USER MOD reduce.3.24.130724 H: found=0, std=0, add=1086, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1086 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 65 ASN : amide:sc= -0.897 K(o=-1.4,f=-2.1!) USER MOD Set 1.2: A 69 GLN : amide:sc= -0.515 X(o=-1.4,f=-1.1) USER MOD Set 2.1: A 13 ASN : amide:sc= 0.543 K(o=1.1,f=-0.43) USER MOD Set 2.2: A 46 TYR OH : rot 11:sc= 0.606 USER MOD Set 3.1: A 9 THR OG1 : rot 79:sc= 1.09 USER MOD Set 3.2: A 42 MET CE :methyl -162:sc= -0.158 (180deg=-0.585) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 GLN : amide:sc= -0.0147 K(o=-0.015,f=-1.5) USER MOD Single : A 10 THR OG1 : rot 70:sc= 1.34 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot -46:sc= 0.992 USER MOD Single : A 18 SER OG : rot 28:sc= 0.0364 USER MOD Single : A 19 GLN : amide:sc= -0.0937 X(o=-0.094,f=0) USER MOD Single : A 21 SER OG : rot 160:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= -0.0476 USER MOD Single : A 24 SER OG : rot 74:sc= 0.224 USER MOD Single : A 26 SER OG : rot 180:sc= -0.585 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN : amide:sc= -0.701 K(o=-0.7,f=-1.6) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -154:sc= -0.539 (180deg=-2.29) USER MOD Single : A 47 MET CE :methyl -126:sc= -2.74 (180deg=-6.97!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -0.012 K(o=-0.012,f=-0.71) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.149 USER MOD Single : A 57 LYS NZ :NH3+ -116:sc= 0.00101 (180deg=0) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 MET CE :methyl -112:sc= -0.0144 (180deg=-0.383) USER MOD Single : A 66 HIS : no HD1:sc= -0.108 X(o=-0.11,f=-0.13) USER MOD Single : A 70 GLN : amide:sc= -0.0179 X(o=-0.018,f=-5.8e-05) USER MOD Single : A 72 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0561) USER MOD Single : A 74 GLN : amide:sc= -0.785 K(o=-0.78,f=-0.21) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -1.2 X(o=-1.2,f=-1.3) USER MOD Single : A 80 GLN : amide:sc= -1.01 X(o=-1,f=-0.64) USER MOD Single : A 82 SER OG : rot 84:sc= -0.136 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= -5.2! C(o=-5.2!,f=-9.4!) USER MOD Single : A 96 GLN : amide:sc= -0.0315 K(o=-0.032,f=-0.54) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -0.894 K(o=-0.89,f=-2.4!) USER MOD Single : A 114 LYS NZ :NH3+ -159:sc= -0.097 (180deg=-0.667) USER MOD Single : A 117 ASN : amide:sc= -0.751 K(o=-0.75,f=-4.1!) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 ASN : amide:sc= 0.608 K(o=0.61,f=0) USER MOD Single : A 130 SER OG : rot 165:sc= 1.3 USER MOD ----------------------------------------------------------------- ATOM 42 N SER A 5 1.308 -6.512 1.719 1.00 72.11 N ATOM 43 CA SER A 5 0.733 -6.369 3.052 1.00 63.45 C ATOM 44 C SER A 5 0.512 -7.734 3.697 1.00 61.12 C ATOM 45 O SER A 5 0.523 -7.862 4.921 1.00 74.35 O ATOM 46 CB SER A 5 -0.591 -5.606 2.980 1.00 5.21 C ATOM 47 OG SER A 5 -0.371 -4.206 2.958 1.00 13.00 O ATOM 0 HA SER A 5 1.436 -5.806 3.666 1.00 63.45 H new ATOM 0 HB2 SER A 5 -1.139 -5.905 2.087 1.00 5.21 H new ATOM 0 HB3 SER A 5 -1.212 -5.867 3.837 1.00 5.21 H new ATOM 0 HG SER A 5 -1.232 -3.740 2.910 1.00 13.00 H new ATOM 53 N GLU A 6 0.312 -8.750 2.863 1.00 30.34 N ATOM 54 CA GLU A 6 0.087 -10.106 3.353 1.00 43.55 C ATOM 55 C GLU A 6 1.345 -10.660 4.016 1.00 72.13 C ATOM 56 O GLU A 6 1.266 -11.428 4.974 1.00 74.43 O ATOM 57 CB GLU A 6 -0.343 -11.021 2.205 1.00 52.04 C ATOM 58 CG GLU A 6 0.773 -11.331 1.222 1.00 43.13 C ATOM 59 CD GLU A 6 0.264 -11.964 -0.059 1.00 3.41 C ATOM 60 OE1 GLU A 6 -0.598 -12.862 0.025 1.00 74.42 O ATOM 61 OE2 GLU A 6 0.729 -11.559 -1.145 1.00 41.13 O ATOM 0 H GLU A 6 0.301 -8.661 1.847 1.00 30.34 H new ATOM 0 HA GLU A 6 -0.709 -10.070 4.097 1.00 43.55 H new ATOM 0 HB2 GLU A 6 -0.721 -11.956 2.619 1.00 52.04 H new ATOM 0 HB3 GLU A 6 -1.168 -10.553 1.669 1.00 52.04 H new ATOM 0 HG2 GLU A 6 1.306 -10.411 0.981 1.00 43.13 H new ATOM 0 HG3 GLU A 6 1.491 -12.002 1.694 1.00 43.13 H new ATOM 68 N GLN A 7 2.503 -10.265 3.498 1.00 42.24 N ATOM 69 CA GLN A 7 3.777 -10.723 4.038 1.00 24.34 C ATOM 70 C GLN A 7 3.994 -10.188 5.450 1.00 34.42 C ATOM 71 O GLN A 7 4.297 -10.946 6.372 1.00 2.33 O ATOM 72 CB GLN A 7 4.928 -10.283 3.132 1.00 62.22 C ATOM 73 CG GLN A 7 5.499 -11.408 2.284 1.00 71.33 C ATOM 74 CD GLN A 7 6.319 -12.392 3.095 1.00 45.15 C ATOM 75 OE1 GLN A 7 6.857 -12.049 4.148 1.00 63.31 O ATOM 76 NE2 GLN A 7 6.420 -13.623 2.607 1.00 51.11 N ATOM 0 H GLN A 7 2.585 -9.629 2.705 1.00 42.24 H new ATOM 0 HA GLN A 7 3.753 -11.812 4.081 1.00 24.34 H new ATOM 0 HB2 GLN A 7 4.578 -9.486 2.476 1.00 62.22 H new ATOM 0 HB3 GLN A 7 5.724 -9.863 3.747 1.00 62.22 H new ATOM 0 HG2 GLN A 7 4.683 -11.938 1.794 1.00 71.33 H new ATOM 0 HG3 GLN A 7 6.122 -10.984 1.497 1.00 71.33 H new ATOM 0 HE21 GLN A 7 5.957 -13.864 1.730 1.00 51.11 H new ATOM 0 HE22 GLN A 7 6.960 -14.328 3.109 1.00 51.11 H new ATOM 85 N PHE A 8 3.836 -8.879 5.612 1.00 14.12 N ATOM 86 CA PHE A 8 4.015 -8.242 6.912 1.00 72.22 C ATOM 87 C PHE A 8 3.078 -8.852 7.950 1.00 33.22 C ATOM 88 O PHE A 8 3.485 -9.148 9.074 1.00 30.11 O ATOM 89 CB PHE A 8 3.765 -6.737 6.805 1.00 53.54 C ATOM 90 CG PHE A 8 4.045 -5.990 8.077 1.00 25.14 C ATOM 91 CD1 PHE A 8 5.286 -6.079 8.689 1.00 55.20 C ATOM 92 CD2 PHE A 8 3.069 -5.200 8.663 1.00 70.25 C ATOM 93 CE1 PHE A 8 5.547 -5.393 9.860 1.00 3.11 C ATOM 94 CE2 PHE A 8 3.325 -4.512 9.833 1.00 1.32 C ATOM 95 CZ PHE A 8 4.565 -4.609 10.433 1.00 23.25 C ATOM 0 H PHE A 8 3.584 -8.238 4.859 1.00 14.12 H new ATOM 0 HA PHE A 8 5.043 -8.410 7.233 1.00 72.22 H new ATOM 0 HB2 PHE A 8 4.388 -6.329 6.009 1.00 53.54 H new ATOM 0 HB3 PHE A 8 2.728 -6.569 6.515 1.00 53.54 H new ATOM 0 HD1 PHE A 8 6.057 -6.691 8.246 1.00 55.20 H new ATOM 0 HD2 PHE A 8 2.097 -5.121 8.199 1.00 70.25 H new ATOM 0 HE1 PHE A 8 6.518 -5.470 10.327 1.00 3.11 H new ATOM 0 HE2 PHE A 8 2.556 -3.899 10.278 1.00 1.32 H new ATOM 0 HZ PHE A 8 4.766 -4.073 11.349 1.00 23.25 H new ATOM 105 N THR A 9 1.818 -9.037 7.566 1.00 65.30 N ATOM 106 CA THR A 9 0.822 -9.610 8.462 1.00 2.25 C ATOM 107 C THR A 9 1.119 -11.077 8.749 1.00 23.23 C ATOM 108 O THR A 9 1.196 -11.492 9.906 1.00 3.34 O ATOM 109 CB THR A 9 -0.597 -9.490 7.875 1.00 23.32 C ATOM 110 OG1 THR A 9 -0.806 -8.169 7.364 1.00 63.21 O ATOM 111 CG2 THR A 9 -1.647 -9.803 8.930 1.00 32.41 C ATOM 0 H THR A 9 1.464 -8.798 6.640 1.00 65.30 H new ATOM 0 HA THR A 9 0.871 -9.044 9.392 1.00 2.25 H new ATOM 0 HB THR A 9 -0.693 -10.212 7.064 1.00 23.32 H new ATOM 0 HG1 THR A 9 -0.376 -8.086 6.487 1.00 63.21 H new ATOM 0 HG21 THR A 9 -2.641 -9.712 8.492 1.00 32.41 H new ATOM 0 HG22 THR A 9 -1.503 -10.820 9.296 1.00 32.41 H new ATOM 0 HG23 THR A 9 -1.550 -9.102 9.759 1.00 32.41 H new ATOM 119 N THR A 10 1.286 -11.861 7.688 1.00 4.14 N ATOM 120 CA THR A 10 1.575 -13.283 7.826 1.00 13.24 C ATOM 121 C THR A 10 2.833 -13.511 8.656 1.00 43.42 C ATOM 122 O THR A 10 2.919 -14.470 9.423 1.00 61.25 O ATOM 123 CB THR A 10 1.750 -13.956 6.452 1.00 23.43 C ATOM 124 OG1 THR A 10 0.550 -13.820 5.683 1.00 43.10 O ATOM 125 CG2 THR A 10 2.092 -15.430 6.612 1.00 73.22 C ATOM 0 H THR A 10 1.226 -11.535 6.723 1.00 4.14 H new ATOM 0 HA THR A 10 0.722 -13.731 8.336 1.00 13.24 H new ATOM 0 HB THR A 10 2.571 -13.463 5.932 1.00 23.43 H new ATOM 0 HG1 THR A 10 0.436 -12.884 5.417 1.00 43.10 H new ATOM 0 HG21 THR A 10 2.211 -15.885 5.629 1.00 73.22 H new ATOM 0 HG22 THR A 10 3.022 -15.529 7.172 1.00 73.22 H new ATOM 0 HG23 THR A 10 1.289 -15.934 7.150 1.00 73.22 H new ATOM 133 N LYS A 11 3.809 -12.622 8.498 1.00 33.35 N ATOM 134 CA LYS A 11 5.063 -12.725 9.234 1.00 4.53 C ATOM 135 C LYS A 11 4.868 -12.346 10.699 1.00 54.01 C ATOM 136 O LYS A 11 5.417 -12.988 11.595 1.00 11.34 O ATOM 137 CB LYS A 11 6.125 -11.822 8.601 1.00 71.42 C ATOM 138 CG LYS A 11 6.667 -12.353 7.285 1.00 43.20 C ATOM 139 CD LYS A 11 7.843 -13.290 7.504 1.00 61.22 C ATOM 140 CE LYS A 11 7.380 -14.718 7.748 1.00 74.23 C ATOM 141 NZ LYS A 11 8.363 -15.715 7.241 1.00 41.23 N ATOM 0 H LYS A 11 3.755 -11.823 7.867 1.00 33.35 H new ATOM 0 HA LYS A 11 5.399 -13.761 9.186 1.00 4.53 H new ATOM 0 HB2 LYS A 11 5.698 -10.833 8.436 1.00 71.42 H new ATOM 0 HB3 LYS A 11 6.951 -11.700 9.302 1.00 71.42 H new ATOM 0 HG2 LYS A 11 5.876 -12.879 6.750 1.00 43.20 H new ATOM 0 HG3 LYS A 11 6.977 -11.519 6.655 1.00 43.20 H new ATOM 0 HD2 LYS A 11 8.498 -13.263 6.633 1.00 61.22 H new ATOM 0 HD3 LYS A 11 8.430 -12.946 8.356 1.00 61.22 H new ATOM 0 HE2 LYS A 11 7.225 -14.872 8.816 1.00 74.23 H new ATOM 0 HE3 LYS A 11 6.418 -14.876 7.260 1.00 74.23 H new ATOM 0 HZ1 LYS A 11 8.010 -16.676 7.427 1.00 41.23 H new ATOM 0 HZ2 LYS A 11 8.492 -15.585 6.217 1.00 41.23 H new ATOM 0 HZ3 LYS A 11 9.274 -15.581 7.725 1.00 41.23 H new ATOM 155 N LEU A 12 4.081 -11.302 10.935 1.00 2.31 N ATOM 156 CA LEU A 12 3.811 -10.839 12.292 1.00 44.41 C ATOM 157 C LEU A 12 3.089 -11.912 13.100 1.00 1.21 C ATOM 158 O LEU A 12 3.271 -12.017 14.312 1.00 22.51 O ATOM 159 CB LEU A 12 2.974 -9.559 12.258 1.00 34.20 C ATOM 160 CG LEU A 12 3.745 -8.257 12.041 1.00 23.13 C ATOM 161 CD1 LEU A 12 2.815 -7.161 11.546 1.00 15.03 C ATOM 162 CD2 LEU A 12 4.441 -7.829 13.325 1.00 33.25 C ATOM 0 H LEU A 12 3.619 -10.760 10.205 1.00 2.31 H new ATOM 0 HA LEU A 12 4.765 -10.629 12.775 1.00 44.41 H new ATOM 0 HB2 LEU A 12 2.233 -9.655 11.465 1.00 34.20 H new ATOM 0 HB3 LEU A 12 2.427 -9.481 13.198 1.00 34.20 H new ATOM 0 HG LEU A 12 4.505 -8.431 11.279 1.00 23.13 H new ATOM 0 HD11 LEU A 12 3.382 -6.242 11.397 1.00 15.03 H new ATOM 0 HD12 LEU A 12 2.364 -7.466 10.602 1.00 15.03 H new ATOM 0 HD13 LEU A 12 2.031 -6.988 12.284 1.00 15.03 H new ATOM 0 HD21 LEU A 12 4.985 -6.900 13.152 1.00 33.25 H new ATOM 0 HD22 LEU A 12 3.698 -7.674 14.107 1.00 33.25 H new ATOM 0 HD23 LEU A 12 5.139 -8.606 13.637 1.00 33.25 H new ATOM 174 N ASN A 13 2.270 -12.707 12.419 1.00 24.23 N ATOM 175 CA ASN A 13 1.522 -13.774 13.074 1.00 53.10 C ATOM 176 C ASN A 13 2.428 -14.960 13.390 1.00 2.44 C ATOM 177 O ASN A 13 2.283 -15.608 14.427 1.00 35.22 O ATOM 178 CB ASN A 13 0.360 -14.228 12.188 1.00 50.02 C ATOM 179 CG ASN A 13 -0.832 -13.295 12.275 1.00 75.02 C ATOM 180 OD1 ASN A 13 -1.294 -12.960 13.366 1.00 50.32 O ATOM 181 ND2 ASN A 13 -1.337 -12.871 11.122 1.00 74.40 N ATOM 0 H ASN A 13 2.108 -12.633 11.415 1.00 24.23 H new ATOM 0 HA ASN A 13 1.126 -13.383 14.011 1.00 53.10 H new ATOM 0 HB2 ASN A 13 0.697 -14.287 11.153 1.00 50.02 H new ATOM 0 HB3 ASN A 13 0.054 -15.232 12.481 1.00 50.02 H new ATOM 0 HD21 ASN A 13 -2.140 -12.242 11.117 1.00 74.40 H new ATOM 0 HD22 ASN A 13 -0.922 -13.174 10.241 1.00 74.40 H new ATOM 188 N THR A 14 3.366 -15.238 12.490 1.00 52.22 N ATOM 189 CA THR A 14 4.296 -16.345 12.672 1.00 52.02 C ATOM 190 C THR A 14 5.601 -15.869 13.299 1.00 20.22 C ATOM 191 O THR A 14 6.634 -16.531 13.185 1.00 10.43 O ATOM 192 CB THR A 14 4.607 -17.043 11.334 1.00 12.03 C ATOM 193 OG1 THR A 14 5.406 -18.208 11.564 1.00 23.53 O ATOM 194 CG2 THR A 14 5.336 -16.100 10.389 1.00 73.44 C ATOM 0 H THR A 14 3.502 -14.711 11.627 1.00 52.22 H new ATOM 0 HA THR A 14 3.813 -17.057 13.341 1.00 52.02 H new ATOM 0 HB THR A 14 3.663 -17.335 10.874 1.00 12.03 H new ATOM 0 HG1 THR A 14 6.137 -17.987 12.178 1.00 23.53 H new ATOM 0 HG21 THR A 14 5.545 -16.615 9.451 1.00 73.44 H new ATOM 0 HG22 THR A 14 4.713 -15.228 10.193 1.00 73.44 H new ATOM 0 HG23 THR A 14 6.273 -15.781 10.845 1.00 73.44 H new ATOM 202 N LEU A 15 5.548 -14.719 13.962 1.00 25.33 N ATOM 203 CA LEU A 15 6.728 -14.155 14.610 1.00 53.25 C ATOM 204 C LEU A 15 7.092 -14.945 15.862 1.00 1.13 C ATOM 205 O LEU A 15 6.218 -15.463 16.557 1.00 40.34 O ATOM 206 CB LEU A 15 6.483 -12.689 14.971 1.00 52.33 C ATOM 207 CG LEU A 15 7.124 -11.653 14.046 1.00 73.43 C ATOM 208 CD1 LEU A 15 6.762 -10.245 14.489 1.00 11.55 C ATOM 209 CD2 LEU A 15 8.634 -11.832 14.011 1.00 65.21 C ATOM 0 H LEU A 15 4.702 -14.159 14.065 1.00 25.33 H new ATOM 0 HA LEU A 15 7.561 -14.216 13.910 1.00 53.25 H new ATOM 0 HB2 LEU A 15 5.407 -12.515 14.988 1.00 52.33 H new ATOM 0 HB3 LEU A 15 6.850 -12.519 15.983 1.00 52.33 H new ATOM 0 HG LEU A 15 6.737 -11.805 13.038 1.00 73.43 H new ATOM 0 HD11 LEU A 15 7.227 -9.522 13.819 1.00 11.55 H new ATOM 0 HD12 LEU A 15 5.679 -10.122 14.461 1.00 11.55 H new ATOM 0 HD13 LEU A 15 7.120 -10.080 15.505 1.00 11.55 H new ATOM 0 HD21 LEU A 15 9.073 -11.087 13.348 1.00 65.21 H new ATOM 0 HD22 LEU A 15 9.038 -11.708 15.016 1.00 65.21 H new ATOM 0 HD23 LEU A 15 8.874 -12.830 13.644 1.00 65.21 H new ATOM 221 N GLU A 16 8.388 -15.031 16.146 1.00 41.05 N ATOM 222 CA GLU A 16 8.867 -15.757 17.316 1.00 50.10 C ATOM 223 C GLU A 16 10.000 -14.998 18.001 1.00 14.22 C ATOM 224 O GLU A 16 10.635 -14.132 17.399 1.00 74.14 O ATOM 225 CB GLU A 16 9.344 -17.155 16.917 1.00 73.03 C ATOM 226 CG GLU A 16 8.261 -18.217 17.010 1.00 50.01 C ATOM 227 CD GLU A 16 8.806 -19.622 16.840 1.00 14.12 C ATOM 228 OE1 GLU A 16 9.979 -19.759 16.435 1.00 74.21 O ATOM 229 OE2 GLU A 16 8.058 -20.584 17.113 1.00 31.43 O ATOM 0 H GLU A 16 9.124 -14.607 15.582 1.00 41.05 H new ATOM 0 HA GLU A 16 8.038 -15.850 18.018 1.00 50.10 H new ATOM 0 HB2 GLU A 16 9.723 -17.123 15.895 1.00 73.03 H new ATOM 0 HB3 GLU A 16 10.178 -17.442 17.557 1.00 73.03 H new ATOM 0 HG2 GLU A 16 7.763 -18.139 17.976 1.00 50.01 H new ATOM 0 HG3 GLU A 16 7.506 -18.029 16.246 1.00 50.01 H new ATOM 236 N ASP A 17 10.246 -15.328 19.264 1.00 62.51 N ATOM 237 CA ASP A 17 11.302 -14.679 20.032 1.00 21.21 C ATOM 238 C ASP A 17 12.675 -15.200 19.618 1.00 74.42 C ATOM 239 O ASP A 17 13.192 -16.150 20.205 1.00 22.24 O ATOM 240 CB ASP A 17 11.087 -14.907 21.529 1.00 32.11 C ATOM 241 CG ASP A 17 11.817 -13.887 22.381 1.00 73.11 C ATOM 242 OD1 ASP A 17 11.489 -12.687 22.279 1.00 2.41 O ATOM 243 OD2 ASP A 17 12.716 -14.289 23.149 1.00 60.43 O ATOM 0 H ASP A 17 9.728 -16.041 19.778 1.00 62.51 H new ATOM 0 HA ASP A 17 11.262 -13.610 19.825 1.00 21.21 H new ATOM 0 HB2 ASP A 17 10.021 -14.865 21.750 1.00 32.11 H new ATOM 0 HB3 ASP A 17 11.428 -15.908 21.794 1.00 32.11 H new ATOM 248 N SER A 18 13.258 -14.573 18.602 1.00 62.24 N ATOM 249 CA SER A 18 14.569 -14.977 18.105 1.00 15.21 C ATOM 250 C SER A 18 15.350 -13.771 17.591 1.00 34.31 C ATOM 251 O SER A 18 14.811 -12.932 16.870 1.00 43.12 O ATOM 252 CB SER A 18 14.418 -16.014 16.991 1.00 72.13 C ATOM 253 OG SER A 18 14.414 -17.330 17.516 1.00 24.20 O ATOM 0 H SER A 18 12.844 -13.783 18.106 1.00 62.24 H new ATOM 0 HA SER A 18 15.123 -15.421 18.932 1.00 15.21 H new ATOM 0 HB2 SER A 18 13.492 -15.834 16.446 1.00 72.13 H new ATOM 0 HB3 SER A 18 15.234 -15.907 16.277 1.00 72.13 H new ATOM 0 HG SER A 18 14.074 -17.314 18.435 1.00 24.20 H new ATOM 259 N GLN A 19 16.622 -13.694 17.968 1.00 13.34 N ATOM 260 CA GLN A 19 17.477 -12.591 17.546 1.00 2.15 C ATOM 261 C GLN A 19 17.501 -12.471 16.026 1.00 21.32 C ATOM 262 O GLN A 19 17.489 -11.368 15.481 1.00 32.14 O ATOM 263 CB GLN A 19 18.898 -12.788 18.077 1.00 64.42 C ATOM 264 CG GLN A 19 19.101 -12.256 19.486 1.00 23.01 C ATOM 265 CD GLN A 19 19.283 -10.751 19.521 1.00 23.40 C ATOM 266 OE1 GLN A 19 20.402 -10.247 19.420 1.00 22.31 O ATOM 267 NE2 GLN A 19 18.181 -10.025 19.664 1.00 2.33 N ATOM 0 H GLN A 19 17.083 -14.381 18.564 1.00 13.34 H new ATOM 0 HA GLN A 19 17.067 -11.669 17.958 1.00 2.15 H new ATOM 0 HB2 GLN A 19 19.139 -13.851 18.061 1.00 64.42 H new ATOM 0 HB3 GLN A 19 19.599 -12.292 17.406 1.00 64.42 H new ATOM 0 HG2 GLN A 19 18.243 -12.529 20.100 1.00 23.01 H new ATOM 0 HG3 GLN A 19 19.975 -12.734 19.928 1.00 23.01 H new ATOM 0 HE21 GLN A 19 17.274 -10.485 19.744 1.00 2.33 H new ATOM 0 HE22 GLN A 19 18.241 -9.007 19.694 1.00 2.33 H new ATOM 276 N GLU A 20 17.536 -13.614 15.348 1.00 32.10 N ATOM 277 CA GLU A 20 17.563 -13.636 13.890 1.00 13.02 C ATOM 278 C GLU A 20 16.183 -13.327 13.316 1.00 42.51 C ATOM 279 O GLU A 20 16.064 -12.713 12.255 1.00 31.32 O ATOM 280 CB GLU A 20 18.043 -14.999 13.387 1.00 34.02 C ATOM 281 CG GLU A 20 19.554 -15.152 13.394 1.00 62.43 C ATOM 282 CD GLU A 20 20.251 -14.098 12.556 1.00 62.12 C ATOM 283 OE1 GLU A 20 19.569 -13.442 11.741 1.00 72.42 O ATOM 284 OE2 GLU A 20 21.478 -13.929 12.715 1.00 41.24 O ATOM 0 H GLU A 20 17.546 -14.536 15.784 1.00 32.10 H new ATOM 0 HA GLU A 20 18.258 -12.867 13.553 1.00 13.02 H new ATOM 0 HB2 GLU A 20 17.604 -15.781 14.007 1.00 34.02 H new ATOM 0 HB3 GLU A 20 17.675 -15.153 12.372 1.00 34.02 H new ATOM 0 HG2 GLU A 20 19.917 -15.093 14.420 1.00 62.43 H new ATOM 0 HG3 GLU A 20 19.817 -16.141 13.019 1.00 62.43 H new ATOM 291 N SER A 21 15.144 -13.756 14.024 1.00 32.04 N ATOM 292 CA SER A 21 13.772 -13.529 13.584 1.00 63.32 C ATOM 293 C SER A 21 13.473 -12.036 13.485 1.00 62.50 C ATOM 294 O SER A 21 12.963 -11.561 12.470 1.00 10.43 O ATOM 295 CB SER A 21 12.788 -14.195 14.547 1.00 21.52 C ATOM 296 OG SER A 21 11.451 -14.022 14.111 1.00 60.42 O ATOM 0 H SER A 21 15.226 -14.263 14.905 1.00 32.04 H new ATOM 0 HA SER A 21 13.656 -13.971 12.595 1.00 63.32 H new ATOM 0 HB2 SER A 21 13.014 -15.259 14.624 1.00 21.52 H new ATOM 0 HB3 SER A 21 12.906 -13.771 15.544 1.00 21.52 H new ATOM 0 HG SER A 21 10.879 -14.697 14.533 1.00 60.42 H new ATOM 302 N ILE A 22 13.794 -11.304 14.546 1.00 45.32 N ATOM 303 CA ILE A 22 13.562 -9.865 14.579 1.00 74.21 C ATOM 304 C ILE A 22 14.292 -9.164 13.439 1.00 4.31 C ATOM 305 O ILE A 22 13.775 -8.217 12.846 1.00 4.01 O ATOM 306 CB ILE A 22 14.013 -9.252 15.918 1.00 64.44 C ATOM 307 CG1 ILE A 22 13.299 -9.938 17.084 1.00 0.12 C ATOM 308 CG2 ILE A 22 13.746 -7.755 15.932 1.00 54.12 C ATOM 309 CD1 ILE A 22 11.801 -9.725 17.085 1.00 64.24 C ATOM 0 H ILE A 22 14.215 -11.683 15.394 1.00 45.32 H new ATOM 0 HA ILE A 22 12.488 -9.716 14.465 1.00 74.21 H new ATOM 0 HB ILE A 22 15.086 -9.410 16.030 1.00 64.44 H new ATOM 0 HG12 ILE A 22 13.506 -11.008 17.047 1.00 0.12 H new ATOM 0 HG13 ILE A 22 13.711 -9.566 18.022 1.00 0.12 H new ATOM 0 HG21 ILE A 22 14.070 -7.336 16.885 1.00 54.12 H new ATOM 0 HG22 ILE A 22 14.297 -7.280 15.121 1.00 54.12 H new ATOM 0 HG23 ILE A 22 12.679 -7.574 15.801 1.00 54.12 H new ATOM 0 HD11 ILE A 22 11.361 -10.239 17.939 1.00 64.24 H new ATOM 0 HD12 ILE A 22 11.585 -8.659 17.153 1.00 64.24 H new ATOM 0 HD13 ILE A 22 11.376 -10.123 16.163 1.00 64.24 H new ATOM 321 N SER A 23 15.498 -9.636 13.137 1.00 54.12 N ATOM 322 CA SER A 23 16.301 -9.053 12.069 1.00 42.22 C ATOM 323 C SER A 23 15.760 -9.455 10.700 1.00 0.02 C ATOM 324 O SER A 23 15.824 -8.683 9.744 1.00 52.32 O ATOM 325 CB SER A 23 17.761 -9.492 12.202 1.00 74.20 C ATOM 326 OG SER A 23 18.635 -8.541 11.619 1.00 73.31 O ATOM 0 H SER A 23 15.940 -10.420 13.617 1.00 54.12 H new ATOM 0 HA SER A 23 16.245 -7.968 12.158 1.00 42.22 H new ATOM 0 HB2 SER A 23 18.010 -9.622 13.255 1.00 74.20 H new ATOM 0 HB3 SER A 23 17.898 -10.460 11.720 1.00 74.20 H new ATOM 0 HG SER A 23 19.562 -8.844 11.719 1.00 73.31 H new ATOM 332 N SER A 24 15.227 -10.670 10.615 1.00 3.22 N ATOM 333 CA SER A 24 14.678 -11.178 9.364 1.00 50.35 C ATOM 334 C SER A 24 13.577 -10.260 8.842 1.00 55.13 C ATOM 335 O SER A 24 13.586 -9.860 7.678 1.00 60.42 O ATOM 336 CB SER A 24 14.129 -12.592 9.560 1.00 54.02 C ATOM 337 OG SER A 24 15.165 -13.556 9.487 1.00 75.25 O ATOM 0 H SER A 24 15.164 -11.321 11.398 1.00 3.22 H new ATOM 0 HA SER A 24 15.482 -11.207 8.628 1.00 50.35 H new ATOM 0 HB2 SER A 24 13.631 -12.661 10.527 1.00 54.02 H new ATOM 0 HB3 SER A 24 13.378 -12.803 8.799 1.00 54.02 H new ATOM 0 HG SER A 24 15.702 -13.522 10.306 1.00 75.25 H new ATOM 343 N ALA A 25 12.628 -9.930 9.712 1.00 21.02 N ATOM 344 CA ALA A 25 11.520 -9.058 9.341 1.00 24.22 C ATOM 345 C ALA A 25 11.968 -7.602 9.270 1.00 71.20 C ATOM 346 O ALA A 25 11.609 -6.877 8.342 1.00 62.30 O ATOM 347 CB ALA A 25 10.374 -9.212 10.329 1.00 33.33 C ATOM 0 H ALA A 25 12.604 -10.254 10.679 1.00 21.02 H new ATOM 0 HA ALA A 25 11.173 -9.353 8.351 1.00 24.22 H new ATOM 0 HB1 ALA A 25 9.554 -8.555 10.040 1.00 33.33 H new ATOM 0 HB2 ALA A 25 10.029 -10.246 10.328 1.00 33.33 H new ATOM 0 HB3 ALA A 25 10.717 -8.945 11.329 1.00 33.33 H new ATOM 353 N SER A 26 12.753 -7.180 10.256 1.00 35.13 N ATOM 354 CA SER A 26 13.245 -5.809 10.308 1.00 42.44 C ATOM 355 C SER A 26 13.954 -5.437 9.008 1.00 14.15 C ATOM 356 O SER A 26 13.676 -4.397 8.411 1.00 11.33 O ATOM 357 CB SER A 26 14.199 -5.631 11.491 1.00 52.33 C ATOM 358 OG SER A 26 14.767 -4.333 11.497 1.00 45.24 O ATOM 0 H SER A 26 13.062 -7.768 11.030 1.00 35.13 H new ATOM 0 HA SER A 26 12.389 -5.147 10.438 1.00 42.44 H new ATOM 0 HB2 SER A 26 13.662 -5.801 12.424 1.00 52.33 H new ATOM 0 HB3 SER A 26 14.991 -6.378 11.439 1.00 52.33 H new ATOM 0 HG SER A 26 15.371 -4.244 12.263 1.00 45.24 H new ATOM 364 N LYS A 27 14.871 -6.295 8.576 1.00 62.10 N ATOM 365 CA LYS A 27 15.620 -6.060 7.347 1.00 24.33 C ATOM 366 C LYS A 27 14.678 -5.819 6.173 1.00 55.31 C ATOM 367 O LYS A 27 14.943 -4.976 5.316 1.00 74.15 O ATOM 368 CB LYS A 27 16.532 -7.252 7.046 1.00 3.22 C ATOM 369 CG LYS A 27 17.799 -7.276 7.885 1.00 55.13 C ATOM 370 CD LYS A 27 18.258 -8.698 8.160 1.00 11.24 C ATOM 371 CE LYS A 27 19.201 -9.198 7.078 1.00 64.55 C ATOM 372 NZ LYS A 27 19.266 -10.686 7.042 1.00 13.23 N ATOM 0 H LYS A 27 15.114 -7.160 9.059 1.00 62.10 H new ATOM 0 HA LYS A 27 16.231 -5.169 7.488 1.00 24.33 H new ATOM 0 HB2 LYS A 27 15.977 -8.175 7.215 1.00 3.22 H new ATOM 0 HB3 LYS A 27 16.805 -7.232 5.991 1.00 3.22 H new ATOM 0 HG2 LYS A 27 18.589 -6.731 7.368 1.00 55.13 H new ATOM 0 HG3 LYS A 27 17.621 -6.761 8.829 1.00 55.13 H new ATOM 0 HD2 LYS A 27 18.758 -8.739 9.128 1.00 11.24 H new ATOM 0 HD3 LYS A 27 17.391 -9.356 8.221 1.00 11.24 H new ATOM 0 HE2 LYS A 27 18.871 -8.825 6.108 1.00 64.55 H new ATOM 0 HE3 LYS A 27 20.199 -8.795 7.251 1.00 64.55 H new ATOM 0 HZ1 LYS A 27 19.919 -10.987 6.291 1.00 13.23 H new ATOM 0 HZ2 LYS A 27 19.605 -11.041 7.959 1.00 13.23 H new ATOM 0 HZ3 LYS A 27 18.319 -11.070 6.851 1.00 13.23 H new ATOM 386 N TRP A 28 13.577 -6.561 6.141 1.00 21.45 N ATOM 387 CA TRP A 28 12.594 -6.426 5.072 1.00 22.03 C ATOM 388 C TRP A 28 11.913 -5.063 5.129 1.00 71.24 C ATOM 389 O TRP A 28 11.800 -4.372 4.115 1.00 22.03 O ATOM 390 CB TRP A 28 11.548 -7.538 5.170 1.00 51.52 C ATOM 391 CG TRP A 28 10.592 -7.556 4.016 1.00 72.12 C ATOM 392 CD1 TRP A 28 10.909 -7.639 2.690 1.00 51.30 C ATOM 393 CD2 TRP A 28 9.163 -7.489 4.085 1.00 4.32 C ATOM 394 NE1 TRP A 28 9.764 -7.627 1.931 1.00 54.30 N ATOM 395 CE2 TRP A 28 8.679 -7.536 2.763 1.00 23.32 C ATOM 396 CE3 TRP A 28 8.246 -7.395 5.135 1.00 21.12 C ATOM 397 CZ2 TRP A 28 7.320 -7.492 2.467 1.00 53.24 C ATOM 398 CZ3 TRP A 28 6.897 -7.351 4.839 1.00 0.22 C ATOM 399 CH2 TRP A 28 6.444 -7.400 3.514 1.00 10.11 C ATOM 0 H TRP A 28 13.342 -7.263 6.843 1.00 21.45 H new ATOM 0 HA TRP A 28 13.116 -6.511 4.119 1.00 22.03 H new ATOM 0 HB2 TRP A 28 12.056 -8.501 5.227 1.00 51.52 H new ATOM 0 HB3 TRP A 28 10.986 -7.418 6.096 1.00 51.52 H new ATOM 0 HD1 TRP A 28 11.912 -7.704 2.296 1.00 51.30 H new ATOM 0 HE1 TRP A 28 9.727 -7.678 0.913 1.00 54.30 H new ATOM 0 HE3 TRP A 28 8.585 -7.357 6.160 1.00 21.12 H new ATOM 0 HZ2 TRP A 28 6.969 -7.529 1.446 1.00 53.24 H new ATOM 0 HZ3 TRP A 28 6.179 -7.278 5.643 1.00 0.22 H new ATOM 0 HH2 TRP A 28 5.383 -7.364 3.315 1.00 10.11 H new ATOM 410 N LEU A 29 11.460 -4.682 6.318 1.00 40.33 N ATOM 411 CA LEU A 29 10.789 -3.400 6.506 1.00 44.12 C ATOM 412 C LEU A 29 11.744 -2.241 6.235 1.00 74.24 C ATOM 413 O LEU A 29 11.330 -1.177 5.773 1.00 54.11 O ATOM 414 CB LEU A 29 10.234 -3.296 7.927 1.00 22.24 C ATOM 415 CG LEU A 29 8.949 -4.077 8.205 1.00 51.44 C ATOM 416 CD1 LEU A 29 8.926 -4.575 9.641 1.00 10.54 C ATOM 417 CD2 LEU A 29 7.729 -3.214 7.918 1.00 53.23 C ATOM 0 H LEU A 29 11.545 -5.242 7.166 1.00 40.33 H new ATOM 0 HA LEU A 29 9.965 -3.342 5.795 1.00 44.12 H new ATOM 0 HB2 LEU A 29 11.001 -3.639 8.621 1.00 22.24 H new ATOM 0 HB3 LEU A 29 10.051 -2.244 8.148 1.00 22.24 H new ATOM 0 HG LEU A 29 8.922 -4.942 7.543 1.00 51.44 H new ATOM 0 HD11 LEU A 29 8.004 -5.128 9.820 1.00 10.54 H new ATOM 0 HD12 LEU A 29 9.781 -5.229 9.813 1.00 10.54 H new ATOM 0 HD13 LEU A 29 8.977 -3.725 10.322 1.00 10.54 H new ATOM 0 HD21 LEU A 29 6.823 -3.785 8.121 1.00 53.23 H new ATOM 0 HD22 LEU A 29 7.751 -2.330 8.555 1.00 53.23 H new ATOM 0 HD23 LEU A 29 7.738 -2.908 6.872 1.00 53.23 H new ATOM 429 N LEU A 30 13.023 -2.455 6.522 1.00 33.31 N ATOM 430 CA LEU A 30 14.037 -1.429 6.307 1.00 24.51 C ATOM 431 C LEU A 30 14.016 -0.936 4.864 1.00 73.21 C ATOM 432 O LEU A 30 14.191 0.254 4.601 1.00 55.43 O ATOM 433 CB LEU A 30 15.424 -1.976 6.650 1.00 22.15 C ATOM 434 CG LEU A 30 16.369 -1.009 7.365 1.00 34.24 C ATOM 435 CD1 LEU A 30 16.433 0.319 6.627 1.00 72.44 C ATOM 436 CD2 LEU A 30 15.926 -0.799 8.806 1.00 23.02 C ATOM 0 H LEU A 30 13.383 -3.330 6.904 1.00 33.31 H new ATOM 0 HA LEU A 30 13.812 -0.588 6.962 1.00 24.51 H new ATOM 0 HB2 LEU A 30 15.299 -2.860 7.275 1.00 22.15 H new ATOM 0 HB3 LEU A 30 15.902 -2.304 5.727 1.00 22.15 H new ATOM 0 HG LEU A 30 17.368 -1.446 7.372 1.00 34.24 H new ATOM 0 HD11 LEU A 30 17.110 0.994 7.151 1.00 72.44 H new ATOM 0 HD12 LEU A 30 16.797 0.154 5.613 1.00 72.44 H new ATOM 0 HD13 LEU A 30 15.438 0.762 6.588 1.00 72.44 H new ATOM 0 HD21 LEU A 30 16.610 -0.108 9.300 1.00 23.02 H new ATOM 0 HD22 LEU A 30 14.918 -0.384 8.820 1.00 23.02 H new ATOM 0 HD23 LEU A 30 15.933 -1.754 9.332 1.00 23.02 H new ATOM 448 N LEU A 31 13.798 -1.858 3.932 1.00 2.14 N ATOM 449 CA LEU A 31 13.751 -1.517 2.515 1.00 51.22 C ATOM 450 C LEU A 31 12.321 -1.221 2.073 1.00 22.13 C ATOM 451 O LEU A 31 12.026 -1.185 0.879 1.00 33.52 O ATOM 452 CB LEU A 31 14.330 -2.657 1.676 1.00 22.31 C ATOM 453 CG LEU A 31 15.680 -3.209 2.135 1.00 65.11 C ATOM 454 CD1 LEU A 31 16.108 -4.374 1.255 1.00 11.23 C ATOM 455 CD2 LEU A 31 16.736 -2.113 2.122 1.00 24.44 C ATOM 0 H LEU A 31 13.651 -2.847 4.133 1.00 2.14 H new ATOM 0 HA LEU A 31 14.352 -0.620 2.363 1.00 51.22 H new ATOM 0 HB2 LEU A 31 13.610 -3.475 1.665 1.00 22.31 H new ATOM 0 HB3 LEU A 31 14.433 -2.309 0.648 1.00 22.31 H new ATOM 0 HG LEU A 31 15.574 -3.572 3.157 1.00 65.11 H new ATOM 0 HD11 LEU A 31 17.071 -4.754 1.597 1.00 11.23 H new ATOM 0 HD12 LEU A 31 15.363 -5.168 1.314 1.00 11.23 H new ATOM 0 HD13 LEU A 31 16.197 -4.036 0.222 1.00 11.23 H new ATOM 0 HD21 LEU A 31 17.690 -2.523 2.451 1.00 24.44 H new ATOM 0 HD22 LEU A 31 16.840 -1.720 1.111 1.00 24.44 H new ATOM 0 HD23 LEU A 31 16.435 -1.310 2.795 1.00 24.44 H new ATOM 467 N GLN A 32 11.439 -1.008 3.045 1.00 44.23 N ATOM 468 CA GLN A 32 10.041 -0.713 2.755 1.00 30.52 C ATOM 469 C GLN A 32 9.661 0.674 3.262 1.00 74.13 C ATOM 470 O GLN A 32 8.526 0.903 3.683 1.00 65.52 O ATOM 471 CB GLN A 32 9.134 -1.768 3.391 1.00 33.03 C ATOM 472 CG GLN A 32 9.143 -3.100 2.659 1.00 74.02 C ATOM 473 CD GLN A 32 8.852 -2.954 1.178 1.00 4.31 C ATOM 474 OE1 GLN A 32 8.211 -1.993 0.751 1.00 4.13 O ATOM 475 NE2 GLN A 32 9.324 -3.909 0.385 1.00 41.41 N ATOM 0 H GLN A 32 11.668 -1.034 4.039 1.00 44.23 H new ATOM 0 HA GLN A 32 9.908 -0.733 1.673 1.00 30.52 H new ATOM 0 HB2 GLN A 32 9.446 -1.928 4.423 1.00 33.03 H new ATOM 0 HB3 GLN A 32 8.113 -1.387 3.422 1.00 33.03 H new ATOM 0 HG2 GLN A 32 10.115 -3.575 2.789 1.00 74.02 H new ATOM 0 HG3 GLN A 32 8.402 -3.762 3.108 1.00 74.02 H new ATOM 0 HE21 GLN A 32 9.850 -4.688 0.782 1.00 41.41 H new ATOM 0 HE22 GLN A 32 9.160 -3.864 -0.621 1.00 41.41 H new ATOM 484 N TYR A 33 10.615 1.596 3.218 1.00 5.32 N ATOM 485 CA TYR A 33 10.381 2.961 3.675 1.00 23.14 C ATOM 486 C TYR A 33 9.265 3.621 2.871 1.00 22.24 C ATOM 487 O TYR A 33 8.662 4.599 3.313 1.00 42.23 O ATOM 488 CB TYR A 33 11.664 3.786 3.561 1.00 11.43 C ATOM 489 CG TYR A 33 12.353 3.653 2.222 1.00 55.43 C ATOM 490 CD1 TYR A 33 11.775 4.168 1.068 1.00 53.14 C ATOM 491 CD2 TYR A 33 13.580 3.012 2.110 1.00 40.31 C ATOM 492 CE1 TYR A 33 12.400 4.048 -0.159 1.00 13.33 C ATOM 493 CE2 TYR A 33 14.213 2.889 0.888 1.00 11.32 C ATOM 494 CZ TYR A 33 13.619 3.409 -0.243 1.00 72.41 C ATOM 495 OH TYR A 33 14.245 3.287 -1.462 1.00 63.22 O ATOM 0 H TYR A 33 11.558 1.424 2.870 1.00 5.32 H new ATOM 0 HA TYR A 33 10.075 2.920 4.720 1.00 23.14 H new ATOM 0 HB2 TYR A 33 11.428 4.836 3.736 1.00 11.43 H new ATOM 0 HB3 TYR A 33 12.354 3.479 4.347 1.00 11.43 H new ATOM 0 HD1 TYR A 33 10.821 4.671 1.131 1.00 53.14 H new ATOM 0 HD2 TYR A 33 14.047 2.603 2.993 1.00 40.31 H new ATOM 0 HE1 TYR A 33 11.936 4.452 -1.047 1.00 13.33 H new ATOM 0 HE2 TYR A 33 15.168 2.389 0.819 1.00 11.32 H new ATOM 0 HH TYR A 33 15.095 2.812 -1.347 1.00 63.22 H new ATOM 505 N ARG A 34 8.996 3.077 1.689 1.00 14.20 N ATOM 506 CA ARG A 34 7.953 3.612 0.822 1.00 12.30 C ATOM 507 C ARG A 34 6.586 3.520 1.495 1.00 62.14 C ATOM 508 O ARG A 34 5.747 4.408 1.343 1.00 5.32 O ATOM 509 CB ARG A 34 7.930 2.859 -0.509 1.00 60.40 C ATOM 510 CG ARG A 34 9.163 3.098 -1.365 1.00 72.44 C ATOM 511 CD ARG A 34 8.930 2.674 -2.807 1.00 63.41 C ATOM 512 NE ARG A 34 9.911 3.261 -3.715 1.00 45.14 N ATOM 513 CZ ARG A 34 9.912 4.542 -4.068 1.00 22.12 C ATOM 514 NH1 ARG A 34 8.989 5.365 -3.590 1.00 72.23 N ATOM 515 NH2 ARG A 34 10.838 5.002 -4.899 1.00 44.02 N ATOM 0 H ARG A 34 9.486 2.266 1.310 1.00 14.20 H new ATOM 0 HA ARG A 34 8.176 4.662 0.633 1.00 12.30 H new ATOM 0 HB2 ARG A 34 7.837 1.791 -0.311 1.00 60.40 H new ATOM 0 HB3 ARG A 34 7.045 3.158 -1.070 1.00 60.40 H new ATOM 0 HG2 ARG A 34 9.430 4.154 -1.334 1.00 72.44 H new ATOM 0 HG3 ARG A 34 10.006 2.544 -0.953 1.00 72.44 H new ATOM 0 HD2 ARG A 34 8.976 1.587 -2.877 1.00 63.41 H new ATOM 0 HD3 ARG A 34 7.928 2.971 -3.115 1.00 63.41 H new ATOM 0 HE ARG A 34 10.635 2.654 -4.100 1.00 45.14 H new ATOM 0 HH11 ARG A 34 8.276 5.015 -2.950 1.00 72.23 H new ATOM 0 HH12 ARG A 34 8.992 6.348 -3.862 1.00 72.23 H new ATOM 0 HH21 ARG A 34 11.550 4.372 -5.268 1.00 44.02 H new ATOM 0 HH22 ARG A 34 10.838 5.986 -5.169 1.00 44.02 H new ATOM 529 N ASP A 35 6.370 2.440 2.237 1.00 73.55 N ATOM 530 CA ASP A 35 5.105 2.231 2.933 1.00 65.12 C ATOM 531 C ASP A 35 5.224 2.621 4.403 1.00 53.53 C ATOM 532 O ASP A 35 4.756 1.903 5.286 1.00 54.25 O ATOM 533 CB ASP A 35 4.668 0.770 2.814 1.00 43.10 C ATOM 534 CG ASP A 35 4.908 0.205 1.428 1.00 64.21 C ATOM 535 OD1 ASP A 35 6.056 -0.197 1.141 1.00 33.43 O ATOM 536 OD2 ASP A 35 3.949 0.164 0.630 1.00 71.20 O ATOM 0 H ASP A 35 7.054 1.695 2.372 1.00 73.55 H new ATOM 0 HA ASP A 35 4.352 2.866 2.466 1.00 65.12 H new ATOM 0 HB2 ASP A 35 5.210 0.171 3.546 1.00 43.10 H new ATOM 0 HB3 ASP A 35 3.609 0.690 3.057 1.00 43.10 H new ATOM 541 N ALA A 36 5.854 3.764 4.657 1.00 34.34 N ATOM 542 CA ALA A 36 6.033 4.250 6.020 1.00 54.02 C ATOM 543 C ALA A 36 4.697 4.345 6.749 1.00 54.23 C ATOM 544 O ALA A 36 4.471 3.695 7.770 1.00 45.12 O ATOM 545 CB ALA A 36 6.728 5.603 6.010 1.00 43.10 C ATOM 0 H ALA A 36 6.248 4.370 3.937 1.00 34.34 H new ATOM 0 HA ALA A 36 6.659 3.536 6.555 1.00 54.02 H new ATOM 0 HB1 ALA A 36 6.855 5.954 7.034 1.00 43.10 H new ATOM 0 HB2 ALA A 36 7.704 5.507 5.535 1.00 43.10 H new ATOM 0 HB3 ALA A 36 6.123 6.319 5.454 1.00 43.10 H new ATOM 551 N PRO A 37 3.788 5.175 6.215 1.00 70.34 N ATOM 552 CA PRO A 37 2.458 5.375 6.799 1.00 65.51 C ATOM 553 C PRO A 37 1.569 4.145 6.649 1.00 54.42 C ATOM 554 O PRO A 37 0.692 3.895 7.477 1.00 44.32 O ATOM 555 CB PRO A 37 1.891 6.547 5.995 1.00 15.14 C ATOM 556 CG PRO A 37 2.610 6.497 4.692 1.00 75.44 C ATOM 557 CD PRO A 37 3.988 5.981 4.999 1.00 43.12 C ATOM 0 HA PRO A 37 2.507 5.561 7.872 1.00 65.51 H new ATOM 0 HB2 PRO A 37 0.814 6.448 5.857 1.00 15.14 H new ATOM 0 HB3 PRO A 37 2.061 7.495 6.505 1.00 15.14 H new ATOM 0 HG2 PRO A 37 2.096 5.843 3.988 1.00 75.44 H new ATOM 0 HG3 PRO A 37 2.656 7.485 4.234 1.00 75.44 H new ATOM 0 HD2 PRO A 37 4.384 5.381 4.180 1.00 43.12 H new ATOM 0 HD3 PRO A 37 4.693 6.795 5.168 1.00 43.12 H new ATOM 565 N LYS A 38 1.799 3.380 5.587 1.00 31.04 N ATOM 566 CA LYS A 38 1.020 2.175 5.329 1.00 53.02 C ATOM 567 C LYS A 38 1.293 1.112 6.388 1.00 0.55 C ATOM 568 O LYS A 38 0.371 0.616 7.036 1.00 4.15 O ATOM 569 CB LYS A 38 1.345 1.621 3.940 1.00 60.21 C ATOM 570 CG LYS A 38 0.268 1.901 2.906 1.00 64.03 C ATOM 571 CD LYS A 38 -0.933 0.989 3.090 1.00 1.13 C ATOM 572 CE LYS A 38 -0.791 -0.290 2.280 1.00 32.31 C ATOM 573 NZ LYS A 38 -2.115 -0.852 1.894 1.00 33.02 N ATOM 0 H LYS A 38 2.519 3.573 4.891 1.00 31.04 H new ATOM 0 HA LYS A 38 -0.036 2.440 5.370 1.00 53.02 H new ATOM 0 HB2 LYS A 38 2.286 2.051 3.598 1.00 60.21 H new ATOM 0 HB3 LYS A 38 1.495 0.544 4.014 1.00 60.21 H new ATOM 0 HG2 LYS A 38 -0.049 2.941 2.982 1.00 64.03 H new ATOM 0 HG3 LYS A 38 0.679 1.765 1.906 1.00 64.03 H new ATOM 0 HD2 LYS A 38 -1.045 0.742 4.146 1.00 1.13 H new ATOM 0 HD3 LYS A 38 -1.839 1.514 2.788 1.00 1.13 H new ATOM 0 HE2 LYS A 38 -0.206 -0.088 1.382 1.00 32.31 H new ATOM 0 HE3 LYS A 38 -0.238 -1.028 2.861 1.00 32.31 H new ATOM 0 HZ1 LYS A 38 -1.975 -1.723 1.343 1.00 33.02 H new ATOM 0 HZ2 LYS A 38 -2.663 -1.068 2.751 1.00 33.02 H new ATOM 0 HZ3 LYS A 38 -2.632 -0.158 1.318 1.00 33.02 H new ATOM 587 N VAL A 39 2.565 0.769 6.561 1.00 65.40 N ATOM 588 CA VAL A 39 2.960 -0.233 7.544 1.00 22.11 C ATOM 589 C VAL A 39 2.655 0.238 8.962 1.00 72.14 C ATOM 590 O VAL A 39 2.261 -0.553 9.818 1.00 54.00 O ATOM 591 CB VAL A 39 4.461 -0.564 7.437 1.00 54.01 C ATOM 592 CG1 VAL A 39 4.852 -1.611 8.468 1.00 34.53 C ATOM 593 CG2 VAL A 39 4.803 -1.034 6.031 1.00 30.13 C ATOM 0 H VAL A 39 3.340 1.170 6.033 1.00 65.40 H new ATOM 0 HA VAL A 39 2.381 -1.131 7.330 1.00 22.11 H new ATOM 0 HB VAL A 39 5.031 0.342 7.642 1.00 54.01 H new ATOM 0 HG11 VAL A 39 5.916 -1.832 8.377 1.00 34.53 H new ATOM 0 HG12 VAL A 39 4.644 -1.232 9.469 1.00 34.53 H new ATOM 0 HG13 VAL A 39 4.277 -2.521 8.298 1.00 34.53 H new ATOM 0 HG21 VAL A 39 5.867 -1.264 5.973 1.00 30.13 H new ATOM 0 HG22 VAL A 39 4.225 -1.928 5.796 1.00 30.13 H new ATOM 0 HG23 VAL A 39 4.562 -0.248 5.316 1.00 30.13 H new ATOM 603 N ALA A 40 2.839 1.532 9.202 1.00 63.02 N ATOM 604 CA ALA A 40 2.581 2.110 10.515 1.00 61.50 C ATOM 605 C ALA A 40 1.104 2.006 10.879 1.00 30.15 C ATOM 606 O ALA A 40 0.756 1.580 11.980 1.00 11.32 O ATOM 607 CB ALA A 40 3.035 3.561 10.552 1.00 42.24 C ATOM 0 H ALA A 40 3.166 2.200 8.504 1.00 63.02 H new ATOM 0 HA ALA A 40 3.151 1.544 11.252 1.00 61.50 H new ATOM 0 HB1 ALA A 40 2.836 3.979 11.539 1.00 42.24 H new ATOM 0 HB2 ALA A 40 4.104 3.613 10.345 1.00 42.24 H new ATOM 0 HB3 ALA A 40 2.491 4.132 9.799 1.00 42.24 H new ATOM 613 N GLU A 41 0.240 2.399 9.948 1.00 24.42 N ATOM 614 CA GLU A 41 -1.199 2.351 10.174 1.00 75.22 C ATOM 615 C GLU A 41 -1.675 0.911 10.347 1.00 15.33 C ATOM 616 O GLU A 41 -2.457 0.609 11.248 1.00 12.54 O ATOM 617 CB GLU A 41 -1.943 3.008 9.009 1.00 3.52 C ATOM 618 CG GLU A 41 -3.393 3.339 9.321 1.00 24.24 C ATOM 619 CD GLU A 41 -4.186 3.709 8.083 1.00 33.54 C ATOM 620 OE1 GLU A 41 -3.960 4.811 7.542 1.00 71.13 O ATOM 621 OE2 GLU A 41 -5.033 2.896 7.656 1.00 12.44 O ATOM 0 H GLU A 41 0.512 2.754 9.031 1.00 24.42 H new ATOM 0 HA GLU A 41 -1.415 2.900 11.090 1.00 75.22 H new ATOM 0 HB2 GLU A 41 -1.423 3.923 8.727 1.00 3.52 H new ATOM 0 HB3 GLU A 41 -1.909 2.343 8.146 1.00 3.52 H new ATOM 0 HG2 GLU A 41 -3.861 2.482 9.805 1.00 24.24 H new ATOM 0 HG3 GLU A 41 -3.429 4.165 10.031 1.00 24.24 H new ATOM 628 N MET A 42 -1.198 0.028 9.477 1.00 72.41 N ATOM 629 CA MET A 42 -1.574 -1.380 9.534 1.00 72.31 C ATOM 630 C MET A 42 -1.084 -2.022 10.828 1.00 42.01 C ATOM 631 O MET A 42 -1.847 -2.685 11.531 1.00 42.33 O ATOM 632 CB MET A 42 -1.003 -2.132 8.330 1.00 52.21 C ATOM 633 CG MET A 42 -1.899 -3.255 7.834 1.00 54.24 C ATOM 634 SD MET A 42 -2.021 -4.617 9.008 1.00 31.15 S ATOM 635 CE MET A 42 -0.421 -5.393 8.794 1.00 1.35 C ATOM 0 H MET A 42 -0.551 0.262 8.724 1.00 72.41 H new ATOM 0 HA MET A 42 -2.662 -1.441 9.508 1.00 72.31 H new ATOM 0 HB2 MET A 42 -0.836 -1.426 7.517 1.00 52.21 H new ATOM 0 HB3 MET A 42 -0.031 -2.545 8.598 1.00 52.21 H new ATOM 0 HG2 MET A 42 -2.896 -2.859 7.638 1.00 54.24 H new ATOM 0 HG3 MET A 42 -1.513 -3.631 6.886 1.00 54.24 H new ATOM 0 HE1 MET A 42 -0.452 -6.407 9.193 1.00 1.35 H new ATOM 0 HE2 MET A 42 -0.173 -5.428 7.733 1.00 1.35 H new ATOM 0 HE3 MET A 42 0.337 -4.817 9.325 1.00 1.35 H new ATOM 645 N TRP A 43 0.192 -1.821 11.136 1.00 63.02 N ATOM 646 CA TRP A 43 0.784 -2.381 12.346 1.00 53.02 C ATOM 647 C TRP A 43 0.033 -1.911 13.587 1.00 53.14 C ATOM 648 O TRP A 43 -0.280 -2.705 14.474 1.00 61.43 O ATOM 649 CB TRP A 43 2.258 -1.987 12.447 1.00 41.30 C ATOM 650 CG TRP A 43 2.950 -2.575 13.639 1.00 12.15 C ATOM 651 CD1 TRP A 43 3.540 -3.804 13.721 1.00 43.31 C ATOM 652 CD2 TRP A 43 3.121 -1.960 14.921 1.00 53.31 C ATOM 653 NE1 TRP A 43 4.068 -3.989 14.976 1.00 31.30 N ATOM 654 CE2 TRP A 43 3.825 -2.872 15.731 1.00 74.43 C ATOM 655 CE3 TRP A 43 2.750 -0.726 15.462 1.00 35.15 C ATOM 656 CZ2 TRP A 43 4.162 -2.589 17.051 1.00 0.34 C ATOM 657 CZ3 TRP A 43 3.085 -0.446 16.774 1.00 71.35 C ATOM 658 CH2 TRP A 43 3.786 -1.374 17.556 1.00 50.42 C ATOM 0 H TRP A 43 0.837 -1.275 10.565 1.00 63.02 H new ATOM 0 HA TRP A 43 0.709 -3.467 12.288 1.00 53.02 H new ATOM 0 HB2 TRP A 43 2.775 -2.306 11.542 1.00 41.30 H new ATOM 0 HB3 TRP A 43 2.334 -0.901 12.491 1.00 41.30 H new ATOM 0 HD1 TRP A 43 3.585 -4.524 12.918 1.00 43.31 H new ATOM 0 HE1 TRP A 43 4.561 -4.823 15.294 1.00 31.30 H new ATOM 0 HE3 TRP A 43 2.211 -0.004 14.866 1.00 35.15 H new ATOM 0 HZ2 TRP A 43 4.701 -3.303 17.656 1.00 0.34 H new ATOM 0 HZ3 TRP A 43 2.802 0.504 17.203 1.00 71.35 H new ATOM 0 HH2 TRP A 43 4.034 -1.125 18.577 1.00 50.42 H new ATOM 669 N LYS A 44 -0.255 -0.615 13.643 1.00 1.03 N ATOM 670 CA LYS A 44 -0.971 -0.039 14.775 1.00 10.50 C ATOM 671 C LYS A 44 -2.360 -0.654 14.911 1.00 70.14 C ATOM 672 O LYS A 44 -2.683 -1.259 15.932 1.00 11.14 O ATOM 673 CB LYS A 44 -1.088 1.479 14.612 1.00 63.41 C ATOM 674 CG LYS A 44 -1.793 2.162 15.770 1.00 11.52 C ATOM 675 CD LYS A 44 -2.455 3.459 15.333 1.00 25.23 C ATOM 676 CE LYS A 44 -3.859 3.216 14.802 1.00 41.42 C ATOM 677 NZ LYS A 44 -3.860 2.962 13.335 1.00 55.45 N ATOM 0 H LYS A 44 -0.003 0.056 12.917 1.00 1.03 H new ATOM 0 HA LYS A 44 -0.405 -0.259 15.680 1.00 10.50 H new ATOM 0 HB2 LYS A 44 -0.089 1.903 14.505 1.00 63.41 H new ATOM 0 HB3 LYS A 44 -1.627 1.697 13.690 1.00 63.41 H new ATOM 0 HG2 LYS A 44 -2.544 1.491 16.186 1.00 11.52 H new ATOM 0 HG3 LYS A 44 -1.075 2.368 16.564 1.00 11.52 H new ATOM 0 HD2 LYS A 44 -2.498 4.149 16.176 1.00 25.23 H new ATOM 0 HD3 LYS A 44 -1.850 3.936 14.561 1.00 25.23 H new ATOM 0 HE2 LYS A 44 -4.300 2.364 15.319 1.00 41.42 H new ATOM 0 HE3 LYS A 44 -4.485 4.081 15.021 1.00 41.42 H new ATOM 0 HZ1 LYS A 44 -4.782 3.233 12.936 1.00 55.45 H new ATOM 0 HZ2 LYS A 44 -3.110 3.524 12.885 1.00 55.45 H new ATOM 0 HZ3 LYS A 44 -3.689 1.952 13.158 1.00 55.45 H new ATOM 691 N GLU A 45 -3.176 -0.497 13.873 1.00 11.31 N ATOM 692 CA GLU A 45 -4.530 -1.038 13.878 1.00 60.41 C ATOM 693 C GLU A 45 -4.515 -2.538 14.160 1.00 0.14 C ATOM 694 O GLU A 45 -5.466 -3.085 14.720 1.00 3.30 O ATOM 695 CB GLU A 45 -5.216 -0.768 12.537 1.00 12.44 C ATOM 696 CG GLU A 45 -6.021 0.521 12.515 1.00 34.21 C ATOM 697 CD GLU A 45 -7.254 0.423 11.637 1.00 42.40 C ATOM 698 OE1 GLU A 45 -7.102 0.434 10.398 1.00 54.54 O ATOM 699 OE2 GLU A 45 -8.370 0.336 12.190 1.00 31.31 O ATOM 0 H GLU A 45 -2.923 -0.000 13.019 1.00 11.31 H new ATOM 0 HA GLU A 45 -5.089 -0.541 14.671 1.00 60.41 H new ATOM 0 HB2 GLU A 45 -4.460 -0.728 11.753 1.00 12.44 H new ATOM 0 HB3 GLU A 45 -5.876 -1.603 12.301 1.00 12.44 H new ATOM 0 HG2 GLU A 45 -6.322 0.774 13.531 1.00 34.21 H new ATOM 0 HG3 GLU A 45 -5.389 1.334 12.158 1.00 34.21 H new ATOM 706 N TYR A 46 -3.430 -3.197 13.769 1.00 51.33 N ATOM 707 CA TYR A 46 -3.292 -4.633 13.976 1.00 24.25 C ATOM 708 C TYR A 46 -2.933 -4.942 15.427 1.00 40.11 C ATOM 709 O TYR A 46 -3.401 -5.927 15.997 1.00 3.13 O ATOM 710 CB TYR A 46 -2.223 -5.204 13.043 1.00 71.14 C ATOM 711 CG TYR A 46 -1.770 -6.596 13.420 1.00 33.51 C ATOM 712 CD1 TYR A 46 -2.444 -7.718 12.953 1.00 32.13 C ATOM 713 CD2 TYR A 46 -0.668 -6.790 14.243 1.00 25.11 C ATOM 714 CE1 TYR A 46 -2.034 -8.992 13.296 1.00 13.14 C ATOM 715 CE2 TYR A 46 -0.250 -8.060 14.590 1.00 24.42 C ATOM 716 CZ TYR A 46 -0.936 -9.158 14.115 1.00 55.12 C ATOM 717 OH TYR A 46 -0.524 -10.425 14.458 1.00 72.23 O ATOM 0 H TYR A 46 -2.633 -2.759 13.307 1.00 51.33 H new ATOM 0 HA TYR A 46 -4.250 -5.100 13.749 1.00 24.25 H new ATOM 0 HB2 TYR A 46 -2.613 -5.221 12.025 1.00 71.14 H new ATOM 0 HB3 TYR A 46 -1.360 -4.538 13.043 1.00 71.14 H new ATOM 0 HD1 TYR A 46 -3.303 -7.592 12.311 1.00 32.13 H new ATOM 0 HD2 TYR A 46 -0.129 -5.933 14.618 1.00 25.11 H new ATOM 0 HE1 TYR A 46 -2.570 -9.853 12.925 1.00 13.14 H new ATOM 0 HE2 TYR A 46 0.610 -8.192 15.230 1.00 24.42 H new ATOM 0 HH TYR A 46 -0.998 -11.083 13.908 1.00 72.23 H new ATOM 727 N MET A 47 -2.100 -4.091 16.017 1.00 24.42 N ATOM 728 CA MET A 47 -1.679 -4.271 17.402 1.00 61.31 C ATOM 729 C MET A 47 -2.797 -3.883 18.365 1.00 63.14 C ATOM 730 O MET A 47 -2.828 -4.335 19.510 1.00 32.10 O ATOM 731 CB MET A 47 -0.429 -3.437 17.690 1.00 32.21 C ATOM 732 CG MET A 47 0.803 -3.907 16.934 1.00 53.14 C ATOM 733 SD MET A 47 1.685 -5.224 17.793 1.00 41.04 S ATOM 734 CE MET A 47 2.443 -4.307 19.131 1.00 1.42 C ATOM 0 H MET A 47 -1.703 -3.271 15.558 1.00 24.42 H new ATOM 0 HA MET A 47 -1.445 -5.325 17.551 1.00 61.31 H new ATOM 0 HB2 MET A 47 -0.629 -2.397 17.432 1.00 32.21 H new ATOM 0 HB3 MET A 47 -0.222 -3.466 18.760 1.00 32.21 H new ATOM 0 HG2 MET A 47 0.506 -4.258 15.946 1.00 53.14 H new ATOM 0 HG3 MET A 47 1.476 -3.063 16.783 1.00 53.14 H new ATOM 0 HE1 MET A 47 3.517 -4.491 19.135 1.00 1.42 H new ATOM 0 HE2 MET A 47 2.257 -3.242 18.993 1.00 1.42 H new ATOM 0 HE3 MET A 47 2.016 -4.629 20.081 1.00 1.42 H new ATOM 744 N LEU A 48 -3.712 -3.044 17.893 1.00 0.54 N ATOM 745 CA LEU A 48 -4.832 -2.594 18.713 1.00 71.20 C ATOM 746 C LEU A 48 -6.087 -3.409 18.414 1.00 5.15 C ATOM 747 O LEU A 48 -7.203 -2.893 18.476 1.00 63.23 O ATOM 748 CB LEU A 48 -5.105 -1.109 18.469 1.00 44.12 C ATOM 749 CG LEU A 48 -3.919 -0.166 18.675 1.00 23.04 C ATOM 750 CD1 LEU A 48 -4.231 1.214 18.118 1.00 44.12 C ATOM 751 CD2 LEU A 48 -3.558 -0.078 20.151 1.00 32.02 C ATOM 0 H LEU A 48 -3.701 -2.662 16.947 1.00 0.54 H new ATOM 0 HA LEU A 48 -4.566 -2.741 19.760 1.00 71.20 H new ATOM 0 HB2 LEU A 48 -5.465 -0.989 17.447 1.00 44.12 H new ATOM 0 HB3 LEU A 48 -5.912 -0.795 19.131 1.00 44.12 H new ATOM 0 HG LEU A 48 -3.062 -0.568 18.135 1.00 23.04 H new ATOM 0 HD11 LEU A 48 -3.375 1.871 18.274 1.00 44.12 H new ATOM 0 HD12 LEU A 48 -4.440 1.137 17.051 1.00 44.12 H new ATOM 0 HD13 LEU A 48 -5.102 1.624 18.629 1.00 44.12 H new ATOM 0 HD21 LEU A 48 -2.712 0.597 20.279 1.00 32.02 H new ATOM 0 HD22 LEU A 48 -4.412 0.300 20.713 1.00 32.02 H new ATOM 0 HD23 LEU A 48 -3.291 -1.068 20.520 1.00 32.02 H new ATOM 763 N ARG A 49 -5.895 -4.684 18.093 1.00 31.25 N ATOM 764 CA ARG A 49 -7.011 -5.571 17.787 1.00 51.34 C ATOM 765 C ARG A 49 -7.108 -6.698 18.811 1.00 41.50 C ATOM 766 O ARG A 49 -6.118 -7.100 19.423 1.00 14.22 O ATOM 767 CB ARG A 49 -6.854 -6.156 16.382 1.00 30.00 C ATOM 768 CG ARG A 49 -7.534 -5.334 15.300 1.00 52.41 C ATOM 769 CD ARG A 49 -7.044 -5.723 13.914 1.00 52.52 C ATOM 770 NE ARG A 49 -8.103 -5.626 12.912 1.00 5.11 N ATOM 771 CZ ARG A 49 -9.072 -6.524 12.778 1.00 12.25 C ATOM 772 NH1 ARG A 49 -9.117 -7.580 13.579 1.00 14.31 N ATOM 773 NH2 ARG A 49 -10.000 -6.366 11.843 1.00 62.32 N ATOM 0 H ARG A 49 -4.977 -5.126 18.038 1.00 31.25 H new ATOM 0 HA ARG A 49 -7.930 -4.986 17.830 1.00 51.34 H new ATOM 0 HB2 ARG A 49 -5.792 -6.240 16.149 1.00 30.00 H new ATOM 0 HB3 ARG A 49 -7.264 -7.166 16.370 1.00 30.00 H new ATOM 0 HG2 ARG A 49 -8.613 -5.475 15.358 1.00 52.41 H new ATOM 0 HG3 ARG A 49 -7.341 -4.275 15.471 1.00 52.41 H new ATOM 0 HD2 ARG A 49 -6.214 -5.077 13.628 1.00 52.52 H new ATOM 0 HD3 ARG A 49 -6.660 -6.743 13.938 1.00 52.52 H new ATOM 0 HE ARG A 49 -8.098 -4.825 12.281 1.00 5.11 H new ATOM 0 HH11 ARG A 49 -8.406 -7.704 14.300 1.00 14.31 H new ATOM 0 HH12 ARG A 49 -9.862 -8.268 13.474 1.00 14.31 H new ATOM 0 HH21 ARG A 49 -9.970 -5.554 11.226 1.00 62.32 H new ATOM 0 HH22 ARG A 49 -10.744 -7.056 11.741 1.00 62.32 H new ATOM 787 N PRO A 50 -8.328 -7.220 19.003 1.00 14.53 N ATOM 788 CA PRO A 50 -8.584 -8.307 19.953 1.00 43.22 C ATOM 789 C PRO A 50 -7.983 -9.631 19.493 1.00 4.34 C ATOM 790 O PRO A 50 -7.434 -10.386 20.296 1.00 74.10 O ATOM 791 CB PRO A 50 -10.111 -8.396 19.987 1.00 75.40 C ATOM 792 CG PRO A 50 -10.552 -7.852 18.672 1.00 14.13 C ATOM 793 CD PRO A 50 -9.553 -6.789 18.308 1.00 11.12 C ATOM 0 HA PRO A 50 -8.133 -8.113 20.926 1.00 43.22 H new ATOM 0 HB2 PRO A 50 -10.445 -9.425 20.122 1.00 75.40 H new ATOM 0 HB3 PRO A 50 -10.523 -7.817 20.813 1.00 75.40 H new ATOM 0 HG2 PRO A 50 -10.581 -8.636 17.915 1.00 14.13 H new ATOM 0 HG3 PRO A 50 -11.557 -7.436 18.739 1.00 14.13 H new ATOM 0 HD2 PRO A 50 -9.404 -6.730 17.230 1.00 11.12 H new ATOM 0 HD3 PRO A 50 -9.877 -5.802 18.639 1.00 11.12 H new ATOM 801 N SER A 51 -8.089 -9.906 18.197 1.00 2.53 N ATOM 802 CA SER A 51 -7.558 -11.140 17.632 1.00 73.52 C ATOM 803 C SER A 51 -6.112 -11.360 18.066 1.00 14.24 C ATOM 804 O SER A 51 -5.734 -12.459 18.472 1.00 2.34 O ATOM 805 CB SER A 51 -7.644 -11.105 16.105 1.00 62.03 C ATOM 806 OG SER A 51 -6.954 -12.201 15.530 1.00 60.24 O ATOM 0 H SER A 51 -8.538 -9.291 17.519 1.00 2.53 H new ATOM 0 HA SER A 51 -8.160 -11.969 18.004 1.00 73.52 H new ATOM 0 HB2 SER A 51 -8.689 -11.127 15.796 1.00 62.03 H new ATOM 0 HB3 SER A 51 -7.221 -10.171 15.735 1.00 62.03 H new ATOM 0 HG SER A 51 -7.025 -12.157 14.554 1.00 60.24 H new ATOM 812 N VAL A 52 -5.308 -10.305 17.978 1.00 20.21 N ATOM 813 CA VAL A 52 -3.904 -10.380 18.363 1.00 63.52 C ATOM 814 C VAL A 52 -3.757 -10.676 19.851 1.00 24.02 C ATOM 815 O VAL A 52 -4.358 -10.006 20.690 1.00 61.14 O ATOM 816 CB VAL A 52 -3.161 -9.072 18.035 1.00 41.33 C ATOM 817 CG1 VAL A 52 -1.707 -9.158 18.474 1.00 71.15 C ATOM 818 CG2 VAL A 52 -3.260 -8.761 16.549 1.00 73.32 C ATOM 0 H VAL A 52 -5.605 -9.388 17.643 1.00 20.21 H new ATOM 0 HA VAL A 52 -3.462 -11.194 17.788 1.00 63.52 H new ATOM 0 HB VAL A 52 -3.634 -8.259 18.586 1.00 41.33 H new ATOM 0 HG11 VAL A 52 -1.199 -8.224 18.234 1.00 71.15 H new ATOM 0 HG12 VAL A 52 -1.661 -9.330 19.549 1.00 71.15 H new ATOM 0 HG13 VAL A 52 -1.218 -9.982 17.954 1.00 71.15 H new ATOM 0 HG21 VAL A 52 -2.729 -7.833 16.335 1.00 73.32 H new ATOM 0 HG22 VAL A 52 -2.814 -9.574 15.977 1.00 73.32 H new ATOM 0 HG23 VAL A 52 -4.308 -8.652 16.269 1.00 73.32 H new ATOM 828 N ASN A 53 -2.952 -11.684 20.172 1.00 20.01 N ATOM 829 CA ASN A 53 -2.725 -12.069 21.560 1.00 14.04 C ATOM 830 C ASN A 53 -1.615 -11.229 22.184 1.00 42.25 C ATOM 831 O ASN A 53 -1.082 -10.315 21.552 1.00 74.51 O ATOM 832 CB ASN A 53 -2.367 -13.554 21.648 1.00 51.13 C ATOM 833 CG ASN A 53 -3.570 -14.452 21.436 1.00 32.41 C ATOM 834 OD1 ASN A 53 -4.664 -14.170 21.926 1.00 24.25 O ATOM 835 ND2 ASN A 53 -3.373 -15.542 20.703 1.00 52.12 N ATOM 0 H ASN A 53 -2.446 -12.249 19.490 1.00 20.01 H new ATOM 0 HA ASN A 53 -3.646 -11.891 22.115 1.00 14.04 H new ATOM 0 HB2 ASN A 53 -1.607 -13.787 20.902 1.00 51.13 H new ATOM 0 HB3 ASN A 53 -1.929 -13.762 22.624 1.00 51.13 H new ATOM 0 HD21 ASN A 53 -4.145 -16.185 20.527 1.00 52.12 H new ATOM 0 HD22 ASN A 53 -2.449 -15.737 20.316 1.00 52.12 H new ATOM 842 N THR A 54 -1.269 -11.544 23.428 1.00 62.21 N ATOM 843 CA THR A 54 -0.222 -10.819 24.137 1.00 34.13 C ATOM 844 C THR A 54 1.146 -11.085 23.520 1.00 11.22 C ATOM 845 O THR A 54 1.899 -10.154 23.232 1.00 32.25 O ATOM 846 CB THR A 54 -0.184 -11.204 25.628 1.00 30.13 C ATOM 847 OG1 THR A 54 -1.193 -12.181 25.908 1.00 24.30 O ATOM 848 CG2 THR A 54 -0.397 -9.982 26.508 1.00 10.34 C ATOM 0 H THR A 54 -1.699 -12.297 23.966 1.00 62.21 H new ATOM 0 HA THR A 54 -0.457 -9.758 24.049 1.00 34.13 H new ATOM 0 HB THR A 54 0.798 -11.623 25.847 1.00 30.13 H new ATOM 0 HG1 THR A 54 -1.161 -12.422 26.857 1.00 24.30 H new ATOM 0 HG21 THR A 54 -0.366 -10.279 27.556 1.00 10.34 H new ATOM 0 HG22 THR A 54 0.389 -9.252 26.314 1.00 10.34 H new ATOM 0 HG23 THR A 54 -1.367 -9.538 26.285 1.00 10.34 H new ATOM 856 N ARG A 55 1.462 -12.360 23.319 1.00 55.03 N ATOM 857 CA ARG A 55 2.740 -12.748 22.736 1.00 43.43 C ATOM 858 C ARG A 55 2.967 -12.040 21.403 1.00 72.54 C ATOM 859 O ARG A 55 4.036 -11.481 21.159 1.00 1.03 O ATOM 860 CB ARG A 55 2.796 -14.263 22.537 1.00 72.40 C ATOM 861 CG ARG A 55 1.600 -14.823 21.783 1.00 25.11 C ATOM 862 CD ARG A 55 1.590 -16.344 21.806 1.00 51.55 C ATOM 863 NE ARG A 55 1.267 -16.869 23.129 1.00 34.22 N ATOM 864 CZ ARG A 55 0.028 -16.962 23.601 1.00 62.44 C ATOM 865 NH1 ARG A 55 -0.998 -16.568 22.860 1.00 51.32 N ATOM 866 NH2 ARG A 55 -0.185 -17.452 24.815 1.00 15.23 N ATOM 0 H ARG A 55 0.850 -13.142 23.552 1.00 55.03 H new ATOM 0 HA ARG A 55 3.530 -12.450 23.425 1.00 43.43 H new ATOM 0 HB2 ARG A 55 3.707 -14.516 21.995 1.00 72.40 H new ATOM 0 HB3 ARG A 55 2.859 -14.747 23.512 1.00 72.40 H new ATOM 0 HG2 ARG A 55 0.679 -14.445 22.227 1.00 25.11 H new ATOM 0 HG3 ARG A 55 1.623 -14.474 20.751 1.00 25.11 H new ATOM 0 HD2 ARG A 55 0.863 -16.713 21.082 1.00 51.55 H new ATOM 0 HD3 ARG A 55 2.566 -16.718 21.496 1.00 51.55 H new ATOM 0 HE ARG A 55 2.034 -17.182 23.724 1.00 34.22 H new ATOM 0 HH11 ARG A 55 -0.838 -16.192 21.925 1.00 51.32 H new ATOM 0 HH12 ARG A 55 -1.948 -16.640 23.224 1.00 51.32 H new ATOM 0 HH21 ARG A 55 0.602 -17.758 25.387 1.00 15.23 H new ATOM 0 HH22 ARG A 55 -1.136 -17.523 25.177 1.00 15.23 H new ATOM 880 N ARG A 56 1.954 -12.071 20.543 1.00 14.41 N ATOM 881 CA ARG A 56 2.043 -11.434 19.234 1.00 33.34 C ATOM 882 C ARG A 56 2.390 -9.955 19.372 1.00 52.23 C ATOM 883 O ARG A 56 3.236 -9.434 18.644 1.00 14.13 O ATOM 884 CB ARG A 56 0.723 -11.591 18.476 1.00 23.34 C ATOM 885 CG ARG A 56 0.636 -12.873 17.664 1.00 45.01 C ATOM 886 CD ARG A 56 -0.780 -13.425 17.643 1.00 14.35 C ATOM 887 NE ARG A 56 -1.647 -12.675 16.738 1.00 63.24 N ATOM 888 CZ ARG A 56 -2.783 -13.154 16.243 1.00 2.02 C ATOM 889 NH1 ARG A 56 -3.188 -14.375 16.566 1.00 43.44 N ATOM 890 NH2 ARG A 56 -3.517 -12.411 15.425 1.00 62.04 N ATOM 0 H ARG A 56 1.062 -12.530 20.729 1.00 14.41 H new ATOM 0 HA ARG A 56 2.837 -11.925 18.672 1.00 33.34 H new ATOM 0 HB2 ARG A 56 -0.101 -11.566 19.189 1.00 23.34 H new ATOM 0 HB3 ARG A 56 0.593 -10.739 17.809 1.00 23.34 H new ATOM 0 HG2 ARG A 56 0.968 -12.682 16.644 1.00 45.01 H new ATOM 0 HG3 ARG A 56 1.312 -13.618 18.085 1.00 45.01 H new ATOM 0 HD2 ARG A 56 -0.757 -14.471 17.338 1.00 14.35 H new ATOM 0 HD3 ARG A 56 -1.195 -13.396 18.650 1.00 14.35 H new ATOM 0 HE ARG A 56 -1.365 -11.732 16.471 1.00 63.24 H new ATOM 0 HH11 ARG A 56 -2.627 -14.949 17.196 1.00 43.44 H new ATOM 0 HH12 ARG A 56 -4.061 -14.740 16.185 1.00 43.44 H new ATOM 0 HH21 ARG A 56 -3.209 -11.471 15.176 1.00 62.04 H new ATOM 0 HH22 ARG A 56 -4.389 -12.780 15.045 1.00 62.04 H new ATOM 904 N LYS A 57 1.731 -9.282 20.309 1.00 34.32 N ATOM 905 CA LYS A 57 1.969 -7.863 20.544 1.00 73.13 C ATOM 906 C LYS A 57 3.405 -7.620 20.995 1.00 44.43 C ATOM 907 O LYS A 57 4.109 -6.778 20.434 1.00 33.00 O ATOM 908 CB LYS A 57 0.995 -7.329 21.596 1.00 10.44 C ATOM 909 CG LYS A 57 -0.348 -6.907 21.025 1.00 64.13 C ATOM 910 CD LYS A 57 -1.408 -6.805 22.108 1.00 21.33 C ATOM 911 CE LYS A 57 -2.810 -6.900 21.527 1.00 52.43 C ATOM 912 NZ LYS A 57 -3.806 -7.328 22.547 1.00 33.33 N ATOM 0 H LYS A 57 1.027 -9.697 20.919 1.00 34.32 H new ATOM 0 HA LYS A 57 1.807 -7.332 19.606 1.00 73.13 H new ATOM 0 HB2 LYS A 57 0.833 -8.097 22.352 1.00 10.44 H new ATOM 0 HB3 LYS A 57 1.450 -6.476 22.100 1.00 10.44 H new ATOM 0 HG2 LYS A 57 -0.245 -5.944 20.524 1.00 64.13 H new ATOM 0 HG3 LYS A 57 -0.666 -7.627 20.271 1.00 64.13 H new ATOM 0 HD2 LYS A 57 -1.261 -7.601 22.838 1.00 21.33 H new ATOM 0 HD3 LYS A 57 -1.297 -5.860 22.640 1.00 21.33 H new ATOM 0 HE2 LYS A 57 -3.101 -5.932 21.120 1.00 52.43 H new ATOM 0 HE3 LYS A 57 -2.812 -7.608 20.698 1.00 52.43 H new ATOM 0 HZ1 LYS A 57 -4.205 -8.250 22.277 1.00 33.33 H new ATOM 0 HZ2 LYS A 57 -3.341 -7.409 23.474 1.00 33.33 H new ATOM 0 HZ3 LYS A 57 -4.569 -6.624 22.604 1.00 33.33 H new ATOM 926 N LEU A 58 3.836 -8.361 22.009 1.00 32.41 N ATOM 927 CA LEU A 58 5.190 -8.227 22.534 1.00 21.25 C ATOM 928 C LEU A 58 6.221 -8.322 21.414 1.00 13.30 C ATOM 929 O LEU A 58 7.089 -7.458 21.280 1.00 21.32 O ATOM 930 CB LEU A 58 5.460 -9.307 23.584 1.00 45.21 C ATOM 931 CG LEU A 58 6.800 -9.212 24.315 1.00 42.22 C ATOM 932 CD1 LEU A 58 7.914 -9.805 23.467 1.00 63.05 C ATOM 933 CD2 LEU A 58 7.112 -7.766 24.672 1.00 55.31 C ATOM 0 H LEU A 58 3.267 -9.061 22.485 1.00 32.41 H new ATOM 0 HA LEU A 58 5.277 -7.245 23.000 1.00 21.25 H new ATOM 0 HB2 LEU A 58 4.661 -9.273 24.325 1.00 45.21 H new ATOM 0 HB3 LEU A 58 5.402 -10.281 23.098 1.00 45.21 H new ATOM 0 HG LEU A 58 6.729 -9.786 25.239 1.00 42.22 H new ATOM 0 HD11 LEU A 58 8.860 -9.728 24.003 1.00 63.05 H new ATOM 0 HD12 LEU A 58 7.697 -10.853 23.262 1.00 63.05 H new ATOM 0 HD13 LEU A 58 7.985 -9.259 22.526 1.00 63.05 H new ATOM 0 HD21 LEU A 58 8.069 -7.718 25.192 1.00 55.31 H new ATOM 0 HD22 LEU A 58 7.163 -7.169 23.761 1.00 55.31 H new ATOM 0 HD23 LEU A 58 6.328 -7.374 25.319 1.00 55.31 H new ATOM 945 N LEU A 59 6.118 -9.374 20.610 1.00 72.11 N ATOM 946 CA LEU A 59 7.040 -9.581 19.498 1.00 13.44 C ATOM 947 C LEU A 59 6.977 -8.416 18.515 1.00 31.22 C ATOM 948 O LEU A 59 8.005 -7.876 18.110 1.00 24.03 O ATOM 949 CB LEU A 59 6.715 -10.890 18.777 1.00 11.02 C ATOM 950 CG LEU A 59 7.377 -12.148 19.339 1.00 24.25 C ATOM 951 CD1 LEU A 59 8.828 -12.233 18.891 1.00 22.32 C ATOM 952 CD2 LEU A 59 7.285 -12.166 20.858 1.00 33.53 C ATOM 0 H LEU A 59 5.405 -10.097 20.707 1.00 72.11 H new ATOM 0 HA LEU A 59 8.051 -9.638 19.902 1.00 13.44 H new ATOM 0 HB2 LEU A 59 5.635 -11.033 18.795 1.00 11.02 H new ATOM 0 HB3 LEU A 59 7.005 -10.787 17.731 1.00 11.02 H new ATOM 0 HG LEU A 59 6.847 -13.018 18.952 1.00 24.25 H new ATOM 0 HD11 LEU A 59 9.283 -13.135 19.301 1.00 22.32 H new ATOM 0 HD12 LEU A 59 8.871 -12.267 17.802 1.00 22.32 H new ATOM 0 HD13 LEU A 59 9.371 -11.358 19.248 1.00 22.32 H new ATOM 0 HD21 LEU A 59 7.761 -13.069 21.241 1.00 33.53 H new ATOM 0 HD22 LEU A 59 7.790 -11.289 21.264 1.00 33.53 H new ATOM 0 HD23 LEU A 59 6.238 -12.153 21.159 1.00 33.53 H new ATOM 964 N GLY A 60 5.761 -8.033 18.136 1.00 3.14 N ATOM 965 CA GLY A 60 5.587 -6.933 17.205 1.00 34.35 C ATOM 966 C GLY A 60 6.297 -5.673 17.657 1.00 13.34 C ATOM 967 O GLY A 60 6.875 -4.951 16.844 1.00 54.14 O ATOM 0 H GLY A 60 4.894 -8.464 18.457 1.00 3.14 H new ATOM 0 HA2 GLY A 60 5.964 -7.227 16.225 1.00 34.35 H new ATOM 0 HA3 GLY A 60 4.523 -6.725 17.088 1.00 34.35 H new ATOM 971 N LEU A 61 6.253 -5.405 18.958 1.00 61.02 N ATOM 972 CA LEU A 61 6.896 -4.221 19.517 1.00 22.13 C ATOM 973 C LEU A 61 8.399 -4.244 19.258 1.00 41.02 C ATOM 974 O LEU A 61 8.985 -3.239 18.854 1.00 71.34 O ATOM 975 CB LEU A 61 6.628 -4.133 21.021 1.00 71.23 C ATOM 976 CG LEU A 61 6.449 -2.725 21.589 1.00 20.13 C ATOM 977 CD1 LEU A 61 6.361 -2.769 23.107 1.00 65.50 C ATOM 978 CD2 LEU A 61 7.590 -1.822 21.145 1.00 2.33 C ATOM 0 H LEU A 61 5.779 -5.991 19.645 1.00 61.02 H new ATOM 0 HA LEU A 61 6.475 -3.343 19.027 1.00 22.13 H new ATOM 0 HB2 LEU A 61 5.731 -4.710 21.244 1.00 71.23 H new ATOM 0 HB3 LEU A 61 7.454 -4.613 21.546 1.00 71.23 H new ATOM 0 HG LEU A 61 5.516 -2.314 21.203 1.00 20.13 H new ATOM 0 HD11 LEU A 61 6.234 -1.758 23.494 1.00 65.50 H new ATOM 0 HD12 LEU A 61 5.510 -3.381 23.405 1.00 65.50 H new ATOM 0 HD13 LEU A 61 7.277 -3.200 23.512 1.00 65.50 H new ATOM 0 HD21 LEU A 61 7.446 -0.824 21.559 1.00 2.33 H new ATOM 0 HD22 LEU A 61 8.536 -2.229 21.501 1.00 2.33 H new ATOM 0 HD23 LEU A 61 7.606 -1.765 20.057 1.00 2.33 H new ATOM 990 N TYR A 62 9.017 -5.397 19.491 1.00 51.41 N ATOM 991 CA TYR A 62 10.452 -5.550 19.283 1.00 72.54 C ATOM 992 C TYR A 62 10.802 -5.441 17.802 1.00 62.12 C ATOM 993 O TYR A 62 11.865 -4.936 17.439 1.00 42.23 O ATOM 994 CB TYR A 62 10.927 -6.897 19.832 1.00 13.55 C ATOM 995 CG TYR A 62 11.305 -6.853 21.296 1.00 71.42 C ATOM 996 CD1 TYR A 62 10.350 -7.047 22.286 1.00 32.22 C ATOM 997 CD2 TYR A 62 12.617 -6.618 21.688 1.00 32.10 C ATOM 998 CE1 TYR A 62 10.690 -7.008 23.624 1.00 24.05 C ATOM 999 CE2 TYR A 62 12.967 -6.579 23.024 1.00 53.32 C ATOM 1000 CZ TYR A 62 12.000 -6.774 23.988 1.00 1.02 C ATOM 1001 OH TYR A 62 12.345 -6.734 25.320 1.00 75.11 O ATOM 0 H TYR A 62 8.547 -6.239 19.824 1.00 51.41 H new ATOM 0 HA TYR A 62 10.959 -4.747 19.818 1.00 72.54 H new ATOM 0 HB2 TYR A 62 10.139 -7.636 19.691 1.00 13.55 H new ATOM 0 HB3 TYR A 62 11.787 -7.233 19.253 1.00 13.55 H new ATOM 0 HD1 TYR A 62 9.324 -7.232 22.004 1.00 32.22 H new ATOM 0 HD2 TYR A 62 13.376 -6.463 20.936 1.00 32.10 H new ATOM 0 HE1 TYR A 62 9.935 -7.160 24.381 1.00 24.05 H new ATOM 0 HE2 TYR A 62 13.992 -6.397 23.312 1.00 53.32 H new ATOM 0 HH TYR A 62 13.306 -6.560 25.404 1.00 75.11 H new ATOM 1011 N LEU A 63 9.900 -5.918 16.951 1.00 45.33 N ATOM 1012 CA LEU A 63 10.112 -5.874 15.508 1.00 51.31 C ATOM 1013 C LEU A 63 10.145 -4.434 15.006 1.00 53.20 C ATOM 1014 O LEU A 63 11.104 -4.013 14.361 1.00 43.15 O ATOM 1015 CB LEU A 63 9.010 -6.652 14.787 1.00 31.12 C ATOM 1016 CG LEU A 63 9.072 -6.644 13.259 1.00 14.14 C ATOM 1017 CD1 LEU A 63 8.382 -5.407 12.704 1.00 65.20 C ATOM 1018 CD2 LEU A 63 10.515 -6.711 12.784 1.00 65.14 C ATOM 0 H LEU A 63 9.016 -6.339 17.235 1.00 45.33 H new ATOM 0 HA LEU A 63 11.075 -6.336 15.293 1.00 51.31 H new ATOM 0 HB2 LEU A 63 9.042 -7.687 15.126 1.00 31.12 H new ATOM 0 HB3 LEU A 63 8.046 -6.246 15.094 1.00 31.12 H new ATOM 0 HG LEU A 63 8.548 -7.525 12.888 1.00 14.14 H new ATOM 0 HD11 LEU A 63 8.436 -5.418 11.615 1.00 65.20 H new ATOM 0 HD12 LEU A 63 7.338 -5.402 13.016 1.00 65.20 H new ATOM 0 HD13 LEU A 63 8.878 -4.513 13.083 1.00 65.20 H new ATOM 0 HD21 LEU A 63 10.540 -6.704 11.694 1.00 65.14 H new ATOM 0 HD22 LEU A 63 11.064 -5.850 13.165 1.00 65.14 H new ATOM 0 HD23 LEU A 63 10.977 -7.627 13.152 1.00 65.14 H new ATOM 1030 N MET A 64 9.091 -3.683 15.309 1.00 51.21 N ATOM 1031 CA MET A 64 9.001 -2.289 14.891 1.00 1.52 C ATOM 1032 C MET A 64 10.095 -1.453 15.548 1.00 11.42 C ATOM 1033 O MET A 64 10.579 -0.481 14.969 1.00 72.22 O ATOM 1034 CB MET A 64 7.626 -1.716 15.241 1.00 21.44 C ATOM 1035 CG MET A 64 7.499 -1.286 16.694 1.00 50.03 C ATOM 1036 SD MET A 64 7.859 0.464 16.933 1.00 10.44 S ATOM 1037 CE MET A 64 6.908 0.806 18.412 1.00 2.24 C ATOM 0 H MET A 64 8.288 -4.016 15.842 1.00 51.21 H new ATOM 0 HA MET A 64 9.138 -2.251 13.810 1.00 1.52 H new ATOM 0 HB2 MET A 64 7.424 -0.859 14.598 1.00 21.44 H new ATOM 0 HB3 MET A 64 6.864 -2.464 15.024 1.00 21.44 H new ATOM 0 HG2 MET A 64 6.488 -1.496 17.044 1.00 50.03 H new ATOM 0 HG3 MET A 64 8.178 -1.880 17.305 1.00 50.03 H new ATOM 0 HE1 MET A 64 6.079 1.470 18.166 1.00 2.24 H new ATOM 0 HE2 MET A 64 6.517 -0.127 18.817 1.00 2.24 H new ATOM 0 HE3 MET A 64 7.548 1.284 19.154 1.00 2.24 H new ATOM 1047 N ASN A 65 10.479 -1.837 16.761 1.00 65.11 N ATOM 1048 CA ASN A 65 11.516 -1.122 17.497 1.00 52.13 C ATOM 1049 C ASN A 65 12.892 -1.384 16.892 1.00 73.11 C ATOM 1050 O ASN A 65 13.763 -0.514 16.903 1.00 53.44 O ATOM 1051 CB ASN A 65 11.505 -1.539 18.969 1.00 64.02 C ATOM 1052 CG ASN A 65 12.286 -0.580 19.847 1.00 71.11 C ATOM 1053 OD1 ASN A 65 12.504 0.575 19.483 1.00 54.54 O ATOM 1054 ND2 ASN A 65 12.711 -1.057 21.011 1.00 23.00 N ATOM 0 H ASN A 65 10.088 -2.639 17.255 1.00 65.11 H new ATOM 0 HA ASN A 65 11.306 -0.055 17.427 1.00 52.13 H new ATOM 0 HB2 ASN A 65 10.475 -1.593 19.321 1.00 64.02 H new ATOM 0 HB3 ASN A 65 11.927 -2.540 19.064 1.00 64.02 H new ATOM 0 HD21 ASN A 65 13.241 -0.459 21.644 1.00 23.00 H new ATOM 0 HD22 ASN A 65 12.507 -2.022 21.272 1.00 23.00 H new ATOM 1061 N HIS A 66 13.080 -2.590 16.364 1.00 3.44 N ATOM 1062 CA HIS A 66 14.350 -2.967 15.754 1.00 50.45 C ATOM 1063 C HIS A 66 14.528 -2.281 14.402 1.00 14.23 C ATOM 1064 O HIS A 66 15.607 -1.780 14.086 1.00 71.22 O ATOM 1065 CB HIS A 66 14.427 -4.484 15.582 1.00 21.04 C ATOM 1066 CG HIS A 66 15.828 -5.011 15.536 1.00 62.15 C ATOM 1067 ND1 HIS A 66 16.678 -4.987 16.621 1.00 42.50 N ATOM 1068 CD2 HIS A 66 16.526 -5.581 14.526 1.00 45.25 C ATOM 1069 CE1 HIS A 66 17.839 -5.517 16.280 1.00 3.42 C ATOM 1070 NE2 HIS A 66 17.773 -5.886 15.014 1.00 42.33 N ATOM 0 H HIS A 66 12.370 -3.322 16.346 1.00 3.44 H new ATOM 0 HA HIS A 66 15.153 -2.642 16.416 1.00 50.45 H new ATOM 0 HB2 HIS A 66 13.895 -4.962 16.404 1.00 21.04 H new ATOM 0 HB3 HIS A 66 13.912 -4.764 14.663 1.00 21.04 H new ATOM 0 HD2 HIS A 66 16.169 -5.762 13.523 1.00 45.25 H new ATOM 0 HE1 HIS A 66 18.696 -5.629 16.927 1.00 3.42 H new ATOM 0 HE2 HIS A 66 18.526 -6.326 14.485 1.00 42.33 H new ATOM 1078 N VAL A 67 13.461 -2.262 13.609 1.00 64.34 N ATOM 1079 CA VAL A 67 13.499 -1.638 12.292 1.00 44.23 C ATOM 1080 C VAL A 67 13.695 -0.130 12.404 1.00 51.01 C ATOM 1081 O VAL A 67 14.476 0.463 11.659 1.00 33.13 O ATOM 1082 CB VAL A 67 12.209 -1.919 11.499 1.00 31.55 C ATOM 1083 CG1 VAL A 67 10.989 -1.471 12.289 1.00 33.33 C ATOM 1084 CG2 VAL A 67 12.257 -1.234 10.142 1.00 20.03 C ATOM 0 H VAL A 67 12.560 -2.672 13.856 1.00 64.34 H new ATOM 0 HA VAL A 67 14.345 -2.074 11.760 1.00 44.23 H new ATOM 0 HB VAL A 67 12.131 -2.994 11.334 1.00 31.55 H new ATOM 0 HG11 VAL A 67 10.087 -1.677 11.713 1.00 33.33 H new ATOM 0 HG12 VAL A 67 10.948 -2.013 13.234 1.00 33.33 H new ATOM 0 HG13 VAL A 67 11.056 -0.401 12.487 1.00 33.33 H new ATOM 0 HG21 VAL A 67 11.337 -1.444 9.596 1.00 20.03 H new ATOM 0 HG22 VAL A 67 12.359 -0.158 10.281 1.00 20.03 H new ATOM 0 HG23 VAL A 67 13.109 -1.609 9.575 1.00 20.03 H new ATOM 1094 N VAL A 68 12.980 0.486 13.341 1.00 65.25 N ATOM 1095 CA VAL A 68 13.076 1.925 13.552 1.00 2.22 C ATOM 1096 C VAL A 68 14.428 2.305 14.147 1.00 73.51 C ATOM 1097 O VAL A 68 14.991 3.348 13.817 1.00 73.24 O ATOM 1098 CB VAL A 68 11.958 2.431 14.483 1.00 50.33 C ATOM 1099 CG1 VAL A 68 10.591 2.148 13.879 1.00 61.35 C ATOM 1100 CG2 VAL A 68 12.083 1.797 15.860 1.00 64.14 C ATOM 0 H VAL A 68 12.328 0.011 13.965 1.00 65.25 H new ATOM 0 HA VAL A 68 12.967 2.396 12.575 1.00 2.22 H new ATOM 0 HB VAL A 68 12.063 3.510 14.594 1.00 50.33 H new ATOM 0 HG11 VAL A 68 9.814 2.512 14.551 1.00 61.35 H new ATOM 0 HG12 VAL A 68 10.506 2.654 12.917 1.00 61.35 H new ATOM 0 HG13 VAL A 68 10.472 1.074 13.735 1.00 61.35 H new ATOM 0 HG21 VAL A 68 11.285 2.166 16.504 1.00 64.14 H new ATOM 0 HG22 VAL A 68 12.005 0.714 15.770 1.00 64.14 H new ATOM 0 HG23 VAL A 68 13.049 2.056 16.294 1.00 64.14 H new ATOM 1110 N GLN A 69 14.943 1.450 15.025 1.00 35.10 N ATOM 1111 CA GLN A 69 16.229 1.696 15.666 1.00 12.21 C ATOM 1112 C GLN A 69 17.366 1.622 14.652 1.00 35.40 C ATOM 1113 O GLN A 69 18.270 2.457 14.658 1.00 75.45 O ATOM 1114 CB GLN A 69 16.464 0.685 16.789 1.00 5.04 C ATOM 1115 CG GLN A 69 15.893 1.120 18.129 1.00 30.02 C ATOM 1116 CD GLN A 69 16.249 0.167 19.253 1.00 64.21 C ATOM 1117 OE1 GLN A 69 17.341 -0.402 19.277 1.00 3.22 O ATOM 1118 NE2 GLN A 69 15.328 -0.013 20.192 1.00 72.02 N ATOM 0 H GLN A 69 14.489 0.581 15.308 1.00 35.10 H new ATOM 0 HA GLN A 69 16.210 2.700 16.089 1.00 12.21 H new ATOM 0 HB2 GLN A 69 16.019 -0.269 16.506 1.00 5.04 H new ATOM 0 HB3 GLN A 69 17.536 0.517 16.897 1.00 5.04 H new ATOM 0 HG2 GLN A 69 16.264 2.116 18.371 1.00 30.02 H new ATOM 0 HG3 GLN A 69 14.808 1.194 18.051 1.00 30.02 H new ATOM 0 HE21 GLN A 69 14.436 0.479 20.133 1.00 72.02 H new ATOM 0 HE22 GLN A 69 15.512 -0.643 20.973 1.00 72.02 H new ATOM 1127 N GLN A 70 17.313 0.616 13.784 1.00 13.41 N ATOM 1128 CA GLN A 70 18.339 0.433 12.765 1.00 42.11 C ATOM 1129 C GLN A 70 18.177 1.449 11.640 1.00 54.55 C ATOM 1130 O GLN A 70 19.154 1.861 11.016 1.00 63.24 O ATOM 1131 CB GLN A 70 18.278 -0.987 12.199 1.00 52.42 C ATOM 1132 CG GLN A 70 19.050 -2.004 13.023 1.00 33.21 C ATOM 1133 CD GLN A 70 20.542 -1.954 12.764 1.00 45.14 C ATOM 1134 OE1 GLN A 70 21.327 -1.609 13.648 1.00 32.21 O ATOM 1135 NE2 GLN A 70 20.944 -2.299 11.546 1.00 51.33 N ATOM 0 H GLN A 70 16.571 -0.084 13.767 1.00 13.41 H new ATOM 0 HA GLN A 70 19.311 0.589 13.233 1.00 42.11 H new ATOM 0 HB2 GLN A 70 17.236 -1.299 12.135 1.00 52.42 H new ATOM 0 HB3 GLN A 70 18.672 -0.981 11.183 1.00 52.42 H new ATOM 0 HG2 GLN A 70 18.863 -1.825 14.082 1.00 33.21 H new ATOM 0 HG3 GLN A 70 18.680 -3.004 12.798 1.00 33.21 H new ATOM 0 HE21 GLN A 70 20.260 -2.579 10.843 1.00 51.33 H new ATOM 0 HE22 GLN A 70 21.937 -2.284 11.313 1.00 51.33 H new ATOM 1144 N ALA A 71 16.935 1.850 11.385 1.00 22.04 N ATOM 1145 CA ALA A 71 16.645 2.819 10.336 1.00 11.43 C ATOM 1146 C ALA A 71 17.522 4.059 10.476 1.00 22.21 C ATOM 1147 O ALA A 71 17.858 4.709 9.486 1.00 3.53 O ATOM 1148 CB ALA A 71 15.174 3.206 10.367 1.00 74.30 C ATOM 0 H ALA A 71 16.114 1.518 11.891 1.00 22.04 H new ATOM 0 HA ALA A 71 16.868 2.354 9.375 1.00 11.43 H new ATOM 0 HB1 ALA A 71 14.972 3.930 9.578 1.00 74.30 H new ATOM 0 HB2 ALA A 71 14.561 2.318 10.211 1.00 74.30 H new ATOM 0 HB3 ALA A 71 14.934 3.647 11.335 1.00 74.30 H new ATOM 1154 N LYS A 72 17.890 4.381 11.711 1.00 0.34 N ATOM 1155 CA LYS A 72 18.729 5.543 11.982 1.00 60.31 C ATOM 1156 C LYS A 72 20.030 5.471 11.189 1.00 70.32 C ATOM 1157 O LYS A 72 20.575 6.494 10.778 1.00 41.13 O ATOM 1158 CB LYS A 72 19.036 5.638 13.478 1.00 1.51 C ATOM 1159 CG LYS A 72 18.093 6.557 14.235 1.00 11.30 C ATOM 1160 CD LYS A 72 18.644 6.916 15.605 1.00 52.10 C ATOM 1161 CE LYS A 72 17.988 8.172 16.158 1.00 34.22 C ATOM 1162 NZ LYS A 72 18.494 9.403 15.490 1.00 72.40 N ATOM 0 H LYS A 72 17.620 3.853 12.541 1.00 0.34 H new ATOM 0 HA LYS A 72 18.184 6.434 11.672 1.00 60.31 H new ATOM 0 HB2 LYS A 72 18.986 4.641 13.915 1.00 1.51 H new ATOM 0 HB3 LYS A 72 20.058 5.993 13.609 1.00 1.51 H new ATOM 0 HG2 LYS A 72 17.929 7.467 13.658 1.00 11.30 H new ATOM 0 HG3 LYS A 72 17.123 6.072 14.348 1.00 11.30 H new ATOM 0 HD2 LYS A 72 18.481 6.086 16.293 1.00 52.10 H new ATOM 0 HD3 LYS A 72 19.721 7.067 15.537 1.00 52.10 H new ATOM 0 HE2 LYS A 72 16.908 8.105 16.027 1.00 34.22 H new ATOM 0 HE3 LYS A 72 18.175 8.238 17.230 1.00 34.22 H new ATOM 0 HZ1 LYS A 72 18.155 10.241 16.004 1.00 72.40 H new ATOM 0 HZ2 LYS A 72 19.534 9.395 15.489 1.00 72.40 H new ATOM 0 HZ3 LYS A 72 18.147 9.434 14.510 1.00 72.40 H new ATOM 1176 N GLY A 73 20.522 4.254 10.976 1.00 32.21 N ATOM 1177 CA GLY A 73 21.754 4.071 10.232 1.00 40.44 C ATOM 1178 C GLY A 73 21.545 4.162 8.733 1.00 72.30 C ATOM 1179 O GLY A 73 22.471 4.484 7.990 1.00 51.25 O ATOM 0 H GLY A 73 20.089 3.391 11.306 1.00 32.21 H new ATOM 0 HA2 GLY A 73 22.477 4.826 10.541 1.00 40.44 H new ATOM 0 HA3 GLY A 73 22.182 3.099 10.478 1.00 40.44 H new ATOM 1183 N GLN A 74 20.325 3.875 8.289 1.00 63.30 N ATOM 1184 CA GLN A 74 19.999 3.923 6.869 1.00 40.03 C ATOM 1185 C GLN A 74 19.420 5.282 6.489 1.00 22.01 C ATOM 1186 O GLN A 74 18.819 5.438 5.426 1.00 70.20 O ATOM 1187 CB GLN A 74 19.006 2.815 6.514 1.00 13.20 C ATOM 1188 CG GLN A 74 19.666 1.478 6.218 1.00 14.04 C ATOM 1189 CD GLN A 74 20.358 0.888 7.431 1.00 2.31 C ATOM 1190 OE1 GLN A 74 21.540 0.546 7.380 1.00 32.50 O ATOM 1191 NE2 GLN A 74 19.625 0.767 8.531 1.00 32.04 N ATOM 0 H GLN A 74 19.547 3.607 8.892 1.00 63.30 H new ATOM 0 HA GLN A 74 20.919 3.770 6.306 1.00 40.03 H new ATOM 0 HB2 GLN A 74 18.304 2.690 7.339 1.00 13.20 H new ATOM 0 HB3 GLN A 74 18.425 3.124 5.645 1.00 13.20 H new ATOM 0 HG2 GLN A 74 18.913 0.777 5.857 1.00 14.04 H new ATOM 0 HG3 GLN A 74 20.393 1.606 5.416 1.00 14.04 H new ATOM 0 HE21 GLN A 74 18.649 1.063 8.529 1.00 32.04 H new ATOM 0 HE22 GLN A 74 20.038 0.378 9.379 1.00 32.04 H new ATOM 1200 N LYS A 75 19.605 6.264 7.365 1.00 31.31 N ATOM 1201 CA LYS A 75 19.102 7.611 7.123 1.00 63.24 C ATOM 1202 C LYS A 75 17.604 7.589 6.835 1.00 4.11 C ATOM 1203 O LYS A 75 17.156 8.068 5.793 1.00 2.21 O ATOM 1204 CB LYS A 75 19.848 8.252 5.950 1.00 1.33 C ATOM 1205 CG LYS A 75 21.355 8.072 6.016 1.00 11.34 C ATOM 1206 CD LYS A 75 21.928 8.635 7.306 1.00 14.43 C ATOM 1207 CE LYS A 75 23.405 8.966 7.162 1.00 2.23 C ATOM 1208 NZ LYS A 75 24.265 7.768 7.370 1.00 13.02 N ATOM 0 H LYS A 75 20.100 6.152 8.250 1.00 31.31 H new ATOM 0 HA LYS A 75 19.272 8.203 8.022 1.00 63.24 H new ATOM 0 HB2 LYS A 75 19.480 7.823 5.018 1.00 1.33 H new ATOM 0 HB3 LYS A 75 19.619 9.317 5.923 1.00 1.33 H new ATOM 0 HG2 LYS A 75 21.599 7.012 5.940 1.00 11.34 H new ATOM 0 HG3 LYS A 75 21.819 8.568 5.164 1.00 11.34 H new ATOM 0 HD2 LYS A 75 21.379 9.533 7.588 1.00 14.43 H new ATOM 0 HD3 LYS A 75 21.793 7.913 8.111 1.00 14.43 H new ATOM 0 HE2 LYS A 75 23.590 9.378 6.170 1.00 2.23 H new ATOM 0 HE3 LYS A 75 23.676 9.737 7.883 1.00 2.23 H new ATOM 0 HZ1 LYS A 75 25.264 8.035 7.263 1.00 13.02 H new ATOM 0 HZ2 LYS A 75 24.108 7.390 8.326 1.00 13.02 H new ATOM 0 HZ3 LYS A 75 24.024 7.041 6.666 1.00 13.02 H new ATOM 1222 N ILE A 76 16.836 7.032 7.765 1.00 1.32 N ATOM 1223 CA ILE A 76 15.389 6.951 7.612 1.00 51.42 C ATOM 1224 C ILE A 76 14.676 7.764 8.688 1.00 72.45 C ATOM 1225 O ILE A 76 14.905 7.568 9.881 1.00 4.14 O ATOM 1226 CB ILE A 76 14.897 5.493 7.675 1.00 53.43 C ATOM 1227 CG1 ILE A 76 15.831 4.582 6.876 1.00 30.02 C ATOM 1228 CG2 ILE A 76 13.473 5.392 7.149 1.00 15.04 C ATOM 1229 CD1 ILE A 76 15.938 4.958 5.415 1.00 61.32 C ATOM 0 H ILE A 76 17.192 6.630 8.632 1.00 1.32 H new ATOM 0 HA ILE A 76 15.152 7.364 6.631 1.00 51.42 H new ATOM 0 HB ILE A 76 14.904 5.167 8.715 1.00 53.43 H new ATOM 0 HG12 ILE A 76 16.824 4.611 7.324 1.00 30.02 H new ATOM 0 HG13 ILE A 76 15.476 3.554 6.953 1.00 30.02 H new ATOM 0 HG21 ILE A 76 13.139 4.356 7.200 1.00 15.04 H new ATOM 0 HG22 ILE A 76 12.816 6.015 7.756 1.00 15.04 H new ATOM 0 HG23 ILE A 76 13.442 5.733 6.114 1.00 15.04 H new ATOM 0 HD11 ILE A 76 16.616 4.270 4.911 1.00 61.32 H new ATOM 0 HD12 ILE A 76 14.953 4.901 4.952 1.00 61.32 H new ATOM 0 HD13 ILE A 76 16.322 5.974 5.328 1.00 61.32 H new ATOM 1241 N ILE A 77 13.809 8.674 8.257 1.00 60.24 N ATOM 1242 CA ILE A 77 13.060 9.514 9.183 1.00 31.50 C ATOM 1243 C ILE A 77 11.562 9.252 9.073 1.00 14.24 C ATOM 1244 O ILE A 77 10.803 9.536 10.000 1.00 42.41 O ATOM 1245 CB ILE A 77 13.329 11.009 8.931 1.00 74.14 C ATOM 1246 CG1 ILE A 77 14.834 11.277 8.874 1.00 20.51 C ATOM 1247 CG2 ILE A 77 12.675 11.855 10.013 1.00 20.43 C ATOM 1248 CD1 ILE A 77 15.554 10.952 10.164 1.00 2.53 C ATOM 0 H ILE A 77 13.608 8.848 7.272 1.00 60.24 H new ATOM 0 HA ILE A 77 13.399 9.257 10.187 1.00 31.50 H new ATOM 0 HB ILE A 77 12.894 11.284 7.970 1.00 74.14 H new ATOM 0 HG12 ILE A 77 15.269 10.689 8.066 1.00 20.51 H new ATOM 0 HG13 ILE A 77 14.999 12.326 8.629 1.00 20.51 H new ATOM 0 HG21 ILE A 77 12.874 12.909 9.821 1.00 20.43 H new ATOM 0 HG22 ILE A 77 11.599 11.683 10.009 1.00 20.43 H new ATOM 0 HG23 ILE A 77 13.083 11.580 10.986 1.00 20.43 H new ATOM 0 HD11 ILE A 77 16.617 11.166 10.051 1.00 2.53 H new ATOM 0 HD12 ILE A 77 15.145 11.559 10.972 1.00 2.53 H new ATOM 0 HD13 ILE A 77 15.420 9.896 10.400 1.00 2.53 H new ATOM 1260 N GLN A 78 11.143 8.708 7.935 1.00 22.55 N ATOM 1261 CA GLN A 78 9.735 8.407 7.706 1.00 61.54 C ATOM 1262 C GLN A 78 9.246 7.326 8.664 1.00 70.30 C ATOM 1263 O GLN A 78 8.168 7.440 9.247 1.00 13.30 O ATOM 1264 CB GLN A 78 9.517 7.959 6.259 1.00 0.02 C ATOM 1265 CG GLN A 78 9.724 9.069 5.241 1.00 20.22 C ATOM 1266 CD GLN A 78 11.187 9.411 5.040 1.00 21.02 C ATOM 1267 OE1 GLN A 78 11.999 8.547 4.707 1.00 74.22 O ATOM 1268 NE2 GLN A 78 11.532 10.677 5.242 1.00 4.21 N ATOM 0 H GLN A 78 11.758 8.467 7.158 1.00 22.55 H new ATOM 0 HA GLN A 78 9.161 9.315 7.889 1.00 61.54 H new ATOM 0 HB2 GLN A 78 10.200 7.139 6.034 1.00 0.02 H new ATOM 0 HB3 GLN A 78 8.505 7.568 6.157 1.00 0.02 H new ATOM 0 HG2 GLN A 78 9.291 8.767 4.287 1.00 20.22 H new ATOM 0 HG3 GLN A 78 9.188 9.960 5.567 1.00 20.22 H new ATOM 0 HE21 GLN A 78 10.826 11.360 5.517 1.00 4.21 H new ATOM 0 HE22 GLN A 78 12.503 10.966 5.122 1.00 4.21 H new ATOM 1277 N PHE A 79 10.045 6.276 8.822 1.00 5.10 N ATOM 1278 CA PHE A 79 9.693 5.173 9.709 1.00 42.41 C ATOM 1279 C PHE A 79 9.656 5.635 11.163 1.00 41.42 C ATOM 1280 O PHE A 79 8.803 5.206 11.939 1.00 50.21 O ATOM 1281 CB PHE A 79 10.693 4.026 9.552 1.00 33.41 C ATOM 1282 CG PHE A 79 10.189 2.907 8.686 1.00 64.34 C ATOM 1283 CD1 PHE A 79 8.974 2.299 8.953 1.00 35.44 C ATOM 1284 CD2 PHE A 79 10.932 2.463 7.603 1.00 11.50 C ATOM 1285 CE1 PHE A 79 8.509 1.268 8.158 1.00 13.30 C ATOM 1286 CE2 PHE A 79 10.472 1.434 6.804 1.00 72.22 C ATOM 1287 CZ PHE A 79 9.258 0.836 7.081 1.00 1.22 C ATOM 0 H PHE A 79 10.941 6.166 8.347 1.00 5.10 H new ATOM 0 HA PHE A 79 8.699 4.820 9.433 1.00 42.41 H new ATOM 0 HB2 PHE A 79 11.618 4.416 9.127 1.00 33.41 H new ATOM 0 HB3 PHE A 79 10.938 3.630 10.538 1.00 33.41 H new ATOM 0 HD1 PHE A 79 8.383 2.634 9.792 1.00 35.44 H new ATOM 0 HD2 PHE A 79 11.882 2.927 7.381 1.00 11.50 H new ATOM 0 HE1 PHE A 79 7.561 0.801 8.379 1.00 13.30 H new ATOM 0 HE2 PHE A 79 11.061 1.097 5.964 1.00 72.22 H new ATOM 0 HZ PHE A 79 8.895 0.033 6.457 1.00 1.22 H new ATOM 1297 N GLN A 80 10.588 6.512 11.523 1.00 51.12 N ATOM 1298 CA GLN A 80 10.663 7.031 12.883 1.00 13.32 C ATOM 1299 C GLN A 80 9.366 7.736 13.269 1.00 23.10 C ATOM 1300 O GLN A 80 8.758 7.422 14.292 1.00 23.24 O ATOM 1301 CB GLN A 80 11.842 7.996 13.019 1.00 14.53 C ATOM 1302 CG GLN A 80 13.173 7.392 12.605 1.00 45.34 C ATOM 1303 CD GLN A 80 14.337 8.339 12.824 1.00 23.53 C ATOM 1304 OE1 GLN A 80 14.168 9.558 12.831 1.00 11.21 O ATOM 1305 NE2 GLN A 80 15.528 7.780 13.006 1.00 44.32 N ATOM 0 H GLN A 80 11.301 6.878 10.892 1.00 51.12 H new ATOM 0 HA GLN A 80 10.812 6.189 13.559 1.00 13.32 H new ATOM 0 HB2 GLN A 80 11.649 8.880 12.411 1.00 14.53 H new ATOM 0 HB3 GLN A 80 11.910 8.330 14.054 1.00 14.53 H new ATOM 0 HG2 GLN A 80 13.344 6.476 13.170 1.00 45.34 H new ATOM 0 HG3 GLN A 80 13.129 7.113 11.552 1.00 45.34 H new ATOM 0 HE21 GLN A 80 15.622 6.764 12.992 1.00 44.32 H new ATOM 0 HE22 GLN A 80 16.348 8.366 13.159 1.00 44.32 H new ATOM 1314 N ASP A 81 8.949 8.690 12.444 1.00 61.32 N ATOM 1315 CA ASP A 81 7.724 9.439 12.698 1.00 20.11 C ATOM 1316 C ASP A 81 6.496 8.558 12.493 1.00 32.44 C ATOM 1317 O ASP A 81 5.513 8.666 13.226 1.00 33.14 O ATOM 1318 CB ASP A 81 7.649 10.661 11.782 1.00 52.04 C ATOM 1319 CG ASP A 81 6.534 11.611 12.173 1.00 32.44 C ATOM 1320 OD1 ASP A 81 5.358 11.192 12.136 1.00 40.25 O ATOM 1321 OD2 ASP A 81 6.837 12.773 12.517 1.00 31.40 O ATOM 0 H ASP A 81 9.441 8.963 11.593 1.00 61.32 H new ATOM 0 HA ASP A 81 7.740 9.773 13.735 1.00 20.11 H new ATOM 0 HB2 ASP A 81 8.601 11.191 11.810 1.00 52.04 H new ATOM 0 HB3 ASP A 81 7.498 10.332 10.754 1.00 52.04 H new ATOM 1326 N SER A 82 6.559 7.686 11.492 1.00 41.34 N ATOM 1327 CA SER A 82 5.450 6.790 11.187 1.00 22.31 C ATOM 1328 C SER A 82 5.166 5.859 12.362 1.00 60.30 C ATOM 1329 O SER A 82 4.048 5.813 12.876 1.00 23.42 O ATOM 1330 CB SER A 82 5.760 5.968 9.934 1.00 1.32 C ATOM 1331 OG SER A 82 5.471 6.704 8.758 1.00 63.21 O ATOM 0 H SER A 82 7.367 7.581 10.878 1.00 41.34 H new ATOM 0 HA SER A 82 4.564 7.398 11.004 1.00 22.31 H new ATOM 0 HB2 SER A 82 6.811 5.678 9.936 1.00 1.32 H new ATOM 0 HB3 SER A 82 5.175 5.048 9.944 1.00 1.32 H new ATOM 0 HG SER A 82 6.233 7.279 8.537 1.00 63.21 H new ATOM 1337 N PHE A 83 6.186 5.118 12.782 1.00 62.23 N ATOM 1338 CA PHE A 83 6.047 4.186 13.895 1.00 5.42 C ATOM 1339 C PHE A 83 5.941 4.935 15.221 1.00 41.15 C ATOM 1340 O PHE A 83 5.473 4.389 16.219 1.00 43.12 O ATOM 1341 CB PHE A 83 7.236 3.224 13.934 1.00 5.21 C ATOM 1342 CG PHE A 83 7.034 1.988 13.106 1.00 65.24 C ATOM 1343 CD1 PHE A 83 5.917 1.190 13.289 1.00 31.32 C ATOM 1344 CD2 PHE A 83 7.963 1.623 12.143 1.00 14.54 C ATOM 1345 CE1 PHE A 83 5.728 0.051 12.528 1.00 12.42 C ATOM 1346 CE2 PHE A 83 7.779 0.487 11.379 1.00 34.32 C ATOM 1347 CZ PHE A 83 6.661 -0.301 11.573 1.00 55.14 C ATOM 0 H PHE A 83 7.118 5.145 12.368 1.00 62.23 H new ATOM 0 HA PHE A 83 5.131 3.615 13.746 1.00 5.42 H new ATOM 0 HB2 PHE A 83 8.127 3.745 13.583 1.00 5.21 H new ATOM 0 HB3 PHE A 83 7.424 2.933 14.967 1.00 5.21 H new ATOM 0 HD1 PHE A 83 5.185 1.461 14.035 1.00 31.32 H new ATOM 0 HD2 PHE A 83 8.840 2.234 11.989 1.00 14.54 H new ATOM 0 HE1 PHE A 83 4.852 -0.562 12.680 1.00 12.42 H new ATOM 0 HE2 PHE A 83 8.509 0.215 10.631 1.00 34.32 H new ATOM 0 HZ PHE A 83 6.517 -1.191 10.979 1.00 55.14 H new ATOM 1357 N GLY A 84 6.380 6.190 15.221 1.00 12.43 N ATOM 1358 CA GLY A 84 6.326 6.994 16.428 1.00 3.14 C ATOM 1359 C GLY A 84 4.955 7.595 16.665 1.00 73.41 C ATOM 1360 O GLY A 84 4.507 7.710 17.806 1.00 21.21 O ATOM 0 H GLY A 84 6.772 6.664 14.407 1.00 12.43 H new ATOM 0 HA2 GLY A 84 6.602 6.378 17.284 1.00 3.14 H new ATOM 0 HA3 GLY A 84 7.063 7.794 16.361 1.00 3.14 H new ATOM 1364 N LYS A 85 4.285 7.980 15.584 1.00 1.30 N ATOM 1365 CA LYS A 85 2.956 8.573 15.678 1.00 63.04 C ATOM 1366 C LYS A 85 1.925 7.532 16.102 1.00 1.44 C ATOM 1367 O LYS A 85 0.788 7.869 16.432 1.00 53.34 O ATOM 1368 CB LYS A 85 2.553 9.187 14.335 1.00 65.01 C ATOM 1369 CG LYS A 85 2.405 8.167 13.220 1.00 72.43 C ATOM 1370 CD LYS A 85 1.410 8.630 12.169 1.00 52.11 C ATOM 1371 CE LYS A 85 -0.016 8.268 12.554 1.00 55.11 C ATOM 1372 NZ LYS A 85 -1.013 8.888 11.637 1.00 2.32 N ATOM 0 H LYS A 85 4.641 7.892 14.632 1.00 1.30 H new ATOM 0 HA LYS A 85 2.988 9.357 16.435 1.00 63.04 H new ATOM 0 HB2 LYS A 85 1.610 9.719 14.457 1.00 65.01 H new ATOM 0 HB3 LYS A 85 3.300 9.925 14.044 1.00 65.01 H new ATOM 0 HG2 LYS A 85 3.375 7.994 12.753 1.00 72.43 H new ATOM 0 HG3 LYS A 85 2.078 7.215 13.638 1.00 72.43 H new ATOM 0 HD2 LYS A 85 1.491 9.709 12.041 1.00 52.11 H new ATOM 0 HD3 LYS A 85 1.655 8.176 11.209 1.00 52.11 H new ATOM 0 HE2 LYS A 85 -0.132 7.184 12.538 1.00 55.11 H new ATOM 0 HE3 LYS A 85 -0.210 8.594 13.576 1.00 55.11 H new ATOM 0 HZ1 LYS A 85 -1.972 8.617 11.933 1.00 2.32 H new ATOM 0 HZ2 LYS A 85 -0.919 9.923 11.671 1.00 2.32 H new ATOM 0 HZ3 LYS A 85 -0.844 8.557 10.666 1.00 2.32 H new ATOM 1386 N VAL A 86 2.330 6.266 16.094 1.00 4.43 N ATOM 1387 CA VAL A 86 1.442 5.177 16.481 1.00 23.23 C ATOM 1388 C VAL A 86 2.046 4.351 17.612 1.00 60.14 C ATOM 1389 O VAL A 86 1.438 3.393 18.087 1.00 32.42 O ATOM 1390 CB VAL A 86 1.138 4.250 15.289 1.00 0.31 C ATOM 1391 CG1 VAL A 86 0.495 5.033 14.155 1.00 41.34 C ATOM 1392 CG2 VAL A 86 2.407 3.556 14.817 1.00 14.20 C ATOM 0 H VAL A 86 3.268 5.970 15.824 1.00 4.43 H new ATOM 0 HA VAL A 86 0.513 5.633 16.824 1.00 23.23 H new ATOM 0 HB VAL A 86 0.433 3.485 15.616 1.00 0.31 H new ATOM 0 HG11 VAL A 86 0.287 4.362 13.322 1.00 41.34 H new ATOM 0 HG12 VAL A 86 -0.437 5.479 14.503 1.00 41.34 H new ATOM 0 HG13 VAL A 86 1.173 5.821 13.826 1.00 41.34 H new ATOM 0 HG21 VAL A 86 2.174 2.905 13.974 1.00 14.20 H new ATOM 0 HG22 VAL A 86 3.137 4.304 14.507 1.00 14.20 H new ATOM 0 HG23 VAL A 86 2.821 2.961 15.631 1.00 14.20 H new ATOM 1402 N ALA A 87 3.247 4.729 18.038 1.00 54.53 N ATOM 1403 CA ALA A 87 3.932 4.025 19.114 1.00 1.53 C ATOM 1404 C ALA A 87 3.299 4.339 20.466 1.00 71.34 C ATOM 1405 O ALA A 87 2.857 3.438 21.178 1.00 13.12 O ATOM 1406 CB ALA A 87 5.410 4.388 19.125 1.00 72.00 C ATOM 0 H ALA A 87 3.765 5.519 17.654 1.00 54.53 H new ATOM 0 HA ALA A 87 3.833 2.954 18.935 1.00 1.53 H new ATOM 0 HB1 ALA A 87 5.910 3.855 19.934 1.00 72.00 H new ATOM 0 HB2 ALA A 87 5.861 4.108 18.173 1.00 72.00 H new ATOM 0 HB3 ALA A 87 5.520 5.462 19.276 1.00 72.00 H new ATOM 1412 N ALA A 88 3.259 5.621 20.812 1.00 3.13 N ATOM 1413 CA ALA A 88 2.679 6.053 22.078 1.00 71.32 C ATOM 1414 C ALA A 88 1.279 5.477 22.264 1.00 0.53 C ATOM 1415 O ALA A 88 0.839 5.245 23.390 1.00 61.23 O ATOM 1416 CB ALA A 88 2.641 7.572 22.150 1.00 3.03 C ATOM 0 H ALA A 88 3.621 6.379 20.234 1.00 3.13 H new ATOM 0 HA ALA A 88 3.308 5.678 22.885 1.00 71.32 H new ATOM 0 HB1 ALA A 88 2.206 7.880 23.100 1.00 3.03 H new ATOM 0 HB2 ALA A 88 3.654 7.965 22.070 1.00 3.03 H new ATOM 0 HB3 ALA A 88 2.036 7.960 21.331 1.00 3.03 H new ATOM 1422 N GLU A 89 0.584 5.251 21.154 1.00 43.33 N ATOM 1423 CA GLU A 89 -0.767 4.705 21.197 1.00 61.43 C ATOM 1424 C GLU A 89 -0.736 3.192 21.397 1.00 3.13 C ATOM 1425 O GLU A 89 -1.309 2.669 22.353 1.00 10.41 O ATOM 1426 CB GLU A 89 -1.519 5.044 19.908 1.00 34.23 C ATOM 1427 CG GLU A 89 -3.028 5.096 20.080 1.00 32.54 C ATOM 1428 CD GLU A 89 -3.476 6.250 20.955 1.00 14.12 C ATOM 1429 OE1 GLU A 89 -3.085 7.400 20.667 1.00 53.41 O ATOM 1430 OE2 GLU A 89 -4.219 6.003 21.929 1.00 61.35 O ATOM 0 H GLU A 89 0.934 5.437 20.214 1.00 43.33 H new ATOM 0 HA GLU A 89 -1.287 5.156 22.042 1.00 61.43 H new ATOM 0 HB2 GLU A 89 -1.171 6.008 19.537 1.00 34.23 H new ATOM 0 HB3 GLU A 89 -1.274 4.302 19.148 1.00 34.23 H new ATOM 0 HG2 GLU A 89 -3.499 5.183 19.101 1.00 32.54 H new ATOM 0 HG3 GLU A 89 -3.373 4.159 20.517 1.00 32.54 H new ATOM 1437 N VAL A 90 -0.062 2.494 20.488 1.00 11.33 N ATOM 1438 CA VAL A 90 0.045 1.042 20.564 1.00 0.25 C ATOM 1439 C VAL A 90 0.635 0.604 21.900 1.00 0.02 C ATOM 1440 O VAL A 90 0.012 -0.149 22.650 1.00 54.41 O ATOM 1441 CB VAL A 90 0.915 0.483 19.423 1.00 22.02 C ATOM 1442 CG1 VAL A 90 1.158 -1.006 19.617 1.00 31.11 C ATOM 1443 CG2 VAL A 90 0.264 0.754 18.075 1.00 2.44 C ATOM 0 H VAL A 90 0.418 2.911 19.690 1.00 11.33 H new ATOM 0 HA VAL A 90 -0.965 0.644 20.468 1.00 0.25 H new ATOM 0 HB VAL A 90 1.880 0.990 19.443 1.00 22.02 H new ATOM 0 HG11 VAL A 90 1.775 -1.383 18.801 1.00 31.11 H new ATOM 0 HG12 VAL A 90 1.670 -1.171 20.565 1.00 31.11 H new ATOM 0 HG13 VAL A 90 0.204 -1.533 19.624 1.00 31.11 H new ATOM 0 HG21 VAL A 90 0.892 0.352 17.280 1.00 2.44 H new ATOM 0 HG22 VAL A 90 -0.715 0.275 18.041 1.00 2.44 H new ATOM 0 HG23 VAL A 90 0.147 1.829 17.937 1.00 2.44 H new ATOM 1453 N LEU A 91 1.840 1.080 22.193 1.00 63.13 N ATOM 1454 CA LEU A 91 2.516 0.738 23.440 1.00 51.03 C ATOM 1455 C LEU A 91 1.670 1.138 24.645 1.00 44.15 C ATOM 1456 O LEU A 91 1.605 0.415 25.637 1.00 33.34 O ATOM 1457 CB LEU A 91 3.880 1.426 23.509 1.00 43.13 C ATOM 1458 CG LEU A 91 3.862 2.922 23.826 1.00 65.12 C ATOM 1459 CD1 LEU A 91 3.911 3.149 25.329 1.00 55.43 C ATOM 1460 CD2 LEU A 91 5.024 3.626 23.140 1.00 3.35 C ATOM 0 H LEU A 91 2.369 1.704 21.584 1.00 63.13 H new ATOM 0 HA LEU A 91 2.660 -0.342 23.463 1.00 51.03 H new ATOM 0 HB2 LEU A 91 4.481 0.922 24.266 1.00 43.13 H new ATOM 0 HB3 LEU A 91 4.385 1.283 22.554 1.00 43.13 H new ATOM 0 HG LEU A 91 2.932 3.344 23.446 1.00 65.12 H new ATOM 0 HD11 LEU A 91 3.897 4.219 25.536 1.00 55.43 H new ATOM 0 HD12 LEU A 91 3.046 2.678 25.796 1.00 55.43 H new ATOM 0 HD13 LEU A 91 4.824 2.713 25.733 1.00 55.43 H new ATOM 0 HD21 LEU A 91 4.996 4.690 23.376 1.00 3.35 H new ATOM 0 HD22 LEU A 91 5.965 3.201 23.490 1.00 3.35 H new ATOM 0 HD23 LEU A 91 4.945 3.492 22.061 1.00 3.35 H new ATOM 1472 N GLY A 92 1.022 2.295 24.549 1.00 45.34 N ATOM 1473 CA GLY A 92 0.188 2.771 25.636 1.00 32.55 C ATOM 1474 C GLY A 92 -1.047 1.914 25.837 1.00 43.02 C ATOM 1475 O GLY A 92 -1.532 1.765 26.958 1.00 1.45 O ATOM 0 H GLY A 92 1.060 2.911 23.737 1.00 45.34 H new ATOM 0 HA2 GLY A 92 0.770 2.786 26.557 1.00 32.55 H new ATOM 0 HA3 GLY A 92 -0.115 3.798 25.434 1.00 32.55 H new ATOM 1479 N ARG A 93 -1.557 1.350 24.747 1.00 53.51 N ATOM 1480 CA ARG A 93 -2.745 0.507 24.808 1.00 63.13 C ATOM 1481 C ARG A 93 -2.387 -0.903 25.269 1.00 10.14 C ATOM 1482 O ARG A 93 -2.945 -1.408 26.244 1.00 11.52 O ATOM 1483 CB ARG A 93 -3.426 0.449 23.439 1.00 12.43 C ATOM 1484 CG ARG A 93 -4.454 1.549 23.224 1.00 64.41 C ATOM 1485 CD ARG A 93 -5.738 1.268 23.988 1.00 72.13 C ATOM 1486 NE ARG A 93 -6.856 2.064 23.489 1.00 15.24 N ATOM 1487 CZ ARG A 93 -7.964 2.294 24.187 1.00 65.23 C ATOM 1488 NH1 ARG A 93 -8.099 1.791 25.406 1.00 74.42 N ATOM 1489 NH2 ARG A 93 -8.937 3.029 23.665 1.00 74.42 N ATOM 0 H ARG A 93 -1.166 1.461 23.811 1.00 53.51 H new ATOM 0 HA ARG A 93 -3.434 0.944 25.531 1.00 63.13 H new ATOM 0 HB2 ARG A 93 -2.666 0.517 22.661 1.00 12.43 H new ATOM 0 HB3 ARG A 93 -3.913 -0.519 23.325 1.00 12.43 H new ATOM 0 HG2 ARG A 93 -4.039 2.504 23.546 1.00 64.41 H new ATOM 0 HG3 ARG A 93 -4.675 1.640 22.160 1.00 64.41 H new ATOM 0 HD2 ARG A 93 -5.983 0.209 23.909 1.00 72.13 H new ATOM 0 HD3 ARG A 93 -5.585 1.481 25.046 1.00 72.13 H new ATOM 0 HE ARG A 93 -6.783 2.465 22.554 1.00 15.24 H new ATOM 0 HH11 ARG A 93 -7.352 1.226 25.810 1.00 74.42 H new ATOM 0 HH12 ARG A 93 -8.950 1.969 25.940 1.00 74.42 H new ATOM 0 HH21 ARG A 93 -8.835 3.418 22.728 1.00 74.42 H new ATOM 0 HH22 ARG A 93 -9.787 3.205 24.201 1.00 74.42 H new ATOM 1503 N ILE A 94 -1.454 -1.532 24.563 1.00 74.43 N ATOM 1504 CA ILE A 94 -1.023 -2.883 24.901 1.00 45.15 C ATOM 1505 C ILE A 94 -0.563 -2.966 26.352 1.00 24.10 C ATOM 1506 O ILE A 94 -0.611 -4.029 26.969 1.00 61.30 O ATOM 1507 CB ILE A 94 0.122 -3.354 23.983 1.00 14.04 C ATOM 1508 CG1 ILE A 94 1.390 -2.543 24.257 1.00 62.33 C ATOM 1509 CG2 ILE A 94 -0.286 -3.233 22.523 1.00 74.02 C ATOM 1510 CD1 ILE A 94 2.558 -2.934 23.378 1.00 31.12 C ATOM 0 H ILE A 94 -0.982 -1.128 23.754 1.00 74.43 H new ATOM 0 HA ILE A 94 -1.885 -3.535 24.758 1.00 45.15 H new ATOM 0 HB ILE A 94 0.331 -4.403 24.195 1.00 14.04 H new ATOM 0 HG12 ILE A 94 1.174 -1.485 24.111 1.00 62.33 H new ATOM 0 HG13 ILE A 94 1.674 -2.669 25.302 1.00 62.33 H new ATOM 0 HG21 ILE A 94 0.533 -3.569 21.887 1.00 74.02 H new ATOM 0 HG22 ILE A 94 -1.165 -3.850 22.339 1.00 74.02 H new ATOM 0 HG23 ILE A 94 -0.518 -2.193 22.295 1.00 74.02 H new ATOM 0 HD11 ILE A 94 3.423 -2.319 23.627 1.00 31.12 H new ATOM 0 HD12 ILE A 94 2.801 -3.984 23.541 1.00 31.12 H new ATOM 0 HD13 ILE A 94 2.293 -2.781 22.332 1.00 31.12 H new ATOM 1522 N ASN A 95 -0.118 -1.836 26.892 1.00 41.12 N ATOM 1523 CA ASN A 95 0.350 -1.780 28.272 1.00 33.31 C ATOM 1524 C ASN A 95 -0.781 -2.107 29.243 1.00 23.31 C ATOM 1525 O ASN A 95 -0.548 -2.660 30.318 1.00 41.04 O ATOM 1526 CB ASN A 95 0.920 -0.395 28.584 1.00 61.22 C ATOM 1527 CG ASN A 95 1.435 -0.289 30.006 1.00 2.32 C ATOM 1528 OD1 ASN A 95 2.321 -1.040 30.415 1.00 13.34 O ATOM 1529 ND2 ASN A 95 0.881 0.648 30.767 1.00 32.55 N ATOM 0 H ASN A 95 -0.072 -0.947 26.395 1.00 41.12 H new ATOM 0 HA ASN A 95 1.137 -2.525 28.393 1.00 33.31 H new ATOM 0 HB2 ASN A 95 1.730 -0.174 27.890 1.00 61.22 H new ATOM 0 HB3 ASN A 95 0.148 0.357 28.423 1.00 61.22 H new ATOM 0 HD21 ASN A 95 1.187 0.768 31.733 1.00 32.55 H new ATOM 0 HD22 ASN A 95 0.150 1.248 30.386 1.00 32.55 H new ATOM 1536 N GLN A 96 -2.004 -1.762 28.856 1.00 74.22 N ATOM 1537 CA GLN A 96 -3.171 -2.019 29.692 1.00 22.23 C ATOM 1538 C GLN A 96 -3.570 -3.490 29.633 1.00 50.13 C ATOM 1539 O GLN A 96 -3.872 -4.102 30.656 1.00 22.24 O ATOM 1540 CB GLN A 96 -4.344 -1.142 29.252 1.00 42.22 C ATOM 1541 CG GLN A 96 -4.044 0.347 29.307 1.00 41.53 C ATOM 1542 CD GLN A 96 -5.300 1.197 29.294 1.00 23.43 C ATOM 1543 OE1 GLN A 96 -6.271 0.899 29.990 1.00 74.44 O ATOM 1544 NE2 GLN A 96 -5.287 2.262 28.502 1.00 65.12 N ATOM 0 H GLN A 96 -2.213 -1.304 27.969 1.00 74.22 H new ATOM 0 HA GLN A 96 -2.910 -1.773 30.721 1.00 22.23 H new ATOM 0 HB2 GLN A 96 -4.625 -1.410 28.234 1.00 42.22 H new ATOM 0 HB3 GLN A 96 -5.204 -1.355 29.887 1.00 42.22 H new ATOM 0 HG2 GLN A 96 -3.472 0.565 30.209 1.00 41.53 H new ATOM 0 HG3 GLN A 96 -3.417 0.619 28.458 1.00 41.53 H new ATOM 0 HE21 GLN A 96 -4.460 2.471 27.942 1.00 65.12 H new ATOM 0 HE22 GLN A 96 -6.104 2.871 28.453 1.00 65.12 H new ATOM 1553 N GLU A 97 -3.570 -4.050 28.427 1.00 45.10 N ATOM 1554 CA GLU A 97 -3.933 -5.449 28.235 1.00 12.10 C ATOM 1555 C GLU A 97 -2.816 -6.372 28.712 1.00 3.14 C ATOM 1556 O GLU A 97 -3.054 -7.533 29.046 1.00 12.34 O ATOM 1557 CB GLU A 97 -4.240 -5.722 26.761 1.00 11.50 C ATOM 1558 CG GLU A 97 -5.480 -5.003 26.254 1.00 24.44 C ATOM 1559 CD GLU A 97 -6.741 -5.829 26.421 1.00 42.42 C ATOM 1560 OE1 GLU A 97 -6.913 -6.436 27.498 1.00 35.41 O ATOM 1561 OE2 GLU A 97 -7.555 -5.867 25.475 1.00 44.14 O ATOM 0 H GLU A 97 -3.323 -3.557 27.569 1.00 45.10 H new ATOM 0 HA GLU A 97 -4.825 -5.650 28.828 1.00 12.10 H new ATOM 0 HB2 GLU A 97 -3.383 -5.420 26.158 1.00 11.50 H new ATOM 0 HB3 GLU A 97 -4.368 -6.795 26.618 1.00 11.50 H new ATOM 0 HG2 GLU A 97 -5.594 -4.060 26.790 1.00 24.44 H new ATOM 0 HG3 GLU A 97 -5.348 -4.757 25.200 1.00 24.44 H new ATOM 1568 N PHE A 98 -1.595 -5.848 28.741 1.00 0.52 N ATOM 1569 CA PHE A 98 -0.440 -6.624 29.176 1.00 45.22 C ATOM 1570 C PHE A 98 -0.404 -6.742 30.697 1.00 53.53 C ATOM 1571 O PHE A 98 -0.753 -5.812 31.425 1.00 70.01 O ATOM 1572 CB PHE A 98 0.853 -5.979 28.673 1.00 45.42 C ATOM 1573 CG PHE A 98 1.266 -6.448 27.307 1.00 55.43 C ATOM 1574 CD1 PHE A 98 0.314 -6.838 26.378 1.00 64.41 C ATOM 1575 CD2 PHE A 98 2.604 -6.497 26.951 1.00 33.32 C ATOM 1576 CE1 PHE A 98 0.691 -7.271 25.121 1.00 61.24 C ATOM 1577 CE2 PHE A 98 2.986 -6.929 25.695 1.00 44.20 C ATOM 1578 CZ PHE A 98 2.029 -7.315 24.778 1.00 35.22 C ATOM 0 H PHE A 98 -1.380 -4.889 28.468 1.00 0.52 H new ATOM 0 HA PHE A 98 -0.527 -7.625 28.754 1.00 45.22 H new ATOM 0 HB2 PHE A 98 0.726 -4.897 28.653 1.00 45.42 H new ATOM 0 HB3 PHE A 98 1.655 -6.193 29.380 1.00 45.42 H new ATOM 0 HD1 PHE A 98 -0.733 -6.803 26.639 1.00 64.41 H new ATOM 0 HD2 PHE A 98 3.357 -6.194 27.663 1.00 33.32 H new ATOM 0 HE1 PHE A 98 -0.060 -7.575 24.407 1.00 61.24 H new ATOM 0 HE2 PHE A 98 4.033 -6.965 25.431 1.00 44.20 H new ATOM 0 HZ PHE A 98 2.325 -7.650 23.795 1.00 35.22 H new ATOM 1588 N PRO A 99 0.027 -7.912 31.189 1.00 34.42 N ATOM 1589 CA PRO A 99 0.118 -8.181 32.627 1.00 0.34 C ATOM 1590 C PRO A 99 1.228 -7.379 33.297 1.00 4.53 C ATOM 1591 O PRO A 99 2.001 -6.692 32.629 1.00 40.14 O ATOM 1592 CB PRO A 99 0.428 -9.678 32.690 1.00 70.42 C ATOM 1593 CG PRO A 99 1.088 -9.983 31.390 1.00 65.13 C ATOM 1594 CD PRO A 99 0.458 -9.064 30.380 1.00 63.42 C ATOM 0 HA PRO A 99 -0.794 -7.899 33.153 1.00 0.34 H new ATOM 0 HB2 PRO A 99 1.082 -9.912 33.530 1.00 70.42 H new ATOM 0 HB3 PRO A 99 -0.481 -10.265 32.820 1.00 70.42 H new ATOM 0 HG2 PRO A 99 2.164 -9.818 31.450 1.00 65.13 H new ATOM 0 HG3 PRO A 99 0.941 -11.027 31.113 1.00 65.13 H new ATOM 0 HD2 PRO A 99 1.168 -8.769 29.607 1.00 63.42 H new ATOM 0 HD3 PRO A 99 -0.384 -9.538 29.875 1.00 63.42 H new ATOM 1602 N ARG A 100 1.302 -7.470 34.621 1.00 24.41 N ATOM 1603 CA ARG A 100 2.318 -6.752 35.381 1.00 23.32 C ATOM 1604 C ARG A 100 3.716 -7.250 35.026 1.00 22.41 C ATOM 1605 O ARG A 100 4.704 -6.538 35.206 1.00 41.02 O ATOM 1606 CB ARG A 100 2.073 -6.916 36.882 1.00 0.43 C ATOM 1607 CG ARG A 100 2.386 -8.309 37.402 1.00 33.24 C ATOM 1608 CD ARG A 100 1.791 -8.535 38.784 1.00 51.33 C ATOM 1609 NE ARG A 100 0.378 -8.897 38.719 1.00 54.34 N ATOM 1610 CZ ARG A 100 -0.055 -10.123 38.446 1.00 12.33 C ATOM 1611 NH1 ARG A 100 0.811 -11.099 38.215 1.00 24.24 N ATOM 1612 NH2 ARG A 100 -1.357 -10.374 38.405 1.00 35.00 N ATOM 0 H ARG A 100 0.670 -8.034 35.190 1.00 24.41 H new ATOM 0 HA ARG A 100 2.251 -5.695 35.122 1.00 23.32 H new ATOM 0 HB2 ARG A 100 2.682 -6.191 37.422 1.00 0.43 H new ATOM 0 HB3 ARG A 100 1.031 -6.682 37.099 1.00 0.43 H new ATOM 0 HG2 ARG A 100 1.994 -9.054 36.710 1.00 33.24 H new ATOM 0 HG3 ARG A 100 3.466 -8.449 37.442 1.00 33.24 H new ATOM 0 HD2 ARG A 100 2.344 -9.325 39.292 1.00 51.33 H new ATOM 0 HD3 ARG A 100 1.906 -7.630 39.381 1.00 51.33 H new ATOM 0 HE ARG A 100 -0.315 -8.169 38.893 1.00 54.34 H new ATOM 0 HH11 ARG A 100 1.813 -10.910 38.247 1.00 24.24 H new ATOM 0 HH12 ARG A 100 0.476 -12.039 38.006 1.00 24.24 H new ATOM 0 HH21 ARG A 100 -2.027 -9.625 38.583 1.00 35.00 H new ATOM 0 HH22 ARG A 100 -1.689 -11.316 38.195 1.00 35.00 H new ATOM 1626 N ASP A 101 3.791 -8.477 34.522 1.00 21.22 N ATOM 1627 CA ASP A 101 5.068 -9.071 34.141 1.00 15.24 C ATOM 1628 C ASP A 101 5.573 -8.477 32.831 1.00 45.15 C ATOM 1629 O ASP A 101 6.729 -8.062 32.729 1.00 31.14 O ATOM 1630 CB ASP A 101 4.929 -10.588 34.008 1.00 22.25 C ATOM 1631 CG ASP A 101 6.227 -11.316 34.300 1.00 11.43 C ATOM 1632 OD1 ASP A 101 6.567 -11.467 35.492 1.00 13.12 O ATOM 1633 OD2 ASP A 101 6.903 -11.733 33.337 1.00 43.14 O ATOM 0 H ASP A 101 2.983 -9.080 34.368 1.00 21.22 H new ATOM 0 HA ASP A 101 5.793 -8.848 34.924 1.00 15.24 H new ATOM 0 HB2 ASP A 101 4.156 -10.940 34.691 1.00 22.25 H new ATOM 0 HB3 ASP A 101 4.598 -10.833 32.999 1.00 22.25 H new ATOM 1638 N LEU A 102 4.702 -8.440 31.829 1.00 40.14 N ATOM 1639 CA LEU A 102 5.060 -7.898 30.523 1.00 43.45 C ATOM 1640 C LEU A 102 5.245 -6.385 30.593 1.00 62.20 C ATOM 1641 O LEU A 102 5.995 -5.803 29.809 1.00 24.13 O ATOM 1642 CB LEU A 102 3.984 -8.244 29.492 1.00 43.10 C ATOM 1643 CG LEU A 102 3.834 -9.727 29.151 1.00 41.12 C ATOM 1644 CD1 LEU A 102 2.829 -9.917 28.026 1.00 54.43 C ATOM 1645 CD2 LEU A 102 5.181 -10.326 28.772 1.00 53.12 C ATOM 0 H LEU A 102 3.742 -8.779 31.896 1.00 40.14 H new ATOM 0 HA LEU A 102 6.005 -8.348 30.218 1.00 43.45 H new ATOM 0 HB2 LEU A 102 3.026 -7.877 29.860 1.00 43.10 H new ATOM 0 HB3 LEU A 102 4.202 -7.700 28.573 1.00 43.10 H new ATOM 0 HG LEU A 102 3.463 -10.247 30.034 1.00 41.12 H new ATOM 0 HD11 LEU A 102 2.735 -10.979 27.797 1.00 54.43 H new ATOM 0 HD12 LEU A 102 1.860 -9.525 28.334 1.00 54.43 H new ATOM 0 HD13 LEU A 102 3.170 -9.383 27.139 1.00 54.43 H new ATOM 0 HD21 LEU A 102 5.055 -11.382 28.532 1.00 53.12 H new ATOM 0 HD22 LEU A 102 5.581 -9.802 27.904 1.00 53.12 H new ATOM 0 HD23 LEU A 102 5.873 -10.224 29.608 1.00 53.12 H new ATOM 1657 N LYS A 103 4.558 -5.754 31.539 1.00 53.24 N ATOM 1658 CA LYS A 103 4.648 -4.309 31.715 1.00 33.22 C ATOM 1659 C LYS A 103 6.103 -3.864 31.825 1.00 75.14 C ATOM 1660 O LYS A 103 6.474 -2.795 31.339 1.00 70.53 O ATOM 1661 CB LYS A 103 3.876 -3.878 32.965 1.00 61.53 C ATOM 1662 CG LYS A 103 2.400 -3.627 32.711 1.00 32.24 C ATOM 1663 CD LYS A 103 1.964 -2.275 33.251 1.00 74.33 C ATOM 1664 CE LYS A 103 0.502 -1.995 32.936 1.00 1.04 C ATOM 1665 NZ LYS A 103 -0.165 -1.237 34.031 1.00 51.33 N ATOM 0 H LYS A 103 3.933 -6.221 32.196 1.00 53.24 H new ATOM 0 HA LYS A 103 4.206 -3.833 30.840 1.00 33.22 H new ATOM 0 HB2 LYS A 103 3.979 -4.649 33.729 1.00 61.53 H new ATOM 0 HB3 LYS A 103 4.327 -2.970 33.365 1.00 61.53 H new ATOM 0 HG2 LYS A 103 2.201 -3.674 31.640 1.00 32.24 H new ATOM 0 HG3 LYS A 103 1.810 -4.415 33.180 1.00 32.24 H new ATOM 0 HD2 LYS A 103 2.117 -2.246 34.330 1.00 74.33 H new ATOM 0 HD3 LYS A 103 2.587 -1.491 32.820 1.00 74.33 H new ATOM 0 HE2 LYS A 103 0.432 -1.429 32.007 1.00 1.04 H new ATOM 0 HE3 LYS A 103 -0.022 -2.937 32.775 1.00 1.04 H new ATOM 0 HZ1 LYS A 103 -1.159 -1.066 33.779 1.00 51.33 H new ATOM 0 HZ2 LYS A 103 -0.121 -1.788 34.912 1.00 51.33 H new ATOM 0 HZ3 LYS A 103 0.319 -0.327 34.168 1.00 51.33 H new ATOM 1679 N LYS A 104 6.923 -4.691 32.464 1.00 11.44 N ATOM 1680 CA LYS A 104 8.338 -4.384 32.635 1.00 21.25 C ATOM 1681 C LYS A 104 9.073 -4.442 31.300 1.00 73.40 C ATOM 1682 O LYS A 104 9.811 -3.523 30.945 1.00 75.03 O ATOM 1683 CB LYS A 104 8.977 -5.362 33.624 1.00 31.40 C ATOM 1684 CG LYS A 104 8.207 -5.501 34.926 1.00 71.11 C ATOM 1685 CD LYS A 104 8.259 -4.222 35.744 1.00 45.31 C ATOM 1686 CE LYS A 104 9.535 -4.139 36.568 1.00 21.12 C ATOM 1687 NZ LYS A 104 9.626 -2.859 37.323 1.00 13.23 N ATOM 0 H LYS A 104 6.632 -5.579 32.872 1.00 11.44 H new ATOM 0 HA LYS A 104 8.419 -3.371 33.030 1.00 21.25 H new ATOM 0 HB2 LYS A 104 9.057 -6.342 33.153 1.00 31.40 H new ATOM 0 HB3 LYS A 104 9.992 -5.031 33.845 1.00 31.40 H new ATOM 0 HG2 LYS A 104 7.169 -5.754 34.711 1.00 71.11 H new ATOM 0 HG3 LYS A 104 8.621 -6.324 35.509 1.00 71.11 H new ATOM 0 HD2 LYS A 104 8.197 -3.361 35.079 1.00 45.31 H new ATOM 0 HD3 LYS A 104 7.394 -4.176 36.405 1.00 45.31 H new ATOM 0 HE2 LYS A 104 9.572 -4.976 37.266 1.00 21.12 H new ATOM 0 HE3 LYS A 104 10.399 -4.235 35.910 1.00 21.12 H new ATOM 0 HZ1 LYS A 104 10.509 -2.842 37.872 1.00 13.23 H new ATOM 0 HZ2 LYS A 104 9.617 -2.061 36.656 1.00 13.23 H new ATOM 0 HZ3 LYS A 104 8.815 -2.779 37.970 1.00 13.23 H new ATOM 1701 N LYS A 105 8.865 -5.528 30.563 1.00 61.14 N ATOM 1702 CA LYS A 105 9.505 -5.706 29.264 1.00 10.35 C ATOM 1703 C LYS A 105 9.045 -4.635 28.280 1.00 32.30 C ATOM 1704 O LYS A 105 9.788 -4.246 27.378 1.00 31.20 O ATOM 1705 CB LYS A 105 9.193 -7.096 28.705 1.00 4.33 C ATOM 1706 CG LYS A 105 9.568 -8.228 29.646 1.00 12.22 C ATOM 1707 CD LYS A 105 8.822 -9.507 29.304 1.00 12.35 C ATOM 1708 CE LYS A 105 9.281 -10.081 27.973 1.00 25.43 C ATOM 1709 NZ LYS A 105 10.355 -11.098 28.149 1.00 5.23 N ATOM 0 H LYS A 105 8.258 -6.299 30.843 1.00 61.14 H new ATOM 0 HA LYS A 105 10.582 -5.610 29.401 1.00 10.35 H new ATOM 0 HB2 LYS A 105 8.128 -7.158 28.482 1.00 4.33 H new ATOM 0 HB3 LYS A 105 9.724 -7.227 27.762 1.00 4.33 H new ATOM 0 HG2 LYS A 105 10.642 -8.407 29.592 1.00 12.22 H new ATOM 0 HG3 LYS A 105 9.344 -7.938 30.673 1.00 12.22 H new ATOM 0 HD2 LYS A 105 8.979 -10.243 30.092 1.00 12.35 H new ATOM 0 HD3 LYS A 105 7.751 -9.306 29.265 1.00 12.35 H new ATOM 0 HE2 LYS A 105 8.432 -10.534 27.461 1.00 25.43 H new ATOM 0 HE3 LYS A 105 9.645 -9.275 27.336 1.00 25.43 H new ATOM 0 HZ1 LYS A 105 10.641 -11.466 27.219 1.00 5.23 H new ATOM 0 HZ2 LYS A 105 11.175 -10.660 28.615 1.00 5.23 H new ATOM 0 HZ3 LYS A 105 10.000 -11.880 28.736 1.00 5.23 H new ATOM 1723 N LEU A 106 7.817 -4.162 28.459 1.00 14.14 N ATOM 1724 CA LEU A 106 7.258 -3.134 27.588 1.00 72.45 C ATOM 1725 C LEU A 106 7.742 -1.748 28.000 1.00 60.02 C ATOM 1726 O LEU A 106 8.068 -0.916 27.153 1.00 33.10 O ATOM 1727 CB LEU A 106 5.729 -3.184 27.622 1.00 23.51 C ATOM 1728 CG LEU A 106 5.007 -1.887 27.259 1.00 51.33 C ATOM 1729 CD1 LEU A 106 5.343 -1.469 25.835 1.00 34.54 C ATOM 1730 CD2 LEU A 106 3.503 -2.048 27.429 1.00 42.23 C ATOM 0 H LEU A 106 7.189 -4.474 29.200 1.00 14.14 H new ATOM 0 HA LEU A 106 7.599 -3.330 26.572 1.00 72.45 H new ATOM 0 HB2 LEU A 106 5.396 -3.965 26.939 1.00 23.51 H new ATOM 0 HB3 LEU A 106 5.417 -3.482 28.623 1.00 23.51 H new ATOM 0 HG LEU A 106 5.347 -1.103 27.936 1.00 51.33 H new ATOM 0 HD11 LEU A 106 4.820 -0.544 25.594 1.00 34.54 H new ATOM 0 HD12 LEU A 106 6.418 -1.312 25.746 1.00 34.54 H new ATOM 0 HD13 LEU A 106 5.032 -2.252 25.143 1.00 34.54 H new ATOM 0 HD21 LEU A 106 3.005 -1.115 27.166 1.00 42.23 H new ATOM 0 HD22 LEU A 106 3.146 -2.846 26.777 1.00 42.23 H new ATOM 0 HD23 LEU A 106 3.279 -2.299 28.466 1.00 42.23 H new ATOM 1742 N SER A 107 7.789 -1.507 29.306 1.00 33.42 N ATOM 1743 CA SER A 107 8.232 -0.221 29.831 1.00 31.22 C ATOM 1744 C SER A 107 9.743 -0.066 29.685 1.00 74.14 C ATOM 1745 O SER A 107 10.259 1.049 29.615 1.00 42.21 O ATOM 1746 CB SER A 107 7.834 -0.082 31.302 1.00 72.12 C ATOM 1747 OG SER A 107 8.616 0.905 31.951 1.00 51.53 O ATOM 0 H SER A 107 7.526 -2.186 30.020 1.00 33.42 H new ATOM 0 HA SER A 107 7.746 0.566 29.254 1.00 31.22 H new ATOM 0 HB2 SER A 107 6.779 0.181 31.373 1.00 72.12 H new ATOM 0 HB3 SER A 107 7.959 -1.040 31.808 1.00 72.12 H new ATOM 0 HG SER A 107 8.341 0.976 32.889 1.00 51.53 H new ATOM 1753 N ARG A 108 10.445 -1.193 29.639 1.00 61.33 N ATOM 1754 CA ARG A 108 11.897 -1.184 29.502 1.00 55.12 C ATOM 1755 C ARG A 108 12.304 -1.048 28.037 1.00 34.15 C ATOM 1756 O ARG A 108 13.306 -0.408 27.717 1.00 34.55 O ATOM 1757 CB ARG A 108 12.494 -2.463 30.092 1.00 50.32 C ATOM 1758 CG ARG A 108 12.401 -3.663 29.164 1.00 50.11 C ATOM 1759 CD ARG A 108 13.025 -4.901 29.790 1.00 53.53 C ATOM 1760 NE ARG A 108 12.558 -5.117 31.156 1.00 32.25 N ATOM 1761 CZ ARG A 108 13.206 -5.862 32.045 1.00 1.12 C ATOM 1762 NH1 ARG A 108 14.343 -6.458 31.713 1.00 50.54 N ATOM 1763 NH2 ARG A 108 12.718 -6.011 33.270 1.00 75.42 N ATOM 0 H ARG A 108 10.032 -2.124 29.695 1.00 61.33 H new ATOM 0 HA ARG A 108 12.284 -0.325 30.050 1.00 55.12 H new ATOM 0 HB2 ARG A 108 13.541 -2.285 30.338 1.00 50.32 H new ATOM 0 HB3 ARG A 108 11.982 -2.696 31.026 1.00 50.32 H new ATOM 0 HG2 ARG A 108 11.356 -3.861 28.927 1.00 50.11 H new ATOM 0 HG3 ARG A 108 12.903 -3.437 28.224 1.00 50.11 H new ATOM 0 HD2 ARG A 108 12.786 -5.774 29.183 1.00 53.53 H new ATOM 0 HD3 ARG A 108 14.110 -4.800 29.790 1.00 53.53 H new ATOM 0 HE ARG A 108 11.687 -4.672 31.444 1.00 32.25 H new ATOM 0 HH11 ARG A 108 14.722 -6.345 30.773 1.00 50.54 H new ATOM 0 HH12 ARG A 108 14.838 -7.029 32.398 1.00 50.54 H new ATOM 0 HH21 ARG A 108 11.844 -5.553 33.530 1.00 75.42 H new ATOM 0 HH22 ARG A 108 13.217 -6.583 33.951 1.00 75.42 H new ATOM 1777 N VAL A 109 11.520 -1.655 27.152 1.00 53.12 N ATOM 1778 CA VAL A 109 11.798 -1.601 25.722 1.00 73.54 C ATOM 1779 C VAL A 109 11.376 -0.261 25.129 1.00 22.45 C ATOM 1780 O VAL A 109 12.009 0.247 24.204 1.00 10.41 O ATOM 1781 CB VAL A 109 11.076 -2.734 24.967 1.00 51.42 C ATOM 1782 CG1 VAL A 109 9.569 -2.539 25.027 1.00 75.13 C ATOM 1783 CG2 VAL A 109 11.556 -2.803 23.525 1.00 1.30 C ATOM 0 H VAL A 109 10.688 -2.190 27.400 1.00 53.12 H new ATOM 0 HA VAL A 109 12.875 -1.724 25.604 1.00 73.54 H new ATOM 0 HB VAL A 109 11.315 -3.681 25.451 1.00 51.42 H new ATOM 0 HG11 VAL A 109 9.076 -3.348 24.489 1.00 75.13 H new ATOM 0 HG12 VAL A 109 9.243 -2.543 26.067 1.00 75.13 H new ATOM 0 HG13 VAL A 109 9.307 -1.586 24.568 1.00 75.13 H new ATOM 0 HG21 VAL A 109 11.036 -3.608 23.007 1.00 1.30 H new ATOM 0 HG22 VAL A 109 11.348 -1.856 23.026 1.00 1.30 H new ATOM 0 HG23 VAL A 109 12.629 -2.994 23.507 1.00 1.30 H new ATOM 1793 N VAL A 110 10.303 0.307 25.670 1.00 72.22 N ATOM 1794 CA VAL A 110 9.797 1.590 25.196 1.00 34.53 C ATOM 1795 C VAL A 110 10.699 2.735 25.642 1.00 63.44 C ATOM 1796 O VAL A 110 11.019 3.627 24.858 1.00 51.24 O ATOM 1797 CB VAL A 110 8.366 1.851 25.704 1.00 22.44 C ATOM 1798 CG1 VAL A 110 7.965 3.296 25.453 1.00 45.24 C ATOM 1799 CG2 VAL A 110 7.384 0.894 25.045 1.00 22.12 C ATOM 0 H VAL A 110 9.767 -0.101 26.436 1.00 72.22 H new ATOM 0 HA VAL A 110 9.786 1.543 24.107 1.00 34.53 H new ATOM 0 HB VAL A 110 8.343 1.675 26.779 1.00 22.44 H new ATOM 0 HG11 VAL A 110 6.951 3.461 25.818 1.00 45.24 H new ATOM 0 HG12 VAL A 110 8.652 3.961 25.977 1.00 45.24 H new ATOM 0 HG13 VAL A 110 8.003 3.504 24.384 1.00 45.24 H new ATOM 0 HG21 VAL A 110 6.378 1.093 25.415 1.00 22.12 H new ATOM 0 HG22 VAL A 110 7.407 1.036 23.965 1.00 22.12 H new ATOM 0 HG23 VAL A 110 7.662 -0.133 25.282 1.00 22.12 H new ATOM 1809 N ASN A 111 11.108 2.702 26.906 1.00 75.20 N ATOM 1810 CA ASN A 111 11.974 3.738 27.456 1.00 22.55 C ATOM 1811 C ASN A 111 13.221 3.917 26.596 1.00 1.41 C ATOM 1812 O ASN A 111 13.684 5.038 26.383 1.00 2.44 O ATOM 1813 CB ASN A 111 12.376 3.386 28.890 1.00 5.12 C ATOM 1814 CG ASN A 111 11.290 3.720 29.894 1.00 51.10 C ATOM 1815 OD1 ASN A 111 10.385 4.505 29.608 1.00 24.13 O ATOM 1816 ND2 ASN A 111 11.375 3.124 31.078 1.00 53.13 N ATOM 0 H ASN A 111 10.854 1.969 27.568 1.00 75.20 H new ATOM 0 HA ASN A 111 11.420 4.677 27.461 1.00 22.55 H new ATOM 0 HB2 ASN A 111 12.607 2.322 28.949 1.00 5.12 H new ATOM 0 HB3 ASN A 111 13.287 3.925 29.152 1.00 5.12 H new ATOM 0 HD21 ASN A 111 10.673 3.310 31.794 1.00 53.13 H new ATOM 0 HD22 ASN A 111 12.143 2.481 31.271 1.00 53.13 H new ATOM 1823 N ILE A 112 13.759 2.807 26.104 1.00 71.51 N ATOM 1824 CA ILE A 112 14.951 2.842 25.265 1.00 33.24 C ATOM 1825 C ILE A 112 14.799 3.856 24.136 1.00 33.45 C ATOM 1826 O ILE A 112 15.777 4.457 23.691 1.00 23.31 O ATOM 1827 CB ILE A 112 15.255 1.458 24.661 1.00 54.55 C ATOM 1828 CG1 ILE A 112 15.599 0.459 25.766 1.00 32.44 C ATOM 1829 CG2 ILE A 112 16.393 1.558 23.656 1.00 12.10 C ATOM 1830 CD1 ILE A 112 15.341 -0.981 25.381 1.00 65.24 C ATOM 0 H ILE A 112 13.389 1.872 26.272 1.00 71.51 H new ATOM 0 HA ILE A 112 15.780 3.139 25.907 1.00 33.24 H new ATOM 0 HB ILE A 112 14.366 1.102 24.140 1.00 54.55 H new ATOM 0 HG12 ILE A 112 16.650 0.573 26.033 1.00 32.44 H new ATOM 0 HG13 ILE A 112 15.016 0.699 26.656 1.00 32.44 H new ATOM 0 HG21 ILE A 112 16.597 0.572 23.238 1.00 12.10 H new ATOM 0 HG22 ILE A 112 16.112 2.241 22.855 1.00 12.10 H new ATOM 0 HG23 ILE A 112 17.287 1.932 24.155 1.00 12.10 H new ATOM 0 HD11 ILE A 112 15.608 -1.633 26.213 1.00 65.24 H new ATOM 0 HD12 ILE A 112 14.285 -1.110 25.142 1.00 65.24 H new ATOM 0 HD13 ILE A 112 15.944 -1.238 24.510 1.00 65.24 H new ATOM 1842 N LEU A 113 13.566 4.042 23.679 1.00 52.44 N ATOM 1843 CA LEU A 113 13.284 4.986 22.602 1.00 21.31 C ATOM 1844 C LEU A 113 13.843 6.367 22.928 1.00 30.03 C ATOM 1845 O LEU A 113 14.354 7.065 22.052 1.00 25.23 O ATOM 1846 CB LEU A 113 11.777 5.077 22.359 1.00 13.30 C ATOM 1847 CG LEU A 113 11.114 3.830 21.773 1.00 23.11 C ATOM 1848 CD1 LEU A 113 9.629 3.810 22.101 1.00 43.22 C ATOM 1849 CD2 LEU A 113 11.331 3.768 20.268 1.00 21.12 C ATOM 0 H LEU A 113 12.746 3.552 24.037 1.00 52.44 H new ATOM 0 HA LEU A 113 13.770 4.622 21.697 1.00 21.31 H new ATOM 0 HB2 LEU A 113 11.290 5.312 23.306 1.00 13.30 H new ATOM 0 HB3 LEU A 113 11.588 5.914 21.687 1.00 13.30 H new ATOM 0 HG LEU A 113 11.576 2.951 22.223 1.00 23.11 H new ATOM 0 HD11 LEU A 113 9.174 2.915 21.676 1.00 43.22 H new ATOM 0 HD12 LEU A 113 9.495 3.806 23.183 1.00 43.22 H new ATOM 0 HD13 LEU A 113 9.151 4.695 21.680 1.00 43.22 H new ATOM 0 HD21 LEU A 113 10.852 2.874 19.868 1.00 21.12 H new ATOM 0 HD22 LEU A 113 10.897 4.652 19.801 1.00 21.12 H new ATOM 0 HD23 LEU A 113 12.400 3.733 20.056 1.00 21.12 H new ATOM 1861 N LYS A 114 13.744 6.756 24.195 1.00 32.51 N ATOM 1862 CA LYS A 114 14.242 8.052 24.640 1.00 61.35 C ATOM 1863 C LYS A 114 15.767 8.064 24.678 1.00 51.52 C ATOM 1864 O LYS A 114 16.392 9.107 24.488 1.00 3.12 O ATOM 1865 CB LYS A 114 13.684 8.388 26.024 1.00 12.31 C ATOM 1866 CG LYS A 114 14.472 7.768 27.165 1.00 52.31 C ATOM 1867 CD LYS A 114 15.546 8.712 27.678 1.00 2.22 C ATOM 1868 CE LYS A 114 15.020 9.601 28.795 1.00 42.02 C ATOM 1869 NZ LYS A 114 14.382 10.838 28.265 1.00 3.03 N ATOM 0 H LYS A 114 13.323 6.191 24.932 1.00 32.51 H new ATOM 0 HA LYS A 114 13.908 8.806 23.928 1.00 61.35 H new ATOM 0 HB2 LYS A 114 13.672 9.471 26.148 1.00 12.31 H new ATOM 0 HB3 LYS A 114 12.650 8.049 26.082 1.00 12.31 H new ATOM 0 HG2 LYS A 114 13.794 7.510 27.979 1.00 52.31 H new ATOM 0 HG3 LYS A 114 14.933 6.840 26.828 1.00 52.31 H new ATOM 0 HD2 LYS A 114 16.396 8.135 28.041 1.00 2.22 H new ATOM 0 HD3 LYS A 114 15.909 9.332 26.858 1.00 2.22 H new ATOM 0 HE2 LYS A 114 14.296 9.045 29.391 1.00 42.02 H new ATOM 0 HE3 LYS A 114 15.840 9.872 29.460 1.00 42.02 H new ATOM 0 HZ1 LYS A 114 14.359 11.563 29.010 1.00 3.03 H new ATOM 0 HZ2 LYS A 114 14.930 11.191 27.454 1.00 3.03 H new ATOM 0 HZ3 LYS A 114 13.411 10.624 27.960 1.00 3.03 H new ATOM 1883 N GLU A 115 16.358 6.899 24.923 1.00 41.21 N ATOM 1884 CA GLU A 115 17.810 6.778 24.985 1.00 51.11 C ATOM 1885 C GLU A 115 18.433 6.992 23.608 1.00 30.13 C ATOM 1886 O GLU A 115 19.410 7.727 23.465 1.00 23.30 O ATOM 1887 CB GLU A 115 18.207 5.404 25.528 1.00 34.15 C ATOM 1888 CG GLU A 115 18.377 5.373 27.038 1.00 32.50 C ATOM 1889 CD GLU A 115 18.942 4.056 27.534 1.00 30.21 C ATOM 1890 OE1 GLU A 115 19.651 3.384 26.755 1.00 0.44 O ATOM 1891 OE2 GLU A 115 18.675 3.697 28.700 1.00 64.41 O ATOM 0 H GLU A 115 15.854 6.026 25.082 1.00 41.21 H new ATOM 0 HA GLU A 115 18.185 7.549 25.658 1.00 51.11 H new ATOM 0 HB2 GLU A 115 17.448 4.676 25.241 1.00 34.15 H new ATOM 0 HB3 GLU A 115 19.141 5.093 25.059 1.00 34.15 H new ATOM 0 HG2 GLU A 115 19.037 6.185 27.342 1.00 32.50 H new ATOM 0 HG3 GLU A 115 17.412 5.552 27.512 1.00 32.50 H new ATOM 1898 N ARG A 116 17.860 6.344 22.599 1.00 24.11 N ATOM 1899 CA ARG A 116 18.360 6.461 21.234 1.00 11.05 C ATOM 1900 C ARG A 116 17.771 7.687 20.543 1.00 13.12 C ATOM 1901 O ARG A 116 18.277 8.136 19.516 1.00 63.00 O ATOM 1902 CB ARG A 116 18.023 5.201 20.435 1.00 30.35 C ATOM 1903 CG ARG A 116 18.342 3.910 21.171 1.00 30.43 C ATOM 1904 CD ARG A 116 19.810 3.840 21.563 1.00 34.15 C ATOM 1905 NE ARG A 116 20.692 4.097 20.429 1.00 41.43 N ATOM 1906 CZ ARG A 116 22.008 4.239 20.539 1.00 43.42 C ATOM 1907 NH1 ARG A 116 22.591 4.149 21.726 1.00 2.02 N ATOM 1908 NH2 ARG A 116 22.744 4.472 19.459 1.00 23.14 N ATOM 0 H ARG A 116 17.050 5.733 22.701 1.00 24.11 H new ATOM 0 HA ARG A 116 19.443 6.576 21.279 1.00 11.05 H new ATOM 0 HB2 ARG A 116 16.963 5.213 20.183 1.00 30.35 H new ATOM 0 HB3 ARG A 116 18.574 5.219 19.495 1.00 30.35 H new ATOM 0 HG2 ARG A 116 17.722 3.837 22.064 1.00 30.43 H new ATOM 0 HG3 ARG A 116 18.092 3.058 20.539 1.00 30.43 H new ATOM 0 HD2 ARG A 116 20.010 4.567 22.350 1.00 34.15 H new ATOM 0 HD3 ARG A 116 20.028 2.855 21.976 1.00 34.15 H new ATOM 0 HE ARG A 116 20.275 4.172 19.501 1.00 41.43 H new ATOM 0 HH11 ARG A 116 22.029 3.970 22.558 1.00 2.02 H new ATOM 0 HH12 ARG A 116 23.602 4.258 21.807 1.00 2.02 H new ATOM 0 HH21 ARG A 116 22.299 4.542 18.544 1.00 23.14 H new ATOM 0 HH22 ARG A 116 23.755 4.581 19.544 1.00 23.14 H new ATOM 1922 N ASN A 117 16.697 8.223 21.114 1.00 1.35 N ATOM 1923 CA ASN A 117 16.038 9.397 20.553 1.00 60.23 C ATOM 1924 C ASN A 117 15.464 9.090 19.173 1.00 60.11 C ATOM 1925 O ASN A 117 15.551 9.909 18.257 1.00 30.33 O ATOM 1926 CB ASN A 117 17.022 10.565 20.460 1.00 61.42 C ATOM 1927 CG ASN A 117 17.871 10.706 21.709 1.00 52.34 C ATOM 1928 OD1 ASN A 117 18.814 9.944 21.921 1.00 1.43 O ATOM 1929 ND2 ASN A 117 17.538 11.685 22.542 1.00 11.10 N ATOM 0 H ASN A 117 16.265 7.863 21.965 1.00 1.35 H new ATOM 0 HA ASN A 117 15.218 9.674 21.215 1.00 60.23 H new ATOM 0 HB2 ASN A 117 17.672 10.421 19.597 1.00 61.42 H new ATOM 0 HB3 ASN A 117 16.470 11.490 20.293 1.00 61.42 H new ATOM 0 HD21 ASN A 117 18.072 11.829 23.399 1.00 11.10 H new ATOM 0 HD22 ASN A 117 16.748 12.293 22.325 1.00 11.10 H new ATOM 1936 N ILE A 118 14.877 7.906 19.032 1.00 4.02 N ATOM 1937 CA ILE A 118 14.288 7.492 17.765 1.00 13.01 C ATOM 1938 C ILE A 118 13.218 8.478 17.308 1.00 10.24 C ATOM 1939 O ILE A 118 13.288 9.020 16.205 1.00 60.31 O ATOM 1940 CB ILE A 118 13.665 6.087 17.866 1.00 0.03 C ATOM 1941 CG1 ILE A 118 14.700 5.082 18.378 1.00 53.55 C ATOM 1942 CG2 ILE A 118 13.118 5.651 16.515 1.00 45.40 C ATOM 1943 CD1 ILE A 118 15.869 4.888 17.437 1.00 35.53 C ATOM 0 H ILE A 118 14.797 7.217 19.780 1.00 4.02 H new ATOM 0 HA ILE A 118 15.096 7.471 17.034 1.00 13.01 H new ATOM 0 HB ILE A 118 12.838 6.122 18.576 1.00 0.03 H new ATOM 0 HG12 ILE A 118 15.074 5.418 19.345 1.00 53.55 H new ATOM 0 HG13 ILE A 118 14.212 4.121 18.542 1.00 53.55 H new ATOM 0 HG21 ILE A 118 12.681 4.656 16.603 1.00 45.40 H new ATOM 0 HG22 ILE A 118 12.353 6.355 16.188 1.00 45.40 H new ATOM 0 HG23 ILE A 118 13.927 5.629 15.785 1.00 45.40 H new ATOM 0 HD11 ILE A 118 16.563 4.163 17.863 1.00 35.53 H new ATOM 0 HD12 ILE A 118 15.506 4.522 16.477 1.00 35.53 H new ATOM 0 HD13 ILE A 118 16.382 5.839 17.293 1.00 35.53 H new ATOM 1955 N PHE A 119 12.229 8.708 18.165 1.00 13.43 N ATOM 1956 CA PHE A 119 11.144 9.631 17.851 1.00 72.44 C ATOM 1957 C PHE A 119 11.457 11.034 18.362 1.00 62.22 C ATOM 1958 O PHE A 119 12.355 11.221 19.183 1.00 62.23 O ATOM 1959 CB PHE A 119 9.831 9.135 18.461 1.00 62.42 C ATOM 1960 CG PHE A 119 9.590 7.667 18.252 1.00 21.11 C ATOM 1961 CD1 PHE A 119 9.814 7.084 17.015 1.00 32.44 C ATOM 1962 CD2 PHE A 119 9.140 6.870 19.293 1.00 42.42 C ATOM 1963 CE1 PHE A 119 9.592 5.733 16.821 1.00 51.44 C ATOM 1964 CE2 PHE A 119 8.917 5.519 19.104 1.00 11.40 C ATOM 1965 CZ PHE A 119 9.144 4.950 17.866 1.00 1.15 C ATOM 0 H PHE A 119 12.156 8.268 19.082 1.00 13.43 H new ATOM 0 HA PHE A 119 11.040 9.674 16.767 1.00 72.44 H new ATOM 0 HB2 PHE A 119 9.834 9.346 19.530 1.00 62.42 H new ATOM 0 HB3 PHE A 119 9.003 9.696 18.028 1.00 62.42 H new ATOM 0 HD1 PHE A 119 10.166 7.691 16.194 1.00 32.44 H new ATOM 0 HD2 PHE A 119 8.962 7.310 20.263 1.00 42.42 H new ATOM 0 HE1 PHE A 119 9.769 5.290 15.852 1.00 51.44 H new ATOM 0 HE2 PHE A 119 8.566 4.909 19.923 1.00 11.40 H new ATOM 0 HZ PHE A 119 8.971 3.895 17.716 1.00 1.15 H new ATOM 1975 N SER A 120 10.710 12.017 17.870 1.00 64.05 N ATOM 1976 CA SER A 120 10.911 13.404 18.272 1.00 15.14 C ATOM 1977 C SER A 120 10.293 13.666 19.642 1.00 12.45 C ATOM 1978 O SER A 120 9.745 12.762 20.274 1.00 44.03 O ATOM 1979 CB SER A 120 10.302 14.351 17.236 1.00 0.12 C ATOM 1980 OG SER A 120 11.044 15.555 17.148 1.00 62.03 O ATOM 0 H SER A 120 9.960 11.879 17.192 1.00 64.05 H new ATOM 0 HA SER A 120 11.984 13.587 18.335 1.00 15.14 H new ATOM 0 HB2 SER A 120 10.278 13.863 16.262 1.00 0.12 H new ATOM 0 HB3 SER A 120 9.270 14.575 17.506 1.00 0.12 H new ATOM 0 HG SER A 120 10.636 16.143 16.478 1.00 62.03 H new ATOM 1986 N LYS A 121 10.385 14.911 20.097 1.00 13.53 N ATOM 1987 CA LYS A 121 9.835 15.296 21.392 1.00 52.33 C ATOM 1988 C LYS A 121 8.314 15.173 21.395 1.00 25.14 C ATOM 1989 O LYS A 121 7.725 14.694 22.363 1.00 33.15 O ATOM 1990 CB LYS A 121 10.241 16.731 21.735 1.00 5.04 C ATOM 1991 CG LYS A 121 11.304 16.819 22.818 1.00 54.54 C ATOM 1992 CD LYS A 121 12.601 16.160 22.381 1.00 42.54 C ATOM 1993 CE LYS A 121 13.813 16.955 22.843 1.00 20.43 C ATOM 1994 NZ LYS A 121 14.148 16.676 24.267 1.00 11.24 N ATOM 0 H LYS A 121 10.836 15.671 19.588 1.00 13.53 H new ATOM 0 HA LYS A 121 10.239 14.620 22.146 1.00 52.33 H new ATOM 0 HB2 LYS A 121 10.610 17.221 20.834 1.00 5.04 H new ATOM 0 HB3 LYS A 121 9.358 17.282 22.058 1.00 5.04 H new ATOM 0 HG2 LYS A 121 11.490 17.865 23.062 1.00 54.54 H new ATOM 0 HG3 LYS A 121 10.940 16.340 23.727 1.00 54.54 H new ATOM 0 HD2 LYS A 121 12.651 15.149 22.786 1.00 42.54 H new ATOM 0 HD3 LYS A 121 12.616 16.069 21.295 1.00 42.54 H new ATOM 0 HE2 LYS A 121 14.669 16.711 22.214 1.00 20.43 H new ATOM 0 HE3 LYS A 121 13.618 18.020 22.717 1.00 20.43 H new ATOM 0 HZ1 LYS A 121 14.979 17.236 24.544 1.00 11.24 H new ATOM 0 HZ2 LYS A 121 13.341 16.932 24.870 1.00 11.24 H new ATOM 0 HZ3 LYS A 121 14.359 15.664 24.382 1.00 11.24 H new ATOM 2008 N GLN A 122 7.687 15.607 20.307 1.00 64.32 N ATOM 2009 CA GLN A 122 6.236 15.543 20.186 1.00 53.43 C ATOM 2010 C GLN A 122 5.738 14.111 20.345 1.00 22.51 C ATOM 2011 O GLN A 122 4.667 13.873 20.903 1.00 30.24 O ATOM 2012 CB GLN A 122 5.791 16.103 18.833 1.00 33.14 C ATOM 2013 CG GLN A 122 5.938 17.612 18.721 1.00 32.31 C ATOM 2014 CD GLN A 122 4.781 18.360 19.354 1.00 20.53 C ATOM 2015 OE1 GLN A 122 3.728 18.533 18.740 1.00 42.23 O ATOM 2016 NE2 GLN A 122 4.971 18.807 20.590 1.00 15.01 N ATOM 0 H GLN A 122 8.161 16.007 19.497 1.00 64.32 H new ATOM 0 HA GLN A 122 5.804 16.148 20.983 1.00 53.43 H new ATOM 0 HB2 GLN A 122 6.375 15.630 18.044 1.00 33.14 H new ATOM 0 HB3 GLN A 122 4.748 15.834 18.663 1.00 33.14 H new ATOM 0 HG2 GLN A 122 6.869 17.919 19.198 1.00 32.31 H new ATOM 0 HG3 GLN A 122 6.013 17.889 17.669 1.00 32.31 H new ATOM 0 HE21 GLN A 122 5.860 18.641 21.061 1.00 15.01 H new ATOM 0 HE22 GLN A 122 4.228 19.316 21.068 1.00 15.01 H new ATOM 2025 N VAL A 123 6.523 13.158 19.851 1.00 51.34 N ATOM 2026 CA VAL A 123 6.162 11.748 19.939 1.00 44.33 C ATOM 2027 C VAL A 123 6.457 11.191 21.327 1.00 42.50 C ATOM 2028 O VAL A 123 5.593 10.585 21.961 1.00 45.02 O ATOM 2029 CB VAL A 123 6.917 10.909 18.890 1.00 1.53 C ATOM 2030 CG1 VAL A 123 6.509 9.447 18.982 1.00 24.02 C ATOM 2031 CG2 VAL A 123 6.667 11.454 17.492 1.00 10.42 C ATOM 0 H VAL A 123 7.413 13.337 19.386 1.00 51.34 H new ATOM 0 HA VAL A 123 5.092 11.682 19.744 1.00 44.33 H new ATOM 0 HB VAL A 123 7.985 10.977 19.096 1.00 1.53 H new ATOM 0 HG11 VAL A 123 7.052 8.870 18.234 1.00 24.02 H new ATOM 0 HG12 VAL A 123 6.744 9.065 19.976 1.00 24.02 H new ATOM 0 HG13 VAL A 123 5.438 9.356 18.803 1.00 24.02 H new ATOM 0 HG21 VAL A 123 7.208 10.850 16.764 1.00 10.42 H new ATOM 0 HG22 VAL A 123 5.600 11.418 17.273 1.00 10.42 H new ATOM 0 HG23 VAL A 123 7.014 12.486 17.436 1.00 10.42 H new ATOM 2041 N VAL A 124 7.684 11.402 21.795 1.00 75.11 N ATOM 2042 CA VAL A 124 8.093 10.922 23.110 1.00 52.54 C ATOM 2043 C VAL A 124 7.157 11.437 24.198 1.00 44.01 C ATOM 2044 O VAL A 124 6.792 10.703 25.115 1.00 65.31 O ATOM 2045 CB VAL A 124 9.534 11.354 23.441 1.00 71.34 C ATOM 2046 CG1 VAL A 124 9.933 10.865 24.825 1.00 42.04 C ATOM 2047 CG2 VAL A 124 10.500 10.838 22.385 1.00 72.32 C ATOM 0 H VAL A 124 8.411 11.902 21.283 1.00 75.11 H new ATOM 0 HA VAL A 124 8.046 9.833 23.079 1.00 52.54 H new ATOM 0 HB VAL A 124 9.578 12.443 23.440 1.00 71.34 H new ATOM 0 HG11 VAL A 124 10.954 11.179 25.042 1.00 42.04 H new ATOM 0 HG12 VAL A 124 9.258 11.288 25.569 1.00 42.04 H new ATOM 0 HG13 VAL A 124 9.874 9.777 24.858 1.00 42.04 H new ATOM 0 HG21 VAL A 124 11.513 11.152 22.634 1.00 72.32 H new ATOM 0 HG22 VAL A 124 10.455 9.749 22.352 1.00 72.32 H new ATOM 0 HG23 VAL A 124 10.224 11.242 21.411 1.00 72.32 H new ATOM 2057 N ASN A 125 6.772 12.704 24.089 1.00 43.40 N ATOM 2058 CA ASN A 125 5.879 13.318 25.064 1.00 15.24 C ATOM 2059 C ASN A 125 4.537 12.593 25.105 1.00 71.13 C ATOM 2060 O ASN A 125 3.837 12.617 26.117 1.00 30.43 O ATOM 2061 CB ASN A 125 5.662 14.796 24.730 1.00 24.43 C ATOM 2062 CG ASN A 125 6.630 15.702 25.467 1.00 53.34 C ATOM 2063 OD1 ASN A 125 6.254 16.389 26.417 1.00 75.23 O ATOM 2064 ND2 ASN A 125 7.884 15.709 25.029 1.00 33.25 N ATOM 0 H ASN A 125 7.065 13.326 23.335 1.00 43.40 H new ATOM 0 HA ASN A 125 6.346 13.239 26.046 1.00 15.24 H new ATOM 0 HB2 ASN A 125 5.776 14.944 23.656 1.00 24.43 H new ATOM 0 HB3 ASN A 125 4.640 15.077 24.984 1.00 24.43 H new ATOM 0 HD21 ASN A 125 8.580 16.300 25.484 1.00 33.25 H new ATOM 0 HD22 ASN A 125 8.151 15.123 24.238 1.00 33.25 H new ATOM 2071 N ASP A 126 4.185 11.949 23.997 1.00 24.13 N ATOM 2072 CA ASP A 126 2.929 11.215 23.906 1.00 74.10 C ATOM 2073 C ASP A 126 3.009 9.902 24.679 1.00 73.14 C ATOM 2074 O ASP A 126 2.051 9.501 25.341 1.00 3.23 O ATOM 2075 CB ASP A 126 2.579 10.939 22.443 1.00 44.44 C ATOM 2076 CG ASP A 126 1.158 10.440 22.271 1.00 65.54 C ATOM 2077 OD1 ASP A 126 0.441 10.330 23.287 1.00 74.21 O ATOM 2078 OD2 ASP A 126 0.764 10.159 21.120 1.00 70.13 O ATOM 0 H ASP A 126 4.752 11.921 23.150 1.00 24.13 H new ATOM 0 HA ASP A 126 2.145 11.830 24.349 1.00 74.10 H new ATOM 0 HB2 ASP A 126 2.713 11.852 21.862 1.00 44.44 H new ATOM 0 HB3 ASP A 126 3.272 10.200 22.040 1.00 44.44 H new ATOM 2083 N ILE A 127 4.155 9.237 24.588 1.00 63.25 N ATOM 2084 CA ILE A 127 4.360 7.969 25.278 1.00 54.51 C ATOM 2085 C ILE A 127 4.256 8.144 26.789 1.00 21.22 C ATOM 2086 O ILE A 127 3.483 7.452 27.452 1.00 44.43 O ATOM 2087 CB ILE A 127 5.731 7.357 24.936 1.00 74.32 C ATOM 2088 CG1 ILE A 127 5.910 7.269 23.419 1.00 44.31 C ATOM 2089 CG2 ILE A 127 5.869 5.981 25.571 1.00 4.32 C ATOM 2090 CD1 ILE A 127 7.254 6.714 23.001 1.00 40.54 C ATOM 0 H ILE A 127 4.956 9.555 24.043 1.00 63.25 H new ATOM 0 HA ILE A 127 3.575 7.293 24.938 1.00 54.51 H new ATOM 0 HB ILE A 127 6.512 8.002 25.339 1.00 74.32 H new ATOM 0 HG12 ILE A 127 5.122 6.641 23.004 1.00 44.31 H new ATOM 0 HG13 ILE A 127 5.786 8.263 22.988 1.00 44.31 H new ATOM 0 HG21 ILE A 127 6.843 5.561 25.321 1.00 4.32 H new ATOM 0 HG22 ILE A 127 5.779 6.069 26.654 1.00 4.32 H new ATOM 0 HG23 ILE A 127 5.084 5.326 25.194 1.00 4.32 H new ATOM 0 HD11 ILE A 127 7.311 6.680 21.913 1.00 40.54 H new ATOM 0 HD12 ILE A 127 8.048 7.354 23.386 1.00 40.54 H new ATOM 0 HD13 ILE A 127 7.373 5.707 23.402 1.00 40.54 H new ATOM 2102 N GLU A 128 5.039 9.074 27.327 1.00 21.23 N ATOM 2103 CA GLU A 128 5.034 9.340 28.761 1.00 21.50 C ATOM 2104 C GLU A 128 3.613 9.567 29.267 1.00 34.34 C ATOM 2105 O GLU A 128 3.152 8.885 30.183 1.00 23.22 O ATOM 2106 CB GLU A 128 5.902 10.559 29.079 1.00 14.22 C ATOM 2107 CG GLU A 128 7.343 10.417 28.621 1.00 24.35 C ATOM 2108 CD GLU A 128 8.151 9.495 29.515 1.00 74.23 C ATOM 2109 OE1 GLU A 128 8.446 9.890 30.662 1.00 11.30 O ATOM 2110 OE2 GLU A 128 8.487 8.379 29.067 1.00 22.10 O ATOM 0 H GLU A 128 5.684 9.655 26.792 1.00 21.23 H new ATOM 0 HA GLU A 128 5.446 8.468 29.268 1.00 21.50 H new ATOM 0 HB2 GLU A 128 5.465 11.439 28.607 1.00 14.22 H new ATOM 0 HB3 GLU A 128 5.887 10.734 30.155 1.00 14.22 H new ATOM 0 HG2 GLU A 128 7.360 10.034 27.601 1.00 24.35 H new ATOM 0 HG3 GLU A 128 7.812 11.400 28.600 1.00 24.35 H new ATOM 2117 N ARG A 129 2.923 10.530 28.665 1.00 60.21 N ATOM 2118 CA ARG A 129 1.555 10.849 29.055 1.00 20.22 C ATOM 2119 C ARG A 129 0.644 9.637 28.881 1.00 14.43 C ATOM 2120 O ARG A 129 -0.350 9.488 29.592 1.00 0.45 O ATOM 2121 CB ARG A 129 1.026 12.021 28.227 1.00 1.54 C ATOM 2122 CG ARG A 129 0.822 11.687 26.759 1.00 52.12 C ATOM 2123 CD ARG A 129 0.054 12.785 26.039 1.00 20.12 C ATOM 2124 NE ARG A 129 0.733 14.075 26.127 1.00 55.20 N ATOM 2125 CZ ARG A 129 0.197 15.217 25.711 1.00 55.12 C ATOM 2126 NH1 ARG A 129 -1.019 15.229 25.181 1.00 21.33 N ATOM 2127 NH2 ARG A 129 0.877 16.351 25.825 1.00 74.15 N ATOM 0 H ARG A 129 3.289 11.103 27.905 1.00 60.21 H new ATOM 0 HA ARG A 129 1.560 11.130 30.108 1.00 20.22 H new ATOM 0 HB2 ARG A 129 0.078 12.355 28.650 1.00 1.54 H new ATOM 0 HB3 ARG A 129 1.723 12.855 28.308 1.00 1.54 H new ATOM 0 HG2 ARG A 129 1.790 11.544 26.279 1.00 52.12 H new ATOM 0 HG3 ARG A 129 0.281 10.745 26.671 1.00 52.12 H new ATOM 0 HD2 ARG A 129 -0.072 12.512 24.991 1.00 20.12 H new ATOM 0 HD3 ARG A 129 -0.944 12.871 26.468 1.00 20.12 H new ATOM 0 HE ARG A 129 1.670 14.100 26.530 1.00 55.20 H new ATOM 0 HH11 ARG A 129 -1.545 14.360 25.092 1.00 21.33 H new ATOM 0 HH12 ARG A 129 -1.428 16.108 24.863 1.00 21.33 H new ATOM 0 HH21 ARG A 129 1.812 16.346 26.232 1.00 74.15 H new ATOM 0 HH22 ARG A 129 0.465 17.227 25.505 1.00 74.15 H new ATOM 2141 N SER A 130 0.989 8.775 27.930 1.00 11.24 N ATOM 2142 CA SER A 130 0.200 7.579 27.660 1.00 53.22 C ATOM 2143 C SER A 130 0.133 6.682 28.892 1.00 11.11 C ATOM 2144 O SER A 130 -0.951 6.339 29.367 1.00 43.11 O ATOM 2145 CB SER A 130 0.796 6.805 26.483 1.00 71.41 C ATOM 2146 OG SER A 130 -0.182 6.558 25.487 1.00 44.41 O ATOM 0 H SER A 130 1.810 8.883 27.334 1.00 11.24 H new ATOM 0 HA SER A 130 -0.813 7.892 27.405 1.00 53.22 H new ATOM 0 HB2 SER A 130 1.623 7.371 26.053 1.00 71.41 H new ATOM 0 HB3 SER A 130 1.207 5.859 26.836 1.00 71.41 H new ATOM 0 HG SER A 130 0.259 6.286 24.655 1.00 44.41 H new ATOM 2152 N LEU A 131 1.299 6.305 29.405 1.00 13.45 N ATOM 2153 CA LEU A 131 1.375 5.448 30.583 1.00 32.22 C ATOM 2154 C LEU A 131 1.065 6.236 31.852 1.00 52.03 C ATOM 2155 O LEU A 131 0.590 5.678 32.840 1.00 11.14 O ATOM 2156 CB LEU A 131 2.763 4.815 30.689 1.00 45.02 C ATOM 2157 CG LEU A 131 3.171 3.895 29.537 1.00 4.52 C ATOM 2158 CD1 LEU A 131 2.022 2.975 29.156 1.00 2.22 C ATOM 2159 CD2 LEU A 131 3.623 4.713 28.336 1.00 50.30 C ATOM 0 H LEU A 131 2.205 6.579 29.024 1.00 13.45 H new ATOM 0 HA LEU A 131 0.630 4.660 30.476 1.00 32.22 H new ATOM 0 HB2 LEU A 131 3.500 5.614 30.768 1.00 45.02 H new ATOM 0 HB3 LEU A 131 2.811 4.245 31.617 1.00 45.02 H new ATOM 0 HG LEU A 131 4.008 3.279 29.868 1.00 4.52 H new ATOM 0 HD11 LEU A 131 2.331 2.328 28.335 1.00 2.22 H new ATOM 0 HD12 LEU A 131 1.745 2.364 30.015 1.00 2.22 H new ATOM 0 HD13 LEU A 131 1.165 3.573 28.844 1.00 2.22 H new ATOM 0 HD21 LEU A 131 3.910 4.042 27.526 1.00 50.30 H new ATOM 0 HD22 LEU A 131 2.806 5.354 28.004 1.00 50.30 H new ATOM 0 HD23 LEU A 131 4.477 5.329 28.616 1.00 50.30 H new