USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 952 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 131 ASN : amide:sc= -4.45! K(o=-2.5!,f=1.6) USER MOD Set 1.2: A 134 SER OG : rot -117:sc= 1.97 USER MOD Set 2.1: A 133 GLN : amide:sc= 0.0204 K(o=1.6,f=0.59) USER MOD Set 2.2: A 137 THR OG1 : rot -51:sc= 1.57 USER MOD Set 3.1: A 46 HIS : no HD1:sc= -0.931 K(o=-7.4,f=-17!) USER MOD Set 3.2: A 48 HIS : no HD1:sc= -0.776 K(o=-7.4,f=-5.2) USER MOD Set 3.3: A 63 HIS : no HE2:sc= -1.61 K(o=-7.4,f=-8.4) USER MOD Set 3.4: A 71 HIS : no HD1:sc= -1.91! C(o=-7.4!,f=-14!) USER MOD Set 3.5: A 80 HIS : no HD1:sc= -1.86 K(o=-7.4,f=-6.2) USER MOD Set 3.6: A 120 HIS : no HE2:sc= -0.32 K(o=-7.4,f=-13!) USER MOD Single : A 3 LYS NZ :NH3+ 179:sc= 1.18 (180deg=1.1) USER MOD Single : A 9 LYS NZ :NH3+ 173:sc= 1.28 (180deg=1.04) USER MOD Single : A 15 GLN : amide:sc= -0.137 K(o=-0.14,f=-1.1) USER MOD Single : A 19 ASN : amide:sc= -0.235 K(o=-0.24,f=-1.2!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0.0528 USER MOD Single : A 43 HIS : no HE2:sc= -2.96! C(o=-1.2!,f=-12!) USER MOD Single : A 65 ASN : amide:sc= -1.05 X(o=-1.1,f=-0.71) USER MOD Single : A 68 SER OG : rot -43:sc= 0.724 USER MOD Single : A 70 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0104) USER MOD Single : A 75 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.049) USER MOD Single : A 86 ASN : amide:sc= -0.173! C(o=-0.17!,f=-4!) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0.0549 USER MOD Single : A 105 SER OG : rot 55:sc= 1.24 USER MOD Single : A 110 HIS : no HE2:sc= 0.982 K(o=0.98,f=-3.4!) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot -73:sc= 1.08 USER MOD Single : A 136 LYS NZ :NH3+ -164:sc= 1.14 (180deg=1.05) USER MOD Single : A 139 ASN : amide:sc= -0.331 K(o=-0.33,f=-1.5) USER MOD Single : A 142 SER OG : rot 180:sc= 0.275 USER MOD Single : A 146 CYS SG : rot 180:sc= 0 USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 27 N LYS A 3 12.688 7.103 10.989 1.00 0.00 N ATOM 28 CA LYS A 3 11.897 5.888 11.074 1.00 0.00 C ATOM 29 C LYS A 3 10.421 6.283 11.141 1.00 0.00 C ATOM 30 O LYS A 3 10.002 6.966 12.079 1.00 0.00 O ATOM 31 CB LYS A 3 12.317 5.078 12.310 1.00 0.00 C ATOM 32 CG LYS A 3 13.098 3.816 11.931 1.00 0.00 C ATOM 33 CD LYS A 3 13.486 3.083 13.221 1.00 0.00 C ATOM 34 CE LYS A 3 13.963 1.648 12.957 1.00 0.00 C ATOM 35 NZ LYS A 3 15.184 1.598 12.128 1.00 0.00 N ATOM 0 HA LYS A 3 12.060 5.259 10.199 1.00 0.00 H new ATOM 0 HB2 LYS A 3 12.930 5.702 12.961 1.00 0.00 H new ATOM 0 HB3 LYS A 3 11.430 4.798 12.879 1.00 0.00 H new ATOM 0 HG2 LYS A 3 12.491 3.171 11.296 1.00 0.00 H new ATOM 0 HG3 LYS A 3 13.989 4.078 11.361 1.00 0.00 H new ATOM 0 HD2 LYS A 3 14.275 3.638 13.728 1.00 0.00 H new ATOM 0 HD3 LYS A 3 12.629 3.060 13.895 1.00 0.00 H new ATOM 0 HE2 LYS A 3 14.154 1.152 13.909 1.00 0.00 H new ATOM 0 HE3 LYS A 3 13.169 1.091 12.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 15.472 0.608 11.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 14.993 2.031 11.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 15.948 2.120 12.603 1.00 0.00 H new ATOM 49 N ALA A 4 9.641 5.867 10.144 1.00 0.00 N ATOM 50 CA ALA A 4 8.217 6.140 10.059 1.00 0.00 C ATOM 51 C ALA A 4 7.457 4.815 10.126 1.00 0.00 C ATOM 52 O ALA A 4 8.014 3.770 9.790 1.00 0.00 O ATOM 53 CB ALA A 4 7.966 6.939 8.779 1.00 0.00 C ATOM 0 H ALA A 4 9.994 5.320 9.359 1.00 0.00 H new ATOM 0 HA ALA A 4 7.855 6.743 10.892 1.00 0.00 H new ATOM 0 HB1 ALA A 4 6.902 7.158 8.690 1.00 0.00 H new ATOM 0 HB2 ALA A 4 8.527 7.873 8.817 1.00 0.00 H new ATOM 0 HB3 ALA A 4 8.290 6.356 7.917 1.00 0.00 H new ATOM 59 N VAL A 5 6.212 4.848 10.603 1.00 0.00 N ATOM 60 CA VAL A 5 5.361 3.692 10.850 1.00 0.00 C ATOM 61 C VAL A 5 3.959 4.018 10.345 1.00 0.00 C ATOM 62 O VAL A 5 3.578 5.187 10.374 1.00 0.00 O ATOM 63 CB VAL A 5 5.360 3.355 12.359 1.00 0.00 C ATOM 64 CG1 VAL A 5 4.775 4.494 13.206 1.00 0.00 C ATOM 65 CG2 VAL A 5 4.613 2.061 12.711 1.00 0.00 C ATOM 0 H VAL A 5 5.751 5.727 10.838 1.00 0.00 H new ATOM 0 HA VAL A 5 5.734 2.815 10.322 1.00 0.00 H new ATOM 0 HB VAL A 5 6.414 3.213 12.596 1.00 0.00 H new ATOM 0 HG11 VAL A 5 4.795 4.212 14.259 1.00 0.00 H new ATOM 0 HG12 VAL A 5 5.368 5.397 13.061 1.00 0.00 H new ATOM 0 HG13 VAL A 5 3.746 4.683 12.901 1.00 0.00 H new ATOM 0 HG21 VAL A 5 4.659 1.896 13.787 1.00 0.00 H new ATOM 0 HG22 VAL A 5 3.572 2.146 12.401 1.00 0.00 H new ATOM 0 HG23 VAL A 5 5.078 1.221 12.195 1.00 0.00 H new ATOM 75 N ALA A 6 3.179 3.021 9.916 1.00 0.00 N ATOM 76 CA ALA A 6 1.744 3.197 9.754 1.00 0.00 C ATOM 77 C ALA A 6 1.036 2.000 10.352 1.00 0.00 C ATOM 78 O ALA A 6 1.220 0.878 9.884 1.00 0.00 O ATOM 79 CB ALA A 6 1.368 3.384 8.287 1.00 0.00 C ATOM 0 H ALA A 6 3.521 2.090 9.677 1.00 0.00 H new ATOM 0 HA ALA A 6 1.432 4.102 10.276 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.289 3.513 8.202 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.871 4.267 7.892 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.675 2.506 7.718 1.00 0.00 H new ATOM 85 N VAL A 7 0.255 2.226 11.404 1.00 0.00 N ATOM 86 CA VAL A 7 -0.551 1.186 11.986 1.00 0.00 C ATOM 87 C VAL A 7 -1.872 1.111 11.216 1.00 0.00 C ATOM 88 O VAL A 7 -2.658 2.057 11.214 1.00 0.00 O ATOM 89 CB VAL A 7 -0.682 1.386 13.500 1.00 0.00 C ATOM 90 CG1 VAL A 7 0.692 1.627 14.139 1.00 0.00 C ATOM 91 CG2 VAL A 7 -1.644 2.504 13.927 1.00 0.00 C ATOM 0 H VAL A 7 0.171 3.132 11.866 1.00 0.00 H new ATOM 0 HA VAL A 7 -0.079 0.208 11.888 1.00 0.00 H new ATOM 0 HB VAL A 7 -1.119 0.455 13.862 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.574 1.766 15.214 1.00 0.00 H new ATOM 0 HG12 VAL A 7 1.336 0.767 13.953 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.144 2.519 13.705 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.668 2.567 15.015 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -1.303 3.454 13.516 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.645 2.285 13.554 1.00 0.00 H new ATOM 101 N LEU A 8 -2.088 0.009 10.502 1.00 0.00 N ATOM 102 CA LEU A 8 -3.335 -0.292 9.828 1.00 0.00 C ATOM 103 C LEU A 8 -4.340 -0.795 10.860 1.00 0.00 C ATOM 104 O LEU A 8 -3.945 -1.494 11.791 1.00 0.00 O ATOM 105 CB LEU A 8 -3.066 -1.315 8.712 1.00 0.00 C ATOM 106 CG LEU A 8 -2.896 -0.576 7.377 1.00 0.00 C ATOM 107 CD1 LEU A 8 -1.630 0.278 7.397 1.00 0.00 C ATOM 108 CD2 LEU A 8 -2.776 -1.603 6.257 1.00 0.00 C ATOM 0 H LEU A 8 -1.379 -0.713 10.377 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.760 0.596 9.359 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.169 -1.891 8.939 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.891 -2.024 8.646 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.759 0.070 7.217 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.525 0.795 6.443 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.698 1.011 8.201 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.762 -0.361 7.561 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -2.655 -1.089 5.303 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -1.910 -2.240 6.439 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.677 -2.216 6.227 1.00 0.00 H new ATOM 120 N LYS A 9 -5.618 -0.444 10.692 1.00 0.00 N ATOM 121 CA LYS A 9 -6.744 -0.860 11.516 1.00 0.00 C ATOM 122 C LYS A 9 -8.007 -0.799 10.651 1.00 0.00 C ATOM 123 O LYS A 9 -8.201 0.161 9.911 1.00 0.00 O ATOM 124 CB LYS A 9 -6.860 0.064 12.747 1.00 0.00 C ATOM 125 CG LYS A 9 -6.328 -0.579 14.042 1.00 0.00 C ATOM 126 CD LYS A 9 -7.429 -1.236 14.895 1.00 0.00 C ATOM 127 CE LYS A 9 -8.214 -2.296 14.110 1.00 0.00 C ATOM 128 NZ LYS A 9 -9.289 -2.934 14.892 1.00 0.00 N ATOM 0 H LYS A 9 -5.905 0.173 9.933 1.00 0.00 H new ATOM 0 HA LYS A 9 -6.605 -1.877 11.883 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -6.310 0.985 12.554 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -7.905 0.340 12.889 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -5.581 -1.330 13.786 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -5.824 0.183 14.637 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -6.979 -1.697 15.774 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -8.115 -0.469 15.253 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -8.647 -1.833 13.223 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.523 -3.065 13.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -9.852 -3.550 14.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -8.872 -3.502 15.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -9.903 -2.201 15.301 1.00 0.00 H new ATOM 142 N GLY A 10 -8.858 -1.825 10.703 1.00 0.00 N ATOM 143 CA GLY A 10 -10.178 -1.789 10.091 1.00 0.00 C ATOM 144 C GLY A 10 -11.267 -1.942 11.143 1.00 0.00 C ATOM 145 O GLY A 10 -10.976 -2.062 12.335 1.00 0.00 O ATOM 0 H GLY A 10 -8.646 -2.705 11.173 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -10.311 -0.847 9.558 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.264 -2.587 9.354 1.00 0.00 H new ATOM 149 N ASP A 11 -12.519 -1.982 10.681 1.00 0.00 N ATOM 150 CA ASP A 11 -13.704 -2.289 11.465 1.00 0.00 C ATOM 151 C ASP A 11 -13.492 -3.522 12.338 1.00 0.00 C ATOM 152 O ASP A 11 -13.896 -3.540 13.498 1.00 0.00 O ATOM 153 CB ASP A 11 -14.880 -2.533 10.509 1.00 0.00 C ATOM 154 CG ASP A 11 -15.195 -1.306 9.665 1.00 0.00 C ATOM 155 OD1 ASP A 11 -14.263 -0.889 8.939 1.00 0.00 O ATOM 156 OD2 ASP A 11 -16.342 -0.820 9.767 1.00 0.00 O ATOM 0 H ASP A 11 -12.738 -1.791 9.703 1.00 0.00 H new ATOM 0 HA ASP A 11 -13.914 -1.446 12.123 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -14.646 -3.373 9.854 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -15.762 -2.813 11.084 1.00 0.00 H new ATOM 161 N GLY A 12 -12.875 -4.571 11.780 1.00 0.00 N ATOM 162 CA GLY A 12 -12.681 -5.810 12.493 1.00 0.00 C ATOM 163 C GLY A 12 -11.385 -5.740 13.293 1.00 0.00 C ATOM 164 O GLY A 12 -10.822 -4.669 13.523 1.00 0.00 O ATOM 0 H GLY A 12 -12.504 -4.572 10.830 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -13.523 -5.993 13.160 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -12.643 -6.643 11.791 1.00 0.00 H new ATOM 168 N PRO A 13 -10.859 -6.896 13.699 1.00 0.00 N ATOM 169 CA PRO A 13 -9.595 -6.962 14.394 1.00 0.00 C ATOM 170 C PRO A 13 -8.418 -6.818 13.421 1.00 0.00 C ATOM 171 O PRO A 13 -7.288 -6.652 13.870 1.00 0.00 O ATOM 172 CB PRO A 13 -9.624 -8.303 15.127 1.00 0.00 C ATOM 173 CG PRO A 13 -10.520 -9.182 14.246 1.00 0.00 C ATOM 174 CD PRO A 13 -11.450 -8.204 13.520 1.00 0.00 C ATOM 0 HA PRO A 13 -9.454 -6.143 15.100 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -8.624 -8.725 15.228 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -10.030 -8.200 16.133 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.929 -9.763 13.538 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -11.087 -9.893 14.846 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.533 -8.455 12.462 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -12.457 -8.239 13.936 1.00 0.00 H new ATOM 182 N VAL A 14 -8.689 -6.836 12.107 1.00 0.00 N ATOM 183 CA VAL A 14 -7.734 -6.522 11.053 1.00 0.00 C ATOM 184 C VAL A 14 -6.934 -5.286 11.429 1.00 0.00 C ATOM 185 O VAL A 14 -7.487 -4.188 11.527 1.00 0.00 O ATOM 186 CB VAL A 14 -8.442 -6.312 9.701 1.00 0.00 C ATOM 187 CG1 VAL A 14 -7.385 -6.323 8.591 1.00 0.00 C ATOM 188 CG2 VAL A 14 -9.495 -7.390 9.412 1.00 0.00 C ATOM 0 H VAL A 14 -9.611 -7.078 11.745 1.00 0.00 H new ATOM 0 HA VAL A 14 -7.055 -7.368 10.945 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.965 -5.356 9.740 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.869 -6.175 7.626 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.668 -5.520 8.764 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -6.865 -7.281 8.593 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.962 -7.193 8.447 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -9.017 -8.369 9.390 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -10.255 -7.375 10.193 1.00 0.00 H new ATOM 198 N GLN A 15 -5.631 -5.488 11.622 1.00 0.00 N ATOM 199 CA GLN A 15 -4.690 -4.407 11.847 1.00 0.00 C ATOM 200 C GLN A 15 -3.389 -4.742 11.146 1.00 0.00 C ATOM 201 O GLN A 15 -3.222 -5.872 10.705 1.00 0.00 O ATOM 202 CB GLN A 15 -4.505 -4.179 13.356 1.00 0.00 C ATOM 203 CG GLN A 15 -3.850 -5.369 14.081 1.00 0.00 C ATOM 204 CD GLN A 15 -4.575 -5.758 15.371 1.00 0.00 C ATOM 205 OE1 GLN A 15 -5.289 -4.962 15.976 1.00 0.00 O ATOM 206 NE2 GLN A 15 -4.372 -6.990 15.832 1.00 0.00 N ATOM 0 H GLN A 15 -5.203 -6.414 11.625 1.00 0.00 H new ATOM 0 HA GLN A 15 -5.067 -3.473 11.431 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -3.894 -3.290 13.509 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -5.477 -3.979 13.807 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -3.828 -6.228 13.410 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -2.815 -5.120 14.314 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -3.776 -7.636 15.315 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -4.813 -7.288 16.702 1.00 0.00 H new ATOM 215 N GLY A 16 -2.460 -3.797 11.047 1.00 0.00 N ATOM 216 CA GLY A 16 -1.101 -4.109 10.661 1.00 0.00 C ATOM 217 C GLY A 16 -0.158 -3.056 11.196 1.00 0.00 C ATOM 218 O GLY A 16 -0.598 -1.984 11.588 1.00 0.00 O ATOM 0 H GLY A 16 -2.630 -2.808 11.231 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -0.821 -5.090 11.046 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -1.025 -4.159 9.575 1.00 0.00 H new ATOM 222 N ILE A 17 1.130 -3.371 11.201 1.00 0.00 N ATOM 223 CA ILE A 17 2.229 -2.480 11.485 1.00 0.00 C ATOM 224 C ILE A 17 3.072 -2.384 10.208 1.00 0.00 C ATOM 225 O ILE A 17 3.677 -3.366 9.782 1.00 0.00 O ATOM 226 CB ILE A 17 3.016 -3.038 12.684 1.00 0.00 C ATOM 227 CG1 ILE A 17 2.901 -4.567 12.830 1.00 0.00 C ATOM 228 CG2 ILE A 17 2.552 -2.323 13.962 1.00 0.00 C ATOM 229 CD1 ILE A 17 3.893 -5.150 13.834 1.00 0.00 C ATOM 0 H ILE A 17 1.447 -4.318 10.993 1.00 0.00 H new ATOM 0 HA ILE A 17 1.901 -1.477 11.759 1.00 0.00 H new ATOM 0 HB ILE A 17 4.074 -2.842 12.508 1.00 0.00 H new ATOM 0 HG12 ILE A 17 1.888 -4.821 13.141 1.00 0.00 H new ATOM 0 HG13 ILE A 17 3.062 -5.032 11.857 1.00 0.00 H new ATOM 0 HG21 ILE A 17 3.104 -2.712 14.817 1.00 0.00 H new ATOM 0 HG22 ILE A 17 2.736 -1.253 13.867 1.00 0.00 H new ATOM 0 HG23 ILE A 17 1.486 -2.496 14.109 1.00 0.00 H new ATOM 0 HD11 ILE A 17 3.761 -6.230 13.891 1.00 0.00 H new ATOM 0 HD12 ILE A 17 4.910 -4.925 13.513 1.00 0.00 H new ATOM 0 HD13 ILE A 17 3.717 -4.711 14.816 1.00 0.00 H new ATOM 241 N ILE A 18 3.079 -1.208 9.574 1.00 0.00 N ATOM 242 CA ILE A 18 3.930 -0.871 8.437 1.00 0.00 C ATOM 243 C ILE A 18 5.078 -0.025 8.954 1.00 0.00 C ATOM 244 O ILE A 18 4.868 0.753 9.878 1.00 0.00 O ATOM 245 CB ILE A 18 3.125 -0.076 7.396 1.00 0.00 C ATOM 246 CG1 ILE A 18 1.843 -0.810 6.993 1.00 0.00 C ATOM 247 CG2 ILE A 18 3.934 0.311 6.150 1.00 0.00 C ATOM 248 CD1 ILE A 18 2.117 -2.209 6.458 1.00 0.00 C ATOM 0 H ILE A 18 2.469 -0.439 9.851 1.00 0.00 H new ATOM 0 HA ILE A 18 4.306 -1.777 7.962 1.00 0.00 H new ATOM 0 HB ILE A 18 2.858 0.856 7.894 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.180 -0.878 7.856 1.00 0.00 H new ATOM 0 HG13 ILE A 18 1.319 -0.230 6.233 1.00 0.00 H new ATOM 0 HG21 ILE A 18 3.298 0.869 5.462 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.782 0.930 6.444 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.297 -0.591 5.657 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.175 -2.686 6.187 1.00 0.00 H new ATOM 0 HD12 ILE A 18 2.757 -2.143 5.578 1.00 0.00 H new ATOM 0 HD13 ILE A 18 2.616 -2.801 7.226 1.00 0.00 H new ATOM 260 N ASN A 19 6.256 -0.143 8.343 1.00 0.00 N ATOM 261 CA ASN A 19 7.407 0.701 8.588 1.00 0.00 C ATOM 262 C ASN A 19 7.885 1.274 7.257 1.00 0.00 C ATOM 263 O ASN A 19 7.811 0.616 6.218 1.00 0.00 O ATOM 264 CB ASN A 19 8.549 -0.083 9.236 1.00 0.00 C ATOM 265 CG ASN A 19 8.143 -0.905 10.457 1.00 0.00 C ATOM 266 OD1 ASN A 19 8.394 -2.105 10.523 1.00 0.00 O ATOM 267 ND2 ASN A 19 7.529 -0.274 11.454 1.00 0.00 N ATOM 0 H ASN A 19 6.434 -0.859 7.638 1.00 0.00 H new ATOM 0 HA ASN A 19 7.114 1.498 9.272 1.00 0.00 H new ATOM 0 HB2 ASN A 19 8.981 -0.752 8.492 1.00 0.00 H new ATOM 0 HB3 ASN A 19 9.332 0.616 9.529 1.00 0.00 H new ATOM 0 HD21 ASN A 19 7.258 -0.788 12.293 1.00 0.00 H new ATOM 0 HD22 ASN A 19 7.329 0.724 11.380 1.00 0.00 H new ATOM 274 N PHE A 20 8.394 2.502 7.319 1.00 0.00 N ATOM 275 CA PHE A 20 9.029 3.219 6.233 1.00 0.00 C ATOM 276 C PHE A 20 10.385 3.701 6.738 1.00 0.00 C ATOM 277 O PHE A 20 10.446 4.344 7.790 1.00 0.00 O ATOM 278 CB PHE A 20 8.161 4.421 5.859 1.00 0.00 C ATOM 279 CG PHE A 20 6.897 4.082 5.112 1.00 0.00 C ATOM 280 CD1 PHE A 20 5.710 3.792 5.808 1.00 0.00 C ATOM 281 CD2 PHE A 20 6.905 4.098 3.710 1.00 0.00 C ATOM 282 CE1 PHE A 20 4.543 3.478 5.092 1.00 0.00 C ATOM 283 CE2 PHE A 20 5.730 3.824 2.995 1.00 0.00 C ATOM 284 CZ PHE A 20 4.560 3.482 3.686 1.00 0.00 C ATOM 0 H PHE A 20 8.369 3.048 8.180 1.00 0.00 H new ATOM 0 HA PHE A 20 9.152 2.583 5.356 1.00 0.00 H new ATOM 0 HB2 PHE A 20 7.895 4.956 6.770 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.754 5.104 5.250 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.696 3.811 6.888 1.00 0.00 H new ATOM 0 HD2 PHE A 20 7.819 4.322 3.179 1.00 0.00 H new ATOM 0 HE1 PHE A 20 3.634 3.234 5.621 1.00 0.00 H new ATOM 0 HE2 PHE A 20 5.727 3.876 1.916 1.00 0.00 H new ATOM 0 HZ PHE A 20 3.668 3.220 3.137 1.00 0.00 H new ATOM 294 N GLU A 21 11.451 3.410 5.988 1.00 0.00 N ATOM 295 CA GLU A 21 12.786 3.935 6.245 1.00 0.00 C ATOM 296 C GLU A 21 13.442 4.323 4.920 1.00 0.00 C ATOM 297 O GLU A 21 13.187 3.695 3.894 1.00 0.00 O ATOM 298 CB GLU A 21 13.629 2.901 7.005 1.00 0.00 C ATOM 299 CG GLU A 21 14.786 3.565 7.759 1.00 0.00 C ATOM 300 CD GLU A 21 15.633 2.537 8.493 1.00 0.00 C ATOM 301 OE1 GLU A 21 16.383 1.817 7.805 1.00 0.00 O ATOM 302 OE2 GLU A 21 15.507 2.481 9.736 1.00 0.00 O ATOM 0 H GLU A 21 11.406 2.795 5.176 1.00 0.00 H new ATOM 0 HA GLU A 21 12.715 4.825 6.870 1.00 0.00 H new ATOM 0 HB2 GLU A 21 12.996 2.361 7.710 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.024 2.166 6.304 1.00 0.00 H new ATOM 0 HG2 GLU A 21 15.410 4.118 7.057 1.00 0.00 H new ATOM 0 HG3 GLU A 21 14.390 4.288 8.472 1.00 0.00 H new ATOM 395 N PRO A 28 15.940 5.630 -2.723 1.00 0.00 N ATOM 396 CA PRO A 28 14.582 5.125 -2.691 1.00 0.00 C ATOM 397 C PRO A 28 14.240 4.687 -1.263 1.00 0.00 C ATOM 398 O PRO A 28 15.084 4.132 -0.561 1.00 0.00 O ATOM 399 CB PRO A 28 14.584 3.941 -3.659 1.00 0.00 C ATOM 400 CG PRO A 28 16.000 3.380 -3.511 1.00 0.00 C ATOM 401 CD PRO A 28 16.851 4.628 -3.255 1.00 0.00 C ATOM 0 HA PRO A 28 13.837 5.866 -2.979 1.00 0.00 H new ATOM 0 HB2 PRO A 28 13.827 3.202 -3.395 1.00 0.00 H new ATOM 0 HB3 PRO A 28 14.379 4.256 -4.682 1.00 0.00 H new ATOM 0 HG2 PRO A 28 16.067 2.671 -2.685 1.00 0.00 H new ATOM 0 HG3 PRO A 28 16.320 2.853 -4.410 1.00 0.00 H new ATOM 0 HD2 PRO A 28 17.653 4.415 -2.549 1.00 0.00 H new ATOM 0 HD3 PRO A 28 17.320 4.976 -4.175 1.00 0.00 H new ATOM 409 N VAL A 29 12.995 4.906 -0.842 1.00 0.00 N ATOM 410 CA VAL A 29 12.530 4.501 0.472 1.00 0.00 C ATOM 411 C VAL A 29 12.259 3.009 0.435 1.00 0.00 C ATOM 412 O VAL A 29 11.715 2.523 -0.549 1.00 0.00 O ATOM 413 CB VAL A 29 11.264 5.297 0.824 1.00 0.00 C ATOM 414 CG1 VAL A 29 10.357 4.606 1.847 1.00 0.00 C ATOM 415 CG2 VAL A 29 11.653 6.662 1.386 1.00 0.00 C ATOM 0 H VAL A 29 12.284 5.370 -1.407 1.00 0.00 H new ATOM 0 HA VAL A 29 13.277 4.705 1.239 1.00 0.00 H new ATOM 0 HB VAL A 29 10.703 5.384 -0.106 1.00 0.00 H new ATOM 0 HG11 VAL A 29 9.486 5.231 2.042 1.00 0.00 H new ATOM 0 HG12 VAL A 29 10.032 3.643 1.453 1.00 0.00 H new ATOM 0 HG13 VAL A 29 10.907 4.451 2.775 1.00 0.00 H new ATOM 0 HG21 VAL A 29 10.752 7.223 1.634 1.00 0.00 H new ATOM 0 HG22 VAL A 29 12.256 6.527 2.284 1.00 0.00 H new ATOM 0 HG23 VAL A 29 12.229 7.211 0.641 1.00 0.00 H new ATOM 425 N LYS A 30 12.587 2.308 1.521 1.00 0.00 N ATOM 426 CA LYS A 30 12.137 0.963 1.803 1.00 0.00 C ATOM 427 C LYS A 30 10.770 1.049 2.486 1.00 0.00 C ATOM 428 O LYS A 30 10.630 1.718 3.514 1.00 0.00 O ATOM 429 CB LYS A 30 13.139 0.299 2.747 1.00 0.00 C ATOM 430 CG LYS A 30 14.354 -0.309 2.031 1.00 0.00 C ATOM 431 CD LYS A 30 14.292 -1.844 2.105 1.00 0.00 C ATOM 432 CE LYS A 30 15.666 -2.496 1.890 1.00 0.00 C ATOM 433 NZ LYS A 30 15.754 -3.800 2.580 1.00 0.00 N ATOM 0 H LYS A 30 13.196 2.683 2.249 1.00 0.00 H new ATOM 0 HA LYS A 30 12.059 0.380 0.885 1.00 0.00 H new ATOM 0 HB2 LYS A 30 13.487 1.037 3.470 1.00 0.00 H new ATOM 0 HB3 LYS A 30 12.631 -0.484 3.309 1.00 0.00 H new ATOM 0 HG2 LYS A 30 14.372 0.013 0.990 1.00 0.00 H new ATOM 0 HG3 LYS A 30 15.275 0.049 2.491 1.00 0.00 H new ATOM 0 HD2 LYS A 30 13.899 -2.143 3.077 1.00 0.00 H new ATOM 0 HD3 LYS A 30 13.596 -2.214 1.352 1.00 0.00 H new ATOM 0 HE2 LYS A 30 15.843 -2.634 0.823 1.00 0.00 H new ATOM 0 HE3 LYS A 30 16.448 -1.833 2.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 16.693 -4.216 2.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 15.609 -3.663 3.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 15.023 -4.439 2.209 1.00 0.00 H new ATOM 447 N VAL A 31 9.791 0.344 1.918 1.00 0.00 N ATOM 448 CA VAL A 31 8.446 0.158 2.429 1.00 0.00 C ATOM 449 C VAL A 31 8.352 -1.292 2.884 1.00 0.00 C ATOM 450 O VAL A 31 8.669 -2.196 2.113 1.00 0.00 O ATOM 451 CB VAL A 31 7.450 0.416 1.288 1.00 0.00 C ATOM 452 CG1 VAL A 31 6.000 0.205 1.737 1.00 0.00 C ATOM 453 CG2 VAL A 31 7.636 1.838 0.764 1.00 0.00 C ATOM 0 H VAL A 31 9.933 -0.141 1.032 1.00 0.00 H new ATOM 0 HA VAL A 31 8.222 0.836 3.252 1.00 0.00 H new ATOM 0 HB VAL A 31 7.652 -0.302 0.493 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.328 0.398 0.900 1.00 0.00 H new ATOM 0 HG12 VAL A 31 5.870 -0.822 2.077 1.00 0.00 H new ATOM 0 HG13 VAL A 31 5.769 0.889 2.553 1.00 0.00 H new ATOM 0 HG21 VAL A 31 6.930 2.023 -0.046 1.00 0.00 H new ATOM 0 HG22 VAL A 31 7.457 2.549 1.570 1.00 0.00 H new ATOM 0 HG23 VAL A 31 8.654 1.959 0.393 1.00 0.00 H new ATOM 463 N TRP A 32 7.909 -1.546 4.112 1.00 0.00 N ATOM 464 CA TRP A 32 7.737 -2.919 4.557 1.00 0.00 C ATOM 465 C TRP A 32 6.710 -2.947 5.670 1.00 0.00 C ATOM 466 O TRP A 32 6.357 -1.897 6.197 1.00 0.00 O ATOM 467 CB TRP A 32 9.079 -3.547 4.976 1.00 0.00 C ATOM 468 CG TRP A 32 9.617 -3.186 6.324 1.00 0.00 C ATOM 469 CD1 TRP A 32 9.235 -3.743 7.495 1.00 0.00 C ATOM 470 CD2 TRP A 32 10.669 -2.238 6.660 1.00 0.00 C ATOM 471 NE1 TRP A 32 9.971 -3.202 8.525 1.00 0.00 N ATOM 472 CE2 TRP A 32 10.902 -2.295 8.066 1.00 0.00 C ATOM 473 CE3 TRP A 32 11.438 -1.320 5.920 1.00 0.00 C ATOM 474 CZ2 TRP A 32 11.852 -1.484 8.704 1.00 0.00 C ATOM 475 CZ3 TRP A 32 12.415 -0.521 6.543 1.00 0.00 C ATOM 476 CH2 TRP A 32 12.626 -0.604 7.932 1.00 0.00 C ATOM 0 H TRP A 32 7.668 -0.834 4.801 1.00 0.00 H new ATOM 0 HA TRP A 32 7.370 -3.529 3.732 1.00 0.00 H new ATOM 0 HB2 TRP A 32 8.971 -4.631 4.936 1.00 0.00 H new ATOM 0 HB3 TRP A 32 9.826 -3.273 4.231 1.00 0.00 H new ATOM 0 HD1 TRP A 32 8.470 -4.497 7.606 1.00 0.00 H new ATOM 0 HE1 TRP A 32 9.843 -3.443 9.508 1.00 0.00 H new ATOM 0 HE3 TRP A 32 11.276 -1.227 4.856 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 11.986 -1.536 9.774 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 13.007 0.161 5.951 1.00 0.00 H new ATOM 0 HH2 TRP A 32 13.381 0.008 8.402 1.00 0.00 H new ATOM 487 N GLY A 33 6.211 -4.121 6.039 1.00 0.00 N ATOM 488 CA GLY A 33 5.237 -4.171 7.118 1.00 0.00 C ATOM 489 C GLY A 33 4.674 -5.557 7.318 1.00 0.00 C ATOM 490 O GLY A 33 5.169 -6.486 6.687 1.00 0.00 O ATOM 0 H GLY A 33 6.454 -5.020 5.624 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.705 -3.835 8.043 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.423 -3.478 6.902 1.00 0.00 H new ATOM 494 N SER A 34 3.630 -5.692 8.143 1.00 0.00 N ATOM 495 CA SER A 34 2.963 -6.958 8.357 1.00 0.00 C ATOM 496 C SER A 34 1.555 -6.664 8.856 1.00 0.00 C ATOM 497 O SER A 34 1.363 -5.822 9.739 1.00 0.00 O ATOM 498 CB SER A 34 3.773 -7.854 9.301 1.00 0.00 C ATOM 499 OG SER A 34 4.016 -7.223 10.545 1.00 0.00 O ATOM 0 H SER A 34 3.232 -4.919 8.676 1.00 0.00 H new ATOM 0 HA SER A 34 2.888 -7.523 7.428 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.236 -8.788 9.466 1.00 0.00 H new ATOM 0 HB3 SER A 34 4.723 -8.111 8.832 1.00 0.00 H new ATOM 0 HG SER A 34 4.533 -7.824 11.121 1.00 0.00 H new ATOM 505 N ILE A 35 0.564 -7.307 8.234 1.00 0.00 N ATOM 506 CA ILE A 35 -0.831 -7.214 8.646 1.00 0.00 C ATOM 507 C ILE A 35 -1.161 -8.356 9.601 1.00 0.00 C ATOM 508 O ILE A 35 -0.358 -9.260 9.799 1.00 0.00 O ATOM 509 CB ILE A 35 -1.749 -7.116 7.404 1.00 0.00 C ATOM 510 CG1 ILE A 35 -2.739 -5.936 7.490 1.00 0.00 C ATOM 511 CG2 ILE A 35 -2.511 -8.402 7.051 1.00 0.00 C ATOM 512 CD1 ILE A 35 -2.699 -5.108 6.208 1.00 0.00 C ATOM 0 H ILE A 35 0.712 -7.910 7.425 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.011 -6.297 9.207 1.00 0.00 H new ATOM 0 HB ILE A 35 -1.044 -6.940 6.591 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.749 -6.312 7.655 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -2.490 -5.306 8.344 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.125 -8.230 6.167 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -1.800 -9.202 6.848 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.150 -8.687 7.887 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -3.404 -4.280 6.287 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.693 -4.715 6.060 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -2.971 -5.737 5.360 1.00 0.00 H new ATOM 524 N LYS A 36 -2.350 -8.320 10.188 1.00 0.00 N ATOM 525 CA LYS A 36 -2.927 -9.386 10.966 1.00 0.00 C ATOM 526 C LYS A 36 -4.428 -9.166 10.876 1.00 0.00 C ATOM 527 O LYS A 36 -4.991 -8.386 11.642 1.00 0.00 O ATOM 528 CB LYS A 36 -2.452 -9.340 12.431 1.00 0.00 C ATOM 529 CG LYS A 36 -1.311 -10.331 12.696 1.00 0.00 C ATOM 530 CD LYS A 36 -1.137 -10.635 14.189 1.00 0.00 C ATOM 531 CE LYS A 36 -2.201 -11.643 14.662 1.00 0.00 C ATOM 532 NZ LYS A 36 -2.084 -11.951 16.102 1.00 0.00 N ATOM 0 H LYS A 36 -2.960 -7.505 10.126 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.629 -10.365 10.590 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -2.119 -8.331 12.673 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -3.289 -9.566 13.091 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.507 -11.259 12.159 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -0.381 -9.924 12.300 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -0.140 -11.037 14.370 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -1.219 -9.714 14.766 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -3.194 -11.242 14.459 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -2.106 -12.564 14.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -2.821 -12.633 16.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -1.147 -12.359 16.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -2.201 -11.078 16.654 1.00 0.00 H new ATOM 546 N GLY A 37 -5.051 -9.842 9.917 1.00 0.00 N ATOM 547 CA GLY A 37 -6.488 -10.051 9.889 1.00 0.00 C ATOM 548 C GLY A 37 -7.066 -10.199 8.485 1.00 0.00 C ATOM 549 O GLY A 37 -8.265 -10.428 8.346 1.00 0.00 O ATOM 0 H GLY A 37 -4.562 -10.265 9.128 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -6.726 -10.945 10.465 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -6.977 -9.213 10.385 1.00 0.00 H new ATOM 553 N LEU A 38 -6.249 -10.043 7.439 1.00 0.00 N ATOM 554 CA LEU A 38 -6.692 -10.312 6.085 1.00 0.00 C ATOM 555 C LEU A 38 -6.879 -11.820 5.910 1.00 0.00 C ATOM 556 O LEU A 38 -6.663 -12.601 6.829 1.00 0.00 O ATOM 557 CB LEU A 38 -5.673 -9.742 5.077 1.00 0.00 C ATOM 558 CG LEU A 38 -5.919 -8.285 4.649 1.00 0.00 C ATOM 559 CD1 LEU A 38 -7.369 -8.023 4.248 1.00 0.00 C ATOM 560 CD2 LEU A 38 -5.532 -7.253 5.702 1.00 0.00 C ATOM 0 H LEU A 38 -5.280 -9.732 7.513 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.648 -9.824 5.897 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.677 -9.812 5.513 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.676 -10.371 4.187 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.264 -8.165 3.786 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.483 -6.979 3.956 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.636 -8.666 3.409 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -8.024 -8.237 5.092 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -5.736 -6.252 5.323 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -6.113 -7.423 6.609 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.470 -7.345 5.929 1.00 0.00 H new ATOM 572 N THR A 39 -7.277 -12.230 4.713 1.00 0.00 N ATOM 573 CA THR A 39 -7.338 -13.615 4.286 1.00 0.00 C ATOM 574 C THR A 39 -6.239 -13.853 3.262 1.00 0.00 C ATOM 575 O THR A 39 -5.792 -12.897 2.627 1.00 0.00 O ATOM 576 CB THR A 39 -8.714 -13.855 3.667 1.00 0.00 C ATOM 577 OG1 THR A 39 -9.068 -12.735 2.869 1.00 0.00 O ATOM 578 CG2 THR A 39 -9.727 -14.029 4.798 1.00 0.00 C ATOM 0 H THR A 39 -7.577 -11.579 3.987 1.00 0.00 H new ATOM 0 HA THR A 39 -7.193 -14.299 5.122 1.00 0.00 H new ATOM 0 HB THR A 39 -8.702 -14.747 3.041 1.00 0.00 H new ATOM 0 HG1 THR A 39 -9.950 -12.885 2.468 1.00 0.00 H new ATOM 0 HG21 THR A 39 -10.717 -14.202 4.376 1.00 0.00 H new ATOM 0 HG22 THR A 39 -9.441 -14.881 5.414 1.00 0.00 H new ATOM 0 HG23 THR A 39 -9.746 -13.128 5.411 1.00 0.00 H new ATOM 586 N GLU A 40 -5.821 -15.112 3.110 1.00 0.00 N ATOM 587 CA GLU A 40 -4.806 -15.524 2.159 1.00 0.00 C ATOM 588 C GLU A 40 -5.044 -14.923 0.771 1.00 0.00 C ATOM 589 O GLU A 40 -6.188 -14.769 0.339 1.00 0.00 O ATOM 590 CB GLU A 40 -4.736 -17.055 2.092 1.00 0.00 C ATOM 591 CG GLU A 40 -6.107 -17.746 2.153 1.00 0.00 C ATOM 592 CD GLU A 40 -6.013 -19.178 1.645 1.00 0.00 C ATOM 593 OE1 GLU A 40 -5.905 -19.328 0.409 1.00 0.00 O ATOM 594 OE2 GLU A 40 -6.030 -20.088 2.501 1.00 0.00 O ATOM 0 H GLU A 40 -6.193 -15.885 3.661 1.00 0.00 H new ATOM 0 HA GLU A 40 -3.846 -15.143 2.508 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.235 -17.346 1.169 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.121 -17.417 2.916 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.476 -17.743 3.179 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.827 -17.189 1.554 1.00 0.00 H new ATOM 601 N GLY A 41 -3.956 -14.580 0.074 1.00 0.00 N ATOM 602 CA GLY A 41 -4.028 -14.069 -1.288 1.00 0.00 C ATOM 603 C GLY A 41 -3.664 -12.589 -1.347 1.00 0.00 C ATOM 604 O GLY A 41 -3.235 -11.997 -0.355 1.00 0.00 O ATOM 0 H GLY A 41 -3.007 -14.650 0.441 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.353 -14.637 -1.928 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -5.035 -14.214 -1.680 1.00 0.00 H new ATOM 608 N LEU A 42 -3.788 -12.002 -2.537 1.00 0.00 N ATOM 609 CA LEU A 42 -3.266 -10.676 -2.829 1.00 0.00 C ATOM 610 C LEU A 42 -4.238 -9.595 -2.366 1.00 0.00 C ATOM 611 O LEU A 42 -5.447 -9.734 -2.539 1.00 0.00 O ATOM 612 CB LEU A 42 -2.945 -10.553 -4.325 1.00 0.00 C ATOM 613 CG LEU A 42 -1.569 -11.112 -4.724 1.00 0.00 C ATOM 614 CD1 LEU A 42 -1.350 -12.558 -4.267 1.00 0.00 C ATOM 615 CD2 LEU A 42 -1.413 -11.041 -6.246 1.00 0.00 C ATOM 0 H LEU A 42 -4.258 -12.441 -3.329 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.339 -10.531 -2.275 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.715 -11.074 -4.894 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -2.994 -9.502 -4.610 1.00 0.00 H new ATOM 0 HG LEU A 42 -0.821 -10.498 -4.222 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -0.361 -12.893 -4.580 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -1.425 -12.612 -3.181 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.109 -13.200 -4.715 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.438 -11.437 -6.531 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -2.197 -11.632 -6.720 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -1.493 -10.004 -6.572 1.00 0.00 H new ATOM 627 N HIS A 43 -3.701 -8.522 -1.772 1.00 0.00 N ATOM 628 CA HIS A 43 -4.489 -7.402 -1.271 1.00 0.00 C ATOM 629 C HIS A 43 -3.907 -6.076 -1.749 1.00 0.00 C ATOM 630 O HIS A 43 -2.724 -5.830 -1.511 1.00 0.00 O ATOM 631 CB HIS A 43 -4.499 -7.460 0.260 1.00 0.00 C ATOM 632 CG HIS A 43 -5.399 -8.539 0.800 1.00 0.00 C ATOM 633 ND1 HIS A 43 -6.769 -8.445 0.870 1.00 0.00 N ATOM 634 CD2 HIS A 43 -5.044 -9.790 1.222 1.00 0.00 C ATOM 635 CE1 HIS A 43 -7.256 -9.612 1.313 1.00 0.00 C ATOM 636 NE2 HIS A 43 -6.224 -10.431 1.553 1.00 0.00 N ATOM 0 H HIS A 43 -2.697 -8.411 -1.627 1.00 0.00 H new ATOM 0 HA HIS A 43 -5.508 -7.473 -1.652 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.483 -7.628 0.619 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -4.821 -6.495 0.653 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -7.322 -7.624 0.625 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -4.045 -10.195 1.284 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.300 -9.851 1.452 1.00 0.00 H new ATOM 645 N GLY A 44 -4.719 -5.233 -2.403 1.00 0.00 N ATOM 646 CA GLY A 44 -4.306 -3.919 -2.872 1.00 0.00 C ATOM 647 C GLY A 44 -3.795 -3.080 -1.711 1.00 0.00 C ATOM 648 O GLY A 44 -4.374 -3.150 -0.627 1.00 0.00 O ATOM 0 H GLY A 44 -5.691 -5.455 -2.620 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.525 -4.023 -3.625 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -5.146 -3.416 -3.351 1.00 0.00 H new ATOM 652 N PHE A 45 -2.722 -2.319 -1.944 1.00 0.00 N ATOM 653 CA PHE A 45 -2.030 -1.512 -0.948 1.00 0.00 C ATOM 654 C PHE A 45 -1.762 -0.142 -1.557 1.00 0.00 C ATOM 655 O PHE A 45 -1.008 -0.052 -2.529 1.00 0.00 O ATOM 656 CB PHE A 45 -0.702 -2.193 -0.575 1.00 0.00 C ATOM 657 CG PHE A 45 -0.627 -2.629 0.870 1.00 0.00 C ATOM 658 CD1 PHE A 45 -1.426 -3.692 1.322 1.00 0.00 C ATOM 659 CD2 PHE A 45 0.240 -1.977 1.764 1.00 0.00 C ATOM 660 CE1 PHE A 45 -1.336 -4.122 2.657 1.00 0.00 C ATOM 661 CE2 PHE A 45 0.292 -2.374 3.110 1.00 0.00 C ATOM 662 CZ PHE A 45 -0.480 -3.462 3.552 1.00 0.00 C ATOM 0 H PHE A 45 -2.299 -2.249 -2.869 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.634 -1.408 -0.047 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.558 -3.063 -1.216 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.119 -1.506 -0.781 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -2.110 -4.179 0.643 1.00 0.00 H new ATOM 0 HD2 PHE A 45 0.867 -1.170 1.415 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.926 -4.961 2.994 1.00 0.00 H new ATOM 0 HE2 PHE A 45 0.925 -1.843 3.805 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.415 -3.790 4.579 1.00 0.00 H new ATOM 672 N HIS A 46 -2.371 0.924 -1.027 1.00 0.00 N ATOM 673 CA HIS A 46 -2.173 2.250 -1.607 1.00 0.00 C ATOM 674 C HIS A 46 -2.217 3.345 -0.555 1.00 0.00 C ATOM 675 O HIS A 46 -2.829 3.175 0.498 1.00 0.00 O ATOM 676 CB HIS A 46 -3.232 2.564 -2.676 1.00 0.00 C ATOM 677 CG HIS A 46 -3.849 1.373 -3.343 1.00 0.00 C ATOM 678 ND1 HIS A 46 -5.121 0.874 -3.080 1.00 0.00 N ATOM 679 CD2 HIS A 46 -3.319 0.629 -4.349 1.00 0.00 C ATOM 680 CE1 HIS A 46 -5.347 -0.143 -3.939 1.00 0.00 C ATOM 681 NE2 HIS A 46 -4.270 -0.268 -4.716 1.00 0.00 N ATOM 0 H HIS A 46 -2.990 0.895 -0.217 1.00 0.00 H new ATOM 0 HA HIS A 46 -1.184 2.230 -2.064 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -4.026 3.152 -2.214 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -2.775 3.191 -3.442 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -2.332 0.731 -4.775 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -6.241 -0.748 -3.988 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -4.175 -0.941 -5.477 1.00 0.00 H new ATOM 689 N VAL A 47 -1.629 4.493 -0.896 1.00 0.00 N ATOM 690 CA VAL A 47 -1.800 5.739 -0.169 1.00 0.00 C ATOM 691 C VAL A 47 -2.989 6.497 -0.771 1.00 0.00 C ATOM 692 O VAL A 47 -2.954 6.912 -1.931 1.00 0.00 O ATOM 693 CB VAL A 47 -0.488 6.542 -0.176 1.00 0.00 C ATOM 694 CG1 VAL A 47 -0.730 8.019 0.151 1.00 0.00 C ATOM 695 CG2 VAL A 47 0.499 5.936 0.828 1.00 0.00 C ATOM 0 H VAL A 47 -1.010 4.578 -1.702 1.00 0.00 H new ATOM 0 HA VAL A 47 -2.028 5.553 0.881 1.00 0.00 H new ATOM 0 HB VAL A 47 -0.066 6.488 -1.180 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.219 8.555 0.137 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -1.402 8.451 -0.591 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -1.180 8.104 1.140 1.00 0.00 H new ATOM 0 HG21 VAL A 47 1.426 6.509 0.818 1.00 0.00 H new ATOM 0 HG22 VAL A 47 0.065 5.965 1.827 1.00 0.00 H new ATOM 0 HG23 VAL A 47 0.709 4.902 0.553 1.00 0.00 H new ATOM 705 N HIS A 48 -4.052 6.655 0.017 1.00 0.00 N ATOM 706 CA HIS A 48 -5.212 7.465 -0.306 1.00 0.00 C ATOM 707 C HIS A 48 -4.955 8.922 0.061 1.00 0.00 C ATOM 708 O HIS A 48 -4.151 9.231 0.943 1.00 0.00 O ATOM 709 CB HIS A 48 -6.432 6.934 0.453 1.00 0.00 C ATOM 710 CG HIS A 48 -6.911 5.618 -0.097 1.00 0.00 C ATOM 711 ND1 HIS A 48 -8.163 5.380 -0.576 1.00 0.00 N ATOM 712 CD2 HIS A 48 -6.128 4.519 -0.288 1.00 0.00 C ATOM 713 CE1 HIS A 48 -8.178 4.135 -1.067 1.00 0.00 C ATOM 714 NE2 HIS A 48 -6.946 3.610 -0.949 1.00 0.00 N ATOM 0 H HIS A 48 -4.126 6.204 0.929 1.00 0.00 H new ATOM 0 HA HIS A 48 -5.404 7.408 -1.378 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -6.180 6.816 1.507 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -7.239 7.665 0.398 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -5.098 4.384 0.009 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -9.038 3.635 -1.488 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -6.658 2.693 -1.290 1.00 0.00 H new ATOM 722 N GLU A 49 -5.671 9.816 -0.618 1.00 0.00 N ATOM 723 CA GLU A 49 -5.639 11.248 -0.368 1.00 0.00 C ATOM 724 C GLU A 49 -6.408 11.568 0.916 1.00 0.00 C ATOM 725 O GLU A 49 -7.502 12.125 0.871 1.00 0.00 O ATOM 726 CB GLU A 49 -6.215 11.978 -1.586 1.00 0.00 C ATOM 727 CG GLU A 49 -5.908 13.481 -1.542 1.00 0.00 C ATOM 728 CD GLU A 49 -6.939 14.290 -2.319 1.00 0.00 C ATOM 729 OE1 GLU A 49 -7.510 13.716 -3.274 1.00 0.00 O ATOM 730 OE2 GLU A 49 -7.133 15.466 -1.945 1.00 0.00 O ATOM 0 H GLU A 49 -6.303 9.554 -1.374 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.614 11.589 -0.222 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.801 11.548 -2.498 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -7.294 11.828 -1.624 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -5.887 13.818 -0.506 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -4.916 13.662 -1.956 1.00 0.00 H new ATOM 876 N PRO A 62 -9.819 9.162 -2.547 1.00 0.00 N ATOM 877 CA PRO A 62 -9.587 8.155 -3.562 1.00 0.00 C ATOM 878 C PRO A 62 -8.076 7.874 -3.654 1.00 0.00 C ATOM 879 O PRO A 62 -7.289 8.388 -2.850 1.00 0.00 O ATOM 880 CB PRO A 62 -10.190 8.746 -4.843 1.00 0.00 C ATOM 881 CG PRO A 62 -10.077 10.261 -4.650 1.00 0.00 C ATOM 882 CD PRO A 62 -10.123 10.459 -3.134 1.00 0.00 C ATOM 0 HA PRO A 62 -10.047 7.189 -3.353 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -9.646 8.416 -5.728 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -11.227 8.438 -4.973 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -9.149 10.647 -5.073 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -10.895 10.786 -5.144 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -9.399 11.209 -2.817 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -11.105 10.810 -2.817 1.00 0.00 H new ATOM 890 N HIS A 63 -7.654 7.052 -4.627 1.00 0.00 N ATOM 891 CA HIS A 63 -6.240 6.913 -4.961 1.00 0.00 C ATOM 892 C HIS A 63 -5.616 8.292 -5.176 1.00 0.00 C ATOM 893 O HIS A 63 -6.012 9.012 -6.089 1.00 0.00 O ATOM 894 CB HIS A 63 -6.045 6.078 -6.236 1.00 0.00 C ATOM 895 CG HIS A 63 -5.956 4.592 -6.006 1.00 0.00 C ATOM 896 ND1 HIS A 63 -5.097 3.679 -6.638 1.00 0.00 N ATOM 897 CD2 HIS A 63 -6.710 3.886 -5.118 1.00 0.00 C ATOM 898 CE1 HIS A 63 -5.382 2.445 -6.148 1.00 0.00 C ATOM 899 NE2 HIS A 63 -6.344 2.583 -5.222 1.00 0.00 N ATOM 0 H HIS A 63 -8.277 6.476 -5.193 1.00 0.00 H new ATOM 0 HA HIS A 63 -5.753 6.404 -4.129 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -6.873 6.278 -6.916 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -5.135 6.410 -6.736 1.00 0.00 H new ATOM 0 HD1 HIS A 63 -4.389 3.902 -7.337 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -7.460 4.289 -4.454 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -4.917 1.518 -6.450 1.00 0.00 H new ATOM 907 N PHE A 64 -4.625 8.633 -4.352 1.00 0.00 N ATOM 908 CA PHE A 64 -3.901 9.891 -4.451 1.00 0.00 C ATOM 909 C PHE A 64 -3.257 9.980 -5.837 1.00 0.00 C ATOM 910 O PHE A 64 -2.512 9.073 -6.220 1.00 0.00 O ATOM 911 CB PHE A 64 -2.835 9.930 -3.344 1.00 0.00 C ATOM 912 CG PHE A 64 -2.509 11.277 -2.720 1.00 0.00 C ATOM 913 CD1 PHE A 64 -2.509 12.470 -3.472 1.00 0.00 C ATOM 914 CD2 PHE A 64 -2.267 11.339 -1.334 1.00 0.00 C ATOM 915 CE1 PHE A 64 -2.206 13.696 -2.856 1.00 0.00 C ATOM 916 CE2 PHE A 64 -2.080 12.579 -0.703 1.00 0.00 C ATOM 917 CZ PHE A 64 -2.001 13.752 -1.468 1.00 0.00 C ATOM 0 H PHE A 64 -4.303 8.035 -3.591 1.00 0.00 H new ATOM 0 HA PHE A 64 -4.572 10.741 -4.323 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.156 9.260 -2.546 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.912 9.519 -3.753 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -2.743 12.441 -4.526 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -2.225 10.429 -0.754 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -2.131 14.595 -3.450 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.997 12.630 0.373 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.783 14.696 -0.991 1.00 0.00 H new ATOM 927 N ASN A 65 -3.523 11.061 -6.582 1.00 0.00 N ATOM 928 CA ASN A 65 -2.999 11.238 -7.934 1.00 0.00 C ATOM 929 C ASN A 65 -2.363 12.611 -8.155 1.00 0.00 C ATOM 930 O ASN A 65 -2.798 13.356 -9.028 1.00 0.00 O ATOM 931 CB ASN A 65 -4.141 10.985 -8.923 1.00 0.00 C ATOM 932 CG ASN A 65 -3.713 10.806 -10.375 1.00 0.00 C ATOM 933 OD1 ASN A 65 -4.539 10.925 -11.273 1.00 0.00 O ATOM 934 ND2 ASN A 65 -2.466 10.423 -10.652 1.00 0.00 N ATOM 0 H ASN A 65 -4.107 11.833 -6.261 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.193 10.522 -8.093 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -4.683 10.093 -8.608 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -4.840 11.819 -8.867 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -2.195 10.227 -11.616 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -1.783 10.326 -9.900 1.00 0.00 H new ATOM 941 N PRO A 66 -1.293 12.941 -7.420 1.00 0.00 N ATOM 942 CA PRO A 66 -0.649 14.236 -7.519 1.00 0.00 C ATOM 943 C PRO A 66 0.155 14.369 -8.821 1.00 0.00 C ATOM 944 O PRO A 66 0.318 15.478 -9.318 1.00 0.00 O ATOM 945 CB PRO A 66 0.214 14.351 -6.260 1.00 0.00 C ATOM 946 CG PRO A 66 0.542 12.906 -5.884 1.00 0.00 C ATOM 947 CD PRO A 66 -0.569 12.065 -6.517 1.00 0.00 C ATOM 0 HA PRO A 66 -1.368 15.054 -7.567 1.00 0.00 H new ATOM 0 HB2 PRO A 66 1.120 14.926 -6.452 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -0.322 14.858 -5.457 1.00 0.00 H new ATOM 0 HG2 PRO A 66 1.522 12.613 -6.262 1.00 0.00 H new ATOM 0 HG3 PRO A 66 0.566 12.776 -4.802 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -0.151 11.214 -7.055 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -1.234 11.663 -5.752 1.00 0.00 H new ATOM 955 N LEU A 67 0.641 13.258 -9.395 1.00 0.00 N ATOM 956 CA LEU A 67 1.360 13.290 -10.675 1.00 0.00 C ATOM 957 C LEU A 67 0.407 13.204 -11.870 1.00 0.00 C ATOM 958 O LEU A 67 0.823 13.461 -12.996 1.00 0.00 O ATOM 959 CB LEU A 67 2.408 12.170 -10.770 1.00 0.00 C ATOM 960 CG LEU A 67 3.670 12.372 -9.917 1.00 0.00 C ATOM 961 CD1 LEU A 67 4.596 11.167 -10.134 1.00 0.00 C ATOM 962 CD2 LEU A 67 4.447 13.640 -10.294 1.00 0.00 C ATOM 0 H LEU A 67 0.548 12.326 -8.991 1.00 0.00 H new ATOM 0 HA LEU A 67 1.873 14.251 -10.710 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.939 11.231 -10.477 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.708 12.064 -11.813 1.00 0.00 H new ATOM 0 HG LEU A 67 3.352 12.471 -8.879 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.499 11.290 -9.537 1.00 0.00 H new ATOM 0 HD12 LEU A 67 4.083 10.254 -9.831 1.00 0.00 H new ATOM 0 HD13 LEU A 67 4.864 11.100 -11.188 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.328 13.730 -9.658 1.00 0.00 H new ATOM 0 HD22 LEU A 67 4.757 13.580 -11.337 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.809 14.513 -10.155 1.00 0.00 H new ATOM 974 N SER A 68 -0.854 12.808 -11.658 1.00 0.00 N ATOM 975 CA SER A 68 -1.878 12.782 -12.704 1.00 0.00 C ATOM 976 C SER A 68 -1.663 11.669 -13.740 1.00 0.00 C ATOM 977 O SER A 68 -2.333 11.669 -14.773 1.00 0.00 O ATOM 978 CB SER A 68 -2.041 14.160 -13.367 1.00 0.00 C ATOM 979 OG SER A 68 -3.224 14.176 -14.141 1.00 0.00 O ATOM 0 H SER A 68 -1.193 12.495 -10.748 1.00 0.00 H new ATOM 0 HA SER A 68 -2.816 12.540 -12.204 1.00 0.00 H new ATOM 0 HB2 SER A 68 -2.082 14.939 -12.605 1.00 0.00 H new ATOM 0 HB3 SER A 68 -1.179 14.376 -13.998 1.00 0.00 H new ATOM 0 HG SER A 68 -3.298 13.337 -14.642 1.00 0.00 H new ATOM 985 N ARG A 69 -0.774 10.706 -13.473 1.00 0.00 N ATOM 986 CA ARG A 69 -0.652 9.496 -14.286 1.00 0.00 C ATOM 987 C ARG A 69 -1.804 8.570 -13.882 1.00 0.00 C ATOM 988 O ARG A 69 -2.299 8.712 -12.771 1.00 0.00 O ATOM 989 CB ARG A 69 0.723 8.824 -14.097 1.00 0.00 C ATOM 990 CG ARG A 69 1.775 9.681 -13.370 1.00 0.00 C ATOM 991 CD ARG A 69 3.196 9.211 -13.697 1.00 0.00 C ATOM 992 NE ARG A 69 3.614 9.734 -15.008 1.00 0.00 N ATOM 993 CZ ARG A 69 4.742 9.414 -15.661 1.00 0.00 C ATOM 994 NH1 ARG A 69 5.547 8.463 -15.178 1.00 0.00 N ATOM 995 NH2 ARG A 69 5.060 10.054 -16.793 1.00 0.00 N ATOM 0 H ARG A 69 -0.122 10.745 -12.690 1.00 0.00 H new ATOM 0 HA ARG A 69 -0.716 9.736 -15.347 1.00 0.00 H new ATOM 0 HB2 ARG A 69 0.584 7.898 -13.540 1.00 0.00 H new ATOM 0 HB3 ARG A 69 1.114 8.551 -15.077 1.00 0.00 H new ATOM 0 HG2 ARG A 69 1.659 10.726 -13.659 1.00 0.00 H new ATOM 0 HG3 ARG A 69 1.610 9.628 -12.294 1.00 0.00 H new ATOM 0 HD2 ARG A 69 3.886 9.551 -12.925 1.00 0.00 H new ATOM 0 HD3 ARG A 69 3.235 8.122 -13.702 1.00 0.00 H new ATOM 0 HE ARG A 69 2.989 10.401 -15.462 1.00 0.00 H new ATOM 0 HH11 ARG A 69 5.304 7.980 -14.313 1.00 0.00 H new ATOM 0 HH12 ARG A 69 6.404 8.220 -15.674 1.00 0.00 H new ATOM 0 HH21 ARG A 69 4.446 10.782 -17.157 1.00 0.00 H new ATOM 0 HH22 ARG A 69 5.917 9.813 -17.292 1.00 0.00 H new ATOM 1009 N LYS A 70 -2.281 7.658 -14.733 1.00 0.00 N ATOM 1010 CA LYS A 70 -3.397 6.801 -14.380 1.00 0.00 C ATOM 1011 C LYS A 70 -2.965 5.697 -13.407 1.00 0.00 C ATOM 1012 O LYS A 70 -1.778 5.564 -13.102 1.00 0.00 O ATOM 1013 CB LYS A 70 -3.962 6.231 -15.676 1.00 0.00 C ATOM 1014 CG LYS A 70 -4.569 7.325 -16.564 1.00 0.00 C ATOM 1015 CD LYS A 70 -5.251 6.685 -17.782 1.00 0.00 C ATOM 1016 CE LYS A 70 -5.932 7.726 -18.681 1.00 0.00 C ATOM 1017 NZ LYS A 70 -7.109 8.351 -18.039 1.00 0.00 N ATOM 0 H LYS A 70 -1.907 7.500 -15.669 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.167 7.371 -13.860 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -3.171 5.717 -16.222 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -4.724 5.487 -15.444 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -5.293 7.909 -15.995 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -3.791 8.014 -16.892 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -4.511 6.135 -18.363 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -5.992 5.961 -17.442 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -5.212 8.501 -18.943 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -6.241 7.250 -19.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -7.571 8.995 -18.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -7.781 7.611 -17.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -6.804 8.887 -17.201 1.00 0.00 H new ATOM 1031 N HIS A 71 -3.934 4.916 -12.902 1.00 0.00 N ATOM 1032 CA HIS A 71 -3.633 3.829 -11.981 1.00 0.00 C ATOM 1033 C HIS A 71 -2.740 2.791 -12.648 1.00 0.00 C ATOM 1034 O HIS A 71 -2.800 2.591 -13.857 1.00 0.00 O ATOM 1035 CB HIS A 71 -4.904 3.124 -11.488 1.00 0.00 C ATOM 1036 CG HIS A 71 -4.634 2.194 -10.335 1.00 0.00 C ATOM 1037 ND1 HIS A 71 -3.956 2.489 -9.149 1.00 0.00 N ATOM 1038 CD2 HIS A 71 -4.861 0.850 -10.315 1.00 0.00 C ATOM 1039 CE1 HIS A 71 -3.615 1.331 -8.570 1.00 0.00 C ATOM 1040 NE2 HIS A 71 -4.284 0.365 -9.184 1.00 0.00 N ATOM 0 H HIS A 71 -4.925 5.023 -13.120 1.00 0.00 H new ATOM 0 HA HIS A 71 -3.123 4.278 -11.129 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -5.636 3.872 -11.184 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.346 2.561 -12.310 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -5.398 0.279 -11.058 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -2.921 1.206 -7.752 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -4.355 -0.598 -8.856 1.00 0.00 H new ATOM 1048 N GLY A 72 -1.969 2.085 -11.830 1.00 0.00 N ATOM 1049 CA GLY A 72 -1.198 0.936 -12.234 1.00 0.00 C ATOM 1050 C GLY A 72 -0.453 0.459 -10.997 1.00 0.00 C ATOM 1051 O GLY A 72 -0.915 0.713 -9.885 1.00 0.00 O ATOM 0 H GLY A 72 -1.866 2.310 -10.840 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -1.847 0.151 -12.623 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -0.501 1.197 -13.030 1.00 0.00 H new ATOM 1055 N GLY A 73 0.693 -0.195 -11.162 1.00 0.00 N ATOM 1056 CA GLY A 73 1.520 -0.638 -10.051 1.00 0.00 C ATOM 1057 C GLY A 73 2.967 -0.709 -10.510 1.00 0.00 C ATOM 1058 O GLY A 73 3.249 -0.407 -11.665 1.00 0.00 O ATOM 0 H GLY A 73 1.074 -0.433 -12.078 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.424 0.051 -9.212 1.00 0.00 H new ATOM 0 HA3 GLY A 73 1.188 -1.615 -9.700 1.00 0.00 H new ATOM 1062 N PRO A 74 3.897 -1.111 -9.634 1.00 0.00 N ATOM 1063 CA PRO A 74 5.327 -1.016 -9.888 1.00 0.00 C ATOM 1064 C PRO A 74 5.793 -1.817 -11.110 1.00 0.00 C ATOM 1065 O PRO A 74 6.860 -1.525 -11.641 1.00 0.00 O ATOM 1066 CB PRO A 74 6.008 -1.461 -8.589 1.00 0.00 C ATOM 1067 CG PRO A 74 4.952 -2.324 -7.897 1.00 0.00 C ATOM 1068 CD PRO A 74 3.639 -1.661 -8.313 1.00 0.00 C ATOM 0 HA PRO A 74 5.600 0.006 -10.150 1.00 0.00 H new ATOM 0 HB2 PRO A 74 6.918 -2.027 -8.789 1.00 0.00 H new ATOM 0 HB3 PRO A 74 6.292 -0.607 -7.974 1.00 0.00 H new ATOM 0 HG2 PRO A 74 5.001 -3.362 -8.225 1.00 0.00 H new ATOM 0 HG3 PRO A 74 5.078 -2.325 -6.814 1.00 0.00 H new ATOM 0 HD2 PRO A 74 2.823 -2.383 -8.339 1.00 0.00 H new ATOM 0 HD3 PRO A 74 3.351 -0.880 -7.610 1.00 0.00 H new ATOM 1076 N LYS A 75 5.019 -2.811 -11.563 1.00 0.00 N ATOM 1077 CA LYS A 75 5.364 -3.561 -12.769 1.00 0.00 C ATOM 1078 C LYS A 75 4.985 -2.810 -14.054 1.00 0.00 C ATOM 1079 O LYS A 75 5.525 -3.123 -15.113 1.00 0.00 O ATOM 1080 CB LYS A 75 4.752 -4.972 -12.720 1.00 0.00 C ATOM 1081 CG LYS A 75 3.319 -5.018 -13.265 1.00 0.00 C ATOM 1082 CD LYS A 75 2.643 -6.367 -12.993 1.00 0.00 C ATOM 1083 CE LYS A 75 1.485 -6.573 -13.984 1.00 0.00 C ATOM 1084 NZ LYS A 75 0.375 -7.355 -13.402 1.00 0.00 N ATOM 0 H LYS A 75 4.154 -3.111 -11.113 1.00 0.00 H new ATOM 0 HA LYS A 75 6.449 -3.666 -12.794 1.00 0.00 H new ATOM 0 HB2 LYS A 75 5.377 -5.654 -13.296 1.00 0.00 H new ATOM 0 HB3 LYS A 75 4.756 -5.329 -11.690 1.00 0.00 H new ATOM 0 HG2 LYS A 75 2.732 -4.220 -12.809 1.00 0.00 H new ATOM 0 HG3 LYS A 75 3.333 -4.830 -14.339 1.00 0.00 H new ATOM 0 HD2 LYS A 75 3.368 -7.175 -13.092 1.00 0.00 H new ATOM 0 HD3 LYS A 75 2.269 -6.398 -11.970 1.00 0.00 H new ATOM 0 HE2 LYS A 75 1.111 -5.602 -14.307 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.858 -7.083 -14.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -0.450 -7.309 -14.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 0.670 -8.346 -13.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 0.123 -6.961 -12.473 1.00 0.00 H new ATOM 1098 N ASP A 76 4.019 -1.884 -13.984 1.00 0.00 N ATOM 1099 CA ASP A 76 3.482 -1.163 -15.130 1.00 0.00 C ATOM 1100 C ASP A 76 4.036 0.264 -15.104 1.00 0.00 C ATOM 1101 O ASP A 76 4.499 0.756 -14.075 1.00 0.00 O ATOM 1102 CB ASP A 76 1.941 -1.194 -15.122 1.00 0.00 C ATOM 1103 CG ASP A 76 1.353 -2.600 -15.264 1.00 0.00 C ATOM 1104 OD1 ASP A 76 1.232 -3.093 -16.410 1.00 0.00 O ATOM 1105 OD2 ASP A 76 1.018 -3.181 -14.210 1.00 0.00 O ATOM 0 H ASP A 76 3.583 -1.614 -13.102 1.00 0.00 H new ATOM 0 HA ASP A 76 3.791 -1.642 -16.059 1.00 0.00 H new ATOM 0 HB2 ASP A 76 1.582 -0.752 -14.192 1.00 0.00 H new ATOM 0 HB3 ASP A 76 1.570 -0.571 -15.935 1.00 0.00 H new ATOM 1110 N GLU A 77 4.010 0.924 -16.261 1.00 0.00 N ATOM 1111 CA GLU A 77 4.495 2.292 -16.412 1.00 0.00 C ATOM 1112 C GLU A 77 3.508 3.279 -15.775 1.00 0.00 C ATOM 1113 O GLU A 77 3.908 4.321 -15.254 1.00 0.00 O ATOM 1114 CB GLU A 77 4.763 2.588 -17.898 1.00 0.00 C ATOM 1115 CG GLU A 77 6.269 2.722 -18.159 1.00 0.00 C ATOM 1116 CD GLU A 77 6.585 2.728 -19.649 1.00 0.00 C ATOM 1117 OE1 GLU A 77 6.056 3.631 -20.332 1.00 0.00 O ATOM 1118 OE2 GLU A 77 7.342 1.828 -20.073 1.00 0.00 O ATOM 0 H GLU A 77 3.649 0.520 -17.125 1.00 0.00 H new ATOM 0 HA GLU A 77 5.441 2.412 -15.884 1.00 0.00 H new ATOM 0 HB2 GLU A 77 4.352 1.788 -18.514 1.00 0.00 H new ATOM 0 HB3 GLU A 77 4.255 3.507 -18.189 1.00 0.00 H new ATOM 0 HG2 GLU A 77 6.636 3.643 -17.706 1.00 0.00 H new ATOM 0 HG3 GLU A 77 6.796 1.898 -17.679 1.00 0.00 H new ATOM 1125 N GLU A 78 2.215 2.937 -15.808 1.00 0.00 N ATOM 1126 CA GLU A 78 1.171 3.697 -15.134 1.00 0.00 C ATOM 1127 C GLU A 78 1.152 3.306 -13.650 1.00 0.00 C ATOM 1128 O GLU A 78 1.644 2.241 -13.279 1.00 0.00 O ATOM 1129 CB GLU A 78 -0.170 3.483 -15.843 1.00 0.00 C ATOM 1130 CG GLU A 78 -0.169 4.212 -17.196 1.00 0.00 C ATOM 1131 CD GLU A 78 -1.313 3.751 -18.093 1.00 0.00 C ATOM 1132 OE1 GLU A 78 -1.188 2.629 -18.628 1.00 0.00 O ATOM 1133 OE2 GLU A 78 -2.286 4.529 -18.226 1.00 0.00 O ATOM 0 H GLU A 78 1.867 2.119 -16.308 1.00 0.00 H new ATOM 0 HA GLU A 78 1.371 4.767 -15.182 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -0.345 2.418 -15.994 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.984 3.855 -15.220 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.249 5.286 -17.029 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.781 4.038 -17.701 1.00 0.00 H new ATOM 1140 N ARG A 79 0.636 4.207 -12.807 1.00 0.00 N ATOM 1141 CA ARG A 79 0.745 4.265 -11.349 1.00 0.00 C ATOM 1142 C ARG A 79 0.571 5.738 -10.965 1.00 0.00 C ATOM 1143 O ARG A 79 1.324 6.580 -11.449 1.00 0.00 O ATOM 1144 CB ARG A 79 2.052 3.654 -10.791 1.00 0.00 C ATOM 1145 CG ARG A 79 3.365 4.155 -11.425 1.00 0.00 C ATOM 1146 CD ARG A 79 4.468 3.086 -11.315 1.00 0.00 C ATOM 1147 NE ARG A 79 4.902 2.860 -9.920 1.00 0.00 N ATOM 1148 CZ ARG A 79 5.896 3.507 -9.281 1.00 0.00 C ATOM 1149 NH1 ARG A 79 6.556 4.483 -9.917 1.00 0.00 N ATOM 1150 NH2 ARG A 79 6.219 3.182 -8.019 1.00 0.00 N ATOM 0 H ARG A 79 0.081 4.985 -13.163 1.00 0.00 H new ATOM 0 HA ARG A 79 -0.028 3.645 -10.896 1.00 0.00 H new ATOM 0 HB2 ARG A 79 2.092 3.852 -9.720 1.00 0.00 H new ATOM 0 HB3 ARG A 79 2.004 2.572 -10.914 1.00 0.00 H new ATOM 0 HG2 ARG A 79 3.196 4.404 -12.473 1.00 0.00 H new ATOM 0 HG3 ARG A 79 3.688 5.070 -10.928 1.00 0.00 H new ATOM 0 HD2 ARG A 79 4.104 2.148 -11.735 1.00 0.00 H new ATOM 0 HD3 ARG A 79 5.326 3.391 -11.914 1.00 0.00 H new ATOM 0 HE ARG A 79 4.401 2.146 -9.391 1.00 0.00 H new ATOM 0 HH11 ARG A 79 6.304 4.729 -10.874 1.00 0.00 H new ATOM 0 HH12 ARG A 79 7.311 4.980 -9.444 1.00 0.00 H new ATOM 0 HH21 ARG A 79 5.711 2.441 -7.537 1.00 0.00 H new ATOM 0 HH22 ARG A 79 6.973 3.677 -7.542 1.00 0.00 H new ATOM 1164 N HIS A 80 -0.444 6.058 -10.151 1.00 0.00 N ATOM 1165 CA HIS A 80 -0.870 7.422 -9.858 1.00 0.00 C ATOM 1166 C HIS A 80 0.270 8.184 -9.162 1.00 0.00 C ATOM 1167 O HIS A 80 0.998 8.941 -9.797 1.00 0.00 O ATOM 1168 CB HIS A 80 -2.163 7.416 -9.013 1.00 0.00 C ATOM 1169 CG HIS A 80 -3.432 6.875 -9.637 1.00 0.00 C ATOM 1170 ND1 HIS A 80 -4.225 5.834 -9.141 1.00 0.00 N ATOM 1171 CD2 HIS A 80 -4.178 7.471 -10.615 1.00 0.00 C ATOM 1172 CE1 HIS A 80 -5.418 5.894 -9.753 1.00 0.00 C ATOM 1173 NE2 HIS A 80 -5.364 6.816 -10.714 1.00 0.00 N ATOM 0 H HIS A 80 -1.002 5.353 -9.669 1.00 0.00 H new ATOM 0 HA HIS A 80 -1.099 7.939 -10.790 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.966 6.839 -8.110 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -2.359 8.441 -8.700 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -3.875 8.320 -11.209 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -6.281 5.293 -9.507 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -6.090 6.999 -11.407 1.00 0.00 H new ATOM 1181 N VAL A 81 0.421 7.979 -7.851 1.00 0.00 N ATOM 1182 CA VAL A 81 1.697 8.002 -7.139 1.00 0.00 C ATOM 1183 C VAL A 81 1.681 6.838 -6.161 1.00 0.00 C ATOM 1184 O VAL A 81 2.470 5.904 -6.280 1.00 0.00 O ATOM 1185 CB VAL A 81 1.951 9.342 -6.414 1.00 0.00 C ATOM 1186 CG1 VAL A 81 2.909 9.229 -5.213 1.00 0.00 C ATOM 1187 CG2 VAL A 81 2.573 10.330 -7.403 1.00 0.00 C ATOM 0 H VAL A 81 -0.370 7.786 -7.237 1.00 0.00 H new ATOM 0 HA VAL A 81 2.516 7.904 -7.851 1.00 0.00 H new ATOM 0 HB VAL A 81 0.983 9.673 -6.037 1.00 0.00 H new ATOM 0 HG11 VAL A 81 3.037 10.210 -4.756 1.00 0.00 H new ATOM 0 HG12 VAL A 81 2.493 8.539 -4.479 1.00 0.00 H new ATOM 0 HG13 VAL A 81 3.876 8.858 -5.553 1.00 0.00 H new ATOM 0 HG21 VAL A 81 2.757 11.280 -6.901 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.515 9.928 -7.775 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.891 10.487 -8.238 1.00 0.00 H new ATOM 1197 N GLY A 82 0.769 6.893 -5.190 1.00 0.00 N ATOM 1198 CA GLY A 82 0.804 6.015 -4.033 1.00 0.00 C ATOM 1199 C GLY A 82 0.216 4.639 -4.318 1.00 0.00 C ATOM 1200 O GLY A 82 -0.560 4.137 -3.509 1.00 0.00 O ATOM 0 H GLY A 82 -0.012 7.549 -5.189 1.00 0.00 H new ATOM 0 HA2 GLY A 82 1.836 5.902 -3.699 1.00 0.00 H new ATOM 0 HA3 GLY A 82 0.253 6.478 -3.214 1.00 0.00 H new ATOM 1204 N ASP A 83 0.567 4.045 -5.459 1.00 0.00 N ATOM 1205 CA ASP A 83 -0.025 2.826 -5.981 1.00 0.00 C ATOM 1206 C ASP A 83 0.955 1.676 -5.826 1.00 0.00 C ATOM 1207 O ASP A 83 1.607 1.257 -6.784 1.00 0.00 O ATOM 1208 CB ASP A 83 -0.377 3.046 -7.450 1.00 0.00 C ATOM 1209 CG ASP A 83 -1.548 3.985 -7.635 1.00 0.00 C ATOM 1210 OD1 ASP A 83 -2.180 4.404 -6.645 1.00 0.00 O ATOM 1211 OD2 ASP A 83 -1.893 4.224 -8.805 1.00 0.00 O ATOM 0 H ASP A 83 1.299 4.418 -6.063 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.931 2.577 -5.429 1.00 0.00 H new ATOM 0 HB2 ASP A 83 0.492 3.448 -7.971 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -0.610 2.086 -7.911 1.00 0.00 H new ATOM 1216 N LEU A 84 1.055 1.147 -4.610 1.00 0.00 N ATOM 1217 CA LEU A 84 2.074 0.170 -4.269 1.00 0.00 C ATOM 1218 C LEU A 84 1.535 -1.229 -4.568 1.00 0.00 C ATOM 1219 O LEU A 84 1.582 -2.118 -3.721 1.00 0.00 O ATOM 1220 CB LEU A 84 2.492 0.378 -2.808 1.00 0.00 C ATOM 1221 CG LEU A 84 2.752 1.861 -2.475 1.00 0.00 C ATOM 1222 CD1 LEU A 84 3.382 1.965 -1.085 1.00 0.00 C ATOM 1223 CD2 LEU A 84 3.669 2.527 -3.509 1.00 0.00 C ATOM 0 H LEU A 84 0.432 1.385 -3.838 1.00 0.00 H new ATOM 0 HA LEU A 84 2.975 0.293 -4.871 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.712 -0.007 -2.152 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.393 -0.200 -2.605 1.00 0.00 H new ATOM 0 HG LEU A 84 1.796 2.384 -2.496 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.567 3.012 -0.847 1.00 0.00 H new ATOM 0 HD12 LEU A 84 2.704 1.539 -0.345 1.00 0.00 H new ATOM 0 HD13 LEU A 84 4.325 1.418 -1.071 1.00 0.00 H new ATOM 0 HD21 LEU A 84 3.826 3.571 -3.237 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.628 2.009 -3.532 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.205 2.475 -4.494 1.00 0.00 H new ATOM 1235 N GLY A 85 1.008 -1.390 -5.791 1.00 0.00 N ATOM 1236 CA GLY A 85 0.194 -2.510 -6.237 1.00 0.00 C ATOM 1237 C GLY A 85 -0.546 -3.215 -5.099 1.00 0.00 C ATOM 1238 O GLY A 85 -1.482 -2.670 -4.508 1.00 0.00 O ATOM 0 H GLY A 85 1.151 -0.700 -6.529 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -0.533 -2.153 -6.967 1.00 0.00 H new ATOM 0 HA3 GLY A 85 0.831 -3.232 -6.748 1.00 0.00 H new ATOM 1242 N ASN A 86 -0.120 -4.445 -4.803 1.00 0.00 N ATOM 1243 CA ASN A 86 -0.722 -5.303 -3.799 1.00 0.00 C ATOM 1244 C ASN A 86 0.334 -6.133 -3.099 1.00 0.00 C ATOM 1245 O ASN A 86 1.402 -6.371 -3.664 1.00 0.00 O ATOM 1246 CB ASN A 86 -1.761 -6.240 -4.420 1.00 0.00 C ATOM 1247 CG ASN A 86 -1.331 -6.973 -5.688 1.00 0.00 C ATOM 1248 OD1 ASN A 86 -2.160 -7.149 -6.572 1.00 0.00 O ATOM 1249 ND2 ASN A 86 -0.084 -7.420 -5.814 1.00 0.00 N ATOM 0 H ASN A 86 0.676 -4.877 -5.272 1.00 0.00 H new ATOM 0 HA ASN A 86 -1.216 -4.655 -3.075 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.043 -6.982 -3.673 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.655 -5.659 -4.646 1.00 0.00 H new ATOM 0 HD21 ASN A 86 0.196 -7.919 -6.658 1.00 0.00 H new ATOM 0 HD22 ASN A 86 0.592 -7.263 -5.066 1.00 0.00 H new ATOM 1256 N VAL A 87 -0.014 -6.623 -1.912 1.00 0.00 N ATOM 1257 CA VAL A 87 0.819 -7.500 -1.111 1.00 0.00 C ATOM 1258 C VAL A 87 0.272 -8.917 -1.248 1.00 0.00 C ATOM 1259 O VAL A 87 -0.532 -9.172 -2.140 1.00 0.00 O ATOM 1260 CB VAL A 87 0.859 -6.974 0.333 1.00 0.00 C ATOM 1261 CG1 VAL A 87 1.361 -5.525 0.312 1.00 0.00 C ATOM 1262 CG2 VAL A 87 -0.509 -7.040 1.024 1.00 0.00 C ATOM 0 H VAL A 87 -0.910 -6.412 -1.473 1.00 0.00 H new ATOM 0 HA VAL A 87 1.855 -7.520 -1.451 1.00 0.00 H new ATOM 0 HB VAL A 87 1.532 -7.612 0.906 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.395 -5.137 1.330 1.00 0.00 H new ATOM 0 HG12 VAL A 87 2.360 -5.492 -0.122 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.685 -4.914 -0.287 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.422 -6.656 2.041 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.227 -6.436 0.468 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -0.852 -8.074 1.055 1.00 0.00 H new ATOM 1272 N THR A 88 0.681 -9.849 -0.388 1.00 0.00 N ATOM 1273 CA THR A 88 0.207 -11.228 -0.400 1.00 0.00 C ATOM 1274 C THR A 88 0.115 -11.695 1.041 1.00 0.00 C ATOM 1275 O THR A 88 1.120 -11.665 1.746 1.00 0.00 O ATOM 1276 CB THR A 88 1.169 -12.080 -1.237 1.00 0.00 C ATOM 1277 OG1 THR A 88 1.148 -11.603 -2.569 1.00 0.00 O ATOM 1278 CG2 THR A 88 0.787 -13.563 -1.227 1.00 0.00 C ATOM 0 H THR A 88 1.362 -9.662 0.348 1.00 0.00 H new ATOM 0 HA THR A 88 -0.779 -11.319 -0.856 1.00 0.00 H new ATOM 0 HB THR A 88 2.165 -11.995 -0.802 1.00 0.00 H new ATOM 0 HG1 THR A 88 1.760 -12.137 -3.117 1.00 0.00 H new ATOM 0 HG21 THR A 88 1.497 -14.126 -1.833 1.00 0.00 H new ATOM 0 HG22 THR A 88 0.807 -13.937 -0.203 1.00 0.00 H new ATOM 0 HG23 THR A 88 -0.216 -13.683 -1.637 1.00 0.00 H new ATOM 1286 N ALA A 89 -1.088 -12.070 1.481 1.00 0.00 N ATOM 1287 CA ALA A 89 -1.307 -12.595 2.813 1.00 0.00 C ATOM 1288 C ALA A 89 -1.122 -14.106 2.834 1.00 0.00 C ATOM 1289 O ALA A 89 -1.535 -14.794 1.898 1.00 0.00 O ATOM 1290 CB ALA A 89 -2.703 -12.235 3.307 1.00 0.00 C ATOM 0 H ALA A 89 -1.935 -12.014 0.915 1.00 0.00 H new ATOM 0 HA ALA A 89 -0.571 -12.144 3.479 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -2.849 -12.638 4.309 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -2.812 -11.151 3.332 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -3.448 -12.659 2.633 1.00 0.00 H new ATOM 1296 N ASP A 90 -0.542 -14.587 3.932 1.00 0.00 N ATOM 1297 CA ASP A 90 -0.443 -15.984 4.302 1.00 0.00 C ATOM 1298 C ASP A 90 -1.812 -16.538 4.678 1.00 0.00 C ATOM 1299 O ASP A 90 -2.770 -15.806 4.923 1.00 0.00 O ATOM 1300 CB ASP A 90 0.519 -16.141 5.494 1.00 0.00 C ATOM 1301 CG ASP A 90 1.954 -16.352 5.036 1.00 0.00 C ATOM 1302 OD1 ASP A 90 2.486 -15.435 4.379 1.00 0.00 O ATOM 1303 OD2 ASP A 90 2.470 -17.452 5.329 1.00 0.00 O ATOM 0 H ASP A 90 -0.107 -13.973 4.620 1.00 0.00 H new ATOM 0 HA ASP A 90 -0.061 -16.541 3.447 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.465 -15.253 6.124 1.00 0.00 H new ATOM 0 HB3 ASP A 90 0.205 -16.986 6.106 1.00 0.00 H new ATOM 1308 N LYS A 91 -1.835 -17.859 4.843 1.00 0.00 N ATOM 1309 CA LYS A 91 -2.906 -18.653 5.410 1.00 0.00 C ATOM 1310 C LYS A 91 -3.374 -18.110 6.766 1.00 0.00 C ATOM 1311 O LYS A 91 -4.516 -18.326 7.159 1.00 0.00 O ATOM 1312 CB LYS A 91 -2.391 -20.095 5.558 1.00 0.00 C ATOM 1313 CG LYS A 91 -1.038 -20.186 6.296 1.00 0.00 C ATOM 1314 CD LYS A 91 -0.873 -21.477 7.105 1.00 0.00 C ATOM 1315 CE LYS A 91 -0.836 -22.723 6.211 1.00 0.00 C ATOM 1316 NZ LYS A 91 -0.292 -23.891 6.934 1.00 0.00 N ATOM 0 H LYS A 91 -1.044 -18.438 4.561 1.00 0.00 H new ATOM 0 HA LYS A 91 -3.771 -18.613 4.748 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -3.132 -20.685 6.098 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -2.288 -20.540 4.568 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -0.230 -20.116 5.568 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -0.939 -19.331 6.965 1.00 0.00 H new ATOM 0 HD2 LYS A 91 0.047 -21.423 7.688 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -1.695 -21.566 7.815 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -1.842 -22.949 5.857 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -0.226 -22.522 5.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -0.281 -24.716 6.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 0.677 -23.683 7.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -0.889 -24.096 7.761 1.00 0.00 H new ATOM 1330 N ASP A 92 -2.472 -17.438 7.488 1.00 0.00 N ATOM 1331 CA ASP A 92 -2.714 -16.933 8.830 1.00 0.00 C ATOM 1332 C ASP A 92 -3.366 -15.556 8.758 1.00 0.00 C ATOM 1333 O ASP A 92 -3.824 -15.013 9.760 1.00 0.00 O ATOM 1334 CB ASP A 92 -1.380 -16.860 9.587 1.00 0.00 C ATOM 1335 CG ASP A 92 -1.583 -17.081 11.081 1.00 0.00 C ATOM 1336 OD1 ASP A 92 -1.871 -18.245 11.435 1.00 0.00 O ATOM 1337 OD2 ASP A 92 -1.426 -16.099 11.839 1.00 0.00 O ATOM 0 H ASP A 92 -1.535 -17.229 7.142 1.00 0.00 H new ATOM 0 HA ASP A 92 -3.390 -17.604 9.361 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.695 -17.611 9.195 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -0.916 -15.888 9.420 1.00 0.00 H new ATOM 1342 N GLY A 93 -3.394 -14.973 7.556 1.00 0.00 N ATOM 1343 CA GLY A 93 -3.978 -13.666 7.340 1.00 0.00 C ATOM 1344 C GLY A 93 -3.015 -12.532 7.684 1.00 0.00 C ATOM 1345 O GLY A 93 -3.442 -11.431 8.052 1.00 0.00 O ATOM 0 H GLY A 93 -3.011 -15.401 6.713 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -4.283 -13.576 6.298 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -4.879 -13.570 7.946 1.00 0.00 H new ATOM 1349 N VAL A 94 -1.717 -12.819 7.542 1.00 0.00 N ATOM 1350 CA VAL A 94 -0.608 -11.898 7.726 1.00 0.00 C ATOM 1351 C VAL A 94 -0.008 -11.639 6.348 1.00 0.00 C ATOM 1352 O VAL A 94 0.352 -12.595 5.675 1.00 0.00 O ATOM 1353 CB VAL A 94 0.435 -12.532 8.661 1.00 0.00 C ATOM 1354 CG1 VAL A 94 1.701 -11.665 8.745 1.00 0.00 C ATOM 1355 CG2 VAL A 94 -0.139 -12.708 10.070 1.00 0.00 C ATOM 0 H VAL A 94 -1.402 -13.754 7.281 1.00 0.00 H new ATOM 0 HA VAL A 94 -0.938 -10.962 8.177 1.00 0.00 H new ATOM 0 HB VAL A 94 0.694 -13.506 8.247 1.00 0.00 H new ATOM 0 HG11 VAL A 94 2.422 -12.137 9.413 1.00 0.00 H new ATOM 0 HG12 VAL A 94 2.139 -11.563 7.752 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.442 -10.679 9.130 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.615 -13.158 10.716 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -0.426 -11.736 10.470 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -1.015 -13.356 10.028 1.00 0.00 H new ATOM 1365 N ALA A 95 0.079 -10.378 5.911 1.00 0.00 N ATOM 1366 CA ALA A 95 0.704 -10.003 4.650 1.00 0.00 C ATOM 1367 C ALA A 95 1.946 -9.195 4.958 1.00 0.00 C ATOM 1368 O ALA A 95 1.833 -8.024 5.320 1.00 0.00 O ATOM 1369 CB ALA A 95 -0.258 -9.205 3.765 1.00 0.00 C ATOM 0 H ALA A 95 -0.289 -9.583 6.434 1.00 0.00 H new ATOM 0 HA ALA A 95 0.971 -10.903 4.096 1.00 0.00 H new ATOM 0 HB1 ALA A 95 0.240 -8.941 2.832 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.139 -9.809 3.548 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.561 -8.296 4.284 1.00 0.00 H new ATOM 1375 N ASP A 96 3.105 -9.834 4.823 1.00 0.00 N ATOM 1376 CA ASP A 96 4.386 -9.203 5.057 1.00 0.00 C ATOM 1377 C ASP A 96 4.756 -8.406 3.810 1.00 0.00 C ATOM 1378 O ASP A 96 4.903 -8.970 2.726 1.00 0.00 O ATOM 1379 CB ASP A 96 5.450 -10.241 5.437 1.00 0.00 C ATOM 1380 CG ASP A 96 5.258 -10.823 6.837 1.00 0.00 C ATOM 1381 OD1 ASP A 96 4.460 -10.250 7.612 1.00 0.00 O ATOM 1382 OD2 ASP A 96 5.938 -11.832 7.117 1.00 0.00 O ATOM 0 H ASP A 96 3.174 -10.813 4.545 1.00 0.00 H new ATOM 0 HA ASP A 96 4.327 -8.520 5.904 1.00 0.00 H new ATOM 0 HB2 ASP A 96 5.432 -11.052 4.709 1.00 0.00 H new ATOM 0 HB3 ASP A 96 6.435 -9.779 5.376 1.00 0.00 H new ATOM 1387 N VAL A 97 4.852 -7.084 3.951 1.00 0.00 N ATOM 1388 CA VAL A 97 5.196 -6.173 2.869 1.00 0.00 C ATOM 1389 C VAL A 97 6.705 -5.969 2.897 1.00 0.00 C ATOM 1390 O VAL A 97 7.288 -5.971 3.981 1.00 0.00 O ATOM 1391 CB VAL A 97 4.457 -4.833 3.036 1.00 0.00 C ATOM 1392 CG1 VAL A 97 4.517 -4.014 1.740 1.00 0.00 C ATOM 1393 CG2 VAL A 97 3.013 -5.064 3.492 1.00 0.00 C ATOM 0 H VAL A 97 4.689 -6.611 4.840 1.00 0.00 H new ATOM 0 HA VAL A 97 4.893 -6.591 1.909 1.00 0.00 H new ATOM 0 HB VAL A 97 4.959 -4.256 3.812 1.00 0.00 H new ATOM 0 HG11 VAL A 97 3.989 -3.071 1.881 1.00 0.00 H new ATOM 0 HG12 VAL A 97 5.557 -3.812 1.485 1.00 0.00 H new ATOM 0 HG13 VAL A 97 4.048 -4.576 0.932 1.00 0.00 H new ATOM 0 HG21 VAL A 97 2.509 -4.104 3.604 1.00 0.00 H new ATOM 0 HG22 VAL A 97 2.489 -5.665 2.749 1.00 0.00 H new ATOM 0 HG23 VAL A 97 3.013 -5.588 4.448 1.00 0.00 H new ATOM 1403 N SER A 98 7.317 -5.757 1.731 1.00 0.00 N ATOM 1404 CA SER A 98 8.758 -5.610 1.573 1.00 0.00 C ATOM 1405 C SER A 98 9.079 -5.186 0.134 1.00 0.00 C ATOM 1406 O SER A 98 9.335 -6.028 -0.722 1.00 0.00 O ATOM 1407 CB SER A 98 9.450 -6.928 1.964 1.00 0.00 C ATOM 1408 OG SER A 98 8.719 -8.047 1.491 1.00 0.00 O ATOM 0 H SER A 98 6.808 -5.681 0.850 1.00 0.00 H new ATOM 0 HA SER A 98 9.137 -4.829 2.233 1.00 0.00 H new ATOM 0 HB2 SER A 98 10.459 -6.949 1.553 1.00 0.00 H new ATOM 0 HB3 SER A 98 9.546 -6.984 3.048 1.00 0.00 H new ATOM 0 HG SER A 98 9.180 -8.872 1.750 1.00 0.00 H new ATOM 1414 N ILE A 99 9.056 -3.879 -0.139 1.00 0.00 N ATOM 1415 CA ILE A 99 9.379 -3.307 -1.443 1.00 0.00 C ATOM 1416 C ILE A 99 10.046 -1.939 -1.210 1.00 0.00 C ATOM 1417 O ILE A 99 10.274 -1.563 -0.061 1.00 0.00 O ATOM 1418 CB ILE A 99 8.092 -3.282 -2.306 1.00 0.00 C ATOM 1419 CG1 ILE A 99 8.419 -3.553 -3.783 1.00 0.00 C ATOM 1420 CG2 ILE A 99 7.248 -2.014 -2.099 1.00 0.00 C ATOM 1421 CD1 ILE A 99 7.203 -3.454 -4.709 1.00 0.00 C ATOM 0 H ILE A 99 8.807 -3.176 0.557 1.00 0.00 H new ATOM 0 HA ILE A 99 10.096 -3.902 -2.008 1.00 0.00 H new ATOM 0 HB ILE A 99 7.456 -4.096 -1.959 1.00 0.00 H new ATOM 0 HG12 ILE A 99 9.176 -2.843 -4.115 1.00 0.00 H new ATOM 0 HG13 ILE A 99 8.854 -4.548 -3.873 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.362 -2.059 -2.732 1.00 0.00 H new ATOM 0 HG22 ILE A 99 6.945 -1.945 -1.054 1.00 0.00 H new ATOM 0 HG23 ILE A 99 7.838 -1.137 -2.364 1.00 0.00 H new ATOM 0 HD11 ILE A 99 7.510 -3.657 -5.735 1.00 0.00 H new ATOM 0 HD12 ILE A 99 6.453 -4.183 -4.403 1.00 0.00 H new ATOM 0 HD13 ILE A 99 6.780 -2.451 -4.649 1.00 0.00 H new ATOM 1433 N GLU A 100 10.360 -1.178 -2.258 1.00 0.00 N ATOM 1434 CA GLU A 100 10.922 0.157 -2.176 1.00 0.00 C ATOM 1435 C GLU A 100 10.238 1.057 -3.206 1.00 0.00 C ATOM 1436 O GLU A 100 9.674 0.559 -4.181 1.00 0.00 O ATOM 1437 CB GLU A 100 12.446 0.109 -2.382 1.00 0.00 C ATOM 1438 CG GLU A 100 12.891 -0.768 -3.564 1.00 0.00 C ATOM 1439 CD GLU A 100 12.950 -2.246 -3.188 1.00 0.00 C ATOM 1440 OE1 GLU A 100 13.881 -2.599 -2.428 1.00 0.00 O ATOM 1441 OE2 GLU A 100 12.044 -2.983 -3.637 1.00 0.00 O ATOM 0 H GLU A 100 10.223 -1.491 -3.219 1.00 0.00 H new ATOM 0 HA GLU A 100 10.743 0.573 -1.185 1.00 0.00 H new ATOM 0 HB2 GLU A 100 12.813 1.123 -2.537 1.00 0.00 H new ATOM 0 HB3 GLU A 100 12.914 -0.263 -1.471 1.00 0.00 H new ATOM 0 HG2 GLU A 100 12.200 -0.633 -4.396 1.00 0.00 H new ATOM 0 HG3 GLU A 100 13.872 -0.442 -3.908 1.00 0.00 H new ATOM 1448 N ASP A 101 10.307 2.376 -2.991 1.00 0.00 N ATOM 1449 CA ASP A 101 9.784 3.382 -3.909 1.00 0.00 C ATOM 1450 C ASP A 101 10.804 4.485 -4.125 1.00 0.00 C ATOM 1451 O ASP A 101 11.555 4.843 -3.221 1.00 0.00 O ATOM 1452 CB ASP A 101 8.513 4.036 -3.366 1.00 0.00 C ATOM 1453 CG ASP A 101 7.260 3.359 -3.879 1.00 0.00 C ATOM 1454 OD1 ASP A 101 6.994 3.494 -5.101 1.00 0.00 O ATOM 1455 OD2 ASP A 101 6.586 2.754 -3.022 1.00 0.00 O ATOM 0 H ASP A 101 10.737 2.776 -2.157 1.00 0.00 H new ATOM 0 HA ASP A 101 9.563 2.866 -4.843 1.00 0.00 H new ATOM 0 HB2 ASP A 101 8.524 3.999 -2.277 1.00 0.00 H new ATOM 0 HB3 ASP A 101 8.498 5.088 -3.650 1.00 0.00 H new ATOM 1460 N SER A 102 10.762 5.053 -5.327 1.00 0.00 N ATOM 1461 CA SER A 102 11.569 6.165 -5.781 1.00 0.00 C ATOM 1462 C SER A 102 10.793 7.486 -5.720 1.00 0.00 C ATOM 1463 O SER A 102 11.405 8.552 -5.708 1.00 0.00 O ATOM 1464 CB SER A 102 11.990 5.843 -7.216 1.00 0.00 C ATOM 1465 OG SER A 102 10.875 5.330 -7.932 1.00 0.00 O ATOM 0 H SER A 102 10.122 4.723 -6.049 1.00 0.00 H new ATOM 0 HA SER A 102 12.438 6.294 -5.137 1.00 0.00 H new ATOM 0 HB2 SER A 102 12.369 6.740 -7.705 1.00 0.00 H new ATOM 0 HB3 SER A 102 12.801 5.115 -7.214 1.00 0.00 H new ATOM 0 HG SER A 102 11.143 5.125 -8.852 1.00 0.00 H new ATOM 1471 N VAL A 103 9.456 7.430 -5.734 1.00 0.00 N ATOM 1472 CA VAL A 103 8.615 8.617 -5.823 1.00 0.00 C ATOM 1473 C VAL A 103 8.419 9.230 -4.439 1.00 0.00 C ATOM 1474 O VAL A 103 8.780 10.384 -4.210 1.00 0.00 O ATOM 1475 CB VAL A 103 7.274 8.275 -6.498 1.00 0.00 C ATOM 1476 CG1 VAL A 103 6.367 9.512 -6.553 1.00 0.00 C ATOM 1477 CG2 VAL A 103 7.499 7.771 -7.929 1.00 0.00 C ATOM 0 H VAL A 103 8.932 6.557 -5.684 1.00 0.00 H new ATOM 0 HA VAL A 103 9.111 9.363 -6.445 1.00 0.00 H new ATOM 0 HB VAL A 103 6.797 7.494 -5.906 1.00 0.00 H new ATOM 0 HG11 VAL A 103 5.424 9.251 -7.033 1.00 0.00 H new ATOM 0 HG12 VAL A 103 6.173 9.866 -5.541 1.00 0.00 H new ATOM 0 HG13 VAL A 103 6.859 10.299 -7.124 1.00 0.00 H new ATOM 0 HG21 VAL A 103 6.538 7.535 -8.387 1.00 0.00 H new ATOM 0 HG22 VAL A 103 7.999 8.544 -8.513 1.00 0.00 H new ATOM 0 HG23 VAL A 103 8.119 6.875 -7.906 1.00 0.00 H new ATOM 1487 N ILE A 104 7.803 8.485 -3.518 1.00 0.00 N ATOM 1488 CA ILE A 104 7.601 8.958 -2.167 1.00 0.00 C ATOM 1489 C ILE A 104 8.939 9.025 -1.426 1.00 0.00 C ATOM 1490 O ILE A 104 9.941 8.498 -1.907 1.00 0.00 O ATOM 1491 CB ILE A 104 6.538 8.100 -1.471 1.00 0.00 C ATOM 1492 CG1 ILE A 104 6.767 6.582 -1.392 1.00 0.00 C ATOM 1493 CG2 ILE A 104 5.156 8.367 -2.081 1.00 0.00 C ATOM 1494 CD1 ILE A 104 8.030 6.189 -0.623 1.00 0.00 C ATOM 0 H ILE A 104 7.438 7.549 -3.695 1.00 0.00 H new ATOM 0 HA ILE A 104 7.214 9.977 -2.171 1.00 0.00 H new ATOM 0 HB ILE A 104 6.614 8.429 -0.435 1.00 0.00 H new ATOM 0 HG12 ILE A 104 5.903 6.118 -0.916 1.00 0.00 H new ATOM 0 HG13 ILE A 104 6.828 6.180 -2.403 1.00 0.00 H new ATOM 0 HG21 ILE A 104 4.411 7.751 -1.577 1.00 0.00 H new ATOM 0 HG22 ILE A 104 4.901 9.419 -1.957 1.00 0.00 H new ATOM 0 HG23 ILE A 104 5.173 8.120 -3.143 1.00 0.00 H new ATOM 0 HD11 ILE A 104 8.125 5.103 -0.609 1.00 0.00 H new ATOM 0 HD12 ILE A 104 8.903 6.623 -1.111 1.00 0.00 H new ATOM 0 HD13 ILE A 104 7.964 6.560 0.400 1.00 0.00 H new ATOM 1506 N SER A 105 8.969 9.704 -0.275 1.00 0.00 N ATOM 1507 CA SER A 105 10.165 10.015 0.491 1.00 0.00 C ATOM 1508 C SER A 105 9.689 10.836 1.677 1.00 0.00 C ATOM 1509 O SER A 105 8.488 11.065 1.805 1.00 0.00 O ATOM 1510 CB SER A 105 11.239 10.721 -0.359 1.00 0.00 C ATOM 1511 OG SER A 105 12.089 9.775 -0.973 1.00 0.00 O ATOM 0 H SER A 105 8.120 10.064 0.161 1.00 0.00 H new ATOM 0 HA SER A 105 10.670 9.112 0.834 1.00 0.00 H new ATOM 0 HB2 SER A 105 10.761 11.336 -1.121 1.00 0.00 H new ATOM 0 HB3 SER A 105 11.826 11.391 0.270 1.00 0.00 H new ATOM 0 HG SER A 105 11.552 9.143 -1.495 1.00 0.00 H new ATOM 1517 N LEU A 106 10.628 11.241 2.529 1.00 0.00 N ATOM 1518 CA LEU A 106 10.473 12.136 3.658 1.00 0.00 C ATOM 1519 C LEU A 106 10.884 13.562 3.250 1.00 0.00 C ATOM 1520 O LEU A 106 11.012 14.434 4.105 1.00 0.00 O ATOM 1521 CB LEU A 106 11.281 11.599 4.848 1.00 0.00 C ATOM 1522 CG LEU A 106 10.883 10.153 5.216 1.00 0.00 C ATOM 1523 CD1 LEU A 106 11.784 9.117 4.532 1.00 0.00 C ATOM 1524 CD2 LEU A 106 11.015 9.941 6.725 1.00 0.00 C ATOM 0 H LEU A 106 11.592 10.922 2.434 1.00 0.00 H new ATOM 0 HA LEU A 106 9.430 12.183 3.970 1.00 0.00 H new ATOM 0 HB2 LEU A 106 12.344 11.632 4.608 1.00 0.00 H new ATOM 0 HB3 LEU A 106 11.129 12.247 5.711 1.00 0.00 H new ATOM 0 HG LEU A 106 9.854 10.018 4.882 1.00 0.00 H new ATOM 0 HD11 LEU A 106 11.468 8.114 4.819 1.00 0.00 H new ATOM 0 HD12 LEU A 106 11.707 9.226 3.450 1.00 0.00 H new ATOM 0 HD13 LEU A 106 12.818 9.274 4.840 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.732 8.918 6.975 1.00 0.00 H new ATOM 0 HD22 LEU A 106 12.047 10.116 7.028 1.00 0.00 H new ATOM 0 HD23 LEU A 106 10.360 10.637 7.249 1.00 0.00 H new ATOM 1566 N HIS A 110 6.923 15.389 -0.612 1.00 0.00 N ATOM 1567 CA HIS A 110 6.939 13.943 -0.732 1.00 0.00 C ATOM 1568 C HIS A 110 6.401 13.325 0.557 1.00 0.00 C ATOM 1569 O HIS A 110 5.517 12.465 0.489 1.00 0.00 O ATOM 1570 CB HIS A 110 8.358 13.451 -1.050 1.00 0.00 C ATOM 1571 CG HIS A 110 8.854 13.883 -2.409 1.00 0.00 C ATOM 1572 ND1 HIS A 110 9.057 13.060 -3.495 1.00 0.00 N ATOM 1573 CD2 HIS A 110 9.149 15.161 -2.806 1.00 0.00 C ATOM 1574 CE1 HIS A 110 9.463 13.829 -4.519 1.00 0.00 C ATOM 1575 NE2 HIS A 110 9.540 15.117 -4.146 1.00 0.00 N ATOM 0 HA HIS A 110 6.297 13.632 -1.556 1.00 0.00 H new ATOM 0 HB2 HIS A 110 9.042 13.822 -0.287 1.00 0.00 H new ATOM 0 HB3 HIS A 110 8.378 12.363 -0.994 1.00 0.00 H new ATOM 0 HD1 HIS A 110 8.923 12.049 -3.518 1.00 0.00 H new ATOM 0 HD2 HIS A 110 9.090 16.047 -2.191 1.00 0.00 H new ATOM 0 HE1 HIS A 110 9.696 13.462 -5.508 1.00 0.00 H new ATOM 1583 N SER A 111 6.933 13.801 1.693 1.00 0.00 N ATOM 1584 CA SER A 111 6.778 13.271 3.039 1.00 0.00 C ATOM 1585 C SER A 111 5.487 12.480 3.202 1.00 0.00 C ATOM 1586 O SER A 111 4.393 13.042 3.233 1.00 0.00 O ATOM 1587 CB SER A 111 6.904 14.364 4.106 1.00 0.00 C ATOM 1588 OG SER A 111 7.083 13.737 5.365 1.00 0.00 O ATOM 0 H SER A 111 7.527 14.630 1.684 1.00 0.00 H new ATOM 0 HA SER A 111 7.602 12.574 3.191 1.00 0.00 H new ATOM 0 HB2 SER A 111 7.748 15.017 3.883 1.00 0.00 H new ATOM 0 HB3 SER A 111 6.011 14.989 4.117 1.00 0.00 H new ATOM 0 HG SER A 111 7.168 14.421 6.062 1.00 0.00 H new ATOM 1594 N ILE A 112 5.612 11.155 3.285 1.00 0.00 N ATOM 1595 CA ILE A 112 4.448 10.305 3.470 1.00 0.00 C ATOM 1596 C ILE A 112 3.851 10.449 4.876 1.00 0.00 C ATOM 1597 O ILE A 112 2.740 9.993 5.129 1.00 0.00 O ATOM 1598 CB ILE A 112 4.725 8.846 3.078 1.00 0.00 C ATOM 1599 CG1 ILE A 112 5.400 7.997 4.163 1.00 0.00 C ATOM 1600 CG2 ILE A 112 5.473 8.756 1.751 1.00 0.00 C ATOM 1601 CD1 ILE A 112 6.793 8.443 4.613 1.00 0.00 C ATOM 0 H ILE A 112 6.500 10.656 3.227 1.00 0.00 H new ATOM 0 HA ILE A 112 3.681 10.656 2.779 1.00 0.00 H new ATOM 0 HB ILE A 112 3.737 8.401 2.956 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.749 7.980 5.037 1.00 0.00 H new ATOM 0 HG13 ILE A 112 5.471 6.972 3.799 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.652 7.709 1.505 1.00 0.00 H new ATOM 0 HG22 ILE A 112 4.875 9.217 0.964 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.427 9.277 1.835 1.00 0.00 H new ATOM 0 HD11 ILE A 112 7.162 7.764 5.381 1.00 0.00 H new ATOM 0 HD12 ILE A 112 7.472 8.430 3.761 1.00 0.00 H new ATOM 0 HD13 ILE A 112 6.738 9.453 5.018 1.00 0.00 H new ATOM 1613 N ILE A 113 4.585 11.082 5.792 1.00 0.00 N ATOM 1614 CA ILE A 113 4.105 11.397 7.122 1.00 0.00 C ATOM 1615 C ILE A 113 2.840 12.232 6.969 1.00 0.00 C ATOM 1616 O ILE A 113 2.866 13.313 6.386 1.00 0.00 O ATOM 1617 CB ILE A 113 5.196 12.121 7.930 1.00 0.00 C ATOM 1618 CG1 ILE A 113 6.386 11.188 8.216 1.00 0.00 C ATOM 1619 CG2 ILE A 113 4.646 12.716 9.235 1.00 0.00 C ATOM 1620 CD1 ILE A 113 6.066 10.114 9.257 1.00 0.00 C ATOM 0 H ILE A 113 5.542 11.391 5.620 1.00 0.00 H new ATOM 0 HA ILE A 113 3.867 10.491 7.680 1.00 0.00 H new ATOM 0 HB ILE A 113 5.549 12.950 7.317 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.694 10.706 7.288 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.231 11.782 8.563 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.450 13.218 9.773 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.860 13.435 9.004 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.237 11.918 9.855 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.944 9.488 9.415 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.785 10.590 10.197 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.240 9.498 8.902 1.00 0.00 H new ATOM 1632 N GLY A 114 1.735 11.691 7.466 1.00 0.00 N ATOM 1633 CA GLY A 114 0.432 12.311 7.401 1.00 0.00 C ATOM 1634 C GLY A 114 -0.463 11.741 6.300 1.00 0.00 C ATOM 1635 O GLY A 114 -1.609 12.161 6.187 1.00 0.00 O ATOM 0 H GLY A 114 1.728 10.786 7.936 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -0.067 12.190 8.362 1.00 0.00 H new ATOM 0 HA3 GLY A 114 0.556 13.382 7.239 1.00 0.00 H new ATOM 1639 N ARG A 115 0.030 10.801 5.488 1.00 0.00 N ATOM 1640 CA ARG A 115 -0.771 10.154 4.453 1.00 0.00 C ATOM 1641 C ARG A 115 -1.567 8.980 5.041 1.00 0.00 C ATOM 1642 O ARG A 115 -1.096 8.326 5.978 1.00 0.00 O ATOM 1643 CB ARG A 115 0.162 9.608 3.369 1.00 0.00 C ATOM 1644 CG ARG A 115 0.978 10.647 2.594 1.00 0.00 C ATOM 1645 CD ARG A 115 0.145 11.501 1.633 1.00 0.00 C ATOM 1646 NE ARG A 115 0.749 11.594 0.289 1.00 0.00 N ATOM 1647 CZ ARG A 115 1.993 12.004 -0.020 1.00 0.00 C ATOM 1648 NH1 ARG A 115 2.823 12.476 0.915 1.00 0.00 N ATOM 1649 NH2 ARG A 115 2.415 11.920 -1.286 1.00 0.00 N ATOM 0 H ARG A 115 0.994 10.470 5.532 1.00 0.00 H new ATOM 0 HA ARG A 115 -1.463 10.887 4.038 1.00 0.00 H new ATOM 0 HB2 ARG A 115 0.854 8.906 3.834 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -0.436 9.041 2.656 1.00 0.00 H new ATOM 0 HG2 ARG A 115 1.481 11.303 3.305 1.00 0.00 H new ATOM 0 HG3 ARG A 115 1.756 10.135 2.028 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -0.855 11.077 1.549 1.00 0.00 H new ATOM 0 HD3 ARG A 115 0.033 12.503 2.047 1.00 0.00 H new ATOM 0 HE ARG A 115 0.157 11.316 -0.494 1.00 0.00 H new ATOM 0 HH11 ARG A 115 2.518 12.531 1.887 1.00 0.00 H new ATOM 0 HH12 ARG A 115 3.762 12.781 0.657 1.00 0.00 H new ATOM 0 HH21 ARG A 115 1.796 11.548 -2.006 1.00 0.00 H new ATOM 0 HH22 ARG A 115 3.356 12.228 -1.531 1.00 0.00 H new ATOM 1663 N THR A 116 -2.725 8.660 4.445 1.00 0.00 N ATOM 1664 CA THR A 116 -3.516 7.491 4.791 1.00 0.00 C ATOM 1665 C THR A 116 -3.171 6.309 3.889 1.00 0.00 C ATOM 1666 O THR A 116 -3.470 6.341 2.696 1.00 0.00 O ATOM 1667 CB THR A 116 -4.997 7.825 4.665 1.00 0.00 C ATOM 1668 OG1 THR A 116 -5.260 8.919 5.492 1.00 0.00 O ATOM 1669 CG2 THR A 116 -5.921 6.681 5.078 1.00 0.00 C ATOM 0 H THR A 116 -3.136 9.221 3.699 1.00 0.00 H new ATOM 0 HA THR A 116 -3.288 7.210 5.819 1.00 0.00 H new ATOM 0 HB THR A 116 -5.196 8.031 3.613 1.00 0.00 H new ATOM 0 HG1 THR A 116 -6.209 9.157 5.428 1.00 0.00 H new ATOM 0 HG21 THR A 116 -6.959 6.992 4.962 1.00 0.00 H new ATOM 0 HG22 THR A 116 -5.729 5.813 4.447 1.00 0.00 H new ATOM 0 HG23 THR A 116 -5.735 6.421 6.120 1.00 0.00 H new ATOM 1677 N LEU A 117 -2.587 5.254 4.454 1.00 0.00 N ATOM 1678 CA LEU A 117 -2.275 4.022 3.748 1.00 0.00 C ATOM 1679 C LEU A 117 -3.376 3.001 4.031 1.00 0.00 C ATOM 1680 O LEU A 117 -3.736 2.791 5.189 1.00 0.00 O ATOM 1681 CB LEU A 117 -0.882 3.548 4.168 1.00 0.00 C ATOM 1682 CG LEU A 117 -0.310 2.506 3.196 1.00 0.00 C ATOM 1683 CD1 LEU A 117 1.194 2.728 3.044 1.00 0.00 C ATOM 1684 CD2 LEU A 117 -0.535 1.083 3.703 1.00 0.00 C ATOM 0 H LEU A 117 -2.313 5.236 5.436 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.247 4.171 2.669 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -0.209 4.403 4.219 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -0.931 3.121 5.169 1.00 0.00 H new ATOM 0 HG LEU A 117 -0.822 2.625 2.241 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.603 1.990 2.354 1.00 0.00 H new ATOM 0 HD12 LEU A 117 1.376 3.729 2.654 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.677 2.624 4.015 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -0.117 0.372 2.990 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.045 0.959 4.668 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.604 0.901 3.813 1.00 0.00 H new ATOM 1696 N VAL A 118 -3.959 2.408 2.984 1.00 0.00 N ATOM 1697 CA VAL A 118 -5.168 1.600 3.085 1.00 0.00 C ATOM 1698 C VAL A 118 -4.971 0.288 2.327 1.00 0.00 C ATOM 1699 O VAL A 118 -4.325 0.279 1.273 1.00 0.00 O ATOM 1700 CB VAL A 118 -6.361 2.409 2.546 1.00 0.00 C ATOM 1701 CG1 VAL A 118 -7.702 1.728 2.817 1.00 0.00 C ATOM 1702 CG2 VAL A 118 -6.424 3.810 3.166 1.00 0.00 C ATOM 0 H VAL A 118 -3.596 2.480 2.033 1.00 0.00 H new ATOM 0 HA VAL A 118 -5.376 1.349 4.125 1.00 0.00 H new ATOM 0 HB VAL A 118 -6.196 2.475 1.471 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -8.509 2.341 2.416 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -7.717 0.750 2.337 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -7.838 1.607 3.892 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -7.280 4.349 2.760 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -6.529 3.725 4.248 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -5.508 4.353 2.932 1.00 0.00 H new ATOM 1712 N VAL A 119 -5.522 -0.807 2.873 1.00 0.00 N ATOM 1713 CA VAL A 119 -5.484 -2.134 2.275 1.00 0.00 C ATOM 1714 C VAL A 119 -6.877 -2.513 1.766 1.00 0.00 C ATOM 1715 O VAL A 119 -7.887 -2.132 2.362 1.00 0.00 O ATOM 1716 CB VAL A 119 -4.939 -3.169 3.273 1.00 0.00 C ATOM 1717 CG1 VAL A 119 -5.897 -3.388 4.439 1.00 0.00 C ATOM 1718 CG2 VAL A 119 -4.735 -4.528 2.602 1.00 0.00 C ATOM 0 H VAL A 119 -6.017 -0.785 3.765 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.803 -2.123 1.424 1.00 0.00 H new ATOM 0 HB VAL A 119 -3.992 -2.768 3.634 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -5.476 -4.126 5.122 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.047 -2.447 4.969 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.854 -3.748 4.061 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.349 -5.240 3.332 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -5.687 -4.888 2.212 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -4.023 -4.426 1.783 1.00 0.00 H new ATOM 1728 N HIS A 120 -6.926 -3.292 0.685 1.00 0.00 N ATOM 1729 CA HIS A 120 -8.153 -3.692 0.003 1.00 0.00 C ATOM 1730 C HIS A 120 -8.341 -5.197 -0.005 1.00 0.00 C ATOM 1731 O HIS A 120 -7.384 -5.940 0.191 1.00 0.00 O ATOM 1732 CB HIS A 120 -8.141 -3.211 -1.441 1.00 0.00 C ATOM 1733 CG HIS A 120 -8.196 -1.732 -1.555 1.00 0.00 C ATOM 1734 ND1 HIS A 120 -9.288 -0.979 -1.873 1.00 0.00 N ATOM 1735 CD2 HIS A 120 -7.098 -0.958 -1.410 1.00 0.00 C ATOM 1736 CE1 HIS A 120 -8.886 0.292 -1.936 1.00 0.00 C ATOM 1737 NE2 HIS A 120 -7.565 0.330 -1.655 1.00 0.00 N ATOM 0 H HIS A 120 -6.086 -3.673 0.248 1.00 0.00 H new ATOM 0 HA HIS A 120 -8.975 -3.236 0.555 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -7.239 -3.575 -1.933 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.990 -3.643 -1.970 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -10.235 -1.323 -2.033 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -6.093 -1.267 -1.162 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -9.509 1.143 -2.171 1.00 0.00 H new ATOM 1745 N GLU A 121 -9.575 -5.642 -0.252 1.00 0.00 N ATOM 1746 CA GLU A 121 -9.935 -7.050 -0.226 1.00 0.00 C ATOM 1747 C GLU A 121 -9.250 -7.841 -1.342 1.00 0.00 C ATOM 1748 O GLU A 121 -8.609 -8.854 -1.082 1.00 0.00 O ATOM 1749 CB GLU A 121 -11.453 -7.209 -0.342 1.00 0.00 C ATOM 1750 CG GLU A 121 -11.858 -8.610 0.140 1.00 0.00 C ATOM 1751 CD GLU A 121 -13.367 -8.797 0.173 1.00 0.00 C ATOM 1752 OE1 GLU A 121 -14.075 -7.797 -0.075 1.00 0.00 O ATOM 1753 OE2 GLU A 121 -13.773 -9.950 0.427 1.00 0.00 O ATOM 0 H GLU A 121 -10.355 -5.025 -0.477 1.00 0.00 H new ATOM 0 HA GLU A 121 -9.592 -7.453 0.727 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -11.956 -6.448 0.254 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -11.767 -7.063 -1.376 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -11.416 -9.359 -0.517 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -11.451 -8.780 1.137 1.00 0.00 H new ATOM 1760 N LYS A 122 -9.424 -7.408 -2.586 1.00 0.00 N ATOM 1761 CA LYS A 122 -8.865 -8.077 -3.749 1.00 0.00 C ATOM 1762 C LYS A 122 -7.470 -7.532 -4.061 1.00 0.00 C ATOM 1763 O LYS A 122 -7.011 -6.535 -3.492 1.00 0.00 O ATOM 1764 CB LYS A 122 -9.799 -7.908 -4.960 1.00 0.00 C ATOM 1765 CG LYS A 122 -11.203 -8.510 -4.799 1.00 0.00 C ATOM 1766 CD LYS A 122 -11.244 -10.032 -5.014 1.00 0.00 C ATOM 1767 CE LYS A 122 -11.303 -10.811 -3.691 1.00 0.00 C ATOM 1768 NZ LYS A 122 -11.296 -12.273 -3.913 1.00 0.00 N ATOM 0 H LYS A 122 -9.964 -6.573 -2.815 1.00 0.00 H new ATOM 0 HA LYS A 122 -8.773 -9.141 -3.530 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -9.901 -6.844 -5.173 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -9.325 -8.363 -5.829 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -11.576 -8.282 -3.800 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -11.879 -8.032 -5.508 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -12.113 -10.287 -5.621 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.362 -10.341 -5.575 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -10.453 -10.534 -3.068 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -12.203 -10.531 -3.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -11.337 -12.763 -2.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -12.121 -12.541 -4.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -10.425 -12.544 -4.412 1.00 0.00 H new ATOM 1782 N ALA A 123 -6.818 -8.211 -5.004 1.00 0.00 N ATOM 1783 CA ALA A 123 -5.569 -7.794 -5.606 1.00 0.00 C ATOM 1784 C ALA A 123 -5.785 -6.492 -6.375 1.00 0.00 C ATOM 1785 O ALA A 123 -6.861 -6.264 -6.920 1.00 0.00 O ATOM 1786 CB ALA A 123 -5.105 -8.892 -6.566 1.00 0.00 C ATOM 0 H ALA A 123 -7.163 -9.095 -5.377 1.00 0.00 H new ATOM 0 HA ALA A 123 -4.815 -7.629 -4.837 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -4.164 -8.596 -7.030 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -4.961 -9.821 -6.014 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -5.859 -9.042 -7.339 1.00 0.00 H new ATOM 1792 N ASP A 124 -4.748 -5.663 -6.436 1.00 0.00 N ATOM 1793 CA ASP A 124 -4.683 -4.523 -7.330 1.00 0.00 C ATOM 1794 C ASP A 124 -4.419 -5.018 -8.759 1.00 0.00 C ATOM 1795 O ASP A 124 -3.394 -5.631 -9.052 1.00 0.00 O ATOM 1796 CB ASP A 124 -3.587 -3.578 -6.840 1.00 0.00 C ATOM 1797 CG ASP A 124 -3.633 -2.264 -7.589 1.00 0.00 C ATOM 1798 OD1 ASP A 124 -3.980 -2.263 -8.786 1.00 0.00 O ATOM 1799 OD2 ASP A 124 -3.388 -1.225 -6.950 1.00 0.00 O ATOM 0 H ASP A 124 -3.917 -5.770 -5.854 1.00 0.00 H new ATOM 0 HA ASP A 124 -5.626 -3.976 -7.337 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -3.708 -3.397 -5.772 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -2.611 -4.045 -6.976 1.00 0.00 H new ATOM 1804 N ASP A 125 -5.370 -4.732 -9.640 1.00 0.00 N ATOM 1805 CA ASP A 125 -5.424 -5.045 -11.056 1.00 0.00 C ATOM 1806 C ASP A 125 -4.502 -4.156 -11.895 1.00 0.00 C ATOM 1807 O ASP A 125 -4.445 -4.305 -13.111 1.00 0.00 O ATOM 1808 CB ASP A 125 -6.895 -4.875 -11.458 1.00 0.00 C ATOM 1809 CG ASP A 125 -7.208 -5.130 -12.917 1.00 0.00 C ATOM 1810 OD1 ASP A 125 -6.779 -6.176 -13.444 1.00 0.00 O ATOM 1811 OD2 ASP A 125 -7.923 -4.263 -13.470 1.00 0.00 O ATOM 0 H ASP A 125 -6.205 -4.224 -9.347 1.00 0.00 H new ATOM 0 HA ASP A 125 -5.067 -6.058 -11.241 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -7.499 -5.550 -10.852 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -7.206 -3.860 -11.210 1.00 0.00 H new ATOM 1816 N LEU A 126 -3.783 -3.209 -11.285 1.00 0.00 N ATOM 1817 CA LEU A 126 -2.913 -2.260 -11.956 1.00 0.00 C ATOM 1818 C LEU A 126 -3.560 -1.679 -13.221 1.00 0.00 C ATOM 1819 O LEU A 126 -2.920 -1.520 -14.258 1.00 0.00 O ATOM 1820 CB LEU A 126 -1.544 -2.897 -12.214 1.00 0.00 C ATOM 1821 CG LEU A 126 -1.051 -3.768 -11.046 1.00 0.00 C ATOM 1822 CD1 LEU A 126 0.361 -4.234 -11.332 1.00 0.00 C ATOM 1823 CD2 LEU A 126 -1.067 -3.105 -9.668 1.00 0.00 C ATOM 0 H LEU A 126 -3.797 -3.084 -10.273 1.00 0.00 H new ATOM 0 HA LEU A 126 -2.756 -1.404 -11.299 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -1.598 -3.507 -13.116 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -0.814 -2.110 -12.405 1.00 0.00 H new ATOM 0 HG LEU A 126 -1.765 -4.590 -10.990 1.00 0.00 H new ATOM 0 HD11 LEU A 126 0.714 -4.852 -10.506 1.00 0.00 H new ATOM 0 HD12 LEU A 126 0.372 -4.818 -12.253 1.00 0.00 H new ATOM 0 HD13 LEU A 126 1.014 -3.369 -11.443 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.700 -3.809 -8.921 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.427 -2.223 -9.681 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -2.086 -2.810 -9.418 1.00 0.00 H new ATOM 1835 N GLY A 127 -4.853 -1.370 -13.122 1.00 0.00 N ATOM 1836 CA GLY A 127 -5.631 -0.734 -14.178 1.00 0.00 C ATOM 1837 C GLY A 127 -6.026 -1.675 -15.326 1.00 0.00 C ATOM 1838 O GLY A 127 -6.814 -1.284 -16.189 1.00 0.00 O ATOM 0 H GLY A 127 -5.400 -1.561 -12.282 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -6.536 -0.312 -13.742 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -5.056 0.097 -14.586 1.00 0.00 H new ATOM 1842 N LYS A 128 -5.497 -2.901 -15.352 1.00 0.00 N ATOM 1843 CA LYS A 128 -5.490 -3.741 -16.541 1.00 0.00 C ATOM 1844 C LYS A 128 -6.889 -4.135 -17.022 1.00 0.00 C ATOM 1845 O LYS A 128 -7.084 -4.334 -18.217 1.00 0.00 O ATOM 1846 CB LYS A 128 -4.578 -4.951 -16.303 1.00 0.00 C ATOM 1847 CG LYS A 128 -3.137 -4.479 -16.017 1.00 0.00 C ATOM 1848 CD LYS A 128 -2.053 -5.334 -16.678 1.00 0.00 C ATOM 1849 CE LYS A 128 -2.151 -5.256 -18.207 1.00 0.00 C ATOM 1850 NZ LYS A 128 -0.856 -5.550 -18.852 1.00 0.00 N ATOM 0 H LYS A 128 -5.060 -3.337 -14.540 1.00 0.00 H new ATOM 0 HA LYS A 128 -5.084 -3.153 -17.365 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -4.950 -5.538 -15.463 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -4.589 -5.602 -17.177 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -3.030 -3.449 -16.358 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -2.975 -4.476 -14.939 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -1.069 -4.994 -16.355 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -2.154 -6.370 -16.355 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -2.902 -5.962 -18.560 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -2.486 -4.261 -18.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -0.961 -5.488 -19.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -0.145 -4.861 -18.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -0.549 -6.509 -18.592 1.00 0.00 H new ATOM 1864 N GLY A 129 -7.867 -4.200 -16.121 1.00 0.00 N ATOM 1865 CA GLY A 129 -9.261 -4.454 -16.438 1.00 0.00 C ATOM 1866 C GLY A 129 -9.844 -3.446 -17.434 1.00 0.00 C ATOM 1867 O GLY A 129 -10.832 -3.750 -18.099 1.00 0.00 O ATOM 0 H GLY A 129 -7.701 -4.073 -15.123 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -9.357 -5.459 -16.849 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -9.847 -4.428 -15.519 1.00 0.00 H new ATOM 1871 N GLY A 130 -9.261 -2.245 -17.550 1.00 0.00 N ATOM 1872 CA GLY A 130 -9.670 -1.294 -18.577 1.00 0.00 C ATOM 1873 C GLY A 130 -11.080 -0.753 -18.340 1.00 0.00 C ATOM 1874 O GLY A 130 -11.807 -0.462 -19.286 1.00 0.00 O ATOM 0 H GLY A 130 -8.509 -1.916 -16.945 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -8.964 -0.464 -18.602 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -9.628 -1.777 -19.553 1.00 0.00 H new ATOM 1878 N ASN A 131 -11.445 -0.575 -17.069 1.00 0.00 N ATOM 1879 CA ASN A 131 -12.660 0.104 -16.629 1.00 0.00 C ATOM 1880 C ASN A 131 -12.306 1.205 -15.646 1.00 0.00 C ATOM 1881 O ASN A 131 -11.221 1.136 -15.068 1.00 0.00 O ATOM 1882 CB ASN A 131 -13.734 -0.865 -16.110 1.00 0.00 C ATOM 1883 CG ASN A 131 -13.170 -1.855 -15.109 1.00 0.00 C ATOM 1884 OD1 ASN A 131 -13.616 -2.991 -15.015 1.00 0.00 O ATOM 1885 ND2 ASN A 131 -12.139 -1.439 -14.390 1.00 0.00 N ATOM 0 H ASN A 131 -10.880 -0.913 -16.290 1.00 0.00 H new ATOM 0 HA ASN A 131 -13.125 0.573 -17.496 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -14.540 -0.298 -15.644 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -14.170 -1.407 -16.950 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -11.688 -2.073 -13.730 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -11.795 -0.485 -14.496 1.00 0.00 H new ATOM 1892 N GLU A 132 -13.200 2.175 -15.413 1.00 0.00 N ATOM 1893 CA GLU A 132 -12.929 3.244 -14.461 1.00 0.00 C ATOM 1894 C GLU A 132 -12.448 2.638 -13.143 1.00 0.00 C ATOM 1895 O GLU A 132 -11.377 2.984 -12.664 1.00 0.00 O ATOM 1896 CB GLU A 132 -14.150 4.146 -14.237 1.00 0.00 C ATOM 1897 CG GLU A 132 -13.692 5.475 -13.614 1.00 0.00 C ATOM 1898 CD GLU A 132 -14.770 6.104 -12.748 1.00 0.00 C ATOM 1899 OE1 GLU A 132 -14.935 5.597 -11.616 1.00 0.00 O ATOM 1900 OE2 GLU A 132 -15.391 7.082 -13.206 1.00 0.00 O ATOM 0 H GLU A 132 -14.110 2.236 -15.871 1.00 0.00 H new ATOM 0 HA GLU A 132 -12.147 3.880 -14.877 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -14.659 4.331 -15.183 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -14.867 3.651 -13.581 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -12.799 5.304 -13.013 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.414 6.169 -14.407 1.00 0.00 H new ATOM 1907 N GLN A 133 -13.213 1.685 -12.600 1.00 0.00 N ATOM 1908 CA GLN A 133 -12.929 1.072 -11.312 1.00 0.00 C ATOM 1909 C GLN A 133 -11.452 0.672 -11.187 1.00 0.00 C ATOM 1910 O GLN A 133 -10.735 1.222 -10.364 1.00 0.00 O ATOM 1911 CB GLN A 133 -13.908 -0.088 -11.039 1.00 0.00 C ATOM 1912 CG GLN A 133 -14.639 0.124 -9.704 1.00 0.00 C ATOM 1913 CD GLN A 133 -13.658 0.341 -8.563 1.00 0.00 C ATOM 1914 OE1 GLN A 133 -13.655 1.383 -7.912 1.00 0.00 O ATOM 1915 NE2 GLN A 133 -12.763 -0.617 -8.389 1.00 0.00 N ATOM 0 H GLN A 133 -14.052 1.319 -13.051 1.00 0.00 H new ATOM 0 HA GLN A 133 -13.094 1.811 -10.528 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -14.633 -0.157 -11.850 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -13.364 -1.032 -11.016 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -15.303 0.985 -9.784 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -15.265 -0.742 -9.488 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -12.807 -1.465 -8.954 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -12.029 -0.508 -7.689 1.00 0.00 H new ATOM 1924 N SER A 134 -10.975 -0.255 -12.011 1.00 0.00 N ATOM 1925 CA SER A 134 -9.569 -0.603 -12.167 1.00 0.00 C ATOM 1926 C SER A 134 -8.693 0.623 -12.378 1.00 0.00 C ATOM 1927 O SER A 134 -7.784 0.850 -11.586 1.00 0.00 O ATOM 1928 CB SER A 134 -9.317 -1.590 -13.310 1.00 0.00 C ATOM 1929 OG SER A 134 -10.072 -2.769 -13.148 1.00 0.00 O ATOM 0 H SER A 134 -11.585 -0.807 -12.614 1.00 0.00 H new ATOM 0 HA SER A 134 -9.298 -1.086 -11.228 1.00 0.00 H new ATOM 0 HB2 SER A 134 -9.572 -1.121 -14.260 1.00 0.00 H new ATOM 0 HB3 SER A 134 -8.256 -1.838 -13.351 1.00 0.00 H new ATOM 0 HG SER A 134 -9.467 -3.532 -13.035 1.00 0.00 H new ATOM 1935 N THR A 135 -8.937 1.400 -13.436 1.00 0.00 N ATOM 1936 CA THR A 135 -8.034 2.485 -13.818 1.00 0.00 C ATOM 1937 C THR A 135 -8.005 3.617 -12.775 1.00 0.00 C ATOM 1938 O THR A 135 -7.160 4.512 -12.852 1.00 0.00 O ATOM 1939 CB THR A 135 -8.349 2.976 -15.237 1.00 0.00 C ATOM 1940 OG1 THR A 135 -9.677 3.437 -15.324 1.00 0.00 O ATOM 1941 CG2 THR A 135 -8.141 1.862 -16.271 1.00 0.00 C ATOM 0 H THR A 135 -9.751 1.297 -14.042 1.00 0.00 H new ATOM 0 HA THR A 135 -7.019 2.089 -13.835 1.00 0.00 H new ATOM 0 HB THR A 135 -7.663 3.795 -15.452 1.00 0.00 H new ATOM 0 HG1 THR A 135 -10.290 2.673 -15.307 1.00 0.00 H new ATOM 0 HG21 THR A 135 -8.372 2.242 -17.266 1.00 0.00 H new ATOM 0 HG22 THR A 135 -7.104 1.528 -16.242 1.00 0.00 H new ATOM 0 HG23 THR A 135 -8.799 1.024 -16.040 1.00 0.00 H new ATOM 1949 N LYS A 136 -8.897 3.541 -11.783 1.00 0.00 N ATOM 1950 CA LYS A 136 -9.007 4.390 -10.618 1.00 0.00 C ATOM 1951 C LYS A 136 -8.520 3.671 -9.353 1.00 0.00 C ATOM 1952 O LYS A 136 -8.085 4.363 -8.433 1.00 0.00 O ATOM 1953 CB LYS A 136 -10.482 4.773 -10.482 1.00 0.00 C ATOM 1954 CG LYS A 136 -10.791 5.756 -9.348 1.00 0.00 C ATOM 1955 CD LYS A 136 -12.288 6.101 -9.328 1.00 0.00 C ATOM 1956 CE LYS A 136 -13.193 4.884 -9.049 1.00 0.00 C ATOM 1957 NZ LYS A 136 -14.619 5.261 -9.060 1.00 0.00 N ATOM 0 H LYS A 136 -9.617 2.818 -11.785 1.00 0.00 H new ATOM 0 HA LYS A 136 -8.381 5.274 -10.736 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -10.817 5.209 -11.423 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -11.065 3.865 -10.326 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -10.499 5.321 -8.392 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -10.204 6.665 -9.477 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -12.468 6.860 -8.567 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -12.565 6.538 -10.287 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -13.013 4.115 -9.800 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -12.937 4.452 -8.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -15.180 4.509 -8.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -14.747 6.149 -8.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -14.936 5.391 -10.042 1.00 0.00 H new ATOM 1971 N THR A 137 -8.632 2.334 -9.244 1.00 0.00 N ATOM 1972 CA THR A 137 -8.345 1.678 -7.952 1.00 0.00 C ATOM 1973 C THR A 137 -7.573 0.361 -8.029 1.00 0.00 C ATOM 1974 O THR A 137 -6.907 -0.011 -7.063 1.00 0.00 O ATOM 1975 CB THR A 137 -9.617 1.448 -7.130 1.00 0.00 C ATOM 1976 OG1 THR A 137 -10.405 0.473 -7.764 1.00 0.00 O ATOM 1977 CG2 THR A 137 -10.457 2.711 -6.926 1.00 0.00 C ATOM 0 H THR A 137 -8.907 1.707 -10.000 1.00 0.00 H new ATOM 0 HA THR A 137 -7.688 2.396 -7.461 1.00 0.00 H new ATOM 0 HB THR A 137 -9.294 1.123 -6.141 1.00 0.00 H new ATOM 0 HG1 THR A 137 -10.526 0.712 -8.707 1.00 0.00 H new ATOM 0 HG21 THR A 137 -11.341 2.469 -6.335 1.00 0.00 H new ATOM 0 HG22 THR A 137 -9.865 3.461 -6.402 1.00 0.00 H new ATOM 0 HG23 THR A 137 -10.765 3.104 -7.895 1.00 0.00 H new ATOM 1985 N GLY A 138 -7.728 -0.375 -9.125 1.00 0.00 N ATOM 1986 CA GLY A 138 -7.160 -1.683 -9.331 1.00 0.00 C ATOM 1987 C GLY A 138 -8.189 -2.769 -9.057 1.00 0.00 C ATOM 1988 O GLY A 138 -7.808 -3.874 -8.698 1.00 0.00 O ATOM 0 H GLY A 138 -8.278 -0.054 -9.922 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -6.798 -1.770 -10.355 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -6.299 -1.818 -8.676 1.00 0.00 H new ATOM 1992 N ASN A 139 -9.491 -2.479 -9.181 1.00 0.00 N ATOM 1993 CA ASN A 139 -10.541 -3.460 -8.933 1.00 0.00 C ATOM 1994 C ASN A 139 -10.338 -4.149 -7.582 1.00 0.00 C ATOM 1995 O ASN A 139 -10.701 -5.304 -7.380 1.00 0.00 O ATOM 1996 CB ASN A 139 -10.628 -4.479 -10.079 1.00 0.00 C ATOM 1997 CG ASN A 139 -11.887 -5.339 -9.995 1.00 0.00 C ATOM 1998 OD1 ASN A 139 -12.885 -4.941 -9.402 1.00 0.00 O ATOM 1999 ND2 ASN A 139 -11.865 -6.517 -10.614 1.00 0.00 N ATOM 0 H ASN A 139 -9.839 -1.560 -9.455 1.00 0.00 H new ATOM 0 HA ASN A 139 -11.494 -2.932 -8.893 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -10.614 -3.952 -11.033 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -9.749 -5.123 -10.057 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -12.692 -7.114 -10.603 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -11.021 -6.822 -11.099 1.00 0.00 H new ATOM 2006 N ALA A 140 -9.726 -3.421 -6.644 1.00 0.00 N ATOM 2007 CA ALA A 140 -9.207 -4.025 -5.438 1.00 0.00 C ATOM 2008 C ALA A 140 -10.345 -4.290 -4.451 1.00 0.00 C ATOM 2009 O ALA A 140 -10.141 -4.903 -3.412 1.00 0.00 O ATOM 2010 CB ALA A 140 -8.091 -3.146 -4.873 1.00 0.00 C ATOM 0 H ALA A 140 -9.583 -2.413 -6.707 1.00 0.00 H new ATOM 0 HA ALA A 140 -8.764 -4.998 -5.652 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -7.697 -3.598 -3.963 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -7.292 -3.055 -5.609 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -8.488 -2.157 -4.644 1.00 0.00 H new ATOM 2016 N GLY A 141 -11.565 -3.849 -4.764 1.00 0.00 N ATOM 2017 CA GLY A 141 -12.693 -4.041 -3.883 1.00 0.00 C ATOM 2018 C GLY A 141 -12.567 -3.126 -2.671 1.00 0.00 C ATOM 2019 O GLY A 141 -11.761 -2.186 -2.647 1.00 0.00 O ATOM 0 H GLY A 141 -11.786 -3.355 -5.629 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -13.621 -3.829 -4.415 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -12.741 -5.081 -3.561 1.00 0.00 H new ATOM 2023 N SER A 142 -13.409 -3.378 -1.670 1.00 0.00 N ATOM 2024 CA SER A 142 -13.483 -2.489 -0.532 1.00 0.00 C ATOM 2025 C SER A 142 -12.255 -2.605 0.358 1.00 0.00 C ATOM 2026 O SER A 142 -11.386 -3.455 0.158 1.00 0.00 O ATOM 2027 CB SER A 142 -14.781 -2.667 0.253 1.00 0.00 C ATOM 2028 OG SER A 142 -15.032 -1.446 0.935 1.00 0.00 O ATOM 0 H SER A 142 -14.037 -4.180 -1.631 1.00 0.00 H new ATOM 0 HA SER A 142 -13.494 -1.472 -0.925 1.00 0.00 H new ATOM 0 HB2 SER A 142 -15.606 -2.909 -0.417 1.00 0.00 H new ATOM 0 HB3 SER A 142 -14.692 -3.491 0.961 1.00 0.00 H new ATOM 0 HG SER A 142 -15.862 -1.524 1.450 1.00 0.00 H new ATOM 2034 N ARG A 143 -12.198 -1.684 1.317 1.00 0.00 N ATOM 2035 CA ARG A 143 -11.069 -1.491 2.197 1.00 0.00 C ATOM 2036 C ARG A 143 -11.256 -2.365 3.430 1.00 0.00 C ATOM 2037 O ARG A 143 -12.218 -2.179 4.167 1.00 0.00 O ATOM 2038 CB ARG A 143 -10.921 -0.014 2.580 1.00 0.00 C ATOM 2039 CG ARG A 143 -11.099 0.929 1.378 1.00 0.00 C ATOM 2040 CD ARG A 143 -12.519 1.514 1.308 1.00 0.00 C ATOM 2041 NE ARG A 143 -13.281 1.093 0.119 1.00 0.00 N ATOM 2042 CZ ARG A 143 -13.146 1.650 -1.095 1.00 0.00 C ATOM 2043 NH1 ARG A 143 -12.145 2.509 -1.319 1.00 0.00 N ATOM 2044 NH2 ARG A 143 -13.998 1.344 -2.079 1.00 0.00 N ATOM 0 H ARG A 143 -12.964 -1.036 1.501 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.151 -1.782 1.686 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.657 0.235 3.345 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -9.937 0.147 3.021 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -10.375 1.741 1.445 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -10.885 0.386 0.457 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -13.068 1.218 2.202 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -12.454 2.602 1.319 1.00 0.00 H new ATOM 0 HE ARG A 143 -13.952 0.332 0.225 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -11.491 2.737 -0.570 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -12.036 2.936 -2.239 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -14.757 0.684 -1.910 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -13.889 1.771 -2.999 1.00 0.00 H new ATOM 2058 N LEU A 144 -10.353 -3.321 3.650 1.00 0.00 N ATOM 2059 CA LEU A 144 -10.409 -4.149 4.856 1.00 0.00 C ATOM 2060 C LEU A 144 -9.874 -3.367 6.057 1.00 0.00 C ATOM 2061 O LEU A 144 -10.295 -3.633 7.180 1.00 0.00 O ATOM 2062 CB LEU A 144 -9.647 -5.475 4.694 1.00 0.00 C ATOM 2063 CG LEU A 144 -10.373 -6.597 3.913 1.00 0.00 C ATOM 2064 CD1 LEU A 144 -11.185 -7.476 4.869 1.00 0.00 C ATOM 2065 CD2 LEU A 144 -11.334 -6.062 2.849 1.00 0.00 C ATOM 0 H LEU A 144 -9.583 -3.540 3.018 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.455 -4.403 5.027 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -8.702 -5.266 4.192 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.404 -5.853 5.687 1.00 0.00 H new ATOM 0 HG LEU A 144 -9.587 -7.168 3.419 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -11.689 -8.260 4.303 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -10.518 -7.929 5.602 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -11.927 -6.865 5.383 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -11.811 -6.897 2.337 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -12.096 -5.445 3.324 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.780 -5.462 2.127 1.00 0.00 H new ATOM 2077 N ALA A 145 -8.938 -2.436 5.844 1.00 0.00 N ATOM 2078 CA ALA A 145 -8.369 -1.628 6.913 1.00 0.00 C ATOM 2079 C ALA A 145 -7.704 -0.381 6.335 1.00 0.00 C ATOM 2080 O ALA A 145 -7.289 -0.381 5.174 1.00 0.00 O ATOM 2081 CB ALA A 145 -7.382 -2.466 7.737 1.00 0.00 C ATOM 0 H ALA A 145 -8.557 -2.226 4.921 1.00 0.00 H new ATOM 0 HA ALA A 145 -9.166 -1.299 7.580 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -6.961 -1.853 8.534 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -7.903 -3.319 8.172 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -6.579 -2.822 7.091 1.00 0.00 H new ATOM 2087 N CYS A 146 -7.612 0.672 7.151 1.00 0.00 N ATOM 2088 CA CYS A 146 -6.997 1.952 6.845 1.00 0.00 C ATOM 2089 C CYS A 146 -6.002 2.256 7.964 1.00 0.00 C ATOM 2090 O CYS A 146 -6.162 1.787 9.085 1.00 0.00 O ATOM 2091 CB CYS A 146 -8.052 3.065 6.724 1.00 0.00 C ATOM 2092 SG CYS A 146 -9.141 3.284 8.157 1.00 0.00 S ATOM 0 H CYS A 146 -7.990 0.645 8.098 1.00 0.00 H new ATOM 0 HA CYS A 146 -6.487 1.906 5.883 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -7.538 4.007 6.536 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -8.670 2.859 5.850 1.00 0.00 H new ATOM 0 HG CYS A 146 -9.977 4.252 7.923 1.00 0.00 H new ATOM 2097 N GLY A 147 -4.934 2.987 7.661 1.00 0.00 N ATOM 2098 CA GLY A 147 -3.926 3.370 8.636 1.00 0.00 C ATOM 2099 C GLY A 147 -3.295 4.694 8.243 1.00 0.00 C ATOM 2100 O GLY A 147 -3.364 5.091 7.082 1.00 0.00 O ATOM 0 H GLY A 147 -4.745 3.333 6.720 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -4.378 3.453 9.624 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -3.159 2.598 8.700 1.00 0.00 H new ATOM 2104 N VAL A 148 -2.684 5.377 9.210 1.00 0.00 N ATOM 2105 CA VAL A 148 -2.120 6.707 9.033 1.00 0.00 C ATOM 2106 C VAL A 148 -0.616 6.608 9.238 1.00 0.00 C ATOM 2107 O VAL A 148 -0.182 6.000 10.217 1.00 0.00 O ATOM 2108 CB VAL A 148 -2.753 7.674 10.045 1.00 0.00 C ATOM 2109 CG1 VAL A 148 -2.334 9.115 9.721 1.00 0.00 C ATOM 2110 CG2 VAL A 148 -4.281 7.536 10.031 1.00 0.00 C ATOM 0 H VAL A 148 -2.567 5.011 10.155 1.00 0.00 H new ATOM 0 HA VAL A 148 -2.327 7.089 8.033 1.00 0.00 H new ATOM 0 HB VAL A 148 -2.399 7.425 11.045 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -2.786 9.796 10.442 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -1.249 9.199 9.774 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -2.670 9.374 8.717 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -4.715 8.227 10.753 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -4.658 7.767 9.035 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -4.557 6.515 10.295 1.00 0.00 H new ATOM 2120 N ILE A 149 0.180 7.166 8.323 1.00 0.00 N ATOM 2121 CA ILE A 149 1.629 7.109 8.449 1.00 0.00 C ATOM 2122 C ILE A 149 2.107 8.246 9.360 1.00 0.00 C ATOM 2123 O ILE A 149 1.778 9.406 9.115 1.00 0.00 O ATOM 2124 CB ILE A 149 2.302 7.147 7.068 1.00 0.00 C ATOM 2125 CG1 ILE A 149 1.840 6.009 6.136 1.00 0.00 C ATOM 2126 CG2 ILE A 149 3.825 7.047 7.272 1.00 0.00 C ATOM 2127 CD1 ILE A 149 1.730 6.453 4.680 1.00 0.00 C ATOM 0 H ILE A 149 -0.156 7.658 7.495 1.00 0.00 H new ATOM 0 HA ILE A 149 1.918 6.163 8.908 1.00 0.00 H new ATOM 0 HB ILE A 149 2.018 8.082 6.586 1.00 0.00 H new ATOM 0 HG12 ILE A 149 2.542 5.178 6.207 1.00 0.00 H new ATOM 0 HG13 ILE A 149 0.872 5.638 6.473 1.00 0.00 H new ATOM 0 HG21 ILE A 149 4.324 7.072 6.303 1.00 0.00 H new ATOM 0 HG22 ILE A 149 4.167 7.886 7.878 1.00 0.00 H new ATOM 0 HG23 ILE A 149 4.064 6.112 7.779 1.00 0.00 H new ATOM 0 HD11 ILE A 149 1.401 5.613 4.067 1.00 0.00 H new ATOM 0 HD12 ILE A 149 1.007 7.265 4.601 1.00 0.00 H new ATOM 0 HD13 ILE A 149 2.703 6.798 4.330 1.00 0.00 H new ATOM 2139 N GLY A 150 2.892 7.926 10.394 1.00 0.00 N ATOM 2140 CA GLY A 150 3.448 8.865 11.356 1.00 0.00 C ATOM 2141 C GLY A 150 4.877 8.446 11.702 1.00 0.00 C ATOM 2142 O GLY A 150 5.370 7.439 11.201 1.00 0.00 O ATOM 0 H GLY A 150 3.165 6.962 10.586 1.00 0.00 H new ATOM 0 HA2 GLY A 150 3.442 9.873 10.942 1.00 0.00 H new ATOM 0 HA3 GLY A 150 2.835 8.887 12.257 1.00 0.00 H new ATOM 2146 N ILE A 151 5.562 9.230 12.534 1.00 0.00 N ATOM 2147 CA ILE A 151 6.897 8.916 13.019 1.00 0.00 C ATOM 2148 C ILE A 151 6.797 7.751 14.001 1.00 0.00 C ATOM 2149 O ILE A 151 5.844 7.657 14.771 1.00 0.00 O ATOM 2150 CB ILE A 151 7.531 10.166 13.656 1.00 0.00 C ATOM 2151 CG1 ILE A 151 7.721 11.297 12.628 1.00 0.00 C ATOM 2152 CG2 ILE A 151 8.862 9.847 14.353 1.00 0.00 C ATOM 2153 CD1 ILE A 151 8.780 11.013 11.554 1.00 0.00 C ATOM 0 H ILE A 151 5.196 10.112 12.892 1.00 0.00 H new ATOM 0 HA ILE A 151 7.546 8.615 12.197 1.00 0.00 H new ATOM 0 HB ILE A 151 6.831 10.512 14.416 1.00 0.00 H new ATOM 0 HG12 ILE A 151 6.767 11.488 12.137 1.00 0.00 H new ATOM 0 HG13 ILE A 151 7.995 12.209 13.158 1.00 0.00 H new ATOM 0 HG21 ILE A 151 9.273 10.758 14.788 1.00 0.00 H new ATOM 0 HG22 ILE A 151 8.693 9.113 15.141 1.00 0.00 H new ATOM 0 HG23 ILE A 151 9.566 9.443 13.626 1.00 0.00 H new ATOM 0 HD11 ILE A 151 8.846 11.863 10.874 1.00 0.00 H new ATOM 0 HD12 ILE A 151 9.747 10.853 12.030 1.00 0.00 H new ATOM 0 HD13 ILE A 151 8.500 10.121 10.994 1.00 0.00 H new ATOM 2165 N ALA A 152 7.776 6.850 13.956 1.00 0.00 N ATOM 2166 CA ALA A 152 7.796 5.650 14.784 1.00 0.00 C ATOM 2167 C ALA A 152 8.467 5.908 16.131 1.00 0.00 C ATOM 2168 O ALA A 152 9.314 5.123 16.556 1.00 0.00 O ATOM 2169 CB ALA A 152 8.496 4.528 14.016 1.00 0.00 C ATOM 0 H ALA A 152 8.583 6.934 13.338 1.00 0.00 H new ATOM 0 HA ALA A 152 6.771 5.350 15.002 1.00 0.00 H new ATOM 0 HB1 ALA A 152 8.516 3.626 14.628 1.00 0.00 H new ATOM 0 HB2 ALA A 152 7.955 4.328 13.091 1.00 0.00 H new ATOM 0 HB3 ALA A 152 9.517 4.830 13.781 1.00 0.00 H new ATOM 2175 N GLN A 153 8.092 6.994 16.805 1.00 0.00 N ATOM 2176 CA GLN A 153 8.605 7.354 18.108 1.00 0.00 C ATOM 2177 C GLN A 153 7.796 8.557 18.587 1.00 0.00 C ATOM 2178 O GLN A 153 7.011 9.064 17.751 1.00 0.00 O ATOM 2179 CB GLN A 153 10.113 7.669 18.034 1.00 0.00 C ATOM 2180 CG GLN A 153 10.891 6.869 19.082 1.00 0.00 C ATOM 2181 CD GLN A 153 12.390 6.901 18.804 1.00 0.00 C ATOM 2182 OE1 GLN A 153 12.965 5.933 18.317 1.00 0.00 O ATOM 2183 NE2 GLN A 153 13.049 8.016 19.105 1.00 0.00 N ATOM 2184 OXT GLN A 153 7.985 8.944 19.760 1.00 0.00 O ATOM 0 H GLN A 153 7.407 7.658 16.444 1.00 0.00 H new ATOM 0 HA GLN A 153 8.502 6.529 18.813 1.00 0.00 H new ATOM 0 HB2 GLN A 153 10.489 7.434 17.038 1.00 0.00 H new ATOM 0 HB3 GLN A 153 10.274 8.735 18.192 1.00 0.00 H new ATOM 0 HG2 GLN A 153 10.694 7.277 20.074 1.00 0.00 H new ATOM 0 HG3 GLN A 153 10.542 5.836 19.087 1.00 0.00 H new ATOM 0 HE21 GLN A 153 12.551 8.809 19.509 1.00 0.00 H new ATOM 0 HE22 GLN A 153 14.052 8.078 18.932 1.00 0.00 H new