USER MOD reduce.3.24.130724 H: found=0, std=0, add=627, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 624 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 27 TYR OH : rot 180:sc= 0.00847 USER MOD Set 1.2: A 56 CYS SG : rot -126:sc= 1.13 USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot -8:sc= 0.15 USER MOD Single : A 9 ASN : amide:sc= -0.152 K(o=-0.15,f=-1.5) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= -0.121 K(o=-0.12,f=-0.92) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -164:sc= 0.437 (180deg=0.148!) USER MOD Single : A 25 SER OG : rot 87:sc= 1.27 USER MOD Single : A 29 HIS : no HD1:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 31 MET CE :methyl 143:sc= -0.159 (180deg=-0.47) USER MOD Single : A 32 GLN : amide:sc= 0.304 K(o=0.3,f=-4.5!) USER MOD Single : A 34 ASN : amide:sc= -0.185 X(o=-0.18,f=-0.18) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= -0.199 K(o=-0.2,f=-3.4!) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 46 ASN : amide:sc= 0.867 K(o=0.87,f=-0.0088) USER MOD Single : A 48 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 49 SER OG : rot -114:sc= 1.75 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 61 MET CE :methyl -166:sc= -0.0777 (180deg=-0.439) USER MOD Single : A 62 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ -156:sc= 1.17 (180deg=0.728) USER MOD Single : A 72 SER OG : rot 150:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0.575 K(o=0.58,f=-0.15) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 17.421 33.436 15.395 1.00 0.00 N ATOM 2 CA PRO A 1 17.643 34.269 16.598 1.00 0.00 C ATOM 3 C PRO A 1 19.049 34.048 17.167 1.00 0.00 C ATOM 4 O PRO A 1 19.271 33.071 17.885 1.00 0.00 O ATOM 5 CB PRO A 1 16.532 33.923 17.609 1.00 0.00 C ATOM 6 CG PRO A 1 15.813 32.718 17.002 1.00 0.00 C ATOM 7 CD PRO A 1 16.043 32.938 15.516 1.00 0.00 C ATOM 0 H2 PRO A 1 18.088 32.666 15.353 1.00 0.00 H new ATOM 0 H3 PRO A 1 17.541 33.982 14.542 1.00 0.00 H new ATOM 0 HA PRO A 1 17.590 35.330 16.354 1.00 0.00 H new ATOM 0 HB2 PRO A 1 16.948 33.684 18.588 1.00 0.00 H new ATOM 0 HB3 PRO A 1 15.850 34.761 17.749 1.00 0.00 H new ATOM 0 HG2 PRO A 1 16.235 31.774 17.346 1.00 0.00 H new ATOM 0 HG3 PRO A 1 14.753 32.704 17.254 1.00 0.00 H new ATOM 0 HD2 PRO A 1 15.912 32.011 14.958 1.00 0.00 H new ATOM 0 HD3 PRO A 1 15.330 33.657 15.112 1.00 0.00 H new ATOM 15 N LYS A 2 19.997 34.933 16.834 1.00 0.00 N ATOM 16 CA LYS A 2 21.395 34.854 17.279 1.00 0.00 C ATOM 17 C LYS A 2 21.519 34.909 18.804 1.00 0.00 C ATOM 18 O LYS A 2 20.880 35.722 19.483 1.00 0.00 O ATOM 19 CB LYS A 2 22.261 35.934 16.610 1.00 0.00 C ATOM 20 CG LYS A 2 22.576 35.595 15.144 1.00 0.00 C ATOM 21 CD LYS A 2 23.705 36.488 14.612 1.00 0.00 C ATOM 22 CE LYS A 2 23.991 36.166 13.142 1.00 0.00 C ATOM 23 NZ LYS A 2 25.123 36.962 12.619 1.00 0.00 N ATOM 0 H LYS A 2 19.811 35.739 16.237 1.00 0.00 H new ATOM 0 HA LYS A 2 21.772 33.882 16.962 1.00 0.00 H new ATOM 0 HB2 LYS A 2 21.745 36.893 16.657 1.00 0.00 H new ATOM 0 HB3 LYS A 2 23.193 36.046 17.164 1.00 0.00 H new ATOM 0 HG2 LYS A 2 22.865 34.547 15.062 1.00 0.00 H new ATOM 0 HG3 LYS A 2 21.682 35.728 14.534 1.00 0.00 H new ATOM 0 HD2 LYS A 2 23.427 37.537 14.714 1.00 0.00 H new ATOM 0 HD3 LYS A 2 24.607 36.338 15.206 1.00 0.00 H new ATOM 0 HE2 LYS A 2 24.214 35.104 13.039 1.00 0.00 H new ATOM 0 HE3 LYS A 2 23.100 36.364 12.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 25.288 36.718 11.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 24.900 37.975 12.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 25.979 36.754 13.172 1.00 0.00 H new ATOM 37 N SER A 3 22.346 34.011 19.319 1.00 0.00 N ATOM 38 CA SER A 3 22.444 33.600 20.719 1.00 0.00 C ATOM 39 C SER A 3 23.896 33.271 21.083 1.00 0.00 C ATOM 40 O SER A 3 24.732 33.112 20.188 1.00 0.00 O ATOM 41 CB SER A 3 21.555 32.367 20.906 1.00 0.00 C ATOM 42 OG SER A 3 21.118 32.300 22.234 1.00 0.00 O ATOM 0 H SER A 3 23.015 33.513 18.731 1.00 0.00 H new ATOM 0 HA SER A 3 22.116 34.408 21.373 1.00 0.00 H new ATOM 0 HB2 SER A 3 20.699 32.418 20.233 1.00 0.00 H new ATOM 0 HB3 SER A 3 22.109 31.464 20.649 1.00 0.00 H new ATOM 0 HG SER A 3 21.586 32.977 22.767 1.00 0.00 H new ATOM 48 N ARG A 4 24.237 33.149 22.370 1.00 0.00 N ATOM 49 CA ARG A 4 25.614 32.846 22.802 1.00 0.00 C ATOM 50 C ARG A 4 25.675 32.028 24.092 1.00 0.00 C ATOM 51 O ARG A 4 25.073 32.385 25.103 1.00 0.00 O ATOM 52 CB ARG A 4 26.391 34.164 22.918 1.00 0.00 C ATOM 53 CG ARG A 4 27.888 33.942 23.183 1.00 0.00 C ATOM 54 CD ARG A 4 28.646 35.271 23.198 1.00 0.00 C ATOM 55 NE ARG A 4 28.192 36.146 24.295 1.00 0.00 N ATOM 56 CZ ARG A 4 27.548 37.293 24.204 1.00 0.00 C ATOM 57 NH1 ARG A 4 27.253 37.851 23.066 1.00 0.00 N ATOM 58 NH2 ARG A 4 27.181 37.886 25.301 1.00 0.00 N ATOM 0 H ARG A 4 23.576 33.256 23.139 1.00 0.00 H new ATOM 0 HA ARG A 4 26.080 32.210 22.049 1.00 0.00 H new ATOM 0 HB2 ARG A 4 26.269 34.736 21.998 1.00 0.00 H new ATOM 0 HB3 ARG A 4 25.967 34.762 23.725 1.00 0.00 H new ATOM 0 HG2 ARG A 4 28.020 33.433 24.138 1.00 0.00 H new ATOM 0 HG3 ARG A 4 28.304 33.291 22.414 1.00 0.00 H new ATOM 0 HD2 ARG A 4 29.714 35.080 23.303 1.00 0.00 H new ATOM 0 HD3 ARG A 4 28.506 35.780 22.245 1.00 0.00 H new ATOM 0 HE ARG A 4 28.402 35.824 25.240 1.00 0.00 H new ATOM 0 HH11 ARG A 4 27.522 37.399 22.192 1.00 0.00 H new ATOM 0 HH12 ARG A 4 26.753 38.740 23.048 1.00 0.00 H new ATOM 0 HH21 ARG A 4 27.393 37.463 26.205 1.00 0.00 H new ATOM 0 HH22 ARG A 4 26.681 38.774 25.258 1.00 0.00 H new ATOM 72 N LEU A 5 26.463 30.957 24.031 1.00 0.00 N ATOM 73 CA LEU A 5 26.747 29.984 25.081 1.00 0.00 C ATOM 74 C LEU A 5 28.192 30.177 25.569 1.00 0.00 C ATOM 75 O LEU A 5 29.151 29.902 24.845 1.00 0.00 O ATOM 76 CB LEU A 5 26.488 28.584 24.482 1.00 0.00 C ATOM 77 CG LEU A 5 26.403 27.435 25.497 1.00 0.00 C ATOM 78 CD1 LEU A 5 25.971 26.131 24.832 1.00 0.00 C ATOM 79 CD2 LEU A 5 27.718 27.159 26.213 1.00 0.00 C ATOM 0 H LEU A 5 26.962 30.729 23.171 1.00 0.00 H new ATOM 0 HA LEU A 5 26.108 30.110 25.955 1.00 0.00 H new ATOM 0 HB2 LEU A 5 25.556 28.616 23.918 1.00 0.00 H new ATOM 0 HB3 LEU A 5 27.283 28.359 23.771 1.00 0.00 H new ATOM 0 HG LEU A 5 25.664 27.769 26.225 1.00 0.00 H new ATOM 0 HD11 LEU A 5 25.922 25.340 25.580 1.00 0.00 H new ATOM 0 HD12 LEU A 5 24.989 26.262 24.377 1.00 0.00 H new ATOM 0 HD13 LEU A 5 26.693 25.858 24.063 1.00 0.00 H new ATOM 0 HD21 LEU A 5 27.584 26.336 26.915 1.00 0.00 H new ATOM 0 HD22 LEU A 5 28.481 26.893 25.482 1.00 0.00 H new ATOM 0 HD23 LEU A 5 28.031 28.051 26.756 1.00 0.00 H new ATOM 91 N PHE A 6 28.343 30.644 26.805 1.00 0.00 N ATOM 92 CA PHE A 6 29.632 30.895 27.452 1.00 0.00 C ATOM 93 C PHE A 6 29.871 29.869 28.571 1.00 0.00 C ATOM 94 O PHE A 6 28.978 29.628 29.388 1.00 0.00 O ATOM 95 CB PHE A 6 29.602 32.344 27.948 1.00 0.00 C ATOM 96 CG PHE A 6 30.815 32.856 28.701 1.00 0.00 C ATOM 97 CD1 PHE A 6 31.069 32.436 30.022 1.00 0.00 C ATOM 98 CD2 PHE A 6 31.641 33.832 28.111 1.00 0.00 C ATOM 99 CE1 PHE A 6 32.170 32.951 30.729 1.00 0.00 C ATOM 100 CE2 PHE A 6 32.732 34.359 28.825 1.00 0.00 C ATOM 101 CZ PHE A 6 33.005 33.907 30.128 1.00 0.00 C ATOM 0 H PHE A 6 27.548 30.866 27.405 1.00 0.00 H new ATOM 0 HA PHE A 6 30.470 30.775 26.765 1.00 0.00 H new ATOM 0 HB2 PHE A 6 29.445 32.991 27.085 1.00 0.00 H new ATOM 0 HB3 PHE A 6 28.732 32.459 28.595 1.00 0.00 H new ATOM 0 HD1 PHE A 6 30.416 31.716 30.493 1.00 0.00 H new ATOM 0 HD2 PHE A 6 31.436 34.177 27.108 1.00 0.00 H new ATOM 0 HE1 PHE A 6 32.373 32.611 31.734 1.00 0.00 H new ATOM 0 HE2 PHE A 6 33.361 35.111 28.372 1.00 0.00 H new ATOM 0 HZ PHE A 6 33.857 34.295 30.667 1.00 0.00 H new ATOM 111 N ILE A 7 31.069 29.279 28.630 1.00 0.00 N ATOM 112 CA ILE A 7 31.444 28.242 29.611 1.00 0.00 C ATOM 113 C ILE A 7 32.787 28.582 30.266 1.00 0.00 C ATOM 114 O ILE A 7 33.708 29.043 29.592 1.00 0.00 O ATOM 115 CB ILE A 7 31.525 26.823 28.979 1.00 0.00 C ATOM 116 CG1 ILE A 7 30.382 26.525 27.984 1.00 0.00 C ATOM 117 CG2 ILE A 7 31.534 25.764 30.099 1.00 0.00 C ATOM 118 CD1 ILE A 7 30.454 25.155 27.297 1.00 0.00 C ATOM 0 H ILE A 7 31.825 29.510 27.986 1.00 0.00 H new ATOM 0 HA ILE A 7 30.655 28.228 30.363 1.00 0.00 H new ATOM 0 HB ILE A 7 32.450 26.785 28.404 1.00 0.00 H new ATOM 0 HG12 ILE A 7 29.432 26.598 28.514 1.00 0.00 H new ATOM 0 HG13 ILE A 7 30.379 27.299 27.216 1.00 0.00 H new ATOM 0 HG21 ILE A 7 31.591 24.769 29.658 1.00 0.00 H new ATOM 0 HG22 ILE A 7 32.397 25.925 30.745 1.00 0.00 H new ATOM 0 HG23 ILE A 7 30.620 25.849 30.687 1.00 0.00 H new ATOM 0 HD11 ILE A 7 29.608 25.043 26.619 1.00 0.00 H new ATOM 0 HD12 ILE A 7 31.384 25.079 26.733 1.00 0.00 H new ATOM 0 HD13 ILE A 7 30.422 24.368 28.050 1.00 0.00 H new ATOM 130 N GLY A 8 32.907 28.304 31.564 1.00 0.00 N ATOM 131 CA GLY A 8 34.166 28.243 32.306 1.00 0.00 C ATOM 132 C GLY A 8 35.009 27.001 31.986 1.00 0.00 C ATOM 133 O GLY A 8 35.144 26.589 30.834 1.00 0.00 O ATOM 0 H GLY A 8 32.097 28.107 32.151 1.00 0.00 H new ATOM 0 HA2 GLY A 8 34.751 29.136 32.086 1.00 0.00 H new ATOM 0 HA3 GLY A 8 33.950 28.259 33.374 1.00 0.00 H new ATOM 137 N ASN A 9 35.591 26.392 33.019 1.00 0.00 N ATOM 138 CA ASN A 9 36.540 25.290 32.894 1.00 0.00 C ATOM 139 C ASN A 9 35.825 23.951 32.621 1.00 0.00 C ATOM 140 O ASN A 9 35.665 23.121 33.514 1.00 0.00 O ATOM 141 CB ASN A 9 37.440 25.268 34.145 1.00 0.00 C ATOM 142 CG ASN A 9 38.470 24.147 34.127 1.00 0.00 C ATOM 143 OD1 ASN A 9 38.664 23.444 33.146 1.00 0.00 O ATOM 144 ND2 ASN A 9 39.142 23.926 35.231 1.00 0.00 N ATOM 0 H ASN A 9 35.411 26.658 33.987 1.00 0.00 H new ATOM 0 HA ASN A 9 37.179 25.444 32.025 1.00 0.00 H new ATOM 0 HB2 ASN A 9 37.956 26.224 34.230 1.00 0.00 H new ATOM 0 HB3 ASN A 9 36.815 25.163 35.032 1.00 0.00 H new ATOM 0 HD21 ASN A 9 39.825 23.169 35.270 1.00 0.00 H new ATOM 0 HD22 ASN A 9 38.982 24.511 36.051 1.00 0.00 H new ATOM 151 N LEU A 10 35.415 23.727 31.372 1.00 0.00 N ATOM 152 CA LEU A 10 35.006 22.411 30.858 1.00 0.00 C ATOM 153 C LEU A 10 35.518 22.155 29.428 1.00 0.00 C ATOM 154 O LEU A 10 36.263 21.195 29.251 1.00 0.00 O ATOM 155 CB LEU A 10 33.488 22.215 31.035 1.00 0.00 C ATOM 156 CG LEU A 10 32.920 20.903 30.461 1.00 0.00 C ATOM 157 CD1 LEU A 10 33.563 19.663 31.082 1.00 0.00 C ATOM 158 CD2 LEU A 10 31.416 20.847 30.731 1.00 0.00 C ATOM 0 H LEU A 10 35.355 24.467 30.672 1.00 0.00 H new ATOM 0 HA LEU A 10 35.488 21.637 31.455 1.00 0.00 H new ATOM 0 HB2 LEU A 10 33.255 22.257 32.099 1.00 0.00 H new ATOM 0 HB3 LEU A 10 32.973 23.052 30.562 1.00 0.00 H new ATOM 0 HG LEU A 10 33.137 20.899 29.393 1.00 0.00 H new ATOM 0 HD11 LEU A 10 33.126 18.767 30.641 1.00 0.00 H new ATOM 0 HD12 LEU A 10 34.636 19.675 30.891 1.00 0.00 H new ATOM 0 HD13 LEU A 10 33.386 19.662 32.158 1.00 0.00 H new ATOM 0 HD21 LEU A 10 31.008 19.920 30.327 1.00 0.00 H new ATOM 0 HD22 LEU A 10 31.238 20.884 31.806 1.00 0.00 H new ATOM 0 HD23 LEU A 10 30.929 21.697 30.253 1.00 0.00 H new ATOM 170 N PRO A 11 35.253 23.004 28.412 1.00 0.00 N ATOM 171 CA PRO A 11 35.765 22.801 27.050 1.00 0.00 C ATOM 172 C PRO A 11 37.264 23.131 26.882 1.00 0.00 C ATOM 173 O PRO A 11 37.705 23.448 25.779 1.00 0.00 O ATOM 174 CB PRO A 11 34.857 23.666 26.162 1.00 0.00 C ATOM 175 CG PRO A 11 34.565 24.852 27.076 1.00 0.00 C ATOM 176 CD PRO A 11 34.357 24.156 28.418 1.00 0.00 C ATOM 0 HA PRO A 11 35.729 21.747 26.773 1.00 0.00 H new ATOM 0 HB2 PRO A 11 35.356 23.972 25.242 1.00 0.00 H new ATOM 0 HB3 PRO A 11 33.948 23.140 25.872 1.00 0.00 H new ATOM 0 HG2 PRO A 11 35.392 25.561 27.105 1.00 0.00 H new ATOM 0 HG3 PRO A 11 33.681 25.406 26.760 1.00 0.00 H new ATOM 0 HD2 PRO A 11 34.588 24.826 29.246 1.00 0.00 H new ATOM 0 HD3 PRO A 11 33.320 23.844 28.540 1.00 0.00 H new ATOM 184 N LEU A 12 38.057 23.092 27.957 1.00 0.00 N ATOM 185 CA LEU A 12 39.387 23.706 28.037 1.00 0.00 C ATOM 186 C LEU A 12 40.422 23.033 27.120 1.00 0.00 C ATOM 187 O LEU A 12 41.191 23.744 26.465 1.00 0.00 O ATOM 188 CB LEU A 12 39.803 23.726 29.521 1.00 0.00 C ATOM 189 CG LEU A 12 41.006 24.638 29.838 1.00 0.00 C ATOM 190 CD1 LEU A 12 40.955 25.071 31.302 1.00 0.00 C ATOM 191 CD2 LEU A 12 42.366 23.969 29.623 1.00 0.00 C ATOM 0 H LEU A 12 37.785 22.620 28.819 1.00 0.00 H new ATOM 0 HA LEU A 12 39.343 24.727 27.659 1.00 0.00 H new ATOM 0 HB2 LEU A 12 38.951 24.049 30.119 1.00 0.00 H new ATOM 0 HB3 LEU A 12 40.043 22.709 29.831 1.00 0.00 H new ATOM 0 HG LEU A 12 40.921 25.477 29.148 1.00 0.00 H new ATOM 0 HD11 LEU A 12 41.807 25.715 31.521 1.00 0.00 H new ATOM 0 HD12 LEU A 12 40.030 25.617 31.488 1.00 0.00 H new ATOM 0 HD13 LEU A 12 40.992 24.190 31.943 1.00 0.00 H new ATOM 0 HD21 LEU A 12 43.161 24.674 29.867 1.00 0.00 H new ATOM 0 HD22 LEU A 12 42.447 23.094 30.267 1.00 0.00 H new ATOM 0 HD23 LEU A 12 42.460 23.662 28.581 1.00 0.00 H new ATOM 203 N LYS A 13 40.428 21.694 27.046 1.00 0.00 N ATOM 204 CA LYS A 13 41.365 20.903 26.218 1.00 0.00 C ATOM 205 C LYS A 13 40.763 19.631 25.593 1.00 0.00 C ATOM 206 O LYS A 13 41.260 19.179 24.563 1.00 0.00 O ATOM 207 CB LYS A 13 42.601 20.582 27.088 1.00 0.00 C ATOM 208 CG LYS A 13 43.871 20.113 26.354 1.00 0.00 C ATOM 209 CD LYS A 13 44.730 21.228 25.731 1.00 0.00 C ATOM 210 CE LYS A 13 44.062 21.933 24.545 1.00 0.00 C ATOM 211 NZ LYS A 13 44.993 22.850 23.851 1.00 0.00 N ATOM 0 H LYS A 13 39.771 21.114 27.568 1.00 0.00 H new ATOM 0 HA LYS A 13 41.636 21.506 25.352 1.00 0.00 H new ATOM 0 HB2 LYS A 13 42.852 21.474 27.662 1.00 0.00 H new ATOM 0 HB3 LYS A 13 42.320 19.810 27.804 1.00 0.00 H new ATOM 0 HG2 LYS A 13 44.489 19.553 27.056 1.00 0.00 H new ATOM 0 HG3 LYS A 13 43.578 19.421 25.565 1.00 0.00 H new ATOM 0 HD2 LYS A 13 44.961 21.967 26.498 1.00 0.00 H new ATOM 0 HD3 LYS A 13 45.678 20.803 25.402 1.00 0.00 H new ATOM 0 HE2 LYS A 13 43.694 21.187 23.840 1.00 0.00 H new ATOM 0 HE3 LYS A 13 43.196 22.493 24.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 44.502 23.306 23.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 45.325 23.577 24.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 45.807 22.312 23.492 1.00 0.00 H new ATOM 225 N ASN A 14 39.690 19.070 26.159 1.00 0.00 N ATOM 226 CA ASN A 14 39.030 17.841 25.689 1.00 0.00 C ATOM 227 C ASN A 14 37.805 18.104 24.778 1.00 0.00 C ATOM 228 O ASN A 14 36.952 17.232 24.584 1.00 0.00 O ATOM 229 CB ASN A 14 38.706 16.954 26.908 1.00 0.00 C ATOM 230 CG ASN A 14 38.361 15.509 26.561 1.00 0.00 C ATOM 231 OD1 ASN A 14 38.594 15.018 25.467 1.00 0.00 O ATOM 232 ND2 ASN A 14 37.822 14.765 27.490 1.00 0.00 N ATOM 0 H ASN A 14 39.240 19.469 26.983 1.00 0.00 H new ATOM 0 HA ASN A 14 39.720 17.305 25.037 1.00 0.00 H new ATOM 0 HB2 ASN A 14 39.562 16.959 27.583 1.00 0.00 H new ATOM 0 HB3 ASN A 14 37.870 17.394 27.451 1.00 0.00 H new ATOM 0 HD21 ASN A 14 37.602 13.788 27.297 1.00 0.00 H new ATOM 0 HD22 ASN A 14 37.622 15.161 28.408 1.00 0.00 H new ATOM 239 N VAL A 15 37.686 19.305 24.200 1.00 0.00 N ATOM 240 CA VAL A 15 36.561 19.679 23.325 1.00 0.00 C ATOM 241 C VAL A 15 37.055 20.409 22.077 1.00 0.00 C ATOM 242 O VAL A 15 37.713 21.446 22.175 1.00 0.00 O ATOM 243 CB VAL A 15 35.529 20.528 24.096 1.00 0.00 C ATOM 244 CG1 VAL A 15 34.382 21.026 23.212 1.00 0.00 C ATOM 245 CG2 VAL A 15 34.886 19.723 25.236 1.00 0.00 C ATOM 0 H VAL A 15 38.370 20.051 24.325 1.00 0.00 H new ATOM 0 HA VAL A 15 36.067 18.764 22.998 1.00 0.00 H new ATOM 0 HB VAL A 15 36.095 21.378 24.476 1.00 0.00 H new ATOM 0 HG11 VAL A 15 33.690 21.617 23.812 1.00 0.00 H new ATOM 0 HG12 VAL A 15 34.784 21.643 22.409 1.00 0.00 H new ATOM 0 HG13 VAL A 15 33.855 20.173 22.785 1.00 0.00 H new ATOM 0 HG21 VAL A 15 34.164 20.348 25.760 1.00 0.00 H new ATOM 0 HG22 VAL A 15 34.379 18.850 24.824 1.00 0.00 H new ATOM 0 HG23 VAL A 15 35.659 19.399 25.933 1.00 0.00 H new ATOM 255 N SER A 16 36.680 19.903 20.906 1.00 0.00 N ATOM 256 CA SER A 16 36.756 20.608 19.619 1.00 0.00 C ATOM 257 C SER A 16 35.346 20.913 19.095 1.00 0.00 C ATOM 258 O SER A 16 34.353 20.482 19.689 1.00 0.00 O ATOM 259 CB SER A 16 37.541 19.757 18.618 1.00 0.00 C ATOM 260 OG SER A 16 38.834 19.454 19.112 1.00 0.00 O ATOM 0 H SER A 16 36.301 18.960 20.818 1.00 0.00 H new ATOM 0 HA SER A 16 37.275 21.557 19.755 1.00 0.00 H new ATOM 0 HB2 SER A 16 36.999 18.833 18.417 1.00 0.00 H new ATOM 0 HB3 SER A 16 37.625 20.289 17.671 1.00 0.00 H new ATOM 0 HG SER A 16 39.315 18.908 18.456 1.00 0.00 H new ATOM 266 N LYS A 17 35.223 21.628 17.971 1.00 0.00 N ATOM 267 CA LYS A 17 33.925 21.998 17.379 1.00 0.00 C ATOM 268 C LYS A 17 33.019 20.800 17.084 1.00 0.00 C ATOM 269 O LYS A 17 31.827 20.850 17.361 1.00 0.00 O ATOM 270 CB LYS A 17 34.134 22.906 16.160 1.00 0.00 C ATOM 271 CG LYS A 17 34.618 22.216 14.887 1.00 0.00 C ATOM 272 CD LYS A 17 34.790 23.223 13.743 1.00 0.00 C ATOM 273 CE LYS A 17 35.209 22.523 12.445 1.00 0.00 C ATOM 274 NZ LYS A 17 34.148 21.644 11.904 1.00 0.00 N ATOM 0 H LYS A 17 36.024 21.970 17.440 1.00 0.00 H new ATOM 0 HA LYS A 17 33.379 22.566 18.132 1.00 0.00 H new ATOM 0 HB2 LYS A 17 33.192 23.410 15.941 1.00 0.00 H new ATOM 0 HB3 LYS A 17 34.854 23.679 16.427 1.00 0.00 H new ATOM 0 HG2 LYS A 17 35.567 21.715 15.080 1.00 0.00 H new ATOM 0 HG3 LYS A 17 33.904 21.446 14.593 1.00 0.00 H new ATOM 0 HD2 LYS A 17 33.855 23.760 13.584 1.00 0.00 H new ATOM 0 HD3 LYS A 17 35.540 23.964 14.018 1.00 0.00 H new ATOM 0 HE2 LYS A 17 35.469 23.274 11.699 1.00 0.00 H new ATOM 0 HE3 LYS A 17 36.107 21.932 12.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 34.558 20.998 11.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 33.727 21.091 12.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 33.412 22.225 11.454 1.00 0.00 H new ATOM 288 N GLU A 18 33.594 19.687 16.633 1.00 0.00 N ATOM 289 CA GLU A 18 32.870 18.426 16.423 1.00 0.00 C ATOM 290 C GLU A 18 32.349 17.802 17.727 1.00 0.00 C ATOM 291 O GLU A 18 31.325 17.119 17.698 1.00 0.00 O ATOM 292 CB GLU A 18 33.797 17.429 15.708 1.00 0.00 C ATOM 293 CG GLU A 18 33.672 17.484 14.181 1.00 0.00 C ATOM 294 CD GLU A 18 33.904 18.883 13.622 1.00 0.00 C ATOM 295 OE1 GLU A 18 35.070 19.341 13.591 1.00 0.00 O ATOM 296 OE2 GLU A 18 32.921 19.555 13.228 1.00 0.00 O ATOM 0 H GLU A 18 34.585 19.630 16.400 1.00 0.00 H new ATOM 0 HA GLU A 18 31.995 18.653 15.814 1.00 0.00 H new ATOM 0 HB2 GLU A 18 34.830 17.635 15.990 1.00 0.00 H new ATOM 0 HB3 GLU A 18 33.568 16.419 16.050 1.00 0.00 H new ATOM 0 HG2 GLU A 18 34.391 16.796 13.737 1.00 0.00 H new ATOM 0 HG3 GLU A 18 32.680 17.140 13.889 1.00 0.00 H new ATOM 303 N ASP A 19 33.016 18.047 18.862 1.00 0.00 N ATOM 304 CA ASP A 19 32.608 17.543 20.175 1.00 0.00 C ATOM 305 C ASP A 19 31.508 18.400 20.794 1.00 0.00 C ATOM 306 O ASP A 19 30.454 17.872 21.139 1.00 0.00 O ATOM 307 CB ASP A 19 33.799 17.422 21.130 1.00 0.00 C ATOM 308 CG ASP A 19 34.847 16.442 20.625 1.00 0.00 C ATOM 309 OD1 ASP A 19 34.557 15.223 20.551 1.00 0.00 O ATOM 310 OD2 ASP A 19 35.979 16.883 20.333 1.00 0.00 O ATOM 0 H ASP A 19 33.866 18.609 18.892 1.00 0.00 H new ATOM 0 HA ASP A 19 32.203 16.544 20.015 1.00 0.00 H new ATOM 0 HB2 ASP A 19 34.256 18.403 21.263 1.00 0.00 H new ATOM 0 HB3 ASP A 19 33.445 17.100 22.109 1.00 0.00 H new ATOM 315 N LEU A 20 31.697 19.722 20.879 1.00 0.00 N ATOM 316 CA LEU A 20 30.644 20.612 21.383 1.00 0.00 C ATOM 317 C LEU A 20 29.388 20.524 20.505 1.00 0.00 C ATOM 318 O LEU A 20 28.276 20.529 21.030 1.00 0.00 O ATOM 319 CB LEU A 20 31.174 22.049 21.567 1.00 0.00 C ATOM 320 CG LEU A 20 31.523 22.781 20.262 1.00 0.00 C ATOM 321 CD1 LEU A 20 30.341 23.559 19.680 1.00 0.00 C ATOM 322 CD2 LEU A 20 32.684 23.749 20.485 1.00 0.00 C ATOM 0 H LEU A 20 32.559 20.195 20.609 1.00 0.00 H new ATOM 0 HA LEU A 20 30.341 20.278 22.375 1.00 0.00 H new ATOM 0 HB2 LEU A 20 30.425 22.631 22.104 1.00 0.00 H new ATOM 0 HB3 LEU A 20 32.063 22.015 22.197 1.00 0.00 H new ATOM 0 HG LEU A 20 31.802 22.007 19.547 1.00 0.00 H new ATOM 0 HD11 LEU A 20 30.649 24.054 18.759 1.00 0.00 H new ATOM 0 HD12 LEU A 20 29.523 22.871 19.466 1.00 0.00 H new ATOM 0 HD13 LEU A 20 30.007 24.306 20.400 1.00 0.00 H new ATOM 0 HD21 LEU A 20 32.918 24.259 19.550 1.00 0.00 H new ATOM 0 HD22 LEU A 20 32.405 24.485 21.239 1.00 0.00 H new ATOM 0 HD23 LEU A 20 33.559 23.195 20.825 1.00 0.00 H new ATOM 334 N PHE A 21 29.536 20.372 19.184 1.00 0.00 N ATOM 335 CA PHE A 21 28.385 20.233 18.301 1.00 0.00 C ATOM 336 C PHE A 21 27.655 18.901 18.504 1.00 0.00 C ATOM 337 O PHE A 21 26.439 18.926 18.693 1.00 0.00 O ATOM 338 CB PHE A 21 28.787 20.456 16.843 1.00 0.00 C ATOM 339 CG PHE A 21 27.600 20.360 15.910 1.00 0.00 C ATOM 340 CD1 PHE A 21 26.571 21.317 15.984 1.00 0.00 C ATOM 341 CD2 PHE A 21 27.481 19.273 15.030 1.00 0.00 C ATOM 342 CE1 PHE A 21 25.433 21.199 15.167 1.00 0.00 C ATOM 343 CE2 PHE A 21 26.338 19.149 14.226 1.00 0.00 C ATOM 344 CZ PHE A 21 25.325 20.121 14.275 1.00 0.00 C ATOM 0 H PHE A 21 30.439 20.343 18.710 1.00 0.00 H new ATOM 0 HA PHE A 21 27.670 21.012 18.568 1.00 0.00 H new ATOM 0 HB2 PHE A 21 29.251 21.437 16.740 1.00 0.00 H new ATOM 0 HB3 PHE A 21 29.535 19.717 16.556 1.00 0.00 H new ATOM 0 HD1 PHE A 21 26.656 22.146 16.671 1.00 0.00 H new ATOM 0 HD2 PHE A 21 28.267 18.534 14.972 1.00 0.00 H new ATOM 0 HE1 PHE A 21 24.645 21.935 15.226 1.00 0.00 H new ATOM 0 HE2 PHE A 21 26.236 18.301 13.565 1.00 0.00 H new ATOM 0 HZ PHE A 21 24.465 20.039 13.627 1.00 0.00 H new ATOM 354 N ARG A 22 28.341 17.746 18.540 1.00 0.00 N ATOM 355 CA ARG A 22 27.660 16.447 18.734 1.00 0.00 C ATOM 356 C ARG A 22 26.998 16.328 20.113 1.00 0.00 C ATOM 357 O ARG A 22 25.910 15.763 20.206 1.00 0.00 O ATOM 358 CB ARG A 22 28.597 15.264 18.410 1.00 0.00 C ATOM 359 CG ARG A 22 29.651 15.016 19.498 1.00 0.00 C ATOM 360 CD ARG A 22 30.804 14.106 19.060 1.00 0.00 C ATOM 361 NE ARG A 22 31.878 14.055 20.072 1.00 0.00 N ATOM 362 CZ ARG A 22 31.797 13.602 21.305 1.00 0.00 C ATOM 363 NH1 ARG A 22 30.803 12.903 21.751 1.00 0.00 N ATOM 364 NH2 ARG A 22 32.743 13.871 22.144 1.00 0.00 N ATOM 0 H ARG A 22 29.354 17.681 18.439 1.00 0.00 H new ATOM 0 HA ARG A 22 26.841 16.403 18.016 1.00 0.00 H new ATOM 0 HB2 ARG A 22 28.001 14.361 18.278 1.00 0.00 H new ATOM 0 HB3 ARG A 22 29.100 15.455 17.462 1.00 0.00 H new ATOM 0 HG2 ARG A 22 30.060 15.975 19.817 1.00 0.00 H new ATOM 0 HG3 ARG A 22 29.163 14.573 20.366 1.00 0.00 H new ATOM 0 HD2 ARG A 22 30.425 13.100 18.881 1.00 0.00 H new ATOM 0 HD3 ARG A 22 31.212 14.465 18.115 1.00 0.00 H new ATOM 0 HE ARG A 22 32.788 14.412 19.782 1.00 0.00 H new ATOM 0 HH11 ARG A 22 30.023 12.674 21.135 1.00 0.00 H new ATOM 0 HH12 ARG A 22 30.800 12.581 22.719 1.00 0.00 H new ATOM 0 HH21 ARG A 22 33.543 14.430 21.848 1.00 0.00 H new ATOM 0 HH22 ARG A 22 32.689 13.524 23.102 1.00 0.00 H new ATOM 378 N ILE A 23 27.595 16.890 21.172 1.00 0.00 N ATOM 379 CA ILE A 23 27.031 16.805 22.532 1.00 0.00 C ATOM 380 C ILE A 23 25.928 17.843 22.800 1.00 0.00 C ATOM 381 O ILE A 23 24.965 17.513 23.493 1.00 0.00 O ATOM 382 CB ILE A 23 28.129 16.787 23.623 1.00 0.00 C ATOM 383 CG1 ILE A 23 28.952 18.092 23.715 1.00 0.00 C ATOM 384 CG2 ILE A 23 29.063 15.580 23.425 1.00 0.00 C ATOM 385 CD1 ILE A 23 28.654 18.912 24.965 1.00 0.00 C ATOM 0 H ILE A 23 28.471 17.410 21.116 1.00 0.00 H new ATOM 0 HA ILE A 23 26.529 15.839 22.590 1.00 0.00 H new ATOM 0 HB ILE A 23 27.601 16.699 24.573 1.00 0.00 H new ATOM 0 HG12 ILE A 23 30.013 17.845 23.697 1.00 0.00 H new ATOM 0 HG13 ILE A 23 28.751 18.702 22.834 1.00 0.00 H new ATOM 0 HG21 ILE A 23 29.829 15.582 24.200 1.00 0.00 H new ATOM 0 HG22 ILE A 23 28.485 14.658 23.489 1.00 0.00 H new ATOM 0 HG23 ILE A 23 29.537 15.644 22.446 1.00 0.00 H new ATOM 0 HD11 ILE A 23 29.267 19.813 24.964 1.00 0.00 H new ATOM 0 HD12 ILE A 23 27.600 19.190 24.975 1.00 0.00 H new ATOM 0 HD13 ILE A 23 28.882 18.320 25.851 1.00 0.00 H new ATOM 397 N PHE A 24 25.990 19.053 22.224 1.00 0.00 N ATOM 398 CA PHE A 24 24.923 20.058 22.372 1.00 0.00 C ATOM 399 C PHE A 24 23.806 19.959 21.314 1.00 0.00 C ATOM 400 O PHE A 24 22.708 20.446 21.573 1.00 0.00 O ATOM 401 CB PHE A 24 25.512 21.478 22.435 1.00 0.00 C ATOM 402 CG PHE A 24 26.459 21.777 23.592 1.00 0.00 C ATOM 403 CD1 PHE A 24 26.118 21.429 24.916 1.00 0.00 C ATOM 404 CD2 PHE A 24 27.646 22.500 23.359 1.00 0.00 C ATOM 405 CE1 PHE A 24 26.955 21.797 25.987 1.00 0.00 C ATOM 406 CE2 PHE A 24 28.489 22.854 24.428 1.00 0.00 C ATOM 407 CZ PHE A 24 28.139 22.508 25.743 1.00 0.00 C ATOM 0 H PHE A 24 26.773 19.362 21.647 1.00 0.00 H new ATOM 0 HA PHE A 24 24.436 19.833 23.321 1.00 0.00 H new ATOM 0 HB2 PHE A 24 26.044 21.667 21.503 1.00 0.00 H new ATOM 0 HB3 PHE A 24 24.686 22.187 22.480 1.00 0.00 H new ATOM 0 HD1 PHE A 24 25.210 20.877 25.109 1.00 0.00 H new ATOM 0 HD2 PHE A 24 27.911 22.785 22.351 1.00 0.00 H new ATOM 0 HE1 PHE A 24 26.685 21.531 26.998 1.00 0.00 H new ATOM 0 HE2 PHE A 24 29.406 23.392 24.237 1.00 0.00 H new ATOM 0 HZ PHE A 24 28.780 22.789 26.565 1.00 0.00 H new ATOM 417 N SER A 25 24.021 19.287 20.174 1.00 0.00 N ATOM 418 CA SER A 25 23.022 19.091 19.100 1.00 0.00 C ATOM 419 C SER A 25 21.599 18.720 19.550 1.00 0.00 C ATOM 420 O SER A 25 20.662 19.351 19.060 1.00 0.00 O ATOM 421 CB SER A 25 23.479 18.012 18.109 1.00 0.00 C ATOM 422 OG SER A 25 24.322 18.587 17.135 1.00 0.00 O ATOM 0 H SER A 25 24.918 18.850 19.962 1.00 0.00 H new ATOM 0 HA SER A 25 22.964 20.080 18.646 1.00 0.00 H new ATOM 0 HB2 SER A 25 24.007 17.219 18.638 1.00 0.00 H new ATOM 0 HB3 SER A 25 22.613 17.554 17.630 1.00 0.00 H new ATOM 0 HG SER A 25 25.246 18.588 17.462 1.00 0.00 H new ATOM 428 N PRO A 26 21.368 17.754 20.464 1.00 0.00 N ATOM 429 CA PRO A 26 20.005 17.398 20.870 1.00 0.00 C ATOM 430 C PRO A 26 19.318 18.462 21.740 1.00 0.00 C ATOM 431 O PRO A 26 18.102 18.407 21.928 1.00 0.00 O ATOM 432 CB PRO A 26 20.143 16.070 21.609 1.00 0.00 C ATOM 433 CG PRO A 26 21.557 16.114 22.180 1.00 0.00 C ATOM 434 CD PRO A 26 22.332 16.863 21.101 1.00 0.00 C ATOM 0 HA PRO A 26 19.358 17.325 19.996 1.00 0.00 H new ATOM 0 HB2 PRO A 26 19.397 15.972 22.397 1.00 0.00 H new ATOM 0 HB3 PRO A 26 20.010 15.223 20.936 1.00 0.00 H new ATOM 0 HG2 PRO A 26 21.591 16.634 23.137 1.00 0.00 H new ATOM 0 HG3 PRO A 26 21.958 15.114 22.346 1.00 0.00 H new ATOM 0 HD2 PRO A 26 23.159 17.427 21.534 1.00 0.00 H new ATOM 0 HD3 PRO A 26 22.762 16.171 20.377 1.00 0.00 H new ATOM 442 N TYR A 27 20.068 19.434 22.258 1.00 0.00 N ATOM 443 CA TYR A 27 19.563 20.519 23.098 1.00 0.00 C ATOM 444 C TYR A 27 19.493 21.862 22.367 1.00 0.00 C ATOM 445 O TYR A 27 18.667 22.698 22.738 1.00 0.00 O ATOM 446 CB TYR A 27 20.447 20.618 24.344 1.00 0.00 C ATOM 447 CG TYR A 27 20.470 19.350 25.176 1.00 0.00 C ATOM 448 CD1 TYR A 27 19.285 18.906 25.795 1.00 0.00 C ATOM 449 CD2 TYR A 27 21.654 18.599 25.305 1.00 0.00 C ATOM 450 CE1 TYR A 27 19.283 17.717 26.544 1.00 0.00 C ATOM 451 CE2 TYR A 27 21.656 17.411 26.062 1.00 0.00 C ATOM 452 CZ TYR A 27 20.473 16.973 26.693 1.00 0.00 C ATOM 453 OH TYR A 27 20.472 15.841 27.448 1.00 0.00 O ATOM 0 H TYR A 27 21.074 19.490 22.100 1.00 0.00 H new ATOM 0 HA TYR A 27 18.536 20.285 23.377 1.00 0.00 H new ATOM 0 HB2 TYR A 27 21.465 20.860 24.038 1.00 0.00 H new ATOM 0 HB3 TYR A 27 20.095 21.443 24.964 1.00 0.00 H new ATOM 0 HD1 TYR A 27 18.376 19.481 25.694 1.00 0.00 H new ATOM 0 HD2 TYR A 27 22.561 18.934 24.823 1.00 0.00 H new ATOM 0 HE1 TYR A 27 18.370 17.372 27.006 1.00 0.00 H new ATOM 0 HE2 TYR A 27 22.564 16.835 26.159 1.00 0.00 H new ATOM 0 HH TYR A 27 21.369 15.447 27.448 1.00 0.00 H new ATOM 463 N GLY A 28 20.314 22.080 21.329 1.00 0.00 N ATOM 464 CA GLY A 28 20.415 23.388 20.693 1.00 0.00 C ATOM 465 C GLY A 28 20.754 23.451 19.204 1.00 0.00 C ATOM 466 O GLY A 28 21.293 22.527 18.595 1.00 0.00 O ATOM 0 H GLY A 28 20.914 21.365 20.918 1.00 0.00 H new ATOM 0 HA2 GLY A 28 19.465 23.902 20.839 1.00 0.00 H new ATOM 0 HA3 GLY A 28 21.172 23.960 21.230 1.00 0.00 H new ATOM 470 N HIS A 29 20.399 24.598 18.620 1.00 0.00 N ATOM 471 CA HIS A 29 20.325 24.837 17.174 1.00 0.00 C ATOM 472 C HIS A 29 21.644 25.318 16.540 1.00 0.00 C ATOM 473 O HIS A 29 21.838 25.069 15.351 1.00 0.00 O ATOM 474 CB HIS A 29 19.150 25.795 16.903 1.00 0.00 C ATOM 475 CG HIS A 29 17.783 25.178 17.111 1.00 0.00 C ATOM 476 ND1 HIS A 29 17.198 24.832 18.340 1.00 0.00 N ATOM 477 CD2 HIS A 29 16.914 24.848 16.114 1.00 0.00 C ATOM 478 CE1 HIS A 29 15.982 24.335 18.041 1.00 0.00 C ATOM 479 NE2 HIS A 29 15.791 24.329 16.713 1.00 0.00 N ATOM 0 H HIS A 29 20.144 25.422 19.164 1.00 0.00 H new ATOM 0 HA HIS A 29 20.147 23.881 16.681 1.00 0.00 H new ATOM 0 HB2 HIS A 29 19.247 26.663 17.554 1.00 0.00 H new ATOM 0 HB3 HIS A 29 19.220 26.157 15.877 1.00 0.00 H new ATOM 0 HD2 HIS A 29 17.077 24.971 15.054 1.00 0.00 H new ATOM 0 HE1 HIS A 29 15.262 23.990 18.768 1.00 0.00 H new ATOM 0 HE2 HIS A 29 14.956 23.996 16.231 1.00 0.00 H new ATOM 487 N ILE A 30 22.557 25.899 17.338 1.00 0.00 N ATOM 488 CA ILE A 30 23.946 26.318 17.009 1.00 0.00 C ATOM 489 C ILE A 30 24.106 27.419 15.929 1.00 0.00 C ATOM 490 O ILE A 30 23.239 27.617 15.081 1.00 0.00 O ATOM 491 CB ILE A 30 24.849 25.067 16.787 1.00 0.00 C ATOM 492 CG1 ILE A 30 26.062 25.010 17.752 1.00 0.00 C ATOM 493 CG2 ILE A 30 25.265 24.850 15.320 1.00 0.00 C ATOM 494 CD1 ILE A 30 27.337 25.764 17.353 1.00 0.00 C ATOM 0 H ILE A 30 22.332 26.108 18.311 1.00 0.00 H new ATOM 0 HA ILE A 30 24.304 26.851 17.890 1.00 0.00 H new ATOM 0 HB ILE A 30 24.209 24.222 17.041 1.00 0.00 H new ATOM 0 HG12 ILE A 30 25.737 25.393 18.720 1.00 0.00 H new ATOM 0 HG13 ILE A 30 26.325 23.962 17.896 1.00 0.00 H new ATOM 0 HG21 ILE A 30 25.891 23.961 15.247 1.00 0.00 H new ATOM 0 HG22 ILE A 30 24.375 24.718 14.705 1.00 0.00 H new ATOM 0 HG23 ILE A 30 25.824 25.717 14.968 1.00 0.00 H new ATOM 0 HD11 ILE A 30 28.095 25.631 18.125 1.00 0.00 H new ATOM 0 HD12 ILE A 30 27.710 25.372 16.407 1.00 0.00 H new ATOM 0 HD13 ILE A 30 27.113 26.825 17.243 1.00 0.00 H new ATOM 506 N MET A 31 25.242 28.131 15.964 1.00 0.00 N ATOM 507 CA MET A 31 25.763 28.984 14.879 1.00 0.00 C ATOM 508 C MET A 31 27.249 28.684 14.594 1.00 0.00 C ATOM 509 O MET A 31 27.566 28.104 13.553 1.00 0.00 O ATOM 510 CB MET A 31 25.563 30.483 15.188 1.00 0.00 C ATOM 511 CG MET A 31 24.142 31.023 15.001 1.00 0.00 C ATOM 512 SD MET A 31 23.725 31.498 13.300 1.00 0.00 S ATOM 513 CE MET A 31 22.827 30.028 12.751 1.00 0.00 C ATOM 0 H MET A 31 25.850 28.130 16.783 1.00 0.00 H new ATOM 0 HA MET A 31 25.189 28.747 13.983 1.00 0.00 H new ATOM 0 HB2 MET A 31 25.867 30.665 16.219 1.00 0.00 H new ATOM 0 HB3 MET A 31 26.236 31.058 14.551 1.00 0.00 H new ATOM 0 HG2 MET A 31 23.434 30.265 15.335 1.00 0.00 H new ATOM 0 HG3 MET A 31 24.010 31.890 15.648 1.00 0.00 H new ATOM 0 HE1 MET A 31 22.002 30.326 12.104 1.00 0.00 H new ATOM 0 HE2 MET A 31 23.502 29.374 12.199 1.00 0.00 H new ATOM 0 HE3 MET A 31 22.435 29.496 13.618 1.00 0.00 H new ATOM 523 N GLN A 32 28.163 29.064 15.497 1.00 0.00 N ATOM 524 CA GLN A 32 29.621 29.107 15.273 1.00 0.00 C ATOM 525 C GLN A 32 30.403 28.858 16.577 1.00 0.00 C ATOM 526 O GLN A 32 29.854 28.978 17.668 1.00 0.00 O ATOM 527 CB GLN A 32 29.984 30.477 14.654 1.00 0.00 C ATOM 528 CG GLN A 32 31.452 30.654 14.225 1.00 0.00 C ATOM 529 CD GLN A 32 31.879 29.604 13.209 1.00 0.00 C ATOM 530 OE1 GLN A 32 32.334 28.517 13.555 1.00 0.00 O ATOM 531 NE2 GLN A 32 31.669 29.848 11.938 1.00 0.00 N ATOM 0 H GLN A 32 27.902 29.361 16.437 1.00 0.00 H new ATOM 0 HA GLN A 32 29.903 28.309 14.586 1.00 0.00 H new ATOM 0 HB2 GLN A 32 29.349 30.640 13.783 1.00 0.00 H new ATOM 0 HB3 GLN A 32 29.740 31.256 15.376 1.00 0.00 H new ATOM 0 HG2 GLN A 32 31.588 31.648 13.798 1.00 0.00 H new ATOM 0 HG3 GLN A 32 32.096 30.593 15.102 1.00 0.00 H new ATOM 0 HE21 GLN A 32 31.291 30.750 11.647 1.00 0.00 H new ATOM 0 HE22 GLN A 32 31.883 29.136 11.240 1.00 0.00 H new ATOM 540 N ILE A 33 31.691 28.524 16.490 1.00 0.00 N ATOM 541 CA ILE A 33 32.528 28.138 17.637 1.00 0.00 C ATOM 542 C ILE A 33 33.716 29.080 17.858 1.00 0.00 C ATOM 543 O ILE A 33 34.335 29.539 16.900 1.00 0.00 O ATOM 544 CB ILE A 33 32.996 26.676 17.477 1.00 0.00 C ATOM 545 CG1 ILE A 33 33.998 26.483 16.312 1.00 0.00 C ATOM 546 CG2 ILE A 33 31.778 25.754 17.296 1.00 0.00 C ATOM 547 CD1 ILE A 33 35.450 26.385 16.800 1.00 0.00 C ATOM 0 H ILE A 33 32.196 28.513 15.604 1.00 0.00 H new ATOM 0 HA ILE A 33 31.911 28.223 18.531 1.00 0.00 H new ATOM 0 HB ILE A 33 33.530 26.410 18.390 1.00 0.00 H new ATOM 0 HG12 ILE A 33 33.741 25.578 15.761 1.00 0.00 H new ATOM 0 HG13 ILE A 33 33.907 27.317 15.616 1.00 0.00 H new ATOM 0 HG21 ILE A 33 32.115 24.724 17.184 1.00 0.00 H new ATOM 0 HG22 ILE A 33 31.131 25.831 18.170 1.00 0.00 H new ATOM 0 HG23 ILE A 33 31.224 26.054 16.406 1.00 0.00 H new ATOM 0 HD11 ILE A 33 36.113 26.250 15.945 1.00 0.00 H new ATOM 0 HD12 ILE A 33 35.719 27.300 17.327 1.00 0.00 H new ATOM 0 HD13 ILE A 33 35.551 25.535 17.475 1.00 0.00 H new ATOM 559 N ASN A 34 34.084 29.293 19.125 1.00 0.00 N ATOM 560 CA ASN A 34 35.397 29.784 19.552 1.00 0.00 C ATOM 561 C ASN A 34 35.750 29.154 20.916 1.00 0.00 C ATOM 562 O ASN A 34 34.889 29.061 21.797 1.00 0.00 O ATOM 563 CB ASN A 34 35.402 31.322 19.651 1.00 0.00 C ATOM 564 CG ASN A 34 35.105 32.049 18.355 1.00 0.00 C ATOM 565 OD1 ASN A 34 34.034 32.615 18.172 1.00 0.00 O ATOM 566 ND2 ASN A 34 36.035 32.079 17.432 1.00 0.00 N ATOM 0 H ASN A 34 33.454 29.122 19.909 1.00 0.00 H new ATOM 0 HA ASN A 34 36.145 29.497 18.813 1.00 0.00 H new ATOM 0 HB2 ASN A 34 34.667 31.625 20.397 1.00 0.00 H new ATOM 0 HB3 ASN A 34 36.377 31.644 20.015 1.00 0.00 H new ATOM 0 HD21 ASN A 34 35.869 32.575 16.556 1.00 0.00 H new ATOM 0 HD22 ASN A 34 36.925 31.606 17.589 1.00 0.00 H new ATOM 573 N ILE A 35 37.003 28.724 21.105 1.00 0.00 N ATOM 574 CA ILE A 35 37.533 28.199 22.379 1.00 0.00 C ATOM 575 C ILE A 35 38.952 28.746 22.569 1.00 0.00 C ATOM 576 O ILE A 35 39.819 28.534 21.714 1.00 0.00 O ATOM 577 CB ILE A 35 37.513 26.646 22.424 1.00 0.00 C ATOM 578 CG1 ILE A 35 36.073 26.084 22.364 1.00 0.00 C ATOM 579 CG2 ILE A 35 38.218 26.132 23.697 1.00 0.00 C ATOM 580 CD1 ILE A 35 35.988 24.554 22.275 1.00 0.00 C ATOM 0 H ILE A 35 37.699 28.730 20.359 1.00 0.00 H new ATOM 0 HA ILE A 35 36.894 28.530 23.198 1.00 0.00 H new ATOM 0 HB ILE A 35 38.050 26.293 21.543 1.00 0.00 H new ATOM 0 HG12 ILE A 35 35.531 26.414 23.250 1.00 0.00 H new ATOM 0 HG13 ILE A 35 35.565 26.514 21.501 1.00 0.00 H new ATOM 0 HG21 ILE A 35 38.194 25.042 23.711 1.00 0.00 H new ATOM 0 HG22 ILE A 35 39.253 26.472 23.702 1.00 0.00 H new ATOM 0 HG23 ILE A 35 37.705 26.518 24.578 1.00 0.00 H new ATOM 0 HD11 ILE A 35 34.942 24.249 22.237 1.00 0.00 H new ATOM 0 HD12 ILE A 35 36.498 24.213 21.374 1.00 0.00 H new ATOM 0 HD13 ILE A 35 36.463 24.112 23.150 1.00 0.00 H new ATOM 592 N LYS A 36 39.181 29.439 23.690 1.00 0.00 N ATOM 593 CA LYS A 36 40.442 30.106 24.048 1.00 0.00 C ATOM 594 C LYS A 36 40.506 30.315 25.563 1.00 0.00 C ATOM 595 O LYS A 36 39.472 30.424 26.219 1.00 0.00 O ATOM 596 CB LYS A 36 40.523 31.432 23.267 1.00 0.00 C ATOM 597 CG LYS A 36 41.792 32.256 23.523 1.00 0.00 C ATOM 598 CD LYS A 36 41.966 33.398 22.512 1.00 0.00 C ATOM 599 CE LYS A 36 40.848 34.443 22.591 1.00 0.00 C ATOM 600 NZ LYS A 36 41.142 35.625 21.747 1.00 0.00 N ATOM 0 H LYS A 36 38.463 29.557 24.405 1.00 0.00 H new ATOM 0 HA LYS A 36 41.302 29.493 23.778 1.00 0.00 H new ATOM 0 HB2 LYS A 36 40.458 31.214 22.201 1.00 0.00 H new ATOM 0 HB3 LYS A 36 39.655 32.040 23.521 1.00 0.00 H new ATOM 0 HG2 LYS A 36 41.755 32.670 24.531 1.00 0.00 H new ATOM 0 HG3 LYS A 36 42.662 31.601 23.479 1.00 0.00 H new ATOM 0 HD2 LYS A 36 42.925 33.886 22.685 1.00 0.00 H new ATOM 0 HD3 LYS A 36 41.997 32.983 21.505 1.00 0.00 H new ATOM 0 HE2 LYS A 36 39.907 33.994 22.273 1.00 0.00 H new ATOM 0 HE3 LYS A 36 40.717 34.758 23.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 40.364 36.310 21.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 42.027 36.068 22.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 41.242 35.327 20.756 1.00 0.00 H new ATOM 614 N ASN A 37 41.718 30.419 26.115 1.00 0.00 N ATOM 615 CA ASN A 37 41.952 30.561 27.556 1.00 0.00 C ATOM 616 C ASN A 37 41.347 29.370 28.351 1.00 0.00 C ATOM 617 O ASN A 37 41.230 28.261 27.823 1.00 0.00 O ATOM 618 CB ASN A 37 41.473 31.975 27.974 1.00 0.00 C ATOM 619 CG ASN A 37 42.063 32.430 29.288 1.00 0.00 C ATOM 620 OD1 ASN A 37 41.428 32.362 30.328 1.00 0.00 O ATOM 621 ND2 ASN A 37 43.303 32.846 29.292 1.00 0.00 N ATOM 0 H ASN A 37 42.577 30.407 25.566 1.00 0.00 H new ATOM 0 HA ASN A 37 43.011 30.500 27.805 1.00 0.00 H new ATOM 0 HB2 ASN A 37 41.740 32.689 27.195 1.00 0.00 H new ATOM 0 HB3 ASN A 37 40.386 31.977 28.049 1.00 0.00 H new ATOM 0 HD21 ASN A 37 43.747 33.117 30.169 1.00 0.00 H new ATOM 0 HD22 ASN A 37 43.826 32.899 28.418 1.00 0.00 H new ATOM 628 N ALA A 38 40.955 29.573 29.611 1.00 0.00 N ATOM 629 CA ALA A 38 40.308 28.568 30.458 1.00 0.00 C ATOM 630 C ALA A 38 38.777 28.458 30.235 1.00 0.00 C ATOM 631 O ALA A 38 38.046 28.108 31.166 1.00 0.00 O ATOM 632 CB ALA A 38 40.689 28.872 31.915 1.00 0.00 C ATOM 0 H ALA A 38 41.083 30.468 30.084 1.00 0.00 H new ATOM 0 HA ALA A 38 40.670 27.578 30.182 1.00 0.00 H new ATOM 0 HB1 ALA A 38 40.222 28.140 32.574 1.00 0.00 H new ATOM 0 HB2 ALA A 38 41.772 28.821 32.026 1.00 0.00 H new ATOM 0 HB3 ALA A 38 40.344 29.871 32.181 1.00 0.00 H new ATOM 638 N PHE A 39 38.277 28.833 29.051 1.00 0.00 N ATOM 639 CA PHE A 39 36.861 29.114 28.776 1.00 0.00 C ATOM 640 C PHE A 39 36.435 28.649 27.365 1.00 0.00 C ATOM 641 O PHE A 39 37.264 28.291 26.526 1.00 0.00 O ATOM 642 CB PHE A 39 36.629 30.632 28.933 1.00 0.00 C ATOM 643 CG PHE A 39 36.755 31.195 30.343 1.00 0.00 C ATOM 644 CD1 PHE A 39 38.009 31.586 30.849 1.00 0.00 C ATOM 645 CD2 PHE A 39 35.611 31.358 31.147 1.00 0.00 C ATOM 646 CE1 PHE A 39 38.124 32.081 32.161 1.00 0.00 C ATOM 647 CE2 PHE A 39 35.724 31.849 32.461 1.00 0.00 C ATOM 648 CZ PHE A 39 36.984 32.204 32.972 1.00 0.00 C ATOM 0 H PHE A 39 38.868 28.954 28.228 1.00 0.00 H new ATOM 0 HA PHE A 39 36.250 28.556 29.485 1.00 0.00 H new ATOM 0 HB2 PHE A 39 37.339 31.154 28.292 1.00 0.00 H new ATOM 0 HB3 PHE A 39 35.632 30.865 28.560 1.00 0.00 H new ATOM 0 HD1 PHE A 39 38.888 31.506 30.227 1.00 0.00 H new ATOM 0 HD2 PHE A 39 34.638 31.104 30.752 1.00 0.00 H new ATOM 0 HE1 PHE A 39 39.092 32.367 32.546 1.00 0.00 H new ATOM 0 HE2 PHE A 39 34.843 31.953 33.076 1.00 0.00 H new ATOM 0 HZ PHE A 39 37.075 32.570 33.984 1.00 0.00 H new ATOM 658 N GLY A 40 35.128 28.672 27.086 1.00 0.00 N ATOM 659 CA GLY A 40 34.547 28.475 25.751 1.00 0.00 C ATOM 660 C GLY A 40 33.507 29.547 25.414 1.00 0.00 C ATOM 661 O GLY A 40 32.727 29.944 26.281 1.00 0.00 O ATOM 0 H GLY A 40 34.422 28.833 27.804 1.00 0.00 H new ATOM 0 HA2 GLY A 40 35.341 28.492 25.004 1.00 0.00 H new ATOM 0 HA3 GLY A 40 34.082 27.490 25.700 1.00 0.00 H new ATOM 665 N PHE A 41 33.489 30.008 24.158 1.00 0.00 N ATOM 666 CA PHE A 41 32.722 31.174 23.698 1.00 0.00 C ATOM 667 C PHE A 41 31.928 30.830 22.422 1.00 0.00 C ATOM 668 O PHE A 41 32.285 31.223 21.309 1.00 0.00 O ATOM 669 CB PHE A 41 33.684 32.360 23.475 1.00 0.00 C ATOM 670 CG PHE A 41 34.725 32.608 24.551 1.00 0.00 C ATOM 671 CD1 PHE A 41 34.336 32.874 25.877 1.00 0.00 C ATOM 672 CD2 PHE A 41 36.094 32.590 24.220 1.00 0.00 C ATOM 673 CE1 PHE A 41 35.309 33.127 26.861 1.00 0.00 C ATOM 674 CE2 PHE A 41 37.064 32.849 25.204 1.00 0.00 C ATOM 675 CZ PHE A 41 36.671 33.122 26.523 1.00 0.00 C ATOM 0 H PHE A 41 34.024 29.567 23.410 1.00 0.00 H new ATOM 0 HA PHE A 41 31.995 31.460 24.458 1.00 0.00 H new ATOM 0 HB2 PHE A 41 34.203 32.203 22.530 1.00 0.00 H new ATOM 0 HB3 PHE A 41 33.087 33.265 23.364 1.00 0.00 H new ATOM 0 HD1 PHE A 41 33.288 32.884 26.140 1.00 0.00 H new ATOM 0 HD2 PHE A 41 36.400 32.376 23.206 1.00 0.00 H new ATOM 0 HE1 PHE A 41 35.007 33.326 27.879 1.00 0.00 H new ATOM 0 HE2 PHE A 41 38.112 32.838 24.945 1.00 0.00 H new ATOM 0 HZ PHE A 41 37.416 33.328 27.277 1.00 0.00 H new ATOM 685 N ILE A 42 30.869 30.032 22.554 1.00 0.00 N ATOM 686 CA ILE A 42 30.178 29.408 21.419 1.00 0.00 C ATOM 687 C ILE A 42 28.974 30.265 20.998 1.00 0.00 C ATOM 688 O ILE A 42 28.131 30.627 21.815 1.00 0.00 O ATOM 689 CB ILE A 42 29.786 27.948 21.746 1.00 0.00 C ATOM 690 CG1 ILE A 42 30.955 27.114 22.336 1.00 0.00 C ATOM 691 CG2 ILE A 42 29.270 27.272 20.463 1.00 0.00 C ATOM 692 CD1 ILE A 42 30.497 25.815 23.011 1.00 0.00 C ATOM 0 H ILE A 42 30.461 29.796 23.459 1.00 0.00 H new ATOM 0 HA ILE A 42 30.857 29.361 20.567 1.00 0.00 H new ATOM 0 HB ILE A 42 29.012 27.985 22.513 1.00 0.00 H new ATOM 0 HG12 ILE A 42 31.658 26.872 21.538 1.00 0.00 H new ATOM 0 HG13 ILE A 42 31.494 27.722 23.063 1.00 0.00 H new ATOM 0 HG21 ILE A 42 28.991 26.241 20.682 1.00 0.00 H new ATOM 0 HG22 ILE A 42 28.400 27.813 20.092 1.00 0.00 H new ATOM 0 HG23 ILE A 42 30.054 27.282 19.706 1.00 0.00 H new ATOM 0 HD11 ILE A 42 31.364 25.282 23.401 1.00 0.00 H new ATOM 0 HD12 ILE A 42 29.818 26.051 23.830 1.00 0.00 H new ATOM 0 HD13 ILE A 42 29.983 25.188 22.282 1.00 0.00 H new ATOM 704 N GLN A 43 28.861 30.571 19.710 1.00 0.00 N ATOM 705 CA GLN A 43 27.725 31.278 19.121 1.00 0.00 C ATOM 706 C GLN A 43 26.620 30.274 18.762 1.00 0.00 C ATOM 707 O GLN A 43 26.877 29.206 18.205 1.00 0.00 O ATOM 708 CB GLN A 43 28.179 32.068 17.884 1.00 0.00 C ATOM 709 CG GLN A 43 29.333 33.056 18.149 1.00 0.00 C ATOM 710 CD GLN A 43 28.947 34.232 19.042 1.00 0.00 C ATOM 711 OE1 GLN A 43 27.796 34.635 19.144 1.00 0.00 O ATOM 712 NE2 GLN A 43 29.885 34.850 19.723 1.00 0.00 N ATOM 0 H GLN A 43 29.577 30.328 19.026 1.00 0.00 H new ATOM 0 HA GLN A 43 27.323 31.987 19.845 1.00 0.00 H new ATOM 0 HB2 GLN A 43 28.489 31.364 17.112 1.00 0.00 H new ATOM 0 HB3 GLN A 43 27.327 32.621 17.488 1.00 0.00 H new ATOM 0 HG2 GLN A 43 30.160 32.518 18.611 1.00 0.00 H new ATOM 0 HG3 GLN A 43 29.696 33.440 17.196 1.00 0.00 H new ATOM 0 HE21 GLN A 43 30.853 34.536 19.658 1.00 0.00 H new ATOM 0 HE22 GLN A 43 29.645 35.644 20.317 1.00 0.00 H new ATOM 721 N PHE A 44 25.373 30.620 19.053 1.00 0.00 N ATOM 722 CA PHE A 44 24.214 29.737 18.946 1.00 0.00 C ATOM 723 C PHE A 44 23.035 30.402 18.234 1.00 0.00 C ATOM 724 O PHE A 44 23.007 31.612 18.025 1.00 0.00 O ATOM 725 CB PHE A 44 23.817 29.260 20.352 1.00 0.00 C ATOM 726 CG PHE A 44 24.329 27.882 20.721 1.00 0.00 C ATOM 727 CD1 PHE A 44 25.655 27.710 21.152 1.00 0.00 C ATOM 728 CD2 PHE A 44 23.463 26.773 20.672 1.00 0.00 C ATOM 729 CE1 PHE A 44 26.108 26.435 21.532 1.00 0.00 C ATOM 730 CE2 PHE A 44 23.919 25.497 21.047 1.00 0.00 C ATOM 731 CZ PHE A 44 25.243 25.329 21.482 1.00 0.00 C ATOM 0 H PHE A 44 25.130 31.555 19.381 1.00 0.00 H new ATOM 0 HA PHE A 44 24.491 28.880 18.332 1.00 0.00 H new ATOM 0 HB2 PHE A 44 24.188 29.978 21.083 1.00 0.00 H new ATOM 0 HB3 PHE A 44 22.730 29.261 20.428 1.00 0.00 H new ATOM 0 HD1 PHE A 44 26.325 28.556 21.191 1.00 0.00 H new ATOM 0 HD2 PHE A 44 22.442 26.903 20.344 1.00 0.00 H new ATOM 0 HE1 PHE A 44 27.127 26.305 21.864 1.00 0.00 H new ATOM 0 HE2 PHE A 44 23.252 24.648 21.001 1.00 0.00 H new ATOM 0 HZ PHE A 44 25.596 24.352 21.778 1.00 0.00 H new ATOM 741 N ASP A 45 22.031 29.593 17.918 1.00 0.00 N ATOM 742 CA ASP A 45 20.684 30.042 17.585 1.00 0.00 C ATOM 743 C ASP A 45 19.713 29.596 18.697 1.00 0.00 C ATOM 744 O ASP A 45 19.917 28.523 19.268 1.00 0.00 O ATOM 745 CB ASP A 45 20.320 29.488 16.205 1.00 0.00 C ATOM 746 CG ASP A 45 18.957 29.988 15.753 1.00 0.00 C ATOM 747 OD1 ASP A 45 18.877 31.114 15.212 1.00 0.00 O ATOM 748 OD2 ASP A 45 17.953 29.274 15.960 1.00 0.00 O ATOM 0 H ASP A 45 22.134 28.579 17.885 1.00 0.00 H new ATOM 0 HA ASP A 45 20.620 31.129 17.531 1.00 0.00 H new ATOM 0 HB2 ASP A 45 21.078 29.785 15.480 1.00 0.00 H new ATOM 0 HB3 ASP A 45 20.318 28.398 16.237 1.00 0.00 H new ATOM 753 N ASN A 46 18.681 30.399 18.991 1.00 0.00 N ATOM 754 CA ASN A 46 17.695 30.238 20.081 1.00 0.00 C ATOM 755 C ASN A 46 18.293 30.244 21.523 1.00 0.00 C ATOM 756 O ASN A 46 19.058 29.346 21.878 1.00 0.00 O ATOM 757 CB ASN A 46 16.812 28.988 19.840 1.00 0.00 C ATOM 758 CG ASN A 46 15.602 29.201 18.956 1.00 0.00 C ATOM 759 OD1 ASN A 46 14.478 29.285 19.431 1.00 0.00 O ATOM 760 ND2 ASN A 46 15.768 29.286 17.662 1.00 0.00 N ATOM 0 H ASN A 46 18.496 31.237 18.439 1.00 0.00 H new ATOM 0 HA ASN A 46 17.075 31.134 20.041 1.00 0.00 H new ATOM 0 HB2 ASN A 46 17.431 28.208 19.396 1.00 0.00 H new ATOM 0 HB3 ASN A 46 16.472 28.614 20.806 1.00 0.00 H new ATOM 0 HD21 ASN A 46 14.962 29.422 17.052 1.00 0.00 H new ATOM 0 HD22 ASN A 46 16.704 29.216 17.262 1.00 0.00 H new ATOM 767 N PRO A 47 17.863 31.149 22.433 1.00 0.00 N ATOM 768 CA PRO A 47 18.365 31.188 23.818 1.00 0.00 C ATOM 769 C PRO A 47 17.909 29.983 24.650 1.00 0.00 C ATOM 770 O PRO A 47 18.688 29.447 25.434 1.00 0.00 O ATOM 771 CB PRO A 47 17.853 32.500 24.416 1.00 0.00 C ATOM 772 CG PRO A 47 16.586 32.776 23.612 1.00 0.00 C ATOM 773 CD PRO A 47 16.878 32.201 22.227 1.00 0.00 C ATOM 0 HA PRO A 47 19.454 31.137 23.825 1.00 0.00 H new ATOM 0 HB2 PRO A 47 17.641 32.402 25.481 1.00 0.00 H new ATOM 0 HB3 PRO A 47 18.582 33.303 24.308 1.00 0.00 H new ATOM 0 HG2 PRO A 47 15.717 32.299 24.065 1.00 0.00 H new ATOM 0 HG3 PRO A 47 16.373 33.844 23.561 1.00 0.00 H new ATOM 0 HD2 PRO A 47 15.972 31.804 21.770 1.00 0.00 H new ATOM 0 HD3 PRO A 47 17.262 32.970 21.557 1.00 0.00 H new ATOM 781 N GLN A 48 16.692 29.475 24.408 1.00 0.00 N ATOM 782 CA GLN A 48 16.199 28.218 24.991 1.00 0.00 C ATOM 783 C GLN A 48 17.086 27.010 24.628 1.00 0.00 C ATOM 784 O GLN A 48 17.155 26.031 25.369 1.00 0.00 O ATOM 785 CB GLN A 48 14.766 27.959 24.518 1.00 0.00 C ATOM 786 CG GLN A 48 13.777 29.011 25.043 1.00 0.00 C ATOM 787 CD GLN A 48 12.334 28.680 24.686 1.00 0.00 C ATOM 788 OE1 GLN A 48 11.998 27.600 24.210 1.00 0.00 O ATOM 789 NE2 GLN A 48 11.417 29.594 24.890 1.00 0.00 N ATOM 0 H GLN A 48 16.015 29.930 23.796 1.00 0.00 H new ATOM 0 HA GLN A 48 16.228 28.331 26.075 1.00 0.00 H new ATOM 0 HB2 GLN A 48 14.741 27.953 23.428 1.00 0.00 H new ATOM 0 HB3 GLN A 48 14.450 26.970 24.849 1.00 0.00 H new ATOM 0 HG2 GLN A 48 13.872 29.087 26.126 1.00 0.00 H new ATOM 0 HG3 GLN A 48 14.036 29.987 24.631 1.00 0.00 H new ATOM 0 HE21 GLN A 48 11.677 30.498 25.285 1.00 0.00 H new ATOM 0 HE22 GLN A 48 10.444 29.401 24.654 1.00 0.00 H new ATOM 798 N SER A 49 17.800 27.113 23.507 1.00 0.00 N ATOM 799 CA SER A 49 18.747 26.126 22.993 1.00 0.00 C ATOM 800 C SER A 49 20.125 26.253 23.657 1.00 0.00 C ATOM 801 O SER A 49 20.715 25.245 24.041 1.00 0.00 O ATOM 802 CB SER A 49 18.748 26.264 21.463 1.00 0.00 C ATOM 803 OG SER A 49 20.017 26.453 20.879 1.00 0.00 O ATOM 0 H SER A 49 17.729 27.931 22.902 1.00 0.00 H new ATOM 0 HA SER A 49 18.447 25.109 23.247 1.00 0.00 H new ATOM 0 HB2 SER A 49 18.297 25.369 21.033 1.00 0.00 H new ATOM 0 HB3 SER A 49 18.111 27.105 21.189 1.00 0.00 H new ATOM 0 HG SER A 49 20.060 27.343 20.472 1.00 0.00 H new ATOM 809 N VAL A 50 20.584 27.486 23.913 1.00 0.00 N ATOM 810 CA VAL A 50 21.771 27.768 24.739 1.00 0.00 C ATOM 811 C VAL A 50 21.601 27.248 26.164 1.00 0.00 C ATOM 812 O VAL A 50 22.432 26.475 26.639 1.00 0.00 O ATOM 813 CB VAL A 50 22.076 29.279 24.770 1.00 0.00 C ATOM 814 CG1 VAL A 50 23.128 29.651 25.817 1.00 0.00 C ATOM 815 CG2 VAL A 50 22.598 29.723 23.410 1.00 0.00 C ATOM 0 H VAL A 50 20.137 28.327 23.549 1.00 0.00 H new ATOM 0 HA VAL A 50 22.610 27.245 24.280 1.00 0.00 H new ATOM 0 HB VAL A 50 21.142 29.779 25.027 1.00 0.00 H new ATOM 0 HG11 VAL A 50 23.301 30.727 25.792 1.00 0.00 H new ATOM 0 HG12 VAL A 50 22.774 29.363 26.807 1.00 0.00 H new ATOM 0 HG13 VAL A 50 24.059 29.128 25.599 1.00 0.00 H new ATOM 0 HG21 VAL A 50 22.813 30.791 23.434 1.00 0.00 H new ATOM 0 HG22 VAL A 50 23.510 29.175 23.173 1.00 0.00 H new ATOM 0 HG23 VAL A 50 21.845 29.521 22.648 1.00 0.00 H new ATOM 825 N ARG A 51 20.533 27.654 26.858 1.00 0.00 N ATOM 826 CA ARG A 51 20.302 27.248 28.253 1.00 0.00 C ATOM 827 C ARG A 51 20.118 25.740 28.387 1.00 0.00 C ATOM 828 O ARG A 51 20.733 25.159 29.269 1.00 0.00 O ATOM 829 CB ARG A 51 19.164 28.062 28.893 1.00 0.00 C ATOM 830 CG ARG A 51 17.831 27.971 28.137 1.00 0.00 C ATOM 831 CD ARG A 51 16.794 27.050 28.779 1.00 0.00 C ATOM 832 NE ARG A 51 15.966 27.794 29.741 1.00 0.00 N ATOM 833 CZ ARG A 51 14.649 27.803 29.815 1.00 0.00 C ATOM 834 NH1 ARG A 51 13.873 27.100 29.048 1.00 0.00 N ATOM 835 NH2 ARG A 51 14.032 28.524 30.696 1.00 0.00 N ATOM 0 H ARG A 51 19.811 28.266 26.477 1.00 0.00 H new ATOM 0 HA ARG A 51 21.202 27.483 28.822 1.00 0.00 H new ATOM 0 HB2 ARG A 51 19.014 27.716 29.916 1.00 0.00 H new ATOM 0 HB3 ARG A 51 19.467 29.108 28.951 1.00 0.00 H new ATOM 0 HG2 ARG A 51 17.407 28.972 28.055 1.00 0.00 H new ATOM 0 HG3 ARG A 51 18.027 27.623 27.123 1.00 0.00 H new ATOM 0 HD2 ARG A 51 16.160 26.613 28.007 1.00 0.00 H new ATOM 0 HD3 ARG A 51 17.296 26.225 29.285 1.00 0.00 H new ATOM 0 HE ARG A 51 16.464 28.364 30.424 1.00 0.00 H new ATOM 0 HH11 ARG A 51 14.276 26.493 28.334 1.00 0.00 H new ATOM 0 HH12 ARG A 51 12.861 27.154 29.159 1.00 0.00 H new ATOM 0 HH21 ARG A 51 14.565 29.099 31.349 1.00 0.00 H new ATOM 0 HH22 ARG A 51 13.013 28.517 30.737 1.00 0.00 H new ATOM 849 N ASP A 52 19.384 25.076 27.494 1.00 0.00 N ATOM 850 CA ASP A 52 19.286 23.611 27.547 1.00 0.00 C ATOM 851 C ASP A 52 20.640 22.929 27.305 1.00 0.00 C ATOM 852 O ASP A 52 20.976 21.981 28.012 1.00 0.00 O ATOM 853 CB ASP A 52 18.239 23.088 26.556 1.00 0.00 C ATOM 854 CG ASP A 52 16.792 23.298 26.997 1.00 0.00 C ATOM 855 OD1 ASP A 52 16.509 23.763 28.129 1.00 0.00 O ATOM 856 OD2 ASP A 52 15.885 22.916 26.222 1.00 0.00 O ATOM 0 H ASP A 52 18.857 25.515 26.739 1.00 0.00 H new ATOM 0 HA ASP A 52 18.966 23.356 28.557 1.00 0.00 H new ATOM 0 HB2 ASP A 52 18.388 23.580 25.595 1.00 0.00 H new ATOM 0 HB3 ASP A 52 18.407 22.023 26.398 1.00 0.00 H new ATOM 861 N ALA A 53 21.453 23.430 26.372 1.00 0.00 N ATOM 862 CA ALA A 53 22.788 22.895 26.125 1.00 0.00 C ATOM 863 C ALA A 53 23.679 22.958 27.384 1.00 0.00 C ATOM 864 O ALA A 53 24.275 21.947 27.765 1.00 0.00 O ATOM 865 CB ALA A 53 23.374 23.642 24.921 1.00 0.00 C ATOM 0 H ALA A 53 21.203 24.215 25.770 1.00 0.00 H new ATOM 0 HA ALA A 53 22.735 21.832 25.888 1.00 0.00 H new ATOM 0 HB1 ALA A 53 24.374 23.264 24.710 1.00 0.00 H new ATOM 0 HB2 ALA A 53 22.736 23.486 24.051 1.00 0.00 H new ATOM 0 HB3 ALA A 53 23.428 24.707 25.145 1.00 0.00 H new ATOM 871 N ILE A 54 23.727 24.095 28.088 1.00 0.00 N ATOM 872 CA ILE A 54 24.535 24.211 29.315 1.00 0.00 C ATOM 873 C ILE A 54 23.912 23.411 30.465 1.00 0.00 C ATOM 874 O ILE A 54 24.570 22.575 31.083 1.00 0.00 O ATOM 875 CB ILE A 54 24.736 25.674 29.769 1.00 0.00 C ATOM 876 CG1 ILE A 54 25.147 26.662 28.660 1.00 0.00 C ATOM 877 CG2 ILE A 54 25.849 25.674 30.826 1.00 0.00 C ATOM 878 CD1 ILE A 54 24.839 28.127 29.012 1.00 0.00 C ATOM 0 H ILE A 54 23.221 24.944 27.834 1.00 0.00 H new ATOM 0 HA ILE A 54 25.513 23.800 29.064 1.00 0.00 H new ATOM 0 HB ILE A 54 23.768 26.018 30.134 1.00 0.00 H new ATOM 0 HG12 ILE A 54 26.215 26.558 28.466 1.00 0.00 H new ATOM 0 HG13 ILE A 54 24.629 26.400 27.738 1.00 0.00 H new ATOM 0 HG21 ILE A 54 26.021 26.693 31.173 1.00 0.00 H new ATOM 0 HG22 ILE A 54 25.551 25.049 31.668 1.00 0.00 H new ATOM 0 HG23 ILE A 54 26.766 25.280 30.389 1.00 0.00 H new ATOM 0 HD11 ILE A 54 25.152 28.772 28.191 1.00 0.00 H new ATOM 0 HD12 ILE A 54 23.768 28.244 29.177 1.00 0.00 H new ATOM 0 HD13 ILE A 54 25.378 28.405 29.917 1.00 0.00 H new ATOM 890 N GLU A 55 22.633 23.636 30.756 1.00 0.00 N ATOM 891 CA GLU A 55 21.976 23.121 31.960 1.00 0.00 C ATOM 892 C GLU A 55 21.723 21.607 31.907 1.00 0.00 C ATOM 893 O GLU A 55 21.524 20.981 32.953 1.00 0.00 O ATOM 894 CB GLU A 55 20.651 23.862 32.181 1.00 0.00 C ATOM 895 CG GLU A 55 20.824 25.376 32.388 1.00 0.00 C ATOM 896 CD GLU A 55 19.510 26.100 32.706 1.00 0.00 C ATOM 897 OE1 GLU A 55 18.415 25.485 32.695 1.00 0.00 O ATOM 898 OE2 GLU A 55 19.555 27.312 33.028 1.00 0.00 O ATOM 0 H GLU A 55 22.016 24.186 30.159 1.00 0.00 H new ATOM 0 HA GLU A 55 22.655 23.298 32.794 1.00 0.00 H new ATOM 0 HB2 GLU A 55 20.001 23.692 31.323 1.00 0.00 H new ATOM 0 HB3 GLU A 55 20.148 23.439 33.051 1.00 0.00 H new ATOM 0 HG2 GLU A 55 21.530 25.546 33.201 1.00 0.00 H new ATOM 0 HG3 GLU A 55 21.262 25.811 31.489 1.00 0.00 H new ATOM 905 N CYS A 56 21.735 21.018 30.705 1.00 0.00 N ATOM 906 CA CYS A 56 21.461 19.604 30.460 1.00 0.00 C ATOM 907 C CYS A 56 22.664 18.810 29.907 1.00 0.00 C ATOM 908 O CYS A 56 22.604 17.582 29.854 1.00 0.00 O ATOM 909 CB CYS A 56 20.241 19.523 29.535 1.00 0.00 C ATOM 910 SG CYS A 56 19.384 17.964 29.835 1.00 0.00 S ATOM 0 H CYS A 56 21.943 21.534 29.850 1.00 0.00 H new ATOM 0 HA CYS A 56 21.255 19.122 31.416 1.00 0.00 H new ATOM 0 HB2 CYS A 56 19.571 20.363 29.720 1.00 0.00 H new ATOM 0 HB3 CYS A 56 20.553 19.587 28.493 1.00 0.00 H new ATOM 0 HG CYS A 56 19.239 17.325 28.712 1.00 0.00 H new ATOM 916 N GLU A 57 23.774 19.459 29.527 1.00 0.00 N ATOM 917 CA GLU A 57 24.991 18.759 29.070 1.00 0.00 C ATOM 918 C GLU A 57 26.318 19.351 29.580 1.00 0.00 C ATOM 919 O GLU A 57 27.335 18.661 29.576 1.00 0.00 O ATOM 920 CB GLU A 57 24.964 18.641 27.539 1.00 0.00 C ATOM 921 CG GLU A 57 26.027 17.706 26.958 1.00 0.00 C ATOM 922 CD GLU A 57 25.927 16.276 27.492 1.00 0.00 C ATOM 923 OE1 GLU A 57 25.168 15.457 26.925 1.00 0.00 O ATOM 924 OE2 GLU A 57 26.659 15.898 28.437 1.00 0.00 O ATOM 0 H GLU A 57 23.857 20.476 29.526 1.00 0.00 H new ATOM 0 HA GLU A 57 24.966 17.767 29.522 1.00 0.00 H new ATOM 0 HB2 GLU A 57 23.980 18.288 27.231 1.00 0.00 H new ATOM 0 HB3 GLU A 57 25.096 19.633 27.108 1.00 0.00 H new ATOM 0 HG2 GLU A 57 25.933 17.689 25.872 1.00 0.00 H new ATOM 0 HG3 GLU A 57 27.016 18.104 27.186 1.00 0.00 H new ATOM 931 N SER A 58 26.350 20.571 30.111 1.00 0.00 N ATOM 932 CA SER A 58 27.404 21.002 31.054 1.00 0.00 C ATOM 933 C SER A 58 26.954 20.882 32.524 1.00 0.00 C ATOM 934 O SER A 58 27.721 21.172 33.439 1.00 0.00 O ATOM 935 CB SER A 58 27.912 22.401 30.706 1.00 0.00 C ATOM 936 OG SER A 58 28.313 22.462 29.347 1.00 0.00 O ATOM 0 H SER A 58 25.656 21.291 29.908 1.00 0.00 H new ATOM 0 HA SER A 58 28.246 20.318 30.944 1.00 0.00 H new ATOM 0 HB2 SER A 58 27.129 23.135 30.893 1.00 0.00 H new ATOM 0 HB3 SER A 58 28.752 22.660 31.351 1.00 0.00 H new ATOM 0 HG SER A 58 28.634 23.365 29.141 1.00 0.00 H new ATOM 942 N GLN A 59 25.725 20.393 32.741 1.00 0.00 N ATOM 943 CA GLN A 59 25.124 20.010 34.024 1.00 0.00 C ATOM 944 C GLN A 59 25.155 21.095 35.116 1.00 0.00 C ATOM 945 O GLN A 59 25.267 20.776 36.300 1.00 0.00 O ATOM 946 CB GLN A 59 25.670 18.653 34.513 1.00 0.00 C ATOM 947 CG GLN A 59 25.487 17.505 33.507 1.00 0.00 C ATOM 948 CD GLN A 59 25.799 16.139 34.114 1.00 0.00 C ATOM 949 OE1 GLN A 59 26.143 15.993 35.284 1.00 0.00 O ATOM 950 NE2 GLN A 59 25.645 15.076 33.364 1.00 0.00 N ATOM 0 H GLN A 59 25.078 20.244 31.966 1.00 0.00 H new ATOM 0 HA GLN A 59 24.060 19.894 33.818 1.00 0.00 H new ATOM 0 HB2 GLN A 59 26.731 18.760 34.737 1.00 0.00 H new ATOM 0 HB3 GLN A 59 25.172 18.388 35.446 1.00 0.00 H new ATOM 0 HG2 GLN A 59 24.461 17.509 33.139 1.00 0.00 H new ATOM 0 HG3 GLN A 59 26.135 17.673 32.647 1.00 0.00 H new ATOM 0 HE21 GLN A 59 25.360 15.176 32.390 1.00 0.00 H new ATOM 0 HE22 GLN A 59 25.810 14.148 33.754 1.00 0.00 H new ATOM 959 N GLU A 60 25.055 22.372 34.743 1.00 0.00 N ATOM 960 CA GLU A 60 25.044 23.486 35.697 1.00 0.00 C ATOM 961 C GLU A 60 23.947 24.505 35.354 1.00 0.00 C ATOM 962 O GLU A 60 23.892 25.023 34.243 1.00 0.00 O ATOM 963 CB GLU A 60 26.446 24.116 35.761 1.00 0.00 C ATOM 964 CG GLU A 60 26.574 25.245 36.793 1.00 0.00 C ATOM 965 CD GLU A 60 26.225 24.787 38.211 1.00 0.00 C ATOM 966 OE1 GLU A 60 27.128 24.293 38.926 1.00 0.00 O ATOM 967 OE2 GLU A 60 25.022 24.909 38.567 1.00 0.00 O ATOM 0 H GLU A 60 24.979 22.665 33.769 1.00 0.00 H new ATOM 0 HA GLU A 60 24.799 23.112 36.691 1.00 0.00 H new ATOM 0 HB2 GLU A 60 27.173 23.338 35.996 1.00 0.00 H new ATOM 0 HB3 GLU A 60 26.704 24.506 34.776 1.00 0.00 H new ATOM 0 HG2 GLU A 60 27.593 25.631 36.780 1.00 0.00 H new ATOM 0 HG3 GLU A 60 25.918 26.068 36.509 1.00 0.00 H new ATOM 974 N MET A 61 23.081 24.799 36.328 1.00 0.00 N ATOM 975 CA MET A 61 21.934 25.713 36.218 1.00 0.00 C ATOM 976 C MET A 61 22.234 27.145 36.681 1.00 0.00 C ATOM 977 O MET A 61 21.309 27.938 36.863 1.00 0.00 O ATOM 978 CB MET A 61 20.721 25.137 36.960 1.00 0.00 C ATOM 979 CG MET A 61 20.251 23.798 36.382 1.00 0.00 C ATOM 980 SD MET A 61 18.727 23.148 37.122 1.00 0.00 S ATOM 981 CE MET A 61 19.191 23.146 38.877 1.00 0.00 C ATOM 0 H MET A 61 23.162 24.389 37.258 1.00 0.00 H new ATOM 0 HA MET A 61 21.706 25.792 35.155 1.00 0.00 H new ATOM 0 HB2 MET A 61 20.974 25.004 38.012 1.00 0.00 H new ATOM 0 HB3 MET A 61 19.901 25.854 36.917 1.00 0.00 H new ATOM 0 HG2 MET A 61 20.097 23.914 35.309 1.00 0.00 H new ATOM 0 HG3 MET A 61 21.045 23.062 36.512 1.00 0.00 H new ATOM 0 HE1 MET A 61 18.474 22.551 39.442 1.00 0.00 H new ATOM 0 HE2 MET A 61 20.187 22.717 38.990 1.00 0.00 H new ATOM 0 HE3 MET A 61 19.192 24.169 39.254 1.00 0.00 H new ATOM 991 N ASN A 62 23.507 27.491 36.895 1.00 0.00 N ATOM 992 CA ASN A 62 23.932 28.751 37.522 1.00 0.00 C ATOM 993 C ASN A 62 23.386 28.905 38.961 1.00 0.00 C ATOM 994 O ASN A 62 23.085 30.011 39.415 1.00 0.00 O ATOM 995 CB ASN A 62 23.604 29.922 36.571 1.00 0.00 C ATOM 996 CG ASN A 62 24.400 31.182 36.824 1.00 0.00 C ATOM 997 OD1 ASN A 62 25.309 31.243 37.641 1.00 0.00 O ATOM 998 ND2 ASN A 62 24.093 32.227 36.101 1.00 0.00 N ATOM 0 H ASN A 62 24.289 26.892 36.632 1.00 0.00 H new ATOM 0 HA ASN A 62 25.013 28.750 37.664 1.00 0.00 H new ATOM 0 HB2 ASN A 62 23.778 29.599 35.545 1.00 0.00 H new ATOM 0 HB3 ASN A 62 22.543 30.155 36.656 1.00 0.00 H new ATOM 0 HD21 ASN A 62 24.612 33.097 36.217 1.00 0.00 H new ATOM 0 HD22 ASN A 62 23.335 32.172 35.421 1.00 0.00 H new ATOM 1005 N PHE A 63 23.210 27.767 39.638 1.00 0.00 N ATOM 1006 CA PHE A 63 22.640 27.618 40.986 1.00 0.00 C ATOM 1007 C PHE A 63 23.329 26.500 41.799 1.00 0.00 C ATOM 1008 O PHE A 63 23.138 26.390 43.014 1.00 0.00 O ATOM 1009 CB PHE A 63 21.132 27.345 40.843 1.00 0.00 C ATOM 1010 CG PHE A 63 20.364 27.172 42.146 1.00 0.00 C ATOM 1011 CD1 PHE A 63 20.496 28.117 43.183 1.00 0.00 C ATOM 1012 CD2 PHE A 63 19.517 26.063 42.327 1.00 0.00 C ATOM 1013 CE1 PHE A 63 19.788 27.953 44.387 1.00 0.00 C ATOM 1014 CE2 PHE A 63 18.798 25.905 43.525 1.00 0.00 C ATOM 1015 CZ PHE A 63 18.935 26.849 44.557 1.00 0.00 C ATOM 0 H PHE A 63 23.477 26.868 39.237 1.00 0.00 H new ATOM 0 HA PHE A 63 22.809 28.540 41.543 1.00 0.00 H new ATOM 0 HB2 PHE A 63 20.684 28.168 40.286 1.00 0.00 H new ATOM 0 HB3 PHE A 63 21.000 26.445 40.243 1.00 0.00 H new ATOM 0 HD1 PHE A 63 21.144 28.971 43.053 1.00 0.00 H new ATOM 0 HD2 PHE A 63 19.419 25.329 41.541 1.00 0.00 H new ATOM 0 HE1 PHE A 63 19.900 28.676 45.182 1.00 0.00 H new ATOM 0 HE2 PHE A 63 18.140 25.058 43.652 1.00 0.00 H new ATOM 0 HZ PHE A 63 18.386 26.726 45.479 1.00 0.00 H new ATOM 1025 N GLY A 64 24.127 25.657 41.137 1.00 0.00 N ATOM 1026 CA GLY A 64 25.083 24.739 41.739 1.00 0.00 C ATOM 1027 C GLY A 64 26.497 25.319 41.720 1.00 0.00 C ATOM 1028 O GLY A 64 26.705 26.499 41.401 1.00 0.00 O ATOM 0 H GLY A 64 24.119 25.598 40.119 1.00 0.00 H new ATOM 0 HA2 GLY A 64 24.789 24.526 42.767 1.00 0.00 H new ATOM 0 HA3 GLY A 64 25.069 23.791 41.201 1.00 0.00 H new ATOM 1032 N LYS A 65 27.475 24.494 42.096 1.00 0.00 N ATOM 1033 CA LYS A 65 28.877 24.906 42.273 1.00 0.00 C ATOM 1034 C LYS A 65 29.872 24.007 41.526 1.00 0.00 C ATOM 1035 O LYS A 65 31.039 23.912 41.915 1.00 0.00 O ATOM 1036 CB LYS A 65 29.163 25.051 43.780 1.00 0.00 C ATOM 1037 CG LYS A 65 30.271 26.078 44.054 1.00 0.00 C ATOM 1038 CD LYS A 65 30.614 26.118 45.544 1.00 0.00 C ATOM 1039 CE LYS A 65 31.704 27.165 45.765 1.00 0.00 C ATOM 1040 NZ LYS A 65 32.052 27.284 47.195 1.00 0.00 N ATOM 0 H LYS A 65 27.318 23.505 42.290 1.00 0.00 H new ATOM 0 HA LYS A 65 29.027 25.879 41.805 1.00 0.00 H new ATOM 0 HB2 LYS A 65 28.251 25.354 44.295 1.00 0.00 H new ATOM 0 HB3 LYS A 65 29.455 24.084 44.189 1.00 0.00 H new ATOM 0 HG2 LYS A 65 31.160 25.823 43.478 1.00 0.00 H new ATOM 0 HG3 LYS A 65 29.949 27.065 43.723 1.00 0.00 H new ATOM 0 HD2 LYS A 65 29.728 26.364 46.130 1.00 0.00 H new ATOM 0 HD3 LYS A 65 30.956 25.139 45.880 1.00 0.00 H new ATOM 0 HE2 LYS A 65 32.592 26.895 45.194 1.00 0.00 H new ATOM 0 HE3 LYS A 65 31.365 28.131 45.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 32.795 28.002 47.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 31.209 27.565 47.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 32.398 26.368 47.546 1.00 0.00 H new ATOM 1054 N LYS A 66 29.435 23.331 40.460 1.00 0.00 N ATOM 1055 CA LYS A 66 30.288 22.428 39.659 1.00 0.00 C ATOM 1056 C LYS A 66 30.923 23.117 38.456 1.00 0.00 C ATOM 1057 O LYS A 66 31.951 22.646 37.971 1.00 0.00 O ATOM 1058 CB LYS A 66 29.478 21.203 39.214 1.00 0.00 C ATOM 1059 CG LYS A 66 29.175 20.281 40.404 1.00 0.00 C ATOM 1060 CD LYS A 66 28.365 19.034 40.026 1.00 0.00 C ATOM 1061 CE LYS A 66 27.016 19.393 39.392 1.00 0.00 C ATOM 1062 NZ LYS A 66 27.042 19.351 37.912 1.00 0.00 N ATOM 0 H LYS A 66 28.475 23.390 40.121 1.00 0.00 H new ATOM 0 HA LYS A 66 31.111 22.112 40.301 1.00 0.00 H new ATOM 0 HB2 LYS A 66 28.545 21.527 38.754 1.00 0.00 H new ATOM 0 HB3 LYS A 66 30.033 20.652 38.455 1.00 0.00 H new ATOM 0 HG2 LYS A 66 30.115 19.969 40.859 1.00 0.00 H new ATOM 0 HG3 LYS A 66 28.627 20.845 41.159 1.00 0.00 H new ATOM 0 HD2 LYS A 66 28.942 18.425 39.330 1.00 0.00 H new ATOM 0 HD3 LYS A 66 28.197 18.428 40.916 1.00 0.00 H new ATOM 0 HE2 LYS A 66 26.255 18.703 39.756 1.00 0.00 H new ATOM 0 HE3 LYS A 66 26.723 20.391 39.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 26.292 19.964 37.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 27.966 19.685 37.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 26.886 18.375 37.590 1.00 0.00 H new ATOM 1076 N LEU A 67 30.330 24.206 37.966 1.00 0.00 N ATOM 1077 CA LEU A 67 30.841 24.943 36.809 1.00 0.00 C ATOM 1078 C LEU A 67 30.492 26.440 36.875 1.00 0.00 C ATOM 1079 O LEU A 67 29.691 26.873 37.710 1.00 0.00 O ATOM 1080 CB LEU A 67 30.289 24.257 35.537 1.00 0.00 C ATOM 1081 CG LEU A 67 31.102 24.460 34.246 1.00 0.00 C ATOM 1082 CD1 LEU A 67 32.504 23.860 34.321 1.00 0.00 C ATOM 1083 CD2 LEU A 67 30.370 23.785 33.090 1.00 0.00 C ATOM 0 H LEU A 67 29.478 24.604 38.362 1.00 0.00 H new ATOM 0 HA LEU A 67 31.930 24.913 36.796 1.00 0.00 H new ATOM 0 HB2 LEU A 67 30.215 23.187 35.730 1.00 0.00 H new ATOM 0 HB3 LEU A 67 29.276 24.621 35.364 1.00 0.00 H new ATOM 0 HG LEU A 67 31.202 25.536 34.101 1.00 0.00 H new ATOM 0 HD11 LEU A 67 33.026 24.036 33.381 1.00 0.00 H new ATOM 0 HD12 LEU A 67 33.057 24.327 35.136 1.00 0.00 H new ATOM 0 HD13 LEU A 67 32.432 22.787 34.500 1.00 0.00 H new ATOM 0 HD21 LEU A 67 30.938 23.923 32.170 1.00 0.00 H new ATOM 0 HD22 LEU A 67 30.267 22.720 33.297 1.00 0.00 H new ATOM 0 HD23 LEU A 67 29.381 24.230 32.976 1.00 0.00 H new ATOM 1095 N ILE A 68 31.092 27.221 35.978 1.00 0.00 N ATOM 1096 CA ILE A 68 30.743 28.611 35.660 1.00 0.00 C ATOM 1097 C ILE A 68 30.200 28.680 34.229 1.00 0.00 C ATOM 1098 O ILE A 68 30.719 28.015 33.331 1.00 0.00 O ATOM 1099 CB ILE A 68 31.980 29.518 35.837 1.00 0.00 C ATOM 1100 CG1 ILE A 68 32.519 29.512 37.284 1.00 0.00 C ATOM 1101 CG2 ILE A 68 31.711 30.952 35.357 1.00 0.00 C ATOM 1102 CD1 ILE A 68 31.588 30.113 38.342 1.00 0.00 C ATOM 0 H ILE A 68 31.878 26.886 35.421 1.00 0.00 H new ATOM 0 HA ILE A 68 29.970 28.966 36.341 1.00 0.00 H new ATOM 0 HB ILE A 68 32.759 29.093 35.204 1.00 0.00 H new ATOM 0 HG12 ILE A 68 32.742 28.483 37.565 1.00 0.00 H new ATOM 0 HG13 ILE A 68 33.462 30.059 37.303 1.00 0.00 H new ATOM 0 HG21 ILE A 68 32.606 31.557 35.499 1.00 0.00 H new ATOM 0 HG22 ILE A 68 31.446 30.938 34.300 1.00 0.00 H new ATOM 0 HG23 ILE A 68 30.889 31.380 35.931 1.00 0.00 H new ATOM 0 HD11 ILE A 68 32.065 30.057 39.320 1.00 0.00 H new ATOM 0 HD12 ILE A 68 31.383 31.155 38.097 1.00 0.00 H new ATOM 0 HD13 ILE A 68 30.652 29.555 38.363 1.00 0.00 H new ATOM 1114 N LEU A 69 29.170 29.496 34.003 1.00 0.00 N ATOM 1115 CA LEU A 69 28.520 29.654 32.701 1.00 0.00 C ATOM 1116 C LEU A 69 27.852 31.019 32.522 1.00 0.00 C ATOM 1117 O LEU A 69 27.618 31.747 33.490 1.00 0.00 O ATOM 1118 CB LEU A 69 27.522 28.500 32.465 1.00 0.00 C ATOM 1119 CG LEU A 69 26.222 28.397 33.302 1.00 0.00 C ATOM 1120 CD1 LEU A 69 26.454 28.396 34.806 1.00 0.00 C ATOM 1121 CD2 LEU A 69 25.156 29.444 32.960 1.00 0.00 C ATOM 0 H LEU A 69 28.756 30.076 34.733 1.00 0.00 H new ATOM 0 HA LEU A 69 29.302 29.609 31.943 1.00 0.00 H new ATOM 0 HB2 LEU A 69 27.227 28.540 31.417 1.00 0.00 H new ATOM 0 HB3 LEU A 69 28.069 27.568 32.606 1.00 0.00 H new ATOM 0 HG LEU A 69 25.836 27.421 33.009 1.00 0.00 H new ATOM 0 HD11 LEU A 69 25.497 28.321 35.322 1.00 0.00 H new ATOM 0 HD12 LEU A 69 27.080 27.546 35.077 1.00 0.00 H new ATOM 0 HD13 LEU A 69 26.952 29.320 35.098 1.00 0.00 H new ATOM 0 HD21 LEU A 69 24.283 29.295 33.595 1.00 0.00 H new ATOM 0 HD22 LEU A 69 25.560 30.443 33.127 1.00 0.00 H new ATOM 0 HD23 LEU A 69 24.866 29.340 31.914 1.00 0.00 H new ATOM 1133 N GLU A 70 27.488 31.339 31.281 1.00 0.00 N ATOM 1134 CA GLU A 70 26.547 32.416 30.970 1.00 0.00 C ATOM 1135 C GLU A 70 25.727 32.113 29.701 1.00 0.00 C ATOM 1136 O GLU A 70 26.274 31.731 28.665 1.00 0.00 O ATOM 1137 CB GLU A 70 27.307 33.750 30.879 1.00 0.00 C ATOM 1138 CG GLU A 70 26.410 34.944 30.559 1.00 0.00 C ATOM 1139 CD GLU A 70 27.260 36.209 30.498 1.00 0.00 C ATOM 1140 OE1 GLU A 70 28.019 36.389 29.513 1.00 0.00 O ATOM 1141 OE2 GLU A 70 27.177 37.051 31.420 1.00 0.00 O ATOM 0 H GLU A 70 27.841 30.854 30.456 1.00 0.00 H new ATOM 0 HA GLU A 70 25.819 32.494 31.777 1.00 0.00 H new ATOM 0 HB2 GLU A 70 27.818 33.933 31.824 1.00 0.00 H new ATOM 0 HB3 GLU A 70 28.077 33.668 30.112 1.00 0.00 H new ATOM 0 HG2 GLU A 70 25.901 34.787 29.608 1.00 0.00 H new ATOM 0 HG3 GLU A 70 25.637 35.048 31.320 1.00 0.00 H new ATOM 1148 N VAL A 71 24.410 32.334 29.781 1.00 0.00 N ATOM 1149 CA VAL A 71 23.477 32.327 28.639 1.00 0.00 C ATOM 1150 C VAL A 71 23.206 33.760 28.178 1.00 0.00 C ATOM 1151 O VAL A 71 22.943 34.645 29.000 1.00 0.00 O ATOM 1152 CB VAL A 71 22.177 31.551 28.954 1.00 0.00 C ATOM 1153 CG1 VAL A 71 21.557 31.890 30.317 1.00 0.00 C ATOM 1154 CG2 VAL A 71 21.101 31.758 27.876 1.00 0.00 C ATOM 0 H VAL A 71 23.946 32.529 30.668 1.00 0.00 H new ATOM 0 HA VAL A 71 23.946 31.791 27.814 1.00 0.00 H new ATOM 0 HB VAL A 71 22.497 30.509 28.975 1.00 0.00 H new ATOM 0 HG11 VAL A 71 20.650 31.303 30.460 1.00 0.00 H new ATOM 0 HG12 VAL A 71 22.269 31.656 31.109 1.00 0.00 H new ATOM 0 HG13 VAL A 71 21.312 32.952 30.351 1.00 0.00 H new ATOM 0 HG21 VAL A 71 20.207 31.194 28.141 1.00 0.00 H new ATOM 0 HG22 VAL A 71 20.854 32.817 27.807 1.00 0.00 H new ATOM 0 HG23 VAL A 71 21.478 31.410 26.914 1.00 0.00 H new ATOM 1164 N SER A 72 23.270 34.011 26.869 1.00 0.00 N ATOM 1165 CA SER A 72 23.117 35.357 26.312 1.00 0.00 C ATOM 1166 C SER A 72 22.515 35.389 24.906 1.00 0.00 C ATOM 1167 O SER A 72 22.439 34.368 24.223 1.00 0.00 O ATOM 1168 CB SER A 72 24.479 36.039 26.309 1.00 0.00 C ATOM 1169 OG SER A 72 24.289 37.432 26.322 1.00 0.00 O ATOM 0 H SER A 72 23.429 33.289 26.166 1.00 0.00 H new ATOM 0 HA SER A 72 22.406 35.886 26.947 1.00 0.00 H new ATOM 0 HB2 SER A 72 25.058 35.729 27.179 1.00 0.00 H new ATOM 0 HB3 SER A 72 25.047 35.744 25.427 1.00 0.00 H new ATOM 0 HG SER A 72 25.040 37.860 26.784 1.00 0.00 H new ATOM 1175 N SER A 73 22.119 36.585 24.470 1.00 0.00 N ATOM 1176 CA SER A 73 21.532 36.869 23.155 1.00 0.00 C ATOM 1177 C SER A 73 22.329 37.940 22.414 1.00 0.00 C ATOM 1178 O SER A 73 22.965 38.799 23.040 1.00 0.00 O ATOM 1179 CB SER A 73 20.056 37.260 23.277 1.00 0.00 C ATOM 1180 OG SER A 73 19.363 36.234 23.968 1.00 0.00 O ATOM 0 H SER A 73 22.201 37.422 25.048 1.00 0.00 H new ATOM 0 HA SER A 73 21.582 35.953 22.567 1.00 0.00 H new ATOM 0 HB2 SER A 73 19.960 38.205 23.811 1.00 0.00 H new ATOM 0 HB3 SER A 73 19.622 37.407 22.288 1.00 0.00 H new ATOM 0 HG SER A 73 18.417 36.477 24.052 1.00 0.00 H new ATOM 1186 N SER A 74 22.301 37.879 21.081 1.00 0.00 N ATOM 1187 CA SER A 74 23.182 38.667 20.213 1.00 0.00 C ATOM 1188 C SER A 74 22.452 39.320 19.034 1.00 0.00 C ATOM 1189 O SER A 74 21.357 38.896 18.650 1.00 0.00 O ATOM 1190 CB SER A 74 24.333 37.783 19.722 1.00 0.00 C ATOM 1191 OG SER A 74 25.050 37.288 20.835 1.00 0.00 O ATOM 0 H SER A 74 21.659 37.275 20.567 1.00 0.00 H new ATOM 0 HA SER A 74 23.572 39.492 20.809 1.00 0.00 H new ATOM 0 HB2 SER A 74 23.944 36.956 19.129 1.00 0.00 H new ATOM 0 HB3 SER A 74 24.996 38.356 19.074 1.00 0.00 H new ATOM 0 HG SER A 74 25.786 36.721 20.524 1.00 0.00 H new ATOM 1197 N ASN A 75 23.034 40.380 18.465 1.00 0.00 N ATOM 1198 CA ASN A 75 22.456 41.100 17.326 1.00 0.00 C ATOM 1199 C ASN A 75 22.820 40.442 15.982 1.00 0.00 C ATOM 1200 O ASN A 75 23.933 39.937 15.799 1.00 0.00 O ATOM 1201 CB ASN A 75 22.836 42.592 17.379 1.00 0.00 C ATOM 1202 CG ASN A 75 24.266 42.839 16.939 1.00 0.00 C ATOM 1203 OD1 ASN A 75 25.208 42.588 17.669 1.00 0.00 O ATOM 1204 ND2 ASN A 75 24.484 43.280 15.726 1.00 0.00 N ATOM 0 H ASN A 75 23.924 40.765 18.783 1.00 0.00 H new ATOM 0 HA ASN A 75 21.370 41.038 17.402 1.00 0.00 H new ATOM 0 HB2 ASN A 75 22.159 43.160 16.741 1.00 0.00 H new ATOM 0 HB3 ASN A 75 22.702 42.963 18.395 1.00 0.00 H new ATOM 0 HD21 ASN A 75 25.440 43.412 15.396 1.00 0.00 H new ATOM 0 HD22 ASN A 75 23.698 43.491 15.111 1.00 0.00 H new ATOM 1211 N ALA A 76 21.894 40.505 15.028 1.00 0.00 N ATOM 1212 CA ALA A 76 22.037 40.013 13.659 1.00 0.00 C ATOM 1213 C ALA A 76 22.107 41.145 12.613 1.00 0.00 C ATOM 1214 O ALA A 76 22.239 40.867 11.414 1.00 0.00 O ATOM 1215 CB ALA A 76 20.911 39.013 13.401 1.00 0.00 C ATOM 0 H ALA A 76 20.978 40.921 15.197 1.00 0.00 H new ATOM 0 HA ALA A 76 22.997 39.508 13.550 1.00 0.00 H new ATOM 0 HB1 ALA A 76 20.992 38.628 12.384 1.00 0.00 H new ATOM 0 HB2 ALA A 76 20.988 38.188 14.109 1.00 0.00 H new ATOM 0 HB3 ALA A 76 19.948 39.509 13.525 1.00 0.00 H new ATOM 1221 N ARG A 77 22.065 42.413 13.047 1.00 0.00 N ATOM 1222 CA ARG A 77 22.305 43.606 12.221 1.00 0.00 C ATOM 1223 C ARG A 77 23.172 44.644 12.924 1.00 0.00 C ATOM 1224 O ARG A 77 22.919 44.972 14.103 1.00 0.00 O ATOM 1225 CB ARG A 77 20.949 44.173 11.757 1.00 0.00 C ATOM 1226 CG ARG A 77 21.027 45.273 10.683 1.00 0.00 C ATOM 1227 CD ARG A 77 21.809 44.855 9.426 1.00 0.00 C ATOM 1228 NE ARG A 77 23.258 45.052 9.590 1.00 0.00 N ATOM 1229 CZ ARG A 77 24.208 44.703 8.752 1.00 0.00 C ATOM 1230 NH1 ARG A 77 23.972 44.063 7.648 1.00 0.00 N ATOM 1231 NH2 ARG A 77 25.437 45.007 9.034 1.00 0.00 N ATOM 0 H ARG A 77 21.855 42.645 14.018 1.00 0.00 H new ATOM 0 HA ARG A 77 22.882 43.317 11.343 1.00 0.00 H new ATOM 0 HB2 ARG A 77 20.345 43.353 11.370 1.00 0.00 H new ATOM 0 HB3 ARG A 77 20.425 44.573 12.625 1.00 0.00 H new ATOM 0 HG2 ARG A 77 20.016 45.558 10.393 1.00 0.00 H new ATOM 0 HG3 ARG A 77 21.496 46.157 11.115 1.00 0.00 H new ATOM 0 HD2 ARG A 77 21.608 43.807 9.205 1.00 0.00 H new ATOM 0 HD3 ARG A 77 21.458 45.434 8.571 1.00 0.00 H new ATOM 0 HE ARG A 77 23.558 45.511 10.450 1.00 0.00 H new ATOM 0 HH11 ARG A 77 23.016 43.810 7.400 1.00 0.00 H new ATOM 0 HH12 ARG A 77 24.743 43.813 7.028 1.00 0.00 H new ATOM 0 HH21 ARG A 77 25.653 45.509 9.895 1.00 0.00 H new ATOM 0 HH22 ARG A 77 26.187 44.744 8.395 1.00 0.00 H new TER 1245 ARG A 77