USER MOD reduce.3.24.130724 H: found=0, std=0, add=745, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 747 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: B 126 GLN : amide:sc= -3.92 K(o=-4.9,f=-6.1!) USER MOD Set 1.2: B 155 GLN : amide:sc= -1 K(o=-4.9,f=-3.9) USER MOD Set 2.1: B 140 GLN : amide:sc= -0.725 K(o=-2.8,f=-4.5) USER MOD Set 2.2: B 143 ASN : amide:sc= -2.03! K(o=-2.8!,f=-0.5) USER MOD Set 3.1: B 121 ASN : amide:sc= -0.219 K(o=-5.9,f=-2.1) USER MOD Set 3.2: B 152 ASN : amide:sc= -5.71 K(o=-5.9,f=-2.1) USER MOD Set 4.1: A 40 GLN : amide:sc= -1.59! K(o=-3.4!,f=-1) USER MOD Set 4.2: A 43 ASN : amide:sc= -1.76! K(o=-3.4!,f=-1) USER MOD Set 5.1: A 26 GLN : amide:sc= -2.99! C(o=-3.3!,f=-6.3!) USER MOD Set 5.2: A 55 GLN : amide:sc= -0.349 K(o=-3.3,f=-6.3) USER MOD Set 6.1: A 18 HIS : no HE2:sc= -0.446 K(o=-0.9,f=-3.7) USER MOD Set 6.2: B 110 GLN : amide:sc= -0.457 X(o=-0.9,f=-0.55) USER MOD Single : A 6 ASN : amide:sc=-0.000356 K(o=-0.00036,f=-0.83) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= -2.31! X(o=-2.3!,f=-2.2) USER MOD Single : A 10 GLN : amide:sc= -0.767 K(o=-0.77,f=-1.3!) USER MOD Single : A 11 ASN : amide:sc= -0.886 X(o=-0.89,f=-0.81) USER MOD Single : A 14 TYR OH : rot 180:sc= -0.938 USER MOD Single : A 21 ASN : amide:sc= -0.811 X(o=-0.81,f=-0.84) USER MOD Single : A 23 ASN : amide:sc= -0.331 K(o=-0.33,f=-12!) USER MOD Single : A 28 ASN : amide:sc= -2.96 X(o=-3,f=-3!) USER MOD Single : A 32 GLN : amide:sc= -3.02! K(o=-3!,f=-1.4) USER MOD Single : A 33 SER OG : rot 80:sc= 0.0174 USER MOD Single : A 35 LYS NZ :NH3+ -125:sc= -0.154 (180deg=-1.31) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 109:sc= 0.659 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= -2.18 K(o=-2.2,f=-14!) USER MOD Single : B 109 THR OG1 : rot 28:sc= -0.038 USER MOD Single : B 113 SER OG : rot 66:sc= -0.452 USER MOD Single : B 118 THR OG1 : rot -20:sc= 0.817 USER MOD Single : B 123 ASN : amide:sc= -0.867 K(o=-0.87,f=-10!) USER MOD Single : B 132 SER OG : rot 14:sc= 0.176 USER MOD Single : B 133 SER OG : rot 160:sc= -0.0366 USER MOD Single : B 139 SER OG : rot 180:sc= 0 USER MOD Single : B 141 SER OG : rot 121:sc= 0.697 USER MOD Single : B 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 87 N ASN A 6 -4.572 -10.075 7.631 1.00 0.35 N ATOM 88 CA ASN A 6 -3.968 -10.509 8.885 1.00 0.37 C ATOM 89 C ASN A 6 -2.907 -9.519 9.363 1.00 0.37 C ATOM 90 O ASN A 6 -2.747 -8.442 8.790 1.00 0.36 O ATOM 91 CB ASN A 6 -3.349 -11.898 8.714 1.00 0.36 C ATOM 92 CG ASN A 6 -4.390 -12.966 8.437 1.00 0.97 C ATOM 93 OD1 ASN A 6 -5.529 -12.873 8.892 1.00 1.73 O ATOM 94 ND2 ASN A 6 -4.001 -13.989 7.683 1.00 1.69 N ATOM 0 HA ASN A 6 -4.753 -10.553 9.640 1.00 0.37 H new ATOM 0 HB2 ASN A 6 -2.630 -11.874 7.895 1.00 0.36 H new ATOM 0 HB3 ASN A 6 -2.796 -12.159 9.616 1.00 0.36 H new ATOM 0 HD21 ASN A 6 -4.657 -14.737 7.461 1.00 1.69 H new ATOM 0 HD22 ASN A 6 -3.046 -14.026 7.326 1.00 1.69 H new ATOM 101 N LYS A 7 -2.186 -9.894 10.416 1.00 0.40 N ATOM 102 CA LYS A 7 -1.143 -9.037 10.974 1.00 0.43 C ATOM 103 C LYS A 7 0.043 -8.936 10.021 1.00 0.40 C ATOM 104 O LYS A 7 0.460 -7.836 9.657 1.00 0.38 O ATOM 105 CB LYS A 7 -0.683 -9.577 12.332 1.00 0.52 C ATOM 106 CG LYS A 7 0.410 -8.745 12.992 1.00 0.58 C ATOM 107 CD LYS A 7 -0.069 -7.340 13.335 1.00 0.60 C ATOM 108 CE LYS A 7 -1.185 -7.364 14.369 1.00 1.39 C ATOM 109 NZ LYS A 7 -1.596 -5.991 14.772 1.00 1.90 N ATOM 0 H LYS A 7 -2.304 -10.784 10.900 1.00 0.40 H new ATOM 0 HA LYS A 7 -1.559 -8.039 11.112 1.00 0.43 H new ATOM 0 HB2 LYS A 7 -1.542 -9.627 13.001 1.00 0.52 H new ATOM 0 HB3 LYS A 7 -0.321 -10.597 12.202 1.00 0.52 H new ATOM 0 HG2 LYS A 7 0.747 -9.245 13.900 1.00 0.58 H new ATOM 0 HG3 LYS A 7 1.270 -8.682 12.325 1.00 0.58 H new ATOM 0 HD2 LYS A 7 0.767 -6.753 13.715 1.00 0.60 H new ATOM 0 HD3 LYS A 7 -0.421 -6.844 12.430 1.00 0.60 H new ATOM 0 HE2 LYS A 7 -2.045 -7.896 13.963 1.00 1.39 H new ATOM 0 HE3 LYS A 7 -0.854 -7.917 15.248 1.00 1.39 H new ATOM 0 HZ1 LYS A 7 -2.358 -6.050 15.477 1.00 1.90 H new ATOM 0 HZ2 LYS A 7 -0.782 -5.491 15.183 1.00 1.90 H new ATOM 0 HZ3 LYS A 7 -1.936 -5.471 13.938 1.00 1.90 H new ATOM 123 N GLU A 8 0.582 -10.085 9.621 1.00 0.43 N ATOM 124 CA GLU A 8 1.717 -10.117 8.705 1.00 0.43 C ATOM 125 C GLU A 8 1.378 -9.386 7.412 1.00 0.37 C ATOM 126 O GLU A 8 2.240 -8.762 6.795 1.00 0.39 O ATOM 127 CB GLU A 8 2.120 -11.559 8.394 1.00 0.47 C ATOM 128 CG GLU A 8 2.397 -12.397 9.631 1.00 0.52 C ATOM 129 CD GLU A 8 2.814 -13.815 9.292 1.00 1.03 C ATOM 130 OE1 GLU A 8 4.015 -14.035 9.029 1.00 1.80 O ATOM 131 OE2 GLU A 8 1.938 -14.706 9.289 1.00 0.95 O ATOM 0 H GLU A 8 0.251 -11.004 9.916 1.00 0.43 H new ATOM 0 HA GLU A 8 2.556 -9.615 9.188 1.00 0.43 H new ATOM 0 HB2 GLU A 8 1.326 -12.032 7.816 1.00 0.47 H new ATOM 0 HB3 GLU A 8 3.010 -11.550 7.765 1.00 0.47 H new ATOM 0 HG2 GLU A 8 3.182 -11.922 10.219 1.00 0.52 H new ATOM 0 HG3 GLU A 8 1.504 -12.424 10.255 1.00 0.52 H new ATOM 138 N GLN A 9 0.115 -9.474 7.007 1.00 0.34 N ATOM 139 CA GLN A 9 -0.344 -8.815 5.794 1.00 0.33 C ATOM 140 C GLN A 9 -0.277 -7.301 5.962 1.00 0.30 C ATOM 141 O GLN A 9 -0.043 -6.566 5.003 1.00 0.32 O ATOM 142 CB GLN A 9 -1.774 -9.248 5.466 1.00 0.36 C ATOM 143 CG GLN A 9 -2.136 -9.102 3.998 1.00 0.38 C ATOM 144 CD GLN A 9 -3.551 -9.557 3.697 1.00 0.73 C ATOM 145 OE1 GLN A 9 -4.087 -10.439 4.367 1.00 1.44 O ATOM 146 NE2 GLN A 9 -4.161 -8.959 2.681 1.00 0.50 N ATOM 0 H GLN A 9 -0.608 -9.996 7.503 1.00 0.34 H new ATOM 0 HA GLN A 9 0.307 -9.105 4.969 1.00 0.33 H new ATOM 0 HB2 GLN A 9 -1.906 -10.289 5.761 1.00 0.36 H new ATOM 0 HB3 GLN A 9 -2.469 -8.657 6.063 1.00 0.36 H new ATOM 0 HG2 GLN A 9 -2.023 -8.059 3.702 1.00 0.38 H new ATOM 0 HG3 GLN A 9 -1.436 -9.682 3.396 1.00 0.38 H new ATOM 0 HE21 GLN A 9 -3.678 -8.232 2.153 1.00 0.50 H new ATOM 0 HE22 GLN A 9 -5.112 -9.226 2.429 1.00 0.50 H new ATOM 155 N GLN A 10 -0.482 -6.846 7.197 1.00 0.27 N ATOM 156 CA GLN A 10 -0.438 -5.423 7.512 1.00 0.25 C ATOM 157 C GLN A 10 1.003 -4.953 7.661 1.00 0.23 C ATOM 158 O GLN A 10 1.351 -3.845 7.252 1.00 0.26 O ATOM 159 CB GLN A 10 -1.220 -5.139 8.795 1.00 0.26 C ATOM 160 CG GLN A 10 -1.521 -3.665 9.005 1.00 0.26 C ATOM 161 CD GLN A 10 -2.526 -3.421 10.116 1.00 0.64 C ATOM 162 OE1 GLN A 10 -3.362 -4.274 10.411 1.00 1.18 O ATOM 163 NE2 GLN A 10 -2.453 -2.245 10.730 1.00 0.89 N ATOM 0 H GLN A 10 -0.681 -7.447 7.997 1.00 0.27 H new ATOM 0 HA GLN A 10 -0.899 -4.874 6.691 1.00 0.25 H new ATOM 0 HB2 GLN A 10 -2.158 -5.694 8.770 1.00 0.26 H new ATOM 0 HB3 GLN A 10 -0.652 -5.511 9.648 1.00 0.26 H new ATOM 0 HG2 GLN A 10 -0.595 -3.140 9.238 1.00 0.26 H new ATOM 0 HG3 GLN A 10 -1.903 -3.241 8.076 1.00 0.26 H new ATOM 0 HE21 GLN A 10 -1.743 -1.568 10.452 1.00 0.89 H new ATOM 0 HE22 GLN A 10 -3.107 -2.020 11.479 1.00 0.89 H new ATOM 172 N ASN A 11 1.837 -5.803 8.250 1.00 0.24 N ATOM 173 CA ASN A 11 3.243 -5.480 8.446 1.00 0.23 C ATOM 174 C ASN A 11 3.954 -5.375 7.104 1.00 0.21 C ATOM 175 O ASN A 11 4.729 -4.449 6.874 1.00 0.22 O ATOM 176 CB ASN A 11 3.919 -6.539 9.318 1.00 0.27 C ATOM 177 CG ASN A 11 3.325 -6.605 10.711 1.00 0.72 C ATOM 178 OD1 ASN A 11 2.850 -5.602 11.244 1.00 1.08 O ATOM 179 ND2 ASN A 11 3.349 -7.790 11.311 1.00 0.82 N ATOM 0 H ASN A 11 1.562 -6.721 8.600 1.00 0.24 H new ATOM 0 HA ASN A 11 3.308 -4.518 8.954 1.00 0.23 H new ATOM 0 HB2 ASN A 11 3.825 -7.514 8.839 1.00 0.27 H new ATOM 0 HB3 ASN A 11 4.984 -6.320 9.390 1.00 0.27 H new ATOM 0 HD21 ASN A 11 2.964 -7.894 12.250 1.00 0.82 H new ATOM 0 HD22 ASN A 11 3.752 -8.596 10.833 1.00 0.82 H new ATOM 186 N ALA A 12 3.683 -6.331 6.222 1.00 0.19 N ATOM 187 CA ALA A 12 4.288 -6.341 4.897 1.00 0.18 C ATOM 188 C ALA A 12 3.943 -5.065 4.140 1.00 0.15 C ATOM 189 O ALA A 12 4.769 -4.521 3.410 1.00 0.20 O ATOM 190 CB ALA A 12 3.833 -7.568 4.119 1.00 0.22 C ATOM 0 H ALA A 12 3.048 -7.109 6.402 1.00 0.19 H new ATOM 0 HA ALA A 12 5.371 -6.385 5.010 1.00 0.18 H new ATOM 0 HB1 ALA A 12 4.292 -7.563 3.131 1.00 0.22 H new ATOM 0 HB2 ALA A 12 4.132 -8.469 4.654 1.00 0.22 H new ATOM 0 HB3 ALA A 12 2.748 -7.551 4.015 1.00 0.22 H new ATOM 196 N PHE A 13 2.717 -4.591 4.331 1.00 0.13 N ATOM 197 CA PHE A 13 2.252 -3.372 3.679 1.00 0.11 C ATOM 198 C PHE A 13 3.132 -2.188 4.066 1.00 0.11 C ATOM 199 O PHE A 13 3.804 -1.599 3.221 1.00 0.15 O ATOM 200 CB PHE A 13 0.794 -3.100 4.073 1.00 0.14 C ATOM 201 CG PHE A 13 0.247 -1.796 3.560 1.00 0.12 C ATOM 202 CD1 PHE A 13 -0.331 -1.717 2.302 1.00 0.12 C ATOM 203 CD2 PHE A 13 0.299 -0.653 4.343 1.00 0.13 C ATOM 204 CE1 PHE A 13 -0.845 -0.522 1.835 1.00 0.11 C ATOM 205 CE2 PHE A 13 -0.213 0.544 3.879 1.00 0.13 C ATOM 206 CZ PHE A 13 -0.785 0.609 2.625 1.00 0.11 C ATOM 0 H PHE A 13 2.025 -5.034 4.935 1.00 0.13 H new ATOM 0 HA PHE A 13 2.313 -3.505 2.599 1.00 0.11 H new ATOM 0 HB2 PHE A 13 0.171 -3.913 3.700 1.00 0.14 H new ATOM 0 HB3 PHE A 13 0.716 -3.111 5.160 1.00 0.14 H new ATOM 0 HD1 PHE A 13 -0.380 -2.599 1.680 1.00 0.12 H new ATOM 0 HD2 PHE A 13 0.744 -0.698 5.326 1.00 0.13 H new ATOM 0 HE1 PHE A 13 -1.293 -0.473 0.854 1.00 0.11 H new ATOM 0 HE2 PHE A 13 -0.165 1.428 4.498 1.00 0.13 H new ATOM 0 HZ PHE A 13 -1.186 1.544 2.262 1.00 0.11 H new ATOM 216 N TYR A 14 3.132 -1.858 5.354 1.00 0.11 N ATOM 217 CA TYR A 14 3.917 -0.738 5.864 1.00 0.13 C ATOM 218 C TYR A 14 5.401 -0.885 5.529 1.00 0.13 C ATOM 219 O TYR A 14 6.024 0.053 5.034 1.00 0.17 O ATOM 220 CB TYR A 14 3.732 -0.608 7.376 1.00 0.16 C ATOM 221 CG TYR A 14 2.335 -0.192 7.785 1.00 0.19 C ATOM 222 CD1 TYR A 14 1.820 1.043 7.410 1.00 0.24 C ATOM 223 CD2 TYR A 14 1.536 -1.031 8.552 1.00 0.26 C ATOM 224 CE1 TYR A 14 0.549 1.431 7.792 1.00 0.31 C ATOM 225 CE2 TYR A 14 0.263 -0.650 8.934 1.00 0.32 C ATOM 226 CZ TYR A 14 -0.224 0.582 8.553 1.00 0.33 C ATOM 227 OH TYR A 14 -1.488 0.965 8.938 1.00 0.42 O ATOM 0 H TYR A 14 2.595 -2.352 6.066 1.00 0.11 H new ATOM 0 HA TYR A 14 3.554 0.166 5.376 1.00 0.13 H new ATOM 0 HB2 TYR A 14 3.969 -1.563 7.845 1.00 0.16 H new ATOM 0 HB3 TYR A 14 4.446 0.122 7.759 1.00 0.16 H new ATOM 0 HD1 TYR A 14 2.422 1.710 6.811 1.00 0.24 H new ATOM 0 HD2 TYR A 14 1.915 -1.996 8.855 1.00 0.26 H new ATOM 0 HE1 TYR A 14 0.164 2.395 7.495 1.00 0.31 H new ATOM 0 HE2 TYR A 14 -0.347 -1.314 9.528 1.00 0.32 H new ATOM 0 HH TYR A 14 -1.899 0.251 9.469 1.00 0.42 H new ATOM 237 N GLU A 15 5.964 -2.061 5.804 1.00 0.11 N ATOM 238 CA GLU A 15 7.377 -2.313 5.532 1.00 0.12 C ATOM 239 C GLU A 15 7.726 -1.983 4.083 1.00 0.12 C ATOM 240 O GLU A 15 8.839 -1.546 3.788 1.00 0.19 O ATOM 241 CB GLU A 15 7.731 -3.770 5.836 1.00 0.13 C ATOM 242 CG GLU A 15 7.702 -4.111 7.317 1.00 0.19 C ATOM 243 CD GLU A 15 8.668 -3.269 8.128 1.00 1.16 C ATOM 244 OE1 GLU A 15 8.272 -2.168 8.565 1.00 2.16 O ATOM 245 OE2 GLU A 15 9.818 -3.711 8.327 1.00 1.08 O ATOM 0 H GLU A 15 5.465 -2.851 6.213 1.00 0.11 H new ATOM 0 HA GLU A 15 7.962 -1.663 6.183 1.00 0.12 H new ATOM 0 HB2 GLU A 15 7.034 -4.421 5.309 1.00 0.13 H new ATOM 0 HB3 GLU A 15 8.725 -3.982 5.443 1.00 0.13 H new ATOM 0 HG2 GLU A 15 6.691 -3.968 7.699 1.00 0.19 H new ATOM 0 HG3 GLU A 15 7.946 -5.165 7.448 1.00 0.19 H new ATOM 252 N ILE A 16 6.769 -2.194 3.185 1.00 0.10 N ATOM 253 CA ILE A 16 6.976 -1.914 1.769 1.00 0.09 C ATOM 254 C ILE A 16 6.926 -0.410 1.500 1.00 0.12 C ATOM 255 O ILE A 16 7.637 0.097 0.634 1.00 0.16 O ATOM 256 CB ILE A 16 5.931 -2.648 0.898 1.00 0.10 C ATOM 257 CG1 ILE A 16 6.241 -4.148 0.873 1.00 0.12 C ATOM 258 CG2 ILE A 16 5.905 -2.083 -0.517 1.00 0.12 C ATOM 259 CD1 ILE A 16 5.146 -4.991 0.255 1.00 0.14 C ATOM 0 H ILE A 16 5.844 -2.558 3.413 1.00 0.10 H new ATOM 0 HA ILE A 16 7.966 -2.283 1.500 1.00 0.09 H new ATOM 0 HB ILE A 16 4.944 -2.495 1.335 1.00 0.10 H new ATOM 0 HG12 ILE A 16 7.166 -4.309 0.319 1.00 0.12 H new ATOM 0 HG13 ILE A 16 6.417 -4.490 1.893 1.00 0.12 H new ATOM 0 HG21 ILE A 16 5.161 -2.617 -1.108 1.00 0.12 H new ATOM 0 HG22 ILE A 16 5.648 -1.024 -0.481 1.00 0.12 H new ATOM 0 HG23 ILE A 16 6.887 -2.203 -0.975 1.00 0.12 H new ATOM 0 HD11 ILE A 16 5.440 -6.040 0.274 1.00 0.14 H new ATOM 0 HD12 ILE A 16 4.224 -4.862 0.822 1.00 0.14 H new ATOM 0 HD13 ILE A 16 4.984 -4.678 -0.777 1.00 0.14 H new ATOM 271 N LEU A 17 6.085 0.297 2.252 1.00 0.14 N ATOM 272 CA LEU A 17 5.960 1.744 2.101 1.00 0.19 C ATOM 273 C LEU A 17 7.163 2.458 2.713 1.00 0.18 C ATOM 274 O LEU A 17 7.535 3.550 2.284 1.00 0.26 O ATOM 275 CB LEU A 17 4.676 2.248 2.764 1.00 0.27 C ATOM 276 CG LEU A 17 3.427 2.196 1.885 1.00 0.35 C ATOM 277 CD1 LEU A 17 2.816 0.805 1.901 1.00 0.80 C ATOM 278 CD2 LEU A 17 2.415 3.232 2.343 1.00 0.77 C ATOM 0 H LEU A 17 5.483 -0.107 2.969 1.00 0.14 H new ATOM 0 HA LEU A 17 5.921 1.965 1.034 1.00 0.19 H new ATOM 0 HB2 LEU A 17 4.494 1.658 3.662 1.00 0.27 H new ATOM 0 HB3 LEU A 17 4.832 3.278 3.086 1.00 0.27 H new ATOM 0 HG LEU A 17 3.717 2.426 0.860 1.00 0.35 H new ATOM 0 HD11 LEU A 17 1.928 0.790 1.269 1.00 0.80 H new ATOM 0 HD12 LEU A 17 3.542 0.084 1.524 1.00 0.80 H new ATOM 0 HD13 LEU A 17 2.539 0.541 2.922 1.00 0.80 H new ATOM 0 HD21 LEU A 17 1.531 3.183 1.707 1.00 0.77 H new ATOM 0 HD22 LEU A 17 2.131 3.031 3.376 1.00 0.77 H new ATOM 0 HD23 LEU A 17 2.856 4.226 2.275 1.00 0.77 H new ATOM 290 N HIS A 18 7.772 1.828 3.717 1.00 0.16 N ATOM 291 CA HIS A 18 8.927 2.403 4.402 1.00 0.16 C ATOM 292 C HIS A 18 10.158 2.423 3.503 1.00 0.13 C ATOM 293 O HIS A 18 11.018 3.295 3.640 1.00 0.15 O ATOM 294 CB HIS A 18 9.234 1.619 5.680 1.00 0.17 C ATOM 295 CG HIS A 18 8.209 1.794 6.760 1.00 0.25 C ATOM 296 ND1 HIS A 18 8.372 1.297 8.036 1.00 0.58 N ATOM 297 CD2 HIS A 18 7.003 2.413 6.752 1.00 0.28 C ATOM 298 CE1 HIS A 18 7.313 1.603 8.765 1.00 0.60 C ATOM 299 NE2 HIS A 18 6.469 2.280 8.010 1.00 0.33 N ATOM 0 H HIS A 18 7.483 0.917 4.074 1.00 0.16 H new ATOM 0 HA HIS A 18 8.676 3.432 4.660 1.00 0.16 H new ATOM 0 HB2 HIS A 18 9.312 0.560 5.435 1.00 0.17 H new ATOM 0 HB3 HIS A 18 10.206 1.931 6.061 1.00 0.17 H new ATOM 0 HD1 HIS A 18 9.184 0.775 8.366 1.00 0.58 H new ATOM 0 HD2 HIS A 18 6.547 2.917 5.913 1.00 0.28 H new ATOM 0 HE1 HIS A 18 7.164 1.343 9.803 1.00 0.60 H new ATOM 308 N LEU A 19 10.243 1.459 2.590 1.00 0.14 N ATOM 309 CA LEU A 19 11.376 1.369 1.674 1.00 0.14 C ATOM 310 C LEU A 19 11.630 2.715 0.990 1.00 0.16 C ATOM 311 O LEU A 19 10.834 3.157 0.163 1.00 0.18 O ATOM 312 CB LEU A 19 11.123 0.277 0.631 1.00 0.12 C ATOM 313 CG LEU A 19 10.942 -1.131 1.206 1.00 0.11 C ATOM 314 CD1 LEU A 19 10.640 -2.127 0.099 1.00 0.13 C ATOM 315 CD2 LEU A 19 12.182 -1.556 1.982 1.00 0.12 C ATOM 0 H LEU A 19 9.541 0.730 2.465 1.00 0.14 H new ATOM 0 HA LEU A 19 12.265 1.108 2.248 1.00 0.14 H new ATOM 0 HB2 LEU A 19 10.232 0.539 0.061 1.00 0.12 H new ATOM 0 HB3 LEU A 19 11.958 0.263 -0.070 1.00 0.12 H new ATOM 0 HG LEU A 19 10.095 -1.113 1.892 1.00 0.11 H new ATOM 0 HD11 LEU A 19 10.515 -3.121 0.528 1.00 0.13 H new ATOM 0 HD12 LEU A 19 9.723 -1.835 -0.413 1.00 0.13 H new ATOM 0 HD13 LEU A 19 11.465 -2.141 -0.613 1.00 0.13 H new ATOM 0 HD21 LEU A 19 12.034 -2.559 2.383 1.00 0.12 H new ATOM 0 HD22 LEU A 19 13.046 -1.555 1.317 1.00 0.12 H new ATOM 0 HD23 LEU A 19 12.354 -0.859 2.802 1.00 0.12 H new ATOM 327 N PRO A 20 12.754 3.382 1.328 1.00 0.18 N ATOM 328 CA PRO A 20 13.098 4.688 0.761 1.00 0.21 C ATOM 329 C PRO A 20 13.696 4.588 -0.638 1.00 0.21 C ATOM 330 O PRO A 20 13.304 5.323 -1.545 1.00 0.23 O ATOM 331 CB PRO A 20 14.135 5.223 1.747 1.00 0.24 C ATOM 332 CG PRO A 20 14.818 4.005 2.268 1.00 0.22 C ATOM 333 CD PRO A 20 13.779 2.913 2.285 1.00 0.19 C ATOM 0 HA PRO A 20 12.221 5.324 0.640 1.00 0.21 H new ATOM 0 HB2 PRO A 20 14.840 5.894 1.256 1.00 0.24 H new ATOM 0 HB3 PRO A 20 13.664 5.788 2.551 1.00 0.24 H new ATOM 0 HG2 PRO A 20 15.661 3.730 1.634 1.00 0.22 H new ATOM 0 HG3 PRO A 20 15.215 4.180 3.268 1.00 0.22 H new ATOM 0 HD2 PRO A 20 14.201 1.955 1.981 1.00 0.19 H new ATOM 0 HD3 PRO A 20 13.361 2.775 3.282 1.00 0.19 H new ATOM 341 N ASN A 21 14.647 3.675 -0.806 1.00 0.20 N ATOM 342 CA ASN A 21 15.305 3.483 -2.091 1.00 0.21 C ATOM 343 C ASN A 21 14.315 2.987 -3.138 1.00 0.20 C ATOM 344 O ASN A 21 14.513 3.186 -4.337 1.00 0.23 O ATOM 345 CB ASN A 21 16.465 2.499 -1.947 1.00 0.21 C ATOM 346 CG ASN A 21 17.495 2.967 -0.936 1.00 0.26 C ATOM 347 OD1 ASN A 21 17.722 4.167 -0.775 1.00 0.30 O ATOM 348 ND2 ASN A 21 18.119 2.022 -0.244 1.00 0.26 N ATOM 0 H ASN A 21 14.979 3.056 -0.066 1.00 0.20 H new ATOM 0 HA ASN A 21 15.698 4.444 -2.423 1.00 0.21 H new ATOM 0 HB2 ASN A 21 16.078 1.526 -1.644 1.00 0.21 H new ATOM 0 HB3 ASN A 21 16.946 2.363 -2.916 1.00 0.21 H new ATOM 0 HD21 ASN A 21 18.818 2.278 0.454 1.00 0.26 H new ATOM 0 HD22 ASN A 21 17.900 1.040 -0.410 1.00 0.26 H new ATOM 355 N LEU A 22 13.250 2.337 -2.678 1.00 0.18 N ATOM 356 CA LEU A 22 12.224 1.823 -3.576 1.00 0.17 C ATOM 357 C LEU A 22 11.341 2.963 -4.065 1.00 0.20 C ATOM 358 O LEU A 22 10.911 3.805 -3.278 1.00 0.26 O ATOM 359 CB LEU A 22 11.366 0.773 -2.867 1.00 0.17 C ATOM 360 CG LEU A 22 10.586 -0.159 -3.797 1.00 0.17 C ATOM 361 CD1 LEU A 22 11.524 -1.164 -4.448 1.00 0.29 C ATOM 362 CD2 LEU A 22 9.482 -0.876 -3.034 1.00 0.26 C ATOM 0 H LEU A 22 13.076 2.154 -1.690 1.00 0.18 H new ATOM 0 HA LEU A 22 12.715 1.356 -4.430 1.00 0.17 H new ATOM 0 HB2 LEU A 22 12.011 0.169 -2.229 1.00 0.17 H new ATOM 0 HB3 LEU A 22 10.659 1.284 -2.213 1.00 0.17 H new ATOM 0 HG LEU A 22 10.125 0.442 -4.580 1.00 0.17 H new ATOM 0 HD11 LEU A 22 10.954 -1.820 -5.106 1.00 0.29 H new ATOM 0 HD12 LEU A 22 12.279 -0.634 -5.028 1.00 0.29 H new ATOM 0 HD13 LEU A 22 12.012 -1.760 -3.676 1.00 0.29 H new ATOM 0 HD21 LEU A 22 8.939 -1.534 -3.712 1.00 0.26 H new ATOM 0 HD22 LEU A 22 9.920 -1.466 -2.229 1.00 0.26 H new ATOM 0 HD23 LEU A 22 8.795 -0.142 -2.613 1.00 0.26 H new ATOM 374 N ASN A 23 11.074 2.989 -5.365 1.00 0.22 N ATOM 375 CA ASN A 23 10.241 4.037 -5.942 1.00 0.27 C ATOM 376 C ASN A 23 8.772 3.633 -5.933 1.00 0.24 C ATOM 377 O ASN A 23 8.441 2.474 -5.683 1.00 0.29 O ATOM 378 CB ASN A 23 10.692 4.368 -7.367 1.00 0.33 C ATOM 379 CG ASN A 23 10.866 3.130 -8.222 1.00 0.75 C ATOM 380 OD1 ASN A 23 10.190 2.125 -8.018 1.00 1.59 O ATOM 381 ND2 ASN A 23 11.778 3.197 -9.185 1.00 1.33 N ATOM 0 H ASN A 23 11.419 2.302 -6.035 1.00 0.22 H new ATOM 0 HA ASN A 23 10.355 4.930 -5.327 1.00 0.27 H new ATOM 0 HB2 ASN A 23 9.959 5.027 -7.833 1.00 0.33 H new ATOM 0 HB3 ASN A 23 11.634 4.915 -7.329 1.00 0.33 H new ATOM 0 HD21 ASN A 23 11.940 2.393 -9.791 1.00 1.33 H new ATOM 0 HD22 ASN A 23 12.317 4.053 -9.318 1.00 1.33 H new ATOM 388 N GLU A 24 7.897 4.592 -6.203 1.00 0.29 N ATOM 389 CA GLU A 24 6.460 4.335 -6.218 1.00 0.29 C ATOM 390 C GLU A 24 6.094 3.307 -7.284 1.00 0.24 C ATOM 391 O GLU A 24 5.209 2.479 -7.077 1.00 0.22 O ATOM 392 CB GLU A 24 5.694 5.635 -6.460 1.00 0.36 C ATOM 393 CG GLU A 24 5.894 6.668 -5.364 1.00 1.23 C ATOM 394 CD GLU A 24 5.138 7.953 -5.632 1.00 1.42 C ATOM 395 OE1 GLU A 24 3.910 7.977 -5.411 1.00 2.17 O ATOM 396 OE2 GLU A 24 5.776 8.936 -6.062 1.00 1.25 O ATOM 0 H GLU A 24 8.155 5.556 -6.415 1.00 0.29 H new ATOM 0 HA GLU A 24 6.181 3.930 -5.245 1.00 0.29 H new ATOM 0 HB2 GLU A 24 6.009 6.061 -7.412 1.00 0.36 H new ATOM 0 HB3 GLU A 24 4.631 5.410 -6.547 1.00 0.36 H new ATOM 0 HG2 GLU A 24 5.567 6.250 -4.412 1.00 1.23 H new ATOM 0 HG3 GLU A 24 6.957 6.889 -5.267 1.00 1.23 H new ATOM 403 N GLU A 25 6.780 3.365 -8.422 1.00 0.27 N ATOM 404 CA GLU A 25 6.520 2.437 -9.519 1.00 0.28 C ATOM 405 C GLU A 25 6.613 0.988 -9.047 1.00 0.24 C ATOM 406 O GLU A 25 5.695 0.195 -9.261 1.00 0.30 O ATOM 407 CB GLU A 25 7.509 2.675 -10.662 1.00 0.36 C ATOM 408 CG GLU A 25 7.454 4.084 -11.230 1.00 0.91 C ATOM 409 CD GLU A 25 6.114 4.407 -11.859 1.00 1.60 C ATOM 410 OE1 GLU A 25 5.212 4.871 -11.130 1.00 2.20 O ATOM 411 OE2 GLU A 25 5.963 4.194 -13.080 1.00 2.00 O ATOM 0 H GLU A 25 7.519 4.043 -8.609 1.00 0.27 H new ATOM 0 HA GLU A 25 5.507 2.618 -9.878 1.00 0.28 H new ATOM 0 HB2 GLU A 25 8.519 2.475 -10.305 1.00 0.36 H new ATOM 0 HB3 GLU A 25 7.307 1.962 -11.461 1.00 0.36 H new ATOM 0 HG2 GLU A 25 7.660 4.801 -10.435 1.00 0.91 H new ATOM 0 HG3 GLU A 25 8.239 4.202 -11.977 1.00 0.91 H new ATOM 418 N GLN A 26 7.724 0.651 -8.403 1.00 0.18 N ATOM 419 CA GLN A 26 7.940 -0.700 -7.899 1.00 0.15 C ATOM 420 C GLN A 26 6.995 -1.002 -6.746 1.00 0.13 C ATOM 421 O GLN A 26 6.350 -2.049 -6.713 1.00 0.16 O ATOM 422 CB GLN A 26 9.392 -0.863 -7.451 1.00 0.15 C ATOM 423 CG GLN A 26 10.381 -0.717 -8.591 1.00 0.19 C ATOM 424 CD GLN A 26 11.801 -0.475 -8.117 1.00 1.03 C ATOM 425 OE1 GLN A 26 12.025 0.157 -7.086 1.00 2.00 O ATOM 426 NE2 GLN A 26 12.770 -0.983 -8.870 1.00 1.59 N ATOM 0 H GLN A 26 8.491 1.297 -8.217 1.00 0.18 H new ATOM 0 HA GLN A 26 7.734 -1.407 -8.702 1.00 0.15 H new ATOM 0 HB2 GLN A 26 9.616 -0.121 -6.685 1.00 0.15 H new ATOM 0 HB3 GLN A 26 9.517 -1.843 -6.991 1.00 0.15 H new ATOM 0 HG2 GLN A 26 10.357 -1.619 -9.203 1.00 0.19 H new ATOM 0 HG3 GLN A 26 10.071 0.110 -9.230 1.00 0.19 H new ATOM 0 HE21 GLN A 26 12.539 -1.501 -9.718 1.00 1.59 H new ATOM 0 HE22 GLN A 26 13.745 -0.855 -8.600 1.00 1.59 H new ATOM 435 N ARG A 27 6.923 -0.072 -5.801 1.00 0.13 N ATOM 436 CA ARG A 27 6.050 -0.221 -4.640 1.00 0.13 C ATOM 437 C ARG A 27 4.612 -0.504 -5.067 1.00 0.14 C ATOM 438 O ARG A 27 3.879 -1.210 -4.375 1.00 0.23 O ATOM 439 CB ARG A 27 6.094 1.041 -3.776 1.00 0.14 C ATOM 440 CG ARG A 27 5.196 0.969 -2.552 1.00 0.18 C ATOM 441 CD ARG A 27 5.231 2.264 -1.758 1.00 0.41 C ATOM 442 NE ARG A 27 6.581 2.594 -1.308 1.00 1.59 N ATOM 443 CZ ARG A 27 6.952 3.809 -0.913 1.00 1.94 C ATOM 444 NH1 ARG A 27 6.075 4.804 -0.909 1.00 1.37 N ATOM 445 NH2 ARG A 27 8.200 4.029 -0.523 1.00 3.04 N ATOM 0 H ARG A 27 7.459 0.795 -5.815 1.00 0.13 H new ATOM 0 HA ARG A 27 6.410 -1.068 -4.057 1.00 0.13 H new ATOM 0 HB2 ARG A 27 7.121 1.216 -3.454 1.00 0.14 H new ATOM 0 HB3 ARG A 27 5.800 1.898 -4.383 1.00 0.14 H new ATOM 0 HG2 ARG A 27 4.172 0.759 -2.862 1.00 0.18 H new ATOM 0 HG3 ARG A 27 5.512 0.142 -1.916 1.00 0.18 H new ATOM 0 HD2 ARG A 27 4.845 3.077 -2.373 1.00 0.41 H new ATOM 0 HD3 ARG A 27 4.572 2.177 -0.894 1.00 0.41 H new ATOM 0 HE ARG A 27 7.279 1.850 -1.296 1.00 1.59 H new ATOM 0 HH11 ARG A 27 5.114 4.638 -1.209 1.00 1.37 H new ATOM 0 HH12 ARG A 27 6.361 5.735 -0.606 1.00 1.37 H new ATOM 0 HH21 ARG A 27 8.877 3.266 -0.526 1.00 3.04 H new ATOM 0 HH22 ARG A 27 8.483 4.961 -0.220 1.00 3.04 H new ATOM 459 N ASN A 28 4.214 0.050 -6.209 1.00 0.13 N ATOM 460 CA ASN A 28 2.862 -0.146 -6.720 1.00 0.15 C ATOM 461 C ASN A 28 2.651 -1.589 -7.155 1.00 0.15 C ATOM 462 O ASN A 28 1.566 -2.146 -6.988 1.00 0.21 O ATOM 463 CB ASN A 28 2.585 0.800 -7.891 1.00 0.19 C ATOM 464 CG ASN A 28 2.161 2.182 -7.438 1.00 0.20 C ATOM 465 OD1 ASN A 28 1.369 2.849 -8.103 1.00 0.26 O ATOM 466 ND2 ASN A 28 2.690 2.622 -6.302 1.00 0.19 N ATOM 0 H ASN A 28 4.807 0.636 -6.796 1.00 0.13 H new ATOM 0 HA ASN A 28 2.163 0.079 -5.914 1.00 0.15 H new ATOM 0 HB2 ASN A 28 3.481 0.883 -8.506 1.00 0.19 H new ATOM 0 HB3 ASN A 28 1.805 0.373 -8.521 1.00 0.19 H new ATOM 0 HD21 ASN A 28 2.443 3.547 -5.949 1.00 0.19 H new ATOM 0 HD22 ASN A 28 3.343 2.035 -5.783 1.00 0.19 H new ATOM 473 N ALA A 29 3.696 -2.192 -7.714 1.00 0.12 N ATOM 474 CA ALA A 29 3.624 -3.574 -8.168 1.00 0.12 C ATOM 475 C ALA A 29 3.458 -4.525 -6.990 1.00 0.11 C ATOM 476 O ALA A 29 2.667 -5.467 -7.046 1.00 0.15 O ATOM 477 CB ALA A 29 4.867 -3.934 -8.969 1.00 0.15 C ATOM 0 H ALA A 29 4.601 -1.745 -7.863 1.00 0.12 H new ATOM 0 HA ALA A 29 2.751 -3.675 -8.812 1.00 0.12 H new ATOM 0 HB1 ALA A 29 4.798 -4.970 -9.301 1.00 0.15 H new ATOM 0 HB2 ALA A 29 4.943 -3.279 -9.837 1.00 0.15 H new ATOM 0 HB3 ALA A 29 5.751 -3.812 -8.343 1.00 0.15 H new ATOM 483 N PHE A 30 4.207 -4.271 -5.921 1.00 0.10 N ATOM 484 CA PHE A 30 4.139 -5.105 -4.728 1.00 0.10 C ATOM 485 C PHE A 30 2.784 -4.967 -4.045 1.00 0.12 C ATOM 486 O PHE A 30 2.158 -5.964 -3.687 1.00 0.18 O ATOM 487 CB PHE A 30 5.266 -4.746 -3.759 1.00 0.12 C ATOM 488 CG PHE A 30 6.629 -5.113 -4.274 1.00 0.12 C ATOM 489 CD1 PHE A 30 7.033 -6.437 -4.323 1.00 0.12 C ATOM 490 CD2 PHE A 30 7.509 -4.131 -4.700 1.00 0.18 C ATOM 491 CE1 PHE A 30 8.290 -6.776 -4.789 1.00 0.16 C ATOM 492 CE2 PHE A 30 8.766 -4.464 -5.169 1.00 0.21 C ATOM 493 CZ PHE A 30 9.144 -5.797 -5.241 1.00 0.20 C ATOM 0 H PHE A 30 4.867 -3.496 -5.857 1.00 0.10 H new ATOM 0 HA PHE A 30 4.261 -6.144 -5.033 1.00 0.10 H new ATOM 0 HB2 PHE A 30 5.237 -3.675 -3.559 1.00 0.12 H new ATOM 0 HB3 PHE A 30 5.095 -5.253 -2.809 1.00 0.12 H new ATOM 0 HD1 PHE A 30 6.359 -7.213 -3.993 1.00 0.12 H new ATOM 0 HD2 PHE A 30 7.209 -3.094 -4.665 1.00 0.18 H new ATOM 0 HE1 PHE A 30 8.601 -7.810 -4.798 1.00 0.16 H new ATOM 0 HE2 PHE A 30 9.452 -3.689 -5.478 1.00 0.21 H new ATOM 0 HZ PHE A 30 10.106 -6.065 -5.651 1.00 0.20 H new ATOM 503 N ILE A 31 2.333 -3.727 -3.868 1.00 0.10 N ATOM 504 CA ILE A 31 1.041 -3.469 -3.243 1.00 0.11 C ATOM 505 C ILE A 31 -0.073 -4.129 -4.049 1.00 0.11 C ATOM 506 O ILE A 31 -1.052 -4.625 -3.490 1.00 0.16 O ATOM 507 CB ILE A 31 0.770 -1.950 -3.118 1.00 0.11 C ATOM 508 CG1 ILE A 31 1.747 -1.322 -2.121 1.00 0.12 C ATOM 509 CG2 ILE A 31 -0.671 -1.686 -2.693 1.00 0.13 C ATOM 510 CD1 ILE A 31 1.584 0.175 -1.964 1.00 0.13 C ATOM 0 H ILE A 31 2.842 -2.889 -4.148 1.00 0.10 H new ATOM 0 HA ILE A 31 1.063 -3.894 -2.240 1.00 0.11 H new ATOM 0 HB ILE A 31 0.921 -1.492 -4.095 1.00 0.11 H new ATOM 0 HG12 ILE A 31 1.614 -1.796 -1.149 1.00 0.12 H new ATOM 0 HG13 ILE A 31 2.766 -1.535 -2.443 1.00 0.12 H new ATOM 0 HG21 ILE A 31 -0.836 -0.612 -2.612 1.00 0.13 H new ATOM 0 HG22 ILE A 31 -1.351 -2.103 -3.436 1.00 0.13 H new ATOM 0 HG23 ILE A 31 -0.857 -2.155 -1.727 1.00 0.13 H new ATOM 0 HD11 ILE A 31 2.311 0.546 -1.242 1.00 0.13 H new ATOM 0 HD12 ILE A 31 1.747 0.662 -2.926 1.00 0.13 H new ATOM 0 HD13 ILE A 31 0.577 0.396 -1.612 1.00 0.13 H new ATOM 522 N GLN A 32 0.091 -4.132 -5.368 1.00 0.08 N ATOM 523 CA GLN A 32 -0.879 -4.739 -6.266 1.00 0.09 C ATOM 524 C GLN A 32 -0.970 -6.245 -6.036 1.00 0.11 C ATOM 525 O GLN A 32 -2.061 -6.796 -5.885 1.00 0.19 O ATOM 526 CB GLN A 32 -0.486 -4.458 -7.717 1.00 0.11 C ATOM 527 CG GLN A 32 -1.673 -4.362 -8.651 1.00 0.15 C ATOM 528 CD GLN A 32 -1.284 -3.990 -10.063 1.00 0.29 C ATOM 529 OE1 GLN A 32 -0.954 -4.851 -10.879 1.00 0.82 O ATOM 530 NE2 GLN A 32 -1.333 -2.701 -10.364 1.00 1.04 N ATOM 0 H GLN A 32 0.894 -3.717 -5.840 1.00 0.08 H new ATOM 0 HA GLN A 32 -1.857 -4.303 -6.062 1.00 0.09 H new ATOM 0 HB2 GLN A 32 0.077 -3.526 -7.760 1.00 0.11 H new ATOM 0 HB3 GLN A 32 0.179 -5.248 -8.066 1.00 0.11 H new ATOM 0 HG2 GLN A 32 -2.196 -5.318 -8.664 1.00 0.15 H new ATOM 0 HG3 GLN A 32 -2.373 -3.621 -8.265 1.00 0.15 H new ATOM 0 HE21 GLN A 32 -1.612 -2.022 -9.656 1.00 1.04 H new ATOM 0 HE22 GLN A 32 -1.092 -2.387 -11.304 1.00 1.04 H new ATOM 539 N SER A 33 0.185 -6.903 -6.011 1.00 0.09 N ATOM 540 CA SER A 33 0.240 -8.347 -5.806 1.00 0.11 C ATOM 541 C SER A 33 -0.072 -8.711 -4.357 1.00 0.10 C ATOM 542 O SER A 33 -0.415 -9.855 -4.055 1.00 0.15 O ATOM 543 CB SER A 33 1.618 -8.882 -6.197 1.00 0.13 C ATOM 544 OG SER A 33 1.909 -8.601 -7.554 1.00 1.19 O ATOM 0 H SER A 33 1.096 -6.459 -6.130 1.00 0.09 H new ATOM 0 HA SER A 33 -0.517 -8.807 -6.441 1.00 0.11 H new ATOM 0 HB2 SER A 33 2.380 -8.434 -5.559 1.00 0.13 H new ATOM 0 HB3 SER A 33 1.654 -9.958 -6.030 1.00 0.13 H new ATOM 0 HG SER A 33 2.204 -7.670 -7.639 1.00 1.19 H new ATOM 550 N LEU A 34 0.049 -7.733 -3.464 1.00 0.10 N ATOM 551 CA LEU A 34 -0.224 -7.952 -2.048 1.00 0.11 C ATOM 552 C LEU A 34 -1.728 -8.034 -1.807 1.00 0.13 C ATOM 553 O LEU A 34 -2.194 -8.773 -0.940 1.00 0.18 O ATOM 554 CB LEU A 34 0.375 -6.814 -1.214 1.00 0.10 C ATOM 555 CG LEU A 34 0.927 -7.215 0.158 1.00 0.13 C ATOM 556 CD1 LEU A 34 1.543 -6.010 0.850 1.00 0.16 C ATOM 557 CD2 LEU A 34 -0.165 -7.821 1.028 1.00 0.17 C ATOM 0 H LEU A 34 0.334 -6.782 -3.696 1.00 0.10 H new ATOM 0 HA LEU A 34 0.234 -8.894 -1.746 1.00 0.11 H new ATOM 0 HB2 LEU A 34 1.179 -6.352 -1.788 1.00 0.10 H new ATOM 0 HB3 LEU A 34 -0.391 -6.053 -1.068 1.00 0.10 H new ATOM 0 HG LEU A 34 1.700 -7.969 0.007 1.00 0.13 H new ATOM 0 HD11 LEU A 34 1.931 -6.309 1.824 1.00 0.16 H new ATOM 0 HD12 LEU A 34 2.356 -5.617 0.240 1.00 0.16 H new ATOM 0 HD13 LEU A 34 0.784 -5.239 0.983 1.00 0.16 H new ATOM 0 HD21 LEU A 34 0.253 -8.097 1.996 1.00 0.17 H new ATOM 0 HD22 LEU A 34 -0.963 -7.092 1.171 1.00 0.17 H new ATOM 0 HD23 LEU A 34 -0.568 -8.709 0.540 1.00 0.17 H new ATOM 569 N LYS A 35 -2.479 -7.270 -2.590 1.00 0.15 N ATOM 570 CA LYS A 35 -3.930 -7.237 -2.472 1.00 0.19 C ATOM 571 C LYS A 35 -4.569 -8.381 -3.256 1.00 0.22 C ATOM 572 O LYS A 35 -5.611 -8.908 -2.866 1.00 0.31 O ATOM 573 CB LYS A 35 -4.458 -5.896 -2.981 1.00 0.23 C ATOM 574 CG LYS A 35 -5.942 -5.685 -2.740 1.00 0.23 C ATOM 575 CD LYS A 35 -6.239 -5.489 -1.264 1.00 0.24 C ATOM 576 CE LYS A 35 -7.704 -5.160 -1.034 1.00 0.22 C ATOM 577 NZ LYS A 35 -8.594 -6.288 -1.424 1.00 0.46 N ATOM 0 H LYS A 35 -2.104 -6.662 -3.318 1.00 0.15 H new ATOM 0 HA LYS A 35 -4.193 -7.357 -1.421 1.00 0.19 H new ATOM 0 HB2 LYS A 35 -3.904 -5.092 -2.497 1.00 0.23 H new ATOM 0 HB3 LYS A 35 -4.260 -5.821 -4.050 1.00 0.23 H new ATOM 0 HG2 LYS A 35 -6.283 -4.815 -3.300 1.00 0.23 H new ATOM 0 HG3 LYS A 35 -6.499 -6.544 -3.114 1.00 0.23 H new ATOM 0 HD2 LYS A 35 -5.977 -6.393 -0.715 1.00 0.24 H new ATOM 0 HD3 LYS A 35 -5.617 -4.685 -0.870 1.00 0.24 H new ATOM 0 HE2 LYS A 35 -7.861 -4.920 0.018 1.00 0.22 H new ATOM 0 HE3 LYS A 35 -7.971 -4.272 -1.607 1.00 0.22 H new ATOM 0 HZ1 LYS A 35 -9.301 -5.952 -2.109 1.00 0.46 H new ATOM 0 HZ2 LYS A 35 -8.026 -7.045 -1.856 1.00 0.46 H new ATOM 0 HZ3 LYS A 35 -9.077 -6.657 -0.580 1.00 0.46 H new ATOM 591 N ASP A 36 -3.936 -8.759 -4.362 1.00 0.23 N ATOM 592 CA ASP A 36 -4.441 -9.839 -5.205 1.00 0.28 C ATOM 593 C ASP A 36 -3.987 -11.196 -4.681 1.00 0.25 C ATOM 594 O ASP A 36 -4.655 -12.210 -4.885 1.00 0.33 O ATOM 595 CB ASP A 36 -3.956 -9.650 -6.643 1.00 0.34 C ATOM 596 CG ASP A 36 -4.619 -10.611 -7.610 1.00 1.07 C ATOM 597 OD1 ASP A 36 -4.160 -11.769 -7.704 1.00 2.07 O ATOM 598 OD2 ASP A 36 -5.596 -10.205 -8.274 1.00 0.96 O ATOM 0 H ASP A 36 -3.071 -8.333 -4.696 1.00 0.23 H new ATOM 0 HA ASP A 36 -5.530 -9.808 -5.183 1.00 0.28 H new ATOM 0 HB2 ASP A 36 -4.156 -8.626 -6.959 1.00 0.34 H new ATOM 0 HB3 ASP A 36 -2.876 -9.790 -6.680 1.00 0.34 H new ATOM 603 N ASP A 37 -2.844 -11.205 -4.003 1.00 0.20 N ATOM 604 CA ASP A 37 -2.287 -12.433 -3.447 1.00 0.22 C ATOM 605 C ASP A 37 -1.649 -12.171 -2.083 1.00 0.18 C ATOM 606 O ASP A 37 -0.427 -12.080 -1.968 1.00 0.16 O ATOM 607 CB ASP A 37 -1.248 -13.027 -4.401 1.00 0.27 C ATOM 608 CG ASP A 37 -1.828 -13.342 -5.767 1.00 0.76 C ATOM 609 OD1 ASP A 37 -2.420 -14.431 -5.924 1.00 0.91 O ATOM 610 OD2 ASP A 37 -1.688 -12.500 -6.678 1.00 1.29 O ATOM 0 H ASP A 37 -2.283 -10.372 -3.825 1.00 0.20 H new ATOM 0 HA ASP A 37 -3.102 -13.146 -3.319 1.00 0.22 H new ATOM 0 HB2 ASP A 37 -0.420 -12.327 -4.514 1.00 0.27 H new ATOM 0 HB3 ASP A 37 -0.838 -13.938 -3.965 1.00 0.27 H new ATOM 615 N PRO A 38 -2.474 -12.040 -1.027 1.00 0.21 N ATOM 616 CA PRO A 38 -1.987 -11.789 0.335 1.00 0.21 C ATOM 617 C PRO A 38 -1.130 -12.934 0.865 1.00 0.21 C ATOM 618 O PRO A 38 -0.463 -12.801 1.890 1.00 0.23 O ATOM 619 CB PRO A 38 -3.270 -11.656 1.159 1.00 0.27 C ATOM 620 CG PRO A 38 -4.314 -12.355 0.360 1.00 0.30 C ATOM 621 CD PRO A 38 -3.944 -12.124 -1.076 1.00 0.26 C ATOM 0 HA PRO A 38 -1.346 -10.909 0.379 1.00 0.21 H new ATOM 0 HB2 PRO A 38 -3.156 -12.110 2.143 1.00 0.27 H new ATOM 0 HB3 PRO A 38 -3.530 -10.610 1.319 1.00 0.27 H new ATOM 0 HG2 PRO A 38 -4.338 -13.420 0.592 1.00 0.30 H new ATOM 0 HG3 PRO A 38 -5.306 -11.959 0.578 1.00 0.30 H new ATOM 0 HD2 PRO A 38 -4.281 -12.939 -1.716 1.00 0.26 H new ATOM 0 HD3 PRO A 38 -4.388 -11.208 -1.466 1.00 0.26 H new ATOM 629 N SER A 39 -1.161 -14.063 0.167 1.00 0.21 N ATOM 630 CA SER A 39 -0.377 -15.227 0.564 1.00 0.23 C ATOM 631 C SER A 39 1.100 -15.003 0.261 1.00 0.21 C ATOM 632 O SER A 39 1.975 -15.580 0.908 1.00 0.24 O ATOM 633 CB SER A 39 -0.878 -16.478 -0.157 1.00 0.26 C ATOM 634 OG SER A 39 -2.236 -16.737 0.155 1.00 1.37 O ATOM 0 H SER A 39 -1.720 -14.198 -0.676 1.00 0.21 H new ATOM 0 HA SER A 39 -0.495 -15.371 1.638 1.00 0.23 H new ATOM 0 HB2 SER A 39 -0.767 -16.350 -1.234 1.00 0.26 H new ATOM 0 HB3 SER A 39 -0.267 -17.335 0.127 1.00 0.26 H new ATOM 0 HG SER A 39 -2.533 -17.541 -0.320 1.00 1.37 H new ATOM 640 N GLN A 40 1.365 -14.159 -0.732 1.00 0.19 N ATOM 641 CA GLN A 40 2.732 -13.841 -1.131 1.00 0.18 C ATOM 642 C GLN A 40 3.252 -12.638 -0.356 1.00 0.16 C ATOM 643 O GLN A 40 4.369 -12.186 -0.582 1.00 0.16 O ATOM 644 CB GLN A 40 2.803 -13.560 -2.632 1.00 0.21 C ATOM 645 CG GLN A 40 2.293 -14.703 -3.493 1.00 0.27 C ATOM 646 CD GLN A 40 3.118 -15.965 -3.338 1.00 0.34 C ATOM 647 OE1 GLN A 40 4.091 -16.177 -4.063 1.00 0.62 O ATOM 648 NE2 GLN A 40 2.731 -16.812 -2.391 1.00 0.69 N ATOM 0 H GLN A 40 0.647 -13.681 -1.277 1.00 0.19 H new ATOM 0 HA GLN A 40 3.358 -14.704 -0.903 1.00 0.18 H new ATOM 0 HB2 GLN A 40 2.223 -12.664 -2.853 1.00 0.21 H new ATOM 0 HB3 GLN A 40 3.837 -13.345 -2.904 1.00 0.21 H new ATOM 0 HG2 GLN A 40 1.257 -14.916 -3.230 1.00 0.27 H new ATOM 0 HG3 GLN A 40 2.299 -14.396 -4.539 1.00 0.27 H new ATOM 0 HE21 GLN A 40 1.919 -16.595 -1.814 1.00 0.69 H new ATOM 0 HE22 GLN A 40 3.246 -17.679 -2.241 1.00 0.69 H new ATOM 657 N SER A 41 2.427 -12.118 0.550 1.00 0.17 N ATOM 658 CA SER A 41 2.791 -10.953 1.354 1.00 0.20 C ATOM 659 C SER A 41 4.231 -11.036 1.850 1.00 0.20 C ATOM 660 O SER A 41 4.942 -10.035 1.868 1.00 0.25 O ATOM 661 CB SER A 41 1.851 -10.814 2.548 1.00 0.23 C ATOM 662 OG SER A 41 0.539 -10.481 2.131 1.00 1.10 O ATOM 0 H SER A 41 1.497 -12.487 0.747 1.00 0.17 H new ATOM 0 HA SER A 41 2.700 -10.077 0.712 1.00 0.20 H new ATOM 0 HB2 SER A 41 1.831 -11.748 3.109 1.00 0.23 H new ATOM 0 HB3 SER A 41 2.227 -10.045 3.223 1.00 0.23 H new ATOM 0 HG SER A 41 -0.053 -11.250 2.268 1.00 1.10 H new ATOM 668 N ALA A 42 4.655 -12.231 2.246 1.00 0.18 N ATOM 669 CA ALA A 42 6.010 -12.430 2.746 1.00 0.20 C ATOM 670 C ALA A 42 7.015 -12.448 1.603 1.00 0.17 C ATOM 671 O ALA A 42 8.141 -11.968 1.742 1.00 0.18 O ATOM 672 CB ALA A 42 6.088 -13.720 3.546 1.00 0.24 C ATOM 0 H ALA A 42 4.082 -13.074 2.231 1.00 0.18 H new ATOM 0 HA ALA A 42 6.261 -11.595 3.400 1.00 0.20 H new ATOM 0 HB1 ALA A 42 7.104 -13.859 3.915 1.00 0.24 H new ATOM 0 HB2 ALA A 42 5.400 -13.667 4.390 1.00 0.24 H new ATOM 0 HB3 ALA A 42 5.816 -14.561 2.908 1.00 0.24 H new ATOM 678 N ASN A 43 6.598 -13.007 0.475 1.00 0.16 N ATOM 679 CA ASN A 43 7.449 -13.085 -0.705 1.00 0.16 C ATOM 680 C ASN A 43 7.670 -11.698 -1.295 1.00 0.13 C ATOM 681 O ASN A 43 8.805 -11.247 -1.445 1.00 0.14 O ATOM 682 CB ASN A 43 6.808 -14.004 -1.746 1.00 0.18 C ATOM 683 CG ASN A 43 6.796 -15.453 -1.300 1.00 0.21 C ATOM 684 OD1 ASN A 43 7.702 -15.906 -0.601 1.00 0.59 O ATOM 685 ND2 ASN A 43 5.765 -16.185 -1.700 1.00 0.71 N ATOM 0 H ASN A 43 5.671 -13.415 0.352 1.00 0.16 H new ATOM 0 HA ASN A 43 8.416 -13.494 -0.414 1.00 0.16 H new ATOM 0 HB2 ASN A 43 5.786 -13.676 -1.938 1.00 0.18 H new ATOM 0 HB3 ASN A 43 7.352 -13.920 -2.687 1.00 0.18 H new ATOM 0 HD21 ASN A 43 5.700 -17.166 -1.429 1.00 0.71 H new ATOM 0 HD22 ASN A 43 5.037 -15.767 -2.279 1.00 0.71 H new ATOM 692 N LEU A 44 6.571 -11.034 -1.630 1.00 0.13 N ATOM 693 CA LEU A 44 6.612 -9.692 -2.194 1.00 0.12 C ATOM 694 C LEU A 44 7.409 -8.749 -1.299 1.00 0.11 C ATOM 695 O LEU A 44 8.181 -7.923 -1.785 1.00 0.12 O ATOM 696 CB LEU A 44 5.187 -9.174 -2.377 1.00 0.12 C ATOM 697 CG LEU A 44 4.292 -10.067 -3.238 1.00 0.16 C ATOM 698 CD1 LEU A 44 2.832 -9.686 -3.068 1.00 0.16 C ATOM 699 CD2 LEU A 44 4.701 -9.980 -4.702 1.00 0.23 C ATOM 0 H LEU A 44 5.629 -11.410 -1.519 1.00 0.13 H new ATOM 0 HA LEU A 44 7.109 -9.733 -3.163 1.00 0.12 H new ATOM 0 HB2 LEU A 44 4.727 -9.059 -1.395 1.00 0.12 H new ATOM 0 HB3 LEU A 44 5.230 -8.182 -2.827 1.00 0.12 H new ATOM 0 HG LEU A 44 4.417 -11.098 -2.907 1.00 0.16 H new ATOM 0 HD11 LEU A 44 2.212 -10.333 -3.689 1.00 0.16 H new ATOM 0 HD12 LEU A 44 2.545 -9.802 -2.023 1.00 0.16 H new ATOM 0 HD13 LEU A 44 2.689 -8.648 -3.370 1.00 0.16 H new ATOM 0 HD21 LEU A 44 4.053 -10.622 -5.299 1.00 0.23 H new ATOM 0 HD22 LEU A 44 4.608 -8.950 -5.045 1.00 0.23 H new ATOM 0 HD23 LEU A 44 5.735 -10.306 -4.811 1.00 0.23 H new ATOM 711 N LEU A 45 7.212 -8.875 0.012 1.00 0.12 N ATOM 712 CA LEU A 45 7.926 -8.041 0.973 1.00 0.13 C ATOM 713 C LEU A 45 9.427 -8.251 0.828 1.00 0.13 C ATOM 714 O LEU A 45 10.193 -7.296 0.721 1.00 0.15 O ATOM 715 CB LEU A 45 7.495 -8.386 2.402 1.00 0.15 C ATOM 716 CG LEU A 45 7.382 -7.211 3.382 1.00 0.14 C ATOM 717 CD1 LEU A 45 7.443 -7.715 4.815 1.00 0.18 C ATOM 718 CD2 LEU A 45 8.469 -6.173 3.142 1.00 0.14 C ATOM 0 H LEU A 45 6.566 -9.544 0.431 1.00 0.12 H new ATOM 0 HA LEU A 45 7.686 -6.997 0.773 1.00 0.13 H new ATOM 0 HB2 LEU A 45 6.528 -8.887 2.356 1.00 0.15 H new ATOM 0 HB3 LEU A 45 8.207 -9.104 2.810 1.00 0.15 H new ATOM 0 HG LEU A 45 6.420 -6.728 3.212 1.00 0.14 H new ATOM 0 HD11 LEU A 45 7.362 -6.872 5.501 1.00 0.18 H new ATOM 0 HD12 LEU A 45 6.620 -8.408 4.992 1.00 0.18 H new ATOM 0 HD13 LEU A 45 8.391 -8.227 4.980 1.00 0.18 H new ATOM 0 HD21 LEU A 45 8.356 -5.356 3.855 1.00 0.14 H new ATOM 0 HD22 LEU A 45 9.448 -6.635 3.271 1.00 0.14 H new ATOM 0 HD23 LEU A 45 8.383 -5.783 2.128 1.00 0.14 H new ATOM 730 N ALA A 46 9.835 -9.517 0.824 1.00 0.14 N ATOM 731 CA ALA A 46 11.240 -9.875 0.689 1.00 0.15 C ATOM 732 C ALA A 46 11.796 -9.397 -0.646 1.00 0.15 C ATOM 733 O ALA A 46 12.952 -8.985 -0.740 1.00 0.20 O ATOM 734 CB ALA A 46 11.405 -11.381 0.819 1.00 0.16 C ATOM 0 H ALA A 46 9.206 -10.315 0.913 1.00 0.14 H new ATOM 0 HA ALA A 46 11.800 -9.384 1.485 1.00 0.15 H new ATOM 0 HB1 ALA A 46 12.458 -11.642 0.717 1.00 0.16 H new ATOM 0 HB2 ALA A 46 11.044 -11.704 1.796 1.00 0.16 H new ATOM 0 HB3 ALA A 46 10.831 -11.879 0.038 1.00 0.16 H new ATOM 740 N GLU A 47 10.960 -9.455 -1.676 1.00 0.13 N ATOM 741 CA GLU A 47 11.355 -9.030 -3.012 1.00 0.15 C ATOM 742 C GLU A 47 11.475 -7.514 -3.080 1.00 0.13 C ATOM 743 O GLU A 47 12.255 -6.976 -3.866 1.00 0.17 O ATOM 744 CB GLU A 47 10.340 -9.521 -4.043 1.00 0.18 C ATOM 745 CG GLU A 47 10.353 -11.027 -4.240 1.00 0.28 C ATOM 746 CD GLU A 47 9.278 -11.501 -5.199 1.00 1.24 C ATOM 747 OE1 GLU A 47 9.553 -11.560 -6.416 1.00 1.09 O ATOM 748 OE2 GLU A 47 8.162 -11.813 -4.734 1.00 2.19 O ATOM 0 H GLU A 47 10.000 -9.794 -1.610 1.00 0.13 H new ATOM 0 HA GLU A 47 12.329 -9.465 -3.237 1.00 0.15 H new ATOM 0 HB2 GLU A 47 9.342 -9.212 -3.733 1.00 0.18 H new ATOM 0 HB3 GLU A 47 10.542 -9.036 -4.998 1.00 0.18 H new ATOM 0 HG2 GLU A 47 11.330 -11.332 -4.616 1.00 0.28 H new ATOM 0 HG3 GLU A 47 10.216 -11.517 -3.276 1.00 0.28 H new ATOM 755 N ALA A 48 10.695 -6.829 -2.252 1.00 0.10 N ATOM 756 CA ALA A 48 10.721 -5.373 -2.214 1.00 0.10 C ATOM 757 C ALA A 48 11.921 -4.886 -1.417 1.00 0.11 C ATOM 758 O ALA A 48 12.549 -3.889 -1.769 1.00 0.12 O ATOM 759 CB ALA A 48 9.428 -4.830 -1.626 1.00 0.11 C ATOM 0 H ALA A 48 10.038 -7.258 -1.600 1.00 0.10 H new ATOM 0 HA ALA A 48 10.812 -5.001 -3.235 1.00 0.10 H new ATOM 0 HB1 ALA A 48 9.467 -3.741 -1.606 1.00 0.11 H new ATOM 0 HB2 ALA A 48 8.586 -5.152 -2.239 1.00 0.11 H new ATOM 0 HB3 ALA A 48 9.303 -5.207 -0.611 1.00 0.11 H new ATOM 765 N LYS A 49 12.228 -5.594 -0.335 1.00 0.12 N ATOM 766 CA LYS A 49 13.369 -5.257 0.500 1.00 0.14 C ATOM 767 C LYS A 49 14.655 -5.515 -0.270 1.00 0.14 C ATOM 768 O LYS A 49 15.622 -4.760 -0.169 1.00 0.17 O ATOM 769 CB LYS A 49 13.344 -6.090 1.782 1.00 0.14 C ATOM 770 CG LYS A 49 12.147 -5.796 2.668 1.00 0.14 C ATOM 771 CD LYS A 49 12.171 -6.634 3.936 1.00 0.16 C ATOM 772 CE LYS A 49 11.693 -8.053 3.677 1.00 0.16 C ATOM 773 NZ LYS A 49 11.721 -8.884 4.912 1.00 0.21 N ATOM 0 H LYS A 49 11.699 -6.406 -0.018 1.00 0.12 H new ATOM 0 HA LYS A 49 13.320 -4.202 0.770 1.00 0.14 H new ATOM 0 HB2 LYS A 49 13.341 -7.148 1.519 1.00 0.14 H new ATOM 0 HB3 LYS A 49 14.258 -5.904 2.345 1.00 0.14 H new ATOM 0 HG2 LYS A 49 12.139 -4.738 2.930 1.00 0.14 H new ATOM 0 HG3 LYS A 49 11.228 -5.995 2.117 1.00 0.14 H new ATOM 0 HD2 LYS A 49 13.184 -6.658 4.338 1.00 0.16 H new ATOM 0 HD3 LYS A 49 11.539 -6.169 4.692 1.00 0.16 H new ATOM 0 HE2 LYS A 49 10.678 -8.027 3.280 1.00 0.16 H new ATOM 0 HE3 LYS A 49 12.322 -8.514 2.915 1.00 0.16 H new ATOM 0 HZ1 LYS A 49 11.388 -9.844 4.692 1.00 0.21 H new ATOM 0 HZ2 LYS A 49 12.694 -8.930 5.277 1.00 0.21 H new ATOM 0 HZ3 LYS A 49 11.101 -8.459 5.631 1.00 0.21 H new ATOM 787 N LYS A 50 14.646 -6.595 -1.043 1.00 0.13 N ATOM 788 CA LYS A 50 15.789 -6.969 -1.861 1.00 0.16 C ATOM 789 C LYS A 50 15.983 -5.956 -2.980 1.00 0.16 C ATOM 790 O LYS A 50 17.106 -5.674 -3.396 1.00 0.22 O ATOM 791 CB LYS A 50 15.575 -8.364 -2.449 1.00 0.17 C ATOM 792 CG LYS A 50 16.675 -8.803 -3.403 1.00 0.52 C ATOM 793 CD LYS A 50 16.417 -10.197 -3.954 1.00 0.51 C ATOM 794 CE LYS A 50 16.561 -11.261 -2.878 1.00 1.36 C ATOM 795 NZ LYS A 50 16.325 -12.630 -3.414 1.00 2.10 N ATOM 0 H LYS A 50 13.852 -7.230 -1.119 1.00 0.13 H new ATOM 0 HA LYS A 50 16.683 -6.981 -1.237 1.00 0.16 H new ATOM 0 HB2 LYS A 50 15.504 -9.085 -1.634 1.00 0.17 H new ATOM 0 HB3 LYS A 50 14.621 -8.384 -2.976 1.00 0.17 H new ATOM 0 HG2 LYS A 50 16.747 -8.093 -4.227 1.00 0.52 H new ATOM 0 HG3 LYS A 50 17.634 -8.788 -2.885 1.00 0.52 H new ATOM 0 HD2 LYS A 50 15.414 -10.241 -4.378 1.00 0.51 H new ATOM 0 HD3 LYS A 50 17.115 -10.403 -4.765 1.00 0.51 H new ATOM 0 HE2 LYS A 50 17.561 -11.208 -2.447 1.00 1.36 H new ATOM 0 HE3 LYS A 50 15.855 -11.060 -2.072 1.00 1.36 H new ATOM 0 HZ1 LYS A 50 16.433 -13.326 -2.649 1.00 2.10 H new ATOM 0 HZ2 LYS A 50 15.362 -12.689 -3.803 1.00 2.10 H new ATOM 0 HZ3 LYS A 50 17.015 -12.832 -4.165 1.00 2.10 H new ATOM 809 N LEU A 51 14.869 -5.411 -3.457 1.00 0.14 N ATOM 810 CA LEU A 51 14.887 -4.425 -4.527 1.00 0.15 C ATOM 811 C LEU A 51 15.322 -3.068 -3.993 1.00 0.15 C ATOM 812 O LEU A 51 16.046 -2.326 -4.658 1.00 0.18 O ATOM 813 CB LEU A 51 13.501 -4.321 -5.161 1.00 0.15 C ATOM 814 CG LEU A 51 13.407 -3.430 -6.402 1.00 0.18 C ATOM 815 CD1 LEU A 51 14.473 -3.806 -7.422 1.00 0.23 C ATOM 816 CD2 LEU A 51 12.018 -3.539 -7.013 1.00 0.18 C ATOM 0 H LEU A 51 13.936 -5.639 -3.115 1.00 0.14 H new ATOM 0 HA LEU A 51 15.603 -4.744 -5.285 1.00 0.15 H new ATOM 0 HB2 LEU A 51 13.168 -5.323 -5.429 1.00 0.15 H new ATOM 0 HB3 LEU A 51 12.805 -3.944 -4.411 1.00 0.15 H new ATOM 0 HG LEU A 51 13.581 -2.396 -6.103 1.00 0.18 H new ATOM 0 HD11 LEU A 51 14.386 -3.159 -8.295 1.00 0.23 H new ATOM 0 HD12 LEU A 51 15.461 -3.685 -6.978 1.00 0.23 H new ATOM 0 HD13 LEU A 51 14.337 -4.844 -7.725 1.00 0.23 H new ATOM 0 HD21 LEU A 51 11.958 -2.902 -7.896 1.00 0.18 H new ATOM 0 HD22 LEU A 51 11.826 -4.573 -7.298 1.00 0.18 H new ATOM 0 HD23 LEU A 51 11.274 -3.219 -6.284 1.00 0.18 H new ATOM 828 N ASN A 52 14.869 -2.751 -2.787 1.00 0.15 N ATOM 829 CA ASN A 52 15.215 -1.491 -2.145 1.00 0.18 C ATOM 830 C ASN A 52 16.701 -1.470 -1.830 1.00 0.17 C ATOM 831 O ASN A 52 17.335 -0.415 -1.821 1.00 0.17 O ATOM 832 CB ASN A 52 14.402 -1.308 -0.860 1.00 0.26 C ATOM 833 CG ASN A 52 14.707 0.002 -0.158 1.00 0.36 C ATOM 834 OD1 ASN A 52 14.084 1.026 -0.435 1.00 0.79 O ATOM 835 ND2 ASN A 52 15.666 -0.024 0.761 1.00 0.21 N ATOM 0 H ASN A 52 14.259 -3.352 -2.233 1.00 0.15 H new ATOM 0 HA ASN A 52 14.980 -0.671 -2.823 1.00 0.18 H new ATOM 0 HB2 ASN A 52 13.339 -1.349 -1.098 1.00 0.26 H new ATOM 0 HB3 ASN A 52 14.609 -2.136 -0.182 1.00 0.26 H new ATOM 0 HD21 ASN A 52 15.910 0.827 1.268 1.00 0.21 H new ATOM 0 HD22 ASN A 52 16.158 -0.895 0.960 1.00 0.21 H new ATOM 842 N ASP A 53 17.250 -2.653 -1.575 1.00 0.18 N ATOM 843 CA ASP A 53 18.663 -2.791 -1.269 1.00 0.20 C ATOM 844 C ASP A 53 19.480 -2.803 -2.554 1.00 0.22 C ATOM 845 O ASP A 53 20.677 -2.512 -2.549 1.00 0.25 O ATOM 846 CB ASP A 53 18.916 -4.074 -0.474 1.00 0.23 C ATOM 847 CG ASP A 53 20.375 -4.239 -0.095 1.00 0.28 C ATOM 848 OD1 ASP A 53 21.134 -4.818 -0.900 1.00 0.34 O ATOM 849 OD2 ASP A 53 20.758 -3.790 1.005 1.00 0.34 O ATOM 0 H ASP A 53 16.732 -3.532 -1.575 1.00 0.18 H new ATOM 0 HA ASP A 53 18.970 -1.939 -0.662 1.00 0.20 H new ATOM 0 HB2 ASP A 53 18.307 -4.064 0.430 1.00 0.23 H new ATOM 0 HB3 ASP A 53 18.597 -4.933 -1.064 1.00 0.23 H new ATOM 854 N ALA A 54 18.819 -3.143 -3.656 1.00 0.22 N ATOM 855 CA ALA A 54 19.469 -3.190 -4.959 1.00 0.26 C ATOM 856 C ALA A 54 19.743 -1.785 -5.472 1.00 0.28 C ATOM 857 O ALA A 54 20.764 -1.530 -6.112 1.00 0.32 O ATOM 858 CB ALA A 54 18.608 -3.953 -5.954 1.00 0.27 C ATOM 0 H ALA A 54 17.830 -3.391 -3.671 1.00 0.22 H new ATOM 0 HA ALA A 54 20.421 -3.710 -4.848 1.00 0.26 H new ATOM 0 HB1 ALA A 54 19.108 -3.979 -6.922 1.00 0.27 H new ATOM 0 HB2 ALA A 54 18.455 -4.971 -5.597 1.00 0.27 H new ATOM 0 HB3 ALA A 54 17.643 -3.456 -6.057 1.00 0.27 H new ATOM 864 N GLN A 55 18.820 -0.876 -5.181 1.00 0.27 N ATOM 865 CA GLN A 55 18.949 0.510 -5.605 1.00 0.31 C ATOM 866 C GLN A 55 19.584 1.349 -4.502 1.00 0.33 C ATOM 867 O GLN A 55 19.766 2.558 -4.652 1.00 0.41 O ATOM 868 CB GLN A 55 17.575 1.074 -5.974 1.00 0.32 C ATOM 869 CG GLN A 55 16.809 0.206 -6.961 1.00 0.32 C ATOM 870 CD GLN A 55 15.484 0.817 -7.377 1.00 0.36 C ATOM 871 OE1 GLN A 55 15.038 0.644 -8.512 1.00 0.61 O ATOM 872 NE2 GLN A 55 14.840 1.528 -6.458 1.00 0.29 N ATOM 0 H GLN A 55 17.972 -1.076 -4.651 1.00 0.27 H new ATOM 0 HA GLN A 55 19.595 0.548 -6.482 1.00 0.31 H new ATOM 0 HB2 GLN A 55 16.982 1.189 -5.066 1.00 0.32 H new ATOM 0 HB3 GLN A 55 17.702 2.069 -6.400 1.00 0.32 H new ATOM 0 HG2 GLN A 55 17.423 0.043 -7.847 1.00 0.32 H new ATOM 0 HG3 GLN A 55 16.629 -0.772 -6.514 1.00 0.32 H new ATOM 0 HE21 GLN A 55 15.245 1.647 -5.529 1.00 0.29 H new ATOM 0 HE22 GLN A 55 13.941 1.955 -6.681 1.00 0.29 H new ATOM 881 N ALA A 56 19.921 0.696 -3.393 1.00 0.28 N ATOM 882 CA ALA A 56 20.539 1.372 -2.260 1.00 0.31 C ATOM 883 C ALA A 56 21.910 1.932 -2.637 1.00 0.39 C ATOM 884 O ALA A 56 22.668 1.290 -3.362 1.00 0.44 O ATOM 885 CB ALA A 56 20.667 0.416 -1.084 1.00 0.29 C ATOM 0 H ALA A 56 19.775 -0.304 -3.256 1.00 0.28 H new ATOM 0 HA ALA A 56 19.899 2.206 -1.972 1.00 0.31 H new ATOM 0 HB1 ALA A 56 21.130 0.933 -0.244 1.00 0.29 H new ATOM 0 HB2 ALA A 56 19.678 0.063 -0.792 1.00 0.29 H new ATOM 0 HB3 ALA A 56 21.285 -0.434 -1.372 1.00 0.29 H new ATOM 1066 N THR B 109 0.167 9.788 7.647 1.00 0.39 N ATOM 1067 CA THR B 109 -0.162 9.417 6.274 1.00 0.28 C ATOM 1068 C THR B 109 -0.353 7.907 6.140 1.00 0.25 C ATOM 1069 O THR B 109 -1.220 7.447 5.397 1.00 0.27 O ATOM 1070 CB THR B 109 0.934 9.882 5.294 1.00 0.25 C ATOM 1071 OG1 THR B 109 1.014 11.312 5.291 1.00 0.33 O ATOM 1072 CG2 THR B 109 0.657 9.383 3.884 1.00 0.27 C ATOM 0 HA THR B 109 -1.098 9.916 6.023 1.00 0.28 H new ATOM 0 HB THR B 109 1.884 9.463 5.627 1.00 0.25 H new ATOM 0 HG1 THR B 109 0.717 11.658 6.158 1.00 0.33 H new ATOM 0 HG21 THR B 109 1.446 9.726 3.215 1.00 0.27 H new ATOM 0 HG22 THR B 109 0.629 8.293 3.883 1.00 0.27 H new ATOM 0 HG23 THR B 109 -0.303 9.771 3.543 1.00 0.27 H new ATOM 1080 N GLN B 110 0.462 7.144 6.862 1.00 0.30 N ATOM 1081 CA GLN B 110 0.381 5.687 6.827 1.00 0.32 C ATOM 1082 C GLN B 110 -1.008 5.198 7.228 1.00 0.30 C ATOM 1083 O GLN B 110 -1.418 4.094 6.862 1.00 0.30 O ATOM 1084 CB GLN B 110 1.434 5.075 7.746 1.00 0.42 C ATOM 1085 CG GLN B 110 2.765 4.856 7.053 1.00 0.48 C ATOM 1086 CD GLN B 110 3.857 4.404 7.997 1.00 0.85 C ATOM 1087 OE1 GLN B 110 3.597 3.749 9.006 1.00 1.34 O ATOM 1088 NE2 GLN B 110 5.090 4.755 7.664 1.00 1.38 N ATOM 0 H GLN B 110 1.187 7.511 7.479 1.00 0.30 H new ATOM 0 HA GLN B 110 0.571 5.368 5.802 1.00 0.32 H new ATOM 0 HB2 GLN B 110 1.581 5.727 8.607 1.00 0.42 H new ATOM 0 HB3 GLN B 110 1.067 4.122 8.127 1.00 0.42 H new ATOM 0 HG2 GLN B 110 2.641 4.111 6.267 1.00 0.48 H new ATOM 0 HG3 GLN B 110 3.072 5.783 6.568 1.00 0.48 H new ATOM 0 HE21 GLN B 110 5.254 5.299 6.817 1.00 1.38 H new ATOM 0 HE22 GLN B 110 5.875 4.482 8.255 1.00 1.38 H new ATOM 1097 N GLU B 111 -1.729 6.022 7.984 1.00 0.30 N ATOM 1098 CA GLU B 111 -3.073 5.670 8.428 1.00 0.30 C ATOM 1099 C GLU B 111 -4.028 5.639 7.244 1.00 0.28 C ATOM 1100 O GLU B 111 -4.917 4.790 7.167 1.00 0.39 O ATOM 1101 CB GLU B 111 -3.569 6.672 9.472 1.00 0.34 C ATOM 1102 CG GLU B 111 -2.535 7.005 10.533 1.00 0.38 C ATOM 1103 CD GLU B 111 -3.059 7.976 11.575 1.00 1.19 C ATOM 1104 OE1 GLU B 111 -3.121 9.188 11.279 1.00 2.25 O ATOM 1105 OE2 GLU B 111 -3.405 7.524 12.686 1.00 1.04 O ATOM 0 H GLU B 111 -1.405 6.936 8.301 1.00 0.30 H new ATOM 0 HA GLU B 111 -3.039 4.679 8.881 1.00 0.30 H new ATOM 0 HB2 GLU B 111 -3.869 7.591 8.968 1.00 0.34 H new ATOM 0 HB3 GLU B 111 -4.458 6.269 9.957 1.00 0.34 H new ATOM 0 HG2 GLU B 111 -2.217 6.086 11.026 1.00 0.38 H new ATOM 0 HG3 GLU B 111 -1.654 7.432 10.055 1.00 0.38 H new ATOM 1112 N ALA B 112 -3.833 6.575 6.323 1.00 0.20 N ATOM 1113 CA ALA B 112 -4.666 6.665 5.131 1.00 0.17 C ATOM 1114 C ALA B 112 -4.274 5.598 4.115 1.00 0.13 C ATOM 1115 O ALA B 112 -5.091 5.173 3.298 1.00 0.13 O ATOM 1116 CB ALA B 112 -4.552 8.050 4.515 1.00 0.17 C ATOM 0 H ALA B 112 -3.102 7.285 6.380 1.00 0.20 H new ATOM 0 HA ALA B 112 -5.702 6.494 5.422 1.00 0.17 H new ATOM 0 HB1 ALA B 112 -5.179 8.105 3.625 1.00 0.17 H new ATOM 0 HB2 ALA B 112 -4.881 8.798 5.237 1.00 0.17 H new ATOM 0 HB3 ALA B 112 -3.515 8.242 4.241 1.00 0.17 H new ATOM 1122 N SER B 113 -3.018 5.168 4.175 1.00 0.13 N ATOM 1123 CA SER B 113 -2.512 4.147 3.266 1.00 0.11 C ATOM 1124 C SER B 113 -3.172 2.801 3.548 1.00 0.10 C ATOM 1125 O SER B 113 -3.685 2.147 2.641 1.00 0.12 O ATOM 1126 CB SER B 113 -0.993 4.028 3.405 1.00 0.15 C ATOM 1127 OG SER B 113 -0.357 5.258 3.109 1.00 0.92 O ATOM 0 H SER B 113 -2.331 5.512 4.846 1.00 0.13 H new ATOM 0 HA SER B 113 -2.754 4.442 2.245 1.00 0.11 H new ATOM 0 HB2 SER B 113 -0.740 3.719 4.419 1.00 0.15 H new ATOM 0 HB3 SER B 113 -0.623 3.253 2.734 1.00 0.15 H new ATOM 0 HG SER B 113 -0.605 5.925 3.783 1.00 0.92 H new ATOM 1133 N TRP B 114 -3.161 2.400 4.814 1.00 0.10 N ATOM 1134 CA TRP B 114 -3.753 1.130 5.220 1.00 0.10 C ATOM 1135 C TRP B 114 -5.249 1.093 4.910 1.00 0.12 C ATOM 1136 O TRP B 114 -5.749 0.111 4.365 1.00 0.16 O ATOM 1137 CB TRP B 114 -3.515 0.892 6.713 1.00 0.13 C ATOM 1138 CG TRP B 114 -4.044 -0.423 7.203 1.00 0.14 C ATOM 1139 CD1 TRP B 114 -4.939 -0.621 8.216 1.00 0.17 C ATOM 1140 CD2 TRP B 114 -3.705 -1.723 6.708 1.00 0.16 C ATOM 1141 NE1 TRP B 114 -5.184 -1.962 8.374 1.00 0.19 N ATOM 1142 CE2 TRP B 114 -4.439 -2.659 7.462 1.00 0.19 C ATOM 1143 CE3 TRP B 114 -2.857 -2.188 5.699 1.00 0.17 C ATOM 1144 CZ2 TRP B 114 -4.348 -4.030 7.238 1.00 0.22 C ATOM 1145 CZ3 TRP B 114 -2.767 -3.549 5.480 1.00 0.21 C ATOM 1146 CH2 TRP B 114 -3.509 -4.456 6.246 1.00 0.23 C ATOM 0 H TRP B 114 -2.749 2.936 5.578 1.00 0.10 H new ATOM 0 HA TRP B 114 -3.272 0.335 4.651 1.00 0.10 H new ATOM 0 HB2 TRP B 114 -2.445 0.941 6.914 1.00 0.13 H new ATOM 0 HB3 TRP B 114 -3.983 1.697 7.280 1.00 0.13 H new ATOM 0 HD1 TRP B 114 -5.388 0.164 8.807 1.00 0.17 H new ATOM 0 HE1 TRP B 114 -5.818 -2.372 9.060 1.00 0.19 H new ATOM 0 HE3 TRP B 114 -2.282 -1.496 5.101 1.00 0.17 H new ATOM 0 HZ2 TRP B 114 -4.920 -4.732 7.827 1.00 0.22 H new ATOM 0 HZ3 TRP B 114 -2.113 -3.920 4.705 1.00 0.21 H new ATOM 0 HH2 TRP B 114 -3.417 -5.514 6.049 1.00 0.23 H new ATOM 1157 N GLU B 115 -5.955 2.167 5.257 1.00 0.14 N ATOM 1158 CA GLU B 115 -7.396 2.249 5.013 1.00 0.18 C ATOM 1159 C GLU B 115 -7.731 1.962 3.550 1.00 0.19 C ATOM 1160 O GLU B 115 -8.754 1.347 3.249 1.00 0.33 O ATOM 1161 CB GLU B 115 -7.925 3.630 5.404 1.00 0.22 C ATOM 1162 CG GLU B 115 -8.277 3.754 6.876 1.00 0.31 C ATOM 1163 CD GLU B 115 -8.622 5.170 7.284 1.00 1.33 C ATOM 1164 OE1 GLU B 115 -7.693 5.938 7.612 1.00 2.03 O ATOM 1165 OE2 GLU B 115 -9.823 5.514 7.278 1.00 1.80 O ATOM 0 H GLU B 115 -5.556 2.991 5.707 1.00 0.14 H new ATOM 0 HA GLU B 115 -7.879 1.490 5.629 1.00 0.18 H new ATOM 0 HB2 GLU B 115 -7.175 4.381 5.154 1.00 0.22 H new ATOM 0 HB3 GLU B 115 -8.810 3.853 4.808 1.00 0.22 H new ATOM 0 HG2 GLU B 115 -9.122 3.102 7.098 1.00 0.31 H new ATOM 0 HG3 GLU B 115 -7.437 3.403 7.476 1.00 0.31 H new ATOM 1172 N ILE B 116 -6.868 2.415 2.648 1.00 0.13 N ATOM 1173 CA ILE B 116 -7.073 2.206 1.219 1.00 0.12 C ATOM 1174 C ILE B 116 -6.874 0.740 0.838 1.00 0.10 C ATOM 1175 O ILE B 116 -7.522 0.232 -0.078 1.00 0.12 O ATOM 1176 CB ILE B 116 -6.109 3.083 0.393 1.00 0.10 C ATOM 1177 CG1 ILE B 116 -6.466 4.561 0.562 1.00 0.10 C ATOM 1178 CG2 ILE B 116 -6.143 2.689 -1.077 1.00 0.11 C ATOM 1179 CD1 ILE B 116 -5.371 5.503 0.114 1.00 0.11 C ATOM 0 H ILE B 116 -6.019 2.930 2.881 1.00 0.13 H new ATOM 0 HA ILE B 116 -8.101 2.491 0.995 1.00 0.12 H new ATOM 0 HB ILE B 116 -5.096 2.923 0.761 1.00 0.10 H new ATOM 0 HG12 ILE B 116 -7.372 4.775 -0.005 1.00 0.10 H new ATOM 0 HG13 ILE B 116 -6.693 4.754 1.610 1.00 0.10 H new ATOM 0 HG21 ILE B 116 -5.455 3.321 -1.639 1.00 0.11 H new ATOM 0 HG22 ILE B 116 -5.844 1.646 -1.181 1.00 0.11 H new ATOM 0 HG23 ILE B 116 -7.154 2.818 -1.465 1.00 0.11 H new ATOM 0 HD11 ILE B 116 -5.694 6.533 0.263 1.00 0.11 H new ATOM 0 HD12 ILE B 116 -4.470 5.317 0.698 1.00 0.11 H new ATOM 0 HD13 ILE B 116 -5.159 5.338 -0.942 1.00 0.11 H new ATOM 1191 N PHE B 117 -5.982 0.067 1.554 1.00 0.09 N ATOM 1192 CA PHE B 117 -5.678 -1.335 1.286 1.00 0.09 C ATOM 1193 C PHE B 117 -6.696 -2.264 1.945 1.00 0.11 C ATOM 1194 O PHE B 117 -6.904 -3.387 1.490 1.00 0.15 O ATOM 1195 CB PHE B 117 -4.271 -1.659 1.796 1.00 0.10 C ATOM 1196 CG PHE B 117 -3.699 -2.940 1.258 1.00 0.12 C ATOM 1197 CD1 PHE B 117 -4.008 -4.155 1.851 1.00 0.19 C ATOM 1198 CD2 PHE B 117 -2.846 -2.930 0.166 1.00 0.11 C ATOM 1199 CE1 PHE B 117 -3.479 -5.334 1.363 1.00 0.23 C ATOM 1200 CE2 PHE B 117 -2.312 -4.106 -0.325 1.00 0.13 C ATOM 1201 CZ PHE B 117 -2.629 -5.309 0.273 1.00 0.20 C ATOM 0 H PHE B 117 -5.454 0.470 2.328 1.00 0.09 H new ATOM 0 HA PHE B 117 -5.728 -1.495 0.209 1.00 0.09 H new ATOM 0 HB2 PHE B 117 -3.604 -0.838 1.533 1.00 0.10 H new ATOM 0 HB3 PHE B 117 -4.295 -1.714 2.884 1.00 0.10 H new ATOM 0 HD1 PHE B 117 -4.670 -4.180 2.704 1.00 0.19 H new ATOM 0 HD2 PHE B 117 -2.596 -1.992 -0.307 1.00 0.11 H new ATOM 0 HE1 PHE B 117 -3.729 -6.274 1.832 1.00 0.23 H new ATOM 0 HE2 PHE B 117 -1.647 -4.084 -1.176 1.00 0.13 H new ATOM 0 HZ PHE B 117 -2.214 -6.229 -0.110 1.00 0.20 H new ATOM 1211 N THR B 118 -7.333 -1.787 3.010 1.00 0.12 N ATOM 1212 CA THR B 118 -8.314 -2.590 3.734 1.00 0.16 C ATOM 1213 C THR B 118 -9.612 -2.742 2.950 1.00 0.18 C ATOM 1214 O THR B 118 -10.468 -3.551 3.308 1.00 0.34 O ATOM 1215 CB THR B 118 -8.627 -1.987 5.115 1.00 0.19 C ATOM 1216 OG1 THR B 118 -9.108 -0.646 4.968 1.00 0.26 O ATOM 1217 CG2 THR B 118 -7.389 -1.996 5.996 1.00 0.20 C ATOM 0 H THR B 118 -7.189 -0.852 3.390 1.00 0.12 H new ATOM 0 HA THR B 118 -7.866 -3.575 3.866 1.00 0.16 H new ATOM 0 HB THR B 118 -9.397 -2.595 5.589 1.00 0.19 H new ATOM 0 HG1 THR B 118 -8.843 -0.298 4.091 1.00 0.26 H new ATOM 0 HG21 THR B 118 -7.631 -1.566 6.968 1.00 0.20 H new ATOM 0 HG22 THR B 118 -7.044 -3.022 6.129 1.00 0.20 H new ATOM 0 HG23 THR B 118 -6.602 -1.407 5.524 1.00 0.20 H new ATOM 1225 N LEU B 119 -9.759 -1.962 1.883 1.00 0.14 N ATOM 1226 CA LEU B 119 -10.955 -2.029 1.053 1.00 0.14 C ATOM 1227 C LEU B 119 -10.967 -3.334 0.254 1.00 0.15 C ATOM 1228 O LEU B 119 -10.155 -3.518 -0.651 1.00 0.24 O ATOM 1229 CB LEU B 119 -11.013 -0.821 0.118 1.00 0.16 C ATOM 1230 CG LEU B 119 -11.012 0.530 0.834 1.00 0.26 C ATOM 1231 CD1 LEU B 119 -10.786 1.665 -0.153 1.00 0.81 C ATOM 1232 CD2 LEU B 119 -12.315 0.736 1.591 1.00 1.01 C ATOM 0 H LEU B 119 -9.067 -1.279 1.575 1.00 0.14 H new ATOM 0 HA LEU B 119 -11.836 -2.010 1.695 1.00 0.14 H new ATOM 0 HB2 LEU B 119 -10.161 -0.860 -0.560 1.00 0.16 H new ATOM 0 HB3 LEU B 119 -11.912 -0.894 -0.495 1.00 0.16 H new ATOM 0 HG LEU B 119 -10.191 0.532 1.551 1.00 0.26 H new ATOM 0 HD11 LEU B 119 -10.789 2.616 0.379 1.00 0.81 H new ATOM 0 HD12 LEU B 119 -9.825 1.530 -0.649 1.00 0.81 H new ATOM 0 HD13 LEU B 119 -11.582 1.663 -0.898 1.00 0.81 H new ATOM 0 HD21 LEU B 119 -12.295 1.703 2.094 1.00 1.01 H new ATOM 0 HD22 LEU B 119 -13.150 0.708 0.892 1.00 1.01 H new ATOM 0 HD23 LEU B 119 -12.435 -0.055 2.331 1.00 1.01 H new ATOM 1244 N PRO B 120 -11.897 -4.256 0.576 1.00 0.21 N ATOM 1245 CA PRO B 120 -11.984 -5.558 -0.096 1.00 0.26 C ATOM 1246 C PRO B 120 -12.523 -5.473 -1.519 1.00 0.26 C ATOM 1247 O PRO B 120 -12.157 -6.277 -2.376 1.00 0.38 O ATOM 1248 CB PRO B 120 -12.949 -6.346 0.791 1.00 0.36 C ATOM 1249 CG PRO B 120 -13.806 -5.314 1.435 1.00 0.38 C ATOM 1250 CD PRO B 120 -12.943 -4.092 1.605 1.00 0.35 C ATOM 0 HA PRO B 120 -11.000 -6.013 -0.207 1.00 0.26 H new ATOM 0 HB2 PRO B 120 -13.545 -7.044 0.203 1.00 0.36 H new ATOM 0 HB3 PRO B 120 -12.411 -6.934 1.535 1.00 0.36 H new ATOM 0 HG2 PRO B 120 -14.677 -5.092 0.818 1.00 0.38 H new ATOM 0 HG3 PRO B 120 -14.178 -5.664 2.398 1.00 0.38 H new ATOM 0 HD2 PRO B 120 -13.513 -3.175 1.454 1.00 0.35 H new ATOM 0 HD3 PRO B 120 -12.515 -4.040 2.606 1.00 0.35 H new ATOM 1258 N ASN B 121 -13.392 -4.500 -1.769 1.00 0.22 N ATOM 1259 CA ASN B 121 -13.981 -4.332 -3.093 1.00 0.23 C ATOM 1260 C ASN B 121 -12.945 -3.832 -4.094 1.00 0.19 C ATOM 1261 O ASN B 121 -13.074 -4.053 -5.298 1.00 0.22 O ATOM 1262 CB ASN B 121 -15.169 -3.373 -3.026 1.00 0.28 C ATOM 1263 CG ASN B 121 -16.231 -3.853 -2.056 1.00 0.50 C ATOM 1264 OD1 ASN B 121 -16.444 -5.055 -1.896 1.00 0.98 O ATOM 1265 ND2 ASN B 121 -16.899 -2.915 -1.397 1.00 0.50 N ATOM 0 H ASN B 121 -13.703 -3.819 -1.077 1.00 0.22 H new ATOM 0 HA ASN B 121 -14.335 -5.305 -3.434 1.00 0.23 H new ATOM 0 HB2 ASN B 121 -14.821 -2.385 -2.723 1.00 0.28 H new ATOM 0 HB3 ASN B 121 -15.606 -3.267 -4.019 1.00 0.28 H new ATOM 0 HD21 ASN B 121 -17.621 -3.179 -0.727 1.00 0.50 H new ATOM 0 HD22 ASN B 121 -16.690 -1.930 -1.560 1.00 0.50 H new ATOM 1272 N LEU B 122 -11.920 -3.152 -3.590 1.00 0.15 N ATOM 1273 CA LEU B 122 -10.857 -2.636 -4.441 1.00 0.13 C ATOM 1274 C LEU B 122 -9.778 -3.685 -4.663 1.00 0.16 C ATOM 1275 O LEU B 122 -9.373 -4.382 -3.731 1.00 0.24 O ATOM 1276 CB LEU B 122 -10.243 -1.383 -3.818 1.00 0.12 C ATOM 1277 CG LEU B 122 -10.709 -0.058 -4.426 1.00 0.14 C ATOM 1278 CD1 LEU B 122 -12.216 -0.056 -4.630 1.00 0.14 C ATOM 1279 CD2 LEU B 122 -10.291 1.102 -3.541 1.00 0.19 C ATOM 0 H LEU B 122 -11.804 -2.946 -2.598 1.00 0.15 H new ATOM 0 HA LEU B 122 -11.292 -2.380 -5.407 1.00 0.13 H new ATOM 0 HB2 LEU B 122 -10.473 -1.376 -2.753 1.00 0.12 H new ATOM 0 HB3 LEU B 122 -9.159 -1.445 -3.910 1.00 0.12 H new ATOM 0 HG LEU B 122 -10.235 0.057 -5.401 1.00 0.14 H new ATOM 0 HD11 LEU B 122 -12.523 0.896 -5.063 1.00 0.14 H new ATOM 0 HD12 LEU B 122 -12.493 -0.867 -5.303 1.00 0.14 H new ATOM 0 HD13 LEU B 122 -12.713 -0.195 -3.670 1.00 0.14 H new ATOM 0 HD21 LEU B 122 -10.629 2.038 -3.985 1.00 0.19 H new ATOM 0 HD22 LEU B 122 -10.739 0.986 -2.554 1.00 0.19 H new ATOM 0 HD23 LEU B 122 -9.205 1.116 -3.448 1.00 0.19 H new ATOM 1291 N ASN B 123 -9.313 -3.792 -5.903 1.00 0.16 N ATOM 1292 CA ASN B 123 -8.275 -4.756 -6.244 1.00 0.20 C ATOM 1293 C ASN B 123 -6.893 -4.149 -6.027 1.00 0.19 C ATOM 1294 O ASN B 123 -6.775 -3.006 -5.586 1.00 0.30 O ATOM 1295 CB ASN B 123 -8.426 -5.220 -7.695 1.00 0.28 C ATOM 1296 CG ASN B 123 -8.089 -4.132 -8.692 1.00 0.91 C ATOM 1297 OD1 ASN B 123 -8.242 -2.946 -8.408 1.00 1.73 O ATOM 1298 ND2 ASN B 123 -7.630 -4.531 -9.873 1.00 1.39 N ATOM 0 H ASN B 123 -9.638 -3.225 -6.686 1.00 0.16 H new ATOM 0 HA ASN B 123 -8.384 -5.621 -5.590 1.00 0.20 H new ATOM 0 HB2 ASN B 123 -7.778 -6.079 -7.867 1.00 0.28 H new ATOM 0 HB3 ASN B 123 -9.450 -5.555 -7.861 1.00 0.28 H new ATOM 0 HD21 ASN B 123 -7.389 -3.842 -10.586 1.00 1.39 H new ATOM 0 HD22 ASN B 123 -7.518 -5.526 -10.067 1.00 1.39 H new ATOM 1305 N GLY B 124 -5.856 -4.915 -6.341 1.00 0.14 N ATOM 1306 CA GLY B 124 -4.498 -4.436 -6.161 1.00 0.11 C ATOM 1307 C GLY B 124 -4.205 -3.164 -6.934 1.00 0.11 C ATOM 1308 O GLY B 124 -3.558 -2.254 -6.416 1.00 0.17 O ATOM 0 H GLY B 124 -5.931 -5.860 -6.717 1.00 0.14 H new ATOM 0 HA2 GLY B 124 -4.320 -4.258 -5.100 1.00 0.11 H new ATOM 0 HA3 GLY B 124 -3.801 -5.213 -6.475 1.00 0.11 H new ATOM 1312 N ARG B 125 -4.676 -3.098 -8.174 1.00 0.13 N ATOM 1313 CA ARG B 125 -4.442 -1.930 -9.018 1.00 0.14 C ATOM 1314 C ARG B 125 -5.024 -0.661 -8.399 1.00 0.12 C ATOM 1315 O ARG B 125 -4.301 0.302 -8.146 1.00 0.21 O ATOM 1316 CB ARG B 125 -5.037 -2.152 -10.410 1.00 0.20 C ATOM 1317 CG ARG B 125 -4.425 -3.326 -11.153 1.00 0.58 C ATOM 1318 CD ARG B 125 -5.081 -3.529 -12.508 1.00 0.90 C ATOM 1319 NE ARG B 125 -4.965 -2.345 -13.354 1.00 1.75 N ATOM 1320 CZ ARG B 125 -5.403 -2.290 -14.607 1.00 2.18 C ATOM 1321 NH1 ARG B 125 -5.984 -3.349 -15.157 1.00 1.82 N ATOM 1322 NH2 ARG B 125 -5.259 -1.175 -15.311 1.00 3.25 N ATOM 0 H ARG B 125 -5.221 -3.837 -8.617 1.00 0.13 H new ATOM 0 HA ARG B 125 -3.363 -1.798 -9.103 1.00 0.14 H new ATOM 0 HB2 ARG B 125 -6.111 -2.313 -10.315 1.00 0.20 H new ATOM 0 HB3 ARG B 125 -4.901 -1.247 -11.002 1.00 0.20 H new ATOM 0 HG2 ARG B 125 -3.357 -3.157 -11.286 1.00 0.58 H new ATOM 0 HG3 ARG B 125 -4.532 -4.232 -10.556 1.00 0.58 H new ATOM 0 HD2 ARG B 125 -4.621 -4.380 -13.010 1.00 0.90 H new ATOM 0 HD3 ARG B 125 -6.134 -3.773 -12.368 1.00 0.90 H new ATOM 0 HE ARG B 125 -4.523 -1.514 -12.961 1.00 1.75 H new ATOM 0 HH11 ARG B 125 -6.095 -4.207 -14.617 1.00 1.82 H new ATOM 0 HH12 ARG B 125 -6.320 -3.304 -16.119 1.00 1.82 H new ATOM 0 HH21 ARG B 125 -4.812 -0.360 -14.890 1.00 3.25 H new ATOM 0 HH22 ARG B 125 -5.595 -1.132 -16.273 1.00 3.25 H new ATOM 1336 N GLN B 126 -6.333 -0.666 -8.163 1.00 0.12 N ATOM 1337 CA GLN B 126 -7.014 0.486 -7.583 1.00 0.11 C ATOM 1338 C GLN B 126 -6.328 0.976 -6.309 1.00 0.09 C ATOM 1339 O GLN B 126 -5.944 2.142 -6.219 1.00 0.11 O ATOM 1340 CB GLN B 126 -8.472 0.134 -7.296 1.00 0.13 C ATOM 1341 CG GLN B 126 -9.268 -0.169 -8.553 1.00 0.26 C ATOM 1342 CD GLN B 126 -10.673 -0.648 -8.259 1.00 0.19 C ATOM 1343 OE1 GLN B 126 -10.929 -1.276 -7.234 1.00 0.77 O ATOM 1344 NE2 GLN B 126 -11.589 -0.352 -9.168 1.00 0.64 N ATOM 0 H GLN B 126 -6.944 -1.457 -8.365 1.00 0.12 H new ATOM 0 HA GLN B 126 -6.969 1.299 -8.308 1.00 0.11 H new ATOM 0 HB2 GLN B 126 -8.508 -0.730 -6.633 1.00 0.13 H new ATOM 0 HB3 GLN B 126 -8.942 0.962 -6.766 1.00 0.13 H new ATOM 0 HG2 GLN B 126 -9.317 0.728 -9.171 1.00 0.26 H new ATOM 0 HG3 GLN B 126 -8.745 -0.928 -9.134 1.00 0.26 H new ATOM 0 HE21 GLN B 126 -11.328 0.172 -10.003 1.00 0.64 H new ATOM 0 HE22 GLN B 126 -12.556 -0.648 -9.033 1.00 0.64 H new ATOM 1353 N VAL B 127 -6.171 0.091 -5.329 1.00 0.09 N ATOM 1354 CA VAL B 127 -5.534 0.464 -4.068 1.00 0.08 C ATOM 1355 C VAL B 127 -4.123 1.006 -4.294 1.00 0.08 C ATOM 1356 O VAL B 127 -3.781 2.073 -3.791 1.00 0.09 O ATOM 1357 CB VAL B 127 -5.487 -0.722 -3.078 1.00 0.09 C ATOM 1358 CG1 VAL B 127 -6.893 -1.181 -2.732 1.00 0.10 C ATOM 1359 CG2 VAL B 127 -4.671 -1.874 -3.645 1.00 0.10 C ATOM 0 H VAL B 127 -6.473 -0.882 -5.381 1.00 0.09 H new ATOM 0 HA VAL B 127 -6.146 1.253 -3.630 1.00 0.08 H new ATOM 0 HB VAL B 127 -4.999 -0.382 -2.165 1.00 0.09 H new ATOM 0 HG11 VAL B 127 -6.842 -2.017 -2.034 1.00 0.10 H new ATOM 0 HG12 VAL B 127 -7.442 -0.358 -2.273 1.00 0.10 H new ATOM 0 HG13 VAL B 127 -7.406 -1.498 -3.640 1.00 0.10 H new ATOM 0 HG21 VAL B 127 -4.654 -2.695 -2.928 1.00 0.10 H new ATOM 0 HG22 VAL B 127 -5.122 -2.215 -4.577 1.00 0.10 H new ATOM 0 HG23 VAL B 127 -3.652 -1.538 -3.836 1.00 0.10 H new ATOM 1369 N ALA B 128 -3.312 0.281 -5.064 1.00 0.09 N ATOM 1370 CA ALA B 128 -1.942 0.707 -5.345 1.00 0.10 C ATOM 1371 C ALA B 128 -1.927 2.061 -6.041 1.00 0.10 C ATOM 1372 O ALA B 128 -0.911 2.757 -6.050 1.00 0.13 O ATOM 1373 CB ALA B 128 -1.219 -0.332 -6.190 1.00 0.10 C ATOM 0 H ALA B 128 -3.579 -0.600 -5.503 1.00 0.09 H new ATOM 0 HA ALA B 128 -1.418 0.805 -4.394 1.00 0.10 H new ATOM 0 HB1 ALA B 128 -0.201 0.004 -6.388 1.00 0.10 H new ATOM 0 HB2 ALA B 128 -1.190 -1.281 -5.654 1.00 0.10 H new ATOM 0 HB3 ALA B 128 -1.747 -0.465 -7.134 1.00 0.10 H new ATOM 1379 N ALA B 129 -3.063 2.427 -6.624 1.00 0.08 N ATOM 1380 CA ALA B 129 -3.191 3.701 -7.318 1.00 0.09 C ATOM 1381 C ALA B 129 -3.478 4.819 -6.325 1.00 0.09 C ATOM 1382 O ALA B 129 -3.021 5.950 -6.496 1.00 0.12 O ATOM 1383 CB ALA B 129 -4.287 3.628 -8.369 1.00 0.10 C ATOM 0 H ALA B 129 -3.909 1.858 -6.629 1.00 0.08 H new ATOM 0 HA ALA B 129 -2.248 3.917 -7.820 1.00 0.09 H new ATOM 0 HB1 ALA B 129 -4.368 4.589 -8.877 1.00 0.10 H new ATOM 0 HB2 ALA B 129 -4.043 2.853 -9.095 1.00 0.10 H new ATOM 0 HB3 ALA B 129 -5.236 3.390 -7.889 1.00 0.10 H new ATOM 1389 N PHE B 130 -4.240 4.491 -5.286 1.00 0.08 N ATOM 1390 CA PHE B 130 -4.583 5.458 -4.254 1.00 0.08 C ATOM 1391 C PHE B 130 -3.428 5.621 -3.270 1.00 0.09 C ATOM 1392 O PHE B 130 -3.272 6.672 -2.649 1.00 0.14 O ATOM 1393 CB PHE B 130 -5.848 5.019 -3.513 1.00 0.09 C ATOM 1394 CG PHE B 130 -7.112 5.198 -4.309 1.00 0.09 C ATOM 1395 CD1 PHE B 130 -7.648 6.460 -4.504 1.00 0.11 C ATOM 1396 CD2 PHE B 130 -7.764 4.105 -4.861 1.00 0.14 C ATOM 1397 CE1 PHE B 130 -8.808 6.631 -5.232 1.00 0.13 C ATOM 1398 CE2 PHE B 130 -8.925 4.271 -5.591 1.00 0.17 C ATOM 1399 CZ PHE B 130 -9.448 5.525 -5.780 1.00 0.16 C ATOM 0 H PHE B 130 -4.631 3.561 -5.138 1.00 0.08 H new ATOM 0 HA PHE B 130 -4.772 6.419 -4.732 1.00 0.08 H new ATOM 0 HB2 PHE B 130 -5.750 3.969 -3.236 1.00 0.09 H new ATOM 0 HB3 PHE B 130 -5.930 5.587 -2.586 1.00 0.09 H new ATOM 0 HD1 PHE B 130 -7.152 7.321 -4.081 1.00 0.11 H new ATOM 0 HD2 PHE B 130 -7.360 3.114 -4.719 1.00 0.14 H new ATOM 0 HE1 PHE B 130 -9.217 7.620 -5.375 1.00 0.13 H new ATOM 0 HE2 PHE B 130 -9.422 3.411 -6.014 1.00 0.17 H new ATOM 0 HZ PHE B 130 -10.355 5.653 -6.353 1.00 0.16 H new ATOM 1409 N ILE B 131 -2.617 4.571 -3.134 1.00 0.08 N ATOM 1410 CA ILE B 131 -1.466 4.604 -2.237 1.00 0.09 C ATOM 1411 C ILE B 131 -0.368 5.465 -2.843 1.00 0.10 C ATOM 1412 O ILE B 131 0.277 6.255 -2.154 1.00 0.14 O ATOM 1413 CB ILE B 131 -0.898 3.192 -1.974 1.00 0.10 C ATOM 1414 CG1 ILE B 131 -1.982 2.270 -1.402 1.00 0.11 C ATOM 1415 CG2 ILE B 131 0.301 3.265 -1.035 1.00 0.12 C ATOM 1416 CD1 ILE B 131 -2.293 2.517 0.057 1.00 0.13 C ATOM 0 H ILE B 131 -2.737 3.690 -3.633 1.00 0.08 H new ATOM 0 HA ILE B 131 -1.805 5.021 -1.289 1.00 0.09 H new ATOM 0 HB ILE B 131 -0.564 2.773 -2.923 1.00 0.10 H new ATOM 0 HG12 ILE B 131 -2.895 2.396 -1.984 1.00 0.11 H new ATOM 0 HG13 ILE B 131 -1.665 1.234 -1.525 1.00 0.11 H new ATOM 0 HG21 ILE B 131 0.688 2.261 -0.861 1.00 0.12 H new ATOM 0 HG22 ILE B 131 1.079 3.881 -1.486 1.00 0.12 H new ATOM 0 HG23 ILE B 131 -0.006 3.705 -0.086 1.00 0.12 H new ATOM 0 HD11 ILE B 131 -3.069 1.825 0.386 1.00 0.13 H new ATOM 0 HD12 ILE B 131 -1.393 2.362 0.652 1.00 0.13 H new ATOM 0 HD13 ILE B 131 -2.642 3.542 0.186 1.00 0.13 H new ATOM 1428 N SER B 132 -0.169 5.298 -4.146 1.00 0.11 N ATOM 1429 CA SER B 132 0.840 6.051 -4.876 1.00 0.13 C ATOM 1430 C SER B 132 0.609 7.549 -4.726 1.00 0.15 C ATOM 1431 O SER B 132 1.492 8.283 -4.281 1.00 0.21 O ATOM 1432 CB SER B 132 0.810 5.667 -6.356 1.00 0.17 C ATOM 1433 OG SER B 132 1.801 6.366 -7.087 1.00 0.63 O ATOM 0 H SER B 132 -0.699 4.642 -4.720 1.00 0.11 H new ATOM 0 HA SER B 132 1.818 5.808 -4.460 1.00 0.13 H new ATOM 0 HB2 SER B 132 0.968 4.593 -6.459 1.00 0.17 H new ATOM 0 HB3 SER B 132 -0.174 5.886 -6.771 1.00 0.17 H new ATOM 0 HG SER B 132 2.437 6.778 -6.465 1.00 0.63 H new ATOM 1439 N SER B 133 -0.586 7.994 -5.100 1.00 0.15 N ATOM 1440 CA SER B 133 -0.942 9.406 -5.006 1.00 0.19 C ATOM 1441 C SER B 133 -0.757 9.912 -3.581 1.00 0.18 C ATOM 1442 O SER B 133 -0.440 11.082 -3.360 1.00 0.26 O ATOM 1443 CB SER B 133 -2.395 9.616 -5.436 1.00 0.23 C ATOM 1444 OG SER B 133 -2.658 10.985 -5.691 1.00 0.74 O ATOM 0 H SER B 133 -1.325 7.397 -5.471 1.00 0.15 H new ATOM 0 HA SER B 133 -0.284 9.967 -5.670 1.00 0.19 H new ATOM 0 HB2 SER B 133 -2.601 9.030 -6.332 1.00 0.23 H new ATOM 0 HB3 SER B 133 -3.065 9.253 -4.656 1.00 0.23 H new ATOM 0 HG SER B 133 -3.456 11.065 -6.254 1.00 0.74 H new ATOM 1450 N LEU B 134 -0.958 9.019 -2.619 1.00 0.13 N ATOM 1451 CA LEU B 134 -0.822 9.363 -1.210 1.00 0.13 C ATOM 1452 C LEU B 134 0.599 9.810 -0.886 1.00 0.15 C ATOM 1453 O LEU B 134 0.822 10.952 -0.484 1.00 0.21 O ATOM 1454 CB LEU B 134 -1.200 8.167 -0.335 1.00 0.14 C ATOM 1455 CG LEU B 134 -2.292 8.437 0.698 1.00 0.17 C ATOM 1456 CD1 LEU B 134 -2.500 7.216 1.577 1.00 0.22 C ATOM 1457 CD2 LEU B 134 -1.938 9.651 1.542 1.00 0.20 C ATOM 0 H LEU B 134 -1.217 8.047 -2.791 1.00 0.13 H new ATOM 0 HA LEU B 134 -1.498 10.192 -1.001 1.00 0.13 H new ATOM 0 HB2 LEU B 134 -1.527 7.353 -0.982 1.00 0.14 H new ATOM 0 HB3 LEU B 134 -0.307 7.821 0.186 1.00 0.14 H new ATOM 0 HG LEU B 134 -3.224 8.646 0.172 1.00 0.17 H new ATOM 0 HD11 LEU B 134 -3.281 7.423 2.308 1.00 0.22 H new ATOM 0 HD12 LEU B 134 -2.797 6.369 0.959 1.00 0.22 H new ATOM 0 HD13 LEU B 134 -1.571 6.978 2.096 1.00 0.22 H new ATOM 0 HD21 LEU B 134 -2.727 9.829 2.273 1.00 0.20 H new ATOM 0 HD22 LEU B 134 -0.997 9.471 2.061 1.00 0.20 H new ATOM 0 HD23 LEU B 134 -1.836 10.525 0.898 1.00 0.20 H new ATOM 1469 N LEU B 135 1.556 8.904 -1.058 1.00 0.17 N ATOM 1470 CA LEU B 135 2.954 9.211 -0.778 1.00 0.22 C ATOM 1471 C LEU B 135 3.489 10.246 -1.762 1.00 0.24 C ATOM 1472 O LEU B 135 4.525 10.867 -1.522 1.00 0.31 O ATOM 1473 CB LEU B 135 3.809 7.938 -0.832 1.00 0.26 C ATOM 1474 CG LEU B 135 3.518 6.869 0.240 1.00 0.31 C ATOM 1475 CD1 LEU B 135 2.566 7.383 1.314 1.00 0.67 C ATOM 1476 CD2 LEU B 135 2.956 5.614 -0.402 1.00 0.65 C ATOM 0 H LEU B 135 1.390 7.954 -1.389 1.00 0.17 H new ATOM 0 HA LEU B 135 3.012 9.628 0.228 1.00 0.22 H new ATOM 0 HB2 LEU B 135 3.680 7.481 -1.813 1.00 0.26 H new ATOM 0 HB3 LEU B 135 4.857 8.227 -0.750 1.00 0.26 H new ATOM 0 HG LEU B 135 4.464 6.630 0.726 1.00 0.31 H new ATOM 0 HD11 LEU B 135 2.388 6.598 2.049 1.00 0.67 H new ATOM 0 HD12 LEU B 135 3.008 8.249 1.808 1.00 0.67 H new ATOM 0 HD13 LEU B 135 1.620 7.671 0.855 1.00 0.67 H new ATOM 0 HD21 LEU B 135 2.756 4.869 0.369 1.00 0.65 H new ATOM 0 HD22 LEU B 135 2.029 5.855 -0.923 1.00 0.65 H new ATOM 0 HD23 LEU B 135 3.678 5.215 -1.114 1.00 0.65 H new ATOM 1488 N ASP B 136 2.777 10.425 -2.871 1.00 0.22 N ATOM 1489 CA ASP B 136 3.177 11.392 -3.886 1.00 0.26 C ATOM 1490 C ASP B 136 2.643 12.779 -3.539 1.00 0.25 C ATOM 1491 O ASP B 136 3.051 13.781 -4.128 1.00 0.29 O ATOM 1492 CB ASP B 136 2.664 10.964 -5.263 1.00 0.29 C ATOM 1493 CG ASP B 136 3.224 11.821 -6.383 1.00 0.37 C ATOM 1494 OD1 ASP B 136 2.618 12.871 -6.685 1.00 0.40 O ATOM 1495 OD2 ASP B 136 4.267 11.443 -6.956 1.00 0.47 O ATOM 0 H ASP B 136 1.922 9.914 -3.089 1.00 0.22 H new ATOM 0 HA ASP B 136 4.266 11.431 -3.913 1.00 0.26 H new ATOM 0 HB2 ASP B 136 2.931 9.922 -5.439 1.00 0.29 H new ATOM 0 HB3 ASP B 136 1.576 11.021 -5.276 1.00 0.29 H new ATOM 1500 N ASP B 137 1.730 12.823 -2.574 1.00 0.24 N ATOM 1501 CA ASP B 137 1.129 14.075 -2.133 1.00 0.27 C ATOM 1502 C ASP B 137 0.341 13.865 -0.840 1.00 0.22 C ATOM 1503 O ASP B 137 -0.886 13.767 -0.862 1.00 0.24 O ATOM 1504 CB ASP B 137 0.212 14.641 -3.221 1.00 0.38 C ATOM 1505 CG ASP B 137 -0.364 15.991 -2.844 1.00 1.19 C ATOM 1506 OD1 ASP B 137 0.294 17.015 -3.122 1.00 1.42 O ATOM 1507 OD2 ASP B 137 -1.474 16.025 -2.272 1.00 2.13 O ATOM 0 H ASP B 137 1.389 11.999 -2.080 1.00 0.24 H new ATOM 0 HA ASP B 137 1.929 14.790 -1.942 1.00 0.27 H new ATOM 0 HB2 ASP B 137 0.771 14.734 -4.152 1.00 0.38 H new ATOM 0 HB3 ASP B 137 -0.602 13.941 -3.407 1.00 0.38 H new ATOM 1512 N PRO B 138 1.044 13.789 0.307 1.00 0.19 N ATOM 1513 CA PRO B 138 0.414 13.586 1.620 1.00 0.21 C ATOM 1514 C PRO B 138 -0.582 14.687 1.983 1.00 0.22 C ATOM 1515 O PRO B 138 -1.162 14.674 3.069 1.00 0.31 O ATOM 1516 CB PRO B 138 1.595 13.601 2.596 1.00 0.24 C ATOM 1517 CG PRO B 138 2.788 13.281 1.763 1.00 0.25 C ATOM 1518 CD PRO B 138 2.511 13.876 0.412 1.00 0.23 C ATOM 0 HA PRO B 138 -0.167 12.664 1.640 1.00 0.21 H new ATOM 0 HB2 PRO B 138 1.698 14.574 3.076 1.00 0.24 H new ATOM 0 HB3 PRO B 138 1.460 12.867 3.390 1.00 0.24 H new ATOM 0 HG2 PRO B 138 3.694 13.703 2.198 1.00 0.25 H new ATOM 0 HG3 PRO B 138 2.939 12.204 1.693 1.00 0.25 H new ATOM 0 HD2 PRO B 138 2.860 14.906 0.345 1.00 0.23 H new ATOM 0 HD3 PRO B 138 3.006 13.319 -0.384 1.00 0.23 H new ATOM 1526 N SER B 139 -0.772 15.643 1.080 1.00 0.20 N ATOM 1527 CA SER B 139 -1.705 16.738 1.316 1.00 0.22 C ATOM 1528 C SER B 139 -3.140 16.297 1.040 1.00 0.19 C ATOM 1529 O SER B 139 -4.057 16.624 1.794 1.00 0.19 O ATOM 1530 CB SER B 139 -1.350 17.939 0.436 1.00 0.28 C ATOM 1531 OG SER B 139 -2.250 19.012 0.652 1.00 1.15 O ATOM 0 H SER B 139 -0.293 15.682 0.180 1.00 0.20 H new ATOM 0 HA SER B 139 -1.627 17.030 2.363 1.00 0.22 H new ATOM 0 HB2 SER B 139 -0.332 18.264 0.652 1.00 0.28 H new ATOM 0 HB3 SER B 139 -1.374 17.645 -0.613 1.00 0.28 H new ATOM 0 HG SER B 139 -2.001 19.768 0.080 1.00 1.15 H new ATOM 1537 N GLN B 140 -3.324 15.550 -0.046 1.00 0.18 N ATOM 1538 CA GLN B 140 -4.645 15.067 -0.429 1.00 0.17 C ATOM 1539 C GLN B 140 -4.930 13.698 0.172 1.00 0.15 C ATOM 1540 O GLN B 140 -5.802 12.980 -0.304 1.00 0.14 O ATOM 1541 CB GLN B 140 -4.761 14.981 -1.948 1.00 0.21 C ATOM 1542 CG GLN B 140 -4.567 16.312 -2.652 1.00 0.26 C ATOM 1543 CD GLN B 140 -5.587 17.353 -2.233 1.00 1.09 C ATOM 1544 OE1 GLN B 140 -6.726 17.027 -1.903 1.00 1.74 O ATOM 1545 NE2 GLN B 140 -5.179 18.617 -2.244 1.00 1.37 N ATOM 0 H GLN B 140 -2.573 15.267 -0.676 1.00 0.18 H new ATOM 0 HA GLN B 140 -5.377 15.778 -0.044 1.00 0.17 H new ATOM 0 HB2 GLN B 140 -4.021 14.272 -2.320 1.00 0.21 H new ATOM 0 HB3 GLN B 140 -5.742 14.583 -2.207 1.00 0.21 H new ATOM 0 HG2 GLN B 140 -3.565 16.686 -2.442 1.00 0.26 H new ATOM 0 HG3 GLN B 140 -4.631 16.161 -3.730 1.00 0.26 H new ATOM 0 HE21 GLN B 140 -4.225 18.842 -2.525 1.00 1.37 H new ATOM 0 HE22 GLN B 140 -5.820 19.362 -1.971 1.00 1.37 H new ATOM 1554 N SER B 141 -4.188 13.343 1.211 1.00 0.15 N ATOM 1555 CA SER B 141 -4.344 12.066 1.874 1.00 0.13 C ATOM 1556 C SER B 141 -5.806 11.759 2.181 1.00 0.13 C ATOM 1557 O SER B 141 -6.303 10.683 1.852 1.00 0.18 O ATOM 1558 CB SER B 141 -3.532 12.082 3.162 1.00 0.15 C ATOM 1559 OG SER B 141 -2.161 12.315 2.898 1.00 1.01 O ATOM 0 H SER B 141 -3.462 13.935 1.615 1.00 0.15 H new ATOM 0 HA SER B 141 -3.984 11.283 1.207 1.00 0.13 H new ATOM 0 HB2 SER B 141 -3.914 12.857 3.827 1.00 0.15 H new ATOM 0 HB3 SER B 141 -3.649 11.131 3.681 1.00 0.15 H new ATOM 0 HG SER B 141 -1.869 13.122 3.371 1.00 1.01 H new ATOM 1565 N ALA B 142 -6.487 12.705 2.815 1.00 0.16 N ATOM 1566 CA ALA B 142 -7.889 12.527 3.167 1.00 0.17 C ATOM 1567 C ALA B 142 -8.773 12.490 1.927 1.00 0.17 C ATOM 1568 O ALA B 142 -9.827 11.855 1.928 1.00 0.18 O ATOM 1569 CB ALA B 142 -8.342 13.633 4.107 1.00 0.20 C ATOM 0 H ALA B 142 -6.091 13.602 3.096 1.00 0.16 H new ATOM 0 HA ALA B 142 -7.987 11.568 3.675 1.00 0.17 H new ATOM 0 HB1 ALA B 142 -9.392 13.487 4.361 1.00 0.20 H new ATOM 0 HB2 ALA B 142 -7.741 13.607 5.016 1.00 0.20 H new ATOM 0 HB3 ALA B 142 -8.218 14.599 3.618 1.00 0.20 H new ATOM 1575 N ASN B 143 -8.340 13.169 0.870 1.00 0.17 N ATOM 1576 CA ASN B 143 -9.108 13.214 -0.370 1.00 0.18 C ATOM 1577 C ASN B 143 -8.863 11.961 -1.201 1.00 0.16 C ATOM 1578 O ASN B 143 -9.704 11.553 -1.997 1.00 0.17 O ATOM 1579 CB ASN B 143 -8.747 14.460 -1.174 1.00 0.20 C ATOM 1580 CG ASN B 143 -8.939 15.736 -0.377 1.00 0.23 C ATOM 1581 OD1 ASN B 143 -9.996 16.365 -0.433 1.00 0.26 O ATOM 1582 ND2 ASN B 143 -7.915 16.121 0.377 1.00 0.23 N ATOM 0 H ASN B 143 -7.466 13.694 0.846 1.00 0.17 H new ATOM 0 HA ASN B 143 -10.167 13.256 -0.115 1.00 0.18 H new ATOM 0 HB2 ASN B 143 -7.709 14.391 -1.500 1.00 0.20 H new ATOM 0 HB3 ASN B 143 -9.362 14.500 -2.073 1.00 0.20 H new ATOM 0 HD21 ASN B 143 -7.986 16.969 0.940 1.00 0.23 H new ATOM 0 HD22 ASN B 143 -7.057 15.569 0.393 1.00 0.23 H new ATOM 1589 N LEU B 144 -7.699 11.360 -0.997 1.00 0.14 N ATOM 1590 CA LEU B 144 -7.308 10.156 -1.711 1.00 0.12 C ATOM 1591 C LEU B 144 -7.930 8.933 -1.053 1.00 0.11 C ATOM 1592 O LEU B 144 -8.325 7.982 -1.727 1.00 0.13 O ATOM 1593 CB LEU B 144 -5.787 10.057 -1.727 1.00 0.12 C ATOM 1594 CG LEU B 144 -5.093 11.106 -2.597 1.00 0.13 C ATOM 1595 CD1 LEU B 144 -3.603 11.122 -2.320 1.00 0.14 C ATOM 1596 CD2 LEU B 144 -5.364 10.842 -4.069 1.00 0.14 C ATOM 0 H LEU B 144 -7.001 11.694 -0.332 1.00 0.14 H new ATOM 0 HA LEU B 144 -7.668 10.201 -2.739 1.00 0.12 H new ATOM 0 HB2 LEU B 144 -5.419 10.149 -0.705 1.00 0.12 H new ATOM 0 HB3 LEU B 144 -5.504 9.065 -2.080 1.00 0.12 H new ATOM 0 HG LEU B 144 -5.498 12.086 -2.347 1.00 0.13 H new ATOM 0 HD11 LEU B 144 -3.124 11.874 -2.947 1.00 0.14 H new ATOM 0 HD12 LEU B 144 -3.431 11.362 -1.271 1.00 0.14 H new ATOM 0 HD13 LEU B 144 -3.181 10.142 -2.542 1.00 0.14 H new ATOM 0 HD21 LEU B 144 -4.862 11.598 -4.673 1.00 0.14 H new ATOM 0 HD22 LEU B 144 -4.987 9.855 -4.337 1.00 0.14 H new ATOM 0 HD23 LEU B 144 -6.437 10.883 -4.254 1.00 0.14 H new ATOM 1608 N LEU B 145 -8.009 8.972 0.270 1.00 0.11 N ATOM 1609 CA LEU B 145 -8.614 7.892 1.031 1.00 0.11 C ATOM 1610 C LEU B 145 -10.124 7.990 0.888 1.00 0.12 C ATOM 1611 O LEU B 145 -10.841 6.991 0.945 1.00 0.11 O ATOM 1612 CB LEU B 145 -8.189 7.972 2.502 1.00 0.12 C ATOM 1613 CG LEU B 145 -9.057 7.192 3.496 1.00 0.13 C ATOM 1614 CD1 LEU B 145 -9.145 5.724 3.109 1.00 0.15 C ATOM 1615 CD2 LEU B 145 -8.504 7.337 4.905 1.00 0.16 C ATOM 0 H LEU B 145 -7.660 9.744 0.839 1.00 0.11 H new ATOM 0 HA LEU B 145 -8.278 6.928 0.648 1.00 0.11 H new ATOM 0 HB2 LEU B 145 -7.164 7.610 2.584 1.00 0.12 H new ATOM 0 HB3 LEU B 145 -8.182 9.020 2.801 1.00 0.12 H new ATOM 0 HG LEU B 145 -10.064 7.609 3.469 1.00 0.13 H new ATOM 0 HD11 LEU B 145 -9.767 5.194 3.831 1.00 0.15 H new ATOM 0 HD12 LEU B 145 -9.586 5.635 2.116 1.00 0.15 H new ATOM 0 HD13 LEU B 145 -8.146 5.289 3.102 1.00 0.15 H new ATOM 0 HD21 LEU B 145 -9.130 6.778 5.601 1.00 0.16 H new ATOM 0 HD22 LEU B 145 -7.487 6.947 4.939 1.00 0.16 H new ATOM 0 HD23 LEU B 145 -8.498 8.390 5.187 1.00 0.16 H new ATOM 1627 N ALA B 146 -10.594 9.218 0.691 1.00 0.16 N ATOM 1628 CA ALA B 146 -12.011 9.475 0.499 1.00 0.17 C ATOM 1629 C ALA B 146 -12.470 8.859 -0.814 1.00 0.16 C ATOM 1630 O ALA B 146 -13.449 8.115 -0.857 1.00 0.17 O ATOM 1631 CB ALA B 146 -12.286 10.973 0.507 1.00 0.20 C ATOM 0 H ALA B 146 -10.008 10.052 0.661 1.00 0.16 H new ATOM 0 HA ALA B 146 -12.568 9.021 1.319 1.00 0.17 H new ATOM 0 HB1 ALA B 146 -13.352 11.148 0.362 1.00 0.20 H new ATOM 0 HB2 ALA B 146 -11.976 11.395 1.463 1.00 0.20 H new ATOM 0 HB3 ALA B 146 -11.727 11.450 -0.298 1.00 0.20 H new ATOM 1637 N GLU B 147 -11.735 9.166 -1.881 1.00 0.18 N ATOM 1638 CA GLU B 147 -12.037 8.646 -3.205 1.00 0.19 C ATOM 1639 C GLU B 147 -12.028 7.132 -3.177 1.00 0.16 C ATOM 1640 O GLU B 147 -12.938 6.478 -3.684 1.00 0.18 O ATOM 1641 CB GLU B 147 -10.997 9.142 -4.206 1.00 0.27 C ATOM 1642 CG GLU B 147 -11.050 10.638 -4.446 1.00 0.18 C ATOM 1643 CD GLU B 147 -12.106 11.030 -5.461 1.00 0.39 C ATOM 1644 OE1 GLU B 147 -11.873 10.819 -6.670 1.00 0.57 O ATOM 1645 OE2 GLU B 147 -13.165 11.546 -5.047 1.00 0.62 O ATOM 0 H GLU B 147 -10.920 9.778 -1.849 1.00 0.18 H new ATOM 0 HA GLU B 147 -13.024 8.996 -3.506 1.00 0.19 H new ATOM 0 HB2 GLU B 147 -10.003 8.875 -3.847 1.00 0.27 H new ATOM 0 HB3 GLU B 147 -11.142 8.625 -5.154 1.00 0.27 H new ATOM 0 HG2 GLU B 147 -11.252 11.146 -3.503 1.00 0.18 H new ATOM 0 HG3 GLU B 147 -10.075 10.981 -4.791 1.00 0.18 H new ATOM 1652 N ALA B 148 -10.975 6.592 -2.583 1.00 0.13 N ATOM 1653 CA ALA B 148 -10.815 5.155 -2.460 1.00 0.12 C ATOM 1654 C ALA B 148 -12.069 4.519 -1.874 1.00 0.14 C ATOM 1655 O ALA B 148 -12.554 3.506 -2.377 1.00 0.20 O ATOM 1656 CB ALA B 148 -9.607 4.841 -1.594 1.00 0.11 C ATOM 0 H ALA B 148 -10.213 7.135 -2.176 1.00 0.13 H new ATOM 0 HA ALA B 148 -10.657 4.737 -3.454 1.00 0.12 H new ATOM 0 HB1 ALA B 148 -9.493 3.761 -1.506 1.00 0.11 H new ATOM 0 HB2 ALA B 148 -8.712 5.264 -2.050 1.00 0.11 H new ATOM 0 HB3 ALA B 148 -9.748 5.273 -0.603 1.00 0.11 H new ATOM 1662 N LYS B 149 -12.587 5.121 -0.807 1.00 0.14 N ATOM 1663 CA LYS B 149 -13.790 4.619 -0.158 1.00 0.17 C ATOM 1664 C LYS B 149 -15.004 4.767 -1.071 1.00 0.17 C ATOM 1665 O LYS B 149 -15.928 3.956 -1.019 1.00 0.22 O ATOM 1666 CB LYS B 149 -14.025 5.343 1.171 1.00 0.24 C ATOM 1667 CG LYS B 149 -13.227 4.755 2.326 1.00 0.34 C ATOM 1668 CD LYS B 149 -13.505 5.482 3.630 1.00 0.42 C ATOM 1669 CE LYS B 149 -12.508 6.605 3.863 1.00 0.59 C ATOM 1670 NZ LYS B 149 -12.905 7.475 5.003 1.00 1.01 N ATOM 0 H LYS B 149 -12.192 5.956 -0.375 1.00 0.14 H new ATOM 0 HA LYS B 149 -13.648 3.558 0.046 1.00 0.17 H new ATOM 0 HB2 LYS B 149 -13.763 6.395 1.055 1.00 0.24 H new ATOM 0 HB3 LYS B 149 -15.087 5.304 1.415 1.00 0.24 H new ATOM 0 HG2 LYS B 149 -13.474 3.699 2.438 1.00 0.34 H new ATOM 0 HG3 LYS B 149 -12.163 4.811 2.098 1.00 0.34 H new ATOM 0 HD2 LYS B 149 -14.516 5.889 3.613 1.00 0.42 H new ATOM 0 HD3 LYS B 149 -13.460 4.776 4.459 1.00 0.42 H new ATOM 0 HE2 LYS B 149 -11.523 6.181 4.057 1.00 0.59 H new ATOM 0 HE3 LYS B 149 -12.423 7.208 2.959 1.00 0.59 H new ATOM 0 HZ1 LYS B 149 -12.198 8.228 5.128 1.00 1.01 H new ATOM 0 HZ2 LYS B 149 -13.834 7.901 4.808 1.00 1.01 H new ATOM 0 HZ3 LYS B 149 -12.961 6.905 5.871 1.00 1.01 H new ATOM 1684 N LYS B 150 -14.999 5.805 -1.905 1.00 0.17 N ATOM 1685 CA LYS B 150 -16.096 6.032 -2.838 1.00 0.20 C ATOM 1686 C LYS B 150 -16.103 4.944 -3.901 1.00 0.21 C ATOM 1687 O LYS B 150 -17.160 4.537 -4.384 1.00 0.30 O ATOM 1688 CB LYS B 150 -15.974 7.405 -3.501 1.00 0.25 C ATOM 1689 CG LYS B 150 -16.024 8.563 -2.518 1.00 0.72 C ATOM 1690 CD LYS B 150 -16.230 9.895 -3.225 1.00 0.81 C ATOM 1691 CE LYS B 150 -17.599 9.979 -3.885 1.00 1.28 C ATOM 1692 NZ LYS B 150 -17.812 11.289 -4.559 1.00 1.99 N ATOM 0 H LYS B 150 -14.251 6.497 -1.953 1.00 0.17 H new ATOM 0 HA LYS B 150 -17.032 6.002 -2.281 1.00 0.20 H new ATOM 0 HB2 LYS B 150 -15.036 7.450 -4.054 1.00 0.25 H new ATOM 0 HB3 LYS B 150 -16.778 7.521 -4.227 1.00 0.25 H new ATOM 0 HG2 LYS B 150 -16.833 8.401 -1.806 1.00 0.72 H new ATOM 0 HG3 LYS B 150 -15.097 8.595 -1.946 1.00 0.72 H new ATOM 0 HD2 LYS B 150 -16.122 10.708 -2.507 1.00 0.81 H new ATOM 0 HD3 LYS B 150 -15.454 10.030 -3.979 1.00 0.81 H new ATOM 0 HE2 LYS B 150 -17.700 9.175 -4.614 1.00 1.28 H new ATOM 0 HE3 LYS B 150 -18.374 9.827 -3.134 1.00 1.28 H new ATOM 0 HZ1 LYS B 150 -18.756 11.305 -4.996 1.00 1.99 H new ATOM 0 HZ2 LYS B 150 -17.741 12.055 -3.859 1.00 1.99 H new ATOM 0 HZ3 LYS B 150 -17.088 11.423 -5.294 1.00 1.99 H new ATOM 1706 N LEU B 151 -14.910 4.479 -4.258 1.00 0.16 N ATOM 1707 CA LEU B 151 -14.762 3.429 -5.255 1.00 0.16 C ATOM 1708 C LEU B 151 -15.188 2.087 -4.672 1.00 0.15 C ATOM 1709 O LEU B 151 -15.946 1.339 -5.287 1.00 0.18 O ATOM 1710 CB LEU B 151 -13.310 3.360 -5.740 1.00 0.16 C ATOM 1711 CG LEU B 151 -13.045 2.360 -6.869 1.00 0.16 C ATOM 1712 CD1 LEU B 151 -14.026 2.566 -8.009 1.00 0.18 C ATOM 1713 CD2 LEU B 151 -11.613 2.486 -7.364 1.00 0.18 C ATOM 0 H LEU B 151 -14.029 4.816 -3.869 1.00 0.16 H new ATOM 0 HA LEU B 151 -15.403 3.660 -6.106 1.00 0.16 H new ATOM 0 HB2 LEU B 151 -13.009 4.352 -6.077 1.00 0.16 H new ATOM 0 HB3 LEU B 151 -12.673 3.104 -4.893 1.00 0.16 H new ATOM 0 HG LEU B 151 -13.187 1.353 -6.477 1.00 0.16 H new ATOM 0 HD11 LEU B 151 -13.820 1.846 -8.801 1.00 0.18 H new ATOM 0 HD12 LEU B 151 -15.043 2.424 -7.644 1.00 0.18 H new ATOM 0 HD13 LEU B 151 -13.920 3.577 -8.402 1.00 0.18 H new ATOM 0 HD21 LEU B 151 -11.441 1.768 -8.166 1.00 0.18 H new ATOM 0 HD22 LEU B 151 -11.445 3.496 -7.738 1.00 0.18 H new ATOM 0 HD23 LEU B 151 -10.925 2.284 -6.543 1.00 0.18 H new ATOM 1725 N ASN B 152 -14.681 1.791 -3.482 1.00 0.13 N ATOM 1726 CA ASN B 152 -15.016 0.553 -2.786 1.00 0.14 C ATOM 1727 C ASN B 152 -16.527 0.405 -2.649 1.00 0.17 C ATOM 1728 O ASN B 152 -17.108 -0.581 -3.102 1.00 0.21 O ATOM 1729 CB ASN B 152 -14.365 0.538 -1.403 1.00 0.20 C ATOM 1730 CG ASN B 152 -14.864 -0.604 -0.539 1.00 0.39 C ATOM 1731 OD1 ASN B 152 -15.859 -0.470 0.174 1.00 1.39 O ATOM 1732 ND2 ASN B 152 -14.170 -1.733 -0.597 1.00 0.69 N ATOM 0 H ASN B 152 -14.033 2.394 -2.976 1.00 0.13 H new ATOM 0 HA ASN B 152 -14.637 -0.285 -3.371 1.00 0.14 H new ATOM 0 HB2 ASN B 152 -13.284 0.459 -1.515 1.00 0.20 H new ATOM 0 HB3 ASN B 152 -14.565 1.484 -0.900 1.00 0.20 H new ATOM 0 HD21 ASN B 152 -14.455 -2.536 -0.036 1.00 0.69 H new ATOM 0 HD22 ASN B 152 -13.352 -1.798 -1.202 1.00 0.69 H new ATOM 1739 N ASP B 153 -17.153 1.393 -2.021 1.00 0.18 N ATOM 1740 CA ASP B 153 -18.598 1.383 -1.820 1.00 0.23 C ATOM 1741 C ASP B 153 -19.333 1.345 -3.157 1.00 0.25 C ATOM 1742 O ASP B 153 -20.460 0.858 -3.243 1.00 0.31 O ATOM 1743 CB ASP B 153 -19.031 2.614 -1.021 1.00 0.28 C ATOM 1744 CG ASP B 153 -20.529 2.655 -0.784 1.00 1.20 C ATOM 1745 OD1 ASP B 153 -21.004 1.954 0.133 1.00 1.04 O ATOM 1746 OD2 ASP B 153 -21.224 3.390 -1.516 1.00 2.25 O ATOM 0 H ASP B 153 -16.682 2.214 -1.641 1.00 0.18 H new ATOM 0 HA ASP B 153 -18.856 0.485 -1.259 1.00 0.23 H new ATOM 0 HB2 ASP B 153 -18.514 2.621 -0.061 1.00 0.28 H new ATOM 0 HB3 ASP B 153 -18.726 3.515 -1.554 1.00 0.28 H new ATOM 1751 N ALA B 154 -18.687 1.864 -4.196 1.00 0.23 N ATOM 1752 CA ALA B 154 -19.277 1.887 -5.530 1.00 0.28 C ATOM 1753 C ALA B 154 -19.443 0.474 -6.076 1.00 0.30 C ATOM 1754 O ALA B 154 -20.555 0.042 -6.380 1.00 0.35 O ATOM 1755 CB ALA B 154 -18.424 2.726 -6.471 1.00 0.28 C ATOM 0 H ALA B 154 -17.755 2.274 -4.140 1.00 0.23 H new ATOM 0 HA ALA B 154 -20.266 2.340 -5.458 1.00 0.28 H new ATOM 0 HB1 ALA B 154 -18.877 2.734 -7.463 1.00 0.28 H new ATOM 0 HB2 ALA B 154 -18.361 3.746 -6.093 1.00 0.28 H new ATOM 0 HB3 ALA B 154 -17.423 2.299 -6.533 1.00 0.28 H new ATOM 1761 N GLN B 155 -18.329 -0.242 -6.199 1.00 0.30 N ATOM 1762 CA GLN B 155 -18.355 -1.611 -6.702 1.00 0.35 C ATOM 1763 C GLN B 155 -19.005 -2.539 -5.684 1.00 0.36 C ATOM 1764 O GLN B 155 -19.425 -3.648 -6.017 1.00 0.44 O ATOM 1765 CB GLN B 155 -16.936 -2.096 -7.003 1.00 0.35 C ATOM 1766 CG GLN B 155 -16.141 -1.160 -7.895 1.00 0.36 C ATOM 1767 CD GLN B 155 -14.753 -1.691 -8.191 1.00 0.41 C ATOM 1768 OE1 GLN B 155 -14.533 -2.361 -9.200 1.00 0.51 O ATOM 1769 NE2 GLN B 155 -13.810 -1.405 -7.301 1.00 0.39 N ATOM 0 H GLN B 155 -17.400 0.102 -5.958 1.00 0.30 H new ATOM 0 HA GLN B 155 -18.940 -1.625 -7.622 1.00 0.35 H new ATOM 0 HB2 GLN B 155 -16.401 -2.227 -6.063 1.00 0.35 H new ATOM 0 HB3 GLN B 155 -16.991 -3.075 -7.478 1.00 0.35 H new ATOM 0 HG2 GLN B 155 -16.678 -1.010 -8.832 1.00 0.36 H new ATOM 0 HG3 GLN B 155 -16.060 -0.185 -7.415 1.00 0.36 H new ATOM 0 HE21 GLN B 155 -14.037 -0.846 -6.479 1.00 0.39 H new ATOM 0 HE22 GLN B 155 -12.858 -1.744 -7.440 1.00 0.39 H new