 C ATOM 214 O LYS A 17 1.808 -3.610 14.892 1.00 0.00 O ATOM 215 CB LYS A 17 1.246 -3.470 11.594 1.00 0.00 C ATOM 216 CG LYS A 17 2.737 -3.704 11.768 1.00 0.00 C ATOM 217 CD LYS A 17 3.525 -3.186 10.577 1.00 0.00 C ATOM 218 CE LYS A 17 3.521 -1.666 10.524 1.00 0.00 C ATOM 219 NZ LYS A 17 4.766 -1.128 9.907 1.00 0.00 N ATOM 0 H LYS A 17 1.492 -1.504 13.588 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.542 -3.494 12.788 1.00 0.00 H new ATOM 0 HB2 LYS A 17 0.807 -4.334 11.095 1.00 0.00 H new ATOM 0 HB3 LYS A 17 1.095 -2.613 10.938 1.00 0.00 H new ATOM 0 HG2 LYS A 17 3.080 -3.208 12.676 1.00 0.00 H new ATOM 0 HG3 LYS A 17 2.927 -4.770 11.895 1.00 0.00 H new ATOM 0 HD2 LYS A 17 4.552 -3.546 10.635 1.00 0.00 H new ATOM 0 HD3 LYS A 17 3.099 -3.584 9.656 1.00 0.00 H new ATOM 0 HE2 LYS A 17 2.657 -1.325 9.954 1.00 0.00 H new ATOM 0 HE3 LYS A 17 3.415 -1.268 11.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.609 -0.144 9.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 5.540 -1.161 10.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 5.019 -1.703 9.078 1.00 0.00 H new ATOM 233 N ALA A 18 0.814 -5.396 13.952 1.00 0.00 N ATOM 234 CA ALA A 18 1.324 -6.338 14.940 1.00 0.00 C ATOM 235 C ALA A 18 2.812 -6.117 15.192 1.00 0.00 C ATOM 236 O ALA A 18 3.486 -5.381 14.471 1.00 0.00 O ATOM 237 CB ALA A 18 1.070 -7.768 14.487 1.00 0.00 C ATOM 0 H ALA A 18 0.230 -5.817 13.230 1.00 0.00 H new ATOM 0 HA ALA A 18 0.794 -6.166 15.877 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.456 -8.461 15.235 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -0.002 -7.926 14.365 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.573 -7.943 13.536 1.00 0.00 H new ATOM 243 N PRO A 19 3.339 -6.769 16.239 1.00 0.00 N ATOM 244 CA PRO A 19 4.753 -6.659 16.610 1.00 0.00 C ATOM 245 C PRO A 19 5.671 -7.339 15.600 1.00 0.00 C ATOM 246 O PRO A 19 6.886 -7.391 15.787 1.00 0.00 O ATOM 247 CB PRO A 19 4.822 -7.375 17.961 1.00 0.00 C ATOM 248 CG PRO A 19 3.679 -8.330 17.943 1.00 0.00 C ATOM 249 CD PRO A 19 2.595 -7.663 17.142 1.00 0.00 C ATOM 0 HA PRO A 19 5.086 -5.622 16.644 1.00 0.00 H new ATOM 0 HB2 PRO A 19 5.771 -7.896 18.085 1.00 0.00 H new ATOM 0 HB3 PRO A 19 4.736 -6.670 18.788 1.00 0.00 H new ATOM 0 HG2 PRO A 19 3.970 -9.279 17.492 1.00 0.00 H new ATOM 0 HG3 PRO A 19 3.338 -8.550 18.955 1.00 0.00 H new ATOM 0 HD2 PRO A 19 2.000 -8.389 16.588 1.00 0.00 H new ATOM 0 HD3 PRO A 19 1.907 -7.108 17.780 1.00 0.00 H new ATOM 257 N GLY A 20 5.082 -7.860 14.527 1.00 0.00 N ATOM 258 CA GLY A 20 5.863 -8.530 13.504 1.00 0.00 C ATOM 259 C GLY A 20 5.060 -8.800 12.247 1.00 0.00 C ATOM 260 O GLY A 20 5.259 -9.817 11.583 1.00 0.00 O ATOM 0 H GLY A 20 4.078 -7.830 14.349 1.00 0.00 H new ATOM 0 HA2 GLY A 20 6.730 -7.918 13.254 1.00 0.00 H new ATOM 0 HA3 GLY A 20 6.242 -9.473 13.899 1.00 0.00 H new ATOM 264 N GLU A 21 4.150 -7.888 11.920 1.00 0.00 N ATOM 265 CA GLU A 21 3.313 -8.035 10.735 1.00 0.00 C ATOM 266 C GLU A 21 3.796 -7.124 9.611 1.00 0.00 C ATOM 267 O GLU A 21 4.188 -5.981 9.849 1.00 0.00 O ATOM 268 CB GLU A 21 1.854 -7.720 11.071 1.00 0.00 C ATOM 269 CG GLU A 21 0.921 -7.807 9.875 1.00 0.00 C ATOM 270 CD GLU A 21 1.260 -8.963 8.954 1.00 0.00 C ATOM 271 OE1 GLU A 21 1.566 -10.060 9.466 1.00 0.00 O ATOM 272 OE2 GLU A 21 1.218 -8.770 7.721 1.00 0.00 O ATOM 0 H GLU A 21 3.974 -7.040 12.459 1.00 0.00 H new ATOM 0 HA GLU A 21 3.385 -9.069 10.397 1.00 0.00 H new ATOM 0 HB2 GLU A 21 1.510 -8.411 11.840 1.00 0.00 H new ATOM 0 HB3 GLU A 21 1.796 -6.717 11.494 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -0.105 -7.916 10.226 1.00 0.00 H new ATOM 0 HG3 GLU A 21 0.968 -6.874 9.313 1.00 0.00 H new ATOM 279 N ARG A 22 3.764 -7.637 8.385 1.00 0.00 N ATOM 280 CA ARG A 22 4.199 -6.870 7.224 1.00 0.00 C ATOM 281 C ARG A 22 3.061 -6.012 6.681 1.00 0.00 C ATOM 282 O ARG A 22 1.987 -6.519 6.354 1.00 0.00 O ATOM 283 CB ARG A 22 4.711 -7.809 6.130 1.00 0.00 C ATOM 284 CG ARG A 22 5.952 -8.590 6.529 1.00 0.00 C ATOM 285 CD ARG A 22 7.068 -7.665 6.990 1.00 0.00 C ATOM 286 NE ARG A 22 6.952 -7.331 8.406 1.00 0.00 N ATOM 287 CZ ARG A 22 7.969 -6.903 9.147 1.00 0.00 C ATOM 288 NH1 ARG A 22 9.171 -6.759 8.607 1.00 0.00 N ATOM 289 NH2 ARG A 22 7.784 -6.619 10.429 1.00 0.00 N ATOM 0 H ARG A 22 3.441 -8.581 8.170 1.00 0.00 H new ATOM 0 HA ARG A 22 5.009 -6.211 7.537 1.00 0.00 H new ATOM 0 HB2 ARG A 22 3.920 -8.511 5.866 1.00 0.00 H new ATOM 0 HB3 ARG A 22 4.931 -7.226 5.236 1.00 0.00 H new ATOM 0 HG2 ARG A 22 5.703 -9.288 7.328 1.00 0.00 H new ATOM 0 HG3 ARG A 22 6.297 -9.185 5.683 1.00 0.00 H new ATOM 0 HD2 ARG A 22 8.032 -8.141 6.808 1.00 0.00 H new ATOM 0 HD3 ARG A 22 7.047 -6.750 6.399 1.00 0.00 H new ATOM 0 HE ARG A 22 6.040 -7.432 8.852 1.00 0.00 H new ATOM 0 HH11 ARG A 22 9.317 -6.977 7.621 1.00 0.00 H new ATOM 0 HH12 ARG A 22 9.950 -6.430 9.177 1.00 0.00 H new ATOM 0 HH21 ARG A 22 6.860 -6.729 10.848 1.00 0.00 H new ATOM 0 HH22 ARG A 22 8.565 -6.291 10.997 1.00 0.00 H new ATOM 303 N LEU A 23 3.302 -4.709 6.589 1.00 0.00 N ATOM 304 CA LEU A 23 2.297 -3.778 6.086 1.00 0.00 C ATOM 305 C LEU A 23 1.445 -4.431 5.002 1.00 0.00 C ATOM 306 O LEU A 23 0.223 -4.289 4.990 1.00 0.00 O ATOM 307 CB LEU A 23 2.969 -2.520 5.534 1.00 0.00 C ATOM 308 CG LEU A 23 2.225 -1.205 5.764 1.00 0.00 C ATOM 309 CD1 LEU A 23 0.762 -1.344 5.373 1.00 0.00 C ATOM 310 CD2 LEU A 23 2.351 -0.768 7.216 1.00 0.00 C ATOM 0 H LEU A 23 4.184 -4.273 6.856 1.00 0.00 H new ATOM 0 HA LEU A 23 1.647 -3.500 6.916 1.00 0.00 H new ATOM 0 HB2 LEU A 23 3.960 -2.436 5.980 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.112 -2.650 4.461 1.00 0.00 H new ATOM 0 HG LEU A 23 2.677 -0.439 5.134 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.248 -0.398 5.544 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.691 -1.610 4.318 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.297 -2.123 5.976 1.00 0.00 H new ATOM 0 HD21 LEU A 23 1.815 0.170 7.361 1.00 0.00 H new ATOM 0 HD22 LEU A 23 1.925 -1.533 7.865 1.00 0.00 H new ATOM 0 HD23 LEU A 23 3.403 -0.627 7.464 1.00 0.00 H new ATOM 322 N GLY A 24 2.099 -5.149 4.094 1.00 0.00 N ATOM 323 CA GLY A 24 1.385 -5.814 3.020 1.00 0.00 C ATOM 324 C GLY A 24 0.850 -4.841 1.989 1.00 0.00 C ATOM 325 O GLY A 24 -0.299 -4.951 1.559 1.00 0.00 O ATOM 0 H GLY A 24 3.110 -5.282 4.083 1.00 0.00 H new ATOM 0 HA2 GLY A 24 2.051 -6.526 2.532 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.557 -6.387 3.438 1.00 0.00 H new ATOM 329 N ILE A 25 1.683 -3.884 1.592 1.00 0.00 N ATOM 330 CA ILE A 25 1.286 -2.887 0.606 1.00 0.00 C ATOM 331 C ILE A 25 2.270 -2.843 -0.558 1.00 0.00 C ATOM 332 O ILE A 25 3.274 -3.555 -0.562 1.00 0.00 O ATOM 333 CB ILE A 25 1.186 -1.484 1.233 1.00 0.00 C ATOM 334 CG1 ILE A 25 2.278 -1.294 2.287 1.00 0.00 C ATOM 335 CG2 ILE A 25 -0.191 -1.274 1.845 1.00 0.00 C ATOM 336 CD1 ILE A 25 2.743 0.139 2.424 1.00 0.00 C ATOM 0 H ILE A 25 2.637 -3.779 1.938 1.00 0.00 H new ATOM 0 HA ILE A 25 0.304 -3.182 0.237 1.00 0.00 H new ATOM 0 HB ILE A 25 1.331 -0.741 0.449 1.00 0.00 H new ATOM 0 HG12 ILE A 25 1.905 -1.640 3.251 1.00 0.00 H new ATOM 0 HG13 ILE A 25 3.132 -1.922 2.031 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -0.246 -0.278 2.284 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.952 -1.372 1.071 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -0.363 -2.022 2.619 1.00 0.00 H new ATOM 0 HD11 ILE A 25 3.517 0.199 3.189 1.00 0.00 H new ATOM 0 HD12 ILE A 25 3.146 0.483 1.472 1.00 0.00 H new ATOM 0 HD13 ILE A 25 1.901 0.769 2.710 1.00 0.00 H new ATOM 348 N SER A 26 1.976 -2.000 -1.543 1.00 0.00 N ATOM 349 CA SER A 26 2.834 -1.864 -2.714 1.00 0.00 C ATOM 350 C SER A 26 2.928 -0.405 -3.152 1.00 0.00 C ATOM 351 O SER A 26 2.026 0.391 -2.892 1.00 0.00 O ATOM 352 CB SER A 26 2.303 -2.720 -3.865 1.00 0.00 C ATOM 353 OG SER A 26 3.362 -3.204 -4.672 1.00 0.00 O ATOM 0 H SER A 26 1.150 -1.401 -1.553 1.00 0.00 H new ATOM 0 HA SER A 26 3.832 -2.210 -2.444 1.00 0.00 H new ATOM 0 HB2 SER A 26 1.734 -3.559 -3.465 1.00 0.00 H new ATOM 0 HB3 SER A 26 1.618 -2.131 -4.474 1.00 0.00 H new ATOM 0 HG SER A 26 2.996 -3.749 -5.399 1.00 0.00 H new ATOM 359 N ILE A 27 4.026 -0.063 -3.818 1.00 0.00 N ATOM 360 CA ILE A 27 4.237 1.298 -4.293 1.00 0.00 C ATOM 361 C ILE A 27 4.835 1.304 -5.696 1.00 0.00 C ATOM 362 O ILE A 27 5.576 0.395 -6.070 1.00 0.00 O ATOM 363 CB ILE A 27 5.164 2.086 -3.349 1.00 0.00 C ATOM 364 CG1 ILE A 27 6.595 1.549 -3.438 1.00 0.00 C ATOM 365 CG2 ILE A 27 4.652 2.010 -1.918 1.00 0.00 C ATOM 366 CD1 ILE A 27 7.604 2.394 -2.692 1.00 0.00 C ATOM 0 H ILE A 27 4.783 -0.710 -4.041 1.00 0.00 H new ATOM 0 HA ILE A 27 3.259 1.780 -4.315 1.00 0.00 H new ATOM 0 HB ILE A 27 5.168 3.131 -3.657 1.00 0.00 H new ATOM 0 HG12 ILE A 27 6.619 0.534 -3.042 1.00 0.00 H new ATOM 0 HG13 ILE A 27 6.888 1.489 -4.486 1.00 0.00 H new ATOM 0 HG21 ILE A 27 5.318 2.572 -1.263 1.00 0.00 H new ATOM 0 HG22 ILE A 27 3.650 2.435 -1.867 1.00 0.00 H new ATOM 0 HG23 ILE A 27 4.621 0.969 -1.597 1.00 0.00 H new ATOM 0 HD11 ILE A 27 8.596 1.955 -2.798 1.00 0.00 H new ATOM 0 HD12 ILE A 27 7.608 3.403 -3.103 1.00 0.00 H new ATOM 0 HD13 ILE A 27 7.336 2.434 -1.636 1.00 0.00 H new ATOM 378 N ARG A 28 4.510 2.336 -6.468 1.00 0.00 N ATOM 379 CA ARG A 28 5.015 2.461 -7.829 1.00 0.00 C ATOM 380 C ARG A 28 5.709 3.805 -8.030 1.00 0.00 C ATOM 381 O ARG A 28 5.131 4.859 -7.769 1.00 0.00 O ATOM 382 CB ARG A 28 3.873 2.309 -8.836 1.00 0.00 C ATOM 383 CG ARG A 28 2.742 3.303 -8.628 1.00 0.00 C ATOM 384 CD ARG A 28 1.783 3.311 -9.808 1.00 0.00 C ATOM 385 NE ARG A 28 0.692 2.356 -9.634 1.00 0.00 N ATOM 386 CZ ARG A 28 -0.072 1.923 -10.630 1.00 0.00 C ATOM 387 NH1 ARG A 28 0.135 2.357 -11.866 1.00 0.00 N ATOM 388 NH2 ARG A 28 -1.046 1.054 -10.391 1.00 0.00 N ATOM 0 H ARG A 28 3.899 3.098 -6.173 1.00 0.00 H new ATOM 0 HA ARG A 28 5.743 1.667 -7.994 1.00 0.00 H new ATOM 0 HB2 ARG A 28 4.270 2.429 -9.844 1.00 0.00 H new ATOM 0 HB3 ARG A 28 3.473 1.297 -8.769 1.00 0.00 H new ATOM 0 HG2 ARG A 28 2.198 3.052 -7.717 1.00 0.00 H new ATOM 0 HG3 ARG A 28 3.155 4.302 -8.487 1.00 0.00 H new ATOM 0 HD2 ARG A 28 1.371 4.312 -9.934 1.00 0.00 H new ATOM 0 HD3 ARG A 28 2.330 3.074 -10.721 1.00 0.00 H new ATOM 0 HE ARG A 28 0.507 2.002 -8.696 1.00 0.00 H new ATOM 0 HH11 ARG A 28 0.883 3.025 -12.053 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -0.453 2.023 -12.629 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -1.208 0.718 -9.442 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -1.632 0.722 -11.157 1.00 0.00 H new ATOM 402 N GLY A 29 6.953 3.759 -8.497 1.00 0.00 N ATOM 403 CA GLY A 29 7.706 4.979 -8.725 1.00 0.00 C ATOM 404 C GLY A 29 9.202 4.765 -8.616 1.00 0.00 C ATOM 405 O GLY A 29 9.703 3.676 -8.894 1.00 0.00 O ATOM 0 H GLY A 29 7.453 2.899 -8.722 1.00 0.00 H new ATOM 0 HA2 GLY A 29 7.469 5.369 -9.715 1.00 0.00 H new ATOM 0 HA3 GLY A 29 7.396 5.734 -8.002 1.00 0.00 H new ATOM 409 N GLY A 30 9.920 5.809 -8.213 1.00 0.00 N ATOM 410 CA GLY A 30 11.362 5.711 -8.078 1.00 0.00 C ATOM 411 C GLY A 30 12.094 6.738 -8.918 1.00 0.00 C ATOM 412 O GLY A 30 11.587 7.184 -9.946 1.00 0.00 O ATOM 0 H GLY A 30 9.529 6.721 -7.978 1.00 0.00 H new ATOM 0 HA2 GLY A 30 11.635 5.841 -7.031 1.00 0.00 H new ATOM 0 HA3 GLY A 30 11.684 4.711 -8.370 1.00 0.00 H new ATOM 416 N ALA A 31 13.291 7.115 -8.478 1.00 0.00 N ATOM 417 CA ALA A 31 14.094 8.096 -9.197 1.00 0.00 C ATOM 418 C ALA A 31 14.448 7.598 -10.594 1.00 0.00 C ATOM 419 O ALA A 31 14.999 8.340 -11.407 1.00 0.00 O ATOM 420 CB ALA A 31 15.358 8.419 -8.414 1.00 0.00 C ATOM 0 H ALA A 31 13.725 6.756 -7.628 1.00 0.00 H new ATOM 0 HA ALA A 31 13.503 9.006 -9.303 1.00 0.00 H new ATOM 0 HB1 ALA A 31 15.948 9.153 -8.963 1.00 0.00 H new ATOM 0 HB2 ALA A 31 15.088 8.826 -7.439 1.00 0.00 H new ATOM 0 HB3 ALA A 31 15.944 7.510 -8.278 1.00 0.00 H new ATOM 426 N ARG A 32 14.127 6.337 -10.867 1.00 0.00 N ATOM 427 CA ARG A 32 14.414 5.740 -12.166 1.00 0.00 C ATOM 428 C ARG A 32 13.181 5.032 -12.722 1.00 0.00 C ATOM 429 O ARG A 32 12.895 5.109 -13.916 1.00 0.00 O ATOM 430 CB ARG A 32 15.575 4.750 -12.051 1.00 0.00 C ATOM 431 CG ARG A 32 16.806 5.332 -11.377 1.00 0.00 C ATOM 432 CD ARG A 32 17.734 5.992 -12.385 1.00 0.00 C ATOM 433 NE ARG A 32 18.530 5.013 -13.120 1.00 0.00 N ATOM 434 CZ ARG A 32 19.526 5.338 -13.935 1.00 0.00 C ATOM 435 NH1 ARG A 32 19.848 6.612 -14.119 1.00 0.00 N ATOM 436 NH2 ARG A 32 20.204 4.390 -14.569 1.00 0.00 N ATOM 0 H ARG A 32 13.668 5.710 -10.206 1.00 0.00 H new ATOM 0 HA ARG A 32 14.694 6.539 -12.852 1.00 0.00 H new ATOM 0 HB2 ARG A 32 15.243 3.877 -11.490 1.00 0.00 H new ATOM 0 HB3 ARG A 32 15.847 4.404 -13.048 1.00 0.00 H new ATOM 0 HG2 ARG A 32 16.501 6.063 -10.629 1.00 0.00 H new ATOM 0 HG3 ARG A 32 17.342 4.542 -10.851 1.00 0.00 H new ATOM 0 HD2 ARG A 32 17.145 6.581 -13.088 1.00 0.00 H new ATOM 0 HD3 ARG A 32 18.398 6.684 -11.867 1.00 0.00 H new ATOM 0 HE ARG A 32 18.308 4.025 -13.000 1.00 0.00 H new ATOM 0 HH11 ARG A 32 19.330 7.344 -13.634 1.00 0.00 H new ATOM 0 HH12 ARG A 32 20.614 6.859 -14.746 1.00 0.00 H new ATOM 0 HH21 ARG A 32 19.960 3.409 -14.431 1.00 0.00 H new ATOM 0 HH22 ARG A 32 20.969 4.642 -15.195 1.00 0.00 H new ATOM 450 N GLY A 33 12.456 4.342 -11.847 1.00 0.00 N ATOM 451 CA GLY A 33 11.264 3.631 -12.269 1.00 0.00 C ATOM 452 C GLY A 33 10.304 4.515 -13.041 1.00 0.00 C ATOM 453 O GLY A 33 10.307 5.736 -12.881 1.00 0.00 O ATOM 0 H GLY A 33 12.673 4.263 -10.854 1.00 0.00 H new ATOM 0 HA2 GLY A 33 11.552 2.783 -12.890 1.00 0.00 H new ATOM 0 HA3 GLY A 33 10.756 3.227 -11.393 1.00 0.00 H new ATOM 457 N HIS A 34 9.480 3.898 -13.883 1.00 0.00 N ATOM 458 CA HIS A 34 8.511 4.637 -14.684 1.00 0.00 C ATOM 459 C HIS A 34 7.981 5.845 -13.916 1.00 0.00 C ATOM 460 O HIS A 34 7.448 5.708 -12.815 1.00 0.00 O ATOM 461 CB HIS A 34 7.352 3.726 -15.089 1.00 0.00 C ATOM 462 CG HIS A 34 6.984 2.722 -14.040 1.00 0.00 C ATOM 463 ND1 HIS A 34 7.436 1.465 -13.821 1.00 0.00 N flip ATOM 464 CD2 HIS A 34 6.044 2.965 -13.061 1.00 0.00 C flip ATOM 465 CE1 HIS A 34 6.768 0.977 -12.725 1.00 0.00 C flip ATOM 466 NE2 HIS A 34 5.934 1.902 -12.285 1.00 0.00 N flip ATOM 0 H HIS A 34 9.464 2.888 -14.028 1.00 0.00 H new ATOM 0 HA HIS A 34 9.014 4.992 -15.583 1.00 0.00 H new ATOM 0 HB2 HIS A 34 6.480 4.340 -15.314 1.00 0.00 H new ATOM 0 HB3 HIS A 34 7.617 3.200 -16.006 1.00 0.00 H new ATOM 0 HD1 HIS A 34 8.142 0.972 -14.368 1.00 0.00 H new ATOM 0 HD2 HIS A 34 5.485 3.882 -12.947 1.00 0.00 H new ATOM 0 HE1 HIS A 34 6.903 -0.004 -12.293 1.00 0.00 H new ATOM 475 N ALA A 35 8.131 7.027 -14.506 1.00 0.00 N ATOM 476 CA ALA A 35 7.666 8.257 -13.878 1.00 0.00 C ATOM 477 C ALA A 35 6.304 8.059 -13.223 1.00 0.00 C ATOM 478 O ALA A 35 5.934 8.787 -12.303 1.00 0.00 O ATOM 479 CB ALA A 35 7.602 9.380 -14.903 1.00 0.00 C ATOM 0 H ALA A 35 8.571 7.158 -15.417 1.00 0.00 H new ATOM 0 HA ALA A 35 8.378 8.530 -13.099 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.253 10.293 -14.421 1.00 0.00 H new ATOM 0 HB2 ALA A 35 8.594 9.547 -15.322 1.00 0.00 H new ATOM 0 HB3 ALA A 35 6.913 9.105 -15.701 1.00 0.00 H new ATOM 485 N GLY A 36 5.559 7.067 -13.703 1.00 0.00 N ATOM 486 CA GLY A 36 4.245 6.792 -13.152 1.00 0.00 C ATOM 487 C GLY A 36 3.128 7.354 -14.009 1.00 0.00 C ATOM 488 O GLY A 36 2.173 6.650 -14.335 1.00 0.00 O ATOM 0 H GLY A 36 5.842 6.449 -14.464 1.00 0.00 H new ATOM 0 HA2 GLY A 36 4.115 5.714 -13.052 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.179 7.216 -12.150 1.00 0.00 H new ATOM 492 N ASN A 37 3.246 8.627 -14.373 1.00 0.00 N ATOM 493 CA ASN A 37 2.236 9.283 -15.195 1.00 0.00 C ATOM 494 C ASN A 37 2.761 9.530 -16.606 1.00 0.00 C ATOM 495 O ASN A 37 3.901 9.948 -16.807 1.00 0.00 O ATOM 496 CB ASN A 37 1.812 10.608 -14.557 1.00 0.00 C ATOM 497 CG ASN A 37 0.819 10.414 -13.428 1.00 0.00 C ATOM 498 OD1 ASN A 37 0.600 9.295 -12.964 1.00 0.00 O ATOM 499 ND2 ASN A 37 0.211 11.507 -12.981 1.00 0.00 N ATOM 0 H ASN A 37 4.031 9.224 -14.112 1.00 0.00 H new ATOM 0 HA ASN A 37 1.370 8.624 -15.259 1.00 0.00 H new ATOM 0 HB2 ASN A 37 2.694 11.124 -14.177 1.00 0.00 H new ATOM 0 HB3 ASN A 37 1.371 11.250 -15.319 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -0.468 11.439 -12.223 1.00 0.00 H new ATOM 0 HD22 ASN A 37 0.423 12.414 -13.395 1.00 0.00 H new ATOM 506 N PRO A 38 1.909 9.267 -17.608 1.00 0.00 N ATOM 507 CA PRO A 38 2.263 9.455 -19.018 1.00 0.00 C ATOM 508 C PRO A 38 2.400 10.927 -19.391 1.00 0.00 C ATOM 509 O PRO A 38 3.275 11.300 -20.171 1.00 0.00 O ATOM 510 CB PRO A 38 1.087 8.821 -19.766 1.00 0.00 C ATOM 511 CG PRO A 38 -0.057 8.908 -18.817 1.00 0.00 C ATOM 512 CD PRO A 38 0.534 8.767 -17.442 1.00 0.00 C ATOM 0 HA PRO A 38 3.229 9.011 -19.258 1.00 0.00 H new ATOM 0 HB2 PRO A 38 0.874 9.354 -20.693 1.00 0.00 H new ATOM 0 HB3 PRO A 38 1.300 7.786 -20.035 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -0.579 9.859 -18.922 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -0.786 8.121 -19.011 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -0.019 9.350 -16.705 1.00 0.00 H new ATOM 0 HD3 PRO A 38 0.521 7.731 -17.104 1.00 0.00 H new ATOM 520 N ARG A 39 1.530 11.759 -18.827 1.00 0.00 N ATOM 521 CA ARG A 39 1.554 13.190 -19.101 1.00 0.00 C ATOM 522 C ARG A 39 2.933 13.776 -18.814 1.00 0.00 C ATOM 523 O ARG A 39 3.556 14.380 -19.687 1.00 0.00 O ATOM 524 CB ARG A 39 0.497 13.910 -18.261 1.00 0.00 C ATOM 525 CG ARG A 39 0.023 15.219 -18.870 1.00 0.00 C ATOM 526 CD ARG A 39 -1.264 15.702 -18.220 1.00 0.00 C ATOM 527 NE ARG A 39 -1.007 16.543 -17.054 1.00 0.00 N ATOM 528 CZ ARG A 39 -0.498 17.767 -17.129 1.00 0.00 C ATOM 529 NH1 ARG A 39 -0.194 18.292 -18.308 1.00 0.00 N ATOM 530 NH2 ARG A 39 -0.293 18.471 -16.022 1.00 0.00 N ATOM 0 H ARG A 39 0.800 11.466 -18.178 1.00 0.00 H new ATOM 0 HA ARG A 39 1.329 13.335 -20.158 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -0.360 13.250 -18.127 1.00 0.00 H new ATOM 0 HB3 ARG A 39 0.905 14.107 -17.270 1.00 0.00 H new ATOM 0 HG2 ARG A 39 0.797 15.977 -18.754 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -0.136 15.087 -19.940 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -1.850 16.262 -18.949 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -1.864 14.842 -17.922 1.00 0.00 H new ATOM 0 HE ARG A 39 -1.231 16.170 -16.132 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -0.351 17.755 -19.161 1.00 0.00 H new ATOM 0 HH12 ARG A 39 0.197 19.233 -18.362 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -0.527 18.072 -15.113 1.00 0.00 H new ATOM 0 HH22 ARG A 39 0.098 19.411 -16.081 1.00 0.00 H new ATOM 544 N ASP A 40 3.403 13.593 -17.585 1.00 0.00 N ATOM 545 CA ASP A 40 4.709 14.102 -17.182 1.00 0.00 C ATOM 546 C ASP A 40 5.697 12.959 -16.970 1.00 0.00 C ATOM 547 O ASP A 40 5.887 12.468 -15.857 1.00 0.00 O ATOM 548 CB ASP A 40 4.585 14.928 -15.901 1.00 0.00 C ATOM 549 CG ASP A 40 3.534 14.378 -14.956 1.00 0.00 C ATOM 550 OD1 ASP A 40 3.593 13.170 -14.644 1.00 0.00 O ATOM 551 OD2 ASP A 40 2.654 15.154 -14.530 1.00 0.00 O ATOM 0 H ASP A 40 2.899 13.096 -16.850 1.00 0.00 H new ATOM 0 HA ASP A 40 5.085 14.740 -17.982 1.00 0.00 H new ATOM 0 HB2 ASP A 40 5.549 14.952 -15.393 1.00 0.00 H new ATOM 0 HB3 ASP A 40 4.335 15.957 -16.159 1.00 0.00 H new ATOM 556 N PRO A 41 6.340 12.522 -18.064 1.00 0.00 N ATOM 557 CA PRO A 41 7.318 11.431 -18.023 1.00 0.00 C ATOM 558 C PRO A 41 8.603 11.831 -17.307 1.00 0.00 C ATOM 559 O PRO A 41 9.523 11.025 -17.162 1.00 0.00 O ATOM 560 CB PRO A 41 7.595 11.148 -19.502 1.00 0.00 C ATOM 561 CG PRO A 41 7.286 12.430 -20.197 1.00 0.00 C ATOM 562 CD PRO A 41 6.162 13.060 -19.423 1.00 0.00 C ATOM 0 HA PRO A 41 6.944 10.568 -17.472 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.632 10.851 -19.661 1.00 0.00 H new ATOM 0 HB3 PRO A 41 6.970 10.336 -19.873 1.00 0.00 H new ATOM 0 HG2 PRO A 41 8.159 13.083 -20.218 1.00 0.00 H new ATOM 0 HG3 PRO A 41 6.995 12.252 -21.232 1.00 0.00 H new ATOM 0 HD2 PRO A 41 6.226 14.148 -19.436 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.190 12.793 -19.837 1.00 0.00 H new ATOM 570 N THR A 42 8.662 13.081 -16.860 1.00 0.00 N ATOM 571 CA THR A 42 9.835 13.589 -16.159 1.00 0.00 C ATOM 572 C THR A 42 9.559 13.746 -14.668 1.00 0.00 C ATOM 573 O THR A 42 10.154 14.594 -14.003 1.00 0.00 O ATOM 574 CB THR A 42 10.288 14.945 -16.732 1.00 0.00 C ATOM 575 OG1 THR A 42 9.175 15.843 -16.803 1.00 0.00 O ATOM 576 CG2 THR A 42 10.896 14.772 -18.115 1.00 0.00 C ATOM 0 H THR A 42 7.910 13.761 -16.971 1.00 0.00 H new ATOM 0 HA THR A 42 10.631 12.858 -16.303 1.00 0.00 H new ATOM 0 HB THR A 42 11.047 15.360 -16.069 1.00 0.00 H new ATOM 0 HG1 THR A 42 9.472 16.703 -17.167 1.00 0.00 H new ATOM 0 HG21 THR A 42 11.208 15.743 -18.499 1.00 0.00 H new ATOM 0 HG22 THR A 42 11.761 14.111 -18.052 1.00 0.00 H new ATOM 0 HG23 THR A 42 10.155 14.337 -18.786 1.00 0.00 H new ATOM 584 N ASP A 43 8.655 12.923 -14.148 1.00 0.00 N ATOM 585 CA ASP A 43 8.302 12.970 -12.734 1.00 0.00 C ATOM 586 C ASP A 43 8.652 11.656 -12.043 1.00 0.00 C ATOM 587 O ASP A 43 8.115 10.602 -12.384 1.00 0.00 O ATOM 588 CB ASP A 43 6.811 13.266 -12.568 1.00 0.00 C ATOM 589 CG ASP A 43 5.971 12.004 -12.528 1.00 0.00 C ATOM 590 OD1 ASP A 43 5.768 11.462 -11.421 1.00 0.00 O ATOM 591 OD2 ASP A 43 5.516 11.560 -13.602 1.00 0.00 O ATOM 0 H ASP A 43 8.153 12.215 -14.685 1.00 0.00 H new ATOM 0 HA ASP A 43 8.877 13.770 -12.268 1.00 0.00 H new ATOM 0 HB2 ASP A 43 6.656 13.831 -11.649 1.00 0.00 H new ATOM 0 HB3 ASP A 43 6.475 13.897 -13.391 1.00 0.00 H new ATOM 596 N GLU A 44 9.557 11.726 -11.072 1.00 0.00 N ATOM 597 CA GLU A 44 9.980 10.541 -10.335 1.00 0.00 C ATOM 598 C GLU A 44 9.102 10.323 -9.106 1.00 0.00 C ATOM 599 O GLU A 44 9.519 9.692 -8.136 1.00 0.00 O ATOM 600 CB GLU A 44 11.445 10.672 -9.912 1.00 0.00 C ATOM 601 CG GLU A 44 12.413 10.729 -11.081 1.00 0.00 C ATOM 602 CD GLU A 44 12.375 12.060 -11.807 1.00 0.00 C ATOM 603 OE1 GLU A 44 12.516 13.105 -11.138 1.00 0.00 O ATOM 604 OE2 GLU A 44 12.205 12.055 -13.044 1.00 0.00 O ATOM 0 H GLU A 44 10.011 12.590 -10.777 1.00 0.00 H new ATOM 0 HA GLU A 44 9.875 9.678 -10.993 1.00 0.00 H new ATOM 0 HB2 GLU A 44 11.561 11.573 -9.310 1.00 0.00 H new ATOM 0 HB3 GLU A 44 11.707 9.827 -9.275 1.00 0.00 H new ATOM 0 HG2 GLU A 44 13.425 10.546 -10.719 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.176 9.930 -11.783 1.00 0.00 H new ATOM 611 N GLY A 45 7.882 10.850 -9.156 1.00 0.00 N ATOM 612 CA GLY A 45 6.964 10.703 -8.042 1.00 0.00 C ATOM 613 C GLY A 45 6.679 9.251 -7.714 1.00 0.00 C ATOM 614 O GLY A 45 6.723 8.389 -8.592 1.00 0.00 O ATOM 0 H GLY A 45 7.513 11.376 -9.948 1.00 0.00 H new ATOM 0 HA2 GLY A 45 7.381 11.196 -7.164 1.00 0.00 H new ATOM 0 HA3 GLY A 45 6.028 11.210 -8.277 1.00 0.00 H new ATOM 618 N ILE A 46 6.388 8.979 -6.446 1.00 0.00 N ATOM 619 CA ILE A 46 6.096 7.621 -6.005 1.00 0.00 C ATOM 620 C ILE A 46 4.728 7.543 -5.335 1.00 0.00 C ATOM 621 O ILE A 46 4.489 8.181 -4.310 1.00 0.00 O ATOM 622 CB ILE A 46 7.165 7.105 -5.023 1.00 0.00 C ATOM 623 CG1 ILE A 46 8.553 7.179 -5.662 1.00 0.00 C ATOM 624 CG2 ILE A 46 6.848 5.680 -4.595 1.00 0.00 C ATOM 625 CD1 ILE A 46 9.680 7.221 -4.654 1.00 0.00 C ATOM 0 H ILE A 46 6.348 9.681 -5.707 1.00 0.00 H new ATOM 0 HA ILE A 46 6.099 6.993 -6.896 1.00 0.00 H new ATOM 0 HB ILE A 46 7.159 7.739 -4.136 1.00 0.00 H new ATOM 0 HG12 ILE A 46 8.691 6.316 -6.313 1.00 0.00 H new ATOM 0 HG13 ILE A 46 8.607 8.066 -6.293 1.00 0.00 H new ATOM 0 HG21 ILE A 46 7.612 5.330 -3.901 1.00 0.00 H new ATOM 0 HG22 ILE A 46 5.875 5.655 -4.105 1.00 0.00 H new ATOM 0 HG23 ILE A 46 6.829 5.032 -5.472 1.00 0.00 H new ATOM 0 HD11 ILE A 46 10.635 7.273 -5.178 1.00 0.00 H new ATOM 0 HD12 ILE A 46 9.567 8.099 -4.018 1.00 0.00 H new ATOM 0 HD13 ILE A 46 9.652 6.321 -4.039 1.00 0.00 H new ATOM 637 N PHE A 47 3.832 6.755 -5.922 1.00 0.00 N ATOM 638 CA PHE A 47 2.487 6.592 -5.382 1.00 0.00 C ATOM 639 C PHE A 47 2.138 5.115 -5.228 1.00 0.00 C ATOM 640 O PHE A 47 2.635 4.268 -5.972 1.00 0.00 O ATOM 641 CB PHE A 47 1.464 7.277 -6.290 1.00 0.00 C ATOM 642 CG PHE A 47 1.779 8.720 -6.566 1.00 0.00 C ATOM 643 CD1 PHE A 47 2.958 9.077 -7.200 1.00 0.00 C ATOM 644 CD2 PHE A 47 0.896 9.719 -6.190 1.00 0.00 C ATOM 645 CE1 PHE A 47 3.250 10.403 -7.455 1.00 0.00 C ATOM 646 CE2 PHE A 47 1.183 11.047 -6.443 1.00 0.00 C ATOM 647 CZ PHE A 47 2.362 11.390 -7.075 1.00 0.00 C ATOM 0 H PHE A 47 4.013 6.220 -6.771 1.00 0.00 H new ATOM 0 HA PHE A 47 2.459 7.058 -4.397 1.00 0.00 H new ATOM 0 HB2 PHE A 47 1.411 6.738 -7.236 1.00 0.00 H new ATOM 0 HB3 PHE A 47 0.479 7.210 -5.829 1.00 0.00 H new ATOM 0 HD1 PHE A 47 3.657 8.310 -7.498 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -0.027 9.457 -5.694 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.172 10.668 -7.951 1.00 0.00 H new ATOM 0 HE2 PHE A 47 0.485 11.816 -6.147 1.00 0.00 H new ATOM 0 HZ PHE A 47 2.589 12.427 -7.272 1.00 0.00 H new ATOM 657 N ILE A 48 1.282 4.813 -4.258 1.00 0.00 N ATOM 658 CA ILE A 48 0.866 3.439 -4.006 1.00 0.00 C ATOM 659 C ILE A 48 0.264 2.809 -5.258 1.00 0.00 C ATOM 660 O ILE A 48 -0.382 3.487 -6.057 1.00 0.00 O ATOM 661 CB ILE A 48 -0.161 3.363 -2.861 1.00 0.00 C ATOM 662 CG1 ILE A 48 0.377 4.069 -1.616 1.00 0.00 C ATOM 663 CG2 ILE A 48 -0.500 1.912 -2.550 1.00 0.00 C ATOM 664 CD1 ILE A 48 -0.627 4.153 -0.487 1.00 0.00 C ATOM 0 H ILE A 48 0.863 5.502 -3.633 1.00 0.00 H new ATOM 0 HA ILE A 48 1.760 2.886 -3.718 1.00 0.00 H new ATOM 0 HB ILE A 48 -1.073 3.870 -3.176 1.00 0.00 H new ATOM 0 HG12 ILE A 48 1.264 3.542 -1.264 1.00 0.00 H new ATOM 0 HG13 ILE A 48 0.692 5.077 -1.887 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -1.227 1.874 -1.739 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -0.921 1.439 -3.437 1.00 0.00 H new ATOM 0 HG23 ILE A 48 0.405 1.383 -2.251 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -0.177 4.666 0.363 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -1.505 4.706 -0.821 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -0.924 3.148 -0.188 1.00 0.00 H new ATOM 676 N SER A 49 0.479 1.508 -5.420 1.00 0.00 N ATOM 677 CA SER A 49 -0.041 0.785 -6.576 1.00 0.00 C ATOM 678 C SER A 49 -0.963 -0.348 -6.138 1.00 0.00 C ATOM 679 O SER A 49 -1.834 -0.783 -6.892 1.00 0.00 O ATOM 680 CB SER A 49 1.110 0.227 -7.414 1.00 0.00 C ATOM 681 OG SER A 49 1.775 -0.823 -6.733 1.00 0.00 O ATOM 0 H SER A 49 1.009 0.932 -4.766 1.00 0.00 H new ATOM 0 HA SER A 49 -0.617 1.484 -7.183 1.00 0.00 H new ATOM 0 HB2 SER A 49 0.726 -0.139 -8.366 1.00 0.00 H new ATOM 0 HB3 SER A 49 1.819 1.024 -7.641 1.00 0.00 H new ATOM 0 HG SER A 49 2.505 -1.164 -7.291 1.00 0.00 H new ATOM 687 N LYS A 50 -0.766 -0.823 -4.913 1.00 0.00 N ATOM 688 CA LYS A 50 -1.579 -1.905 -4.371 1.00 0.00 C ATOM 689 C LYS A 50 -1.604 -1.857 -2.847 1.00 0.00 C ATOM 690 O LYS A 50 -0.697 -1.312 -2.218 1.00 0.00 O ATOM 691 CB LYS A 50 -1.041 -3.259 -4.840 1.00 0.00 C ATOM 692 CG LYS A 50 -1.590 -4.437 -4.054 1.00 0.00 C ATOM 693 CD LYS A 50 -0.820 -5.713 -4.351 1.00 0.00 C ATOM 694 CE LYS A 50 -1.208 -6.296 -5.701 1.00 0.00 C ATOM 695 NZ LYS A 50 -0.921 -7.755 -5.778 1.00 0.00 N ATOM 0 H LYS A 50 -0.049 -0.475 -4.276 1.00 0.00 H new ATOM 0 HA LYS A 50 -2.598 -1.778 -4.737 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -1.284 -3.392 -5.894 1.00 0.00 H new ATOM 0 HB3 LYS A 50 0.046 -3.256 -4.761 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -1.538 -4.220 -2.987 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -2.642 -4.581 -4.299 1.00 0.00 H new ATOM 0 HD2 LYS A 50 0.250 -5.505 -4.337 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -1.013 -6.446 -3.568 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -2.270 -6.125 -5.879 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -0.665 -5.777 -6.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -1.199 -8.115 -6.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 0.096 -7.917 -5.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -1.459 -8.254 -5.041 1.00 0.00 H new ATOM 709 N VAL A 51 -2.648 -2.432 -2.258 1.00 0.00 N ATOM 710 CA VAL A 51 -2.789 -2.456 -0.807 1.00 0.00 C ATOM 711 C VAL A 51 -3.507 -3.720 -0.346 1.00 0.00 C ATOM 712 O VAL A 51 -4.687 -3.916 -0.635 1.00 0.00 O ATOM 713 CB VAL A 51 -3.561 -1.225 -0.297 1.00 0.00 C ATOM 714 CG1 VAL A 51 -3.714 -1.278 1.215 1.00 0.00 C ATOM 715 CG2 VAL A 51 -2.863 0.057 -0.726 1.00 0.00 C ATOM 0 H VAL A 51 -3.408 -2.887 -2.763 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.782 -2.441 -0.391 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.557 -1.235 -0.739 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.262 -0.400 1.556 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -4.261 -2.178 1.494 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -2.728 -1.294 1.680 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.422 0.917 -0.357 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -1.854 0.077 -0.315 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -2.812 0.097 -1.814 1.00 0.00 H new ATOM 725 N SER A 52 -2.786 -4.574 0.374 1.00 0.00 N ATOM 726 CA SER A 52 -3.354 -5.822 0.873 1.00 0.00 C ATOM 727 C SER A 52 -4.578 -5.552 1.742 1.00 0.00 C ATOM 728 O SER A 52 -4.594 -4.643 2.572 1.00 0.00 O ATOM 729 CB SER A 52 -2.306 -6.598 1.673 1.00 0.00 C ATOM 730 OG SER A 52 -2.833 -7.827 2.145 1.00 0.00 O ATOM 0 H SER A 52 -1.809 -4.425 0.625 1.00 0.00 H new ATOM 0 HA SER A 52 -3.664 -6.421 0.017 1.00 0.00 H new ATOM 0 HB2 SER A 52 -1.434 -6.789 1.047 1.00 0.00 H new ATOM 0 HB3 SER A 52 -1.968 -5.996 2.516 1.00 0.00 H new ATOM 0 HG SER A 52 -2.144 -8.305 2.652 1.00 0.00 H new ATOM 736 N PRO A 53 -5.630 -6.361 1.548 1.00 0.00 N ATOM 737 CA PRO A 53 -6.879 -6.231 2.305 1.00 0.00 C ATOM 738 C PRO A 53 -6.715 -6.632 3.767 1.00 0.00 C ATOM 739 O PRO A 53 -7.496 -6.222 4.626 1.00 0.00 O ATOM 740 CB PRO A 53 -7.829 -7.194 1.589 1.00 0.00 C ATOM 741 CG PRO A 53 -6.937 -8.203 0.952 1.00 0.00 C ATOM 742 CD PRO A 53 -5.681 -7.466 0.576 1.00 0.00 C ATOM 0 HA PRO A 53 -7.235 -5.201 2.332 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -8.520 -7.663 2.290 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -8.433 -6.674 0.845 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -6.719 -9.020 1.639 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -7.410 -8.643 0.074 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -4.802 -8.106 0.649 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -5.723 -7.098 -0.449 1.00 0.00 H new ATOM 750 N THR A 54 -5.694 -7.437 4.044 1.00 0.00 N ATOM 751 CA THR A 54 -5.428 -7.895 5.403 1.00 0.00 C ATOM 752 C THR A 54 -4.199 -7.206 5.984 1.00 0.00 C ATOM 753 O THR A 54 -3.910 -7.330 7.173 1.00 0.00 O ATOM 754 CB THR A 54 -5.219 -9.420 5.451 1.00 0.00 C ATOM 755 OG1 THR A 54 -4.307 -9.756 6.502 1.00 0.00 O ATOM 756 CG2 THR A 54 -4.684 -9.935 4.124 1.00 0.00 C ATOM 0 H THR A 54 -5.037 -7.786 3.345 1.00 0.00 H new ATOM 0 HA THR A 54 -6.302 -7.637 6.001 1.00 0.00 H new ATOM 0 HB THR A 54 -6.183 -9.891 5.643 1.00 0.00 H new ATOM 0 HG1 THR A 54 -4.290 -9.033 7.164 1.00 0.00 H new ATOM 0 HG21 THR A 54 -4.544 -11.014 4.182 1.00 0.00 H new ATOM 0 HG22 THR A 54 -5.395 -9.703 3.331 1.00 0.00 H new ATOM 0 HG23 THR A 54 -3.729 -9.457 3.907 1.00 0.00 H new ATOM 764 N GLY A 55 -3.478 -6.478 5.136 1.00 0.00 N ATOM 765 CA GLY A 55 -2.287 -5.780 5.585 1.00 0.00 C ATOM 766 C GLY A 55 -2.608 -4.630 6.520 1.00 0.00 C ATOM 767 O GLY A 55 -3.712 -4.087 6.491 1.00 0.00 O ATOM 0 H GLY A 55 -3.697 -6.359 4.147 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -1.627 -6.483 6.092 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -1.744 -5.400 4.720 1.00 0.00 H new ATOM 771 N ALA A 56 -1.640 -4.259 7.352 1.00 0.00 N ATOM 772 CA ALA A 56 -1.825 -3.166 8.299 1.00 0.00 C ATOM 773 C ALA A 56 -2.512 -1.976 7.637 1.00 0.00 C ATOM 774 O ALA A 56 -3.304 -1.276 8.267 1.00 0.00 O ATOM 775 CB ALA A 56 -0.486 -2.745 8.887 1.00 0.00 C ATOM 0 H ALA A 56 -0.721 -4.699 7.389 1.00 0.00 H new ATOM 0 HA ALA A 56 -2.468 -3.521 9.105 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -0.639 -1.928 9.592 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -0.034 -3.591 9.404 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.175 -2.414 8.086 1.00 0.00 H new ATOM 781 N ALA A 57 -2.202 -1.753 6.364 1.00 0.00 N ATOM 782 CA ALA A 57 -2.791 -0.649 5.617 1.00 0.00 C ATOM 783 C ALA A 57 -4.256 -0.922 5.296 1.00 0.00 C ATOM 784 O ALA A 57 -5.136 -0.137 5.646 1.00 0.00 O ATOM 785 CB ALA A 57 -2.006 -0.399 4.338 1.00 0.00 C ATOM 0 H ALA A 57 -1.546 -2.322 5.829 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.744 0.244 6.240 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -2.457 0.428 3.790 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -0.975 -0.150 4.587 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -2.023 -1.296 3.719 1.00 0.00 H new ATOM 791 N GLY A 58 -4.512 -2.043 4.627 1.00 0.00 N ATOM 792 CA GLY A 58 -5.872 -2.400 4.269 1.00 0.00 C ATOM 793 C GLY A 58 -6.814 -2.356 5.456 1.00 0.00 C ATOM 794 O GLY A 58 -7.964 -1.934 5.329 1.00 0.00 O ATOM 0 H GLY A 58 -3.801 -2.710 4.327 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -6.232 -1.719 3.498 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -5.880 -3.402 3.839 1.00 0.00 H new ATOM 798 N ARG A 59 -6.327 -2.794 6.612 1.00 0.00 N ATOM 799 CA ARG A 59 -7.135 -2.806 7.826 1.00 0.00 C ATOM 800 C ARG A 59 -7.253 -1.403 8.414 1.00 0.00 C ATOM 801 O ARG A 59 -8.243 -1.075 9.069 1.00 0.00 O ATOM 802 CB ARG A 59 -6.526 -3.755 8.860 1.00 0.00 C ATOM 803 CG ARG A 59 -5.184 -3.288 9.399 1.00 0.00 C ATOM 804 CD ARG A 59 -4.904 -3.871 10.776 1.00 0.00 C ATOM 805 NE ARG A 59 -3.477 -4.087 10.998 1.00 0.00 N ATOM 806 CZ ARG A 59 -2.856 -5.231 10.733 1.00 0.00 C ATOM 807 NH1 ARG A 59 -3.534 -6.257 10.237 1.00 0.00 N ATOM 808 NH2 ARG A 59 -1.555 -5.350 10.963 1.00 0.00 N ATOM 0 H ARG A 59 -5.377 -3.145 6.734 1.00 0.00 H new ATOM 0 HA ARG A 59 -8.133 -3.157 7.565 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -7.222 -3.868 9.691 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -6.404 -4.740 8.409 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.392 -3.582 8.710 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.171 -2.199 9.454 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -5.292 -3.198 11.541 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.435 -4.817 10.884 1.00 0.00 H new ATOM 0 HE ARG A 59 -2.927 -3.317 11.378 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -4.534 -6.169 10.058 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -3.055 -7.135 10.034 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -1.030 -4.563 11.344 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -1.079 -6.229 10.759 1.00 0.00 H new ATOM 822 N ASP A 60 -6.237 -0.581 8.177 1.00 0.00 N ATOM 823 CA ASP A 60 -6.226 0.787 8.683 1.00 0.00 C ATOM 824 C ASP A 60 -7.474 1.542 8.234 1.00 0.00 C ATOM 825 O ASP A 60 -8.299 1.941 9.054 1.00 0.00 O ATOM 826 CB ASP A 60 -4.972 1.520 8.206 1.00 0.00 C ATOM 827 CG ASP A 60 -4.942 2.968 8.653 1.00 0.00 C ATOM 828 OD1 ASP A 60 -5.722 3.774 8.105 1.00 0.00 O ATOM 829 OD2 ASP A 60 -4.139 3.296 9.552 1.00 0.00 O ATOM 0 H ASP A 60 -5.410 -0.838 7.638 1.00 0.00 H new ATOM 0 HA ASP A 60 -6.220 0.746 9.772 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -4.088 1.007 8.586 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -4.922 1.478 7.118 1.00 0.00 H new ATOM 834 N GLY A 61 -7.603 1.735 6.925 1.00 0.00 N ATOM 835 CA GLY A 61 -8.752 2.443 6.390 1.00 0.00 C ATOM 836 C GLY A 61 -8.363 3.721 5.674 1.00 0.00 C ATOM 837 O GLY A 61 -9.207 4.383 5.070 1.00 0.00 O ATOM 0 H GLY A 61 -6.933 1.414 6.226 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -9.287 1.791 5.699 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -9.439 2.680 7.202 1.00 0.00 H new ATOM 841 N ARG A 62 -7.083 4.070 5.743 1.00 0.00 N ATOM 842 CA ARG A 62 -6.584 5.279 5.098 1.00 0.00 C ATOM 843 C ARG A 62 -5.710 4.934 3.897 1.00 0.00 C ATOM 844 O ARG A 62 -5.905 5.463 2.801 1.00 0.00 O ATOM 845 CB ARG A 62 -5.789 6.124 6.096 1.00 0.00 C ATOM 846 CG ARG A 62 -6.544 6.420 7.381 1.00 0.00 C ATOM 847 CD ARG A 62 -7.622 7.470 7.165 1.00 0.00 C ATOM 848 NE ARG A 62 -8.719 6.968 6.341 1.00 0.00 N ATOM 849 CZ ARG A 62 -9.572 7.754 5.694 1.00 0.00 C ATOM 850 NH1 ARG A 62 -9.455 9.072 5.775 1.00 0.00 N ATOM 851 NH2 ARG A 62 -10.544 7.222 4.964 1.00 0.00 N ATOM 0 H ARG A 62 -6.372 3.533 6.239 1.00 0.00 H new ATOM 0 HA ARG A 62 -7.441 5.854 4.748 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -4.862 5.606 6.341 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -5.512 7.066 5.622 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -6.998 5.503 7.757 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -5.846 6.766 8.143 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -8.012 7.793 8.130 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -7.183 8.347 6.689 1.00 0.00 H new ATOM 0 HE ARG A 62 -8.836 5.958 6.258 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -8.709 9.484 6.335 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -10.111 9.674 5.277 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -10.637 6.208 4.899 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -11.198 7.827 4.468 1.00 0.00 H new ATOM 865 N LEU A 63 -4.746 4.045 4.109 1.00 0.00 N ATOM 866 CA LEU A 63 -3.840 3.629 3.044 1.00 0.00 C ATOM 867 C LEU A 63 -4.597 2.896 1.941 1.00 0.00 C ATOM 868 O LEU A 63 -5.257 1.888 2.192 1.00 0.00 O ATOM 869 CB LEU A 63 -2.738 2.730 3.606 1.00 0.00 C ATOM 870 CG LEU A 63 -1.530 2.501 2.698 1.00 0.00 C ATOM 871 CD1 LEU A 63 -1.950 1.793 1.419 1.00 0.00 C ATOM 872 CD2 LEU A 63 -0.845 3.821 2.379 1.00 0.00 C ATOM 0 H LEU A 63 -4.571 3.598 5.009 1.00 0.00 H new ATOM 0 HA LEU A 63 -3.387 4.523 2.616 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.386 3.163 4.543 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.175 1.761 3.847 1.00 0.00 H new ATOM 0 HG LEU A 63 -0.819 1.864 3.225 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -1.077 1.639 0.785 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -2.394 0.829 1.666 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -2.680 2.404 0.888 1.00 0.00 H new ATOM 0 HD21 LEU A 63 0.013 3.639 1.732 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -1.548 4.483 1.872 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -0.508 4.289 3.304 1.00 0.00 H new ATOM 884 N ARG A 64 -4.496 3.409 0.719 1.00 0.00 N ATOM 885 CA ARG A 64 -5.170 2.803 -0.423 1.00 0.00 C ATOM 886 C ARG A 64 -4.423 3.106 -1.719 1.00 0.00 C ATOM 887 O ARG A 64 -3.908 4.208 -1.908 1.00 0.00 O ATOM 888 CB ARG A 64 -6.609 3.310 -0.520 1.00 0.00 C ATOM 889 CG ARG A 64 -7.344 3.318 0.810 1.00 0.00 C ATOM 890 CD ARG A 64 -8.835 3.550 0.622 1.00 0.00 C ATOM 891 NE ARG A 64 -9.621 2.968 1.707 1.00 0.00 N ATOM 892 CZ ARG A 64 -10.947 3.016 1.761 1.00 0.00 C ATOM 893 NH1 ARG A 64 -11.633 3.615 0.797 1.00 0.00 N ATOM 894 NH2 ARG A 64 -11.591 2.464 2.782 1.00 0.00 N ATOM 0 H ARG A 64 -3.954 4.243 0.494 1.00 0.00 H new ATOM 0 HA ARG A 64 -5.182 1.723 -0.275 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.602 4.321 -0.927 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -7.158 2.686 -1.225 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -7.184 2.368 1.321 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -6.931 4.098 1.450 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -9.031 4.621 0.566 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -9.152 3.118 -0.327 1.00 0.00 H new ATOM 0 HE ARG A 64 -9.124 2.499 2.465 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -11.142 4.041 0.011 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -12.651 3.650 0.842 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -11.067 2.003 3.526 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -12.610 2.501 2.823 1.00 0.00 H new ATOM 908 N VAL A 65 -4.369 2.120 -2.608 1.00 0.00 N ATOM 909 CA VAL A 65 -3.686 2.280 -3.887 1.00 0.00 C ATOM 910 C VAL A 65 -4.163 3.534 -4.611 1.00 0.00 C ATOM 911 O VAL A 65 -5.182 3.516 -5.300 1.00 0.00 O ATOM 912 CB VAL A 65 -3.907 1.059 -4.798 1.00 0.00 C ATOM 913 CG1 VAL A 65 -5.235 0.388 -4.481 1.00 0.00 C ATOM 914 CG2 VAL A 65 -3.844 1.468 -6.262 1.00 0.00 C ATOM 0 H VAL A 65 -4.790 1.202 -2.467 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.622 2.372 -3.668 1.00 0.00 H new ATOM 0 HB VAL A 65 -3.110 0.340 -4.610 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -5.373 -0.473 -5.135 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -5.237 0.058 -3.442 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -6.048 1.097 -4.638 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -4.002 0.592 -6.892 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -4.618 2.207 -6.467 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -2.866 1.898 -6.478 1.00 0.00 H new ATOM 924 N GLY A 66 -3.418 4.624 -4.450 1.00 0.00 N ATOM 925 CA GLY A 66 -3.781 5.872 -5.094 1.00 0.00 C ATOM 926 C GLY A 66 -3.243 7.083 -4.357 1.00 0.00 C ATOM 927 O GLY A 66 -3.257 8.196 -4.884 1.00 0.00 O ATOM 0 H GLY A 66 -2.570 4.664 -3.885 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -3.401 5.874 -6.116 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.867 5.942 -5.158 1.00 0.00 H new ATOM 931 N LEU A 67 -2.770 6.867 -3.135 1.00 0.00 N ATOM 932 CA LEU A 67 -2.227 7.950 -2.323 1.00 0.00 C ATOM 933 C LEU A 67 -0.770 8.224 -2.683 1.00 0.00 C ATOM 934 O LEU A 67 -0.049 7.325 -3.117 1.00 0.00 O ATOM 935 CB LEU A 67 -2.340 7.606 -0.837 1.00 0.00 C ATOM 936 CG LEU A 67 -3.727 7.185 -0.349 1.00 0.00 C ATOM 937 CD1 LEU A 67 -3.709 6.921 1.148 1.00 0.00 C ATOM 938 CD2 LEU A 67 -4.759 8.250 -0.692 1.00 0.00 C ATOM 0 H LEU A 67 -2.751 5.952 -2.685 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.808 8.849 -2.527 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.639 6.801 -0.617 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.021 8.473 -0.259 1.00 0.00 H new ATOM 0 HG LEU A 67 -4.005 6.261 -0.857 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.704 6.623 1.477 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.000 6.123 1.368 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -3.410 7.828 1.674 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.740 7.934 -0.337 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -4.485 9.190 -0.212 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.792 8.390 -1.772 1.00 0.00 H new ATOM 950 N ARG A 68 -0.344 9.469 -2.499 1.00 0.00 N ATOM 951 CA ARG A 68 1.027 9.860 -2.804 1.00 0.00 C ATOM 952 C ARG A 68 1.898 9.809 -1.552 1.00 0.00 C ATOM 953 O ARG A 68 1.690 10.569 -0.606 1.00 0.00 O ATOM 954 CB ARG A 68 1.057 11.268 -3.401 1.00 0.00 C ATOM 955 CG ARG A 68 2.430 11.688 -3.900 1.00 0.00 C ATOM 956 CD ARG A 68 2.418 13.114 -4.430 1.00 0.00 C ATOM 957 NE ARG A 68 3.747 13.557 -4.841 1.00 0.00 N ATOM 958 CZ ARG A 68 4.058 14.826 -5.080 1.00 0.00 C ATOM 959 NH1 ARG A 68 3.139 15.772 -4.951 1.00 0.00 N ATOM 960 NH2 ARG A 68 5.290 15.150 -5.450 1.00 0.00 N ATOM 0 H ARG A 68 -0.928 10.224 -2.140 1.00 0.00 H new ATOM 0 HA ARG A 68 1.426 9.155 -3.533 1.00 0.00 H new ATOM 0 HB2 ARG A 68 0.348 11.318 -4.227 1.00 0.00 H new ATOM 0 HB3 ARG A 68 0.720 11.980 -2.648 1.00 0.00 H new ATOM 0 HG2 ARG A 68 3.154 11.606 -3.089 1.00 0.00 H new ATOM 0 HG3 ARG A 68 2.756 11.009 -4.688 1.00 0.00 H new ATOM 0 HD2 ARG A 68 1.736 13.180 -5.278 1.00 0.00 H new ATOM 0 HD3 ARG A 68 2.035 13.784 -3.660 1.00 0.00 H new ATOM 0 HE ARG A 68 4.477 12.853 -4.951 1.00 0.00 H new ATOM 0 HH11 ARG A 68 2.190 15.526 -4.668 1.00 0.00 H new ATOM 0 HH12 ARG A 68 3.380 16.746 -5.135 1.00 0.00 H new ATOM 0 HH21 ARG A 68 6.000 14.424 -5.551 1.00 0.00 H new ATOM 0 HH22 ARG A 68 5.528 16.125 -5.633 1.00 0.00 H new ATOM 974 N LEU A 69 2.874 8.907 -1.553 1.00 0.00 N ATOM 975 CA LEU A 69 3.777 8.755 -0.418 1.00 0.00 C ATOM 976 C LEU A 69 4.755 9.923 -0.340 1.00 0.00 C ATOM 977 O LEU A 69 5.671 10.035 -1.157 1.00 0.00 O ATOM 978 CB LEU A 69 4.546 7.437 -0.525 1.00 0.00 C ATOM 979 CG LEU A 69 3.950 6.250 0.232 1.00 0.00 C ATOM 980 CD1 LEU A 69 4.143 6.420 1.731 1.00 0.00 C ATOM 981 CD2 LEU A 69 2.474 6.090 -0.103 1.00 0.00 C ATOM 0 H LEU A 69 3.060 8.270 -2.328 1.00 0.00 H new ATOM 0 HA LEU A 69 3.178 8.745 0.492 1.00 0.00 H new ATOM 0 HB2 LEU A 69 4.623 7.169 -1.579 1.00 0.00 H new ATOM 0 HB3 LEU A 69 5.561 7.601 -0.163 1.00 0.00 H new ATOM 0 HG LEU A 69 4.473 5.346 -0.080 1.00 0.00 H new ATOM 0 HD11 LEU A 69 3.712 5.565 2.253 1.00 0.00 H new ATOM 0 HD12 LEU A 69 5.208 6.483 1.956 1.00 0.00 H new ATOM 0 HD13 LEU A 69 3.648 7.333 2.060 1.00 0.00 H new ATOM 0 HD21 LEU A 69 2.067 5.240 0.445 1.00 0.00 H new ATOM 0 HD22 LEU A 69 1.937 6.995 0.179 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.360 5.920 -1.174 1.00 0.00 H new ATOM 993 N LEU A 70 4.558 10.790 0.647 1.00 0.00 N ATOM 994 CA LEU A 70 5.424 11.949 0.833 1.00 0.00 C ATOM 995 C LEU A 70 6.667 11.576 1.634 1.00 0.00 C ATOM 996 O LEU A 70 7.783 11.948 1.273 1.00 0.00 O ATOM 997 CB LEU A 70 4.663 13.070 1.543 1.00 0.00 C ATOM 998 CG LEU A 70 3.914 14.050 0.639 1.00 0.00 C ATOM 999 CD1 LEU A 70 2.909 13.311 -0.231 1.00 0.00 C ATOM 1000 CD2 LEU A 70 3.219 15.117 1.471 1.00 0.00 C ATOM 0 H LEU A 70 3.806 10.712 1.331 1.00 0.00 H new ATOM 0 HA LEU A 70 5.739 12.298 -0.150 1.00 0.00 H new ATOM 0 HB2 LEU A 70 3.946 12.618 2.228 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.371 13.635 2.150 1.00 0.00 H new ATOM 0 HG LEU A 70 4.637 14.540 -0.013 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.385 14.024 -0.868 1.00 0.00 H new ATOM 0 HD12 LEU A 70 3.431 12.584 -0.853 1.00 0.00 H new ATOM 0 HD13 LEU A 70 2.189 12.794 0.404 1.00 0.00 H new ATOM 0 HD21 LEU A 70 2.691 15.806 0.812 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.507 14.644 2.147 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.961 15.666 2.051 1.00 0.00 H new ATOM 1012 N GLU A 71 6.466 10.837 2.720 1.00 0.00 N ATOM 1013 CA GLU A 71 7.572 10.413 3.571 1.00 0.00 C ATOM 1014 C GLU A 71 7.183 9.194 4.402 1.00 0.00 C ATOM 1015 O GLU A 71 6.028 9.045 4.802 1.00 0.00 O ATOM 1016 CB GLU A 71 8.004 11.556 4.492 1.00 0.00 C ATOM 1017 CG GLU A 71 8.145 12.891 3.780 1.00 0.00 C ATOM 1018 CD GLU A 71 8.517 14.019 4.723 1.00 0.00 C ATOM 1019 OE1 GLU A 71 8.880 13.727 5.882 1.00 0.00 O ATOM 1020 OE2 GLU A 71 8.446 15.192 4.303 1.00 0.00 O ATOM 0 H GLU A 71 5.548 10.519 3.032 1.00 0.00 H new ATOM 0 HA GLU A 71 8.408 10.140 2.927 1.00 0.00 H new ATOM 0 HB2 GLU A 71 7.276 11.658 5.297 1.00 0.00 H new ATOM 0 HB3 GLU A 71 8.957 11.298 4.955 1.00 0.00 H new ATOM 0 HG2 GLU A 71 8.905 12.806 3.004 1.00 0.00 H new ATOM 0 HG3 GLU A 71 7.206 13.134 3.282 1.00 0.00 H new ATOM 1027 N VAL A 72 8.155 8.325 4.659 1.00 0.00 N ATOM 1028 CA VAL A 72 7.916 7.120 5.444 1.00 0.00 C ATOM 1029 C VAL A 72 8.775 7.104 6.703 1.00 0.00 C ATOM 1030 O VAL A 72 9.989 6.915 6.636 1.00 0.00 O ATOM 1031 CB VAL A 72 8.205 5.849 4.622 1.00 0.00 C ATOM 1032 CG1 VAL A 72 8.098 4.611 5.499 1.00 0.00 C ATOM 1033 CG2 VAL A 72 7.257 5.756 3.436 1.00 0.00 C ATOM 0 H VAL A 72 9.116 8.433 4.335 1.00 0.00 H new ATOM 0 HA VAL A 72 6.863 7.130 5.727 1.00 0.00 H new ATOM 0 HB VAL A 72 9.224 5.907 4.240 1.00 0.00 H new ATOM 0 HG11 VAL A 72 8.305 3.723 4.902 1.00 0.00 H new ATOM 0 HG12 VAL A 72 8.820 4.678 6.313 1.00 0.00 H new ATOM 0 HG13 VAL A 72 7.092 4.544 5.912 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.475 4.853 2.866 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.228 5.720 3.794 1.00 0.00 H new ATOM 0 HG23 VAL A 72 7.388 6.629 2.796 1.00 0.00 H new ATOM 1043 N ASN A 73 8.136 7.303 7.851 1.00 0.00 N ATOM 1044 CA ASN A 73 8.842 7.311 9.127 1.00 0.00 C ATOM 1045 C ASN A 73 9.804 8.492 9.209 1.00 0.00 C ATOM 1046 O ASN A 73 10.928 8.356 9.691 1.00 0.00 O ATOM 1047 CB ASN A 73 9.607 6.000 9.319 1.00 0.00 C ATOM 1048 CG ASN A 73 8.822 4.985 10.127 1.00 0.00 C ATOM 1049 OD1 ASN A 73 7.944 5.345 10.912 1.00 0.00 O ATOM 1050 ND2 ASN A 73 9.137 3.709 9.939 1.00 0.00 N ATOM 0 H ASN A 73 7.131 7.461 7.924 1.00 0.00 H new ATOM 0 HA ASN A 73 8.103 7.412 9.922 1.00 0.00 H new ATOM 0 HB2 ASN A 73 9.847 5.577 8.344 1.00 0.00 H new ATOM 0 HB3 ASN A 73 10.553 6.205 9.819 1.00 0.00 H new ATOM 0 HD21 ASN A 73 8.644 2.981 10.456 1.00 0.00 H new ATOM 0 HD22 ASN A 73 9.872 3.457 9.278 1.00 0.00 H new ATOM 1057 N GLN A 74 9.354 9.649 8.734 1.00 0.00 N ATOM 1058 CA GLN A 74 10.176 10.854 8.754 1.00 0.00 C ATOM 1059 C GLN A 74 11.406 10.687 7.868 1.00 0.00 C ATOM 1060 O GLN A 74 12.477 11.210 8.174 1.00 0.00 O ATOM 1061 CB GLN A 74 10.604 11.182 10.185 1.00 0.00 C ATOM 1062 CG GLN A 74 9.455 11.623 11.077 1.00 0.00 C ATOM 1063 CD GLN A 74 9.705 11.323 12.542 1.00 0.00 C ATOM 1064 OE1 GLN A 74 10.512 11.986 13.195 1.00 0.00 O ATOM 1065 NE2 GLN A 74 9.013 10.319 13.068 1.00 0.00 N ATOM 0 H GLN A 74 8.426 9.778 8.331 1.00 0.00 H new ATOM 0 HA GLN A 74 9.578 11.678 8.364 1.00 0.00 H new ATOM 0 HB2 GLN A 74 11.078 10.304 10.624 1.00 0.00 H new ATOM 0 HB3 GLN A 74 11.356 11.970 10.159 1.00 0.00 H new ATOM 0 HG2 GLN A 74 9.293 12.694 10.952 1.00 0.00 H new ATOM 0 HG3 GLN A 74 8.540 11.123 10.759 1.00 0.00 H new ATOM 0 HE21 GLN A 74 8.355 9.796 12.491 1.00 0.00 H new ATOM 0 HE22 GLN A 74 9.140 10.071 14.049 1.00 0.00 H new ATOM 1074 N GLN A 75 11.244 9.956 6.770 1.00 0.00 N ATOM 1075 CA GLN A 75 12.343 9.721 5.841 1.00 0.00 C ATOM 1076 C GLN A 75 11.932 10.065 4.413 1.00 0.00 C ATOM 1077 O GLN A 75 11.407 9.220 3.687 1.00 0.00 O ATOM 1078 CB GLN A 75 12.799 8.263 5.916 1.00 0.00 C ATOM 1079 CG GLN A 75 13.208 7.825 7.313 1.00 0.00 C ATOM 1080 CD GLN A 75 14.242 6.716 7.297 1.00 0.00 C ATOM 1081 OE1 GLN A 75 14.866 6.448 6.270 1.00 0.00 O ATOM 1082 NE2 GLN A 75 14.430 6.065 8.439 1.00 0.00 N ATOM 0 H GLN A 75 10.363 9.517 6.502 1.00 0.00 H new ATOM 0 HA GLN A 75 13.172 10.369 6.127 1.00 0.00 H new ATOM 0 HB2 GLN A 75 11.992 7.620 5.564 1.00 0.00 H new ATOM 0 HB3 GLN A 75 13.640 8.119 5.238 1.00 0.00 H new ATOM 0 HG2 GLN A 75 13.608 8.682 7.856 1.00 0.00 H new ATOM 0 HG3 GLN A 75 12.326 7.486 7.856 1.00 0.00 H new ATOM 0 HE21 GLN A 75 13.891 6.320 9.266 1.00 0.00 H new ATOM 0 HE22 GLN A 75 15.114 5.310 8.489 1.00 0.00 H new ATOM 1091 N SER A 76 12.173 11.310 4.016 1.00 0.00 N ATOM 1092 CA SER A 76 11.824 11.767 2.676 1.00 0.00 C ATOM 1093 C SER A 76 12.300 10.772 1.622 1.00 0.00 C ATOM 1094 O SER A 76 13.485 10.441 1.554 1.00 0.00 O ATOM 1095 CB SER A 76 12.435 13.143 2.408 1.00 0.00 C ATOM 1096 OG SER A 76 11.784 13.788 1.327 1.00 0.00 O ATOM 0 H SER A 76 12.609 12.021 4.604 1.00 0.00 H new ATOM 0 HA SER A 76 10.738 11.842 2.616 1.00 0.00 H new ATOM 0 HB2 SER A 76 12.357 13.760 3.304 1.00 0.00 H new ATOM 0 HB3 SER A 76 13.497 13.036 2.186 1.00 0.00 H new ATOM 0 HG SER A 76 12.192 14.666 1.177 1.00 0.00 H new ATOM 1102 N LEU A 77 11.369 10.299 0.800 1.00 0.00 N ATOM 1103 CA LEU A 77 11.693 9.342 -0.252 1.00 0.00 C ATOM 1104 C LEU A 77 12.303 10.045 -1.460 1.00 0.00 C ATOM 1105 O LEU A 77 12.479 9.443 -2.519 1.00 0.00 O ATOM 1106 CB LEU A 77 10.438 8.575 -0.674 1.00 0.00 C ATOM 1107 CG LEU A 77 9.489 8.168 0.453 1.00 0.00 C ATOM 1108 CD1 LEU A 77 8.223 7.544 -0.114 1.00 0.00 C ATOM 1109 CD2 LEU A 77 10.178 7.205 1.409 1.00 0.00 C ATOM 0 H LEU A 77 10.385 10.563 0.842 1.00 0.00 H new ATOM 0 HA LEU A 77 12.426 8.639 0.144 1.00 0.00 H new ATOM 0 HB2 LEU A 77 9.884 9.188 -1.385 1.00 0.00 H new ATOM 0 HB3 LEU A 77 10.748 7.674 -1.204 1.00 0.00 H new ATOM 0 HG LEU A 77 9.211 9.064 1.009 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.560 7.261 0.703 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.719 8.265 -0.757 1.00 0.00 H new ATOM 0 HD13 LEU A 77 8.482 6.659 -0.695 1.00 0.00 H new ATOM 0 HD21 LEU A 77 9.487 6.926 2.205 1.00 0.00 H new ATOM 0 HD22 LEU A 77 10.486 6.311 0.866 1.00 0.00 H new ATOM 0 HD23 LEU A 77 11.055 7.687 1.842 1.00 0.00 H new ATOM 1121 N LEU A 78 12.626 11.323 -1.292 1.00 0.00 N ATOM 1122 CA LEU A 78 13.220 12.109 -2.368 1.00 0.00 C ATOM 1123 C LEU A 78 14.714 11.827 -2.488 1.00 0.00 C ATOM 1124 O LEU A 78 15.466 11.988 -1.528 1.00 0.00 O ATOM 1125 CB LEU A 78 12.989 13.601 -2.123 1.00 0.00 C ATOM 1126 CG LEU A 78 12.934 14.486 -3.369 1.00 0.00 C ATOM 1127 CD1 LEU A 78 14.155 14.252 -4.244 1.00 0.00 C ATOM 1128 CD2 LEU A 78 11.656 14.224 -4.152 1.00 0.00 C ATOM 0 H LEU A 78 12.487 11.836 -0.422 1.00 0.00 H new ATOM 0 HA LEU A 78 12.739 11.822 -3.303 1.00 0.00 H new ATOM 0 HB2 LEU A 78 12.053 13.718 -1.577 1.00 0.00 H new ATOM 0 HB3 LEU A 78 13.784 13.970 -1.475 1.00 0.00 H new ATOM 0 HG LEU A 78 12.935 15.529 -3.052 1.00 0.00 H new ATOM 0 HD11 LEU A 78 14.098 14.890 -5.126 1.00 0.00 H new ATOM 0 HD12 LEU A 78 15.057 14.490 -3.681 1.00 0.00 H new ATOM 0 HD13 LEU A 78 14.186 13.207 -4.554 1.00 0.00 H new ATOM 0 HD21 LEU A 78 11.633 14.862 -5.035 1.00 0.00 H new ATOM 0 HD22 LEU A 78 11.625 13.178 -4.459 1.00 0.00 H new ATOM 0 HD23 LEU A 78 10.793 14.443 -3.524 1.00 0.00 H new ATOM 1140 N GLY A 79 15.138 11.407 -3.676 1.00 0.00 N ATOM 1141 CA GLY A 79 16.541 11.111 -3.901 1.00 0.00 C ATOM 1142 C GLY A 79 16.804 9.625 -4.045 1.00 0.00 C ATOM 1143 O GLY A 79 17.661 9.211 -4.827 1.00 0.00 O ATOM 0 H GLY A 79 14.535 11.266 -4.487 1.00 0.00 H new ATOM 0 HA2 GLY A 79 16.878 11.625 -4.801 1.00 0.00 H new ATOM 0 HA3 GLY A 79 17.129 11.502 -3.071 1.00 0.00 H new ATOM 1147 N LEU A 80 16.068 8.820 -3.287 1.00 0.00 N ATOM 1148 CA LEU A 80 16.227 7.370 -3.332 1.00 0.00 C ATOM 1149 C LEU A 80 15.465 6.775 -4.512 1.00 0.00 C ATOM 1150 O LEU A 80 14.629 7.440 -5.125 1.00 0.00 O ATOM 1151 CB LEU A 80 15.737 6.743 -2.025 1.00 0.00 C ATOM 1152 CG LEU A 80 14.506 7.390 -1.390 1.00 0.00 C ATOM 1153 CD1 LEU A 80 13.726 6.369 -0.577 1.00 0.00 C ATOM 1154 CD2 LEU A 80 14.913 8.570 -0.520 1.00 0.00 C ATOM 0 H LEU A 80 15.355 9.146 -2.634 1.00 0.00 H new ATOM 0 HA LEU A 80 17.287 7.149 -3.459 1.00 0.00 H new ATOM 0 HB2 LEU A 80 15.515 5.692 -2.210 1.00 0.00 H new ATOM 0 HB3 LEU A 80 16.552 6.774 -1.302 1.00 0.00 H new ATOM 0 HG LEU A 80 13.860 7.758 -2.187 1.00 0.00 H new ATOM 0 HD11 LEU A 80 12.853 6.848 -0.133 1.00 0.00 H new ATOM 0 HD12 LEU A 80 13.402 5.556 -1.227 1.00 0.00 H new ATOM 0 HD13 LEU A 80 14.362 5.970 0.213 1.00 0.00 H new ATOM 0 HD21 LEU A 80 14.024 9.018 -0.076 1.00 0.00 H new ATOM 0 HD22 LEU A 80 15.580 8.226 0.271 1.00 0.00 H new ATOM 0 HD23 LEU A 80 15.427 9.312 -1.131 1.00 0.00 H new ATOM 1166 N THR A 81 15.758 5.516 -4.824 1.00 0.00 N ATOM 1167 CA THR A 81 15.100 4.830 -5.930 1.00 0.00 C ATOM 1168 C THR A 81 14.006 3.897 -5.424 1.00 0.00 C ATOM 1169 O THR A 81 14.012 3.488 -4.263 1.00 0.00 O ATOM 1170 CB THR A 81 16.107 4.017 -6.765 1.00 0.00 C ATOM 1171 OG1 THR A 81 16.782 3.069 -5.932 1.00 0.00 O ATOM 1172 CG2 THR A 81 17.126 4.934 -7.427 1.00 0.00 C ATOM 0 H THR A 81 16.446 4.951 -4.327 1.00 0.00 H new ATOM 0 HA THR A 81 14.655 5.600 -6.560 1.00 0.00 H new ATOM 0 HB THR A 81 15.557 3.489 -7.544 1.00 0.00 H new ATOM 0 HG1 THR A 81 17.419 2.555 -6.471 1.00 0.00 H new ATOM 0 HG21 THR A 81 17.827 4.338 -8.011 1.00 0.00 H new ATOM 0 HG22 THR A 81 16.612 5.636 -8.083 1.00 0.00 H new ATOM 0 HG23 THR A 81 17.670 5.486 -6.661 1.00 0.00 H new ATOM 1180 N HIS A 82 13.068 3.562 -6.304 1.00 0.00 N ATOM 1181 CA HIS A 82 11.966 2.675 -5.947 1.00 0.00 C ATOM 1182 C HIS A 82 12.419 1.629 -4.932 1.00 0.00 C ATOM 1183 O HIS A 82 11.804 1.465 -3.879 1.00 0.00 O ATOM 1184 CB HIS A 82 11.413 1.985 -7.195 1.00 0.00 C ATOM 1185 CG HIS A 82 9.995 1.528 -7.047 1.00 0.00 C ATOM 1186 ND1 HIS A 82 9.580 0.251 -7.360 1.00 0.00 N ATOM 1187 CD2 HIS A 82 8.893 2.185 -6.616 1.00 0.00 C ATOM 1188 CE1 HIS A 82 8.284 0.142 -7.129 1.00 0.00 C ATOM 1189 NE2 HIS A 82 7.843 1.302 -6.676 1.00 0.00 N ATOM 0 H HIS A 82 13.049 3.891 -7.269 1.00 0.00 H new ATOM 0 HA HIS A 82 11.178 3.278 -5.496 1.00 0.00 H new ATOM 0 HB2 HIS A 82 11.479 2.672 -8.039 1.00 0.00 H new ATOM 0 HB3 HIS A 82 12.040 1.126 -7.433 1.00 0.00 H new ATOM 0 HD1 HIS A 82 10.180 -0.494 -7.715 1.00 0.00 H new ATOM 0 HD2 HIS A 82 8.848 3.212 -6.286 1.00 0.00 H new ATOM 0 HE1 HIS A 82 7.687 -0.744 -7.284 1.00 0.00 H new ATOM 1198 N GLY A 83 13.498 0.923 -5.258 1.00 0.00 N ATOM 1199 CA GLY A 83 14.013 -0.099 -4.365 1.00 0.00 C ATOM 1200 C GLY A 83 14.337 0.445 -2.987 1.00 0.00 C ATOM 1201 O GLY A 83 13.984 -0.161 -1.976 1.00 0.00 O ATOM 0 H GLY A 83 14.024 1.041 -6.124 1.00 0.00 H new ATOM 0 HA2 GLY A 83 13.279 -0.900 -4.273 1.00 0.00 H new ATOM 0 HA3 GLY A 83 14.911 -0.538 -4.799 1.00 0.00 H new ATOM 1205 N GLU A 84 15.011 1.590 -2.948 1.00 0.00 N ATOM 1206 CA GLU A 84 15.384 2.213 -1.684 1.00 0.00 C ATOM 1207 C GLU A 84 14.146 2.627 -0.895 1.00 0.00 C ATOM 1208 O GLU A 84 14.045 2.370 0.304 1.00 0.00 O ATOM 1209 CB GLU A 84 16.275 3.432 -1.933 1.00 0.00 C ATOM 1210 CG GLU A 84 17.755 3.098 -2.014 1.00 0.00 C ATOM 1211 CD GLU A 84 18.418 3.053 -0.651 1.00 0.00 C ATOM 1212 OE1 GLU A 84 18.515 4.115 -0.002 1.00 0.00 O ATOM 1213 OE2 GLU A 84 18.839 1.954 -0.232 1.00 0.00 O ATOM 0 H GLU A 84 15.310 2.104 -3.777 1.00 0.00 H new ATOM 0 HA GLU A 84 15.939 1.480 -1.098 1.00 0.00 H new ATOM 0 HB2 GLU A 84 15.968 3.912 -2.862 1.00 0.00 H new ATOM 0 HB3 GLU A 84 16.118 4.156 -1.133 1.00 0.00 H new ATOM 0 HG2 GLU A 84 17.880 2.134 -2.507 1.00 0.00 H new ATOM 0 HG3 GLU A 84 18.258 3.840 -2.634 1.00 0.00 H new ATOM 1220 N ALA A 85 13.205 3.271 -1.578 1.00 0.00 N ATOM 1221 CA ALA A 85 11.972 3.720 -0.942 1.00 0.00 C ATOM 1222 C ALA A 85 11.210 2.548 -0.333 1.00 0.00 C ATOM 1223 O ALA A 85 10.772 2.609 0.816 1.00 0.00 O ATOM 1224 CB ALA A 85 11.098 4.456 -1.947 1.00 0.00 C ATOM 0 H ALA A 85 13.273 3.493 -2.571 1.00 0.00 H new ATOM 0 HA ALA A 85 12.236 4.405 -0.136 1.00 0.00 H new ATOM 0 HB1 ALA A 85 10.181 4.786 -1.459 1.00 0.00 H new ATOM 0 HB2 ALA A 85 11.636 5.322 -2.331 1.00 0.00 H new ATOM 0 HB3 ALA A 85 10.850 3.788 -2.772 1.00 0.00 H new ATOM 1230 N VAL A 86 11.053 1.482 -1.111 1.00 0.00 N ATOM 1231 CA VAL A 86 10.344 0.295 -0.648 1.00 0.00 C ATOM 1232 C VAL A 86 10.942 -0.230 0.652 1.00 0.00 C ATOM 1233 O VAL A 86 10.276 -0.254 1.687 1.00 0.00 O ATOM 1234 CB VAL A 86 10.375 -0.826 -1.704 1.00 0.00 C ATOM 1235 CG1 VAL A 86 9.811 -2.116 -1.131 1.00 0.00 C ATOM 1236 CG2 VAL A 86 9.609 -0.406 -2.949 1.00 0.00 C ATOM 0 H VAL A 86 11.407 1.416 -2.065 1.00 0.00 H new ATOM 0 HA VAL A 86 9.310 0.592 -0.475 1.00 0.00 H new ATOM 0 HB VAL A 86 11.412 -1.006 -1.987 1.00 0.00 H new ATOM 0 HG11 VAL A 86 9.841 -2.896 -1.892 1.00 0.00 H new ATOM 0 HG12 VAL A 86 10.407 -2.424 -0.272 1.00 0.00 H new ATOM 0 HG13 VAL A 86 8.780 -1.955 -0.818 1.00 0.00 H new ATOM 0 HG21 VAL A 86 9.641 -1.210 -3.684 1.00 0.00 H new ATOM 0 HG22 VAL A 86 8.572 -0.197 -2.685 1.00 0.00 H new ATOM 0 HG23 VAL A 86 10.064 0.490 -3.371 1.00 0.00 H new ATOM 1246 N GLN A 87 12.202 -0.649 0.591 1.00 0.00 N ATOM 1247 CA GLN A 87 12.889 -1.175 1.765 1.00 0.00 C ATOM 1248 C GLN A 87 12.686 -0.261 2.969 1.00 0.00 C ATOM 1249 O GLN A 87 12.738 -0.708 4.116 1.00 0.00 O ATOM 1250 CB GLN A 87 14.383 -1.335 1.478 1.00 0.00 C ATOM 1251 CG GLN A 87 14.683 -2.266 0.314 1.00 0.00 C ATOM 1252 CD GLN A 87 14.070 -3.641 0.495 1.00 0.00 C ATOM 1253 OE1 GLN A 87 14.757 -4.597 0.857 1.00 0.00 O ATOM 1254 NE2 GLN A 87 12.771 -3.748 0.244 1.00 0.00 N ATOM 0 H GLN A 87 12.767 -0.635 -0.258 1.00 0.00 H new ATOM 0 HA GLN A 87 12.464 -2.151 1.997 1.00 0.00 H new ATOM 0 HB2 GLN A 87 14.811 -0.355 1.268 1.00 0.00 H new ATOM 0 HB3 GLN A 87 14.878 -1.714 2.372 1.00 0.00 H new ATOM 0 HG2 GLN A 87 14.306 -1.823 -0.608 1.00 0.00 H new ATOM 0 HG3 GLN A 87 15.763 -2.365 0.202 1.00 0.00 H new ATOM 0 HE21 GLN A 87 12.240 -2.930 -0.054 1.00 0.00 H new ATOM 0 HE22 GLN A 87 12.304 -4.649 0.349 1.00 0.00 H new ATOM 1263 N LEU A 88 12.454 1.019 2.701 1.00 0.00 N ATOM 1264 CA LEU A 88 12.242 1.996 3.764 1.00 0.00 C ATOM 1265 C LEU A 88 10.877 1.806 4.415 1.00 0.00 C ATOM 1266 O LEU A 88 10.714 2.025 5.617 1.00 0.00 O ATOM 1267 CB LEU A 88 12.361 3.417 3.208 1.00 0.00 C ATOM 1268 CG LEU A 88 12.846 4.484 4.190 1.00 0.00 C ATOM 1269 CD1 LEU A 88 13.158 5.780 3.459 1.00 0.00 C ATOM 1270 CD2 LEU A 88 11.807 4.718 5.278 1.00 0.00 C ATOM 0 H LEU A 88 12.408 1.405 1.758 1.00 0.00 H new ATOM 0 HA LEU A 88 13.010 1.843 4.523 1.00 0.00 H new ATOM 0 HB2 LEU A 88 13.043 3.397 2.358 1.00 0.00 H new ATOM 0 HB3 LEU A 88 11.386 3.719 2.827 1.00 0.00 H new ATOM 0 HG LEU A 88 13.762 4.128 4.661 1.00 0.00 H new ATOM 0 HD11 LEU A 88 13.502 6.527 4.174 1.00 0.00 H new ATOM 0 HD12 LEU A 88 13.937 5.601 2.718 1.00 0.00 H new ATOM 0 HD13 LEU A 88 12.259 6.142 2.960 1.00 0.00 H new ATOM 0 HD21 LEU A 88 12.168 5.480 5.968 1.00 0.00 H new ATOM 0 HD22 LEU A 88 10.874 5.052 4.824 1.00 0.00 H new ATOM 0 HD23 LEU A 88 11.634 3.789 5.821 1.00 0.00 H new ATOM 1282 N LEU A 89 9.898 1.395 3.617 1.00 0.00 N ATOM 1283 CA LEU A 89 8.546 1.172 4.116 1.00 0.00 C ATOM 1284 C LEU A 89 8.470 -0.118 4.927 1.00 0.00 C ATOM 1285 O LEU A 89 7.714 -0.211 5.894 1.00 0.00 O ATOM 1286 CB LEU A 89 7.554 1.114 2.952 1.00 0.00 C ATOM 1287 CG LEU A 89 7.306 -0.269 2.350 1.00 0.00 C ATOM 1288 CD1 LEU A 89 6.330 -1.058 3.208 1.00 0.00 C ATOM 1289 CD2 LEU A 89 6.786 -0.145 0.925 1.00 0.00 C ATOM 0 H LEU A 89 10.015 1.209 2.621 1.00 0.00 H new ATOM 0 HA LEU A 89 8.285 2.006 4.768 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.600 1.516 3.293 1.00 0.00 H new ATOM 0 HB3 LEU A 89 7.913 1.773 2.162 1.00 0.00 H new ATOM 0 HG LEU A 89 8.253 -0.808 2.325 1.00 0.00 H new ATOM 0 HD11 LEU A 89 6.166 -2.040 2.763 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.741 -1.178 4.210 1.00 0.00 H new ATOM 0 HD13 LEU A 89 5.382 -0.523 3.266 1.00 0.00 H new ATOM 0 HD21 LEU A 89 6.615 -1.139 0.512 1.00 0.00 H new ATOM 0 HD22 LEU A 89 5.850 0.413 0.927 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.520 0.380 0.314 1.00 0.00 H new ATOM 1301 N ARG A 90 9.261 -1.109 4.528 1.00 0.00 N ATOM 1302 CA ARG A 90 9.284 -2.393 5.218 1.00 0.00 C ATOM 1303 C ARG A 90 10.354 -2.405 6.307 1.00 0.00 C ATOM 1304 O ARG A 90 10.654 -3.450 6.884 1.00 0.00 O ATOM 1305 CB ARG A 90 9.540 -3.527 4.224 1.00 0.00 C ATOM 1306 CG ARG A 90 10.867 -3.407 3.492 1.00 0.00 C ATOM 1307 CD ARG A 90 11.424 -4.772 3.121 1.00 0.00 C ATOM 1308 NE ARG A 90 12.884 -4.786 3.120 1.00 0.00 N ATOM 1309 CZ ARG A 90 13.621 -4.750 4.225 1.00 0.00 C ATOM 1310 NH1 ARG A 90 13.036 -4.699 5.414 1.00 0.00 N ATOM 1311 NH2 ARG A 90 14.945 -4.766 4.142 1.00 0.00 N ATOM 0 H ARG A 90 9.894 -1.047 3.731 1.00 0.00 H new ATOM 0 HA ARG A 90 8.311 -2.543 5.686 1.00 0.00 H new ATOM 0 HB2 ARG A 90 9.513 -4.478 4.756 1.00 0.00 H new ATOM 0 HB3 ARG A 90 8.732 -3.547 3.493 1.00 0.00 H new ATOM 0 HG2 ARG A 90 10.733 -2.810 2.590 1.00 0.00 H new ATOM 0 HG3 ARG A 90 11.584 -2.879 4.121 1.00 0.00 H new ATOM 0 HD2 ARG A 90 11.055 -5.518 3.825 1.00 0.00 H new ATOM 0 HD3 ARG A 90 11.058 -5.057 2.134 1.00 0.00 H new ATOM 0 HE ARG A 90 13.365 -4.826 2.221 1.00 0.00 H new ATOM 0 HH11 ARG A 90 12.018 -4.687 5.482 1.00 0.00 H new ATOM 0 HH12 ARG A 90 13.604 -4.671 6.261 1.00 0.00 H new ATOM 0 HH21 ARG A 90 15.398 -4.806 3.229 1.00 0.00 H new ATOM 0 HH22 ARG A 90 15.510 -4.738 4.991 1.00 0.00 H new ATOM 1325 N SER A 91 10.926 -1.237 6.581 1.00 0.00 N ATOM 1326 CA SER A 91 11.965 -1.114 7.596 1.00 0.00 C ATOM 1327 C SER A 91 11.385 -0.591 8.906 1.00 0.00 C ATOM 1328 O SER A 91 12.077 0.061 9.689 1.00 0.00 O ATOM 1329 CB SER A 91 13.076 -0.182 7.109 1.00 0.00 C ATOM 1330 OG SER A 91 14.134 -0.115 8.049 1.00 0.00 O ATOM 0 H SER A 91 10.687 -0.362 6.114 1.00 0.00 H new ATOM 0 HA SER A 91 12.384 -2.105 7.774 1.00 0.00 H new ATOM 0 HB2 SER A 91 13.458 -0.536 6.151 1.00 0.00 H new ATOM 0 HB3 SER A 91 12.671 0.816 6.941 1.00 0.00 H new ATOM 0 HG SER A 91 13.768 0.052 8.943 1.00 0.00 H new ATOM 1336 N VAL A 92 10.109 -0.881 9.139 1.00 0.00 N ATOM 1337 CA VAL A 92 9.434 -0.442 10.355 1.00 0.00 C ATOM 1338 C VAL A 92 9.441 -1.539 11.414 1.00 0.00 C ATOM 1339 O VAL A 92 9.742 -2.695 11.123 1.00 0.00 O ATOM 1340 CB VAL A 92 7.978 -0.028 10.070 1.00 0.00 C ATOM 1341 CG1 VAL A 92 7.362 0.634 11.293 1.00 0.00 C ATOM 1342 CG2 VAL A 92 7.914 0.897 8.864 1.00 0.00 C ATOM 0 H VAL A 92 9.521 -1.418 8.501 1.00 0.00 H new ATOM 0 HA VAL A 92 9.983 0.422 10.728 1.00 0.00 H new ATOM 0 HB VAL A 92 7.401 -0.925 9.843 1.00 0.00 H new ATOM 0 HG11 VAL A 92 6.333 0.920 11.073 1.00 0.00 H new ATOM 0 HG12 VAL A 92 7.373 -0.065 12.129 1.00 0.00 H new ATOM 0 HG13 VAL A 92 7.937 1.522 11.554 1.00 0.00 H new ATOM 0 HG21 VAL A 92 6.878 1.180 8.677 1.00 0.00 H new ATOM 0 HG22 VAL A 92 8.505 1.792 9.060 1.00 0.00 H new ATOM 0 HG23 VAL A 92 8.313 0.383 7.990 1.00 0.00 H new ATOM 1352 N GLY A 93 9.107 -1.166 12.646 1.00 0.00 N ATOM 1353 CA GLY A 93 9.080 -2.130 13.731 1.00 0.00 C ATOM 1354 C GLY A 93 7.672 -2.558 14.092 1.00 0.00 C ATOM 1355 O GLY A 93 7.301 -3.716 13.905 1.00 0.00 O ATOM 0 H GLY A 93 8.855 -0.214 12.912 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.662 -3.007 13.448 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.561 -1.698 14.608 1.00 0.00 H new ATOM 1359 N ASP A 94 6.886 -1.622 14.613 1.00 0.00 N ATOM 1360 CA ASP A 94 5.510 -1.908 15.002 1.00 0.00 C ATOM 1361 C ASP A 94 4.545 -0.924 14.350 1.00 0.00 C ATOM 1362 O ASP A 94 3.366 -1.226 14.160 1.00 0.00 O ATOM 1363 CB ASP A 94 5.366 -1.850 16.524 1.00 0.00 C ATOM 1364 CG ASP A 94 6.229 -0.771 17.147 1.00 0.00 C ATOM 1365 OD1 ASP A 94 7.399 -1.062 17.475 1.00 0.00 O ATOM 1366 OD2 ASP A 94 5.736 0.365 17.306 1.00 0.00 O ATOM 0 H ASP A 94 7.178 -0.658 14.776 1.00 0.00 H new ATOM 0 HA ASP A 94 5.263 -2.913 14.659 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.322 -1.669 16.781 1.00 0.00 H new ATOM 0 HB3 ASP A 94 5.636 -2.817 16.949 1.00 0.00 H new ATOM 1371 N THR A 95 5.052 0.256 14.008 1.00 0.00 N ATOM 1372 CA THR A 95 4.235 1.286 13.378 1.00 0.00 C ATOM 1373 C THR A 95 5.101 2.307 12.650 1.00 0.00 C ATOM 1374 O THR A 95 6.165 2.694 13.136 1.00 0.00 O ATOM 1375 CB THR A 95 3.358 2.018 14.412 1.00 0.00 C ATOM 1376 OG1 THR A 95 2.635 1.067 15.202 1.00 0.00 O ATOM 1377 CG2 THR A 95 2.383 2.961 13.725 1.00 0.00 C ATOM 0 H THR A 95 6.025 0.522 14.157 1.00 0.00 H new ATOM 0 HA THR A 95 3.591 0.781 12.658 1.00 0.00 H new ATOM 0 HB THR A 95 4.011 2.605 15.058 1.00 0.00 H new ATOM 0 HG1 THR A 95 2.560 0.223 14.710 1.00 0.00 H new ATOM 0 HG21 THR A 95 1.775 3.466 14.476 1.00 0.00 H new ATOM 0 HG22 THR A 95 2.938 3.702 13.149 1.00 0.00 H new ATOM 0 HG23 THR A 95 1.736 2.392 13.057 1.00 0.00 H new ATOM 1385 N LEU A 96 4.641 2.741 11.482 1.00 0.00 N ATOM 1386 CA LEU A 96 5.374 3.719 10.686 1.00 0.00 C ATOM 1387 C LEU A 96 4.576 5.011 10.540 1.00 0.00 C ATOM 1388 O LEU A 96 3.387 5.058 10.856 1.00 0.00 O ATOM 1389 CB LEU A 96 5.693 3.145 9.304 1.00 0.00 C ATOM 1390 CG LEU A 96 4.675 3.441 8.203 1.00 0.00 C ATOM 1391 CD1 LEU A 96 5.257 3.114 6.836 1.00 0.00 C ATOM 1392 CD2 LEU A 96 3.391 2.659 8.439 1.00 0.00 C ATOM 0 H LEU A 96 3.763 2.431 11.065 1.00 0.00 H new ATOM 0 HA LEU A 96 6.306 3.946 11.203 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.662 3.530 8.988 1.00 0.00 H new ATOM 0 HB3 LEU A 96 5.794 2.064 9.396 1.00 0.00 H new ATOM 0 HG LEU A 96 4.439 4.505 8.230 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.518 3.331 6.065 1.00 0.00 H new ATOM 0 HD12 LEU A 96 6.148 3.719 6.666 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.523 2.058 6.797 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.678 2.882 7.645 1.00 0.00 H new ATOM 0 HD22 LEU A 96 3.610 1.591 8.440 1.00 0.00 H new ATOM 0 HD23 LEU A 96 2.964 2.943 9.401 1.00 0.00 H new ATOM 1404 N THR A 97 5.238 6.058 10.058 1.00 0.00 N ATOM 1405 CA THR A 97 4.592 7.350 9.869 1.00 0.00 C ATOM 1406 C THR A 97 4.617 7.769 8.403 1.00 0.00 C ATOM 1407 O THR A 97 5.604 8.326 7.923 1.00 0.00 O ATOM 1408 CB THR A 97 5.267 8.446 10.716 1.00 0.00 C ATOM 1409 OG1 THR A 97 5.614 7.925 12.003 1.00 0.00 O ATOM 1410 CG2 THR A 97 4.348 9.647 10.879 1.00 0.00 C ATOM 0 H THR A 97 6.222 6.036 9.791 1.00 0.00 H new ATOM 0 HA THR A 97 3.558 7.236 10.194 1.00 0.00 H new ATOM 0 HB THR A 97 6.171 8.769 10.200 1.00 0.00 H new ATOM 0 HG1 THR A 97 6.044 8.627 12.535 1.00 0.00 H new ATOM 0 HG21 THR A 97 4.846 10.407 11.480 1.00 0.00 H new ATOM 0 HG22 THR A 97 4.110 10.059 9.898 1.00 0.00 H new ATOM 0 HG23 THR A 97 3.428 9.337 11.375 1.00 0.00 H new ATOM 1418 N VAL A 98 3.524 7.497 7.696 1.00 0.00 N ATOM 1419 CA VAL A 98 3.420 7.847 6.285 1.00 0.00 C ATOM 1420 C VAL A 98 2.705 9.181 6.101 1.00 0.00 C ATOM 1421 O VAL A 98 1.612 9.390 6.630 1.00 0.00 O ATOM 1422 CB VAL A 98 2.671 6.761 5.491 1.00 0.00 C ATOM 1423 CG1 VAL A 98 3.199 5.379 5.846 1.00 0.00 C ATOM 1424 CG2 VAL A 98 1.174 6.851 5.747 1.00 0.00 C ATOM 0 H VAL A 98 2.699 7.035 8.078 1.00 0.00 H new ATOM 0 HA VAL A 98 4.438 7.928 5.903 1.00 0.00 H new ATOM 0 HB VAL A 98 2.845 6.928 4.428 1.00 0.00 H new ATOM 0 HG11 VAL A 98 2.657 4.625 5.275 1.00 0.00 H new ATOM 0 HG12 VAL A 98 4.261 5.323 5.606 1.00 0.00 H new ATOM 0 HG13 VAL A 98 3.058 5.198 6.912 1.00 0.00 H new ATOM 0 HG21 VAL A 98 0.660 6.076 5.178 1.00 0.00 H new ATOM 0 HG22 VAL A 98 0.978 6.711 6.810 1.00 0.00 H new ATOM 0 HG23 VAL A 98 0.810 7.830 5.437 1.00 0.00 H new ATOM 1434 N LEU A 99 3.326 10.080 5.346 1.00 0.00 N ATOM 1435 CA LEU A 99 2.748 11.395 5.091 1.00 0.00 C ATOM 1436 C LEU A 99 1.936 11.391 3.800 1.00 0.00 C ATOM 1437 O LEU A 99 1.924 12.374 3.058 1.00 0.00 O ATOM 1438 CB LEU A 99 3.852 12.451 5.009 1.00 0.00 C ATOM 1439 CG LEU A 99 3.385 13.907 4.972 1.00 0.00 C ATOM 1440 CD1 LEU A 99 2.435 14.193 6.125 1.00 0.00 C ATOM 1441 CD2 LEU A 99 4.579 14.851 5.016 1.00 0.00 C ATOM 0 H LEU A 99 4.230 9.923 4.900 1.00 0.00 H new ATOM 0 HA LEU A 99 2.081 11.639 5.918 1.00 0.00 H new ATOM 0 HB2 LEU A 99 4.513 12.324 5.866 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.447 12.258 4.116 1.00 0.00 H new ATOM 0 HG LEU A 99 2.849 14.073 4.037 1.00 0.00 H new ATOM 0 HD11 LEU A 99 2.114 15.234 6.082 1.00 0.00 H new ATOM 0 HD12 LEU A 99 1.565 13.541 6.050 1.00 0.00 H new ATOM 0 HD13 LEU A 99 2.945 14.010 7.071 1.00 0.00 H new ATOM 0 HD21 LEU A 99 4.228 15.883 4.989 1.00 0.00 H new ATOM 0 HD22 LEU A 99 5.142 14.683 5.934 1.00 0.00 H new ATOM 0 HD23 LEU A 99 5.223 14.664 4.156 1.00 0.00 H new ATOM 1453 N VAL A 100 1.255 10.280 3.539 1.00 0.00 N ATOM 1454 CA VAL A 100 0.436 10.149 2.339 1.00 0.00 C ATOM 1455 C VAL A 100 -0.753 11.103 2.379 1.00 0.00 C ATOM 1456 O VAL A 100 -1.052 11.695 3.416 1.00 0.00 O ATOM 1457 CB VAL A 100 -0.081 8.708 2.167 1.00 0.00 C ATOM 1458 CG1 VAL A 100 1.061 7.712 2.298 1.00 0.00 C ATOM 1459 CG2 VAL A 100 -1.177 8.412 3.179 1.00 0.00 C ATOM 0 H VAL A 100 1.254 9.457 4.142 1.00 0.00 H new ATOM 0 HA VAL A 100 1.073 10.402 1.491 1.00 0.00 H new ATOM 0 HB VAL A 100 -0.505 8.609 1.168 1.00 0.00 H new ATOM 0 HG11 VAL A 100 0.677 6.700 2.174 1.00 0.00 H new ATOM 0 HG12 VAL A 100 1.809 7.913 1.531 1.00 0.00 H new ATOM 0 HG13 VAL A 100 1.517 7.809 3.283 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -1.531 7.390 3.044 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -0.782 8.528 4.188 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -2.005 9.105 3.032 1.00 0.00 H new ATOM 1469 N CYS A 101 -1.426 11.246 1.243 1.00 0.00 N ATOM 1470 CA CYS A 101 -2.583 12.129 1.147 1.00 0.00 C ATOM 1471 C CYS A 101 -3.370 11.858 -0.132 1.00 0.00 C ATOM 1472 O CYS A 101 -2.794 11.745 -1.214 1.00 0.00 O ATOM 1473 CB CYS A 101 -2.140 13.592 1.186 1.00 0.00 C ATOM 1474 SG CYS A 101 -1.055 14.072 -0.179 1.00 0.00 S ATOM 0 H CYS A 101 -1.191 10.762 0.376 1.00 0.00 H new ATOM 0 HA CYS A 101 -3.231 11.930 2.000 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -3.025 14.229 1.174 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -1.625 13.780 2.128 1.00 0.00 H new ATOM 0 HG CYS A 101 -1.339 13.361 -1.230 1.00 0.00 H new ATOM 1480 N ASP A 102 -4.687 11.753 0.001 1.00 0.00 N ATOM 1481 CA ASP A 102 -5.553 11.494 -1.143 1.00 0.00 C ATOM 1482 C ASP A 102 -5.013 12.173 -2.398 1.00 0.00 C ATOM 1483 O ASP A 102 -5.065 13.396 -2.526 1.00 0.00 O ATOM 1484 CB ASP A 102 -6.974 11.981 -0.855 1.00 0.00 C ATOM 1485 CG ASP A 102 -6.993 13.305 -0.116 1.00 0.00 C ATOM 1486 OD1 ASP A 102 -6.159 14.177 -0.438 1.00 0.00 O ATOM 1487 OD2 ASP A 102 -7.843 13.469 0.784 1.00 0.00 O ATOM 0 H ASP A 102 -5.179 11.843 0.890 1.00 0.00 H new ATOM 0 HA ASP A 102 -5.575 10.418 -1.315 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -7.517 12.085 -1.794 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -7.499 11.231 -0.264 1.00 0.00 H new ATOM 1492 N GLY A 103 -4.493 11.371 -3.322 1.00 0.00 N ATOM 1493 CA GLY A 103 -3.949 11.913 -4.554 1.00 0.00 C ATOM 1494 C GLY A 103 -4.902 11.762 -5.723 1.00 0.00 C ATOM 1495 O GLY A 103 -5.211 12.735 -6.410 1.00 0.00 O ATOM 0 H GLY A 103 -4.439 10.356 -3.240 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -3.717 12.969 -4.412 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -3.011 11.409 -4.786 1.00 0.00 H new ATOM 1499 N PHE A 104 -5.367 10.538 -5.952 1.00 0.00 N ATOM 1500 CA PHE A 104 -6.287 10.262 -7.048 1.00 0.00 C ATOM 1501 C PHE A 104 -6.801 8.827 -6.980 1.00 0.00 C ATOM 1502 O PHE A 104 -6.033 7.893 -6.747 1.00 0.00 O ATOM 1503 CB PHE A 104 -5.600 10.506 -8.393 1.00 0.00 C ATOM 1504 CG PHE A 104 -4.108 10.338 -8.343 1.00 0.00 C ATOM 1505 CD1 PHE A 104 -3.545 9.105 -8.055 1.00 0.00 C ATOM 1506 CD2 PHE A 104 -3.268 11.414 -8.583 1.00 0.00 C ATOM 1507 CE1 PHE A 104 -2.173 8.947 -8.009 1.00 0.00 C ATOM 1508 CE2 PHE A 104 -1.895 11.262 -8.538 1.00 0.00 C ATOM 1509 CZ PHE A 104 -1.347 10.028 -8.249 1.00 0.00 C ATOM 0 H PHE A 104 -5.121 9.721 -5.392 1.00 0.00 H new ATOM 0 HA PHE A 104 -7.137 10.938 -6.954 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -6.011 9.818 -9.132 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -5.833 11.515 -8.733 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -4.186 8.257 -7.864 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -3.691 12.382 -8.808 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -1.747 7.980 -7.786 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -1.251 12.108 -8.729 1.00 0.00 H new ATOM 0 HZ PHE A 104 -0.274 9.908 -8.211 1.00 0.00 H new ATOM 1519 N GLU A 105 -8.104 8.660 -7.183 1.00 0.00 N ATOM 1520 CA GLU A 105 -8.720 7.339 -7.143 1.00 0.00 C ATOM 1521 C GLU A 105 -8.890 6.775 -8.550 1.00 0.00 C ATOM 1522 O GLU A 105 -9.448 7.431 -9.430 1.00 0.00 O ATOM 1523 CB GLU A 105 -10.078 7.407 -6.441 1.00 0.00 C ATOM 1524 CG GLU A 105 -9.976 7.526 -4.929 1.00 0.00 C ATOM 1525 CD GLU A 105 -11.261 8.025 -4.296 1.00 0.00 C ATOM 1526 OE1 GLU A 105 -11.653 9.176 -4.579 1.00 0.00 O ATOM 1527 OE2 GLU A 105 -11.873 7.264 -3.518 1.00 0.00 O ATOM 0 H GLU A 105 -8.753 9.423 -7.377 1.00 0.00 H new ATOM 0 HA GLU A 105 -8.062 6.676 -6.582 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -10.635 8.260 -6.828 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.651 6.514 -6.689 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -9.722 6.553 -4.508 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.162 8.206 -4.676 1.00 0.00 H new ATOM 1534 N SER A 106 -8.404 5.555 -8.755 1.00 0.00 N ATOM 1535 CA SER A 106 -8.498 4.903 -10.056 1.00 0.00 C ATOM 1536 C SER A 106 -9.823 4.160 -10.198 1.00 0.00 C ATOM 1537 O SER A 106 -9.890 3.100 -10.817 1.00 0.00 O ATOM 1538 CB SER A 106 -7.332 3.931 -10.249 1.00 0.00 C ATOM 1539 OG SER A 106 -6.146 4.621 -10.605 1.00 0.00 O ATOM 0 H SER A 106 -7.941 4.998 -8.037 1.00 0.00 H new ATOM 0 HA SER A 106 -8.450 5.674 -10.825 1.00 0.00 H new ATOM 0 HB2 SER A 106 -7.167 3.369 -9.330 1.00 0.00 H new ATOM 0 HB3 SER A 106 -7.582 3.207 -11.025 1.00 0.00 H new ATOM 0 HG SER A 106 -5.416 3.978 -10.721 1.00 0.00 H new ATOM 1545 N GLY A 107 -10.876 4.726 -9.617 1.00 0.00 N ATOM 1546 CA GLY A 107 -12.186 4.105 -9.689 1.00 0.00 C ATOM 1547 C GLY A 107 -12.635 3.543 -8.354 1.00 0.00 C ATOM 1548 O GLY A 107 -11.861 3.459 -7.400 1.00 0.00 O ATOM 0 H GLY A 107 -10.846 5.603 -9.098 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -12.914 4.839 -10.034 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -12.165 3.304 -10.428 1.00 0.00 H new ATOM 1552 N PRO A 108 -13.915 3.149 -8.274 1.00 0.00 N ATOM 1553 CA PRO A 108 -14.495 2.587 -7.051 1.00 0.00 C ATOM 1554 C PRO A 108 -13.945 1.201 -6.732 1.00 0.00 C ATOM 1555 O PRO A 108 -13.548 0.459 -7.631 1.00 0.00 O ATOM 1556 CB PRO A 108 -15.990 2.510 -7.370 1.00 0.00 C ATOM 1557 CG PRO A 108 -16.055 2.418 -8.856 1.00 0.00 C ATOM 1558 CD PRO A 108 -14.893 3.221 -9.372 1.00 0.00 C ATOM 0 HA PRO A 108 -14.263 3.192 -6.175 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -16.451 1.642 -6.899 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -16.519 3.390 -7.004 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -15.990 1.381 -9.186 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -16.999 2.813 -9.230 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -14.493 2.801 -10.295 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -15.180 4.250 -9.588 1.00 0.00 H new ATOM 1566 N SER A 109 -13.927 0.857 -5.449 1.00 0.00 N ATOM 1567 CA SER A 109 -13.423 -0.440 -5.012 1.00 0.00 C ATOM 1568 C SER A 109 -14.446 -1.152 -4.133 1.00 0.00 C ATOM 1569 O SER A 109 -14.633 -0.800 -2.968 1.00 0.00 O ATOM 1570 CB SER A 109 -12.108 -0.269 -4.248 1.00 0.00 C ATOM 1571 OG SER A 109 -11.347 -1.464 -4.270 1.00 0.00 O ATOM 0 H SER A 109 -14.256 1.458 -4.693 1.00 0.00 H new ATOM 0 HA SER A 109 -13.244 -1.050 -5.898 1.00 0.00 H new ATOM 0 HB2 SER A 109 -11.530 0.542 -4.690 1.00 0.00 H new ATOM 0 HB3 SER A 109 -12.317 0.014 -3.216 1.00 0.00 H new ATOM 0 HG SER A 109 -10.511 -1.329 -3.777 1.00 0.00 H new ATOM 1577 N SER A 110 -15.107 -2.157 -4.700 1.00 0.00 N ATOM 1578 CA SER A 110 -16.115 -2.917 -3.971 1.00 0.00 C ATOM 1579 C SER A 110 -16.394 -4.249 -4.660 1.00 0.00 C ATOM 1580 O SER A 110 -16.168 -4.400 -5.860 1.00 0.00 O ATOM 1581 CB SER A 110 -17.409 -2.109 -3.854 1.00 0.00 C ATOM 1582 OG SER A 110 -17.996 -1.900 -5.126 1.00 0.00 O ATOM 0 H SER A 110 -14.962 -2.463 -5.662 1.00 0.00 H new ATOM 0 HA SER A 110 -15.730 -3.118 -2.971 1.00 0.00 H new ATOM 0 HB2 SER A 110 -18.112 -2.634 -3.207 1.00 0.00 H new ATOM 0 HB3 SER A 110 -17.200 -1.148 -3.384 1.00 0.00 H new ATOM 0 HG SER A 110 -18.822 -1.383 -5.024 1.00 0.00 H new ATOM 1588 N GLY A 111 -16.888 -5.215 -3.890 1.00 0.00 N ATOM 1589 CA GLY A 111 -17.190 -6.522 -4.443 1.00 0.00 C ATOM 1590 C GLY A 111 -17.708 -6.445 -5.865 1.00 0.00 C ATOM 1591 O GLY A 111 -18.843 -6.030 -6.098 1.00 0.00 O ATOM 0 H GLY A 111 -17.084 -5.115 -2.894 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -16.292 -7.139 -4.420 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -17.932 -7.016 -3.816 1.00 0.00 H new TER 1595 GLY A 111