USER MOD reduce.3.24.130724 H: found=0, std=0, add=745, rem=0, adj=14 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 123 ASN : amide:sc= -5.87! K(o=-14!,f=-7.8) USER MOD Set 1.2: B 126 GLN : amide:sc= -7.52! K(o=-14!,f=-7.4) USER MOD Set 1.3: B 155 GLN : amide:sc= -0.877! K(o=-14!,f=-7.4) USER MOD Set 2.1: B 140 GLN : amide:sc= -0.37 K(o=-2.4,f=-3.5) USER MOD Set 2.2: B 143 ASN : amide:sc= -2.02! K(o=-2.4!,f=-0.29) USER MOD Set 3.1: B 121 ASN : amide:sc= -2.29! K(o=-8.2!,f=-2.2) USER MOD Set 3.2: B 152 ASN : amide:sc= -5.89! K(o=-8.2!,f=-2.2) USER MOD Set 4.1: A 39 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 40 GLN : amide:sc= -1.66! K(o=-3.6!,f=-0.76) USER MOD Set 4.3: A 43 ASN : amide:sc= -1.99! K(o=-3.6!,f=-0.76) USER MOD Set 5.1: A 23 ASN : amide:sc= -2.5! C(o=-5.6!,f=-16!) USER MOD Set 5.2: A 26 GLN : amide:sc= -2.36 K(o=-5.6,f=-6.2) USER MOD Set 5.3: A 55 GLN : amide:sc= -0.702 K(o=-5.6,f=-4.9) USER MOD Set 6.1: A 6 ASN : amide:sc= -7.16! K(o=-9.2!,f=-4.3) USER MOD Set 6.2: A 9 GLN : amide:sc= -2.01! K(o=-9.2!,f=-5.8) USER MOD Single : A 7 LYS NZ :NH3+ -144:sc= -1.61 (180deg=-4.05!) USER MOD Single : A 10 GLN : amide:sc= -1.24 K(o=-1.2,f=-5.3!) USER MOD Single : A 11 ASN : amide:sc= -0.133 X(o=-0.13,f=-0.5) USER MOD Single : A 14 TYR OH : rot 12:sc= -0.269 USER MOD Single : A 18 HIS : no HD1:sc= -0.162 X(o=-0.16,f=0) USER MOD Single : A 21 ASN : amide:sc= -1.19 X(o=-1.2,f=-1) USER MOD Single : A 28 ASN : amide:sc= -3.63 K(o=-3.6,f=-5.9!) USER MOD Single : A 32 GLN : amide:sc= -3.67! C(o=-3.7!,f=-2.2!) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -129:sc= -0.437 (180deg=-2.84!) USER MOD Single : A 41 SER OG : rot 81:sc= 0.896 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= -1.95 K(o=-1.9,f=-14!) USER MOD Single : B 109 THR OG1 : rot 30:sc= -0.64 USER MOD Single : B 110 GLN : amide:sc= -0.584 K(o=-0.58,f=0) USER MOD Single : B 113 SER OG : rot 84:sc= 1 USER MOD Single : B 118 THR OG1 : rot 180:sc= -0.0986 USER MOD Single : B 132 SER OG : rot 180:sc= 0 USER MOD Single : B 133 SER OG : rot 150:sc= -0.226 USER MOD Single : B 139 SER OG : rot 180:sc= 0 USER MOD Single : B 141 SER OG : rot 180:sc= -1.03 USER MOD Single : B 149 LYS NZ :NH3+ 156:sc= -2.52 (180deg=-3.23!) USER MOD Single : B 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 87 N ASN A 6 -4.907 -9.972 7.664 1.00 0.35 N ATOM 88 CA ASN A 6 -4.332 -10.378 8.939 1.00 0.37 C ATOM 89 C ASN A 6 -3.261 -9.400 9.413 1.00 0.37 C ATOM 90 O ASN A 6 -3.110 -8.311 8.860 1.00 0.36 O ATOM 91 CB ASN A 6 -3.747 -11.785 8.828 1.00 0.36 C ATOM 92 CG ASN A 6 -2.710 -11.897 7.732 1.00 0.97 C ATOM 93 OD1 ASN A 6 -3.041 -12.133 6.570 1.00 1.73 O ATOM 94 ND2 ASN A 6 -1.449 -11.737 8.097 1.00 1.69 N ATOM 0 HA ASN A 6 -5.133 -10.377 9.679 1.00 0.37 H new ATOM 0 HB2 ASN A 6 -3.296 -12.063 9.780 1.00 0.36 H new ATOM 0 HB3 ASN A 6 -4.551 -12.495 8.637 1.00 0.36 H new ATOM 0 HD21 ASN A 6 -0.704 -11.808 7.403 1.00 1.69 H new ATOM 0 HD22 ASN A 6 -1.221 -11.543 9.072 1.00 1.69 H new ATOM 101 N LYS A 7 -2.518 -9.803 10.440 1.00 0.40 N ATOM 102 CA LYS A 7 -1.463 -8.966 11.001 1.00 0.43 C ATOM 103 C LYS A 7 -0.267 -8.878 10.056 1.00 0.40 C ATOM 104 O LYS A 7 0.237 -7.788 9.781 1.00 0.38 O ATOM 105 CB LYS A 7 -1.021 -9.516 12.360 1.00 0.52 C ATOM 106 CG LYS A 7 0.134 -8.751 12.994 1.00 0.58 C ATOM 107 CD LYS A 7 -0.221 -7.293 13.259 1.00 0.60 C ATOM 108 CE LYS A 7 -1.106 -7.135 14.487 1.00 1.39 C ATOM 109 NZ LYS A 7 -2.491 -7.629 14.251 1.00 1.90 N ATOM 0 H LYS A 7 -2.628 -10.706 10.901 1.00 0.40 H new ATOM 0 HA LYS A 7 -1.864 -7.961 11.134 1.00 0.43 H new ATOM 0 HB2 LYS A 7 -1.872 -9.499 13.041 1.00 0.52 H new ATOM 0 HB3 LYS A 7 -0.730 -10.559 12.240 1.00 0.52 H new ATOM 0 HG2 LYS A 7 0.415 -9.231 13.931 1.00 0.58 H new ATOM 0 HG3 LYS A 7 1.003 -8.799 12.338 1.00 0.58 H new ATOM 0 HD2 LYS A 7 0.694 -6.716 13.395 1.00 0.60 H new ATOM 0 HD3 LYS A 7 -0.732 -6.880 12.389 1.00 0.60 H new ATOM 0 HE2 LYS A 7 -0.666 -7.679 15.322 1.00 1.39 H new ATOM 0 HE3 LYS A 7 -1.141 -6.084 14.774 1.00 1.39 H new ATOM 0 HZ1 LYS A 7 -3.167 -7.023 14.759 1.00 1.90 H new ATOM 0 HZ2 LYS A 7 -2.700 -7.603 13.233 1.00 1.90 H new ATOM 0 HZ3 LYS A 7 -2.575 -8.606 14.597 1.00 1.90 H new ATOM 123 N GLU A 8 0.182 -10.028 9.561 1.00 0.43 N ATOM 124 CA GLU A 8 1.319 -10.069 8.648 1.00 0.43 C ATOM 125 C GLU A 8 1.029 -9.259 7.389 1.00 0.37 C ATOM 126 O GLU A 8 1.943 -8.730 6.756 1.00 0.39 O ATOM 127 CB GLU A 8 1.662 -11.512 8.279 1.00 0.47 C ATOM 128 CG GLU A 8 2.047 -12.368 9.474 1.00 0.52 C ATOM 129 CD GLU A 8 2.408 -13.788 9.084 1.00 1.03 C ATOM 130 OE1 GLU A 8 3.588 -14.030 8.755 1.00 1.80 O ATOM 131 OE2 GLU A 8 1.512 -14.657 9.109 1.00 0.95 O ATOM 0 H GLU A 8 -0.222 -10.940 9.776 1.00 0.43 H new ATOM 0 HA GLU A 8 2.176 -9.626 9.155 1.00 0.43 H new ATOM 0 HB2 GLU A 8 0.805 -11.964 7.779 1.00 0.47 H new ATOM 0 HB3 GLU A 8 2.484 -11.510 7.563 1.00 0.47 H new ATOM 0 HG2 GLU A 8 2.893 -11.910 9.986 1.00 0.52 H new ATOM 0 HG3 GLU A 8 1.219 -12.389 10.182 1.00 0.52 H new ATOM 138 N GLN A 9 -0.250 -9.168 7.029 1.00 0.34 N ATOM 139 CA GLN A 9 -0.659 -8.410 5.852 1.00 0.33 C ATOM 140 C GLN A 9 -0.555 -6.913 6.122 1.00 0.30 C ATOM 141 O GLN A 9 -0.338 -6.117 5.207 1.00 0.32 O ATOM 142 CB GLN A 9 -2.088 -8.774 5.449 1.00 0.36 C ATOM 143 CG GLN A 9 -2.163 -9.805 4.335 1.00 0.38 C ATOM 144 CD GLN A 9 -3.588 -10.105 3.913 1.00 0.73 C ATOM 145 OE1 GLN A 9 -4.241 -10.986 4.471 1.00 1.44 O ATOM 146 NE2 GLN A 9 -4.076 -9.375 2.917 1.00 0.50 N ATOM 0 H GLN A 9 -1.018 -9.609 7.535 1.00 0.34 H new ATOM 0 HA GLN A 9 0.010 -8.666 5.030 1.00 0.33 H new ATOM 0 HB2 GLN A 9 -2.617 -9.156 6.322 1.00 0.36 H new ATOM 0 HB3 GLN A 9 -2.608 -7.870 5.132 1.00 0.36 H new ATOM 0 HG2 GLN A 9 -1.601 -9.445 3.473 1.00 0.38 H new ATOM 0 HG3 GLN A 9 -1.684 -10.727 4.665 1.00 0.38 H new ATOM 0 HE21 GLN A 9 -3.499 -8.654 2.483 1.00 0.50 H new ATOM 0 HE22 GLN A 9 -5.028 -9.535 2.586 1.00 0.50 H new ATOM 155 N GLN A 10 -0.713 -6.540 7.387 1.00 0.27 N ATOM 156 CA GLN A 10 -0.630 -5.143 7.794 1.00 0.25 C ATOM 157 C GLN A 10 0.823 -4.692 7.840 1.00 0.23 C ATOM 158 O GLN A 10 1.174 -3.630 7.325 1.00 0.26 O ATOM 159 CB GLN A 10 -1.284 -4.958 9.166 1.00 0.26 C ATOM 160 CG GLN A 10 -1.710 -3.528 9.449 1.00 0.26 C ATOM 161 CD GLN A 10 -0.700 -2.766 10.284 1.00 0.64 C ATOM 162 OE1 GLN A 10 0.495 -3.058 10.258 1.00 1.18 O ATOM 163 NE2 GLN A 10 -1.179 -1.773 11.025 1.00 0.89 N ATOM 0 H GLN A 10 -0.900 -7.189 8.151 1.00 0.27 H new ATOM 0 HA GLN A 10 -1.161 -4.532 7.064 1.00 0.25 H new ATOM 0 HB2 GLN A 10 -2.156 -5.608 9.234 1.00 0.26 H new ATOM 0 HB3 GLN A 10 -0.586 -5.280 9.938 1.00 0.26 H new ATOM 0 HG2 GLN A 10 -1.861 -3.006 8.504 1.00 0.26 H new ATOM 0 HG3 GLN A 10 -2.670 -3.536 9.966 1.00 0.26 H new ATOM 0 HE21 GLN A 10 -2.178 -1.566 11.016 1.00 0.89 H new ATOM 0 HE22 GLN A 10 -0.548 -1.218 11.603 1.00 0.89 H new ATOM 172 N ASN A 11 1.661 -5.510 8.465 1.00 0.24 N ATOM 173 CA ASN A 11 3.084 -5.215 8.578 1.00 0.23 C ATOM 174 C ASN A 11 3.734 -5.144 7.198 1.00 0.21 C ATOM 175 O ASN A 11 4.394 -4.163 6.865 1.00 0.22 O ATOM 176 CB ASN A 11 3.781 -6.282 9.425 1.00 0.27 C ATOM 177 CG ASN A 11 3.155 -6.436 10.797 1.00 0.72 C ATOM 178 OD1 ASN A 11 2.625 -5.479 11.363 1.00 1.08 O ATOM 179 ND2 ASN A 11 3.215 -7.646 11.341 1.00 0.82 N ATOM 0 H ASN A 11 1.378 -6.387 8.903 1.00 0.24 H new ATOM 0 HA ASN A 11 3.192 -4.245 9.064 1.00 0.23 H new ATOM 0 HB2 ASN A 11 3.743 -7.238 8.903 1.00 0.27 H new ATOM 0 HB3 ASN A 11 4.834 -6.022 9.537 1.00 0.27 H new ATOM 0 HD21 ASN A 11 2.812 -7.811 12.263 1.00 0.82 H new ATOM 0 HD22 ASN A 11 3.664 -8.410 10.836 1.00 0.82 H new ATOM 186 N ALA A 12 3.534 -6.191 6.399 1.00 0.19 N ATOM 187 CA ALA A 12 4.102 -6.257 5.054 1.00 0.18 C ATOM 188 C ALA A 12 3.791 -4.998 4.254 1.00 0.15 C ATOM 189 O ALA A 12 4.637 -4.496 3.513 1.00 0.20 O ATOM 190 CB ALA A 12 3.582 -7.488 4.323 1.00 0.22 C ATOM 0 H ALA A 12 2.981 -7.007 6.661 1.00 0.19 H new ATOM 0 HA ALA A 12 5.185 -6.330 5.152 1.00 0.18 H new ATOM 0 HB1 ALA A 12 4.012 -7.526 3.322 1.00 0.22 H new ATOM 0 HB2 ALA A 12 3.865 -8.385 4.874 1.00 0.22 H new ATOM 0 HB3 ALA A 12 2.496 -7.435 4.249 1.00 0.22 H new ATOM 196 N PHE A 13 2.574 -4.496 4.409 1.00 0.13 N ATOM 197 CA PHE A 13 2.140 -3.295 3.707 1.00 0.11 C ATOM 198 C PHE A 13 3.048 -2.111 4.030 1.00 0.11 C ATOM 199 O PHE A 13 3.681 -1.541 3.143 1.00 0.15 O ATOM 200 CB PHE A 13 0.692 -2.970 4.088 1.00 0.14 C ATOM 201 CG PHE A 13 0.195 -1.653 3.562 1.00 0.12 C ATOM 202 CD1 PHE A 13 -0.382 -1.567 2.304 1.00 0.12 C ATOM 203 CD2 PHE A 13 0.312 -0.500 4.321 1.00 0.13 C ATOM 204 CE1 PHE A 13 -0.832 -0.357 1.815 1.00 0.11 C ATOM 205 CE2 PHE A 13 -0.138 0.712 3.838 1.00 0.13 C ATOM 206 CZ PHE A 13 -0.739 0.780 2.599 1.00 0.11 C ATOM 0 H PHE A 13 1.865 -4.904 5.018 1.00 0.13 H new ATOM 0 HA PHE A 13 2.200 -3.481 2.635 1.00 0.11 H new ATOM 0 HB2 PHE A 13 0.044 -3.764 3.717 1.00 0.14 H new ATOM 0 HB3 PHE A 13 0.606 -2.970 5.175 1.00 0.14 H new ATOM 0 HD1 PHE A 13 -0.480 -2.457 1.700 1.00 0.12 H new ATOM 0 HD2 PHE A 13 0.761 -0.550 5.302 1.00 0.13 H new ATOM 0 HE1 PHE A 13 -1.256 -0.298 0.823 1.00 0.11 H new ATOM 0 HE2 PHE A 13 -0.019 1.607 4.431 1.00 0.13 H new ATOM 0 HZ PHE A 13 -1.136 1.718 2.241 1.00 0.11 H new ATOM 216 N TYR A 14 3.113 -1.759 5.309 1.00 0.11 N ATOM 217 CA TYR A 14 3.926 -0.633 5.756 1.00 0.13 C ATOM 218 C TYR A 14 5.409 -0.839 5.455 1.00 0.13 C ATOM 219 O TYR A 14 6.077 0.077 4.980 1.00 0.17 O ATOM 220 CB TYR A 14 3.721 -0.398 7.250 1.00 0.16 C ATOM 221 CG TYR A 14 2.367 0.186 7.584 1.00 0.19 C ATOM 222 CD1 TYR A 14 2.027 1.471 7.180 1.00 0.24 C ATOM 223 CD2 TYR A 14 1.433 -0.542 8.309 1.00 0.26 C ATOM 224 CE1 TYR A 14 0.796 2.014 7.491 1.00 0.31 C ATOM 225 CE2 TYR A 14 0.198 -0.006 8.621 1.00 0.32 C ATOM 226 CZ TYR A 14 -0.114 1.272 8.211 1.00 0.33 C ATOM 227 OH TYR A 14 -1.338 1.813 8.528 1.00 0.42 O ATOM 0 H TYR A 14 2.611 -2.238 6.057 1.00 0.11 H new ATOM 0 HA TYR A 14 3.599 0.246 5.201 1.00 0.13 H new ATOM 0 HB2 TYR A 14 3.842 -1.343 7.779 1.00 0.16 H new ATOM 0 HB3 TYR A 14 4.498 0.273 7.615 1.00 0.16 H new ATOM 0 HD1 TYR A 14 2.737 2.055 6.613 1.00 0.24 H new ATOM 0 HD2 TYR A 14 1.675 -1.543 8.634 1.00 0.26 H new ATOM 0 HE1 TYR A 14 0.548 3.015 7.171 1.00 0.31 H new ATOM 0 HE2 TYR A 14 -0.519 -0.586 9.183 1.00 0.32 H new ATOM 0 HH TYR A 14 -1.474 2.637 8.016 1.00 0.42 H new ATOM 237 N GLU A 15 5.922 -2.035 5.733 1.00 0.11 N ATOM 238 CA GLU A 15 7.330 -2.331 5.489 1.00 0.12 C ATOM 239 C GLU A 15 7.700 -2.045 4.037 1.00 0.12 C ATOM 240 O GLU A 15 8.857 -1.761 3.724 1.00 0.19 O ATOM 241 CB GLU A 15 7.640 -3.791 5.831 1.00 0.13 C ATOM 242 CG GLU A 15 7.481 -4.118 7.307 1.00 0.19 C ATOM 243 CD GLU A 15 8.361 -3.259 8.194 1.00 1.16 C ATOM 244 OE1 GLU A 15 9.513 -3.662 8.456 1.00 1.08 O ATOM 245 OE2 GLU A 15 7.897 -2.183 8.627 1.00 2.16 O ATOM 0 H GLU A 15 5.387 -2.810 6.125 1.00 0.11 H new ATOM 0 HA GLU A 15 7.926 -1.685 6.133 1.00 0.12 H new ATOM 0 HB2 GLU A 15 6.982 -4.439 5.251 1.00 0.13 H new ATOM 0 HB3 GLU A 15 8.661 -4.018 5.525 1.00 0.13 H new ATOM 0 HG2 GLU A 15 6.439 -3.982 7.595 1.00 0.19 H new ATOM 0 HG3 GLU A 15 7.722 -5.168 7.470 1.00 0.19 H new ATOM 252 N ILE A 16 6.710 -2.128 3.156 1.00 0.10 N ATOM 253 CA ILE A 16 6.918 -1.869 1.738 1.00 0.09 C ATOM 254 C ILE A 16 6.935 -0.367 1.456 1.00 0.12 C ATOM 255 O ILE A 16 7.669 0.104 0.586 1.00 0.16 O ATOM 256 CB ILE A 16 5.828 -2.561 0.891 1.00 0.10 C ATOM 257 CG1 ILE A 16 6.096 -4.066 0.827 1.00 0.12 C ATOM 258 CG2 ILE A 16 5.759 -1.968 -0.511 1.00 0.12 C ATOM 259 CD1 ILE A 16 4.961 -4.861 0.219 1.00 0.14 C ATOM 0 H ILE A 16 5.751 -2.374 3.401 1.00 0.10 H new ATOM 0 HA ILE A 16 7.888 -2.282 1.459 1.00 0.09 H new ATOM 0 HB ILE A 16 4.863 -2.392 1.368 1.00 0.10 H new ATOM 0 HG12 ILE A 16 7.002 -4.240 0.246 1.00 0.12 H new ATOM 0 HG13 ILE A 16 6.287 -4.435 1.835 1.00 0.12 H new ATOM 0 HG21 ILE A 16 4.982 -2.476 -1.083 1.00 0.12 H new ATOM 0 HG22 ILE A 16 5.525 -0.905 -0.446 1.00 0.12 H new ATOM 0 HG23 ILE A 16 6.720 -2.098 -1.009 1.00 0.12 H new ATOM 0 HD11 ILE A 16 5.223 -5.919 0.207 1.00 0.14 H new ATOM 0 HD12 ILE A 16 4.058 -4.718 0.812 1.00 0.14 H new ATOM 0 HD13 ILE A 16 4.783 -4.520 -0.801 1.00 0.14 H new ATOM 271 N LEU A 17 6.124 0.381 2.202 1.00 0.14 N ATOM 272 CA LEU A 17 6.049 1.832 2.042 1.00 0.19 C ATOM 273 C LEU A 17 7.276 2.515 2.648 1.00 0.18 C ATOM 274 O LEU A 17 7.738 3.541 2.149 1.00 0.26 O ATOM 275 CB LEU A 17 4.786 2.377 2.709 1.00 0.27 C ATOM 276 CG LEU A 17 3.539 2.393 1.825 1.00 0.35 C ATOM 277 CD1 LEU A 17 2.897 1.015 1.771 1.00 0.80 C ATOM 278 CD2 LEU A 17 2.551 3.431 2.330 1.00 0.77 C ATOM 0 H LEU A 17 5.509 0.006 2.924 1.00 0.14 H new ATOM 0 HA LEU A 17 6.018 2.047 0.974 1.00 0.19 H new ATOM 0 HB2 LEU A 17 4.576 1.779 3.596 1.00 0.27 H new ATOM 0 HB3 LEU A 17 4.984 3.393 3.049 1.00 0.27 H new ATOM 0 HG LEU A 17 3.836 2.663 0.812 1.00 0.35 H new ATOM 0 HD11 LEU A 17 2.012 1.051 1.136 1.00 0.80 H new ATOM 0 HD12 LEU A 17 3.608 0.298 1.361 1.00 0.80 H new ATOM 0 HD13 LEU A 17 2.610 0.708 2.777 1.00 0.80 H new ATOM 0 HD21 LEU A 17 1.667 3.433 1.692 1.00 0.77 H new ATOM 0 HD22 LEU A 17 2.260 3.189 3.352 1.00 0.77 H new ATOM 0 HD23 LEU A 17 3.016 4.417 2.308 1.00 0.77 H new ATOM 290 N HIS A 18 7.797 1.932 3.725 1.00 0.16 N ATOM 291 CA HIS A 18 8.955 2.484 4.425 1.00 0.16 C ATOM 292 C HIS A 18 10.210 2.463 3.557 1.00 0.13 C ATOM 293 O HIS A 18 11.084 3.318 3.706 1.00 0.15 O ATOM 294 CB HIS A 18 9.207 1.710 5.722 1.00 0.17 C ATOM 295 CG HIS A 18 8.220 2.015 6.807 1.00 0.25 C ATOM 296 ND1 HIS A 18 8.543 1.989 8.148 1.00 0.58 N ATOM 297 CD2 HIS A 18 6.908 2.351 6.747 1.00 0.28 C ATOM 298 CE1 HIS A 18 7.475 2.293 8.864 1.00 0.60 C ATOM 299 NE2 HIS A 18 6.470 2.517 8.038 1.00 0.33 N ATOM 0 H HIS A 18 7.433 1.072 4.134 1.00 0.16 H new ATOM 0 HA HIS A 18 8.729 3.525 4.658 1.00 0.16 H new ATOM 0 HB2 HIS A 18 9.180 0.642 5.508 1.00 0.17 H new ATOM 0 HB3 HIS A 18 10.211 1.938 6.081 1.00 0.17 H new ATOM 0 HD2 HIS A 18 6.317 2.467 5.850 1.00 0.28 H new ATOM 0 HE1 HIS A 18 7.432 2.349 9.942 1.00 0.60 H new ATOM 0 HE2 HIS A 18 5.522 2.772 8.314 1.00 0.33 H new ATOM 308 N LEU A 19 10.300 1.485 2.661 1.00 0.14 N ATOM 309 CA LEU A 19 11.455 1.362 1.776 1.00 0.14 C ATOM 310 C LEU A 19 11.775 2.705 1.115 1.00 0.16 C ATOM 311 O LEU A 19 10.974 3.226 0.338 1.00 0.18 O ATOM 312 CB LEU A 19 11.194 0.293 0.713 1.00 0.12 C ATOM 313 CG LEU A 19 10.982 -1.121 1.261 1.00 0.11 C ATOM 314 CD1 LEU A 19 10.648 -2.086 0.137 1.00 0.13 C ATOM 315 CD2 LEU A 19 12.217 -1.591 2.018 1.00 0.12 C ATOM 0 H LEU A 19 9.588 0.767 2.528 1.00 0.14 H new ATOM 0 HA LEU A 19 12.317 1.061 2.372 1.00 0.14 H new ATOM 0 HB2 LEU A 19 10.314 0.580 0.138 1.00 0.12 H new ATOM 0 HB3 LEU A 19 12.036 0.276 0.021 1.00 0.12 H new ATOM 0 HG LEU A 19 10.141 -1.097 1.954 1.00 0.11 H new ATOM 0 HD11 LEU A 19 10.501 -3.085 0.547 1.00 0.13 H new ATOM 0 HD12 LEU A 19 9.735 -1.761 -0.362 1.00 0.13 H new ATOM 0 HD13 LEU A 19 11.468 -2.105 -0.581 1.00 0.13 H new ATOM 0 HD21 LEU A 19 12.048 -2.598 2.400 1.00 0.12 H new ATOM 0 HD22 LEU A 19 13.075 -1.597 1.346 1.00 0.12 H new ATOM 0 HD23 LEU A 19 12.413 -0.915 2.850 1.00 0.12 H new ATOM 327 N PRO A 20 12.957 3.286 1.415 1.00 0.18 N ATOM 328 CA PRO A 20 13.364 4.581 0.863 1.00 0.21 C ATOM 329 C PRO A 20 13.887 4.491 -0.568 1.00 0.21 C ATOM 330 O PRO A 20 13.459 5.247 -1.440 1.00 0.23 O ATOM 331 CB PRO A 20 14.478 5.021 1.810 1.00 0.24 C ATOM 332 CG PRO A 20 15.095 3.750 2.285 1.00 0.22 C ATOM 333 CD PRO A 20 13.994 2.721 2.306 1.00 0.19 C ATOM 0 HA PRO A 20 12.524 5.273 0.800 1.00 0.21 H new ATOM 0 HB2 PRO A 20 15.208 5.648 1.298 1.00 0.24 H new ATOM 0 HB3 PRO A 20 14.083 5.605 2.642 1.00 0.24 H new ATOM 0 HG2 PRO A 20 15.903 3.440 1.623 1.00 0.22 H new ATOM 0 HG3 PRO A 20 15.527 3.876 3.278 1.00 0.22 H new ATOM 0 HD2 PRO A 20 14.345 1.754 1.946 1.00 0.19 H new ATOM 0 HD3 PRO A 20 13.612 2.566 3.315 1.00 0.19 H new ATOM 341 N ASN A 21 14.813 3.568 -0.804 1.00 0.20 N ATOM 342 CA ASN A 21 15.394 3.396 -2.129 1.00 0.21 C ATOM 343 C ASN A 21 14.339 2.946 -3.133 1.00 0.20 C ATOM 344 O ASN A 21 14.446 3.229 -4.328 1.00 0.23 O ATOM 345 CB ASN A 21 16.542 2.388 -2.078 1.00 0.21 C ATOM 346 CG ASN A 21 17.680 2.860 -1.191 1.00 0.26 C ATOM 347 OD1 ASN A 21 17.931 4.058 -1.071 1.00 0.30 O ATOM 348 ND2 ASN A 21 18.374 1.917 -0.562 1.00 0.26 N ATOM 0 H ASN A 21 15.176 2.929 -0.097 1.00 0.20 H new ATOM 0 HA ASN A 21 15.785 4.359 -2.456 1.00 0.21 H new ATOM 0 HB2 ASN A 21 16.168 1.433 -1.709 1.00 0.21 H new ATOM 0 HB3 ASN A 21 16.917 2.216 -3.087 1.00 0.21 H new ATOM 0 HD21 ASN A 21 19.149 2.176 0.049 1.00 0.26 H new ATOM 0 HD22 ASN A 21 18.132 0.935 -0.690 1.00 0.26 H new ATOM 355 N LEU A 22 13.318 2.249 -2.645 1.00 0.18 N ATOM 356 CA LEU A 22 12.240 1.773 -3.503 1.00 0.17 C ATOM 357 C LEU A 22 11.344 2.936 -3.912 1.00 0.20 C ATOM 358 O LEU A 22 10.941 3.741 -3.073 1.00 0.26 O ATOM 359 CB LEU A 22 11.407 0.710 -2.782 1.00 0.17 C ATOM 360 CG LEU A 22 10.618 -0.227 -3.700 1.00 0.17 C ATOM 361 CD1 LEU A 22 11.500 -1.368 -4.180 1.00 0.29 C ATOM 362 CD2 LEU A 22 9.387 -0.765 -2.986 1.00 0.26 C ATOM 0 H LEU A 22 13.215 2.002 -1.661 1.00 0.18 H new ATOM 0 HA LEU A 22 12.682 1.328 -4.394 1.00 0.17 H new ATOM 0 HB2 LEU A 22 12.071 0.110 -2.160 1.00 0.17 H new ATOM 0 HB3 LEU A 22 10.708 1.211 -2.112 1.00 0.17 H new ATOM 0 HG LEU A 22 10.287 0.341 -4.569 1.00 0.17 H new ATOM 0 HD11 LEU A 22 10.923 -2.024 -4.831 1.00 0.29 H new ATOM 0 HD12 LEU A 22 12.349 -0.964 -4.731 1.00 0.29 H new ATOM 0 HD13 LEU A 22 11.861 -1.935 -3.322 1.00 0.29 H new ATOM 0 HD21 LEU A 22 8.839 -1.429 -3.655 1.00 0.26 H new ATOM 0 HD22 LEU A 22 9.694 -1.317 -2.098 1.00 0.26 H new ATOM 0 HD23 LEU A 22 8.744 0.065 -2.693 1.00 0.26 H new ATOM 374 N ASN A 23 11.034 3.023 -5.201 1.00 0.22 N ATOM 375 CA ASN A 23 10.185 4.098 -5.701 1.00 0.27 C ATOM 376 C ASN A 23 8.722 3.676 -5.702 1.00 0.24 C ATOM 377 O ASN A 23 8.395 2.546 -5.342 1.00 0.29 O ATOM 378 CB ASN A 23 10.614 4.522 -7.108 1.00 0.33 C ATOM 379 CG ASN A 23 10.543 3.386 -8.107 1.00 0.75 C ATOM 380 OD1 ASN A 23 10.684 2.219 -7.747 1.00 1.59 O ATOM 381 ND2 ASN A 23 10.326 3.724 -9.373 1.00 1.33 N ATOM 0 H ASN A 23 11.355 2.368 -5.914 1.00 0.22 H new ATOM 0 HA ASN A 23 10.299 4.952 -5.033 1.00 0.27 H new ATOM 0 HB2 ASN A 23 9.977 5.339 -7.447 1.00 0.33 H new ATOM 0 HB3 ASN A 23 11.633 4.906 -7.072 1.00 0.33 H new ATOM 0 HD21 ASN A 23 10.271 3.002 -10.091 1.00 1.33 H new ATOM 0 HD22 ASN A 23 10.215 4.706 -9.627 1.00 1.33 H new ATOM 388 N GLU A 24 7.845 4.586 -6.110 1.00 0.29 N ATOM 389 CA GLU A 24 6.419 4.299 -6.144 1.00 0.29 C ATOM 390 C GLU A 24 6.081 3.295 -7.246 1.00 0.24 C ATOM 391 O GLU A 24 5.166 2.488 -7.096 1.00 0.22 O ATOM 392 CB GLU A 24 5.619 5.587 -6.331 1.00 0.36 C ATOM 393 CG GLU A 24 5.645 6.103 -7.752 1.00 1.23 C ATOM 394 CD GLU A 24 6.928 6.837 -8.087 1.00 1.42 C ATOM 395 OE1 GLU A 24 7.897 6.175 -8.516 1.00 1.25 O ATOM 396 OE2 GLU A 24 6.966 8.075 -7.919 1.00 2.17 O ATOM 0 H GLU A 24 8.096 5.525 -6.420 1.00 0.29 H new ATOM 0 HA GLU A 24 6.145 3.852 -5.188 1.00 0.29 H new ATOM 0 HB2 GLU A 24 4.585 5.411 -6.034 1.00 0.36 H new ATOM 0 HB3 GLU A 24 6.016 6.354 -5.666 1.00 0.36 H new ATOM 0 HG2 GLU A 24 5.520 5.267 -8.440 1.00 1.23 H new ATOM 0 HG3 GLU A 24 4.798 6.772 -7.906 1.00 1.23 H new ATOM 403 N GLU A 25 6.821 3.345 -8.350 1.00 0.27 N ATOM 404 CA GLU A 25 6.586 2.432 -9.465 1.00 0.28 C ATOM 405 C GLU A 25 6.691 0.982 -9.006 1.00 0.24 C ATOM 406 O GLU A 25 5.817 0.164 -9.293 1.00 0.30 O ATOM 407 CB GLU A 25 7.584 2.693 -10.592 1.00 0.36 C ATOM 408 CG GLU A 25 7.510 4.100 -11.162 1.00 0.91 C ATOM 409 CD GLU A 25 8.572 4.359 -12.213 1.00 1.60 C ATOM 410 OE1 GLU A 25 8.349 3.990 -13.385 1.00 2.00 O ATOM 411 OE2 GLU A 25 9.625 4.932 -11.863 1.00 2.20 O ATOM 0 H GLU A 25 7.585 4.005 -8.497 1.00 0.27 H new ATOM 0 HA GLU A 25 5.577 2.609 -9.839 1.00 0.28 H new ATOM 0 HB2 GLU A 25 8.593 2.514 -10.220 1.00 0.36 H new ATOM 0 HB3 GLU A 25 7.408 1.976 -11.394 1.00 0.36 H new ATOM 0 HG2 GLU A 25 6.524 4.260 -11.599 1.00 0.91 H new ATOM 0 HG3 GLU A 25 7.621 4.822 -10.353 1.00 0.91 H new ATOM 418 N GLN A 26 7.768 0.674 -8.290 1.00 0.18 N ATOM 419 CA GLN A 26 7.992 -0.674 -7.784 1.00 0.15 C ATOM 420 C GLN A 26 7.050 -0.973 -6.625 1.00 0.13 C ATOM 421 O GLN A 26 6.413 -2.026 -6.584 1.00 0.16 O ATOM 422 CB GLN A 26 9.447 -0.832 -7.340 1.00 0.15 C ATOM 423 CG GLN A 26 10.443 -0.627 -8.467 1.00 0.19 C ATOM 424 CD GLN A 26 11.871 -0.505 -7.974 1.00 1.03 C ATOM 425 OE1 GLN A 26 12.121 -0.021 -6.870 1.00 2.00 O ATOM 426 NE2 GLN A 26 12.820 -0.945 -8.792 1.00 1.59 N ATOM 0 H GLN A 26 8.500 1.342 -8.047 1.00 0.18 H new ATOM 0 HA GLN A 26 7.788 -1.385 -8.584 1.00 0.15 H new ATOM 0 HB2 GLN A 26 9.657 -0.117 -6.544 1.00 0.15 H new ATOM 0 HB3 GLN A 26 9.585 -1.828 -6.919 1.00 0.15 H new ATOM 0 HG2 GLN A 26 10.374 -1.463 -9.163 1.00 0.19 H new ATOM 0 HG3 GLN A 26 10.177 0.273 -9.022 1.00 0.19 H new ATOM 0 HE21 GLN A 26 12.569 -1.339 -9.699 1.00 1.59 H new ATOM 0 HE22 GLN A 26 13.800 -0.889 -8.514 1.00 1.59 H new ATOM 435 N ARG A 27 6.968 -0.034 -5.686 1.00 0.13 N ATOM 436 CA ARG A 27 6.103 -0.180 -4.519 1.00 0.13 C ATOM 437 C ARG A 27 4.669 -0.503 -4.933 1.00 0.14 C ATOM 438 O ARG A 27 3.992 -1.303 -4.287 1.00 0.23 O ATOM 439 CB ARG A 27 6.125 1.102 -3.685 1.00 0.14 C ATOM 440 CG ARG A 27 5.211 1.057 -2.472 1.00 0.18 C ATOM 441 CD ARG A 27 5.193 2.390 -1.744 1.00 0.41 C ATOM 442 NE ARG A 27 6.532 2.807 -1.338 1.00 1.59 N ATOM 443 CZ ARG A 27 7.074 3.976 -1.665 1.00 1.94 C ATOM 444 NH1 ARG A 27 6.401 4.839 -2.414 1.00 1.37 N ATOM 445 NH2 ARG A 27 8.294 4.281 -1.246 1.00 3.04 N ATOM 0 H ARG A 27 7.493 0.840 -5.711 1.00 0.13 H new ATOM 0 HA ARG A 27 6.482 -1.008 -3.920 1.00 0.13 H new ATOM 0 HB2 ARG A 27 7.146 1.291 -3.353 1.00 0.14 H new ATOM 0 HB3 ARG A 27 5.834 1.941 -4.317 1.00 0.14 H new ATOM 0 HG2 ARG A 27 4.200 0.798 -2.786 1.00 0.18 H new ATOM 0 HG3 ARG A 27 5.544 0.273 -1.792 1.00 0.18 H new ATOM 0 HD2 ARG A 27 4.756 3.151 -2.391 1.00 0.41 H new ATOM 0 HD3 ARG A 27 4.554 2.315 -0.864 1.00 0.41 H new ATOM 0 HE ARG A 27 7.084 2.164 -0.770 1.00 1.59 H new ATOM 0 HH11 ARG A 27 5.463 4.607 -2.742 1.00 1.37 H new ATOM 0 HH12 ARG A 27 6.821 5.735 -2.662 1.00 1.37 H new ATOM 0 HH21 ARG A 27 8.817 3.619 -0.673 1.00 3.04 H new ATOM 0 HH22 ARG A 27 8.710 5.178 -1.497 1.00 3.04 H new ATOM 459 N ASN A 28 4.209 0.126 -6.012 1.00 0.13 N ATOM 460 CA ASN A 28 2.856 -0.097 -6.508 1.00 0.15 C ATOM 461 C ASN A 28 2.676 -1.545 -6.945 1.00 0.15 C ATOM 462 O ASN A 28 1.624 -2.143 -6.725 1.00 0.21 O ATOM 463 CB ASN A 28 2.547 0.841 -7.677 1.00 0.19 C ATOM 464 CG ASN A 28 2.137 2.229 -7.223 1.00 0.20 C ATOM 465 OD1 ASN A 28 1.278 2.864 -7.834 1.00 0.26 O ATOM 466 ND2 ASN A 28 2.761 2.714 -6.156 1.00 0.19 N ATOM 0 H ASN A 28 4.754 0.793 -6.558 1.00 0.13 H new ATOM 0 HA ASN A 28 2.161 0.114 -5.695 1.00 0.15 H new ATOM 0 HB2 ASN A 28 3.426 0.918 -8.318 1.00 0.19 H new ATOM 0 HB3 ASN A 28 1.749 0.410 -8.281 1.00 0.19 H new ATOM 0 HD21 ASN A 28 2.534 3.647 -5.813 1.00 0.19 H new ATOM 0 HD22 ASN A 28 3.467 2.153 -5.679 1.00 0.19 H new ATOM 473 N ALA A 29 3.712 -2.100 -7.567 1.00 0.12 N ATOM 474 CA ALA A 29 3.672 -3.479 -8.036 1.00 0.12 C ATOM 475 C ALA A 29 3.496 -4.447 -6.871 1.00 0.11 C ATOM 476 O ALA A 29 2.774 -5.438 -6.980 1.00 0.15 O ATOM 477 CB ALA A 29 4.936 -3.810 -8.815 1.00 0.15 C ATOM 0 H ALA A 29 4.589 -1.615 -7.757 1.00 0.12 H new ATOM 0 HA ALA A 29 2.814 -3.588 -8.699 1.00 0.12 H new ATOM 0 HB1 ALA A 29 4.891 -4.843 -9.159 1.00 0.15 H new ATOM 0 HB2 ALA A 29 5.018 -3.145 -9.675 1.00 0.15 H new ATOM 0 HB3 ALA A 29 5.805 -3.679 -8.171 1.00 0.15 H new ATOM 483 N PHE A 30 4.160 -4.154 -5.757 1.00 0.10 N ATOM 484 CA PHE A 30 4.071 -5.002 -4.574 1.00 0.10 C ATOM 485 C PHE A 30 2.694 -4.882 -3.929 1.00 0.12 C ATOM 486 O PHE A 30 2.043 -5.889 -3.650 1.00 0.18 O ATOM 487 CB PHE A 30 5.165 -4.636 -3.571 1.00 0.12 C ATOM 488 CG PHE A 30 6.550 -4.906 -4.086 1.00 0.12 C ATOM 489 CD1 PHE A 30 7.004 -6.207 -4.238 1.00 0.12 C ATOM 490 CD2 PHE A 30 7.395 -3.862 -4.426 1.00 0.18 C ATOM 491 CE1 PHE A 30 8.274 -6.461 -4.719 1.00 0.16 C ATOM 492 CE2 PHE A 30 8.667 -4.110 -4.907 1.00 0.21 C ATOM 493 CZ PHE A 30 9.106 -5.412 -5.054 1.00 0.20 C ATOM 0 H PHE A 30 4.763 -3.339 -5.649 1.00 0.10 H new ATOM 0 HA PHE A 30 4.216 -6.037 -4.882 1.00 0.10 H new ATOM 0 HB2 PHE A 30 5.078 -3.580 -3.317 1.00 0.12 H new ATOM 0 HB3 PHE A 30 5.010 -5.199 -2.651 1.00 0.12 H new ATOM 0 HD1 PHE A 30 6.357 -7.032 -3.977 1.00 0.12 H new ATOM 0 HD2 PHE A 30 7.056 -2.843 -4.314 1.00 0.18 H new ATOM 0 HE1 PHE A 30 8.615 -7.479 -4.833 1.00 0.16 H new ATOM 0 HE2 PHE A 30 9.317 -3.288 -5.167 1.00 0.21 H new ATOM 0 HZ PHE A 30 10.099 -5.608 -5.431 1.00 0.20 H new ATOM 503 N ILE A 31 2.256 -3.647 -3.694 1.00 0.10 N ATOM 504 CA ILE A 31 0.948 -3.399 -3.098 1.00 0.11 C ATOM 505 C ILE A 31 -0.145 -4.055 -3.940 1.00 0.11 C ATOM 506 O ILE A 31 -1.156 -4.522 -3.419 1.00 0.16 O ATOM 507 CB ILE A 31 0.673 -1.883 -2.969 1.00 0.11 C ATOM 508 CG1 ILE A 31 1.632 -1.262 -1.947 1.00 0.12 C ATOM 509 CG2 ILE A 31 -0.776 -1.620 -2.577 1.00 0.13 C ATOM 510 CD1 ILE A 31 1.489 0.239 -1.808 1.00 0.13 C ATOM 0 H ILE A 31 2.788 -2.804 -3.908 1.00 0.10 H new ATOM 0 HA ILE A 31 0.944 -3.834 -2.098 1.00 0.11 H new ATOM 0 HB ILE A 31 0.843 -1.418 -3.940 1.00 0.11 H new ATOM 0 HG12 ILE A 31 1.462 -1.725 -0.975 1.00 0.12 H new ATOM 0 HG13 ILE A 31 2.657 -1.495 -2.236 1.00 0.12 H new ATOM 0 HG21 ILE A 31 -0.941 -0.546 -2.493 1.00 0.13 H new ATOM 0 HG22 ILE A 31 -1.439 -2.031 -3.338 1.00 0.13 H new ATOM 0 HG23 ILE A 31 -0.986 -2.095 -1.619 1.00 0.13 H new ATOM 0 HD11 ILE A 31 2.200 0.605 -1.067 1.00 0.13 H new ATOM 0 HD12 ILE A 31 1.689 0.714 -2.769 1.00 0.13 H new ATOM 0 HD13 ILE A 31 0.475 0.480 -1.488 1.00 0.13 H new ATOM 522 N GLN A 32 0.081 -4.080 -5.249 1.00 0.08 N ATOM 523 CA GLN A 32 -0.851 -4.679 -6.190 1.00 0.09 C ATOM 524 C GLN A 32 -0.979 -6.184 -5.961 1.00 0.11 C ATOM 525 O GLN A 32 -2.074 -6.696 -5.728 1.00 0.19 O ATOM 526 CB GLN A 32 -0.363 -4.415 -7.613 1.00 0.11 C ATOM 527 CG GLN A 32 -1.473 -4.345 -8.637 1.00 0.15 C ATOM 528 CD GLN A 32 -0.957 -4.040 -10.029 1.00 0.29 C ATOM 529 OE1 GLN A 32 0.043 -3.342 -10.194 1.00 0.82 O ATOM 530 NE2 GLN A 32 -1.634 -4.567 -11.041 1.00 1.04 N ATOM 0 H GLN A 32 0.915 -3.686 -5.684 1.00 0.08 H new ATOM 0 HA GLN A 32 -1.833 -4.231 -6.039 1.00 0.09 H new ATOM 0 HB2 GLN A 32 0.192 -3.477 -7.628 1.00 0.11 H new ATOM 0 HB3 GLN A 32 0.334 -5.203 -7.900 1.00 0.11 H new ATOM 0 HG2 GLN A 32 -2.011 -5.293 -8.651 1.00 0.15 H new ATOM 0 HG3 GLN A 32 -2.188 -3.578 -8.341 1.00 0.15 H new ATOM 0 HE21 GLN A 32 -2.458 -5.140 -10.860 1.00 1.04 H new ATOM 0 HE22 GLN A 32 -1.330 -4.399 -12.000 1.00 1.04 H new ATOM 539 N SER A 33 0.151 -6.884 -6.029 1.00 0.09 N ATOM 540 CA SER A 33 0.172 -8.332 -5.845 1.00 0.11 C ATOM 541 C SER A 33 -0.136 -8.724 -4.401 1.00 0.10 C ATOM 542 O SER A 33 -0.481 -9.871 -4.123 1.00 0.15 O ATOM 543 CB SER A 33 1.533 -8.895 -6.258 1.00 0.13 C ATOM 544 OG SER A 33 1.798 -8.633 -7.627 1.00 1.19 O ATOM 0 H SER A 33 1.066 -6.470 -6.211 1.00 0.09 H new ATOM 0 HA SER A 33 -0.606 -8.756 -6.479 1.00 0.11 H new ATOM 0 HB2 SER A 33 2.316 -8.453 -5.641 1.00 0.13 H new ATOM 0 HB3 SER A 33 1.555 -9.970 -6.079 1.00 0.13 H new ATOM 0 HG SER A 33 2.674 -9.001 -7.867 1.00 1.19 H new ATOM 550 N LEU A 34 -0.004 -7.771 -3.483 1.00 0.10 N ATOM 551 CA LEU A 34 -0.278 -8.026 -2.071 1.00 0.11 C ATOM 552 C LEU A 34 -1.781 -8.096 -1.831 1.00 0.13 C ATOM 553 O LEU A 34 -2.260 -8.878 -1.010 1.00 0.18 O ATOM 554 CB LEU A 34 0.330 -6.919 -1.204 1.00 0.10 C ATOM 555 CG LEU A 34 0.867 -7.358 0.164 1.00 0.13 C ATOM 556 CD1 LEU A 34 1.488 -6.174 0.885 1.00 0.16 C ATOM 557 CD2 LEU A 34 -0.233 -7.978 1.017 1.00 0.17 C ATOM 0 H LEU A 34 0.290 -6.817 -3.690 1.00 0.10 H new ATOM 0 HA LEU A 34 0.173 -8.980 -1.798 1.00 0.11 H new ATOM 0 HB2 LEU A 34 1.144 -6.455 -1.760 1.00 0.10 H new ATOM 0 HB3 LEU A 34 -0.427 -6.151 -1.046 1.00 0.10 H new ATOM 0 HG LEU A 34 1.631 -8.117 -0.000 1.00 0.13 H new ATOM 0 HD11 LEU A 34 1.866 -6.496 1.855 1.00 0.16 H new ATOM 0 HD12 LEU A 34 2.309 -5.775 0.290 1.00 0.16 H new ATOM 0 HD13 LEU A 34 0.735 -5.399 1.028 1.00 0.16 H new ATOM 0 HD21 LEU A 34 0.179 -8.279 1.980 1.00 0.17 H new ATOM 0 HD22 LEU A 34 -1.027 -7.248 1.174 1.00 0.17 H new ATOM 0 HD23 LEU A 34 -0.640 -8.852 0.508 1.00 0.17 H new ATOM 569 N LYS A 35 -2.518 -7.271 -2.565 1.00 0.15 N ATOM 570 CA LYS A 35 -3.968 -7.214 -2.442 1.00 0.19 C ATOM 571 C LYS A 35 -4.629 -8.345 -3.223 1.00 0.22 C ATOM 572 O LYS A 35 -5.672 -8.864 -2.821 1.00 0.31 O ATOM 573 CB LYS A 35 -4.473 -5.864 -2.950 1.00 0.23 C ATOM 574 CG LYS A 35 -5.944 -5.614 -2.672 1.00 0.23 C ATOM 575 CD LYS A 35 -6.199 -5.409 -1.189 1.00 0.24 C ATOM 576 CE LYS A 35 -7.650 -5.051 -0.923 1.00 0.22 C ATOM 577 NZ LYS A 35 -8.565 -6.191 -1.202 1.00 0.46 N ATOM 0 H LYS A 35 -2.131 -6.628 -3.256 1.00 0.15 H new ATOM 0 HA LYS A 35 -4.230 -7.330 -1.390 1.00 0.19 H new ATOM 0 HB2 LYS A 35 -3.886 -5.070 -2.488 1.00 0.23 H new ATOM 0 HB3 LYS A 35 -4.301 -5.804 -4.025 1.00 0.23 H new ATOM 0 HG2 LYS A 35 -6.276 -4.736 -3.225 1.00 0.23 H new ATOM 0 HG3 LYS A 35 -6.533 -6.458 -3.031 1.00 0.23 H new ATOM 0 HD2 LYS A 35 -5.941 -6.317 -0.644 1.00 0.24 H new ATOM 0 HD3 LYS A 35 -5.552 -4.617 -0.813 1.00 0.24 H new ATOM 0 HE2 LYS A 35 -7.763 -4.742 0.116 1.00 0.22 H new ATOM 0 HE3 LYS A 35 -7.933 -4.199 -1.542 1.00 0.22 H new ATOM 0 HZ1 LYS A 35 -9.335 -5.874 -1.825 1.00 0.46 H new ATOM 0 HZ2 LYS A 35 -8.035 -6.955 -1.668 1.00 0.46 H new ATOM 0 HZ3 LYS A 35 -8.965 -6.542 -0.308 1.00 0.46 H new ATOM 591 N ASP A 36 -4.017 -8.721 -4.341 1.00 0.23 N ATOM 592 CA ASP A 36 -4.546 -9.787 -5.184 1.00 0.28 C ATOM 593 C ASP A 36 -4.056 -11.150 -4.709 1.00 0.25 C ATOM 594 O ASP A 36 -4.725 -12.166 -4.902 1.00 0.33 O ATOM 595 CB ASP A 36 -4.126 -9.562 -6.636 1.00 0.34 C ATOM 596 CG ASP A 36 -4.771 -10.550 -7.588 1.00 1.07 C ATOM 597 OD1 ASP A 36 -5.969 -10.379 -7.900 1.00 0.96 O ATOM 598 OD2 ASP A 36 -4.080 -11.496 -8.019 1.00 2.07 O ATOM 0 H ASP A 36 -3.153 -8.302 -4.685 1.00 0.23 H new ATOM 0 HA ASP A 36 -5.634 -9.769 -5.115 1.00 0.28 H new ATOM 0 HB2 ASP A 36 -4.392 -8.548 -6.935 1.00 0.34 H new ATOM 0 HB3 ASP A 36 -3.042 -9.643 -6.714 1.00 0.34 H new ATOM 603 N ASP A 37 -2.884 -11.160 -4.086 1.00 0.20 N ATOM 604 CA ASP A 37 -2.292 -12.394 -3.580 1.00 0.22 C ATOM 605 C ASP A 37 -1.686 -12.181 -2.193 1.00 0.18 C ATOM 606 O ASP A 37 -0.468 -12.065 -2.052 1.00 0.16 O ATOM 607 CB ASP A 37 -1.219 -12.900 -4.546 1.00 0.27 C ATOM 608 CG ASP A 37 -1.768 -13.170 -5.931 1.00 0.76 C ATOM 609 OD1 ASP A 37 -2.238 -14.302 -6.172 1.00 0.91 O ATOM 610 OD2 ASP A 37 -1.728 -12.251 -6.776 1.00 1.29 O ATOM 0 H ASP A 37 -2.323 -10.325 -3.918 1.00 0.20 H new ATOM 0 HA ASP A 37 -3.082 -13.141 -3.499 1.00 0.22 H new ATOM 0 HB2 ASP A 37 -0.418 -12.163 -4.613 1.00 0.27 H new ATOM 0 HB3 ASP A 37 -0.779 -13.814 -4.148 1.00 0.27 H new ATOM 615 N PRO A 38 -2.533 -12.124 -1.149 1.00 0.21 N ATOM 616 CA PRO A 38 -2.076 -11.927 0.233 1.00 0.21 C ATOM 617 C PRO A 38 -1.131 -13.032 0.701 1.00 0.21 C ATOM 618 O PRO A 38 -0.422 -12.873 1.695 1.00 0.23 O ATOM 619 CB PRO A 38 -3.371 -11.950 1.056 1.00 0.27 C ATOM 620 CG PRO A 38 -4.384 -12.597 0.174 1.00 0.30 C ATOM 621 CD PRO A 38 -3.998 -12.236 -1.230 1.00 0.26 C ATOM 0 HA PRO A 38 -1.508 -11.003 0.337 1.00 0.21 H new ATOM 0 HB2 PRO A 38 -3.239 -12.511 1.981 1.00 0.27 H new ATOM 0 HB3 PRO A 38 -3.678 -10.942 1.335 1.00 0.27 H new ATOM 0 HG2 PRO A 38 -4.388 -13.678 0.312 1.00 0.30 H new ATOM 0 HG3 PRO A 38 -5.388 -12.242 0.407 1.00 0.30 H new ATOM 0 HD2 PRO A 38 -4.306 -13.001 -1.943 1.00 0.26 H new ATOM 0 HD3 PRO A 38 -4.458 -11.300 -1.548 1.00 0.26 H new ATOM 629 N SER A 39 -1.126 -14.153 -0.015 1.00 0.21 N ATOM 630 CA SER A 39 -0.260 -15.275 0.336 1.00 0.23 C ATOM 631 C SER A 39 1.199 -14.940 0.040 1.00 0.21 C ATOM 632 O SER A 39 2.113 -15.553 0.591 1.00 0.24 O ATOM 633 CB SER A 39 -0.675 -16.530 -0.435 1.00 0.26 C ATOM 634 OG SER A 39 -0.586 -16.324 -1.834 1.00 1.37 O ATOM 0 H SER A 39 -1.709 -14.309 -0.838 1.00 0.21 H new ATOM 0 HA SER A 39 -0.365 -15.466 1.404 1.00 0.23 H new ATOM 0 HB2 SER A 39 -0.037 -17.365 -0.146 1.00 0.26 H new ATOM 0 HB3 SER A 39 -1.696 -16.802 -0.169 1.00 0.26 H new ATOM 0 HG SER A 39 -0.855 -17.142 -2.303 1.00 1.37 H new ATOM 640 N GLN A 40 1.402 -13.959 -0.833 1.00 0.19 N ATOM 641 CA GLN A 40 2.742 -13.527 -1.213 1.00 0.18 C ATOM 642 C GLN A 40 3.237 -12.412 -0.295 1.00 0.16 C ATOM 643 O GLN A 40 4.330 -11.883 -0.484 1.00 0.16 O ATOM 644 CB GLN A 40 2.754 -13.048 -2.666 1.00 0.21 C ATOM 645 CG GLN A 40 2.223 -14.078 -3.650 1.00 0.27 C ATOM 646 CD GLN A 40 3.061 -15.341 -3.689 1.00 0.34 C ATOM 647 OE1 GLN A 40 4.008 -15.447 -4.469 1.00 0.62 O ATOM 648 NE2 GLN A 40 2.715 -16.308 -2.846 1.00 0.69 N ATOM 0 H GLN A 40 0.650 -13.445 -1.293 1.00 0.19 H new ATOM 0 HA GLN A 40 3.412 -14.381 -1.113 1.00 0.18 H new ATOM 0 HB2 GLN A 40 2.156 -12.140 -2.745 1.00 0.21 H new ATOM 0 HB3 GLN A 40 3.774 -12.784 -2.944 1.00 0.21 H new ATOM 0 HG2 GLN A 40 1.198 -14.336 -3.382 1.00 0.27 H new ATOM 0 HG3 GLN A 40 2.190 -13.638 -4.647 1.00 0.27 H new ATOM 0 HE21 GLN A 40 1.923 -16.177 -2.217 1.00 0.69 H new ATOM 0 HE22 GLN A 40 3.242 -17.181 -2.828 1.00 0.69 H new ATOM 657 N SER A 41 2.416 -12.054 0.689 1.00 0.17 N ATOM 658 CA SER A 41 2.756 -10.992 1.639 1.00 0.20 C ATOM 659 C SER A 41 4.191 -11.118 2.141 1.00 0.20 C ATOM 660 O SER A 41 4.828 -10.119 2.476 1.00 0.25 O ATOM 661 CB SER A 41 1.794 -11.015 2.826 1.00 0.23 C ATOM 662 OG SER A 41 0.500 -10.582 2.444 1.00 1.10 O ATOM 0 H SER A 41 1.506 -12.485 0.852 1.00 0.17 H new ATOM 0 HA SER A 41 2.665 -10.043 1.111 1.00 0.20 H new ATOM 0 HB2 SER A 41 1.737 -12.025 3.232 1.00 0.23 H new ATOM 0 HB3 SER A 41 2.176 -10.373 3.620 1.00 0.23 H new ATOM 0 HG SER A 41 0.021 -11.321 2.014 1.00 1.10 H new ATOM 668 N ALA A 42 4.694 -12.347 2.202 1.00 0.18 N ATOM 669 CA ALA A 42 6.053 -12.593 2.666 1.00 0.20 C ATOM 670 C ALA A 42 7.045 -12.562 1.508 1.00 0.17 C ATOM 671 O ALA A 42 8.196 -12.156 1.671 1.00 0.18 O ATOM 672 CB ALA A 42 6.125 -13.925 3.391 1.00 0.24 C ATOM 0 H ALA A 42 4.180 -13.187 1.936 1.00 0.18 H new ATOM 0 HA ALA A 42 6.325 -11.797 3.360 1.00 0.20 H new ATOM 0 HB1 ALA A 42 7.145 -14.098 3.733 1.00 0.24 H new ATOM 0 HB2 ALA A 42 5.452 -13.909 4.249 1.00 0.24 H new ATOM 0 HB3 ALA A 42 5.829 -14.725 2.712 1.00 0.24 H new ATOM 678 N ASN A 43 6.590 -12.996 0.336 1.00 0.16 N ATOM 679 CA ASN A 43 7.432 -13.019 -0.854 1.00 0.16 C ATOM 680 C ASN A 43 7.668 -11.609 -1.382 1.00 0.13 C ATOM 681 O ASN A 43 8.807 -11.157 -1.480 1.00 0.14 O ATOM 682 CB ASN A 43 6.784 -13.879 -1.940 1.00 0.18 C ATOM 683 CG ASN A 43 6.658 -15.332 -1.527 1.00 0.21 C ATOM 684 OD1 ASN A 43 7.471 -15.845 -0.758 1.00 0.59 O ATOM 685 ND2 ASN A 43 5.634 -16.004 -2.038 1.00 0.71 N ATOM 0 H ASN A 43 5.641 -13.337 0.186 1.00 0.16 H new ATOM 0 HA ASN A 43 8.395 -13.450 -0.580 1.00 0.16 H new ATOM 0 HB2 ASN A 43 5.795 -13.483 -2.172 1.00 0.18 H new ATOM 0 HB3 ASN A 43 7.376 -13.813 -2.853 1.00 0.18 H new ATOM 0 HD21 ASN A 43 5.497 -16.986 -1.797 1.00 0.71 H new ATOM 0 HD22 ASN A 43 4.984 -15.539 -2.672 1.00 0.71 H new ATOM 692 N LEU A 44 6.581 -10.926 -1.728 1.00 0.13 N ATOM 693 CA LEU A 44 6.655 -9.563 -2.243 1.00 0.12 C ATOM 694 C LEU A 44 7.474 -8.676 -1.313 1.00 0.11 C ATOM 695 O LEU A 44 8.206 -7.796 -1.765 1.00 0.12 O ATOM 696 CB LEU A 44 5.249 -8.990 -2.410 1.00 0.12 C ATOM 697 CG LEU A 44 4.348 -9.767 -3.369 1.00 0.16 C ATOM 698 CD1 LEU A 44 2.891 -9.403 -3.139 1.00 0.16 C ATOM 699 CD2 LEU A 44 4.749 -9.494 -4.811 1.00 0.23 C ATOM 0 H LEU A 44 5.633 -11.297 -1.660 1.00 0.13 H new ATOM 0 HA LEU A 44 7.149 -9.589 -3.215 1.00 0.12 H new ATOM 0 HB2 LEU A 44 4.769 -8.954 -1.432 1.00 0.12 H new ATOM 0 HB3 LEU A 44 5.331 -7.962 -2.764 1.00 0.12 H new ATOM 0 HG LEU A 44 4.470 -10.833 -3.175 1.00 0.16 H new ATOM 0 HD11 LEU A 44 2.262 -9.965 -3.830 1.00 0.16 H new ATOM 0 HD12 LEU A 44 2.612 -9.647 -2.114 1.00 0.16 H new ATOM 0 HD13 LEU A 44 2.752 -8.335 -3.308 1.00 0.16 H new ATOM 0 HD21 LEU A 44 4.098 -10.055 -5.482 1.00 0.23 H new ATOM 0 HD22 LEU A 44 4.654 -8.428 -5.020 1.00 0.23 H new ATOM 0 HD23 LEU A 44 5.783 -9.803 -4.966 1.00 0.23 H new ATOM 711 N LEU A 45 7.338 -8.912 -0.013 1.00 0.12 N ATOM 712 CA LEU A 45 8.074 -8.146 0.984 1.00 0.13 C ATOM 713 C LEU A 45 9.570 -8.381 0.824 1.00 0.13 C ATOM 714 O LEU A 45 10.352 -7.439 0.704 1.00 0.15 O ATOM 715 CB LEU A 45 7.638 -8.556 2.392 1.00 0.15 C ATOM 716 CG LEU A 45 7.313 -7.407 3.350 1.00 0.14 C ATOM 717 CD1 LEU A 45 7.093 -7.942 4.756 1.00 0.18 C ATOM 718 CD2 LEU A 45 8.424 -6.367 3.347 1.00 0.14 C ATOM 0 H LEU A 45 6.724 -9.628 0.375 1.00 0.12 H new ATOM 0 HA LEU A 45 7.859 -7.087 0.838 1.00 0.13 H new ATOM 0 HB2 LEU A 45 6.758 -9.194 2.308 1.00 0.15 H new ATOM 0 HB3 LEU A 45 8.429 -9.161 2.835 1.00 0.15 H new ATOM 0 HG LEU A 45 6.397 -6.926 3.009 1.00 0.14 H new ATOM 0 HD11 LEU A 45 6.863 -7.115 5.428 1.00 0.18 H new ATOM 0 HD12 LEU A 45 6.262 -8.648 4.751 1.00 0.18 H new ATOM 0 HD13 LEU A 45 7.996 -8.447 5.099 1.00 0.18 H new ATOM 0 HD21 LEU A 45 8.170 -5.561 4.035 1.00 0.14 H new ATOM 0 HD22 LEU A 45 9.358 -6.832 3.662 1.00 0.14 H new ATOM 0 HD23 LEU A 45 8.541 -5.962 2.342 1.00 0.14 H new ATOM 730 N ALA A 46 9.953 -9.653 0.827 1.00 0.14 N ATOM 731 CA ALA A 46 11.349 -10.042 0.674 1.00 0.15 C ATOM 732 C ALA A 46 11.920 -9.521 -0.640 1.00 0.15 C ATOM 733 O ALA A 46 13.099 -9.180 -0.725 1.00 0.20 O ATOM 734 CB ALA A 46 11.471 -11.556 0.737 1.00 0.16 C ATOM 0 H ALA A 46 9.310 -10.437 0.935 1.00 0.14 H new ATOM 0 HA ALA A 46 11.922 -9.601 1.489 1.00 0.15 H new ATOM 0 HB1 ALA A 46 12.517 -11.842 0.622 1.00 0.16 H new ATOM 0 HB2 ALA A 46 11.101 -11.911 1.699 1.00 0.16 H new ATOM 0 HB3 ALA A 46 10.883 -12.002 -0.065 1.00 0.16 H new ATOM 740 N GLU A 47 11.070 -9.463 -1.660 1.00 0.13 N ATOM 741 CA GLU A 47 11.478 -8.985 -2.975 1.00 0.15 C ATOM 742 C GLU A 47 11.545 -7.464 -2.994 1.00 0.13 C ATOM 743 O GLU A 47 12.318 -6.876 -3.750 1.00 0.17 O ATOM 744 CB GLU A 47 10.505 -9.481 -4.045 1.00 0.18 C ATOM 745 CG GLU A 47 10.702 -10.943 -4.408 1.00 0.28 C ATOM 746 CD GLU A 47 11.915 -11.168 -5.290 1.00 1.24 C ATOM 747 OE1 GLU A 47 13.023 -11.347 -4.742 1.00 2.19 O ATOM 748 OE2 GLU A 47 11.756 -11.166 -6.529 1.00 1.09 O ATOM 0 H GLU A 47 10.091 -9.742 -1.600 1.00 0.13 H new ATOM 0 HA GLU A 47 12.471 -9.379 -3.191 1.00 0.15 H new ATOM 0 HB2 GLU A 47 9.484 -9.336 -3.692 1.00 0.18 H new ATOM 0 HB3 GLU A 47 10.622 -8.873 -4.942 1.00 0.18 H new ATOM 0 HG2 GLU A 47 10.808 -11.529 -3.495 1.00 0.28 H new ATOM 0 HG3 GLU A 47 9.812 -11.309 -4.920 1.00 0.28 H new ATOM 755 N ALA A 48 10.730 -6.836 -2.155 1.00 0.10 N ATOM 756 CA ALA A 48 10.705 -5.383 -2.066 1.00 0.10 C ATOM 757 C ALA A 48 11.941 -4.890 -1.332 1.00 0.11 C ATOM 758 O ALA A 48 12.533 -3.876 -1.697 1.00 0.12 O ATOM 759 CB ALA A 48 9.439 -4.909 -1.371 1.00 0.11 C ATOM 0 H ALA A 48 10.079 -7.310 -1.528 1.00 0.10 H new ATOM 0 HA ALA A 48 10.708 -4.968 -3.074 1.00 0.10 H new ATOM 0 HB1 ALA A 48 9.440 -3.820 -1.315 1.00 0.11 H new ATOM 0 HB2 ALA A 48 8.568 -5.242 -1.935 1.00 0.11 H new ATOM 0 HB3 ALA A 48 9.400 -5.324 -0.364 1.00 0.11 H new ATOM 765 N LYS A 49 12.315 -5.619 -0.288 1.00 0.12 N ATOM 766 CA LYS A 49 13.497 -5.294 0.488 1.00 0.14 C ATOM 767 C LYS A 49 14.733 -5.598 -0.344 1.00 0.14 C ATOM 768 O LYS A 49 15.739 -4.892 -0.280 1.00 0.17 O ATOM 769 CB LYS A 49 13.514 -6.112 1.777 1.00 0.14 C ATOM 770 CG LYS A 49 12.313 -5.851 2.671 1.00 0.14 C ATOM 771 CD LYS A 49 12.337 -6.737 3.905 1.00 0.16 C ATOM 772 CE LYS A 49 11.779 -8.118 3.609 1.00 0.16 C ATOM 773 NZ LYS A 49 11.809 -8.998 4.810 1.00 0.21 N ATOM 0 H LYS A 49 11.811 -6.443 0.039 1.00 0.12 H new ATOM 0 HA LYS A 49 13.487 -4.236 0.750 1.00 0.14 H new ATOM 0 HB2 LYS A 49 13.548 -7.172 1.526 1.00 0.14 H new ATOM 0 HB3 LYS A 49 14.426 -5.886 2.330 1.00 0.14 H new ATOM 0 HG2 LYS A 49 12.303 -4.804 2.973 1.00 0.14 H new ATOM 0 HG3 LYS A 49 11.395 -6.029 2.111 1.00 0.14 H new ATOM 0 HD2 LYS A 49 13.360 -6.827 4.270 1.00 0.16 H new ATOM 0 HD3 LYS A 49 11.755 -6.271 4.700 1.00 0.16 H new ATOM 0 HE2 LYS A 49 10.753 -8.026 3.252 1.00 0.16 H new ATOM 0 HE3 LYS A 49 12.356 -8.578 2.807 1.00 0.16 H new ATOM 0 HZ1 LYS A 49 11.420 -9.931 4.566 1.00 0.21 H new ATOM 0 HZ2 LYS A 49 12.790 -9.107 5.136 1.00 0.21 H new ATOM 0 HZ3 LYS A 49 11.238 -8.572 5.567 1.00 0.21 H new ATOM 787 N LYS A 50 14.632 -6.668 -1.127 1.00 0.13 N ATOM 788 CA LYS A 50 15.710 -7.090 -2.008 1.00 0.16 C ATOM 789 C LYS A 50 15.874 -6.089 -3.143 1.00 0.16 C ATOM 790 O LYS A 50 16.974 -5.881 -3.656 1.00 0.22 O ATOM 791 CB LYS A 50 15.404 -8.478 -2.574 1.00 0.17 C ATOM 792 CG LYS A 50 16.429 -8.962 -3.588 1.00 0.52 C ATOM 793 CD LYS A 50 16.091 -10.353 -4.098 1.00 0.51 C ATOM 794 CE LYS A 50 17.122 -10.842 -5.103 1.00 1.36 C ATOM 795 NZ LYS A 50 16.807 -12.211 -5.598 1.00 2.10 N ATOM 0 H LYS A 50 13.804 -7.263 -1.167 1.00 0.13 H new ATOM 0 HA LYS A 50 16.639 -7.135 -1.439 1.00 0.16 H new ATOM 0 HB2 LYS A 50 15.352 -9.193 -1.753 1.00 0.17 H new ATOM 0 HB3 LYS A 50 14.421 -8.461 -3.044 1.00 0.17 H new ATOM 0 HG2 LYS A 50 16.471 -8.266 -4.426 1.00 0.52 H new ATOM 0 HG3 LYS A 50 17.419 -8.971 -3.131 1.00 0.52 H new ATOM 0 HD2 LYS A 50 16.041 -11.047 -3.259 1.00 0.51 H new ATOM 0 HD3 LYS A 50 15.105 -10.342 -4.562 1.00 0.51 H new ATOM 0 HE2 LYS A 50 17.164 -10.152 -5.946 1.00 1.36 H new ATOM 0 HE3 LYS A 50 18.109 -10.841 -4.641 1.00 1.36 H new ATOM 0 HZ1 LYS A 50 17.533 -12.509 -6.281 1.00 2.10 H new ATOM 0 HZ2 LYS A 50 16.792 -12.875 -4.797 1.00 2.10 H new ATOM 0 HZ3 LYS A 50 15.876 -12.207 -6.062 1.00 2.10 H new ATOM 809 N LEU A 51 14.761 -5.473 -3.523 1.00 0.14 N ATOM 810 CA LEU A 51 14.749 -4.487 -4.592 1.00 0.15 C ATOM 811 C LEU A 51 15.230 -3.138 -4.078 1.00 0.15 C ATOM 812 O LEU A 51 15.929 -2.404 -4.777 1.00 0.18 O ATOM 813 CB LEU A 51 13.335 -4.361 -5.158 1.00 0.15 C ATOM 814 CG LEU A 51 13.194 -3.477 -6.398 1.00 0.18 C ATOM 815 CD1 LEU A 51 14.228 -3.848 -7.453 1.00 0.23 C ATOM 816 CD2 LEU A 51 11.786 -3.597 -6.963 1.00 0.18 C ATOM 0 H LEU A 51 13.848 -5.643 -3.101 1.00 0.14 H new ATOM 0 HA LEU A 51 15.425 -4.814 -5.382 1.00 0.15 H new ATOM 0 HB2 LEU A 51 12.971 -5.359 -5.402 1.00 0.15 H new ATOM 0 HB3 LEU A 51 12.685 -3.967 -4.377 1.00 0.15 H new ATOM 0 HG LEU A 51 13.371 -2.442 -6.107 1.00 0.18 H new ATOM 0 HD11 LEU A 51 14.106 -3.204 -8.324 1.00 0.23 H new ATOM 0 HD12 LEU A 51 15.229 -3.717 -7.043 1.00 0.23 H new ATOM 0 HD13 LEU A 51 14.090 -4.888 -7.748 1.00 0.23 H new ATOM 0 HD21 LEU A 51 11.693 -2.965 -7.846 1.00 0.18 H new ATOM 0 HD22 LEU A 51 11.591 -4.634 -7.237 1.00 0.18 H new ATOM 0 HD23 LEU A 51 11.064 -3.279 -6.211 1.00 0.18 H new ATOM 828 N ASN A 52 14.844 -2.821 -2.849 1.00 0.15 N ATOM 829 CA ASN A 52 15.239 -1.569 -2.220 1.00 0.18 C ATOM 830 C ASN A 52 16.737 -1.575 -1.958 1.00 0.17 C ATOM 831 O ASN A 52 17.385 -0.528 -1.946 1.00 0.17 O ATOM 832 CB ASN A 52 14.472 -1.371 -0.910 1.00 0.26 C ATOM 833 CG ASN A 52 14.890 -0.112 -0.173 1.00 0.36 C ATOM 834 OD1 ASN A 52 14.340 0.963 -0.398 1.00 0.79 O ATOM 835 ND2 ASN A 52 15.864 -0.245 0.722 1.00 0.21 N ATOM 0 H ASN A 52 14.255 -3.417 -2.267 1.00 0.15 H new ATOM 0 HA ASN A 52 15.000 -0.743 -2.890 1.00 0.18 H new ATOM 0 HB2 ASN A 52 13.404 -1.326 -1.122 1.00 0.26 H new ATOM 0 HB3 ASN A 52 14.632 -2.235 -0.265 1.00 0.26 H new ATOM 0 HD21 ASN A 52 16.182 0.565 1.254 1.00 0.21 H new ATOM 0 HD22 ASN A 52 16.293 -1.157 0.877 1.00 0.21 H new ATOM 842 N ASP A 53 17.278 -2.770 -1.751 1.00 0.18 N ATOM 843 CA ASP A 53 18.701 -2.934 -1.498 1.00 0.20 C ATOM 844 C ASP A 53 19.469 -2.979 -2.813 1.00 0.22 C ATOM 845 O ASP A 53 20.679 -2.751 -2.847 1.00 0.25 O ATOM 846 CB ASP A 53 18.957 -4.212 -0.695 1.00 0.23 C ATOM 847 CG ASP A 53 20.432 -4.447 -0.436 1.00 0.28 C ATOM 848 OD1 ASP A 53 20.937 -3.965 0.600 1.00 0.34 O ATOM 849 OD2 ASP A 53 21.082 -5.112 -1.269 1.00 0.34 O ATOM 0 H ASP A 53 16.748 -3.642 -1.754 1.00 0.18 H new ATOM 0 HA ASP A 53 19.049 -2.081 -0.916 1.00 0.20 H new ATOM 0 HB2 ASP A 53 18.429 -4.152 0.257 1.00 0.23 H new ATOM 0 HB3 ASP A 53 18.545 -5.065 -1.234 1.00 0.23 H new ATOM 854 N ALA A 54 18.754 -3.277 -3.893 1.00 0.22 N ATOM 855 CA ALA A 54 19.359 -3.350 -5.217 1.00 0.26 C ATOM 856 C ALA A 54 19.717 -1.959 -5.725 1.00 0.28 C ATOM 857 O ALA A 54 20.702 -1.779 -6.441 1.00 0.32 O ATOM 858 CB ALA A 54 18.418 -4.042 -6.191 1.00 0.27 C ATOM 0 H ALA A 54 17.753 -3.472 -3.876 1.00 0.22 H new ATOM 0 HA ALA A 54 20.277 -3.934 -5.142 1.00 0.26 H new ATOM 0 HB1 ALA A 54 18.884 -4.089 -7.175 1.00 0.27 H new ATOM 0 HB2 ALA A 54 18.209 -5.052 -5.840 1.00 0.27 H new ATOM 0 HB3 ALA A 54 17.486 -3.481 -6.257 1.00 0.27 H new ATOM 864 N GLN A 55 18.906 -0.978 -5.344 1.00 0.27 N ATOM 865 CA GLN A 55 19.125 0.405 -5.750 1.00 0.31 C ATOM 866 C GLN A 55 19.961 1.142 -4.709 1.00 0.33 C ATOM 867 O GLN A 55 20.487 2.223 -4.971 1.00 0.41 O ATOM 868 CB GLN A 55 17.784 1.114 -5.936 1.00 0.32 C ATOM 869 CG GLN A 55 16.777 0.316 -6.745 1.00 0.32 C ATOM 870 CD GLN A 55 15.557 1.134 -7.115 1.00 0.36 C ATOM 871 OE1 GLN A 55 15.463 1.667 -8.222 1.00 0.61 O ATOM 872 NE2 GLN A 55 14.629 1.263 -6.177 1.00 0.29 N ATOM 0 H GLN A 55 18.087 -1.116 -4.752 1.00 0.27 H new ATOM 0 HA GLN A 55 19.666 0.407 -6.696 1.00 0.31 H new ATOM 0 HB2 GLN A 55 17.359 1.331 -4.956 1.00 0.32 H new ATOM 0 HB3 GLN A 55 17.955 2.071 -6.428 1.00 0.32 H new ATOM 0 HG2 GLN A 55 17.254 -0.052 -7.654 1.00 0.32 H new ATOM 0 HG3 GLN A 55 16.466 -0.558 -6.173 1.00 0.32 H new ATOM 0 HE21 GLN A 55 14.749 0.803 -5.274 1.00 0.29 H new ATOM 0 HE22 GLN A 55 13.795 1.822 -6.358 1.00 0.29 H new ATOM 881 N ALA A 56 20.072 0.544 -3.525 1.00 0.28 N ATOM 882 CA ALA A 56 20.834 1.130 -2.433 1.00 0.31 C ATOM 883 C ALA A 56 22.266 1.447 -2.861 1.00 0.39 C ATOM 884 O ALA A 56 22.860 0.719 -3.655 1.00 0.44 O ATOM 885 CB ALA A 56 20.837 0.191 -1.236 1.00 0.29 C ATOM 0 H ALA A 56 19.639 -0.352 -3.300 1.00 0.28 H new ATOM 0 HA ALA A 56 20.355 2.068 -2.152 1.00 0.31 H new ATOM 0 HB1 ALA A 56 21.410 0.639 -0.424 1.00 0.29 H new ATOM 0 HB2 ALA A 56 19.813 0.019 -0.906 1.00 0.29 H new ATOM 0 HB3 ALA A 56 21.291 -0.759 -1.520 1.00 0.29 H new ATOM 1066 N THR B 109 -0.399 9.917 7.152 1.00 0.39 N ATOM 1067 CA THR B 109 -0.402 9.339 5.814 1.00 0.28 C ATOM 1068 C THR B 109 -0.469 7.815 5.872 1.00 0.25 C ATOM 1069 O THR B 109 -1.182 7.184 5.092 1.00 0.27 O ATOM 1070 CB THR B 109 0.852 9.761 5.023 1.00 0.25 C ATOM 1071 OG1 THR B 109 0.824 11.172 4.775 1.00 0.33 O ATOM 1072 CG2 THR B 109 0.949 9.010 3.703 1.00 0.27 C ATOM 0 HA THR B 109 -1.289 9.716 5.305 1.00 0.28 H new ATOM 0 HB THR B 109 1.728 9.514 5.623 1.00 0.25 H new ATOM 0 HG1 THR B 109 0.346 11.623 5.502 1.00 0.33 H new ATOM 0 HG21 THR B 109 1.843 9.329 3.168 1.00 0.27 H new ATOM 0 HG22 THR B 109 1.005 7.939 3.897 1.00 0.27 H new ATOM 0 HG23 THR B 109 0.068 9.223 3.097 1.00 0.27 H new ATOM 1080 N GLN B 110 0.275 7.233 6.805 1.00 0.30 N ATOM 1081 CA GLN B 110 0.312 5.785 6.972 1.00 0.32 C ATOM 1082 C GLN B 110 -1.060 5.226 7.342 1.00 0.30 C ATOM 1083 O GLN B 110 -1.420 4.122 6.933 1.00 0.30 O ATOM 1084 CB GLN B 110 1.336 5.407 8.042 1.00 0.42 C ATOM 1085 CG GLN B 110 2.772 5.460 7.547 1.00 0.48 C ATOM 1086 CD GLN B 110 3.791 5.302 8.661 1.00 0.85 C ATOM 1087 OE1 GLN B 110 4.898 5.832 8.580 1.00 1.34 O ATOM 1088 NE2 GLN B 110 3.425 4.571 9.709 1.00 1.38 N ATOM 0 H GLN B 110 0.864 7.745 7.461 1.00 0.30 H new ATOM 0 HA GLN B 110 0.605 5.347 6.018 1.00 0.32 H new ATOM 0 HB2 GLN B 110 1.227 6.080 8.893 1.00 0.42 H new ATOM 0 HB3 GLN B 110 1.120 4.401 8.402 1.00 0.42 H new ATOM 0 HG2 GLN B 110 2.925 4.673 6.808 1.00 0.48 H new ATOM 0 HG3 GLN B 110 2.941 6.410 7.040 1.00 0.48 H new ATOM 0 HE21 GLN B 110 2.497 4.148 9.737 1.00 1.38 H new ATOM 0 HE22 GLN B 110 4.072 4.433 10.485 1.00 1.38 H new ATOM 1097 N GLU B 111 -1.827 5.991 8.115 1.00 0.30 N ATOM 1098 CA GLU B 111 -3.154 5.559 8.533 1.00 0.30 C ATOM 1099 C GLU B 111 -4.088 5.499 7.337 1.00 0.28 C ATOM 1100 O GLU B 111 -4.855 4.550 7.177 1.00 0.39 O ATOM 1101 CB GLU B 111 -3.710 6.513 9.587 1.00 0.34 C ATOM 1102 CG GLU B 111 -2.730 6.799 10.707 1.00 0.38 C ATOM 1103 CD GLU B 111 -2.541 5.613 11.633 1.00 1.19 C ATOM 1104 OE1 GLU B 111 -1.708 4.739 11.316 1.00 2.25 O ATOM 1105 OE2 GLU B 111 -3.226 5.560 12.676 1.00 1.04 O ATOM 0 H GLU B 111 -1.552 6.910 8.463 1.00 0.30 H new ATOM 0 HA GLU B 111 -3.077 4.562 8.967 1.00 0.30 H new ATOM 0 HB2 GLU B 111 -3.989 7.452 9.108 1.00 0.34 H new ATOM 0 HB3 GLU B 111 -4.621 6.088 10.009 1.00 0.34 H new ATOM 0 HG2 GLU B 111 -1.767 7.079 10.280 1.00 0.38 H new ATOM 0 HG3 GLU B 111 -3.083 7.654 11.284 1.00 0.38 H new ATOM 1112 N ALA B 112 -4.011 6.525 6.498 1.00 0.20 N ATOM 1113 CA ALA B 112 -4.838 6.601 5.303 1.00 0.17 C ATOM 1114 C ALA B 112 -4.400 5.560 4.279 1.00 0.13 C ATOM 1115 O ALA B 112 -5.207 5.073 3.487 1.00 0.13 O ATOM 1116 CB ALA B 112 -4.769 7.995 4.703 1.00 0.17 C ATOM 0 H ALA B 112 -3.382 7.318 6.625 1.00 0.20 H new ATOM 0 HA ALA B 112 -5.870 6.392 5.584 1.00 0.17 H new ATOM 0 HB1 ALA B 112 -5.392 8.038 3.810 1.00 0.17 H new ATOM 0 HB2 ALA B 112 -5.128 8.723 5.431 1.00 0.17 H new ATOM 0 HB3 ALA B 112 -3.737 8.226 4.437 1.00 0.17 H new ATOM 1122 N SER B 113 -3.115 5.224 4.306 1.00 0.13 N ATOM 1123 CA SER B 113 -2.561 4.237 3.387 1.00 0.11 C ATOM 1124 C SER B 113 -3.182 2.867 3.634 1.00 0.10 C ATOM 1125 O SER B 113 -3.654 2.212 2.705 1.00 0.12 O ATOM 1126 CB SER B 113 -1.041 4.160 3.550 1.00 0.15 C ATOM 1127 OG SER B 113 -0.431 5.399 3.232 1.00 0.92 O ATOM 0 H SER B 113 -2.437 5.622 4.956 1.00 0.13 H new ATOM 0 HA SER B 113 -2.794 4.545 2.368 1.00 0.11 H new ATOM 0 HB2 SER B 113 -0.796 3.883 4.575 1.00 0.15 H new ATOM 0 HB3 SER B 113 -0.642 3.378 2.904 1.00 0.15 H new ATOM 0 HG SER B 113 -0.459 5.988 4.015 1.00 0.92 H new ATOM 1133 N TRP B 114 -3.184 2.442 4.894 1.00 0.10 N ATOM 1134 CA TRP B 114 -3.751 1.151 5.262 1.00 0.10 C ATOM 1135 C TRP B 114 -5.257 1.137 5.017 1.00 0.12 C ATOM 1136 O TRP B 114 -5.813 0.132 4.577 1.00 0.16 O ATOM 1137 CB TRP B 114 -3.449 0.836 6.729 1.00 0.13 C ATOM 1138 CG TRP B 114 -3.976 -0.492 7.180 1.00 0.14 C ATOM 1139 CD1 TRP B 114 -4.849 -0.720 8.205 1.00 0.17 C ATOM 1140 CD2 TRP B 114 -3.663 -1.778 6.626 1.00 0.16 C ATOM 1141 NE1 TRP B 114 -5.103 -2.066 8.320 1.00 0.19 N ATOM 1142 CE2 TRP B 114 -4.388 -2.735 7.362 1.00 0.19 C ATOM 1143 CE3 TRP B 114 -2.845 -2.211 5.578 1.00 0.17 C ATOM 1144 CZ2 TRP B 114 -4.318 -4.097 7.084 1.00 0.22 C ATOM 1145 CZ3 TRP B 114 -2.777 -3.566 5.304 1.00 0.21 C ATOM 1146 CH2 TRP B 114 -3.511 -4.493 6.054 1.00 0.23 C ATOM 0 H TRP B 114 -2.800 2.973 5.676 1.00 0.10 H new ATOM 0 HA TRP B 114 -3.293 0.384 4.638 1.00 0.10 H new ATOM 0 HB2 TRP B 114 -2.370 0.860 6.882 1.00 0.13 H new ATOM 0 HB3 TRP B 114 -3.877 1.619 7.355 1.00 0.13 H new ATOM 0 HD1 TRP B 114 -5.278 0.046 8.834 1.00 0.17 H new ATOM 0 HE1 TRP B 114 -5.723 -2.496 9.006 1.00 0.19 H new ATOM 0 HE3 TRP B 114 -2.277 -1.502 4.994 1.00 0.17 H new ATOM 0 HZ2 TRP B 114 -4.881 -4.815 7.661 1.00 0.22 H new ATOM 0 HZ3 TRP B 114 -2.147 -3.914 4.498 1.00 0.21 H new ATOM 0 HH2 TRP B 114 -3.438 -5.543 5.814 1.00 0.23 H new ATOM 1157 N GLU B 115 -5.908 2.262 5.300 1.00 0.14 N ATOM 1158 CA GLU B 115 -7.350 2.384 5.107 1.00 0.18 C ATOM 1159 C GLU B 115 -7.732 2.122 3.652 1.00 0.19 C ATOM 1160 O GLU B 115 -8.847 1.686 3.361 1.00 0.33 O ATOM 1161 CB GLU B 115 -7.828 3.776 5.534 1.00 0.22 C ATOM 1162 CG GLU B 115 -7.912 3.952 7.040 1.00 0.31 C ATOM 1163 CD GLU B 115 -8.183 5.384 7.455 1.00 1.33 C ATOM 1164 OE1 GLU B 115 -7.220 6.177 7.513 1.00 2.03 O ATOM 1165 OE2 GLU B 115 -9.357 5.712 7.724 1.00 1.80 O ATOM 0 H GLU B 115 -5.460 3.103 5.664 1.00 0.14 H new ATOM 0 HA GLU B 115 -7.839 1.634 5.729 1.00 0.18 H new ATOM 0 HB2 GLU B 115 -7.150 4.525 5.126 1.00 0.22 H new ATOM 0 HB3 GLU B 115 -8.810 3.964 5.099 1.00 0.22 H new ATOM 0 HG2 GLU B 115 -8.701 3.311 7.432 1.00 0.31 H new ATOM 0 HG3 GLU B 115 -6.977 3.619 7.492 1.00 0.31 H new ATOM 1172 N ILE B 116 -6.800 2.392 2.743 1.00 0.13 N ATOM 1173 CA ILE B 116 -7.033 2.181 1.318 1.00 0.12 C ATOM 1174 C ILE B 116 -6.857 0.710 0.945 1.00 0.10 C ATOM 1175 O ILE B 116 -7.564 0.187 0.083 1.00 0.12 O ATOM 1176 CB ILE B 116 -6.083 3.056 0.467 1.00 0.10 C ATOM 1177 CG1 ILE B 116 -6.483 4.527 0.588 1.00 0.10 C ATOM 1178 CG2 ILE B 116 -6.099 2.616 -0.990 1.00 0.11 C ATOM 1179 CD1 ILE B 116 -5.366 5.490 0.251 1.00 0.11 C ATOM 0 H ILE B 116 -5.875 2.758 2.968 1.00 0.13 H new ATOM 0 HA ILE B 116 -8.062 2.473 1.107 1.00 0.12 H new ATOM 0 HB ILE B 116 -5.067 2.933 0.843 1.00 0.10 H new ATOM 0 HG12 ILE B 116 -7.329 4.720 -0.072 1.00 0.10 H new ATOM 0 HG13 ILE B 116 -6.822 4.720 1.606 1.00 0.10 H new ATOM 0 HG21 ILE B 116 -5.423 3.246 -1.568 1.00 0.11 H new ATOM 0 HG22 ILE B 116 -5.775 1.578 -1.060 1.00 0.11 H new ATOM 0 HG23 ILE B 116 -7.110 2.709 -1.387 1.00 0.11 H new ATOM 0 HD11 ILE B 116 -5.723 6.514 0.359 1.00 0.11 H new ATOM 0 HD12 ILE B 116 -4.527 5.325 0.927 1.00 0.11 H new ATOM 0 HD13 ILE B 116 -5.041 5.326 -0.776 1.00 0.11 H new ATOM 1191 N PHE B 117 -5.914 0.049 1.606 1.00 0.09 N ATOM 1192 CA PHE B 117 -5.635 -1.361 1.349 1.00 0.09 C ATOM 1193 C PHE B 117 -6.674 -2.257 2.023 1.00 0.11 C ATOM 1194 O PHE B 117 -6.856 -3.410 1.634 1.00 0.15 O ATOM 1195 CB PHE B 117 -4.235 -1.710 1.863 1.00 0.10 C ATOM 1196 CG PHE B 117 -3.681 -2.995 1.311 1.00 0.12 C ATOM 1197 CD1 PHE B 117 -3.982 -4.209 1.907 1.00 0.19 C ATOM 1198 CD2 PHE B 117 -2.848 -2.987 0.203 1.00 0.11 C ATOM 1199 CE1 PHE B 117 -3.467 -5.390 1.407 1.00 0.23 C ATOM 1200 CE2 PHE B 117 -2.327 -4.164 -0.300 1.00 0.13 C ATOM 1201 CZ PHE B 117 -2.638 -5.367 0.302 1.00 0.20 C ATOM 0 H PHE B 117 -5.327 0.468 2.327 1.00 0.09 H new ATOM 0 HA PHE B 117 -5.684 -1.532 0.274 1.00 0.09 H new ATOM 0 HB2 PHE B 117 -3.554 -0.896 1.613 1.00 0.10 H new ATOM 0 HB3 PHE B 117 -4.265 -1.777 2.951 1.00 0.10 H new ATOM 0 HD1 PHE B 117 -4.627 -4.233 2.773 1.00 0.19 H new ATOM 0 HD2 PHE B 117 -2.603 -2.049 -0.273 1.00 0.11 H new ATOM 0 HE1 PHE B 117 -3.712 -6.330 1.879 1.00 0.23 H new ATOM 0 HE2 PHE B 117 -1.678 -4.143 -1.163 1.00 0.13 H new ATOM 0 HZ PHE B 117 -2.234 -6.289 -0.090 1.00 0.20 H new ATOM 1211 N THR B 118 -7.354 -1.719 3.032 1.00 0.12 N ATOM 1212 CA THR B 118 -8.365 -2.477 3.765 1.00 0.16 C ATOM 1213 C THR B 118 -9.684 -2.547 3.004 1.00 0.18 C ATOM 1214 O THR B 118 -10.687 -3.028 3.531 1.00 0.34 O ATOM 1215 CB THR B 118 -8.623 -1.869 5.155 1.00 0.19 C ATOM 1216 OG1 THR B 118 -8.953 -0.480 5.033 1.00 0.26 O ATOM 1217 CG2 THR B 118 -7.404 -2.032 6.047 1.00 0.20 C ATOM 0 H THR B 118 -7.224 -0.762 3.361 1.00 0.12 H new ATOM 0 HA THR B 118 -7.969 -3.486 3.879 1.00 0.16 H new ATOM 0 HB THR B 118 -9.461 -2.398 5.609 1.00 0.19 H new ATOM 0 HG1 THR B 118 -9.117 -0.103 5.923 1.00 0.26 H new ATOM 0 HG21 THR B 118 -7.608 -1.595 7.025 1.00 0.20 H new ATOM 0 HG22 THR B 118 -7.177 -3.092 6.163 1.00 0.20 H new ATOM 0 HG23 THR B 118 -6.551 -1.526 5.594 1.00 0.20 H new ATOM 1225 N LEU B 119 -9.682 -2.067 1.766 1.00 0.14 N ATOM 1226 CA LEU B 119 -10.884 -2.087 0.942 1.00 0.14 C ATOM 1227 C LEU B 119 -10.922 -3.355 0.088 1.00 0.15 C ATOM 1228 O LEU B 119 -10.159 -3.488 -0.867 1.00 0.24 O ATOM 1229 CB LEU B 119 -10.938 -0.839 0.064 1.00 0.16 C ATOM 1230 CG LEU B 119 -10.973 0.476 0.845 1.00 0.26 C ATOM 1231 CD1 LEU B 119 -10.702 1.655 -0.075 1.00 0.81 C ATOM 1232 CD2 LEU B 119 -12.311 0.647 1.547 1.00 1.01 C ATOM 0 H LEU B 119 -8.864 -1.660 1.312 1.00 0.14 H new ATOM 0 HA LEU B 119 -11.759 -2.089 1.592 1.00 0.14 H new ATOM 0 HB2 LEU B 119 -10.070 -0.834 -0.595 1.00 0.16 H new ATOM 0 HB3 LEU B 119 -11.821 -0.894 -0.573 1.00 0.16 H new ATOM 0 HG LEU B 119 -10.189 0.443 1.601 1.00 0.26 H new ATOM 0 HD11 LEU B 119 -10.732 2.580 0.501 1.00 0.81 H new ATOM 0 HD12 LEU B 119 -9.718 1.542 -0.531 1.00 0.81 H new ATOM 0 HD13 LEU B 119 -11.462 1.689 -0.856 1.00 0.81 H new ATOM 0 HD21 LEU B 119 -12.316 1.588 2.097 1.00 1.01 H new ATOM 0 HD22 LEU B 119 -13.112 0.655 0.807 1.00 1.01 H new ATOM 0 HD23 LEU B 119 -12.466 -0.179 2.241 1.00 1.01 H new ATOM 1244 N PRO B 120 -11.824 -4.299 0.418 1.00 0.21 N ATOM 1245 CA PRO B 120 -11.939 -5.574 -0.303 1.00 0.26 C ATOM 1246 C PRO B 120 -12.466 -5.413 -1.723 1.00 0.26 C ATOM 1247 O PRO B 120 -12.106 -6.180 -2.616 1.00 0.38 O ATOM 1248 CB PRO B 120 -12.927 -6.377 0.546 1.00 0.36 C ATOM 1249 CG PRO B 120 -13.740 -5.351 1.255 1.00 0.38 C ATOM 1250 CD PRO B 120 -12.817 -4.191 1.504 1.00 0.35 C ATOM 0 HA PRO B 120 -10.967 -6.052 -0.424 1.00 0.26 H new ATOM 0 HB2 PRO B 120 -13.553 -7.018 -0.075 1.00 0.36 H new ATOM 0 HB3 PRO B 120 -12.407 -7.026 1.251 1.00 0.36 H new ATOM 0 HG2 PRO B 120 -14.596 -5.046 0.652 1.00 0.38 H new ATOM 0 HG3 PRO B 120 -14.134 -5.744 2.192 1.00 0.38 H new ATOM 0 HD2 PRO B 120 -13.349 -3.240 1.468 1.00 0.35 H new ATOM 0 HD3 PRO B 120 -12.347 -4.256 2.485 1.00 0.35 H new ATOM 1258 N ASN B 121 -13.318 -4.418 -1.929 1.00 0.22 N ATOM 1259 CA ASN B 121 -13.890 -4.172 -3.246 1.00 0.23 C ATOM 1260 C ASN B 121 -12.824 -3.664 -4.212 1.00 0.19 C ATOM 1261 O ASN B 121 -12.914 -3.882 -5.420 1.00 0.22 O ATOM 1262 CB ASN B 121 -15.042 -3.172 -3.149 1.00 0.28 C ATOM 1263 CG ASN B 121 -16.144 -3.659 -2.231 1.00 0.50 C ATOM 1264 OD1 ASN B 121 -16.419 -4.856 -2.152 1.00 0.98 O ATOM 1265 ND2 ASN B 121 -16.779 -2.732 -1.524 1.00 0.50 N ATOM 0 H ASN B 121 -13.627 -3.770 -1.204 1.00 0.22 H new ATOM 0 HA ASN B 121 -14.279 -5.115 -3.631 1.00 0.23 H new ATOM 0 HB2 ASN B 121 -14.663 -2.217 -2.785 1.00 0.28 H new ATOM 0 HB3 ASN B 121 -15.451 -2.994 -4.143 1.00 0.28 H new ATOM 0 HD21 ASN B 121 -17.527 -3.001 -0.885 1.00 0.50 H new ATOM 0 HD22 ASN B 121 -16.519 -1.750 -1.620 1.00 0.50 H new ATOM 1272 N LEU B 122 -11.814 -2.989 -3.671 1.00 0.15 N ATOM 1273 CA LEU B 122 -10.727 -2.461 -4.482 1.00 0.13 C ATOM 1274 C LEU B 122 -9.638 -3.502 -4.686 1.00 0.16 C ATOM 1275 O LEU B 122 -9.146 -4.099 -3.728 1.00 0.24 O ATOM 1276 CB LEU B 122 -10.137 -1.210 -3.830 1.00 0.12 C ATOM 1277 CG LEU B 122 -10.663 0.116 -4.381 1.00 0.14 C ATOM 1278 CD1 LEU B 122 -12.176 0.067 -4.542 1.00 0.14 C ATOM 1279 CD2 LEU B 122 -10.263 1.262 -3.470 1.00 0.19 C ATOM 0 H LEU B 122 -11.728 -2.796 -2.673 1.00 0.15 H new ATOM 0 HA LEU B 122 -11.135 -2.197 -5.458 1.00 0.13 H new ATOM 0 HB2 LEU B 122 -10.339 -1.247 -2.760 1.00 0.12 H new ATOM 0 HB3 LEU B 122 -9.054 -1.232 -3.951 1.00 0.12 H new ATOM 0 HG LEU B 122 -10.219 0.282 -5.363 1.00 0.14 H new ATOM 0 HD11 LEU B 122 -12.531 1.020 -4.935 1.00 0.14 H new ATOM 0 HD12 LEU B 122 -12.443 -0.733 -5.233 1.00 0.14 H new ATOM 0 HD13 LEU B 122 -12.639 -0.121 -3.573 1.00 0.14 H new ATOM 0 HD21 LEU B 122 -10.644 2.199 -3.875 1.00 0.19 H new ATOM 0 HD22 LEU B 122 -10.681 1.100 -2.476 1.00 0.19 H new ATOM 0 HD23 LEU B 122 -9.176 1.311 -3.403 1.00 0.19 H new ATOM 1291 N ASN B 123 -9.265 -3.712 -5.941 1.00 0.16 N ATOM 1292 CA ASN B 123 -8.230 -4.682 -6.274 1.00 0.20 C ATOM 1293 C ASN B 123 -6.844 -4.073 -6.093 1.00 0.19 C ATOM 1294 O ASN B 123 -6.714 -2.885 -5.803 1.00 0.30 O ATOM 1295 CB ASN B 123 -8.405 -5.187 -7.708 1.00 0.28 C ATOM 1296 CG ASN B 123 -8.600 -4.060 -8.700 1.00 0.91 C ATOM 1297 OD1 ASN B 123 -9.727 -3.663 -8.990 1.00 1.73 O ATOM 1298 ND2 ASN B 123 -7.499 -3.537 -9.226 1.00 1.39 N ATOM 0 H ASN B 123 -9.663 -3.225 -6.744 1.00 0.16 H new ATOM 0 HA ASN B 123 -8.327 -5.529 -5.595 1.00 0.20 H new ATOM 0 HB2 ASN B 123 -7.530 -5.771 -7.994 1.00 0.28 H new ATOM 0 HB3 ASN B 123 -9.263 -5.857 -7.751 1.00 0.28 H new ATOM 0 HD21 ASN B 123 -7.568 -2.774 -9.900 1.00 1.39 H new ATOM 0 HD22 ASN B 123 -6.584 -3.898 -8.956 1.00 1.39 H new ATOM 1305 N GLY B 124 -5.812 -4.892 -6.268 1.00 0.14 N ATOM 1306 CA GLY B 124 -4.450 -4.419 -6.104 1.00 0.11 C ATOM 1307 C GLY B 124 -4.131 -3.202 -6.953 1.00 0.11 C ATOM 1308 O GLY B 124 -3.465 -2.277 -6.492 1.00 0.17 O ATOM 0 H GLY B 124 -5.895 -5.877 -6.521 1.00 0.14 H new ATOM 0 HA2 GLY B 124 -4.281 -4.176 -5.055 1.00 0.11 H new ATOM 0 HA3 GLY B 124 -3.760 -5.223 -6.360 1.00 0.11 H new ATOM 1312 N ARG B 125 -4.609 -3.202 -8.191 1.00 0.13 N ATOM 1313 CA ARG B 125 -4.355 -2.095 -9.107 1.00 0.14 C ATOM 1314 C ARG B 125 -5.004 -0.803 -8.621 1.00 0.12 C ATOM 1315 O ARG B 125 -4.402 0.269 -8.690 1.00 0.21 O ATOM 1316 CB ARG B 125 -4.873 -2.435 -10.508 1.00 0.20 C ATOM 1317 CG ARG B 125 -4.756 -3.908 -10.862 1.00 0.58 C ATOM 1318 CD ARG B 125 -5.171 -4.171 -12.299 1.00 0.90 C ATOM 1319 NE ARG B 125 -6.540 -3.736 -12.560 1.00 1.75 N ATOM 1320 CZ ARG B 125 -7.161 -3.909 -13.724 1.00 2.18 C ATOM 1321 NH1 ARG B 125 -6.539 -4.506 -14.731 1.00 1.82 N ATOM 1322 NH2 ARG B 125 -8.407 -3.483 -13.881 1.00 3.25 N ATOM 0 H ARG B 125 -5.174 -3.955 -8.584 1.00 0.13 H new ATOM 0 HA ARG B 125 -3.277 -1.941 -9.144 1.00 0.14 H new ATOM 0 HB2 ARG B 125 -5.918 -2.135 -10.582 1.00 0.20 H new ATOM 0 HB3 ARG B 125 -4.320 -1.849 -11.242 1.00 0.20 H new ATOM 0 HG2 ARG B 125 -3.728 -4.238 -10.713 1.00 0.58 H new ATOM 0 HG3 ARG B 125 -5.380 -4.496 -10.189 1.00 0.58 H new ATOM 0 HD2 ARG B 125 -4.491 -3.652 -12.974 1.00 0.90 H new ATOM 0 HD3 ARG B 125 -5.082 -5.236 -12.513 1.00 0.90 H new ATOM 0 HE ARG B 125 -7.049 -3.273 -11.807 1.00 1.75 H new ATOM 0 HH11 ARG B 125 -5.580 -4.835 -14.615 1.00 1.82 H new ATOM 0 HH12 ARG B 125 -7.019 -4.636 -15.621 1.00 1.82 H new ATOM 0 HH21 ARG B 125 -8.890 -3.023 -13.109 1.00 3.25 H new ATOM 0 HH22 ARG B 125 -8.883 -3.616 -14.773 1.00 3.25 H new ATOM 1336 N GLN B 126 -6.234 -0.911 -8.129 1.00 0.12 N ATOM 1337 CA GLN B 126 -6.971 0.251 -7.643 1.00 0.11 C ATOM 1338 C GLN B 126 -6.336 0.838 -6.384 1.00 0.09 C ATOM 1339 O GLN B 126 -6.077 2.040 -6.318 1.00 0.11 O ATOM 1340 CB GLN B 126 -8.432 -0.123 -7.390 1.00 0.13 C ATOM 1341 CG GLN B 126 -9.193 -0.438 -8.669 1.00 0.26 C ATOM 1342 CD GLN B 126 -10.644 -0.782 -8.430 1.00 0.19 C ATOM 1343 OE1 GLN B 126 -11.232 -1.584 -9.155 1.00 0.77 O ATOM 1344 NE2 GLN B 126 -11.234 -0.164 -7.421 1.00 0.64 N ATOM 0 H GLN B 126 -6.742 -1.792 -8.056 1.00 0.12 H new ATOM 0 HA GLN B 126 -6.930 1.021 -8.413 1.00 0.11 H new ATOM 0 HB2 GLN B 126 -8.471 -0.988 -6.728 1.00 0.13 H new ATOM 0 HB3 GLN B 126 -8.927 0.698 -6.871 1.00 0.13 H new ATOM 0 HG2 GLN B 126 -9.136 0.420 -9.339 1.00 0.26 H new ATOM 0 HG3 GLN B 126 -8.708 -1.272 -9.177 1.00 0.26 H new ATOM 0 HE21 GLN B 126 -10.706 0.493 -6.847 1.00 0.64 H new ATOM 0 HE22 GLN B 126 -12.217 -0.345 -7.217 1.00 0.64 H new ATOM 1353 N VAL B 127 -6.080 -0.008 -5.391 1.00 0.09 N ATOM 1354 CA VAL B 127 -5.474 0.448 -4.143 1.00 0.08 C ATOM 1355 C VAL B 127 -4.070 1.002 -4.379 1.00 0.08 C ATOM 1356 O VAL B 127 -3.726 2.066 -3.869 1.00 0.09 O ATOM 1357 CB VAL B 127 -5.414 -0.681 -3.091 1.00 0.09 C ATOM 1358 CG1 VAL B 127 -6.815 -1.107 -2.686 1.00 0.10 C ATOM 1359 CG2 VAL B 127 -4.621 -1.868 -3.616 1.00 0.10 C ATOM 0 H VAL B 127 -6.281 -1.007 -5.425 1.00 0.09 H new ATOM 0 HA VAL B 127 -6.110 1.245 -3.759 1.00 0.08 H new ATOM 0 HB VAL B 127 -4.903 -0.298 -2.208 1.00 0.09 H new ATOM 0 HG11 VAL B 127 -6.753 -1.903 -1.944 1.00 0.10 H new ATOM 0 HG12 VAL B 127 -7.346 -0.255 -2.261 1.00 0.10 H new ATOM 0 HG13 VAL B 127 -7.353 -1.469 -3.562 1.00 0.10 H new ATOM 0 HG21 VAL B 127 -4.592 -2.651 -2.858 1.00 0.10 H new ATOM 0 HG22 VAL B 127 -5.097 -2.254 -4.518 1.00 0.10 H new ATOM 0 HG23 VAL B 127 -3.604 -1.552 -3.849 1.00 0.10 H new ATOM 1369 N ALA B 128 -3.266 0.285 -5.164 1.00 0.09 N ATOM 1370 CA ALA B 128 -1.904 0.721 -5.462 1.00 0.10 C ATOM 1371 C ALA B 128 -1.912 2.077 -6.155 1.00 0.10 C ATOM 1372 O ALA B 128 -0.885 2.751 -6.239 1.00 0.13 O ATOM 1373 CB ALA B 128 -1.184 -0.312 -6.320 1.00 0.10 C ATOM 0 H ALA B 128 -3.534 -0.596 -5.603 1.00 0.09 H new ATOM 0 HA ALA B 128 -1.366 0.821 -4.519 1.00 0.10 H new ATOM 0 HB1 ALA B 128 -0.171 0.032 -6.531 1.00 0.10 H new ATOM 0 HB2 ALA B 128 -1.141 -1.262 -5.787 1.00 0.10 H new ATOM 0 HB3 ALA B 128 -1.724 -0.446 -7.257 1.00 0.10 H new ATOM 1379 N ALA B 129 -3.080 2.470 -6.651 1.00 0.08 N ATOM 1380 CA ALA B 129 -3.233 3.749 -7.331 1.00 0.09 C ATOM 1381 C ALA B 129 -3.549 4.854 -6.330 1.00 0.09 C ATOM 1382 O ALA B 129 -3.189 6.013 -6.534 1.00 0.12 O ATOM 1383 CB ALA B 129 -4.324 3.662 -8.386 1.00 0.10 C ATOM 0 H ALA B 129 -3.936 1.919 -6.594 1.00 0.08 H new ATOM 0 HA ALA B 129 -2.291 3.990 -7.824 1.00 0.09 H new ATOM 0 HB1 ALA B 129 -4.426 4.626 -8.885 1.00 0.10 H new ATOM 0 HB2 ALA B 129 -4.061 2.900 -9.119 1.00 0.10 H new ATOM 0 HB3 ALA B 129 -5.269 3.398 -7.911 1.00 0.10 H new ATOM 1389 N PHE B 130 -4.228 4.482 -5.250 1.00 0.08 N ATOM 1390 CA PHE B 130 -4.590 5.434 -4.208 1.00 0.08 C ATOM 1391 C PHE B 130 -3.432 5.624 -3.230 1.00 0.09 C ATOM 1392 O PHE B 130 -3.296 6.682 -2.616 1.00 0.14 O ATOM 1393 CB PHE B 130 -5.843 4.964 -3.464 1.00 0.09 C ATOM 1394 CG PHE B 130 -7.113 5.135 -4.254 1.00 0.09 C ATOM 1395 CD1 PHE B 130 -7.682 6.390 -4.421 1.00 0.11 C ATOM 1396 CD2 PHE B 130 -7.736 4.042 -4.832 1.00 0.14 C ATOM 1397 CE1 PHE B 130 -8.847 6.546 -5.148 1.00 0.13 C ATOM 1398 CE2 PHE B 130 -8.901 4.193 -5.560 1.00 0.17 C ATOM 1399 CZ PHE B 130 -9.456 5.446 -5.720 1.00 0.16 C ATOM 0 H PHE B 130 -4.539 3.527 -5.074 1.00 0.08 H new ATOM 0 HA PHE B 130 -4.806 6.393 -4.679 1.00 0.08 H new ATOM 0 HB2 PHE B 130 -5.727 3.912 -3.202 1.00 0.09 H new ATOM 0 HB3 PHE B 130 -5.929 5.518 -2.529 1.00 0.09 H new ATOM 0 HD1 PHE B 130 -7.209 7.254 -3.978 1.00 0.11 H new ATOM 0 HD2 PHE B 130 -7.306 3.059 -4.712 1.00 0.14 H new ATOM 0 HE1 PHE B 130 -9.281 7.528 -5.269 1.00 0.13 H new ATOM 0 HE2 PHE B 130 -9.377 3.331 -6.003 1.00 0.17 H new ATOM 0 HZ PHE B 130 -10.365 5.567 -6.291 1.00 0.16 H new ATOM 1409 N ILE B 131 -2.598 4.594 -3.094 1.00 0.08 N ATOM 1410 CA ILE B 131 -1.445 4.661 -2.204 1.00 0.09 C ATOM 1411 C ILE B 131 -0.361 5.523 -2.834 1.00 0.10 C ATOM 1412 O ILE B 131 0.290 6.322 -2.159 1.00 0.14 O ATOM 1413 CB ILE B 131 -0.856 3.263 -1.912 1.00 0.10 C ATOM 1414 CG1 ILE B 131 -1.944 2.316 -1.392 1.00 0.11 C ATOM 1415 CG2 ILE B 131 0.295 3.369 -0.914 1.00 0.12 C ATOM 1416 CD1 ILE B 131 -2.390 2.608 0.024 1.00 0.13 C ATOM 0 H ILE B 131 -2.700 3.707 -3.588 1.00 0.08 H new ATOM 0 HA ILE B 131 -1.786 5.094 -1.263 1.00 0.09 H new ATOM 0 HB ILE B 131 -0.466 2.850 -2.842 1.00 0.10 H new ATOM 0 HG12 ILE B 131 -2.808 2.375 -2.053 1.00 0.11 H new ATOM 0 HG13 ILE B 131 -1.574 1.292 -1.441 1.00 0.11 H new ATOM 0 HG21 ILE B 131 0.700 2.376 -0.718 1.00 0.12 H new ATOM 0 HG22 ILE B 131 1.078 4.005 -1.328 1.00 0.12 H new ATOM 0 HG23 ILE B 131 -0.070 3.802 0.017 1.00 0.12 H new ATOM 0 HD11 ILE B 131 -3.161 1.895 0.317 1.00 0.13 H new ATOM 0 HD12 ILE B 131 -1.539 2.520 0.699 1.00 0.13 H new ATOM 0 HD13 ILE B 131 -2.793 3.620 0.077 1.00 0.13 H new ATOM 1428 N SER B 132 -0.181 5.345 -4.139 1.00 0.11 N ATOM 1429 CA SER B 132 0.814 6.099 -4.892 1.00 0.13 C ATOM 1430 C SER B 132 0.572 7.597 -4.758 1.00 0.15 C ATOM 1431 O SER B 132 1.465 8.348 -4.367 1.00 0.21 O ATOM 1432 CB SER B 132 0.767 5.701 -6.368 1.00 0.17 C ATOM 1433 OG SER B 132 1.773 6.369 -7.111 1.00 0.63 O ATOM 0 H SER B 132 -0.715 4.681 -4.699 1.00 0.11 H new ATOM 0 HA SER B 132 1.798 5.867 -4.485 1.00 0.13 H new ATOM 0 HB2 SER B 132 0.898 4.623 -6.461 1.00 0.17 H new ATOM 0 HB3 SER B 132 -0.213 5.940 -6.781 1.00 0.17 H new ATOM 0 HG SER B 132 1.722 6.095 -8.051 1.00 0.63 H new ATOM 1439 N SER B 133 -0.643 8.023 -5.092 1.00 0.15 N ATOM 1440 CA SER B 133 -1.013 9.432 -5.008 1.00 0.19 C ATOM 1441 C SER B 133 -0.760 9.974 -3.608 1.00 0.18 C ATOM 1442 O SER B 133 -0.389 11.135 -3.436 1.00 0.26 O ATOM 1443 CB SER B 133 -2.486 9.616 -5.371 1.00 0.23 C ATOM 1444 OG SER B 133 -2.799 10.986 -5.556 1.00 0.74 O ATOM 0 H SER B 133 -1.389 7.411 -5.424 1.00 0.15 H new ATOM 0 HA SER B 133 -0.396 9.986 -5.716 1.00 0.19 H new ATOM 0 HB2 SER B 133 -2.711 9.062 -6.282 1.00 0.23 H new ATOM 0 HB3 SER B 133 -3.113 9.200 -4.582 1.00 0.23 H new ATOM 0 HG SER B 133 -3.523 11.071 -6.211 1.00 0.74 H new ATOM 1450 N LEU B 134 -0.970 9.124 -2.610 1.00 0.13 N ATOM 1451 CA LEU B 134 -0.771 9.507 -1.217 1.00 0.13 C ATOM 1452 C LEU B 134 0.694 9.837 -0.948 1.00 0.15 C ATOM 1453 O LEU B 134 1.022 10.927 -0.477 1.00 0.21 O ATOM 1454 CB LEU B 134 -1.227 8.376 -0.292 1.00 0.14 C ATOM 1455 CG LEU B 134 -2.199 8.790 0.814 1.00 0.17 C ATOM 1456 CD1 LEU B 134 -2.477 7.618 1.742 1.00 0.22 C ATOM 1457 CD2 LEU B 134 -1.644 9.970 1.595 1.00 0.20 C ATOM 0 H LEU B 134 -1.279 8.161 -2.740 1.00 0.13 H new ATOM 0 HA LEU B 134 -1.367 10.398 -1.019 1.00 0.13 H new ATOM 0 HB2 LEU B 134 -1.699 7.602 -0.897 1.00 0.14 H new ATOM 0 HB3 LEU B 134 -0.347 7.928 0.169 1.00 0.14 H new ATOM 0 HG LEU B 134 -3.139 9.095 0.353 1.00 0.17 H new ATOM 0 HD11 LEU B 134 -3.170 7.929 2.523 1.00 0.22 H new ATOM 0 HD12 LEU B 134 -2.916 6.799 1.172 1.00 0.22 H new ATOM 0 HD13 LEU B 134 -1.544 7.285 2.196 1.00 0.22 H new ATOM 0 HD21 LEU B 134 -2.348 10.252 2.378 1.00 0.20 H new ATOM 0 HD22 LEU B 134 -0.692 9.692 2.046 1.00 0.20 H new ATOM 0 HD23 LEU B 134 -1.494 10.814 0.922 1.00 0.20 H new ATOM 1469 N LEU B 135 1.568 8.887 -1.252 1.00 0.17 N ATOM 1470 CA LEU B 135 3.001 9.058 -1.045 1.00 0.22 C ATOM 1471 C LEU B 135 3.563 10.125 -1.979 1.00 0.24 C ATOM 1472 O LEU B 135 4.615 10.707 -1.715 1.00 0.31 O ATOM 1473 CB LEU B 135 3.722 7.726 -1.270 1.00 0.26 C ATOM 1474 CG LEU B 135 3.633 6.707 -0.121 1.00 0.31 C ATOM 1475 CD1 LEU B 135 2.390 6.924 0.734 1.00 0.67 C ATOM 1476 CD2 LEU B 135 3.641 5.294 -0.677 1.00 0.65 C ATOM 0 H LEU B 135 1.307 7.983 -1.646 1.00 0.17 H new ATOM 0 HA LEU B 135 3.165 9.386 -0.018 1.00 0.22 H new ATOM 0 HB2 LEU B 135 3.317 7.264 -2.170 1.00 0.26 H new ATOM 0 HB3 LEU B 135 4.774 7.934 -1.464 1.00 0.26 H new ATOM 0 HG LEU B 135 4.504 6.853 0.518 1.00 0.31 H new ATOM 0 HD11 LEU B 135 2.365 6.184 1.534 1.00 0.67 H new ATOM 0 HD12 LEU B 135 2.416 7.924 1.166 1.00 0.67 H new ATOM 0 HD13 LEU B 135 1.499 6.819 0.114 1.00 0.67 H new ATOM 0 HD21 LEU B 135 3.578 4.580 0.144 1.00 0.65 H new ATOM 0 HD22 LEU B 135 2.788 5.160 -1.342 1.00 0.65 H new ATOM 0 HD23 LEU B 135 4.564 5.127 -1.233 1.00 0.65 H new ATOM 1488 N ASP B 136 2.852 10.374 -3.073 1.00 0.22 N ATOM 1489 CA ASP B 136 3.273 11.373 -4.048 1.00 0.26 C ATOM 1490 C ASP B 136 2.688 12.741 -3.706 1.00 0.25 C ATOM 1491 O ASP B 136 3.130 13.764 -4.228 1.00 0.29 O ATOM 1492 CB ASP B 136 2.839 10.957 -5.455 1.00 0.29 C ATOM 1493 CG ASP B 136 3.307 11.932 -6.519 1.00 0.37 C ATOM 1494 OD1 ASP B 136 4.455 11.791 -6.988 1.00 0.47 O ATOM 1495 OD2 ASP B 136 2.526 12.838 -6.880 1.00 0.40 O ATOM 0 H ASP B 136 1.981 9.898 -3.307 1.00 0.22 H new ATOM 0 HA ASP B 136 4.360 11.442 -4.017 1.00 0.26 H new ATOM 0 HB2 ASP B 136 3.235 9.966 -5.676 1.00 0.29 H new ATOM 0 HB3 ASP B 136 1.752 10.881 -5.489 1.00 0.29 H new ATOM 1500 N ASP B 137 1.693 12.746 -2.823 1.00 0.24 N ATOM 1501 CA ASP B 137 1.041 13.983 -2.406 1.00 0.27 C ATOM 1502 C ASP B 137 0.220 13.759 -1.135 1.00 0.22 C ATOM 1503 O ASP B 137 -1.007 13.665 -1.188 1.00 0.24 O ATOM 1504 CB ASP B 137 0.137 14.514 -3.523 1.00 0.38 C ATOM 1505 CG ASP B 137 -0.448 15.875 -3.197 1.00 1.19 C ATOM 1506 OD1 ASP B 137 0.191 16.893 -3.538 1.00 1.42 O ATOM 1507 OD2 ASP B 137 -1.545 15.922 -2.602 1.00 2.13 O ATOM 0 H ASP B 137 1.320 11.905 -2.382 1.00 0.24 H new ATOM 0 HA ASP B 137 1.816 14.721 -2.196 1.00 0.27 H new ATOM 0 HB2 ASP B 137 0.709 14.580 -4.449 1.00 0.38 H new ATOM 0 HB3 ASP B 137 -0.673 13.806 -3.698 1.00 0.38 H new ATOM 1512 N PRO B 138 0.893 13.665 0.028 1.00 0.19 N ATOM 1513 CA PRO B 138 0.223 13.448 1.319 1.00 0.21 C ATOM 1514 C PRO B 138 -0.781 14.550 1.654 1.00 0.22 C ATOM 1515 O PRO B 138 -1.518 14.450 2.634 1.00 0.31 O ATOM 1516 CB PRO B 138 1.374 13.456 2.332 1.00 0.24 C ATOM 1517 CG PRO B 138 2.593 13.146 1.533 1.00 0.25 C ATOM 1518 CD PRO B 138 2.356 13.747 0.178 1.00 0.23 C ATOM 0 HA PRO B 138 -0.357 12.525 1.317 1.00 0.21 H new ATOM 0 HB2 PRO B 138 1.460 14.425 2.824 1.00 0.24 H new ATOM 0 HB3 PRO B 138 1.216 12.714 3.115 1.00 0.24 H new ATOM 0 HG2 PRO B 138 3.484 13.569 1.998 1.00 0.25 H new ATOM 0 HG3 PRO B 138 2.751 12.070 1.462 1.00 0.25 H new ATOM 0 HD2 PRO B 138 2.710 14.777 0.126 1.00 0.23 H new ATOM 0 HD3 PRO B 138 2.873 13.193 -0.605 1.00 0.23 H new ATOM 1526 N SER B 139 -0.804 15.599 0.837 1.00 0.20 N ATOM 1527 CA SER B 139 -1.719 16.713 1.054 1.00 0.22 C ATOM 1528 C SER B 139 -3.166 16.285 0.823 1.00 0.19 C ATOM 1529 O SER B 139 -4.058 16.639 1.594 1.00 0.19 O ATOM 1530 CB SER B 139 -1.366 17.881 0.130 1.00 0.28 C ATOM 1531 OG SER B 139 -2.247 18.972 0.329 1.00 1.15 O ATOM 0 H SER B 139 -0.201 15.700 0.021 1.00 0.20 H new ATOM 0 HA SER B 139 -1.616 17.036 2.090 1.00 0.22 H new ATOM 0 HB2 SER B 139 -0.340 18.199 0.316 1.00 0.28 H new ATOM 0 HB3 SER B 139 -1.415 17.555 -0.909 1.00 0.28 H new ATOM 0 HG SER B 139 -2.000 19.706 -0.272 1.00 1.15 H new ATOM 1537 N GLN B 140 -3.390 15.522 -0.241 1.00 0.18 N ATOM 1538 CA GLN B 140 -4.727 15.043 -0.573 1.00 0.17 C ATOM 1539 C GLN B 140 -5.007 13.705 0.091 1.00 0.15 C ATOM 1540 O GLN B 140 -5.910 12.984 -0.316 1.00 0.14 O ATOM 1541 CB GLN B 140 -4.886 14.898 -2.085 1.00 0.21 C ATOM 1542 CG GLN B 140 -4.742 16.203 -2.844 1.00 0.26 C ATOM 1543 CD GLN B 140 -5.745 17.250 -2.398 1.00 1.09 C ATOM 1544 OE1 GLN B 140 -6.860 16.925 -1.990 1.00 1.74 O ATOM 1545 NE2 GLN B 140 -5.351 18.517 -2.471 1.00 1.37 N ATOM 0 H GLN B 140 -2.662 15.221 -0.889 1.00 0.18 H new ATOM 0 HA GLN B 140 -5.441 15.778 -0.203 1.00 0.17 H new ATOM 0 HB2 GLN B 140 -4.143 14.191 -2.453 1.00 0.21 H new ATOM 0 HB3 GLN B 140 -5.866 14.471 -2.299 1.00 0.21 H new ATOM 0 HG2 GLN B 140 -3.732 16.590 -2.706 1.00 0.26 H new ATOM 0 HG3 GLN B 140 -4.868 16.015 -3.910 1.00 0.26 H new ATOM 0 HE21 GLN B 140 -4.418 18.742 -2.815 1.00 1.37 H new ATOM 0 HE22 GLN B 140 -5.982 19.265 -2.183 1.00 1.37 H new ATOM 1554 N SER B 141 -4.225 13.385 1.113 1.00 0.15 N ATOM 1555 CA SER B 141 -4.369 12.126 1.840 1.00 0.13 C ATOM 1556 C SER B 141 -5.830 11.796 2.126 1.00 0.13 C ATOM 1557 O SER B 141 -6.365 10.818 1.605 1.00 0.18 O ATOM 1558 CB SER B 141 -3.589 12.185 3.154 1.00 0.15 C ATOM 1559 OG SER B 141 -3.731 10.982 3.887 1.00 1.01 O ATOM 0 H SER B 141 -3.477 13.985 1.462 1.00 0.15 H new ATOM 0 HA SER B 141 -3.966 11.336 1.206 1.00 0.13 H new ATOM 0 HB2 SER B 141 -2.534 12.365 2.946 1.00 0.15 H new ATOM 0 HB3 SER B 141 -3.944 13.023 3.753 1.00 0.15 H new ATOM 0 HG SER B 141 -3.221 11.045 4.722 1.00 1.01 H new ATOM 1565 N ALA B 142 -6.469 12.611 2.956 1.00 0.16 N ATOM 1566 CA ALA B 142 -7.866 12.394 3.316 1.00 0.17 C ATOM 1567 C ALA B 142 -8.769 12.386 2.090 1.00 0.17 C ATOM 1568 O ALA B 142 -9.829 11.760 2.097 1.00 0.18 O ATOM 1569 CB ALA B 142 -8.325 13.454 4.306 1.00 0.20 C ATOM 0 H ALA B 142 -6.043 13.428 3.393 1.00 0.16 H new ATOM 0 HA ALA B 142 -7.939 11.413 3.785 1.00 0.17 H new ATOM 0 HB1 ALA B 142 -9.369 13.281 4.567 1.00 0.20 H new ATOM 0 HB2 ALA B 142 -7.713 13.401 5.206 1.00 0.20 H new ATOM 0 HB3 ALA B 142 -8.222 14.441 3.856 1.00 0.20 H new ATOM 1575 N ASN B 143 -8.350 13.079 1.037 1.00 0.17 N ATOM 1576 CA ASN B 143 -9.136 13.141 -0.187 1.00 0.18 C ATOM 1577 C ASN B 143 -8.906 11.896 -1.032 1.00 0.16 C ATOM 1578 O ASN B 143 -9.756 11.504 -1.829 1.00 0.17 O ATOM 1579 CB ASN B 143 -8.780 14.392 -0.989 1.00 0.20 C ATOM 1580 CG ASN B 143 -8.913 15.660 -0.168 1.00 0.23 C ATOM 1581 OD1 ASN B 143 -9.975 16.282 -0.134 1.00 0.26 O ATOM 1582 ND2 ASN B 143 -7.833 16.049 0.500 1.00 0.23 N ATOM 0 H ASN B 143 -7.475 13.603 1.007 1.00 0.17 H new ATOM 0 HA ASN B 143 -10.190 13.189 0.086 1.00 0.18 H new ATOM 0 HB2 ASN B 143 -7.758 14.306 -1.357 1.00 0.20 H new ATOM 0 HB3 ASN B 143 -9.429 14.458 -1.862 1.00 0.20 H new ATOM 0 HD21 ASN B 143 -7.863 16.894 1.070 1.00 0.23 H new ATOM 0 HD22 ASN B 143 -6.974 15.503 0.443 1.00 0.23 H new ATOM 1589 N LEU B 144 -7.748 11.281 -0.839 1.00 0.14 N ATOM 1590 CA LEU B 144 -7.371 10.085 -1.572 1.00 0.12 C ATOM 1591 C LEU B 144 -8.008 8.855 -0.943 1.00 0.11 C ATOM 1592 O LEU B 144 -8.421 7.929 -1.642 1.00 0.13 O ATOM 1593 CB LEU B 144 -5.849 9.973 -1.595 1.00 0.12 C ATOM 1594 CG LEU B 144 -5.154 11.020 -2.466 1.00 0.13 C ATOM 1595 CD1 LEU B 144 -3.663 11.040 -2.192 1.00 0.14 C ATOM 1596 CD2 LEU B 144 -5.430 10.751 -3.936 1.00 0.14 C ATOM 0 H LEU B 144 -7.046 11.598 -0.171 1.00 0.14 H new ATOM 0 HA LEU B 144 -7.733 10.151 -2.598 1.00 0.12 H new ATOM 0 HB2 LEU B 144 -5.475 10.059 -0.575 1.00 0.12 H new ATOM 0 HB3 LEU B 144 -5.575 8.980 -1.952 1.00 0.12 H new ATOM 0 HG LEU B 144 -5.556 12.002 -2.215 1.00 0.13 H new ATOM 0 HD11 LEU B 144 -3.187 11.792 -2.822 1.00 0.14 H new ATOM 0 HD12 LEU B 144 -3.489 11.282 -1.144 1.00 0.14 H new ATOM 0 HD13 LEU B 144 -3.239 10.060 -2.413 1.00 0.14 H new ATOM 0 HD21 LEU B 144 -4.929 11.504 -4.544 1.00 0.14 H new ATOM 0 HD22 LEU B 144 -5.055 9.762 -4.202 1.00 0.14 H new ATOM 0 HD23 LEU B 144 -6.504 10.793 -4.118 1.00 0.14 H new ATOM 1608 N LEU B 145 -8.080 8.851 0.383 1.00 0.11 N ATOM 1609 CA LEU B 145 -8.704 7.757 1.110 1.00 0.11 C ATOM 1610 C LEU B 145 -10.210 7.861 0.930 1.00 0.12 C ATOM 1611 O LEU B 145 -10.923 6.857 0.896 1.00 0.11 O ATOM 1612 CB LEU B 145 -8.327 7.815 2.596 1.00 0.12 C ATOM 1613 CG LEU B 145 -9.279 7.094 3.558 1.00 0.13 C ATOM 1614 CD1 LEU B 145 -9.414 5.621 3.200 1.00 0.15 C ATOM 1615 CD2 LEU B 145 -8.793 7.247 4.991 1.00 0.16 C ATOM 0 H LEU B 145 -7.713 9.596 0.976 1.00 0.11 H new ATOM 0 HA LEU B 145 -8.353 6.802 0.720 1.00 0.11 H new ATOM 0 HB2 LEU B 145 -7.331 7.389 2.715 1.00 0.12 H new ATOM 0 HB3 LEU B 145 -8.264 8.862 2.894 1.00 0.12 H new ATOM 0 HG LEU B 145 -10.263 7.553 3.466 1.00 0.13 H new ATOM 0 HD11 LEU B 145 -10.095 5.137 3.900 1.00 0.15 H new ATOM 0 HD12 LEU B 145 -9.807 5.527 2.188 1.00 0.15 H new ATOM 0 HD13 LEU B 145 -8.436 5.142 3.255 1.00 0.15 H new ATOM 0 HD21 LEU B 145 -9.477 6.731 5.664 1.00 0.16 H new ATOM 0 HD22 LEU B 145 -7.797 6.815 5.085 1.00 0.16 H new ATOM 0 HD23 LEU B 145 -8.756 8.305 5.252 1.00 0.16 H new ATOM 1627 N ALA B 146 -10.677 9.098 0.809 1.00 0.16 N ATOM 1628 CA ALA B 146 -12.090 9.367 0.596 1.00 0.17 C ATOM 1629 C ALA B 146 -12.533 8.771 -0.731 1.00 0.16 C ATOM 1630 O ALA B 146 -13.521 8.045 -0.800 1.00 0.17 O ATOM 1631 CB ALA B 146 -12.355 10.866 0.617 1.00 0.20 C ATOM 0 H ALA B 146 -10.093 9.933 0.855 1.00 0.16 H new ATOM 0 HA ALA B 146 -12.662 8.906 1.401 1.00 0.17 H new ATOM 0 HB1 ALA B 146 -13.417 11.050 0.456 1.00 0.20 H new ATOM 0 HB2 ALA B 146 -12.058 11.274 1.583 1.00 0.20 H new ATOM 0 HB3 ALA B 146 -11.779 11.348 -0.173 1.00 0.20 H new ATOM 1637 N GLU B 147 -11.773 9.078 -1.781 1.00 0.18 N ATOM 1638 CA GLU B 147 -12.060 8.576 -3.116 1.00 0.19 C ATOM 1639 C GLU B 147 -12.032 7.060 -3.113 1.00 0.16 C ATOM 1640 O GLU B 147 -12.930 6.405 -3.640 1.00 0.18 O ATOM 1641 CB GLU B 147 -11.021 9.103 -4.102 1.00 0.27 C ATOM 1642 CG GLU B 147 -11.078 10.605 -4.296 1.00 0.18 C ATOM 1643 CD GLU B 147 -12.137 11.027 -5.295 1.00 0.39 C ATOM 1644 OE1 GLU B 147 -13.301 11.215 -4.882 1.00 0.62 O ATOM 1645 OE2 GLU B 147 -11.802 11.172 -6.490 1.00 0.57 O ATOM 0 H GLU B 147 -10.949 9.677 -1.728 1.00 0.18 H new ATOM 0 HA GLU B 147 -13.050 8.918 -3.418 1.00 0.19 H new ATOM 0 HB2 GLU B 147 -10.026 8.828 -3.751 1.00 0.27 H new ATOM 0 HB3 GLU B 147 -11.166 8.615 -5.066 1.00 0.27 H new ATOM 0 HG2 GLU B 147 -11.278 11.084 -3.337 1.00 0.18 H new ATOM 0 HG3 GLU B 147 -10.104 10.961 -4.633 1.00 0.18 H new ATOM 1652 N ALA B 148 -10.976 6.518 -2.520 1.00 0.13 N ATOM 1653 CA ALA B 148 -10.805 5.080 -2.419 1.00 0.12 C ATOM 1654 C ALA B 148 -12.057 4.426 -1.851 1.00 0.14 C ATOM 1655 O ALA B 148 -12.516 3.401 -2.353 1.00 0.20 O ATOM 1656 CB ALA B 148 -9.603 4.759 -1.549 1.00 0.11 C ATOM 0 H ALA B 148 -10.221 7.060 -2.100 1.00 0.13 H new ATOM 0 HA ALA B 148 -10.636 4.681 -3.419 1.00 0.12 H new ATOM 0 HB1 ALA B 148 -9.483 3.678 -1.479 1.00 0.11 H new ATOM 0 HB2 ALA B 148 -8.707 5.196 -1.990 1.00 0.11 H new ATOM 0 HB3 ALA B 148 -9.755 5.172 -0.552 1.00 0.11 H new ATOM 1662 N LYS B 149 -12.600 5.027 -0.796 1.00 0.14 N ATOM 1663 CA LYS B 149 -13.805 4.514 -0.164 1.00 0.17 C ATOM 1664 C LYS B 149 -15.011 4.712 -1.077 1.00 0.17 C ATOM 1665 O LYS B 149 -15.931 3.895 -1.086 1.00 0.22 O ATOM 1666 CB LYS B 149 -14.028 5.191 1.190 1.00 0.24 C ATOM 1667 CG LYS B 149 -13.129 4.642 2.287 1.00 0.34 C ATOM 1668 CD LYS B 149 -13.355 5.345 3.614 1.00 0.42 C ATOM 1669 CE LYS B 149 -12.844 6.774 3.582 1.00 0.59 C ATOM 1670 NZ LYS B 149 -13.886 7.728 3.106 1.00 1.01 N ATOM 0 H LYS B 149 -12.222 5.870 -0.363 1.00 0.14 H new ATOM 0 HA LYS B 149 -13.681 3.445 0.007 1.00 0.17 H new ATOM 0 HB2 LYS B 149 -13.853 6.262 1.087 1.00 0.24 H new ATOM 0 HB3 LYS B 149 -15.070 5.065 1.485 1.00 0.24 H new ATOM 0 HG2 LYS B 149 -13.314 3.574 2.406 1.00 0.34 H new ATOM 0 HG3 LYS B 149 -12.086 4.754 1.991 1.00 0.34 H new ATOM 0 HD2 LYS B 149 -14.419 5.343 3.851 1.00 0.42 H new ATOM 0 HD3 LYS B 149 -12.851 4.795 4.409 1.00 0.42 H new ATOM 0 HE2 LYS B 149 -12.515 7.064 4.580 1.00 0.59 H new ATOM 0 HE3 LYS B 149 -11.973 6.833 2.930 1.00 0.59 H new ATOM 0 HZ1 LYS B 149 -13.675 8.681 3.466 1.00 1.01 H new ATOM 0 HZ2 LYS B 149 -13.893 7.744 2.066 1.00 1.01 H new ATOM 0 HZ3 LYS B 149 -14.818 7.426 3.454 1.00 1.01 H new ATOM 1684 N LYS B 150 -15.002 5.801 -1.846 1.00 0.17 N ATOM 1685 CA LYS B 150 -16.089 6.076 -2.778 1.00 0.20 C ATOM 1686 C LYS B 150 -16.096 5.030 -3.882 1.00 0.21 C ATOM 1687 O LYS B 150 -17.145 4.687 -4.428 1.00 0.30 O ATOM 1688 CB LYS B 150 -15.949 7.471 -3.395 1.00 0.25 C ATOM 1689 CG LYS B 150 -16.076 8.604 -2.393 1.00 0.72 C ATOM 1690 CD LYS B 150 -16.403 9.922 -3.079 1.00 0.81 C ATOM 1691 CE LYS B 150 -17.816 9.923 -3.644 1.00 1.28 C ATOM 1692 NZ LYS B 150 -18.129 11.193 -4.355 1.00 1.99 N ATOM 0 H LYS B 150 -14.259 6.500 -1.841 1.00 0.17 H new ATOM 0 HA LYS B 150 -17.028 6.037 -2.226 1.00 0.20 H new ATOM 0 HB2 LYS B 150 -14.980 7.543 -3.889 1.00 0.25 H new ATOM 0 HB3 LYS B 150 -16.710 7.594 -4.166 1.00 0.25 H new ATOM 0 HG2 LYS B 150 -16.856 8.366 -1.670 1.00 0.72 H new ATOM 0 HG3 LYS B 150 -15.145 8.704 -1.836 1.00 0.72 H new ATOM 0 HD2 LYS B 150 -16.294 10.740 -2.367 1.00 0.81 H new ATOM 0 HD3 LYS B 150 -15.689 10.102 -3.883 1.00 0.81 H new ATOM 0 HE2 LYS B 150 -17.933 9.084 -4.330 1.00 1.28 H new ATOM 0 HE3 LYS B 150 -18.531 9.775 -2.835 1.00 1.28 H new ATOM 0 HZ1 LYS B 150 -19.100 11.154 -4.725 1.00 1.99 H new ATOM 0 HZ2 LYS B 150 -18.042 11.991 -3.694 1.00 1.99 H new ATOM 0 HZ3 LYS B 150 -17.463 11.323 -5.143 1.00 1.99 H new ATOM 1706 N LEU B 151 -14.907 4.530 -4.201 1.00 0.16 N ATOM 1707 CA LEU B 151 -14.751 3.516 -5.232 1.00 0.16 C ATOM 1708 C LEU B 151 -15.153 2.154 -4.683 1.00 0.15 C ATOM 1709 O LEU B 151 -15.851 1.383 -5.343 1.00 0.18 O ATOM 1710 CB LEU B 151 -13.299 3.489 -5.725 1.00 0.16 C ATOM 1711 CG LEU B 151 -13.013 2.539 -6.893 1.00 0.16 C ATOM 1712 CD1 LEU B 151 -14.057 2.697 -7.987 1.00 0.18 C ATOM 1713 CD2 LEU B 151 -11.618 2.791 -7.447 1.00 0.18 C ATOM 0 H LEU B 151 -14.034 4.814 -3.756 1.00 0.16 H new ATOM 0 HA LEU B 151 -15.399 3.758 -6.074 1.00 0.16 H new ATOM 0 HB2 LEU B 151 -13.017 4.499 -6.024 1.00 0.16 H new ATOM 0 HB3 LEU B 151 -12.656 3.213 -4.890 1.00 0.16 H new ATOM 0 HG LEU B 151 -13.063 1.515 -6.523 1.00 0.16 H new ATOM 0 HD11 LEU B 151 -13.833 2.013 -8.805 1.00 0.18 H new ATOM 0 HD12 LEU B 151 -15.044 2.470 -7.584 1.00 0.18 H new ATOM 0 HD13 LEU B 151 -14.044 3.722 -8.357 1.00 0.18 H new ATOM 0 HD21 LEU B 151 -11.427 2.110 -8.276 1.00 0.18 H new ATOM 0 HD22 LEU B 151 -11.547 3.820 -7.799 1.00 0.18 H new ATOM 0 HD23 LEU B 151 -10.879 2.624 -6.663 1.00 0.18 H new ATOM 1725 N ASN B 152 -14.693 1.868 -3.472 1.00 0.13 N ATOM 1726 CA ASN B 152 -15.016 0.615 -2.799 1.00 0.14 C ATOM 1727 C ASN B 152 -16.527 0.408 -2.739 1.00 0.17 C ATOM 1728 O ASN B 152 -17.046 -0.591 -3.237 1.00 0.21 O ATOM 1729 CB ASN B 152 -14.434 0.614 -1.385 1.00 0.20 C ATOM 1730 CG ASN B 152 -14.930 -0.552 -0.552 1.00 0.39 C ATOM 1731 OD1 ASN B 152 -15.966 -0.462 0.108 1.00 1.39 O ATOM 1732 ND2 ASN B 152 -14.191 -1.653 -0.576 1.00 0.69 N ATOM 0 H ASN B 152 -14.091 2.490 -2.932 1.00 0.13 H new ATOM 0 HA ASN B 152 -14.577 -0.204 -3.368 1.00 0.14 H new ATOM 0 HB2 ASN B 152 -13.346 0.577 -1.444 1.00 0.20 H new ATOM 0 HB3 ASN B 152 -14.695 1.548 -0.888 1.00 0.20 H new ATOM 0 HD21 ASN B 152 -14.474 -2.469 -0.033 1.00 0.69 H new ATOM 0 HD22 ASN B 152 -13.340 -1.684 -1.137 1.00 0.69 H new ATOM 1739 N ASP B 153 -17.224 1.361 -2.128 1.00 0.18 N ATOM 1740 CA ASP B 153 -18.677 1.286 -1.999 1.00 0.23 C ATOM 1741 C ASP B 153 -19.356 1.300 -3.366 1.00 0.25 C ATOM 1742 O ASP B 153 -20.440 0.740 -3.534 1.00 0.31 O ATOM 1743 CB ASP B 153 -19.195 2.445 -1.146 1.00 0.28 C ATOM 1744 CG ASP B 153 -18.732 2.354 0.295 1.00 1.20 C ATOM 1745 OD1 ASP B 153 -19.343 1.585 1.067 1.00 1.04 O ATOM 1746 OD2 ASP B 153 -17.760 3.051 0.651 1.00 2.25 O ATOM 0 H ASP B 153 -16.807 2.195 -1.714 1.00 0.18 H new ATOM 0 HA ASP B 153 -18.920 0.344 -1.508 1.00 0.23 H new ATOM 0 HB2 ASP B 153 -18.856 3.388 -1.575 1.00 0.28 H new ATOM 0 HB3 ASP B 153 -20.285 2.455 -1.175 1.00 0.28 H new ATOM 1751 N ALA B 154 -18.718 1.944 -4.338 1.00 0.23 N ATOM 1752 CA ALA B 154 -19.266 2.027 -5.689 1.00 0.28 C ATOM 1753 C ALA B 154 -19.451 0.636 -6.291 1.00 0.30 C ATOM 1754 O ALA B 154 -20.557 0.261 -6.679 1.00 0.35 O ATOM 1755 CB ALA B 154 -18.363 2.873 -6.574 1.00 0.28 C ATOM 0 H ALA B 154 -17.822 2.416 -4.217 1.00 0.23 H new ATOM 0 HA ALA B 154 -20.245 2.503 -5.630 1.00 0.28 H new ATOM 0 HB1 ALA B 154 -18.784 2.926 -7.578 1.00 0.28 H new ATOM 0 HB2 ALA B 154 -18.285 3.878 -6.159 1.00 0.28 H new ATOM 0 HB3 ALA B 154 -17.372 2.422 -6.619 1.00 0.28 H new ATOM 1761 N GLN B 155 -18.363 -0.124 -6.362 1.00 0.30 N ATOM 1762 CA GLN B 155 -18.407 -1.472 -6.918 1.00 0.35 C ATOM 1763 C GLN B 155 -18.968 -2.458 -5.900 1.00 0.36 C ATOM 1764 O GLN B 155 -19.344 -3.578 -6.247 1.00 0.44 O ATOM 1765 CB GLN B 155 -17.010 -1.912 -7.356 1.00 0.35 C ATOM 1766 CG GLN B 155 -16.296 -0.887 -8.221 1.00 0.36 C ATOM 1767 CD GLN B 155 -15.010 -1.423 -8.815 1.00 0.41 C ATOM 1768 OE1 GLN B 155 -15.002 -1.968 -9.920 1.00 0.51 O ATOM 1769 NE2 GLN B 155 -13.914 -1.278 -8.082 1.00 0.39 N ATOM 0 H GLN B 155 -17.440 0.170 -6.042 1.00 0.30 H new ATOM 0 HA GLN B 155 -19.064 -1.460 -7.788 1.00 0.35 H new ATOM 0 HB2 GLN B 155 -16.406 -2.112 -6.471 1.00 0.35 H new ATOM 0 HB3 GLN B 155 -17.089 -2.849 -7.907 1.00 0.35 H new ATOM 0 HG2 GLN B 155 -16.960 -0.570 -9.026 1.00 0.36 H new ATOM 0 HG3 GLN B 155 -16.075 -0.003 -7.623 1.00 0.36 H new ATOM 0 HE21 GLN B 155 -13.966 -0.820 -7.172 1.00 0.39 H new ATOM 0 HE22 GLN B 155 -13.019 -1.624 -8.428 1.00 0.39 H new