USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 783 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 62 ASN : amide:sc= 0.496 K(o=1.1,f=-0.02) USER MOD Set 1.2: A 65 SER OG : rot 180:sc= 0.573 USER MOD Set 2.1: A 57 ASN : amide:sc= -4.04! C(o=-3.2!,f=-2.6!) USER MOD Set 2.2: A 102 THR OG1 : rot 50:sc= 0.798 USER MOD Set 3.1: A 42 ASN : amide:sc= 0.926 K(o=2.1,f=-0.84) USER MOD Set 3.2: A 48 SER OG : rot 123:sc= 1.2 USER MOD Set 4.1: A 36 ASN : amide:sc= -2.38! C(o=-1!,f=-7.3!) USER MOD Set 4.2: A 37 SER OG : rot 107:sc= 0.74 USER MOD Set 4.3: A 41 THR OG1 : rot 2:sc= 0.625 USER MOD Single : A 1 SER N :NH3+ -168:sc= -0.119 (180deg=-0.324) USER MOD Single : A 1 SER OG : rot -109:sc= 0.0951 USER MOD Single : A 5 SER OG : rot 180:sc= 0.00984 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 ASN : amide:sc= 1.09 K(o=1.1,f=-0.014) USER MOD Single : A 11 LYS NZ :NH3+ -146:sc= 0.229 (180deg=-0.29) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.0641 USER MOD Single : A 15 SER OG : rot -161:sc= 0.973 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 GLN : amide:sc= -0.393 X(o=-0.39,f=-0.39) USER MOD Single : A 25 THR OG1 : rot 54:sc= 0.534 USER MOD Single : A 26 THR OG1 : rot -61:sc= 0.115 USER MOD Single : A 28 ASN : amide:sc= 0.21 K(o=0.21,f=-4.5!) USER MOD Single : A 31 SER OG : rot 180:sc= -1.2 USER MOD Single : A 43 ASN : amide:sc= 1.17 K(o=1.2,f=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0.165 USER MOD Single : A 60 SER OG : rot 180:sc= -0.412 USER MOD Single : A 63 THR OG1 : rot 91:sc= 0.0421 USER MOD Single : A 69 LYS NZ :NH3+ -109:sc= 0.473 (180deg=-8.42!) USER MOD Single : A 71 SER OG : rot 180:sc= 0.137 USER MOD Single : A 75 GLN : amide:sc= -1.03 K(o=-1,f=0) USER MOD Single : A 84 HIS : no HE2:sc= -0.125 K(o=-0.12,f=-0.85) USER MOD Single : A 85 THR OG1 : rot 126:sc= -0.125 USER MOD Single : A 92 LYS NZ :NH3+ -138:sc= 0.605 (180deg=-2.39!) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -3.63! C(o=-3.6!,f=-4.9!) USER MOD Single : A 110 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0.00194 USER MOD Single : A 116 LYS NZ :NH3+ 159:sc= 1.32 (180deg=0.516!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 4.798 -10.810 -9.035 1.00 0.00 N ATOM 2 CA SER A 1 6.002 -10.379 -8.296 1.00 0.00 C ATOM 3 C SER A 1 7.205 -11.243 -8.668 1.00 0.00 C ATOM 4 O SER A 1 8.348 -10.831 -8.475 1.00 0.00 O ATOM 5 CB SER A 1 5.739 -10.450 -6.793 1.00 0.00 C ATOM 6 OG SER A 1 4.351 -10.315 -6.514 1.00 0.00 O ATOM 0 H1 SER A 1 4.050 -10.095 -8.927 1.00 0.00 H new ATOM 0 H2 SER A 1 5.030 -10.919 -10.043 1.00 0.00 H new ATOM 0 H3 SER A 1 4.465 -11.719 -8.656 1.00 0.00 H new ATOM 0 HA SER A 1 6.229 -9.349 -8.570 1.00 0.00 H new ATOM 0 HB2 SER A 1 6.102 -11.400 -6.401 1.00 0.00 H new ATOM 0 HB3 SER A 1 6.295 -9.662 -6.285 1.00 0.00 H new ATOM 0 HG SER A 1 4.185 -9.447 -6.090 1.00 0.00 H new ATOM 14 N LEU A 2 6.932 -12.446 -9.195 1.00 0.00 N ATOM 15 CA LEU A 2 7.971 -13.365 -9.669 1.00 0.00 C ATOM 16 C LEU A 2 8.854 -13.858 -8.520 1.00 0.00 C ATOM 17 O LEU A 2 9.869 -13.244 -8.188 1.00 0.00 O ATOM 18 CB LEU A 2 8.826 -12.710 -10.764 1.00 0.00 C ATOM 19 CG LEU A 2 8.658 -13.301 -12.166 1.00 0.00 C ATOM 20 CD1 LEU A 2 8.461 -12.191 -13.184 1.00 0.00 C ATOM 21 CD2 LEU A 2 9.864 -14.150 -12.540 1.00 0.00 C ATOM 0 H LEU A 2 5.984 -12.807 -9.303 1.00 0.00 H new ATOM 0 HA LEU A 2 7.468 -14.232 -10.097 1.00 0.00 H new ATOM 0 HB2 LEU A 2 8.584 -11.648 -10.804 1.00 0.00 H new ATOM 0 HB3 LEU A 2 9.875 -12.788 -10.478 1.00 0.00 H new ATOM 0 HG LEU A 2 7.775 -13.940 -12.166 1.00 0.00 H new ATOM 0 HD11 LEU A 2 8.343 -12.625 -14.177 1.00 0.00 H new ATOM 0 HD12 LEU A 2 7.569 -11.618 -12.930 1.00 0.00 H new ATOM 0 HD13 LEU A 2 9.330 -11.532 -13.177 1.00 0.00 H new ATOM 0 HD21 LEU A 2 9.724 -14.560 -13.540 1.00 0.00 H new ATOM 0 HD22 LEU A 2 10.762 -13.533 -12.523 1.00 0.00 H new ATOM 0 HD23 LEU A 2 9.971 -14.966 -11.825 1.00 0.00 H new ATOM 33 N PRO A 3 8.479 -14.991 -7.904 1.00 0.00 N ATOM 34 CA PRO A 3 9.236 -15.588 -6.803 1.00 0.00 C ATOM 35 C PRO A 3 10.494 -16.309 -7.292 1.00 0.00 C ATOM 36 O PRO A 3 10.611 -17.532 -7.178 1.00 0.00 O ATOM 37 CB PRO A 3 8.249 -16.589 -6.174 1.00 0.00 C ATOM 38 CG PRO A 3 6.948 -16.393 -6.890 1.00 0.00 C ATOM 39 CD PRO A 3 7.285 -15.785 -8.219 1.00 0.00 C ATOM 0 HA PRO A 3 9.591 -14.834 -6.101 1.00 0.00 H new ATOM 0 HB2 PRO A 3 8.606 -17.613 -6.287 1.00 0.00 H new ATOM 0 HB3 PRO A 3 8.137 -16.407 -5.105 1.00 0.00 H new ATOM 0 HG2 PRO A 3 6.428 -17.342 -7.018 1.00 0.00 H new ATOM 0 HG3 PRO A 3 6.286 -15.741 -6.321 1.00 0.00 H new ATOM 0 HD2 PRO A 3 7.489 -16.544 -8.974 1.00 0.00 H new ATOM 0 HD3 PRO A 3 6.473 -15.166 -8.601 1.00 0.00 H new ATOM 47 N ALA A 4 11.422 -15.547 -7.858 1.00 0.00 N ATOM 48 CA ALA A 4 12.683 -16.099 -8.328 1.00 0.00 C ATOM 49 C ALA A 4 13.623 -16.360 -7.157 1.00 0.00 C ATOM 50 O ALA A 4 13.884 -17.510 -6.806 1.00 0.00 O ATOM 51 CB ALA A 4 13.326 -15.169 -9.346 1.00 0.00 C ATOM 0 H ALA A 4 11.323 -14.542 -8.002 1.00 0.00 H new ATOM 0 HA ALA A 4 12.483 -17.051 -8.819 1.00 0.00 H new ATOM 0 HB1 ALA A 4 14.268 -15.598 -9.687 1.00 0.00 H new ATOM 0 HB2 ALA A 4 12.657 -15.042 -10.197 1.00 0.00 H new ATOM 0 HB3 ALA A 4 13.514 -14.199 -8.885 1.00 0.00 H new ATOM 57 N SER A 5 14.132 -15.293 -6.554 1.00 0.00 N ATOM 58 CA SER A 5 14.971 -15.422 -5.374 1.00 0.00 C ATOM 59 C SER A 5 14.410 -14.594 -4.220 1.00 0.00 C ATOM 60 O SER A 5 13.547 -15.055 -3.473 1.00 0.00 O ATOM 61 CB SER A 5 16.399 -14.981 -5.691 1.00 0.00 C ATOM 62 OG SER A 5 16.409 -13.941 -6.655 1.00 0.00 O ATOM 0 H SER A 5 13.978 -14.333 -6.863 1.00 0.00 H new ATOM 0 HA SER A 5 14.982 -16.470 -5.074 1.00 0.00 H new ATOM 0 HB2 SER A 5 16.889 -14.640 -4.779 1.00 0.00 H new ATOM 0 HB3 SER A 5 16.972 -15.831 -6.062 1.00 0.00 H new ATOM 0 HG SER A 5 17.334 -13.675 -6.840 1.00 0.00 H new ATOM 68 N ALA A 6 14.887 -13.361 -4.095 1.00 0.00 N ATOM 69 CA ALA A 6 14.478 -12.493 -2.998 1.00 0.00 C ATOM 70 C ALA A 6 13.370 -11.536 -3.424 1.00 0.00 C ATOM 71 O ALA A 6 12.760 -10.873 -2.581 1.00 0.00 O ATOM 72 CB ALA A 6 15.669 -11.711 -2.471 1.00 0.00 C ATOM 0 H ALA A 6 15.557 -12.940 -4.739 1.00 0.00 H new ATOM 0 HA ALA A 6 14.086 -13.127 -2.203 1.00 0.00 H new ATOM 0 HB1 ALA A 6 15.348 -11.067 -1.652 1.00 0.00 H new ATOM 0 HB2 ALA A 6 16.429 -12.404 -2.111 1.00 0.00 H new ATOM 0 HB3 ALA A 6 16.086 -11.100 -3.271 1.00 0.00 H new ATOM 78 N ALA A 7 13.127 -11.468 -4.736 1.00 0.00 N ATOM 79 CA ALA A 7 12.101 -10.593 -5.307 1.00 0.00 C ATOM 80 C ALA A 7 12.269 -9.146 -4.838 1.00 0.00 C ATOM 81 O ALA A 7 11.342 -8.534 -4.308 1.00 0.00 O ATOM 82 CB ALA A 7 10.708 -11.110 -4.974 1.00 0.00 C ATOM 0 H ALA A 7 13.635 -12.017 -5.430 1.00 0.00 H new ATOM 0 HA ALA A 7 12.225 -10.603 -6.390 1.00 0.00 H new ATOM 0 HB1 ALA A 7 9.960 -10.446 -5.407 1.00 0.00 H new ATOM 0 HB2 ALA A 7 10.584 -12.112 -5.384 1.00 0.00 H new ATOM 0 HB3 ALA A 7 10.581 -11.142 -3.892 1.00 0.00 H new ATOM 88 N LYS A 8 13.455 -8.602 -5.054 1.00 0.00 N ATOM 89 CA LYS A 8 13.767 -7.247 -4.626 1.00 0.00 C ATOM 90 C LYS A 8 13.090 -6.232 -5.541 1.00 0.00 C ATOM 91 O LYS A 8 13.550 -5.983 -6.656 1.00 0.00 O ATOM 92 CB LYS A 8 15.281 -7.024 -4.619 1.00 0.00 C ATOM 93 CG LYS A 8 16.050 -8.085 -3.849 1.00 0.00 C ATOM 94 CD LYS A 8 17.202 -7.476 -3.066 1.00 0.00 C ATOM 95 CE LYS A 8 17.240 -7.993 -1.638 1.00 0.00 C ATOM 96 NZ LYS A 8 18.387 -8.909 -1.406 1.00 0.00 N ATOM 0 H LYS A 8 14.222 -9.081 -5.526 1.00 0.00 H new ATOM 0 HA LYS A 8 13.390 -7.110 -3.612 1.00 0.00 H new ATOM 0 HB2 LYS A 8 15.641 -7.001 -5.648 1.00 0.00 H new ATOM 0 HB3 LYS A 8 15.494 -6.047 -4.185 1.00 0.00 H new ATOM 0 HG2 LYS A 8 15.376 -8.601 -3.165 1.00 0.00 H new ATOM 0 HG3 LYS A 8 16.434 -8.833 -4.542 1.00 0.00 H new ATOM 0 HD2 LYS A 8 18.144 -7.708 -3.563 1.00 0.00 H new ATOM 0 HD3 LYS A 8 17.104 -6.390 -3.058 1.00 0.00 H new ATOM 0 HE2 LYS A 8 17.304 -7.151 -0.949 1.00 0.00 H new ATOM 0 HE3 LYS A 8 16.309 -8.515 -1.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 18.375 -9.238 -0.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 18.313 -9.727 -2.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 19.277 -8.404 -1.591 1.00 0.00 H new ATOM 110 N ASN A 9 11.986 -5.669 -5.073 1.00 0.00 N ATOM 111 CA ASN A 9 11.222 -4.716 -5.869 1.00 0.00 C ATOM 112 C ASN A 9 10.586 -3.633 -4.998 1.00 0.00 C ATOM 113 O ASN A 9 10.050 -2.652 -5.510 1.00 0.00 O ATOM 114 CB ASN A 9 10.129 -5.450 -6.659 1.00 0.00 C ATOM 115 CG ASN A 9 8.970 -5.911 -5.786 1.00 0.00 C ATOM 116 OD1 ASN A 9 7.897 -5.310 -5.792 1.00 0.00 O ATOM 117 ND2 ASN A 9 9.174 -6.985 -5.034 1.00 0.00 N ATOM 0 H ASN A 9 11.598 -5.854 -4.148 1.00 0.00 H new ATOM 0 HA ASN A 9 11.914 -4.231 -6.558 1.00 0.00 H new ATOM 0 HB2 ASN A 9 9.749 -4.791 -7.440 1.00 0.00 H new ATOM 0 HB3 ASN A 9 10.567 -6.315 -7.157 1.00 0.00 H new ATOM 0 HD21 ASN A 9 8.427 -7.338 -4.435 1.00 0.00 H new ATOM 0 HD22 ASN A 9 10.077 -7.458 -5.055 1.00 0.00 H new ATOM 124 N ALA A 10 10.665 -3.793 -3.683 1.00 0.00 N ATOM 125 CA ALA A 10 9.959 -2.898 -2.777 1.00 0.00 C ATOM 126 C ALA A 10 10.918 -2.146 -1.862 1.00 0.00 C ATOM 127 O ALA A 10 11.907 -2.702 -1.386 1.00 0.00 O ATOM 128 CB ALA A 10 8.945 -3.677 -1.950 1.00 0.00 C ATOM 0 H ALA A 10 11.205 -4.527 -3.224 1.00 0.00 H new ATOM 0 HA ALA A 10 9.436 -2.160 -3.385 1.00 0.00 H new ATOM 0 HB1 ALA A 10 8.424 -2.996 -1.277 1.00 0.00 H new ATOM 0 HB2 ALA A 10 8.223 -4.154 -2.614 1.00 0.00 H new ATOM 0 HB3 ALA A 10 9.460 -4.440 -1.367 1.00 0.00 H new ATOM 134 N LYS A 11 10.618 -0.871 -1.632 1.00 0.00 N ATOM 135 CA LYS A 11 11.368 -0.047 -0.686 1.00 0.00 C ATOM 136 C LYS A 11 10.415 0.602 0.297 1.00 0.00 C ATOM 137 O LYS A 11 10.535 0.413 1.509 1.00 0.00 O ATOM 138 CB LYS A 11 12.159 1.044 -1.405 1.00 0.00 C ATOM 139 CG LYS A 11 13.342 0.522 -2.204 1.00 0.00 C ATOM 140 CD LYS A 11 14.477 0.083 -1.288 1.00 0.00 C ATOM 141 CE LYS A 11 14.740 -1.410 -1.387 1.00 0.00 C ATOM 142 NZ LYS A 11 14.520 -2.104 -0.087 1.00 0.00 N ATOM 0 H LYS A 11 9.852 -0.381 -2.093 1.00 0.00 H new ATOM 0 HA LYS A 11 12.068 -0.696 -0.160 1.00 0.00 H new ATOM 0 HB2 LYS A 11 11.489 1.582 -2.076 1.00 0.00 H new ATOM 0 HB3 LYS A 11 12.519 1.763 -0.669 1.00 0.00 H new ATOM 0 HG2 LYS A 11 13.024 -0.318 -2.822 1.00 0.00 H new ATOM 0 HG3 LYS A 11 13.698 1.299 -2.881 1.00 0.00 H new ATOM 0 HD2 LYS A 11 15.384 0.629 -1.547 1.00 0.00 H new ATOM 0 HD3 LYS A 11 14.232 0.341 -0.258 1.00 0.00 H new ATOM 0 HE2 LYS A 11 14.087 -1.844 -2.144 1.00 0.00 H new ATOM 0 HE3 LYS A 11 15.765 -1.576 -1.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 15.194 -2.890 0.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 14.663 -1.432 0.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 13.549 -2.475 -0.051 1.00 0.00 H new ATOM 156 N LEU A 12 9.493 1.394 -0.253 1.00 0.00 N ATOM 157 CA LEU A 12 8.425 2.039 0.507 1.00 0.00 C ATOM 158 C LEU A 12 8.944 3.232 1.313 1.00 0.00 C ATOM 159 O LEU A 12 8.519 4.366 1.098 1.00 0.00 O ATOM 160 CB LEU A 12 7.724 1.025 1.421 1.00 0.00 C ATOM 161 CG LEU A 12 6.276 1.353 1.777 1.00 0.00 C ATOM 162 CD1 LEU A 12 6.237 2.403 2.869 1.00 0.00 C ATOM 163 CD2 LEU A 12 5.511 1.826 0.550 1.00 0.00 C ATOM 0 H LEU A 12 9.468 1.607 -1.250 1.00 0.00 H new ATOM 0 HA LEU A 12 7.697 2.422 -0.208 1.00 0.00 H new ATOM 0 HB2 LEU A 12 7.749 0.048 0.938 1.00 0.00 H new ATOM 0 HB3 LEU A 12 8.296 0.938 2.345 1.00 0.00 H new ATOM 0 HG LEU A 12 5.794 0.447 2.144 1.00 0.00 H new ATOM 0 HD11 LEU A 12 5.201 2.631 3.117 1.00 0.00 H new ATOM 0 HD12 LEU A 12 6.748 2.026 3.755 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.735 3.308 2.521 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.482 2.054 0.828 1.00 0.00 H new ATOM 0 HD22 LEU A 12 5.985 2.722 0.149 1.00 0.00 H new ATOM 0 HD23 LEU A 12 5.517 1.042 -0.207 1.00 0.00 H new ATOM 175 N ALA A 13 9.861 2.979 2.235 1.00 0.00 N ATOM 176 CA ALA A 13 10.396 4.035 3.084 1.00 0.00 C ATOM 177 C ALA A 13 11.331 4.936 2.289 1.00 0.00 C ATOM 178 O ALA A 13 11.290 6.163 2.409 1.00 0.00 O ATOM 179 CB ALA A 13 11.121 3.437 4.282 1.00 0.00 C ATOM 0 H ALA A 13 10.250 2.053 2.415 1.00 0.00 H new ATOM 0 HA ALA A 13 9.566 4.639 3.449 1.00 0.00 H new ATOM 0 HB1 ALA A 13 11.515 4.239 4.906 1.00 0.00 H new ATOM 0 HB2 ALA A 13 10.425 2.833 4.864 1.00 0.00 H new ATOM 0 HB3 ALA A 13 11.943 2.811 3.935 1.00 0.00 H new ATOM 185 N THR A 14 12.147 4.315 1.449 1.00 0.00 N ATOM 186 CA THR A 14 13.127 5.032 0.643 1.00 0.00 C ATOM 187 C THR A 14 12.484 5.705 -0.573 1.00 0.00 C ATOM 188 O THR A 14 13.173 6.260 -1.428 1.00 0.00 O ATOM 189 CB THR A 14 14.236 4.069 0.187 1.00 0.00 C ATOM 190 OG1 THR A 14 14.192 2.886 1.000 1.00 0.00 O ATOM 191 CG2 THR A 14 15.610 4.719 0.300 1.00 0.00 C ATOM 0 H THR A 14 12.149 3.305 1.307 1.00 0.00 H new ATOM 0 HA THR A 14 13.557 5.817 1.265 1.00 0.00 H new ATOM 0 HB THR A 14 14.069 3.813 -0.859 1.00 0.00 H new ATOM 0 HG1 THR A 14 14.895 2.266 0.714 1.00 0.00 H new ATOM 0 HG21 THR A 14 16.374 4.015 -0.029 1.00 0.00 H new ATOM 0 HG22 THR A 14 15.644 5.610 -0.327 1.00 0.00 H new ATOM 0 HG23 THR A 14 15.796 4.998 1.337 1.00 0.00 H new ATOM 199 N SER A 15 11.159 5.653 -0.638 1.00 0.00 N ATOM 200 CA SER A 15 10.412 6.355 -1.668 1.00 0.00 C ATOM 201 C SER A 15 10.419 7.848 -1.393 1.00 0.00 C ATOM 202 O SER A 15 10.294 8.643 -2.317 1.00 0.00 O ATOM 203 CB SER A 15 8.978 5.828 -1.729 1.00 0.00 C ATOM 204 OG SER A 15 8.966 4.410 -1.832 1.00 0.00 O ATOM 0 H SER A 15 10.579 5.128 0.016 1.00 0.00 H new ATOM 0 HA SER A 15 10.888 6.178 -2.633 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.434 6.137 -0.837 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.462 6.264 -2.584 1.00 0.00 H new ATOM 0 HG SER A 15 8.095 4.114 -2.170 1.00 0.00 H new ATOM 210 N ALA A 16 10.580 8.210 -0.110 1.00 0.00 N ATOM 211 CA ALA A 16 10.598 9.609 0.333 1.00 0.00 C ATOM 212 C ALA A 16 9.225 10.262 0.171 1.00 0.00 C ATOM 213 O ALA A 16 8.671 10.814 1.121 1.00 0.00 O ATOM 214 CB ALA A 16 11.660 10.405 -0.419 1.00 0.00 C ATOM 0 H ALA A 16 10.701 7.539 0.648 1.00 0.00 H new ATOM 0 HA ALA A 16 10.850 9.614 1.393 1.00 0.00 H new ATOM 0 HB1 ALA A 16 11.653 11.438 -0.073 1.00 0.00 H new ATOM 0 HB2 ALA A 16 12.641 9.967 -0.235 1.00 0.00 H new ATOM 0 HB3 ALA A 16 11.446 10.379 -1.487 1.00 0.00 H new ATOM 220 N ALA A 17 8.685 10.180 -1.032 1.00 0.00 N ATOM 221 CA ALA A 17 7.379 10.726 -1.348 1.00 0.00 C ATOM 222 C ALA A 17 6.291 10.030 -0.542 1.00 0.00 C ATOM 223 O ALA A 17 5.295 10.641 -0.161 1.00 0.00 O ATOM 224 CB ALA A 17 7.113 10.585 -2.836 1.00 0.00 C ATOM 0 H ALA A 17 9.145 9.729 -1.823 1.00 0.00 H new ATOM 0 HA ALA A 17 7.367 11.783 -1.082 1.00 0.00 H new ATOM 0 HB1 ALA A 17 6.131 10.996 -3.071 1.00 0.00 H new ATOM 0 HB2 ALA A 17 7.876 11.127 -3.395 1.00 0.00 H new ATOM 0 HB3 ALA A 17 7.141 9.531 -3.112 1.00 0.00 H new ATOM 230 N PHE A 18 6.494 8.745 -0.270 1.00 0.00 N ATOM 231 CA PHE A 18 5.553 7.989 0.543 1.00 0.00 C ATOM 232 C PHE A 18 5.654 8.421 2.002 1.00 0.00 C ATOM 233 O PHE A 18 4.682 8.357 2.750 1.00 0.00 O ATOM 234 CB PHE A 18 5.803 6.484 0.420 1.00 0.00 C ATOM 235 CG PHE A 18 4.604 5.657 0.797 1.00 0.00 C ATOM 236 CD1 PHE A 18 4.397 5.261 2.110 1.00 0.00 C ATOM 237 CD2 PHE A 18 3.676 5.285 -0.163 1.00 0.00 C ATOM 238 CE1 PHE A 18 3.292 4.507 2.455 1.00 0.00 C ATOM 239 CE2 PHE A 18 2.570 4.533 0.178 1.00 0.00 C ATOM 240 CZ PHE A 18 2.376 4.144 1.488 1.00 0.00 C ATOM 0 H PHE A 18 7.297 8.209 -0.599 1.00 0.00 H new ATOM 0 HA PHE A 18 4.547 8.196 0.178 1.00 0.00 H new ATOM 0 HB2 PHE A 18 6.090 6.251 -0.605 1.00 0.00 H new ATOM 0 HB3 PHE A 18 6.643 6.207 1.057 1.00 0.00 H new ATOM 0 HD1 PHE A 18 5.108 5.545 2.872 1.00 0.00 H new ATOM 0 HD2 PHE A 18 3.820 5.587 -1.190 1.00 0.00 H new ATOM 0 HE1 PHE A 18 3.145 4.202 3.480 1.00 0.00 H new ATOM 0 HE2 PHE A 18 1.856 4.249 -0.581 1.00 0.00 H new ATOM 0 HZ PHE A 18 1.510 3.557 1.756 1.00 0.00 H new ATOM 250 N ALA A 19 6.831 8.878 2.399 1.00 0.00 N ATOM 251 CA ALA A 19 7.030 9.361 3.760 1.00 0.00 C ATOM 252 C ALA A 19 6.274 10.669 3.986 1.00 0.00 C ATOM 253 O ALA A 19 5.951 11.024 5.117 1.00 0.00 O ATOM 254 CB ALA A 19 8.510 9.536 4.059 1.00 0.00 C ATOM 0 H ALA A 19 7.659 8.925 1.805 1.00 0.00 H new ATOM 0 HA ALA A 19 6.631 8.615 4.447 1.00 0.00 H new ATOM 0 HB1 ALA A 19 8.635 9.897 5.080 1.00 0.00 H new ATOM 0 HB2 ALA A 19 9.019 8.579 3.948 1.00 0.00 H new ATOM 0 HB3 ALA A 19 8.939 10.258 3.364 1.00 0.00 H new ATOM 260 N LYS A 20 5.977 11.376 2.897 1.00 0.00 N ATOM 261 CA LYS A 20 5.187 12.598 2.974 1.00 0.00 C ATOM 262 C LYS A 20 3.759 12.259 3.386 1.00 0.00 C ATOM 263 O LYS A 20 3.084 13.048 4.043 1.00 0.00 O ATOM 264 CB LYS A 20 5.181 13.327 1.627 1.00 0.00 C ATOM 265 CG LYS A 20 6.564 13.716 1.125 1.00 0.00 C ATOM 266 CD LYS A 20 6.480 14.437 -0.210 1.00 0.00 C ATOM 267 CE LYS A 20 7.811 14.422 -0.944 1.00 0.00 C ATOM 268 NZ LYS A 20 8.844 15.229 -0.243 1.00 0.00 N ATOM 0 H LYS A 20 6.272 11.122 1.954 1.00 0.00 H new ATOM 0 HA LYS A 20 5.635 13.256 3.719 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.702 12.690 0.883 1.00 0.00 H new ATOM 0 HB3 LYS A 20 4.572 14.227 1.716 1.00 0.00 H new ATOM 0 HG2 LYS A 20 7.053 14.358 1.858 1.00 0.00 H new ATOM 0 HG3 LYS A 20 7.181 12.823 1.021 1.00 0.00 H new ATOM 0 HD2 LYS A 20 5.717 13.966 -0.830 1.00 0.00 H new ATOM 0 HD3 LYS A 20 6.166 15.468 -0.047 1.00 0.00 H new ATOM 0 HE2 LYS A 20 8.159 13.394 -1.042 1.00 0.00 H new ATOM 0 HE3 LYS A 20 7.672 14.809 -1.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 9.735 15.191 -0.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 8.524 16.216 -0.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 8.996 14.845 0.711 1.00 0.00 H new ATOM 282 N GLN A 21 3.328 11.062 3.013 1.00 0.00 N ATOM 283 CA GLN A 21 1.994 10.574 3.335 1.00 0.00 C ATOM 284 C GLN A 21 1.823 10.433 4.843 1.00 0.00 C ATOM 285 O GLN A 21 0.733 10.635 5.379 1.00 0.00 O ATOM 286 CB GLN A 21 1.766 9.221 2.659 1.00 0.00 C ATOM 287 CG GLN A 21 0.441 9.097 1.927 1.00 0.00 C ATOM 288 CD GLN A 21 0.006 7.653 1.766 1.00 0.00 C ATOM 289 OE1 GLN A 21 -0.371 6.993 2.731 1.00 0.00 O ATOM 290 NE2 GLN A 21 0.051 7.152 0.540 1.00 0.00 N ATOM 0 H GLN A 21 3.893 10.402 2.479 1.00 0.00 H new ATOM 0 HA GLN A 21 1.261 11.293 2.970 1.00 0.00 H new ATOM 0 HB2 GLN A 21 2.576 9.042 1.951 1.00 0.00 H new ATOM 0 HB3 GLN A 21 1.824 8.437 3.415 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -0.326 9.647 2.473 1.00 0.00 H new ATOM 0 HG3 GLN A 21 0.527 9.560 0.944 1.00 0.00 H new ATOM 0 HE21 GLN A 21 0.370 7.732 -0.236 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -0.233 6.187 0.373 1.00 0.00 H new ATOM 299 N ALA A 22 2.920 10.112 5.521 1.00 0.00 N ATOM 300 CA ALA A 22 2.901 9.886 6.960 1.00 0.00 C ATOM 301 C ALA A 22 2.671 11.185 7.728 1.00 0.00 C ATOM 302 O ALA A 22 2.296 11.167 8.899 1.00 0.00 O ATOM 303 CB ALA A 22 4.206 9.238 7.400 1.00 0.00 C ATOM 0 H ALA A 22 3.839 10.002 5.092 1.00 0.00 H new ATOM 0 HA ALA A 22 2.071 9.217 7.186 1.00 0.00 H new ATOM 0 HB1 ALA A 22 4.185 9.072 8.477 1.00 0.00 H new ATOM 0 HB2 ALA A 22 4.329 8.284 6.888 1.00 0.00 H new ATOM 0 HB3 ALA A 22 5.040 9.894 7.150 1.00 0.00 H new ATOM 309 N GLU A 23 2.906 12.309 7.066 1.00 0.00 N ATOM 310 CA GLU A 23 2.704 13.609 7.691 1.00 0.00 C ATOM 311 C GLU A 23 1.484 14.308 7.103 1.00 0.00 C ATOM 312 O GLU A 23 0.864 15.151 7.752 1.00 0.00 O ATOM 313 CB GLU A 23 3.944 14.487 7.521 1.00 0.00 C ATOM 314 CG GLU A 23 5.213 13.875 8.098 1.00 0.00 C ATOM 315 CD GLU A 23 5.306 14.006 9.608 1.00 0.00 C ATOM 316 OE1 GLU A 23 4.259 13.956 10.286 1.00 0.00 O ATOM 317 OE2 GLU A 23 6.433 14.143 10.127 1.00 0.00 O ATOM 0 H GLU A 23 3.235 12.348 6.101 1.00 0.00 H new ATOM 0 HA GLU A 23 2.532 13.448 8.755 1.00 0.00 H new ATOM 0 HB2 GLU A 23 4.096 14.683 6.460 1.00 0.00 H new ATOM 0 HB3 GLU A 23 3.765 15.449 8.001 1.00 0.00 H new ATOM 0 HG2 GLU A 23 5.255 12.820 7.828 1.00 0.00 H new ATOM 0 HG3 GLU A 23 6.080 14.355 7.644 1.00 0.00 H new ATOM 324 N GLY A 24 1.140 13.949 5.872 1.00 0.00 N ATOM 325 CA GLY A 24 -0.018 14.535 5.220 1.00 0.00 C ATOM 326 C GLY A 24 -1.318 13.950 5.724 1.00 0.00 C ATOM 327 O GLY A 24 -2.362 14.602 5.682 1.00 0.00 O ATOM 0 H GLY A 24 1.643 13.261 5.312 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -0.019 15.612 5.385 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.055 14.378 4.144 1.00 0.00 H new ATOM 331 N THR A 25 -1.255 12.720 6.205 1.00 0.00 N ATOM 332 CA THR A 25 -2.432 12.041 6.713 1.00 0.00 C ATOM 333 C THR A 25 -2.101 11.291 7.992 1.00 0.00 C ATOM 334 O THR A 25 -0.946 10.940 8.233 1.00 0.00 O ATOM 335 CB THR A 25 -2.991 11.057 5.672 1.00 0.00 C ATOM 336 OG1 THR A 25 -2.066 10.921 4.585 1.00 0.00 O ATOM 337 CG2 THR A 25 -4.328 11.540 5.145 1.00 0.00 C ATOM 0 H THR A 25 -0.397 12.170 6.254 1.00 0.00 H new ATOM 0 HA THR A 25 -3.188 12.797 6.924 1.00 0.00 H new ATOM 0 HB THR A 25 -3.133 10.089 6.153 1.00 0.00 H new ATOM 0 HG1 THR A 25 -1.184 10.674 4.935 1.00 0.00 H new ATOM 0 HG21 THR A 25 -4.707 10.830 4.410 1.00 0.00 H new ATOM 0 HG22 THR A 25 -5.036 11.621 5.970 1.00 0.00 H new ATOM 0 HG23 THR A 25 -4.203 12.516 4.676 1.00 0.00 H new ATOM 345 N THR A 26 -3.107 11.056 8.822 1.00 0.00 N ATOM 346 CA THR A 26 -2.894 10.344 10.068 1.00 0.00 C ATOM 347 C THR A 26 -2.956 8.836 9.837 1.00 0.00 C ATOM 348 O THR A 26 -4.035 8.233 9.831 1.00 0.00 O ATOM 349 CB THR A 26 -3.927 10.763 11.146 1.00 0.00 C ATOM 350 OG1 THR A 26 -4.141 9.700 12.087 1.00 0.00 O ATOM 351 CG2 THR A 26 -5.256 11.158 10.515 1.00 0.00 C ATOM 0 H THR A 26 -4.070 11.346 8.655 1.00 0.00 H new ATOM 0 HA THR A 26 -1.902 10.608 10.434 1.00 0.00 H new ATOM 0 HB THR A 26 -3.518 11.628 11.669 1.00 0.00 H new ATOM 0 HG1 THR A 26 -4.489 8.913 11.618 1.00 0.00 H new ATOM 0 HG21 THR A 26 -5.959 11.446 11.297 1.00 0.00 H new ATOM 0 HG22 THR A 26 -5.102 11.998 9.838 1.00 0.00 H new ATOM 0 HG23 THR A 26 -5.660 10.313 9.958 1.00 0.00 H new ATOM 359 N CYS A 27 -1.791 8.234 9.657 1.00 0.00 N ATOM 360 CA CYS A 27 -1.683 6.792 9.513 1.00 0.00 C ATOM 361 C CYS A 27 -0.352 6.318 10.086 1.00 0.00 C ATOM 362 O CYS A 27 0.698 6.894 9.804 1.00 0.00 O ATOM 363 CB CYS A 27 -1.818 6.370 8.040 1.00 0.00 C ATOM 364 SG CYS A 27 -2.165 7.739 6.878 1.00 0.00 S ATOM 0 H CYS A 27 -0.900 8.728 9.607 1.00 0.00 H new ATOM 0 HA CYS A 27 -2.498 6.325 10.066 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -0.896 5.876 7.732 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -2.617 5.633 7.960 1.00 0.00 H new ATOM 369 N ASN A 28 -0.404 5.275 10.903 1.00 0.00 N ATOM 370 CA ASN A 28 0.786 4.753 11.565 1.00 0.00 C ATOM 371 C ASN A 28 1.578 3.866 10.609 1.00 0.00 C ATOM 372 O ASN A 28 1.122 3.582 9.508 1.00 0.00 O ATOM 373 CB ASN A 28 0.383 3.956 12.809 1.00 0.00 C ATOM 374 CG ASN A 28 1.497 3.830 13.830 1.00 0.00 C ATOM 375 OD1 ASN A 28 2.573 4.406 13.673 1.00 0.00 O ATOM 376 ND2 ASN A 28 1.242 3.066 14.878 1.00 0.00 N ATOM 0 H ASN A 28 -1.262 4.770 11.125 1.00 0.00 H new ATOM 0 HA ASN A 28 1.416 5.590 11.867 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -0.476 4.437 13.277 1.00 0.00 H new ATOM 0 HB3 ASN A 28 0.064 2.959 12.505 1.00 0.00 H new ATOM 0 HD21 ASN A 28 1.952 2.935 15.598 1.00 0.00 H new ATOM 0 HD22 ASN A 28 0.335 2.608 14.966 1.00 0.00 H new ATOM 383 N VAL A 29 2.757 3.426 11.041 1.00 0.00 N ATOM 384 CA VAL A 29 3.622 2.576 10.220 1.00 0.00 C ATOM 385 C VAL A 29 2.886 1.308 9.759 1.00 0.00 C ATOM 386 O VAL A 29 2.997 0.901 8.602 1.00 0.00 O ATOM 387 CB VAL A 29 4.923 2.198 10.979 1.00 0.00 C ATOM 388 CG1 VAL A 29 4.613 1.650 12.366 1.00 0.00 C ATOM 389 CG2 VAL A 29 5.755 1.204 10.177 1.00 0.00 C ATOM 0 H VAL A 29 3.139 3.645 11.961 1.00 0.00 H new ATOM 0 HA VAL A 29 3.895 3.152 9.336 1.00 0.00 H new ATOM 0 HB VAL A 29 5.510 3.108 11.103 1.00 0.00 H new ATOM 0 HG11 VAL A 29 5.544 1.394 12.873 1.00 0.00 H new ATOM 0 HG12 VAL A 29 4.080 2.405 12.945 1.00 0.00 H new ATOM 0 HG13 VAL A 29 3.993 0.758 12.275 1.00 0.00 H new ATOM 0 HG21 VAL A 29 6.660 0.956 10.731 1.00 0.00 H new ATOM 0 HG22 VAL A 29 5.174 0.297 10.007 1.00 0.00 H new ATOM 0 HG23 VAL A 29 6.026 1.646 9.218 1.00 0.00 H new ATOM 399 N GLY A 30 2.118 0.704 10.659 1.00 0.00 N ATOM 400 CA GLY A 30 1.361 -0.485 10.308 1.00 0.00 C ATOM 401 C GLY A 30 -0.063 -0.162 9.908 1.00 0.00 C ATOM 402 O GLY A 30 -0.910 -1.053 9.806 1.00 0.00 O ATOM 0 H GLY A 30 2.006 1.015 11.624 1.00 0.00 H new ATOM 0 HA2 GLY A 30 1.859 -1.001 9.487 1.00 0.00 H new ATOM 0 HA3 GLY A 30 1.351 -1.170 11.156 1.00 0.00 H new ATOM 406 N SER A 31 -0.329 1.114 9.690 1.00 0.00 N ATOM 407 CA SER A 31 -1.652 1.563 9.290 1.00 0.00 C ATOM 408 C SER A 31 -1.563 2.487 8.080 1.00 0.00 C ATOM 409 O SER A 31 -2.505 3.217 7.770 1.00 0.00 O ATOM 410 CB SER A 31 -2.343 2.276 10.452 1.00 0.00 C ATOM 411 OG SER A 31 -1.716 1.970 11.685 1.00 0.00 O ATOM 0 H SER A 31 0.358 1.862 9.784 1.00 0.00 H new ATOM 0 HA SER A 31 -2.243 0.690 9.013 1.00 0.00 H new ATOM 0 HB2 SER A 31 -2.320 3.353 10.287 1.00 0.00 H new ATOM 0 HB3 SER A 31 -3.392 1.982 10.491 1.00 0.00 H new ATOM 0 HG SER A 31 -2.176 2.440 12.411 1.00 0.00 H new ATOM 417 N ILE A 32 -0.423 2.459 7.410 1.00 0.00 N ATOM 418 CA ILE A 32 -0.235 3.219 6.190 1.00 0.00 C ATOM 419 C ILE A 32 -0.249 2.266 5.000 1.00 0.00 C ATOM 420 O ILE A 32 0.362 1.191 5.045 1.00 0.00 O ATOM 421 CB ILE A 32 1.072 4.053 6.239 1.00 0.00 C ATOM 422 CG1 ILE A 32 0.919 5.322 5.401 1.00 0.00 C ATOM 423 CG2 ILE A 32 2.290 3.249 5.792 1.00 0.00 C ATOM 424 CD1 ILE A 32 1.428 6.566 6.102 1.00 0.00 C ATOM 0 H ILE A 32 0.390 1.913 7.695 1.00 0.00 H new ATOM 0 HA ILE A 32 -1.054 3.931 6.082 1.00 0.00 H new ATOM 0 HB ILE A 32 1.244 4.332 7.279 1.00 0.00 H new ATOM 0 HG12 ILE A 32 1.457 5.196 4.462 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -0.133 5.459 5.150 1.00 0.00 H new ATOM 0 HG21 ILE A 32 3.180 3.877 5.844 1.00 0.00 H new ATOM 0 HG22 ILE A 32 2.416 2.386 6.446 1.00 0.00 H new ATOM 0 HG23 ILE A 32 2.145 2.909 4.766 1.00 0.00 H new ATOM 0 HD11 ILE A 32 1.290 7.431 5.453 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.873 6.715 7.028 1.00 0.00 H new ATOM 0 HD13 ILE A 32 2.487 6.448 6.329 1.00 0.00 H new ATOM 436 N ALA A 33 -0.995 2.618 3.965 1.00 0.00 N ATOM 437 CA ALA A 33 -1.215 1.703 2.864 1.00 0.00 C ATOM 438 C ALA A 33 -1.432 2.426 1.549 1.00 0.00 C ATOM 439 O ALA A 33 -1.437 3.655 1.484 1.00 0.00 O ATOM 440 CB ALA A 33 -2.416 0.821 3.161 1.00 0.00 C ATOM 0 H ALA A 33 -1.454 3.524 3.867 1.00 0.00 H new ATOM 0 HA ALA A 33 -0.316 1.095 2.762 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -2.578 0.134 2.330 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -2.233 0.251 4.072 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -3.301 1.444 3.294 1.00 0.00 H new ATOM 446 N CYS A 34 -1.616 1.638 0.509 1.00 0.00 N ATOM 447 CA CYS A 34 -2.024 2.144 -0.783 1.00 0.00 C ATOM 448 C CYS A 34 -3.244 1.371 -1.248 1.00 0.00 C ATOM 449 O CYS A 34 -3.297 0.145 -1.118 1.00 0.00 O ATOM 450 CB CYS A 34 -0.894 2.007 -1.801 1.00 0.00 C ATOM 451 SG CYS A 34 0.260 3.410 -1.831 1.00 0.00 S ATOM 0 H CYS A 34 -1.486 0.627 0.538 1.00 0.00 H new ATOM 0 HA CYS A 34 -2.267 3.203 -0.694 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -0.335 1.096 -1.585 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -1.328 1.887 -2.794 1.00 0.00 H new ATOM 456 N CYS A 35 -4.235 2.077 -1.756 1.00 0.00 N ATOM 457 CA CYS A 35 -5.429 1.433 -2.267 1.00 0.00 C ATOM 458 C CYS A 35 -5.477 1.584 -3.778 1.00 0.00 C ATOM 459 O CYS A 35 -4.835 2.478 -4.342 1.00 0.00 O ATOM 460 CB CYS A 35 -6.690 2.008 -1.619 1.00 0.00 C ATOM 461 SG CYS A 35 -7.926 0.743 -1.169 1.00 0.00 S ATOM 0 H CYS A 35 -4.237 3.095 -1.826 1.00 0.00 H new ATOM 0 HA CYS A 35 -5.392 0.373 -2.015 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -6.407 2.562 -0.724 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -7.147 2.722 -2.304 1.00 0.00 H new ATOM 466 N ASN A 36 -6.221 0.717 -4.435 1.00 0.00 N ATOM 467 CA ASN A 36 -6.207 0.667 -5.883 1.00 0.00 C ATOM 468 C ASN A 36 -7.563 0.224 -6.424 1.00 0.00 C ATOM 469 O ASN A 36 -8.375 -0.348 -5.694 1.00 0.00 O ATOM 470 CB ASN A 36 -5.086 -0.279 -6.332 1.00 0.00 C ATOM 471 CG ASN A 36 -5.132 -0.634 -7.803 1.00 0.00 C ATOM 472 OD1 ASN A 36 -5.324 -1.792 -8.155 1.00 0.00 O ATOM 473 ND2 ASN A 36 -4.946 0.356 -8.666 1.00 0.00 N ATOM 0 H ASN A 36 -6.841 0.040 -3.991 1.00 0.00 H new ATOM 0 HA ASN A 36 -6.016 1.662 -6.285 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -4.124 0.183 -6.110 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -5.142 -1.196 -5.746 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -4.959 0.168 -9.668 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -4.790 1.305 -8.327 1.00 0.00 H new ATOM 480 N SER A 37 -7.810 0.545 -7.691 1.00 0.00 N ATOM 481 CA SER A 37 -9.025 0.161 -8.392 1.00 0.00 C ATOM 482 C SER A 37 -9.307 -1.341 -8.249 1.00 0.00 C ATOM 483 O SER A 37 -8.413 -2.166 -8.437 1.00 0.00 O ATOM 484 CB SER A 37 -8.864 0.538 -9.863 1.00 0.00 C ATOM 485 OG SER A 37 -7.649 1.254 -10.061 1.00 0.00 O ATOM 0 H SER A 37 -7.162 1.086 -8.264 1.00 0.00 H new ATOM 0 HA SER A 37 -9.875 0.686 -7.956 1.00 0.00 H new ATOM 0 HB2 SER A 37 -8.868 -0.362 -10.478 1.00 0.00 H new ATOM 0 HB3 SER A 37 -9.709 1.147 -10.184 1.00 0.00 H new ATOM 0 HG SER A 37 -6.998 0.676 -10.511 1.00 0.00 H new ATOM 491 N PRO A 38 -10.559 -1.708 -7.915 1.00 0.00 N ATOM 492 CA PRO A 38 -10.959 -3.107 -7.692 1.00 0.00 C ATOM 493 C PRO A 38 -10.605 -4.032 -8.854 1.00 0.00 C ATOM 494 O PRO A 38 -10.099 -5.130 -8.639 1.00 0.00 O ATOM 495 CB PRO A 38 -12.478 -3.019 -7.522 1.00 0.00 C ATOM 496 CG PRO A 38 -12.716 -1.637 -7.029 1.00 0.00 C ATOM 497 CD PRO A 38 -11.690 -0.781 -7.718 1.00 0.00 C ATOM 0 HA PRO A 38 -10.437 -3.536 -6.836 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -12.994 -3.199 -8.465 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -12.842 -3.762 -6.813 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -13.727 -1.305 -7.266 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -12.608 -1.583 -5.946 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -12.061 -0.391 -8.666 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -11.406 0.077 -7.109 1.00 0.00 H new ATOM 505 N ALA A 39 -10.844 -3.581 -10.084 1.00 0.00 N ATOM 506 CA ALA A 39 -10.587 -4.407 -11.263 1.00 0.00 C ATOM 507 C ALA A 39 -9.087 -4.554 -11.513 1.00 0.00 C ATOM 508 O ALA A 39 -8.660 -5.334 -12.365 1.00 0.00 O ATOM 509 CB ALA A 39 -11.273 -3.826 -12.491 1.00 0.00 C ATOM 0 H ALA A 39 -11.213 -2.653 -10.290 1.00 0.00 H new ATOM 0 HA ALA A 39 -11.001 -5.397 -11.072 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -11.067 -4.457 -13.355 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -12.349 -3.783 -12.321 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -10.895 -2.821 -12.678 1.00 0.00 H new ATOM 515 N GLU A 40 -8.298 -3.802 -10.760 1.00 0.00 N ATOM 516 CA GLU A 40 -6.850 -3.853 -10.861 1.00 0.00 C ATOM 517 C GLU A 40 -6.283 -4.645 -9.685 1.00 0.00 C ATOM 518 O GLU A 40 -5.447 -5.534 -9.856 1.00 0.00 O ATOM 519 CB GLU A 40 -6.286 -2.432 -10.863 1.00 0.00 C ATOM 520 CG GLU A 40 -5.479 -2.073 -12.095 1.00 0.00 C ATOM 521 CD GLU A 40 -4.694 -0.794 -11.895 1.00 0.00 C ATOM 522 OE1 GLU A 40 -5.260 0.178 -11.343 1.00 0.00 O ATOM 523 OE2 GLU A 40 -3.504 -0.759 -12.270 1.00 0.00 O ATOM 0 H GLU A 40 -8.644 -3.141 -10.064 1.00 0.00 H new ATOM 0 HA GLU A 40 -6.566 -4.347 -11.790 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -7.112 -1.727 -10.769 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.656 -2.304 -9.983 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.794 -2.887 -12.332 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.148 -1.960 -12.948 1.00 0.00 H new ATOM 530 N THR A 41 -6.776 -4.321 -8.498 1.00 0.00 N ATOM 531 CA THR A 41 -6.416 -5.023 -7.275 1.00 0.00 C ATOM 532 C THR A 41 -6.793 -6.504 -7.362 1.00 0.00 C ATOM 533 O THR A 41 -6.059 -7.377 -6.904 1.00 0.00 O ATOM 534 CB THR A 41 -7.133 -4.369 -6.072 1.00 0.00 C ATOM 535 OG1 THR A 41 -6.837 -2.969 -6.039 1.00 0.00 O ATOM 536 CG2 THR A 41 -6.733 -5.004 -4.746 1.00 0.00 C ATOM 0 H THR A 41 -7.440 -3.560 -8.356 1.00 0.00 H new ATOM 0 HA THR A 41 -5.337 -4.953 -7.141 1.00 0.00 H new ATOM 0 HB THR A 41 -8.203 -4.528 -6.204 1.00 0.00 H new ATOM 0 HG1 THR A 41 -6.273 -2.736 -6.806 1.00 0.00 H new ATOM 0 HG21 THR A 41 -7.263 -4.510 -3.932 1.00 0.00 H new ATOM 0 HG22 THR A 41 -6.991 -6.063 -4.757 1.00 0.00 H new ATOM 0 HG23 THR A 41 -5.659 -4.894 -4.599 1.00 0.00 H new ATOM 544 N ASN A 42 -7.933 -6.776 -7.976 1.00 0.00 N ATOM 545 CA ASN A 42 -8.447 -8.134 -8.089 1.00 0.00 C ATOM 546 C ASN A 42 -8.200 -8.696 -9.479 1.00 0.00 C ATOM 547 O ASN A 42 -8.797 -9.698 -9.873 1.00 0.00 O ATOM 548 CB ASN A 42 -9.939 -8.150 -7.792 1.00 0.00 C ATOM 549 CG ASN A 42 -10.256 -8.732 -6.429 1.00 0.00 C ATOM 550 OD1 ASN A 42 -10.836 -9.810 -6.322 1.00 0.00 O ATOM 551 ND2 ASN A 42 -9.873 -8.024 -5.379 1.00 0.00 N ATOM 0 H ASN A 42 -8.526 -6.068 -8.408 1.00 0.00 H new ATOM 0 HA ASN A 42 -7.922 -8.757 -7.365 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -10.328 -7.133 -7.848 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -10.452 -8.730 -8.559 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -10.057 -8.369 -4.437 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -9.394 -7.133 -5.512 1.00 0.00 H new ATOM 558 N ASN A 43 -7.331 -8.031 -10.224 1.00 0.00 N ATOM 559 CA ASN A 43 -7.033 -8.429 -11.599 1.00 0.00 C ATOM 560 C ASN A 43 -6.420 -9.822 -11.647 1.00 0.00 C ATOM 561 O ASN A 43 -6.774 -10.639 -12.501 1.00 0.00 O ATOM 562 CB ASN A 43 -6.093 -7.418 -12.263 1.00 0.00 C ATOM 563 CG ASN A 43 -6.203 -7.428 -13.777 1.00 0.00 C ATOM 564 OD1 ASN A 43 -5.451 -8.118 -14.462 1.00 0.00 O ATOM 565 ND2 ASN A 43 -7.136 -6.655 -14.309 1.00 0.00 N ATOM 0 H ASN A 43 -6.817 -7.211 -9.903 1.00 0.00 H new ATOM 0 HA ASN A 43 -7.974 -8.449 -12.149 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -6.320 -6.418 -11.892 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -5.065 -7.639 -11.975 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -7.250 -6.617 -15.322 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -7.741 -6.097 -13.706 1.00 0.00 H new ATOM 572 N ASP A 44 -5.512 -10.097 -10.720 1.00 0.00 N ATOM 573 CA ASP A 44 -4.872 -11.404 -10.649 1.00 0.00 C ATOM 574 C ASP A 44 -5.699 -12.358 -9.798 1.00 0.00 C ATOM 575 O ASP A 44 -6.254 -11.970 -8.769 1.00 0.00 O ATOM 576 CB ASP A 44 -3.458 -11.299 -10.075 1.00 0.00 C ATOM 577 CG ASP A 44 -2.728 -12.629 -10.128 1.00 0.00 C ATOM 578 OD1 ASP A 44 -2.125 -12.943 -11.176 1.00 0.00 O ATOM 579 OD2 ASP A 44 -2.781 -13.378 -9.134 1.00 0.00 O ATOM 0 H ASP A 44 -5.203 -9.435 -10.009 1.00 0.00 H new ATOM 0 HA ASP A 44 -4.805 -11.793 -11.665 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -2.894 -10.552 -10.633 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -3.510 -10.954 -9.042 1.00 0.00 H new ATOM 584 N SER A 45 -5.766 -13.604 -10.236 1.00 0.00 N ATOM 585 CA SER A 45 -6.536 -14.628 -9.556 1.00 0.00 C ATOM 586 C SER A 45 -6.046 -14.851 -8.123 1.00 0.00 C ATOM 587 O SER A 45 -6.848 -15.029 -7.204 1.00 0.00 O ATOM 588 CB SER A 45 -6.430 -15.921 -10.353 1.00 0.00 C ATOM 589 OG SER A 45 -5.538 -15.756 -11.447 1.00 0.00 O ATOM 0 H SER A 45 -5.287 -13.933 -11.074 1.00 0.00 H new ATOM 0 HA SER A 45 -7.574 -14.302 -9.493 1.00 0.00 H new ATOM 0 HB2 SER A 45 -6.079 -16.726 -9.707 1.00 0.00 H new ATOM 0 HB3 SER A 45 -7.415 -16.212 -10.719 1.00 0.00 H new ATOM 0 HG SER A 45 -5.478 -16.595 -11.950 1.00 0.00 H new ATOM 595 N LEU A 46 -4.733 -14.836 -7.934 1.00 0.00 N ATOM 596 CA LEU A 46 -4.149 -15.126 -6.632 1.00 0.00 C ATOM 597 C LEU A 46 -3.957 -13.850 -5.822 1.00 0.00 C ATOM 598 O LEU A 46 -3.829 -13.902 -4.600 1.00 0.00 O ATOM 599 CB LEU A 46 -2.809 -15.856 -6.788 1.00 0.00 C ATOM 600 CG LEU A 46 -2.571 -16.998 -5.794 1.00 0.00 C ATOM 601 CD1 LEU A 46 -2.292 -18.298 -6.530 1.00 0.00 C ATOM 602 CD2 LEU A 46 -1.422 -16.659 -4.856 1.00 0.00 C ATOM 0 H LEU A 46 -4.053 -14.626 -8.665 1.00 0.00 H new ATOM 0 HA LEU A 46 -4.841 -15.775 -6.095 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -2.747 -16.257 -7.800 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.003 -15.130 -6.683 1.00 0.00 H new ATOM 0 HG LEU A 46 -3.475 -17.128 -5.198 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -2.126 -19.097 -5.807 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -3.145 -18.550 -7.159 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -1.405 -18.181 -7.152 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -1.268 -17.481 -4.157 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -0.513 -16.501 -5.436 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -1.661 -15.752 -4.301 1.00 0.00 H new ATOM 614 N LEU A 47 -3.941 -12.704 -6.507 1.00 0.00 N ATOM 615 CA LEU A 47 -3.758 -11.410 -5.845 1.00 0.00 C ATOM 616 C LEU A 47 -4.824 -11.180 -4.779 1.00 0.00 C ATOM 617 O LEU A 47 -4.545 -10.601 -3.732 1.00 0.00 O ATOM 618 CB LEU A 47 -3.799 -10.268 -6.867 1.00 0.00 C ATOM 619 CG LEU A 47 -2.700 -9.209 -6.707 1.00 0.00 C ATOM 620 CD1 LEU A 47 -2.348 -8.585 -8.051 1.00 0.00 C ATOM 621 CD2 LEU A 47 -3.141 -8.137 -5.723 1.00 0.00 C ATOM 0 H LEU A 47 -4.052 -12.646 -7.519 1.00 0.00 H new ATOM 0 HA LEU A 47 -2.780 -11.424 -5.363 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.728 -10.694 -7.868 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.769 -9.775 -6.799 1.00 0.00 H new ATOM 0 HG LEU A 47 -1.808 -9.698 -6.316 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.567 -7.838 -7.912 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -1.992 -9.360 -8.730 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.233 -8.110 -8.475 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.352 -7.392 -5.619 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -4.048 -7.656 -6.091 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -3.340 -8.593 -4.753 1.00 0.00 H new ATOM 633 N SER A 48 -6.038 -11.650 -5.044 1.00 0.00 N ATOM 634 CA SER A 48 -7.151 -11.492 -4.112 1.00 0.00 C ATOM 635 C SER A 48 -6.885 -12.231 -2.791 1.00 0.00 C ATOM 636 O SER A 48 -7.459 -11.897 -1.753 1.00 0.00 O ATOM 637 CB SER A 48 -8.446 -11.988 -4.759 1.00 0.00 C ATOM 638 OG SER A 48 -9.561 -11.196 -4.374 1.00 0.00 O ATOM 0 H SER A 48 -6.278 -12.147 -5.902 1.00 0.00 H new ATOM 0 HA SER A 48 -7.254 -10.432 -3.878 1.00 0.00 H new ATOM 0 HB2 SER A 48 -8.342 -11.968 -5.844 1.00 0.00 H new ATOM 0 HB3 SER A 48 -8.621 -13.026 -4.475 1.00 0.00 H new ATOM 0 HG SER A 48 -9.998 -10.836 -5.174 1.00 0.00 H new ATOM 644 N GLY A 49 -6.016 -13.237 -2.836 1.00 0.00 N ATOM 645 CA GLY A 49 -5.614 -13.928 -1.623 1.00 0.00 C ATOM 646 C GLY A 49 -4.260 -13.450 -1.141 1.00 0.00 C ATOM 647 O GLY A 49 -3.909 -13.623 0.024 1.00 0.00 O ATOM 0 H GLY A 49 -5.583 -13.586 -3.691 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -6.359 -13.763 -0.844 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -5.578 -15.002 -1.808 1.00 0.00 H new ATOM 651 N LEU A 50 -3.511 -12.828 -2.043 1.00 0.00 N ATOM 652 CA LEU A 50 -2.190 -12.301 -1.736 1.00 0.00 C ATOM 653 C LEU A 50 -2.277 -11.182 -0.703 1.00 0.00 C ATOM 654 O LEU A 50 -1.391 -11.028 0.134 1.00 0.00 O ATOM 655 CB LEU A 50 -1.536 -11.782 -3.017 1.00 0.00 C ATOM 656 CG LEU A 50 -0.042 -12.066 -3.152 1.00 0.00 C ATOM 657 CD1 LEU A 50 0.196 -13.513 -3.545 1.00 0.00 C ATOM 658 CD2 LEU A 50 0.591 -11.130 -4.168 1.00 0.00 C ATOM 0 H LEU A 50 -3.804 -12.675 -3.008 1.00 0.00 H new ATOM 0 HA LEU A 50 -1.583 -13.104 -1.316 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -2.051 -12.222 -3.871 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.690 -10.704 -3.072 1.00 0.00 H new ATOM 0 HG LEU A 50 0.426 -11.892 -2.183 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.267 -13.694 -3.636 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.220 -14.170 -2.781 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.288 -13.715 -4.500 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.656 -11.348 -4.250 1.00 0.00 H new ATOM 0 HD22 LEU A 50 0.116 -11.272 -5.139 1.00 0.00 H new ATOM 0 HD23 LEU A 50 0.456 -10.098 -3.845 1.00 0.00 H new ATOM 670 N LEU A 51 -3.345 -10.395 -0.774 1.00 0.00 N ATOM 671 CA LEU A 51 -3.545 -9.308 0.174 1.00 0.00 C ATOM 672 C LEU A 51 -3.927 -9.855 1.547 1.00 0.00 C ATOM 673 O LEU A 51 -3.516 -9.327 2.580 1.00 0.00 O ATOM 674 CB LEU A 51 -4.617 -8.330 -0.333 1.00 0.00 C ATOM 675 CG LEU A 51 -5.773 -8.952 -1.121 1.00 0.00 C ATOM 676 CD1 LEU A 51 -7.021 -9.031 -0.258 1.00 0.00 C ATOM 677 CD2 LEU A 51 -6.051 -8.145 -2.381 1.00 0.00 C ATOM 0 H LEU A 51 -4.081 -10.489 -1.474 1.00 0.00 H new ATOM 0 HA LEU A 51 -2.605 -8.764 0.268 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -5.032 -7.800 0.524 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -4.132 -7.585 -0.964 1.00 0.00 H new ATOM 0 HG LEU A 51 -5.488 -9.963 -1.412 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -7.833 -9.475 -0.833 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -6.819 -9.646 0.619 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -7.308 -8.029 0.060 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -6.875 -8.600 -2.930 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -6.317 -7.124 -2.108 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -5.160 -8.132 -3.009 1.00 0.00 H new ATOM 689 N GLY A 52 -4.674 -10.950 1.551 1.00 0.00 N ATOM 690 CA GLY A 52 -5.179 -11.504 2.790 1.00 0.00 C ATOM 691 C GLY A 52 -4.155 -12.366 3.502 1.00 0.00 C ATOM 692 O GLY A 52 -4.435 -13.516 3.834 1.00 0.00 O ATOM 0 H GLY A 52 -4.940 -11.467 0.713 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -5.486 -10.692 3.449 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -6.068 -12.099 2.582 1.00 0.00 H new ATOM 696 N ALA A 53 -2.972 -11.811 3.733 1.00 0.00 N ATOM 697 CA ALA A 53 -1.908 -12.524 4.429 1.00 0.00 C ATOM 698 C ALA A 53 -2.215 -12.621 5.917 1.00 0.00 C ATOM 699 O ALA A 53 -1.780 -13.547 6.603 1.00 0.00 O ATOM 700 CB ALA A 53 -0.575 -11.825 4.211 1.00 0.00 C ATOM 0 H ALA A 53 -2.724 -10.864 3.447 1.00 0.00 H new ATOM 0 HA ALA A 53 -1.845 -13.533 4.022 1.00 0.00 H new ATOM 0 HB1 ALA A 53 0.211 -12.368 4.736 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -0.348 -11.799 3.145 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -0.631 -10.806 4.595 1.00 0.00 H new ATOM 706 N GLY A 54 -2.972 -11.651 6.401 1.00 0.00 N ATOM 707 CA GLY A 54 -3.359 -11.628 7.794 1.00 0.00 C ATOM 708 C GLY A 54 -4.807 -11.235 7.960 1.00 0.00 C ATOM 709 O GLY A 54 -5.700 -12.076 7.869 1.00 0.00 O ATOM 0 H GLY A 54 -3.328 -10.872 5.848 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -3.195 -12.612 8.234 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -2.726 -10.926 8.337 1.00 0.00 H new ATOM 713 N LEU A 55 -5.043 -9.955 8.181 1.00 0.00 N ATOM 714 CA LEU A 55 -6.389 -9.436 8.326 1.00 0.00 C ATOM 715 C LEU A 55 -6.580 -8.221 7.425 1.00 0.00 C ATOM 716 O LEU A 55 -6.887 -7.121 7.898 1.00 0.00 O ATOM 717 CB LEU A 55 -6.661 -9.063 9.786 1.00 0.00 C ATOM 718 CG LEU A 55 -7.967 -9.605 10.375 1.00 0.00 C ATOM 719 CD1 LEU A 55 -8.042 -9.299 11.861 1.00 0.00 C ATOM 720 CD2 LEU A 55 -9.171 -9.013 9.658 1.00 0.00 C ATOM 0 H LEU A 55 -4.311 -9.250 8.265 1.00 0.00 H new ATOM 0 HA LEU A 55 -7.097 -10.209 8.029 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.832 -9.423 10.395 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -6.669 -7.976 9.869 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.980 -10.686 10.235 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -8.975 -9.690 12.266 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.200 -9.767 12.372 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -8.004 -8.220 12.013 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -10.087 -9.413 10.094 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -9.161 -7.928 9.765 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -9.129 -9.273 8.600 1.00 0.00 H new ATOM 732 N LEU A 56 -6.389 -8.414 6.125 1.00 0.00 N ATOM 733 CA LEU A 56 -6.590 -7.334 5.177 1.00 0.00 C ATOM 734 C LEU A 56 -8.062 -7.182 4.865 1.00 0.00 C ATOM 735 O LEU A 56 -8.651 -7.976 4.132 1.00 0.00 O ATOM 736 CB LEU A 56 -5.806 -7.542 3.886 1.00 0.00 C ATOM 737 CG LEU A 56 -5.410 -6.247 3.167 1.00 0.00 C ATOM 738 CD1 LEU A 56 -3.965 -6.308 2.699 1.00 0.00 C ATOM 739 CD2 LEU A 56 -6.340 -5.980 1.991 1.00 0.00 C ATOM 0 H LEU A 56 -6.098 -9.299 5.710 1.00 0.00 H new ATOM 0 HA LEU A 56 -6.216 -6.423 5.644 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -4.902 -8.108 4.112 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -6.403 -8.151 3.207 1.00 0.00 H new ATOM 0 HG LEU A 56 -5.505 -5.424 3.876 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -3.707 -5.378 2.192 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.310 -6.446 3.559 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -3.841 -7.144 2.010 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -6.042 -5.057 1.494 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -6.280 -6.808 1.285 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -7.364 -5.884 2.352 1.00 0.00 H new ATOM 751 N ASN A 57 -8.641 -6.174 5.463 1.00 0.00 N ATOM 752 CA ASN A 57 -10.018 -5.810 5.218 1.00 0.00 C ATOM 753 C ASN A 57 -10.080 -4.812 4.070 1.00 0.00 C ATOM 754 O ASN A 57 -9.046 -4.319 3.614 1.00 0.00 O ATOM 755 CB ASN A 57 -10.633 -5.222 6.485 1.00 0.00 C ATOM 756 CG ASN A 57 -9.693 -4.249 7.156 1.00 0.00 C ATOM 757 OD1 ASN A 57 -8.795 -4.635 7.909 1.00 0.00 O ATOM 758 ND2 ASN A 57 -9.883 -2.981 6.888 1.00 0.00 N ATOM 0 H ASN A 57 -8.169 -5.575 6.140 1.00 0.00 H new ATOM 0 HA ASN A 57 -10.590 -6.696 4.942 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -11.566 -4.716 6.237 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -10.881 -6.026 7.178 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -9.278 -2.275 7.307 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -10.636 -2.700 6.260 1.00 0.00 H new ATOM 765 N GLY A 58 -11.280 -4.515 3.609 1.00 0.00 N ATOM 766 CA GLY A 58 -11.433 -3.670 2.442 1.00 0.00 C ATOM 767 C GLY A 58 -11.637 -2.203 2.788 1.00 0.00 C ATOM 768 O GLY A 58 -11.319 -1.760 3.897 1.00 0.00 O ATOM 0 H GLY A 58 -12.154 -4.843 4.020 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -10.549 -3.769 1.811 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -12.283 -4.020 1.856 1.00 0.00 H new ATOM 772 N LEU A 59 -12.181 -1.460 1.833 1.00 0.00 N ATOM 773 CA LEU A 59 -12.411 -0.030 1.988 1.00 0.00 C ATOM 774 C LEU A 59 -13.491 0.258 3.029 1.00 0.00 C ATOM 775 O LEU A 59 -14.302 -0.615 3.350 1.00 0.00 O ATOM 776 CB LEU A 59 -12.823 0.577 0.645 1.00 0.00 C ATOM 777 CG LEU A 59 -11.808 1.528 0.000 1.00 0.00 C ATOM 778 CD1 LEU A 59 -12.518 2.509 -0.921 1.00 0.00 C ATOM 779 CD2 LEU A 59 -11.013 2.277 1.058 1.00 0.00 C ATOM 0 H LEU A 59 -12.475 -1.832 0.930 1.00 0.00 H new ATOM 0 HA LEU A 59 -11.480 0.421 2.332 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -13.024 -0.236 -0.053 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -13.760 1.117 0.784 1.00 0.00 H new ATOM 0 HG LEU A 59 -11.110 0.932 -0.589 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -11.786 3.179 -1.373 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -13.040 1.960 -1.705 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -13.237 3.092 -0.346 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -10.301 2.944 0.573 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -11.693 2.861 1.678 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -10.475 1.563 1.682 1.00 0.00 H new ATOM 791 N SER A 60 -13.475 1.487 3.548 1.00 0.00 N ATOM 792 CA SER A 60 -14.434 1.963 4.536 1.00 0.00 C ATOM 793 C SER A 60 -15.876 1.796 4.058 1.00 0.00 C ATOM 794 O SER A 60 -16.453 2.701 3.452 1.00 0.00 O ATOM 795 CB SER A 60 -14.141 3.434 4.848 1.00 0.00 C ATOM 796 OG SER A 60 -13.547 4.084 3.727 1.00 0.00 O ATOM 0 H SER A 60 -12.782 2.188 3.287 1.00 0.00 H new ATOM 0 HA SER A 60 -14.326 1.362 5.439 1.00 0.00 H new ATOM 0 HB2 SER A 60 -15.065 3.943 5.121 1.00 0.00 H new ATOM 0 HB3 SER A 60 -13.474 3.502 5.708 1.00 0.00 H new ATOM 0 HG SER A 60 -13.370 5.022 3.949 1.00 0.00 H new ATOM 802 N GLY A 61 -16.439 0.621 4.317 1.00 0.00 N ATOM 803 CA GLY A 61 -17.816 0.351 3.950 1.00 0.00 C ATOM 804 C GLY A 61 -17.956 -0.093 2.506 1.00 0.00 C ATOM 805 O GLY A 61 -19.068 -0.224 1.998 1.00 0.00 O ATOM 0 H GLY A 61 -15.962 -0.154 4.778 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -18.218 -0.422 4.605 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -18.414 1.248 4.111 1.00 0.00 H new ATOM 809 N ASN A 62 -16.830 -0.333 1.839 1.00 0.00 N ATOM 810 CA ASN A 62 -16.854 -0.738 0.438 1.00 0.00 C ATOM 811 C ASN A 62 -16.194 -2.094 0.238 1.00 0.00 C ATOM 812 O ASN A 62 -14.969 -2.208 0.237 1.00 0.00 O ATOM 813 CB ASN A 62 -16.157 0.305 -0.439 1.00 0.00 C ATOM 814 CG ASN A 62 -16.628 0.246 -1.878 1.00 0.00 C ATOM 815 OD1 ASN A 62 -17.825 0.320 -2.154 1.00 0.00 O ATOM 816 ND2 ASN A 62 -15.696 0.113 -2.806 1.00 0.00 N ATOM 0 H ASN A 62 -15.897 -0.255 2.243 1.00 0.00 H new ATOM 0 HA ASN A 62 -17.900 -0.816 0.142 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -16.345 1.300 -0.037 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -15.079 0.146 -0.404 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -15.959 0.068 -3.790 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -14.714 0.055 -2.538 1.00 0.00 H new ATOM 823 N THR A 63 -17.015 -3.117 0.081 1.00 0.00 N ATOM 824 CA THR A 63 -16.525 -4.452 -0.203 1.00 0.00 C ATOM 825 C THR A 63 -16.073 -4.558 -1.659 1.00 0.00 C ATOM 826 O THR A 63 -16.895 -4.624 -2.571 1.00 0.00 O ATOM 827 CB THR A 63 -17.620 -5.499 0.081 1.00 0.00 C ATOM 828 OG1 THR A 63 -18.586 -4.950 0.995 1.00 0.00 O ATOM 829 CG2 THR A 63 -17.019 -6.766 0.670 1.00 0.00 C ATOM 0 H THR A 63 -18.030 -3.047 0.146 1.00 0.00 H new ATOM 0 HA THR A 63 -15.672 -4.647 0.446 1.00 0.00 H new ATOM 0 HB THR A 63 -18.107 -5.755 -0.860 1.00 0.00 H new ATOM 0 HG1 THR A 63 -19.305 -4.516 0.490 1.00 0.00 H new ATOM 0 HG21 THR A 63 -17.811 -7.490 0.862 1.00 0.00 H new ATOM 0 HG22 THR A 63 -16.303 -7.190 -0.034 1.00 0.00 H new ATOM 0 HG23 THR A 63 -16.512 -6.528 1.605 1.00 0.00 H new ATOM 837 N GLY A 64 -14.767 -4.553 -1.876 1.00 0.00 N ATOM 838 CA GLY A 64 -14.242 -4.648 -3.221 1.00 0.00 C ATOM 839 C GLY A 64 -12.839 -4.092 -3.327 1.00 0.00 C ATOM 840 O GLY A 64 -11.901 -4.817 -3.663 1.00 0.00 O ATOM 0 H GLY A 64 -14.061 -4.485 -1.143 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -14.242 -5.691 -3.537 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -14.898 -4.108 -3.904 1.00 0.00 H new ATOM 844 N SER A 65 -12.690 -2.807 -3.032 1.00 0.00 N ATOM 845 CA SER A 65 -11.394 -2.155 -3.066 1.00 0.00 C ATOM 846 C SER A 65 -10.587 -2.531 -1.830 1.00 0.00 C ATOM 847 O SER A 65 -11.012 -2.291 -0.701 1.00 0.00 O ATOM 848 CB SER A 65 -11.578 -0.638 -3.146 1.00 0.00 C ATOM 849 OG SER A 65 -12.937 -0.307 -3.408 1.00 0.00 O ATOM 0 H SER A 65 -13.460 -2.194 -2.765 1.00 0.00 H new ATOM 0 HA SER A 65 -10.848 -2.488 -3.949 1.00 0.00 H new ATOM 0 HB2 SER A 65 -11.261 -0.179 -2.210 1.00 0.00 H new ATOM 0 HB3 SER A 65 -10.942 -0.231 -3.932 1.00 0.00 H new ATOM 0 HG SER A 65 -13.033 0.667 -3.454 1.00 0.00 H new ATOM 855 N ALA A 66 -9.440 -3.145 -2.052 1.00 0.00 N ATOM 856 CA ALA A 66 -8.589 -3.576 -0.963 1.00 0.00 C ATOM 857 C ALA A 66 -7.287 -2.799 -0.977 1.00 0.00 C ATOM 858 O ALA A 66 -6.685 -2.601 -2.035 1.00 0.00 O ATOM 859 CB ALA A 66 -8.321 -5.072 -1.058 1.00 0.00 C ATOM 0 H ALA A 66 -9.077 -3.356 -2.981 1.00 0.00 H new ATOM 0 HA ALA A 66 -9.100 -3.379 -0.021 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -7.680 -5.380 -0.232 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -9.265 -5.615 -1.006 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -7.826 -5.294 -2.004 1.00 0.00 H new ATOM 865 N CYS A 67 -6.855 -2.355 0.188 1.00 0.00 N ATOM 866 CA CYS A 67 -5.626 -1.591 0.292 1.00 0.00 C ATOM 867 C CYS A 67 -4.611 -2.363 1.120 1.00 0.00 C ATOM 868 O CYS A 67 -4.934 -2.863 2.198 1.00 0.00 O ATOM 869 CB CYS A 67 -5.885 -0.208 0.910 1.00 0.00 C ATOM 870 SG CYS A 67 -7.616 0.371 0.809 1.00 0.00 S ATOM 0 H CYS A 67 -7.336 -2.510 1.074 1.00 0.00 H new ATOM 0 HA CYS A 67 -5.227 -1.437 -0.711 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -5.587 -0.233 1.958 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -5.244 0.521 0.414 1.00 0.00 H new ATOM 875 N ALA A 68 -3.387 -2.458 0.623 1.00 0.00 N ATOM 876 CA ALA A 68 -2.361 -3.225 1.307 1.00 0.00 C ATOM 877 C ALA A 68 -1.396 -2.298 2.014 1.00 0.00 C ATOM 878 O ALA A 68 -0.887 -1.344 1.427 1.00 0.00 O ATOM 879 CB ALA A 68 -1.621 -4.138 0.340 1.00 0.00 C ATOM 0 H ALA A 68 -3.083 -2.017 -0.245 1.00 0.00 H new ATOM 0 HA ALA A 68 -2.847 -3.855 2.052 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -0.859 -4.700 0.881 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -2.326 -4.831 -0.118 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -1.147 -3.538 -0.436 1.00 0.00 H new ATOM 885 N LYS A 69 -1.172 -2.580 3.286 1.00 0.00 N ATOM 886 CA LYS A 69 -0.321 -1.752 4.127 1.00 0.00 C ATOM 887 C LYS A 69 1.141 -1.994 3.798 1.00 0.00 C ATOM 888 O LYS A 69 1.473 -2.950 3.100 1.00 0.00 O ATOM 889 CB LYS A 69 -0.587 -2.042 5.611 1.00 0.00 C ATOM 890 CG LYS A 69 -1.444 -3.278 5.853 1.00 0.00 C ATOM 891 CD LYS A 69 -2.927 -2.939 5.880 1.00 0.00 C ATOM 892 CE LYS A 69 -3.773 -4.046 5.273 1.00 0.00 C ATOM 893 NZ LYS A 69 -4.894 -4.451 6.161 1.00 0.00 N ATOM 0 H LYS A 69 -1.573 -3.386 3.765 1.00 0.00 H new ATOM 0 HA LYS A 69 -0.555 -0.706 3.931 1.00 0.00 H new ATOM 0 HB2 LYS A 69 0.367 -2.167 6.124 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -1.078 -1.178 6.058 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -1.253 -4.012 5.070 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -1.159 -3.739 6.799 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -3.241 -2.765 6.909 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -3.097 -2.011 5.334 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -4.173 -3.711 4.316 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -3.143 -4.912 5.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -4.704 -5.396 6.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -4.985 -3.767 6.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -5.779 -4.473 5.615 1.00 0.00 H new ATOM 907 N ALA A 70 2.010 -1.135 4.311 1.00 0.00 N ATOM 908 CA ALA A 70 3.442 -1.241 4.053 1.00 0.00 C ATOM 909 C ALA A 70 3.996 -2.594 4.494 1.00 0.00 C ATOM 910 O ALA A 70 4.921 -3.121 3.882 1.00 0.00 O ATOM 911 CB ALA A 70 4.187 -0.118 4.745 1.00 0.00 C ATOM 0 H ALA A 70 1.748 -0.353 4.911 1.00 0.00 H new ATOM 0 HA ALA A 70 3.590 -1.157 2.976 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.254 -0.211 4.543 1.00 0.00 H new ATOM 0 HB2 ALA A 70 3.829 0.841 4.371 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.015 -0.175 5.820 1.00 0.00 H new ATOM 917 N SER A 71 3.410 -3.162 5.544 1.00 0.00 N ATOM 918 CA SER A 71 3.847 -4.448 6.056 1.00 0.00 C ATOM 919 C SER A 71 3.464 -5.542 5.075 1.00 0.00 C ATOM 920 O SER A 71 4.195 -6.509 4.882 1.00 0.00 O ATOM 921 CB SER A 71 3.205 -4.712 7.417 1.00 0.00 C ATOM 922 OG SER A 71 2.378 -3.626 7.805 1.00 0.00 O ATOM 0 H SER A 71 2.630 -2.748 6.055 1.00 0.00 H new ATOM 0 HA SER A 71 4.930 -4.440 6.176 1.00 0.00 H new ATOM 0 HB2 SER A 71 2.614 -5.627 7.374 1.00 0.00 H new ATOM 0 HB3 SER A 71 3.981 -4.869 8.166 1.00 0.00 H new ATOM 0 HG SER A 71 1.976 -3.817 8.678 1.00 0.00 H new ATOM 928 N LEU A 72 2.314 -5.365 4.442 1.00 0.00 N ATOM 929 CA LEU A 72 1.830 -6.314 3.458 1.00 0.00 C ATOM 930 C LEU A 72 2.577 -6.139 2.144 1.00 0.00 C ATOM 931 O LEU A 72 2.804 -7.103 1.409 1.00 0.00 O ATOM 932 CB LEU A 72 0.328 -6.125 3.242 1.00 0.00 C ATOM 933 CG LEU A 72 -0.492 -7.409 3.279 1.00 0.00 C ATOM 934 CD1 LEU A 72 0.057 -8.409 2.284 1.00 0.00 C ATOM 935 CD2 LEU A 72 -0.484 -7.999 4.675 1.00 0.00 C ATOM 0 H LEU A 72 1.697 -4.567 4.595 1.00 0.00 H new ATOM 0 HA LEU A 72 2.008 -7.324 3.827 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -0.052 -5.447 4.006 1.00 0.00 H new ATOM 0 HB3 LEU A 72 0.172 -5.639 2.279 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.521 -7.174 3.007 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -0.537 -9.322 2.320 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.012 -7.986 1.280 1.00 0.00 H new ATOM 0 HD13 LEU A 72 1.092 -8.640 2.534 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.074 -8.916 4.686 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.541 -8.224 4.969 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.914 -7.283 5.375 1.00 0.00 H new ATOM 947 N ILE A 73 2.962 -4.904 1.858 1.00 0.00 N ATOM 948 CA ILE A 73 3.742 -4.608 0.669 1.00 0.00 C ATOM 949 C ILE A 73 5.070 -5.364 0.726 1.00 0.00 C ATOM 950 O ILE A 73 5.547 -5.892 -0.280 1.00 0.00 O ATOM 951 CB ILE A 73 3.977 -3.083 0.513 1.00 0.00 C ATOM 952 CG1 ILE A 73 2.819 -2.458 -0.269 1.00 0.00 C ATOM 953 CG2 ILE A 73 5.302 -2.785 -0.186 1.00 0.00 C ATOM 954 CD1 ILE A 73 2.422 -1.085 0.219 1.00 0.00 C ATOM 0 H ILE A 73 2.746 -4.091 2.435 1.00 0.00 H new ATOM 0 HA ILE A 73 3.182 -4.938 -0.206 1.00 0.00 H new ATOM 0 HB ILE A 73 4.024 -2.646 1.511 1.00 0.00 H new ATOM 0 HG12 ILE A 73 3.097 -2.393 -1.321 1.00 0.00 H new ATOM 0 HG13 ILE A 73 1.954 -3.119 -0.208 1.00 0.00 H new ATOM 0 HG21 ILE A 73 5.431 -1.706 -0.277 1.00 0.00 H new ATOM 0 HG22 ILE A 73 6.123 -3.201 0.398 1.00 0.00 H new ATOM 0 HG23 ILE A 73 5.299 -3.235 -1.179 1.00 0.00 H new ATOM 0 HD11 ILE A 73 1.596 -0.709 -0.385 1.00 0.00 H new ATOM 0 HD12 ILE A 73 2.111 -1.145 1.262 1.00 0.00 H new ATOM 0 HD13 ILE A 73 3.272 -0.408 0.132 1.00 0.00 H new ATOM 966 N ASP A 74 5.634 -5.439 1.927 1.00 0.00 N ATOM 967 CA ASP A 74 6.878 -6.171 2.157 1.00 0.00 C ATOM 968 C ASP A 74 6.625 -7.679 2.216 1.00 0.00 C ATOM 969 O ASP A 74 7.512 -8.484 1.937 1.00 0.00 O ATOM 970 CB ASP A 74 7.527 -5.691 3.462 1.00 0.00 C ATOM 971 CG ASP A 74 8.793 -6.445 3.808 1.00 0.00 C ATOM 972 OD1 ASP A 74 9.880 -6.043 3.336 1.00 0.00 O ATOM 973 OD2 ASP A 74 8.713 -7.428 4.573 1.00 0.00 O ATOM 0 H ASP A 74 5.247 -4.999 2.762 1.00 0.00 H new ATOM 0 HA ASP A 74 7.554 -5.975 1.324 1.00 0.00 H new ATOM 0 HB2 ASP A 74 7.756 -4.629 3.378 1.00 0.00 H new ATOM 0 HB3 ASP A 74 6.812 -5.800 4.278 1.00 0.00 H new ATOM 978 N GLN A 75 5.399 -8.056 2.559 1.00 0.00 N ATOM 979 CA GLN A 75 5.054 -9.459 2.748 1.00 0.00 C ATOM 980 C GLN A 75 4.873 -10.188 1.422 1.00 0.00 C ATOM 981 O GLN A 75 5.495 -11.223 1.185 1.00 0.00 O ATOM 982 CB GLN A 75 3.775 -9.586 3.574 1.00 0.00 C ATOM 983 CG GLN A 75 3.931 -10.465 4.803 1.00 0.00 C ATOM 984 CD GLN A 75 4.426 -9.691 6.009 1.00 0.00 C ATOM 985 OE1 GLN A 75 3.865 -9.789 7.101 1.00 0.00 O ATOM 986 NE2 GLN A 75 5.478 -8.912 5.824 1.00 0.00 N ATOM 0 H GLN A 75 4.626 -7.408 2.712 1.00 0.00 H new ATOM 0 HA GLN A 75 5.885 -9.923 3.279 1.00 0.00 H new ATOM 0 HB2 GLN A 75 3.454 -8.592 3.886 1.00 0.00 H new ATOM 0 HB3 GLN A 75 2.984 -9.993 2.944 1.00 0.00 H new ATOM 0 HG2 GLN A 75 2.973 -10.927 5.040 1.00 0.00 H new ATOM 0 HG3 GLN A 75 4.628 -11.273 4.582 1.00 0.00 H new ATOM 0 HE21 GLN A 75 5.916 -8.857 4.905 1.00 0.00 H new ATOM 0 HE22 GLN A 75 5.851 -8.366 6.601 1.00 0.00 H new ATOM 995 N LEU A 76 4.022 -9.653 0.559 1.00 0.00 N ATOM 996 CA LEU A 76 3.664 -10.352 -0.668 1.00 0.00 C ATOM 997 C LEU A 76 4.086 -9.577 -1.914 1.00 0.00 C ATOM 998 O LEU A 76 4.273 -10.164 -2.979 1.00 0.00 O ATOM 999 CB LEU A 76 2.161 -10.619 -0.703 1.00 0.00 C ATOM 1000 CG LEU A 76 1.721 -11.974 -0.129 1.00 0.00 C ATOM 1001 CD1 LEU A 76 2.663 -13.086 -0.573 1.00 0.00 C ATOM 1002 CD2 LEU A 76 1.647 -11.919 1.388 1.00 0.00 C ATOM 0 H LEU A 76 3.570 -8.747 0.682 1.00 0.00 H new ATOM 0 HA LEU A 76 4.203 -11.299 -0.672 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.655 -9.827 -0.150 1.00 0.00 H new ATOM 0 HB3 LEU A 76 1.821 -10.553 -1.737 1.00 0.00 H new ATOM 0 HG LEU A 76 0.726 -12.193 -0.516 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.329 -14.035 -0.153 1.00 0.00 H new ATOM 0 HD12 LEU A 76 2.662 -13.151 -1.661 1.00 0.00 H new ATOM 0 HD13 LEU A 76 3.672 -12.869 -0.223 1.00 0.00 H new ATOM 0 HD21 LEU A 76 1.333 -12.890 1.772 1.00 0.00 H new ATOM 0 HD22 LEU A 76 2.628 -11.669 1.791 1.00 0.00 H new ATOM 0 HD23 LEU A 76 0.926 -11.159 1.690 1.00 0.00 H new ATOM 1014 N GLY A 77 4.226 -8.266 -1.787 1.00 0.00 N ATOM 1015 CA GLY A 77 4.662 -7.468 -2.923 1.00 0.00 C ATOM 1016 C GLY A 77 3.550 -7.239 -3.928 1.00 0.00 C ATOM 1017 O GLY A 77 3.713 -7.492 -5.124 1.00 0.00 O ATOM 0 H GLY A 77 4.049 -7.742 -0.930 1.00 0.00 H new ATOM 0 HA2 GLY A 77 5.031 -6.506 -2.568 1.00 0.00 H new ATOM 0 HA3 GLY A 77 5.496 -7.967 -3.416 1.00 0.00 H new ATOM 1021 N LEU A 78 2.409 -6.786 -3.435 1.00 0.00 N ATOM 1022 CA LEU A 78 1.252 -6.523 -4.276 1.00 0.00 C ATOM 1023 C LEU A 78 1.447 -5.242 -5.076 1.00 0.00 C ATOM 1024 O LEU A 78 1.117 -4.150 -4.613 1.00 0.00 O ATOM 1025 CB LEU A 78 -0.010 -6.413 -3.421 1.00 0.00 C ATOM 1026 CG LEU A 78 -0.237 -7.566 -2.448 1.00 0.00 C ATOM 1027 CD1 LEU A 78 0.145 -7.153 -1.041 1.00 0.00 C ATOM 1028 CD2 LEU A 78 -1.684 -8.014 -2.496 1.00 0.00 C ATOM 0 H LEU A 78 2.259 -6.591 -2.445 1.00 0.00 H new ATOM 0 HA LEU A 78 1.141 -7.355 -4.972 1.00 0.00 H new ATOM 0 HB2 LEU A 78 0.034 -5.483 -2.854 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -0.873 -6.342 -4.083 1.00 0.00 H new ATOM 0 HG LEU A 78 0.396 -8.403 -2.744 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.023 -7.987 -0.359 1.00 0.00 H new ATOM 0 HD12 LEU A 78 1.198 -6.871 -1.018 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -0.465 -6.304 -0.733 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -1.833 -8.837 -1.797 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -2.332 -7.182 -2.220 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -1.929 -8.346 -3.505 1.00 0.00 H new ATOM 1040 N LEU A 79 1.967 -5.386 -6.289 1.00 0.00 N ATOM 1041 CA LEU A 79 2.254 -4.241 -7.152 1.00 0.00 C ATOM 1042 C LEU A 79 0.987 -3.693 -7.803 1.00 0.00 C ATOM 1043 O LEU A 79 1.053 -2.809 -8.651 1.00 0.00 O ATOM 1044 CB LEU A 79 3.263 -4.624 -8.240 1.00 0.00 C ATOM 1045 CG LEU A 79 3.899 -6.005 -8.089 1.00 0.00 C ATOM 1046 CD1 LEU A 79 3.256 -6.993 -9.049 1.00 0.00 C ATOM 1047 CD2 LEU A 79 5.397 -5.928 -8.325 1.00 0.00 C ATOM 0 H LEU A 79 2.201 -6.289 -6.701 1.00 0.00 H new ATOM 0 HA LEU A 79 2.680 -3.462 -6.520 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.763 -4.577 -9.208 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.057 -3.877 -8.254 1.00 0.00 H new ATOM 0 HG LEU A 79 3.730 -6.355 -7.071 1.00 0.00 H new ATOM 0 HD11 LEU A 79 3.720 -7.972 -8.929 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.190 -7.068 -8.834 1.00 0.00 H new ATOM 0 HD13 LEU A 79 3.396 -6.648 -10.074 1.00 0.00 H new ATOM 0 HD21 LEU A 79 5.834 -6.920 -8.214 1.00 0.00 H new ATOM 0 HD22 LEU A 79 5.588 -5.558 -9.332 1.00 0.00 H new ATOM 0 HD23 LEU A 79 5.845 -5.250 -7.599 1.00 0.00 H new ATOM 1059 N ALA A 80 -0.164 -4.218 -7.407 1.00 0.00 N ATOM 1060 CA ALA A 80 -1.439 -3.742 -7.931 1.00 0.00 C ATOM 1061 C ALA A 80 -1.701 -2.314 -7.472 1.00 0.00 C ATOM 1062 O ALA A 80 -2.067 -1.445 -8.265 1.00 0.00 O ATOM 1063 CB ALA A 80 -2.569 -4.664 -7.489 1.00 0.00 C ATOM 0 H ALA A 80 -0.242 -4.973 -6.725 1.00 0.00 H new ATOM 0 HA ALA A 80 -1.394 -3.749 -9.020 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.515 -4.297 -7.887 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -2.384 -5.671 -7.863 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -2.617 -4.684 -6.400 1.00 0.00 H new ATOM 1069 N LEU A 81 -1.456 -2.066 -6.193 1.00 0.00 N ATOM 1070 CA LEU A 81 -1.726 -0.765 -5.602 1.00 0.00 C ATOM 1071 C LEU A 81 -0.484 0.110 -5.607 1.00 0.00 C ATOM 1072 O LEU A 81 -0.504 1.238 -5.111 1.00 0.00 O ATOM 1073 CB LEU A 81 -2.231 -0.915 -4.170 1.00 0.00 C ATOM 1074 CG LEU A 81 -1.918 -2.252 -3.506 1.00 0.00 C ATOM 1075 CD1 LEU A 81 -1.147 -2.030 -2.215 1.00 0.00 C ATOM 1076 CD2 LEU A 81 -3.203 -3.012 -3.247 1.00 0.00 C ATOM 0 H LEU A 81 -1.070 -2.751 -5.544 1.00 0.00 H new ATOM 0 HA LEU A 81 -2.496 -0.287 -6.208 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -1.800 -0.118 -3.565 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -3.311 -0.770 -4.166 1.00 0.00 H new ATOM 0 HG LEU A 81 -1.295 -2.847 -4.174 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -0.930 -2.992 -1.751 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.212 -1.513 -2.434 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -1.745 -1.425 -1.533 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.972 -3.966 -2.773 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -3.846 -2.426 -2.590 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -3.716 -3.191 -4.192 1.00 0.00 H new ATOM 1088 N VAL A 82 0.593 -0.404 -6.180 1.00 0.00 N ATOM 1089 CA VAL A 82 1.859 0.306 -6.186 1.00 0.00 C ATOM 1090 C VAL A 82 2.264 0.678 -7.605 1.00 0.00 C ATOM 1091 O VAL A 82 2.104 -0.106 -8.541 1.00 0.00 O ATOM 1092 CB VAL A 82 2.978 -0.540 -5.537 1.00 0.00 C ATOM 1093 CG1 VAL A 82 4.233 0.291 -5.322 1.00 0.00 C ATOM 1094 CG2 VAL A 82 2.506 -1.138 -4.220 1.00 0.00 C ATOM 0 H VAL A 82 0.614 -1.311 -6.647 1.00 0.00 H new ATOM 0 HA VAL A 82 1.724 1.216 -5.602 1.00 0.00 H new ATOM 0 HB VAL A 82 3.221 -1.355 -6.219 1.00 0.00 H new ATOM 0 HG11 VAL A 82 5.005 -0.328 -4.864 1.00 0.00 H new ATOM 0 HG12 VAL A 82 4.590 0.666 -6.281 1.00 0.00 H new ATOM 0 HG13 VAL A 82 4.005 1.131 -4.666 1.00 0.00 H new ATOM 0 HG21 VAL A 82 3.309 -1.729 -3.780 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.229 -0.337 -3.535 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.641 -1.777 -4.400 1.00 0.00 H new ATOM 1104 N ASP A 83 2.769 1.887 -7.755 1.00 0.00 N ATOM 1105 CA ASP A 83 3.298 2.351 -9.026 1.00 0.00 C ATOM 1106 C ASP A 83 4.691 2.918 -8.799 1.00 0.00 C ATOM 1107 O ASP A 83 5.072 3.174 -7.659 1.00 0.00 O ATOM 1108 CB ASP A 83 2.375 3.407 -9.641 1.00 0.00 C ATOM 1109 CG ASP A 83 2.592 3.574 -11.133 1.00 0.00 C ATOM 1110 OD1 ASP A 83 3.289 2.733 -11.739 1.00 0.00 O ATOM 1111 OD2 ASP A 83 2.055 4.538 -11.713 1.00 0.00 O ATOM 0 H ASP A 83 2.825 2.574 -7.003 1.00 0.00 H new ATOM 0 HA ASP A 83 3.355 1.517 -9.725 1.00 0.00 H new ATOM 0 HB2 ASP A 83 1.337 3.128 -9.458 1.00 0.00 H new ATOM 0 HB3 ASP A 83 2.541 4.363 -9.144 1.00 0.00 H new ATOM 1116 N HIS A 84 5.454 3.104 -9.858 1.00 0.00 N ATOM 1117 CA HIS A 84 6.822 3.574 -9.711 1.00 0.00 C ATOM 1118 C HIS A 84 6.981 4.996 -10.224 1.00 0.00 C ATOM 1119 O HIS A 84 6.467 5.350 -11.285 1.00 0.00 O ATOM 1120 CB HIS A 84 7.794 2.645 -10.438 1.00 0.00 C ATOM 1121 CG HIS A 84 9.041 2.384 -9.653 1.00 0.00 C ATOM 1122 ND1 HIS A 84 10.016 3.340 -9.439 1.00 0.00 N ATOM 1123 CD2 HIS A 84 9.465 1.269 -9.018 1.00 0.00 C ATOM 1124 CE1 HIS A 84 10.973 2.825 -8.693 1.00 0.00 C ATOM 1125 NE2 HIS A 84 10.669 1.568 -8.426 1.00 0.00 N ATOM 0 H HIS A 84 5.157 2.940 -10.820 1.00 0.00 H new ATOM 0 HA HIS A 84 7.055 3.569 -8.646 1.00 0.00 H new ATOM 0 HB2 HIS A 84 7.297 1.698 -10.648 1.00 0.00 H new ATOM 0 HB3 HIS A 84 8.060 3.085 -11.399 1.00 0.00 H new ATOM 0 HD1 HIS A 84 9.998 4.293 -9.801 1.00 0.00 H new ATOM 0 HD2 HIS A 84 8.953 0.319 -8.982 1.00 0.00 H new ATOM 0 HE1 HIS A 84 11.858 3.344 -8.356 1.00 0.00 H new ATOM 1134 N THR A 85 7.688 5.810 -9.457 1.00 0.00 N ATOM 1135 CA THR A 85 7.991 7.173 -9.855 1.00 0.00 C ATOM 1136 C THR A 85 9.496 7.385 -9.912 1.00 0.00 C ATOM 1137 O THR A 85 10.263 6.419 -9.836 1.00 0.00 O ATOM 1138 CB THR A 85 7.387 8.184 -8.868 1.00 0.00 C ATOM 1139 OG1 THR A 85 7.500 7.678 -7.529 1.00 0.00 O ATOM 1140 CG2 THR A 85 5.928 8.455 -9.199 1.00 0.00 C ATOM 0 H THR A 85 8.065 5.546 -8.547 1.00 0.00 H new ATOM 0 HA THR A 85 7.556 7.332 -10.842 1.00 0.00 H new ATOM 0 HB THR A 85 7.937 9.122 -8.950 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.952 8.341 -6.966 1.00 0.00 H new ATOM 0 HG21 THR A 85 5.521 9.173 -8.487 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.853 8.861 -10.208 1.00 0.00 H new ATOM 0 HG23 THR A 85 5.363 7.525 -9.139 1.00 0.00 H new ATOM 1148 N GLU A 86 9.903 8.640 -10.052 1.00 0.00 N ATOM 1149 CA GLU A 86 11.306 9.015 -10.003 1.00 0.00 C ATOM 1150 C GLU A 86 11.857 8.787 -8.598 1.00 0.00 C ATOM 1151 O GLU A 86 13.030 8.463 -8.421 1.00 0.00 O ATOM 1152 CB GLU A 86 11.481 10.493 -10.400 1.00 0.00 C ATOM 1153 CG GLU A 86 10.513 10.980 -11.474 1.00 0.00 C ATOM 1154 CD GLU A 86 9.214 11.529 -10.904 1.00 0.00 C ATOM 1155 OE1 GLU A 86 8.341 10.716 -10.538 1.00 0.00 O ATOM 1156 OE2 GLU A 86 9.057 12.766 -10.830 1.00 0.00 O ATOM 0 H GLU A 86 9.269 9.424 -10.203 1.00 0.00 H new ATOM 0 HA GLU A 86 11.857 8.395 -10.710 1.00 0.00 H new ATOM 0 HB2 GLU A 86 11.358 11.112 -9.511 1.00 0.00 H new ATOM 0 HB3 GLU A 86 12.501 10.642 -10.754 1.00 0.00 H new ATOM 0 HG2 GLU A 86 10.998 11.755 -12.067 1.00 0.00 H new ATOM 0 HG3 GLU A 86 10.286 10.156 -12.150 1.00 0.00 H new ATOM 1163 N GLU A 87 10.997 8.968 -7.605 1.00 0.00 N ATOM 1164 CA GLU A 87 11.362 8.739 -6.217 1.00 0.00 C ATOM 1165 C GLU A 87 11.485 7.249 -5.927 1.00 0.00 C ATOM 1166 O GLU A 87 12.515 6.783 -5.443 1.00 0.00 O ATOM 1167 CB GLU A 87 10.320 9.360 -5.295 1.00 0.00 C ATOM 1168 CG GLU A 87 10.585 10.822 -4.992 1.00 0.00 C ATOM 1169 CD GLU A 87 9.510 11.726 -5.549 1.00 0.00 C ATOM 1170 OE1 GLU A 87 9.245 11.666 -6.764 1.00 0.00 O ATOM 1171 OE2 GLU A 87 8.915 12.496 -4.768 1.00 0.00 O ATOM 0 H GLU A 87 10.034 9.276 -7.739 1.00 0.00 H new ATOM 0 HA GLU A 87 12.330 9.207 -6.036 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.336 9.263 -5.753 1.00 0.00 H new ATOM 0 HB3 GLU A 87 10.293 8.801 -4.360 1.00 0.00 H new ATOM 0 HG2 GLU A 87 10.651 10.961 -3.913 1.00 0.00 H new ATOM 0 HG3 GLU A 87 11.550 11.108 -5.410 1.00 0.00 H new ATOM 1178 N GLY A 88 10.432 6.502 -6.222 1.00 0.00 N ATOM 1179 CA GLY A 88 10.454 5.078 -5.967 1.00 0.00 C ATOM 1180 C GLY A 88 9.080 4.456 -6.055 1.00 0.00 C ATOM 1181 O GLY A 88 8.226 4.939 -6.800 1.00 0.00 O ATOM 0 H GLY A 88 9.567 6.855 -6.631 1.00 0.00 H new ATOM 0 HA2 GLY A 88 11.116 4.593 -6.685 1.00 0.00 H new ATOM 0 HA3 GLY A 88 10.870 4.895 -4.976 1.00 0.00 H new ATOM 1185 N PRO A 89 8.844 3.355 -5.325 1.00 0.00 N ATOM 1186 CA PRO A 89 7.527 2.722 -5.240 1.00 0.00 C ATOM 1187 C PRO A 89 6.553 3.589 -4.447 1.00 0.00 C ATOM 1188 O PRO A 89 6.798 3.899 -3.280 1.00 0.00 O ATOM 1189 CB PRO A 89 7.791 1.404 -4.493 1.00 0.00 C ATOM 1190 CG PRO A 89 9.275 1.243 -4.464 1.00 0.00 C ATOM 1191 CD PRO A 89 9.845 2.635 -4.529 1.00 0.00 C ATOM 0 HA PRO A 89 7.078 2.573 -6.222 1.00 0.00 H new ATOM 0 HB2 PRO A 89 7.382 1.438 -3.483 1.00 0.00 H new ATOM 0 HB3 PRO A 89 7.316 0.565 -5.001 1.00 0.00 H new ATOM 0 HG2 PRO A 89 9.594 0.733 -3.555 1.00 0.00 H new ATOM 0 HG3 PRO A 89 9.619 0.641 -5.305 1.00 0.00 H new ATOM 0 HD2 PRO A 89 9.964 3.071 -3.537 1.00 0.00 H new ATOM 0 HD3 PRO A 89 10.826 2.649 -5.003 1.00 0.00 H new ATOM 1199 N VAL A 90 5.462 3.979 -5.084 1.00 0.00 N ATOM 1200 CA VAL A 90 4.504 4.897 -4.486 1.00 0.00 C ATOM 1201 C VAL A 90 3.074 4.421 -4.713 1.00 0.00 C ATOM 1202 O VAL A 90 2.845 3.347 -5.270 1.00 0.00 O ATOM 1203 CB VAL A 90 4.654 6.311 -5.076 1.00 0.00 C ATOM 1204 CG1 VAL A 90 5.761 7.077 -4.360 1.00 0.00 C ATOM 1205 CG2 VAL A 90 4.926 6.242 -6.575 1.00 0.00 C ATOM 0 H VAL A 90 5.215 3.671 -6.025 1.00 0.00 H new ATOM 0 HA VAL A 90 4.711 4.925 -3.416 1.00 0.00 H new ATOM 0 HB VAL A 90 3.717 6.847 -4.925 1.00 0.00 H new ATOM 0 HG11 VAL A 90 5.851 8.074 -4.791 1.00 0.00 H new ATOM 0 HG12 VAL A 90 5.519 7.161 -3.301 1.00 0.00 H new ATOM 0 HG13 VAL A 90 6.705 6.545 -4.475 1.00 0.00 H new ATOM 0 HG21 VAL A 90 5.029 7.252 -6.973 1.00 0.00 H new ATOM 0 HG22 VAL A 90 5.847 5.686 -6.753 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.097 5.739 -7.072 1.00 0.00 H new ATOM 1215 N CYS A 91 2.113 5.236 -4.295 1.00 0.00 N ATOM 1216 CA CYS A 91 0.707 4.895 -4.439 1.00 0.00 C ATOM 1217 C CYS A 91 0.285 4.950 -5.899 1.00 0.00 C ATOM 1218 O CYS A 91 0.473 5.961 -6.572 1.00 0.00 O ATOM 1219 CB CYS A 91 -0.165 5.832 -3.602 1.00 0.00 C ATOM 1220 SG CYS A 91 -0.924 5.028 -2.154 1.00 0.00 S ATOM 0 H CYS A 91 2.284 6.139 -3.853 1.00 0.00 H new ATOM 0 HA CYS A 91 0.569 3.876 -4.077 1.00 0.00 H new ATOM 0 HB2 CYS A 91 0.441 6.672 -3.264 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -0.953 6.241 -4.234 1.00 0.00 H new ATOM 1225 N LYS A 92 -0.277 3.850 -6.380 1.00 0.00 N ATOM 1226 CA LYS A 92 -0.675 3.736 -7.771 1.00 0.00 C ATOM 1227 C LYS A 92 -1.854 4.641 -8.098 1.00 0.00 C ATOM 1228 O LYS A 92 -1.881 5.279 -9.151 1.00 0.00 O ATOM 1229 CB LYS A 92 -1.029 2.282 -8.082 1.00 0.00 C ATOM 1230 CG LYS A 92 -1.652 2.075 -9.448 1.00 0.00 C ATOM 1231 CD LYS A 92 -0.634 2.240 -10.558 1.00 0.00 C ATOM 1232 CE LYS A 92 -0.963 1.358 -11.750 1.00 0.00 C ATOM 1233 NZ LYS A 92 -1.181 -0.062 -11.356 1.00 0.00 N ATOM 0 H LYS A 92 -0.468 3.019 -5.820 1.00 0.00 H new ATOM 0 HA LYS A 92 0.164 4.055 -8.390 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.126 1.676 -8.011 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -1.718 1.916 -7.321 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -2.090 1.078 -9.501 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -2.464 2.788 -9.590 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -0.603 3.283 -10.873 1.00 0.00 H new ATOM 0 HD3 LYS A 92 0.359 1.991 -10.183 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -1.857 1.737 -12.245 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -0.151 1.412 -12.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.720 -0.689 -12.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -0.774 -0.227 -10.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -2.201 -0.263 -11.333 1.00 0.00 H new ATOM 1247 N ASN A 93 -2.828 4.709 -7.201 1.00 0.00 N ATOM 1248 CA ASN A 93 -4.061 5.418 -7.514 1.00 0.00 C ATOM 1249 C ASN A 93 -4.673 6.093 -6.294 1.00 0.00 C ATOM 1250 O ASN A 93 -4.783 7.318 -6.251 1.00 0.00 O ATOM 1251 CB ASN A 93 -5.072 4.460 -8.140 1.00 0.00 C ATOM 1252 CG ASN A 93 -5.381 4.815 -9.580 1.00 0.00 C ATOM 1253 OD1 ASN A 93 -5.962 5.863 -9.860 1.00 0.00 O ATOM 1254 ND2 ASN A 93 -4.993 3.944 -10.506 1.00 0.00 N ATOM 0 H ASN A 93 -2.792 4.292 -6.271 1.00 0.00 H new ATOM 0 HA ASN A 93 -3.806 6.204 -8.225 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -4.683 3.443 -8.094 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -5.993 4.476 -7.558 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -5.174 4.133 -11.492 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -4.514 3.087 -10.231 1.00 0.00 H new ATOM 1261 N ILE A 94 -5.072 5.303 -5.308 1.00 0.00 N ATOM 1262 CA ILE A 94 -5.804 5.835 -4.167 1.00 0.00 C ATOM 1263 C ILE A 94 -4.956 5.830 -2.901 1.00 0.00 C ATOM 1264 O ILE A 94 -4.460 4.785 -2.473 1.00 0.00 O ATOM 1265 CB ILE A 94 -7.102 5.038 -3.906 1.00 0.00 C ATOM 1266 CG1 ILE A 94 -7.679 4.493 -5.218 1.00 0.00 C ATOM 1267 CG2 ILE A 94 -8.124 5.911 -3.199 1.00 0.00 C ATOM 1268 CD1 ILE A 94 -8.809 3.505 -5.022 1.00 0.00 C ATOM 0 H ILE A 94 -4.903 4.298 -5.274 1.00 0.00 H new ATOM 0 HA ILE A 94 -6.059 6.864 -4.419 1.00 0.00 H new ATOM 0 HB ILE A 94 -6.861 4.192 -3.263 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -8.038 5.327 -5.821 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -6.881 4.011 -5.783 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -9.033 5.336 -3.022 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -7.717 6.249 -2.246 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -8.357 6.775 -3.821 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -9.166 3.163 -5.993 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -8.450 2.652 -4.446 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -9.625 3.988 -4.485 1.00 0.00 H new ATOM 1280 N VAL A 95 -4.786 7.007 -2.315 1.00 0.00 N ATOM 1281 CA VAL A 95 -4.080 7.138 -1.047 1.00 0.00 C ATOM 1282 C VAL A 95 -5.048 6.899 0.112 1.00 0.00 C ATOM 1283 O VAL A 95 -6.117 7.516 0.189 1.00 0.00 O ATOM 1284 CB VAL A 95 -3.393 8.525 -0.905 1.00 0.00 C ATOM 1285 CG1 VAL A 95 -4.202 9.616 -1.593 1.00 0.00 C ATOM 1286 CG2 VAL A 95 -3.156 8.883 0.556 1.00 0.00 C ATOM 0 H VAL A 95 -5.128 7.888 -2.699 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.292 6.385 -1.023 1.00 0.00 H new ATOM 0 HB VAL A 95 -2.424 8.455 -1.398 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -3.695 10.574 -1.476 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.298 9.384 -2.654 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -5.193 9.673 -1.143 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.674 9.859 0.618 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -4.110 8.915 1.082 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -2.514 8.131 1.015 1.00 0.00 H new ATOM 1296 N ALA A 96 -4.679 5.989 0.999 1.00 0.00 N ATOM 1297 CA ALA A 96 -5.540 5.616 2.107 1.00 0.00 C ATOM 1298 C ALA A 96 -4.709 5.089 3.267 1.00 0.00 C ATOM 1299 O ALA A 96 -3.634 4.532 3.064 1.00 0.00 O ATOM 1300 CB ALA A 96 -6.538 4.557 1.655 1.00 0.00 C ATOM 0 H ALA A 96 -3.787 5.495 0.972 1.00 0.00 H new ATOM 0 HA ALA A 96 -6.085 6.499 2.441 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -7.181 4.282 2.491 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -7.148 4.955 0.844 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -6.000 3.676 1.306 1.00 0.00 H new ATOM 1306 N CYS A 97 -5.220 5.235 4.475 1.00 0.00 N ATOM 1307 CA CYS A 97 -4.533 4.702 5.639 1.00 0.00 C ATOM 1308 C CYS A 97 -5.247 3.442 6.091 1.00 0.00 C ATOM 1309 O CYS A 97 -6.361 3.488 6.613 1.00 0.00 O ATOM 1310 CB CYS A 97 -4.484 5.732 6.772 1.00 0.00 C ATOM 1311 SG CYS A 97 -4.071 7.423 6.228 1.00 0.00 S ATOM 0 H CYS A 97 -6.099 5.713 4.676 1.00 0.00 H new ATOM 0 HA CYS A 97 -3.503 4.466 5.372 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -5.452 5.750 7.274 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -3.749 5.410 7.509 1.00 0.00 H new ATOM 1316 N CYS A 98 -4.601 2.315 5.852 1.00 0.00 N ATOM 1317 CA CYS A 98 -5.207 1.021 6.103 1.00 0.00 C ATOM 1318 C CYS A 98 -4.394 0.239 7.123 1.00 0.00 C ATOM 1319 O CYS A 98 -3.227 -0.070 6.890 1.00 0.00 O ATOM 1320 CB CYS A 98 -5.315 0.238 4.790 1.00 0.00 C ATOM 1321 SG CYS A 98 -6.077 -1.408 4.942 1.00 0.00 S ATOM 0 H CYS A 98 -3.651 2.271 5.482 1.00 0.00 H new ATOM 0 HA CYS A 98 -6.207 1.172 6.510 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -5.895 0.827 4.079 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -4.316 0.123 4.369 1.00 0.00 H new ATOM 1326 N PRO A 99 -4.998 -0.067 8.278 1.00 0.00 N ATOM 1327 CA PRO A 99 -4.373 -0.884 9.309 1.00 0.00 C ATOM 1328 C PRO A 99 -4.463 -2.369 8.990 1.00 0.00 C ATOM 1329 O PRO A 99 -5.347 -2.804 8.251 1.00 0.00 O ATOM 1330 CB PRO A 99 -5.195 -0.589 10.571 1.00 0.00 C ATOM 1331 CG PRO A 99 -6.247 0.391 10.178 1.00 0.00 C ATOM 1332 CD PRO A 99 -6.339 0.357 8.679 1.00 0.00 C ATOM 0 HA PRO A 99 -3.312 -0.653 9.408 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -5.644 -1.502 10.963 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -4.562 -0.182 11.359 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -7.204 0.131 10.629 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -5.992 1.392 10.526 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -7.103 -0.342 8.337 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -6.594 1.334 8.268 1.00 0.00 H new ATOM 1340 N GLU A 100 -3.537 -3.145 9.529 1.00 0.00 N ATOM 1341 CA GLU A 100 -3.620 -4.592 9.440 1.00 0.00 C ATOM 1342 C GLU A 100 -4.428 -5.120 10.615 1.00 0.00 C ATOM 1343 O GLU A 100 -3.928 -5.208 11.735 1.00 0.00 O ATOM 1344 CB GLU A 100 -2.225 -5.220 9.429 1.00 0.00 C ATOM 1345 CG GLU A 100 -1.944 -6.058 8.188 1.00 0.00 C ATOM 1346 CD GLU A 100 -3.075 -7.007 7.856 1.00 0.00 C ATOM 1347 OE1 GLU A 100 -3.222 -8.031 8.550 1.00 0.00 O ATOM 1348 OE2 GLU A 100 -3.827 -6.720 6.899 1.00 0.00 O ATOM 0 H GLU A 100 -2.721 -2.797 10.032 1.00 0.00 H new ATOM 0 HA GLU A 100 -4.114 -4.862 8.507 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -1.479 -4.429 9.500 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -2.110 -5.846 10.314 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -1.769 -5.396 7.340 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -1.028 -6.629 8.340 1.00 0.00 H new ATOM 1355 N GLY A 101 -5.688 -5.439 10.367 1.00 0.00 N ATOM 1356 CA GLY A 101 -6.543 -5.911 11.434 1.00 0.00 C ATOM 1357 C GLY A 101 -7.621 -4.915 11.796 1.00 0.00 C ATOM 1358 O GLY A 101 -7.605 -4.347 12.891 1.00 0.00 O ATOM 0 H GLY A 101 -6.132 -5.380 9.451 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -7.007 -6.851 11.135 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -5.937 -6.121 12.315 1.00 0.00 H new ATOM 1362 N THR A 102 -8.567 -4.707 10.896 1.00 0.00 N ATOM 1363 CA THR A 102 -9.629 -3.743 11.135 1.00 0.00 C ATOM 1364 C THR A 102 -10.935 -4.199 10.501 1.00 0.00 C ATOM 1365 O THR A 102 -11.011 -5.288 9.928 1.00 0.00 O ATOM 1366 CB THR A 102 -9.252 -2.357 10.574 1.00 0.00 C ATOM 1367 OG1 THR A 102 -8.144 -2.478 9.667 1.00 0.00 O ATOM 1368 CG2 THR A 102 -8.883 -1.403 11.694 1.00 0.00 C ATOM 0 H THR A 102 -8.622 -5.189 9.999 1.00 0.00 H new ATOM 0 HA THR A 102 -9.762 -3.670 12.214 1.00 0.00 H new ATOM 0 HB THR A 102 -10.118 -1.959 10.044 1.00 0.00 H new ATOM 0 HG1 THR A 102 -8.329 -3.189 9.018 1.00 0.00 H new ATOM 0 HG21 THR A 102 -8.621 -0.432 11.273 1.00 0.00 H new ATOM 0 HG22 THR A 102 -9.731 -1.289 12.369 1.00 0.00 H new ATOM 0 HG23 THR A 102 -8.031 -1.801 12.245 1.00 0.00 H new ATOM 1376 N THR A 103 -11.961 -3.370 10.620 1.00 0.00 N ATOM 1377 CA THR A 103 -13.219 -3.608 9.934 1.00 0.00 C ATOM 1378 C THR A 103 -13.112 -3.112 8.504 1.00 0.00 C ATOM 1379 O THR A 103 -13.471 -3.811 7.554 1.00 0.00 O ATOM 1380 CB THR A 103 -14.381 -2.895 10.650 1.00 0.00 C ATOM 1381 OG1 THR A 103 -14.321 -3.168 12.062 1.00 0.00 O ATOM 1382 CG2 THR A 103 -15.724 -3.343 10.091 1.00 0.00 C ATOM 0 H THR A 103 -11.945 -2.523 11.188 1.00 0.00 H new ATOM 0 HA THR A 103 -13.423 -4.679 9.940 1.00 0.00 H new ATOM 0 HB THR A 103 -14.284 -1.823 10.482 1.00 0.00 H new ATOM 0 HG1 THR A 103 -15.060 -2.712 12.515 1.00 0.00 H new ATOM 0 HG21 THR A 103 -16.527 -2.824 10.614 1.00 0.00 H new ATOM 0 HG22 THR A 103 -15.772 -3.108 9.028 1.00 0.00 H new ATOM 0 HG23 THR A 103 -15.836 -4.418 10.230 1.00 0.00 H new ATOM 1390 N ASN A 104 -12.608 -1.900 8.356 1.00 0.00 N ATOM 1391 CA ASN A 104 -12.335 -1.342 7.046 1.00 0.00 C ATOM 1392 C ASN A 104 -11.242 -0.288 7.143 1.00 0.00 C ATOM 1393 O ASN A 104 -10.923 0.190 8.234 1.00 0.00 O ATOM 1394 CB ASN A 104 -13.597 -0.747 6.421 1.00 0.00 C ATOM 1395 CG ASN A 104 -14.293 0.252 7.321 1.00 0.00 C ATOM 1396 OD1 ASN A 104 -13.745 1.298 7.659 1.00 0.00 O ATOM 1397 ND2 ASN A 104 -15.517 -0.059 7.698 1.00 0.00 N ATOM 0 H ASN A 104 -12.379 -1.281 9.133 1.00 0.00 H new ATOM 0 HA ASN A 104 -11.993 -2.150 6.399 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -13.335 -0.260 5.482 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -14.290 -1.553 6.179 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -16.045 0.580 8.293 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -15.936 -0.938 7.395 1.00 0.00 H new ATOM 1404 N CYS A 105 -10.668 0.055 6.007 1.00 0.00 N ATOM 1405 CA CYS A 105 -9.644 1.081 5.954 1.00 0.00 C ATOM 1406 C CYS A 105 -10.195 2.285 5.199 1.00 0.00 C ATOM 1407 O CYS A 105 -10.912 2.125 4.218 1.00 0.00 O ATOM 1408 CB CYS A 105 -8.401 0.536 5.251 1.00 0.00 C ATOM 1409 SG CYS A 105 -7.815 -1.054 5.921 1.00 0.00 S ATOM 0 H CYS A 105 -10.894 -0.363 5.105 1.00 0.00 H new ATOM 0 HA CYS A 105 -9.365 1.382 6.964 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -8.619 0.414 4.190 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -7.599 1.270 5.329 1.00 0.00 H new ATOM 1414 N VAL A 106 -9.857 3.483 5.639 1.00 0.00 N ATOM 1415 CA VAL A 106 -10.469 4.681 5.083 1.00 0.00 C ATOM 1416 C VAL A 106 -9.588 5.312 4.009 1.00 0.00 C ATOM 1417 O VAL A 106 -8.376 5.469 4.187 1.00 0.00 O ATOM 1418 CB VAL A 106 -10.820 5.715 6.194 1.00 0.00 C ATOM 1419 CG1 VAL A 106 -10.346 5.240 7.557 1.00 0.00 C ATOM 1420 CG2 VAL A 106 -10.265 7.105 5.892 1.00 0.00 C ATOM 0 H VAL A 106 -9.169 3.655 6.372 1.00 0.00 H new ATOM 0 HA VAL A 106 -11.402 4.374 4.611 1.00 0.00 H new ATOM 0 HB VAL A 106 -11.907 5.795 6.211 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -10.605 5.983 8.312 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -10.827 4.293 7.800 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -9.265 5.103 7.539 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -10.537 7.788 6.697 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -9.179 7.054 5.811 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -10.682 7.467 4.952 1.00 0.00 H new ATOM 1430 N ALA A 107 -10.213 5.635 2.881 1.00 0.00 N ATOM 1431 CA ALA A 107 -9.549 6.364 1.813 1.00 0.00 C ATOM 1432 C ALA A 107 -9.702 7.858 2.047 1.00 0.00 C ATOM 1433 O ALA A 107 -10.803 8.344 2.302 1.00 0.00 O ATOM 1434 CB ALA A 107 -10.117 5.969 0.457 1.00 0.00 C ATOM 0 H ALA A 107 -11.186 5.400 2.685 1.00 0.00 H new ATOM 0 HA ALA A 107 -8.489 6.111 1.815 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -9.606 6.526 -0.328 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -9.970 4.901 0.298 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -11.183 6.197 0.429 1.00 0.00 H new ATOM 1440 N VAL A 108 -8.600 8.582 1.964 1.00 0.00 N ATOM 1441 CA VAL A 108 -8.595 9.992 2.328 1.00 0.00 C ATOM 1442 C VAL A 108 -8.455 10.893 1.110 1.00 0.00 C ATOM 1443 O VAL A 108 -7.990 12.027 1.217 1.00 0.00 O ATOM 1444 CB VAL A 108 -7.460 10.312 3.322 1.00 0.00 C ATOM 1445 CG1 VAL A 108 -7.964 10.211 4.752 1.00 0.00 C ATOM 1446 CG2 VAL A 108 -6.273 9.387 3.099 1.00 0.00 C ATOM 0 H VAL A 108 -7.699 8.221 1.649 1.00 0.00 H new ATOM 0 HA VAL A 108 -9.557 10.189 2.802 1.00 0.00 H new ATOM 0 HB VAL A 108 -7.127 11.335 3.148 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.151 10.440 5.441 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -8.778 10.921 4.902 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -8.325 9.200 4.940 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -5.484 9.630 3.811 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -6.586 8.353 3.243 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -5.898 9.515 2.084 1.00 0.00 H new ATOM 1456 N ASP A 109 -8.865 10.395 -0.046 1.00 0.00 N ATOM 1457 CA ASP A 109 -8.784 11.181 -1.269 1.00 0.00 C ATOM 1458 C ASP A 109 -9.920 12.203 -1.325 1.00 0.00 C ATOM 1459 O ASP A 109 -9.662 13.402 -1.456 1.00 0.00 O ATOM 1460 CB ASP A 109 -8.775 10.270 -2.512 1.00 0.00 C ATOM 1461 CG ASP A 109 -10.117 9.631 -2.813 1.00 0.00 C ATOM 1462 OD1 ASP A 109 -10.706 9.013 -1.899 1.00 0.00 O ATOM 1463 OD2 ASP A 109 -10.593 9.749 -3.955 1.00 0.00 O ATOM 0 H ASP A 109 -9.254 9.459 -0.164 1.00 0.00 H new ATOM 0 HA ASP A 109 -7.843 11.730 -1.265 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -8.459 10.854 -3.376 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -8.033 9.484 -2.370 1.00 0.00 H new ATOM 1468 N ASN A 110 -11.162 11.718 -1.209 1.00 0.00 N ATOM 1469 CA ASN A 110 -12.370 12.556 -1.190 1.00 0.00 C ATOM 1470 C ASN A 110 -12.643 13.204 -2.546 1.00 0.00 C ATOM 1471 O ASN A 110 -13.740 13.095 -3.094 1.00 0.00 O ATOM 1472 CB ASN A 110 -12.288 13.624 -0.091 1.00 0.00 C ATOM 1473 CG ASN A 110 -12.921 13.155 1.205 1.00 0.00 C ATOM 1474 OD1 ASN A 110 -14.129 13.282 1.400 1.00 0.00 O ATOM 1475 ND2 ASN A 110 -12.106 12.608 2.098 1.00 0.00 N ATOM 0 H ASN A 110 -11.360 10.721 -1.125 1.00 0.00 H new ATOM 0 HA ASN A 110 -13.207 11.894 -0.968 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -11.244 13.881 0.088 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -12.786 14.532 -0.430 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -12.475 12.273 2.988 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -11.110 12.522 1.895 1.00 0.00 H new ATOM 1482 N ALA A 111 -11.641 13.872 -3.069 1.00 0.00 N ATOM 1483 CA ALA A 111 -11.723 14.531 -4.360 1.00 0.00 C ATOM 1484 C ALA A 111 -10.541 14.125 -5.227 1.00 0.00 C ATOM 1485 O ALA A 111 -10.696 13.407 -6.217 1.00 0.00 O ATOM 1486 CB ALA A 111 -11.766 16.045 -4.185 1.00 0.00 C ATOM 0 H ALA A 111 -10.736 13.977 -2.609 1.00 0.00 H new ATOM 0 HA ALA A 111 -12.643 14.220 -4.856 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -11.827 16.523 -5.163 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -12.639 16.318 -3.592 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -10.862 16.378 -3.675 1.00 0.00 H new ATOM 1492 N GLY A 112 -9.358 14.565 -4.828 1.00 0.00 N ATOM 1493 CA GLY A 112 -8.158 14.242 -5.571 1.00 0.00 C ATOM 1494 C GLY A 112 -6.956 15.024 -5.084 1.00 0.00 C ATOM 1495 O GLY A 112 -6.684 16.119 -5.571 1.00 0.00 O ATOM 0 H GLY A 112 -9.207 15.142 -4.000 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -7.955 13.175 -5.484 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -8.320 14.450 -6.629 1.00 0.00 H new ATOM 1499 N ALA A 113 -6.247 14.474 -4.111 1.00 0.00 N ATOM 1500 CA ALA A 113 -5.052 15.117 -3.582 1.00 0.00 C ATOM 1501 C ALA A 113 -3.865 14.866 -4.508 1.00 0.00 C ATOM 1502 O ALA A 113 -3.532 15.697 -5.351 1.00 0.00 O ATOM 1503 CB ALA A 113 -4.760 14.618 -2.174 1.00 0.00 C ATOM 0 H ALA A 113 -6.477 13.583 -3.671 1.00 0.00 H new ATOM 0 HA ALA A 113 -5.224 16.192 -3.530 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -3.864 15.108 -1.793 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -5.604 14.848 -1.524 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -4.602 13.540 -2.196 1.00 0.00 H new ATOM 1509 N GLY A 114 -3.250 13.708 -4.354 1.00 0.00 N ATOM 1510 CA GLY A 114 -2.139 13.329 -5.197 1.00 0.00 C ATOM 1511 C GLY A 114 -1.804 11.863 -5.056 1.00 0.00 C ATOM 1512 O GLY A 114 -2.544 11.110 -4.418 1.00 0.00 O ATOM 0 H GLY A 114 -3.504 13.015 -3.650 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -2.380 13.549 -6.237 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -1.266 13.928 -4.939 1.00 0.00 H new ATOM 1516 N THR A 115 -0.708 11.453 -5.666 1.00 0.00 N ATOM 1517 CA THR A 115 -0.255 10.078 -5.567 1.00 0.00 C ATOM 1518 C THR A 115 1.045 9.997 -4.774 1.00 0.00 C ATOM 1519 O THR A 115 1.424 8.924 -4.298 1.00 0.00 O ATOM 1520 CB THR A 115 -0.037 9.463 -6.960 1.00 0.00 C ATOM 1521 OG1 THR A 115 0.345 10.488 -7.887 1.00 0.00 O ATOM 1522 CG2 THR A 115 -1.297 8.767 -7.450 1.00 0.00 C ATOM 0 H THR A 115 -0.113 12.054 -6.237 1.00 0.00 H new ATOM 0 HA THR A 115 -1.032 9.515 -5.050 1.00 0.00 H new ATOM 0 HB THR A 115 0.758 8.721 -6.889 1.00 0.00 H new ATOM 0 HG1 THR A 115 0.485 10.093 -8.773 1.00 0.00 H new ATOM 0 HG21 THR A 115 -1.117 8.341 -8.437 1.00 0.00 H new ATOM 0 HG22 THR A 115 -1.567 7.972 -6.755 1.00 0.00 H new ATOM 0 HG23 THR A 115 -2.112 9.489 -7.510 1.00 0.00 H new ATOM 1530 N LYS A 116 1.693 11.155 -4.614 1.00 0.00 N ATOM 1531 CA LYS A 116 3.016 11.260 -3.983 1.00 0.00 C ATOM 1532 C LYS A 116 3.640 12.624 -4.287 1.00 0.00 C ATOM 1533 O LYS A 116 4.789 12.887 -3.925 1.00 0.00 O ATOM 1534 CB LYS A 116 3.967 10.151 -4.463 1.00 0.00 C ATOM 1535 CG LYS A 116 4.386 10.272 -5.924 1.00 0.00 C ATOM 1536 CD LYS A 116 5.878 10.558 -6.064 1.00 0.00 C ATOM 1537 CE LYS A 116 6.123 11.815 -6.887 1.00 0.00 C ATOM 1538 NZ LYS A 116 6.633 12.935 -6.051 1.00 0.00 N ATOM 0 H LYS A 116 1.314 12.051 -4.919 1.00 0.00 H new ATOM 0 HA LYS A 116 2.872 11.147 -2.908 1.00 0.00 H new ATOM 0 HB2 LYS A 116 4.861 10.160 -3.839 1.00 0.00 H new ATOM 0 HB3 LYS A 116 3.484 9.185 -4.315 1.00 0.00 H new ATOM 0 HG2 LYS A 116 4.142 9.349 -6.450 1.00 0.00 H new ATOM 0 HG3 LYS A 116 3.817 11.070 -6.400 1.00 0.00 H new ATOM 0 HD2 LYS A 116 6.323 10.675 -5.076 1.00 0.00 H new ATOM 0 HD3 LYS A 116 6.371 9.709 -6.537 1.00 0.00 H new ATOM 0 HE2 LYS A 116 6.840 11.597 -7.678 1.00 0.00 H new ATOM 0 HE3 LYS A 116 5.195 12.118 -7.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 7.114 13.629 -6.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 5.838 13.394 -5.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 7.304 12.566 -5.348 1.00 0.00 H new ATOM 1552 N ALA A 117 2.891 13.476 -4.976 1.00 0.00 N ATOM 1553 CA ALA A 117 3.393 14.778 -5.383 1.00 0.00 C ATOM 1554 C ALA A 117 2.520 15.881 -4.811 1.00 0.00 C ATOM 1555 O ALA A 117 1.674 16.452 -5.507 1.00 0.00 O ATOM 1556 CB ALA A 117 3.456 14.869 -6.901 1.00 0.00 C ATOM 0 H ALA A 117 1.931 13.286 -5.264 1.00 0.00 H new ATOM 0 HA ALA A 117 4.403 14.904 -4.992 1.00 0.00 H new ATOM 0 HB1 ALA A 117 3.834 15.849 -7.191 1.00 0.00 H new ATOM 0 HB2 ALA A 117 4.121 14.096 -7.285 1.00 0.00 H new ATOM 0 HB3 ALA A 117 2.458 14.727 -7.316 1.00 0.00 H new ATOM 1562 N GLU A 118 2.734 16.174 -3.543 1.00 0.00 N ATOM 1563 CA GLU A 118 1.945 17.170 -2.842 1.00 0.00 C ATOM 1564 C GLU A 118 2.862 18.100 -2.061 1.00 0.00 C ATOM 1565 O GLU A 118 2.362 19.063 -1.444 1.00 0.00 O ATOM 1566 CB GLU A 118 0.946 16.493 -1.897 1.00 0.00 C ATOM 1567 CG GLU A 118 -0.182 15.766 -2.617 1.00 0.00 C ATOM 1568 CD GLU A 118 -0.036 14.257 -2.571 1.00 0.00 C ATOM 1569 OE1 GLU A 118 -0.438 13.656 -1.551 1.00 0.00 O ATOM 1570 OE2 GLU A 118 0.475 13.670 -3.555 1.00 0.00 O ATOM 1571 OXT GLU A 118 4.093 17.876 -2.087 1.00 0.00 O ATOM 0 H GLU A 118 3.455 15.732 -2.972 1.00 0.00 H new ATOM 0 HA GLU A 118 1.386 17.754 -3.573 1.00 0.00 H new ATOM 0 HB2 GLU A 118 1.480 15.782 -1.267 1.00 0.00 H new ATOM 0 HB3 GLU A 118 0.517 17.246 -1.236 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -1.134 16.048 -2.167 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -0.212 16.092 -3.657 1.00 0.00 H new TER 1578 GLU A 118