USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 694 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 Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 140:sc= 0.348 (180deg=-0.0597!) USER MOD Single : A 25 LYS NZ :NH3+ -156:sc= 1.24 (180deg=1.12) USER MOD Single : A 29 GLN : amide:sc= -0.183 X(o=-0.18,f=-0.13) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -123:sc= 1.12 USER MOD Single : A 35 HIS : no HD1:sc= -2.24 X(o=-2.2,f=-2.5) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 143:sc= 0 (180deg=-0.475) USER MOD Single : A 41 THR OG1 : rot -13:sc= -0.602 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.0981 USER MOD Single : A 43 HIS : no HD1:sc=-0.00213 X(o=-0.0021,f=-0.015) USER MOD Single : A 45 LYS NZ :NH3+ 161:sc= 2.23 (180deg=1.64) USER MOD Single : A 46 LYS NZ :NH3+ 162:sc= -0.0493 (180deg=-0.302) USER MOD Single : A 48 LYS NZ :NH3+ 162:sc= 1.78 (180deg=1.36) USER MOD Single : A 50 SER OG : rot 85:sc= 0.54 USER MOD Single : A 51 TYR OH : rot -114:sc= -0.62 USER MOD Single : A 52 CYS SG : rot 63:sc= 0.393 USER MOD Single : A 53 GLN : amide:sc=-0.00338 K(o=-0.0034,f=-0.89) USER MOD Single : A 55 GLN :FLIP amide:sc= 0.644 F(o=-0.42,f=0.64) USER MOD Single : A 59 MET CE :methyl -162:sc= -0.24 (180deg=-0.498) USER MOD Single : A 60 ASN : amide:sc= 0.0523 X(o=0.052,f=0) USER MOD Single : A 61 SER OG : rot -113:sc= 0.863 USER MOD Single : A 69 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 74 ASN : amide:sc= 0.0222 K(o=0.022,f=-3!) USER MOD Single : A 75 HIS : no HD1:sc= 0.349 K(o=0.35,f=-5.7!) USER MOD Single : A 76 THR OG1 : rot 83:sc= 1.23 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 169:sc= 1.26 USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : B 357 ASN : amide:sc= -0.114 K(o=-0.11,f=-1.5!) USER MOD Single : B 358 ASN : amide:sc= 0 K(o=0,f=-0.7) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 21 2.384 5.353 10.342 1.00 10.00 N ATOM 2 CA TYR A 21 2.579 5.176 8.888 1.00 10.00 C ATOM 3 C TYR A 21 1.329 4.589 8.262 1.00 10.00 C ATOM 4 O TYR A 21 0.435 4.131 8.968 1.00 10.00 O ATOM 5 CB TYR A 21 3.771 4.256 8.618 1.00 10.00 C ATOM 6 CG TYR A 21 5.117 4.908 8.840 1.00 10.00 C ATOM 7 CD1 TYR A 21 6.136 4.230 9.491 1.00 10.00 C ATOM 8 CD2 TYR A 21 5.366 6.200 8.396 1.00 10.00 C ATOM 9 CE1 TYR A 21 7.369 4.818 9.691 1.00 10.00 C ATOM 10 CE2 TYR A 21 6.595 6.795 8.593 1.00 10.00 C ATOM 11 CZ TYR A 21 7.592 6.100 9.241 1.00 10.00 C ATOM 12 OH TYR A 21 8.817 6.690 9.436 1.00 10.00 O ATOM 0 HA TYR A 21 2.778 6.152 8.445 1.00 10.00 H new ATOM 0 HB2 TYR A 21 3.693 3.380 9.262 1.00 10.00 H new ATOM 0 HB3 TYR A 21 3.717 3.901 7.589 1.00 10.00 H new ATOM 0 HD1 TYR A 21 5.962 3.225 9.848 1.00 10.00 H new ATOM 0 HD2 TYR A 21 4.585 6.747 7.889 1.00 10.00 H new ATOM 0 HE1 TYR A 21 8.154 4.276 10.197 1.00 10.00 H new ATOM 0 HE2 TYR A 21 6.774 7.800 8.241 1.00 10.00 H new ATOM 0 HH TYR A 21 8.809 7.594 9.058 1.00 10.00 H new ATOM 22 N ILE A 22 1.275 4.594 6.939 1.00 10.00 N ATOM 23 CA ILE A 22 0.129 4.062 6.221 1.00 10.00 C ATOM 24 C ILE A 22 0.404 2.625 5.805 1.00 10.00 C ATOM 25 O ILE A 22 1.291 2.363 4.993 1.00 10.00 O ATOM 26 CB ILE A 22 -0.203 4.910 4.970 1.00 10.00 C ATOM 27 CG1 ILE A 22 -0.396 6.384 5.352 1.00 10.00 C ATOM 28 CG2 ILE A 22 -1.444 4.373 4.268 1.00 10.00 C ATOM 29 CD1 ILE A 22 -1.558 6.631 6.295 1.00 10.00 C ATOM 0 H ILE A 22 2.014 4.962 6.340 1.00 10.00 H new ATOM 0 HA ILE A 22 -0.731 4.097 6.890 1.00 10.00 H new ATOM 0 HB ILE A 22 0.637 4.841 4.279 1.00 10.00 H new ATOM 0 HG12 ILE A 22 0.519 6.751 5.816 1.00 10.00 H new ATOM 0 HG13 ILE A 22 -0.549 6.967 4.444 1.00 10.00 H new ATOM 0 HG21 ILE A 22 -1.659 4.984 3.391 1.00 10.00 H new ATOM 0 HG22 ILE A 22 -1.270 3.343 3.958 1.00 10.00 H new ATOM 0 HG23 ILE A 22 -2.292 4.408 4.952 1.00 10.00 H new ATOM 0 HD11 ILE A 22 -1.627 7.696 6.516 1.00 10.00 H new ATOM 0 HD12 ILE A 22 -2.484 6.297 5.827 1.00 10.00 H new ATOM 0 HD13 ILE A 22 -1.399 6.078 7.221 1.00 10.00 H new ATOM 41 N LYS A 23 -0.339 1.695 6.371 1.00 10.00 N ATOM 42 CA LYS A 23 -0.159 0.289 6.055 1.00 10.00 C ATOM 43 C LYS A 23 -1.184 -0.161 5.021 1.00 10.00 C ATOM 44 O LYS A 23 -2.389 -0.158 5.285 1.00 10.00 O ATOM 45 CB LYS A 23 -0.280 -0.546 7.325 1.00 10.00 C ATOM 46 CG LYS A 23 0.225 -1.970 7.181 1.00 10.00 C ATOM 47 CD LYS A 23 0.033 -2.760 8.467 1.00 10.00 C ATOM 48 CE LYS A 23 -1.409 -3.221 8.639 1.00 10.00 C ATOM 49 NZ LYS A 23 -2.262 -2.198 9.307 1.00 10.00 N ATOM 0 H LYS A 23 -1.074 1.886 7.052 1.00 10.00 H new ATOM 0 HA LYS A 23 0.836 0.147 5.633 1.00 10.00 H new ATOM 0 HB2 LYS A 23 0.274 -0.054 8.124 1.00 10.00 H new ATOM 0 HB3 LYS A 23 -1.326 -0.572 7.632 1.00 10.00 H new ATOM 0 HG2 LYS A 23 -0.304 -2.464 6.366 1.00 10.00 H new ATOM 0 HG3 LYS A 23 1.282 -1.958 6.914 1.00 10.00 H new ATOM 0 HD2 LYS A 23 0.694 -3.627 8.463 1.00 10.00 H new ATOM 0 HD3 LYS A 23 0.321 -2.144 9.319 1.00 10.00 H new ATOM 0 HE2 LYS A 23 -1.830 -3.458 7.662 1.00 10.00 H new ATOM 0 HE3 LYS A 23 -1.425 -4.140 9.224 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 -3.197 -2.175 8.852 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 -2.372 -2.440 10.312 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 -1.813 -1.263 9.223 1.00 10.00 H new ATOM 63 N LEU A 24 -0.700 -0.536 3.847 1.00 10.00 N ATOM 64 CA LEU A 24 -1.565 -0.984 2.764 1.00 10.00 C ATOM 65 C LEU A 24 -1.563 -2.505 2.673 1.00 10.00 C ATOM 66 O LEU A 24 -0.544 -3.149 2.936 1.00 10.00 O ATOM 67 CB LEU A 24 -1.100 -0.383 1.435 1.00 10.00 C ATOM 68 CG LEU A 24 -0.949 1.141 1.429 1.00 10.00 C ATOM 69 CD1 LEU A 24 -0.221 1.595 0.177 1.00 10.00 C ATOM 70 CD2 LEU A 24 -2.309 1.814 1.530 1.00 10.00 C ATOM 0 H LEU A 24 0.294 -0.539 3.618 1.00 10.00 H new ATOM 0 HA LEU A 24 -2.581 -0.647 2.972 1.00 10.00 H new ATOM 0 HB2 LEU A 24 -0.142 -0.829 1.168 1.00 10.00 H new ATOM 0 HB3 LEU A 24 -1.810 -0.665 0.658 1.00 10.00 H new ATOM 0 HG LEU A 24 -0.358 1.433 2.297 1.00 10.00 H new ATOM 0 HD11 LEU A 24 -0.121 2.680 0.187 1.00 10.00 H new ATOM 0 HD12 LEU A 24 0.769 1.140 0.147 1.00 10.00 H new ATOM 0 HD13 LEU A 24 -0.787 1.291 -0.703 1.00 10.00 H new ATOM 0 HD21 LEU A 24 -2.181 2.896 1.524 1.00 10.00 H new ATOM 0 HD22 LEU A 24 -2.926 1.517 0.682 1.00 10.00 H new ATOM 0 HD23 LEU A 24 -2.797 1.511 2.457 1.00 10.00 H new ATOM 82 N LYS A 25 -2.705 -3.076 2.308 1.00 10.00 N ATOM 83 CA LYS A 25 -2.829 -4.518 2.176 1.00 10.00 C ATOM 84 C LYS A 25 -2.889 -4.915 0.708 1.00 10.00 C ATOM 85 O LYS A 25 -3.922 -4.757 0.054 1.00 10.00 O ATOM 86 CB LYS A 25 -4.075 -5.036 2.903 1.00 10.00 C ATOM 87 CG LYS A 25 -3.914 -5.106 4.412 1.00 10.00 C ATOM 88 CD LYS A 25 -5.014 -5.936 5.063 1.00 10.00 C ATOM 89 CE LYS A 25 -4.839 -7.425 4.794 1.00 10.00 C ATOM 90 NZ LYS A 25 -5.854 -8.246 5.512 1.00 10.00 N ATOM 0 H LYS A 25 -3.559 -2.559 2.098 1.00 10.00 H new ATOM 0 HA LYS A 25 -1.949 -4.969 2.634 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -4.919 -4.389 2.666 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -4.319 -6.029 2.526 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -2.943 -5.537 4.654 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -3.927 -4.098 4.826 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -5.013 -5.759 6.139 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -5.984 -5.611 4.687 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -4.915 -7.611 3.723 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -3.840 -7.734 5.101 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -5.488 -9.210 5.648 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -6.054 -7.818 6.438 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -6.729 -8.284 4.952 1.00 10.00 H new ATOM 104 N VAL A 26 -1.776 -5.417 0.196 1.00 10.00 N ATOM 105 CA VAL A 26 -1.700 -5.851 -1.191 1.00 10.00 C ATOM 106 C VAL A 26 -2.150 -7.299 -1.296 1.00 10.00 C ATOM 107 O VAL A 26 -1.704 -8.145 -0.524 1.00 10.00 O ATOM 108 CB VAL A 26 -0.265 -5.731 -1.756 1.00 10.00 C ATOM 109 CG1 VAL A 26 -0.289 -5.743 -3.279 1.00 10.00 C ATOM 110 CG2 VAL A 26 0.424 -4.478 -1.236 1.00 10.00 C ATOM 0 H VAL A 26 -0.910 -5.534 0.722 1.00 10.00 H new ATOM 0 HA VAL A 26 -2.352 -5.202 -1.775 1.00 10.00 H new ATOM 0 HB VAL A 26 0.308 -6.593 -1.414 1.00 10.00 H new ATOM 0 HG11 VAL A 26 0.729 -5.658 -3.660 1.00 10.00 H new ATOM 0 HG12 VAL A 26 -0.730 -6.676 -3.629 1.00 10.00 H new ATOM 0 HG13 VAL A 26 -0.883 -4.903 -3.640 1.00 10.00 H new ATOM 0 HG21 VAL A 26 1.431 -4.419 -1.649 1.00 10.00 H new ATOM 0 HG22 VAL A 26 -0.144 -3.598 -1.538 1.00 10.00 H new ATOM 0 HG23 VAL A 26 0.480 -4.518 -0.148 1.00 10.00 H new ATOM 120 N ILE A 27 -3.047 -7.573 -2.230 1.00 10.00 N ATOM 121 CA ILE A 27 -3.551 -8.925 -2.426 1.00 10.00 C ATOM 122 C ILE A 27 -2.889 -9.569 -3.637 1.00 10.00 C ATOM 123 O ILE A 27 -3.066 -9.116 -4.772 1.00 10.00 O ATOM 124 CB ILE A 27 -5.089 -8.944 -2.597 1.00 10.00 C ATOM 125 CG1 ILE A 27 -5.770 -8.291 -1.390 1.00 10.00 C ATOM 126 CG2 ILE A 27 -5.586 -10.373 -2.778 1.00 10.00 C ATOM 127 CD1 ILE A 27 -5.470 -8.973 -0.069 1.00 10.00 C ATOM 0 H ILE A 27 -3.441 -6.878 -2.864 1.00 10.00 H new ATOM 0 HA ILE A 27 -3.304 -9.497 -1.532 1.00 10.00 H new ATOM 0 HB ILE A 27 -5.344 -8.372 -3.489 1.00 10.00 H new ATOM 0 HG12 ILE A 27 -5.456 -7.249 -1.329 1.00 10.00 H new ATOM 0 HG13 ILE A 27 -6.848 -8.290 -1.550 1.00 10.00 H new ATOM 0 HG21 ILE A 27 -6.669 -10.369 -2.897 1.00 10.00 H new ATOM 0 HG22 ILE A 27 -5.125 -10.809 -3.664 1.00 10.00 H new ATOM 0 HG23 ILE A 27 -5.319 -10.965 -1.902 1.00 10.00 H new ATOM 0 HD11 ILE A 27 -5.988 -8.452 0.736 1.00 10.00 H new ATOM 0 HD12 ILE A 27 -5.809 -10.008 -0.109 1.00 10.00 H new ATOM 0 HD13 ILE A 27 -4.396 -8.950 0.117 1.00 10.00 H new ATOM 139 N GLY A 28 -2.113 -10.614 -3.383 1.00 10.00 N ATOM 140 CA GLY A 28 -1.424 -11.308 -4.449 1.00 10.00 C ATOM 141 C GLY A 28 -2.335 -12.244 -5.224 1.00 10.00 C ATOM 142 O GLY A 28 -3.499 -12.437 -4.861 1.00 10.00 O ATOM 0 H GLY A 28 -1.949 -10.994 -2.451 1.00 10.00 H new ATOM 0 HA2 GLY A 28 -0.993 -10.577 -5.134 1.00 10.00 H new ATOM 0 HA3 GLY A 28 -0.596 -11.879 -4.029 1.00 10.00 H new ATOM 146 N GLN A 29 -1.793 -12.844 -6.279 1.00 10.00 N ATOM 147 CA GLN A 29 -2.543 -13.763 -7.133 1.00 10.00 C ATOM 148 C GLN A 29 -3.037 -14.985 -6.352 1.00 10.00 C ATOM 149 O GLN A 29 -4.076 -15.563 -6.677 1.00 10.00 O ATOM 150 CB GLN A 29 -1.667 -14.207 -8.311 1.00 10.00 C ATOM 151 CG GLN A 29 -2.431 -14.914 -9.424 1.00 10.00 C ATOM 152 CD GLN A 29 -3.488 -14.032 -10.065 1.00 10.00 C ATOM 153 OE1 GLN A 29 -3.197 -13.262 -10.981 1.00 10.00 O ATOM 154 NE2 GLN A 29 -4.724 -14.149 -9.600 1.00 10.00 N ATOM 0 H GLN A 29 -0.824 -12.708 -6.567 1.00 10.00 H new ATOM 0 HA GLN A 29 -3.420 -13.235 -7.508 1.00 10.00 H new ATOM 0 HB2 GLN A 29 -1.167 -13.333 -8.727 1.00 10.00 H new ATOM 0 HB3 GLN A 29 -0.888 -14.873 -7.940 1.00 10.00 H new ATOM 0 HG2 GLN A 29 -1.728 -15.244 -10.188 1.00 10.00 H new ATOM 0 HG3 GLN A 29 -2.906 -15.808 -9.021 1.00 10.00 H new ATOM 0 HE21 GLN A 29 -4.923 -14.799 -8.840 1.00 10.00 H new ATOM 0 HE22 GLN A 29 -5.476 -13.589 -10.003 1.00 10.00 H new ATOM 163 N ASP A 30 -2.295 -15.370 -5.320 1.00 10.00 N ATOM 164 CA ASP A 30 -2.666 -16.520 -4.497 1.00 10.00 C ATOM 165 C ASP A 30 -3.393 -16.064 -3.234 1.00 10.00 C ATOM 166 O ASP A 30 -3.482 -16.806 -2.254 1.00 10.00 O ATOM 167 CB ASP A 30 -1.426 -17.338 -4.128 1.00 10.00 C ATOM 168 CG ASP A 30 -0.544 -16.637 -3.116 1.00 10.00 C ATOM 169 OD1 ASP A 30 -0.098 -15.507 -3.398 1.00 10.00 O ATOM 170 OD2 ASP A 30 -0.288 -17.220 -2.039 1.00 10.00 O ATOM 0 H ASP A 30 -1.434 -14.905 -5.032 1.00 10.00 H new ATOM 0 HA ASP A 30 -3.340 -17.151 -5.076 1.00 10.00 H new ATOM 0 HB2 ASP A 30 -1.738 -18.302 -3.726 1.00 10.00 H new ATOM 0 HB3 ASP A 30 -0.848 -17.541 -5.029 1.00 10.00 H new ATOM 175 N SER A 31 -3.904 -14.831 -3.279 1.00 10.00 N ATOM 176 CA SER A 31 -4.645 -14.230 -2.169 1.00 10.00 C ATOM 177 C SER A 31 -3.733 -13.903 -0.985 1.00 10.00 C ATOM 178 O SER A 31 -4.191 -13.816 0.154 1.00 10.00 O ATOM 179 CB SER A 31 -5.791 -15.149 -1.725 1.00 10.00 C ATOM 180 OG SER A 31 -6.655 -15.442 -2.814 1.00 10.00 O ATOM 0 H SER A 31 -3.815 -14.219 -4.090 1.00 10.00 H new ATOM 0 HA SER A 31 -5.065 -13.291 -2.529 1.00 10.00 H new ATOM 0 HB2 SER A 31 -5.384 -16.075 -1.319 1.00 10.00 H new ATOM 0 HB3 SER A 31 -6.357 -14.672 -0.925 1.00 10.00 H new ATOM 0 HG SER A 31 -7.377 -16.030 -2.509 1.00 10.00 H new ATOM 186 N SER A 32 -2.448 -13.716 -1.256 1.00 10.00 N ATOM 187 CA SER A 32 -1.492 -13.383 -0.211 1.00 10.00 C ATOM 188 C SER A 32 -1.710 -11.946 0.251 1.00 10.00 C ATOM 189 O SER A 32 -1.940 -11.057 -0.571 1.00 10.00 O ATOM 190 CB SER A 32 -0.070 -13.562 -0.738 1.00 10.00 C ATOM 191 OG SER A 32 -0.008 -13.273 -2.125 1.00 10.00 O ATOM 0 H SER A 32 -2.045 -13.789 -2.190 1.00 10.00 H new ATOM 0 HA SER A 32 -1.639 -14.049 0.639 1.00 10.00 H new ATOM 0 HB2 SER A 32 0.610 -12.906 -0.194 1.00 10.00 H new ATOM 0 HB3 SER A 32 0.263 -14.584 -0.559 1.00 10.00 H new ATOM 0 HG SER A 32 0.339 -14.053 -2.606 1.00 10.00 H new ATOM 197 N GLU A 33 -1.660 -11.722 1.558 1.00 10.00 N ATOM 198 CA GLU A 33 -1.859 -10.388 2.099 1.00 10.00 C ATOM 199 C GLU A 33 -0.517 -9.750 2.440 1.00 10.00 C ATOM 200 O GLU A 33 0.149 -10.140 3.400 1.00 10.00 O ATOM 201 CB GLU A 33 -2.753 -10.445 3.336 1.00 10.00 C ATOM 202 CG GLU A 33 -4.039 -11.218 3.109 1.00 10.00 C ATOM 203 CD GLU A 33 -4.685 -11.663 4.402 1.00 10.00 C ATOM 204 OE1 GLU A 33 -4.595 -12.869 4.734 1.00 10.00 O ATOM 205 OE2 GLU A 33 -5.302 -10.815 5.081 1.00 10.00 O ATOM 0 H GLU A 33 -1.484 -12.443 2.257 1.00 10.00 H new ATOM 0 HA GLU A 33 -2.352 -9.775 1.344 1.00 10.00 H new ATOM 0 HB2 GLU A 33 -2.200 -10.905 4.155 1.00 10.00 H new ATOM 0 HB3 GLU A 33 -2.997 -9.429 3.647 1.00 10.00 H new ATOM 0 HG2 GLU A 33 -4.740 -10.595 2.552 1.00 10.00 H new ATOM 0 HG3 GLU A 33 -3.829 -12.092 2.492 1.00 10.00 H new ATOM 212 N ILE A 34 -0.116 -8.788 1.630 1.00 10.00 N ATOM 213 CA ILE A 34 1.147 -8.094 1.832 1.00 10.00 C ATOM 214 C ILE A 34 0.919 -6.782 2.569 1.00 10.00 C ATOM 215 O ILE A 34 0.206 -5.905 2.084 1.00 10.00 O ATOM 216 CB ILE A 34 1.857 -7.791 0.491 1.00 10.00 C ATOM 217 CG1 ILE A 34 1.592 -8.894 -0.547 1.00 10.00 C ATOM 218 CG2 ILE A 34 3.352 -7.614 0.712 1.00 10.00 C ATOM 219 CD1 ILE A 34 2.166 -10.247 -0.183 1.00 10.00 C ATOM 0 H ILE A 34 -0.648 -8.467 0.821 1.00 10.00 H new ATOM 0 HA ILE A 34 1.782 -8.754 2.424 1.00 10.00 H new ATOM 0 HB ILE A 34 1.447 -6.861 0.098 1.00 10.00 H new ATOM 0 HG12 ILE A 34 0.515 -8.995 -0.685 1.00 10.00 H new ATOM 0 HG13 ILE A 34 2.008 -8.582 -1.505 1.00 10.00 H new ATOM 0 HG21 ILE A 34 3.838 -7.401 -0.240 1.00 10.00 H new ATOM 0 HG22 ILE A 34 3.523 -6.785 1.399 1.00 10.00 H new ATOM 0 HG23 ILE A 34 3.768 -8.528 1.135 1.00 10.00 H new ATOM 0 HD11 ILE A 34 1.933 -10.965 -0.969 1.00 10.00 H new ATOM 0 HD12 ILE A 34 3.248 -10.166 -0.075 1.00 10.00 H new ATOM 0 HD13 ILE A 34 1.732 -10.585 0.758 1.00 10.00 H new ATOM 231 N HIS A 35 1.516 -6.654 3.742 1.00 10.00 N ATOM 232 CA HIS A 35 1.386 -5.448 4.540 1.00 10.00 C ATOM 233 C HIS A 35 2.573 -4.532 4.297 1.00 10.00 C ATOM 234 O HIS A 35 3.640 -4.701 4.896 1.00 10.00 O ATOM 235 CB HIS A 35 1.289 -5.776 6.036 1.00 10.00 C ATOM 236 CG HIS A 35 0.039 -6.507 6.427 1.00 10.00 C ATOM 237 ND1 HIS A 35 0.080 -7.781 6.937 1.00 10.00 N ATOM 238 CD2 HIS A 35 -1.250 -6.095 6.371 1.00 10.00 C ATOM 239 CE1 HIS A 35 -1.175 -8.117 7.176 1.00 10.00 C ATOM 240 NE2 HIS A 35 -2.018 -7.127 6.852 1.00 10.00 N ATOM 0 H HIS A 35 2.099 -7.376 4.164 1.00 10.00 H new ATOM 0 HA HIS A 35 0.467 -4.946 4.238 1.00 10.00 H new ATOM 0 HB2 HIS A 35 2.152 -6.378 6.321 1.00 10.00 H new ATOM 0 HB3 HIS A 35 1.346 -4.848 6.604 1.00 10.00 H new ATOM 0 HD2 HIS A 35 -1.606 -5.139 6.016 1.00 10.00 H new ATOM 0 HE1 HIS A 35 -1.483 -9.070 7.581 1.00 10.00 H new ATOM 0 HE2 HIS A 35 -3.034 -7.138 6.945 1.00 10.00 H new ATOM 248 N PHE A 36 2.400 -3.574 3.405 1.00 10.00 N ATOM 249 CA PHE A 36 3.463 -2.637 3.093 1.00 10.00 C ATOM 250 C PHE A 36 3.296 -1.367 3.920 1.00 10.00 C ATOM 251 O PHE A 36 2.302 -0.652 3.781 1.00 10.00 O ATOM 252 CB PHE A 36 3.480 -2.300 1.600 1.00 10.00 C ATOM 253 CG PHE A 36 4.865 -2.245 1.014 1.00 10.00 C ATOM 254 CD1 PHE A 36 5.906 -1.657 1.715 1.00 10.00 C ATOM 255 CD2 PHE A 36 5.126 -2.782 -0.237 1.00 10.00 C ATOM 256 CE1 PHE A 36 7.179 -1.609 1.184 1.00 10.00 C ATOM 257 CE2 PHE A 36 6.401 -2.734 -0.774 1.00 10.00 C ATOM 258 CZ PHE A 36 7.428 -2.145 -0.063 1.00 10.00 C ATOM 0 H PHE A 36 1.535 -3.425 2.885 1.00 10.00 H new ATOM 0 HA PHE A 36 4.416 -3.104 3.343 1.00 10.00 H new ATOM 0 HB2 PHE A 36 2.895 -3.045 1.061 1.00 10.00 H new ATOM 0 HB3 PHE A 36 2.991 -1.338 1.447 1.00 10.00 H new ATOM 0 HD1 PHE A 36 5.719 -1.231 2.689 1.00 10.00 H new ATOM 0 HD2 PHE A 36 4.327 -3.243 -0.798 1.00 10.00 H new ATOM 0 HE1 PHE A 36 7.981 -1.152 1.745 1.00 10.00 H new ATOM 0 HE2 PHE A 36 6.593 -3.157 -1.749 1.00 10.00 H new ATOM 0 HZ PHE A 36 8.423 -2.104 -0.482 1.00 10.00 H new ATOM 268 N LYS A 37 4.261 -1.105 4.784 1.00 10.00 N ATOM 269 CA LYS A 37 4.225 0.072 5.638 1.00 10.00 C ATOM 270 C LYS A 37 4.849 1.259 4.911 1.00 10.00 C ATOM 271 O LYS A 37 6.072 1.350 4.795 1.00 10.00 O ATOM 272 CB LYS A 37 4.969 -0.209 6.944 1.00 10.00 C ATOM 273 CG LYS A 37 4.513 0.664 8.102 1.00 10.00 C ATOM 274 CD LYS A 37 5.404 0.499 9.326 1.00 10.00 C ATOM 275 CE LYS A 37 5.357 -0.918 9.877 1.00 10.00 C ATOM 276 NZ LYS A 37 5.938 -1.003 11.242 1.00 10.00 N ATOM 0 H LYS A 37 5.084 -1.694 4.914 1.00 10.00 H new ATOM 0 HA LYS A 37 3.189 0.314 5.874 1.00 10.00 H new ATOM 0 HB2 LYS A 37 4.832 -1.256 7.213 1.00 10.00 H new ATOM 0 HB3 LYS A 37 6.037 -0.058 6.784 1.00 10.00 H new ATOM 0 HG2 LYS A 37 4.514 1.709 7.791 1.00 10.00 H new ATOM 0 HG3 LYS A 37 3.486 0.411 8.364 1.00 10.00 H new ATOM 0 HD2 LYS A 37 6.431 0.752 9.064 1.00 10.00 H new ATOM 0 HD3 LYS A 37 5.091 1.200 10.100 1.00 10.00 H new ATOM 0 HE2 LYS A 37 4.324 -1.264 9.900 1.00 10.00 H new ATOM 0 HE3 LYS A 37 5.901 -1.585 9.209 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 5.887 -1.985 11.581 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 6.932 -0.697 11.216 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 5.403 -0.386 11.886 1.00 10.00 H new ATOM 290 N VAL A 38 4.007 2.160 4.417 1.00 10.00 N ATOM 291 CA VAL A 38 4.481 3.324 3.680 1.00 10.00 C ATOM 292 C VAL A 38 4.307 4.610 4.482 1.00 10.00 C ATOM 293 O VAL A 38 3.650 4.625 5.523 1.00 10.00 O ATOM 294 CB VAL A 38 3.754 3.463 2.320 1.00 10.00 C ATOM 295 CG1 VAL A 38 3.629 2.109 1.640 1.00 10.00 C ATOM 296 CG2 VAL A 38 2.380 4.101 2.486 1.00 10.00 C ATOM 0 H VAL A 38 2.993 2.106 4.514 1.00 10.00 H new ATOM 0 HA VAL A 38 5.545 3.167 3.501 1.00 10.00 H new ATOM 0 HB VAL A 38 4.354 4.119 1.690 1.00 10.00 H new ATOM 0 HG11 VAL A 38 3.115 2.227 0.686 1.00 10.00 H new ATOM 0 HG12 VAL A 38 4.623 1.695 1.469 1.00 10.00 H new ATOM 0 HG13 VAL A 38 3.059 1.433 2.277 1.00 10.00 H new ATOM 0 HG21 VAL A 38 1.897 4.184 1.512 1.00 10.00 H new ATOM 0 HG22 VAL A 38 1.769 3.482 3.143 1.00 10.00 H new ATOM 0 HG23 VAL A 38 2.490 5.094 2.922 1.00 10.00 H new ATOM 306 N LYS A 39 4.896 5.692 3.986 1.00 10.00 N ATOM 307 CA LYS A 39 4.807 6.987 4.645 1.00 10.00 C ATOM 308 C LYS A 39 4.102 7.985 3.732 1.00 10.00 C ATOM 309 O LYS A 39 4.281 7.951 2.513 1.00 10.00 O ATOM 310 CB LYS A 39 6.208 7.501 5.012 1.00 10.00 C ATOM 311 CG LYS A 39 6.204 8.887 5.643 1.00 10.00 C ATOM 312 CD LYS A 39 7.612 9.430 5.819 1.00 10.00 C ATOM 313 CE LYS A 39 7.594 10.877 6.280 1.00 10.00 C ATOM 314 NZ LYS A 39 8.893 11.558 6.036 1.00 10.00 N ATOM 0 H LYS A 39 5.443 5.696 3.125 1.00 10.00 H new ATOM 0 HA LYS A 39 4.230 6.875 5.563 1.00 10.00 H new ATOM 0 HB2 LYS A 39 6.674 6.798 5.702 1.00 10.00 H new ATOM 0 HB3 LYS A 39 6.825 7.522 4.114 1.00 10.00 H new ATOM 0 HG2 LYS A 39 5.627 9.569 5.019 1.00 10.00 H new ATOM 0 HG3 LYS A 39 5.707 8.844 6.612 1.00 10.00 H new ATOM 0 HD2 LYS A 39 8.150 8.822 6.546 1.00 10.00 H new ATOM 0 HD3 LYS A 39 8.154 9.354 4.876 1.00 10.00 H new ATOM 0 HE2 LYS A 39 6.801 11.413 5.759 1.00 10.00 H new ATOM 0 HE3 LYS A 39 7.359 10.915 7.344 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 8.836 12.543 6.366 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 9.647 11.063 6.553 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 9.106 11.545 5.018 1.00 10.00 H new ATOM 328 N MET A 40 3.301 8.866 4.316 1.00 10.00 N ATOM 329 CA MET A 40 2.581 9.872 3.543 1.00 10.00 C ATOM 330 C MET A 40 3.522 11.020 3.162 1.00 10.00 C ATOM 331 O MET A 40 3.375 12.152 3.628 1.00 10.00 O ATOM 332 CB MET A 40 1.378 10.391 4.342 1.00 10.00 C ATOM 333 CG MET A 40 0.488 11.353 3.566 1.00 10.00 C ATOM 334 SD MET A 40 -0.116 10.659 2.014 1.00 10.00 S ATOM 335 CE MET A 40 -1.260 9.416 2.616 1.00 10.00 C ATOM 0 H MET A 40 3.133 8.905 5.321 1.00 10.00 H new ATOM 0 HA MET A 40 2.210 9.417 2.625 1.00 10.00 H new ATOM 0 HB2 MET A 40 0.779 9.542 4.670 1.00 10.00 H new ATOM 0 HB3 MET A 40 1.740 10.891 5.240 1.00 10.00 H new ATOM 0 HG2 MET A 40 -0.362 11.634 4.187 1.00 10.00 H new ATOM 0 HG3 MET A 40 1.045 12.266 3.357 1.00 10.00 H new ATOM 0 HE1 MET A 40 -2.127 9.370 1.957 1.00 10.00 H new ATOM 0 HE2 MET A 40 -0.766 8.445 2.634 1.00 10.00 H new ATOM 0 HE3 MET A 40 -1.584 9.677 3.623 1.00 10.00 H new ATOM 345 N THR A 41 4.514 10.696 2.335 1.00 10.00 N ATOM 346 CA THR A 41 5.507 11.657 1.858 1.00 10.00 C ATOM 347 C THR A 41 6.242 11.078 0.647 1.00 10.00 C ATOM 348 O THR A 41 6.410 11.743 -0.378 1.00 10.00 O ATOM 349 CB THR A 41 6.554 12.009 2.946 1.00 10.00 C ATOM 350 OG1 THR A 41 5.909 12.521 4.121 1.00 10.00 O ATOM 351 CG2 THR A 41 7.550 13.038 2.429 1.00 10.00 C ATOM 0 H THR A 41 4.653 9.752 1.974 1.00 10.00 H new ATOM 0 HA THR A 41 4.971 12.568 1.591 1.00 10.00 H new ATOM 0 HB THR A 41 7.089 11.093 3.199 1.00 10.00 H new ATOM 0 HG1 THR A 41 4.977 12.740 3.913 1.00 10.00 H new ATOM 0 HG21 THR A 41 8.274 13.268 3.211 1.00 10.00 H new ATOM 0 HG22 THR A 41 8.070 12.636 1.560 1.00 10.00 H new ATOM 0 HG23 THR A 41 7.020 13.947 2.146 1.00 10.00 H new ATOM 359 N THR A 42 6.661 9.828 0.780 1.00 10.00 N ATOM 360 CA THR A 42 7.388 9.132 -0.268 1.00 10.00 C ATOM 361 C THR A 42 6.502 8.855 -1.477 1.00 10.00 C ATOM 362 O THR A 42 5.294 8.644 -1.341 1.00 10.00 O ATOM 363 CB THR A 42 7.929 7.807 0.282 1.00 10.00 C ATOM 364 OG1 THR A 42 7.895 7.858 1.713 1.00 10.00 O ATOM 365 CG2 THR A 42 9.350 7.550 -0.194 1.00 10.00 C ATOM 0 H THR A 42 6.506 9.269 1.619 1.00 10.00 H new ATOM 0 HA THR A 42 8.210 9.771 -0.591 1.00 10.00 H new ATOM 0 HB THR A 42 7.306 6.991 -0.084 1.00 10.00 H new ATOM 0 HG1 THR A 42 8.237 7.015 2.079 1.00 10.00 H new ATOM 0 HG21 THR A 42 9.704 6.603 0.213 1.00 10.00 H new ATOM 0 HG22 THR A 42 9.366 7.506 -1.283 1.00 10.00 H new ATOM 0 HG23 THR A 42 9.999 8.357 0.146 1.00 10.00 H new ATOM 373 N HIS A 43 7.103 8.872 -2.657 1.00 10.00 N ATOM 374 CA HIS A 43 6.375 8.613 -3.885 1.00 10.00 C ATOM 375 C HIS A 43 6.089 7.124 -4.006 1.00 10.00 C ATOM 376 O HIS A 43 6.846 6.294 -3.499 1.00 10.00 O ATOM 377 CB HIS A 43 7.176 9.097 -5.098 1.00 10.00 C ATOM 378 CG HIS A 43 7.643 10.519 -4.982 1.00 10.00 C ATOM 379 ND1 HIS A 43 8.929 10.821 -4.609 1.00 10.00 N ATOM 380 CD2 HIS A 43 6.960 11.671 -5.185 1.00 10.00 C ATOM 381 CE1 HIS A 43 9.002 12.141 -4.587 1.00 10.00 C ATOM 382 NE2 HIS A 43 7.832 12.702 -4.930 1.00 10.00 N ATOM 0 H HIS A 43 8.096 9.063 -2.788 1.00 10.00 H new ATOM 0 HA HIS A 43 5.432 9.159 -3.857 1.00 10.00 H new ATOM 0 HB2 HIS A 43 8.042 8.449 -5.233 1.00 10.00 H new ATOM 0 HB3 HIS A 43 6.561 8.997 -5.992 1.00 10.00 H new ATOM 0 HD2 HIS A 43 5.928 11.762 -5.489 1.00 10.00 H new ATOM 0 HE1 HIS A 43 9.890 12.697 -4.326 1.00 10.00 H new ATOM 0 HE2 HIS A 43 7.629 13.700 -4.990 1.00 10.00 H new ATOM 390 N LEU A 44 5.009 6.785 -4.691 1.00 10.00 N ATOM 391 CA LEU A 44 4.623 5.391 -4.859 1.00 10.00 C ATOM 392 C LEU A 44 5.575 4.657 -5.796 1.00 10.00 C ATOM 393 O LEU A 44 5.524 3.434 -5.900 1.00 10.00 O ATOM 394 CB LEU A 44 3.188 5.288 -5.372 1.00 10.00 C ATOM 395 CG LEU A 44 2.107 5.438 -4.298 1.00 10.00 C ATOM 396 CD1 LEU A 44 0.751 5.692 -4.935 1.00 10.00 C ATOM 397 CD2 LEU A 44 2.056 4.198 -3.416 1.00 10.00 C ATOM 0 H LEU A 44 4.384 7.454 -5.140 1.00 10.00 H new ATOM 0 HA LEU A 44 4.681 4.913 -3.881 1.00 10.00 H new ATOM 0 HB2 LEU A 44 3.033 6.054 -6.132 1.00 10.00 H new ATOM 0 HB3 LEU A 44 3.061 4.323 -5.862 1.00 10.00 H new ATOM 0 HG LEU A 44 2.360 6.296 -3.675 1.00 10.00 H new ATOM 0 HD11 LEU A 44 -0.004 5.796 -4.155 1.00 10.00 H new ATOM 0 HD12 LEU A 44 0.792 6.608 -5.525 1.00 10.00 H new ATOM 0 HD13 LEU A 44 0.491 4.855 -5.583 1.00 10.00 H new ATOM 0 HD21 LEU A 44 1.282 4.322 -2.658 1.00 10.00 H new ATOM 0 HD22 LEU A 44 1.828 3.325 -4.028 1.00 10.00 H new ATOM 0 HD23 LEU A 44 3.021 4.058 -2.929 1.00 10.00 H new ATOM 409 N LYS A 45 6.440 5.403 -6.473 1.00 10.00 N ATOM 410 CA LYS A 45 7.406 4.803 -7.383 1.00 10.00 C ATOM 411 C LYS A 45 8.355 3.898 -6.611 1.00 10.00 C ATOM 412 O LYS A 45 8.590 2.753 -7.003 1.00 10.00 O ATOM 413 CB LYS A 45 8.199 5.875 -8.131 1.00 10.00 C ATOM 414 CG LYS A 45 9.328 5.306 -8.975 1.00 10.00 C ATOM 415 CD LYS A 45 9.932 6.347 -9.899 1.00 10.00 C ATOM 416 CE LYS A 45 11.127 5.783 -10.652 1.00 10.00 C ATOM 417 NZ LYS A 45 10.905 4.375 -11.073 1.00 10.00 N ATOM 0 H LYS A 45 6.492 6.420 -6.409 1.00 10.00 H new ATOM 0 HA LYS A 45 6.859 4.211 -8.117 1.00 10.00 H new ATOM 0 HB2 LYS A 45 7.521 6.437 -8.774 1.00 10.00 H new ATOM 0 HB3 LYS A 45 8.613 6.580 -7.410 1.00 10.00 H new ATOM 0 HG2 LYS A 45 10.104 4.909 -8.321 1.00 10.00 H new ATOM 0 HG3 LYS A 45 8.952 4.471 -9.567 1.00 10.00 H new ATOM 0 HD2 LYS A 45 9.179 6.688 -10.609 1.00 10.00 H new ATOM 0 HD3 LYS A 45 10.241 7.217 -9.319 1.00 10.00 H new ATOM 0 HE2 LYS A 45 11.325 6.397 -11.530 1.00 10.00 H new ATOM 0 HE3 LYS A 45 12.013 5.837 -10.019 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 11.569 4.132 -11.836 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 11.061 3.742 -10.263 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 9.929 4.265 -11.416 1.00 10.00 H new ATOM 431 N LYS A 46 8.882 4.419 -5.503 1.00 10.00 N ATOM 432 CA LYS A 46 9.801 3.670 -4.650 1.00 10.00 C ATOM 433 C LYS A 46 9.149 2.365 -4.202 1.00 10.00 C ATOM 434 O LYS A 46 9.780 1.311 -4.187 1.00 10.00 O ATOM 435 CB LYS A 46 10.201 4.520 -3.431 1.00 10.00 C ATOM 436 CG LYS A 46 10.907 3.738 -2.327 1.00 10.00 C ATOM 437 CD LYS A 46 12.385 3.524 -2.626 1.00 10.00 C ATOM 438 CE LYS A 46 13.212 4.757 -2.289 1.00 10.00 C ATOM 439 NZ LYS A 46 13.259 5.025 -0.826 1.00 10.00 N ATOM 0 H LYS A 46 8.685 5.364 -5.174 1.00 10.00 H new ATOM 0 HA LYS A 46 10.701 3.433 -5.217 1.00 10.00 H new ATOM 0 HB2 LYS A 46 10.854 5.327 -3.764 1.00 10.00 H new ATOM 0 HB3 LYS A 46 9.306 4.984 -3.017 1.00 10.00 H new ATOM 0 HG2 LYS A 46 10.803 4.272 -1.383 1.00 10.00 H new ATOM 0 HG3 LYS A 46 10.420 2.771 -2.201 1.00 10.00 H new ATOM 0 HD2 LYS A 46 12.752 2.672 -2.054 1.00 10.00 H new ATOM 0 HD3 LYS A 46 12.511 3.278 -3.680 1.00 10.00 H new ATOM 0 HE2 LYS A 46 14.227 4.624 -2.664 1.00 10.00 H new ATOM 0 HE3 LYS A 46 12.793 5.623 -2.801 1.00 10.00 H new ATOM 0 HZ1 LYS A 46 14.053 5.662 -0.615 1.00 10.00 H new ATOM 0 HZ2 LYS A 46 12.369 5.471 -0.526 1.00 10.00 H new ATOM 0 HZ3 LYS A 46 13.388 4.130 -0.313 1.00 10.00 H new ATOM 453 N LEU A 47 7.870 2.448 -3.875 1.00 10.00 N ATOM 454 CA LEU A 47 7.113 1.287 -3.431 1.00 10.00 C ATOM 455 C LEU A 47 7.014 0.249 -4.542 1.00 10.00 C ATOM 456 O LEU A 47 7.145 -0.948 -4.297 1.00 10.00 O ATOM 457 CB LEU A 47 5.705 1.704 -2.983 1.00 10.00 C ATOM 458 CG LEU A 47 5.596 2.287 -1.566 1.00 10.00 C ATOM 459 CD1 LEU A 47 6.263 1.372 -0.554 1.00 10.00 C ATOM 460 CD2 LEU A 47 6.196 3.683 -1.497 1.00 10.00 C ATOM 0 H LEU A 47 7.330 3.313 -3.909 1.00 10.00 H new ATOM 0 HA LEU A 47 7.639 0.845 -2.585 1.00 10.00 H new ATOM 0 HB2 LEU A 47 5.324 2.442 -3.689 1.00 10.00 H new ATOM 0 HB3 LEU A 47 5.052 0.834 -3.048 1.00 10.00 H new ATOM 0 HG LEU A 47 4.537 2.362 -1.319 1.00 10.00 H new ATOM 0 HD11 LEU A 47 6.174 1.805 0.442 1.00 10.00 H new ATOM 0 HD12 LEU A 47 5.778 0.396 -0.571 1.00 10.00 H new ATOM 0 HD13 LEU A 47 7.317 1.257 -0.806 1.00 10.00 H new ATOM 0 HD21 LEU A 47 6.104 4.069 -0.482 1.00 10.00 H new ATOM 0 HD22 LEU A 47 7.249 3.641 -1.775 1.00 10.00 H new ATOM 0 HD23 LEU A 47 5.666 4.341 -2.185 1.00 10.00 H new ATOM 472 N LYS A 48 6.801 0.721 -5.762 1.00 10.00 N ATOM 473 CA LYS A 48 6.670 -0.160 -6.914 1.00 10.00 C ATOM 474 C LYS A 48 7.979 -0.882 -7.232 1.00 10.00 C ATOM 475 O LYS A 48 7.985 -2.099 -7.439 1.00 10.00 O ATOM 476 CB LYS A 48 6.210 0.633 -8.137 1.00 10.00 C ATOM 477 CG LYS A 48 4.783 1.149 -8.033 1.00 10.00 C ATOM 478 CD LYS A 48 4.416 2.032 -9.217 1.00 10.00 C ATOM 479 CE LYS A 48 4.227 1.217 -10.488 1.00 10.00 C ATOM 480 NZ LYS A 48 4.169 2.081 -11.696 1.00 10.00 N ATOM 0 H LYS A 48 6.715 1.714 -5.980 1.00 10.00 H new ATOM 0 HA LYS A 48 5.923 -0.913 -6.663 1.00 10.00 H new ATOM 0 HB2 LYS A 48 6.882 1.478 -8.284 1.00 10.00 H new ATOM 0 HB3 LYS A 48 6.294 0.001 -9.021 1.00 10.00 H new ATOM 0 HG2 LYS A 48 4.094 0.306 -7.980 1.00 10.00 H new ATOM 0 HG3 LYS A 48 4.667 1.714 -7.108 1.00 10.00 H new ATOM 0 HD2 LYS A 48 3.499 2.577 -8.994 1.00 10.00 H new ATOM 0 HD3 LYS A 48 5.198 2.775 -9.374 1.00 10.00 H new ATOM 0 HE2 LYS A 48 5.047 0.506 -10.589 1.00 10.00 H new ATOM 0 HE3 LYS A 48 3.308 0.635 -10.413 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 4.346 1.505 -12.544 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 3.228 2.519 -11.765 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 4.892 2.825 -11.626 1.00 10.00 H new ATOM 494 N GLU A 49 9.084 -0.143 -7.265 1.00 10.00 N ATOM 495 CA GLU A 49 10.379 -0.738 -7.585 1.00 10.00 C ATOM 496 C GLU A 49 10.879 -1.657 -6.471 1.00 10.00 C ATOM 497 O GLU A 49 11.487 -2.691 -6.747 1.00 10.00 O ATOM 498 CB GLU A 49 11.427 0.335 -7.922 1.00 10.00 C ATOM 499 CG GLU A 49 11.438 1.538 -6.993 1.00 10.00 C ATOM 500 CD GLU A 49 11.871 2.813 -7.697 1.00 10.00 C ATOM 501 OE1 GLU A 49 12.377 3.732 -7.015 1.00 10.00 O ATOM 502 OE2 GLU A 49 11.706 2.899 -8.937 1.00 10.00 O ATOM 0 H GLU A 49 9.110 0.859 -7.076 1.00 10.00 H new ATOM 0 HA GLU A 49 10.230 -1.352 -8.473 1.00 10.00 H new ATOM 0 HB2 GLU A 49 12.415 -0.126 -7.906 1.00 10.00 H new ATOM 0 HB3 GLU A 49 11.254 0.683 -8.940 1.00 10.00 H new ATOM 0 HG2 GLU A 49 10.442 1.679 -6.574 1.00 10.00 H new ATOM 0 HG3 GLU A 49 12.110 1.342 -6.158 1.00 10.00 H new ATOM 509 N SER A 50 10.615 -1.299 -5.220 1.00 10.00 N ATOM 510 CA SER A 50 11.048 -2.118 -4.096 1.00 10.00 C ATOM 511 C SER A 50 10.169 -3.365 -3.941 1.00 10.00 C ATOM 512 O SER A 50 10.636 -4.409 -3.484 1.00 10.00 O ATOM 513 CB SER A 50 11.048 -1.294 -2.810 1.00 10.00 C ATOM 514 OG SER A 50 11.913 -0.176 -2.927 1.00 10.00 O ATOM 0 H SER A 50 10.107 -0.454 -4.960 1.00 10.00 H new ATOM 0 HA SER A 50 12.065 -2.455 -4.296 1.00 10.00 H new ATOM 0 HB2 SER A 50 10.036 -0.955 -2.590 1.00 10.00 H new ATOM 0 HB3 SER A 50 11.364 -1.917 -1.973 1.00 10.00 H new ATOM 0 HG SER A 50 11.436 0.563 -3.359 1.00 10.00 H new ATOM 520 N TYR A 51 8.899 -3.263 -4.332 1.00 10.00 N ATOM 521 CA TYR A 51 7.981 -4.396 -4.237 1.00 10.00 C ATOM 522 C TYR A 51 8.423 -5.521 -5.166 1.00 10.00 C ATOM 523 O TYR A 51 8.312 -6.701 -4.830 1.00 10.00 O ATOM 524 CB TYR A 51 6.553 -3.966 -4.589 1.00 10.00 C ATOM 525 CG TYR A 51 5.509 -5.034 -4.335 1.00 10.00 C ATOM 526 CD1 TYR A 51 4.869 -5.128 -3.107 1.00 10.00 C ATOM 527 CD2 TYR A 51 5.165 -5.949 -5.324 1.00 10.00 C ATOM 528 CE1 TYR A 51 3.919 -6.103 -2.868 1.00 10.00 C ATOM 529 CE2 TYR A 51 4.214 -6.923 -5.094 1.00 10.00 C ATOM 530 CZ TYR A 51 3.596 -6.995 -3.865 1.00 10.00 C ATOM 531 OH TYR A 51 2.655 -7.971 -3.631 1.00 10.00 O ATOM 0 H TYR A 51 8.485 -2.413 -4.715 1.00 10.00 H new ATOM 0 HA TYR A 51 7.997 -4.758 -3.209 1.00 10.00 H new ATOM 0 HB2 TYR A 51 6.298 -3.078 -4.010 1.00 10.00 H new ATOM 0 HB3 TYR A 51 6.519 -3.681 -5.641 1.00 10.00 H new ATOM 0 HD1 TYR A 51 5.118 -4.427 -2.324 1.00 10.00 H new ATOM 0 HD2 TYR A 51 5.650 -5.897 -6.288 1.00 10.00 H new ATOM 0 HE1 TYR A 51 3.433 -6.164 -1.905 1.00 10.00 H new ATOM 0 HE2 TYR A 51 3.956 -7.625 -5.873 1.00 10.00 H new ATOM 0 HH TYR A 51 3.084 -8.852 -3.654 1.00 10.00 H new ATOM 541 N CYS A 52 8.948 -5.144 -6.329 1.00 10.00 N ATOM 542 CA CYS A 52 9.414 -6.112 -7.313 1.00 10.00 C ATOM 543 C CYS A 52 10.524 -6.986 -6.727 1.00 10.00 C ATOM 544 O CYS A 52 10.642 -8.165 -7.061 1.00 10.00 O ATOM 545 CB CYS A 52 9.915 -5.387 -8.566 1.00 10.00 C ATOM 546 SG CYS A 52 8.685 -4.305 -9.337 1.00 10.00 S ATOM 0 H CYS A 52 9.061 -4.171 -6.612 1.00 10.00 H new ATOM 0 HA CYS A 52 8.579 -6.757 -7.587 1.00 10.00 H new ATOM 0 HB2 CYS A 52 10.791 -4.794 -8.303 1.00 10.00 H new ATOM 0 HB3 CYS A 52 10.239 -6.128 -9.296 1.00 10.00 H new ATOM 0 HG CYS A 52 8.360 -3.358 -8.508 1.00 10.00 H new ATOM 552 N GLN A 53 11.309 -6.409 -5.824 1.00 10.00 N ATOM 553 CA GLN A 53 12.406 -7.127 -5.187 1.00 10.00 C ATOM 554 C GLN A 53 11.877 -8.194 -4.233 1.00 10.00 C ATOM 555 O GLN A 53 12.493 -9.245 -4.059 1.00 10.00 O ATOM 556 CB GLN A 53 13.306 -6.149 -4.430 1.00 10.00 C ATOM 557 CG GLN A 53 13.876 -5.050 -5.309 1.00 10.00 C ATOM 558 CD GLN A 53 14.597 -3.978 -4.516 1.00 10.00 C ATOM 559 OE1 GLN A 53 14.259 -3.704 -3.365 1.00 10.00 O ATOM 560 NE2 GLN A 53 15.602 -3.371 -5.121 1.00 10.00 N ATOM 0 H GLN A 53 11.205 -5.442 -5.516 1.00 10.00 H new ATOM 0 HA GLN A 53 12.988 -7.620 -5.965 1.00 10.00 H new ATOM 0 HB2 GLN A 53 12.736 -5.696 -3.619 1.00 10.00 H new ATOM 0 HB3 GLN A 53 14.127 -6.701 -3.973 1.00 10.00 H new ATOM 0 HG2 GLN A 53 14.566 -5.489 -6.029 1.00 10.00 H new ATOM 0 HG3 GLN A 53 13.068 -4.592 -5.880 1.00 10.00 H new ATOM 0 HE21 GLN A 53 15.852 -3.627 -6.076 1.00 10.00 H new ATOM 0 HE22 GLN A 53 16.129 -2.647 -4.633 1.00 10.00 H new ATOM 569 N ARG A 54 10.720 -7.930 -3.637 1.00 10.00 N ATOM 570 CA ARG A 54 10.114 -8.867 -2.700 1.00 10.00 C ATOM 571 C ARG A 54 9.659 -10.131 -3.421 1.00 10.00 C ATOM 572 O ARG A 54 9.781 -11.234 -2.893 1.00 10.00 O ATOM 573 CB ARG A 54 8.926 -8.219 -1.977 1.00 10.00 C ATOM 574 CG ARG A 54 8.433 -9.021 -0.779 1.00 10.00 C ATOM 575 CD ARG A 54 9.514 -9.139 0.282 1.00 10.00 C ATOM 576 NE ARG A 54 9.006 -9.617 1.568 1.00 10.00 N ATOM 577 CZ ARG A 54 9.783 -9.836 2.627 1.00 10.00 C ATOM 578 NH1 ARG A 54 11.091 -9.614 2.546 1.00 10.00 N ATOM 579 NH2 ARG A 54 9.258 -10.264 3.766 1.00 10.00 N ATOM 0 H ARG A 54 10.184 -7.075 -3.786 1.00 10.00 H new ATOM 0 HA ARG A 54 10.867 -9.138 -1.960 1.00 10.00 H new ATOM 0 HB2 ARG A 54 9.214 -7.222 -1.643 1.00 10.00 H new ATOM 0 HB3 ARG A 54 8.105 -8.094 -2.683 1.00 10.00 H new ATOM 0 HG2 ARG A 54 7.552 -8.540 -0.353 1.00 10.00 H new ATOM 0 HG3 ARG A 54 8.128 -10.016 -1.104 1.00 10.00 H new ATOM 0 HD2 ARG A 54 10.289 -9.819 -0.071 1.00 10.00 H new ATOM 0 HD3 ARG A 54 9.984 -8.166 0.423 1.00 10.00 H new ATOM 0 HE ARG A 54 8.005 -9.791 1.658 1.00 10.00 H new ATOM 0 HH11 ARG A 54 11.498 -9.276 1.674 1.00 10.00 H new ATOM 0 HH12 ARG A 54 11.688 -9.781 3.356 1.00 10.00 H new ATOM 0 HH21 ARG A 54 8.254 -10.428 3.835 1.00 10.00 H new ATOM 0 HH22 ARG A 54 9.858 -10.430 4.574 1.00 10.00 H new ATOM 593 N GLN A 55 9.154 -9.966 -4.638 1.00 10.00 N ATOM 594 CA GLN A 55 8.679 -11.097 -5.425 1.00 10.00 C ATOM 595 C GLN A 55 9.802 -11.694 -6.271 1.00 10.00 C ATOM 596 O GLN A 55 9.675 -12.803 -6.794 1.00 10.00 O ATOM 597 CB GLN A 55 7.511 -10.673 -6.315 1.00 10.00 C ATOM 598 CG GLN A 55 6.146 -11.090 -5.776 1.00 10.00 C ATOM 599 CD GLN A 55 5.927 -10.683 -4.329 1.00 10.00 C ATOM 600 OE1 GLN A 55 6.236 -11.579 -3.407 1.00 10.00 O flip ATOM 601 NE2 GLN A 55 5.473 -9.580 -4.044 1.00 10.00 N flip ATOM 0 H GLN A 55 9.063 -9.061 -5.100 1.00 10.00 H new ATOM 0 HA GLN A 55 8.335 -11.866 -4.733 1.00 10.00 H new ATOM 0 HB2 GLN A 55 7.530 -9.589 -6.432 1.00 10.00 H new ATOM 0 HB3 GLN A 55 7.647 -11.103 -7.307 1.00 10.00 H new ATOM 0 HG2 GLN A 55 5.366 -10.645 -6.394 1.00 10.00 H new ATOM 0 HG3 GLN A 55 6.043 -12.172 -5.863 1.00 10.00 H new ATOM 0 HE21 GLN A 55 5.247 -8.915 -4.784 1.00 10.00 H new ATOM 0 HE22 GLN A 55 5.322 -9.328 -3.067 1.00 10.00 H new ATOM 610 N GLY A 56 10.898 -10.956 -6.397 1.00 10.00 N ATOM 611 CA GLY A 56 12.030 -11.429 -7.173 1.00 10.00 C ATOM 612 C GLY A 56 11.821 -11.255 -8.664 1.00 10.00 C ATOM 613 O GLY A 56 12.249 -12.087 -9.464 1.00 10.00 O ATOM 0 H GLY A 56 11.024 -10.036 -5.975 1.00 10.00 H new ATOM 0 HA2 GLY A 56 12.927 -10.889 -6.869 1.00 10.00 H new ATOM 0 HA3 GLY A 56 12.203 -12.483 -6.954 1.00 10.00 H new ATOM 617 N VAL A 57 11.167 -10.168 -9.034 1.00 10.00 N ATOM 618 CA VAL A 57 10.886 -9.877 -10.433 1.00 10.00 C ATOM 619 C VAL A 57 11.443 -8.512 -10.818 1.00 10.00 C ATOM 620 O VAL A 57 11.723 -7.689 -9.947 1.00 10.00 O ATOM 621 CB VAL A 57 9.366 -9.909 -10.714 1.00 10.00 C ATOM 622 CG1 VAL A 57 8.869 -11.340 -10.827 1.00 10.00 C ATOM 623 CG2 VAL A 57 8.601 -9.161 -9.630 1.00 10.00 C ATOM 0 H VAL A 57 10.817 -9.466 -8.381 1.00 10.00 H new ATOM 0 HA VAL A 57 11.370 -10.647 -11.033 1.00 10.00 H new ATOM 0 HB VAL A 57 9.187 -9.409 -11.666 1.00 10.00 H new ATOM 0 HG11 VAL A 57 7.797 -11.338 -11.025 1.00 10.00 H new ATOM 0 HG12 VAL A 57 9.388 -11.842 -11.644 1.00 10.00 H new ATOM 0 HG13 VAL A 57 9.065 -11.868 -9.894 1.00 10.00 H new ATOM 0 HG21 VAL A 57 7.534 -9.196 -9.848 1.00 10.00 H new ATOM 0 HG22 VAL A 57 8.790 -9.628 -8.663 1.00 10.00 H new ATOM 0 HG23 VAL A 57 8.932 -8.123 -9.602 1.00 10.00 H new ATOM 633 N PRO A 58 11.646 -8.260 -12.124 1.00 10.00 N ATOM 634 CA PRO A 58 12.156 -6.972 -12.601 1.00 10.00 C ATOM 635 C PRO A 58 11.139 -5.849 -12.395 1.00 10.00 C ATOM 636 O PRO A 58 9.969 -6.103 -12.104 1.00 10.00 O ATOM 637 CB PRO A 58 12.403 -7.209 -14.097 1.00 10.00 C ATOM 638 CG PRO A 58 11.521 -8.351 -14.459 1.00 10.00 C ATOM 639 CD PRO A 58 11.423 -9.211 -13.231 1.00 10.00 C ATOM 0 HA PRO A 58 13.050 -6.658 -12.061 1.00 10.00 H new ATOM 0 HB2 PRO A 58 12.160 -6.322 -14.682 1.00 10.00 H new ATOM 0 HB3 PRO A 58 13.450 -7.442 -14.292 1.00 10.00 H new ATOM 0 HG2 PRO A 58 10.536 -8.000 -14.768 1.00 10.00 H new ATOM 0 HG3 PRO A 58 11.936 -8.913 -15.296 1.00 10.00 H new ATOM 0 HD2 PRO A 58 10.448 -9.693 -13.156 1.00 10.00 H new ATOM 0 HD3 PRO A 58 12.171 -10.004 -13.236 1.00 10.00 H new ATOM 647 N MET A 59 11.585 -4.613 -12.545 1.00 10.00 N ATOM 648 CA MET A 59 10.714 -3.461 -12.361 1.00 10.00 C ATOM 649 C MET A 59 9.645 -3.396 -13.452 1.00 10.00 C ATOM 650 O MET A 59 9.914 -3.699 -14.616 1.00 10.00 O ATOM 651 CB MET A 59 11.541 -2.171 -12.359 1.00 10.00 C ATOM 652 CG MET A 59 10.966 -1.067 -11.476 1.00 10.00 C ATOM 653 SD MET A 59 9.544 -0.236 -12.215 1.00 10.00 S ATOM 654 CE MET A 59 9.155 0.964 -10.942 1.00 10.00 C ATOM 0 H MET A 59 12.546 -4.380 -12.794 1.00 10.00 H new ATOM 0 HA MET A 59 10.211 -3.568 -11.400 1.00 10.00 H new ATOM 0 HB2 MET A 59 12.553 -2.400 -12.024 1.00 10.00 H new ATOM 0 HB3 MET A 59 11.620 -1.801 -13.381 1.00 10.00 H new ATOM 0 HG2 MET A 59 10.672 -1.493 -10.517 1.00 10.00 H new ATOM 0 HG3 MET A 59 11.744 -0.331 -11.272 1.00 10.00 H new ATOM 0 HE1 MET A 59 8.139 1.330 -11.086 1.00 10.00 H new ATOM 0 HE2 MET A 59 9.236 0.494 -9.962 1.00 10.00 H new ATOM 0 HE3 MET A 59 9.854 1.799 -11.003 1.00 10.00 H new ATOM 664 N ASN A 60 8.433 -3.027 -13.039 1.00 10.00 N ATOM 665 CA ASN A 60 7.276 -2.877 -13.933 1.00 10.00 C ATOM 666 C ASN A 60 6.770 -4.217 -14.471 1.00 10.00 C ATOM 667 O ASN A 60 6.105 -4.267 -15.505 1.00 10.00 O ATOM 668 CB ASN A 60 7.594 -1.929 -15.096 1.00 10.00 C ATOM 669 CG ASN A 60 6.394 -1.091 -15.507 1.00 10.00 C ATOM 670 OD1 ASN A 60 6.184 0.008 -14.992 1.00 10.00 O ATOM 671 ND2 ASN A 60 5.596 -1.603 -16.429 1.00 10.00 N ATOM 0 H ASN A 60 8.220 -2.820 -12.063 1.00 10.00 H new ATOM 0 HA ASN A 60 6.478 -2.444 -13.330 1.00 10.00 H new ATOM 0 HB2 ASN A 60 8.413 -1.269 -14.810 1.00 10.00 H new ATOM 0 HB3 ASN A 60 7.937 -2.511 -15.951 1.00 10.00 H new ATOM 0 HD21 ASN A 60 4.773 -1.084 -16.737 1.00 10.00 H new ATOM 0 HD22 ASN A 60 5.803 -2.517 -16.832 1.00 10.00 H new ATOM 678 N SER A 61 7.078 -5.299 -13.774 1.00 10.00 N ATOM 679 CA SER A 61 6.612 -6.615 -14.190 1.00 10.00 C ATOM 680 C SER A 61 5.237 -6.878 -13.587 1.00 10.00 C ATOM 681 O SER A 61 4.455 -7.684 -14.096 1.00 10.00 O ATOM 682 CB SER A 61 7.598 -7.692 -13.747 1.00 10.00 C ATOM 683 OG SER A 61 7.859 -7.593 -12.359 1.00 10.00 O ATOM 0 H SER A 61 7.643 -5.295 -12.925 1.00 10.00 H new ATOM 0 HA SER A 61 6.540 -6.643 -15.277 1.00 10.00 H new ATOM 0 HB2 SER A 61 7.194 -8.678 -13.976 1.00 10.00 H new ATOM 0 HB3 SER A 61 8.529 -7.591 -14.305 1.00 10.00 H new ATOM 0 HG SER A 61 8.792 -7.326 -12.220 1.00 10.00 H new ATOM 689 N LEU A 62 4.952 -6.180 -12.496 1.00 10.00 N ATOM 690 CA LEU A 62 3.684 -6.307 -11.806 1.00 10.00 C ATOM 691 C LEU A 62 2.947 -4.974 -11.832 1.00 10.00 C ATOM 692 O LEU A 62 3.545 -3.924 -11.589 1.00 10.00 O ATOM 693 CB LEU A 62 3.900 -6.749 -10.356 1.00 10.00 C ATOM 694 CG LEU A 62 4.769 -7.994 -10.162 1.00 10.00 C ATOM 695 CD1 LEU A 62 5.075 -8.204 -8.686 1.00 10.00 C ATOM 696 CD2 LEU A 62 4.084 -9.223 -10.742 1.00 10.00 C ATOM 0 H LEU A 62 5.594 -5.513 -12.069 1.00 10.00 H new ATOM 0 HA LEU A 62 3.087 -7.063 -12.315 1.00 10.00 H new ATOM 0 HB2 LEU A 62 4.354 -5.923 -9.808 1.00 10.00 H new ATOM 0 HB3 LEU A 62 2.926 -6.935 -9.904 1.00 10.00 H new ATOM 0 HG LEU A 62 5.708 -7.842 -10.693 1.00 10.00 H new ATOM 0 HD11 LEU A 62 5.694 -9.093 -8.566 1.00 10.00 H new ATOM 0 HD12 LEU A 62 5.608 -7.336 -8.298 1.00 10.00 H new ATOM 0 HD13 LEU A 62 4.143 -8.333 -8.136 1.00 10.00 H new ATOM 0 HD21 LEU A 62 4.718 -10.097 -10.594 1.00 10.00 H new ATOM 0 HD22 LEU A 62 3.129 -9.378 -10.240 1.00 10.00 H new ATOM 0 HD23 LEU A 62 3.913 -9.075 -11.808 1.00 10.00 H new ATOM 708 N ARG A 63 1.660 -5.012 -12.132 1.00 10.00 N ATOM 709 CA ARG A 63 0.858 -3.800 -12.186 1.00 10.00 C ATOM 710 C ARG A 63 -0.022 -3.690 -10.947 1.00 10.00 C ATOM 711 O ARG A 63 -0.741 -4.626 -10.591 1.00 10.00 O ATOM 712 CB ARG A 63 0.007 -3.757 -13.462 1.00 10.00 C ATOM 713 CG ARG A 63 -0.945 -4.934 -13.626 1.00 10.00 C ATOM 714 CD ARG A 63 -1.815 -4.770 -14.863 1.00 10.00 C ATOM 715 NE ARG A 63 -2.764 -5.873 -15.022 1.00 10.00 N ATOM 716 CZ ARG A 63 -2.592 -6.893 -15.860 1.00 10.00 C ATOM 717 NH1 ARG A 63 -1.530 -6.950 -16.647 1.00 10.00 N ATOM 718 NH2 ARG A 63 -3.497 -7.853 -15.922 1.00 10.00 N ATOM 0 H ARG A 63 1.147 -5.868 -12.342 1.00 10.00 H new ATOM 0 HA ARG A 63 1.535 -2.946 -12.208 1.00 10.00 H new ATOM 0 HB2 ARG A 63 -0.573 -2.834 -13.466 1.00 10.00 H new ATOM 0 HB3 ARG A 63 0.671 -3.720 -14.325 1.00 10.00 H new ATOM 0 HG2 ARG A 63 -0.374 -5.859 -13.700 1.00 10.00 H new ATOM 0 HG3 ARG A 63 -1.577 -5.020 -12.742 1.00 10.00 H new ATOM 0 HD2 ARG A 63 -2.362 -3.829 -14.798 1.00 10.00 H new ATOM 0 HD3 ARG A 63 -1.180 -4.709 -15.747 1.00 10.00 H new ATOM 0 HE ARG A 63 -3.611 -5.859 -14.454 1.00 10.00 H new ATOM 0 HH11 ARG A 63 -0.832 -6.207 -16.616 1.00 10.00 H new ATOM 0 HH12 ARG A 63 -1.410 -7.737 -17.285 1.00 10.00 H new ATOM 0 HH21 ARG A 63 -4.326 -7.812 -15.329 1.00 10.00 H new ATOM 0 HH22 ARG A 63 -3.367 -8.635 -16.563 1.00 10.00 H new ATOM 732 N PHE A 64 0.069 -2.549 -10.284 1.00 10.00 N ATOM 733 CA PHE A 64 -0.710 -2.294 -9.085 1.00 10.00 C ATOM 734 C PHE A 64 -2.035 -1.653 -9.454 1.00 10.00 C ATOM 735 O PHE A 64 -2.063 -0.611 -10.109 1.00 10.00 O ATOM 736 CB PHE A 64 0.064 -1.383 -8.132 1.00 10.00 C ATOM 737 CG PHE A 64 1.292 -2.020 -7.552 1.00 10.00 C ATOM 738 CD1 PHE A 64 2.483 -2.030 -8.262 1.00 10.00 C ATOM 739 CD2 PHE A 64 1.255 -2.606 -6.298 1.00 10.00 C ATOM 740 CE1 PHE A 64 3.615 -2.613 -7.729 1.00 10.00 C ATOM 741 CE2 PHE A 64 2.383 -3.191 -5.760 1.00 10.00 C ATOM 742 CZ PHE A 64 3.564 -3.193 -6.477 1.00 10.00 C ATOM 0 H PHE A 64 0.680 -1.780 -10.559 1.00 10.00 H new ATOM 0 HA PHE A 64 -0.901 -3.243 -8.584 1.00 10.00 H new ATOM 0 HB2 PHE A 64 0.353 -0.477 -8.664 1.00 10.00 H new ATOM 0 HB3 PHE A 64 -0.595 -1.079 -7.319 1.00 10.00 H new ATOM 0 HD1 PHE A 64 2.525 -1.577 -9.242 1.00 10.00 H new ATOM 0 HD2 PHE A 64 0.333 -2.605 -5.735 1.00 10.00 H new ATOM 0 HE1 PHE A 64 4.538 -2.615 -8.290 1.00 10.00 H new ATOM 0 HE2 PHE A 64 2.343 -3.646 -4.781 1.00 10.00 H new ATOM 0 HZ PHE A 64 4.449 -3.649 -6.058 1.00 10.00 H new ATOM 752 N LEU A 65 -3.124 -2.274 -9.039 1.00 10.00 N ATOM 753 CA LEU A 65 -4.450 -1.764 -9.342 1.00 10.00 C ATOM 754 C LEU A 65 -5.132 -1.238 -8.088 1.00 10.00 C ATOM 755 O LEU A 65 -5.369 -1.981 -7.132 1.00 10.00 O ATOM 756 CB LEU A 65 -5.317 -2.851 -9.981 1.00 10.00 C ATOM 757 CG LEU A 65 -4.802 -3.404 -11.312 1.00 10.00 C ATOM 758 CD1 LEU A 65 -5.731 -4.492 -11.829 1.00 10.00 C ATOM 759 CD2 LEU A 65 -4.662 -2.292 -12.340 1.00 10.00 C ATOM 0 H LEU A 65 -3.117 -3.134 -8.490 1.00 10.00 H new ATOM 0 HA LEU A 65 -4.333 -0.942 -10.048 1.00 10.00 H new ATOM 0 HB2 LEU A 65 -5.412 -3.677 -9.276 1.00 10.00 H new ATOM 0 HB3 LEU A 65 -6.318 -2.449 -10.137 1.00 10.00 H new ATOM 0 HG LEU A 65 -3.817 -3.839 -11.144 1.00 10.00 H new ATOM 0 HD11 LEU A 65 -5.351 -4.875 -12.776 1.00 10.00 H new ATOM 0 HD12 LEU A 65 -5.780 -5.304 -11.103 1.00 10.00 H new ATOM 0 HD13 LEU A 65 -6.728 -4.078 -11.979 1.00 10.00 H new ATOM 0 HD21 LEU A 65 -4.295 -2.708 -13.278 1.00 10.00 H new ATOM 0 HD22 LEU A 65 -5.633 -1.825 -12.506 1.00 10.00 H new ATOM 0 HD23 LEU A 65 -3.958 -1.545 -11.974 1.00 10.00 H new ATOM 771 N PHE A 66 -5.435 0.046 -8.106 1.00 10.00 N ATOM 772 CA PHE A 66 -6.104 0.707 -7.004 1.00 10.00 C ATOM 773 C PHE A 66 -7.349 1.403 -7.533 1.00 10.00 C ATOM 774 O PHE A 66 -7.253 2.298 -8.377 1.00 10.00 O ATOM 775 CB PHE A 66 -5.163 1.716 -6.338 1.00 10.00 C ATOM 776 CG PHE A 66 -5.778 2.466 -5.191 1.00 10.00 C ATOM 777 CD1 PHE A 66 -6.126 1.807 -4.025 1.00 10.00 C ATOM 778 CD2 PHE A 66 -6.003 3.829 -5.279 1.00 10.00 C ATOM 779 CE1 PHE A 66 -6.689 2.493 -2.969 1.00 10.00 C ATOM 780 CE2 PHE A 66 -6.568 4.523 -4.225 1.00 10.00 C ATOM 781 CZ PHE A 66 -6.910 3.854 -3.068 1.00 10.00 C ATOM 0 H PHE A 66 -5.222 0.662 -8.890 1.00 10.00 H new ATOM 0 HA PHE A 66 -6.391 -0.029 -6.253 1.00 10.00 H new ATOM 0 HB2 PHE A 66 -4.278 1.190 -5.981 1.00 10.00 H new ATOM 0 HB3 PHE A 66 -4.827 2.432 -7.088 1.00 10.00 H new ATOM 0 HD1 PHE A 66 -5.955 0.744 -3.941 1.00 10.00 H new ATOM 0 HD2 PHE A 66 -5.734 4.357 -6.182 1.00 10.00 H new ATOM 0 HE1 PHE A 66 -6.957 1.967 -2.065 1.00 10.00 H new ATOM 0 HE2 PHE A 66 -6.741 5.586 -4.307 1.00 10.00 H new ATOM 0 HZ PHE A 66 -7.349 4.392 -2.241 1.00 10.00 H new ATOM 791 N GLU A 67 -8.514 0.958 -7.066 1.00 10.00 N ATOM 792 CA GLU A 67 -9.792 1.522 -7.491 1.00 10.00 C ATOM 793 C GLU A 67 -10.032 1.259 -8.976 1.00 10.00 C ATOM 794 O GLU A 67 -10.768 1.989 -9.641 1.00 10.00 O ATOM 795 CB GLU A 67 -9.852 3.022 -7.192 1.00 10.00 C ATOM 796 CG GLU A 67 -10.177 3.329 -5.743 1.00 10.00 C ATOM 797 CD GLU A 67 -11.573 2.890 -5.366 1.00 10.00 C ATOM 798 OE1 GLU A 67 -11.748 1.720 -4.958 1.00 10.00 O ATOM 799 OE2 GLU A 67 -12.504 3.710 -5.489 1.00 10.00 O ATOM 0 H GLU A 67 -8.598 0.202 -6.387 1.00 10.00 H new ATOM 0 HA GLU A 67 -10.583 1.031 -6.925 1.00 10.00 H new ATOM 0 HB2 GLU A 67 -8.894 3.475 -7.447 1.00 10.00 H new ATOM 0 HB3 GLU A 67 -10.604 3.484 -7.832 1.00 10.00 H new ATOM 0 HG2 GLU A 67 -9.454 2.831 -5.097 1.00 10.00 H new ATOM 0 HG3 GLU A 67 -10.075 4.400 -5.569 1.00 10.00 H new ATOM 806 N GLY A 68 -9.408 0.203 -9.482 1.00 10.00 N ATOM 807 CA GLY A 68 -9.557 -0.158 -10.878 1.00 10.00 C ATOM 808 C GLY A 68 -8.536 0.512 -11.772 1.00 10.00 C ATOM 809 O GLY A 68 -8.414 0.170 -12.947 1.00 10.00 O ATOM 0 H GLY A 68 -8.797 -0.414 -8.946 1.00 10.00 H new ATOM 0 HA2 GLY A 68 -9.468 -1.240 -10.980 1.00 10.00 H new ATOM 0 HA3 GLY A 68 -10.559 0.112 -11.213 1.00 10.00 H new ATOM 813 N GLN A 69 -7.793 1.463 -11.223 1.00 10.00 N ATOM 814 CA GLN A 69 -6.789 2.183 -11.993 1.00 10.00 C ATOM 815 C GLN A 69 -5.393 1.742 -11.586 1.00 10.00 C ATOM 816 O GLN A 69 -5.150 1.427 -10.423 1.00 10.00 O ATOM 817 CB GLN A 69 -6.945 3.693 -11.793 1.00 10.00 C ATOM 818 CG GLN A 69 -8.353 4.195 -12.066 1.00 10.00 C ATOM 819 CD GLN A 69 -8.486 5.693 -11.883 1.00 10.00 C ATOM 820 OE1 GLN A 69 -7.795 6.299 -11.066 1.00 10.00 O ATOM 821 NE2 GLN A 69 -9.379 6.300 -12.646 1.00 10.00 N ATOM 0 H GLN A 69 -7.867 1.754 -10.248 1.00 10.00 H new ATOM 0 HA GLN A 69 -6.934 1.954 -13.049 1.00 10.00 H new ATOM 0 HB2 GLN A 69 -6.669 3.947 -10.770 1.00 10.00 H new ATOM 0 HB3 GLN A 69 -6.248 4.213 -12.450 1.00 10.00 H new ATOM 0 HG2 GLN A 69 -8.637 3.931 -13.085 1.00 10.00 H new ATOM 0 HG3 GLN A 69 -9.051 3.688 -11.399 1.00 10.00 H new ATOM 0 HE21 GLN A 69 -9.932 5.760 -13.312 1.00 10.00 H new ATOM 0 HE22 GLN A 69 -9.515 7.308 -12.569 1.00 10.00 H new ATOM 830 N ARG A 70 -4.482 1.706 -12.543 1.00 10.00 N ATOM 831 CA ARG A 70 -3.117 1.294 -12.259 1.00 10.00 C ATOM 832 C ARG A 70 -2.310 2.456 -11.696 1.00 10.00 C ATOM 833 O ARG A 70 -2.410 3.592 -12.167 1.00 10.00 O ATOM 834 CB ARG A 70 -2.440 0.718 -13.506 1.00 10.00 C ATOM 835 CG ARG A 70 -2.293 1.703 -14.655 1.00 10.00 C ATOM 836 CD ARG A 70 -1.681 1.031 -15.873 1.00 10.00 C ATOM 837 NE ARG A 70 -0.329 0.538 -15.610 1.00 10.00 N ATOM 838 CZ ARG A 70 0.129 -0.649 -16.014 1.00 10.00 C ATOM 839 NH1 ARG A 70 -0.649 -1.477 -16.701 1.00 10.00 N ATOM 840 NH2 ARG A 70 1.372 -1.012 -15.734 1.00 10.00 N ATOM 0 H ARG A 70 -4.660 1.955 -13.516 1.00 10.00 H new ATOM 0 HA ARG A 70 -3.156 0.506 -11.507 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -1.452 0.350 -13.230 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -3.015 -0.141 -13.852 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -3.269 2.114 -14.914 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -1.667 2.540 -14.344 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -2.315 0.201 -16.185 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -1.653 1.739 -16.701 1.00 10.00 H new ATOM 0 HE ARG A 70 0.305 1.140 -15.084 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -1.607 -1.209 -16.925 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -0.289 -2.382 -17.005 1.00 10.00 H new ATOM 0 HH21 ARG A 70 1.981 -0.384 -15.209 1.00 10.00 H new ATOM 0 HH22 ARG A 70 1.720 -1.919 -16.043 1.00 10.00 H new ATOM 854 N ILE A 71 -1.527 2.162 -10.671 1.00 10.00 N ATOM 855 CA ILE A 71 -0.694 3.164 -10.027 1.00 10.00 C ATOM 856 C ILE A 71 0.473 3.559 -10.926 1.00 10.00 C ATOM 857 O ILE A 71 1.300 2.721 -11.296 1.00 10.00 O ATOM 858 CB ILE A 71 -0.149 2.652 -8.672 1.00 10.00 C ATOM 859 CG1 ILE A 71 -1.301 2.334 -7.713 1.00 10.00 C ATOM 860 CG2 ILE A 71 0.801 3.667 -8.049 1.00 10.00 C ATOM 861 CD1 ILE A 71 -2.204 3.517 -7.434 1.00 10.00 C ATOM 0 H ILE A 71 -1.451 1.230 -10.265 1.00 10.00 H new ATOM 0 HA ILE A 71 -1.319 4.038 -9.847 1.00 10.00 H new ATOM 0 HB ILE A 71 0.409 1.734 -8.857 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -1.898 1.523 -8.132 1.00 10.00 H new ATOM 0 HG13 ILE A 71 -0.889 1.973 -6.771 1.00 10.00 H new ATOM 0 HG21 ILE A 71 1.170 3.284 -7.098 1.00 10.00 H new ATOM 0 HG22 ILE A 71 1.641 3.839 -8.722 1.00 10.00 H new ATOM 0 HG23 ILE A 71 0.272 4.605 -7.881 1.00 10.00 H new ATOM 0 HD11 ILE A 71 -2.996 3.216 -6.748 1.00 10.00 H new ATOM 0 HD12 ILE A 71 -1.621 4.322 -6.986 1.00 10.00 H new ATOM 0 HD13 ILE A 71 -2.646 3.866 -8.367 1.00 10.00 H new ATOM 873 N ALA A 72 0.531 4.838 -11.271 1.00 10.00 N ATOM 874 CA ALA A 72 1.587 5.356 -12.126 1.00 10.00 C ATOM 875 C ALA A 72 2.897 5.457 -11.352 1.00 10.00 C ATOM 876 O ALA A 72 2.908 5.421 -10.122 1.00 10.00 O ATOM 877 CB ALA A 72 1.193 6.711 -12.691 1.00 10.00 C ATOM 0 H ALA A 72 -0.146 5.539 -10.969 1.00 10.00 H new ATOM 0 HA ALA A 72 1.732 4.666 -12.957 1.00 10.00 H new ATOM 0 HB1 ALA A 72 1.993 7.086 -13.329 1.00 10.00 H new ATOM 0 HB2 ALA A 72 0.280 6.609 -13.277 1.00 10.00 H new ATOM 0 HB3 ALA A 72 1.023 7.411 -11.873 1.00 10.00 H new ATOM 883 N ASP A 73 3.998 5.601 -12.073 1.00 10.00 N ATOM 884 CA ASP A 73 5.317 5.688 -11.451 1.00 10.00 C ATOM 885 C ASP A 73 5.572 7.073 -10.876 1.00 10.00 C ATOM 886 O ASP A 73 6.619 7.331 -10.291 1.00 10.00 O ATOM 887 CB ASP A 73 6.405 5.335 -12.461 1.00 10.00 C ATOM 888 CG ASP A 73 7.214 4.134 -12.025 1.00 10.00 C ATOM 889 OD1 ASP A 73 6.600 3.113 -11.649 1.00 10.00 O ATOM 890 OD2 ASP A 73 8.462 4.205 -12.066 1.00 10.00 O ATOM 0 H ASP A 73 4.008 5.661 -13.091 1.00 10.00 H new ATOM 0 HA ASP A 73 5.343 4.971 -10.630 1.00 10.00 H new ATOM 0 HB2 ASP A 73 5.948 5.132 -13.430 1.00 10.00 H new ATOM 0 HB3 ASP A 73 7.068 6.190 -12.594 1.00 10.00 H new ATOM 895 N ASN A 74 4.616 7.968 -11.051 1.00 10.00 N ATOM 896 CA ASN A 74 4.739 9.326 -10.535 1.00 10.00 C ATOM 897 C ASN A 74 3.587 9.638 -9.588 1.00 10.00 C ATOM 898 O ASN A 74 3.324 10.795 -9.262 1.00 10.00 O ATOM 899 CB ASN A 74 4.775 10.345 -11.684 1.00 10.00 C ATOM 900 CG ASN A 74 3.434 10.519 -12.380 1.00 10.00 C ATOM 901 OD1 ASN A 74 2.665 9.570 -12.536 1.00 10.00 O ATOM 902 ND2 ASN A 74 3.147 11.738 -12.806 1.00 10.00 N ATOM 0 H ASN A 74 3.744 7.782 -11.546 1.00 10.00 H new ATOM 0 HA ASN A 74 5.677 9.399 -9.984 1.00 10.00 H new ATOM 0 HB2 ASN A 74 5.101 11.309 -11.294 1.00 10.00 H new ATOM 0 HB3 ASN A 74 5.518 10.029 -12.417 1.00 10.00 H new ATOM 0 HD21 ASN A 74 2.263 11.917 -13.282 1.00 10.00 H new ATOM 0 HD22 ASN A 74 3.810 12.499 -12.658 1.00 10.00 H new ATOM 909 N HIS A 75 2.907 8.591 -9.145 1.00 10.00 N ATOM 910 CA HIS A 75 1.776 8.744 -8.242 1.00 10.00 C ATOM 911 C HIS A 75 2.237 8.849 -6.792 1.00 10.00 C ATOM 912 O HIS A 75 3.255 8.271 -6.400 1.00 10.00 O ATOM 913 CB HIS A 75 0.802 7.572 -8.398 1.00 10.00 C ATOM 914 CG HIS A 75 -0.388 7.880 -9.256 1.00 10.00 C ATOM 915 ND1 HIS A 75 -1.004 6.906 -10.007 1.00 10.00 N ATOM 916 CD2 HIS A 75 -1.042 9.053 -9.434 1.00 10.00 C ATOM 917 CE1 HIS A 75 -2.012 7.504 -10.619 1.00 10.00 C ATOM 918 NE2 HIS A 75 -2.073 8.804 -10.302 1.00 10.00 N ATOM 0 H HIS A 75 3.119 7.625 -9.396 1.00 10.00 H new ATOM 0 HA HIS A 75 1.264 9.669 -8.506 1.00 10.00 H new ATOM 0 HB2 HIS A 75 1.336 6.723 -8.826 1.00 10.00 H new ATOM 0 HB3 HIS A 75 0.456 7.266 -7.411 1.00 10.00 H new ATOM 0 HD2 HIS A 75 -0.798 10.002 -8.979 1.00 10.00 H new ATOM 0 HE1 HIS A 75 -2.698 7.008 -11.289 1.00 10.00 H new ATOM 0 HE2 HIS A 75 -2.757 9.480 -10.642 1.00 10.00 H new ATOM 926 N THR A 76 1.485 9.601 -6.009 1.00 10.00 N ATOM 927 CA THR A 76 1.775 9.795 -4.598 1.00 10.00 C ATOM 928 C THR A 76 0.604 9.277 -3.761 1.00 10.00 C ATOM 929 O THR A 76 -0.540 9.385 -4.189 1.00 10.00 O ATOM 930 CB THR A 76 2.003 11.292 -4.294 1.00 10.00 C ATOM 931 OG1 THR A 76 2.238 12.001 -5.519 1.00 10.00 O ATOM 932 CG2 THR A 76 3.185 11.495 -3.352 1.00 10.00 C ATOM 0 H THR A 76 0.654 10.096 -6.333 1.00 10.00 H new ATOM 0 HA THR A 76 2.681 9.244 -4.347 1.00 10.00 H new ATOM 0 HB THR A 76 1.109 11.678 -3.805 1.00 10.00 H new ATOM 0 HG1 THR A 76 1.381 12.214 -5.943 1.00 10.00 H new ATOM 0 HG21 THR A 76 3.318 12.560 -3.159 1.00 10.00 H new ATOM 0 HG22 THR A 76 2.994 10.977 -2.412 1.00 10.00 H new ATOM 0 HG23 THR A 76 4.089 11.094 -3.811 1.00 10.00 H new ATOM 940 N PRO A 77 0.860 8.702 -2.567 1.00 10.00 N ATOM 941 CA PRO A 77 -0.210 8.179 -1.695 1.00 10.00 C ATOM 942 C PRO A 77 -1.203 9.262 -1.270 1.00 10.00 C ATOM 943 O PRO A 77 -2.302 8.968 -0.795 1.00 10.00 O ATOM 944 CB PRO A 77 0.548 7.640 -0.474 1.00 10.00 C ATOM 945 CG PRO A 77 1.944 7.428 -0.945 1.00 10.00 C ATOM 946 CD PRO A 77 2.196 8.486 -1.978 1.00 10.00 C ATOM 0 HA PRO A 77 -0.812 7.427 -2.205 1.00 10.00 H new ATOM 0 HB2 PRO A 77 0.515 8.348 0.354 1.00 10.00 H new ATOM 0 HB3 PRO A 77 0.107 6.710 -0.116 1.00 10.00 H new ATOM 0 HG2 PRO A 77 2.651 7.512 -0.120 1.00 10.00 H new ATOM 0 HG3 PRO A 77 2.066 6.431 -1.369 1.00 10.00 H new ATOM 0 HD2 PRO A 77 2.593 9.398 -1.532 1.00 10.00 H new ATOM 0 HD3 PRO A 77 2.918 8.156 -2.725 1.00 10.00 H new ATOM 954 N LYS A 78 -0.797 10.514 -1.447 1.00 10.00 N ATOM 955 CA LYS A 78 -1.627 11.657 -1.098 1.00 10.00 C ATOM 956 C LYS A 78 -2.823 11.766 -2.043 1.00 10.00 C ATOM 957 O LYS A 78 -3.950 12.014 -1.609 1.00 10.00 O ATOM 958 CB LYS A 78 -0.788 12.942 -1.139 1.00 10.00 C ATOM 959 CG LYS A 78 -1.595 14.227 -0.988 1.00 10.00 C ATOM 960 CD LYS A 78 -2.424 14.244 0.289 1.00 10.00 C ATOM 961 CE LYS A 78 -1.554 14.171 1.531 1.00 10.00 C ATOM 962 NZ LYS A 78 -2.355 14.292 2.776 1.00 10.00 N ATOM 0 H LYS A 78 0.113 10.763 -1.835 1.00 10.00 H new ATOM 0 HA LYS A 78 -2.009 11.517 -0.087 1.00 10.00 H new ATOM 0 HB2 LYS A 78 -0.043 12.900 -0.345 1.00 10.00 H new ATOM 0 HB3 LYS A 78 -0.245 12.977 -2.084 1.00 10.00 H new ATOM 0 HG2 LYS A 78 -0.917 15.081 -0.990 1.00 10.00 H new ATOM 0 HG3 LYS A 78 -2.255 14.342 -1.848 1.00 10.00 H new ATOM 0 HD2 LYS A 78 -3.025 15.153 0.320 1.00 10.00 H new ATOM 0 HD3 LYS A 78 -3.118 13.404 0.282 1.00 10.00 H new ATOM 0 HE2 LYS A 78 -1.011 13.226 1.539 1.00 10.00 H new ATOM 0 HE3 LYS A 78 -0.809 14.966 1.500 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 -1.724 14.237 3.601 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 -2.853 15.205 2.781 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 -3.049 13.519 2.819 1.00 10.00 H new ATOM 976 N GLU A 79 -2.576 11.567 -3.330 1.00 10.00 N ATOM 977 CA GLU A 79 -3.636 11.645 -4.321 1.00 10.00 C ATOM 978 C GLU A 79 -4.365 10.313 -4.405 1.00 10.00 C ATOM 979 O GLU A 79 -3.995 9.360 -3.712 1.00 10.00 O ATOM 980 CB GLU A 79 -3.071 12.051 -5.685 1.00 10.00 C ATOM 981 CG GLU A 79 -2.003 11.113 -6.223 1.00 10.00 C ATOM 982 CD GLU A 79 -1.111 11.787 -7.240 1.00 10.00 C ATOM 983 OE1 GLU A 79 -1.644 12.412 -8.179 1.00 10.00 O ATOM 984 OE2 GLU A 79 0.126 11.706 -7.102 1.00 10.00 O ATOM 0 H GLU A 79 -1.654 11.351 -3.710 1.00 10.00 H new ATOM 0 HA GLU A 79 -4.349 12.411 -4.017 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -3.889 12.102 -6.404 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -2.652 13.054 -5.608 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -1.395 10.745 -5.396 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -2.480 10.245 -6.679 1.00 10.00 H new ATOM 991 N LEU A 80 -5.405 10.259 -5.240 1.00 10.00 N ATOM 992 CA LEU A 80 -6.222 9.055 -5.425 1.00 10.00 C ATOM 993 C LEU A 80 -7.115 8.814 -4.209 1.00 10.00 C ATOM 994 O LEU A 80 -8.335 8.705 -4.336 1.00 10.00 O ATOM 995 CB LEU A 80 -5.351 7.822 -5.699 1.00 10.00 C ATOM 996 CG LEU A 80 -4.557 7.862 -7.005 1.00 10.00 C ATOM 997 CD1 LEU A 80 -3.278 7.049 -6.877 1.00 10.00 C ATOM 998 CD2 LEU A 80 -5.404 7.342 -8.157 1.00 10.00 C ATOM 0 H LEU A 80 -5.706 11.050 -5.809 1.00 10.00 H new ATOM 0 HA LEU A 80 -6.855 9.220 -6.297 1.00 10.00 H new ATOM 0 HB2 LEU A 80 -4.652 7.700 -4.871 1.00 10.00 H new ATOM 0 HB3 LEU A 80 -5.991 6.940 -5.709 1.00 10.00 H new ATOM 0 HG LEU A 80 -4.287 8.897 -7.213 1.00 10.00 H new ATOM 0 HD11 LEU A 80 -2.726 7.089 -7.816 1.00 10.00 H new ATOM 0 HD12 LEU A 80 -2.663 7.461 -6.077 1.00 10.00 H new ATOM 0 HD13 LEU A 80 -3.527 6.013 -6.646 1.00 10.00 H new ATOM 0 HD21 LEU A 80 -4.824 7.377 -9.079 1.00 10.00 H new ATOM 0 HD22 LEU A 80 -5.702 6.313 -7.954 1.00 10.00 H new ATOM 0 HD23 LEU A 80 -6.294 7.963 -8.264 1.00 10.00 H new ATOM 1010 N GLY A 81 -6.508 8.748 -3.035 1.00 10.00 N ATOM 1011 CA GLY A 81 -7.260 8.533 -1.820 1.00 10.00 C ATOM 1012 C GLY A 81 -6.858 7.263 -1.103 1.00 10.00 C ATOM 1013 O GLY A 81 -7.663 6.342 -0.966 1.00 10.00 O ATOM 0 H GLY A 81 -5.501 8.840 -2.903 1.00 10.00 H new ATOM 0 HA2 GLY A 81 -7.116 9.383 -1.153 1.00 10.00 H new ATOM 0 HA3 GLY A 81 -8.323 8.490 -2.058 1.00 10.00 H new ATOM 1017 N MET A 82 -5.618 7.214 -0.642 1.00 10.00 N ATOM 1018 CA MET A 82 -5.113 6.047 0.068 1.00 10.00 C ATOM 1019 C MET A 82 -5.189 6.262 1.574 1.00 10.00 C ATOM 1020 O MET A 82 -4.837 7.330 2.078 1.00 10.00 O ATOM 1021 CB MET A 82 -3.670 5.744 -0.341 1.00 10.00 C ATOM 1022 CG MET A 82 -3.548 5.052 -1.689 1.00 10.00 C ATOM 1023 SD MET A 82 -1.855 4.559 -2.069 1.00 10.00 S ATOM 1024 CE MET A 82 -2.109 3.634 -3.582 1.00 10.00 C ATOM 0 H MET A 82 -4.941 7.970 -0.747 1.00 10.00 H new ATOM 0 HA MET A 82 -5.738 5.195 -0.200 1.00 10.00 H new ATOM 0 HB2 MET A 82 -3.107 6.677 -0.369 1.00 10.00 H new ATOM 0 HB3 MET A 82 -3.210 5.117 0.422 1.00 10.00 H new ATOM 0 HG2 MET A 82 -4.190 4.171 -1.700 1.00 10.00 H new ATOM 0 HG3 MET A 82 -3.911 5.720 -2.470 1.00 10.00 H new ATOM 0 HE1 MET A 82 -1.152 3.261 -3.945 1.00 10.00 H new ATOM 0 HE2 MET A 82 -2.776 2.794 -3.387 1.00 10.00 H new ATOM 0 HE3 MET A 82 -2.555 4.284 -4.335 1.00 10.00 H new ATOM 1034 N GLU A 83 -5.663 5.252 2.286 1.00 10.00 N ATOM 1035 CA GLU A 83 -5.784 5.337 3.734 1.00 10.00 C ATOM 1036 C GLU A 83 -5.229 4.087 4.408 1.00 10.00 C ATOM 1037 O GLU A 83 -4.687 3.202 3.749 1.00 10.00 O ATOM 1038 CB GLU A 83 -7.247 5.547 4.126 1.00 10.00 C ATOM 1039 CG GLU A 83 -7.551 6.957 4.600 1.00 10.00 C ATOM 1040 CD GLU A 83 -6.810 7.304 5.873 1.00 10.00 C ATOM 1041 OE1 GLU A 83 -6.850 6.495 6.827 1.00 10.00 O ATOM 1042 OE2 GLU A 83 -6.188 8.382 5.928 1.00 10.00 O ATOM 0 H GLU A 83 -5.970 4.365 1.886 1.00 10.00 H new ATOM 0 HA GLU A 83 -5.197 6.190 4.075 1.00 10.00 H new ATOM 0 HB2 GLU A 83 -7.881 5.315 3.270 1.00 10.00 H new ATOM 0 HB3 GLU A 83 -7.508 4.843 4.916 1.00 10.00 H new ATOM 0 HG2 GLU A 83 -7.280 7.667 3.819 1.00 10.00 H new ATOM 0 HG3 GLU A 83 -8.623 7.059 4.766 1.00 10.00 H new ATOM 1049 N GLU A 84 -5.362 4.032 5.726 1.00 10.00 N ATOM 1050 CA GLU A 84 -4.881 2.901 6.504 1.00 10.00 C ATOM 1051 C GLU A 84 -5.749 1.670 6.258 1.00 10.00 C ATOM 1052 O GLU A 84 -6.972 1.780 6.145 1.00 10.00 O ATOM 1053 CB GLU A 84 -4.877 3.261 7.992 1.00 10.00 C ATOM 1054 CG GLU A 84 -4.489 2.113 8.911 1.00 10.00 C ATOM 1055 CD GLU A 84 -3.085 1.599 8.663 1.00 10.00 C ATOM 1056 OE1 GLU A 84 -2.214 2.395 8.255 1.00 10.00 O ATOM 1057 OE2 GLU A 84 -2.840 0.398 8.903 1.00 10.00 O ATOM 0 H GLU A 84 -5.803 4.765 6.282 1.00 10.00 H new ATOM 0 HA GLU A 84 -3.863 2.667 6.191 1.00 10.00 H new ATOM 0 HB2 GLU A 84 -4.186 4.089 8.152 1.00 10.00 H new ATOM 0 HB3 GLU A 84 -5.869 3.615 8.271 1.00 10.00 H new ATOM 0 HG2 GLU A 84 -4.571 2.442 9.947 1.00 10.00 H new ATOM 0 HG3 GLU A 84 -5.197 1.295 8.779 1.00 10.00 H new ATOM 1064 N GLU A 85 -5.097 0.508 6.155 1.00 10.00 N ATOM 1065 CA GLU A 85 -5.779 -0.767 5.929 1.00 10.00 C ATOM 1066 C GLU A 85 -6.449 -0.799 4.560 1.00 10.00 C ATOM 1067 O GLU A 85 -7.417 -1.533 4.350 1.00 10.00 O ATOM 1068 CB GLU A 85 -6.816 -1.036 7.025 1.00 10.00 C ATOM 1069 CG GLU A 85 -6.211 -1.391 8.373 1.00 10.00 C ATOM 1070 CD GLU A 85 -5.767 -2.837 8.452 1.00 10.00 C ATOM 1071 OE1 GLU A 85 -4.549 -3.094 8.398 1.00 10.00 O ATOM 1072 OE2 GLU A 85 -6.636 -3.726 8.588 1.00 10.00 O ATOM 0 H GLU A 85 -4.083 0.426 6.226 1.00 10.00 H new ATOM 0 HA GLU A 85 -5.023 -1.552 5.962 1.00 10.00 H new ATOM 0 HB2 GLU A 85 -7.444 -0.153 7.141 1.00 10.00 H new ATOM 0 HB3 GLU A 85 -7.466 -1.850 6.704 1.00 10.00 H new ATOM 0 HG2 GLU A 85 -5.357 -0.742 8.565 1.00 10.00 H new ATOM 0 HG3 GLU A 85 -6.942 -1.196 9.157 1.00 10.00 H new ATOM 1079 N ASP A 86 -5.929 -0.009 3.629 1.00 10.00 N ATOM 1080 CA ASP A 86 -6.486 0.043 2.282 1.00 10.00 C ATOM 1081 C ASP A 86 -6.152 -1.235 1.524 1.00 10.00 C ATOM 1082 O ASP A 86 -5.180 -1.922 1.845 1.00 10.00 O ATOM 1083 CB ASP A 86 -5.955 1.254 1.516 1.00 10.00 C ATOM 1084 CG ASP A 86 -7.042 1.963 0.734 1.00 10.00 C ATOM 1085 OD1 ASP A 86 -7.758 1.297 -0.042 1.00 10.00 O ATOM 1086 OD2 ASP A 86 -7.186 3.195 0.898 1.00 10.00 O ATOM 0 H ASP A 86 -5.126 0.602 3.780 1.00 10.00 H new ATOM 0 HA ASP A 86 -7.569 0.137 2.368 1.00 10.00 H new ATOM 0 HB2 ASP A 86 -5.500 1.954 2.217 1.00 10.00 H new ATOM 0 HB3 ASP A 86 -5.170 0.932 0.832 1.00 10.00 H new ATOM 1091 N VAL A 87 -6.948 -1.546 0.517 1.00 10.00 N ATOM 1092 CA VAL A 87 -6.748 -2.750 -0.274 1.00 10.00 C ATOM 1093 C VAL A 87 -6.303 -2.403 -1.688 1.00 10.00 C ATOM 1094 O VAL A 87 -6.902 -1.552 -2.346 1.00 10.00 O ATOM 1095 CB VAL A 87 -8.038 -3.597 -0.349 1.00 10.00 C ATOM 1096 CG1 VAL A 87 -7.768 -4.944 -1.005 1.00 10.00 C ATOM 1097 CG2 VAL A 87 -8.639 -3.789 1.035 1.00 10.00 C ATOM 0 H VAL A 87 -7.744 -0.979 0.225 1.00 10.00 H new ATOM 0 HA VAL A 87 -5.970 -3.331 0.222 1.00 10.00 H new ATOM 0 HB VAL A 87 -8.758 -3.057 -0.964 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -8.692 -5.521 -1.045 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -7.393 -4.787 -2.017 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -7.025 -5.490 -0.423 1.00 10.00 H new ATOM 0 HG21 VAL A 87 -9.546 -4.388 0.958 1.00 10.00 H new ATOM 0 HG22 VAL A 87 -7.920 -4.300 1.676 1.00 10.00 H new ATOM 0 HG23 VAL A 87 -8.882 -2.817 1.464 1.00 10.00 H new ATOM 1107 N ILE A 88 -5.248 -3.058 -2.142 1.00 10.00 N ATOM 1108 CA ILE A 88 -4.724 -2.840 -3.479 1.00 10.00 C ATOM 1109 C ILE A 88 -4.370 -4.185 -4.115 1.00 10.00 C ATOM 1110 O ILE A 88 -3.901 -5.100 -3.431 1.00 10.00 O ATOM 1111 CB ILE A 88 -3.496 -1.892 -3.458 1.00 10.00 C ATOM 1112 CG1 ILE A 88 -2.990 -1.623 -4.879 1.00 10.00 C ATOM 1113 CG2 ILE A 88 -2.382 -2.462 -2.588 1.00 10.00 C ATOM 1114 CD1 ILE A 88 -2.026 -0.457 -4.968 1.00 10.00 C ATOM 0 H ILE A 88 -4.734 -3.751 -1.598 1.00 10.00 H new ATOM 0 HA ILE A 88 -5.492 -2.354 -4.080 1.00 10.00 H new ATOM 0 HB ILE A 88 -3.812 -0.943 -3.024 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.499 -2.520 -5.257 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -3.843 -1.429 -5.529 1.00 10.00 H new ATOM 0 HG21 ILE A 88 -1.533 -1.779 -2.590 1.00 10.00 H new ATOM 0 HG22 ILE A 88 -2.745 -2.587 -1.568 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -2.070 -3.429 -2.983 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.709 -0.325 -6.003 1.00 10.00 H new ATOM 0 HD12 ILE A 88 -2.520 0.451 -4.621 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -1.155 -0.657 -4.345 1.00 10.00 H new ATOM 1126 N GLU A 89 -4.620 -4.315 -5.408 1.00 10.00 N ATOM 1127 CA GLU A 89 -4.351 -5.560 -6.113 1.00 10.00 C ATOM 1128 C GLU A 89 -3.073 -5.471 -6.930 1.00 10.00 C ATOM 1129 O GLU A 89 -2.691 -4.394 -7.392 1.00 10.00 O ATOM 1130 CB GLU A 89 -5.516 -5.903 -7.041 1.00 10.00 C ATOM 1131 CG GLU A 89 -6.855 -6.024 -6.338 1.00 10.00 C ATOM 1132 CD GLU A 89 -7.986 -6.298 -7.306 1.00 10.00 C ATOM 1133 OE1 GLU A 89 -8.259 -7.483 -7.584 1.00 10.00 O ATOM 1134 OE2 GLU A 89 -8.603 -5.331 -7.800 1.00 10.00 O ATOM 0 H GLU A 89 -5.009 -3.574 -5.992 1.00 10.00 H new ATOM 0 HA GLU A 89 -4.231 -6.342 -5.363 1.00 10.00 H new ATOM 0 HB2 GLU A 89 -5.591 -5.135 -7.811 1.00 10.00 H new ATOM 0 HB3 GLU A 89 -5.298 -6.843 -7.548 1.00 10.00 H new ATOM 0 HG2 GLU A 89 -6.806 -6.827 -5.602 1.00 10.00 H new ATOM 0 HG3 GLU A 89 -7.061 -5.103 -5.792 1.00 10.00 H new ATOM 1141 N VAL A 90 -2.419 -6.607 -7.104 1.00 10.00 N ATOM 1142 CA VAL A 90 -1.197 -6.677 -7.885 1.00 10.00 C ATOM 1143 C VAL A 90 -1.289 -7.838 -8.875 1.00 10.00 C ATOM 1144 O VAL A 90 -1.558 -8.978 -8.493 1.00 10.00 O ATOM 1145 CB VAL A 90 0.054 -6.825 -6.982 1.00 10.00 C ATOM 1146 CG1 VAL A 90 -0.036 -8.067 -6.105 1.00 10.00 C ATOM 1147 CG2 VAL A 90 1.324 -6.848 -7.818 1.00 10.00 C ATOM 0 H VAL A 90 -2.718 -7.500 -6.711 1.00 10.00 H new ATOM 0 HA VAL A 90 -1.087 -5.741 -8.433 1.00 10.00 H new ATOM 0 HB VAL A 90 0.091 -5.956 -6.324 1.00 10.00 H new ATOM 0 HG11 VAL A 90 0.857 -8.140 -5.485 1.00 10.00 H new ATOM 0 HG12 VAL A 90 -0.917 -7.998 -5.466 1.00 10.00 H new ATOM 0 HG13 VAL A 90 -0.113 -8.953 -6.735 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.189 -6.953 -7.163 1.00 10.00 H new ATOM 0 HG22 VAL A 90 1.289 -7.690 -8.510 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.406 -5.918 -8.381 1.00 10.00 H new ATOM 1157 N TYR A 91 -1.099 -7.539 -10.152 1.00 10.00 N ATOM 1158 CA TYR A 91 -1.177 -8.557 -11.190 1.00 10.00 C ATOM 1159 C TYR A 91 0.076 -8.534 -12.051 1.00 10.00 C ATOM 1160 O TYR A 91 0.774 -7.527 -12.106 1.00 10.00 O ATOM 1161 CB TYR A 91 -2.429 -8.350 -12.045 1.00 10.00 C ATOM 1162 CG TYR A 91 -3.712 -8.609 -11.283 1.00 10.00 C ATOM 1163 CD1 TYR A 91 -4.239 -9.889 -11.190 1.00 10.00 C ATOM 1164 CD2 TYR A 91 -4.388 -7.575 -10.647 1.00 10.00 C ATOM 1165 CE1 TYR A 91 -5.401 -10.133 -10.487 1.00 10.00 C ATOM 1166 CE2 TYR A 91 -5.554 -7.812 -9.943 1.00 10.00 C ATOM 1167 CZ TYR A 91 -6.054 -9.092 -9.865 1.00 10.00 C ATOM 1168 OH TYR A 91 -7.210 -9.339 -9.156 1.00 10.00 O ATOM 0 H TYR A 91 -0.890 -6.601 -10.494 1.00 10.00 H new ATOM 0 HA TYR A 91 -1.245 -9.536 -10.715 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -2.438 -7.329 -12.426 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -2.386 -9.012 -12.910 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -3.731 -10.709 -11.676 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -3.996 -6.570 -10.704 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -5.797 -11.136 -10.425 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -6.070 -6.997 -9.457 1.00 10.00 H new ATOM 0 HH TYR A 91 -7.448 -8.546 -8.632 1.00 10.00 H new ATOM 1178 N GLN A 92 0.355 -9.641 -12.720 1.00 10.00 N ATOM 1179 CA GLN A 92 1.543 -9.746 -13.555 1.00 10.00 C ATOM 1180 C GLN A 92 1.280 -9.247 -14.973 1.00 10.00 C ATOM 1181 O GLN A 92 0.296 -9.636 -15.609 1.00 10.00 O ATOM 1182 CB GLN A 92 2.033 -11.196 -13.584 1.00 10.00 C ATOM 1183 CG GLN A 92 3.217 -11.423 -14.509 1.00 10.00 C ATOM 1184 CD GLN A 92 3.945 -12.717 -14.215 1.00 10.00 C ATOM 1185 OE1 GLN A 92 4.905 -12.740 -13.445 1.00 10.00 O ATOM 1186 NE2 GLN A 92 3.501 -13.802 -14.829 1.00 10.00 N ATOM 0 H GLN A 92 -0.224 -10.480 -12.702 1.00 10.00 H new ATOM 0 HA GLN A 92 2.316 -9.112 -13.122 1.00 10.00 H new ATOM 0 HB2 GLN A 92 2.310 -11.497 -12.574 1.00 10.00 H new ATOM 0 HB3 GLN A 92 1.212 -11.842 -13.895 1.00 10.00 H new ATOM 0 HG2 GLN A 92 2.870 -11.432 -15.542 1.00 10.00 H new ATOM 0 HG3 GLN A 92 3.913 -10.589 -14.414 1.00 10.00 H new ATOM 0 HE21 GLN A 92 2.702 -13.740 -15.460 1.00 10.00 H new ATOM 0 HE22 GLN A 92 3.958 -14.700 -14.671 1.00 10.00 H new ATOM 1195 N GLU A 93 2.168 -8.387 -15.459 1.00 10.00 N ATOM 1196 CA GLU A 93 2.055 -7.838 -16.802 1.00 10.00 C ATOM 1197 C GLU A 93 2.380 -8.913 -17.833 1.00 10.00 C ATOM 1198 O GLU A 93 3.267 -9.745 -17.617 1.00 10.00 O ATOM 1199 CB GLU A 93 2.998 -6.641 -16.975 1.00 10.00 C ATOM 1200 CG GLU A 93 2.619 -5.434 -16.128 1.00 10.00 C ATOM 1201 CD GLU A 93 1.469 -4.638 -16.715 1.00 10.00 C ATOM 1202 OE1 GLU A 93 0.430 -5.239 -17.055 1.00 10.00 O ATOM 1203 OE2 GLU A 93 1.595 -3.402 -16.834 1.00 10.00 O ATOM 0 H GLU A 93 2.979 -8.054 -14.937 1.00 10.00 H new ATOM 0 HA GLU A 93 1.031 -7.497 -16.953 1.00 10.00 H new ATOM 0 HB2 GLU A 93 4.012 -6.949 -16.719 1.00 10.00 H new ATOM 0 HB3 GLU A 93 3.009 -6.348 -18.025 1.00 10.00 H new ATOM 0 HG2 GLU A 93 2.348 -5.770 -15.127 1.00 10.00 H new ATOM 0 HG3 GLU A 93 3.487 -4.784 -16.022 1.00 10.00 H new ATOM 1210 N GLN A 94 1.668 -8.882 -18.951 1.00 10.00 N ATOM 1211 CA GLN A 94 1.852 -9.857 -20.019 1.00 10.00 C ATOM 1212 C GLN A 94 3.204 -9.687 -20.704 1.00 10.00 C ATOM 1213 O GLN A 94 3.747 -10.635 -21.263 1.00 10.00 O ATOM 1214 CB GLN A 94 0.724 -9.722 -21.043 1.00 10.00 C ATOM 1215 CG GLN A 94 0.662 -10.869 -22.035 1.00 10.00 C ATOM 1216 CD GLN A 94 -0.565 -10.809 -22.923 1.00 10.00 C ATOM 1217 OE1 GLN A 94 -1.068 -9.731 -23.242 1.00 10.00 O ATOM 1218 NE2 GLN A 94 -1.063 -11.965 -23.317 1.00 10.00 N ATOM 0 H GLN A 94 0.950 -8.184 -19.144 1.00 10.00 H new ATOM 0 HA GLN A 94 1.826 -10.853 -19.576 1.00 10.00 H new ATOM 0 HB2 GLN A 94 -0.228 -9.657 -20.516 1.00 10.00 H new ATOM 0 HB3 GLN A 94 0.850 -8.787 -21.589 1.00 10.00 H new ATOM 0 HG2 GLN A 94 1.557 -10.854 -22.657 1.00 10.00 H new ATOM 0 HG3 GLN A 94 0.667 -11.814 -21.492 1.00 10.00 H new ATOM 0 HE21 GLN A 94 -0.617 -12.837 -23.031 1.00 10.00 H new ATOM 0 HE22 GLN A 94 -1.894 -11.987 -23.908 1.00 10.00 H new ATOM 1227 N THR A 95 3.746 -8.479 -20.653 1.00 10.00 N ATOM 1228 CA THR A 95 5.032 -8.195 -21.275 1.00 10.00 C ATOM 1229 C THR A 95 6.172 -8.841 -20.492 1.00 10.00 C ATOM 1230 O THR A 95 7.208 -9.191 -21.056 1.00 10.00 O ATOM 1231 CB THR A 95 5.272 -6.678 -21.378 1.00 10.00 C ATOM 1232 OG1 THR A 95 5.071 -6.058 -20.099 1.00 10.00 O ATOM 1233 CG2 THR A 95 4.333 -6.053 -22.400 1.00 10.00 C ATOM 0 H THR A 95 3.316 -7.680 -20.188 1.00 10.00 H new ATOM 0 HA THR A 95 5.009 -8.618 -22.279 1.00 10.00 H new ATOM 0 HB THR A 95 6.301 -6.517 -21.701 1.00 10.00 H new ATOM 0 HG1 THR A 95 5.228 -5.094 -20.175 1.00 10.00 H new ATOM 0 HG21 THR A 95 4.519 -4.981 -22.457 1.00 10.00 H new ATOM 0 HG22 THR A 95 4.506 -6.504 -23.377 1.00 10.00 H new ATOM 0 HG23 THR A 95 3.300 -6.226 -22.099 1.00 10.00 H new ATOM 1241 N GLY A 96 5.965 -9.007 -19.189 1.00 10.00 N ATOM 1242 CA GLY A 96 6.980 -9.605 -18.343 1.00 10.00 C ATOM 1243 C GLY A 96 8.050 -8.607 -17.949 1.00 10.00 C ATOM 1244 O GLY A 96 9.088 -8.974 -17.397 1.00 10.00 O ATOM 0 H GLY A 96 5.110 -8.737 -18.704 1.00 10.00 H new ATOM 0 HA2 GLY A 96 6.512 -10.008 -17.445 1.00 10.00 H new ATOM 0 HA3 GLY A 96 7.441 -10.443 -18.866 1.00 10.00 H new ATOM 1248 N GLY A 97 7.794 -7.343 -18.238 1.00 10.00 N ATOM 1249 CA GLY A 97 8.734 -6.298 -17.917 1.00 10.00 C ATOM 1250 C GLY A 97 8.287 -4.968 -18.473 1.00 10.00 C ATOM 1251 O GLY A 97 8.832 -3.930 -18.057 1.00 10.00 O ATOM 0 H GLY A 97 6.941 -7.021 -18.695 1.00 10.00 H new ATOM 0 HA2 GLY A 97 8.843 -6.224 -16.835 1.00 10.00 H new ATOM 0 HA3 GLY A 97 9.715 -6.552 -18.320 1.00 10.00 H new ATOM 1256 N ASN B 357 -5.312 -15.404 5.099 1.00 10.00 N ATOM 1257 CA ASN B 357 -4.705 -15.700 6.419 1.00 10.00 C ATOM 1258 C ASN B 357 -3.183 -15.745 6.303 1.00 10.00 C ATOM 1259 O ASN B 357 -2.502 -16.383 7.106 1.00 10.00 O ATOM 1260 CB ASN B 357 -5.237 -17.036 6.966 1.00 10.00 C ATOM 1261 CG ASN B 357 -5.024 -17.201 8.461 1.00 10.00 C ATOM 1262 OD1 ASN B 357 -4.872 -16.222 9.196 1.00 10.00 O ATOM 1263 ND2 ASN B 357 -5.014 -18.443 8.921 1.00 10.00 N ATOM 0 HA ASN B 357 -4.980 -14.906 7.113 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -6.302 -17.112 6.747 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -4.745 -17.856 6.443 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -4.877 -18.617 9.917 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -5.143 -19.225 8.280 1.00 10.00 H new ATOM 1270 N ASN B 358 -2.649 -15.068 5.292 1.00 10.00 N ATOM 1271 CA ASN B 358 -1.210 -15.025 5.080 1.00 10.00 C ATOM 1272 C ASN B 358 -0.757 -13.578 5.134 1.00 10.00 C ATOM 1273 O ASN B 358 -1.253 -12.756 4.375 1.00 10.00 O ATOM 1274 CB ASN B 358 -0.886 -15.636 3.712 1.00 10.00 C ATOM 1275 CG ASN B 358 0.600 -15.708 3.421 1.00 10.00 C ATOM 1276 OD1 ASN B 358 1.422 -15.765 4.331 1.00 10.00 O ATOM 1277 ND2 ASN B 358 0.948 -15.731 2.145 1.00 10.00 N ATOM 0 H ASN B 358 -3.193 -14.542 4.608 1.00 10.00 H new ATOM 0 HA ASN B 358 -0.691 -15.595 5.851 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -1.307 -16.640 3.662 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -1.373 -15.047 2.935 1.00 10.00 H new ATOM 0 HD21 ASN B 358 1.932 -15.798 1.886 1.00 10.00 H new ATOM 0 HD22 ASN B 358 0.232 -15.681 1.420 1.00 10.00 H new ATOM 1284 N ARG B 359 0.183 -13.265 6.008 1.00 10.00 N ATOM 1285 CA ARG B 359 0.653 -11.895 6.121 1.00 10.00 C ATOM 1286 C ARG B 359 2.164 -11.765 5.979 1.00 10.00 C ATOM 1287 O ARG B 359 2.931 -12.444 6.661 1.00 10.00 O ATOM 1288 CB ARG B 359 0.198 -11.270 7.448 1.00 10.00 C ATOM 1289 CG ARG B 359 0.735 -11.976 8.686 1.00 10.00 C ATOM 1290 CD ARG B 359 0.767 -11.046 9.892 1.00 10.00 C ATOM 1291 NE ARG B 359 1.527 -11.614 11.006 1.00 10.00 N ATOM 1292 CZ ARG B 359 2.089 -10.891 11.976 1.00 10.00 C ATOM 1293 NH1 ARG B 359 1.954 -9.567 11.987 1.00 10.00 N ATOM 1294 NH2 ARG B 359 2.787 -11.496 12.932 1.00 10.00 N ATOM 0 H ARG B 359 0.630 -13.928 6.641 1.00 10.00 H new ATOM 0 HA ARG B 359 0.206 -11.353 5.288 1.00 10.00 H new ATOM 0 HB2 ARG B 359 0.513 -10.227 7.473 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -0.891 -11.275 7.484 1.00 10.00 H new ATOM 0 HG2 ARG B 359 0.113 -12.842 8.910 1.00 10.00 H new ATOM 0 HG3 ARG B 359 1.740 -12.348 8.486 1.00 10.00 H new ATOM 0 HD2 ARG B 359 1.208 -10.092 9.602 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -0.253 -10.840 10.217 1.00 10.00 H new ATOM 0 HE ARG B 359 1.634 -12.628 11.043 1.00 10.00 H new ATOM 0 HH11 ARG B 359 1.420 -9.103 11.253 1.00 10.00 H new ATOM 0 HH12 ARG B 359 2.385 -9.017 12.730 1.00 10.00 H new ATOM 0 HH21 ARG B 359 2.892 -12.511 12.923 1.00 10.00 H new ATOM 0 HH22 ARG B 359 3.218 -10.946 13.675 1.00 10.00 H new ATOM 1308 N ASP B 360 2.577 -10.896 5.078 1.00 10.00 N ATOM 1309 CA ASP B 360 3.989 -10.598 4.882 1.00 10.00 C ATOM 1310 C ASP B 360 4.170 -9.101 5.083 1.00 10.00 C ATOM 1311 O ASP B 360 3.442 -8.322 4.475 1.00 10.00 O ATOM 1312 CB ASP B 360 4.458 -11.016 3.478 1.00 10.00 C ATOM 1313 CG ASP B 360 5.931 -10.728 3.230 1.00 10.00 C ATOM 1314 OD1 ASP B 360 6.292 -10.337 2.097 1.00 10.00 O ATOM 1315 OD2 ASP B 360 6.741 -10.917 4.156 1.00 10.00 O ATOM 0 H ASP B 360 1.951 -10.377 4.462 1.00 10.00 H new ATOM 0 HA ASP B 360 4.592 -11.159 5.596 1.00 10.00 H new ATOM 0 HB2 ASP B 360 4.275 -12.082 3.343 1.00 10.00 H new ATOM 0 HB3 ASP B 360 3.861 -10.493 2.731 1.00 10.00 H new ATOM 1320 N PRO B 361 5.114 -8.651 5.924 1.00 10.00 N ATOM 1321 CA PRO B 361 5.317 -7.236 6.154 1.00 10.00 C ATOM 1322 C PRO B 361 6.634 -6.707 5.591 1.00 10.00 C ATOM 1323 O PRO B 361 7.718 -7.246 5.822 1.00 10.00 O ATOM 1324 CB PRO B 361 5.345 -7.201 7.689 1.00 10.00 C ATOM 1325 CG PRO B 361 5.812 -8.571 8.116 1.00 10.00 C ATOM 1326 CD PRO B 361 5.912 -9.426 6.866 1.00 10.00 C ATOM 0 HA PRO B 361 4.561 -6.616 5.672 1.00 10.00 H new ATOM 0 HB2 PRO B 361 6.020 -6.426 8.051 1.00 10.00 H new ATOM 0 HB3 PRO B 361 4.358 -6.979 8.094 1.00 10.00 H new ATOM 0 HG2 PRO B 361 6.778 -8.508 8.617 1.00 10.00 H new ATOM 0 HG3 PRO B 361 5.113 -9.011 8.827 1.00 10.00 H new ATOM 0 HD2 PRO B 361 6.942 -9.545 6.531 1.00 10.00 H new ATOM 0 HD3 PRO B 361 5.509 -10.427 7.020 1.00 10.00 H new ATOM 1334 N ILE B 362 6.494 -5.632 4.829 1.00 10.00 N ATOM 1335 CA ILE B 362 7.609 -4.949 4.188 1.00 10.00 C ATOM 1336 C ILE B 362 7.683 -3.509 4.682 1.00 10.00 C ATOM 1337 O ILE B 362 6.654 -2.837 4.814 1.00 10.00 O ATOM 1338 CB ILE B 362 7.496 -4.937 2.652 1.00 10.00 C ATOM 1339 CG1 ILE B 362 6.886 -6.242 2.142 1.00 10.00 C ATOM 1340 CG2 ILE B 362 8.868 -4.706 2.024 1.00 10.00 C ATOM 1341 CD1 ILE B 362 6.585 -6.232 0.660 1.00 10.00 C ATOM 0 H ILE B 362 5.589 -5.203 4.636 1.00 10.00 H new ATOM 0 HA ILE B 362 8.511 -5.501 4.454 1.00 10.00 H new ATOM 0 HB ILE B 362 6.836 -4.119 2.362 1.00 10.00 H new ATOM 0 HG12 ILE B 362 7.570 -7.062 2.360 1.00 10.00 H new ATOM 0 HG13 ILE B 362 5.965 -6.441 2.690 1.00 10.00 H new ATOM 0 HG21 ILE B 362 8.775 -4.700 0.938 1.00 10.00 H new ATOM 0 HG22 ILE B 362 9.265 -3.748 2.360 1.00 10.00 H new ATOM 0 HG23 ILE B 362 9.545 -5.505 2.325 1.00 10.00 H new ATOM 0 HD11 ILE B 362 6.154 -7.190 0.370 1.00 10.00 H new ATOM 0 HD12 ILE B 362 5.877 -5.434 0.438 1.00 10.00 H new ATOM 0 HD13 ILE B 362 7.507 -6.065 0.103 1.00 10.00 H new ATOM 1353 N VAL B 363 8.887 -3.045 4.970 1.00 10.00 N ATOM 1354 CA VAL B 363 9.091 -1.689 5.465 1.00 10.00 C ATOM 1355 C VAL B 363 9.850 -0.868 4.419 1.00 10.00 C ATOM 1356 O VAL B 363 10.812 -1.337 3.810 1.00 10.00 O ATOM 1357 CB VAL B 363 9.848 -1.653 6.816 1.00 10.00 C ATOM 1358 CG1 VAL B 363 9.366 -0.478 7.654 1.00 10.00 C ATOM 1359 CG2 VAL B 363 9.668 -2.956 7.581 1.00 10.00 C ATOM 0 H VAL B 363 9.744 -3.589 4.870 1.00 10.00 H new ATOM 0 HA VAL B 363 8.106 -1.257 5.641 1.00 10.00 H new ATOM 0 HB VAL B 363 10.911 -1.530 6.607 1.00 10.00 H new ATOM 0 HG11 VAL B 363 9.904 -0.462 8.602 1.00 10.00 H new ATOM 0 HG12 VAL B 363 9.550 0.452 7.116 1.00 10.00 H new ATOM 0 HG13 VAL B 363 8.298 -0.581 7.845 1.00 10.00 H new ATOM 0 HG21 VAL B 363 10.210 -2.902 8.525 1.00 10.00 H new ATOM 0 HG22 VAL B 363 8.609 -3.118 7.780 1.00 10.00 H new ATOM 0 HG23 VAL B 363 10.056 -3.783 6.987 1.00 10.00 H new ATOM 1369 N ILE B 364 9.381 0.352 4.209 1.00 10.00 N ATOM 1370 CA ILE B 364 9.919 1.258 3.199 1.00 10.00 C ATOM 1371 C ILE B 364 10.598 2.472 3.831 1.00 10.00 C ATOM 1372 O ILE B 364 10.178 2.971 4.880 1.00 10.00 O ATOM 1373 CB ILE B 364 8.830 1.723 2.190 1.00 10.00 C ATOM 1374 CG1 ILE B 364 9.473 2.096 0.850 1.00 10.00 C ATOM 1375 CG2 ILE B 364 8.024 2.899 2.735 1.00 10.00 C ATOM 1376 CD1 ILE B 364 9.903 0.901 0.024 1.00 10.00 C ATOM 0 H ILE B 364 8.606 0.749 4.741 1.00 10.00 H new ATOM 0 HA ILE B 364 10.669 0.690 2.650 1.00 10.00 H new ATOM 0 HB ILE B 364 8.142 0.891 2.037 1.00 10.00 H new ATOM 0 HG12 ILE B 364 8.766 2.690 0.271 1.00 10.00 H new ATOM 0 HG13 ILE B 364 10.341 2.727 1.038 1.00 10.00 H new ATOM 0 HG21 ILE B 364 7.273 3.196 2.003 1.00 10.00 H new ATOM 0 HG22 ILE B 364 7.531 2.604 3.661 1.00 10.00 H new ATOM 0 HG23 ILE B 364 8.692 3.738 2.931 1.00 10.00 H new ATOM 0 HD11 ILE B 364 10.349 1.245 -0.909 1.00 10.00 H new ATOM 0 HD12 ILE B 364 10.635 0.317 0.582 1.00 10.00 H new ATOM 0 HD13 ILE B 364 9.035 0.280 -0.196 1.00 10.00 H new