USER MOD reduce.3.24.130724 H: found=0, std=0, add=1061, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1063 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 47 THR OG1 : rot 180:sc= -2.6! USER MOD Set 1.2: A 84 MET CE :methyl 165:sc= -0.965 (180deg=-1.47) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot -112:sc= 0.0514 USER MOD Single : A 13 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.227) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ -152:sc= -0.142 (180deg=-0.966) USER MOD Single : A 34 TYR OH : rot -114:sc= 1.24 USER MOD Single : A 36 SER OG : rot 179:sc= -0.235 USER MOD Single : A 38 SER OG : rot 180:sc= 0.224 USER MOD Single : A 49 GLN : amide:sc= -0.816 K(o=-0.82,f=-3.9!) USER MOD Single : A 54 TYR OH : rot 32:sc= 1.18 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -0.568 K(o=-0.57,f=-2.7) USER MOD Single : A 60 SER OG : rot -141:sc= 0.514 USER MOD Single : A 61 LYS NZ :NH3+ -110:sc= 1.06 (180deg=-1!) USER MOD Single : A 62 ASN : amide:sc= -0.32 X(o=-0.32,f=0) USER MOD Single : A 68 CYS SG : rot 180:sc= -1.11 USER MOD Single : A 69 THR OG1 : rot 85:sc= -0.136 USER MOD Single : A 80 TYR OH : rot 180:sc= -0.788 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 GLN : amide:sc= -0.573 K(o=-0.57,f=-0.066) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc=-0.00025 X(o=-0.00025,f=-0.0006) USER MOD Single : A 99 LYS NZ :NH3+ -149:sc= -0.398 (180deg=-1.54!) USER MOD Single : A 101 SER OG : rot -65:sc= 0.541 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 HIS : no HD1:sc= -0.227 X(o=-0.23,f=-0.08) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot -74:sc= -2.04! USER MOD Single : A 119 SER OG : rot -73:sc= 0.182 USER MOD Single : A 124 THR OG1 : rot 167:sc= 0.736 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot 136:sc= -2.74! USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 GLN : amide:sc= -0.15 K(o=-0.15,f=-2.1!) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N LEU A 4 -3.990 11.605 1.939 1.00 0.00 N ATOM 22 CA LEU A 4 -4.650 11.091 0.744 1.00 0.00 C ATOM 23 C LEU A 4 -5.509 12.169 0.089 1.00 0.00 C ATOM 24 O LEU A 4 -5.691 12.176 -1.129 1.00 0.00 O ATOM 25 CB LEU A 4 -5.512 9.878 1.094 1.00 0.00 C ATOM 26 CG LEU A 4 -4.731 8.601 1.418 1.00 0.00 C ATOM 27 CD1 LEU A 4 -4.596 8.424 2.923 1.00 0.00 C ATOM 28 CD2 LEU A 4 -5.408 7.389 0.796 1.00 0.00 C ATOM 0 HA LEU A 4 -3.879 10.788 0.036 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -6.137 10.131 1.950 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -6.182 9.674 0.259 1.00 0.00 H new ATOM 0 HG LEU A 4 -3.732 8.692 0.993 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -4.038 7.511 3.133 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -4.066 9.278 3.344 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.587 8.355 3.372 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -4.839 6.491 1.037 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -6.419 7.295 1.191 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -5.451 7.512 -0.286 1.00 0.00 H new ATOM 40 N ASP A 5 -6.034 13.079 0.903 1.00 0.00 N ATOM 41 CA ASP A 5 -6.873 14.161 0.401 1.00 0.00 C ATOM 42 C ASP A 5 -6.045 15.178 -0.379 1.00 0.00 C ATOM 43 O ASP A 5 -6.549 15.836 -1.289 1.00 0.00 O ATOM 44 CB ASP A 5 -7.594 14.854 1.558 1.00 0.00 C ATOM 45 CG ASP A 5 -8.668 15.812 1.080 1.00 0.00 C ATOM 46 OD1 ASP A 5 -8.314 16.853 0.488 1.00 0.00 O ATOM 47 OD2 ASP A 5 -9.863 15.520 1.295 1.00 0.00 O ATOM 0 H ASP A 5 -5.893 13.089 1.913 1.00 0.00 H new ATOM 0 HA ASP A 5 -7.612 13.729 -0.273 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -8.044 14.101 2.205 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -6.867 15.399 2.161 1.00 0.00 H new ATOM 52 N LYS A 6 -4.771 15.298 -0.019 1.00 0.00 N ATOM 53 CA LYS A 6 -3.871 16.229 -0.683 1.00 0.00 C ATOM 54 C LYS A 6 -3.332 15.621 -1.969 1.00 0.00 C ATOM 55 O LYS A 6 -3.325 16.259 -3.022 1.00 0.00 O ATOM 56 CB LYS A 6 -2.706 16.582 0.242 1.00 0.00 C ATOM 57 CG LYS A 6 -3.045 16.497 1.720 1.00 0.00 C ATOM 58 CD LYS A 6 -1.990 17.182 2.574 1.00 0.00 C ATOM 59 CE LYS A 6 -2.416 18.589 2.964 1.00 0.00 C ATOM 60 NZ LYS A 6 -1.453 19.218 3.910 1.00 0.00 N ATOM 0 H LYS A 6 -4.339 14.759 0.732 1.00 0.00 H new ATOM 0 HA LYS A 6 -4.428 17.134 -0.925 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -1.872 15.912 0.032 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -2.368 17.593 0.015 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -4.016 16.959 1.899 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -3.131 15.451 2.015 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -1.810 16.593 3.473 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -1.048 17.224 2.026 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -2.500 19.204 2.068 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -3.405 18.555 3.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -1.779 20.176 4.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -1.392 18.645 4.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -0.515 19.274 3.465 1.00 0.00 H new ATOM 74 N TYR A 7 -2.879 14.376 -1.867 1.00 0.00 N ATOM 75 CA TYR A 7 -2.330 13.661 -3.015 1.00 0.00 C ATOM 76 C TYR A 7 -3.313 13.659 -4.183 1.00 0.00 C ATOM 77 O TYR A 7 -2.927 13.877 -5.332 1.00 0.00 O ATOM 78 CB TYR A 7 -1.981 12.223 -2.626 1.00 0.00 C ATOM 79 CG TYR A 7 -0.978 12.127 -1.498 1.00 0.00 C ATOM 80 CD1 TYR A 7 0.128 12.967 -1.453 1.00 0.00 C ATOM 81 CD2 TYR A 7 -1.137 11.196 -0.479 1.00 0.00 C ATOM 82 CE1 TYR A 7 1.047 12.883 -0.425 1.00 0.00 C ATOM 83 CE2 TYR A 7 -0.222 11.106 0.553 1.00 0.00 C ATOM 84 CZ TYR A 7 0.868 11.951 0.576 1.00 0.00 C ATOM 85 OH TYR A 7 1.780 11.864 1.602 1.00 0.00 O ATOM 0 H TYR A 7 -2.881 13.840 -0.999 1.00 0.00 H new ATOM 0 HA TYR A 7 -1.424 14.178 -3.331 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -2.893 11.703 -2.335 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -1.584 11.706 -3.499 1.00 0.00 H new ATOM 0 HD1 TYR A 7 0.272 13.698 -2.235 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -1.989 10.532 -0.494 1.00 0.00 H new ATOM 0 HE1 TYR A 7 1.901 13.544 -0.405 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -0.360 10.377 1.338 1.00 0.00 H new ATOM 0 HH TYR A 7 2.260 11.012 1.541 1.00 0.00 H new ATOM 135 N ILE A 11 -10.076 10.676 -4.970 1.00 0.00 N ATOM 136 CA ILE A 11 -10.242 9.351 -4.386 1.00 0.00 C ATOM 137 C ILE A 11 -11.212 9.393 -3.210 1.00 0.00 C ATOM 138 O ILE A 11 -10.846 9.795 -2.105 1.00 0.00 O ATOM 139 CB ILE A 11 -8.896 8.768 -3.907 1.00 0.00 C ATOM 140 CG1 ILE A 11 -7.813 8.984 -4.970 1.00 0.00 C ATOM 141 CG2 ILE A 11 -9.050 7.289 -3.582 1.00 0.00 C ATOM 142 CD1 ILE A 11 -6.518 8.252 -4.684 1.00 0.00 C ATOM 0 HA ILE A 11 -10.645 8.708 -5.169 1.00 0.00 H new ATOM 0 HB ILE A 11 -8.590 9.288 -2.999 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -8.197 8.659 -5.937 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.606 10.051 -5.052 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.094 6.889 -3.245 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -9.793 7.165 -2.794 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -9.374 6.752 -4.474 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -5.802 8.454 -5.481 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -6.109 8.594 -3.733 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -6.710 7.180 -4.632 1.00 0.00 H new ATOM 154 N GLU A 12 -12.452 8.982 -3.456 1.00 0.00 N ATOM 155 CA GLU A 12 -13.477 8.978 -2.418 1.00 0.00 C ATOM 156 C GLU A 12 -13.954 7.560 -2.101 1.00 0.00 C ATOM 157 O GLU A 12 -14.769 7.362 -1.199 1.00 0.00 O ATOM 158 CB GLU A 12 -14.665 9.843 -2.848 1.00 0.00 C ATOM 159 CG GLU A 12 -14.671 11.225 -2.217 1.00 0.00 C ATOM 160 CD GLU A 12 -13.370 11.973 -2.439 1.00 0.00 C ATOM 161 OE1 GLU A 12 -13.224 12.608 -3.505 1.00 0.00 O ATOM 162 OE2 GLU A 12 -12.497 11.923 -1.547 1.00 0.00 O ATOM 0 H GLU A 12 -12.771 8.647 -4.365 1.00 0.00 H new ATOM 0 HA GLU A 12 -13.033 9.392 -1.513 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -14.653 9.948 -3.933 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.591 9.330 -2.587 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -15.495 11.806 -2.631 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -14.854 11.131 -1.147 1.00 0.00 H new ATOM 169 N LYS A 13 -13.448 6.575 -2.840 1.00 0.00 N ATOM 170 CA LYS A 13 -13.840 5.183 -2.618 1.00 0.00 C ATOM 171 C LYS A 13 -12.685 4.234 -2.920 1.00 0.00 C ATOM 172 O LYS A 13 -11.697 4.616 -3.545 1.00 0.00 O ATOM 173 CB LYS A 13 -15.047 4.825 -3.487 1.00 0.00 C ATOM 174 CG LYS A 13 -16.371 5.314 -2.921 1.00 0.00 C ATOM 175 CD LYS A 13 -17.020 6.350 -3.825 1.00 0.00 C ATOM 176 CE LYS A 13 -17.950 7.265 -3.045 1.00 0.00 C ATOM 177 NZ LYS A 13 -18.827 6.504 -2.114 1.00 0.00 N ATOM 0 H LYS A 13 -12.772 6.711 -3.591 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.110 5.074 -1.568 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -14.907 5.250 -4.481 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.090 3.742 -3.606 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -17.047 4.468 -2.793 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -16.208 5.744 -1.933 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -16.247 6.945 -4.312 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -17.580 5.847 -4.614 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -17.359 7.986 -2.479 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -18.567 7.834 -3.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -19.577 7.129 -1.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -19.256 5.702 -2.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -18.261 6.148 -1.317 1.00 0.00 H new ATOM 191 N LEU A 14 -12.822 2.991 -2.468 1.00 0.00 N ATOM 192 CA LEU A 14 -11.797 1.976 -2.683 1.00 0.00 C ATOM 193 C LEU A 14 -12.343 0.817 -3.511 1.00 0.00 C ATOM 194 O LEU A 14 -13.554 0.678 -3.679 1.00 0.00 O ATOM 195 CB LEU A 14 -11.272 1.459 -1.343 1.00 0.00 C ATOM 196 CG LEU A 14 -10.063 2.213 -0.787 1.00 0.00 C ATOM 197 CD1 LEU A 14 -9.869 1.896 0.687 1.00 0.00 C ATOM 198 CD2 LEU A 14 -8.812 1.867 -1.579 1.00 0.00 C ATOM 0 H LEU A 14 -13.636 2.662 -1.949 1.00 0.00 H new ATOM 0 HA LEU A 14 -10.976 2.436 -3.233 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -12.079 1.507 -0.611 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -11.005 0.408 -1.456 1.00 0.00 H new ATOM 0 HG LEU A 14 -10.247 3.283 -0.885 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -9.004 2.441 1.066 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -10.758 2.194 1.243 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -9.705 0.825 0.810 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -7.961 2.412 -1.171 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -8.623 0.796 -1.512 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -8.954 2.145 -2.623 1.00 0.00 H new ATOM 210 N ARG A 15 -11.442 -0.017 -4.022 1.00 0.00 N ATOM 211 CA ARG A 15 -11.828 -1.163 -4.823 1.00 0.00 C ATOM 212 C ARG A 15 -11.756 -2.437 -4.005 1.00 0.00 C ATOM 213 O ARG A 15 -10.684 -2.998 -3.776 1.00 0.00 O ATOM 214 CB ARG A 15 -10.947 -1.306 -6.052 1.00 0.00 C ATOM 215 CG ARG A 15 -11.062 -0.148 -7.030 1.00 0.00 C ATOM 216 CD ARG A 15 -11.795 -0.560 -8.297 1.00 0.00 C ATOM 217 NE ARG A 15 -13.242 -0.404 -8.168 1.00 0.00 N ATOM 218 CZ ARG A 15 -14.126 -1.000 -8.964 1.00 0.00 C ATOM 219 NH1 ARG A 15 -13.716 -1.792 -9.947 1.00 0.00 N ATOM 220 NH2 ARG A 15 -15.424 -0.805 -8.777 1.00 0.00 N ATOM 0 H ARG A 15 -10.435 0.085 -3.892 1.00 0.00 H new ATOM 0 HA ARG A 15 -12.855 -0.997 -5.148 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -9.909 -1.398 -5.734 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -11.206 -2.231 -6.567 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -11.590 0.679 -6.556 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -10.066 0.214 -7.286 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -11.439 0.041 -9.134 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -11.562 -1.599 -8.529 1.00 0.00 H new ATOM 0 HE ARG A 15 -13.595 0.197 -7.424 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -12.719 -1.946 -10.095 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -14.398 -2.246 -10.554 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -15.745 -0.198 -8.023 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -16.102 -1.262 -9.387 1.00 0.00 H new ATOM 234 N ARG A 16 -12.914 -2.878 -3.580 1.00 0.00 N ATOM 235 CA ARG A 16 -13.044 -4.093 -2.783 1.00 0.00 C ATOM 236 C ARG A 16 -13.547 -5.250 -3.645 1.00 0.00 C ATOM 237 O ARG A 16 -13.514 -5.180 -4.873 1.00 0.00 O ATOM 238 CB ARG A 16 -13.998 -3.856 -1.609 1.00 0.00 C ATOM 239 CG ARG A 16 -13.534 -4.493 -0.308 1.00 0.00 C ATOM 240 CD ARG A 16 -14.689 -4.687 0.662 1.00 0.00 C ATOM 241 NE ARG A 16 -14.956 -6.101 0.921 1.00 0.00 N ATOM 242 CZ ARG A 16 -16.066 -6.552 1.501 1.00 0.00 C ATOM 243 NH1 ARG A 16 -17.014 -5.705 1.884 1.00 0.00 N ATOM 244 NH2 ARG A 16 -16.229 -7.853 1.698 1.00 0.00 N ATOM 0 H ARG A 16 -13.800 -2.411 -3.772 1.00 0.00 H new ATOM 0 HA ARG A 16 -12.061 -4.355 -2.392 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -14.114 -2.783 -1.457 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -14.981 -4.250 -1.866 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -13.069 -5.456 -0.519 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -12.772 -3.866 0.154 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -14.462 -4.183 1.601 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -15.585 -4.217 0.257 1.00 0.00 H new ATOM 0 HE ARG A 16 -14.250 -6.782 0.641 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -16.894 -4.703 1.734 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -17.863 -6.056 2.328 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -15.504 -8.508 1.405 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -17.079 -8.199 2.142 1.00 0.00 H new ATOM 258 N GLY A 17 -14.013 -6.311 -2.994 1.00 0.00 N ATOM 259 CA GLY A 17 -14.515 -7.463 -3.720 1.00 0.00 C ATOM 260 C GLY A 17 -15.769 -7.148 -4.511 1.00 0.00 C ATOM 261 O GLY A 17 -15.693 -6.648 -5.633 1.00 0.00 O ATOM 0 H GLY A 17 -14.052 -6.394 -1.978 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -13.743 -7.826 -4.398 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -14.726 -8.269 -3.017 1.00 0.00 H new ATOM 265 N ASP A 18 -16.928 -7.446 -3.926 1.00 0.00 N ATOM 266 CA ASP A 18 -18.209 -7.201 -4.573 1.00 0.00 C ATOM 267 C ASP A 18 -18.249 -5.826 -5.234 1.00 0.00 C ATOM 268 O ASP A 18 -18.874 -5.646 -6.279 1.00 0.00 O ATOM 269 CB ASP A 18 -19.346 -7.323 -3.556 1.00 0.00 C ATOM 270 CG ASP A 18 -20.706 -7.416 -4.220 1.00 0.00 C ATOM 271 OD1 ASP A 18 -21.083 -8.529 -4.646 1.00 0.00 O ATOM 272 OD2 ASP A 18 -21.394 -6.379 -4.311 1.00 0.00 O ATOM 0 H ASP A 18 -17.002 -7.861 -2.997 1.00 0.00 H new ATOM 0 HA ASP A 18 -18.337 -7.953 -5.352 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -19.185 -8.207 -2.939 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -19.328 -6.461 -2.889 1.00 0.00 H new ATOM 277 N GLY A 19 -17.578 -4.859 -4.617 1.00 0.00 N ATOM 278 CA GLY A 19 -17.550 -3.514 -5.158 1.00 0.00 C ATOM 279 C GLY A 19 -16.668 -2.582 -4.350 1.00 0.00 C ATOM 280 O GLY A 19 -15.633 -2.995 -3.826 1.00 0.00 O ATOM 0 H GLY A 19 -17.053 -4.984 -3.751 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -17.192 -3.547 -6.187 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -18.564 -3.116 -5.186 1.00 0.00 H new ATOM 284 N GLU A 20 -17.075 -1.321 -4.253 1.00 0.00 N ATOM 285 CA GLU A 20 -16.314 -0.327 -3.506 1.00 0.00 C ATOM 286 C GLU A 20 -16.870 -0.162 -2.094 1.00 0.00 C ATOM 287 O GLU A 20 -18.027 -0.486 -1.830 1.00 0.00 O ATOM 288 CB GLU A 20 -16.337 1.014 -4.246 1.00 0.00 C ATOM 289 CG GLU A 20 -17.668 1.744 -4.156 1.00 0.00 C ATOM 290 CD GLU A 20 -17.757 2.915 -5.115 1.00 0.00 C ATOM 291 OE1 GLU A 20 -16.741 3.623 -5.282 1.00 0.00 O ATOM 292 OE2 GLU A 20 -18.841 3.126 -5.697 1.00 0.00 O ATOM 0 H GLU A 20 -17.928 -0.963 -4.683 1.00 0.00 H new ATOM 0 HA GLU A 20 -15.283 -0.672 -3.425 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -15.554 1.655 -3.841 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -16.098 0.843 -5.296 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -18.477 1.044 -4.367 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -17.814 2.102 -3.137 1.00 0.00 H new ATOM 299 N VAL A 21 -16.036 0.344 -1.190 1.00 0.00 N ATOM 300 CA VAL A 21 -16.445 0.550 0.193 1.00 0.00 C ATOM 301 C VAL A 21 -16.211 1.992 0.630 1.00 0.00 C ATOM 302 O VAL A 21 -15.469 2.735 -0.013 1.00 0.00 O ATOM 303 CB VAL A 21 -15.693 -0.393 1.151 1.00 0.00 C ATOM 304 CG1 VAL A 21 -16.022 -1.845 0.839 1.00 0.00 C ATOM 305 CG2 VAL A 21 -14.194 -0.150 1.070 1.00 0.00 C ATOM 0 H VAL A 21 -15.074 0.618 -1.391 1.00 0.00 H new ATOM 0 HA VAL A 21 -17.511 0.328 0.240 1.00 0.00 H new ATOM 0 HB VAL A 21 -16.018 -0.182 2.170 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -15.482 -2.496 1.526 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -17.094 -2.008 0.952 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -15.727 -2.073 -0.185 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -13.679 -0.825 1.753 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -13.850 -0.332 0.052 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -13.977 0.882 1.347 1.00 0.00 H new ATOM 315 N GLU A 22 -16.852 2.381 1.726 1.00 0.00 N ATOM 316 CA GLU A 22 -16.718 3.735 2.252 1.00 0.00 C ATOM 317 C GLU A 22 -15.308 3.993 2.769 1.00 0.00 C ATOM 318 O GLU A 22 -14.752 3.191 3.518 1.00 0.00 O ATOM 319 CB GLU A 22 -17.728 3.975 3.379 1.00 0.00 C ATOM 320 CG GLU A 22 -17.855 2.808 4.346 1.00 0.00 C ATOM 321 CD GLU A 22 -19.120 2.002 4.122 1.00 0.00 C ATOM 322 OE1 GLU A 22 -19.595 1.951 2.969 1.00 0.00 O ATOM 323 OE2 GLU A 22 -19.635 1.422 5.102 1.00 0.00 O ATOM 0 H GLU A 22 -17.470 1.778 2.268 1.00 0.00 H new ATOM 0 HA GLU A 22 -16.918 4.426 1.433 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.434 4.865 3.935 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -18.705 4.181 2.941 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -16.989 2.155 4.238 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -17.845 3.185 5.369 1.00 0.00 H new ATOM 330 N VAL A 23 -14.740 5.129 2.373 1.00 0.00 N ATOM 331 CA VAL A 23 -13.400 5.508 2.804 1.00 0.00 C ATOM 332 C VAL A 23 -13.320 5.572 4.328 1.00 0.00 C ATOM 333 O VAL A 23 -12.255 5.378 4.915 1.00 0.00 O ATOM 334 CB VAL A 23 -12.985 6.870 2.209 1.00 0.00 C ATOM 335 CG1 VAL A 23 -11.666 7.345 2.803 1.00 0.00 C ATOM 336 CG2 VAL A 23 -12.891 6.780 0.694 1.00 0.00 C ATOM 0 H VAL A 23 -15.189 5.803 1.753 1.00 0.00 H new ATOM 0 HA VAL A 23 -12.713 4.744 2.440 1.00 0.00 H new ATOM 0 HB VAL A 23 -13.751 7.602 2.465 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -11.396 8.307 2.367 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -11.771 7.453 3.883 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -10.885 6.616 2.585 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -12.597 7.749 0.289 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -12.148 6.032 0.419 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -13.861 6.495 0.286 1.00 0.00 H new ATOM 346 N LYS A 24 -14.457 5.847 4.962 1.00 0.00 N ATOM 347 CA LYS A 24 -14.530 5.941 6.417 1.00 0.00 C ATOM 348 C LYS A 24 -13.913 4.709 7.077 1.00 0.00 C ATOM 349 O LYS A 24 -13.422 4.779 8.202 1.00 0.00 O ATOM 350 CB LYS A 24 -15.984 6.105 6.866 1.00 0.00 C ATOM 351 CG LYS A 24 -16.290 7.480 7.437 1.00 0.00 C ATOM 352 CD LYS A 24 -15.991 8.581 6.432 1.00 0.00 C ATOM 353 CE LYS A 24 -15.367 9.794 7.103 1.00 0.00 C ATOM 354 NZ LYS A 24 -13.879 9.750 7.058 1.00 0.00 N ATOM 0 H LYS A 24 -15.345 6.009 4.487 1.00 0.00 H new ATOM 0 HA LYS A 24 -13.961 6.817 6.728 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -16.642 5.918 6.017 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -16.211 5.349 7.618 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -17.339 7.528 7.729 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -15.700 7.640 8.339 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -15.316 8.201 5.665 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -16.912 8.876 5.929 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -15.718 10.701 6.612 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -15.697 9.845 8.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.492 10.595 7.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -13.542 8.897 7.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -13.562 9.727 6.068 1.00 0.00 H new ATOM 368 N SER A 25 -13.941 3.583 6.371 1.00 0.00 N ATOM 369 CA SER A 25 -13.379 2.343 6.897 1.00 0.00 C ATOM 370 C SER A 25 -11.886 2.500 7.190 1.00 0.00 C ATOM 371 O SER A 25 -11.311 1.727 7.956 1.00 0.00 O ATOM 372 CB SER A 25 -13.597 1.200 5.904 1.00 0.00 C ATOM 373 OG SER A 25 -13.080 -0.020 6.407 1.00 0.00 O ATOM 0 H SER A 25 -14.345 3.503 5.438 1.00 0.00 H new ATOM 0 HA SER A 25 -13.891 2.109 7.830 1.00 0.00 H new ATOM 0 HB2 SER A 25 -14.662 1.090 5.700 1.00 0.00 H new ATOM 0 HB3 SER A 25 -13.114 1.440 4.957 1.00 0.00 H new ATOM 0 HG SER A 25 -13.234 -0.734 5.754 1.00 0.00 H new ATOM 379 N LEU A 26 -11.268 3.515 6.588 1.00 0.00 N ATOM 380 CA LEU A 26 -9.850 3.785 6.796 1.00 0.00 C ATOM 381 C LEU A 26 -9.669 5.149 7.459 1.00 0.00 C ATOM 382 O LEU A 26 -8.898 5.987 6.989 1.00 0.00 O ATOM 383 CB LEU A 26 -9.083 3.743 5.466 1.00 0.00 C ATOM 384 CG LEU A 26 -9.626 2.776 4.406 1.00 0.00 C ATOM 385 CD1 LEU A 26 -8.593 2.556 3.312 1.00 0.00 C ATOM 386 CD2 LEU A 26 -10.027 1.447 5.034 1.00 0.00 C ATOM 0 H LEU A 26 -11.730 4.164 5.951 1.00 0.00 H new ATOM 0 HA LEU A 26 -9.447 3.011 7.449 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -9.075 4.747 5.043 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -8.047 3.477 5.675 1.00 0.00 H new ATOM 0 HG LEU A 26 -10.516 3.223 3.963 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.993 1.868 2.567 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -8.358 3.508 2.837 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -7.687 2.134 3.747 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -10.409 0.780 4.261 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -9.158 0.992 5.509 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -10.802 1.617 5.782 1.00 0.00 H new ATOM 398 N ALA A 27 -10.397 5.361 8.550 1.00 0.00 N ATOM 399 CA ALA A 27 -10.348 6.598 9.286 1.00 0.00 C ATOM 400 C ALA A 27 -9.667 6.403 10.623 1.00 0.00 C ATOM 401 O ALA A 27 -10.291 6.050 11.624 1.00 0.00 O ATOM 402 CB ALA A 27 -11.740 7.121 9.487 1.00 0.00 C ATOM 0 H ALA A 27 -11.037 4.671 8.942 1.00 0.00 H new ATOM 0 HA ALA A 27 -9.769 7.322 8.713 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -11.700 8.057 10.044 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -12.207 7.295 8.518 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -12.326 6.391 10.046 1.00 0.00 H new ATOM 408 N GLY A 28 -8.387 6.640 10.606 1.00 0.00 N ATOM 409 CA GLY A 28 -7.569 6.503 11.797 1.00 0.00 C ATOM 410 C GLY A 28 -6.839 5.177 11.857 1.00 0.00 C ATOM 411 O GLY A 28 -6.795 4.526 12.901 1.00 0.00 O ATOM 0 H GLY A 28 -7.874 6.933 9.775 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -6.842 7.315 11.829 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -8.200 6.606 12.680 1.00 0.00 H new ATOM 415 N LYS A 29 -6.256 4.784 10.731 1.00 0.00 N ATOM 416 CA LYS A 29 -5.509 3.537 10.641 1.00 0.00 C ATOM 417 C LYS A 29 -4.239 3.742 9.823 1.00 0.00 C ATOM 418 O LYS A 29 -4.111 4.735 9.107 1.00 0.00 O ATOM 419 CB LYS A 29 -6.376 2.446 10.011 1.00 0.00 C ATOM 420 CG LYS A 29 -6.727 2.705 8.553 1.00 0.00 C ATOM 421 CD LYS A 29 -6.874 1.407 7.778 1.00 0.00 C ATOM 422 CE LYS A 29 -8.098 0.624 8.227 1.00 0.00 C ATOM 423 NZ LYS A 29 -7.798 -0.260 9.386 1.00 0.00 N ATOM 0 H LYS A 29 -6.287 5.316 9.861 1.00 0.00 H new ATOM 0 HA LYS A 29 -5.229 3.223 11.646 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -5.854 1.492 10.085 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -7.297 2.351 10.585 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -7.657 3.271 8.496 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.952 3.318 8.094 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.951 1.625 6.713 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -5.981 0.797 7.915 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -8.894 1.318 8.497 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -8.468 0.022 7.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -8.437 -1.080 9.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -6.813 -0.588 9.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -7.934 0.269 10.271 1.00 0.00 H new ATOM 437 N LEU A 30 -3.305 2.804 9.923 1.00 0.00 N ATOM 438 CA LEU A 30 -2.057 2.903 9.179 1.00 0.00 C ATOM 439 C LEU A 30 -2.210 2.257 7.808 1.00 0.00 C ATOM 440 O LEU A 30 -2.077 1.041 7.665 1.00 0.00 O ATOM 441 CB LEU A 30 -0.915 2.246 9.953 1.00 0.00 C ATOM 442 CG LEU A 30 0.454 2.339 9.281 1.00 0.00 C ATOM 443 CD1 LEU A 30 0.901 3.789 9.167 1.00 0.00 C ATOM 444 CD2 LEU A 30 1.484 1.521 10.048 1.00 0.00 C ATOM 0 H LEU A 30 -3.387 1.972 10.508 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.817 3.958 9.045 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.852 2.706 10.939 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -1.157 1.195 10.107 1.00 0.00 H new ATOM 0 HG LEU A 30 0.368 1.928 8.275 1.00 0.00 H new ATOM 0 HD11 LEU A 30 1.878 3.832 8.686 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.178 4.347 8.571 1.00 0.00 H new ATOM 0 HD13 LEU A 30 0.967 4.229 10.162 1.00 0.00 H new ATOM 0 HD21 LEU A 30 2.452 1.600 9.554 1.00 0.00 H new ATOM 0 HD22 LEU A 30 1.564 1.900 11.067 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.174 0.476 10.073 1.00 0.00 H new ATOM 456 N VAL A 31 -2.505 3.077 6.806 1.00 0.00 N ATOM 457 CA VAL A 31 -2.696 2.582 5.448 1.00 0.00 C ATOM 458 C VAL A 31 -1.386 2.548 4.667 1.00 0.00 C ATOM 459 O VAL A 31 -0.663 3.540 4.592 1.00 0.00 O ATOM 460 CB VAL A 31 -3.721 3.433 4.671 1.00 0.00 C ATOM 461 CG1 VAL A 31 -4.207 2.683 3.440 1.00 0.00 C ATOM 462 CG2 VAL A 31 -4.892 3.816 5.564 1.00 0.00 C ATOM 0 H VAL A 31 -2.617 4.086 6.908 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.076 1.565 5.547 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.230 4.350 4.346 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.930 3.296 2.902 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.360 2.465 2.789 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.680 1.750 3.746 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.602 4.416 4.995 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.386 2.913 5.924 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.528 4.394 6.414 1.00 0.00 H new ATOM 472 N PHE A 32 -1.103 1.392 4.079 1.00 0.00 N ATOM 473 CA PHE A 32 0.105 1.197 3.283 1.00 0.00 C ATOM 474 C PHE A 32 -0.248 1.146 1.798 1.00 0.00 C ATOM 475 O PHE A 32 -1.392 0.872 1.436 1.00 0.00 O ATOM 476 CB PHE A 32 0.811 -0.098 3.703 1.00 0.00 C ATOM 477 CG PHE A 32 1.775 0.078 4.850 1.00 0.00 C ATOM 478 CD1 PHE A 32 1.514 0.990 5.861 1.00 0.00 C ATOM 479 CD2 PHE A 32 2.943 -0.668 4.916 1.00 0.00 C ATOM 480 CE1 PHE A 32 2.398 1.153 6.912 1.00 0.00 C ATOM 481 CE2 PHE A 32 3.828 -0.507 5.965 1.00 0.00 C ATOM 482 CZ PHE A 32 3.555 0.405 6.963 1.00 0.00 C ATOM 0 H PHE A 32 -1.700 0.567 4.139 1.00 0.00 H new ATOM 0 HA PHE A 32 0.779 2.036 3.456 1.00 0.00 H new ATOM 0 HB2 PHE A 32 0.059 -0.836 3.982 1.00 0.00 H new ATOM 0 HB3 PHE A 32 1.350 -0.501 2.846 1.00 0.00 H new ATOM 0 HD1 PHE A 32 0.610 1.580 5.827 1.00 0.00 H new ATOM 0 HD2 PHE A 32 3.163 -1.384 4.138 1.00 0.00 H new ATOM 0 HE1 PHE A 32 2.182 1.867 7.693 1.00 0.00 H new ATOM 0 HE2 PHE A 32 4.733 -1.095 6.003 1.00 0.00 H new ATOM 0 HZ PHE A 32 4.246 0.533 7.783 1.00 0.00 H new ATOM 492 N PHE A 33 0.733 1.412 0.937 1.00 0.00 N ATOM 493 CA PHE A 33 0.499 1.390 -0.502 1.00 0.00 C ATOM 494 C PHE A 33 1.685 0.789 -1.249 1.00 0.00 C ATOM 495 O PHE A 33 2.729 1.425 -1.394 1.00 0.00 O ATOM 496 CB PHE A 33 0.233 2.804 -1.031 1.00 0.00 C ATOM 497 CG PHE A 33 -0.465 3.709 -0.055 1.00 0.00 C ATOM 498 CD1 PHE A 33 -1.765 3.449 0.344 1.00 0.00 C ATOM 499 CD2 PHE A 33 0.180 4.824 0.455 1.00 0.00 C ATOM 500 CE1 PHE A 33 -2.411 4.285 1.236 1.00 0.00 C ATOM 501 CE2 PHE A 33 -0.459 5.662 1.348 1.00 0.00 C ATOM 502 CZ PHE A 33 -1.756 5.392 1.739 1.00 0.00 C ATOM 0 H PHE A 33 1.688 1.643 1.209 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.378 0.767 -0.676 1.00 0.00 H new ATOM 0 HB2 PHE A 33 1.183 3.258 -1.314 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -0.369 2.733 -1.937 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -2.280 2.584 -0.046 1.00 0.00 H new ATOM 0 HD2 PHE A 33 1.194 5.040 0.151 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -3.426 4.073 1.539 1.00 0.00 H new ATOM 0 HE2 PHE A 33 0.055 6.527 1.740 1.00 0.00 H new ATOM 0 HZ PHE A 33 -2.257 6.046 2.437 1.00 0.00 H new ATOM 512 N TYR A 34 1.508 -0.434 -1.735 1.00 0.00 N ATOM 513 CA TYR A 34 2.555 -1.118 -2.485 1.00 0.00 C ATOM 514 C TYR A 34 2.380 -0.890 -3.985 1.00 0.00 C ATOM 515 O TYR A 34 1.312 -1.144 -4.542 1.00 0.00 O ATOM 516 CB TYR A 34 2.553 -2.615 -2.161 1.00 0.00 C ATOM 517 CG TYR A 34 1.586 -3.442 -2.982 1.00 0.00 C ATOM 518 CD1 TYR A 34 1.961 -3.961 -4.216 1.00 0.00 C ATOM 519 CD2 TYR A 34 0.305 -3.711 -2.520 1.00 0.00 C ATOM 520 CE1 TYR A 34 1.085 -4.723 -4.965 1.00 0.00 C ATOM 521 CE2 TYR A 34 -0.576 -4.472 -3.262 1.00 0.00 C ATOM 522 CZ TYR A 34 -0.181 -4.976 -4.483 1.00 0.00 C ATOM 523 OH TYR A 34 -1.056 -5.735 -5.227 1.00 0.00 O ATOM 0 H TYR A 34 0.649 -0.973 -1.623 1.00 0.00 H new ATOM 0 HA TYR A 34 3.518 -0.703 -2.189 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.560 -3.006 -2.309 1.00 0.00 H new ATOM 0 HB3 TYR A 34 2.313 -2.743 -1.105 1.00 0.00 H new ATOM 0 HD1 TYR A 34 2.953 -3.765 -4.595 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -0.008 -3.318 -1.564 1.00 0.00 H new ATOM 0 HE1 TYR A 34 1.391 -5.118 -5.923 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -1.569 -4.671 -2.888 1.00 0.00 H new ATOM 0 HH TYR A 34 -1.807 -5.177 -5.518 1.00 0.00 H new ATOM 533 N PHE A 35 3.434 -0.402 -4.630 1.00 0.00 N ATOM 534 CA PHE A 35 3.397 -0.131 -6.065 1.00 0.00 C ATOM 535 C PHE A 35 3.982 -1.293 -6.862 1.00 0.00 C ATOM 536 O PHE A 35 5.090 -1.750 -6.583 1.00 0.00 O ATOM 537 CB PHE A 35 4.166 1.154 -6.377 1.00 0.00 C ATOM 538 CG PHE A 35 3.620 2.365 -5.674 1.00 0.00 C ATOM 539 CD1 PHE A 35 3.739 2.498 -4.300 1.00 0.00 C ATOM 540 CD2 PHE A 35 2.987 3.369 -6.388 1.00 0.00 C ATOM 541 CE1 PHE A 35 3.236 3.611 -3.652 1.00 0.00 C ATOM 542 CE2 PHE A 35 2.482 4.483 -5.746 1.00 0.00 C ATOM 543 CZ PHE A 35 2.608 4.604 -4.376 1.00 0.00 C ATOM 0 H PHE A 35 4.325 -0.186 -4.183 1.00 0.00 H new ATOM 0 HA PHE A 35 2.354 -0.008 -6.358 1.00 0.00 H new ATOM 0 HB2 PHE A 35 5.211 1.020 -6.095 1.00 0.00 H new ATOM 0 HB3 PHE A 35 4.146 1.328 -7.453 1.00 0.00 H new ATOM 0 HD1 PHE A 35 4.230 1.724 -3.729 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.887 3.280 -7.460 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.334 3.703 -2.580 1.00 0.00 H new ATOM 0 HE2 PHE A 35 1.989 5.258 -6.314 1.00 0.00 H new ATOM 0 HZ PHE A 35 2.216 5.475 -3.872 1.00 0.00 H new ATOM 553 N SER A 36 3.234 -1.771 -7.857 1.00 0.00 N ATOM 554 CA SER A 36 3.691 -2.878 -8.688 1.00 0.00 C ATOM 555 C SER A 36 2.717 -3.138 -9.833 1.00 0.00 C ATOM 556 O SER A 36 1.634 -2.555 -9.883 1.00 0.00 O ATOM 557 CB SER A 36 3.858 -4.144 -7.844 1.00 0.00 C ATOM 558 OG SER A 36 2.640 -4.864 -7.750 1.00 0.00 O ATOM 0 H SER A 36 2.313 -1.409 -8.104 1.00 0.00 H new ATOM 0 HA SER A 36 4.657 -2.605 -9.113 1.00 0.00 H new ATOM 0 HB2 SER A 36 4.626 -4.780 -8.286 1.00 0.00 H new ATOM 0 HB3 SER A 36 4.202 -3.875 -6.845 1.00 0.00 H new ATOM 0 HG SER A 36 2.780 -5.676 -7.220 1.00 0.00 H new ATOM 564 N ALA A 37 3.105 -4.022 -10.747 1.00 0.00 N ATOM 565 CA ALA A 37 2.260 -4.362 -11.882 1.00 0.00 C ATOM 566 C ALA A 37 2.240 -5.868 -12.113 1.00 0.00 C ATOM 567 O ALA A 37 3.247 -6.551 -11.928 1.00 0.00 O ATOM 568 CB ALA A 37 2.729 -3.628 -13.129 1.00 0.00 C ATOM 0 H ALA A 37 3.998 -4.514 -10.722 1.00 0.00 H new ATOM 0 HA ALA A 37 1.241 -4.045 -11.659 1.00 0.00 H new ATOM 0 HB1 ALA A 37 2.087 -3.892 -13.970 1.00 0.00 H new ATOM 0 HB2 ALA A 37 2.679 -2.553 -12.959 1.00 0.00 H new ATOM 0 HB3 ALA A 37 3.757 -3.912 -13.354 1.00 0.00 H new ATOM 574 N SER A 38 1.080 -6.383 -12.506 1.00 0.00 N ATOM 575 CA SER A 38 0.914 -7.812 -12.750 1.00 0.00 C ATOM 576 C SER A 38 1.909 -8.329 -13.786 1.00 0.00 C ATOM 577 O SER A 38 2.301 -9.496 -13.748 1.00 0.00 O ATOM 578 CB SER A 38 -0.514 -8.106 -13.214 1.00 0.00 C ATOM 579 OG SER A 38 -1.388 -7.040 -12.884 1.00 0.00 O ATOM 0 H SER A 38 0.237 -5.830 -12.663 1.00 0.00 H new ATOM 0 HA SER A 38 1.108 -8.329 -11.810 1.00 0.00 H new ATOM 0 HB2 SER A 38 -0.523 -8.267 -14.292 1.00 0.00 H new ATOM 0 HB3 SER A 38 -0.868 -9.027 -12.751 1.00 0.00 H new ATOM 0 HG SER A 38 -2.294 -7.252 -13.193 1.00 0.00 H new ATOM 585 N TRP A 39 2.305 -7.468 -14.719 1.00 0.00 N ATOM 586 CA TRP A 39 3.241 -7.866 -15.766 1.00 0.00 C ATOM 587 C TRP A 39 4.574 -7.130 -15.649 1.00 0.00 C ATOM 588 O TRP A 39 5.214 -6.834 -16.658 1.00 0.00 O ATOM 589 CB TRP A 39 2.626 -7.616 -17.146 1.00 0.00 C ATOM 590 CG TRP A 39 2.382 -6.167 -17.449 1.00 0.00 C ATOM 591 CD1 TRP A 39 2.635 -5.099 -16.635 1.00 0.00 C ATOM 592 CD2 TRP A 39 1.831 -5.627 -18.657 1.00 0.00 C ATOM 593 NE1 TRP A 39 2.278 -3.931 -17.263 1.00 0.00 N ATOM 594 CE2 TRP A 39 1.781 -4.228 -18.504 1.00 0.00 C ATOM 595 CE3 TRP A 39 1.376 -6.190 -19.852 1.00 0.00 C ATOM 596 CZ2 TRP A 39 1.295 -3.387 -19.502 1.00 0.00 C ATOM 597 CZ3 TRP A 39 0.894 -5.354 -20.842 1.00 0.00 C ATOM 598 CH2 TRP A 39 0.857 -3.966 -20.661 1.00 0.00 C ATOM 0 H TRP A 39 1.995 -6.498 -14.772 1.00 0.00 H new ATOM 0 HA TRP A 39 3.438 -8.931 -15.642 1.00 0.00 H new ATOM 0 HB2 TRP A 39 3.286 -8.030 -17.908 1.00 0.00 H new ATOM 0 HB3 TRP A 39 1.682 -8.156 -17.215 1.00 0.00 H new ATOM 0 HD1 TRP A 39 3.055 -5.164 -15.642 1.00 0.00 H new ATOM 0 HE1 TRP A 39 2.368 -2.994 -16.869 1.00 0.00 H new ATOM 0 HE3 TRP A 39 1.400 -7.260 -20.000 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 1.265 -2.316 -19.366 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 0.540 -5.778 -21.770 1.00 0.00 H new ATOM 0 HH2 TRP A 39 0.475 -3.340 -21.453 1.00 0.00 H new ATOM 609 N CYS A 40 4.996 -6.841 -14.422 1.00 0.00 N ATOM 610 CA CYS A 40 6.261 -6.148 -14.205 1.00 0.00 C ATOM 611 C CYS A 40 7.429 -7.135 -14.260 1.00 0.00 C ATOM 612 O CYS A 40 7.221 -8.343 -14.361 1.00 0.00 O ATOM 613 CB CYS A 40 6.233 -5.387 -12.870 1.00 0.00 C ATOM 614 SG CYS A 40 6.652 -6.365 -11.384 1.00 0.00 S ATOM 0 H CYS A 40 4.486 -7.073 -13.570 1.00 0.00 H new ATOM 0 HA CYS A 40 6.403 -5.419 -15.003 1.00 0.00 H new ATOM 0 HB2 CYS A 40 6.927 -4.549 -12.937 1.00 0.00 H new ATOM 0 HB3 CYS A 40 5.237 -4.966 -12.735 1.00 0.00 H new ATOM 619 N PRO A 41 8.677 -6.641 -14.213 1.00 0.00 N ATOM 620 CA PRO A 41 9.855 -7.504 -14.275 1.00 0.00 C ATOM 621 C PRO A 41 10.002 -8.398 -13.038 1.00 0.00 C ATOM 622 O PRO A 41 10.030 -9.623 -13.165 1.00 0.00 O ATOM 623 CB PRO A 41 11.038 -6.534 -14.409 1.00 0.00 C ATOM 624 CG PRO A 41 10.436 -5.188 -14.674 1.00 0.00 C ATOM 625 CD PRO A 41 9.038 -5.220 -14.122 1.00 0.00 C ATOM 0 HA PRO A 41 9.789 -8.203 -15.109 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.638 -6.521 -13.499 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.699 -6.834 -15.222 1.00 0.00 H new ATOM 0 HG2 PRO A 41 11.022 -4.402 -14.197 1.00 0.00 H new ATOM 0 HG3 PRO A 41 10.425 -4.973 -15.743 1.00 0.00 H new ATOM 0 HD2 PRO A 41 9.002 -4.860 -13.094 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.361 -4.594 -14.703 1.00 0.00 H new ATOM 633 N PRO A 42 10.107 -7.820 -11.820 1.00 0.00 N ATOM 634 CA PRO A 42 10.260 -8.611 -10.592 1.00 0.00 C ATOM 635 C PRO A 42 8.992 -9.376 -10.198 1.00 0.00 C ATOM 636 O PRO A 42 8.938 -10.596 -10.346 1.00 0.00 O ATOM 637 CB PRO A 42 10.617 -7.568 -9.517 1.00 0.00 C ATOM 638 CG PRO A 42 10.901 -6.304 -10.258 1.00 0.00 C ATOM 639 CD PRO A 42 10.106 -6.379 -11.528 1.00 0.00 C ATOM 0 HA PRO A 42 11.016 -9.385 -10.721 1.00 0.00 H new ATOM 0 HB2 PRO A 42 9.795 -7.433 -8.814 1.00 0.00 H new ATOM 0 HB3 PRO A 42 11.484 -7.885 -8.937 1.00 0.00 H new ATOM 0 HG2 PRO A 42 10.613 -5.434 -9.669 1.00 0.00 H new ATOM 0 HG3 PRO A 42 11.966 -6.207 -10.470 1.00 0.00 H new ATOM 0 HD2 PRO A 42 9.095 -5.992 -11.397 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.567 -5.802 -12.330 1.00 0.00 H new ATOM 647 N CYS A 43 7.987 -8.654 -9.677 1.00 0.00 N ATOM 648 CA CYS A 43 6.713 -9.256 -9.225 1.00 0.00 C ATOM 649 C CYS A 43 6.803 -10.772 -9.094 1.00 0.00 C ATOM 650 O CYS A 43 6.328 -11.516 -9.952 1.00 0.00 O ATOM 651 CB CYS A 43 5.544 -8.889 -10.147 1.00 0.00 C ATOM 652 SG CYS A 43 6.011 -8.246 -11.785 1.00 0.00 S ATOM 0 H CYS A 43 8.029 -7.642 -9.556 1.00 0.00 H new ATOM 0 HA CYS A 43 6.523 -8.837 -8.237 1.00 0.00 H new ATOM 0 HB2 CYS A 43 4.922 -9.773 -10.287 1.00 0.00 H new ATOM 0 HB3 CYS A 43 4.928 -8.143 -9.645 1.00 0.00 H new ATOM 657 N ARG A 44 7.415 -11.211 -8.006 1.00 0.00 N ATOM 658 CA ARG A 44 7.578 -12.633 -7.731 1.00 0.00 C ATOM 659 C ARG A 44 7.262 -12.936 -6.270 1.00 0.00 C ATOM 660 O ARG A 44 7.826 -13.855 -5.677 1.00 0.00 O ATOM 661 CB ARG A 44 9.004 -13.081 -8.062 1.00 0.00 C ATOM 662 CG ARG A 44 10.076 -12.155 -7.508 1.00 0.00 C ATOM 663 CD ARG A 44 10.962 -12.867 -6.497 1.00 0.00 C ATOM 664 NE ARG A 44 10.567 -12.575 -5.121 1.00 0.00 N ATOM 665 CZ ARG A 44 11.356 -12.773 -4.066 1.00 0.00 C ATOM 666 NH1 ARG A 44 12.579 -13.261 -4.225 1.00 0.00 N ATOM 667 NH2 ARG A 44 10.918 -12.481 -2.849 1.00 0.00 N ATOM 0 H ARG A 44 7.811 -10.599 -7.292 1.00 0.00 H new ATOM 0 HA ARG A 44 6.880 -13.185 -8.361 1.00 0.00 H new ATOM 0 HB2 ARG A 44 9.162 -14.084 -7.666 1.00 0.00 H new ATOM 0 HB3 ARG A 44 9.114 -13.144 -9.145 1.00 0.00 H new ATOM 0 HG2 ARG A 44 10.688 -11.776 -8.326 1.00 0.00 H new ATOM 0 HG3 ARG A 44 9.605 -11.293 -7.036 1.00 0.00 H new ATOM 0 HD2 ARG A 44 10.914 -13.943 -6.667 1.00 0.00 H new ATOM 0 HD3 ARG A 44 11.999 -12.566 -6.648 1.00 0.00 H new ATOM 0 HE ARG A 44 9.633 -12.198 -4.959 1.00 0.00 H new ATOM 0 HH11 ARG A 44 12.920 -13.487 -5.159 1.00 0.00 H new ATOM 0 HH12 ARG A 44 13.178 -13.410 -3.413 1.00 0.00 H new ATOM 0 HH21 ARG A 44 9.978 -12.105 -2.722 1.00 0.00 H new ATOM 0 HH22 ARG A 44 11.521 -12.632 -2.040 1.00 0.00 H new ATOM 681 N GLY A 45 6.358 -12.149 -5.694 1.00 0.00 N ATOM 682 CA GLY A 45 5.979 -12.339 -4.307 1.00 0.00 C ATOM 683 C GLY A 45 5.586 -11.036 -3.636 1.00 0.00 C ATOM 684 O GLY A 45 5.045 -10.138 -4.281 1.00 0.00 O ATOM 0 H GLY A 45 5.880 -11.381 -6.166 1.00 0.00 H new ATOM 0 HA2 GLY A 45 5.146 -13.039 -4.253 1.00 0.00 H new ATOM 0 HA3 GLY A 45 6.810 -12.789 -3.764 1.00 0.00 H new ATOM 688 N PHE A 46 5.862 -10.932 -2.338 1.00 0.00 N ATOM 689 CA PHE A 46 5.538 -9.729 -1.570 1.00 0.00 C ATOM 690 C PHE A 46 4.047 -9.654 -1.250 1.00 0.00 C ATOM 691 O PHE A 46 3.661 -9.513 -0.090 1.00 0.00 O ATOM 692 CB PHE A 46 5.972 -8.469 -2.325 1.00 0.00 C ATOM 693 CG PHE A 46 6.400 -7.348 -1.421 1.00 0.00 C ATOM 694 CD1 PHE A 46 5.659 -7.030 -0.293 1.00 0.00 C ATOM 695 CD2 PHE A 46 7.544 -6.617 -1.695 1.00 0.00 C ATOM 696 CE1 PHE A 46 6.052 -6.004 0.544 1.00 0.00 C ATOM 697 CE2 PHE A 46 7.940 -5.588 -0.863 1.00 0.00 C ATOM 698 CZ PHE A 46 7.194 -5.282 0.259 1.00 0.00 C ATOM 0 H PHE A 46 6.311 -11.668 -1.793 1.00 0.00 H new ATOM 0 HA PHE A 46 6.087 -9.787 -0.630 1.00 0.00 H new ATOM 0 HB2 PHE A 46 6.795 -8.721 -2.994 1.00 0.00 H new ATOM 0 HB3 PHE A 46 5.147 -8.127 -2.950 1.00 0.00 H new ATOM 0 HD1 PHE A 46 4.764 -7.591 -0.066 1.00 0.00 H new ATOM 0 HD2 PHE A 46 8.133 -6.854 -2.569 1.00 0.00 H new ATOM 0 HE1 PHE A 46 5.467 -5.767 1.420 1.00 0.00 H new ATOM 0 HE2 PHE A 46 8.832 -5.023 -1.089 1.00 0.00 H new ATOM 0 HZ PHE A 46 7.504 -4.479 0.912 1.00 0.00 H new ATOM 708 N THR A 47 3.210 -9.745 -2.282 1.00 0.00 N ATOM 709 CA THR A 47 1.761 -9.683 -2.095 1.00 0.00 C ATOM 710 C THR A 47 1.301 -10.619 -0.974 1.00 0.00 C ATOM 711 O THR A 47 0.478 -10.234 -0.144 1.00 0.00 O ATOM 712 CB THR A 47 1.014 -10.011 -3.397 1.00 0.00 C ATOM 713 OG1 THR A 47 0.804 -11.405 -3.529 1.00 0.00 O ATOM 714 CG2 THR A 47 1.725 -9.533 -4.646 1.00 0.00 C ATOM 0 H THR A 47 3.507 -9.861 -3.251 1.00 0.00 H new ATOM 0 HA THR A 47 1.520 -8.659 -1.808 1.00 0.00 H new ATOM 0 HB THR A 47 0.067 -9.477 -3.314 1.00 0.00 H new ATOM 0 HG1 THR A 47 0.325 -11.586 -4.365 1.00 0.00 H new ATOM 0 HG21 THR A 47 1.137 -9.801 -5.524 1.00 0.00 H new ATOM 0 HG22 THR A 47 1.844 -8.450 -4.605 1.00 0.00 H new ATOM 0 HG23 THR A 47 2.706 -10.004 -4.709 1.00 0.00 H new ATOM 722 N PRO A 48 1.820 -11.863 -0.922 1.00 0.00 N ATOM 723 CA PRO A 48 1.440 -12.820 0.115 1.00 0.00 C ATOM 724 C PRO A 48 2.224 -12.624 1.412 1.00 0.00 C ATOM 725 O PRO A 48 1.918 -13.245 2.428 1.00 0.00 O ATOM 726 CB PRO A 48 1.783 -14.162 -0.523 1.00 0.00 C ATOM 727 CG PRO A 48 2.954 -13.875 -1.398 1.00 0.00 C ATOM 728 CD PRO A 48 2.813 -12.442 -1.856 1.00 0.00 C ATOM 0 HA PRO A 48 0.395 -12.719 0.407 1.00 0.00 H new ATOM 0 HB2 PRO A 48 2.027 -14.909 0.232 1.00 0.00 H new ATOM 0 HB3 PRO A 48 0.944 -14.553 -1.099 1.00 0.00 H new ATOM 0 HG2 PRO A 48 3.888 -14.017 -0.854 1.00 0.00 H new ATOM 0 HG3 PRO A 48 2.975 -14.554 -2.251 1.00 0.00 H new ATOM 0 HD2 PRO A 48 3.764 -11.912 -1.806 1.00 0.00 H new ATOM 0 HD3 PRO A 48 2.470 -12.385 -2.889 1.00 0.00 H new ATOM 736 N GLN A 49 3.232 -11.753 1.376 1.00 0.00 N ATOM 737 CA GLN A 49 4.042 -11.482 2.556 1.00 0.00 C ATOM 738 C GLN A 49 3.294 -10.556 3.508 1.00 0.00 C ATOM 739 O GLN A 49 3.328 -10.741 4.725 1.00 0.00 O ATOM 740 CB GLN A 49 5.395 -10.874 2.162 1.00 0.00 C ATOM 741 CG GLN A 49 6.479 -11.912 1.929 1.00 0.00 C ATOM 742 CD GLN A 49 7.738 -11.317 1.330 1.00 0.00 C ATOM 743 OE1 GLN A 49 7.740 -10.177 0.867 1.00 0.00 O ATOM 744 NE2 GLN A 49 8.820 -12.088 1.337 1.00 0.00 N ATOM 0 H GLN A 49 3.504 -11.227 0.545 1.00 0.00 H new ATOM 0 HA GLN A 49 4.233 -12.426 3.067 1.00 0.00 H new ATOM 0 HB2 GLN A 49 5.269 -10.282 1.256 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.720 -10.190 2.946 1.00 0.00 H new ATOM 0 HG2 GLN A 49 6.724 -12.394 2.875 1.00 0.00 H new ATOM 0 HG3 GLN A 49 6.097 -12.688 1.265 1.00 0.00 H new ATOM 0 HE21 GLN A 49 8.774 -13.028 1.731 1.00 0.00 H new ATOM 0 HE22 GLN A 49 9.697 -11.740 0.948 1.00 0.00 H new ATOM 753 N LEU A 50 2.612 -9.563 2.943 1.00 0.00 N ATOM 754 CA LEU A 50 1.847 -8.615 3.732 1.00 0.00 C ATOM 755 C LEU A 50 0.775 -9.323 4.546 1.00 0.00 C ATOM 756 O LEU A 50 0.636 -9.100 5.747 1.00 0.00 O ATOM 757 CB LEU A 50 1.182 -7.609 2.799 1.00 0.00 C ATOM 758 CG LEU A 50 1.182 -6.166 3.287 1.00 0.00 C ATOM 759 CD1 LEU A 50 0.805 -6.088 4.762 1.00 0.00 C ATOM 760 CD2 LEU A 50 2.543 -5.534 3.042 1.00 0.00 C ATOM 0 H LEU A 50 2.577 -9.398 1.937 1.00 0.00 H new ATOM 0 HA LEU A 50 2.526 -8.108 4.418 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.685 -7.648 1.833 1.00 0.00 H new ATOM 0 HB3 LEU A 50 0.150 -7.919 2.634 1.00 0.00 H new ATOM 0 HG LEU A 50 0.432 -5.610 2.724 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.813 -5.047 5.085 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.192 -6.505 4.905 1.00 0.00 H new ATOM 0 HD13 LEU A 50 1.524 -6.656 5.352 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.534 -4.502 3.394 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.307 -6.095 3.581 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.765 -5.551 1.975 1.00 0.00 H new ATOM 772 N ILE A 51 0.020 -10.177 3.871 1.00 0.00 N ATOM 773 CA ILE A 51 -1.051 -10.928 4.514 1.00 0.00 C ATOM 774 C ILE A 51 -0.500 -11.802 5.639 1.00 0.00 C ATOM 775 O ILE A 51 -1.156 -11.996 6.661 1.00 0.00 O ATOM 776 CB ILE A 51 -1.818 -11.804 3.489 1.00 0.00 C ATOM 777 CG1 ILE A 51 -2.767 -10.941 2.649 1.00 0.00 C ATOM 778 CG2 ILE A 51 -2.596 -12.911 4.190 1.00 0.00 C ATOM 779 CD1 ILE A 51 -2.158 -9.638 2.174 1.00 0.00 C ATOM 0 H ILE A 51 0.129 -10.368 2.875 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.749 -10.206 4.938 1.00 0.00 H new ATOM 0 HB ILE A 51 -1.085 -12.267 2.828 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.092 -11.516 1.782 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -3.658 -10.721 3.237 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -3.124 -13.510 3.448 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.905 -13.546 4.744 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -3.316 -12.470 4.879 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.892 -9.086 1.587 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -1.859 -9.041 3.035 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -1.284 -9.848 1.557 1.00 0.00 H new ATOM 791 N GLU A 52 0.707 -12.322 5.448 1.00 0.00 N ATOM 792 CA GLU A 52 1.337 -13.169 6.455 1.00 0.00 C ATOM 793 C GLU A 52 1.743 -12.348 7.675 1.00 0.00 C ATOM 794 O GLU A 52 1.412 -12.697 8.808 1.00 0.00 O ATOM 795 CB GLU A 52 2.563 -13.873 5.867 1.00 0.00 C ATOM 796 CG GLU A 52 2.759 -15.287 6.388 1.00 0.00 C ATOM 797 CD GLU A 52 4.198 -15.754 6.280 1.00 0.00 C ATOM 798 OE1 GLU A 52 5.105 -14.896 6.334 1.00 0.00 O ATOM 799 OE2 GLU A 52 4.417 -16.975 6.140 1.00 0.00 O ATOM 0 H GLU A 52 1.267 -12.173 4.609 1.00 0.00 H new ATOM 0 HA GLU A 52 0.613 -13.921 6.768 1.00 0.00 H new ATOM 0 HB2 GLU A 52 2.468 -13.904 4.782 1.00 0.00 H new ATOM 0 HB3 GLU A 52 3.453 -13.285 6.092 1.00 0.00 H new ATOM 0 HG2 GLU A 52 2.443 -15.333 7.430 1.00 0.00 H new ATOM 0 HG3 GLU A 52 2.117 -15.968 5.830 1.00 0.00 H new ATOM 806 N PHE A 53 2.457 -11.254 7.432 1.00 0.00 N ATOM 807 CA PHE A 53 2.904 -10.377 8.509 1.00 0.00 C ATOM 808 C PHE A 53 1.725 -9.611 9.105 1.00 0.00 C ATOM 809 O PHE A 53 1.750 -9.224 10.274 1.00 0.00 O ATOM 810 CB PHE A 53 3.962 -9.396 7.988 1.00 0.00 C ATOM 811 CG PHE A 53 4.366 -8.352 8.991 1.00 0.00 C ATOM 812 CD1 PHE A 53 4.904 -8.716 10.215 1.00 0.00 C ATOM 813 CD2 PHE A 53 4.205 -7.004 8.709 1.00 0.00 C ATOM 814 CE1 PHE A 53 5.275 -7.756 11.138 1.00 0.00 C ATOM 815 CE2 PHE A 53 4.574 -6.040 9.628 1.00 0.00 C ATOM 816 CZ PHE A 53 5.110 -6.417 10.845 1.00 0.00 C ATOM 0 H PHE A 53 2.739 -10.953 6.499 1.00 0.00 H new ATOM 0 HA PHE A 53 3.347 -10.992 9.292 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.846 -9.957 7.685 1.00 0.00 H new ATOM 0 HB3 PHE A 53 3.577 -8.901 7.097 1.00 0.00 H new ATOM 0 HD1 PHE A 53 5.035 -9.762 10.451 1.00 0.00 H new ATOM 0 HD2 PHE A 53 3.786 -6.704 7.760 1.00 0.00 H new ATOM 0 HE1 PHE A 53 5.694 -8.053 12.088 1.00 0.00 H new ATOM 0 HE2 PHE A 53 4.444 -4.993 9.396 1.00 0.00 H new ATOM 0 HZ PHE A 53 5.399 -5.666 11.565 1.00 0.00 H new ATOM 826 N TYR A 54 0.701 -9.386 8.289 1.00 0.00 N ATOM 827 CA TYR A 54 -0.484 -8.656 8.725 1.00 0.00 C ATOM 828 C TYR A 54 -1.473 -9.569 9.448 1.00 0.00 C ATOM 829 O TYR A 54 -1.946 -9.243 10.534 1.00 0.00 O ATOM 830 CB TYR A 54 -1.164 -7.998 7.520 1.00 0.00 C ATOM 831 CG TYR A 54 -2.508 -7.379 7.835 1.00 0.00 C ATOM 832 CD1 TYR A 54 -2.650 -6.475 8.880 1.00 0.00 C ATOM 833 CD2 TYR A 54 -3.635 -7.702 7.089 1.00 0.00 C ATOM 834 CE1 TYR A 54 -3.877 -5.911 9.172 1.00 0.00 C ATOM 835 CE2 TYR A 54 -4.864 -7.141 7.374 1.00 0.00 C ATOM 836 CZ TYR A 54 -4.980 -6.247 8.416 1.00 0.00 C ATOM 837 OH TYR A 54 -6.204 -5.687 8.704 1.00 0.00 O ATOM 0 H TYR A 54 0.668 -9.700 7.319 1.00 0.00 H new ATOM 0 HA TYR A 54 -0.164 -7.888 9.429 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -0.505 -7.227 7.120 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -1.294 -8.745 6.736 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -1.788 -6.209 9.474 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -3.548 -8.404 6.273 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -3.972 -5.210 9.988 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -5.730 -7.402 6.783 1.00 0.00 H new ATOM 0 HH TYR A 54 -6.075 -4.782 9.057 1.00 0.00 H new ATOM 847 N ASP A 55 -1.796 -10.702 8.837 1.00 0.00 N ATOM 848 CA ASP A 55 -2.746 -11.644 9.423 1.00 0.00 C ATOM 849 C ASP A 55 -2.328 -12.078 10.827 1.00 0.00 C ATOM 850 O ASP A 55 -3.169 -12.465 11.639 1.00 0.00 O ATOM 851 CB ASP A 55 -2.896 -12.874 8.526 1.00 0.00 C ATOM 852 CG ASP A 55 -3.970 -13.823 9.021 1.00 0.00 C ATOM 853 OD1 ASP A 55 -4.843 -13.379 9.797 1.00 0.00 O ATOM 854 OD2 ASP A 55 -3.940 -15.009 8.631 1.00 0.00 O ATOM 0 H ASP A 55 -1.415 -10.992 7.936 1.00 0.00 H new ATOM 0 HA ASP A 55 -3.704 -11.130 9.503 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.137 -12.554 7.512 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -1.944 -13.402 8.476 1.00 0.00 H new ATOM 859 N LYS A 56 -1.030 -12.039 11.103 1.00 0.00 N ATOM 860 CA LYS A 56 -0.515 -12.456 12.398 1.00 0.00 C ATOM 861 C LYS A 56 -0.507 -11.320 13.426 1.00 0.00 C ATOM 862 O LYS A 56 -0.308 -11.565 14.615 1.00 0.00 O ATOM 863 CB LYS A 56 0.899 -13.018 12.244 1.00 0.00 C ATOM 864 CG LYS A 56 0.972 -14.241 11.345 1.00 0.00 C ATOM 865 CD LYS A 56 0.245 -15.429 11.958 1.00 0.00 C ATOM 866 CE LYS A 56 1.220 -16.460 12.502 1.00 0.00 C ATOM 867 NZ LYS A 56 1.404 -17.602 11.563 1.00 0.00 N ATOM 0 H LYS A 56 -0.316 -11.723 10.446 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.188 -13.228 12.772 1.00 0.00 H new ATOM 0 HB2 LYS A 56 1.548 -12.241 11.840 1.00 0.00 H new ATOM 0 HB3 LYS A 56 1.287 -13.277 13.229 1.00 0.00 H new ATOM 0 HG2 LYS A 56 0.535 -14.007 10.374 1.00 0.00 H new ATOM 0 HG3 LYS A 56 2.015 -14.503 11.169 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -0.406 -15.083 12.761 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -0.394 -15.893 11.207 1.00 0.00 H new ATOM 0 HE2 LYS A 56 2.183 -15.985 12.689 1.00 0.00 H new ATOM 0 HE3 LYS A 56 0.857 -16.833 13.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 2.076 -18.282 11.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 0.490 -18.071 11.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 1.775 -17.250 10.657 1.00 0.00 H new ATOM 881 N PHE A 57 -0.701 -10.083 12.976 1.00 0.00 N ATOM 882 CA PHE A 57 -0.682 -8.942 13.890 1.00 0.00 C ATOM 883 C PHE A 57 -1.809 -7.944 13.610 1.00 0.00 C ATOM 884 O PHE A 57 -1.879 -6.894 14.249 1.00 0.00 O ATOM 885 CB PHE A 57 0.668 -8.231 13.804 1.00 0.00 C ATOM 886 CG PHE A 57 1.178 -7.741 15.129 1.00 0.00 C ATOM 887 CD1 PHE A 57 0.712 -6.554 15.669 1.00 0.00 C ATOM 888 CD2 PHE A 57 2.124 -8.468 15.834 1.00 0.00 C ATOM 889 CE1 PHE A 57 1.179 -6.101 16.888 1.00 0.00 C ATOM 890 CE2 PHE A 57 2.595 -8.021 17.053 1.00 0.00 C ATOM 891 CZ PHE A 57 2.123 -6.834 17.582 1.00 0.00 C ATOM 0 H PHE A 57 -0.871 -9.846 11.999 1.00 0.00 H new ATOM 0 HA PHE A 57 -0.838 -9.334 14.895 1.00 0.00 H new ATOM 0 HB2 PHE A 57 1.401 -8.913 13.372 1.00 0.00 H new ATOM 0 HB3 PHE A 57 0.580 -7.384 13.123 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -0.025 -5.976 15.131 1.00 0.00 H new ATOM 0 HD2 PHE A 57 2.497 -9.395 15.425 1.00 0.00 H new ATOM 0 HE1 PHE A 57 0.806 -5.174 17.298 1.00 0.00 H new ATOM 0 HE2 PHE A 57 3.331 -8.598 17.593 1.00 0.00 H new ATOM 0 HZ PHE A 57 2.491 -6.481 18.534 1.00 0.00 H new ATOM 901 N HIS A 58 -2.674 -8.252 12.648 1.00 0.00 N ATOM 902 CA HIS A 58 -3.764 -7.355 12.293 1.00 0.00 C ATOM 903 C HIS A 58 -4.623 -6.997 13.505 1.00 0.00 C ATOM 904 O HIS A 58 -5.121 -5.881 13.613 1.00 0.00 O ATOM 905 CB HIS A 58 -4.638 -7.980 11.200 1.00 0.00 C ATOM 906 CG HIS A 58 -5.539 -9.072 11.694 1.00 0.00 C ATOM 907 ND1 HIS A 58 -5.194 -10.406 11.665 1.00 0.00 N ATOM 908 CD2 HIS A 58 -6.782 -9.019 12.231 1.00 0.00 C ATOM 909 CE1 HIS A 58 -6.183 -11.127 12.162 1.00 0.00 C ATOM 910 NE2 HIS A 58 -7.158 -10.309 12.513 1.00 0.00 N ATOM 0 H HIS A 58 -2.640 -9.114 12.103 1.00 0.00 H new ATOM 0 HA HIS A 58 -3.317 -6.435 11.916 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -5.246 -7.199 10.744 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -3.993 -8.380 10.417 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -7.368 -8.128 12.405 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -6.192 -12.202 12.264 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -8.047 -10.590 12.927 1.00 0.00 H new ATOM 919 N GLU A 59 -4.810 -7.955 14.400 1.00 0.00 N ATOM 920 CA GLU A 59 -5.629 -7.738 15.587 1.00 0.00 C ATOM 921 C GLU A 59 -5.047 -6.665 16.500 1.00 0.00 C ATOM 922 O GLU A 59 -5.748 -5.742 16.917 1.00 0.00 O ATOM 923 CB GLU A 59 -5.761 -9.044 16.364 1.00 0.00 C ATOM 924 CG GLU A 59 -4.442 -9.772 16.579 1.00 0.00 C ATOM 925 CD GLU A 59 -4.552 -11.264 16.331 1.00 0.00 C ATOM 926 OE1 GLU A 59 -4.510 -11.675 15.152 1.00 0.00 O ATOM 927 OE2 GLU A 59 -4.682 -12.021 17.316 1.00 0.00 O ATOM 0 H GLU A 59 -4.407 -8.889 14.329 1.00 0.00 H new ATOM 0 HA GLU A 59 -6.607 -7.394 15.251 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -6.211 -8.834 17.334 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -6.446 -9.704 15.832 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -3.687 -9.352 15.915 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -4.099 -9.601 17.600 1.00 0.00 H new ATOM 934 N SER A 60 -3.772 -6.805 16.824 1.00 0.00 N ATOM 935 CA SER A 60 -3.095 -5.862 17.711 1.00 0.00 C ATOM 936 C SER A 60 -2.818 -4.525 17.025 1.00 0.00 C ATOM 937 O SER A 60 -3.068 -3.465 17.599 1.00 0.00 O ATOM 938 CB SER A 60 -1.784 -6.466 18.215 1.00 0.00 C ATOM 939 OG SER A 60 -1.060 -5.533 18.998 1.00 0.00 O ATOM 0 H SER A 60 -3.180 -7.564 16.487 1.00 0.00 H new ATOM 0 HA SER A 60 -3.761 -5.670 18.552 1.00 0.00 H new ATOM 0 HB2 SER A 60 -1.994 -7.357 18.807 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.176 -6.783 17.367 1.00 0.00 H new ATOM 0 HG SER A 60 -0.103 -5.618 18.806 1.00 0.00 H new ATOM 945 N LYS A 61 -2.281 -4.575 15.812 1.00 0.00 N ATOM 946 CA LYS A 61 -1.952 -3.358 15.075 1.00 0.00 C ATOM 947 C LYS A 61 -3.175 -2.758 14.382 1.00 0.00 C ATOM 948 O LYS A 61 -3.266 -1.541 14.219 1.00 0.00 O ATOM 949 CB LYS A 61 -0.851 -3.645 14.051 1.00 0.00 C ATOM 950 CG LYS A 61 0.537 -3.246 14.532 1.00 0.00 C ATOM 951 CD LYS A 61 1.636 -3.924 13.725 1.00 0.00 C ATOM 952 CE LYS A 61 1.405 -3.764 12.201 1.00 0.00 C ATOM 953 NZ LYS A 61 2.455 -4.465 11.412 1.00 0.00 N ATOM 0 H LYS A 61 -2.064 -5.441 15.318 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.594 -2.624 15.797 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -0.854 -4.709 13.813 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.075 -3.111 13.127 1.00 0.00 H new ATOM 0 HG2 LYS A 61 0.649 -2.164 14.460 1.00 0.00 H new ATOM 0 HG3 LYS A 61 0.645 -3.508 15.584 1.00 0.00 H new ATOM 0 HD2 LYS A 61 2.602 -3.497 13.994 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.674 -4.983 13.979 1.00 0.00 H new ATOM 0 HE2 LYS A 61 0.425 -4.161 11.937 1.00 0.00 H new ATOM 0 HE3 LYS A 61 1.400 -2.705 11.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 3.066 -3.764 10.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 3.029 -5.057 12.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 2.005 -5.065 10.691 1.00 0.00 H new ATOM 967 N ASN A 62 -4.115 -3.608 13.980 1.00 0.00 N ATOM 968 CA ASN A 62 -5.332 -3.149 13.310 1.00 0.00 C ATOM 969 C ASN A 62 -5.021 -2.131 12.211 1.00 0.00 C ATOM 970 O ASN A 62 -5.308 -0.943 12.353 1.00 0.00 O ATOM 971 CB ASN A 62 -6.290 -2.540 14.333 1.00 0.00 C ATOM 972 CG ASN A 62 -7.744 -2.719 13.943 1.00 0.00 C ATOM 973 OD1 ASN A 62 -8.512 -3.370 14.651 1.00 0.00 O ATOM 974 ND2 ASN A 62 -8.130 -2.142 12.812 1.00 0.00 N ATOM 0 H ASN A 62 -4.059 -4.619 14.106 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.802 -4.013 12.839 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -6.119 -3.000 15.306 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -6.074 -1.477 14.441 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -9.097 -2.229 12.499 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -7.460 -1.611 12.256 1.00 0.00 H new ATOM 981 N PHE A 63 -4.441 -2.610 11.113 1.00 0.00 N ATOM 982 CA PHE A 63 -4.097 -1.748 9.983 1.00 0.00 C ATOM 983 C PHE A 63 -4.586 -2.360 8.672 1.00 0.00 C ATOM 984 O PHE A 63 -5.035 -3.504 8.643 1.00 0.00 O ATOM 985 CB PHE A 63 -2.587 -1.507 9.915 1.00 0.00 C ATOM 986 CG PHE A 63 -2.013 -0.861 11.147 1.00 0.00 C ATOM 987 CD1 PHE A 63 -2.741 0.076 11.863 1.00 0.00 C ATOM 988 CD2 PHE A 63 -0.739 -1.187 11.581 1.00 0.00 C ATOM 989 CE1 PHE A 63 -2.209 0.674 12.991 1.00 0.00 C ATOM 990 CE2 PHE A 63 -0.201 -0.592 12.706 1.00 0.00 C ATOM 991 CZ PHE A 63 -0.937 0.339 13.412 1.00 0.00 C ATOM 0 H PHE A 63 -4.199 -3.592 10.981 1.00 0.00 H new ATOM 0 HA PHE A 63 -4.593 -0.789 10.133 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -2.085 -2.460 9.750 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -2.369 -0.878 9.052 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -3.735 0.342 11.536 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -0.159 -1.915 11.034 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -2.787 1.401 13.541 1.00 0.00 H new ATOM 0 HE2 PHE A 63 0.794 -0.855 13.033 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.519 0.805 14.292 1.00 0.00 H new ATOM 1001 N GLU A 64 -4.502 -1.591 7.589 1.00 0.00 N ATOM 1002 CA GLU A 64 -4.935 -2.056 6.289 1.00 0.00 C ATOM 1003 C GLU A 64 -3.920 -1.682 5.217 1.00 0.00 C ATOM 1004 O GLU A 64 -3.368 -0.582 5.216 1.00 0.00 O ATOM 1005 CB GLU A 64 -6.296 -1.463 5.936 1.00 0.00 C ATOM 1006 CG GLU A 64 -7.007 -2.192 4.808 1.00 0.00 C ATOM 1007 CD GLU A 64 -7.248 -3.657 5.121 1.00 0.00 C ATOM 1008 OE1 GLU A 64 -8.304 -3.972 5.709 1.00 0.00 O ATOM 1009 OE2 GLU A 64 -6.381 -4.487 4.778 1.00 0.00 O ATOM 0 H GLU A 64 -4.135 -0.639 7.594 1.00 0.00 H new ATOM 0 HA GLU A 64 -5.019 -3.142 6.331 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -6.930 -1.478 6.823 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -6.165 -0.418 5.655 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.962 -1.705 4.610 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -6.413 -2.112 3.897 1.00 0.00 H new ATOM 1016 N VAL A 65 -3.695 -2.607 4.308 1.00 0.00 N ATOM 1017 CA VAL A 65 -2.758 -2.408 3.205 1.00 0.00 C ATOM 1018 C VAL A 65 -3.505 -2.292 1.880 1.00 0.00 C ATOM 1019 O VAL A 65 -4.156 -3.235 1.445 1.00 0.00 O ATOM 1020 CB VAL A 65 -1.734 -3.560 3.118 1.00 0.00 C ATOM 1021 CG1 VAL A 65 -0.801 -3.377 1.925 1.00 0.00 C ATOM 1022 CG2 VAL A 65 -0.944 -3.663 4.416 1.00 0.00 C ATOM 0 H VAL A 65 -4.152 -3.519 4.306 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.220 -1.480 3.400 1.00 0.00 H new ATOM 0 HB VAL A 65 -2.279 -4.492 2.970 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.091 -4.203 1.889 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -1.386 -3.360 1.005 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.259 -2.437 2.028 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.226 -4.479 4.341 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.413 -2.728 4.594 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.627 -3.856 5.243 1.00 0.00 H new ATOM 1032 N VAL A 66 -3.407 -1.131 1.245 1.00 0.00 N ATOM 1033 CA VAL A 66 -4.083 -0.899 -0.027 1.00 0.00 C ATOM 1034 C VAL A 66 -3.177 -1.278 -1.199 1.00 0.00 C ATOM 1035 O VAL A 66 -1.957 -1.144 -1.113 1.00 0.00 O ATOM 1036 CB VAL A 66 -4.507 0.577 -0.169 1.00 0.00 C ATOM 1037 CG1 VAL A 66 -5.371 0.781 -1.405 1.00 0.00 C ATOM 1038 CG2 VAL A 66 -5.237 1.044 1.082 1.00 0.00 C ATOM 0 H VAL A 66 -2.867 -0.336 1.588 1.00 0.00 H new ATOM 0 HA VAL A 66 -4.974 -1.527 -0.042 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.606 1.179 -0.288 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -5.656 1.830 -1.481 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -4.809 0.492 -2.293 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -6.268 0.166 -1.327 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.529 2.088 0.965 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -6.127 0.433 1.233 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -4.579 0.946 1.945 1.00 0.00 H new ATOM 1048 N PHE A 67 -3.773 -1.762 -2.290 1.00 0.00 N ATOM 1049 CA PHE A 67 -2.997 -2.163 -3.458 1.00 0.00 C ATOM 1050 C PHE A 67 -2.815 -1.004 -4.436 1.00 0.00 C ATOM 1051 O PHE A 67 -3.786 -0.390 -4.881 1.00 0.00 O ATOM 1052 CB PHE A 67 -3.663 -3.357 -4.156 1.00 0.00 C ATOM 1053 CG PHE A 67 -3.393 -3.458 -5.636 1.00 0.00 C ATOM 1054 CD1 PHE A 67 -2.116 -3.262 -6.138 1.00 0.00 C ATOM 1055 CD2 PHE A 67 -4.417 -3.757 -6.520 1.00 0.00 C ATOM 1056 CE1 PHE A 67 -1.867 -3.360 -7.494 1.00 0.00 C ATOM 1057 CE2 PHE A 67 -4.174 -3.856 -7.877 1.00 0.00 C ATOM 1058 CZ PHE A 67 -2.898 -3.657 -8.365 1.00 0.00 C ATOM 0 H PHE A 67 -4.781 -1.884 -2.387 1.00 0.00 H new ATOM 0 HA PHE A 67 -2.007 -2.462 -3.114 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -3.324 -4.275 -3.676 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -4.740 -3.295 -4.001 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -1.306 -3.030 -5.462 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -5.417 -3.915 -6.144 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -0.868 -3.205 -7.873 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -4.982 -4.089 -8.555 1.00 0.00 H new ATOM 0 HZ PHE A 67 -2.706 -3.733 -9.425 1.00 0.00 H new ATOM 1068 N CYS A 68 -1.562 -0.735 -4.785 1.00 0.00 N ATOM 1069 CA CYS A 68 -1.236 0.322 -5.732 1.00 0.00 C ATOM 1070 C CYS A 68 -0.673 -0.294 -7.007 1.00 0.00 C ATOM 1071 O CYS A 68 0.414 -0.870 -7.003 1.00 0.00 O ATOM 1072 CB CYS A 68 -0.230 1.302 -5.130 1.00 0.00 C ATOM 1073 SG CYS A 68 -0.971 2.831 -4.512 1.00 0.00 S ATOM 0 H CYS A 68 -0.752 -1.238 -4.423 1.00 0.00 H new ATOM 0 HA CYS A 68 -2.145 0.875 -5.967 1.00 0.00 H new ATOM 0 HB2 CYS A 68 0.297 0.810 -4.313 1.00 0.00 H new ATOM 0 HB3 CYS A 68 0.515 1.551 -5.885 1.00 0.00 H new ATOM 0 HG CYS A 68 -0.042 3.596 -4.020 1.00 0.00 H new ATOM 1079 N THR A 69 -1.431 -0.189 -8.089 1.00 0.00 N ATOM 1080 CA THR A 69 -1.019 -0.759 -9.366 1.00 0.00 C ATOM 1081 C THR A 69 0.022 0.109 -10.066 1.00 0.00 C ATOM 1082 O THR A 69 0.227 1.270 -9.714 1.00 0.00 O ATOM 1083 CB THR A 69 -2.236 -0.952 -10.273 1.00 0.00 C ATOM 1084 OG1 THR A 69 -1.921 -1.806 -11.360 1.00 0.00 O ATOM 1085 CG2 THR A 69 -2.768 0.343 -10.843 1.00 0.00 C ATOM 0 H THR A 69 -2.334 0.285 -8.109 1.00 0.00 H new ATOM 0 HA THR A 69 -0.560 -1.726 -9.162 1.00 0.00 H new ATOM 0 HB THR A 69 -3.004 -1.391 -9.637 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.029 -2.740 -11.084 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.630 0.135 -11.477 1.00 0.00 H new ATOM 0 HG22 THR A 69 -3.067 1.003 -10.029 1.00 0.00 H new ATOM 0 HG23 THR A 69 -1.991 0.826 -11.435 1.00 0.00 H new ATOM 1093 N TRP A 70 0.671 -0.476 -11.065 1.00 0.00 N ATOM 1094 CA TRP A 70 1.696 0.216 -11.839 1.00 0.00 C ATOM 1095 C TRP A 70 1.745 -0.326 -13.269 1.00 0.00 C ATOM 1096 O TRP A 70 2.822 -0.511 -13.837 1.00 0.00 O ATOM 1097 CB TRP A 70 3.062 0.052 -11.168 1.00 0.00 C ATOM 1098 CG TRP A 70 3.758 1.352 -10.904 1.00 0.00 C ATOM 1099 CD1 TRP A 70 3.634 2.135 -9.793 1.00 0.00 C ATOM 1100 CD2 TRP A 70 4.686 2.020 -11.766 1.00 0.00 C ATOM 1101 NE1 TRP A 70 4.430 3.248 -9.909 1.00 0.00 N ATOM 1102 CE2 TRP A 70 5.086 3.201 -11.112 1.00 0.00 C ATOM 1103 CE3 TRP A 70 5.219 1.734 -13.025 1.00 0.00 C ATOM 1104 CZ2 TRP A 70 5.993 4.094 -11.676 1.00 0.00 C ATOM 1105 CZ3 TRP A 70 6.120 2.621 -13.584 1.00 0.00 C ATOM 1106 CH2 TRP A 70 6.499 3.788 -12.910 1.00 0.00 C ATOM 0 H TRP A 70 0.504 -1.438 -11.361 1.00 0.00 H new ATOM 0 HA TRP A 70 1.445 1.276 -11.878 1.00 0.00 H new ATOM 0 HB2 TRP A 70 2.933 -0.480 -10.225 1.00 0.00 H new ATOM 0 HB3 TRP A 70 3.696 -0.569 -11.801 1.00 0.00 H new ATOM 0 HD1 TRP A 70 3.002 1.912 -8.946 1.00 0.00 H new ATOM 0 HE1 TRP A 70 4.519 3.989 -9.214 1.00 0.00 H new ATOM 0 HE3 TRP A 70 4.932 0.836 -13.552 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 6.287 4.995 -11.158 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 6.539 2.410 -14.557 1.00 0.00 H new ATOM 0 HH2 TRP A 70 7.205 4.461 -13.374 1.00 0.00 H new ATOM 1117 N ASP A 71 0.572 -0.584 -13.841 1.00 0.00 N ATOM 1118 CA ASP A 71 0.476 -1.112 -15.197 1.00 0.00 C ATOM 1119 C ASP A 71 -0.029 -0.046 -16.165 1.00 0.00 C ATOM 1120 O ASP A 71 -0.354 1.071 -15.762 1.00 0.00 O ATOM 1121 CB ASP A 71 -0.462 -2.322 -15.229 1.00 0.00 C ATOM 1122 CG ASP A 71 -0.056 -3.398 -14.240 1.00 0.00 C ATOM 1123 OD1 ASP A 71 -0.309 -3.216 -13.030 1.00 0.00 O ATOM 1124 OD2 ASP A 71 0.515 -4.419 -14.675 1.00 0.00 O ATOM 0 H ASP A 71 -0.328 -0.435 -13.384 1.00 0.00 H new ATOM 0 HA ASP A 71 1.474 -1.420 -15.509 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.478 -1.996 -15.009 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.473 -2.743 -16.234 1.00 0.00 H new ATOM 1129 N GLU A 72 -0.095 -0.402 -17.444 1.00 0.00 N ATOM 1130 CA GLU A 72 -0.565 0.518 -18.472 1.00 0.00 C ATOM 1131 C GLU A 72 -1.974 0.148 -18.927 1.00 0.00 C ATOM 1132 O GLU A 72 -2.752 1.010 -19.336 1.00 0.00 O ATOM 1133 CB GLU A 72 0.388 0.510 -19.668 1.00 0.00 C ATOM 1134 CG GLU A 72 1.839 0.764 -19.292 1.00 0.00 C ATOM 1135 CD GLU A 72 2.805 0.347 -20.383 1.00 0.00 C ATOM 1136 OE1 GLU A 72 2.521 0.626 -21.567 1.00 0.00 O ATOM 1137 OE2 GLU A 72 3.847 -0.258 -20.054 1.00 0.00 O ATOM 0 H GLU A 72 0.172 -1.323 -17.793 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.591 1.520 -18.045 1.00 0.00 H new ATOM 0 HB2 GLU A 72 0.316 -0.453 -20.173 1.00 0.00 H new ATOM 0 HB3 GLU A 72 0.068 1.269 -20.382 1.00 0.00 H new ATOM 0 HG2 GLU A 72 1.975 1.824 -19.077 1.00 0.00 H new ATOM 0 HG3 GLU A 72 2.074 0.221 -18.377 1.00 0.00 H new ATOM 1144 N GLU A 73 -2.295 -1.140 -18.849 1.00 0.00 N ATOM 1145 CA GLU A 73 -3.611 -1.626 -19.250 1.00 0.00 C ATOM 1146 C GLU A 73 -4.479 -1.912 -18.029 1.00 0.00 C ATOM 1147 O GLU A 73 -3.972 -2.251 -16.960 1.00 0.00 O ATOM 1148 CB GLU A 73 -3.473 -2.891 -20.100 1.00 0.00 C ATOM 1149 CG GLU A 73 -4.623 -3.098 -21.073 1.00 0.00 C ATOM 1150 CD GLU A 73 -4.472 -2.278 -22.339 1.00 0.00 C ATOM 1151 OE1 GLU A 73 -3.331 -1.885 -22.659 1.00 0.00 O ATOM 1152 OE2 GLU A 73 -5.496 -2.028 -23.010 1.00 0.00 O ATOM 0 H GLU A 73 -1.662 -1.866 -18.512 1.00 0.00 H new ATOM 0 HA GLU A 73 -4.094 -0.849 -19.843 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -2.539 -2.843 -20.659 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -3.405 -3.756 -19.441 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -4.687 -4.154 -21.334 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -5.560 -2.834 -20.583 1.00 0.00 H new ATOM 1159 N GLU A 74 -5.790 -1.773 -18.197 1.00 0.00 N ATOM 1160 CA GLU A 74 -6.731 -2.016 -17.108 1.00 0.00 C ATOM 1161 C GLU A 74 -6.860 -3.507 -16.816 1.00 0.00 C ATOM 1162 O GLU A 74 -6.922 -3.921 -15.659 1.00 0.00 O ATOM 1163 CB GLU A 74 -8.103 -1.434 -17.451 1.00 0.00 C ATOM 1164 CG GLU A 74 -8.101 0.078 -17.607 1.00 0.00 C ATOM 1165 CD GLU A 74 -9.073 0.555 -18.670 1.00 0.00 C ATOM 1166 OE1 GLU A 74 -10.000 -0.208 -19.012 1.00 0.00 O ATOM 1167 OE2 GLU A 74 -8.907 1.693 -19.158 1.00 0.00 O ATOM 0 H GLU A 74 -6.225 -1.494 -19.076 1.00 0.00 H new ATOM 0 HA GLU A 74 -6.345 -1.523 -16.216 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.459 -1.886 -18.377 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.811 -1.709 -16.669 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -8.357 0.539 -16.653 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -7.095 0.412 -17.863 1.00 0.00 H new ATOM 1174 N ASP A 75 -6.904 -4.310 -17.875 1.00 0.00 N ATOM 1175 CA ASP A 75 -7.031 -5.757 -17.736 1.00 0.00 C ATOM 1176 C ASP A 75 -5.904 -6.333 -16.881 1.00 0.00 C ATOM 1177 O ASP A 75 -6.049 -7.403 -16.290 1.00 0.00 O ATOM 1178 CB ASP A 75 -7.031 -6.423 -19.112 1.00 0.00 C ATOM 1179 CG ASP A 75 -7.631 -7.816 -19.081 1.00 0.00 C ATOM 1180 OD1 ASP A 75 -7.658 -8.425 -17.991 1.00 0.00 O ATOM 1181 OD2 ASP A 75 -8.073 -8.296 -20.145 1.00 0.00 O ATOM 0 H ASP A 75 -6.854 -3.983 -18.840 1.00 0.00 H new ATOM 0 HA ASP A 75 -7.978 -5.962 -17.236 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -7.592 -5.804 -19.812 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -6.008 -6.479 -19.485 1.00 0.00 H new ATOM 1186 N GLY A 76 -4.782 -5.622 -16.822 1.00 0.00 N ATOM 1187 CA GLY A 76 -3.653 -6.089 -16.039 1.00 0.00 C ATOM 1188 C GLY A 76 -3.887 -5.969 -14.545 1.00 0.00 C ATOM 1189 O GLY A 76 -3.788 -6.955 -13.815 1.00 0.00 O ATOM 0 H GLY A 76 -4.635 -4.734 -17.301 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -3.449 -7.130 -16.288 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.766 -5.517 -16.311 1.00 0.00 H new ATOM 1193 N PHE A 77 -4.193 -4.760 -14.088 1.00 0.00 N ATOM 1194 CA PHE A 77 -4.436 -4.517 -12.670 1.00 0.00 C ATOM 1195 C PHE A 77 -5.589 -5.378 -12.154 1.00 0.00 C ATOM 1196 O PHE A 77 -5.525 -5.926 -11.054 1.00 0.00 O ATOM 1197 CB PHE A 77 -4.726 -3.026 -12.431 1.00 0.00 C ATOM 1198 CG PHE A 77 -6.189 -2.684 -12.336 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -6.863 -2.796 -11.131 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -6.886 -2.252 -13.452 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -8.206 -2.484 -11.041 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -8.229 -1.938 -13.368 1.00 0.00 C ATOM 1203 CZ PHE A 77 -8.891 -2.053 -12.160 1.00 0.00 C ATOM 0 H PHE A 77 -4.279 -3.933 -14.678 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.539 -4.794 -12.117 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.232 -2.716 -11.510 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -4.282 -2.448 -13.241 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -6.333 -3.131 -10.252 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -6.374 -2.159 -14.399 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -8.720 -2.577 -10.096 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -8.761 -1.603 -14.246 1.00 0.00 H new ATOM 0 HZ PHE A 77 -9.940 -1.807 -12.092 1.00 0.00 H new ATOM 1213 N ALA A 78 -6.642 -5.485 -12.957 1.00 0.00 N ATOM 1214 CA ALA A 78 -7.818 -6.270 -12.589 1.00 0.00 C ATOM 1215 C ALA A 78 -7.457 -7.710 -12.283 1.00 0.00 C ATOM 1216 O ALA A 78 -7.763 -8.225 -11.208 1.00 0.00 O ATOM 1217 CB ALA A 78 -8.798 -6.261 -13.722 1.00 0.00 C ATOM 0 H ALA A 78 -6.706 -5.037 -13.871 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.249 -5.819 -11.695 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.676 -6.846 -13.448 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -9.098 -5.235 -13.935 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -8.334 -6.695 -14.608 1.00 0.00 H new ATOM 1223 N GLY A 79 -6.770 -8.349 -13.226 1.00 0.00 N ATOM 1224 CA GLY A 79 -6.342 -9.714 -13.019 1.00 0.00 C ATOM 1225 C GLY A 79 -5.508 -9.811 -11.767 1.00 0.00 C ATOM 1226 O GLY A 79 -5.251 -10.898 -11.249 1.00 0.00 O ATOM 0 H GLY A 79 -6.505 -7.945 -14.124 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -7.211 -10.367 -12.938 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.764 -10.056 -13.878 1.00 0.00 H new ATOM 1230 N TYR A 80 -5.084 -8.645 -11.289 1.00 0.00 N ATOM 1231 CA TYR A 80 -4.261 -8.560 -10.088 1.00 0.00 C ATOM 1232 C TYR A 80 -5.108 -8.249 -8.854 1.00 0.00 C ATOM 1233 O TYR A 80 -4.840 -8.755 -7.765 1.00 0.00 O ATOM 1234 CB TYR A 80 -3.181 -7.491 -10.260 1.00 0.00 C ATOM 1235 CG TYR A 80 -1.903 -7.792 -9.506 1.00 0.00 C ATOM 1236 CD1 TYR A 80 -1.330 -9.056 -9.549 1.00 0.00 C ATOM 1237 CD2 TYR A 80 -1.271 -6.810 -8.754 1.00 0.00 C ATOM 1238 CE1 TYR A 80 -0.164 -9.335 -8.863 1.00 0.00 C ATOM 1239 CE2 TYR A 80 -0.104 -7.080 -8.065 1.00 0.00 C ATOM 1240 CZ TYR A 80 0.445 -8.343 -8.123 1.00 0.00 C ATOM 1241 OH TYR A 80 1.608 -8.615 -7.439 1.00 0.00 O ATOM 0 H TYR A 80 -5.298 -7.744 -11.717 1.00 0.00 H new ATOM 0 HA TYR A 80 -3.787 -9.530 -9.940 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -2.951 -7.386 -11.320 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -3.574 -6.532 -9.923 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -1.804 -9.834 -10.129 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -1.699 -5.819 -8.707 1.00 0.00 H new ATOM 0 HE1 TYR A 80 0.268 -10.324 -8.906 1.00 0.00 H new ATOM 0 HE2 TYR A 80 0.375 -6.306 -7.484 1.00 0.00 H new ATOM 0 HH TYR A 80 1.907 -7.809 -6.969 1.00 0.00 H new ATOM 1251 N PHE A 81 -6.127 -7.414 -9.031 1.00 0.00 N ATOM 1252 CA PHE A 81 -7.005 -7.038 -7.922 1.00 0.00 C ATOM 1253 C PHE A 81 -8.038 -8.133 -7.633 1.00 0.00 C ATOM 1254 O PHE A 81 -8.705 -8.107 -6.598 1.00 0.00 O ATOM 1255 CB PHE A 81 -7.699 -5.689 -8.201 1.00 0.00 C ATOM 1256 CG PHE A 81 -9.195 -5.770 -8.352 1.00 0.00 C ATOM 1257 CD1 PHE A 81 -9.764 -6.374 -9.462 1.00 0.00 C ATOM 1258 CD2 PHE A 81 -10.030 -5.241 -7.381 1.00 0.00 C ATOM 1259 CE1 PHE A 81 -11.137 -6.449 -9.600 1.00 0.00 C ATOM 1260 CE2 PHE A 81 -11.404 -5.313 -7.514 1.00 0.00 C ATOM 1261 CZ PHE A 81 -11.957 -5.917 -8.625 1.00 0.00 C ATOM 0 H PHE A 81 -6.367 -6.986 -9.925 1.00 0.00 H new ATOM 0 HA PHE A 81 -6.384 -6.923 -7.033 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -7.466 -5.001 -7.388 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -7.278 -5.261 -9.111 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.127 -6.791 -10.228 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -9.602 -4.767 -6.510 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -11.568 -6.923 -10.469 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -12.044 -4.897 -6.750 1.00 0.00 H new ATOM 0 HZ PHE A 81 -13.030 -5.973 -8.732 1.00 0.00 H new ATOM 1271 N ALA A 82 -8.169 -9.089 -8.551 1.00 0.00 N ATOM 1272 CA ALA A 82 -9.125 -10.181 -8.386 1.00 0.00 C ATOM 1273 C ALA A 82 -8.949 -10.878 -7.039 1.00 0.00 C ATOM 1274 O ALA A 82 -9.927 -11.239 -6.383 1.00 0.00 O ATOM 1275 CB ALA A 82 -8.979 -11.183 -9.521 1.00 0.00 C ATOM 0 H ALA A 82 -7.627 -9.129 -9.414 1.00 0.00 H new ATOM 0 HA ALA A 82 -10.128 -9.755 -8.413 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -9.697 -11.992 -9.387 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -9.167 -10.685 -10.472 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -7.968 -11.591 -9.519 1.00 0.00 H new ATOM 1281 N LYS A 83 -7.698 -11.064 -6.632 1.00 0.00 N ATOM 1282 CA LYS A 83 -7.393 -11.717 -5.366 1.00 0.00 C ATOM 1283 C LYS A 83 -7.139 -10.679 -4.271 1.00 0.00 C ATOM 1284 O LYS A 83 -7.563 -9.531 -4.392 1.00 0.00 O ATOM 1285 CB LYS A 83 -6.173 -12.627 -5.531 1.00 0.00 C ATOM 1286 CG LYS A 83 -6.220 -13.485 -6.786 1.00 0.00 C ATOM 1287 CD LYS A 83 -5.141 -13.084 -7.779 1.00 0.00 C ATOM 1288 CE LYS A 83 -4.689 -14.268 -8.617 1.00 0.00 C ATOM 1289 NZ LYS A 83 -4.071 -13.835 -9.902 1.00 0.00 N ATOM 0 H LYS A 83 -6.878 -10.771 -7.162 1.00 0.00 H new ATOM 0 HA LYS A 83 -8.250 -12.322 -5.069 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -5.273 -12.013 -5.554 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -6.094 -13.277 -4.659 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -6.095 -14.533 -6.515 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -7.200 -13.392 -7.255 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -5.520 -12.298 -8.432 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -4.287 -12.669 -7.243 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -3.971 -14.861 -8.050 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -5.543 -14.913 -8.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -3.776 -14.672 -10.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -4.764 -13.291 -10.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -3.241 -13.240 -9.705 1.00 0.00 H new ATOM 1303 N MET A 84 -6.427 -11.085 -3.216 1.00 0.00 N ATOM 1304 CA MET A 84 -6.091 -10.198 -2.112 1.00 0.00 C ATOM 1305 C MET A 84 -7.286 -9.326 -1.697 1.00 0.00 C ATOM 1306 O MET A 84 -7.607 -8.341 -2.359 1.00 0.00 O ATOM 1307 CB MET A 84 -4.916 -9.341 -2.537 1.00 0.00 C ATOM 1308 CG MET A 84 -3.578 -10.045 -2.390 1.00 0.00 C ATOM 1309 SD MET A 84 -3.194 -10.455 -0.678 1.00 0.00 S ATOM 1310 CE MET A 84 -1.974 -11.748 -0.908 1.00 0.00 C ATOM 0 H MET A 84 -6.071 -12.035 -3.108 1.00 0.00 H new ATOM 0 HA MET A 84 -5.826 -10.793 -1.238 1.00 0.00 H new ATOM 0 HB2 MET A 84 -5.050 -9.042 -3.577 1.00 0.00 H new ATOM 0 HB3 MET A 84 -4.906 -8.428 -1.942 1.00 0.00 H new ATOM 0 HG2 MET A 84 -3.585 -10.958 -2.985 1.00 0.00 H new ATOM 0 HG3 MET A 84 -2.790 -9.408 -2.792 1.00 0.00 H new ATOM 0 HE1 MET A 84 -1.446 -11.921 0.030 1.00 0.00 H new ATOM 0 HE2 MET A 84 -2.472 -12.666 -1.220 1.00 0.00 H new ATOM 0 HE3 MET A 84 -1.261 -11.444 -1.674 1.00 0.00 H new ATOM 1320 N PRO A 85 -7.969 -9.691 -0.593 1.00 0.00 N ATOM 1321 CA PRO A 85 -9.143 -8.953 -0.102 1.00 0.00 C ATOM 1322 C PRO A 85 -8.851 -7.498 0.262 1.00 0.00 C ATOM 1323 O PRO A 85 -9.777 -6.705 0.432 1.00 0.00 O ATOM 1324 CB PRO A 85 -9.571 -9.735 1.147 1.00 0.00 C ATOM 1325 CG PRO A 85 -8.379 -10.541 1.533 1.00 0.00 C ATOM 1326 CD PRO A 85 -7.666 -10.858 0.254 1.00 0.00 C ATOM 0 HA PRO A 85 -9.908 -8.889 -0.876 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -9.867 -9.061 1.951 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -10.427 -10.375 0.936 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -7.734 -9.984 2.212 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -8.675 -11.453 2.051 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -6.594 -10.977 0.409 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -8.028 -11.785 -0.191 1.00 0.00 H new ATOM 1334 N TRP A 86 -7.575 -7.140 0.387 1.00 0.00 N ATOM 1335 CA TRP A 86 -7.212 -5.766 0.739 1.00 0.00 C ATOM 1336 C TRP A 86 -7.852 -4.771 -0.218 1.00 0.00 C ATOM 1337 O TRP A 86 -8.253 -5.144 -1.322 1.00 0.00 O ATOM 1338 CB TRP A 86 -5.692 -5.584 0.749 1.00 0.00 C ATOM 1339 CG TRP A 86 -4.997 -5.819 -0.560 1.00 0.00 C ATOM 1340 CD1 TRP A 86 -5.397 -5.415 -1.802 1.00 0.00 C ATOM 1341 CD2 TRP A 86 -3.743 -6.486 -0.742 1.00 0.00 C ATOM 1342 NE1 TRP A 86 -4.475 -5.798 -2.742 1.00 0.00 N ATOM 1343 CE2 TRP A 86 -3.451 -6.458 -2.118 1.00 0.00 C ATOM 1344 CE3 TRP A 86 -2.841 -7.107 0.125 1.00 0.00 C ATOM 1345 CZ2 TRP A 86 -2.294 -7.027 -2.644 1.00 0.00 C ATOM 1346 CZ3 TRP A 86 -1.693 -7.671 -0.397 1.00 0.00 C ATOM 1347 CH2 TRP A 86 -1.428 -7.627 -1.771 1.00 0.00 C ATOM 0 H TRP A 86 -6.784 -7.770 0.253 1.00 0.00 H new ATOM 0 HA TRP A 86 -7.590 -5.573 1.743 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -5.469 -4.570 1.080 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -5.269 -6.262 1.490 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -6.307 -4.873 -2.013 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -4.542 -5.620 -3.744 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -3.038 -7.146 1.186 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -2.088 -6.996 -3.704 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -0.989 -8.153 0.265 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -0.522 -8.076 -2.150 1.00 0.00 H new ATOM 1358 N LEU A 87 -7.970 -3.505 0.194 1.00 0.00 N ATOM 1359 CA LEU A 87 -8.575 -2.519 -0.663 1.00 0.00 C ATOM 1360 C LEU A 87 -7.558 -1.937 -1.637 1.00 0.00 C ATOM 1361 O LEU A 87 -6.405 -1.718 -1.284 1.00 0.00 O ATOM 1362 CB LEU A 87 -9.217 -1.401 0.162 1.00 0.00 C ATOM 1363 CG LEU A 87 -10.344 -1.845 1.095 1.00 0.00 C ATOM 1364 CD1 LEU A 87 -10.292 -1.071 2.407 1.00 0.00 C ATOM 1365 CD2 LEU A 87 -11.694 -1.660 0.419 1.00 0.00 C ATOM 0 H LEU A 87 -7.657 -3.157 1.100 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.354 -3.017 -1.240 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -8.442 -0.920 0.758 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -9.608 -0.646 -0.520 1.00 0.00 H new ATOM 0 HG LEU A 87 -10.210 -2.904 1.318 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -11.102 -1.402 3.057 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -9.336 -1.252 2.898 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -10.401 -0.005 2.205 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -12.487 -1.980 1.095 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -11.834 -0.609 0.168 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.730 -2.258 -0.491 1.00 0.00 H new ATOM 1377 N ALA A 88 -7.988 -1.704 -2.870 1.00 0.00 N ATOM 1378 CA ALA A 88 -7.108 -1.161 -3.892 1.00 0.00 C ATOM 1379 C ALA A 88 -7.710 0.072 -4.554 1.00 0.00 C ATOM 1380 O ALA A 88 -8.927 0.251 -4.567 1.00 0.00 O ATOM 1381 CB ALA A 88 -6.825 -2.227 -4.930 1.00 0.00 C ATOM 0 H ALA A 88 -8.941 -1.883 -3.185 1.00 0.00 H new ATOM 0 HA ALA A 88 -6.177 -0.854 -3.415 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -6.165 -1.822 -5.697 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -6.345 -3.081 -4.453 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.761 -2.546 -5.388 1.00 0.00 H new ATOM 1387 N VAL A 89 -6.847 0.915 -5.111 1.00 0.00 N ATOM 1388 CA VAL A 89 -7.294 2.128 -5.786 1.00 0.00 C ATOM 1389 C VAL A 89 -7.827 1.809 -7.180 1.00 0.00 C ATOM 1390 O VAL A 89 -7.169 1.116 -7.958 1.00 0.00 O ATOM 1391 CB VAL A 89 -6.158 3.165 -5.914 1.00 0.00 C ATOM 1392 CG1 VAL A 89 -6.668 4.446 -6.563 1.00 0.00 C ATOM 1393 CG2 VAL A 89 -5.548 3.458 -4.552 1.00 0.00 C ATOM 0 H VAL A 89 -5.836 0.781 -5.108 1.00 0.00 H new ATOM 0 HA VAL A 89 -8.090 2.552 -5.173 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.382 2.746 -6.555 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -5.851 5.163 -6.644 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.053 4.222 -7.558 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -7.465 4.871 -5.953 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -4.749 4.191 -4.661 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -6.316 3.854 -3.887 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.142 2.539 -4.130 1.00 0.00 H new ATOM 1403 N PRO A 90 -9.024 2.314 -7.525 1.00 0.00 N ATOM 1404 CA PRO A 90 -9.626 2.077 -8.839 1.00 0.00 C ATOM 1405 C PRO A 90 -8.847 2.769 -9.949 1.00 0.00 C ATOM 1406 O PRO A 90 -8.233 3.813 -9.729 1.00 0.00 O ATOM 1407 CB PRO A 90 -11.025 2.685 -8.710 1.00 0.00 C ATOM 1408 CG PRO A 90 -10.902 3.701 -7.629 1.00 0.00 C ATOM 1409 CD PRO A 90 -9.879 3.160 -6.669 1.00 0.00 C ATOM 0 HA PRO A 90 -9.635 1.019 -9.102 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -11.346 3.141 -9.647 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -11.764 1.925 -8.456 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -10.589 4.664 -8.032 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -11.859 3.860 -7.132 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -9.309 3.960 -6.196 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -10.343 2.583 -5.869 1.00 0.00 H new ATOM 1417 N PHE A 91 -8.872 2.186 -11.145 1.00 0.00 N ATOM 1418 CA PHE A 91 -8.164 2.759 -12.285 1.00 0.00 C ATOM 1419 C PHE A 91 -8.463 4.251 -12.410 1.00 0.00 C ATOM 1420 O PHE A 91 -7.633 5.025 -12.887 1.00 0.00 O ATOM 1421 CB PHE A 91 -8.557 2.036 -13.576 1.00 0.00 C ATOM 1422 CG PHE A 91 -7.394 1.765 -14.486 1.00 0.00 C ATOM 1423 CD1 PHE A 91 -6.466 0.785 -14.172 1.00 0.00 C ATOM 1424 CD2 PHE A 91 -7.228 2.490 -15.655 1.00 0.00 C ATOM 1425 CE1 PHE A 91 -5.394 0.532 -15.008 1.00 0.00 C ATOM 1426 CE2 PHE A 91 -6.158 2.242 -16.494 1.00 0.00 C ATOM 1427 CZ PHE A 91 -5.240 1.262 -16.170 1.00 0.00 C ATOM 0 H PHE A 91 -9.373 1.321 -11.349 1.00 0.00 H new ATOM 0 HA PHE A 91 -7.094 2.631 -12.121 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -9.038 1.091 -13.322 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -9.294 2.636 -14.110 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -6.581 0.212 -13.264 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -7.943 3.257 -15.913 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -4.678 -0.235 -14.753 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -6.040 2.814 -17.402 1.00 0.00 H new ATOM 0 HZ PHE A 91 -4.403 1.067 -16.824 1.00 0.00 H new ATOM 1437 N ALA A 92 -9.656 4.642 -11.975 1.00 0.00 N ATOM 1438 CA ALA A 92 -10.077 6.038 -12.032 1.00 0.00 C ATOM 1439 C ALA A 92 -9.054 6.966 -11.376 1.00 0.00 C ATOM 1440 O ALA A 92 -8.829 8.080 -11.849 1.00 0.00 O ATOM 1441 CB ALA A 92 -11.437 6.202 -11.372 1.00 0.00 C ATOM 0 H ALA A 92 -10.351 4.010 -11.578 1.00 0.00 H new ATOM 0 HA ALA A 92 -10.151 6.320 -13.082 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -11.741 7.248 -11.420 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -12.171 5.586 -11.892 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -11.375 5.890 -10.329 1.00 0.00 H new ATOM 1447 N GLN A 93 -8.436 6.512 -10.284 1.00 0.00 N ATOM 1448 CA GLN A 93 -7.450 7.324 -9.582 1.00 0.00 C ATOM 1449 C GLN A 93 -6.048 6.740 -9.735 1.00 0.00 C ATOM 1450 O GLN A 93 -5.165 7.006 -8.920 1.00 0.00 O ATOM 1451 CB GLN A 93 -7.807 7.434 -8.098 1.00 0.00 C ATOM 1452 CG GLN A 93 -9.303 7.499 -7.830 1.00 0.00 C ATOM 1453 CD GLN A 93 -9.937 8.769 -8.361 1.00 0.00 C ATOM 1454 OE1 GLN A 93 -10.934 8.724 -9.081 1.00 0.00 O ATOM 1455 NE2 GLN A 93 -9.361 9.912 -8.007 1.00 0.00 N ATOM 0 H GLN A 93 -8.601 5.594 -9.872 1.00 0.00 H new ATOM 0 HA GLN A 93 -7.460 8.319 -10.027 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -7.389 6.577 -7.569 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -7.334 8.325 -7.685 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -9.788 6.637 -8.288 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -9.479 7.431 -6.756 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -8.535 9.903 -7.408 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -9.744 10.799 -8.334 1.00 0.00 H new ATOM 1464 N SER A 94 -5.846 5.948 -10.784 1.00 0.00 N ATOM 1465 CA SER A 94 -4.545 5.339 -11.033 1.00 0.00 C ATOM 1466 C SER A 94 -3.494 6.411 -11.292 1.00 0.00 C ATOM 1467 O SER A 94 -2.316 6.224 -10.989 1.00 0.00 O ATOM 1468 CB SER A 94 -4.618 4.376 -12.217 1.00 0.00 C ATOM 1469 OG SER A 94 -4.495 5.068 -13.449 1.00 0.00 O ATOM 0 H SER A 94 -6.563 5.714 -11.471 1.00 0.00 H new ATOM 0 HA SER A 94 -4.258 4.776 -10.145 1.00 0.00 H new ATOM 0 HB2 SER A 94 -3.825 3.632 -12.134 1.00 0.00 H new ATOM 0 HB3 SER A 94 -5.565 3.837 -12.193 1.00 0.00 H new ATOM 0 HG SER A 94 -4.543 4.428 -14.190 1.00 0.00 H new ATOM 1475 N GLU A 95 -3.929 7.541 -11.843 1.00 0.00 N ATOM 1476 CA GLU A 95 -3.025 8.648 -12.129 1.00 0.00 C ATOM 1477 C GLU A 95 -2.280 9.055 -10.865 1.00 0.00 C ATOM 1478 O GLU A 95 -1.115 9.449 -10.913 1.00 0.00 O ATOM 1479 CB GLU A 95 -3.806 9.838 -12.685 1.00 0.00 C ATOM 1480 CG GLU A 95 -4.578 9.517 -13.953 1.00 0.00 C ATOM 1481 CD GLU A 95 -3.679 9.047 -15.080 1.00 0.00 C ATOM 1482 OE1 GLU A 95 -2.644 9.699 -15.325 1.00 0.00 O ATOM 1483 OE2 GLU A 95 -4.013 8.025 -15.717 1.00 0.00 O ATOM 0 H GLU A 95 -4.901 7.713 -12.100 1.00 0.00 H new ATOM 0 HA GLU A 95 -2.301 8.325 -12.877 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -4.502 10.192 -11.925 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -3.113 10.654 -12.888 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -5.318 8.746 -13.738 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -5.125 10.403 -14.275 1.00 0.00 H new ATOM 1490 N ALA A 96 -2.964 8.941 -9.732 1.00 0.00 N ATOM 1491 CA ALA A 96 -2.377 9.279 -8.444 1.00 0.00 C ATOM 1492 C ALA A 96 -1.173 8.400 -8.160 1.00 0.00 C ATOM 1493 O ALA A 96 -0.158 8.863 -7.655 1.00 0.00 O ATOM 1494 CB ALA A 96 -3.398 9.109 -7.335 1.00 0.00 C ATOM 0 H ALA A 96 -3.929 8.616 -9.681 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.058 10.321 -8.481 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -2.943 9.366 -6.379 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.249 9.765 -7.520 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -3.738 8.074 -7.309 1.00 0.00 H new ATOM 1500 N VAL A 97 -1.307 7.124 -8.484 1.00 0.00 N ATOM 1501 CA VAL A 97 -0.245 6.156 -8.262 1.00 0.00 C ATOM 1502 C VAL A 97 1.035 6.561 -8.977 1.00 0.00 C ATOM 1503 O VAL A 97 2.140 6.312 -8.497 1.00 0.00 O ATOM 1504 CB VAL A 97 -0.687 4.762 -8.730 1.00 0.00 C ATOM 1505 CG1 VAL A 97 0.449 3.764 -8.594 1.00 0.00 C ATOM 1506 CG2 VAL A 97 -1.911 4.322 -7.943 1.00 0.00 C ATOM 0 H VAL A 97 -2.149 6.732 -8.906 1.00 0.00 H new ATOM 0 HA VAL A 97 -0.041 6.128 -7.192 1.00 0.00 H new ATOM 0 HB VAL A 97 -0.954 4.807 -9.786 1.00 0.00 H new ATOM 0 HG11 VAL A 97 0.114 2.783 -8.931 1.00 0.00 H new ATOM 0 HG12 VAL A 97 1.293 4.088 -9.203 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.757 3.703 -7.550 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -2.222 3.332 -8.277 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.667 4.286 -6.881 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -2.722 5.032 -8.105 1.00 0.00 H new ATOM 1516 N GLN A 98 0.869 7.186 -10.125 1.00 0.00 N ATOM 1517 CA GLN A 98 1.997 7.639 -10.929 1.00 0.00 C ATOM 1518 C GLN A 98 2.787 8.725 -10.212 1.00 0.00 C ATOM 1519 O GLN A 98 4.000 8.618 -10.025 1.00 0.00 O ATOM 1520 CB GLN A 98 1.483 8.208 -12.247 1.00 0.00 C ATOM 1521 CG GLN A 98 0.611 7.239 -13.032 1.00 0.00 C ATOM 1522 CD GLN A 98 1.166 6.939 -14.411 1.00 0.00 C ATOM 1523 OE1 GLN A 98 1.324 7.837 -15.238 1.00 0.00 O ATOM 1524 NE2 GLN A 98 1.465 5.671 -14.666 1.00 0.00 N ATOM 0 H GLN A 98 -0.044 7.396 -10.529 1.00 0.00 H new ATOM 0 HA GLN A 98 2.650 6.784 -11.104 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.912 9.114 -12.044 1.00 0.00 H new ATOM 0 HB3 GLN A 98 2.334 8.499 -12.863 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.515 6.308 -12.473 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -0.391 7.656 -13.131 1.00 0.00 H new ATOM 0 HE21 GLN A 98 1.318 4.959 -13.951 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.842 5.409 -15.577 1.00 0.00 H new ATOM 1533 N LYS A 99 2.081 9.778 -9.837 1.00 0.00 N ATOM 1534 CA LYS A 99 2.690 10.919 -9.159 1.00 0.00 C ATOM 1535 C LYS A 99 2.871 10.676 -7.661 1.00 0.00 C ATOM 1536 O LYS A 99 3.824 11.174 -7.061 1.00 0.00 O ATOM 1537 CB LYS A 99 1.877 12.197 -9.414 1.00 0.00 C ATOM 1538 CG LYS A 99 0.568 12.280 -8.644 1.00 0.00 C ATOM 1539 CD LYS A 99 0.336 13.679 -8.095 1.00 0.00 C ATOM 1540 CE LYS A 99 -1.143 14.028 -8.065 1.00 0.00 C ATOM 1541 NZ LYS A 99 -1.796 13.796 -9.383 1.00 0.00 N ATOM 0 H LYS A 99 1.077 9.870 -9.990 1.00 0.00 H new ATOM 0 HA LYS A 99 3.687 11.049 -9.580 1.00 0.00 H new ATOM 0 HB2 LYS A 99 2.491 13.060 -9.155 1.00 0.00 H new ATOM 0 HB3 LYS A 99 1.661 12.268 -10.480 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -0.259 12.002 -9.298 1.00 0.00 H new ATOM 0 HG3 LYS A 99 0.581 11.563 -7.823 1.00 0.00 H new ATOM 0 HD2 LYS A 99 0.748 13.749 -7.088 1.00 0.00 H new ATOM 0 HD3 LYS A 99 0.870 14.405 -8.709 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -1.642 13.429 -7.303 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -1.264 15.073 -7.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -2.572 14.476 -9.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -1.098 13.921 -10.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -2.175 12.828 -9.417 1.00 0.00 H new ATOM 1555 N LEU A 100 1.965 9.913 -7.055 1.00 0.00 N ATOM 1556 CA LEU A 100 2.059 9.623 -5.628 1.00 0.00 C ATOM 1557 C LEU A 100 3.239 8.700 -5.344 1.00 0.00 C ATOM 1558 O LEU A 100 3.814 8.729 -4.254 1.00 0.00 O ATOM 1559 CB LEU A 100 0.759 8.995 -5.118 1.00 0.00 C ATOM 1560 CG LEU A 100 0.772 8.555 -3.659 1.00 0.00 C ATOM 1561 CD1 LEU A 100 0.516 9.748 -2.755 1.00 0.00 C ATOM 1562 CD2 LEU A 100 -0.267 7.462 -3.430 1.00 0.00 C ATOM 0 H LEU A 100 1.165 9.488 -7.525 1.00 0.00 H new ATOM 0 HA LEU A 100 2.220 10.563 -5.100 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.049 9.713 -5.256 1.00 0.00 H new ATOM 0 HB3 LEU A 100 0.526 8.130 -5.738 1.00 0.00 H new ATOM 0 HG LEU A 100 1.753 8.146 -3.417 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.527 9.425 -1.714 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.293 10.496 -2.911 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.456 10.181 -2.990 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.248 7.156 -2.384 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.257 7.843 -3.679 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.039 6.605 -4.063 1.00 0.00 H new ATOM 1574 N SER A 101 3.602 7.884 -6.331 1.00 0.00 N ATOM 1575 CA SER A 101 4.720 6.959 -6.182 1.00 0.00 C ATOM 1576 C SER A 101 6.029 7.717 -5.983 1.00 0.00 C ATOM 1577 O SER A 101 6.788 7.432 -5.059 1.00 0.00 O ATOM 1578 CB SER A 101 4.828 6.055 -7.412 1.00 0.00 C ATOM 1579 OG SER A 101 4.974 6.820 -8.596 1.00 0.00 O ATOM 0 H SER A 101 3.139 7.845 -7.239 1.00 0.00 H new ATOM 0 HA SER A 101 4.536 6.345 -5.301 1.00 0.00 H new ATOM 0 HB2 SER A 101 5.680 5.385 -7.301 1.00 0.00 H new ATOM 0 HB3 SER A 101 3.938 5.430 -7.487 1.00 0.00 H new ATOM 0 HG SER A 101 4.159 7.342 -8.751 1.00 0.00 H new ATOM 1585 N LYS A 102 6.285 8.684 -6.858 1.00 0.00 N ATOM 1586 CA LYS A 102 7.501 9.483 -6.781 1.00 0.00 C ATOM 1587 C LYS A 102 7.568 10.256 -5.467 1.00 0.00 C ATOM 1588 O LYS A 102 8.642 10.431 -4.893 1.00 0.00 O ATOM 1589 CB LYS A 102 7.573 10.454 -7.962 1.00 0.00 C ATOM 1590 CG LYS A 102 8.985 10.688 -8.472 1.00 0.00 C ATOM 1591 CD LYS A 102 9.452 9.544 -9.359 1.00 0.00 C ATOM 1592 CE LYS A 102 10.372 8.595 -8.606 1.00 0.00 C ATOM 1593 NZ LYS A 102 11.805 8.837 -8.929 1.00 0.00 N ATOM 0 H LYS A 102 5.665 8.933 -7.629 1.00 0.00 H new ATOM 0 HA LYS A 102 8.353 8.804 -6.823 1.00 0.00 H new ATOM 0 HB2 LYS A 102 6.961 10.068 -8.777 1.00 0.00 H new ATOM 0 HB3 LYS A 102 7.141 11.409 -7.663 1.00 0.00 H new ATOM 0 HG2 LYS A 102 9.021 11.622 -9.032 1.00 0.00 H new ATOM 0 HG3 LYS A 102 9.665 10.796 -7.627 1.00 0.00 H new ATOM 0 HD2 LYS A 102 8.587 8.995 -9.732 1.00 0.00 H new ATOM 0 HD3 LYS A 102 9.974 9.945 -10.228 1.00 0.00 H new ATOM 0 HE2 LYS A 102 10.217 8.714 -7.534 1.00 0.00 H new ATOM 0 HE3 LYS A 102 10.113 7.566 -8.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 12.399 8.170 -8.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 11.959 8.699 -9.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 12.060 9.811 -8.669 1.00 0.00 H new ATOM 1607 N HIS A 103 6.413 10.715 -4.998 1.00 0.00 N ATOM 1608 CA HIS A 103 6.341 11.470 -3.752 1.00 0.00 C ATOM 1609 C HIS A 103 6.680 10.587 -2.555 1.00 0.00 C ATOM 1610 O HIS A 103 7.157 11.074 -1.529 1.00 0.00 O ATOM 1611 CB HIS A 103 4.946 12.071 -3.576 1.00 0.00 C ATOM 1612 CG HIS A 103 4.820 13.462 -4.117 1.00 0.00 C ATOM 1613 ND1 HIS A 103 3.645 13.968 -4.630 1.00 0.00 N ATOM 1614 CD2 HIS A 103 5.733 14.457 -4.221 1.00 0.00 C ATOM 1615 CE1 HIS A 103 3.840 15.213 -5.027 1.00 0.00 C ATOM 1616 NE2 HIS A 103 5.098 15.534 -4.789 1.00 0.00 N ATOM 0 H HIS A 103 5.515 10.578 -5.461 1.00 0.00 H new ATOM 0 HA HIS A 103 7.074 12.275 -3.804 1.00 0.00 H new ATOM 0 HB2 HIS A 103 4.218 11.430 -4.073 1.00 0.00 H new ATOM 0 HB3 HIS A 103 4.694 12.078 -2.516 1.00 0.00 H new ATOM 0 HD2 HIS A 103 6.768 14.412 -3.914 1.00 0.00 H new ATOM 0 HE1 HIS A 103 3.096 15.858 -5.471 1.00 0.00 H new ATOM 0 HE2 HIS A 103 5.529 16.436 -4.994 1.00 0.00 H new ATOM 1625 N PHE A 104 6.432 9.288 -2.689 1.00 0.00 N ATOM 1626 CA PHE A 104 6.709 8.342 -1.614 1.00 0.00 C ATOM 1627 C PHE A 104 8.100 7.726 -1.759 1.00 0.00 C ATOM 1628 O PHE A 104 8.392 6.689 -1.162 1.00 0.00 O ATOM 1629 CB PHE A 104 5.651 7.239 -1.594 1.00 0.00 C ATOM 1630 CG PHE A 104 4.388 7.631 -0.882 1.00 0.00 C ATOM 1631 CD1 PHE A 104 4.439 8.289 0.337 1.00 0.00 C ATOM 1632 CD2 PHE A 104 3.149 7.339 -1.429 1.00 0.00 C ATOM 1633 CE1 PHE A 104 3.279 8.650 0.995 1.00 0.00 C ATOM 1634 CE2 PHE A 104 1.985 7.696 -0.776 1.00 0.00 C ATOM 1635 CZ PHE A 104 2.049 8.352 0.438 1.00 0.00 C ATOM 0 H PHE A 104 6.040 8.867 -3.531 1.00 0.00 H new ATOM 0 HA PHE A 104 6.677 8.890 -0.672 1.00 0.00 H new ATOM 0 HB2 PHE A 104 5.409 6.961 -2.620 1.00 0.00 H new ATOM 0 HB3 PHE A 104 6.069 6.354 -1.114 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.397 8.522 0.778 1.00 0.00 H new ATOM 0 HD2 PHE A 104 3.092 6.826 -2.378 1.00 0.00 H new ATOM 0 HE1 PHE A 104 3.333 9.164 1.943 1.00 0.00 H new ATOM 0 HE2 PHE A 104 1.026 7.462 -1.214 1.00 0.00 H new ATOM 0 HZ PHE A 104 1.141 8.631 0.951 1.00 0.00 H new ATOM 1645 N ASN A 105 8.956 8.369 -2.547 1.00 0.00 N ATOM 1646 CA ASN A 105 10.316 7.885 -2.760 1.00 0.00 C ATOM 1647 C ASN A 105 10.321 6.433 -3.236 1.00 0.00 C ATOM 1648 O ASN A 105 10.785 5.538 -2.530 1.00 0.00 O ATOM 1649 CB ASN A 105 11.128 8.016 -1.471 1.00 0.00 C ATOM 1650 CG ASN A 105 12.619 8.105 -1.732 1.00 0.00 C ATOM 1651 OD1 ASN A 105 13.093 9.041 -2.377 1.00 0.00 O ATOM 1652 ND2 ASN A 105 13.367 7.129 -1.232 1.00 0.00 N ATOM 0 H ASN A 105 8.732 9.228 -3.049 1.00 0.00 H new ATOM 0 HA ASN A 105 10.773 8.497 -3.538 1.00 0.00 H new ATOM 0 HB2 ASN A 105 10.803 8.904 -0.929 1.00 0.00 H new ATOM 0 HB3 ASN A 105 10.925 7.159 -0.829 1.00 0.00 H new ATOM 0 HD21 ASN A 105 14.377 7.135 -1.376 1.00 0.00 H new ATOM 0 HD22 ASN A 105 12.932 6.373 -0.704 1.00 0.00 H new ATOM 1659 N VAL A 106 9.808 6.210 -4.442 1.00 0.00 N ATOM 1660 CA VAL A 106 9.761 4.868 -5.014 1.00 0.00 C ATOM 1661 C VAL A 106 10.768 4.723 -6.149 1.00 0.00 C ATOM 1662 O VAL A 106 10.491 5.091 -7.291 1.00 0.00 O ATOM 1663 CB VAL A 106 8.353 4.521 -5.542 1.00 0.00 C ATOM 1664 CG1 VAL A 106 8.287 3.064 -5.978 1.00 0.00 C ATOM 1665 CG2 VAL A 106 7.301 4.817 -4.483 1.00 0.00 C ATOM 0 H VAL A 106 9.420 6.939 -5.041 1.00 0.00 H new ATOM 0 HA VAL A 106 10.015 4.176 -4.211 1.00 0.00 H new ATOM 0 HB VAL A 106 8.147 5.144 -6.413 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.286 2.840 -6.347 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.014 2.888 -6.771 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.514 2.419 -5.129 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.314 4.567 -4.871 1.00 0.00 H new ATOM 0 HG22 VAL A 106 7.503 4.221 -3.593 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.332 5.876 -4.225 1.00 0.00 H new ATOM 1675 N GLU A 107 11.940 4.185 -5.827 1.00 0.00 N ATOM 1676 CA GLU A 107 12.993 3.990 -6.817 1.00 0.00 C ATOM 1677 C GLU A 107 12.500 3.130 -7.976 1.00 0.00 C ATOM 1678 O GLU A 107 12.774 3.422 -9.140 1.00 0.00 O ATOM 1679 CB GLU A 107 14.217 3.340 -6.168 1.00 0.00 C ATOM 1680 CG GLU A 107 15.478 3.438 -7.012 1.00 0.00 C ATOM 1681 CD GLU A 107 15.928 4.870 -7.225 1.00 0.00 C ATOM 1682 OE1 GLU A 107 15.271 5.589 -8.008 1.00 0.00 O ATOM 1683 OE2 GLU A 107 16.936 5.274 -6.608 1.00 0.00 O ATOM 0 H GLU A 107 12.185 3.876 -4.886 1.00 0.00 H new ATOM 0 HA GLU A 107 13.274 4.968 -7.209 1.00 0.00 H new ATOM 0 HB2 GLU A 107 14.399 3.811 -5.202 1.00 0.00 H new ATOM 0 HB3 GLU A 107 14.000 2.289 -5.974 1.00 0.00 H new ATOM 0 HG2 GLU A 107 16.278 2.878 -6.529 1.00 0.00 H new ATOM 0 HG3 GLU A 107 15.300 2.969 -7.980 1.00 0.00 H new ATOM 1690 N SER A 108 11.773 2.067 -7.649 1.00 0.00 N ATOM 1691 CA SER A 108 11.241 1.166 -8.664 1.00 0.00 C ATOM 1692 C SER A 108 10.369 0.086 -8.033 1.00 0.00 C ATOM 1693 O SER A 108 10.574 -0.302 -6.883 1.00 0.00 O ATOM 1694 CB SER A 108 12.382 0.518 -9.450 1.00 0.00 C ATOM 1695 OG SER A 108 13.334 -0.068 -8.579 1.00 0.00 O ATOM 0 H SER A 108 11.539 1.809 -6.690 1.00 0.00 H new ATOM 0 HA SER A 108 10.625 1.753 -9.345 1.00 0.00 H new ATOM 0 HB2 SER A 108 11.980 -0.243 -10.119 1.00 0.00 H new ATOM 0 HB3 SER A 108 12.869 1.267 -10.075 1.00 0.00 H new ATOM 0 HG SER A 108 14.052 -0.477 -9.106 1.00 0.00 H new ATOM 1701 N ILE A 109 9.394 -0.394 -8.797 1.00 0.00 N ATOM 1702 CA ILE A 109 8.485 -1.430 -8.321 1.00 0.00 C ATOM 1703 C ILE A 109 9.109 -2.818 -8.468 1.00 0.00 C ATOM 1704 O ILE A 109 9.989 -3.021 -9.304 1.00 0.00 O ATOM 1705 CB ILE A 109 7.146 -1.387 -9.083 1.00 0.00 C ATOM 1706 CG1 ILE A 109 7.374 -1.659 -10.580 1.00 0.00 C ATOM 1707 CG2 ILE A 109 6.458 -0.045 -8.855 1.00 0.00 C ATOM 1708 CD1 ILE A 109 6.613 -0.735 -11.511 1.00 0.00 C ATOM 0 H ILE A 109 9.213 -0.081 -9.751 1.00 0.00 H new ATOM 0 HA ILE A 109 8.298 -1.235 -7.265 1.00 0.00 H new ATOM 0 HB ILE A 109 6.490 -2.170 -8.702 1.00 0.00 H new ATOM 0 HG12 ILE A 109 8.439 -1.572 -10.794 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.088 -2.688 -10.797 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.513 -0.024 -9.397 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.269 0.090 -7.790 1.00 0.00 H new ATOM 0 HG23 ILE A 109 7.100 0.759 -9.214 1.00 0.00 H new ATOM 0 HD11 ILE A 109 6.833 -0.999 -12.545 1.00 0.00 H new ATOM 0 HD12 ILE A 109 5.543 -0.837 -11.330 1.00 0.00 H new ATOM 0 HD13 ILE A 109 6.915 0.296 -11.327 1.00 0.00 H new ATOM 1720 N PRO A 110 8.667 -3.799 -7.655 1.00 0.00 N ATOM 1721 CA PRO A 110 7.619 -3.602 -6.644 1.00 0.00 C ATOM 1722 C PRO A 110 8.122 -2.838 -5.423 1.00 0.00 C ATOM 1723 O PRO A 110 9.256 -3.025 -4.984 1.00 0.00 O ATOM 1724 CB PRO A 110 7.237 -5.029 -6.258 1.00 0.00 C ATOM 1725 CG PRO A 110 8.474 -5.823 -6.490 1.00 0.00 C ATOM 1726 CD PRO A 110 9.162 -5.188 -7.668 1.00 0.00 C ATOM 0 HA PRO A 110 6.789 -3.008 -7.026 1.00 0.00 H new ATOM 0 HB2 PRO A 110 6.918 -5.087 -5.217 1.00 0.00 H new ATOM 0 HB3 PRO A 110 6.410 -5.396 -6.866 1.00 0.00 H new ATOM 0 HG2 PRO A 110 9.117 -5.810 -5.610 1.00 0.00 H new ATOM 0 HG3 PRO A 110 8.235 -6.867 -6.694 1.00 0.00 H new ATOM 0 HD2 PRO A 110 10.247 -5.227 -7.567 1.00 0.00 H new ATOM 0 HD3 PRO A 110 8.910 -5.694 -8.600 1.00 0.00 H new ATOM 1734 N THR A 111 7.268 -1.977 -4.880 1.00 0.00 N ATOM 1735 CA THR A 111 7.623 -1.183 -3.709 1.00 0.00 C ATOM 1736 C THR A 111 6.541 -1.279 -2.638 1.00 0.00 C ATOM 1737 O THR A 111 5.457 -1.810 -2.882 1.00 0.00 O ATOM 1738 CB THR A 111 7.837 0.278 -4.106 1.00 0.00 C ATOM 1739 OG1 THR A 111 8.127 0.384 -5.488 1.00 0.00 O ATOM 1740 CG2 THR A 111 8.964 0.946 -3.348 1.00 0.00 C ATOM 0 H THR A 111 6.325 -1.811 -5.232 1.00 0.00 H new ATOM 0 HA THR A 111 8.551 -1.581 -3.298 1.00 0.00 H new ATOM 0 HB THR A 111 6.904 0.784 -3.858 1.00 0.00 H new ATOM 0 HG1 THR A 111 9.042 0.075 -5.655 1.00 0.00 H new ATOM 0 HG21 THR A 111 9.062 1.980 -3.678 1.00 0.00 H new ATOM 0 HG22 THR A 111 8.747 0.925 -2.280 1.00 0.00 H new ATOM 0 HG23 THR A 111 9.896 0.415 -3.539 1.00 0.00 H new ATOM 1748 N LEU A 112 6.837 -0.750 -1.457 1.00 0.00 N ATOM 1749 CA LEU A 112 5.876 -0.765 -0.348 1.00 0.00 C ATOM 1750 C LEU A 112 6.040 0.486 0.514 1.00 0.00 C ATOM 1751 O LEU A 112 7.117 0.738 1.054 1.00 0.00 O ATOM 1752 CB LEU A 112 6.034 -2.037 0.516 1.00 0.00 C ATOM 1753 CG LEU A 112 4.798 -2.471 1.324 1.00 0.00 C ATOM 1754 CD1 LEU A 112 3.969 -1.287 1.778 1.00 0.00 C ATOM 1755 CD2 LEU A 112 3.929 -3.418 0.523 1.00 0.00 C ATOM 0 H LEU A 112 7.729 -0.306 -1.238 1.00 0.00 H new ATOM 0 HA LEU A 112 4.873 -0.772 -0.774 1.00 0.00 H new ATOM 0 HB2 LEU A 112 6.322 -2.861 -0.137 1.00 0.00 H new ATOM 0 HB3 LEU A 112 6.858 -1.878 1.211 1.00 0.00 H new ATOM 0 HG LEU A 112 5.171 -2.985 2.209 1.00 0.00 H new ATOM 0 HD11 LEU A 112 3.108 -1.642 2.344 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.576 -0.638 2.409 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.626 -0.728 0.907 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.063 -3.709 1.118 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.594 -2.922 -0.388 1.00 0.00 H new ATOM 0 HD23 LEU A 112 4.504 -4.306 0.261 1.00 0.00 H new ATOM 1767 N ILE A 113 4.974 1.272 0.634 1.00 0.00 N ATOM 1768 CA ILE A 113 5.014 2.501 1.424 1.00 0.00 C ATOM 1769 C ILE A 113 3.925 2.508 2.493 1.00 0.00 C ATOM 1770 O ILE A 113 2.842 1.962 2.290 1.00 0.00 O ATOM 1771 CB ILE A 113 4.844 3.744 0.528 1.00 0.00 C ATOM 1772 CG1 ILE A 113 5.743 3.638 -0.705 1.00 0.00 C ATOM 1773 CG2 ILE A 113 5.154 5.012 1.309 1.00 0.00 C ATOM 1774 CD1 ILE A 113 7.222 3.658 -0.380 1.00 0.00 C ATOM 0 H ILE A 113 4.073 1.081 0.196 1.00 0.00 H new ATOM 0 HA ILE A 113 5.990 2.535 1.907 1.00 0.00 H new ATOM 0 HB ILE A 113 3.807 3.792 0.196 1.00 0.00 H new ATOM 0 HG12 ILE A 113 5.509 2.716 -1.237 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.517 4.462 -1.381 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.029 5.879 0.660 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.474 5.092 2.157 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.182 4.975 1.670 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.798 3.579 -1.302 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.471 4.591 0.125 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.463 2.818 0.271 1.00 0.00 H new ATOM 1786 N GLY A 114 4.216 3.131 3.635 1.00 0.00 N ATOM 1787 CA GLY A 114 3.244 3.189 4.710 1.00 0.00 C ATOM 1788 C GLY A 114 2.992 4.602 5.202 1.00 0.00 C ATOM 1789 O GLY A 114 3.930 5.362 5.441 1.00 0.00 O ATOM 0 H GLY A 114 5.104 3.594 3.832 1.00 0.00 H new ATOM 0 HA2 GLY A 114 2.304 2.756 4.367 1.00 0.00 H new ATOM 0 HA3 GLY A 114 3.593 2.577 5.542 1.00 0.00 H new ATOM 1793 N VAL A 115 1.717 4.950 5.360 1.00 0.00 N ATOM 1794 CA VAL A 115 1.333 6.266 5.834 1.00 0.00 C ATOM 1795 C VAL A 115 0.276 6.156 6.925 1.00 0.00 C ATOM 1796 O VAL A 115 -0.364 5.118 7.084 1.00 0.00 O ATOM 1797 CB VAL A 115 0.794 7.148 4.688 1.00 0.00 C ATOM 1798 CG1 VAL A 115 1.800 7.220 3.550 1.00 0.00 C ATOM 1799 CG2 VAL A 115 -0.548 6.629 4.189 1.00 0.00 C ATOM 0 H VAL A 115 0.931 4.330 5.164 1.00 0.00 H new ATOM 0 HA VAL A 115 2.229 6.735 6.240 1.00 0.00 H new ATOM 0 HB VAL A 115 0.643 8.155 5.076 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.402 7.846 2.752 1.00 0.00 H new ATOM 0 HG12 VAL A 115 2.733 7.648 3.916 1.00 0.00 H new ATOM 0 HG13 VAL A 115 1.987 6.217 3.166 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -0.907 7.267 3.382 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.430 5.610 3.821 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.269 6.638 5.007 1.00 0.00 H new ATOM 1809 N ASP A 116 0.100 7.235 7.667 1.00 0.00 N ATOM 1810 CA ASP A 116 -0.882 7.274 8.746 1.00 0.00 C ATOM 1811 C ASP A 116 -2.084 8.126 8.352 1.00 0.00 C ATOM 1812 O ASP A 116 -1.980 9.347 8.235 1.00 0.00 O ATOM 1813 CB ASP A 116 -0.249 7.819 10.030 1.00 0.00 C ATOM 1814 CG ASP A 116 0.685 8.986 9.774 1.00 0.00 C ATOM 1815 OD1 ASP A 116 0.324 9.871 8.971 1.00 0.00 O ATOM 1816 OD2 ASP A 116 1.778 9.014 10.377 1.00 0.00 O ATOM 0 H ASP A 116 0.625 8.101 7.544 1.00 0.00 H new ATOM 0 HA ASP A 116 -1.224 6.255 8.929 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -1.038 8.134 10.713 1.00 0.00 H new ATOM 0 HB3 ASP A 116 0.302 7.020 10.526 1.00 0.00 H new ATOM 1821 N ALA A 117 -3.224 7.474 8.147 1.00 0.00 N ATOM 1822 CA ALA A 117 -4.446 8.172 7.764 1.00 0.00 C ATOM 1823 C ALA A 117 -4.845 9.205 8.813 1.00 0.00 C ATOM 1824 O ALA A 117 -5.219 10.330 8.481 1.00 0.00 O ATOM 1825 CB ALA A 117 -5.576 7.177 7.543 1.00 0.00 C ATOM 0 H ALA A 117 -3.327 6.463 8.240 1.00 0.00 H new ATOM 0 HA ALA A 117 -4.253 8.700 6.830 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -6.482 7.712 7.258 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -5.300 6.483 6.749 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -5.757 6.622 8.463 1.00 0.00 H new ATOM 1831 N ASP A 118 -4.766 8.813 10.081 1.00 0.00 N ATOM 1832 CA ASP A 118 -5.121 9.702 11.182 1.00 0.00 C ATOM 1833 C ASP A 118 -4.314 10.996 11.126 1.00 0.00 C ATOM 1834 O ASP A 118 -4.871 12.081 10.966 1.00 0.00 O ATOM 1835 CB ASP A 118 -4.893 9.003 12.523 1.00 0.00 C ATOM 1836 CG ASP A 118 -5.877 9.452 13.585 1.00 0.00 C ATOM 1837 OD1 ASP A 118 -7.097 9.309 13.360 1.00 0.00 O ATOM 1838 OD2 ASP A 118 -5.428 9.946 14.640 1.00 0.00 O ATOM 0 H ASP A 118 -4.459 7.885 10.372 1.00 0.00 H new ATOM 0 HA ASP A 118 -6.177 9.952 11.084 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.977 7.925 12.386 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -3.878 9.202 12.865 1.00 0.00 H new ATOM 1843 N SER A 119 -2.996 10.873 11.261 1.00 0.00 N ATOM 1844 CA SER A 119 -2.114 12.034 11.228 1.00 0.00 C ATOM 1845 C SER A 119 -2.119 12.686 9.849 1.00 0.00 C ATOM 1846 O SER A 119 -2.185 13.909 9.730 1.00 0.00 O ATOM 1847 CB SER A 119 -0.688 11.627 11.607 1.00 0.00 C ATOM 1848 OG SER A 119 0.117 12.764 11.860 1.00 0.00 O ATOM 0 H SER A 119 -2.517 9.982 11.394 1.00 0.00 H new ATOM 0 HA SER A 119 -2.484 12.759 11.953 1.00 0.00 H new ATOM 0 HB2 SER A 119 -0.711 10.990 12.491 1.00 0.00 H new ATOM 0 HB3 SER A 119 -0.248 11.038 10.802 1.00 0.00 H new ATOM 0 HG SER A 119 0.325 13.212 11.014 1.00 0.00 H new ATOM 1854 N GLY A 120 -2.049 11.861 8.809 1.00 0.00 N ATOM 1855 CA GLY A 120 -2.047 12.377 7.452 1.00 0.00 C ATOM 1856 C GLY A 120 -0.652 12.716 6.963 1.00 0.00 C ATOM 1857 O GLY A 120 -0.454 13.715 6.272 1.00 0.00 O ATOM 0 H GLY A 120 -1.994 10.845 8.881 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -2.493 11.639 6.785 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -2.672 13.269 7.405 1.00 0.00 H new ATOM 1861 N ASP A 121 0.318 11.881 7.322 1.00 0.00 N ATOM 1862 CA ASP A 121 1.702 12.096 6.915 1.00 0.00 C ATOM 1863 C ASP A 121 2.404 10.767 6.648 1.00 0.00 C ATOM 1864 O ASP A 121 1.944 9.713 7.088 1.00 0.00 O ATOM 1865 CB ASP A 121 2.457 12.877 7.991 1.00 0.00 C ATOM 1866 CG ASP A 121 1.720 14.131 8.419 1.00 0.00 C ATOM 1867 OD1 ASP A 121 0.632 14.006 9.020 1.00 0.00 O ATOM 1868 OD2 ASP A 121 2.232 15.240 8.154 1.00 0.00 O ATOM 0 H ASP A 121 0.171 11.049 7.894 1.00 0.00 H new ATOM 0 HA ASP A 121 1.697 12.676 5.992 1.00 0.00 H new ATOM 0 HB2 ASP A 121 2.613 12.236 8.859 1.00 0.00 H new ATOM 0 HB3 ASP A 121 3.443 13.149 7.614 1.00 0.00 H new ATOM 1873 N VAL A 122 3.516 10.827 5.925 1.00 0.00 N ATOM 1874 CA VAL A 122 4.282 9.630 5.599 1.00 0.00 C ATOM 1875 C VAL A 122 5.001 9.085 6.827 1.00 0.00 C ATOM 1876 O VAL A 122 5.657 9.830 7.557 1.00 0.00 O ATOM 1877 CB VAL A 122 5.317 9.911 4.495 1.00 0.00 C ATOM 1878 CG1 VAL A 122 5.912 8.611 3.980 1.00 0.00 C ATOM 1879 CG2 VAL A 122 4.690 10.705 3.359 1.00 0.00 C ATOM 0 H VAL A 122 3.908 11.692 5.553 1.00 0.00 H new ATOM 0 HA VAL A 122 3.570 8.887 5.240 1.00 0.00 H new ATOM 0 HB VAL A 122 6.121 10.510 4.922 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.642 8.829 3.200 1.00 0.00 H new ATOM 0 HG12 VAL A 122 6.403 8.086 4.799 1.00 0.00 H new ATOM 0 HG13 VAL A 122 5.119 7.985 3.571 1.00 0.00 H new ATOM 0 HG21 VAL A 122 5.439 10.893 2.590 1.00 0.00 H new ATOM 0 HG22 VAL A 122 3.864 10.137 2.931 1.00 0.00 H new ATOM 0 HG23 VAL A 122 4.317 11.655 3.742 1.00 0.00 H new ATOM 1889 N VAL A 123 4.874 7.781 7.052 1.00 0.00 N ATOM 1890 CA VAL A 123 5.510 7.136 8.194 1.00 0.00 C ATOM 1891 C VAL A 123 6.670 6.247 7.752 1.00 0.00 C ATOM 1892 O VAL A 123 7.710 6.195 8.409 1.00 0.00 O ATOM 1893 CB VAL A 123 4.506 6.292 9.005 1.00 0.00 C ATOM 1894 CG1 VAL A 123 5.036 6.037 10.407 1.00 0.00 C ATOM 1895 CG2 VAL A 123 3.147 6.976 9.062 1.00 0.00 C ATOM 0 H VAL A 123 4.336 7.150 6.458 1.00 0.00 H new ATOM 0 HA VAL A 123 5.891 7.935 8.830 1.00 0.00 H new ATOM 0 HB VAL A 123 4.382 5.332 8.503 1.00 0.00 H new ATOM 0 HG11 VAL A 123 4.315 5.440 10.966 1.00 0.00 H new ATOM 0 HG12 VAL A 123 5.982 5.500 10.346 1.00 0.00 H new ATOM 0 HG13 VAL A 123 5.191 6.988 10.916 1.00 0.00 H new ATOM 0 HG21 VAL A 123 2.455 6.363 9.639 1.00 0.00 H new ATOM 0 HG22 VAL A 123 3.250 7.951 9.537 1.00 0.00 H new ATOM 0 HG23 VAL A 123 2.762 7.104 8.051 1.00 0.00 H new ATOM 1905 N THR A 124 6.487 5.554 6.634 1.00 0.00 N ATOM 1906 CA THR A 124 7.520 4.670 6.101 1.00 0.00 C ATOM 1907 C THR A 124 7.470 4.651 4.573 1.00 0.00 C ATOM 1908 O THR A 124 6.396 4.755 3.980 1.00 0.00 O ATOM 1909 CB THR A 124 7.363 3.244 6.659 1.00 0.00 C ATOM 1910 OG1 THR A 124 7.597 2.276 5.649 1.00 0.00 O ATOM 1911 CG2 THR A 124 5.996 2.966 7.253 1.00 0.00 C ATOM 0 H THR A 124 5.633 5.586 6.078 1.00 0.00 H new ATOM 0 HA THR A 124 8.491 5.054 6.414 1.00 0.00 H new ATOM 0 HB THR A 124 8.104 3.173 7.456 1.00 0.00 H new ATOM 0 HG1 THR A 124 7.695 1.392 6.060 1.00 0.00 H new ATOM 0 HG21 THR A 124 5.962 1.942 7.625 1.00 0.00 H new ATOM 0 HG22 THR A 124 5.809 3.657 8.075 1.00 0.00 H new ATOM 0 HG23 THR A 124 5.232 3.099 6.487 1.00 0.00 H new ATOM 1919 N THR A 125 8.634 4.521 3.940 1.00 0.00 N ATOM 1920 CA THR A 125 8.709 4.494 2.482 1.00 0.00 C ATOM 1921 C THR A 125 9.784 3.520 2.006 1.00 0.00 C ATOM 1922 O THR A 125 10.581 3.843 1.124 1.00 0.00 O ATOM 1923 CB THR A 125 8.998 5.896 1.941 1.00 0.00 C ATOM 1924 OG1 THR A 125 10.143 6.448 2.568 1.00 0.00 O ATOM 1925 CG2 THR A 125 7.854 6.865 2.139 1.00 0.00 C ATOM 0 H THR A 125 9.534 4.433 4.412 1.00 0.00 H new ATOM 0 HA THR A 125 7.746 4.155 2.101 1.00 0.00 H new ATOM 0 HB THR A 125 9.157 5.764 0.871 1.00 0.00 H new ATOM 0 HG1 THR A 125 10.313 7.344 2.208 1.00 0.00 H new ATOM 0 HG21 THR A 125 8.127 7.839 1.732 1.00 0.00 H new ATOM 0 HG22 THR A 125 6.968 6.492 1.624 1.00 0.00 H new ATOM 0 HG23 THR A 125 7.641 6.963 3.203 1.00 0.00 H new ATOM 1933 N ARG A 126 9.800 2.328 2.593 1.00 0.00 N ATOM 1934 CA ARG A 126 10.779 1.310 2.225 1.00 0.00 C ATOM 1935 C ARG A 126 10.545 0.021 3.008 1.00 0.00 C ATOM 1936 O ARG A 126 11.388 -0.398 3.802 1.00 0.00 O ATOM 1937 CB ARG A 126 12.205 1.820 2.464 1.00 0.00 C ATOM 1938 CG ARG A 126 12.354 2.691 3.704 1.00 0.00 C ATOM 1939 CD ARG A 126 12.499 1.851 4.962 1.00 0.00 C ATOM 1940 NE ARG A 126 13.327 2.513 5.968 1.00 0.00 N ATOM 1941 CZ ARG A 126 13.286 2.229 7.268 1.00 0.00 C ATOM 1942 NH1 ARG A 126 12.457 1.300 7.727 1.00 0.00 N ATOM 1943 NH2 ARG A 126 14.077 2.877 8.112 1.00 0.00 N ATOM 0 H ARG A 126 9.148 2.043 3.324 1.00 0.00 H new ATOM 0 HA ARG A 126 10.657 1.096 1.163 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.875 0.965 2.551 1.00 0.00 H new ATOM 0 HB3 ARG A 126 12.527 2.390 1.592 1.00 0.00 H new ATOM 0 HG2 ARG A 126 13.226 3.336 3.594 1.00 0.00 H new ATOM 0 HG3 ARG A 126 11.485 3.342 3.799 1.00 0.00 H new ATOM 0 HD2 ARG A 126 11.512 1.649 5.379 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.940 0.887 4.706 1.00 0.00 H new ATOM 0 HE ARG A 126 13.975 3.236 5.655 1.00 0.00 H new ATOM 0 HH11 ARG A 126 11.846 0.798 7.083 1.00 0.00 H new ATOM 0 HH12 ARG A 126 12.431 1.088 8.724 1.00 0.00 H new ATOM 0 HH21 ARG A 126 14.716 3.592 7.765 1.00 0.00 H new ATOM 0 HH22 ARG A 126 14.046 2.660 9.108 1.00 0.00 H new ATOM 1957 N ALA A 127 9.394 -0.603 2.781 1.00 0.00 N ATOM 1958 CA ALA A 127 9.048 -1.843 3.467 1.00 0.00 C ATOM 1959 C ALA A 127 9.585 -3.069 2.734 1.00 0.00 C ATOM 1960 O ALA A 127 9.430 -4.195 3.207 1.00 0.00 O ATOM 1961 CB ALA A 127 7.539 -1.952 3.636 1.00 0.00 C ATOM 0 H ALA A 127 8.685 -0.271 2.127 1.00 0.00 H new ATOM 0 HA ALA A 127 9.519 -1.814 4.450 1.00 0.00 H new ATOM 0 HB1 ALA A 127 7.297 -2.882 4.149 1.00 0.00 H new ATOM 0 HB2 ALA A 127 7.177 -1.108 4.224 1.00 0.00 H new ATOM 0 HB3 ALA A 127 7.062 -1.943 2.656 1.00 0.00 H new ATOM 1967 N ARG A 128 10.214 -2.855 1.583 1.00 0.00 N ATOM 1968 CA ARG A 128 10.764 -3.962 0.810 1.00 0.00 C ATOM 1969 C ARG A 128 11.622 -4.865 1.689 1.00 0.00 C ATOM 1970 O ARG A 128 11.396 -6.069 1.757 1.00 0.00 O ATOM 1971 CB ARG A 128 11.587 -3.445 -0.376 1.00 0.00 C ATOM 1972 CG ARG A 128 12.323 -2.139 -0.101 1.00 0.00 C ATOM 1973 CD ARG A 128 13.773 -2.201 -0.558 1.00 0.00 C ATOM 1974 NE ARG A 128 14.097 -1.128 -1.495 1.00 0.00 N ATOM 1975 CZ ARG A 128 13.605 -1.047 -2.729 1.00 0.00 C ATOM 1976 NH1 ARG A 128 12.767 -1.973 -3.179 1.00 0.00 N ATOM 1977 NH2 ARG A 128 13.951 -0.036 -3.515 1.00 0.00 N ATOM 0 H ARG A 128 10.355 -1.934 1.168 1.00 0.00 H new ATOM 0 HA ARG A 128 9.928 -4.546 0.424 1.00 0.00 H new ATOM 0 HB2 ARG A 128 12.314 -4.206 -0.659 1.00 0.00 H new ATOM 0 HB3 ARG A 128 10.924 -3.303 -1.230 1.00 0.00 H new ATOM 0 HG2 ARG A 128 11.815 -1.321 -0.612 1.00 0.00 H new ATOM 0 HG3 ARG A 128 12.287 -1.919 0.966 1.00 0.00 H new ATOM 0 HD2 ARG A 128 14.430 -2.136 0.309 1.00 0.00 H new ATOM 0 HD3 ARG A 128 13.964 -3.165 -1.030 1.00 0.00 H new ATOM 0 HE ARG A 128 14.738 -0.398 -1.185 1.00 0.00 H new ATOM 0 HH11 ARG A 128 12.497 -2.752 -2.578 1.00 0.00 H new ATOM 0 HH12 ARG A 128 12.393 -1.906 -4.126 1.00 0.00 H new ATOM 0 HH21 ARG A 128 14.594 0.679 -3.174 1.00 0.00 H new ATOM 0 HH22 ARG A 128 13.574 0.027 -4.461 1.00 0.00 H new ATOM 1991 N ALA A 129 12.609 -4.275 2.354 1.00 0.00 N ATOM 1992 CA ALA A 129 13.508 -5.020 3.230 1.00 0.00 C ATOM 1993 C ALA A 129 12.940 -5.186 4.641 1.00 0.00 C ATOM 1994 O ALA A 129 12.933 -6.282 5.197 1.00 0.00 O ATOM 1995 CB ALA A 129 14.853 -4.316 3.298 1.00 0.00 C ATOM 0 H ALA A 129 12.808 -3.276 2.303 1.00 0.00 H new ATOM 0 HA ALA A 129 13.626 -6.018 2.807 1.00 0.00 H new ATOM 0 HB1 ALA A 129 15.523 -4.874 3.953 1.00 0.00 H new ATOM 0 HB2 ALA A 129 15.285 -4.260 2.299 1.00 0.00 H new ATOM 0 HB3 ALA A 129 14.717 -3.309 3.691 1.00 0.00 H new ATOM 2001 N THR A 130 12.511 -4.072 5.222 1.00 0.00 N ATOM 2002 CA THR A 130 11.989 -4.035 6.570 1.00 0.00 C ATOM 2003 C THR A 130 10.804 -4.958 6.792 1.00 0.00 C ATOM 2004 O THR A 130 10.804 -5.752 7.729 1.00 0.00 O ATOM 2005 CB THR A 130 11.627 -2.600 6.907 1.00 0.00 C ATOM 2006 OG1 THR A 130 10.707 -2.086 5.969 1.00 0.00 O ATOM 2007 CG2 THR A 130 12.822 -1.674 6.921 1.00 0.00 C ATOM 0 H THR A 130 12.519 -3.163 4.760 1.00 0.00 H new ATOM 0 HA THR A 130 12.768 -4.404 7.237 1.00 0.00 H new ATOM 0 HB THR A 130 11.197 -2.636 7.908 1.00 0.00 H new ATOM 0 HG1 THR A 130 10.003 -1.592 6.438 1.00 0.00 H new ATOM 0 HG21 THR A 130 12.496 -0.664 7.168 1.00 0.00 H new ATOM 0 HG22 THR A 130 13.539 -2.017 7.667 1.00 0.00 H new ATOM 0 HG23 THR A 130 13.293 -1.673 5.938 1.00 0.00 H new ATOM 2015 N LEU A 131 9.790 -4.856 5.954 1.00 0.00 N ATOM 2016 CA LEU A 131 8.613 -5.694 6.118 1.00 0.00 C ATOM 2017 C LEU A 131 8.991 -7.170 6.214 1.00 0.00 C ATOM 2018 O LEU A 131 8.332 -7.941 6.911 1.00 0.00 O ATOM 2019 CB LEU A 131 7.638 -5.485 4.962 1.00 0.00 C ATOM 2020 CG LEU A 131 6.287 -6.182 5.133 1.00 0.00 C ATOM 2021 CD1 LEU A 131 5.159 -5.164 5.172 1.00 0.00 C ATOM 2022 CD2 LEU A 131 6.061 -7.193 4.020 1.00 0.00 C ATOM 0 H LEU A 131 9.754 -4.212 5.164 1.00 0.00 H new ATOM 0 HA LEU A 131 8.130 -5.401 7.050 1.00 0.00 H new ATOM 0 HB2 LEU A 131 7.467 -4.416 4.837 1.00 0.00 H new ATOM 0 HB3 LEU A 131 8.103 -5.843 4.043 1.00 0.00 H new ATOM 0 HG LEU A 131 6.296 -6.717 6.083 1.00 0.00 H new ATOM 0 HD11 LEU A 131 4.207 -5.680 5.294 1.00 0.00 H new ATOM 0 HD12 LEU A 131 5.312 -4.483 6.009 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.148 -4.598 4.241 1.00 0.00 H new ATOM 0 HD21 LEU A 131 5.095 -7.678 4.160 1.00 0.00 H new ATOM 0 HD22 LEU A 131 6.075 -6.683 3.057 1.00 0.00 H new ATOM 0 HD23 LEU A 131 6.851 -7.944 4.045 1.00 0.00 H new ATOM 2034 N VAL A 132 10.052 -7.561 5.515 1.00 0.00 N ATOM 2035 CA VAL A 132 10.503 -8.940 5.531 1.00 0.00 C ATOM 2036 C VAL A 132 11.513 -9.183 6.646 1.00 0.00 C ATOM 2037 O VAL A 132 11.515 -10.234 7.286 1.00 0.00 O ATOM 2038 CB VAL A 132 11.140 -9.351 4.189 1.00 0.00 C ATOM 2039 CG1 VAL A 132 10.533 -10.647 3.675 1.00 0.00 C ATOM 2040 CG2 VAL A 132 11.019 -8.253 3.150 1.00 0.00 C ATOM 0 H VAL A 132 10.612 -6.939 4.932 1.00 0.00 H new ATOM 0 HA VAL A 132 9.615 -9.548 5.705 1.00 0.00 H new ATOM 0 HB VAL A 132 12.202 -9.516 4.370 1.00 0.00 H new ATOM 0 HG11 VAL A 132 10.999 -10.916 2.727 1.00 0.00 H new ATOM 0 HG12 VAL A 132 10.703 -11.442 4.401 1.00 0.00 H new ATOM 0 HG13 VAL A 132 9.461 -10.514 3.528 1.00 0.00 H new ATOM 0 HG21 VAL A 132 11.480 -8.581 2.218 1.00 0.00 H new ATOM 0 HG22 VAL A 132 9.966 -8.031 2.976 1.00 0.00 H new ATOM 0 HG23 VAL A 132 11.524 -7.356 3.508 1.00 0.00 H new ATOM 2050 N LYS A 133 12.398 -8.210 6.836 1.00 0.00 N ATOM 2051 CA LYS A 133 13.456 -8.312 7.830 1.00 0.00 C ATOM 2052 C LYS A 133 13.070 -7.648 9.153 1.00 0.00 C ATOM 2053 O LYS A 133 13.930 -7.349 9.982 1.00 0.00 O ATOM 2054 CB LYS A 133 14.734 -7.694 7.260 1.00 0.00 C ATOM 2055 CG LYS A 133 15.046 -8.161 5.845 1.00 0.00 C ATOM 2056 CD LYS A 133 15.594 -9.579 5.834 1.00 0.00 C ATOM 2057 CE LYS A 133 15.480 -10.210 4.457 1.00 0.00 C ATOM 2058 NZ LYS A 133 16.588 -9.785 3.557 1.00 0.00 N ATOM 0 H LYS A 133 12.401 -7.336 6.309 1.00 0.00 H new ATOM 0 HA LYS A 133 13.623 -9.366 8.051 1.00 0.00 H new ATOM 0 HB2 LYS A 133 14.638 -6.608 7.265 1.00 0.00 H new ATOM 0 HB3 LYS A 133 15.572 -7.943 7.911 1.00 0.00 H new ATOM 0 HG2 LYS A 133 14.142 -8.115 5.238 1.00 0.00 H new ATOM 0 HG3 LYS A 133 15.771 -7.486 5.390 1.00 0.00 H new ATOM 0 HD2 LYS A 133 16.639 -9.569 6.145 1.00 0.00 H new ATOM 0 HD3 LYS A 133 15.051 -10.185 6.559 1.00 0.00 H new ATOM 0 HE2 LYS A 133 15.487 -11.296 4.554 1.00 0.00 H new ATOM 0 HE3 LYS A 133 14.524 -9.936 4.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 16.473 -10.238 2.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 16.566 -8.751 3.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 17.499 -10.069 3.970 1.00 0.00 H new ATOM 2072 N ASP A 134 11.774 -7.440 9.348 1.00 0.00 N ATOM 2073 CA ASP A 134 11.264 -6.833 10.575 1.00 0.00 C ATOM 2074 C ASP A 134 10.011 -7.565 11.048 1.00 0.00 C ATOM 2075 O ASP A 134 8.954 -6.957 11.225 1.00 0.00 O ATOM 2076 CB ASP A 134 10.958 -5.350 10.357 1.00 0.00 C ATOM 2077 CG ASP A 134 11.059 -4.544 11.638 1.00 0.00 C ATOM 2078 OD1 ASP A 134 10.755 -5.100 12.714 1.00 0.00 O ATOM 2079 OD2 ASP A 134 11.443 -3.358 11.564 1.00 0.00 O ATOM 0 H ASP A 134 11.052 -7.683 8.670 1.00 0.00 H new ATOM 0 HA ASP A 134 12.032 -6.918 11.344 1.00 0.00 H new ATOM 0 HB2 ASP A 134 11.650 -4.944 9.620 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.955 -5.246 9.944 1.00 0.00 H new ATOM 2084 N PRO A 135 10.114 -8.891 11.257 1.00 0.00 N ATOM 2085 CA PRO A 135 8.992 -9.710 11.706 1.00 0.00 C ATOM 2086 C PRO A 135 8.849 -9.728 13.225 1.00 0.00 C ATOM 2087 O PRO A 135 8.217 -10.624 13.784 1.00 0.00 O ATOM 2088 CB PRO A 135 9.374 -11.093 11.194 1.00 0.00 C ATOM 2089 CG PRO A 135 10.862 -11.121 11.292 1.00 0.00 C ATOM 2090 CD PRO A 135 11.334 -9.704 11.068 1.00 0.00 C ATOM 0 HA PRO A 135 8.034 -9.339 11.342 1.00 0.00 H new ATOM 0 HB2 PRO A 135 8.920 -11.880 11.796 1.00 0.00 H new ATOM 0 HB3 PRO A 135 9.039 -11.244 10.168 1.00 0.00 H new ATOM 0 HG2 PRO A 135 11.179 -11.486 12.269 1.00 0.00 H new ATOM 0 HG3 PRO A 135 11.287 -11.794 10.547 1.00 0.00 H new ATOM 0 HD2 PRO A 135 12.114 -9.426 11.777 1.00 0.00 H new ATOM 0 HD3 PRO A 135 11.750 -9.574 10.069 1.00 0.00 H new ATOM 2098 N GLU A 136 9.435 -8.737 13.891 1.00 0.00 N ATOM 2099 CA GLU A 136 9.361 -8.654 15.340 1.00 0.00 C ATOM 2100 C GLU A 136 8.305 -7.642 15.757 1.00 0.00 C ATOM 2101 O GLU A 136 7.611 -7.831 16.755 1.00 0.00 O ATOM 2102 CB GLU A 136 10.721 -8.268 15.925 1.00 0.00 C ATOM 2103 CG GLU A 136 11.825 -9.261 15.604 1.00 0.00 C ATOM 2104 CD GLU A 136 13.177 -8.819 16.129 1.00 0.00 C ATOM 2105 OE1 GLU A 136 13.700 -7.797 15.638 1.00 0.00 O ATOM 2106 OE2 GLU A 136 13.713 -9.496 17.031 1.00 0.00 O ATOM 0 H GLU A 136 9.964 -7.985 13.449 1.00 0.00 H new ATOM 0 HA GLU A 136 9.082 -9.634 15.728 1.00 0.00 H new ATOM 0 HB2 GLU A 136 11.005 -7.286 15.546 1.00 0.00 H new ATOM 0 HB3 GLU A 136 10.629 -8.177 17.007 1.00 0.00 H new ATOM 0 HG2 GLU A 136 11.572 -10.231 16.033 1.00 0.00 H new ATOM 0 HG3 GLU A 136 11.885 -9.396 14.524 1.00 0.00 H new ATOM 2113 N GLY A 137 8.193 -6.563 14.989 1.00 0.00 N ATOM 2114 CA GLY A 137 7.223 -5.539 15.306 1.00 0.00 C ATOM 2115 C GLY A 137 7.798 -4.514 16.253 1.00 0.00 C ATOM 2116 O GLY A 137 7.084 -3.943 17.077 1.00 0.00 O ATOM 0 H GLY A 137 8.755 -6.383 14.157 1.00 0.00 H new ATOM 0 HA2 GLY A 137 6.897 -5.048 14.389 1.00 0.00 H new ATOM 0 HA3 GLY A 137 6.341 -5.997 15.754 1.00 0.00 H new ATOM 2120 N GLU A 138 9.100 -4.294 16.138 1.00 0.00 N ATOM 2121 CA GLU A 138 9.790 -3.343 16.997 1.00 0.00 C ATOM 2122 C GLU A 138 9.461 -1.907 16.610 1.00 0.00 C ATOM 2123 O GLU A 138 9.201 -1.070 17.474 1.00 0.00 O ATOM 2124 CB GLU A 138 11.304 -3.555 16.927 1.00 0.00 C ATOM 2125 CG GLU A 138 11.750 -4.962 17.292 1.00 0.00 C ATOM 2126 CD GLU A 138 11.088 -5.481 18.554 1.00 0.00 C ATOM 2127 OE1 GLU A 138 10.762 -4.659 19.434 1.00 0.00 O ATOM 2128 OE2 GLU A 138 10.897 -6.712 18.661 1.00 0.00 O ATOM 0 H GLU A 138 9.700 -4.761 15.458 1.00 0.00 H new ATOM 0 HA GLU A 138 9.447 -3.516 18.017 1.00 0.00 H new ATOM 0 HB2 GLU A 138 11.646 -3.327 15.917 1.00 0.00 H new ATOM 0 HB3 GLU A 138 11.791 -2.846 17.596 1.00 0.00 H new ATOM 0 HG2 GLU A 138 11.524 -5.636 16.465 1.00 0.00 H new ATOM 0 HG3 GLU A 138 12.832 -4.972 17.424 1.00 0.00 H new ATOM 2135 N GLN A 139 9.499 -1.615 15.313 1.00 0.00 N ATOM 2136 CA GLN A 139 9.229 -0.265 14.843 1.00 0.00 C ATOM 2137 C GLN A 139 8.524 -0.261 13.493 1.00 0.00 C ATOM 2138 O GLN A 139 8.639 0.707 12.757 1.00 0.00 O ATOM 2139 CB GLN A 139 10.545 0.497 14.692 1.00 0.00 C ATOM 2140 CG GLN A 139 11.695 -0.038 15.531 1.00 0.00 C ATOM 2141 CD GLN A 139 12.767 1.003 15.780 1.00 0.00 C ATOM 2142 OE1 GLN A 139 12.573 2.188 15.507 1.00 0.00 O ATOM 2143 NE2 GLN A 139 13.908 0.566 16.302 1.00 0.00 N ATOM 0 H GLN A 139 9.712 -2.289 14.578 1.00 0.00 H new ATOM 0 HA GLN A 139 8.580 0.209 15.579 1.00 0.00 H new ATOM 0 HB2 GLN A 139 10.840 0.478 13.643 1.00 0.00 H new ATOM 0 HB3 GLN A 139 10.376 1.541 14.957 1.00 0.00 H new ATOM 0 HG2 GLN A 139 11.309 -0.392 16.487 1.00 0.00 H new ATOM 0 HG3 GLN A 139 12.138 -0.897 15.028 1.00 0.00 H new ATOM 0 HE21 GLN A 139 14.026 -0.425 16.513 1.00 0.00 H new ATOM 0 HE22 GLN A 139 14.666 1.222 16.492 1.00 0.00 H new ATOM 2152 N PHE A 140 7.825 -1.345 13.161 1.00 0.00 N ATOM 2153 CA PHE A 140 7.134 -1.465 11.864 1.00 0.00 C ATOM 2154 C PHE A 140 6.749 -0.128 11.245 1.00 0.00 C ATOM 2155 O PHE A 140 7.113 0.137 10.102 1.00 0.00 O ATOM 2156 CB PHE A 140 5.935 -2.406 11.952 1.00 0.00 C ATOM 2157 CG PHE A 140 4.938 -2.242 10.836 1.00 0.00 C ATOM 2158 CD1 PHE A 140 5.307 -2.471 9.521 1.00 0.00 C ATOM 2159 CD2 PHE A 140 3.633 -1.860 11.105 1.00 0.00 C ATOM 2160 CE1 PHE A 140 4.394 -2.322 8.494 1.00 0.00 C ATOM 2161 CE2 PHE A 140 2.717 -1.710 10.082 1.00 0.00 C ATOM 2162 CZ PHE A 140 3.097 -1.940 8.775 1.00 0.00 C ATOM 0 H PHE A 140 7.718 -2.157 13.768 1.00 0.00 H new ATOM 0 HA PHE A 140 7.864 -1.904 11.184 1.00 0.00 H new ATOM 0 HB2 PHE A 140 6.295 -3.435 11.955 1.00 0.00 H new ATOM 0 HB3 PHE A 140 5.429 -2.243 12.903 1.00 0.00 H new ATOM 0 HD1 PHE A 140 6.320 -2.770 9.295 1.00 0.00 H new ATOM 0 HD2 PHE A 140 3.329 -1.678 12.125 1.00 0.00 H new ATOM 0 HE1 PHE A 140 4.695 -2.504 7.473 1.00 0.00 H new ATOM 0 HE2 PHE A 140 1.703 -1.413 10.305 1.00 0.00 H new ATOM 0 HZ PHE A 140 2.382 -1.822 7.974 1.00 0.00 H new ATOM 2172 N PRO A 141 6.043 0.757 11.957 1.00 0.00 N ATOM 2173 CA PRO A 141 5.695 2.059 11.392 1.00 0.00 C ATOM 2174 C PRO A 141 6.950 2.863 11.024 1.00 0.00 C ATOM 2175 O PRO A 141 6.851 4.022 10.625 1.00 0.00 O ATOM 2176 CB PRO A 141 4.918 2.753 12.513 1.00 0.00 C ATOM 2177 CG PRO A 141 5.272 2.008 13.758 1.00 0.00 C ATOM 2178 CD PRO A 141 5.549 0.594 13.334 1.00 0.00 C ATOM 0 HA PRO A 141 5.121 1.969 10.470 1.00 0.00 H new ATOM 0 HB2 PRO A 141 5.195 3.804 12.591 1.00 0.00 H new ATOM 0 HB3 PRO A 141 3.845 2.720 12.327 1.00 0.00 H new ATOM 0 HG2 PRO A 141 6.145 2.448 14.240 1.00 0.00 H new ATOM 0 HG3 PRO A 141 4.456 2.046 14.480 1.00 0.00 H new ATOM 0 HD2 PRO A 141 6.290 0.117 13.976 1.00 0.00 H new ATOM 0 HD3 PRO A 141 4.651 -0.023 13.371 1.00 0.00 H new ATOM 2186 N TRP A 142 8.127 2.219 11.165 1.00 0.00 N ATOM 2187 CA TRP A 142 9.438 2.818 10.868 1.00 0.00 C ATOM 2188 C TRP A 142 9.340 4.298 10.513 1.00 0.00 C ATOM 2189 O TRP A 142 9.631 4.705 9.388 1.00 0.00 O ATOM 2190 CB TRP A 142 10.132 2.040 9.743 1.00 0.00 C ATOM 2191 CG TRP A 142 9.833 0.570 9.770 1.00 0.00 C ATOM 2192 CD1 TRP A 142 10.027 -0.302 10.809 1.00 0.00 C ATOM 2193 CD2 TRP A 142 9.279 -0.201 8.701 1.00 0.00 C ATOM 2194 NE1 TRP A 142 9.597 -1.560 10.456 1.00 0.00 N ATOM 2195 CE2 TRP A 142 9.142 -1.524 9.161 1.00 0.00 C ATOM 2196 CE3 TRP A 142 8.877 0.106 7.401 1.00 0.00 C ATOM 2197 CZ2 TRP A 142 8.618 -2.538 8.364 1.00 0.00 C ATOM 2198 CZ3 TRP A 142 8.360 -0.900 6.610 1.00 0.00 C ATOM 2199 CH2 TRP A 142 8.234 -2.208 7.092 1.00 0.00 C ATOM 0 H TRP A 142 8.191 1.255 11.493 1.00 0.00 H new ATOM 0 HA TRP A 142 10.036 2.751 11.777 1.00 0.00 H new ATOM 0 HB2 TRP A 142 9.822 2.450 8.782 1.00 0.00 H new ATOM 0 HB3 TRP A 142 11.209 2.187 9.819 1.00 0.00 H new ATOM 0 HD1 TRP A 142 10.455 -0.040 11.765 1.00 0.00 H new ATOM 0 HE1 TRP A 142 9.613 -2.384 11.057 1.00 0.00 H new ATOM 0 HE3 TRP A 142 8.969 1.113 7.020 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 8.518 -3.547 8.735 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 8.047 -0.674 5.601 1.00 0.00 H new ATOM 0 HH2 TRP A 142 7.826 -2.972 6.447 1.00 0.00 H new ATOM 2210 N LYS A 143 8.926 5.093 11.492 1.00 0.00 N ATOM 2211 CA LYS A 143 8.781 6.533 11.307 1.00 0.00 C ATOM 2212 C LYS A 143 10.096 7.163 10.858 1.00 0.00 C ATOM 2213 O LYS A 143 11.121 6.488 10.770 1.00 0.00 O ATOM 2214 CB LYS A 143 8.308 7.188 12.605 1.00 0.00 C ATOM 2215 CG LYS A 143 7.104 6.500 13.230 1.00 0.00 C ATOM 2216 CD LYS A 143 7.312 6.247 14.716 1.00 0.00 C ATOM 2217 CE LYS A 143 8.364 5.177 14.957 1.00 0.00 C ATOM 2218 NZ LYS A 143 8.672 5.018 16.404 1.00 0.00 N ATOM 0 H LYS A 143 8.684 4.764 12.426 1.00 0.00 H new ATOM 0 HA LYS A 143 8.036 6.699 10.529 1.00 0.00 H new ATOM 0 HB2 LYS A 143 9.129 7.188 13.322 1.00 0.00 H new ATOM 0 HB3 LYS A 143 8.058 8.230 12.406 1.00 0.00 H new ATOM 0 HG2 LYS A 143 6.217 7.116 13.086 1.00 0.00 H new ATOM 0 HG3 LYS A 143 6.920 5.554 12.721 1.00 0.00 H new ATOM 0 HD2 LYS A 143 7.615 7.173 15.205 1.00 0.00 H new ATOM 0 HD3 LYS A 143 6.369 5.941 15.169 1.00 0.00 H new ATOM 0 HE2 LYS A 143 8.014 4.227 14.554 1.00 0.00 H new ATOM 0 HE3 LYS A 143 9.275 5.436 14.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 9.394 4.279 16.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 9.030 5.918 16.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 7.808 4.746 16.915 1.00 0.00 H new