USER MOD reduce.3.24.130724 H: found=0, std=0, add=852, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 847 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 49 THR OG1 : rot 180:sc= 0.0203 USER MOD Set 1.2: A 78 THR OG1 : rot -160:sc= 0 USER MOD Set 2.1: A 52 ASN : amide:sc= -0.983 K(o=-0.98,f=-2.4!) USER MOD Set 2.2: A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 149:sc= 0.293 (180deg=0.00426) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 LYS NZ :NH3+ -160:sc= 0.106 (180deg=-0.216) USER MOD Single : A 14 CYS SG : rot 112:sc= 0.87 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 CYS SG : rot 180:sc= -1.65! USER MOD Single : A 18 HIS : no HE2:sc= 0.673 K(o=0.67,f=-2.1!) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HE2:sc= 0.399 K(o=0.4,f=-2.9!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= -0.13 K(o=-0.13,f=-4.4!) USER MOD Single : A 33 HIS : no HE2:sc= -0.482 K(o=-0.48,f=-1.5) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 148:sc= 1.14 USER MOD Single : A 42 GLN : amide:sc= 0.771 K(o=0.77,f=-0.1) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot -104:sc= 0.055 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 143:sc= 0.0949 (180deg=-1.35) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0.0749 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 ASN : amide:sc= -0.17 K(o=-0.17,f=-1.1) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0066) USER MOD Single : A 74 TYR OH : rot 139:sc= 0.04 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.122 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ -150:sc= 1.13 (180deg=1.03) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot -88:sc= 1.25 USER MOD Single : A 103 ASN : amide:sc= -0.12 K(o=-0.12,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.920 -4.375 -15.044 1.00 10.00 N ATOM 2 CA GLY A 1 -4.507 -4.072 -14.969 1.00 10.00 C ATOM 3 C GLY A 1 -3.830 -5.402 -15.270 1.00 10.00 C ATOM 4 O GLY A 1 -4.472 -6.440 -15.114 1.00 10.00 O ATOM 0 H1 GLY A 1 -6.442 -3.760 -14.388 1.00 10.00 H new ATOM 0 H2 GLY A 1 -6.259 -4.213 -16.014 1.00 10.00 H new ATOM 0 H3 GLY A 1 -6.076 -5.370 -14.784 1.00 10.00 H new ATOM 0 HA2 GLY A 1 -4.224 -3.307 -15.692 1.00 10.00 H new ATOM 0 HA3 GLY A 1 -4.231 -3.697 -13.983 1.00 10.00 H new ATOM 10 N ASP A 2 -2.637 -5.360 -15.810 1.00 10.00 N ATOM 11 CA ASP A 2 -1.806 -6.527 -16.043 1.00 10.00 C ATOM 12 C ASP A 2 -1.290 -7.080 -14.714 1.00 10.00 C ATOM 13 O ASP A 2 -0.565 -6.396 -13.994 1.00 10.00 O ATOM 14 CB ASP A 2 -0.595 -6.177 -16.901 1.00 10.00 C ATOM 15 CG ASP A 2 0.204 -7.433 -17.220 1.00 10.00 C ATOM 16 OD1 ASP A 2 -0.289 -8.541 -16.912 1.00 10.00 O ATOM 17 OD2 ASP A 2 1.363 -7.273 -17.651 1.00 10.00 O ATOM 0 H ASP A 2 -2.200 -4.489 -16.110 1.00 10.00 H new ATOM 0 HA ASP A 2 -2.421 -7.266 -16.557 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -0.921 -5.700 -17.825 1.00 10.00 H new ATOM 0 HB3 ASP A 2 0.036 -5.459 -16.377 1.00 10.00 H new ATOM 22 N VAL A 3 -1.612 -8.333 -14.401 1.00 10.00 N ATOM 23 CA VAL A 3 -1.036 -9.021 -13.257 1.00 10.00 C ATOM 24 C VAL A 3 0.479 -9.176 -13.438 1.00 10.00 C ATOM 25 O VAL A 3 1.221 -9.024 -12.469 1.00 10.00 O ATOM 26 CB VAL A 3 -1.744 -10.377 -13.058 1.00 10.00 C ATOM 27 CG1 VAL A 3 -1.212 -11.173 -11.851 1.00 10.00 C ATOM 28 CG2 VAL A 3 -3.260 -10.201 -12.883 1.00 10.00 C ATOM 0 H VAL A 3 -2.277 -8.895 -14.933 1.00 10.00 H new ATOM 0 HA VAL A 3 -1.191 -8.431 -12.354 1.00 10.00 H new ATOM 0 HB VAL A 3 -1.528 -10.940 -13.966 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -1.753 -12.115 -11.769 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -0.150 -11.375 -11.988 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -1.356 -10.592 -10.940 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -3.726 -11.177 -12.745 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -3.456 -9.579 -12.010 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -3.675 -9.722 -13.770 1.00 10.00 H new ATOM 38 N GLU A 4 0.956 -9.471 -14.652 1.00 10.00 N ATOM 39 CA GLU A 4 2.383 -9.665 -14.873 1.00 10.00 C ATOM 40 C GLU A 4 3.116 -8.366 -14.568 1.00 10.00 C ATOM 41 O GLU A 4 3.925 -8.311 -13.640 1.00 10.00 O ATOM 42 CB GLU A 4 2.661 -10.120 -16.308 1.00 10.00 C ATOM 43 CG GLU A 4 2.669 -11.645 -16.448 1.00 10.00 C ATOM 44 CD GLU A 4 4.091 -12.192 -16.430 1.00 10.00 C ATOM 45 OE1 GLU A 4 4.756 -12.057 -17.479 1.00 10.00 O ATOM 46 OE2 GLU A 4 4.500 -12.698 -15.361 1.00 10.00 O ATOM 0 H GLU A 4 0.378 -9.579 -15.485 1.00 10.00 H new ATOM 0 HA GLU A 4 2.743 -10.449 -14.207 1.00 10.00 H new ATOM 0 HB2 GLU A 4 1.904 -9.701 -16.972 1.00 10.00 H new ATOM 0 HB3 GLU A 4 3.623 -9.724 -16.632 1.00 10.00 H new ATOM 0 HG2 GLU A 4 2.095 -12.091 -15.636 1.00 10.00 H new ATOM 0 HG3 GLU A 4 2.179 -11.930 -17.379 1.00 10.00 H new ATOM 53 N LYS A 5 2.827 -7.308 -15.328 1.00 10.00 N ATOM 54 CA LYS A 5 3.452 -6.030 -15.076 1.00 10.00 C ATOM 55 C LYS A 5 3.201 -5.618 -13.634 1.00 10.00 C ATOM 56 O LYS A 5 4.131 -5.167 -12.983 1.00 10.00 O ATOM 57 CB LYS A 5 3.035 -4.950 -16.070 1.00 10.00 C ATOM 58 CG LYS A 5 3.705 -5.084 -17.439 1.00 10.00 C ATOM 59 CD LYS A 5 3.974 -3.654 -17.923 1.00 10.00 C ATOM 60 CE LYS A 5 4.172 -3.553 -19.431 1.00 10.00 C ATOM 61 NZ LYS A 5 5.370 -4.272 -19.909 1.00 10.00 N ATOM 0 H LYS A 5 2.172 -7.320 -16.110 1.00 10.00 H new ATOM 0 HA LYS A 5 4.525 -6.146 -15.227 1.00 10.00 H new ATOM 0 HB2 LYS A 5 1.953 -4.986 -16.199 1.00 10.00 H new ATOM 0 HB3 LYS A 5 3.274 -3.972 -15.652 1.00 10.00 H new ATOM 0 HG2 LYS A 5 4.633 -5.651 -17.365 1.00 10.00 H new ATOM 0 HG3 LYS A 5 3.060 -5.617 -18.138 1.00 10.00 H new ATOM 0 HD2 LYS A 5 3.140 -3.016 -17.630 1.00 10.00 H new ATOM 0 HD3 LYS A 5 4.862 -3.269 -17.421 1.00 10.00 H new ATOM 0 HE2 LYS A 5 3.291 -3.952 -19.934 1.00 10.00 H new ATOM 0 HE3 LYS A 5 4.250 -2.503 -19.711 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 5.450 -4.166 -20.941 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 6.217 -3.876 -19.454 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 5.288 -5.281 -19.670 1.00 10.00 H new ATOM 75 N GLY A 6 2.001 -5.827 -13.096 1.00 10.00 N ATOM 76 CA GLY A 6 1.721 -5.529 -11.705 1.00 10.00 C ATOM 77 C GLY A 6 2.695 -6.205 -10.736 1.00 10.00 C ATOM 78 O GLY A 6 3.175 -5.577 -9.789 1.00 10.00 O ATOM 0 H GLY A 6 1.206 -6.204 -13.612 1.00 10.00 H new ATOM 0 HA2 GLY A 6 1.761 -4.450 -11.556 1.00 10.00 H new ATOM 0 HA3 GLY A 6 0.705 -5.846 -11.469 1.00 10.00 H new ATOM 82 N LYS A 7 2.996 -7.486 -10.971 1.00 10.00 N ATOM 83 CA LYS A 7 3.919 -8.257 -10.168 1.00 10.00 C ATOM 84 C LYS A 7 5.270 -7.575 -10.269 1.00 10.00 C ATOM 85 O LYS A 7 5.867 -7.201 -9.259 1.00 10.00 O ATOM 86 CB LYS A 7 3.952 -9.705 -10.687 1.00 10.00 C ATOM 87 CG LYS A 7 4.831 -10.633 -9.841 1.00 10.00 C ATOM 88 CD LYS A 7 4.994 -11.992 -10.545 1.00 10.00 C ATOM 89 CE LYS A 7 4.689 -13.162 -9.597 1.00 10.00 C ATOM 90 NZ LYS A 7 4.966 -14.471 -10.227 1.00 10.00 N ATOM 0 H LYS A 7 2.591 -8.016 -11.743 1.00 10.00 H new ATOM 0 HA LYS A 7 3.620 -8.302 -9.121 1.00 10.00 H new ATOM 0 HB2 LYS A 7 2.936 -10.099 -10.709 1.00 10.00 H new ATOM 0 HB3 LYS A 7 4.317 -9.707 -11.714 1.00 10.00 H new ATOM 0 HG2 LYS A 7 5.808 -10.177 -9.683 1.00 10.00 H new ATOM 0 HG3 LYS A 7 4.383 -10.775 -8.858 1.00 10.00 H new ATOM 0 HD2 LYS A 7 4.328 -12.038 -11.406 1.00 10.00 H new ATOM 0 HD3 LYS A 7 6.012 -12.086 -10.924 1.00 10.00 H new ATOM 0 HE2 LYS A 7 5.288 -13.061 -8.692 1.00 10.00 H new ATOM 0 HE3 LYS A 7 3.643 -13.120 -9.293 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 4.747 -15.233 -9.554 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 4.376 -14.579 -11.077 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 5.970 -14.522 -10.494 1.00 10.00 H new ATOM 104 N LYS A 8 5.754 -7.409 -11.500 1.00 10.00 N ATOM 105 CA LYS A 8 7.083 -6.871 -11.696 1.00 10.00 C ATOM 106 C LYS A 8 7.186 -5.476 -11.094 1.00 10.00 C ATOM 107 O LYS A 8 8.173 -5.175 -10.440 1.00 10.00 O ATOM 108 CB LYS A 8 7.520 -6.931 -13.164 1.00 10.00 C ATOM 109 CG LYS A 8 7.289 -8.304 -13.818 1.00 10.00 C ATOM 110 CD LYS A 8 7.637 -9.516 -12.938 1.00 10.00 C ATOM 111 CE LYS A 8 9.156 -9.752 -12.886 1.00 10.00 C ATOM 112 NZ LYS A 8 9.574 -10.509 -11.687 1.00 10.00 N ATOM 0 H LYS A 8 5.250 -7.637 -12.357 1.00 10.00 H new ATOM 0 HA LYS A 8 7.791 -7.504 -11.161 1.00 10.00 H new ATOM 0 HB2 LYS A 8 6.976 -6.173 -13.728 1.00 10.00 H new ATOM 0 HB3 LYS A 8 8.579 -6.679 -13.230 1.00 10.00 H new ATOM 0 HG2 LYS A 8 6.242 -8.377 -14.111 1.00 10.00 H new ATOM 0 HG3 LYS A 8 7.881 -8.357 -14.732 1.00 10.00 H new ATOM 0 HD2 LYS A 8 7.257 -9.356 -11.929 1.00 10.00 H new ATOM 0 HD3 LYS A 8 7.142 -10.405 -13.328 1.00 10.00 H new ATOM 0 HE2 LYS A 8 9.466 -10.294 -13.779 1.00 10.00 H new ATOM 0 HE3 LYS A 8 9.670 -8.791 -12.901 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 10.606 -10.640 -11.701 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 9.304 -9.982 -10.832 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 9.107 -11.438 -11.683 1.00 10.00 H new ATOM 126 N ILE A 9 6.156 -4.651 -11.246 1.00 10.00 N ATOM 127 CA ILE A 9 6.078 -3.342 -10.639 1.00 10.00 C ATOM 128 C ILE A 9 6.233 -3.489 -9.130 1.00 10.00 C ATOM 129 O ILE A 9 7.173 -2.930 -8.577 1.00 10.00 O ATOM 130 CB ILE A 9 4.770 -2.649 -11.063 1.00 10.00 C ATOM 131 CG1 ILE A 9 4.829 -2.221 -12.540 1.00 10.00 C ATOM 132 CG2 ILE A 9 4.491 -1.413 -10.209 1.00 10.00 C ATOM 133 CD1 ILE A 9 3.434 -1.918 -13.097 1.00 10.00 C ATOM 0 H ILE A 9 5.338 -4.886 -11.808 1.00 10.00 H new ATOM 0 HA ILE A 9 6.887 -2.698 -10.983 1.00 10.00 H new ATOM 0 HB ILE A 9 3.968 -3.373 -10.920 1.00 10.00 H new ATOM 0 HG12 ILE A 9 5.460 -1.338 -12.638 1.00 10.00 H new ATOM 0 HG13 ILE A 9 5.293 -3.011 -13.130 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.561 -0.948 -10.535 1.00 10.00 H new ATOM 0 HG22 ILE A 9 4.403 -1.706 -9.163 1.00 10.00 H new ATOM 0 HG23 ILE A 9 5.310 -0.702 -10.319 1.00 10.00 H new ATOM 0 HD11 ILE A 9 3.516 -1.619 -14.142 1.00 10.00 H new ATOM 0 HD12 ILE A 9 2.811 -2.809 -13.022 1.00 10.00 H new ATOM 0 HD13 ILE A 9 2.981 -1.110 -12.523 1.00 10.00 H new ATOM 145 N PHE A 10 5.358 -4.243 -8.459 1.00 10.00 N ATOM 146 CA PHE A 10 5.468 -4.453 -7.018 1.00 10.00 C ATOM 147 C PHE A 10 6.915 -4.791 -6.621 1.00 10.00 C ATOM 148 O PHE A 10 7.477 -4.194 -5.699 1.00 10.00 O ATOM 149 CB PHE A 10 4.486 -5.547 -6.586 1.00 10.00 C ATOM 150 CG PHE A 10 4.507 -5.838 -5.100 1.00 10.00 C ATOM 151 CD1 PHE A 10 3.902 -4.941 -4.202 1.00 10.00 C ATOM 152 CD2 PHE A 10 5.180 -6.971 -4.607 1.00 10.00 C ATOM 153 CE1 PHE A 10 3.916 -5.205 -2.824 1.00 10.00 C ATOM 154 CE2 PHE A 10 5.190 -7.238 -3.228 1.00 10.00 C ATOM 155 CZ PHE A 10 4.528 -6.373 -2.341 1.00 10.00 C ATOM 0 H PHE A 10 4.566 -4.717 -8.893 1.00 10.00 H new ATOM 0 HA PHE A 10 5.206 -3.532 -6.497 1.00 10.00 H new ATOM 0 HB2 PHE A 10 3.477 -5.251 -6.874 1.00 10.00 H new ATOM 0 HB3 PHE A 10 4.716 -6.464 -7.129 1.00 10.00 H new ATOM 0 HD1 PHE A 10 3.425 -4.046 -4.574 1.00 10.00 H new ATOM 0 HD2 PHE A 10 5.689 -7.636 -5.289 1.00 10.00 H new ATOM 0 HE1 PHE A 10 3.457 -4.511 -2.136 1.00 10.00 H new ATOM 0 HE2 PHE A 10 5.706 -8.108 -2.850 1.00 10.00 H new ATOM 0 HZ PHE A 10 4.490 -6.606 -1.287 1.00 10.00 H new ATOM 165 N VAL A 11 7.537 -5.705 -7.372 1.00 10.00 N ATOM 166 CA VAL A 11 8.911 -6.135 -7.135 1.00 10.00 C ATOM 167 C VAL A 11 9.962 -5.068 -7.480 1.00 10.00 C ATOM 168 O VAL A 11 11.039 -5.037 -6.891 1.00 10.00 O ATOM 169 CB VAL A 11 9.164 -7.468 -7.858 1.00 10.00 C ATOM 170 CG1 VAL A 11 10.595 -7.981 -7.652 1.00 10.00 C ATOM 171 CG2 VAL A 11 8.170 -8.519 -7.347 1.00 10.00 C ATOM 0 H VAL A 11 7.095 -6.168 -8.166 1.00 10.00 H new ATOM 0 HA VAL A 11 9.028 -6.288 -6.062 1.00 10.00 H new ATOM 0 HB VAL A 11 9.027 -7.295 -8.925 1.00 10.00 H new ATOM 0 HG11 VAL A 11 10.723 -8.925 -8.182 1.00 10.00 H new ATOM 0 HG12 VAL A 11 11.303 -7.248 -8.039 1.00 10.00 H new ATOM 0 HG13 VAL A 11 10.777 -8.135 -6.588 1.00 10.00 H new ATOM 0 HG21 VAL A 11 8.347 -9.466 -7.858 1.00 10.00 H new ATOM 0 HG22 VAL A 11 8.304 -8.655 -6.274 1.00 10.00 H new ATOM 0 HG23 VAL A 11 7.152 -8.184 -7.546 1.00 10.00 H new ATOM 181 N GLN A 12 9.689 -4.211 -8.458 1.00 10.00 N ATOM 182 CA GLN A 12 10.614 -3.195 -8.946 1.00 10.00 C ATOM 183 C GLN A 12 10.372 -1.848 -8.266 1.00 10.00 C ATOM 184 O GLN A 12 11.129 -0.904 -8.492 1.00 10.00 O ATOM 185 CB GLN A 12 10.465 -3.079 -10.464 1.00 10.00 C ATOM 186 CG GLN A 12 10.917 -4.372 -11.164 1.00 10.00 C ATOM 187 CD GLN A 12 12.426 -4.440 -11.353 1.00 10.00 C ATOM 188 OE1 GLN A 12 12.949 -3.984 -12.363 1.00 10.00 O ATOM 189 NE2 GLN A 12 13.140 -5.025 -10.395 1.00 10.00 N ATOM 0 H GLN A 12 8.794 -4.204 -8.946 1.00 10.00 H new ATOM 0 HA GLN A 12 11.634 -3.493 -8.702 1.00 10.00 H new ATOM 0 HB2 GLN A 12 9.425 -2.870 -10.716 1.00 10.00 H new ATOM 0 HB3 GLN A 12 11.056 -2.239 -10.828 1.00 10.00 H new ATOM 0 HG2 GLN A 12 10.589 -5.231 -10.579 1.00 10.00 H new ATOM 0 HG3 GLN A 12 10.429 -4.444 -12.136 1.00 10.00 H new ATOM 0 HE21 GLN A 12 12.675 -5.395 -9.566 1.00 10.00 H new ATOM 0 HE22 GLN A 12 14.153 -5.104 -10.490 1.00 10.00 H new ATOM 198 N LYS A 13 9.307 -1.739 -7.468 1.00 10.00 N ATOM 199 CA LYS A 13 8.941 -0.528 -6.763 1.00 10.00 C ATOM 200 C LYS A 13 9.094 -0.695 -5.256 1.00 10.00 C ATOM 201 O LYS A 13 9.673 0.180 -4.616 1.00 10.00 O ATOM 202 CB LYS A 13 7.496 -0.145 -7.094 1.00 10.00 C ATOM 203 CG LYS A 13 7.264 0.252 -8.559 1.00 10.00 C ATOM 204 CD LYS A 13 8.213 1.324 -9.102 1.00 10.00 C ATOM 205 CE LYS A 13 8.317 2.554 -8.186 1.00 10.00 C ATOM 206 NZ LYS A 13 9.406 3.453 -8.612 1.00 10.00 N ATOM 0 H LYS A 13 8.666 -2.514 -7.296 1.00 10.00 H new ATOM 0 HA LYS A 13 9.614 0.265 -7.089 1.00 10.00 H new ATOM 0 HB2 LYS A 13 6.846 -0.985 -6.851 1.00 10.00 H new ATOM 0 HB3 LYS A 13 7.197 0.685 -6.454 1.00 10.00 H new ATOM 0 HG2 LYS A 13 7.356 -0.640 -9.179 1.00 10.00 H new ATOM 0 HG3 LYS A 13 6.240 0.609 -8.664 1.00 10.00 H new ATOM 0 HD2 LYS A 13 9.205 0.891 -9.233 1.00 10.00 H new ATOM 0 HD3 LYS A 13 7.870 1.640 -10.087 1.00 10.00 H new ATOM 0 HE2 LYS A 13 7.372 3.096 -8.194 1.00 10.00 H new ATOM 0 HE3 LYS A 13 8.490 2.231 -7.159 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 9.676 4.070 -7.820 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 10.228 2.888 -8.906 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 9.083 4.036 -9.410 1.00 10.00 H new ATOM 220 N CYS A 14 8.530 -1.768 -4.690 1.00 10.00 N ATOM 221 CA CYS A 14 8.484 -1.974 -3.250 1.00 10.00 C ATOM 222 C CYS A 14 9.343 -3.189 -2.875 1.00 10.00 C ATOM 223 O CYS A 14 10.462 -3.010 -2.403 1.00 10.00 O ATOM 224 CB CYS A 14 7.053 -2.001 -2.719 1.00 10.00 C ATOM 225 SG CYS A 14 5.714 -1.881 -3.976 1.00 10.00 S ATOM 0 H CYS A 14 8.093 -2.517 -5.226 1.00 10.00 H new ATOM 0 HA CYS A 14 8.927 -1.118 -2.741 1.00 10.00 H new ATOM 0 HB2 CYS A 14 6.914 -2.925 -2.158 1.00 10.00 H new ATOM 0 HB3 CYS A 14 6.934 -1.179 -2.013 1.00 10.00 H new ATOM 0 HG CYS A 14 5.074 -3.011 -4.037 1.00 10.00 H new ATOM 230 N ALA A 15 8.843 -4.411 -3.095 1.00 10.00 N ATOM 231 CA ALA A 15 9.455 -5.698 -2.728 1.00 10.00 C ATOM 232 C ALA A 15 10.186 -5.756 -1.382 1.00 10.00 C ATOM 233 O ALA A 15 9.688 -6.336 -0.423 1.00 10.00 O ATOM 234 CB ALA A 15 10.365 -6.214 -3.849 1.00 10.00 C ATOM 0 H ALA A 15 7.945 -4.538 -3.563 1.00 10.00 H new ATOM 0 HA ALA A 15 8.596 -6.355 -2.594 1.00 10.00 H new ATOM 0 HB1 ALA A 15 10.804 -7.166 -3.552 1.00 10.00 H new ATOM 0 HB2 ALA A 15 9.780 -6.352 -4.758 1.00 10.00 H new ATOM 0 HB3 ALA A 15 11.159 -5.491 -4.035 1.00 10.00 H new ATOM 240 N GLN A 16 11.382 -5.180 -1.264 1.00 10.00 N ATOM 241 CA GLN A 16 12.140 -5.179 -0.019 1.00 10.00 C ATOM 242 C GLN A 16 11.571 -4.131 0.954 1.00 10.00 C ATOM 243 O GLN A 16 12.310 -3.442 1.652 1.00 10.00 O ATOM 244 CB GLN A 16 13.645 -5.016 -0.317 1.00 10.00 C ATOM 245 CG GLN A 16 14.394 -6.358 -0.443 1.00 10.00 C ATOM 246 CD GLN A 16 15.713 -6.316 0.327 1.00 10.00 C ATOM 247 OE1 GLN A 16 16.748 -5.949 -0.216 1.00 10.00 O ATOM 248 NE2 GLN A 16 15.686 -6.675 1.609 1.00 10.00 N ATOM 0 H GLN A 16 11.851 -4.701 -2.032 1.00 10.00 H new ATOM 0 HA GLN A 16 12.035 -6.138 0.488 1.00 10.00 H new ATOM 0 HB2 GLN A 16 13.765 -4.453 -1.243 1.00 10.00 H new ATOM 0 HB3 GLN A 16 14.103 -4.426 0.477 1.00 10.00 H new ATOM 0 HG2 GLN A 16 13.770 -7.166 -0.061 1.00 10.00 H new ATOM 0 HG3 GLN A 16 14.587 -6.575 -1.494 1.00 10.00 H new ATOM 0 HE21 GLN A 16 14.810 -6.977 2.036 1.00 10.00 H new ATOM 0 HE22 GLN A 16 16.541 -6.648 2.164 1.00 10.00 H new ATOM 257 N CYS A 17 10.243 -4.086 1.082 1.00 10.00 N ATOM 258 CA CYS A 17 9.540 -3.347 2.115 1.00 10.00 C ATOM 259 C CYS A 17 8.208 -4.039 2.401 1.00 10.00 C ATOM 260 O CYS A 17 7.928 -4.331 3.563 1.00 10.00 O ATOM 261 CB CYS A 17 9.372 -1.881 1.774 1.00 10.00 C ATOM 262 SG CYS A 17 8.841 -1.061 3.308 1.00 10.00 S ATOM 0 H CYS A 17 9.615 -4.580 0.448 1.00 10.00 H new ATOM 0 HA CYS A 17 10.143 -3.354 3.023 1.00 10.00 H new ATOM 0 HB2 CYS A 17 10.307 -1.456 1.409 1.00 10.00 H new ATOM 0 HB3 CYS A 17 8.632 -1.747 0.985 1.00 10.00 H new ATOM 0 HG CYS A 17 8.679 0.210 3.087 1.00 10.00 H new ATOM 267 N HIS A 18 7.422 -4.347 1.358 1.00 10.00 N ATOM 268 CA HIS A 18 6.147 -5.037 1.504 1.00 10.00 C ATOM 269 C HIS A 18 6.234 -6.431 0.926 1.00 10.00 C ATOM 270 O HIS A 18 7.005 -6.692 0.009 1.00 10.00 O ATOM 271 CB HIS A 18 5.042 -4.327 0.731 1.00 10.00 C ATOM 272 CG HIS A 18 4.403 -3.202 1.477 1.00 10.00 C ATOM 273 ND1 HIS A 18 3.376 -3.291 2.393 1.00 10.00 N ATOM 274 CD2 HIS A 18 4.486 -1.910 1.070 1.00 10.00 C ATOM 275 CE1 HIS A 18 2.840 -2.061 2.505 1.00 10.00 C ATOM 276 NE2 HIS A 18 3.506 -1.178 1.730 1.00 10.00 N ATOM 0 H HIS A 18 7.660 -4.121 0.392 1.00 10.00 H new ATOM 0 HA HIS A 18 5.923 -5.056 2.571 1.00 10.00 H new ATOM 0 HB2 HIS A 18 5.455 -3.942 -0.202 1.00 10.00 H new ATOM 0 HB3 HIS A 18 4.275 -5.054 0.464 1.00 10.00 H new ATOM 0 HD1 HIS A 18 3.079 -4.130 2.891 1.00 10.00 H new ATOM 0 HD2 HIS A 18 5.193 -1.517 0.355 1.00 10.00 H new ATOM 0 HE1 HIS A 18 1.994 -1.814 3.129 1.00 10.00 H new ATOM 284 N THR A 19 5.331 -7.277 1.400 1.00 10.00 N ATOM 285 CA THR A 19 5.205 -8.645 0.973 1.00 10.00 C ATOM 286 C THR A 19 3.722 -8.924 0.795 1.00 10.00 C ATOM 287 O THR A 19 2.905 -8.341 1.512 1.00 10.00 O ATOM 288 CB THR A 19 5.824 -9.522 2.060 1.00 10.00 C ATOM 289 OG1 THR A 19 7.142 -9.095 2.337 1.00 10.00 O ATOM 290 CG2 THR A 19 5.859 -10.959 1.573 1.00 10.00 C ATOM 0 H THR A 19 4.650 -7.014 2.113 1.00 10.00 H new ATOM 0 HA THR A 19 5.715 -8.849 0.032 1.00 10.00 H new ATOM 0 HB THR A 19 5.226 -9.445 2.968 1.00 10.00 H new ATOM 0 HG1 THR A 19 7.530 -9.662 3.036 1.00 10.00 H new ATOM 0 HG21 THR A 19 6.299 -11.593 2.342 1.00 10.00 H new ATOM 0 HG22 THR A 19 4.844 -11.296 1.362 1.00 10.00 H new ATOM 0 HG23 THR A 19 6.458 -11.021 0.665 1.00 10.00 H new ATOM 298 N VAL A 20 3.378 -9.793 -0.157 1.00 10.00 N ATOM 299 CA VAL A 20 2.006 -10.193 -0.407 1.00 10.00 C ATOM 300 C VAL A 20 1.934 -11.710 -0.579 1.00 10.00 C ATOM 301 O VAL A 20 1.507 -12.208 -1.615 1.00 10.00 O ATOM 302 CB VAL A 20 1.411 -9.427 -1.597 1.00 10.00 C ATOM 303 CG1 VAL A 20 1.200 -7.979 -1.184 1.00 10.00 C ATOM 304 CG2 VAL A 20 2.289 -9.456 -2.846 1.00 10.00 C ATOM 0 H VAL A 20 4.054 -10.238 -0.777 1.00 10.00 H new ATOM 0 HA VAL A 20 1.391 -9.931 0.454 1.00 10.00 H new ATOM 0 HB VAL A 20 0.475 -9.921 -1.857 1.00 10.00 H new ATOM 0 HG11 VAL A 20 0.777 -7.420 -2.019 1.00 10.00 H new ATOM 0 HG12 VAL A 20 0.515 -7.938 -0.337 1.00 10.00 H new ATOM 0 HG13 VAL A 20 2.156 -7.539 -0.900 1.00 10.00 H new ATOM 0 HG21 VAL A 20 1.804 -8.895 -3.645 1.00 10.00 H new ATOM 0 HG22 VAL A 20 3.256 -9.006 -2.621 1.00 10.00 H new ATOM 0 HG23 VAL A 20 2.434 -10.488 -3.165 1.00 10.00 H new ATOM 314 N GLU A 21 2.370 -12.437 0.449 1.00 10.00 N ATOM 315 CA GLU A 21 2.268 -13.881 0.515 1.00 10.00 C ATOM 316 C GLU A 21 2.183 -14.306 1.979 1.00 10.00 C ATOM 317 O GLU A 21 2.652 -13.596 2.877 1.00 10.00 O ATOM 318 CB GLU A 21 3.429 -14.554 -0.233 1.00 10.00 C ATOM 319 CG GLU A 21 4.806 -14.075 0.240 1.00 10.00 C ATOM 320 CD GLU A 21 5.932 -14.826 -0.458 1.00 10.00 C ATOM 321 OE1 GLU A 21 5.967 -16.065 -0.306 1.00 10.00 O ATOM 322 OE2 GLU A 21 6.735 -14.140 -1.126 1.00 10.00 O ATOM 0 H GLU A 21 2.811 -12.024 1.271 1.00 10.00 H new ATOM 0 HA GLU A 21 1.359 -14.211 0.012 1.00 10.00 H new ATOM 0 HB2 GLU A 21 3.361 -15.634 -0.101 1.00 10.00 H new ATOM 0 HB3 GLU A 21 3.329 -14.357 -1.300 1.00 10.00 H new ATOM 0 HG2 GLU A 21 4.906 -13.007 0.047 1.00 10.00 H new ATOM 0 HG3 GLU A 21 4.889 -14.213 1.318 1.00 10.00 H new ATOM 329 N LYS A 22 1.555 -15.457 2.223 1.00 10.00 N ATOM 330 CA LYS A 22 1.426 -16.020 3.555 1.00 10.00 C ATOM 331 C LYS A 22 2.827 -16.289 4.112 1.00 10.00 C ATOM 332 O LYS A 22 3.672 -16.846 3.418 1.00 10.00 O ATOM 333 CB LYS A 22 0.579 -17.310 3.491 1.00 10.00 C ATOM 334 CG LYS A 22 -0.623 -17.282 4.444 1.00 10.00 C ATOM 335 CD LYS A 22 -0.210 -17.575 5.891 1.00 10.00 C ATOM 336 CE LYS A 22 -1.353 -17.214 6.853 1.00 10.00 C ATOM 337 NZ LYS A 22 -0.905 -17.197 8.261 1.00 10.00 N ATOM 0 H LYS A 22 1.121 -16.023 1.494 1.00 10.00 H new ATOM 0 HA LYS A 22 0.917 -15.323 4.221 1.00 10.00 H new ATOM 0 HB2 LYS A 22 0.224 -17.456 2.471 1.00 10.00 H new ATOM 0 HB3 LYS A 22 1.209 -18.165 3.734 1.00 10.00 H new ATOM 0 HG2 LYS A 22 -1.104 -16.305 4.394 1.00 10.00 H new ATOM 0 HG3 LYS A 22 -1.360 -18.017 4.121 1.00 10.00 H new ATOM 0 HD2 LYS A 22 0.045 -18.629 5.998 1.00 10.00 H new ATOM 0 HD3 LYS A 22 0.683 -17.004 6.145 1.00 10.00 H new ATOM 0 HE2 LYS A 22 -1.755 -16.236 6.588 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -2.164 -17.933 6.739 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -1.705 -16.949 8.877 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -0.545 -18.137 8.522 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 -0.149 -16.493 8.376 1.00 10.00 H new ATOM 351 N GLY A 23 3.084 -15.874 5.356 1.00 10.00 N ATOM 352 CA GLY A 23 4.407 -15.971 5.959 1.00 10.00 C ATOM 353 C GLY A 23 5.193 -14.668 5.805 1.00 10.00 C ATOM 354 O GLY A 23 6.170 -14.461 6.525 1.00 10.00 O ATOM 0 H GLY A 23 2.379 -15.463 5.968 1.00 10.00 H new ATOM 0 HA2 GLY A 23 4.308 -16.214 7.017 1.00 10.00 H new ATOM 0 HA3 GLY A 23 4.960 -16.787 5.495 1.00 10.00 H new ATOM 358 N GLY A 24 4.770 -13.778 4.896 1.00 10.00 N ATOM 359 CA GLY A 24 5.374 -12.468 4.736 1.00 10.00 C ATOM 360 C GLY A 24 5.453 -11.727 6.069 1.00 10.00 C ATOM 361 O GLY A 24 4.428 -11.461 6.693 1.00 10.00 O ATOM 0 H GLY A 24 3.997 -13.956 4.255 1.00 10.00 H new ATOM 0 HA2 GLY A 24 6.375 -12.575 4.317 1.00 10.00 H new ATOM 0 HA3 GLY A 24 4.792 -11.881 4.025 1.00 10.00 H new ATOM 365 N LYS A 25 6.674 -11.410 6.505 1.00 10.00 N ATOM 366 CA LYS A 25 6.911 -10.677 7.739 1.00 10.00 C ATOM 367 C LYS A 25 6.716 -9.178 7.495 1.00 10.00 C ATOM 368 O LYS A 25 6.504 -8.746 6.363 1.00 10.00 O ATOM 369 CB LYS A 25 8.326 -10.970 8.263 1.00 10.00 C ATOM 370 CG LYS A 25 8.643 -12.472 8.309 1.00 10.00 C ATOM 371 CD LYS A 25 10.012 -12.685 8.972 1.00 10.00 C ATOM 372 CE LYS A 25 10.544 -14.102 8.702 1.00 10.00 C ATOM 373 NZ LYS A 25 11.990 -14.215 8.989 1.00 10.00 N ATOM 0 H LYS A 25 7.528 -11.659 6.005 1.00 10.00 H new ATOM 0 HA LYS A 25 6.196 -11.000 8.496 1.00 10.00 H new ATOM 0 HB2 LYS A 25 9.055 -10.468 7.627 1.00 10.00 H new ATOM 0 HB3 LYS A 25 8.433 -10.550 9.263 1.00 10.00 H new ATOM 0 HG2 LYS A 25 7.870 -13.001 8.867 1.00 10.00 H new ATOM 0 HG3 LYS A 25 8.647 -12.885 7.300 1.00 10.00 H new ATOM 0 HD2 LYS A 25 10.721 -11.949 8.593 1.00 10.00 H new ATOM 0 HD3 LYS A 25 9.928 -12.523 10.047 1.00 10.00 H new ATOM 0 HE2 LYS A 25 9.996 -14.818 9.315 1.00 10.00 H new ATOM 0 HE3 LYS A 25 10.359 -14.366 7.661 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 12.308 -15.186 8.794 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 12.516 -13.551 8.387 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 12.164 -13.988 9.989 1.00 10.00 H new ATOM 387 N HIS A 26 6.836 -8.391 8.565 1.00 10.00 N ATOM 388 CA HIS A 26 6.650 -6.949 8.570 1.00 10.00 C ATOM 389 C HIS A 26 7.954 -6.286 9.025 1.00 10.00 C ATOM 390 O HIS A 26 8.283 -6.327 10.209 1.00 10.00 O ATOM 391 CB HIS A 26 5.446 -6.614 9.467 1.00 10.00 C ATOM 392 CG HIS A 26 5.376 -7.362 10.778 1.00 10.00 C ATOM 393 ND1 HIS A 26 6.376 -7.450 11.718 1.00 10.00 N ATOM 394 CD2 HIS A 26 4.352 -8.175 11.190 1.00 10.00 C ATOM 395 CE1 HIS A 26 5.964 -8.299 12.675 1.00 10.00 C ATOM 396 NE2 HIS A 26 4.743 -8.778 12.389 1.00 10.00 N ATOM 0 H HIS A 26 7.075 -8.760 9.485 1.00 10.00 H new ATOM 0 HA HIS A 26 6.427 -6.562 7.576 1.00 10.00 H new ATOM 0 HB2 HIS A 26 5.462 -5.545 9.680 1.00 10.00 H new ATOM 0 HB3 HIS A 26 4.533 -6.814 8.907 1.00 10.00 H new ATOM 0 HD1 HIS A 26 7.270 -6.959 11.693 1.00 10.00 H new ATOM 0 HD2 HIS A 26 3.412 -8.323 10.680 1.00 10.00 H new ATOM 0 HE1 HIS A 26 6.536 -8.560 13.553 1.00 10.00 H new ATOM 404 N LYS A 27 8.726 -5.721 8.089 1.00 10.00 N ATOM 405 CA LYS A 27 9.964 -5.021 8.424 1.00 10.00 C ATOM 406 C LYS A 27 9.663 -3.548 8.713 1.00 10.00 C ATOM 407 O LYS A 27 9.815 -3.095 9.844 1.00 10.00 O ATOM 408 CB LYS A 27 11.032 -5.204 7.329 1.00 10.00 C ATOM 409 CG LYS A 27 11.640 -6.618 7.353 1.00 10.00 C ATOM 410 CD LYS A 27 11.030 -7.599 6.340 1.00 10.00 C ATOM 411 CE LYS A 27 11.786 -7.665 5.002 1.00 10.00 C ATOM 412 NZ LYS A 27 11.543 -6.492 4.134 1.00 10.00 N ATOM 0 H LYS A 27 8.511 -5.737 7.092 1.00 10.00 H new ATOM 0 HA LYS A 27 10.386 -5.459 9.328 1.00 10.00 H new ATOM 0 HB2 LYS A 27 10.586 -5.017 6.352 1.00 10.00 H new ATOM 0 HB3 LYS A 27 11.823 -4.466 7.466 1.00 10.00 H new ATOM 0 HG2 LYS A 27 12.711 -6.541 7.164 1.00 10.00 H new ATOM 0 HG3 LYS A 27 11.522 -7.032 8.354 1.00 10.00 H new ATOM 0 HD2 LYS A 27 11.007 -8.595 6.782 1.00 10.00 H new ATOM 0 HD3 LYS A 27 9.996 -7.311 6.148 1.00 10.00 H new ATOM 0 HE2 LYS A 27 12.855 -7.746 5.200 1.00 10.00 H new ATOM 0 HE3 LYS A 27 11.491 -8.569 4.470 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 12.080 -6.597 3.250 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 10.528 -6.425 3.917 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 11.850 -5.628 4.624 1.00 10.00 H new ATOM 426 N THR A 28 9.234 -2.809 7.689 1.00 10.00 N ATOM 427 CA THR A 28 8.862 -1.404 7.807 1.00 10.00 C ATOM 428 C THR A 28 7.344 -1.251 7.745 1.00 10.00 C ATOM 429 O THR A 28 6.786 -0.485 8.526 1.00 10.00 O ATOM 430 CB THR A 28 9.611 -0.583 6.755 1.00 10.00 C ATOM 431 OG1 THR A 28 10.986 -0.567 7.075 1.00 10.00 O ATOM 432 CG2 THR A 28 9.104 0.858 6.656 1.00 10.00 C ATOM 0 H THR A 28 9.135 -3.177 6.743 1.00 10.00 H new ATOM 0 HA THR A 28 9.162 -1.011 8.779 1.00 10.00 H new ATOM 0 HB THR A 28 9.437 -1.056 5.789 1.00 10.00 H new ATOM 0 HG1 THR A 28 11.472 -0.044 6.404 1.00 10.00 H new ATOM 0 HG21 THR A 28 9.672 1.392 5.894 1.00 10.00 H new ATOM 0 HG22 THR A 28 8.048 0.854 6.385 1.00 10.00 H new ATOM 0 HG23 THR A 28 9.230 1.355 7.618 1.00 10.00 H new ATOM 440 N GLY A 29 6.679 -1.956 6.825 1.00 10.00 N ATOM 441 CA GLY A 29 5.229 -1.964 6.707 1.00 10.00 C ATOM 442 C GLY A 29 4.724 -3.394 6.764 1.00 10.00 C ATOM 443 O GLY A 29 5.530 -4.320 6.645 1.00 10.00 O ATOM 0 H GLY A 29 7.145 -2.544 6.134 1.00 10.00 H new ATOM 0 HA2 GLY A 29 4.785 -1.378 7.512 1.00 10.00 H new ATOM 0 HA3 GLY A 29 4.927 -1.498 5.769 1.00 10.00 H new ATOM 447 N PRO A 30 3.415 -3.589 6.972 1.00 10.00 N ATOM 448 CA PRO A 30 2.870 -4.918 7.049 1.00 10.00 C ATOM 449 C PRO A 30 2.864 -5.609 5.696 1.00 10.00 C ATOM 450 O PRO A 30 2.979 -4.994 4.630 1.00 10.00 O ATOM 451 CB PRO A 30 1.482 -4.791 7.684 1.00 10.00 C ATOM 452 CG PRO A 30 1.096 -3.319 7.520 1.00 10.00 C ATOM 453 CD PRO A 30 2.400 -2.574 7.216 1.00 10.00 C ATOM 0 HA PRO A 30 3.492 -5.564 7.669 1.00 10.00 H new ATOM 0 HB2 PRO A 30 0.762 -5.444 7.190 1.00 10.00 H new ATOM 0 HB3 PRO A 30 1.503 -5.077 8.735 1.00 10.00 H new ATOM 0 HG2 PRO A 30 0.376 -3.192 6.712 1.00 10.00 H new ATOM 0 HG3 PRO A 30 0.629 -2.934 8.427 1.00 10.00 H new ATOM 0 HD2 PRO A 30 2.283 -1.927 6.346 1.00 10.00 H new ATOM 0 HD3 PRO A 30 2.685 -1.935 8.052 1.00 10.00 H new ATOM 461 N ASN A 31 2.734 -6.932 5.772 1.00 10.00 N ATOM 462 CA ASN A 31 2.444 -7.733 4.613 1.00 10.00 C ATOM 463 C ASN A 31 1.093 -7.267 4.087 1.00 10.00 C ATOM 464 O ASN A 31 0.077 -7.361 4.767 1.00 10.00 O ATOM 465 CB ASN A 31 2.492 -9.234 4.935 1.00 10.00 C ATOM 466 CG ASN A 31 1.576 -9.674 6.079 1.00 10.00 C ATOM 467 OD1 ASN A 31 1.370 -8.944 7.045 1.00 10.00 O ATOM 468 ND2 ASN A 31 1.053 -10.895 6.003 1.00 10.00 N ATOM 0 H ASN A 31 2.828 -7.464 6.637 1.00 10.00 H new ATOM 0 HA ASN A 31 3.200 -7.601 3.839 1.00 10.00 H new ATOM 0 HB2 ASN A 31 2.224 -9.792 4.038 1.00 10.00 H new ATOM 0 HB3 ASN A 31 3.518 -9.505 5.185 1.00 10.00 H new ATOM 0 HD21 ASN A 31 0.465 -11.246 6.759 1.00 10.00 H new ATOM 0 HD22 ASN A 31 1.240 -11.480 5.189 1.00 10.00 H new ATOM 475 N LEU A 32 1.108 -6.749 2.863 1.00 10.00 N ATOM 476 CA LEU A 32 -0.071 -6.297 2.145 1.00 10.00 C ATOM 477 C LEU A 32 -1.031 -7.490 1.952 1.00 10.00 C ATOM 478 O LEU A 32 -2.210 -7.300 1.676 1.00 10.00 O ATOM 479 CB LEU A 32 0.403 -5.684 0.814 1.00 10.00 C ATOM 480 CG LEU A 32 0.313 -4.168 0.625 1.00 10.00 C ATOM 481 CD1 LEU A 32 1.197 -3.811 -0.576 1.00 10.00 C ATOM 482 CD2 LEU A 32 -1.119 -3.774 0.362 1.00 10.00 C ATOM 0 H LEU A 32 1.969 -6.630 2.330 1.00 10.00 H new ATOM 0 HA LEU A 32 -0.623 -5.535 2.695 1.00 10.00 H new ATOM 0 HB2 LEU A 32 1.444 -5.973 0.670 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -0.171 -6.151 0.013 1.00 10.00 H new ATOM 0 HG LEU A 32 0.649 -3.637 1.516 1.00 10.00 H new ATOM 0 HD11 LEU A 32 1.162 -2.735 -0.747 1.00 10.00 H new ATOM 0 HD12 LEU A 32 2.225 -4.113 -0.374 1.00 10.00 H new ATOM 0 HD13 LEU A 32 0.834 -4.331 -1.462 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -1.180 -2.694 0.228 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -1.474 -4.273 -0.540 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -1.739 -4.070 1.208 1.00 10.00 H new ATOM 494 N HIS A 33 -0.542 -8.730 2.098 1.00 10.00 N ATOM 495 CA HIS A 33 -1.351 -9.941 2.163 1.00 10.00 C ATOM 496 C HIS A 33 -2.546 -9.766 3.121 1.00 10.00 C ATOM 497 O HIS A 33 -2.371 -9.781 4.337 1.00 10.00 O ATOM 498 CB HIS A 33 -0.448 -11.118 2.561 1.00 10.00 C ATOM 499 CG HIS A 33 -1.123 -12.457 2.494 1.00 10.00 C ATOM 500 ND1 HIS A 33 -1.340 -13.234 1.373 1.00 10.00 N ATOM 501 CD2 HIS A 33 -1.544 -13.160 3.585 1.00 10.00 C ATOM 502 CE1 HIS A 33 -1.911 -14.378 1.795 1.00 10.00 C ATOM 503 NE2 HIS A 33 -2.052 -14.379 3.134 1.00 10.00 N ATOM 0 H HIS A 33 0.458 -8.916 2.176 1.00 10.00 H new ATOM 0 HA HIS A 33 -1.782 -10.149 1.184 1.00 10.00 H new ATOM 0 HB2 HIS A 33 0.425 -11.130 1.908 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -0.085 -10.956 3.576 1.00 10.00 H new ATOM 0 HD1 HIS A 33 -1.111 -12.988 0.410 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -1.493 -12.832 4.613 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -2.215 -15.186 1.146 1.00 10.00 H new ATOM 511 N GLY A 34 -3.757 -9.602 2.570 1.00 10.00 N ATOM 512 CA GLY A 34 -4.994 -9.376 3.320 1.00 10.00 C ATOM 513 C GLY A 34 -5.455 -7.910 3.337 1.00 10.00 C ATOM 514 O GLY A 34 -6.392 -7.568 4.059 1.00 10.00 O ATOM 0 H GLY A 34 -3.904 -9.624 1.561 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -5.785 -9.990 2.890 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -4.851 -9.713 4.347 1.00 10.00 H new ATOM 518 N LEU A 35 -4.828 -7.051 2.528 1.00 10.00 N ATOM 519 CA LEU A 35 -5.169 -5.642 2.350 1.00 10.00 C ATOM 520 C LEU A 35 -6.631 -5.471 1.932 1.00 10.00 C ATOM 521 O LEU A 35 -7.399 -4.777 2.600 1.00 10.00 O ATOM 522 CB LEU A 35 -4.215 -5.076 1.286 1.00 10.00 C ATOM 523 CG LEU A 35 -4.566 -3.697 0.693 1.00 10.00 C ATOM 524 CD1 LEU A 35 -4.204 -2.535 1.622 1.00 10.00 C ATOM 525 CD2 LEU A 35 -4.072 -3.538 -0.742 1.00 10.00 C ATOM 0 H LEU A 35 -4.033 -7.335 1.955 1.00 10.00 H new ATOM 0 HA LEU A 35 -5.056 -5.102 3.290 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -3.219 -5.013 1.724 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -4.158 -5.793 0.467 1.00 10.00 H new ATOM 0 HG LEU A 35 -5.653 -3.654 0.623 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -4.476 -1.592 1.148 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -4.746 -2.638 2.562 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -3.132 -2.547 1.819 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -4.344 -2.550 -1.113 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -2.988 -3.649 -0.768 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -4.530 -4.301 -1.371 1.00 10.00 H new ATOM 537 N PHE A 36 -6.999 -6.060 0.789 1.00 10.00 N ATOM 538 CA PHE A 36 -8.310 -5.881 0.180 1.00 10.00 C ATOM 539 C PHE A 36 -9.400 -6.595 0.974 1.00 10.00 C ATOM 540 O PHE A 36 -9.913 -7.631 0.558 1.00 10.00 O ATOM 541 CB PHE A 36 -8.292 -6.343 -1.284 1.00 10.00 C ATOM 542 CG PHE A 36 -7.396 -5.553 -2.222 1.00 10.00 C ATOM 543 CD1 PHE A 36 -7.381 -4.146 -2.181 1.00 10.00 C ATOM 544 CD2 PHE A 36 -6.753 -6.213 -3.284 1.00 10.00 C ATOM 545 CE1 PHE A 36 -6.692 -3.413 -3.159 1.00 10.00 C ATOM 546 CE2 PHE A 36 -6.058 -5.474 -4.256 1.00 10.00 C ATOM 547 CZ PHE A 36 -5.992 -4.078 -4.173 1.00 10.00 C ATOM 0 H PHE A 36 -6.385 -6.679 0.260 1.00 10.00 H new ATOM 0 HA PHE A 36 -8.546 -4.817 0.198 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -7.981 -7.387 -1.311 1.00 10.00 H new ATOM 0 HB3 PHE A 36 -9.311 -6.304 -1.669 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -7.904 -3.627 -1.391 1.00 10.00 H new ATOM 0 HD2 PHE A 36 -6.793 -7.290 -3.353 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -6.702 -2.333 -3.130 1.00 10.00 H new ATOM 0 HE2 PHE A 36 -5.571 -5.986 -5.073 1.00 10.00 H new ATOM 0 HZ PHE A 36 -5.405 -3.518 -4.886 1.00 10.00 H new ATOM 557 N GLY A 37 -9.778 -5.997 2.101 1.00 10.00 N ATOM 558 CA GLY A 37 -10.898 -6.415 2.925 1.00 10.00 C ATOM 559 C GLY A 37 -10.667 -5.985 4.367 1.00 10.00 C ATOM 560 O GLY A 37 -10.849 -6.778 5.290 1.00 10.00 O ATOM 0 H GLY A 37 -9.293 -5.181 2.474 1.00 10.00 H new ATOM 0 HA2 GLY A 37 -11.822 -5.976 2.549 1.00 10.00 H new ATOM 0 HA3 GLY A 37 -11.015 -7.497 2.873 1.00 10.00 H new ATOM 564 N ARG A 38 -10.244 -4.732 4.564 1.00 10.00 N ATOM 565 CA ARG A 38 -9.923 -4.167 5.862 1.00 10.00 C ATOM 566 C ARG A 38 -9.857 -2.646 5.695 1.00 10.00 C ATOM 567 O ARG A 38 -9.985 -2.147 4.575 1.00 10.00 O ATOM 568 CB ARG A 38 -8.602 -4.774 6.371 1.00 10.00 C ATOM 569 CG ARG A 38 -8.439 -4.704 7.898 1.00 10.00 C ATOM 570 CD ARG A 38 -7.890 -6.001 8.520 1.00 10.00 C ATOM 571 NE ARG A 38 -8.963 -6.879 9.031 1.00 10.00 N ATOM 572 CZ ARG A 38 -9.598 -7.860 8.365 1.00 10.00 C ATOM 573 NH1 ARG A 38 -9.252 -8.168 7.114 1.00 10.00 N ATOM 574 NH2 ARG A 38 -10.588 -8.535 8.964 1.00 10.00 N ATOM 0 H ARG A 38 -10.115 -4.071 3.798 1.00 10.00 H new ATOM 0 HA ARG A 38 -10.680 -4.401 6.611 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -8.546 -5.816 6.056 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -7.768 -4.253 5.901 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -7.769 -3.880 8.146 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -9.405 -4.476 8.348 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -7.308 -6.541 7.773 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -7.210 -5.751 9.335 1.00 10.00 H new ATOM 0 HE ARG A 38 -9.255 -6.724 9.996 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -8.499 -7.658 6.653 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -9.741 -8.914 6.619 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -10.857 -8.304 9.920 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -11.073 -9.280 8.464 1.00 10.00 H new ATOM 588 N LYS A 39 -9.699 -1.919 6.802 1.00 10.00 N ATOM 589 CA LYS A 39 -9.577 -0.469 6.838 1.00 10.00 C ATOM 590 C LYS A 39 -8.097 -0.105 7.005 1.00 10.00 C ATOM 591 O LYS A 39 -7.260 -0.991 7.160 1.00 10.00 O ATOM 592 CB LYS A 39 -10.454 0.038 7.996 1.00 10.00 C ATOM 593 CG LYS A 39 -11.140 1.387 7.729 1.00 10.00 C ATOM 594 CD LYS A 39 -12.572 1.369 8.277 1.00 10.00 C ATOM 595 CE LYS A 39 -13.526 0.777 7.223 1.00 10.00 C ATOM 596 NZ LYS A 39 -14.784 0.269 7.808 1.00 10.00 N ATOM 0 H LYS A 39 -9.651 -2.343 7.729 1.00 10.00 H new ATOM 0 HA LYS A 39 -9.920 0.003 5.917 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -11.219 -0.709 8.210 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -9.837 0.128 8.890 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -10.573 2.191 8.198 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -11.155 1.590 6.658 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -12.614 0.778 9.192 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -12.885 2.380 8.537 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -13.759 1.541 6.481 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -13.021 -0.034 6.698 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 -15.387 -0.117 7.053 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -14.569 -0.480 8.497 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -15.283 1.046 8.286 1.00 10.00 H new ATOM 610 N THR A 40 -7.762 1.186 6.985 1.00 10.00 N ATOM 611 CA THR A 40 -6.391 1.642 7.184 1.00 10.00 C ATOM 612 C THR A 40 -5.855 1.188 8.532 1.00 10.00 C ATOM 613 O THR A 40 -4.953 0.364 8.602 1.00 10.00 O ATOM 614 CB THR A 40 -6.316 3.166 7.079 1.00 10.00 C ATOM 615 OG1 THR A 40 -7.188 3.787 8.008 1.00 10.00 O ATOM 616 CG2 THR A 40 -6.757 3.603 5.697 1.00 10.00 C ATOM 0 H THR A 40 -8.432 1.940 6.831 1.00 10.00 H new ATOM 0 HA THR A 40 -5.773 1.200 6.402 1.00 10.00 H new ATOM 0 HB THR A 40 -5.285 3.457 7.282 1.00 10.00 H new ATOM 0 HG1 THR A 40 -6.802 4.639 8.300 1.00 10.00 H new ATOM 0 HG21 THR A 40 -6.703 4.689 5.624 1.00 10.00 H new ATOM 0 HG22 THR A 40 -6.103 3.156 4.948 1.00 10.00 H new ATOM 0 HG23 THR A 40 -7.783 3.278 5.523 1.00 10.00 H new ATOM 624 N GLY A 41 -6.406 1.754 9.604 1.00 10.00 N ATOM 625 CA GLY A 41 -5.941 1.591 10.971 1.00 10.00 C ATOM 626 C GLY A 41 -6.274 0.227 11.571 1.00 10.00 C ATOM 627 O GLY A 41 -6.789 0.163 12.687 1.00 10.00 O ATOM 0 H GLY A 41 -7.222 2.363 9.536 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -4.861 1.737 10.999 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -6.384 2.370 11.592 1.00 10.00 H new ATOM 631 N GLN A 42 -6.002 -0.847 10.833 1.00 10.00 N ATOM 632 CA GLN A 42 -6.274 -2.232 11.177 1.00 10.00 C ATOM 633 C GLN A 42 -5.200 -3.091 10.496 1.00 10.00 C ATOM 634 O GLN A 42 -5.274 -3.314 9.291 1.00 10.00 O ATOM 635 CB GLN A 42 -7.670 -2.612 10.654 1.00 10.00 C ATOM 636 CG GLN A 42 -8.844 -1.982 11.412 1.00 10.00 C ATOM 637 CD GLN A 42 -8.919 -2.464 12.858 1.00 10.00 C ATOM 638 OE1 GLN A 42 -9.311 -3.596 13.115 1.00 10.00 O ATOM 639 NE2 GLN A 42 -8.547 -1.619 13.812 1.00 10.00 N ATOM 0 H GLN A 42 -5.556 -0.762 9.919 1.00 10.00 H new ATOM 0 HA GLN A 42 -6.252 -2.387 12.256 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -7.739 -2.323 9.605 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -7.773 -3.696 10.694 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -8.744 -0.897 11.397 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -9.776 -2.223 10.901 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -8.225 -0.683 13.567 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -8.583 -1.906 14.790 1.00 10.00 H new ATOM 648 N ALA A 43 -4.189 -3.543 11.246 1.00 10.00 N ATOM 649 CA ALA A 43 -3.117 -4.403 10.750 1.00 10.00 C ATOM 650 C ALA A 43 -2.774 -5.424 11.832 1.00 10.00 C ATOM 651 O ALA A 43 -2.959 -5.128 13.013 1.00 10.00 O ATOM 652 CB ALA A 43 -1.872 -3.578 10.414 1.00 10.00 C ATOM 0 H ALA A 43 -4.094 -3.314 12.236 1.00 10.00 H new ATOM 0 HA ALA A 43 -3.450 -4.906 9.842 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -1.086 -4.238 10.047 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -2.118 -2.844 9.646 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -1.524 -3.063 11.310 1.00 10.00 H new ATOM 658 N PRO A 44 -2.278 -6.610 11.453 1.00 10.00 N ATOM 659 CA PRO A 44 -1.935 -7.651 12.401 1.00 10.00 C ATOM 660 C PRO A 44 -0.662 -7.268 13.163 1.00 10.00 C ATOM 661 O PRO A 44 0.433 -7.368 12.617 1.00 10.00 O ATOM 662 CB PRO A 44 -1.762 -8.920 11.558 1.00 10.00 C ATOM 663 CG PRO A 44 -1.345 -8.402 10.180 1.00 10.00 C ATOM 664 CD PRO A 44 -2.038 -7.043 10.082 1.00 10.00 C ATOM 0 HA PRO A 44 -2.698 -7.803 13.164 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -1.004 -9.579 11.982 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -2.688 -9.492 11.505 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -0.262 -8.307 10.098 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -1.667 -9.074 9.385 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -1.414 -6.325 9.550 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -2.974 -7.122 9.529 1.00 10.00 H new ATOM 672 N GLY A 45 -0.814 -6.839 14.422 1.00 10.00 N ATOM 673 CA GLY A 45 0.283 -6.604 15.356 1.00 10.00 C ATOM 674 C GLY A 45 1.391 -5.745 14.751 1.00 10.00 C ATOM 675 O GLY A 45 2.541 -6.169 14.665 1.00 10.00 O ATOM 0 H GLY A 45 -1.730 -6.642 14.825 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -0.104 -6.116 16.250 1.00 10.00 H new ATOM 0 HA3 GLY A 45 0.700 -7.561 15.670 1.00 10.00 H new ATOM 679 N PHE A 46 1.022 -4.531 14.338 1.00 10.00 N ATOM 680 CA PHE A 46 1.900 -3.602 13.640 1.00 10.00 C ATOM 681 C PHE A 46 1.825 -2.228 14.313 1.00 10.00 C ATOM 682 O PHE A 46 2.838 -1.717 14.783 1.00 10.00 O ATOM 683 CB PHE A 46 1.484 -3.560 12.161 1.00 10.00 C ATOM 684 CG PHE A 46 2.050 -2.401 11.363 1.00 10.00 C ATOM 685 CD1 PHE A 46 3.423 -2.364 11.059 1.00 10.00 C ATOM 686 CD2 PHE A 46 1.232 -1.301 11.031 1.00 10.00 C ATOM 687 CE1 PHE A 46 3.988 -1.210 10.487 1.00 10.00 C ATOM 688 CE2 PHE A 46 1.798 -0.153 10.451 1.00 10.00 C ATOM 689 CZ PHE A 46 3.179 -0.095 10.209 1.00 10.00 C ATOM 0 H PHE A 46 0.082 -4.162 14.485 1.00 10.00 H new ATOM 0 HA PHE A 46 2.940 -3.925 13.689 1.00 10.00 H new ATOM 0 HB2 PHE A 46 1.793 -4.492 11.687 1.00 10.00 H new ATOM 0 HB3 PHE A 46 0.396 -3.520 12.107 1.00 10.00 H new ATOM 0 HD1 PHE A 46 4.044 -3.223 11.265 1.00 10.00 H new ATOM 0 HD2 PHE A 46 0.170 -1.341 11.223 1.00 10.00 H new ATOM 0 HE1 PHE A 46 5.044 -1.181 10.261 1.00 10.00 H new ATOM 0 HE2 PHE A 46 1.169 0.686 10.191 1.00 10.00 H new ATOM 0 HZ PHE A 46 3.620 0.806 9.809 1.00 10.00 H new ATOM 699 N THR A 47 0.610 -1.669 14.381 1.00 10.00 N ATOM 700 CA THR A 47 0.287 -0.360 14.941 1.00 10.00 C ATOM 701 C THR A 47 0.633 0.762 13.957 1.00 10.00 C ATOM 702 O THR A 47 1.764 0.870 13.496 1.00 10.00 O ATOM 703 CB THR A 47 0.890 -0.149 16.341 1.00 10.00 C ATOM 704 OG1 THR A 47 0.525 -1.249 17.153 1.00 10.00 O ATOM 705 CG2 THR A 47 0.360 1.130 16.998 1.00 10.00 C ATOM 0 H THR A 47 -0.217 -2.149 14.026 1.00 10.00 H new ATOM 0 HA THR A 47 -0.792 -0.325 15.090 1.00 10.00 H new ATOM 0 HB THR A 47 1.972 -0.062 16.240 1.00 10.00 H new ATOM 0 HG1 THR A 47 0.902 -1.133 18.050 1.00 10.00 H new ATOM 0 HG21 THR A 47 0.808 1.245 17.985 1.00 10.00 H new ATOM 0 HG22 THR A 47 0.618 1.990 16.380 1.00 10.00 H new ATOM 0 HG23 THR A 47 -0.724 1.066 17.097 1.00 10.00 H new ATOM 713 N TYR A 48 -0.366 1.584 13.624 1.00 10.00 N ATOM 714 CA TYR A 48 -0.249 2.673 12.670 1.00 10.00 C ATOM 715 C TYR A 48 0.004 3.982 13.398 1.00 10.00 C ATOM 716 O TYR A 48 -0.012 4.047 14.626 1.00 10.00 O ATOM 717 CB TYR A 48 -1.546 2.783 11.864 1.00 10.00 C ATOM 718 CG TYR A 48 -1.707 1.700 10.828 1.00 10.00 C ATOM 719 CD1 TYR A 48 -1.174 1.870 9.537 1.00 10.00 C ATOM 720 CD2 TYR A 48 -2.409 0.530 11.151 1.00 10.00 C ATOM 721 CE1 TYR A 48 -1.419 0.903 8.548 1.00 10.00 C ATOM 722 CE2 TYR A 48 -2.639 -0.435 10.162 1.00 10.00 C ATOM 723 CZ TYR A 48 -2.155 -0.247 8.857 1.00 10.00 C ATOM 724 OH TYR A 48 -2.496 -1.115 7.864 1.00 10.00 O ATOM 0 H TYR A 48 -1.300 1.502 14.025 1.00 10.00 H new ATOM 0 HA TYR A 48 0.587 2.471 12.000 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -2.393 2.748 12.549 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -1.575 3.754 11.370 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -0.578 2.741 9.307 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -2.770 0.374 12.157 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -1.039 1.047 7.547 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -3.193 -1.330 10.405 1.00 10.00 H new ATOM 0 HH TYR A 48 -3.443 -0.999 7.639 1.00 10.00 H new ATOM 734 N THR A 49 0.193 5.031 12.604 1.00 10.00 N ATOM 735 CA THR A 49 0.435 6.377 13.056 1.00 10.00 C ATOM 736 C THR A 49 -0.892 7.123 13.271 1.00 10.00 C ATOM 737 O THR A 49 -1.942 6.706 12.763 1.00 10.00 O ATOM 738 CB THR A 49 1.277 7.048 11.963 1.00 10.00 C ATOM 739 OG1 THR A 49 0.538 7.035 10.752 1.00 10.00 O ATOM 740 CG2 THR A 49 2.608 6.323 11.725 1.00 10.00 C ATOM 0 H THR A 49 0.179 4.952 11.587 1.00 10.00 H new ATOM 0 HA THR A 49 0.956 6.390 14.013 1.00 10.00 H new ATOM 0 HB THR A 49 1.500 8.063 12.290 1.00 10.00 H new ATOM 0 HG1 THR A 49 1.063 7.463 10.044 1.00 10.00 H new ATOM 0 HG21 THR A 49 3.167 6.836 10.943 1.00 10.00 H new ATOM 0 HG22 THR A 49 3.191 6.321 12.646 1.00 10.00 H new ATOM 0 HG23 THR A 49 2.413 5.296 11.417 1.00 10.00 H new ATOM 748 N ASP A 50 -0.832 8.263 13.969 1.00 10.00 N ATOM 749 CA ASP A 50 -1.964 9.140 14.273 1.00 10.00 C ATOM 750 C ASP A 50 -2.398 9.934 13.029 1.00 10.00 C ATOM 751 O ASP A 50 -2.496 11.158 13.053 1.00 10.00 O ATOM 752 CB ASP A 50 -1.587 10.076 15.440 1.00 10.00 C ATOM 753 CG ASP A 50 -1.707 9.413 16.807 1.00 10.00 C ATOM 754 OD1 ASP A 50 -1.382 8.210 16.892 1.00 10.00 O ATOM 755 OD2 ASP A 50 -2.131 10.125 17.742 1.00 10.00 O ATOM 0 H ASP A 50 0.046 8.613 14.353 1.00 10.00 H new ATOM 0 HA ASP A 50 -2.817 8.532 14.575 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -0.563 10.424 15.301 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -2.230 10.956 15.413 1.00 10.00 H new ATOM 760 N ALA A 51 -2.678 9.233 11.928 1.00 10.00 N ATOM 761 CA ALA A 51 -3.088 9.826 10.660 1.00 10.00 C ATOM 762 C ALA A 51 -3.573 8.737 9.709 1.00 10.00 C ATOM 763 O ALA A 51 -4.611 8.890 9.056 1.00 10.00 O ATOM 764 CB ALA A 51 -1.929 10.597 10.016 1.00 10.00 C ATOM 0 H ALA A 51 -2.624 8.215 11.896 1.00 10.00 H new ATOM 0 HA ALA A 51 -3.901 10.525 10.857 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -2.260 11.030 9.072 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -1.605 11.393 10.686 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -1.097 9.917 9.832 1.00 10.00 H new ATOM 770 N ASN A 52 -2.809 7.640 9.625 1.00 10.00 N ATOM 771 CA ASN A 52 -3.185 6.486 8.818 1.00 10.00 C ATOM 772 C ASN A 52 -4.515 5.932 9.320 1.00 10.00 C ATOM 773 O ASN A 52 -5.461 5.788 8.550 1.00 10.00 O ATOM 774 CB ASN A 52 -2.091 5.406 8.841 1.00 10.00 C ATOM 775 CG ASN A 52 -1.813 4.866 7.443 1.00 10.00 C ATOM 776 OD1 ASN A 52 -1.044 5.461 6.700 1.00 10.00 O ATOM 777 ND2 ASN A 52 -2.430 3.753 7.058 1.00 10.00 N ATOM 0 H ASN A 52 -1.920 7.534 10.113 1.00 10.00 H new ATOM 0 HA ASN A 52 -3.298 6.802 7.781 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -1.175 5.823 9.261 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -2.398 4.589 9.494 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -2.267 3.376 6.124 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -3.066 3.276 7.696 1.00 10.00 H new ATOM 784 N LYS A 53 -4.607 5.651 10.623 1.00 10.00 N ATOM 785 CA LYS A 53 -5.834 5.134 11.215 1.00 10.00 C ATOM 786 C LYS A 53 -6.953 6.158 11.101 1.00 10.00 C ATOM 787 O LYS A 53 -8.044 5.841 10.630 1.00 10.00 O ATOM 788 CB LYS A 53 -5.575 4.710 12.667 1.00 10.00 C ATOM 789 CG LYS A 53 -6.851 4.242 13.396 1.00 10.00 C ATOM 790 CD LYS A 53 -6.562 3.100 14.388 1.00 10.00 C ATOM 791 CE LYS A 53 -6.965 3.453 15.826 1.00 10.00 C ATOM 792 NZ LYS A 53 -6.492 2.435 16.789 1.00 10.00 N ATOM 0 H LYS A 53 -3.842 5.775 11.286 1.00 10.00 H new ATOM 0 HA LYS A 53 -6.158 4.249 10.668 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -4.841 3.905 12.679 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -5.139 5.547 13.212 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -7.293 5.083 13.930 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -7.586 3.909 12.663 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -7.099 2.205 14.073 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -5.499 2.860 14.361 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -6.552 4.426 16.092 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -8.050 3.539 15.890 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -6.782 2.705 17.750 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -6.906 1.512 16.549 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -5.455 2.371 16.745 1.00 10.00 H new ATOM 806 N ASN A 54 -6.647 7.393 11.500 1.00 10.00 N ATOM 807 CA ASN A 54 -7.581 8.512 11.506 1.00 10.00 C ATOM 808 C ASN A 54 -8.269 8.705 10.150 1.00 10.00 C ATOM 809 O ASN A 54 -9.345 9.288 10.075 1.00 10.00 O ATOM 810 CB ASN A 54 -6.841 9.790 11.934 1.00 10.00 C ATOM 811 CG ASN A 54 -7.713 10.657 12.832 1.00 10.00 C ATOM 812 OD1 ASN A 54 -8.237 11.681 12.409 1.00 10.00 O ATOM 813 ND2 ASN A 54 -7.858 10.251 14.091 1.00 10.00 N ATOM 0 H ASN A 54 -5.718 7.646 11.836 1.00 10.00 H new ATOM 0 HA ASN A 54 -8.371 8.290 12.223 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -5.924 9.524 12.460 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -6.548 10.357 11.050 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -8.421 10.798 14.742 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -7.406 9.393 14.405 1.00 10.00 H new ATOM 820 N LYS A 55 -7.646 8.216 9.073 1.00 10.00 N ATOM 821 CA LYS A 55 -8.202 8.248 7.732 1.00 10.00 C ATOM 822 C LYS A 55 -9.536 7.513 7.622 1.00 10.00 C ATOM 823 O LYS A 55 -10.449 7.993 6.957 1.00 10.00 O ATOM 824 CB LYS A 55 -7.196 7.595 6.783 1.00 10.00 C ATOM 825 CG LYS A 55 -7.330 8.145 5.365 1.00 10.00 C ATOM 826 CD LYS A 55 -6.088 8.896 4.895 1.00 10.00 C ATOM 827 CE LYS A 55 -6.083 10.367 5.322 1.00 10.00 C ATOM 828 NZ LYS A 55 -5.889 10.577 6.774 1.00 10.00 N ATOM 0 H LYS A 55 -6.725 7.781 9.118 1.00 10.00 H new ATOM 0 HA LYS A 55 -8.389 9.290 7.473 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -6.184 7.768 7.148 1.00 10.00 H new ATOM 0 HB3 LYS A 55 -7.351 6.516 6.773 1.00 10.00 H new ATOM 0 HG2 LYS A 55 -7.530 7.321 4.680 1.00 10.00 H new ATOM 0 HG3 LYS A 55 -8.190 8.813 5.321 1.00 10.00 H new ATOM 0 HD2 LYS A 55 -5.200 8.404 5.293 1.00 10.00 H new ATOM 0 HD3 LYS A 55 -6.024 8.838 3.808 1.00 10.00 H new ATOM 0 HE2 LYS A 55 -5.292 10.888 4.782 1.00 10.00 H new ATOM 0 HE3 LYS A 55 -7.027 10.824 5.023 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 -5.303 11.422 6.927 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 -6.813 10.709 7.232 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 -5.414 9.748 7.184 1.00 10.00 H new ATOM 842 N GLY A 56 -9.611 6.318 8.208 1.00 10.00 N ATOM 843 CA GLY A 56 -10.796 5.480 8.159 1.00 10.00 C ATOM 844 C GLY A 56 -11.308 5.161 6.747 1.00 10.00 C ATOM 845 O GLY A 56 -12.510 5.233 6.505 1.00 10.00 O ATOM 0 H GLY A 56 -8.840 5.906 8.734 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -10.581 4.542 8.671 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -11.594 5.972 8.716 1.00 10.00 H new ATOM 849 N ILE A 57 -10.420 4.747 5.836 1.00 10.00 N ATOM 850 CA ILE A 57 -10.763 4.332 4.468 1.00 10.00 C ATOM 851 C ILE A 57 -10.476 2.846 4.278 1.00 10.00 C ATOM 852 O ILE A 57 -9.648 2.269 4.985 1.00 10.00 O ATOM 853 CB ILE A 57 -10.028 5.179 3.404 1.00 10.00 C ATOM 854 CG1 ILE A 57 -8.510 5.042 3.583 1.00 10.00 C ATOM 855 CG2 ILE A 57 -10.533 6.627 3.491 1.00 10.00 C ATOM 856 CD1 ILE A 57 -7.606 5.678 2.526 1.00 10.00 C ATOM 0 H ILE A 57 -9.421 4.689 6.032 1.00 10.00 H new ATOM 0 HA ILE A 57 -11.830 4.503 4.328 1.00 10.00 H new ATOM 0 HB ILE A 57 -10.244 4.822 2.397 1.00 10.00 H new ATOM 0 HG12 ILE A 57 -8.247 5.471 4.550 1.00 10.00 H new ATOM 0 HG13 ILE A 57 -8.273 3.979 3.630 1.00 10.00 H new ATOM 0 HG21 ILE A 57 -10.022 7.236 2.745 1.00 10.00 H new ATOM 0 HG22 ILE A 57 -11.607 6.650 3.304 1.00 10.00 H new ATOM 0 HG23 ILE A 57 -10.329 7.024 4.485 1.00 10.00 H new ATOM 0 HD11 ILE A 57 -6.562 5.500 2.785 1.00 10.00 H new ATOM 0 HD12 ILE A 57 -7.819 5.237 1.552 1.00 10.00 H new ATOM 0 HD13 ILE A 57 -7.792 6.751 2.486 1.00 10.00 H new ATOM 868 N THR A 58 -11.190 2.232 3.337 1.00 10.00 N ATOM 869 CA THR A 58 -11.034 0.845 2.950 1.00 10.00 C ATOM 870 C THR A 58 -9.939 0.729 1.892 1.00 10.00 C ATOM 871 O THR A 58 -9.335 1.725 1.496 1.00 10.00 O ATOM 872 CB THR A 58 -12.389 0.371 2.405 1.00 10.00 C ATOM 873 OG1 THR A 58 -12.875 1.313 1.466 1.00 10.00 O ATOM 874 CG2 THR A 58 -13.398 0.255 3.548 1.00 10.00 C ATOM 0 H THR A 58 -11.918 2.711 2.808 1.00 10.00 H new ATOM 0 HA THR A 58 -10.738 0.224 3.796 1.00 10.00 H new ATOM 0 HB THR A 58 -12.258 -0.601 1.929 1.00 10.00 H new ATOM 0 HG1 THR A 58 -13.739 1.010 1.116 1.00 10.00 H new ATOM 0 HG21 THR A 58 -14.357 -0.082 3.154 1.00 10.00 H new ATOM 0 HG22 THR A 58 -13.035 -0.464 4.282 1.00 10.00 H new ATOM 0 HG23 THR A 58 -13.523 1.228 4.024 1.00 10.00 H new ATOM 882 N TRP A 59 -9.745 -0.486 1.384 1.00 10.00 N ATOM 883 CA TRP A 59 -8.855 -0.767 0.281 1.00 10.00 C ATOM 884 C TRP A 59 -9.615 -1.631 -0.714 1.00 10.00 C ATOM 885 O TRP A 59 -10.214 -2.630 -0.320 1.00 10.00 O ATOM 886 CB TRP A 59 -7.625 -1.470 0.834 1.00 10.00 C ATOM 887 CG TRP A 59 -6.959 -0.710 1.932 1.00 10.00 C ATOM 888 CD1 TRP A 59 -7.021 -0.996 3.252 1.00 10.00 C ATOM 889 CD2 TRP A 59 -6.174 0.510 1.815 1.00 10.00 C ATOM 890 NE1 TRP A 59 -6.240 -0.093 3.947 1.00 10.00 N ATOM 891 CE2 TRP A 59 -5.701 0.869 3.110 1.00 10.00 C ATOM 892 CE3 TRP A 59 -5.817 1.347 0.737 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -4.879 1.992 3.309 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -5.006 2.478 0.931 1.00 10.00 C ATOM 895 CH2 TRP A 59 -4.527 2.789 2.212 1.00 10.00 C ATOM 0 H TRP A 59 -10.218 -1.316 1.743 1.00 10.00 H new ATOM 0 HA TRP A 59 -8.523 0.137 -0.230 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -7.912 -2.454 1.204 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -6.911 -1.629 0.026 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -7.590 -1.801 3.692 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -6.080 -0.130 4.954 1.00 10.00 H new ATOM 0 HE3 TRP A 59 -6.174 1.114 -0.256 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -4.522 2.238 4.298 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 -4.751 3.109 0.092 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -3.885 3.646 2.353 1.00 10.00 H new ATOM 906 N LYS A 60 -9.620 -1.221 -1.983 1.00 10.00 N ATOM 907 CA LYS A 60 -10.315 -1.921 -3.055 1.00 10.00 C ATOM 908 C LYS A 60 -9.481 -1.841 -4.333 1.00 10.00 C ATOM 909 O LYS A 60 -9.044 -2.859 -4.860 1.00 10.00 O ATOM 910 CB LYS A 60 -11.745 -1.366 -3.221 1.00 10.00 C ATOM 911 CG LYS A 60 -11.910 0.157 -3.026 1.00 10.00 C ATOM 912 CD LYS A 60 -13.357 0.590 -3.300 1.00 10.00 C ATOM 913 CE LYS A 60 -14.196 0.655 -2.014 1.00 10.00 C ATOM 914 NZ LYS A 60 -15.625 0.395 -2.279 1.00 10.00 N ATOM 0 H LYS A 60 -9.133 -0.381 -2.296 1.00 10.00 H new ATOM 0 HA LYS A 60 -10.429 -2.977 -2.809 1.00 10.00 H new ATOM 0 HB2 LYS A 60 -12.100 -1.624 -4.219 1.00 10.00 H new ATOM 0 HB3 LYS A 60 -12.395 -1.875 -2.510 1.00 10.00 H new ATOM 0 HG2 LYS A 60 -11.631 0.430 -2.008 1.00 10.00 H new ATOM 0 HG3 LYS A 60 -11.234 0.689 -3.695 1.00 10.00 H new ATOM 0 HD2 LYS A 60 -13.357 1.568 -3.782 1.00 10.00 H new ATOM 0 HD3 LYS A 60 -13.818 -0.109 -3.998 1.00 10.00 H new ATOM 0 HE2 LYS A 60 -13.820 -0.075 -1.297 1.00 10.00 H new ATOM 0 HE3 LYS A 60 -14.084 1.638 -1.556 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 -16.158 0.447 -1.388 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 -15.990 1.107 -2.943 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 -15.734 -0.553 -2.693 1.00 10.00 H new ATOM 928 N GLU A 61 -9.218 -0.610 -4.776 1.00 10.00 N ATOM 929 CA GLU A 61 -8.453 -0.265 -5.961 1.00 10.00 C ATOM 930 C GLU A 61 -8.517 1.248 -6.161 1.00 10.00 C ATOM 931 O GLU A 61 -7.482 1.879 -6.303 1.00 10.00 O ATOM 932 CB GLU A 61 -8.895 -1.047 -7.208 1.00 10.00 C ATOM 933 CG GLU A 61 -10.416 -1.075 -7.450 1.00 10.00 C ATOM 934 CD GLU A 61 -10.900 -2.477 -7.801 1.00 10.00 C ATOM 935 OE1 GLU A 61 -10.610 -2.922 -8.935 1.00 10.00 O ATOM 936 OE2 GLU A 61 -11.534 -3.115 -6.936 1.00 10.00 O ATOM 0 H GLU A 61 -9.556 0.217 -4.283 1.00 10.00 H new ATOM 0 HA GLU A 61 -7.415 -0.561 -5.808 1.00 10.00 H new ATOM 0 HB2 GLU A 61 -8.411 -0.612 -8.082 1.00 10.00 H new ATOM 0 HB3 GLU A 61 -8.536 -2.073 -7.122 1.00 10.00 H new ATOM 0 HG2 GLU A 61 -10.934 -0.723 -6.558 1.00 10.00 H new ATOM 0 HG3 GLU A 61 -10.670 -0.388 -8.258 1.00 10.00 H new ATOM 943 N GLU A 62 -9.721 1.825 -6.113 1.00 10.00 N ATOM 944 CA GLU A 62 -9.987 3.247 -6.331 1.00 10.00 C ATOM 945 C GLU A 62 -9.104 4.155 -5.469 1.00 10.00 C ATOM 946 O GLU A 62 -8.260 4.886 -5.982 1.00 10.00 O ATOM 947 CB GLU A 62 -11.482 3.512 -6.053 1.00 10.00 C ATOM 948 CG GLU A 62 -12.191 4.249 -7.189 1.00 10.00 C ATOM 949 CD GLU A 62 -13.664 4.433 -6.840 1.00 10.00 C ATOM 950 OE1 GLU A 62 -13.919 4.957 -5.735 1.00 10.00 O ATOM 951 OE2 GLU A 62 -14.502 3.996 -7.655 1.00 10.00 O ATOM 0 H GLU A 62 -10.568 1.293 -5.914 1.00 10.00 H new ATOM 0 HA GLU A 62 -9.743 3.488 -7.366 1.00 10.00 H new ATOM 0 HB2 GLU A 62 -11.985 2.561 -5.877 1.00 10.00 H new ATOM 0 HB3 GLU A 62 -11.575 4.096 -5.137 1.00 10.00 H new ATOM 0 HG2 GLU A 62 -11.722 5.219 -7.355 1.00 10.00 H new ATOM 0 HG3 GLU A 62 -12.095 3.686 -8.117 1.00 10.00 H new ATOM 958 N THR A 63 -9.301 4.131 -4.148 1.00 10.00 N ATOM 959 CA THR A 63 -8.553 4.998 -3.254 1.00 10.00 C ATOM 960 C THR A 63 -7.067 4.686 -3.387 1.00 10.00 C ATOM 961 O THR A 63 -6.244 5.581 -3.558 1.00 10.00 O ATOM 962 CB THR A 63 -9.067 4.796 -1.825 1.00 10.00 C ATOM 963 OG1 THR A 63 -10.463 5.008 -1.819 1.00 10.00 O ATOM 964 CG2 THR A 63 -8.378 5.737 -0.840 1.00 10.00 C ATOM 0 H THR A 63 -9.972 3.520 -3.682 1.00 10.00 H new ATOM 0 HA THR A 63 -8.693 6.048 -3.513 1.00 10.00 H new ATOM 0 HB THR A 63 -8.839 3.780 -1.504 1.00 10.00 H new ATOM 0 HG1 THR A 63 -10.809 4.881 -0.911 1.00 10.00 H new ATOM 0 HG21 THR A 63 -8.769 5.564 0.163 1.00 10.00 H new ATOM 0 HG22 THR A 63 -7.304 5.550 -0.848 1.00 10.00 H new ATOM 0 HG23 THR A 63 -8.568 6.770 -1.130 1.00 10.00 H new ATOM 972 N LEU A 64 -6.747 3.393 -3.330 1.00 10.00 N ATOM 973 CA LEU A 64 -5.401 2.866 -3.388 1.00 10.00 C ATOM 974 C LEU A 64 -4.626 3.431 -4.575 1.00 10.00 C ATOM 975 O LEU A 64 -3.529 3.955 -4.399 1.00 10.00 O ATOM 976 CB LEU A 64 -5.494 1.335 -3.407 1.00 10.00 C ATOM 977 CG LEU A 64 -4.378 0.702 -2.593 1.00 10.00 C ATOM 978 CD1 LEU A 64 -4.806 -0.696 -2.177 1.00 10.00 C ATOM 979 CD2 LEU A 64 -3.051 0.632 -3.352 1.00 10.00 C ATOM 0 H LEU A 64 -7.453 2.663 -3.239 1.00 10.00 H new ATOM 0 HA LEU A 64 -4.835 3.175 -2.509 1.00 10.00 H new ATOM 0 HB2 LEU A 64 -6.459 1.023 -3.009 1.00 10.00 H new ATOM 0 HB3 LEU A 64 -5.443 0.979 -4.436 1.00 10.00 H new ATOM 0 HG LEU A 64 -4.207 1.333 -1.721 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -4.012 -1.160 -1.592 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -5.713 -0.635 -1.575 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -5.000 -1.297 -3.066 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -2.293 0.170 -2.719 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -3.180 0.037 -4.256 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -2.733 1.639 -3.623 1.00 10.00 H new ATOM 991 N MET A 65 -5.214 3.356 -5.770 1.00 10.00 N ATOM 992 CA MET A 65 -4.690 3.942 -6.984 1.00 10.00 C ATOM 993 C MET A 65 -4.141 5.350 -6.732 1.00 10.00 C ATOM 994 O MET A 65 -3.000 5.639 -7.089 1.00 10.00 O ATOM 995 CB MET A 65 -5.791 3.926 -8.068 1.00 10.00 C ATOM 996 CG MET A 65 -5.648 2.742 -9.032 1.00 10.00 C ATOM 997 SD MET A 65 -6.229 3.040 -10.725 1.00 10.00 S ATOM 998 CE MET A 65 -8.007 2.780 -10.546 1.00 10.00 C ATOM 0 H MET A 65 -6.098 2.867 -5.914 1.00 10.00 H new ATOM 0 HA MET A 65 -3.847 3.350 -7.340 1.00 10.00 H new ATOM 0 HB2 MET A 65 -6.769 3.884 -7.588 1.00 10.00 H new ATOM 0 HB3 MET A 65 -5.754 4.857 -8.633 1.00 10.00 H new ATOM 0 HG2 MET A 65 -4.598 2.453 -9.072 1.00 10.00 H new ATOM 0 HG3 MET A 65 -6.196 1.894 -8.622 1.00 10.00 H new ATOM 0 HE1 MET A 65 -8.495 2.930 -11.509 1.00 10.00 H new ATOM 0 HE2 MET A 65 -8.193 1.764 -10.199 1.00 10.00 H new ATOM 0 HE3 MET A 65 -8.407 3.489 -9.822 1.00 10.00 H new ATOM 1008 N GLU A 66 -4.924 6.227 -6.103 1.00 10.00 N ATOM 1009 CA GLU A 66 -4.426 7.558 -5.810 1.00 10.00 C ATOM 1010 C GLU A 66 -3.392 7.488 -4.697 1.00 10.00 C ATOM 1011 O GLU A 66 -2.316 8.052 -4.829 1.00 10.00 O ATOM 1012 CB GLU A 66 -5.554 8.510 -5.421 1.00 10.00 C ATOM 1013 CG GLU A 66 -6.209 9.197 -6.622 1.00 10.00 C ATOM 1014 CD GLU A 66 -6.502 10.635 -6.224 1.00 10.00 C ATOM 1015 OE1 GLU A 66 -7.341 10.798 -5.309 1.00 10.00 O ATOM 1016 OE2 GLU A 66 -5.793 11.520 -6.755 1.00 10.00 O ATOM 0 H GLU A 66 -5.879 6.042 -5.796 1.00 10.00 H new ATOM 0 HA GLU A 66 -3.962 7.950 -6.715 1.00 10.00 H new ATOM 0 HB2 GLU A 66 -6.314 7.956 -4.870 1.00 10.00 H new ATOM 0 HB3 GLU A 66 -5.161 9.270 -4.746 1.00 10.00 H new ATOM 0 HG2 GLU A 66 -5.548 9.166 -7.488 1.00 10.00 H new ATOM 0 HG3 GLU A 66 -7.128 8.683 -6.904 1.00 10.00 H new ATOM 1023 N TYR A 67 -3.716 6.806 -3.603 1.00 10.00 N ATOM 1024 CA TYR A 67 -2.872 6.685 -2.424 1.00 10.00 C ATOM 1025 C TYR A 67 -1.409 6.399 -2.799 1.00 10.00 C ATOM 1026 O TYR A 67 -0.494 7.068 -2.321 1.00 10.00 O ATOM 1027 CB TYR A 67 -3.477 5.609 -1.516 1.00 10.00 C ATOM 1028 CG TYR A 67 -3.194 5.801 -0.041 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -2.028 5.276 0.546 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -4.130 6.490 0.753 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -1.833 5.389 1.935 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -3.925 6.618 2.135 1.00 10.00 C ATOM 1033 CZ TYR A 67 -2.801 6.024 2.732 1.00 10.00 C ATOM 1034 OH TYR A 67 -2.736 5.920 4.087 1.00 10.00 O ATOM 0 H TYR A 67 -4.601 6.308 -3.512 1.00 10.00 H new ATOM 0 HA TYR A 67 -2.845 7.630 -1.882 1.00 10.00 H new ATOM 0 HB2 TYR A 67 -4.556 5.589 -1.666 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -3.095 4.635 -1.823 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -1.285 4.788 -0.067 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -5.009 6.921 0.297 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -0.939 4.988 2.389 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -4.629 7.172 2.738 1.00 10.00 H new ATOM 0 HH TYR A 67 -3.478 6.417 4.489 1.00 10.00 H new ATOM 1044 N LEU A 68 -1.191 5.429 -3.692 1.00 10.00 N ATOM 1045 CA LEU A 68 0.135 5.088 -4.201 1.00 10.00 C ATOM 1046 C LEU A 68 0.747 6.208 -5.036 1.00 10.00 C ATOM 1047 O LEU A 68 1.958 6.426 -4.999 1.00 10.00 O ATOM 1048 CB LEU A 68 0.058 3.830 -5.071 1.00 10.00 C ATOM 1049 CG LEU A 68 -0.449 2.602 -4.316 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -0.370 1.381 -5.237 1.00 10.00 C ATOM 1051 CD2 LEU A 68 0.318 2.365 -3.013 1.00 10.00 C ATOM 0 H LEU A 68 -1.938 4.855 -4.083 1.00 10.00 H new ATOM 0 HA LEU A 68 0.768 4.922 -3.329 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -0.599 4.023 -5.919 1.00 10.00 H new ATOM 0 HB3 LEU A 68 1.047 3.616 -5.476 1.00 10.00 H new ATOM 0 HG LEU A 68 -1.486 2.776 -4.030 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -0.730 0.500 -4.705 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -0.988 1.550 -6.119 1.00 10.00 H new ATOM 0 HD13 LEU A 68 0.664 1.222 -5.543 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -0.079 1.482 -2.513 1.00 10.00 H new ATOM 0 HD22 LEU A 68 1.374 2.213 -3.235 1.00 10.00 H new ATOM 0 HD23 LEU A 68 0.206 3.232 -2.362 1.00 10.00 H new ATOM 1063 N GLU A 69 -0.082 6.885 -5.828 1.00 10.00 N ATOM 1064 CA GLU A 69 0.332 7.914 -6.766 1.00 10.00 C ATOM 1065 C GLU A 69 0.097 9.307 -6.171 1.00 10.00 C ATOM 1066 O GLU A 69 -0.118 10.275 -6.895 1.00 10.00 O ATOM 1067 CB GLU A 69 -0.395 7.645 -8.097 1.00 10.00 C ATOM 1068 CG GLU A 69 0.474 7.868 -9.349 1.00 10.00 C ATOM 1069 CD GLU A 69 0.017 9.065 -10.161 1.00 10.00 C ATOM 1070 OE1 GLU A 69 -1.146 8.984 -10.614 1.00 10.00 O ATOM 1071 OE2 GLU A 69 0.824 9.997 -10.347 1.00 10.00 O ATOM 0 H GLU A 69 -1.089 6.724 -5.831 1.00 10.00 H new ATOM 0 HA GLU A 69 1.403 7.884 -6.966 1.00 10.00 H new ATOM 0 HB2 GLU A 69 -0.757 6.617 -8.099 1.00 10.00 H new ATOM 0 HB3 GLU A 69 -1.271 8.291 -8.157 1.00 10.00 H new ATOM 0 HG2 GLU A 69 1.512 8.011 -9.048 1.00 10.00 H new ATOM 0 HG3 GLU A 69 0.444 6.975 -9.973 1.00 10.00 H new ATOM 1078 N ASN A 70 0.146 9.411 -4.838 1.00 10.00 N ATOM 1079 CA ASN A 70 -0.101 10.640 -4.094 1.00 10.00 C ATOM 1080 C ASN A 70 0.044 10.365 -2.589 1.00 10.00 C ATOM 1081 O ASN A 70 -0.883 10.602 -1.812 1.00 10.00 O ATOM 1082 CB ASN A 70 -1.495 11.200 -4.469 1.00 10.00 C ATOM 1083 CG ASN A 70 -1.447 12.503 -5.259 1.00 10.00 C ATOM 1084 OD1 ASN A 70 -0.555 13.329 -5.077 1.00 10.00 O ATOM 1085 ND2 ASN A 70 -2.446 12.735 -6.108 1.00 10.00 N ATOM 0 H ASN A 70 0.365 8.618 -4.235 1.00 10.00 H new ATOM 0 HA ASN A 70 0.633 11.402 -4.356 1.00 10.00 H new ATOM 0 HB2 ASN A 70 -2.031 10.452 -5.054 1.00 10.00 H new ATOM 0 HB3 ASN A 70 -2.068 11.361 -3.556 1.00 10.00 H new ATOM 0 HD21 ASN A 70 -2.483 13.614 -6.624 1.00 10.00 H new ATOM 0 HD22 ASN A 70 -3.175 12.034 -6.242 1.00 10.00 H new ATOM 1092 N PRO A 71 1.209 9.877 -2.130 1.00 10.00 N ATOM 1093 CA PRO A 71 1.374 9.555 -0.723 1.00 10.00 C ATOM 1094 C PRO A 71 1.303 10.823 0.130 1.00 10.00 C ATOM 1095 O PRO A 71 0.553 10.885 1.105 1.00 10.00 O ATOM 1096 CB PRO A 71 2.707 8.800 -0.624 1.00 10.00 C ATOM 1097 CG PRO A 71 3.495 9.264 -1.852 1.00 10.00 C ATOM 1098 CD PRO A 71 2.409 9.549 -2.890 1.00 10.00 C ATOM 0 HA PRO A 71 0.575 8.925 -0.332 1.00 10.00 H new ATOM 0 HB2 PRO A 71 3.233 9.040 0.300 1.00 10.00 H new ATOM 0 HB3 PRO A 71 2.555 7.721 -0.633 1.00 10.00 H new ATOM 0 HG2 PRO A 71 4.086 10.154 -1.636 1.00 10.00 H new ATOM 0 HG3 PRO A 71 4.188 8.497 -2.197 1.00 10.00 H new ATOM 0 HD2 PRO A 71 2.697 10.374 -3.541 1.00 10.00 H new ATOM 0 HD3 PRO A 71 2.242 8.682 -3.529 1.00 10.00 H new ATOM 1106 N LYS A 72 2.024 11.869 -0.279 1.00 10.00 N ATOM 1107 CA LYS A 72 2.012 13.160 0.392 1.00 10.00 C ATOM 1108 C LYS A 72 0.778 13.984 0.018 1.00 10.00 C ATOM 1109 O LYS A 72 0.890 15.142 -0.379 1.00 10.00 O ATOM 1110 CB LYS A 72 3.322 13.918 0.142 1.00 10.00 C ATOM 1111 CG LYS A 72 3.677 14.297 -1.309 1.00 10.00 C ATOM 1112 CD LYS A 72 4.354 13.165 -2.102 1.00 10.00 C ATOM 1113 CE LYS A 72 5.232 13.704 -3.240 1.00 10.00 C ATOM 1114 NZ LYS A 72 4.445 14.411 -4.272 1.00 10.00 N ATOM 0 H LYS A 72 2.637 11.838 -1.094 1.00 10.00 H new ATOM 0 HA LYS A 72 1.943 12.980 1.465 1.00 10.00 H new ATOM 0 HB2 LYS A 72 3.293 14.836 0.729 1.00 10.00 H new ATOM 0 HB3 LYS A 72 4.138 13.313 0.537 1.00 10.00 H new ATOM 0 HG2 LYS A 72 2.767 14.597 -1.829 1.00 10.00 H new ATOM 0 HG3 LYS A 72 4.338 15.164 -1.296 1.00 10.00 H new ATOM 0 HD2 LYS A 72 4.964 12.564 -1.427 1.00 10.00 H new ATOM 0 HD3 LYS A 72 3.591 12.505 -2.515 1.00 10.00 H new ATOM 0 HE2 LYS A 72 5.979 14.383 -2.829 1.00 10.00 H new ATOM 0 HE3 LYS A 72 5.772 12.877 -3.702 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 5.082 14.756 -5.018 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 3.749 13.758 -4.685 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 3.950 15.217 -3.839 1.00 10.00 H new ATOM 1128 N LYS A 73 -0.401 13.379 0.132 1.00 10.00 N ATOM 1129 CA LYS A 73 -1.660 14.015 -0.229 1.00 10.00 C ATOM 1130 C LYS A 73 -2.729 13.595 0.772 1.00 10.00 C ATOM 1131 O LYS A 73 -3.374 14.445 1.379 1.00 10.00 O ATOM 1132 CB LYS A 73 -2.008 13.679 -1.694 1.00 10.00 C ATOM 1133 CG LYS A 73 -2.361 14.923 -2.520 1.00 10.00 C ATOM 1134 CD LYS A 73 -3.826 15.347 -2.335 1.00 10.00 C ATOM 1135 CE LYS A 73 -4.047 16.807 -2.761 1.00 10.00 C ATOM 1136 NZ LYS A 73 -3.695 17.053 -4.177 1.00 10.00 N ATOM 0 H LYS A 73 -0.508 12.426 0.480 1.00 10.00 H new ATOM 0 HA LYS A 73 -1.587 15.101 -0.177 1.00 10.00 H new ATOM 0 HB2 LYS A 73 -1.163 13.169 -2.156 1.00 10.00 H new ATOM 0 HB3 LYS A 73 -2.848 12.985 -1.713 1.00 10.00 H new ATOM 0 HG2 LYS A 73 -1.707 15.746 -2.231 1.00 10.00 H new ATOM 0 HG3 LYS A 73 -2.173 14.722 -3.575 1.00 10.00 H new ATOM 0 HD2 LYS A 73 -4.472 14.694 -2.922 1.00 10.00 H new ATOM 0 HD3 LYS A 73 -4.112 15.224 -1.291 1.00 10.00 H new ATOM 0 HE2 LYS A 73 -5.092 17.073 -2.600 1.00 10.00 H new ATOM 0 HE3 LYS A 73 -3.450 17.460 -2.125 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 -3.912 18.040 -4.422 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 -2.680 16.876 -4.318 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 -4.246 16.416 -4.787 1.00 10.00 H new ATOM 1150 N TYR A 74 -2.885 12.286 0.979 1.00 10.00 N ATOM 1151 CA TYR A 74 -3.791 11.776 1.994 1.00 10.00 C ATOM 1152 C TYR A 74 -3.250 12.046 3.406 1.00 10.00 C ATOM 1153 O TYR A 74 -3.931 12.674 4.214 1.00 10.00 O ATOM 1154 CB TYR A 74 -4.072 10.289 1.737 1.00 10.00 C ATOM 1155 CG TYR A 74 -5.128 10.049 0.670 1.00 10.00 C ATOM 1156 CD1 TYR A 74 -6.488 10.264 0.967 1.00 10.00 C ATOM 1157 CD2 TYR A 74 -4.756 9.669 -0.633 1.00 10.00 C ATOM 1158 CE1 TYR A 74 -7.465 10.110 -0.033 1.00 10.00 C ATOM 1159 CE2 TYR A 74 -5.738 9.497 -1.626 1.00 10.00 C ATOM 1160 CZ TYR A 74 -7.088 9.760 -1.342 1.00 10.00 C ATOM 1161 OH TYR A 74 -8.031 9.697 -2.328 1.00 10.00 O ATOM 0 H TYR A 74 -2.392 11.564 0.453 1.00 10.00 H new ATOM 0 HA TYR A 74 -4.741 12.306 1.930 1.00 10.00 H new ATOM 0 HB2 TYR A 74 -3.146 9.798 1.438 1.00 10.00 H new ATOM 0 HB3 TYR A 74 -4.394 9.822 2.668 1.00 10.00 H new ATOM 0 HD1 TYR A 74 -6.782 10.548 1.967 1.00 10.00 H new ATOM 0 HD2 TYR A 74 -3.715 9.509 -0.871 1.00 10.00 H new ATOM 0 HE1 TYR A 74 -8.508 10.261 0.205 1.00 10.00 H new ATOM 0 HE2 TYR A 74 -5.452 9.161 -2.612 1.00 10.00 H new ATOM 0 HH TYR A 74 -7.668 10.083 -3.153 1.00 10.00 H new ATOM 1171 N ILE A 75 -2.052 11.549 3.728 1.00 10.00 N ATOM 1172 CA ILE A 75 -1.458 11.635 5.068 1.00 10.00 C ATOM 1173 C ILE A 75 -0.146 12.428 5.003 1.00 10.00 C ATOM 1174 O ILE A 75 0.933 11.834 5.025 1.00 10.00 O ATOM 1175 CB ILE A 75 -1.267 10.223 5.675 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -0.682 9.277 4.595 1.00 10.00 C ATOM 1177 CG2 ILE A 75 -2.623 9.672 6.120 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -0.174 7.936 5.116 1.00 10.00 C ATOM 0 H ILE A 75 -1.457 11.067 3.054 1.00 10.00 H new ATOM 0 HA ILE A 75 -2.136 12.170 5.733 1.00 10.00 H new ATOM 0 HB ILE A 75 -0.591 10.286 6.528 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -1.449 9.090 3.844 1.00 10.00 H new ATOM 0 HG13 ILE A 75 0.139 9.788 4.092 1.00 10.00 H new ATOM 0 HG21 ILE A 75 -2.489 8.678 6.547 1.00 10.00 H new ATOM 0 HG22 ILE A 75 -3.057 10.334 6.870 1.00 10.00 H new ATOM 0 HG23 ILE A 75 -3.291 9.611 5.261 1.00 10.00 H new ATOM 0 HD11 ILE A 75 0.215 7.347 4.286 1.00 10.00 H new ATOM 0 HD12 ILE A 75 0.619 8.105 5.844 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -0.993 7.396 5.591 1.00 10.00 H new ATOM 1190 N PRO A 76 -0.203 13.770 4.938 1.00 10.00 N ATOM 1191 CA PRO A 76 0.984 14.613 4.882 1.00 10.00 C ATOM 1192 C PRO A 76 1.664 14.704 6.261 1.00 10.00 C ATOM 1193 O PRO A 76 1.796 15.784 6.831 1.00 10.00 O ATOM 1194 CB PRO A 76 0.479 15.959 4.346 1.00 10.00 C ATOM 1195 CG PRO A 76 -0.954 16.034 4.871 1.00 10.00 C ATOM 1196 CD PRO A 76 -1.413 14.577 4.835 1.00 10.00 C ATOM 0 HA PRO A 76 1.764 14.216 4.233 1.00 10.00 H new ATOM 0 HB2 PRO A 76 1.084 16.789 4.710 1.00 10.00 H new ATOM 0 HB3 PRO A 76 0.510 15.995 3.257 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -0.993 16.444 5.880 1.00 10.00 H new ATOM 0 HG3 PRO A 76 -1.580 16.669 4.245 1.00 10.00 H new ATOM 0 HD2 PRO A 76 -2.096 14.363 5.657 1.00 10.00 H new ATOM 0 HD3 PRO A 76 -1.949 14.360 3.911 1.00 10.00 H new ATOM 1204 N GLY A 77 2.115 13.561 6.788 1.00 10.00 N ATOM 1205 CA GLY A 77 2.867 13.440 8.032 1.00 10.00 C ATOM 1206 C GLY A 77 3.003 11.969 8.427 1.00 10.00 C ATOM 1207 O GLY A 77 2.815 11.624 9.590 1.00 10.00 O ATOM 0 H GLY A 77 1.957 12.660 6.337 1.00 10.00 H new ATOM 0 HA2 GLY A 77 3.855 13.885 7.913 1.00 10.00 H new ATOM 0 HA3 GLY A 77 2.363 13.992 8.825 1.00 10.00 H new ATOM 1211 N THR A 78 3.336 11.111 7.455 1.00 10.00 N ATOM 1212 CA THR A 78 3.520 9.678 7.660 1.00 10.00 C ATOM 1213 C THR A 78 4.812 9.238 6.972 1.00 10.00 C ATOM 1214 O THR A 78 5.799 8.954 7.646 1.00 10.00 O ATOM 1215 CB THR A 78 2.270 8.922 7.183 1.00 10.00 C ATOM 1216 OG1 THR A 78 1.204 9.204 8.063 1.00 10.00 O ATOM 1217 CG2 THR A 78 2.486 7.405 7.140 1.00 10.00 C ATOM 0 H THR A 78 3.487 11.403 6.489 1.00 10.00 H new ATOM 0 HA THR A 78 3.631 9.441 8.718 1.00 10.00 H new ATOM 0 HB THR A 78 2.048 9.255 6.169 1.00 10.00 H new ATOM 0 HG1 THR A 78 0.515 8.512 7.975 1.00 10.00 H new ATOM 0 HG21 THR A 78 1.574 6.917 6.797 1.00 10.00 H new ATOM 0 HG22 THR A 78 3.301 7.173 6.455 1.00 10.00 H new ATOM 0 HG23 THR A 78 2.737 7.045 8.138 1.00 10.00 H new ATOM 1225 N LYS A 79 4.826 9.192 5.634 1.00 10.00 N ATOM 1226 CA LYS A 79 6.011 8.845 4.861 1.00 10.00 C ATOM 1227 C LYS A 79 5.787 9.248 3.405 1.00 10.00 C ATOM 1228 O LYS A 79 5.422 8.433 2.562 1.00 10.00 O ATOM 1229 CB LYS A 79 6.390 7.364 5.045 1.00 10.00 C ATOM 1230 CG LYS A 79 5.370 6.370 4.470 1.00 10.00 C ATOM 1231 CD LYS A 79 5.073 5.238 5.464 1.00 10.00 C ATOM 1232 CE LYS A 79 6.323 4.454 5.899 1.00 10.00 C ATOM 1233 NZ LYS A 79 6.431 4.403 7.375 1.00 10.00 N ATOM 0 H LYS A 79 4.008 9.397 5.060 1.00 10.00 H new ATOM 0 HA LYS A 79 6.874 9.401 5.228 1.00 10.00 H new ATOM 0 HB2 LYS A 79 7.356 7.188 4.573 1.00 10.00 H new ATOM 0 HB3 LYS A 79 6.514 7.163 6.109 1.00 10.00 H new ATOM 0 HG2 LYS A 79 4.446 6.894 4.226 1.00 10.00 H new ATOM 0 HG3 LYS A 79 5.753 5.949 3.540 1.00 10.00 H new ATOM 0 HD2 LYS A 79 4.593 5.659 6.348 1.00 10.00 H new ATOM 0 HD3 LYS A 79 4.361 4.548 5.013 1.00 10.00 H new ATOM 0 HE2 LYS A 79 6.279 3.441 5.499 1.00 10.00 H new ATOM 0 HE3 LYS A 79 7.214 4.923 5.482 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 7.282 3.869 7.643 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 6.496 5.370 7.752 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 5.590 3.934 7.769 1.00 10.00 H new ATOM 1247 N MET A 80 5.978 10.535 3.120 1.00 10.00 N ATOM 1248 CA MET A 80 5.846 11.081 1.777 1.00 10.00 C ATOM 1249 C MET A 80 6.694 10.313 0.765 1.00 10.00 C ATOM 1250 O MET A 80 6.253 10.031 -0.344 1.00 10.00 O ATOM 1251 CB MET A 80 6.238 12.568 1.793 1.00 10.00 C ATOM 1252 CG MET A 80 7.634 12.879 2.359 1.00 10.00 C ATOM 1253 SD MET A 80 7.900 14.616 2.796 1.00 10.00 S ATOM 1254 CE MET A 80 7.991 15.376 1.162 1.00 10.00 C ATOM 0 H MET A 80 6.230 11.230 3.822 1.00 10.00 H new ATOM 0 HA MET A 80 4.807 10.978 1.465 1.00 10.00 H new ATOM 0 HB2 MET A 80 6.185 12.951 0.774 1.00 10.00 H new ATOM 0 HB3 MET A 80 5.498 13.115 2.378 1.00 10.00 H new ATOM 0 HG2 MET A 80 7.797 12.266 3.245 1.00 10.00 H new ATOM 0 HG3 MET A 80 8.383 12.584 1.625 1.00 10.00 H new ATOM 0 HE1 MET A 80 8.153 16.449 1.268 1.00 10.00 H new ATOM 0 HE2 MET A 80 8.817 14.938 0.602 1.00 10.00 H new ATOM 0 HE3 MET A 80 7.058 15.201 0.627 1.00 10.00 H new ATOM 1264 N ILE A 81 7.914 9.998 1.194 1.00 10.00 N ATOM 1265 CA ILE A 81 8.974 9.355 0.448 1.00 10.00 C ATOM 1266 C ILE A 81 9.182 9.904 -0.972 1.00 10.00 C ATOM 1267 O ILE A 81 8.941 11.085 -1.220 1.00 10.00 O ATOM 1268 CB ILE A 81 8.901 7.810 0.583 1.00 10.00 C ATOM 1269 CG1 ILE A 81 7.588 7.247 0.002 1.00 10.00 C ATOM 1270 CG2 ILE A 81 9.072 7.390 2.048 1.00 10.00 C ATOM 1271 CD1 ILE A 81 7.613 5.727 -0.200 1.00 10.00 C ATOM 0 H ILE A 81 8.202 10.206 2.150 1.00 10.00 H new ATOM 0 HA ILE A 81 9.916 9.638 0.918 1.00 10.00 H new ATOM 0 HB ILE A 81 9.721 7.389 0.001 1.00 10.00 H new ATOM 0 HG12 ILE A 81 6.765 7.504 0.669 1.00 10.00 H new ATOM 0 HG13 ILE A 81 7.386 7.730 -0.954 1.00 10.00 H new ATOM 0 HG21 ILE A 81 9.018 6.304 2.124 1.00 10.00 H new ATOM 0 HG22 ILE A 81 10.040 7.732 2.414 1.00 10.00 H new ATOM 0 HG23 ILE A 81 8.279 7.835 2.649 1.00 10.00 H new ATOM 0 HD11 ILE A 81 6.658 5.399 -0.611 1.00 10.00 H new ATOM 0 HD12 ILE A 81 8.415 5.465 -0.890 1.00 10.00 H new ATOM 0 HD13 ILE A 81 7.784 5.235 0.758 1.00 10.00 H new ATOM 1283 N PHE A 82 9.712 9.073 -1.880 1.00 10.00 N ATOM 1284 CA PHE A 82 9.882 9.407 -3.286 1.00 10.00 C ATOM 1285 C PHE A 82 8.541 9.804 -3.915 1.00 10.00 C ATOM 1286 O PHE A 82 7.485 9.593 -3.324 1.00 10.00 O ATOM 1287 CB PHE A 82 10.538 8.231 -4.037 1.00 10.00 C ATOM 1288 CG PHE A 82 9.598 7.122 -4.496 1.00 10.00 C ATOM 1289 CD1 PHE A 82 8.655 6.565 -3.612 1.00 10.00 C ATOM 1290 CD2 PHE A 82 9.579 6.735 -5.848 1.00 10.00 C ATOM 1291 CE1 PHE A 82 7.660 5.691 -4.081 1.00 10.00 C ATOM 1292 CE2 PHE A 82 8.590 5.854 -6.317 1.00 10.00 C ATOM 1293 CZ PHE A 82 7.625 5.332 -5.438 1.00 10.00 C ATOM 0 H PHE A 82 10.038 8.135 -1.646 1.00 10.00 H new ATOM 0 HA PHE A 82 10.546 10.268 -3.367 1.00 10.00 H new ATOM 0 HB2 PHE A 82 11.054 8.627 -4.911 1.00 10.00 H new ATOM 0 HB3 PHE A 82 11.298 7.792 -3.390 1.00 10.00 H new ATOM 0 HD1 PHE A 82 8.697 6.812 -2.561 1.00 10.00 H new ATOM 0 HD2 PHE A 82 10.327 7.116 -6.528 1.00 10.00 H new ATOM 0 HE1 PHE A 82 6.923 5.296 -3.398 1.00 10.00 H new ATOM 0 HE2 PHE A 82 8.571 5.576 -7.360 1.00 10.00 H new ATOM 0 HZ PHE A 82 6.863 4.660 -5.804 1.00 10.00 H new ATOM 1303 N ALA A 83 8.596 10.373 -5.124 1.00 10.00 N ATOM 1304 CA ALA A 83 7.448 10.961 -5.807 1.00 10.00 C ATOM 1305 C ALA A 83 6.174 10.114 -5.685 1.00 10.00 C ATOM 1306 O ALA A 83 5.143 10.618 -5.238 1.00 10.00 O ATOM 1307 CB ALA A 83 7.795 11.242 -7.277 1.00 10.00 C ATOM 0 H ALA A 83 9.460 10.437 -5.663 1.00 10.00 H new ATOM 0 HA ALA A 83 7.225 11.904 -5.307 1.00 10.00 H new ATOM 0 HB1 ALA A 83 6.932 11.681 -7.777 1.00 10.00 H new ATOM 0 HB2 ALA A 83 8.634 11.936 -7.327 1.00 10.00 H new ATOM 0 HB3 ALA A 83 8.066 10.309 -7.772 1.00 10.00 H new ATOM 1313 N GLY A 84 6.260 8.845 -6.096 1.00 10.00 N ATOM 1314 CA GLY A 84 5.154 7.903 -6.109 1.00 10.00 C ATOM 1315 C GLY A 84 5.319 6.953 -7.292 1.00 10.00 C ATOM 1316 O GLY A 84 6.387 6.898 -7.904 1.00 10.00 O ATOM 0 H GLY A 84 7.131 8.440 -6.438 1.00 10.00 H new ATOM 0 HA2 GLY A 84 5.129 7.340 -5.176 1.00 10.00 H new ATOM 0 HA3 GLY A 84 4.207 8.437 -6.185 1.00 10.00 H new ATOM 1320 N ILE A 85 4.274 6.189 -7.614 1.00 10.00 N ATOM 1321 CA ILE A 85 4.278 5.288 -8.757 1.00 10.00 C ATOM 1322 C ILE A 85 4.535 6.072 -10.050 1.00 10.00 C ATOM 1323 O ILE A 85 4.374 7.287 -10.100 1.00 10.00 O ATOM 1324 CB ILE A 85 2.973 4.459 -8.752 1.00 10.00 C ATOM 1325 CG1 ILE A 85 3.224 3.072 -8.144 1.00 10.00 C ATOM 1326 CG2 ILE A 85 2.269 4.336 -10.107 1.00 10.00 C ATOM 1327 CD1 ILE A 85 3.827 2.072 -9.129 1.00 10.00 C ATOM 0 H ILE A 85 3.402 6.181 -7.086 1.00 10.00 H new ATOM 0 HA ILE A 85 5.097 4.572 -8.691 1.00 10.00 H new ATOM 0 HB ILE A 85 2.280 5.025 -8.130 1.00 10.00 H new ATOM 0 HG12 ILE A 85 3.892 3.175 -7.289 1.00 10.00 H new ATOM 0 HG13 ILE A 85 2.282 2.674 -7.766 1.00 10.00 H new ATOM 0 HG21 ILE A 85 1.366 3.736 -9.995 1.00 10.00 H new ATOM 0 HG22 ILE A 85 2.003 5.329 -10.470 1.00 10.00 H new ATOM 0 HG23 ILE A 85 2.937 3.855 -10.822 1.00 10.00 H new ATOM 0 HD11 ILE A 85 3.977 1.115 -8.630 1.00 10.00 H new ATOM 0 HD12 ILE A 85 3.150 1.939 -9.973 1.00 10.00 H new ATOM 0 HD13 ILE A 85 4.785 2.448 -9.488 1.00 10.00 H new ATOM 1339 N LYS A 86 4.976 5.358 -11.089 1.00 10.00 N ATOM 1340 CA LYS A 86 5.391 5.955 -12.351 1.00 10.00 C ATOM 1341 C LYS A 86 4.289 6.846 -12.932 1.00 10.00 C ATOM 1342 O LYS A 86 4.589 7.931 -13.421 1.00 10.00 O ATOM 1343 CB LYS A 86 5.785 4.867 -13.359 1.00 10.00 C ATOM 1344 CG LYS A 86 6.755 3.822 -12.788 1.00 10.00 C ATOM 1345 CD LYS A 86 7.331 2.919 -13.895 1.00 10.00 C ATOM 1346 CE LYS A 86 8.624 3.489 -14.497 1.00 10.00 C ATOM 1347 NZ LYS A 86 9.116 2.669 -15.626 1.00 10.00 N ATOM 0 H LYS A 86 5.054 4.341 -11.073 1.00 10.00 H new ATOM 0 HA LYS A 86 6.262 6.580 -12.153 1.00 10.00 H new ATOM 0 HB2 LYS A 86 4.884 4.362 -13.707 1.00 10.00 H new ATOM 0 HB3 LYS A 86 6.242 5.338 -14.229 1.00 10.00 H new ATOM 0 HG2 LYS A 86 7.570 4.326 -12.268 1.00 10.00 H new ATOM 0 HG3 LYS A 86 6.237 3.209 -12.050 1.00 10.00 H new ATOM 0 HD2 LYS A 86 7.529 1.928 -13.486 1.00 10.00 H new ATOM 0 HD3 LYS A 86 6.589 2.796 -14.684 1.00 10.00 H new ATOM 0 HE2 LYS A 86 8.446 4.508 -14.839 1.00 10.00 H new ATOM 0 HE3 LYS A 86 9.392 3.541 -13.725 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 9.990 3.087 -16.004 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 9.310 1.703 -15.294 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 8.394 2.640 -16.374 1.00 10.00 H new ATOM 1361 N LYS A 87 3.043 6.355 -12.908 1.00 10.00 N ATOM 1362 CA LYS A 87 1.833 7.017 -13.366 1.00 10.00 C ATOM 1363 C LYS A 87 0.631 6.091 -13.141 1.00 10.00 C ATOM 1364 O LYS A 87 0.782 4.971 -12.645 1.00 10.00 O ATOM 1365 CB LYS A 87 1.954 7.373 -14.851 1.00 10.00 C ATOM 1366 CG LYS A 87 1.980 6.114 -15.722 1.00 10.00 C ATOM 1367 CD LYS A 87 2.782 6.284 -17.009 1.00 10.00 C ATOM 1368 CE LYS A 87 4.282 6.420 -16.714 1.00 10.00 C ATOM 1369 NZ LYS A 87 5.089 5.992 -17.869 1.00 10.00 N ATOM 0 H LYS A 87 2.850 5.423 -12.542 1.00 10.00 H new ATOM 0 HA LYS A 87 1.690 7.938 -12.801 1.00 10.00 H new ATOM 0 HB2 LYS A 87 1.116 8.005 -15.146 1.00 10.00 H new ATOM 0 HB3 LYS A 87 2.863 7.951 -15.016 1.00 10.00 H new ATOM 0 HG2 LYS A 87 2.402 5.291 -15.145 1.00 10.00 H new ATOM 0 HG3 LYS A 87 0.957 5.834 -15.974 1.00 10.00 H new ATOM 0 HD2 LYS A 87 2.613 5.427 -17.662 1.00 10.00 H new ATOM 0 HD3 LYS A 87 2.432 7.167 -17.545 1.00 10.00 H new ATOM 0 HE2 LYS A 87 4.515 7.456 -16.467 1.00 10.00 H new ATOM 0 HE3 LYS A 87 4.541 5.819 -15.842 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 6.099 6.094 -17.644 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 4.882 4.997 -18.088 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 4.857 6.583 -18.693 1.00 10.00 H new ATOM 1383 N LYS A 88 -0.551 6.536 -13.575 1.00 10.00 N ATOM 1384 CA LYS A 88 -1.813 5.851 -13.334 1.00 10.00 C ATOM 1385 C LYS A 88 -1.857 4.446 -13.945 1.00 10.00 C ATOM 1386 O LYS A 88 -2.381 3.508 -13.347 1.00 10.00 O ATOM 1387 CB LYS A 88 -3.004 6.734 -13.714 1.00 10.00 C ATOM 1388 CG LYS A 88 -3.098 7.008 -15.217 1.00 10.00 C ATOM 1389 CD LYS A 88 -4.205 8.033 -15.479 1.00 10.00 C ATOM 1390 CE LYS A 88 -4.217 8.411 -16.965 1.00 10.00 C ATOM 1391 NZ LYS A 88 -5.301 9.360 -17.287 1.00 10.00 N ATOM 0 H LYS A 88 -0.654 7.397 -14.112 1.00 10.00 H new ATOM 0 HA LYS A 88 -1.892 5.678 -12.261 1.00 10.00 H new ATOM 0 HB2 LYS A 88 -3.924 6.254 -13.381 1.00 10.00 H new ATOM 0 HB3 LYS A 88 -2.929 7.683 -13.183 1.00 10.00 H new ATOM 0 HG2 LYS A 88 -2.145 7.383 -15.590 1.00 10.00 H new ATOM 0 HG3 LYS A 88 -3.309 6.083 -15.754 1.00 10.00 H new ATOM 0 HD2 LYS A 88 -5.172 7.620 -15.191 1.00 10.00 H new ATOM 0 HD3 LYS A 88 -4.043 8.922 -14.869 1.00 10.00 H new ATOM 0 HE2 LYS A 88 -3.257 8.852 -17.234 1.00 10.00 H new ATOM 0 HE3 LYS A 88 -4.334 7.510 -17.567 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 -5.272 9.589 -18.301 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 -6.219 8.930 -17.055 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 -5.176 10.231 -16.732 1.00 10.00 H new ATOM 1405 N THR A 89 -1.270 4.307 -15.130 1.00 10.00 N ATOM 1406 CA THR A 89 -1.092 3.049 -15.828 1.00 10.00 C ATOM 1407 C THR A 89 -0.446 2.014 -14.903 1.00 10.00 C ATOM 1408 O THR A 89 -0.959 0.916 -14.701 1.00 10.00 O ATOM 1409 CB THR A 89 -0.206 3.358 -17.045 1.00 10.00 C ATOM 1410 OG1 THR A 89 -0.613 4.603 -17.593 1.00 10.00 O ATOM 1411 CG2 THR A 89 -0.320 2.278 -18.116 1.00 10.00 C ATOM 0 H THR A 89 -0.892 5.102 -15.646 1.00 10.00 H new ATOM 0 HA THR A 89 -2.043 2.622 -16.147 1.00 10.00 H new ATOM 0 HB THR A 89 0.833 3.394 -16.717 1.00 10.00 H new ATOM 0 HG1 THR A 89 -0.056 4.816 -18.370 1.00 10.00 H new ATOM 0 HG21 THR A 89 0.321 2.533 -18.960 1.00 10.00 H new ATOM 0 HG22 THR A 89 -0.009 1.319 -17.701 1.00 10.00 H new ATOM 0 HG23 THR A 89 -1.354 2.209 -18.454 1.00 10.00 H new ATOM 1419 N GLU A 90 0.685 2.396 -14.311 1.00 10.00 N ATOM 1420 CA GLU A 90 1.455 1.510 -13.470 1.00 10.00 C ATOM 1421 C GLU A 90 0.656 1.078 -12.245 1.00 10.00 C ATOM 1422 O GLU A 90 0.512 -0.116 -12.016 1.00 10.00 O ATOM 1423 CB GLU A 90 2.776 2.175 -13.097 1.00 10.00 C ATOM 1424 CG GLU A 90 3.940 1.692 -13.975 1.00 10.00 C ATOM 1425 CD GLU A 90 3.916 2.179 -15.424 1.00 10.00 C ATOM 1426 OE1 GLU A 90 3.770 3.403 -15.634 1.00 10.00 O ATOM 1427 OE2 GLU A 90 4.149 1.332 -16.309 1.00 10.00 O ATOM 0 H GLU A 90 1.084 3.330 -14.407 1.00 10.00 H new ATOM 0 HA GLU A 90 1.682 0.599 -14.023 1.00 10.00 H new ATOM 0 HB2 GLU A 90 2.676 3.256 -13.193 1.00 10.00 H new ATOM 0 HB3 GLU A 90 3.002 1.967 -12.051 1.00 10.00 H new ATOM 0 HG2 GLU A 90 4.876 2.013 -13.517 1.00 10.00 H new ATOM 0 HG3 GLU A 90 3.944 0.602 -13.976 1.00 10.00 H new ATOM 1434 N ARG A 91 0.145 2.020 -11.446 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.659 1.665 -10.279 1.00 10.00 C ATOM 1436 C ARG A 91 -1.815 0.737 -10.673 1.00 10.00 C ATOM 1437 O ARG A 91 -2.080 -0.243 -9.981 1.00 10.00 O ATOM 1438 CB ARG A 91 -1.203 2.876 -9.503 1.00 10.00 C ATOM 1439 CG ARG A 91 -1.426 4.179 -10.284 1.00 10.00 C ATOM 1440 CD ARG A 91 -2.818 4.811 -10.108 1.00 10.00 C ATOM 1441 NE ARG A 91 -2.758 6.290 -10.067 1.00 10.00 N ATOM 1442 CZ ARG A 91 -3.811 7.123 -10.074 1.00 10.00 C ATOM 1443 NH1 ARG A 91 -5.052 6.647 -10.225 1.00 10.00 N ATOM 1444 NH2 ARG A 91 -3.618 8.437 -9.952 1.00 10.00 N ATOM 0 H ARG A 91 0.273 3.022 -11.586 1.00 10.00 H new ATOM 0 HA ARG A 91 0.022 1.145 -9.605 1.00 10.00 H new ATOM 0 HB2 ARG A 91 -2.153 2.587 -9.053 1.00 10.00 H new ATOM 0 HB3 ARG A 91 -0.514 3.088 -8.685 1.00 10.00 H new ATOM 0 HG2 ARG A 91 -0.673 4.904 -9.975 1.00 10.00 H new ATOM 0 HG3 ARG A 91 -1.264 3.982 -11.344 1.00 10.00 H new ATOM 0 HD2 ARG A 91 -3.464 4.498 -10.928 1.00 10.00 H new ATOM 0 HD3 ARG A 91 -3.270 4.441 -9.187 1.00 10.00 H new ATOM 0 HE ARG A 91 -1.832 6.715 -10.030 1.00 10.00 H new ATOM 0 HH11 ARG A 91 -5.204 5.644 -10.336 1.00 10.00 H new ATOM 0 HH12 ARG A 91 -5.847 7.287 -10.229 1.00 10.00 H new ATOM 0 HH21 ARG A 91 -2.672 8.807 -9.854 1.00 10.00 H new ATOM 0 HH22 ARG A 91 -4.416 9.072 -9.957 1.00 10.00 H new ATOM 1458 N GLU A 92 -2.510 1.054 -11.769 1.00 10.00 N ATOM 1459 CA GLU A 92 -3.635 0.266 -12.248 1.00 10.00 C ATOM 1460 C GLU A 92 -3.200 -1.190 -12.463 1.00 10.00 C ATOM 1461 O GLU A 92 -3.846 -2.126 -11.985 1.00 10.00 O ATOM 1462 CB GLU A 92 -4.170 0.930 -13.525 1.00 10.00 C ATOM 1463 CG GLU A 92 -5.261 0.097 -14.195 1.00 10.00 C ATOM 1464 CD GLU A 92 -5.807 0.745 -15.461 1.00 10.00 C ATOM 1465 OE1 GLU A 92 -5.663 1.981 -15.593 1.00 10.00 O ATOM 1466 OE2 GLU A 92 -6.365 -0.025 -16.272 1.00 10.00 O ATOM 0 H GLU A 92 -2.303 1.869 -12.347 1.00 10.00 H new ATOM 0 HA GLU A 92 -4.442 0.237 -11.516 1.00 10.00 H new ATOM 0 HB2 GLU A 92 -4.566 1.916 -13.281 1.00 10.00 H new ATOM 0 HB3 GLU A 92 -3.349 1.081 -14.226 1.00 10.00 H new ATOM 0 HG2 GLU A 92 -4.861 -0.887 -14.440 1.00 10.00 H new ATOM 0 HG3 GLU A 92 -6.078 -0.057 -13.490 1.00 10.00 H new ATOM 1473 N ASP A 93 -2.080 -1.375 -13.160 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.487 -2.694 -13.380 1.00 10.00 C ATOM 1475 C ASP A 93 -1.150 -3.326 -12.025 1.00 10.00 C ATOM 1476 O ASP A 93 -1.499 -4.469 -11.745 1.00 10.00 O ATOM 1477 CB ASP A 93 -0.259 -2.563 -14.299 1.00 10.00 C ATOM 1478 CG ASP A 93 -0.589 -2.649 -15.788 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -1.783 -2.837 -16.121 1.00 10.00 O ATOM 1480 OD2 ASP A 93 0.376 -2.560 -16.577 1.00 10.00 O ATOM 0 H ASP A 93 -1.556 -0.612 -13.590 1.00 10.00 H new ATOM 0 HA ASP A 93 -2.192 -3.355 -13.884 1.00 10.00 H new ATOM 0 HB2 ASP A 93 0.232 -1.610 -14.100 1.00 10.00 H new ATOM 0 HB3 ASP A 93 0.455 -3.348 -14.049 1.00 10.00 H new ATOM 1485 N LEU A 94 -0.518 -2.558 -11.144 1.00 10.00 N ATOM 1486 CA LEU A 94 -0.149 -2.966 -9.795 1.00 10.00 C ATOM 1487 C LEU A 94 -1.328 -3.579 -9.032 1.00 10.00 C ATOM 1488 O LEU A 94 -1.210 -4.678 -8.483 1.00 10.00 O ATOM 1489 CB LEU A 94 0.448 -1.760 -9.066 1.00 10.00 C ATOM 1490 CG LEU A 94 1.716 -2.114 -8.298 1.00 10.00 C ATOM 1491 CD1 LEU A 94 2.308 -0.819 -7.753 1.00 10.00 C ATOM 1492 CD2 LEU A 94 1.419 -3.046 -7.139 1.00 10.00 C ATOM 0 H LEU A 94 -0.239 -1.601 -11.358 1.00 10.00 H new ATOM 0 HA LEU A 94 0.599 -3.756 -9.852 1.00 10.00 H new ATOM 0 HB2 LEU A 94 0.672 -0.976 -9.789 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -0.291 -1.355 -8.375 1.00 10.00 H new ATOM 0 HG LEU A 94 2.410 -2.621 -8.968 1.00 10.00 H new ATOM 0 HD11 LEU A 94 3.219 -1.041 -7.197 1.00 10.00 H new ATOM 0 HD12 LEU A 94 2.542 -0.149 -8.581 1.00 10.00 H new ATOM 0 HD13 LEU A 94 1.587 -0.340 -7.091 1.00 10.00 H new ATOM 0 HD21 LEU A 94 2.345 -3.278 -6.613 1.00 10.00 H new ATOM 0 HD22 LEU A 94 0.723 -2.563 -6.453 1.00 10.00 H new ATOM 0 HD23 LEU A 94 0.976 -3.967 -7.517 1.00 10.00 H new ATOM 1504 N ILE A 95 -2.473 -2.885 -9.018 1.00 10.00 N ATOM 1505 CA ILE A 95 -3.705 -3.399 -8.433 1.00 10.00 C ATOM 1506 C ILE A 95 -4.006 -4.802 -8.939 1.00 10.00 C ATOM 1507 O ILE A 95 -4.459 -5.639 -8.169 1.00 10.00 O ATOM 1508 CB ILE A 95 -4.892 -2.447 -8.690 1.00 10.00 C ATOM 1509 CG1 ILE A 95 -5.016 -1.453 -7.537 1.00 10.00 C ATOM 1510 CG2 ILE A 95 -6.244 -3.177 -8.793 1.00 10.00 C ATOM 1511 CD1 ILE A 95 -3.978 -0.343 -7.547 1.00 10.00 C ATOM 0 H ILE A 95 -2.565 -1.950 -9.414 1.00 10.00 H new ATOM 0 HA ILE A 95 -3.559 -3.456 -7.354 1.00 10.00 H new ATOM 0 HB ILE A 95 -4.681 -1.957 -9.641 1.00 10.00 H new ATOM 0 HG12 ILE A 95 -6.009 -1.005 -7.566 1.00 10.00 H new ATOM 0 HG13 ILE A 95 -4.939 -1.997 -6.595 1.00 10.00 H new ATOM 0 HG21 ILE A 95 -7.037 -2.451 -8.974 1.00 10.00 H new ATOM 0 HG22 ILE A 95 -6.210 -3.890 -9.616 1.00 10.00 H new ATOM 0 HG23 ILE A 95 -6.443 -3.707 -7.862 1.00 10.00 H new ATOM 0 HD11 ILE A 95 -4.141 0.315 -6.694 1.00 10.00 H new ATOM 0 HD12 ILE A 95 -2.980 -0.777 -7.485 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -4.067 0.230 -8.470 1.00 10.00 H new ATOM 1523 N ALA A 96 -3.800 -5.057 -10.228 1.00 10.00 N ATOM 1524 CA ALA A 96 -4.079 -6.363 -10.807 1.00 10.00 C ATOM 1525 C ALA A 96 -3.302 -7.460 -10.088 1.00 10.00 C ATOM 1526 O ALA A 96 -3.877 -8.474 -9.697 1.00 10.00 O ATOM 1527 CB ALA A 96 -3.743 -6.367 -12.288 1.00 10.00 C ATOM 0 H ALA A 96 -3.439 -4.372 -10.892 1.00 10.00 H new ATOM 0 HA ALA A 96 -5.143 -6.565 -10.685 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -3.957 -7.350 -12.707 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -4.345 -5.616 -12.800 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -2.686 -6.138 -12.422 1.00 10.00 H new ATOM 1533 N TYR A 97 -1.995 -7.258 -9.906 1.00 10.00 N ATOM 1534 CA TYR A 97 -1.205 -8.210 -9.147 1.00 10.00 C ATOM 1535 C TYR A 97 -1.751 -8.306 -7.737 1.00 10.00 C ATOM 1536 O TYR A 97 -2.138 -9.389 -7.305 1.00 10.00 O ATOM 1537 CB TYR A 97 0.264 -7.812 -9.112 1.00 10.00 C ATOM 1538 CG TYR A 97 1.110 -8.695 -8.211 1.00 10.00 C ATOM 1539 CD1 TYR A 97 1.155 -10.086 -8.427 1.00 10.00 C ATOM 1540 CD2 TYR A 97 1.797 -8.139 -7.115 1.00 10.00 C ATOM 1541 CE1 TYR A 97 1.908 -10.909 -7.574 1.00 10.00 C ATOM 1542 CE2 TYR A 97 2.587 -8.960 -6.292 1.00 10.00 C ATOM 1543 CZ TYR A 97 2.634 -10.346 -6.513 1.00 10.00 C ATOM 1544 OH TYR A 97 3.438 -11.143 -5.756 1.00 10.00 O ATOM 0 H TYR A 97 -1.476 -6.458 -10.269 1.00 10.00 H new ATOM 0 HA TYR A 97 -1.274 -9.181 -9.637 1.00 10.00 H new ATOM 0 HB2 TYR A 97 0.666 -7.848 -10.124 1.00 10.00 H new ATOM 0 HB3 TYR A 97 0.344 -6.779 -8.774 1.00 10.00 H new ATOM 0 HD1 TYR A 97 0.609 -10.521 -9.251 1.00 10.00 H new ATOM 0 HD2 TYR A 97 1.717 -7.082 -6.907 1.00 10.00 H new ATOM 0 HE1 TYR A 97 1.928 -11.977 -7.735 1.00 10.00 H new ATOM 0 HE2 TYR A 97 3.160 -8.524 -5.487 1.00 10.00 H new ATOM 0 HH TYR A 97 3.873 -10.604 -5.063 1.00 10.00 H new ATOM 1554 N LEU A 98 -1.780 -7.169 -7.036 1.00 10.00 N ATOM 1555 CA LEU A 98 -2.290 -7.100 -5.671 1.00 10.00 C ATOM 1556 C LEU A 98 -3.602 -7.872 -5.514 1.00 10.00 C ATOM 1557 O LEU A 98 -3.746 -8.596 -4.537 1.00 10.00 O ATOM 1558 CB LEU A 98 -2.419 -5.652 -5.177 1.00 10.00 C ATOM 1559 CG LEU A 98 -1.304 -5.248 -4.194 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -0.315 -4.304 -4.854 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -1.896 -4.576 -2.957 1.00 10.00 C ATOM 0 H LEU A 98 -1.451 -6.275 -7.401 1.00 10.00 H new ATOM 0 HA LEU A 98 -1.552 -7.588 -5.034 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -2.401 -4.979 -6.034 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -3.387 -5.525 -4.692 1.00 10.00 H new ATOM 0 HG LEU A 98 -0.781 -6.157 -3.895 1.00 10.00 H new ATOM 0 HD11 LEU A 98 0.462 -4.034 -4.139 1.00 10.00 H new ATOM 0 HD12 LEU A 98 0.138 -4.796 -5.715 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -0.835 -3.404 -5.183 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -1.093 -4.298 -2.275 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -2.444 -3.682 -3.256 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -2.574 -5.267 -2.457 1.00 10.00 H new ATOM 1573 N LYS A 99 -4.549 -7.752 -6.452 1.00 10.00 N ATOM 1574 CA LYS A 99 -5.828 -8.453 -6.384 1.00 10.00 C ATOM 1575 C LYS A 99 -5.619 -9.932 -6.111 1.00 10.00 C ATOM 1576 O LYS A 99 -6.134 -10.449 -5.121 1.00 10.00 O ATOM 1577 CB LYS A 99 -6.672 -8.251 -7.651 1.00 10.00 C ATOM 1578 CG LYS A 99 -7.538 -6.996 -7.536 1.00 10.00 C ATOM 1579 CD LYS A 99 -8.550 -6.920 -8.686 1.00 10.00 C ATOM 1580 CE LYS A 99 -9.366 -5.633 -8.507 1.00 10.00 C ATOM 1581 NZ LYS A 99 -10.377 -5.425 -9.560 1.00 10.00 N ATOM 0 H LYS A 99 -4.446 -7.164 -7.279 1.00 10.00 H new ATOM 0 HA LYS A 99 -6.385 -8.018 -5.554 1.00 10.00 H new ATOM 0 HB2 LYS A 99 -6.018 -8.168 -8.519 1.00 10.00 H new ATOM 0 HB3 LYS A 99 -7.307 -9.122 -7.812 1.00 10.00 H new ATOM 0 HG2 LYS A 99 -8.066 -7.000 -6.582 1.00 10.00 H new ATOM 0 HG3 LYS A 99 -6.904 -6.110 -7.546 1.00 10.00 H new ATOM 0 HD2 LYS A 99 -8.036 -6.916 -9.647 1.00 10.00 H new ATOM 0 HD3 LYS A 99 -9.204 -7.792 -8.678 1.00 10.00 H new ATOM 0 HE2 LYS A 99 -9.863 -5.660 -7.537 1.00 10.00 H new ATOM 0 HE3 LYS A 99 -8.687 -4.781 -8.493 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 -10.525 -4.406 -9.703 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 -10.047 -5.855 -10.448 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 -11.273 -5.868 -9.273 1.00 10.00 H new ATOM 1595 N LYS A 100 -4.859 -10.614 -6.968 1.00 10.00 N ATOM 1596 CA LYS A 100 -4.560 -11.996 -6.721 1.00 10.00 C ATOM 1597 C LYS A 100 -3.705 -12.093 -5.454 1.00 10.00 C ATOM 1598 O LYS A 100 -4.047 -12.854 -4.566 1.00 10.00 O ATOM 1599 CB LYS A 100 -3.909 -12.606 -7.969 1.00 10.00 C ATOM 1600 CG LYS A 100 -3.529 -14.061 -7.682 1.00 10.00 C ATOM 1601 CD LYS A 100 -4.207 -15.101 -8.583 1.00 10.00 C ATOM 1602 CE LYS A 100 -3.568 -15.170 -9.977 1.00 10.00 C ATOM 1603 NZ LYS A 100 -3.893 -16.441 -10.658 1.00 10.00 N ATOM 0 H LYS A 100 -4.453 -10.228 -7.820 1.00 10.00 H new ATOM 0 HA LYS A 100 -5.462 -12.580 -6.537 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -4.597 -12.558 -8.813 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -3.023 -12.035 -8.247 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -2.449 -14.165 -7.783 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -3.775 -14.287 -6.644 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -4.148 -16.081 -8.110 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -5.265 -14.858 -8.682 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -3.917 -14.332 -10.581 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -2.486 -15.069 -9.888 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 -3.446 -16.456 -11.597 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -3.538 -17.238 -10.093 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -4.924 -16.524 -10.764 1.00 10.00 H new ATOM 1617 N ALA A 101 -2.623 -11.323 -5.354 1.00 10.00 N ATOM 1618 CA ALA A 101 -1.557 -11.546 -4.381 1.00 10.00 C ATOM 1619 C ALA A 101 -2.056 -11.463 -2.935 1.00 10.00 C ATOM 1620 O ALA A 101 -1.571 -12.136 -2.030 1.00 10.00 O ATOM 1621 CB ALA A 101 -0.452 -10.516 -4.621 1.00 10.00 C ATOM 0 H ALA A 101 -2.461 -10.515 -5.955 1.00 10.00 H new ATOM 0 HA ALA A 101 -1.174 -12.557 -4.520 1.00 10.00 H new ATOM 0 HB1 ALA A 101 0.352 -10.670 -3.901 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -0.061 -10.631 -5.632 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -0.858 -9.512 -4.501 1.00 10.00 H new ATOM 1627 N THR A 102 -2.999 -10.557 -2.698 1.00 10.00 N ATOM 1628 CA THR A 102 -3.541 -10.324 -1.373 1.00 10.00 C ATOM 1629 C THR A 102 -4.582 -11.382 -1.029 1.00 10.00 C ATOM 1630 O THR A 102 -4.683 -11.793 0.125 1.00 10.00 O ATOM 1631 CB THR A 102 -4.108 -8.909 -1.295 1.00 10.00 C ATOM 1632 OG1 THR A 102 -5.149 -8.754 -2.237 1.00 10.00 O ATOM 1633 CG2 THR A 102 -2.988 -7.900 -1.569 1.00 10.00 C ATOM 0 H THR A 102 -3.406 -9.966 -3.422 1.00 10.00 H new ATOM 0 HA THR A 102 -2.747 -10.408 -0.631 1.00 10.00 H new ATOM 0 HB THR A 102 -4.514 -8.733 -0.299 1.00 10.00 H new ATOM 0 HG1 THR A 102 -4.774 -8.461 -3.094 1.00 10.00 H new ATOM 0 HG21 THR A 102 -3.389 -6.888 -1.514 1.00 10.00 H new ATOM 0 HG22 THR A 102 -2.201 -8.019 -0.825 1.00 10.00 H new ATOM 0 HG23 THR A 102 -2.577 -8.074 -2.563 1.00 10.00 H new ATOM 1641 N ASN A 103 -5.351 -11.794 -2.039 1.00 10.00 N ATOM 1642 CA ASN A 103 -6.329 -12.865 -1.956 1.00 10.00 C ATOM 1643 C ASN A 103 -5.621 -14.198 -1.670 1.00 10.00 C ATOM 1644 O ASN A 103 -6.024 -14.932 -0.770 1.00 10.00 O ATOM 1645 CB ASN A 103 -7.120 -12.859 -3.274 1.00 10.00 C ATOM 1646 CG ASN A 103 -8.327 -13.788 -3.301 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -8.401 -14.780 -2.590 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -9.314 -13.454 -4.130 1.00 10.00 N ATOM 0 H ASN A 103 -5.303 -11.372 -2.967 1.00 10.00 H new ATOM 0 HA ASN A 103 -7.029 -12.722 -1.133 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -7.458 -11.842 -3.474 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -6.448 -13.137 -4.086 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -10.154 -14.030 -4.181 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -9.230 -12.622 -4.714 1.00 10.00 H new ATOM 1655 N GLU A 104 -4.550 -14.472 -2.418 1.00 10.00 N ATOM 1656 CA GLU A 104 -3.759 -15.689 -2.415 1.00 10.00 C ATOM 1657 C GLU A 104 -2.291 -15.305 -2.628 1.00 10.00 C ATOM 1658 O GLU A 104 -1.510 -15.458 -1.660 1.00 10.00 O ATOM 1659 CB GLU A 104 -4.237 -16.593 -3.561 1.00 10.00 C ATOM 1660 CG GLU A 104 -5.533 -17.344 -3.232 1.00 10.00 C ATOM 1661 CD GLU A 104 -5.947 -18.229 -4.400 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -5.273 -19.264 -4.594 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -6.905 -17.844 -5.104 1.00 10.00 O ATOM 1664 OXT GLU A 104 -1.977 -14.875 -3.762 1.00 10.00 O ATOM 0 H GLU A 104 -4.192 -13.793 -3.090 1.00 10.00 H new ATOM 0 HA GLU A 104 -3.867 -16.222 -1.470 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -4.391 -15.987 -4.454 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -3.455 -17.315 -3.797 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -5.391 -17.953 -2.339 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -6.327 -16.631 -3.009 1.00 10.00 H new