USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 774 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 29 GLN : amide:sc= 0 K(o=-0.049,f=-1.3) USER MOD Set 1.2: A 61 LYS NZ :NH3+ -153:sc= -0.0493 (180deg=-0.928) USER MOD Set 2.1: A 30 CYS SG : rot 128:sc= -0.827 USER MOD Set 2.2: A 79 CYS SG : rot 112:sc= 1.91 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -14:sc= 0.0607 USER MOD Single : A 3 SER OG : rot 67:sc= 0.215 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= 0.627 K(o=0.63,f=-3.5!) USER MOD Single : A 18 GLN : amide:sc= -1.88! C(o=-1.9!,f=-5.4!) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 ASN :FLIP amide:sc= 0.142 F(o=-2.5,f=0.14) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot -56:sc= 0.0676 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN :FLIP amide:sc= -0.715 F(o=-2.1!,f=-0.72) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 CYS SG : rot 114:sc= -0.233 USER MOD Single : A 65 GLN : amide:sc= 0.699 K(o=0.7,f=-0.43) USER MOD Single : A 71 MET CE :methyl -146:sc= -1.31 (180deg=-3.17!) USER MOD Single : A 74 THR OG1 : rot 102:sc= -0.547 USER MOD Single : A 77 TYR OH : rot 180:sc= -0.13 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 81 CYS SG : rot -103:sc= -0.443 USER MOD Single : A 83 GLN : amide:sc= -0.0141 K(o=-0.014,f=-0.62) USER MOD Single : A 86 THR OG1 : rot -131:sc= -0.512 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl -170:sc= 0 (180deg=-0.115) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 THR OG1 : rot -24:sc= 0.512 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.193 25.001 14.039 1.00 0.00 N ATOM 2 CA GLY A 1 -15.253 25.978 13.876 1.00 0.00 C ATOM 3 C GLY A 1 -15.051 26.853 12.655 1.00 0.00 C ATOM 4 O GLY A 1 -14.579 27.985 12.764 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.377 24.428 14.887 1.00 0.00 H new ATOM 0 H2 GLY A 1 -14.159 24.383 13.204 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.282 25.491 14.143 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -16.210 25.462 13.795 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -15.304 26.606 14.765 1.00 0.00 H new ATOM 8 N SER A 2 -15.408 26.328 11.487 1.00 0.00 N ATOM 9 CA SER A 2 -15.259 27.067 10.239 1.00 0.00 C ATOM 10 C SER A 2 -14.009 27.942 10.272 1.00 0.00 C ATOM 11 O SER A 2 -14.030 29.090 9.828 1.00 0.00 O ATOM 12 CB SER A 2 -16.494 27.932 9.982 1.00 0.00 C ATOM 13 OG SER A 2 -16.581 28.988 10.923 1.00 0.00 O ATOM 0 H SER A 2 -15.802 25.394 11.379 1.00 0.00 H new ATOM 0 HA SER A 2 -15.156 26.345 9.429 1.00 0.00 H new ATOM 0 HB2 SER A 2 -16.451 28.342 8.973 1.00 0.00 H new ATOM 0 HB3 SER A 2 -17.392 27.316 10.038 1.00 0.00 H new ATOM 0 HG SER A 2 -15.964 28.817 11.665 1.00 0.00 H new ATOM 19 N SER A 3 -12.922 27.390 10.801 1.00 0.00 N ATOM 20 CA SER A 3 -11.663 28.120 10.896 1.00 0.00 C ATOM 21 C SER A 3 -10.560 27.405 10.121 1.00 0.00 C ATOM 22 O SER A 3 -9.426 27.304 10.586 1.00 0.00 O ATOM 23 CB SER A 3 -11.252 28.281 12.361 1.00 0.00 C ATOM 24 OG SER A 3 -11.886 29.404 12.948 1.00 0.00 O ATOM 0 H SER A 3 -12.888 26.440 11.170 1.00 0.00 H new ATOM 0 HA SER A 3 -11.809 29.107 10.457 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.513 27.380 12.916 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.170 28.394 12.428 1.00 0.00 H new ATOM 0 HG SER A 3 -12.850 29.240 13.011 1.00 0.00 H new ATOM 30 N GLY A 4 -10.904 26.910 8.936 1.00 0.00 N ATOM 31 CA GLY A 4 -9.933 26.210 8.115 1.00 0.00 C ATOM 32 C GLY A 4 -10.532 25.015 7.401 1.00 0.00 C ATOM 33 O GLY A 4 -10.957 25.120 6.250 1.00 0.00 O ATOM 0 H GLY A 4 -11.837 26.981 8.530 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.520 26.900 7.379 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.105 25.878 8.741 1.00 0.00 H new ATOM 37 N SER A 5 -10.565 23.875 8.083 1.00 0.00 N ATOM 38 CA SER A 5 -11.112 22.653 7.504 1.00 0.00 C ATOM 39 C SER A 5 -12.626 22.754 7.351 1.00 0.00 C ATOM 40 O SER A 5 -13.363 22.729 8.337 1.00 0.00 O ATOM 41 CB SER A 5 -10.755 21.447 8.374 1.00 0.00 C ATOM 42 OG SER A 5 -9.351 21.265 8.444 1.00 0.00 O ATOM 0 H SER A 5 -10.220 23.772 9.037 1.00 0.00 H new ATOM 0 HA SER A 5 -10.673 22.521 6.515 1.00 0.00 H new ATOM 0 HB2 SER A 5 -11.157 21.587 9.377 1.00 0.00 H new ATOM 0 HB3 SER A 5 -11.221 20.550 7.966 1.00 0.00 H new ATOM 0 HG SER A 5 -9.149 20.489 9.007 1.00 0.00 H new ATOM 48 N SER A 6 -13.083 22.869 6.109 1.00 0.00 N ATOM 49 CA SER A 6 -14.510 22.978 5.826 1.00 0.00 C ATOM 50 C SER A 6 -15.215 21.648 6.070 1.00 0.00 C ATOM 51 O SER A 6 -15.338 20.823 5.166 1.00 0.00 O ATOM 52 CB SER A 6 -14.732 23.429 4.381 1.00 0.00 C ATOM 53 OG SER A 6 -14.613 24.836 4.261 1.00 0.00 O ATOM 0 H SER A 6 -12.486 22.889 5.282 1.00 0.00 H new ATOM 0 HA SER A 6 -14.933 23.723 6.500 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.006 22.943 3.730 1.00 0.00 H new ATOM 0 HB3 SER A 6 -15.721 23.115 4.047 1.00 0.00 H new ATOM 0 HG SER A 6 -14.758 25.098 3.328 1.00 0.00 H new ATOM 59 N GLY A 7 -15.678 21.447 7.300 1.00 0.00 N ATOM 60 CA GLY A 7 -16.365 20.216 7.643 1.00 0.00 C ATOM 61 C GLY A 7 -15.626 18.985 7.158 1.00 0.00 C ATOM 62 O GLY A 7 -14.395 18.944 7.131 1.00 0.00 O ATOM 0 H GLY A 7 -15.589 22.115 8.065 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -16.486 20.161 8.725 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -17.365 20.229 7.211 1.00 0.00 H new ATOM 66 N PRO A 8 -16.384 17.951 6.766 1.00 0.00 N ATOM 67 CA PRO A 8 -15.814 16.693 6.274 1.00 0.00 C ATOM 68 C PRO A 8 -15.151 16.851 4.909 1.00 0.00 C ATOM 69 O PRO A 8 -15.440 17.795 4.174 1.00 0.00 O ATOM 70 CB PRO A 8 -17.029 15.768 6.173 1.00 0.00 C ATOM 71 CG PRO A 8 -18.190 16.685 5.996 1.00 0.00 C ATOM 72 CD PRO A 8 -17.856 17.929 6.771 1.00 0.00 C ATOM 0 HA PRO A 8 -15.029 16.318 6.930 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -16.935 15.081 5.332 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -17.139 15.159 7.070 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -18.350 16.913 4.942 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -19.108 16.229 6.367 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -18.272 18.819 6.300 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -18.254 17.889 7.785 1.00 0.00 H new ATOM 80 N ALA A 9 -14.262 15.921 4.577 1.00 0.00 N ATOM 81 CA ALA A 9 -13.560 15.957 3.300 1.00 0.00 C ATOM 82 C ALA A 9 -14.132 14.928 2.331 1.00 0.00 C ATOM 83 O ALA A 9 -14.677 13.905 2.747 1.00 0.00 O ATOM 84 CB ALA A 9 -12.072 15.719 3.509 1.00 0.00 C ATOM 0 H ALA A 9 -14.011 15.133 5.175 1.00 0.00 H new ATOM 0 HA ALA A 9 -13.700 16.946 2.863 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -11.560 15.749 2.547 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -11.667 16.494 4.159 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -11.921 14.743 3.971 1.00 0.00 H new ATOM 90 N ARG A 10 -14.003 15.205 1.037 1.00 0.00 N ATOM 91 CA ARG A 10 -14.509 14.303 0.009 1.00 0.00 C ATOM 92 C ARG A 10 -13.430 13.998 -1.025 1.00 0.00 C ATOM 93 O ARG A 10 -12.753 14.901 -1.517 1.00 0.00 O ATOM 94 CB ARG A 10 -15.732 14.914 -0.678 1.00 0.00 C ATOM 95 CG ARG A 10 -15.479 16.300 -1.250 1.00 0.00 C ATOM 96 CD ARG A 10 -16.433 16.613 -2.393 1.00 0.00 C ATOM 97 NE ARG A 10 -17.661 17.249 -1.922 1.00 0.00 N ATOM 98 CZ ARG A 10 -18.799 17.246 -2.606 1.00 0.00 C ATOM 99 NH1 ARG A 10 -18.866 16.643 -3.785 1.00 0.00 N ATOM 100 NH2 ARG A 10 -19.874 17.847 -2.111 1.00 0.00 N ATOM 0 H ARG A 10 -13.553 16.046 0.676 1.00 0.00 H new ATOM 0 HA ARG A 10 -14.800 13.369 0.491 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -16.056 14.252 -1.481 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -16.551 14.970 0.039 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -15.594 17.046 -0.464 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -14.450 16.367 -1.604 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -15.938 17.268 -3.110 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -16.681 15.692 -2.921 1.00 0.00 H new ATOM 0 HE ARG A 10 -17.643 17.721 -1.018 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -18.042 16.180 -4.169 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -19.741 16.642 -4.308 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -19.826 18.312 -1.204 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -20.748 17.844 -2.637 1.00 0.00 H new ATOM 114 N PHE A 11 -13.274 12.719 -1.351 1.00 0.00 N ATOM 115 CA PHE A 11 -12.276 12.294 -2.325 1.00 0.00 C ATOM 116 C PHE A 11 -12.599 12.847 -3.711 1.00 0.00 C ATOM 117 O PHE A 11 -13.449 12.310 -4.422 1.00 0.00 O ATOM 118 CB PHE A 11 -12.202 10.767 -2.378 1.00 0.00 C ATOM 119 CG PHE A 11 -11.633 10.151 -1.131 1.00 0.00 C ATOM 120 CD1 PHE A 11 -10.267 9.967 -0.995 1.00 0.00 C ATOM 121 CD2 PHE A 11 -12.465 9.758 -0.095 1.00 0.00 C ATOM 122 CE1 PHE A 11 -9.741 9.400 0.151 1.00 0.00 C ATOM 123 CE2 PHE A 11 -11.945 9.191 1.053 1.00 0.00 C ATOM 124 CZ PHE A 11 -10.581 9.013 1.176 1.00 0.00 C ATOM 0 H PHE A 11 -13.826 11.959 -0.955 1.00 0.00 H new ATOM 0 HA PHE A 11 -11.309 12.687 -2.012 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -13.202 10.368 -2.547 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -11.592 10.470 -3.231 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -9.605 10.270 -1.793 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -13.532 9.896 -0.186 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -8.674 9.260 0.244 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -12.604 8.888 1.853 1.00 0.00 H new ATOM 0 HZ PHE A 11 -10.172 8.572 2.073 1.00 0.00 H new ATOM 134 N ILE A 12 -11.916 13.923 -4.086 1.00 0.00 N ATOM 135 CA ILE A 12 -12.129 14.548 -5.385 1.00 0.00 C ATOM 136 C ILE A 12 -11.672 13.634 -6.517 1.00 0.00 C ATOM 137 O ILE A 12 -12.253 13.635 -7.601 1.00 0.00 O ATOM 138 CB ILE A 12 -11.384 15.891 -5.493 1.00 0.00 C ATOM 139 CG1 ILE A 12 -9.875 15.674 -5.360 1.00 0.00 C ATOM 140 CG2 ILE A 12 -11.880 16.859 -4.429 1.00 0.00 C ATOM 141 CD1 ILE A 12 -9.054 16.883 -5.752 1.00 0.00 C ATOM 0 H ILE A 12 -11.210 14.380 -3.508 1.00 0.00 H new ATOM 0 HA ILE A 12 -13.200 14.728 -5.476 1.00 0.00 H new ATOM 0 HB ILE A 12 -11.586 16.323 -6.473 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -9.644 15.407 -4.329 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -9.581 14.828 -5.982 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -11.344 17.804 -4.518 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -12.947 17.033 -4.565 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -11.705 16.434 -3.441 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -7.994 16.657 -5.633 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -9.256 17.138 -6.792 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -9.319 17.726 -5.114 1.00 0.00 H new ATOM 153 N GLU A 13 -10.628 12.853 -6.254 1.00 0.00 N ATOM 154 CA GLU A 13 -10.094 11.933 -7.251 1.00 0.00 C ATOM 155 C GLU A 13 -10.019 10.513 -6.697 1.00 0.00 C ATOM 156 O GLU A 13 -9.366 10.265 -5.683 1.00 0.00 O ATOM 157 CB GLU A 13 -8.705 12.388 -7.706 1.00 0.00 C ATOM 158 CG GLU A 13 -8.738 13.420 -8.821 1.00 0.00 C ATOM 159 CD GLU A 13 -9.762 13.092 -9.890 1.00 0.00 C ATOM 160 OE1 GLU A 13 -9.448 12.279 -10.783 1.00 0.00 O ATOM 161 OE2 GLU A 13 -10.879 13.650 -9.832 1.00 0.00 O ATOM 0 H GLU A 13 -10.136 12.839 -5.360 1.00 0.00 H new ATOM 0 HA GLU A 13 -10.768 11.936 -8.107 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -8.171 12.805 -6.852 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -8.139 11.519 -8.043 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -8.961 14.399 -8.398 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -7.751 13.488 -9.278 1.00 0.00 H new ATOM 168 N ASP A 14 -10.693 9.586 -7.368 1.00 0.00 N ATOM 169 CA ASP A 14 -10.703 8.191 -6.944 1.00 0.00 C ATOM 170 C ASP A 14 -9.486 7.449 -7.486 1.00 0.00 C ATOM 171 O ASP A 14 -9.111 7.614 -8.648 1.00 0.00 O ATOM 172 CB ASP A 14 -11.986 7.503 -7.412 1.00 0.00 C ATOM 173 CG ASP A 14 -13.203 8.399 -7.287 1.00 0.00 C ATOM 174 OD1 ASP A 14 -13.510 8.828 -6.156 1.00 0.00 O ATOM 175 OD2 ASP A 14 -13.847 8.672 -8.322 1.00 0.00 O ATOM 0 H ASP A 14 -11.240 9.775 -8.208 1.00 0.00 H new ATOM 0 HA ASP A 14 -10.664 8.168 -5.855 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -11.871 7.194 -8.451 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -12.144 6.597 -6.826 1.00 0.00 H new ATOM 180 N VAL A 15 -8.871 6.631 -6.638 1.00 0.00 N ATOM 181 CA VAL A 15 -7.696 5.863 -7.032 1.00 0.00 C ATOM 182 C VAL A 15 -8.002 4.961 -8.222 1.00 0.00 C ATOM 183 O VAL A 15 -9.154 4.600 -8.461 1.00 0.00 O ATOM 184 CB VAL A 15 -7.173 5.000 -5.868 1.00 0.00 C ATOM 185 CG1 VAL A 15 -6.956 5.852 -4.627 1.00 0.00 C ATOM 186 CG2 VAL A 15 -8.135 3.857 -5.580 1.00 0.00 C ATOM 0 H VAL A 15 -9.167 6.483 -5.673 1.00 0.00 H new ATOM 0 HA VAL A 15 -6.928 6.583 -7.314 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.213 4.573 -6.157 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -6.587 5.225 -3.815 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -6.226 6.632 -4.844 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.900 6.310 -4.331 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -7.751 3.257 -4.755 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -9.111 4.262 -5.311 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -8.234 3.232 -6.468 1.00 0.00 H new ATOM 196 N LYS A 16 -6.963 4.600 -8.967 1.00 0.00 N ATOM 197 CA LYS A 16 -7.119 3.738 -10.132 1.00 0.00 C ATOM 198 C LYS A 16 -6.816 2.285 -9.779 1.00 0.00 C ATOM 199 O LYS A 16 -5.974 2.006 -8.926 1.00 0.00 O ATOM 200 CB LYS A 16 -6.196 4.201 -11.262 1.00 0.00 C ATOM 201 CG LYS A 16 -6.248 5.698 -11.514 1.00 0.00 C ATOM 202 CD LYS A 16 -7.644 6.149 -11.912 1.00 0.00 C ATOM 203 CE LYS A 16 -7.643 7.583 -12.419 1.00 0.00 C ATOM 204 NZ LYS A 16 -7.325 7.658 -13.872 1.00 0.00 N ATOM 0 H LYS A 16 -6.003 4.892 -8.784 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.155 3.805 -10.465 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -5.171 3.917 -11.023 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -6.466 3.677 -12.179 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -5.935 6.230 -10.616 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -5.542 5.960 -12.302 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -8.034 5.488 -12.686 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -8.313 6.065 -11.055 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -8.619 8.033 -12.237 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -6.913 8.166 -11.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -7.334 8.652 -14.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -6.383 7.252 -14.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -8.035 7.123 -14.411 1.00 0.00 H new ATOM 218 N ASN A 17 -7.508 1.363 -10.441 1.00 0.00 N ATOM 219 CA ASN A 17 -7.313 -0.061 -10.197 1.00 0.00 C ATOM 220 C ASN A 17 -5.848 -0.365 -9.896 1.00 0.00 C ATOM 221 O ASN A 17 -4.949 0.309 -10.398 1.00 0.00 O ATOM 222 CB ASN A 17 -7.777 -0.875 -11.406 1.00 0.00 C ATOM 223 CG ASN A 17 -8.973 -0.252 -12.099 1.00 0.00 C ATOM 224 OD1 ASN A 17 -8.879 0.839 -12.662 1.00 0.00 O ATOM 225 ND2 ASN A 17 -10.106 -0.943 -12.059 1.00 0.00 N ATOM 0 H ASN A 17 -8.209 1.577 -11.151 1.00 0.00 H new ATOM 0 HA ASN A 17 -7.910 -0.341 -9.329 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -6.955 -0.965 -12.117 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -8.032 -1.885 -11.084 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -10.945 -0.573 -12.506 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -10.138 -1.843 -11.581 1.00 0.00 H new ATOM 232 N GLN A 18 -5.618 -1.385 -9.076 1.00 0.00 N ATOM 233 CA GLN A 18 -4.262 -1.779 -8.709 1.00 0.00 C ATOM 234 C GLN A 18 -3.908 -3.135 -9.308 1.00 0.00 C ATOM 235 O GLN A 18 -4.532 -4.147 -8.990 1.00 0.00 O ATOM 236 CB GLN A 18 -4.117 -1.827 -7.187 1.00 0.00 C ATOM 237 CG GLN A 18 -2.683 -1.676 -6.707 1.00 0.00 C ATOM 238 CD GLN A 18 -2.012 -0.432 -7.257 1.00 0.00 C ATOM 239 OE1 GLN A 18 -0.815 -0.435 -7.545 1.00 0.00 O ATOM 240 NE2 GLN A 18 -2.781 0.640 -7.406 1.00 0.00 N ATOM 0 H GLN A 18 -6.352 -1.953 -8.653 1.00 0.00 H new ATOM 0 HA GLN A 18 -3.574 -1.035 -9.110 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -4.724 -1.035 -6.748 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -4.516 -2.774 -6.822 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -2.670 -1.640 -5.618 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -2.110 -2.555 -7.003 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -3.769 0.598 -7.155 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -2.384 1.505 -7.772 1.00 0.00 H new ATOM 249 N GLU A 19 -2.903 -3.148 -10.179 1.00 0.00 N ATOM 250 CA GLU A 19 -2.467 -4.381 -10.823 1.00 0.00 C ATOM 251 C GLU A 19 -0.966 -4.588 -10.644 1.00 0.00 C ATOM 252 O GLU A 19 -0.176 -3.662 -10.820 1.00 0.00 O ATOM 253 CB GLU A 19 -2.815 -4.354 -12.313 1.00 0.00 C ATOM 254 CG GLU A 19 -2.124 -5.441 -13.119 1.00 0.00 C ATOM 255 CD GLU A 19 -0.777 -5.001 -13.658 1.00 0.00 C ATOM 256 OE1 GLU A 19 -0.751 -4.318 -14.704 1.00 0.00 O ATOM 257 OE2 GLU A 19 0.251 -5.339 -13.036 1.00 0.00 O ATOM 0 H GLU A 19 -2.376 -2.319 -10.454 1.00 0.00 H new ATOM 0 HA GLU A 19 -2.989 -5.212 -10.349 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -3.894 -4.459 -12.427 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -2.544 -3.381 -12.723 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -1.990 -6.323 -12.492 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -2.765 -5.735 -13.950 1.00 0.00 H new ATOM 264 N ALA A 20 -0.582 -5.810 -10.290 1.00 0.00 N ATOM 265 CA ALA A 20 0.824 -6.140 -10.088 1.00 0.00 C ATOM 266 C ALA A 20 1.005 -7.631 -9.823 1.00 0.00 C ATOM 267 O ALA A 20 0.112 -8.289 -9.289 1.00 0.00 O ATOM 268 CB ALA A 20 1.397 -5.324 -8.938 1.00 0.00 C ATOM 0 H ALA A 20 -1.224 -6.588 -10.137 1.00 0.00 H new ATOM 0 HA ALA A 20 1.365 -5.892 -11.001 1.00 0.00 H new ATOM 0 HB1 ALA A 20 2.447 -5.580 -8.798 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.310 -4.262 -9.167 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.845 -5.545 -8.025 1.00 0.00 H new ATOM 274 N ARG A 21 2.166 -8.157 -10.200 1.00 0.00 N ATOM 275 CA ARG A 21 2.463 -9.571 -10.004 1.00 0.00 C ATOM 276 C ARG A 21 2.695 -9.879 -8.528 1.00 0.00 C ATOM 277 O ARG A 21 2.745 -8.974 -7.696 1.00 0.00 O ATOM 278 CB ARG A 21 3.693 -9.973 -10.820 1.00 0.00 C ATOM 279 CG ARG A 21 3.461 -9.956 -12.322 1.00 0.00 C ATOM 280 CD ARG A 21 4.317 -10.993 -13.030 1.00 0.00 C ATOM 281 NE ARG A 21 5.609 -10.449 -13.440 1.00 0.00 N ATOM 282 CZ ARG A 21 6.411 -11.041 -14.318 1.00 0.00 C ATOM 283 NH1 ARG A 21 6.055 -12.190 -14.876 1.00 0.00 N ATOM 284 NH2 ARG A 21 7.571 -10.484 -14.640 1.00 0.00 N ATOM 0 H ARG A 21 2.916 -7.626 -10.643 1.00 0.00 H new ATOM 0 HA ARG A 21 1.604 -10.148 -10.346 1.00 0.00 H new ATOM 0 HB2 ARG A 21 4.514 -9.297 -10.580 1.00 0.00 H new ATOM 0 HB3 ARG A 21 4.006 -10.973 -10.521 1.00 0.00 H new ATOM 0 HG2 ARG A 21 2.408 -10.148 -12.531 1.00 0.00 H new ATOM 0 HG3 ARG A 21 3.689 -8.965 -12.715 1.00 0.00 H new ATOM 0 HD2 ARG A 21 4.476 -11.845 -12.369 1.00 0.00 H new ATOM 0 HD3 ARG A 21 3.786 -11.365 -13.906 1.00 0.00 H new ATOM 0 HE ARG A 21 5.912 -9.566 -13.030 1.00 0.00 H new ATOM 0 HH11 ARG A 21 5.164 -12.621 -14.631 1.00 0.00 H new ATOM 0 HH12 ARG A 21 6.673 -12.643 -15.550 1.00 0.00 H new ATOM 0 HH21 ARG A 21 7.848 -9.600 -14.213 1.00 0.00 H new ATOM 0 HH22 ARG A 21 8.186 -10.940 -15.314 1.00 0.00 H new ATOM 298 N GLU A 22 2.835 -11.162 -8.211 1.00 0.00 N ATOM 299 CA GLU A 22 3.060 -11.589 -6.835 1.00 0.00 C ATOM 300 C GLU A 22 4.425 -11.123 -6.338 1.00 0.00 C ATOM 301 O GLU A 22 5.315 -10.816 -7.130 1.00 0.00 O ATOM 302 CB GLU A 22 2.958 -13.112 -6.726 1.00 0.00 C ATOM 303 CG GLU A 22 1.561 -13.605 -6.386 1.00 0.00 C ATOM 304 CD GLU A 22 1.537 -15.074 -6.012 1.00 0.00 C ATOM 305 OE1 GLU A 22 1.606 -15.921 -6.927 1.00 0.00 O ATOM 306 OE2 GLU A 22 1.449 -15.377 -4.803 1.00 0.00 O ATOM 0 H GLU A 22 2.797 -11.924 -8.888 1.00 0.00 H new ATOM 0 HA GLU A 22 2.290 -11.136 -6.211 1.00 0.00 H new ATOM 0 HB2 GLU A 22 3.272 -13.557 -7.670 1.00 0.00 H new ATOM 0 HB3 GLU A 22 3.653 -13.461 -5.962 1.00 0.00 H new ATOM 0 HG2 GLU A 22 1.163 -13.017 -5.559 1.00 0.00 H new ATOM 0 HG3 GLU A 22 0.904 -13.440 -7.240 1.00 0.00 H new ATOM 313 N GLY A 23 4.583 -11.072 -5.018 1.00 0.00 N ATOM 314 CA GLY A 23 5.841 -10.642 -4.437 1.00 0.00 C ATOM 315 C GLY A 23 6.197 -9.218 -4.813 1.00 0.00 C ATOM 316 O GLY A 23 7.346 -8.800 -4.672 1.00 0.00 O ATOM 0 H GLY A 23 3.862 -11.321 -4.341 1.00 0.00 H new ATOM 0 HA2 GLY A 23 5.783 -10.724 -3.352 1.00 0.00 H new ATOM 0 HA3 GLY A 23 6.637 -11.311 -4.765 1.00 0.00 H new ATOM 320 N ALA A 24 5.209 -8.471 -5.296 1.00 0.00 N ATOM 321 CA ALA A 24 5.424 -7.085 -5.693 1.00 0.00 C ATOM 322 C ALA A 24 4.880 -6.122 -4.643 1.00 0.00 C ATOM 323 O ALA A 24 4.425 -6.540 -3.578 1.00 0.00 O ATOM 324 CB ALA A 24 4.776 -6.817 -7.044 1.00 0.00 C ATOM 0 H ALA A 24 4.253 -8.803 -5.422 1.00 0.00 H new ATOM 0 HA ALA A 24 6.498 -6.919 -5.778 1.00 0.00 H new ATOM 0 HB1 ALA A 24 4.944 -5.778 -7.329 1.00 0.00 H new ATOM 0 HB2 ALA A 24 5.215 -7.474 -7.795 1.00 0.00 H new ATOM 0 HB3 ALA A 24 3.705 -7.006 -6.978 1.00 0.00 H new ATOM 330 N THR A 25 4.932 -4.829 -4.949 1.00 0.00 N ATOM 331 CA THR A 25 4.447 -3.806 -4.031 1.00 0.00 C ATOM 332 C THR A 25 3.424 -2.900 -4.708 1.00 0.00 C ATOM 333 O THR A 25 3.776 -2.066 -5.542 1.00 0.00 O ATOM 334 CB THR A 25 5.602 -2.943 -3.490 1.00 0.00 C ATOM 335 OG1 THR A 25 6.618 -3.781 -2.929 1.00 0.00 O ATOM 336 CG2 THR A 25 5.101 -1.968 -2.436 1.00 0.00 C ATOM 0 H THR A 25 5.305 -4.466 -5.826 1.00 0.00 H new ATOM 0 HA THR A 25 3.973 -4.327 -3.199 1.00 0.00 H new ATOM 0 HB THR A 25 6.020 -2.373 -4.319 1.00 0.00 H new ATOM 0 HG1 THR A 25 7.350 -3.225 -2.589 1.00 0.00 H new ATOM 0 HG21 THR A 25 5.935 -1.369 -2.069 1.00 0.00 H new ATOM 0 HG22 THR A 25 4.349 -1.312 -2.875 1.00 0.00 H new ATOM 0 HG23 THR A 25 4.660 -2.523 -1.608 1.00 0.00 H new ATOM 344 N ALA A 26 2.158 -3.069 -4.344 1.00 0.00 N ATOM 345 CA ALA A 26 1.085 -2.264 -4.914 1.00 0.00 C ATOM 346 C ALA A 26 1.159 -0.823 -4.423 1.00 0.00 C ATOM 347 O ALA A 26 1.756 -0.540 -3.384 1.00 0.00 O ATOM 348 CB ALA A 26 -0.269 -2.871 -4.572 1.00 0.00 C ATOM 0 H ALA A 26 1.850 -3.757 -3.657 1.00 0.00 H new ATOM 0 HA ALA A 26 1.206 -2.258 -5.997 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -1.061 -2.260 -5.004 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -0.328 -3.881 -4.978 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -0.388 -2.907 -3.489 1.00 0.00 H new ATOM 354 N VAL A 27 0.552 0.087 -5.178 1.00 0.00 N ATOM 355 CA VAL A 27 0.549 1.500 -4.820 1.00 0.00 C ATOM 356 C VAL A 27 -0.799 2.142 -5.125 1.00 0.00 C ATOM 357 O VAL A 27 -1.215 2.220 -6.282 1.00 0.00 O ATOM 358 CB VAL A 27 1.653 2.271 -5.567 1.00 0.00 C ATOM 359 CG1 VAL A 27 1.767 3.691 -5.035 1.00 0.00 C ATOM 360 CG2 VAL A 27 2.983 1.541 -5.452 1.00 0.00 C ATOM 0 H VAL A 27 0.056 -0.130 -6.042 1.00 0.00 H new ATOM 0 HA VAL A 27 0.740 1.555 -3.748 1.00 0.00 H new ATOM 0 HB VAL A 27 1.384 2.325 -6.622 1.00 0.00 H new ATOM 0 HG11 VAL A 27 2.552 4.220 -5.575 1.00 0.00 H new ATOM 0 HG12 VAL A 27 0.818 4.209 -5.175 1.00 0.00 H new ATOM 0 HG13 VAL A 27 2.012 3.663 -3.973 1.00 0.00 H new ATOM 0 HG21 VAL A 27 3.752 2.100 -5.986 1.00 0.00 H new ATOM 0 HG22 VAL A 27 3.261 1.454 -4.402 1.00 0.00 H new ATOM 0 HG23 VAL A 27 2.890 0.546 -5.886 1.00 0.00 H new ATOM 370 N LEU A 28 -1.479 2.603 -4.081 1.00 0.00 N ATOM 371 CA LEU A 28 -2.782 3.240 -4.236 1.00 0.00 C ATOM 372 C LEU A 28 -2.725 4.706 -3.818 1.00 0.00 C ATOM 373 O LEU A 28 -2.602 5.018 -2.634 1.00 0.00 O ATOM 374 CB LEU A 28 -3.835 2.502 -3.408 1.00 0.00 C ATOM 375 CG LEU A 28 -4.307 1.158 -3.965 1.00 0.00 C ATOM 376 CD1 LEU A 28 -4.707 0.222 -2.836 1.00 0.00 C ATOM 377 CD2 LEU A 28 -5.467 1.359 -4.930 1.00 0.00 C ATOM 0 H LEU A 28 -1.149 2.547 -3.117 1.00 0.00 H new ATOM 0 HA LEU A 28 -3.059 3.192 -5.289 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.432 2.337 -2.409 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -4.703 3.152 -3.298 1.00 0.00 H new ATOM 0 HG LEU A 28 -3.481 0.702 -4.510 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.040 -0.729 -3.252 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -3.851 0.052 -2.183 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -5.518 0.670 -2.262 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -5.790 0.393 -5.317 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -6.296 1.837 -4.408 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.146 1.992 -5.757 1.00 0.00 H new ATOM 389 N GLN A 29 -2.818 5.599 -4.797 1.00 0.00 N ATOM 390 CA GLN A 29 -2.778 7.032 -4.529 1.00 0.00 C ATOM 391 C GLN A 29 -4.145 7.667 -4.762 1.00 0.00 C ATOM 392 O GLN A 29 -4.892 7.249 -5.647 1.00 0.00 O ATOM 393 CB GLN A 29 -1.731 7.709 -5.415 1.00 0.00 C ATOM 394 CG GLN A 29 -0.300 7.352 -5.046 1.00 0.00 C ATOM 395 CD GLN A 29 0.719 8.027 -5.943 1.00 0.00 C ATOM 396 OE1 GLN A 29 0.742 9.252 -6.064 1.00 0.00 O ATOM 397 NE2 GLN A 29 1.570 7.229 -6.578 1.00 0.00 N ATOM 0 H GLN A 29 -2.921 5.356 -5.782 1.00 0.00 H new ATOM 0 HA GLN A 29 -2.505 7.173 -3.483 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -1.910 7.430 -6.453 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -1.856 8.790 -5.349 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -0.113 7.638 -4.011 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -0.172 6.271 -5.106 1.00 0.00 H new ATOM 0 HE21 GLN A 29 1.515 6.219 -6.449 1.00 0.00 H new ATOM 0 HE22 GLN A 29 2.278 7.626 -7.195 1.00 0.00 H new ATOM 406 N CYS A 30 -4.466 8.678 -3.962 1.00 0.00 N ATOM 407 CA CYS A 30 -5.745 9.370 -4.079 1.00 0.00 C ATOM 408 C CYS A 30 -5.587 10.857 -3.778 1.00 0.00 C ATOM 409 O CYS A 30 -4.482 11.336 -3.529 1.00 0.00 O ATOM 410 CB CYS A 30 -6.773 8.751 -3.132 1.00 0.00 C ATOM 411 SG CYS A 30 -6.687 9.377 -1.438 1.00 0.00 S ATOM 0 H CYS A 30 -3.858 9.037 -3.225 1.00 0.00 H new ATOM 0 HA CYS A 30 -6.097 9.261 -5.105 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -7.772 8.936 -3.526 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -6.632 7.670 -3.116 1.00 0.00 H new ATOM 0 HG CYS A 30 -7.866 9.775 -1.062 1.00 0.00 H new ATOM 417 N GLU A 31 -6.702 11.582 -3.803 1.00 0.00 N ATOM 418 CA GLU A 31 -6.686 13.015 -3.535 1.00 0.00 C ATOM 419 C GLU A 31 -7.934 13.438 -2.765 1.00 0.00 C ATOM 420 O GLU A 31 -8.950 12.742 -2.776 1.00 0.00 O ATOM 421 CB GLU A 31 -6.590 13.801 -4.844 1.00 0.00 C ATOM 422 CG GLU A 31 -5.966 15.177 -4.684 1.00 0.00 C ATOM 423 CD GLU A 31 -5.468 15.748 -5.997 1.00 0.00 C ATOM 424 OE1 GLU A 31 -6.075 15.445 -7.045 1.00 0.00 O ATOM 425 OE2 GLU A 31 -4.470 16.499 -5.977 1.00 0.00 O ATOM 0 H GLU A 31 -7.626 11.201 -4.006 1.00 0.00 H new ATOM 0 HA GLU A 31 -5.811 13.234 -2.924 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -6.003 13.226 -5.561 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -7.589 13.911 -5.266 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -6.700 15.857 -4.252 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -5.136 15.116 -3.981 1.00 0.00 H new ATOM 432 N LEU A 32 -7.850 14.583 -2.096 1.00 0.00 N ATOM 433 CA LEU A 32 -8.972 15.100 -1.320 1.00 0.00 C ATOM 434 C LEU A 32 -9.232 16.566 -1.649 1.00 0.00 C ATOM 435 O LEU A 32 -8.334 17.282 -2.089 1.00 0.00 O ATOM 436 CB LEU A 32 -8.697 14.942 0.176 1.00 0.00 C ATOM 437 CG LEU A 32 -8.572 13.507 0.689 1.00 0.00 C ATOM 438 CD1 LEU A 32 -7.652 13.450 1.898 1.00 0.00 C ATOM 439 CD2 LEU A 32 -9.943 12.942 1.032 1.00 0.00 C ATOM 0 H LEU A 32 -7.017 15.171 -2.075 1.00 0.00 H new ATOM 0 HA LEU A 32 -9.860 14.525 -1.583 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -7.775 15.473 0.413 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -9.499 15.434 0.726 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.137 12.896 -0.101 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.576 12.421 2.249 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -6.663 13.813 1.620 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -8.057 14.075 2.693 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -9.835 11.920 1.395 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -10.406 13.555 1.805 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -10.571 12.946 0.141 1.00 0.00 H new ATOM 451 N ASN A 33 -10.467 17.006 -1.431 1.00 0.00 N ATOM 452 CA ASN A 33 -10.846 18.388 -1.703 1.00 0.00 C ATOM 453 C ASN A 33 -10.252 19.330 -0.661 1.00 0.00 C ATOM 454 O ASN A 33 -10.132 20.533 -0.893 1.00 0.00 O ATOM 455 CB ASN A 33 -12.369 18.527 -1.723 1.00 0.00 C ATOM 456 CG ASN A 33 -12.938 18.851 -0.356 1.00 0.00 C ATOM 457 OD1 ASN A 33 -12.651 17.998 0.621 1.00 0.00 O flip ATOM 458 ND2 ASN A 33 -13.628 19.855 -0.180 1.00 0.00 N flip ATOM 0 H ASN A 33 -11.223 16.426 -1.067 1.00 0.00 H new ATOM 0 HA ASN A 33 -10.450 18.661 -2.681 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -12.650 19.311 -2.426 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -12.811 17.599 -2.087 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -13.823 20.483 -0.960 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -14.005 20.059 0.746 1.00 0.00 H new ATOM 465 N SER A 34 -9.881 18.774 0.488 1.00 0.00 N ATOM 466 CA SER A 34 -9.302 19.564 1.568 1.00 0.00 C ATOM 467 C SER A 34 -8.351 18.720 2.411 1.00 0.00 C ATOM 468 O SER A 34 -8.585 17.531 2.626 1.00 0.00 O ATOM 469 CB SER A 34 -10.407 20.144 2.453 1.00 0.00 C ATOM 470 OG SER A 34 -9.899 21.154 3.308 1.00 0.00 O ATOM 0 H SER A 34 -9.971 17.779 0.695 1.00 0.00 H new ATOM 0 HA SER A 34 -8.736 20.382 1.122 1.00 0.00 H new ATOM 0 HB2 SER A 34 -11.199 20.557 1.828 1.00 0.00 H new ATOM 0 HB3 SER A 34 -10.854 19.349 3.050 1.00 0.00 H new ATOM 0 HG SER A 34 -10.625 21.510 3.862 1.00 0.00 H new ATOM 476 N ALA A 35 -7.277 19.343 2.884 1.00 0.00 N ATOM 477 CA ALA A 35 -6.291 18.651 3.704 1.00 0.00 C ATOM 478 C ALA A 35 -6.960 17.902 4.852 1.00 0.00 C ATOM 479 O ALA A 35 -7.520 18.514 5.762 1.00 0.00 O ATOM 480 CB ALA A 35 -5.265 19.637 4.242 1.00 0.00 C ATOM 0 H ALA A 35 -7.068 20.327 2.713 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.781 17.920 3.076 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.535 19.106 4.853 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -4.756 20.123 3.410 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.767 20.389 4.850 1.00 0.00 H new ATOM 486 N ALA A 36 -6.899 16.576 4.803 1.00 0.00 N ATOM 487 CA ALA A 36 -7.498 15.744 5.839 1.00 0.00 C ATOM 488 C ALA A 36 -6.934 14.328 5.801 1.00 0.00 C ATOM 489 O ALA A 36 -6.497 13.836 4.761 1.00 0.00 O ATOM 490 CB ALA A 36 -9.011 15.716 5.685 1.00 0.00 C ATOM 0 H ALA A 36 -6.440 16.054 4.056 1.00 0.00 H new ATOM 0 HA ALA A 36 -7.251 16.179 6.807 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -9.445 15.091 6.466 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -9.404 16.729 5.771 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -9.270 15.308 4.708 1.00 0.00 H new ATOM 496 N PRO A 37 -6.943 13.655 6.961 1.00 0.00 N ATOM 497 CA PRO A 37 -6.435 12.285 7.086 1.00 0.00 C ATOM 498 C PRO A 37 -7.326 11.270 6.378 1.00 0.00 C ATOM 499 O PRO A 37 -8.400 11.611 5.882 1.00 0.00 O ATOM 500 CB PRO A 37 -6.442 12.041 8.597 1.00 0.00 C ATOM 501 CG PRO A 37 -7.484 12.964 9.126 1.00 0.00 C ATOM 502 CD PRO A 37 -7.449 14.179 8.241 1.00 0.00 C ATOM 0 HA PRO A 37 -5.453 12.170 6.627 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -6.679 11.003 8.829 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -5.467 12.252 9.036 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -8.468 12.495 9.106 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -7.279 13.230 10.163 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -8.438 14.624 8.130 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -6.795 14.952 8.645 1.00 0.00 H new ATOM 510 N VAL A 38 -6.874 10.021 6.336 1.00 0.00 N ATOM 511 CA VAL A 38 -7.631 8.955 5.690 1.00 0.00 C ATOM 512 C VAL A 38 -7.300 7.598 6.301 1.00 0.00 C ATOM 513 O VAL A 38 -6.484 7.501 7.216 1.00 0.00 O ATOM 514 CB VAL A 38 -7.352 8.907 4.176 1.00 0.00 C ATOM 515 CG1 VAL A 38 -7.743 10.221 3.518 1.00 0.00 C ATOM 516 CG2 VAL A 38 -5.889 8.585 3.915 1.00 0.00 C ATOM 0 H VAL A 38 -5.987 9.722 6.742 1.00 0.00 H new ATOM 0 HA VAL A 38 -8.687 9.174 5.850 1.00 0.00 H new ATOM 0 HB VAL A 38 -7.959 8.115 3.737 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -7.538 10.167 2.449 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -8.806 10.405 3.675 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -7.165 11.034 3.958 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -5.709 8.555 2.840 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.261 9.353 4.367 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -5.646 7.616 4.351 1.00 0.00 H new ATOM 526 N GLU A 39 -7.940 6.552 5.787 1.00 0.00 N ATOM 527 CA GLU A 39 -7.714 5.200 6.283 1.00 0.00 C ATOM 528 C GLU A 39 -7.829 4.180 5.154 1.00 0.00 C ATOM 529 O GLU A 39 -8.838 4.130 4.450 1.00 0.00 O ATOM 530 CB GLU A 39 -8.713 4.865 7.392 1.00 0.00 C ATOM 531 CG GLU A 39 -8.299 3.680 8.248 1.00 0.00 C ATOM 532 CD GLU A 39 -7.469 2.669 7.481 1.00 0.00 C ATOM 533 OE1 GLU A 39 -8.063 1.827 6.776 1.00 0.00 O ATOM 534 OE2 GLU A 39 -6.225 2.719 7.587 1.00 0.00 O ATOM 0 H GLU A 39 -8.618 6.615 5.028 1.00 0.00 H new ATOM 0 HA GLU A 39 -6.704 5.154 6.689 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -8.838 5.738 8.032 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -9.684 4.656 6.943 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -7.729 4.037 9.105 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -9.191 3.190 8.640 1.00 0.00 H new ATOM 541 N TRP A 40 -6.790 3.370 4.988 1.00 0.00 N ATOM 542 CA TRP A 40 -6.774 2.352 3.944 1.00 0.00 C ATOM 543 C TRP A 40 -7.309 1.025 4.470 1.00 0.00 C ATOM 544 O TRP A 40 -6.682 0.382 5.311 1.00 0.00 O ATOM 545 CB TRP A 40 -5.354 2.166 3.406 1.00 0.00 C ATOM 546 CG TRP A 40 -4.784 3.408 2.791 1.00 0.00 C ATOM 547 CD1 TRP A 40 -4.024 4.357 3.414 1.00 0.00 C ATOM 548 CD2 TRP A 40 -4.931 3.837 1.433 1.00 0.00 C ATOM 549 NE1 TRP A 40 -3.690 5.350 2.525 1.00 0.00 N ATOM 550 CE2 TRP A 40 -4.233 5.054 1.302 1.00 0.00 C ATOM 551 CE3 TRP A 40 -5.581 3.311 0.314 1.00 0.00 C ATOM 552 CZ2 TRP A 40 -4.170 5.750 0.098 1.00 0.00 C ATOM 553 CZ3 TRP A 40 -5.518 4.003 -0.880 1.00 0.00 C ATOM 554 CH2 TRP A 40 -4.816 5.212 -0.981 1.00 0.00 C ATOM 0 H TRP A 40 -5.948 3.398 5.563 1.00 0.00 H new ATOM 0 HA TRP A 40 -7.421 2.688 3.134 1.00 0.00 H new ATOM 0 HB2 TRP A 40 -4.705 1.841 4.219 1.00 0.00 H new ATOM 0 HB3 TRP A 40 -5.356 1.369 2.662 1.00 0.00 H new ATOM 0 HD1 TRP A 40 -3.729 4.331 4.453 1.00 0.00 H new ATOM 0 HE1 TRP A 40 -3.129 6.174 2.740 1.00 0.00 H new ATOM 0 HE3 TRP A 40 -6.123 2.379 0.381 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 -3.630 6.682 0.019 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 -6.018 3.606 -1.751 1.00 0.00 H new ATOM 0 HH2 TRP A 40 -4.785 5.729 -1.929 1.00 0.00 H new ATOM 565 N ARG A 41 -8.472 0.620 3.969 1.00 0.00 N ATOM 566 CA ARG A 41 -9.092 -0.630 4.390 1.00 0.00 C ATOM 567 C ARG A 41 -8.836 -1.735 3.368 1.00 0.00 C ATOM 568 O ARG A 41 -8.116 -1.536 2.389 1.00 0.00 O ATOM 569 CB ARG A 41 -10.597 -0.438 4.583 1.00 0.00 C ATOM 570 CG ARG A 41 -10.951 0.740 5.475 1.00 0.00 C ATOM 571 CD ARG A 41 -12.448 1.010 5.474 1.00 0.00 C ATOM 572 NE ARG A 41 -12.889 1.651 6.710 1.00 0.00 N ATOM 573 CZ ARG A 41 -14.166 1.815 7.038 1.00 0.00 C ATOM 574 NH1 ARG A 41 -15.122 1.385 6.226 1.00 0.00 N ATOM 575 NH2 ARG A 41 -14.488 2.408 8.180 1.00 0.00 N ATOM 0 H ARG A 41 -9.004 1.140 3.271 1.00 0.00 H new ATOM 0 HA ARG A 41 -8.646 -0.926 5.339 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -11.065 -0.298 3.608 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -11.019 -1.347 5.012 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -10.617 0.540 6.493 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -10.420 1.629 5.134 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -12.701 1.646 4.626 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -12.986 0.071 5.341 1.00 0.00 H new ATOM 0 HE ARG A 41 -12.178 1.991 7.357 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -14.878 0.927 5.348 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -16.102 1.512 6.480 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -13.755 2.739 8.807 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -15.469 2.533 8.431 1.00 0.00 H new ATOM 589 N LYS A 42 -9.430 -2.900 3.603 1.00 0.00 N ATOM 590 CA LYS A 42 -9.268 -4.036 2.704 1.00 0.00 C ATOM 591 C LYS A 42 -10.229 -5.162 3.073 1.00 0.00 C ATOM 592 O LYS A 42 -10.184 -5.691 4.183 1.00 0.00 O ATOM 593 CB LYS A 42 -7.826 -4.547 2.748 1.00 0.00 C ATOM 594 CG LYS A 42 -7.509 -5.567 1.669 1.00 0.00 C ATOM 595 CD LYS A 42 -6.442 -6.548 2.125 1.00 0.00 C ATOM 596 CE LYS A 42 -6.587 -7.893 1.430 1.00 0.00 C ATOM 597 NZ LYS A 42 -5.772 -8.950 2.090 1.00 0.00 N ATOM 0 H LYS A 42 -10.028 -3.082 4.409 1.00 0.00 H new ATOM 0 HA LYS A 42 -9.497 -3.702 1.692 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -7.146 -3.701 2.647 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -7.637 -4.993 3.724 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -8.415 -6.111 1.404 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -7.171 -5.053 0.769 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -5.455 -6.135 1.918 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -6.510 -6.686 3.204 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -7.636 -8.190 1.430 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -6.283 -7.798 0.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -5.898 -9.851 1.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -4.768 -8.679 2.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -6.079 -9.059 3.078 1.00 0.00 H new ATOM 611 N GLY A 43 -11.097 -5.526 2.134 1.00 0.00 N ATOM 612 CA GLY A 43 -12.054 -6.588 2.379 1.00 0.00 C ATOM 613 C GLY A 43 -12.731 -6.458 3.730 1.00 0.00 C ATOM 614 O GLY A 43 -12.885 -7.443 4.452 1.00 0.00 O ATOM 0 H GLY A 43 -11.154 -5.104 1.207 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -12.811 -6.579 1.594 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -11.546 -7.551 2.321 1.00 0.00 H new ATOM 618 N SER A 44 -13.134 -5.239 4.073 1.00 0.00 N ATOM 619 CA SER A 44 -13.792 -4.983 5.348 1.00 0.00 C ATOM 620 C SER A 44 -12.800 -5.088 6.503 1.00 0.00 C ATOM 621 O SER A 44 -13.087 -5.707 7.527 1.00 0.00 O ATOM 622 CB SER A 44 -14.944 -5.968 5.559 1.00 0.00 C ATOM 623 OG SER A 44 -15.822 -5.516 6.576 1.00 0.00 O ATOM 0 H SER A 44 -13.016 -4.413 3.486 1.00 0.00 H new ATOM 0 HA SER A 44 -14.190 -3.969 5.325 1.00 0.00 H new ATOM 0 HB2 SER A 44 -15.495 -6.092 4.627 1.00 0.00 H new ATOM 0 HB3 SER A 44 -14.545 -6.947 5.827 1.00 0.00 H new ATOM 0 HG SER A 44 -15.315 -5.361 7.401 1.00 0.00 H new ATOM 629 N GLU A 45 -11.632 -4.478 6.328 1.00 0.00 N ATOM 630 CA GLU A 45 -10.597 -4.504 7.355 1.00 0.00 C ATOM 631 C GLU A 45 -9.775 -3.218 7.331 1.00 0.00 C ATOM 632 O GLU A 45 -9.350 -2.758 6.271 1.00 0.00 O ATOM 633 CB GLU A 45 -9.679 -5.712 7.155 1.00 0.00 C ATOM 634 CG GLU A 45 -8.448 -5.410 6.318 1.00 0.00 C ATOM 635 CD GLU A 45 -7.830 -6.659 5.718 1.00 0.00 C ATOM 636 OE1 GLU A 45 -8.587 -7.589 5.372 1.00 0.00 O ATOM 637 OE2 GLU A 45 -6.588 -6.704 5.595 1.00 0.00 O ATOM 0 H GLU A 45 -11.379 -3.961 5.486 1.00 0.00 H new ATOM 0 HA GLU A 45 -11.086 -4.585 8.326 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -9.363 -6.083 8.130 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -10.245 -6.512 6.678 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -8.718 -4.722 5.517 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -7.707 -4.904 6.937 1.00 0.00 H new ATOM 644 N THR A 46 -9.554 -2.642 8.509 1.00 0.00 N ATOM 645 CA THR A 46 -8.785 -1.409 8.624 1.00 0.00 C ATOM 646 C THR A 46 -7.292 -1.700 8.720 1.00 0.00 C ATOM 647 O THR A 46 -6.847 -2.436 9.602 1.00 0.00 O ATOM 648 CB THR A 46 -9.218 -0.591 9.855 1.00 0.00 C ATOM 649 OG1 THR A 46 -10.589 -0.199 9.726 1.00 0.00 O ATOM 650 CG2 THR A 46 -8.345 0.644 10.018 1.00 0.00 C ATOM 0 H THR A 46 -9.897 -3.010 9.397 1.00 0.00 H new ATOM 0 HA THR A 46 -8.981 -0.828 7.723 1.00 0.00 H new ATOM 0 HB THR A 46 -9.102 -1.218 10.739 1.00 0.00 H new ATOM 0 HG1 THR A 46 -10.857 0.319 10.514 1.00 0.00 H new ATOM 0 HG21 THR A 46 -8.670 1.206 10.894 1.00 0.00 H new ATOM 0 HG22 THR A 46 -7.306 0.341 10.146 1.00 0.00 H new ATOM 0 HG23 THR A 46 -8.433 1.272 9.131 1.00 0.00 H new ATOM 658 N LEU A 47 -6.521 -1.116 7.809 1.00 0.00 N ATOM 659 CA LEU A 47 -5.076 -1.312 7.791 1.00 0.00 C ATOM 660 C LEU A 47 -4.361 -0.159 8.488 1.00 0.00 C ATOM 661 O LEU A 47 -4.972 0.864 8.802 1.00 0.00 O ATOM 662 CB LEU A 47 -4.576 -1.440 6.351 1.00 0.00 C ATOM 663 CG LEU A 47 -5.473 -2.230 5.397 1.00 0.00 C ATOM 664 CD1 LEU A 47 -5.105 -1.935 3.951 1.00 0.00 C ATOM 665 CD2 LEU A 47 -5.371 -3.722 5.682 1.00 0.00 C ATOM 0 H LEU A 47 -6.873 -0.503 7.073 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.853 -2.233 8.330 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -4.440 -0.438 5.944 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -3.594 -1.912 6.369 1.00 0.00 H new ATOM 0 HG LEU A 47 -6.505 -1.919 5.558 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -5.754 -2.506 3.287 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -5.230 -0.870 3.754 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -4.067 -2.217 3.775 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -6.016 -4.269 4.994 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -4.339 -4.048 5.549 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.685 -3.919 6.707 1.00 0.00 H new ATOM 677 N ARG A 48 -3.065 -0.329 8.727 1.00 0.00 N ATOM 678 CA ARG A 48 -2.268 0.698 9.386 1.00 0.00 C ATOM 679 C ARG A 48 -0.834 0.690 8.864 1.00 0.00 C ATOM 680 O ARG A 48 -0.301 -0.357 8.498 1.00 0.00 O ATOM 681 CB ARG A 48 -2.272 0.483 10.900 1.00 0.00 C ATOM 682 CG ARG A 48 -3.660 0.531 11.518 1.00 0.00 C ATOM 683 CD ARG A 48 -4.084 1.959 11.824 1.00 0.00 C ATOM 684 NE ARG A 48 -3.497 2.450 13.068 1.00 0.00 N ATOM 685 CZ ARG A 48 -3.803 3.623 13.612 1.00 0.00 C ATOM 686 NH1 ARG A 48 -4.684 4.420 13.025 1.00 0.00 N ATOM 687 NH2 ARG A 48 -3.226 3.999 14.746 1.00 0.00 N ATOM 0 H ARG A 48 -2.544 -1.169 8.474 1.00 0.00 H new ATOM 0 HA ARG A 48 -2.713 1.668 9.163 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -1.818 -0.482 11.123 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -1.648 1.244 11.368 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -4.379 0.075 10.837 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -3.672 -0.058 12.435 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -3.787 2.609 11.001 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -5.171 2.008 11.892 1.00 0.00 H new ATOM 0 HE ARG A 48 -2.815 1.860 13.545 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -5.129 4.134 12.153 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -4.917 5.320 13.445 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -2.548 3.388 15.200 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -3.461 4.899 15.164 1.00 0.00 H new ATOM 701 N ASP A 49 -0.215 1.866 8.833 1.00 0.00 N ATOM 702 CA ASP A 49 1.157 1.995 8.357 1.00 0.00 C ATOM 703 C ASP A 49 2.117 1.210 9.246 1.00 0.00 C ATOM 704 O ASP A 49 2.026 1.260 10.472 1.00 0.00 O ATOM 705 CB ASP A 49 1.569 3.467 8.317 1.00 0.00 C ATOM 706 CG ASP A 49 2.066 3.967 9.659 1.00 0.00 C ATOM 707 OD1 ASP A 49 3.246 3.718 9.985 1.00 0.00 O ATOM 708 OD2 ASP A 49 1.276 4.606 10.385 1.00 0.00 O ATOM 0 H ASP A 49 -0.642 2.743 9.132 1.00 0.00 H new ATOM 0 HA ASP A 49 1.205 1.584 7.349 1.00 0.00 H new ATOM 0 HB2 ASP A 49 2.351 3.602 7.570 1.00 0.00 H new ATOM 0 HB3 ASP A 49 0.718 4.071 8.000 1.00 0.00 H new ATOM 713 N GLY A 50 3.037 0.483 8.619 1.00 0.00 N ATOM 714 CA GLY A 50 3.999 -0.304 9.368 1.00 0.00 C ATOM 715 C GLY A 50 5.125 -0.825 8.498 1.00 0.00 C ATOM 716 O GLY A 50 5.756 -0.063 7.765 1.00 0.00 O ATOM 0 H GLY A 50 3.133 0.425 7.605 1.00 0.00 H new ATOM 0 HA2 GLY A 50 4.416 0.305 10.170 1.00 0.00 H new ATOM 0 HA3 GLY A 50 3.489 -1.145 9.838 1.00 0.00 H new ATOM 720 N ASP A 51 5.379 -2.126 8.578 1.00 0.00 N ATOM 721 CA ASP A 51 6.438 -2.749 7.792 1.00 0.00 C ATOM 722 C ASP A 51 5.946 -3.084 6.387 1.00 0.00 C ATOM 723 O ASP A 51 6.528 -2.645 5.395 1.00 0.00 O ATOM 724 CB ASP A 51 6.940 -4.016 8.486 1.00 0.00 C ATOM 725 CG ASP A 51 8.403 -4.293 8.199 1.00 0.00 C ATOM 726 OD1 ASP A 51 8.710 -4.758 7.081 1.00 0.00 O ATOM 727 OD2 ASP A 51 9.240 -4.043 9.091 1.00 0.00 O ATOM 0 H ASP A 51 4.866 -2.770 9.179 1.00 0.00 H new ATOM 0 HA ASP A 51 7.261 -2.039 7.710 1.00 0.00 H new ATOM 0 HB2 ASP A 51 6.796 -3.919 9.562 1.00 0.00 H new ATOM 0 HB3 ASP A 51 6.341 -4.867 8.160 1.00 0.00 H new ATOM 732 N ARG A 52 4.873 -3.864 6.312 1.00 0.00 N ATOM 733 CA ARG A 52 4.305 -4.260 5.029 1.00 0.00 C ATOM 734 C ARG A 52 3.545 -3.101 4.391 1.00 0.00 C ATOM 735 O ARG A 52 3.683 -2.838 3.196 1.00 0.00 O ATOM 736 CB ARG A 52 3.372 -5.459 5.209 1.00 0.00 C ATOM 737 CG ARG A 52 4.072 -6.801 5.074 1.00 0.00 C ATOM 738 CD ARG A 52 3.124 -7.876 4.565 1.00 0.00 C ATOM 739 NE ARG A 52 2.444 -8.567 5.656 1.00 0.00 N ATOM 740 CZ ARG A 52 1.565 -9.546 5.471 1.00 0.00 C ATOM 741 NH1 ARG A 52 1.262 -9.947 4.244 1.00 0.00 N ATOM 742 NH2 ARG A 52 0.988 -10.127 6.515 1.00 0.00 N ATOM 0 H ARG A 52 4.379 -4.234 7.124 1.00 0.00 H new ATOM 0 HA ARG A 52 5.124 -4.542 4.368 1.00 0.00 H new ATOM 0 HB2 ARG A 52 2.904 -5.400 6.192 1.00 0.00 H new ATOM 0 HB3 ARG A 52 2.572 -5.400 4.471 1.00 0.00 H new ATOM 0 HG2 ARG A 52 4.916 -6.705 4.391 1.00 0.00 H new ATOM 0 HG3 ARG A 52 4.477 -7.100 6.041 1.00 0.00 H new ATOM 0 HD2 ARG A 52 2.384 -7.424 3.905 1.00 0.00 H new ATOM 0 HD3 ARG A 52 3.682 -8.599 3.970 1.00 0.00 H new ATOM 0 HE ARG A 52 2.655 -8.283 6.613 1.00 0.00 H new ATOM 0 HH11 ARG A 52 1.704 -9.504 3.439 1.00 0.00 H new ATOM 0 HH12 ARG A 52 0.587 -10.699 4.105 1.00 0.00 H new ATOM 0 HH21 ARG A 52 1.219 -9.822 7.461 1.00 0.00 H new ATOM 0 HH22 ARG A 52 0.313 -10.878 6.372 1.00 0.00 H new ATOM 756 N TYR A 53 2.742 -2.413 5.195 1.00 0.00 N ATOM 757 CA TYR A 53 1.958 -1.284 4.708 1.00 0.00 C ATOM 758 C TYR A 53 2.725 0.024 4.872 1.00 0.00 C ATOM 759 O TYR A 53 3.392 0.243 5.884 1.00 0.00 O ATOM 760 CB TYR A 53 0.625 -1.204 5.453 1.00 0.00 C ATOM 761 CG TYR A 53 -0.224 -2.447 5.311 1.00 0.00 C ATOM 762 CD1 TYR A 53 -0.748 -2.818 4.079 1.00 0.00 C ATOM 763 CD2 TYR A 53 -0.504 -3.250 6.410 1.00 0.00 C ATOM 764 CE1 TYR A 53 -1.525 -3.952 3.945 1.00 0.00 C ATOM 765 CE2 TYR A 53 -1.278 -4.387 6.285 1.00 0.00 C ATOM 766 CZ TYR A 53 -1.787 -4.734 5.050 1.00 0.00 C ATOM 767 OH TYR A 53 -2.560 -5.865 4.922 1.00 0.00 O ATOM 0 H TYR A 53 2.617 -2.617 6.186 1.00 0.00 H new ATOM 0 HA TYR A 53 1.765 -1.439 3.646 1.00 0.00 H new ATOM 0 HB2 TYR A 53 0.820 -1.026 6.511 1.00 0.00 H new ATOM 0 HB3 TYR A 53 0.063 -0.346 5.084 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -0.544 -2.209 3.211 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -0.110 -2.980 7.379 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -1.925 -4.225 2.980 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -1.484 -5.001 7.149 1.00 0.00 H new ATOM 0 HH TYR A 53 -2.647 -6.302 5.795 1.00 0.00 H new ATOM 777 N SER A 54 2.625 0.891 3.870 1.00 0.00 N ATOM 778 CA SER A 54 3.311 2.178 3.901 1.00 0.00 C ATOM 779 C SER A 54 2.382 3.300 3.450 1.00 0.00 C ATOM 780 O SER A 54 2.199 3.528 2.254 1.00 0.00 O ATOM 781 CB SER A 54 4.553 2.138 3.007 1.00 0.00 C ATOM 782 OG SER A 54 5.087 0.828 2.934 1.00 0.00 O ATOM 0 H SER A 54 2.076 0.726 3.026 1.00 0.00 H new ATOM 0 HA SER A 54 3.617 2.375 4.929 1.00 0.00 H new ATOM 0 HB2 SER A 54 4.296 2.485 2.006 1.00 0.00 H new ATOM 0 HB3 SER A 54 5.308 2.821 3.397 1.00 0.00 H new ATOM 0 HG SER A 54 5.878 0.829 2.356 1.00 0.00 H new ATOM 788 N LEU A 55 1.797 3.999 4.417 1.00 0.00 N ATOM 789 CA LEU A 55 0.885 5.099 4.122 1.00 0.00 C ATOM 790 C LEU A 55 1.622 6.434 4.133 1.00 0.00 C ATOM 791 O LEU A 55 2.258 6.796 5.123 1.00 0.00 O ATOM 792 CB LEU A 55 -0.258 5.126 5.138 1.00 0.00 C ATOM 793 CG LEU A 55 -0.741 3.765 5.642 1.00 0.00 C ATOM 794 CD1 LEU A 55 -1.745 3.940 6.771 1.00 0.00 C ATOM 795 CD2 LEU A 55 -1.350 2.961 4.503 1.00 0.00 C ATOM 0 H LEU A 55 1.938 3.824 5.412 1.00 0.00 H new ATOM 0 HA LEU A 55 0.473 4.940 3.125 1.00 0.00 H new ATOM 0 HB2 LEU A 55 0.060 5.717 5.997 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -1.104 5.646 4.689 1.00 0.00 H new ATOM 0 HG LEU A 55 0.117 3.216 6.029 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -2.078 2.961 7.117 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -1.275 4.476 7.596 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -2.603 4.508 6.411 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -1.688 1.996 4.879 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -2.197 3.505 4.086 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -0.601 2.805 3.726 1.00 0.00 H new ATOM 807 N ARG A 56 1.530 7.164 3.026 1.00 0.00 N ATOM 808 CA ARG A 56 2.187 8.460 2.909 1.00 0.00 C ATOM 809 C ARG A 56 1.213 9.520 2.403 1.00 0.00 C ATOM 810 O ARG A 56 0.629 9.377 1.328 1.00 0.00 O ATOM 811 CB ARG A 56 3.387 8.364 1.965 1.00 0.00 C ATOM 812 CG ARG A 56 4.598 7.687 2.587 1.00 0.00 C ATOM 813 CD ARG A 56 5.779 7.669 1.629 1.00 0.00 C ATOM 814 NE ARG A 56 7.020 7.290 2.298 1.00 0.00 N ATOM 815 CZ ARG A 56 8.174 7.114 1.663 1.00 0.00 C ATOM 816 NH1 ARG A 56 8.243 7.283 0.350 1.00 0.00 N ATOM 817 NH2 ARG A 56 9.261 6.769 2.342 1.00 0.00 N ATOM 0 H ARG A 56 1.007 6.880 2.198 1.00 0.00 H new ATOM 0 HA ARG A 56 2.534 8.753 3.900 1.00 0.00 H new ATOM 0 HB2 ARG A 56 3.093 7.814 1.071 1.00 0.00 H new ATOM 0 HB3 ARG A 56 3.667 9.367 1.644 1.00 0.00 H new ATOM 0 HG2 ARG A 56 4.878 8.209 3.502 1.00 0.00 H new ATOM 0 HG3 ARG A 56 4.341 6.666 2.869 1.00 0.00 H new ATOM 0 HD2 ARG A 56 5.577 6.970 0.817 1.00 0.00 H new ATOM 0 HD3 ARG A 56 5.896 8.655 1.179 1.00 0.00 H new ATOM 0 HE ARG A 56 7.000 7.153 3.309 1.00 0.00 H new ATOM 0 HH11 ARG A 56 7.409 7.549 -0.175 1.00 0.00 H new ATOM 0 HH12 ARG A 56 9.130 7.148 -0.136 1.00 0.00 H new ATOM 0 HH21 ARG A 56 9.211 6.639 3.352 1.00 0.00 H new ATOM 0 HH22 ARG A 56 10.146 6.634 1.853 1.00 0.00 H new ATOM 831 N GLN A 57 1.042 10.581 3.185 1.00 0.00 N ATOM 832 CA GLN A 57 0.137 11.663 2.816 1.00 0.00 C ATOM 833 C GLN A 57 0.905 12.962 2.591 1.00 0.00 C ATOM 834 O GLN A 57 1.838 13.279 3.329 1.00 0.00 O ATOM 835 CB GLN A 57 -0.921 11.865 3.902 1.00 0.00 C ATOM 836 CG GLN A 57 -1.913 12.973 3.588 1.00 0.00 C ATOM 837 CD GLN A 57 -2.767 13.348 4.783 1.00 0.00 C ATOM 838 OE1 GLN A 57 -4.071 13.124 4.672 1.00 0.00 O flip ATOM 839 NE2 GLN A 57 -2.261 13.834 5.794 1.00 0.00 N flip ATOM 0 H GLN A 57 1.518 10.714 4.077 1.00 0.00 H new ATOM 0 HA GLN A 57 -0.357 11.387 1.884 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -1.465 10.932 4.045 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -0.423 12.091 4.845 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -1.371 13.854 3.243 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -2.559 12.656 2.770 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -1.254 13.989 5.836 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -2.849 14.082 6.590 1.00 0.00 H new ATOM 848 N ASP A 58 0.507 13.708 1.566 1.00 0.00 N ATOM 849 CA ASP A 58 1.157 14.973 1.244 1.00 0.00 C ATOM 850 C ASP A 58 0.127 16.085 1.069 1.00 0.00 C ATOM 851 O ASP A 58 -0.153 16.515 -0.049 1.00 0.00 O ATOM 852 CB ASP A 58 1.994 14.831 -0.028 1.00 0.00 C ATOM 853 CG ASP A 58 3.196 15.755 -0.037 1.00 0.00 C ATOM 854 OD1 ASP A 58 3.121 16.831 0.591 1.00 0.00 O ATOM 855 OD2 ASP A 58 4.211 15.402 -0.673 1.00 0.00 O ATOM 0 H ASP A 58 -0.262 13.459 0.944 1.00 0.00 H new ATOM 0 HA ASP A 58 1.813 15.238 2.074 1.00 0.00 H new ATOM 0 HB2 ASP A 58 2.332 13.799 -0.124 1.00 0.00 H new ATOM 0 HB3 ASP A 58 1.370 15.044 -0.896 1.00 0.00 H new ATOM 860 N GLY A 59 -0.435 16.545 2.183 1.00 0.00 N ATOM 861 CA GLY A 59 -1.429 17.601 2.130 1.00 0.00 C ATOM 862 C GLY A 59 -2.826 17.071 1.875 1.00 0.00 C ATOM 863 O GLY A 59 -3.557 16.749 2.813 1.00 0.00 O ATOM 0 H GLY A 59 -0.220 16.205 3.120 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.419 18.152 3.070 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -1.163 18.307 1.344 1.00 0.00 H new ATOM 867 N THR A 60 -3.200 16.981 0.603 1.00 0.00 N ATOM 868 CA THR A 60 -4.519 16.489 0.227 1.00 0.00 C ATOM 869 C THR A 60 -4.426 15.125 -0.447 1.00 0.00 C ATOM 870 O THR A 60 -5.399 14.371 -0.483 1.00 0.00 O ATOM 871 CB THR A 60 -5.236 17.469 -0.721 1.00 0.00 C ATOM 872 OG1 THR A 60 -4.327 17.929 -1.727 1.00 0.00 O ATOM 873 CG2 THR A 60 -5.791 18.658 0.049 1.00 0.00 C ATOM 0 H THR A 60 -2.607 17.243 -0.185 1.00 0.00 H new ATOM 0 HA THR A 60 -5.096 16.398 1.148 1.00 0.00 H new ATOM 0 HB THR A 60 -6.065 16.943 -1.193 1.00 0.00 H new ATOM 0 HG1 THR A 60 -4.790 18.550 -2.327 1.00 0.00 H new ATOM 0 HG21 THR A 60 -6.293 19.336 -0.641 1.00 0.00 H new ATOM 0 HG22 THR A 60 -6.504 18.307 0.796 1.00 0.00 H new ATOM 0 HG23 THR A 60 -4.975 19.183 0.545 1.00 0.00 H new ATOM 881 N LYS A 61 -3.250 14.813 -0.980 1.00 0.00 N ATOM 882 CA LYS A 61 -3.028 13.538 -1.652 1.00 0.00 C ATOM 883 C LYS A 61 -2.615 12.461 -0.653 1.00 0.00 C ATOM 884 O LYS A 61 -2.056 12.762 0.403 1.00 0.00 O ATOM 885 CB LYS A 61 -1.953 13.687 -2.731 1.00 0.00 C ATOM 886 CG LYS A 61 -2.448 14.375 -3.991 1.00 0.00 C ATOM 887 CD LYS A 61 -1.398 14.348 -5.090 1.00 0.00 C ATOM 888 CE LYS A 61 -1.537 13.110 -5.963 1.00 0.00 C ATOM 889 NZ LYS A 61 -0.782 11.953 -5.408 1.00 0.00 N ATOM 0 H LYS A 61 -2.435 15.426 -0.960 1.00 0.00 H new ATOM 0 HA LYS A 61 -3.964 13.235 -2.120 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -1.116 14.253 -2.323 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.572 12.699 -2.992 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -3.356 13.884 -4.342 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -2.711 15.408 -3.763 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -1.492 15.242 -5.707 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -0.403 14.371 -4.645 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -2.591 12.846 -6.054 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -1.176 13.331 -6.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -0.510 11.313 -6.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 0.073 12.296 -4.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -1.381 11.441 -4.729 1.00 0.00 H new ATOM 903 N CYS A 62 -2.891 11.207 -0.994 1.00 0.00 N ATOM 904 CA CYS A 62 -2.548 10.086 -0.127 1.00 0.00 C ATOM 905 C CYS A 62 -1.890 8.964 -0.924 1.00 0.00 C ATOM 906 O CYS A 62 -1.895 8.979 -2.154 1.00 0.00 O ATOM 907 CB CYS A 62 -3.797 9.560 0.581 1.00 0.00 C ATOM 908 SG CYS A 62 -4.751 10.834 1.439 1.00 0.00 S ATOM 0 H CYS A 62 -3.351 10.941 -1.865 1.00 0.00 H new ATOM 0 HA CYS A 62 -1.839 10.441 0.620 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -4.439 9.073 -0.153 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -3.500 8.797 1.301 1.00 0.00 H new ATOM 0 HG CYS A 62 -5.909 10.969 0.865 1.00 0.00 H new ATOM 914 N GLU A 63 -1.324 7.994 -0.213 1.00 0.00 N ATOM 915 CA GLU A 63 -0.660 6.866 -0.856 1.00 0.00 C ATOM 916 C GLU A 63 -0.517 5.695 0.113 1.00 0.00 C ATOM 917 O GLU A 63 -0.161 5.878 1.278 1.00 0.00 O ATOM 918 CB GLU A 63 0.718 7.284 -1.374 1.00 0.00 C ATOM 919 CG GLU A 63 1.558 6.122 -1.877 1.00 0.00 C ATOM 920 CD GLU A 63 2.771 6.577 -2.664 1.00 0.00 C ATOM 921 OE1 GLU A 63 2.710 7.667 -3.269 1.00 0.00 O ATOM 922 OE2 GLU A 63 3.781 5.842 -2.676 1.00 0.00 O ATOM 0 H GLU A 63 -1.312 7.966 0.807 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.275 6.547 -1.697 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.590 8.005 -2.181 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.258 7.793 -0.575 1.00 0.00 H new ATOM 0 HG2 GLU A 63 1.885 5.521 -1.029 1.00 0.00 H new ATOM 0 HG3 GLU A 63 0.942 5.479 -2.505 1.00 0.00 H new ATOM 929 N LEU A 64 -0.797 4.492 -0.377 1.00 0.00 N ATOM 930 CA LEU A 64 -0.701 3.290 0.444 1.00 0.00 C ATOM 931 C LEU A 64 -0.024 2.159 -0.323 1.00 0.00 C ATOM 932 O LEU A 64 -0.552 1.672 -1.322 1.00 0.00 O ATOM 933 CB LEU A 64 -2.092 2.849 0.903 1.00 0.00 C ATOM 934 CG LEU A 64 -2.197 1.428 1.457 1.00 0.00 C ATOM 935 CD1 LEU A 64 -2.427 0.432 0.332 1.00 0.00 C ATOM 936 CD2 LEU A 64 -0.945 1.069 2.243 1.00 0.00 C ATOM 0 H LEU A 64 -1.092 4.323 -1.339 1.00 0.00 H new ATOM 0 HA LEU A 64 -0.094 3.525 1.318 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.436 3.543 1.670 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -2.777 2.940 0.060 1.00 0.00 H new ATOM 0 HG LEU A 64 -3.051 1.384 2.133 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -2.499 -0.574 0.746 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -3.353 0.678 -0.188 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.594 0.477 -0.370 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -1.037 0.054 2.630 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -0.075 1.131 1.589 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -0.825 1.765 3.074 1.00 0.00 H new ATOM 948 N GLN A 65 1.146 1.746 0.152 1.00 0.00 N ATOM 949 CA GLN A 65 1.894 0.671 -0.489 1.00 0.00 C ATOM 950 C GLN A 65 1.720 -0.640 0.269 1.00 0.00 C ATOM 951 O GLN A 65 1.676 -0.656 1.500 1.00 0.00 O ATOM 952 CB GLN A 65 3.378 1.033 -0.572 1.00 0.00 C ATOM 953 CG GLN A 65 3.737 1.851 -1.802 1.00 0.00 C ATOM 954 CD GLN A 65 5.199 2.252 -1.830 1.00 0.00 C ATOM 955 OE1 GLN A 65 6.085 1.430 -1.597 1.00 0.00 O ATOM 956 NE2 GLN A 65 5.459 3.523 -2.115 1.00 0.00 N ATOM 0 H GLN A 65 1.597 2.139 0.978 1.00 0.00 H new ATOM 0 HA GLN A 65 1.502 0.541 -1.498 1.00 0.00 H new ATOM 0 HB2 GLN A 65 3.657 1.593 0.321 1.00 0.00 H new ATOM 0 HB3 GLN A 65 3.968 0.116 -0.571 1.00 0.00 H new ATOM 0 HG2 GLN A 65 3.505 1.274 -2.697 1.00 0.00 H new ATOM 0 HG3 GLN A 65 3.118 2.747 -1.831 1.00 0.00 H new ATOM 0 HE21 GLN A 65 4.693 4.171 -2.302 1.00 0.00 H new ATOM 0 HE22 GLN A 65 6.424 3.851 -2.147 1.00 0.00 H new ATOM 965 N ILE A 66 1.621 -1.738 -0.473 1.00 0.00 N ATOM 966 CA ILE A 66 1.453 -3.055 0.130 1.00 0.00 C ATOM 967 C ILE A 66 2.630 -3.965 -0.200 1.00 0.00 C ATOM 968 O ILE A 66 2.701 -4.536 -1.289 1.00 0.00 O ATOM 969 CB ILE A 66 0.150 -3.727 -0.341 1.00 0.00 C ATOM 970 CG1 ILE A 66 -1.045 -2.804 -0.093 1.00 0.00 C ATOM 971 CG2 ILE A 66 -0.046 -5.058 0.368 1.00 0.00 C ATOM 972 CD1 ILE A 66 -2.306 -3.245 -0.802 1.00 0.00 C ATOM 0 H ILE A 66 1.654 -1.742 -1.492 1.00 0.00 H new ATOM 0 HA ILE A 66 1.405 -2.905 1.209 1.00 0.00 H new ATOM 0 HB ILE A 66 0.223 -3.915 -1.412 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -1.239 -2.754 0.978 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -0.789 -1.796 -0.418 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -0.971 -5.521 0.024 1.00 0.00 H new ATOM 0 HG22 ILE A 66 0.794 -5.716 0.145 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -0.101 -4.892 1.444 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -3.111 -2.545 -0.581 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -2.130 -3.268 -1.877 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -2.587 -4.241 -0.459 1.00 0.00 H new ATOM 984 N ARG A 67 3.552 -4.099 0.747 1.00 0.00 N ATOM 985 CA ARG A 67 4.727 -4.941 0.557 1.00 0.00 C ATOM 986 C ARG A 67 4.420 -6.392 0.918 1.00 0.00 C ATOM 987 O ARG A 67 4.036 -6.693 2.047 1.00 0.00 O ATOM 988 CB ARG A 67 5.891 -4.429 1.407 1.00 0.00 C ATOM 989 CG ARG A 67 6.563 -3.190 0.836 1.00 0.00 C ATOM 990 CD ARG A 67 7.730 -2.741 1.701 1.00 0.00 C ATOM 991 NE ARG A 67 8.797 -3.737 1.742 1.00 0.00 N ATOM 992 CZ ARG A 67 8.817 -4.758 2.592 1.00 0.00 C ATOM 993 NH1 ARG A 67 7.832 -4.916 3.467 1.00 0.00 N ATOM 994 NH2 ARG A 67 9.822 -5.623 2.568 1.00 0.00 N ATOM 0 H ARG A 67 3.508 -3.635 1.654 1.00 0.00 H new ATOM 0 HA ARG A 67 5.008 -4.897 -0.495 1.00 0.00 H new ATOM 0 HB2 ARG A 67 5.527 -4.205 2.410 1.00 0.00 H new ATOM 0 HB3 ARG A 67 6.633 -5.221 1.507 1.00 0.00 H new ATOM 0 HG2 ARG A 67 6.916 -3.399 -0.174 1.00 0.00 H new ATOM 0 HG3 ARG A 67 5.835 -2.383 0.758 1.00 0.00 H new ATOM 0 HD2 ARG A 67 8.126 -1.801 1.316 1.00 0.00 H new ATOM 0 HD3 ARG A 67 7.377 -2.547 2.714 1.00 0.00 H new ATOM 0 HE ARG A 67 9.569 -3.644 1.082 1.00 0.00 H new ATOM 0 HH11 ARG A 67 7.057 -4.253 3.488 1.00 0.00 H new ATOM 0 HH12 ARG A 67 7.850 -5.701 4.119 1.00 0.00 H new ATOM 0 HH21 ARG A 67 10.581 -5.505 1.897 1.00 0.00 H new ATOM 0 HH22 ARG A 67 9.836 -6.406 3.221 1.00 0.00 H new ATOM 1008 N GLY A 68 4.592 -7.286 -0.050 1.00 0.00 N ATOM 1009 CA GLY A 68 4.328 -8.694 0.185 1.00 0.00 C ATOM 1010 C GLY A 68 3.049 -9.163 -0.479 1.00 0.00 C ATOM 1011 O GLY A 68 2.223 -9.828 0.147 1.00 0.00 O ATOM 0 H GLY A 68 4.909 -7.061 -0.993 1.00 0.00 H new ATOM 0 HA2 GLY A 68 5.165 -9.284 -0.188 1.00 0.00 H new ATOM 0 HA3 GLY A 68 4.264 -8.874 1.258 1.00 0.00 H new ATOM 1015 N LEU A 69 2.882 -8.815 -1.751 1.00 0.00 N ATOM 1016 CA LEU A 69 1.692 -9.203 -2.501 1.00 0.00 C ATOM 1017 C LEU A 69 1.601 -10.720 -2.630 1.00 0.00 C ATOM 1018 O LEU A 69 2.617 -11.415 -2.632 1.00 0.00 O ATOM 1019 CB LEU A 69 1.709 -8.562 -3.889 1.00 0.00 C ATOM 1020 CG LEU A 69 1.299 -7.090 -3.954 1.00 0.00 C ATOM 1021 CD1 LEU A 69 1.606 -6.510 -5.325 1.00 0.00 C ATOM 1022 CD2 LEU A 69 -0.179 -6.934 -3.625 1.00 0.00 C ATOM 0 H LEU A 69 3.556 -8.265 -2.284 1.00 0.00 H new ATOM 0 HA LEU A 69 0.817 -8.850 -1.955 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.715 -8.657 -4.299 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.045 -9.132 -4.539 1.00 0.00 H new ATOM 0 HG LEU A 69 1.877 -6.538 -3.212 1.00 0.00 H new ATOM 0 HD11 LEU A 69 1.307 -5.462 -5.352 1.00 0.00 H new ATOM 0 HD12 LEU A 69 2.675 -6.588 -5.522 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.056 -7.064 -6.086 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.454 -5.880 -3.676 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.773 -7.499 -4.343 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.370 -7.311 -2.620 1.00 0.00 H new ATOM 1034 N ALA A 70 0.378 -11.227 -2.740 1.00 0.00 N ATOM 1035 CA ALA A 70 0.154 -12.661 -2.874 1.00 0.00 C ATOM 1036 C ALA A 70 -1.243 -12.951 -3.412 1.00 0.00 C ATOM 1037 O ALA A 70 -2.195 -12.233 -3.110 1.00 0.00 O ATOM 1038 CB ALA A 70 0.362 -13.355 -1.536 1.00 0.00 C ATOM 0 H ALA A 70 -0.474 -10.666 -2.739 1.00 0.00 H new ATOM 0 HA ALA A 70 0.878 -13.051 -3.589 1.00 0.00 H new ATOM 0 HB1 ALA A 70 0.191 -14.425 -1.651 1.00 0.00 H new ATOM 0 HB2 ALA A 70 1.382 -13.185 -1.193 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -0.339 -12.952 -0.805 1.00 0.00 H new ATOM 1044 N MET A 71 -1.358 -14.008 -4.210 1.00 0.00 N ATOM 1045 CA MET A 71 -2.640 -14.392 -4.789 1.00 0.00 C ATOM 1046 C MET A 71 -3.771 -14.194 -3.785 1.00 0.00 C ATOM 1047 O MET A 71 -4.903 -13.893 -4.163 1.00 0.00 O ATOM 1048 CB MET A 71 -2.599 -15.851 -5.248 1.00 0.00 C ATOM 1049 CG MET A 71 -1.439 -16.163 -6.180 1.00 0.00 C ATOM 1050 SD MET A 71 -1.277 -14.960 -7.513 1.00 0.00 S ATOM 1051 CE MET A 71 -2.935 -14.981 -8.192 1.00 0.00 C ATOM 0 H MET A 71 -0.579 -14.613 -4.470 1.00 0.00 H new ATOM 0 HA MET A 71 -2.828 -13.752 -5.651 1.00 0.00 H new ATOM 0 HB2 MET A 71 -2.535 -16.497 -4.372 1.00 0.00 H new ATOM 0 HB3 MET A 71 -3.535 -16.091 -5.753 1.00 0.00 H new ATOM 0 HG2 MET A 71 -0.513 -16.190 -5.605 1.00 0.00 H new ATOM 0 HG3 MET A 71 -1.578 -17.156 -6.607 1.00 0.00 H new ATOM 0 HE1 MET A 71 -2.889 -14.825 -9.270 1.00 0.00 H new ATOM 0 HE2 MET A 71 -3.401 -15.944 -7.985 1.00 0.00 H new ATOM 0 HE3 MET A 71 -3.525 -14.187 -7.735 1.00 0.00 H new ATOM 1061 N ALA A 72 -3.457 -14.366 -2.505 1.00 0.00 N ATOM 1062 CA ALA A 72 -4.447 -14.204 -1.447 1.00 0.00 C ATOM 1063 C ALA A 72 -4.783 -12.733 -1.230 1.00 0.00 C ATOM 1064 O ALA A 72 -5.945 -12.373 -1.042 1.00 0.00 O ATOM 1065 CB ALA A 72 -3.944 -14.829 -0.154 1.00 0.00 C ATOM 0 H ALA A 72 -2.525 -14.617 -2.176 1.00 0.00 H new ATOM 0 HA ALA A 72 -5.359 -14.716 -1.755 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -4.693 -14.701 0.628 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -3.761 -15.892 -0.311 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -3.017 -14.342 0.149 1.00 0.00 H new ATOM 1071 N ASP A 73 -3.759 -11.887 -1.257 1.00 0.00 N ATOM 1072 CA ASP A 73 -3.946 -10.453 -1.063 1.00 0.00 C ATOM 1073 C ASP A 73 -4.968 -9.900 -2.051 1.00 0.00 C ATOM 1074 O ASP A 73 -5.573 -8.854 -1.816 1.00 0.00 O ATOM 1075 CB ASP A 73 -2.615 -9.718 -1.221 1.00 0.00 C ATOM 1076 CG ASP A 73 -1.589 -10.149 -0.191 1.00 0.00 C ATOM 1077 OD1 ASP A 73 -1.986 -10.435 0.958 1.00 0.00 O ATOM 1078 OD2 ASP A 73 -0.390 -10.200 -0.535 1.00 0.00 O ATOM 0 H ASP A 73 -2.791 -12.169 -1.411 1.00 0.00 H new ATOM 0 HA ASP A 73 -4.322 -10.294 -0.052 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -2.220 -9.899 -2.221 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -2.784 -8.645 -1.134 1.00 0.00 H new ATOM 1083 N THR A 74 -5.155 -10.610 -3.160 1.00 0.00 N ATOM 1084 CA THR A 74 -6.102 -10.189 -4.186 1.00 0.00 C ATOM 1085 C THR A 74 -7.482 -9.937 -3.590 1.00 0.00 C ATOM 1086 O THR A 74 -8.209 -10.874 -3.265 1.00 0.00 O ATOM 1087 CB THR A 74 -6.222 -11.241 -5.304 1.00 0.00 C ATOM 1088 OG1 THR A 74 -4.930 -11.523 -5.853 1.00 0.00 O ATOM 1089 CG2 THR A 74 -7.152 -10.755 -6.406 1.00 0.00 C ATOM 0 H THR A 74 -4.663 -11.479 -3.370 1.00 0.00 H new ATOM 0 HA THR A 74 -5.718 -9.261 -4.610 1.00 0.00 H new ATOM 0 HB THR A 74 -6.639 -12.151 -4.873 1.00 0.00 H new ATOM 0 HG1 THR A 74 -4.601 -12.374 -5.495 1.00 0.00 H new ATOM 0 HG21 THR A 74 -7.221 -11.514 -7.185 1.00 0.00 H new ATOM 0 HG22 THR A 74 -8.143 -10.570 -5.991 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.759 -9.832 -6.833 1.00 0.00 H new ATOM 1097 N GLY A 75 -7.837 -8.663 -3.449 1.00 0.00 N ATOM 1098 CA GLY A 75 -9.131 -8.311 -2.893 1.00 0.00 C ATOM 1099 C GLY A 75 -9.576 -6.920 -3.297 1.00 0.00 C ATOM 1100 O GLY A 75 -9.461 -6.538 -4.461 1.00 0.00 O ATOM 0 H GLY A 75 -7.252 -7.869 -3.710 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -9.874 -9.037 -3.222 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -9.085 -8.373 -1.806 1.00 0.00 H new ATOM 1104 N GLU A 76 -10.087 -6.160 -2.332 1.00 0.00 N ATOM 1105 CA GLU A 76 -10.553 -4.804 -2.595 1.00 0.00 C ATOM 1106 C GLU A 76 -10.150 -3.861 -1.465 1.00 0.00 C ATOM 1107 O GLU A 76 -10.351 -4.163 -0.288 1.00 0.00 O ATOM 1108 CB GLU A 76 -12.073 -4.788 -2.770 1.00 0.00 C ATOM 1109 CG GLU A 76 -12.664 -3.390 -2.835 1.00 0.00 C ATOM 1110 CD GLU A 76 -14.130 -3.394 -3.222 1.00 0.00 C ATOM 1111 OE1 GLU A 76 -14.463 -3.968 -4.280 1.00 0.00 O ATOM 1112 OE2 GLU A 76 -14.945 -2.823 -2.467 1.00 0.00 O ATOM 0 H GLU A 76 -10.188 -6.461 -1.363 1.00 0.00 H new ATOM 0 HA GLU A 76 -10.085 -4.459 -3.517 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -12.331 -5.325 -3.683 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -12.531 -5.329 -1.942 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -12.549 -2.906 -1.865 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -12.103 -2.796 -3.556 1.00 0.00 H new ATOM 1119 N TYR A 77 -9.580 -2.719 -1.831 1.00 0.00 N ATOM 1120 CA TYR A 77 -9.145 -1.733 -0.848 1.00 0.00 C ATOM 1121 C TYR A 77 -9.954 -0.445 -0.975 1.00 0.00 C ATOM 1122 O TYR A 77 -10.322 -0.036 -2.075 1.00 0.00 O ATOM 1123 CB TYR A 77 -7.655 -1.432 -1.022 1.00 0.00 C ATOM 1124 CG TYR A 77 -6.767 -2.641 -0.831 1.00 0.00 C ATOM 1125 CD1 TYR A 77 -6.780 -3.687 -1.745 1.00 0.00 C ATOM 1126 CD2 TYR A 77 -5.916 -2.736 0.263 1.00 0.00 C ATOM 1127 CE1 TYR A 77 -5.971 -4.794 -1.575 1.00 0.00 C ATOM 1128 CE2 TYR A 77 -5.102 -3.839 0.440 1.00 0.00 C ATOM 1129 CZ TYR A 77 -5.134 -4.865 -0.481 1.00 0.00 C ATOM 1130 OH TYR A 77 -4.326 -5.965 -0.307 1.00 0.00 O ATOM 0 H TYR A 77 -9.408 -2.453 -2.800 1.00 0.00 H new ATOM 0 HA TYR A 77 -9.311 -2.149 0.146 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -7.489 -1.024 -2.019 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -7.363 -0.661 -0.309 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -7.434 -3.634 -2.603 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -5.890 -1.935 0.987 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -5.994 -5.599 -2.295 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -4.445 -3.897 1.295 1.00 0.00 H new ATOM 0 HH TYR A 77 -3.798 -5.857 0.512 1.00 0.00 H new ATOM 1140 N SER A 78 -10.226 0.189 0.162 1.00 0.00 N ATOM 1141 CA SER A 78 -10.993 1.428 0.180 1.00 0.00 C ATOM 1142 C SER A 78 -10.349 2.452 1.110 1.00 0.00 C ATOM 1143 O SER A 78 -10.046 2.153 2.266 1.00 0.00 O ATOM 1144 CB SER A 78 -12.432 1.156 0.622 1.00 0.00 C ATOM 1145 OG SER A 78 -12.942 -0.013 0.004 1.00 0.00 O ATOM 0 H SER A 78 -9.926 -0.135 1.081 1.00 0.00 H new ATOM 0 HA SER A 78 -11.002 1.835 -0.831 1.00 0.00 H new ATOM 0 HB2 SER A 78 -12.468 1.044 1.706 1.00 0.00 H new ATOM 0 HB3 SER A 78 -13.061 2.009 0.369 1.00 0.00 H new ATOM 0 HG SER A 78 -13.862 -0.166 0.304 1.00 0.00 H new ATOM 1151 N CYS A 79 -10.143 3.660 0.598 1.00 0.00 N ATOM 1152 CA CYS A 79 -9.534 4.729 1.381 1.00 0.00 C ATOM 1153 C CYS A 79 -10.599 5.665 1.944 1.00 0.00 C ATOM 1154 O CYS A 79 -11.122 6.524 1.234 1.00 0.00 O ATOM 1155 CB CYS A 79 -8.545 5.519 0.523 1.00 0.00 C ATOM 1156 SG CYS A 79 -7.178 6.248 1.454 1.00 0.00 S ATOM 0 H CYS A 79 -10.389 3.924 -0.356 1.00 0.00 H new ATOM 0 HA CYS A 79 -8.998 4.275 2.214 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -8.138 4.859 -0.243 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -9.083 6.314 0.006 1.00 0.00 H new ATOM 0 HG CYS A 79 -6.067 5.659 1.126 1.00 0.00 H new ATOM 1162 N VAL A 80 -10.916 5.492 3.223 1.00 0.00 N ATOM 1163 CA VAL A 80 -11.919 6.321 3.881 1.00 0.00 C ATOM 1164 C VAL A 80 -11.293 7.583 4.464 1.00 0.00 C ATOM 1165 O VAL A 80 -10.136 7.576 4.886 1.00 0.00 O ATOM 1166 CB VAL A 80 -12.634 5.550 5.006 1.00 0.00 C ATOM 1167 CG1 VAL A 80 -14.004 6.153 5.280 1.00 0.00 C ATOM 1168 CG2 VAL A 80 -12.753 4.076 4.648 1.00 0.00 C ATOM 0 H VAL A 80 -10.493 4.785 3.824 1.00 0.00 H new ATOM 0 HA VAL A 80 -12.648 6.599 3.120 1.00 0.00 H new ATOM 0 HB VAL A 80 -12.039 5.633 5.915 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -14.494 5.595 6.078 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -13.889 7.194 5.583 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -14.611 6.103 4.376 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -13.261 3.546 5.454 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -13.326 3.970 3.727 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -11.758 3.654 4.507 1.00 0.00 H new ATOM 1178 N CYS A 81 -12.064 8.665 4.483 1.00 0.00 N ATOM 1179 CA CYS A 81 -11.584 9.936 5.014 1.00 0.00 C ATOM 1180 C CYS A 81 -12.614 10.555 5.954 1.00 0.00 C ATOM 1181 O CYS A 81 -12.535 11.737 6.285 1.00 0.00 O ATOM 1182 CB CYS A 81 -11.271 10.904 3.872 1.00 0.00 C ATOM 1183 SG CYS A 81 -12.728 11.701 3.160 1.00 0.00 S ATOM 0 H CYS A 81 -13.023 8.688 4.137 1.00 0.00 H new ATOM 0 HA CYS A 81 -10.671 9.745 5.579 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -10.592 11.674 4.238 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -10.745 10.363 3.085 1.00 0.00 H new ATOM 0 HG CYS A 81 -13.020 11.138 2.025 1.00 0.00 H new ATOM 1189 N GLY A 82 -13.581 9.748 6.379 1.00 0.00 N ATOM 1190 CA GLY A 82 -14.614 10.235 7.275 1.00 0.00 C ATOM 1191 C GLY A 82 -16.005 9.832 6.829 1.00 0.00 C ATOM 1192 O GLY A 82 -16.564 8.855 7.327 1.00 0.00 O ATOM 0 H GLY A 82 -13.668 8.766 6.119 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -14.432 9.850 8.278 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -14.556 11.322 7.335 1.00 0.00 H new ATOM 1196 N GLN A 83 -16.566 10.587 5.890 1.00 0.00 N ATOM 1197 CA GLN A 83 -17.902 10.303 5.380 1.00 0.00 C ATOM 1198 C GLN A 83 -17.831 9.566 4.047 1.00 0.00 C ATOM 1199 O GLN A 83 -18.541 8.584 3.832 1.00 0.00 O ATOM 1200 CB GLN A 83 -18.694 11.602 5.215 1.00 0.00 C ATOM 1201 CG GLN A 83 -18.835 12.395 6.504 1.00 0.00 C ATOM 1202 CD GLN A 83 -19.869 13.499 6.400 1.00 0.00 C ATOM 1203 OE1 GLN A 83 -20.264 13.894 5.302 1.00 0.00 O ATOM 1204 NE2 GLN A 83 -20.314 14.004 7.544 1.00 0.00 N ATOM 0 H GLN A 83 -16.117 11.399 5.467 1.00 0.00 H new ATOM 0 HA GLN A 83 -18.410 9.663 6.102 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -18.203 12.225 4.467 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -19.687 11.366 4.832 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -19.111 11.719 7.314 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -17.870 12.829 6.766 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -19.959 13.647 8.431 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -21.011 14.749 7.536 1.00 0.00 H new ATOM 1213 N GLU A 84 -16.968 10.045 3.156 1.00 0.00 N ATOM 1214 CA GLU A 84 -16.806 9.431 1.843 1.00 0.00 C ATOM 1215 C GLU A 84 -15.565 8.544 1.808 1.00 0.00 C ATOM 1216 O GLU A 84 -14.721 8.602 2.702 1.00 0.00 O ATOM 1217 CB GLU A 84 -16.708 10.507 0.760 1.00 0.00 C ATOM 1218 CG GLU A 84 -17.941 11.390 0.666 1.00 0.00 C ATOM 1219 CD GLU A 84 -19.232 10.597 0.723 1.00 0.00 C ATOM 1220 OE1 GLU A 84 -19.605 10.150 1.829 1.00 0.00 O ATOM 1221 OE2 GLU A 84 -19.869 10.422 -0.336 1.00 0.00 O ATOM 0 H GLU A 84 -16.371 10.856 3.319 1.00 0.00 H new ATOM 0 HA GLU A 84 -17.681 8.811 1.650 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -15.838 11.133 0.959 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -16.541 10.026 -0.204 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -17.928 12.114 1.480 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -17.908 11.956 -0.265 1.00 0.00 H new ATOM 1228 N ARG A 85 -15.461 7.722 0.768 1.00 0.00 N ATOM 1229 CA ARG A 85 -14.325 6.821 0.617 1.00 0.00 C ATOM 1230 C ARG A 85 -14.241 6.289 -0.811 1.00 0.00 C ATOM 1231 O ARG A 85 -15.247 6.208 -1.516 1.00 0.00 O ATOM 1232 CB ARG A 85 -14.436 5.656 1.601 1.00 0.00 C ATOM 1233 CG ARG A 85 -15.249 4.486 1.072 1.00 0.00 C ATOM 1234 CD ARG A 85 -15.943 3.735 2.197 1.00 0.00 C ATOM 1235 NE ARG A 85 -16.344 2.390 1.792 1.00 0.00 N ATOM 1236 CZ ARG A 85 -17.298 1.693 2.399 1.00 0.00 C ATOM 1237 NH1 ARG A 85 -17.947 2.212 3.432 1.00 0.00 N ATOM 1238 NH2 ARG A 85 -17.606 0.475 1.972 1.00 0.00 N ATOM 0 H ARG A 85 -16.150 7.662 0.018 1.00 0.00 H new ATOM 0 HA ARG A 85 -13.416 7.383 0.832 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -13.434 5.307 1.852 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -14.890 6.014 2.525 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -15.993 4.850 0.363 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -14.596 3.805 0.527 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -15.275 3.671 3.056 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -16.822 4.294 2.518 1.00 0.00 H new ATOM 0 HE ARG A 85 -15.865 1.962 0.999 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -17.714 3.149 3.762 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -18.679 1.675 3.896 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -17.110 0.073 1.177 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -18.339 -0.059 2.439 1.00 0.00 H new ATOM 1252 N THR A 86 -13.033 5.926 -1.231 1.00 0.00 N ATOM 1253 CA THR A 86 -12.816 5.403 -2.574 1.00 0.00 C ATOM 1254 C THR A 86 -12.559 3.901 -2.544 1.00 0.00 C ATOM 1255 O THR A 86 -12.511 3.290 -1.476 1.00 0.00 O ATOM 1256 CB THR A 86 -11.629 6.102 -3.264 1.00 0.00 C ATOM 1257 OG1 THR A 86 -11.668 5.855 -4.674 1.00 0.00 O ATOM 1258 CG2 THR A 86 -10.307 5.611 -2.695 1.00 0.00 C ATOM 0 H THR A 86 -12.190 5.985 -0.660 1.00 0.00 H new ATOM 0 HA THR A 86 -13.725 5.602 -3.142 1.00 0.00 H new ATOM 0 HB THR A 86 -11.710 7.173 -3.080 1.00 0.00 H new ATOM 0 HG1 THR A 86 -10.785 5.559 -4.979 1.00 0.00 H new ATOM 0 HG21 THR A 86 -9.484 6.119 -3.198 1.00 0.00 H new ATOM 0 HG22 THR A 86 -10.268 5.826 -1.627 1.00 0.00 H new ATOM 0 HG23 THR A 86 -10.220 4.536 -2.852 1.00 0.00 H new ATOM 1266 N SER A 87 -12.393 3.310 -3.723 1.00 0.00 N ATOM 1267 CA SER A 87 -12.143 1.877 -3.832 1.00 0.00 C ATOM 1268 C SER A 87 -11.491 1.539 -5.169 1.00 0.00 C ATOM 1269 O SER A 87 -11.757 2.185 -6.183 1.00 0.00 O ATOM 1270 CB SER A 87 -13.450 1.097 -3.678 1.00 0.00 C ATOM 1271 OG SER A 87 -14.538 1.809 -4.241 1.00 0.00 O ATOM 0 H SER A 87 -12.427 3.801 -4.616 1.00 0.00 H new ATOM 0 HA SER A 87 -11.460 1.591 -3.032 1.00 0.00 H new ATOM 0 HB2 SER A 87 -13.357 0.126 -4.164 1.00 0.00 H new ATOM 0 HB3 SER A 87 -13.642 0.908 -2.622 1.00 0.00 H new ATOM 0 HG SER A 87 -15.361 1.289 -4.131 1.00 0.00 H new ATOM 1277 N ALA A 88 -10.635 0.523 -5.163 1.00 0.00 N ATOM 1278 CA ALA A 88 -9.946 0.097 -6.375 1.00 0.00 C ATOM 1279 C ALA A 88 -9.503 -1.359 -6.271 1.00 0.00 C ATOM 1280 O ALA A 88 -8.593 -1.688 -5.511 1.00 0.00 O ATOM 1281 CB ALA A 88 -8.749 0.997 -6.645 1.00 0.00 C ATOM 0 H ALA A 88 -10.402 -0.021 -4.332 1.00 0.00 H new ATOM 0 HA ALA A 88 -10.644 0.179 -7.209 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -8.244 0.668 -7.553 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -9.088 2.025 -6.771 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -8.057 0.944 -5.805 1.00 0.00 H new ATOM 1287 N MET A 89 -10.153 -2.226 -7.040 1.00 0.00 N ATOM 1288 CA MET A 89 -9.824 -3.647 -7.035 1.00 0.00 C ATOM 1289 C MET A 89 -8.326 -3.860 -7.226 1.00 0.00 C ATOM 1290 O MET A 89 -7.684 -3.158 -8.009 1.00 0.00 O ATOM 1291 CB MET A 89 -10.599 -4.375 -8.135 1.00 0.00 C ATOM 1292 CG MET A 89 -12.034 -4.703 -7.753 1.00 0.00 C ATOM 1293 SD MET A 89 -12.144 -5.694 -6.251 1.00 0.00 S ATOM 1294 CE MET A 89 -11.505 -7.263 -6.833 1.00 0.00 C ATOM 0 H MET A 89 -10.910 -1.970 -7.674 1.00 0.00 H new ATOM 0 HA MET A 89 -10.110 -4.057 -6.066 1.00 0.00 H new ATOM 0 HB2 MET A 89 -10.603 -3.759 -9.034 1.00 0.00 H new ATOM 0 HB3 MET A 89 -10.078 -5.299 -8.384 1.00 0.00 H new ATOM 0 HG2 MET A 89 -12.590 -3.776 -7.613 1.00 0.00 H new ATOM 0 HG3 MET A 89 -12.511 -5.240 -8.573 1.00 0.00 H new ATOM 0 HE1 MET A 89 -11.673 -8.028 -6.075 1.00 0.00 H new ATOM 0 HE2 MET A 89 -12.017 -7.546 -7.753 1.00 0.00 H new ATOM 0 HE3 MET A 89 -10.436 -7.172 -7.026 1.00 0.00 H new ATOM 1304 N LEU A 90 -7.774 -4.830 -6.506 1.00 0.00 N ATOM 1305 CA LEU A 90 -6.350 -5.135 -6.596 1.00 0.00 C ATOM 1306 C LEU A 90 -6.129 -6.566 -7.075 1.00 0.00 C ATOM 1307 O LEU A 90 -6.388 -7.524 -6.345 1.00 0.00 O ATOM 1308 CB LEU A 90 -5.678 -4.929 -5.238 1.00 0.00 C ATOM 1309 CG LEU A 90 -4.339 -5.641 -5.037 1.00 0.00 C ATOM 1310 CD1 LEU A 90 -3.316 -5.147 -6.049 1.00 0.00 C ATOM 1311 CD2 LEU A 90 -3.832 -5.432 -3.618 1.00 0.00 C ATOM 0 H LEU A 90 -8.291 -5.419 -5.853 1.00 0.00 H new ATOM 0 HA LEU A 90 -5.903 -4.456 -7.322 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -5.524 -3.860 -5.089 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -6.365 -5.263 -4.461 1.00 0.00 H new ATOM 0 HG LEU A 90 -4.489 -6.709 -5.194 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -2.369 -5.664 -5.892 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -3.676 -5.348 -7.058 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -3.169 -4.074 -5.924 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -2.879 -5.945 -3.493 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.697 -4.366 -3.433 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -4.556 -5.834 -2.910 1.00 0.00 H new ATOM 1323 N THR A 91 -5.647 -6.705 -8.306 1.00 0.00 N ATOM 1324 CA THR A 91 -5.389 -8.019 -8.882 1.00 0.00 C ATOM 1325 C THR A 91 -3.914 -8.389 -8.770 1.00 0.00 C ATOM 1326 O THR A 91 -3.040 -7.625 -9.179 1.00 0.00 O ATOM 1327 CB THR A 91 -5.810 -8.076 -10.362 1.00 0.00 C ATOM 1328 OG1 THR A 91 -7.225 -7.889 -10.477 1.00 0.00 O ATOM 1329 CG2 THR A 91 -5.417 -9.406 -10.986 1.00 0.00 C ATOM 0 H THR A 91 -5.427 -5.923 -8.923 1.00 0.00 H new ATOM 0 HA THR A 91 -5.984 -8.735 -8.315 1.00 0.00 H new ATOM 0 HB THR A 91 -5.294 -7.277 -10.894 1.00 0.00 H new ATOM 0 HG1 THR A 91 -7.484 -7.925 -11.421 1.00 0.00 H new ATOM 0 HG21 THR A 91 -5.725 -9.422 -12.032 1.00 0.00 H new ATOM 0 HG22 THR A 91 -4.336 -9.532 -10.924 1.00 0.00 H new ATOM 0 HG23 THR A 91 -5.908 -10.218 -10.450 1.00 0.00 H new ATOM 1337 N VAL A 92 -3.644 -9.566 -8.215 1.00 0.00 N ATOM 1338 CA VAL A 92 -2.275 -10.038 -8.051 1.00 0.00 C ATOM 1339 C VAL A 92 -1.971 -11.186 -9.007 1.00 0.00 C ATOM 1340 O VAL A 92 -2.431 -12.311 -8.807 1.00 0.00 O ATOM 1341 CB VAL A 92 -2.010 -10.503 -6.607 1.00 0.00 C ATOM 1342 CG1 VAL A 92 -0.642 -11.160 -6.500 1.00 0.00 C ATOM 1343 CG2 VAL A 92 -2.126 -9.333 -5.641 1.00 0.00 C ATOM 0 H VAL A 92 -4.356 -10.210 -7.871 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.621 -9.196 -8.279 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.764 -11.243 -6.338 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.472 -11.482 -5.473 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -0.601 -12.024 -7.163 1.00 0.00 H new ATOM 0 HG13 VAL A 92 0.129 -10.445 -6.788 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.936 -9.680 -4.625 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.396 -8.568 -5.906 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -3.130 -8.912 -5.699 1.00 0.00 H new ATOM 1353 N ARG A 93 -1.195 -10.895 -10.046 1.00 0.00 N ATOM 1354 CA ARG A 93 -0.831 -11.904 -11.034 1.00 0.00 C ATOM 1355 C ARG A 93 0.274 -12.812 -10.501 1.00 0.00 C ATOM 1356 O ARG A 93 1.412 -12.380 -10.320 1.00 0.00 O ATOM 1357 CB ARG A 93 -0.375 -11.235 -12.332 1.00 0.00 C ATOM 1358 CG ARG A 93 -1.405 -10.287 -12.923 1.00 0.00 C ATOM 1359 CD ARG A 93 -2.574 -11.044 -13.534 1.00 0.00 C ATOM 1360 NE ARG A 93 -2.202 -11.714 -14.777 1.00 0.00 N ATOM 1361 CZ ARG A 93 -3.071 -12.031 -15.730 1.00 0.00 C ATOM 1362 NH1 ARG A 93 -4.356 -11.739 -15.583 1.00 0.00 N ATOM 1363 NH2 ARG A 93 -2.656 -12.640 -16.833 1.00 0.00 N ATOM 0 H ARG A 93 -0.806 -9.969 -10.226 1.00 0.00 H new ATOM 0 HA ARG A 93 -1.712 -12.513 -11.237 1.00 0.00 H new ATOM 0 HB2 ARG A 93 0.547 -10.685 -12.143 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -0.141 -12.006 -13.066 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -1.771 -9.616 -12.146 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -0.934 -9.666 -13.685 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -2.941 -11.782 -12.820 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -3.393 -10.352 -13.727 1.00 0.00 H new ATOM 0 HE ARG A 93 -1.221 -11.952 -14.921 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -4.679 -11.270 -14.737 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -5.022 -11.983 -16.316 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -1.668 -12.866 -16.950 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -3.325 -12.883 -17.564 1.00 0.00 H new ATOM 1377 N ALA A 94 -0.070 -14.071 -10.253 1.00 0.00 N ATOM 1378 CA ALA A 94 0.892 -15.040 -9.743 1.00 0.00 C ATOM 1379 C ALA A 94 2.163 -15.046 -10.585 1.00 0.00 C ATOM 1380 O ALA A 94 2.107 -14.971 -11.813 1.00 0.00 O ATOM 1381 CB ALA A 94 0.273 -16.430 -9.708 1.00 0.00 C ATOM 0 H ALA A 94 -1.008 -14.444 -10.397 1.00 0.00 H new ATOM 0 HA ALA A 94 1.161 -14.749 -8.728 1.00 0.00 H new ATOM 0 HB1 ALA A 94 1.003 -17.144 -9.325 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -0.602 -16.422 -9.059 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.025 -16.721 -10.715 1.00 0.00 H new ATOM 1387 N LEU A 95 3.308 -15.135 -9.918 1.00 0.00 N ATOM 1388 CA LEU A 95 4.595 -15.150 -10.605 1.00 0.00 C ATOM 1389 C LEU A 95 4.959 -16.563 -11.050 1.00 0.00 C ATOM 1390 O LEU A 95 4.462 -17.555 -10.516 1.00 0.00 O ATOM 1391 CB LEU A 95 5.689 -14.593 -9.693 1.00 0.00 C ATOM 1392 CG LEU A 95 5.803 -13.069 -9.634 1.00 0.00 C ATOM 1393 CD1 LEU A 95 6.709 -12.645 -8.488 1.00 0.00 C ATOM 1394 CD2 LEU A 95 6.321 -12.521 -10.956 1.00 0.00 C ATOM 0 H LEU A 95 3.372 -15.198 -8.902 1.00 0.00 H new ATOM 0 HA LEU A 95 4.513 -14.520 -11.491 1.00 0.00 H new ATOM 0 HB2 LEU A 95 5.515 -14.964 -8.683 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.647 -14.997 -10.020 1.00 0.00 H new ATOM 0 HG LEU A 95 4.810 -12.657 -9.457 1.00 0.00 H new ATOM 0 HD11 LEU A 95 6.778 -11.557 -8.462 1.00 0.00 H new ATOM 0 HD12 LEU A 95 6.296 -13.005 -7.546 1.00 0.00 H new ATOM 0 HD13 LEU A 95 7.703 -13.068 -8.634 1.00 0.00 H new ATOM 0 HD21 LEU A 95 6.396 -11.435 -10.896 1.00 0.00 H new ATOM 0 HD22 LEU A 95 7.305 -12.941 -11.164 1.00 0.00 H new ATOM 0 HD23 LEU A 95 5.634 -12.793 -11.757 1.00 0.00 H new ATOM 1406 N PRO A 96 5.848 -16.658 -12.049 1.00 0.00 N ATOM 1407 CA PRO A 96 6.300 -17.946 -12.586 1.00 0.00 C ATOM 1408 C PRO A 96 7.179 -18.708 -11.600 1.00 0.00 C ATOM 1409 O PRO A 96 8.349 -18.374 -11.411 1.00 0.00 O ATOM 1410 CB PRO A 96 7.106 -17.549 -13.826 1.00 0.00 C ATOM 1411 CG PRO A 96 7.567 -16.160 -13.550 1.00 0.00 C ATOM 1412 CD PRO A 96 6.481 -15.518 -12.732 1.00 0.00 C ATOM 0 HA PRO A 96 5.466 -18.615 -12.799 1.00 0.00 H new ATOM 0 HB2 PRO A 96 7.949 -18.222 -13.982 1.00 0.00 H new ATOM 0 HB3 PRO A 96 6.493 -17.591 -14.727 1.00 0.00 H new ATOM 0 HG2 PRO A 96 8.513 -16.163 -13.009 1.00 0.00 H new ATOM 0 HG3 PRO A 96 7.732 -15.612 -14.478 1.00 0.00 H new ATOM 0 HD2 PRO A 96 6.886 -14.798 -12.021 1.00 0.00 H new ATOM 0 HD3 PRO A 96 5.770 -14.980 -13.359 1.00 0.00 H new ATOM 1420 N ILE A 97 6.608 -19.733 -10.976 1.00 0.00 N ATOM 1421 CA ILE A 97 7.341 -20.543 -10.011 1.00 0.00 C ATOM 1422 C ILE A 97 8.344 -21.455 -10.709 1.00 0.00 C ATOM 1423 O ILE A 97 7.992 -22.199 -11.625 1.00 0.00 O ATOM 1424 CB ILE A 97 6.388 -21.403 -9.159 1.00 0.00 C ATOM 1425 CG1 ILE A 97 5.328 -20.522 -8.494 1.00 0.00 C ATOM 1426 CG2 ILE A 97 7.171 -22.181 -8.112 1.00 0.00 C ATOM 1427 CD1 ILE A 97 4.036 -21.251 -8.198 1.00 0.00 C ATOM 0 H ILE A 97 5.641 -20.022 -11.121 1.00 0.00 H new ATOM 0 HA ILE A 97 7.875 -19.852 -9.359 1.00 0.00 H new ATOM 0 HB ILE A 97 5.884 -22.116 -9.811 1.00 0.00 H new ATOM 0 HG12 ILE A 97 5.731 -20.122 -7.564 1.00 0.00 H new ATOM 0 HG13 ILE A 97 5.116 -19.671 -9.142 1.00 0.00 H new ATOM 0 HG21 ILE A 97 6.484 -22.784 -7.518 1.00 0.00 H new ATOM 0 HG22 ILE A 97 7.891 -22.833 -8.606 1.00 0.00 H new ATOM 0 HG23 ILE A 97 7.699 -21.485 -7.461 1.00 0.00 H new ATOM 0 HD11 ILE A 97 3.331 -20.566 -7.727 1.00 0.00 H new ATOM 0 HD12 ILE A 97 3.610 -21.628 -9.128 1.00 0.00 H new ATOM 0 HD13 ILE A 97 4.235 -22.085 -7.525 1.00 0.00 H new ATOM 1439 N LYS A 98 9.596 -21.394 -10.269 1.00 0.00 N ATOM 1440 CA LYS A 98 10.652 -22.216 -10.848 1.00 0.00 C ATOM 1441 C LYS A 98 10.245 -23.686 -10.872 1.00 0.00 C ATOM 1442 O LYS A 98 9.603 -24.179 -9.944 1.00 0.00 O ATOM 1443 CB LYS A 98 11.950 -22.049 -10.054 1.00 0.00 C ATOM 1444 CG LYS A 98 11.893 -22.650 -8.661 1.00 0.00 C ATOM 1445 CD LYS A 98 12.368 -24.094 -8.657 1.00 0.00 C ATOM 1446 CE LYS A 98 13.882 -24.183 -8.765 1.00 0.00 C ATOM 1447 NZ LYS A 98 14.409 -25.438 -8.159 1.00 0.00 N ATOM 0 H LYS A 98 9.905 -20.783 -9.513 1.00 0.00 H new ATOM 0 HA LYS A 98 10.815 -21.885 -11.874 1.00 0.00 H new ATOM 0 HB2 LYS A 98 12.767 -22.513 -10.607 1.00 0.00 H new ATOM 0 HB3 LYS A 98 12.182 -20.987 -9.973 1.00 0.00 H new ATOM 0 HG2 LYS A 98 12.511 -22.061 -7.984 1.00 0.00 H new ATOM 0 HG3 LYS A 98 10.871 -22.601 -8.284 1.00 0.00 H new ATOM 0 HD2 LYS A 98 12.038 -24.584 -7.741 1.00 0.00 H new ATOM 0 HD3 LYS A 98 11.911 -24.631 -9.488 1.00 0.00 H new ATOM 0 HE2 LYS A 98 14.175 -24.136 -9.814 1.00 0.00 H new ATOM 0 HE3 LYS A 98 14.333 -23.323 -8.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 15.444 -25.461 -8.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 14.152 -25.472 -7.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 13.999 -26.259 -8.649 1.00 0.00 H new ATOM 1461 N PHE A 99 10.624 -24.382 -11.939 1.00 0.00 N ATOM 1462 CA PHE A 99 10.298 -25.797 -12.084 1.00 0.00 C ATOM 1463 C PHE A 99 11.288 -26.490 -13.016 1.00 0.00 C ATOM 1464 O PHE A 99 11.834 -25.873 -13.932 1.00 0.00 O ATOM 1465 CB PHE A 99 8.875 -25.962 -12.620 1.00 0.00 C ATOM 1466 CG PHE A 99 8.791 -25.927 -14.120 1.00 0.00 C ATOM 1467 CD1 PHE A 99 9.004 -24.745 -14.811 1.00 0.00 C ATOM 1468 CD2 PHE A 99 8.499 -27.075 -14.838 1.00 0.00 C ATOM 1469 CE1 PHE A 99 8.927 -24.710 -16.190 1.00 0.00 C ATOM 1470 CE2 PHE A 99 8.421 -27.046 -16.217 1.00 0.00 C ATOM 1471 CZ PHE A 99 8.636 -25.862 -16.894 1.00 0.00 C ATOM 0 H PHE A 99 11.157 -23.990 -12.716 1.00 0.00 H new ATOM 0 HA PHE A 99 10.364 -26.262 -11.101 1.00 0.00 H new ATOM 0 HB2 PHE A 99 8.469 -26.908 -12.263 1.00 0.00 H new ATOM 0 HB3 PHE A 99 8.247 -25.171 -12.210 1.00 0.00 H new ATOM 0 HD1 PHE A 99 9.233 -23.841 -14.266 1.00 0.00 H new ATOM 0 HD2 PHE A 99 8.330 -28.004 -14.313 1.00 0.00 H new ATOM 0 HE1 PHE A 99 9.094 -23.782 -16.717 1.00 0.00 H new ATOM 0 HE2 PHE A 99 8.192 -27.948 -16.765 1.00 0.00 H new ATOM 0 HZ PHE A 99 8.577 -25.837 -17.972 1.00 0.00 H new ATOM 1481 N THR A 100 11.517 -27.777 -12.775 1.00 0.00 N ATOM 1482 CA THR A 100 12.441 -28.555 -13.590 1.00 0.00 C ATOM 1483 C THR A 100 12.171 -30.049 -13.454 1.00 0.00 C ATOM 1484 O THR A 100 12.031 -30.565 -12.346 1.00 0.00 O ATOM 1485 CB THR A 100 13.905 -28.272 -13.203 1.00 0.00 C ATOM 1486 OG1 THR A 100 14.136 -26.860 -13.156 1.00 0.00 O ATOM 1487 CG2 THR A 100 14.862 -28.915 -14.196 1.00 0.00 C ATOM 0 H THR A 100 11.075 -28.303 -12.021 1.00 0.00 H new ATOM 0 HA THR A 100 12.281 -28.253 -14.625 1.00 0.00 H new ATOM 0 HB THR A 100 14.086 -28.702 -12.218 1.00 0.00 H new ATOM 0 HG1 THR A 100 13.485 -26.403 -13.729 1.00 0.00 H new ATOM 0 HG21 THR A 100 15.890 -28.701 -13.902 1.00 0.00 H new ATOM 0 HG22 THR A 100 14.705 -29.994 -14.207 1.00 0.00 H new ATOM 0 HG23 THR A 100 14.678 -28.511 -15.192 1.00 0.00 H new ATOM 1495 N GLU A 101 12.100 -30.738 -14.589 1.00 0.00 N ATOM 1496 CA GLU A 101 11.846 -32.174 -14.595 1.00 0.00 C ATOM 1497 C GLU A 101 12.505 -32.838 -15.800 1.00 0.00 C ATOM 1498 O GLU A 101 13.033 -32.162 -16.683 1.00 0.00 O ATOM 1499 CB GLU A 101 10.341 -32.448 -14.607 1.00 0.00 C ATOM 1500 CG GLU A 101 9.629 -31.996 -13.343 1.00 0.00 C ATOM 1501 CD GLU A 101 9.891 -32.915 -12.166 1.00 0.00 C ATOM 1502 OE1 GLU A 101 11.001 -32.850 -11.597 1.00 0.00 O ATOM 1503 OE2 GLU A 101 8.986 -33.700 -11.813 1.00 0.00 O ATOM 0 H GLU A 101 12.215 -30.326 -15.515 1.00 0.00 H new ATOM 0 HA GLU A 101 12.278 -32.597 -13.688 1.00 0.00 H new ATOM 0 HB2 GLU A 101 9.895 -31.944 -15.465 1.00 0.00 H new ATOM 0 HB3 GLU A 101 10.176 -33.517 -14.744 1.00 0.00 H new ATOM 0 HG2 GLU A 101 9.952 -30.986 -13.090 1.00 0.00 H new ATOM 0 HG3 GLU A 101 8.556 -31.950 -13.531 1.00 0.00 H new ATOM 1510 N SER A 102 12.471 -34.166 -15.829 1.00 0.00 N ATOM 1511 CA SER A 102 13.069 -34.923 -16.923 1.00 0.00 C ATOM 1512 C SER A 102 12.012 -35.743 -17.656 1.00 0.00 C ATOM 1513 O SER A 102 11.071 -36.250 -17.048 1.00 0.00 O ATOM 1514 CB SER A 102 14.169 -35.844 -16.392 1.00 0.00 C ATOM 1515 OG SER A 102 13.646 -36.783 -15.468 1.00 0.00 O ATOM 0 H SER A 102 12.036 -34.741 -15.107 1.00 0.00 H new ATOM 0 HA SER A 102 13.507 -34.215 -17.627 1.00 0.00 H new ATOM 0 HB2 SER A 102 14.640 -36.370 -17.223 1.00 0.00 H new ATOM 0 HB3 SER A 102 14.945 -35.249 -15.911 1.00 0.00 H new ATOM 0 HG SER A 102 14.368 -37.361 -15.145 1.00 0.00 H new ATOM 1521 N GLY A 103 12.176 -35.869 -18.970 1.00 0.00 N ATOM 1522 CA GLY A 103 11.230 -36.629 -19.766 1.00 0.00 C ATOM 1523 C GLY A 103 10.743 -35.859 -20.978 1.00 0.00 C ATOM 1524 O GLY A 103 11.276 -34.805 -21.326 1.00 0.00 O ATOM 0 H GLY A 103 12.947 -35.458 -19.497 1.00 0.00 H new ATOM 0 HA2 GLY A 103 11.698 -37.557 -20.093 1.00 0.00 H new ATOM 0 HA3 GLY A 103 10.376 -36.904 -19.146 1.00 0.00 H new ATOM 1528 N PRO A 104 9.706 -36.389 -21.643 1.00 0.00 N ATOM 1529 CA PRO A 104 9.125 -35.762 -22.834 1.00 0.00 C ATOM 1530 C PRO A 104 8.380 -34.473 -22.505 1.00 0.00 C ATOM 1531 O PRO A 104 7.989 -34.246 -21.360 1.00 0.00 O ATOM 1532 CB PRO A 104 8.153 -36.823 -23.356 1.00 0.00 C ATOM 1533 CG PRO A 104 7.796 -37.632 -22.157 1.00 0.00 C ATOM 1534 CD PRO A 104 9.021 -37.643 -21.285 1.00 0.00 C ATOM 0 HA PRO A 104 9.889 -35.473 -23.556 1.00 0.00 H new ATOM 0 HB2 PRO A 104 7.270 -36.366 -23.802 1.00 0.00 H new ATOM 0 HB3 PRO A 104 8.616 -37.440 -24.126 1.00 0.00 H new ATOM 0 HG2 PRO A 104 6.947 -37.196 -21.631 1.00 0.00 H new ATOM 0 HG3 PRO A 104 7.510 -38.645 -22.441 1.00 0.00 H new ATOM 0 HD2 PRO A 104 8.761 -37.671 -20.227 1.00 0.00 H new ATOM 0 HD3 PRO A 104 9.647 -38.513 -21.482 1.00 0.00 H new ATOM 1542 N SER A 105 8.187 -33.632 -23.516 1.00 0.00 N ATOM 1543 CA SER A 105 7.492 -32.363 -23.332 1.00 0.00 C ATOM 1544 C SER A 105 6.109 -32.404 -23.975 1.00 0.00 C ATOM 1545 O SER A 105 5.109 -32.056 -23.347 1.00 0.00 O ATOM 1546 CB SER A 105 8.311 -31.217 -23.930 1.00 0.00 C ATOM 1547 OG SER A 105 9.641 -31.234 -23.444 1.00 0.00 O ATOM 0 H SER A 105 8.502 -33.806 -24.470 1.00 0.00 H new ATOM 0 HA SER A 105 7.372 -32.194 -22.262 1.00 0.00 H new ATOM 0 HB2 SER A 105 8.317 -31.298 -25.017 1.00 0.00 H new ATOM 0 HB3 SER A 105 7.843 -30.264 -23.684 1.00 0.00 H new ATOM 0 HG SER A 105 10.144 -30.493 -23.842 1.00 0.00 H new ATOM 1553 N SER A 106 6.060 -32.832 -25.233 1.00 0.00 N ATOM 1554 CA SER A 106 4.801 -32.916 -25.964 1.00 0.00 C ATOM 1555 C SER A 106 4.129 -31.548 -26.046 1.00 0.00 C ATOM 1556 O SER A 106 2.920 -31.426 -25.857 1.00 0.00 O ATOM 1557 CB SER A 106 3.861 -33.918 -25.290 1.00 0.00 C ATOM 1558 OG SER A 106 4.199 -35.249 -25.642 1.00 0.00 O ATOM 0 H SER A 106 6.878 -33.126 -25.767 1.00 0.00 H new ATOM 0 HA SER A 106 5.019 -33.257 -26.976 1.00 0.00 H new ATOM 0 HB2 SER A 106 3.914 -33.800 -24.208 1.00 0.00 H new ATOM 0 HB3 SER A 106 2.832 -33.711 -25.584 1.00 0.00 H new ATOM 0 HG SER A 106 3.585 -35.871 -25.198 1.00 0.00 H new ATOM 1564 N GLY A 107 4.925 -30.521 -26.331 1.00 0.00 N ATOM 1565 CA GLY A 107 4.391 -29.176 -26.434 1.00 0.00 C ATOM 1566 C GLY A 107 5.148 -28.326 -27.435 1.00 0.00 C ATOM 1567 O GLY A 107 6.300 -28.616 -27.758 1.00 0.00 O ATOM 0 H GLY A 107 5.929 -30.597 -26.492 1.00 0.00 H new ATOM 0 HA2 GLY A 107 3.342 -29.226 -26.725 1.00 0.00 H new ATOM 0 HA3 GLY A 107 4.428 -28.698 -25.455 1.00 0.00 H new TER 1571 GLY A 107