USER MOD reduce.3.24.130724 H: found=0, std=0, add=745, rem=0, adj=22 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 :FLIP amide:sc= -3.67 F(o=-8.4,f=-7.6) USER MOD Set 1.2: B 126 GLN : amide:sc= -4.1! C(o=-7.6!,f=-12!) USER MOD Set 1.3: B 155 GLN : amide:sc= 0.218 X(o=-7.6,f=-8) USER MOD Set 2.1: B 121 ASN : amide:sc=0.000201 X(o=-2.1,f=-2.1) USER MOD Set 2.2: B 152 ASN :FLIP amide:sc= -2.13 F(o=-6.9!,f=-2.1) USER MOD Set 3.1: A 39 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 40 GLN : amide:sc= -0.106 X(o=-0.11,f=-0.035) USER MOD Set 4.1: A 28 ASN : amide:sc= -5.08! C(o=-5.1!,f=-5.5!) USER MOD Set 4.2: B 132 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 23 ASN :FLIP amide:sc= 0.0872 F(o=-1.7,f=-0.2) USER MOD Set 5.2: A 55 GLN :FLIP amide:sc= -0.291 F(o=-1.7,f=-0.2) USER MOD Single : A 6 ASN : amide:sc= -0.0572 K(o=-0.057,f=-1.3!) USER MOD Single : A 7 LYS NZ :NH3+ -145:sc= -1.78! (180deg=-4.33!) USER MOD Single : A 9 GLN : amide:sc= -1.77! X(o=-1.8!,f=-1.9) USER MOD Single : A 10 GLN : amide:sc=-0.00696 K(o=-0.007,f=-0.94) USER MOD Single : A 11 ASN : amide:sc= -0.989 X(o=-0.99,f=-0.91) USER MOD Single : A 14 TYR OH : rot 180:sc= -1.02 USER MOD Single : A 18 HIS : no HD1:sc= -0.132 X(o=-0.13,f=0.022) USER MOD Single : A 21 ASN : amide:sc= -1.64 X(o=-1.6,f=-1.6) USER MOD Single : A 26 GLN : amide:sc= -2.24 K(o=-2.2,f=-6.1!) USER MOD Single : A 32 GLN :FLIP amide:sc= -1.56 F(o=-2.7,f=-1.6) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -133:sc= 0 (180deg=-0.717) USER MOD Single : A 41 SER OG : rot -92:sc= 0.526 USER MOD Single : A 43 ASN :FLIP amide:sc= -0.153 F(o=-2.7!,f=-0.15) 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= -2.7 K(o=-2.7,f=-13!) USER MOD Single : B 109 THR OG1 : rot 25:sc= 0.068 USER MOD Single : B 110 GLN :FLIP amide:sc= 0 F(o=-0.59,f=0) USER MOD Single : B 113 SER OG : rot -38:sc= -0.0195 USER MOD Single : B 118 THR OG1 : rot -10:sc= 0.77 USER MOD Single : B 133 SER OG : rot 91:sc= 0.625 USER MOD Single : B 139 SER OG : rot 180:sc= 0 USER MOD Single : B 140 GLN :FLIP amide:sc= -4.85! C(o=-7!,f=-4.9!) USER MOD Single : B 141 SER OG : rot 180:sc= -0.726 USER MOD Single : B 143 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) 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 -4.708 -10.055 8.247 1.00 0.35 N ATOM 88 CA ASN A 6 -3.989 -10.449 9.451 1.00 0.37 C ATOM 89 C ASN A 6 -2.873 -9.468 9.802 1.00 0.37 C ATOM 90 O ASN A 6 -2.757 -8.399 9.204 1.00 0.36 O ATOM 91 CB ASN A 6 -3.414 -11.854 9.270 1.00 0.36 C ATOM 92 CG ASN A 6 -4.464 -12.936 9.433 1.00 0.97 C ATOM 93 OD1 ASN A 6 -5.421 -12.780 10.192 1.00 1.73 O ATOM 94 ND2 ASN A 6 -4.290 -14.040 8.717 1.00 1.69 N ATOM 0 HA ASN A 6 -4.699 -10.442 10.278 1.00 0.37 H new ATOM 0 HB2 ASN A 6 -2.964 -11.934 8.280 1.00 0.36 H new ATOM 0 HB3 ASN A 6 -2.617 -12.013 9.996 1.00 0.36 H new ATOM 0 HD21 ASN A 6 -4.964 -14.802 8.783 1.00 1.69 H new ATOM 0 HD22 ASN A 6 -3.482 -14.126 8.101 1.00 1.69 H new ATOM 101 N LYS A 7 -2.053 -9.847 10.778 1.00 0.40 N ATOM 102 CA LYS A 7 -0.950 -9.005 11.228 1.00 0.43 C ATOM 103 C LYS A 7 0.156 -8.929 10.180 1.00 0.40 C ATOM 104 O LYS A 7 0.542 -7.841 9.757 1.00 0.38 O ATOM 105 CB LYS A 7 -0.387 -9.533 12.550 1.00 0.52 C ATOM 106 CG LYS A 7 0.765 -8.704 13.106 1.00 0.58 C ATOM 107 CD LYS A 7 0.370 -7.250 13.338 1.00 0.60 C ATOM 108 CE LYS A 7 -0.512 -7.086 14.567 1.00 1.39 C ATOM 109 NZ LYS A 7 -1.878 -7.643 14.358 1.00 1.90 N ATOM 0 H LYS A 7 -2.132 -10.735 11.274 1.00 0.40 H new ATOM 0 HA LYS A 7 -1.339 -7.998 11.380 1.00 0.43 H new ATOM 0 HB2 LYS A 7 -1.188 -9.564 13.288 1.00 0.52 H new ATOM 0 HB3 LYS A 7 -0.047 -10.558 12.405 1.00 0.52 H new ATOM 0 HG2 LYS A 7 1.104 -9.141 14.045 1.00 0.58 H new ATOM 0 HG3 LYS A 7 1.606 -8.744 12.414 1.00 0.58 H new ATOM 0 HD2 LYS A 7 1.269 -6.645 13.454 1.00 0.60 H new ATOM 0 HD3 LYS A 7 -0.157 -6.874 12.461 1.00 0.60 H new ATOM 0 HE2 LYS A 7 -0.045 -7.584 15.417 1.00 1.39 H new ATOM 0 HE3 LYS A 7 -0.587 -6.028 14.819 1.00 1.39 H new ATOM 0 HZ1 LYS A 7 -2.573 -7.058 14.864 1.00 1.90 H new ATOM 0 HZ2 LYS A 7 -2.101 -7.644 13.342 1.00 1.90 H new ATOM 0 HZ3 LYS A 7 -1.915 -8.617 14.722 1.00 1.90 H new ATOM 123 N GLU A 8 0.666 -10.087 9.769 1.00 0.43 N ATOM 124 CA GLU A 8 1.732 -10.139 8.772 1.00 0.43 C ATOM 125 C GLU A 8 1.320 -9.416 7.495 1.00 0.37 C ATOM 126 O GLU A 8 2.158 -8.849 6.794 1.00 0.39 O ATOM 127 CB GLU A 8 2.100 -11.588 8.454 1.00 0.47 C ATOM 128 CG GLU A 8 2.519 -12.390 9.675 1.00 0.52 C ATOM 129 CD GLU A 8 2.922 -13.809 9.327 1.00 1.03 C ATOM 130 OE1 GLU A 8 4.099 -14.019 8.963 1.00 1.80 O ATOM 131 OE2 GLU A 8 2.063 -14.711 9.419 1.00 0.95 O ATOM 0 H GLU A 8 0.360 -10.999 10.109 1.00 0.43 H new ATOM 0 HA GLU A 8 2.604 -9.636 9.189 1.00 0.43 H new ATOM 0 HB2 GLU A 8 1.246 -12.076 7.984 1.00 0.47 H new ATOM 0 HB3 GLU A 8 2.912 -11.597 7.727 1.00 0.47 H new ATOM 0 HG2 GLU A 8 3.353 -11.889 10.166 1.00 0.52 H new ATOM 0 HG3 GLU A 8 1.696 -12.414 10.390 1.00 0.52 H new ATOM 138 N GLN A 9 0.025 -9.444 7.197 1.00 0.34 N ATOM 139 CA GLN A 9 -0.495 -8.785 6.007 1.00 0.33 C ATOM 140 C GLN A 9 -0.422 -7.270 6.167 1.00 0.30 C ATOM 141 O GLN A 9 -0.276 -6.535 5.191 1.00 0.32 O ATOM 142 CB GLN A 9 -1.940 -9.220 5.754 1.00 0.36 C ATOM 143 CG GLN A 9 -2.376 -9.072 4.306 1.00 0.38 C ATOM 144 CD GLN A 9 -3.733 -9.692 4.039 1.00 0.73 C ATOM 145 OE1 GLN A 9 -4.128 -10.658 4.693 1.00 1.44 O ATOM 146 NE2 GLN A 9 -4.455 -9.142 3.069 1.00 0.50 N ATOM 0 H GLN A 9 -0.681 -9.915 7.762 1.00 0.34 H new ATOM 0 HA GLN A 9 0.115 -9.075 5.151 1.00 0.33 H new ATOM 0 HB2 GLN A 9 -2.055 -10.261 6.054 1.00 0.36 H new ATOM 0 HB3 GLN A 9 -2.604 -8.631 6.387 1.00 0.36 H new ATOM 0 HG2 GLN A 9 -2.407 -8.014 4.046 1.00 0.38 H new ATOM 0 HG3 GLN A 9 -1.634 -9.538 3.658 1.00 0.38 H new ATOM 0 HE21 GLN A 9 -4.090 -8.342 2.552 1.00 0.50 H new ATOM 0 HE22 GLN A 9 -5.375 -9.519 2.841 1.00 0.50 H new ATOM 155 N GLN A 10 -0.523 -6.816 7.414 1.00 0.27 N ATOM 156 CA GLN A 10 -0.466 -5.392 7.727 1.00 0.25 C ATOM 157 C GLN A 10 0.978 -4.898 7.760 1.00 0.23 C ATOM 158 O GLN A 10 1.296 -3.845 7.207 1.00 0.26 O ATOM 159 CB GLN A 10 -1.141 -5.125 9.073 1.00 0.26 C ATOM 160 CG GLN A 10 -1.333 -3.649 9.377 1.00 0.26 C ATOM 161 CD GLN A 10 -1.839 -3.406 10.785 1.00 0.64 C ATOM 162 OE1 GLN A 10 -1.567 -4.185 11.699 1.00 1.18 O ATOM 163 NE2 GLN A 10 -2.580 -2.319 10.969 1.00 0.89 N ATOM 0 H GLN A 10 -0.645 -7.419 8.228 1.00 0.27 H new ATOM 0 HA GLN A 10 -0.996 -4.848 6.945 1.00 0.25 H new ATOM 0 HB2 GLN A 10 -2.112 -5.619 9.087 1.00 0.26 H new ATOM 0 HB3 GLN A 10 -0.543 -5.575 9.865 1.00 0.26 H new ATOM 0 HG2 GLN A 10 -0.386 -3.127 9.240 1.00 0.26 H new ATOM 0 HG3 GLN A 10 -2.038 -3.223 8.663 1.00 0.26 H new ATOM 0 HE21 GLN A 10 -2.781 -1.700 10.184 1.00 0.89 H new ATOM 0 HE22 GLN A 10 -2.948 -2.103 11.896 1.00 0.89 H new ATOM 172 N ASN A 11 1.845 -5.664 8.417 1.00 0.24 N ATOM 173 CA ASN A 11 3.255 -5.306 8.524 1.00 0.23 C ATOM 174 C ASN A 11 3.907 -5.251 7.147 1.00 0.21 C ATOM 175 O ASN A 11 4.669 -4.334 6.847 1.00 0.22 O ATOM 176 CB ASN A 11 3.997 -6.315 9.405 1.00 0.27 C ATOM 177 CG ASN A 11 3.395 -6.434 10.791 1.00 0.72 C ATOM 178 OD1 ASN A 11 2.811 -5.483 11.313 1.00 1.08 O ATOM 179 ND2 ASN A 11 3.540 -7.606 11.399 1.00 0.82 N ATOM 0 H ASN A 11 1.595 -6.536 8.883 1.00 0.24 H new ATOM 0 HA ASN A 11 3.317 -4.318 8.980 1.00 0.23 H new ATOM 0 HB2 ASN A 11 3.983 -7.292 8.922 1.00 0.27 H new ATOM 0 HB3 ASN A 11 5.042 -6.017 9.491 1.00 0.27 H new ATOM 0 HD21 ASN A 11 3.160 -7.745 12.335 1.00 0.82 H new ATOM 0 HD22 ASN A 11 4.031 -8.367 10.929 1.00 0.82 H new ATOM 186 N ALA A 12 3.599 -6.240 6.314 1.00 0.19 N ATOM 187 CA ALA A 12 4.155 -6.313 4.968 1.00 0.18 C ATOM 188 C ALA A 12 3.838 -5.056 4.168 1.00 0.15 C ATOM 189 O ALA A 12 4.665 -4.575 3.396 1.00 0.20 O ATOM 190 CB ALA A 12 3.628 -7.547 4.251 1.00 0.22 C ATOM 0 H ALA A 12 2.965 -7.004 6.549 1.00 0.19 H new ATOM 0 HA ALA A 12 5.239 -6.387 5.053 1.00 0.18 H new ATOM 0 HB1 ALA A 12 4.049 -7.592 3.247 1.00 0.22 H new ATOM 0 HB2 ALA A 12 3.915 -8.440 4.805 1.00 0.22 H new ATOM 0 HB3 ALA A 12 2.541 -7.494 4.186 1.00 0.22 H new ATOM 196 N PHE A 13 2.636 -4.529 4.360 1.00 0.13 N ATOM 197 CA PHE A 13 2.204 -3.327 3.659 1.00 0.11 C ATOM 198 C PHE A 13 3.102 -2.140 4.003 1.00 0.11 C ATOM 199 O PHE A 13 3.744 -1.562 3.126 1.00 0.15 O ATOM 200 CB PHE A 13 0.750 -3.013 4.021 1.00 0.14 C ATOM 201 CG PHE A 13 0.253 -1.698 3.488 1.00 0.12 C ATOM 202 CD1 PHE A 13 -0.266 -1.608 2.206 1.00 0.12 C ATOM 203 CD2 PHE A 13 0.314 -0.552 4.265 1.00 0.13 C ATOM 204 CE1 PHE A 13 -0.716 -0.400 1.712 1.00 0.11 C ATOM 205 CE2 PHE A 13 -0.136 0.658 3.774 1.00 0.13 C ATOM 206 CZ PHE A 13 -0.674 0.732 2.512 1.00 0.11 C ATOM 0 H PHE A 13 1.941 -4.917 4.998 1.00 0.13 H new ATOM 0 HA PHE A 13 2.278 -3.506 2.586 1.00 0.11 H new ATOM 0 HB2 PHE A 13 0.112 -3.811 3.641 1.00 0.14 H new ATOM 0 HB3 PHE A 13 0.649 -3.014 5.106 1.00 0.14 H new ATOM 0 HD1 PHE A 13 -0.319 -2.492 1.587 1.00 0.12 H new ATOM 0 HD2 PHE A 13 0.718 -0.606 5.265 1.00 0.13 H new ATOM 0 HE1 PHE A 13 -1.100 -0.337 0.705 1.00 0.11 H new ATOM 0 HE2 PHE A 13 -0.065 1.547 4.383 1.00 0.13 H new ATOM 0 HZ PHE A 13 -1.063 1.670 2.144 1.00 0.11 H new ATOM 216 N TYR A 14 3.142 -1.790 5.284 1.00 0.11 N ATOM 217 CA TYR A 14 3.947 -0.665 5.753 1.00 0.13 C ATOM 218 C TYR A 14 5.424 -0.832 5.405 1.00 0.13 C ATOM 219 O TYR A 14 6.047 0.089 4.881 1.00 0.17 O ATOM 220 CB TYR A 14 3.786 -0.497 7.264 1.00 0.16 C ATOM 221 CG TYR A 14 2.388 -0.102 7.684 1.00 0.19 C ATOM 222 CD1 TYR A 14 1.853 1.126 7.314 1.00 0.24 C ATOM 223 CD2 TYR A 14 1.607 -0.953 8.456 1.00 0.26 C ATOM 224 CE1 TYR A 14 0.579 1.496 7.704 1.00 0.31 C ATOM 225 CE2 TYR A 14 0.333 -0.591 8.848 1.00 0.32 C ATOM 226 CZ TYR A 14 -0.175 0.634 8.471 1.00 0.33 C ATOM 227 OH TYR A 14 -1.442 0.998 8.865 1.00 0.42 O ATOM 0 H TYR A 14 2.624 -2.271 6.020 1.00 0.11 H new ATOM 0 HA TYR A 14 3.586 0.228 5.243 1.00 0.13 H new ATOM 0 HB2 TYR A 14 4.053 -1.432 7.756 1.00 0.16 H new ATOM 0 HB3 TYR A 14 4.489 0.259 7.614 1.00 0.16 H new ATOM 0 HD1 TYR A 14 2.442 1.802 6.712 1.00 0.24 H new ATOM 0 HD2 TYR A 14 2.002 -1.913 8.754 1.00 0.26 H new ATOM 0 HE1 TYR A 14 0.177 2.454 7.410 1.00 0.31 H new ATOM 0 HE2 TYR A 14 -0.262 -1.264 9.447 1.00 0.32 H new ATOM 0 HH TYR A 14 -1.838 0.278 9.399 1.00 0.42 H new ATOM 237 N GLU A 15 5.983 -2.003 5.701 1.00 0.11 N ATOM 238 CA GLU A 15 7.391 -2.269 5.420 1.00 0.12 C ATOM 239 C GLU A 15 7.725 -1.984 3.958 1.00 0.12 C ATOM 240 O GLU A 15 8.866 -1.666 3.623 1.00 0.19 O ATOM 241 CB GLU A 15 7.744 -3.716 5.766 1.00 0.13 C ATOM 242 CG GLU A 15 7.698 -4.013 7.257 1.00 0.19 C ATOM 243 CD GLU A 15 8.108 -5.436 7.581 1.00 1.16 C ATOM 244 OE1 GLU A 15 9.317 -5.676 7.778 1.00 1.08 O ATOM 245 OE2 GLU A 15 7.218 -6.312 7.637 1.00 2.16 O ATOM 0 H GLU A 15 5.484 -2.780 6.134 1.00 0.11 H new ATOM 0 HA GLU A 15 7.986 -1.601 6.043 1.00 0.12 H new ATOM 0 HB2 GLU A 15 7.054 -4.383 5.249 1.00 0.13 H new ATOM 0 HB3 GLU A 15 8.743 -3.938 5.390 1.00 0.13 H new ATOM 0 HG2 GLU A 15 8.356 -3.321 7.782 1.00 0.19 H new ATOM 0 HG3 GLU A 15 6.688 -3.836 7.628 1.00 0.19 H new ATOM 252 N ILE A 16 6.723 -2.103 3.091 1.00 0.10 N ATOM 253 CA ILE A 16 6.908 -1.850 1.667 1.00 0.09 C ATOM 254 C ILE A 16 6.883 -0.350 1.375 1.00 0.12 C ATOM 255 O ILE A 16 7.582 0.130 0.482 1.00 0.16 O ATOM 256 CB ILE A 16 5.827 -2.570 0.829 1.00 0.10 C ATOM 257 CG1 ILE A 16 6.091 -4.077 0.820 1.00 0.12 C ATOM 258 CG2 ILE A 16 5.785 -2.026 -0.592 1.00 0.12 C ATOM 259 CD1 ILE A 16 4.959 -4.889 0.228 1.00 0.14 C ATOM 0 H ILE A 16 5.774 -2.373 3.351 1.00 0.10 H new ATOM 0 HA ILE A 16 7.884 -2.246 1.385 1.00 0.09 H new ATOM 0 HB ILE A 16 4.855 -2.384 1.286 1.00 0.10 H new ATOM 0 HG12 ILE A 16 7.002 -4.274 0.255 1.00 0.12 H new ATOM 0 HG13 ILE A 16 6.271 -4.412 1.842 1.00 0.12 H new ATOM 0 HG21 ILE A 16 5.016 -2.550 -1.160 1.00 0.12 H new ATOM 0 HG22 ILE A 16 5.555 -0.961 -0.567 1.00 0.12 H new ATOM 0 HG23 ILE A 16 6.754 -2.177 -1.068 1.00 0.12 H new ATOM 0 HD11 ILE A 16 5.218 -5.948 0.255 1.00 0.14 H new ATOM 0 HD12 ILE A 16 4.050 -4.722 0.807 1.00 0.14 H new ATOM 0 HD13 ILE A 16 4.793 -4.583 -0.805 1.00 0.14 H new ATOM 271 N LEU A 17 6.079 0.386 2.138 1.00 0.14 N ATOM 272 CA LEU A 17 5.971 1.831 1.963 1.00 0.19 C ATOM 273 C LEU A 17 7.194 2.543 2.540 1.00 0.18 C ATOM 274 O LEU A 17 7.605 3.590 2.041 1.00 0.26 O ATOM 275 CB LEU A 17 4.703 2.364 2.636 1.00 0.27 C ATOM 276 CG LEU A 17 3.447 2.333 1.764 1.00 0.35 C ATOM 277 CD1 LEU A 17 2.792 0.963 1.810 1.00 0.80 C ATOM 278 CD2 LEU A 17 2.473 3.414 2.205 1.00 0.77 C ATOM 0 H LEU A 17 5.494 0.006 2.882 1.00 0.14 H new ATOM 0 HA LEU A 17 5.918 2.032 0.893 1.00 0.19 H new ATOM 0 HB2 LEU A 17 4.516 1.781 3.538 1.00 0.27 H new ATOM 0 HB3 LEU A 17 4.882 3.392 2.953 1.00 0.27 H new ATOM 0 HG LEU A 17 3.737 2.531 0.732 1.00 0.35 H new ATOM 0 HD11 LEU A 17 1.901 0.965 1.183 1.00 0.80 H new ATOM 0 HD12 LEU A 17 3.492 0.212 1.444 1.00 0.80 H new ATOM 0 HD13 LEU A 17 2.512 0.728 2.837 1.00 0.80 H new ATOM 0 HD21 LEU A 17 1.583 3.381 1.576 1.00 0.77 H new ATOM 0 HD22 LEU A 17 2.189 3.246 3.244 1.00 0.77 H new ATOM 0 HD23 LEU A 17 2.947 4.391 2.112 1.00 0.77 H new ATOM 290 N HIS A 18 7.771 1.963 3.589 1.00 0.16 N ATOM 291 CA HIS A 18 8.936 2.544 4.250 1.00 0.16 C ATOM 292 C HIS A 18 10.176 2.508 3.362 1.00 0.13 C ATOM 293 O HIS A 18 11.071 3.340 3.508 1.00 0.15 O ATOM 294 CB HIS A 18 9.218 1.815 5.566 1.00 0.17 C ATOM 295 CG HIS A 18 8.312 2.224 6.685 1.00 0.25 C ATOM 296 ND1 HIS A 18 8.777 2.597 7.929 1.00 0.58 N ATOM 297 CD2 HIS A 18 6.962 2.316 6.748 1.00 0.28 C ATOM 298 CE1 HIS A 18 7.753 2.898 8.708 1.00 0.60 C ATOM 299 NE2 HIS A 18 6.642 2.736 8.015 1.00 0.33 N ATOM 0 H HIS A 18 7.449 1.087 4.001 1.00 0.16 H new ATOM 0 HA HIS A 18 8.704 3.589 4.454 1.00 0.16 H new ATOM 0 HB2 HIS A 18 9.120 0.741 5.405 1.00 0.17 H new ATOM 0 HB3 HIS A 18 10.251 2.001 5.860 1.00 0.17 H new ATOM 0 HD2 HIS A 18 6.267 2.099 5.950 1.00 0.28 H new ATOM 0 HE1 HIS A 18 7.815 3.221 9.737 1.00 0.60 H new ATOM 0 HE2 HIS A 18 5.697 2.897 8.365 1.00 0.33 H new ATOM 308 N LEU A 19 10.229 1.544 2.446 1.00 0.14 N ATOM 309 CA LEU A 19 11.371 1.411 1.547 1.00 0.14 C ATOM 310 C LEU A 19 11.664 2.735 0.838 1.00 0.16 C ATOM 311 O LEU A 19 10.892 3.170 -0.018 1.00 0.18 O ATOM 312 CB LEU A 19 11.115 0.303 0.524 1.00 0.12 C ATOM 313 CG LEU A 19 10.944 -1.097 1.120 1.00 0.11 C ATOM 314 CD1 LEU A 19 10.714 -2.120 0.021 1.00 0.13 C ATOM 315 CD2 LEU A 19 12.159 -1.476 1.957 1.00 0.12 C ATOM 0 H LEU A 19 9.498 0.847 2.307 1.00 0.14 H new ATOM 0 HA LEU A 19 12.245 1.144 2.142 1.00 0.14 H new ATOM 0 HB2 LEU A 19 10.218 0.552 -0.044 1.00 0.12 H new ATOM 0 HB3 LEU A 19 11.944 0.282 -0.183 1.00 0.12 H new ATOM 0 HG LEU A 19 10.069 -1.088 1.770 1.00 0.11 H new ATOM 0 HD11 LEU A 19 10.595 -3.109 0.464 1.00 0.13 H new ATOM 0 HD12 LEU A 19 9.813 -1.860 -0.535 1.00 0.13 H new ATOM 0 HD13 LEU A 19 11.569 -2.126 -0.655 1.00 0.13 H new ATOM 0 HD21 LEU A 19 12.018 -2.474 2.372 1.00 0.12 H new ATOM 0 HD22 LEU A 19 13.050 -1.466 1.330 1.00 0.12 H new ATOM 0 HD23 LEU A 19 12.279 -0.759 2.769 1.00 0.12 H new ATOM 327 N PRO A 20 12.788 3.394 1.186 1.00 0.18 N ATOM 328 CA PRO A 20 13.169 4.680 0.593 1.00 0.21 C ATOM 329 C PRO A 20 13.844 4.536 -0.765 1.00 0.21 C ATOM 330 O PRO A 20 13.529 5.268 -1.705 1.00 0.23 O ATOM 331 CB PRO A 20 14.152 5.240 1.618 1.00 0.24 C ATOM 332 CG PRO A 20 14.817 4.035 2.187 1.00 0.22 C ATOM 333 CD PRO A 20 13.780 2.941 2.185 1.00 0.19 C ATOM 0 HA PRO A 20 12.303 5.313 0.400 1.00 0.21 H new ATOM 0 HB2 PRO A 20 14.874 5.910 1.152 1.00 0.24 H new ATOM 0 HB3 PRO A 20 13.638 5.813 2.390 1.00 0.24 H new ATOM 0 HG2 PRO A 20 15.684 3.751 1.590 1.00 0.22 H new ATOM 0 HG3 PRO A 20 15.176 4.229 3.198 1.00 0.22 H new ATOM 0 HD2 PRO A 20 14.214 1.980 1.910 1.00 0.19 H new ATOM 0 HD3 PRO A 20 13.328 2.817 3.169 1.00 0.19 H new ATOM 341 N ASN A 21 14.775 3.595 -0.865 1.00 0.20 N ATOM 342 CA ASN A 21 15.501 3.367 -2.106 1.00 0.21 C ATOM 343 C ASN A 21 14.569 2.853 -3.197 1.00 0.20 C ATOM 344 O ASN A 21 14.866 2.970 -4.385 1.00 0.23 O ATOM 345 CB ASN A 21 16.643 2.378 -1.875 1.00 0.21 C ATOM 346 CG ASN A 21 17.617 2.865 -0.820 1.00 0.26 C ATOM 347 OD1 ASN A 21 17.852 4.067 -0.683 1.00 0.30 O ATOM 348 ND2 ASN A 21 18.186 1.935 -0.062 1.00 0.26 N ATOM 0 H ASN A 21 15.045 2.977 -0.100 1.00 0.20 H new ATOM 0 HA ASN A 21 15.918 4.318 -2.437 1.00 0.21 H new ATOM 0 HB2 ASN A 21 16.232 1.415 -1.571 1.00 0.21 H new ATOM 0 HB3 ASN A 21 17.176 2.215 -2.812 1.00 0.21 H new ATOM 0 HD21 ASN A 21 18.846 2.205 0.667 1.00 0.26 H new ATOM 0 HD22 ASN A 21 17.963 0.951 -0.209 1.00 0.26 H new ATOM 355 N LEU A 22 13.437 2.289 -2.784 1.00 0.18 N ATOM 356 CA LEU A 22 12.459 1.763 -3.729 1.00 0.17 C ATOM 357 C LEU A 22 11.581 2.888 -4.263 1.00 0.20 C ATOM 358 O LEU A 22 11.189 3.787 -3.517 1.00 0.26 O ATOM 359 CB LEU A 22 11.590 0.693 -3.062 1.00 0.17 C ATOM 360 CG LEU A 22 10.872 -0.253 -4.027 1.00 0.17 C ATOM 361 CD1 LEU A 22 11.878 -1.081 -4.812 1.00 0.29 C ATOM 362 CD2 LEU A 22 9.913 -1.159 -3.269 1.00 0.26 C ATOM 0 H LEU A 22 13.176 2.185 -1.804 1.00 0.18 H new ATOM 0 HA LEU A 22 12.996 1.308 -4.561 1.00 0.17 H new ATOM 0 HB2 LEU A 22 12.217 0.101 -2.396 1.00 0.17 H new ATOM 0 HB3 LEU A 22 10.844 1.188 -2.440 1.00 0.17 H new ATOM 0 HG LEU A 22 10.296 0.347 -4.732 1.00 0.17 H new ATOM 0 HD11 LEU A 22 11.348 -1.748 -5.493 1.00 0.29 H new ATOM 0 HD12 LEU A 22 12.527 -0.418 -5.385 1.00 0.29 H new ATOM 0 HD13 LEU A 22 12.481 -1.671 -4.122 1.00 0.29 H new ATOM 0 HD21 LEU A 22 9.411 -1.825 -3.970 1.00 0.26 H new ATOM 0 HD22 LEU A 22 10.469 -1.750 -2.542 1.00 0.26 H new ATOM 0 HD23 LEU A 22 9.171 -0.551 -2.751 1.00 0.26 H new ATOM 374 N ASN A 23 11.273 2.836 -5.553 1.00 0.22 N ATOM 375 CA ASN A 23 10.445 3.861 -6.178 1.00 0.27 C ATOM 376 C ASN A 23 8.967 3.503 -6.080 1.00 0.24 C ATOM 377 O ASN A 23 8.614 2.337 -5.901 1.00 0.29 O ATOM 378 CB ASN A 23 10.835 4.041 -7.646 1.00 0.33 C ATOM 379 CG ASN A 23 12.330 4.211 -7.832 1.00 0.75 C ATOM 380 OD1 ASN A 23 13.028 3.101 -8.030 1.00 1.59 O flip ATOM 381 ND2 ASN A 23 12.849 5.327 -7.802 1.00 1.33 N flip ATOM 0 H ASN A 23 11.583 2.098 -6.185 1.00 0.22 H new ATOM 0 HA ASN A 23 10.613 4.797 -5.645 1.00 0.27 H new ATOM 0 HB2 ASN A 23 10.497 3.176 -8.217 1.00 0.33 H new ATOM 0 HB3 ASN A 23 10.320 4.912 -8.051 1.00 0.33 H new ATOM 0 HD21 ASN A 23 12.272 6.154 -7.647 1.00 1.33 H new ATOM 0 HD22 ASN A 23 13.856 5.425 -7.933 1.00 1.33 H new ATOM 388 N GLU A 24 8.109 4.511 -6.197 1.00 0.29 N ATOM 389 CA GLU A 24 6.668 4.298 -6.129 1.00 0.29 C ATOM 390 C GLU A 24 6.226 3.307 -7.197 1.00 0.24 C ATOM 391 O GLU A 24 5.278 2.548 -7.000 1.00 0.22 O ATOM 392 CB GLU A 24 5.924 5.624 -6.302 1.00 0.36 C ATOM 393 CG GLU A 24 6.224 6.637 -5.210 1.00 1.23 C ATOM 394 CD GLU A 24 5.535 7.967 -5.445 1.00 1.42 C ATOM 395 OE1 GLU A 24 6.111 8.815 -6.160 1.00 1.25 O ATOM 396 OE2 GLU A 24 4.422 8.161 -4.914 1.00 2.17 O ATOM 0 H GLU A 24 8.386 5.482 -6.339 1.00 0.29 H new ATOM 0 HA GLU A 24 6.427 3.886 -5.149 1.00 0.29 H new ATOM 0 HB2 GLU A 24 6.187 6.055 -7.268 1.00 0.36 H new ATOM 0 HB3 GLU A 24 4.852 5.430 -6.321 1.00 0.36 H new ATOM 0 HG2 GLU A 24 5.908 6.233 -4.248 1.00 1.23 H new ATOM 0 HG3 GLU A 24 7.301 6.795 -5.152 1.00 1.23 H new ATOM 403 N GLU A 25 6.923 3.316 -8.330 1.00 0.27 N ATOM 404 CA GLU A 25 6.609 2.413 -9.430 1.00 0.28 C ATOM 405 C GLU A 25 6.700 0.963 -8.969 1.00 0.24 C ATOM 406 O GLU A 25 5.807 0.157 -9.236 1.00 0.30 O ATOM 407 CB GLU A 25 7.560 2.646 -10.606 1.00 0.36 C ATOM 408 CG GLU A 25 7.353 3.980 -11.309 1.00 0.91 C ATOM 409 CD GLU A 25 7.610 5.168 -10.402 1.00 1.60 C ATOM 410 OE1 GLU A 25 8.794 5.479 -10.154 1.00 2.20 O ATOM 411 OE2 GLU A 25 6.628 5.788 -9.942 1.00 2.00 O ATOM 0 H GLU A 25 7.710 3.940 -8.509 1.00 0.27 H new ATOM 0 HA GLU A 25 5.590 2.617 -9.758 1.00 0.28 H new ATOM 0 HB2 GLU A 25 8.588 2.591 -10.246 1.00 0.36 H new ATOM 0 HB3 GLU A 25 7.432 1.841 -11.330 1.00 0.36 H new ATOM 0 HG2 GLU A 25 8.016 4.037 -12.172 1.00 0.91 H new ATOM 0 HG3 GLU A 25 6.332 4.032 -11.687 1.00 0.91 H new ATOM 418 N GLN A 26 7.786 0.642 -8.274 1.00 0.18 N ATOM 419 CA GLN A 26 7.996 -0.707 -7.767 1.00 0.15 C ATOM 420 C GLN A 26 7.004 -1.020 -6.653 1.00 0.13 C ATOM 421 O GLN A 26 6.402 -2.093 -6.623 1.00 0.16 O ATOM 422 CB GLN A 26 9.427 -0.862 -7.249 1.00 0.15 C ATOM 423 CG GLN A 26 10.493 -0.617 -8.306 1.00 0.19 C ATOM 424 CD GLN A 26 10.561 -1.716 -9.345 1.00 1.03 C ATOM 425 OE1 GLN A 26 9.567 -2.382 -9.634 1.00 2.00 O ATOM 426 NE2 GLN A 26 11.740 -1.905 -9.916 1.00 1.59 N ATOM 0 H GLN A 26 8.534 1.298 -8.049 1.00 0.18 H new ATOM 0 HA GLN A 26 7.837 -1.410 -8.585 1.00 0.15 H new ATOM 0 HB2 GLN A 26 9.582 -0.168 -6.423 1.00 0.15 H new ATOM 0 HB3 GLN A 26 9.551 -1.868 -6.848 1.00 0.15 H new ATOM 0 HG2 GLN A 26 10.293 0.333 -8.802 1.00 0.19 H new ATOM 0 HG3 GLN A 26 11.464 -0.524 -7.820 1.00 0.19 H new ATOM 0 HE21 GLN A 26 12.536 -1.329 -9.644 1.00 1.59 H new ATOM 0 HE22 GLN A 26 11.852 -2.627 -10.628 1.00 1.59 H new ATOM 435 N ARG A 27 6.840 -0.068 -5.738 1.00 0.13 N ATOM 436 CA ARG A 27 5.923 -0.226 -4.616 1.00 0.13 C ATOM 437 C ARG A 27 4.503 -0.508 -5.099 1.00 0.14 C ATOM 438 O ARG A 27 3.751 -1.235 -4.452 1.00 0.23 O ATOM 439 CB ARG A 27 5.936 1.033 -3.748 1.00 0.14 C ATOM 440 CG ARG A 27 4.954 0.988 -2.589 1.00 0.18 C ATOM 441 CD ARG A 27 4.954 2.293 -1.813 1.00 0.41 C ATOM 442 NE ARG A 27 6.276 2.616 -1.285 1.00 1.59 N ATOM 443 CZ ARG A 27 6.785 3.845 -1.273 1.00 1.94 C ATOM 444 NH1 ARG A 27 6.085 4.859 -1.763 1.00 1.37 N ATOM 445 NH2 ARG A 27 7.993 4.059 -0.772 1.00 3.04 N ATOM 0 H ARG A 27 7.334 0.825 -5.753 1.00 0.13 H new ATOM 0 HA ARG A 27 6.257 -1.078 -4.024 1.00 0.13 H new ATOM 0 HB2 ARG A 27 6.942 1.182 -3.355 1.00 0.14 H new ATOM 0 HB3 ARG A 27 5.707 1.896 -4.373 1.00 0.14 H new ATOM 0 HG2 ARG A 27 3.951 0.788 -2.967 1.00 0.18 H new ATOM 0 HG3 ARG A 27 5.213 0.166 -1.922 1.00 0.18 H new ATOM 0 HD2 ARG A 27 4.616 3.101 -2.462 1.00 0.41 H new ATOM 0 HD3 ARG A 27 4.242 2.226 -0.991 1.00 0.41 H new ATOM 0 HE ARG A 27 6.841 1.857 -0.904 1.00 1.59 H new ATOM 0 HH11 ARG A 27 5.155 4.697 -2.150 1.00 1.37 H new ATOM 0 HH12 ARG A 27 6.476 5.801 -1.753 1.00 1.37 H new ATOM 0 HH21 ARG A 27 8.534 3.281 -0.395 1.00 3.04 H new ATOM 0 HH22 ARG A 27 8.382 5.002 -0.764 1.00 3.04 H new ATOM 459 N ASN A 28 4.144 0.072 -6.239 1.00 0.13 N ATOM 460 CA ASN A 28 2.813 -0.113 -6.805 1.00 0.15 C ATOM 461 C ASN A 28 2.618 -1.540 -7.304 1.00 0.15 C ATOM 462 O ASN A 28 1.497 -2.043 -7.343 1.00 0.21 O ATOM 463 CB ASN A 28 2.579 0.882 -7.943 1.00 0.19 C ATOM 464 CG ASN A 28 2.249 2.270 -7.437 1.00 0.20 C ATOM 465 OD1 ASN A 28 1.533 3.027 -8.091 1.00 0.26 O ATOM 466 ND2 ASN A 28 2.773 2.611 -6.266 1.00 0.19 N ATOM 0 H ASN A 28 4.756 0.674 -6.789 1.00 0.13 H new ATOM 0 HA ASN A 28 2.083 0.070 -6.016 1.00 0.15 H new ATOM 0 HB2 ASN A 28 3.469 0.929 -8.570 1.00 0.19 H new ATOM 0 HB3 ASN A 28 1.764 0.525 -8.573 1.00 0.19 H new ATOM 0 HD21 ASN A 28 2.587 3.534 -5.874 1.00 0.19 H new ATOM 0 HD22 ASN A 28 3.361 1.950 -5.759 1.00 0.19 H new ATOM 473 N ALA A 29 3.716 -2.187 -7.684 1.00 0.12 N ATOM 474 CA ALA A 29 3.660 -3.559 -8.175 1.00 0.12 C ATOM 475 C ALA A 29 3.508 -4.541 -7.020 1.00 0.11 C ATOM 476 O ALA A 29 2.796 -5.539 -7.131 1.00 0.15 O ATOM 477 CB ALA A 29 4.905 -3.883 -8.984 1.00 0.15 C ATOM 0 H ALA A 29 4.653 -1.784 -7.661 1.00 0.12 H new ATOM 0 HA ALA A 29 2.788 -3.655 -8.822 1.00 0.12 H new ATOM 0 HB1 ALA A 29 4.848 -4.910 -9.343 1.00 0.15 H new ATOM 0 HB2 ALA A 29 4.973 -3.204 -9.834 1.00 0.15 H new ATOM 0 HB3 ALA A 29 5.788 -3.767 -8.355 1.00 0.15 H new ATOM 483 N PHE A 30 4.181 -4.251 -5.912 1.00 0.10 N ATOM 484 CA PHE A 30 4.116 -5.108 -4.736 1.00 0.10 C ATOM 485 C PHE A 30 2.750 -5.001 -4.069 1.00 0.12 C ATOM 486 O PHE A 30 2.116 -6.013 -3.771 1.00 0.18 O ATOM 487 CB PHE A 30 5.225 -4.746 -3.749 1.00 0.12 C ATOM 488 CG PHE A 30 6.599 -5.098 -4.246 1.00 0.12 C ATOM 489 CD1 PHE A 30 6.985 -6.424 -4.365 1.00 0.12 C ATOM 490 CD2 PHE A 30 7.500 -4.107 -4.599 1.00 0.18 C ATOM 491 CE1 PHE A 30 8.244 -6.754 -4.825 1.00 0.16 C ATOM 492 CE2 PHE A 30 8.762 -4.432 -5.059 1.00 0.21 C ATOM 493 CZ PHE A 30 9.134 -5.757 -5.173 1.00 0.20 C ATOM 0 H PHE A 30 4.777 -3.430 -5.804 1.00 0.10 H new ATOM 0 HA PHE A 30 4.261 -6.140 -5.054 1.00 0.10 H new ATOM 0 HB2 PHE A 30 5.184 -3.677 -3.542 1.00 0.12 H new ATOM 0 HB3 PHE A 30 5.044 -5.260 -2.805 1.00 0.12 H new ATOM 0 HD1 PHE A 30 6.293 -7.208 -4.095 1.00 0.12 H new ATOM 0 HD2 PHE A 30 7.213 -3.069 -4.514 1.00 0.18 H new ATOM 0 HE1 PHE A 30 8.533 -7.791 -4.913 1.00 0.16 H new ATOM 0 HE2 PHE A 30 9.457 -3.650 -5.329 1.00 0.21 H new ATOM 0 HZ PHE A 30 10.119 -6.013 -5.534 1.00 0.20 H new ATOM 503 N ILE A 31 2.302 -3.770 -3.836 1.00 0.10 N ATOM 504 CA ILE A 31 1.001 -3.536 -3.222 1.00 0.11 C ATOM 505 C ILE A 31 -0.094 -4.213 -4.038 1.00 0.11 C ATOM 506 O ILE A 31 -1.058 -4.747 -3.489 1.00 0.16 O ATOM 507 CB ILE A 31 0.700 -2.025 -3.099 1.00 0.11 C ATOM 508 CG1 ILE A 31 1.662 -1.376 -2.101 1.00 0.12 C ATOM 509 CG2 ILE A 31 -0.747 -1.791 -2.681 1.00 0.13 C ATOM 510 CD1 ILE A 31 1.481 0.121 -1.962 1.00 0.13 C ATOM 0 H ILE A 31 2.821 -2.922 -4.063 1.00 0.10 H new ATOM 0 HA ILE A 31 1.024 -3.962 -2.219 1.00 0.11 H new ATOM 0 HB ILE A 31 0.845 -1.563 -4.076 1.00 0.11 H new ATOM 0 HG12 ILE A 31 1.526 -1.841 -1.125 1.00 0.12 H new ATOM 0 HG13 ILE A 31 2.686 -1.581 -2.412 1.00 0.12 H new ATOM 0 HG21 ILE A 31 -0.934 -0.720 -2.601 1.00 0.13 H new ATOM 0 HG22 ILE A 31 -1.415 -2.222 -3.427 1.00 0.13 H new ATOM 0 HG23 ILE A 31 -0.928 -2.264 -1.716 1.00 0.13 H new ATOM 0 HD11 ILE A 31 2.198 0.508 -1.238 1.00 0.13 H new ATOM 0 HD12 ILE A 31 1.647 0.599 -2.928 1.00 0.13 H new ATOM 0 HD13 ILE A 31 0.468 0.335 -1.620 1.00 0.13 H new ATOM 522 N GLN A 32 0.068 -4.182 -5.358 1.00 0.08 N ATOM 523 CA GLN A 32 -0.883 -4.795 -6.269 1.00 0.09 C ATOM 524 C GLN A 32 -1.004 -6.296 -6.016 1.00 0.11 C ATOM 525 O GLN A 32 -2.102 -6.814 -5.813 1.00 0.19 O ATOM 526 CB GLN A 32 -0.444 -4.546 -7.711 1.00 0.11 C ATOM 527 CG GLN A 32 -1.597 -4.512 -8.691 1.00 0.15 C ATOM 528 CD GLN A 32 -1.171 -4.104 -10.082 1.00 0.29 C ATOM 529 OE1 GLN A 32 -1.271 -2.817 -10.371 1.00 0.82 O flip ATOM 530 NE2 GLN A 32 -0.765 -4.938 -10.891 1.00 1.04 N flip ATOM 0 H GLN A 32 0.859 -3.733 -5.820 1.00 0.08 H new ATOM 0 HA GLN A 32 -1.860 -4.344 -6.098 1.00 0.09 H new ATOM 0 HB2 GLN A 32 0.094 -3.600 -7.761 1.00 0.11 H new ATOM 0 HB3 GLN A 32 0.255 -5.327 -8.010 1.00 0.11 H new ATOM 0 HG2 GLN A 32 -2.062 -5.497 -8.733 1.00 0.15 H new ATOM 0 HG3 GLN A 32 -2.355 -3.817 -8.329 1.00 0.15 H new ATOM 0 HE21 GLN A 32 -0.705 -5.921 -10.624 1.00 1.04 H new ATOM 0 HE22 GLN A 32 -0.489 -4.647 -11.829 1.00 1.04 H new ATOM 539 N SER A 33 0.131 -6.987 -6.030 1.00 0.09 N ATOM 540 CA SER A 33 0.154 -8.430 -5.813 1.00 0.11 C ATOM 541 C SER A 33 -0.100 -8.778 -4.348 1.00 0.10 C ATOM 542 O SER A 33 -0.372 -9.932 -4.016 1.00 0.15 O ATOM 543 CB SER A 33 1.497 -9.012 -6.259 1.00 0.13 C ATOM 544 OG SER A 33 1.730 -8.763 -7.635 1.00 1.19 O ATOM 0 H SER A 33 1.048 -6.571 -6.190 1.00 0.09 H new ATOM 0 HA SER A 33 -0.646 -8.868 -6.410 1.00 0.11 H new ATOM 0 HB2 SER A 33 2.301 -8.575 -5.666 1.00 0.13 H new ATOM 0 HB3 SER A 33 1.511 -10.086 -6.073 1.00 0.13 H new ATOM 0 HG SER A 33 2.595 -9.143 -7.894 1.00 1.19 H new ATOM 550 N LEU A 34 -0.010 -7.780 -3.475 1.00 0.10 N ATOM 551 CA LEU A 34 -0.231 -7.992 -2.048 1.00 0.11 C ATOM 552 C LEU A 34 -1.723 -8.053 -1.741 1.00 0.13 C ATOM 553 O LEU A 34 -2.183 -8.923 -1.000 1.00 0.18 O ATOM 554 CB LEU A 34 0.422 -6.871 -1.235 1.00 0.10 C ATOM 555 CG LEU A 34 1.043 -7.297 0.101 1.00 0.13 C ATOM 556 CD1 LEU A 34 1.630 -6.092 0.818 1.00 0.16 C ATOM 557 CD2 LEU A 34 0.015 -7.992 0.984 1.00 0.17 C ATOM 0 H LEU A 34 0.214 -6.818 -3.729 1.00 0.10 H new ATOM 0 HA LEU A 34 0.224 -8.943 -1.770 1.00 0.11 H new ATOM 0 HB2 LEU A 34 1.198 -6.409 -1.845 1.00 0.10 H new ATOM 0 HB3 LEU A 34 -0.328 -6.105 -1.039 1.00 0.10 H new ATOM 0 HG LEU A 34 1.844 -8.006 -0.107 1.00 0.13 H new ATOM 0 HD11 LEU A 34 2.067 -6.409 1.765 1.00 0.16 H new ATOM 0 HD12 LEU A 34 2.402 -5.639 0.196 1.00 0.16 H new ATOM 0 HD13 LEU A 34 0.843 -5.363 1.008 1.00 0.16 H new ATOM 0 HD21 LEU A 34 0.481 -8.284 1.925 1.00 0.17 H new ATOM 0 HD22 LEU A 34 -0.812 -7.311 1.185 1.00 0.17 H new ATOM 0 HD23 LEU A 34 -0.361 -8.879 0.475 1.00 0.17 H new ATOM 569 N LYS A 35 -2.473 -7.122 -2.319 1.00 0.15 N ATOM 570 CA LYS A 35 -3.915 -7.056 -2.113 1.00 0.19 C ATOM 571 C LYS A 35 -4.625 -8.197 -2.836 1.00 0.22 C ATOM 572 O LYS A 35 -5.608 -8.744 -2.337 1.00 0.31 O ATOM 573 CB LYS A 35 -4.449 -5.710 -2.605 1.00 0.23 C ATOM 574 CG LYS A 35 -5.947 -5.538 -2.429 1.00 0.23 C ATOM 575 CD LYS A 35 -6.315 -5.354 -0.968 1.00 0.24 C ATOM 576 CE LYS A 35 -7.788 -5.021 -0.805 1.00 0.22 C ATOM 577 NZ LYS A 35 -8.658 -6.199 -1.074 1.00 0.46 N ATOM 0 H LYS A 35 -2.104 -6.399 -2.937 1.00 0.15 H new ATOM 0 HA LYS A 35 -4.114 -7.155 -1.046 1.00 0.19 H new ATOM 0 HB2 LYS A 35 -3.937 -4.910 -2.070 1.00 0.23 H new ATOM 0 HB3 LYS A 35 -4.202 -5.597 -3.661 1.00 0.23 H new ATOM 0 HG2 LYS A 35 -6.286 -4.675 -3.003 1.00 0.23 H new ATOM 0 HG3 LYS A 35 -6.464 -6.410 -2.829 1.00 0.23 H new ATOM 0 HD2 LYS A 35 -6.083 -6.264 -0.415 1.00 0.24 H new ATOM 0 HD3 LYS A 35 -5.710 -4.556 -0.537 1.00 0.24 H new ATOM 0 HE2 LYS A 35 -7.968 -4.660 0.208 1.00 0.22 H new ATOM 0 HE3 LYS A 35 -8.054 -4.211 -1.484 1.00 0.22 H new ATOM 0 HZ1 LYS A 35 -9.437 -5.919 -1.703 1.00 0.46 H new ATOM 0 HZ2 LYS A 35 -8.098 -6.948 -1.530 1.00 0.46 H new ATOM 0 HZ3 LYS A 35 -9.047 -6.555 -0.178 1.00 0.46 H new ATOM 591 N ASP A 36 -4.119 -8.552 -4.014 1.00 0.23 N ATOM 592 CA ASP A 36 -4.709 -9.627 -4.807 1.00 0.28 C ATOM 593 C ASP A 36 -4.232 -10.989 -4.315 1.00 0.25 C ATOM 594 O ASP A 36 -4.980 -11.967 -4.350 1.00 0.33 O ATOM 595 CB ASP A 36 -4.356 -9.452 -6.285 1.00 0.34 C ATOM 596 CG ASP A 36 -5.087 -10.439 -7.174 1.00 1.07 C ATOM 597 OD1 ASP A 36 -4.648 -11.607 -7.249 1.00 2.07 O ATOM 598 OD2 ASP A 36 -6.094 -10.046 -7.798 1.00 0.96 O ATOM 0 H ASP A 36 -3.303 -8.112 -4.440 1.00 0.23 H new ATOM 0 HA ASP A 36 -5.792 -9.578 -4.692 1.00 0.28 H new ATOM 0 HB2 ASP A 36 -4.600 -8.436 -6.596 1.00 0.34 H new ATOM 0 HB3 ASP A 36 -3.281 -9.576 -6.416 1.00 0.34 H new ATOM 603 N ASP A 37 -2.986 -11.046 -3.859 1.00 0.20 N ATOM 604 CA ASP A 37 -2.408 -12.287 -3.357 1.00 0.22 C ATOM 605 C ASP A 37 -1.712 -12.050 -2.019 1.00 0.18 C ATOM 606 O ASP A 37 -0.484 -12.010 -1.950 1.00 0.16 O ATOM 607 CB ASP A 37 -1.416 -12.861 -4.370 1.00 0.27 C ATOM 608 CG ASP A 37 -2.063 -13.162 -5.708 1.00 0.76 C ATOM 609 OD1 ASP A 37 -2.638 -14.261 -5.855 1.00 0.91 O ATOM 610 OD2 ASP A 37 -1.996 -12.298 -6.609 1.00 1.29 O ATOM 0 H ASP A 37 -2.355 -10.245 -3.827 1.00 0.20 H new ATOM 0 HA ASP A 37 -3.214 -13.006 -3.209 1.00 0.22 H new ATOM 0 HB2 ASP A 37 -0.600 -12.154 -4.516 1.00 0.27 H new ATOM 0 HB3 ASP A 37 -0.978 -13.775 -3.968 1.00 0.27 H new ATOM 615 N PRO A 38 -2.494 -11.884 -0.936 1.00 0.21 N ATOM 616 CA PRO A 38 -1.950 -11.649 0.406 1.00 0.21 C ATOM 617 C PRO A 38 -1.048 -12.785 0.875 1.00 0.21 C ATOM 618 O PRO A 38 -0.293 -12.633 1.834 1.00 0.23 O ATOM 619 CB PRO A 38 -3.195 -11.548 1.297 1.00 0.27 C ATOM 620 CG PRO A 38 -4.291 -12.181 0.508 1.00 0.30 C ATOM 621 CD PRO A 38 -3.966 -11.911 -0.932 1.00 0.26 C ATOM 0 HA PRO A 38 -1.323 -10.758 0.434 1.00 0.21 H new ATOM 0 HB2 PRO A 38 -3.044 -12.064 2.245 1.00 0.27 H new ATOM 0 HB3 PRO A 38 -3.428 -10.510 1.532 1.00 0.27 H new ATOM 0 HG2 PRO A 38 -4.345 -13.252 0.703 1.00 0.30 H new ATOM 0 HG3 PRO A 38 -5.260 -11.759 0.776 1.00 0.30 H new ATOM 0 HD2 PRO A 38 -4.358 -12.689 -1.588 1.00 0.26 H new ATOM 0 HD3 PRO A 38 -4.389 -10.965 -1.271 1.00 0.26 H new ATOM 629 N SER A 39 -1.131 -13.924 0.194 1.00 0.21 N ATOM 630 CA SER A 39 -0.315 -15.082 0.543 1.00 0.23 C ATOM 631 C SER A 39 1.155 -14.817 0.229 1.00 0.21 C ATOM 632 O SER A 39 2.047 -15.441 0.803 1.00 0.24 O ATOM 633 CB SER A 39 -0.798 -16.320 -0.215 1.00 0.26 C ATOM 634 OG SER A 39 -0.720 -16.124 -1.617 1.00 1.37 O ATOM 0 H SER A 39 -1.753 -14.070 -0.601 1.00 0.21 H new ATOM 0 HA SER A 39 -0.415 -15.262 1.613 1.00 0.23 H new ATOM 0 HB2 SER A 39 -0.194 -17.182 0.069 1.00 0.26 H new ATOM 0 HB3 SER A 39 -1.827 -16.544 0.067 1.00 0.26 H new ATOM 0 HG SER A 39 -1.033 -16.930 -2.078 1.00 1.37 H new ATOM 640 N GLN A 40 1.392 -13.884 -0.687 1.00 0.19 N ATOM 641 CA GLN A 40 2.746 -13.520 -1.088 1.00 0.18 C ATOM 642 C GLN A 40 3.287 -12.395 -0.210 1.00 0.16 C ATOM 643 O GLN A 40 4.393 -11.907 -0.427 1.00 0.16 O ATOM 644 CB GLN A 40 2.770 -13.091 -2.557 1.00 0.21 C ATOM 645 CG GLN A 40 2.267 -14.163 -3.511 1.00 0.27 C ATOM 646 CD GLN A 40 3.182 -15.370 -3.568 1.00 0.34 C ATOM 647 OE1 GLN A 40 4.093 -15.434 -4.392 1.00 0.62 O ATOM 648 NE2 GLN A 40 2.943 -16.337 -2.687 1.00 0.69 N ATOM 0 H GLN A 40 0.659 -13.363 -1.168 1.00 0.19 H new ATOM 0 HA GLN A 40 3.383 -14.396 -0.963 1.00 0.18 H new ATOM 0 HB2 GLN A 40 2.160 -12.195 -2.676 1.00 0.21 H new ATOM 0 HB3 GLN A 40 3.790 -12.821 -2.832 1.00 0.21 H new ATOM 0 HG2 GLN A 40 1.271 -14.481 -3.202 1.00 0.27 H new ATOM 0 HG3 GLN A 40 2.170 -13.738 -4.510 1.00 0.27 H new ATOM 0 HE21 GLN A 40 2.176 -16.242 -2.021 1.00 0.69 H new ATOM 0 HE22 GLN A 40 3.527 -17.174 -2.677 1.00 0.69 H new ATOM 657 N SER A 41 2.487 -11.981 0.769 1.00 0.17 N ATOM 658 CA SER A 41 2.866 -10.907 1.687 1.00 0.20 C ATOM 659 C SER A 41 4.310 -11.052 2.156 1.00 0.20 C ATOM 660 O SER A 41 4.986 -10.059 2.420 1.00 0.25 O ATOM 661 CB SER A 41 1.934 -10.893 2.899 1.00 0.23 C ATOM 662 OG SER A 41 1.914 -12.155 3.543 1.00 1.10 O ATOM 0 H SER A 41 1.564 -12.376 0.949 1.00 0.17 H new ATOM 0 HA SER A 41 2.776 -9.966 1.145 1.00 0.20 H new ATOM 0 HB2 SER A 41 2.260 -10.127 3.603 1.00 0.23 H new ATOM 0 HB3 SER A 41 0.925 -10.627 2.583 1.00 0.23 H new ATOM 0 HG SER A 41 1.182 -12.696 3.179 1.00 1.10 H new ATOM 668 N ALA A 42 4.773 -12.291 2.261 1.00 0.18 N ATOM 669 CA ALA A 42 6.135 -12.566 2.700 1.00 0.20 C ATOM 670 C ALA A 42 7.110 -12.535 1.526 1.00 0.17 C ATOM 671 O ALA A 42 8.258 -12.115 1.672 1.00 0.18 O ATOM 672 CB ALA A 42 6.198 -13.911 3.404 1.00 0.24 C ATOM 0 H ALA A 42 4.224 -13.123 2.048 1.00 0.18 H new ATOM 0 HA ALA A 42 6.429 -11.785 3.401 1.00 0.20 H new ATOM 0 HB1 ALA A 42 7.221 -14.105 3.727 1.00 0.24 H new ATOM 0 HB2 ALA A 42 5.539 -13.898 4.272 1.00 0.24 H new ATOM 0 HB3 ALA A 42 5.879 -14.696 2.718 1.00 0.24 H new ATOM 678 N ASN A 43 6.645 -12.982 0.365 1.00 0.16 N ATOM 679 CA ASN A 43 7.476 -13.009 -0.836 1.00 0.16 C ATOM 680 C ASN A 43 7.701 -11.600 -1.373 1.00 0.13 C ATOM 681 O ASN A 43 8.837 -11.140 -1.475 1.00 0.14 O ATOM 682 CB ASN A 43 6.823 -13.876 -1.914 1.00 0.18 C ATOM 683 CG ASN A 43 6.869 -15.360 -1.588 1.00 0.21 C ATOM 684 OD1 ASN A 43 6.881 -15.691 -0.302 1.00 0.59 O flip ATOM 685 ND2 ASN A 43 6.893 -16.200 -2.486 1.00 0.71 N flip ATOM 0 H ASN A 43 5.696 -13.331 0.228 1.00 0.16 H new ATOM 0 HA ASN A 43 8.442 -13.437 -0.569 1.00 0.16 H new ATOM 0 HB2 ASN A 43 5.785 -13.569 -2.040 1.00 0.18 H new ATOM 0 HB3 ASN A 43 7.325 -13.703 -2.866 1.00 0.18 H new ATOM 0 HD21 ASN A 43 6.883 -15.904 -3.462 1.00 0.71 H new ATOM 0 HD22 ASN A 43 6.923 -17.193 -2.255 1.00 0.71 H new ATOM 692 N LEU A 44 6.609 -10.927 -1.723 1.00 0.13 N ATOM 693 CA LEU A 44 6.671 -9.566 -2.245 1.00 0.12 C ATOM 694 C LEU A 44 7.509 -8.673 -1.338 1.00 0.11 C ATOM 695 O LEU A 44 8.242 -7.804 -1.810 1.00 0.12 O ATOM 696 CB LEU A 44 5.258 -8.998 -2.383 1.00 0.12 C ATOM 697 CG LEU A 44 4.335 -9.794 -3.306 1.00 0.16 C ATOM 698 CD1 LEU A 44 2.882 -9.441 -3.039 1.00 0.16 C ATOM 699 CD2 LEU A 44 4.688 -9.537 -4.763 1.00 0.23 C ATOM 0 H LEU A 44 5.664 -11.305 -1.654 1.00 0.13 H new ATOM 0 HA LEU A 44 7.145 -9.594 -3.226 1.00 0.12 H new ATOM 0 HB2 LEU A 44 4.804 -8.947 -1.394 1.00 0.12 H new ATOM 0 HB3 LEU A 44 5.327 -7.976 -2.755 1.00 0.12 H new ATOM 0 HG LEU A 44 4.474 -10.855 -3.101 1.00 0.16 H new ATOM 0 HD11 LEU A 44 2.239 -10.017 -3.705 1.00 0.16 H new ATOM 0 HD12 LEU A 44 2.635 -9.676 -2.004 1.00 0.16 H new ATOM 0 HD13 LEU A 44 2.728 -8.377 -3.217 1.00 0.16 H new ATOM 0 HD21 LEU A 44 4.021 -10.112 -5.406 1.00 0.23 H new ATOM 0 HD22 LEU A 44 4.577 -8.475 -4.982 1.00 0.23 H new ATOM 0 HD23 LEU A 44 5.719 -9.840 -4.947 1.00 0.23 H new ATOM 711 N LEU A 45 7.390 -8.890 -0.033 1.00 0.12 N ATOM 712 CA LEU A 45 8.148 -8.116 0.942 1.00 0.13 C ATOM 713 C LEU A 45 9.638 -8.346 0.746 1.00 0.13 C ATOM 714 O LEU A 45 10.411 -7.404 0.587 1.00 0.15 O ATOM 715 CB LEU A 45 7.752 -8.519 2.362 1.00 0.15 C ATOM 716 CG LEU A 45 7.408 -7.369 3.310 1.00 0.14 C ATOM 717 CD1 LEU A 45 7.236 -7.890 4.727 1.00 0.18 C ATOM 718 CD2 LEU A 45 8.480 -6.290 3.268 1.00 0.14 C ATOM 0 H LEU A 45 6.776 -9.595 0.374 1.00 0.12 H new ATOM 0 HA LEU A 45 7.924 -7.059 0.795 1.00 0.13 H new ATOM 0 HB2 LEU A 45 6.892 -9.186 2.303 1.00 0.15 H new ATOM 0 HB3 LEU A 45 8.570 -9.092 2.798 1.00 0.15 H new ATOM 0 HG LEU A 45 6.468 -6.925 2.982 1.00 0.14 H new ATOM 0 HD11 LEU A 45 6.991 -7.062 5.392 1.00 0.18 H new ATOM 0 HD12 LEU A 45 6.430 -8.624 4.750 1.00 0.18 H new ATOM 0 HD13 LEU A 45 8.163 -8.359 5.057 1.00 0.18 H new ATOM 0 HD21 LEU A 45 8.212 -5.484 3.951 1.00 0.14 H new ATOM 0 HD22 LEU A 45 9.437 -6.716 3.568 1.00 0.14 H new ATOM 0 HD23 LEU A 45 8.560 -5.896 2.255 1.00 0.14 H new ATOM 730 N ALA A 46 10.025 -9.616 0.761 1.00 0.14 N ATOM 731 CA ALA A 46 11.418 -10.005 0.583 1.00 0.15 C ATOM 732 C ALA A 46 11.948 -9.534 -0.765 1.00 0.15 C ATOM 733 O ALA A 46 13.131 -9.231 -0.909 1.00 0.20 O ATOM 734 CB ALA A 46 11.550 -11.513 0.704 1.00 0.16 C ATOM 0 H ALA A 46 9.387 -10.400 0.896 1.00 0.14 H new ATOM 0 HA ALA A 46 12.013 -9.529 1.363 1.00 0.15 H new ATOM 0 HB1 ALA A 46 12.593 -11.799 0.570 1.00 0.16 H new ATOM 0 HB2 ALA A 46 11.211 -11.830 1.690 1.00 0.16 H new ATOM 0 HB3 ALA A 46 10.941 -11.994 -0.061 1.00 0.16 H new ATOM 740 N GLU A 47 11.058 -9.478 -1.748 1.00 0.13 N ATOM 741 CA GLU A 47 11.423 -9.048 -3.091 1.00 0.15 C ATOM 742 C GLU A 47 11.579 -7.537 -3.142 1.00 0.13 C ATOM 743 O GLU A 47 12.344 -7.005 -3.948 1.00 0.17 O ATOM 744 CB GLU A 47 10.358 -9.490 -4.094 1.00 0.18 C ATOM 745 CG GLU A 47 10.325 -10.990 -4.325 1.00 0.28 C ATOM 746 CD GLU A 47 9.263 -11.403 -5.325 1.00 1.24 C ATOM 747 OE1 GLU A 47 9.569 -11.438 -6.536 1.00 1.09 O ATOM 748 OE2 GLU A 47 8.125 -11.692 -4.898 1.00 2.19 O ATOM 0 H GLU A 47 10.075 -9.726 -1.639 1.00 0.13 H new ATOM 0 HA GLU A 47 12.375 -9.510 -3.353 1.00 0.15 H new ATOM 0 HB2 GLU A 47 9.380 -9.164 -3.740 1.00 0.18 H new ATOM 0 HB3 GLU A 47 10.536 -8.988 -5.045 1.00 0.18 H new ATOM 0 HG2 GLU A 47 11.301 -11.321 -4.680 1.00 0.28 H new ATOM 0 HG3 GLU A 47 10.142 -11.496 -3.377 1.00 0.28 H new ATOM 755 N ALA A 48 10.846 -6.851 -2.275 1.00 0.10 N ATOM 756 CA ALA A 48 10.901 -5.397 -2.214 1.00 0.10 C ATOM 757 C ALA A 48 12.111 -4.941 -1.415 1.00 0.11 C ATOM 758 O ALA A 48 12.741 -3.937 -1.740 1.00 0.12 O ATOM 759 CB ALA A 48 9.621 -4.843 -1.611 1.00 0.11 C ATOM 0 H ALA A 48 10.207 -7.278 -1.605 1.00 0.10 H new ATOM 0 HA ALA A 48 10.998 -5.012 -3.229 1.00 0.10 H new ATOM 0 HB1 ALA A 48 9.678 -3.755 -1.572 1.00 0.11 H new ATOM 0 HB2 ALA A 48 8.771 -5.140 -2.225 1.00 0.11 H new ATOM 0 HB3 ALA A 48 9.494 -5.236 -0.602 1.00 0.11 H new ATOM 765 N LYS A 49 12.420 -5.683 -0.360 1.00 0.12 N ATOM 766 CA LYS A 49 13.566 -5.384 0.480 1.00 0.14 C ATOM 767 C LYS A 49 14.848 -5.702 -0.275 1.00 0.14 C ATOM 768 O LYS A 49 15.848 -4.992 -0.165 1.00 0.17 O ATOM 769 CB LYS A 49 13.491 -6.208 1.763 1.00 0.14 C ATOM 770 CG LYS A 49 12.273 -5.890 2.614 1.00 0.14 C ATOM 771 CD LYS A 49 12.224 -6.755 3.863 1.00 0.16 C ATOM 772 CE LYS A 49 11.715 -8.153 3.554 1.00 0.16 C ATOM 773 NZ LYS A 49 11.668 -9.009 4.772 1.00 0.21 N ATOM 0 H LYS A 49 11.887 -6.502 -0.066 1.00 0.12 H new ATOM 0 HA LYS A 49 13.561 -4.325 0.740 1.00 0.14 H new ATOM 0 HB2 LYS A 49 13.479 -7.267 1.506 1.00 0.14 H new ATOM 0 HB3 LYS A 49 14.392 -6.033 2.351 1.00 0.14 H new ATOM 0 HG2 LYS A 49 12.292 -4.838 2.899 1.00 0.14 H new ATOM 0 HG3 LYS A 49 11.368 -6.045 2.027 1.00 0.14 H new ATOM 0 HD2 LYS A 49 13.220 -6.818 4.302 1.00 0.16 H new ATOM 0 HD3 LYS A 49 11.577 -6.287 4.605 1.00 0.16 H new ATOM 0 HE2 LYS A 49 10.718 -8.088 3.117 1.00 0.16 H new ATOM 0 HE3 LYS A 49 12.360 -8.618 2.808 1.00 0.16 H new ATOM 0 HZ1 LYS A 49 11.316 -9.954 4.519 1.00 0.21 H new ATOM 0 HZ2 LYS A 49 12.623 -9.092 5.175 1.00 0.21 H new ATOM 0 HZ3 LYS A 49 11.032 -8.579 5.474 1.00 0.21 H new ATOM 787 N LYS A 50 14.797 -6.783 -1.046 1.00 0.13 N ATOM 788 CA LYS A 50 15.930 -7.214 -1.850 1.00 0.16 C ATOM 789 C LYS A 50 16.185 -6.213 -2.970 1.00 0.16 C ATOM 790 O LYS A 50 17.316 -6.039 -3.425 1.00 0.22 O ATOM 791 CB LYS A 50 15.650 -8.597 -2.442 1.00 0.17 C ATOM 792 CG LYS A 50 16.725 -9.083 -3.400 1.00 0.52 C ATOM 793 CD LYS A 50 16.390 -10.452 -3.969 1.00 0.51 C ATOM 794 CE LYS A 50 17.474 -10.945 -4.915 1.00 1.36 C ATOM 795 NZ LYS A 50 17.157 -12.288 -5.475 1.00 2.10 N ATOM 0 H LYS A 50 13.974 -7.380 -1.130 1.00 0.13 H new ATOM 0 HA LYS A 50 16.815 -7.269 -1.216 1.00 0.16 H new ATOM 0 HB2 LYS A 50 15.549 -9.316 -1.629 1.00 0.17 H new ATOM 0 HB3 LYS A 50 14.694 -8.571 -2.966 1.00 0.17 H new ATOM 0 HG2 LYS A 50 16.838 -8.367 -4.215 1.00 0.52 H new ATOM 0 HG3 LYS A 50 17.682 -9.128 -2.881 1.00 0.52 H new ATOM 0 HD2 LYS A 50 16.266 -11.165 -3.154 1.00 0.51 H new ATOM 0 HD3 LYS A 50 15.438 -10.404 -4.498 1.00 0.51 H new ATOM 0 HE2 LYS A 50 17.596 -10.232 -5.730 1.00 1.36 H new ATOM 0 HE3 LYS A 50 18.425 -10.989 -4.385 1.00 1.36 H new ATOM 0 HZ1 LYS A 50 17.921 -12.587 -6.114 1.00 2.10 H new ATOM 0 HZ2 LYS A 50 17.066 -12.975 -4.699 1.00 2.10 H new ATOM 0 HZ3 LYS A 50 16.262 -12.242 -6.003 1.00 2.10 H new ATOM 809 N LEU A 51 15.115 -5.558 -3.400 1.00 0.14 N ATOM 810 CA LEU A 51 15.188 -4.569 -4.466 1.00 0.15 C ATOM 811 C LEU A 51 15.600 -3.210 -3.918 1.00 0.15 C ATOM 812 O LEU A 51 16.367 -2.480 -4.547 1.00 0.18 O ATOM 813 CB LEU A 51 13.830 -4.462 -5.158 1.00 0.15 C ATOM 814 CG LEU A 51 13.787 -3.565 -6.396 1.00 0.18 C ATOM 815 CD1 LEU A 51 14.889 -3.940 -7.378 1.00 0.23 C ATOM 816 CD2 LEU A 51 12.423 -3.662 -7.059 1.00 0.18 C ATOM 0 H LEU A 51 14.178 -5.696 -3.022 1.00 0.14 H new ATOM 0 HA LEU A 51 15.941 -4.889 -5.186 1.00 0.15 H new ATOM 0 HB2 LEU A 51 13.509 -5.463 -5.446 1.00 0.15 H new ATOM 0 HB3 LEU A 51 13.103 -4.090 -4.436 1.00 0.15 H new ATOM 0 HG LEU A 51 13.955 -2.534 -6.084 1.00 0.18 H new ATOM 0 HD11 LEU A 51 14.837 -3.288 -8.250 1.00 0.23 H new ATOM 0 HD12 LEU A 51 15.860 -3.825 -6.896 1.00 0.23 H new ATOM 0 HD13 LEU A 51 14.760 -4.976 -7.692 1.00 0.23 H new ATOM 0 HD21 LEU A 51 12.400 -3.020 -7.940 1.00 0.18 H new ATOM 0 HD22 LEU A 51 12.236 -4.694 -7.357 1.00 0.18 H new ATOM 0 HD23 LEU A 51 11.653 -3.342 -6.357 1.00 0.18 H new ATOM 828 N ASN A 52 15.083 -2.880 -2.742 1.00 0.15 N ATOM 829 CA ASN A 52 15.394 -1.614 -2.096 1.00 0.18 C ATOM 830 C ASN A 52 16.866 -1.579 -1.715 1.00 0.17 C ATOM 831 O ASN A 52 17.487 -0.517 -1.676 1.00 0.17 O ATOM 832 CB ASN A 52 14.522 -1.419 -0.853 1.00 0.26 C ATOM 833 CG ASN A 52 14.747 -0.072 -0.191 1.00 0.36 C ATOM 834 OD1 ASN A 52 14.086 0.912 -0.520 1.00 0.79 O ATOM 835 ND2 ASN A 52 15.682 -0.023 0.750 1.00 0.21 N ATOM 0 H ASN A 52 14.444 -3.475 -2.215 1.00 0.15 H new ATOM 0 HA ASN A 52 15.186 -0.802 -2.793 1.00 0.18 H new ATOM 0 HB2 ASN A 52 13.472 -1.513 -1.131 1.00 0.26 H new ATOM 0 HB3 ASN A 52 14.734 -2.212 -0.136 1.00 0.26 H new ATOM 0 HD21 ASN A 52 15.876 0.855 1.231 1.00 0.21 H new ATOM 0 HD22 ASN A 52 16.207 -0.864 0.992 1.00 0.21 H new ATOM 842 N ASP A 53 17.418 -2.756 -1.437 1.00 0.18 N ATOM 843 CA ASP A 53 18.820 -2.872 -1.070 1.00 0.20 C ATOM 844 C ASP A 53 19.691 -2.847 -2.319 1.00 0.22 C ATOM 845 O ASP A 53 20.886 -2.555 -2.254 1.00 0.25 O ATOM 846 CB ASP A 53 19.065 -4.160 -0.281 1.00 0.23 C ATOM 847 CG ASP A 53 20.505 -4.296 0.177 1.00 0.28 C ATOM 848 OD1 ASP A 53 20.830 -3.799 1.276 1.00 0.34 O ATOM 849 OD2 ASP A 53 21.309 -4.902 -0.563 1.00 0.34 O ATOM 0 H ASP A 53 16.913 -3.642 -1.460 1.00 0.18 H new ATOM 0 HA ASP A 53 19.084 -2.025 -0.437 1.00 0.20 H new ATOM 0 HB2 ASP A 53 18.407 -4.181 0.588 1.00 0.23 H new ATOM 0 HB3 ASP A 53 18.802 -5.017 -0.900 1.00 0.23 H new ATOM 854 N ALA A 54 19.077 -3.153 -3.458 1.00 0.22 N ATOM 855 CA ALA A 54 19.783 -3.162 -4.733 1.00 0.26 C ATOM 856 C ALA A 54 20.049 -1.738 -5.203 1.00 0.28 C ATOM 857 O ALA A 54 21.038 -1.470 -5.886 1.00 0.32 O ATOM 858 CB ALA A 54 18.980 -3.924 -5.776 1.00 0.27 C ATOM 0 H ALA A 54 18.089 -3.399 -3.523 1.00 0.22 H new ATOM 0 HA ALA A 54 20.740 -3.665 -4.596 1.00 0.26 H new ATOM 0 HB1 ALA A 54 19.520 -3.922 -6.723 1.00 0.27 H new ATOM 0 HB2 ALA A 54 18.834 -4.952 -5.443 1.00 0.27 H new ATOM 0 HB3 ALA A 54 18.010 -3.445 -5.910 1.00 0.27 H new ATOM 864 N GLN A 55 19.153 -0.828 -4.831 1.00 0.27 N ATOM 865 CA GLN A 55 19.281 0.575 -5.203 1.00 0.31 C ATOM 866 C GLN A 55 19.898 1.375 -4.060 1.00 0.33 C ATOM 867 O GLN A 55 20.157 2.572 -4.193 1.00 0.41 O ATOM 868 CB GLN A 55 17.909 1.155 -5.558 1.00 0.32 C ATOM 869 CG GLN A 55 17.093 0.276 -6.491 1.00 0.32 C ATOM 870 CD GLN A 55 15.833 0.964 -6.974 1.00 0.36 C ATOM 871 OE1 GLN A 55 14.805 0.961 -6.135 1.00 0.61 O flip ATOM 872 NE2 GLN A 55 15.793 1.515 -8.074 1.00 0.29 N flip ATOM 0 H GLN A 55 18.328 -1.040 -4.270 1.00 0.27 H new ATOM 0 HA GLN A 55 19.934 0.642 -6.073 1.00 0.31 H new ATOM 0 HB2 GLN A 55 17.344 1.316 -4.640 1.00 0.32 H new ATOM 0 HB3 GLN A 55 18.047 2.131 -6.022 1.00 0.32 H new ATOM 0 HG2 GLN A 55 17.704 -0.004 -7.350 1.00 0.32 H new ATOM 0 HG3 GLN A 55 16.826 -0.647 -5.976 1.00 0.32 H new ATOM 0 HE21 GLN A 55 16.609 1.491 -8.686 1.00 0.29 H new ATOM 0 HE22 GLN A 55 14.944 1.995 -8.373 1.00 0.29 H new ATOM 881 N ALA A 56 20.129 0.700 -2.938 1.00 0.28 N ATOM 882 CA ALA A 56 20.709 1.336 -1.760 1.00 0.31 C ATOM 883 C ALA A 56 22.069 1.957 -2.076 1.00 0.39 C ATOM 884 O ALA A 56 22.843 1.403 -2.857 1.00 0.44 O ATOM 885 CB ALA A 56 20.839 0.325 -0.632 1.00 0.29 C ATOM 0 H ALA A 56 19.922 -0.292 -2.820 1.00 0.28 H new ATOM 0 HA ALA A 56 20.041 2.138 -1.446 1.00 0.31 H new ATOM 0 HB1 ALA A 56 21.273 0.810 0.243 1.00 0.29 H new ATOM 0 HB2 ALA A 56 19.854 -0.066 -0.379 1.00 0.29 H new ATOM 0 HB3 ALA A 56 21.484 -0.494 -0.950 1.00 0.29 H new ATOM 1066 N THR B 109 -0.419 9.821 7.041 1.00 0.39 N ATOM 1067 CA THR B 109 -0.345 9.280 5.688 1.00 0.28 C ATOM 1068 C THR B 109 -0.415 7.753 5.692 1.00 0.25 C ATOM 1069 O THR B 109 -0.963 7.145 4.772 1.00 0.27 O ATOM 1070 CB THR B 109 0.952 9.726 4.986 1.00 0.25 C ATOM 1071 OG1 THR B 109 1.021 11.157 4.952 1.00 0.33 O ATOM 1072 CG2 THR B 109 1.025 9.178 3.569 1.00 0.27 C ATOM 0 HA THR B 109 -1.204 9.670 5.142 1.00 0.28 H new ATOM 0 HB THR B 109 1.796 9.331 5.552 1.00 0.25 H new ATOM 0 HG1 THR B 109 0.484 11.528 5.683 1.00 0.33 H new ATOM 0 HG21 THR B 109 1.951 9.509 3.098 1.00 0.27 H new ATOM 0 HG22 THR B 109 1.002 8.089 3.599 1.00 0.27 H new ATOM 0 HG23 THR B 109 0.174 9.543 2.993 1.00 0.27 H new ATOM 1080 N GLN B 110 0.140 7.143 6.734 1.00 0.30 N ATOM 1081 CA GLN B 110 0.148 5.688 6.859 1.00 0.32 C ATOM 1082 C GLN B 110 -1.225 5.150 7.257 1.00 0.30 C ATOM 1083 O GLN B 110 -1.618 4.064 6.833 1.00 0.30 O ATOM 1084 CB GLN B 110 1.195 5.252 7.882 1.00 0.42 C ATOM 1085 CG GLN B 110 2.623 5.386 7.377 1.00 0.48 C ATOM 1086 CD GLN B 110 3.658 5.184 8.469 1.00 0.85 C ATOM 1087 OE1 GLN B 110 3.327 4.366 9.461 1.00 1.34 O flip ATOM 1088 NE2 GLN B 110 4.745 5.758 8.421 1.00 1.38 N flip ATOM 0 H GLN B 110 0.591 7.634 7.506 1.00 0.30 H new ATOM 0 HA GLN B 110 0.401 5.274 5.883 1.00 0.32 H new ATOM 0 HB2 GLN B 110 1.080 5.849 8.787 1.00 0.42 H new ATOM 0 HB3 GLN B 110 1.011 4.214 8.160 1.00 0.42 H new ATOM 0 HG2 GLN B 110 2.792 4.658 6.584 1.00 0.48 H new ATOM 0 HG3 GLN B 110 2.756 6.374 6.936 1.00 0.48 H new ATOM 0 HE21 GLN B 110 4.960 6.379 7.641 1.00 1.38 H new ATOM 0 HE22 GLN B 110 5.431 5.613 9.161 1.00 1.38 H new ATOM 1097 N GLU B 111 -1.949 5.904 8.077 1.00 0.30 N ATOM 1098 CA GLU B 111 -3.275 5.485 8.514 1.00 0.30 C ATOM 1099 C GLU B 111 -4.218 5.439 7.327 1.00 0.28 C ATOM 1100 O GLU B 111 -5.065 4.552 7.221 1.00 0.39 O ATOM 1101 CB GLU B 111 -3.812 6.445 9.572 1.00 0.34 C ATOM 1102 CG GLU B 111 -2.815 6.736 10.675 1.00 0.38 C ATOM 1103 CD GLU B 111 -2.573 5.537 11.573 1.00 1.19 C ATOM 1104 OE1 GLU B 111 -1.708 4.704 11.232 1.00 2.25 O ATOM 1105 OE2 GLU B 111 -3.250 5.434 12.618 1.00 1.04 O ATOM 0 H GLU B 111 -1.643 6.802 8.450 1.00 0.30 H new ATOM 0 HA GLU B 111 -3.203 4.489 8.951 1.00 0.30 H new ATOM 0 HB2 GLU B 111 -4.097 7.381 9.092 1.00 0.34 H new ATOM 0 HB3 GLU B 111 -4.716 6.023 10.011 1.00 0.34 H new ATOM 0 HG2 GLU B 111 -1.870 7.050 10.232 1.00 0.38 H new ATOM 0 HG3 GLU B 111 -3.178 7.569 11.277 1.00 0.38 H new ATOM 1112 N ALA B 112 -4.058 6.405 6.435 1.00 0.20 N ATOM 1113 CA ALA B 112 -4.882 6.486 5.239 1.00 0.17 C ATOM 1114 C ALA B 112 -4.434 5.457 4.207 1.00 0.13 C ATOM 1115 O ALA B 112 -5.249 4.920 3.457 1.00 0.13 O ATOM 1116 CB ALA B 112 -4.821 7.887 4.655 1.00 0.17 C ATOM 0 H ALA B 112 -3.362 7.146 6.518 1.00 0.20 H new ATOM 0 HA ALA B 112 -5.914 6.266 5.513 1.00 0.17 H new ATOM 0 HB1 ALA B 112 -5.442 7.936 3.760 1.00 0.17 H new ATOM 0 HB2 ALA B 112 -5.187 8.604 5.390 1.00 0.17 H new ATOM 0 HB3 ALA B 112 -3.790 8.128 4.395 1.00 0.17 H new ATOM 1122 N SER B 113 -3.131 5.187 4.179 1.00 0.13 N ATOM 1123 CA SER B 113 -2.570 4.219 3.242 1.00 0.11 C ATOM 1124 C SER B 113 -3.123 2.825 3.520 1.00 0.10 C ATOM 1125 O SER B 113 -3.429 2.070 2.598 1.00 0.12 O ATOM 1126 CB SER B 113 -1.042 4.212 3.338 1.00 0.15 C ATOM 1127 OG SER B 113 -0.608 3.606 4.542 1.00 0.92 O ATOM 0 H SER B 113 -2.445 5.625 4.794 1.00 0.13 H new ATOM 0 HA SER B 113 -2.856 4.510 2.231 1.00 0.11 H new ATOM 0 HB2 SER B 113 -0.624 3.676 2.486 1.00 0.15 H new ATOM 0 HB3 SER B 113 -0.667 5.234 3.286 1.00 0.15 H new ATOM 0 HG SER B 113 -1.215 3.853 5.270 1.00 0.92 H new ATOM 1133 N TRP B 114 -3.255 2.492 4.799 1.00 0.10 N ATOM 1134 CA TRP B 114 -3.771 1.190 5.201 1.00 0.10 C ATOM 1135 C TRP B 114 -5.260 1.070 4.889 1.00 0.12 C ATOM 1136 O TRP B 114 -5.711 0.052 4.364 1.00 0.16 O ATOM 1137 CB TRP B 114 -3.518 0.964 6.693 1.00 0.13 C ATOM 1138 CG TRP B 114 -4.064 -0.333 7.210 1.00 0.14 C ATOM 1139 CD1 TRP B 114 -4.995 -0.495 8.196 1.00 0.17 C ATOM 1140 CD2 TRP B 114 -3.712 -1.650 6.773 1.00 0.16 C ATOM 1141 NE1 TRP B 114 -5.243 -1.831 8.397 1.00 0.19 N ATOM 1142 CE2 TRP B 114 -4.468 -2.560 7.536 1.00 0.19 C ATOM 1143 CE3 TRP B 114 -2.831 -2.150 5.808 1.00 0.17 C ATOM 1144 CZ2 TRP B 114 -4.371 -3.938 7.365 1.00 0.22 C ATOM 1145 CZ3 TRP B 114 -2.734 -3.519 5.640 1.00 0.21 C ATOM 1146 CH2 TRP B 114 -3.501 -4.399 6.415 1.00 0.23 C ATOM 0 H TRP B 114 -3.011 3.107 5.576 1.00 0.10 H new ATOM 0 HA TRP B 114 -3.246 0.423 4.632 1.00 0.10 H new ATOM 0 HB2 TRP B 114 -2.444 0.995 6.879 1.00 0.13 H new ATOM 0 HB3 TRP B 114 -3.963 1.785 7.256 1.00 0.13 H new ATOM 0 HD1 TRP B 114 -5.468 0.310 8.739 1.00 0.17 H new ATOM 0 HE1 TRP B 114 -5.898 -2.217 9.077 1.00 0.19 H new ATOM 0 HE3 TRP B 114 -2.237 -1.479 5.205 1.00 0.17 H new ATOM 0 HZ2 TRP B 114 -4.961 -4.619 7.961 1.00 0.22 H new ATOM 0 HZ3 TRP B 114 -2.056 -3.917 4.899 1.00 0.21 H new ATOM 0 HH2 TRP B 114 -3.403 -5.463 6.259 1.00 0.23 H new ATOM 1157 N GLU B 115 -6.018 2.115 5.213 1.00 0.14 N ATOM 1158 CA GLU B 115 -7.458 2.123 4.961 1.00 0.18 C ATOM 1159 C GLU B 115 -7.758 1.854 3.488 1.00 0.19 C ATOM 1160 O GLU B 115 -8.775 1.245 3.154 1.00 0.33 O ATOM 1161 CB GLU B 115 -8.065 3.463 5.381 1.00 0.22 C ATOM 1162 CG GLU B 115 -8.062 3.690 6.883 1.00 0.31 C ATOM 1163 CD GLU B 115 -8.882 2.657 7.631 1.00 1.33 C ATOM 1164 OE1 GLU B 115 -10.115 2.830 7.720 1.00 1.80 O ATOM 1165 OE2 GLU B 115 -8.290 1.676 8.128 1.00 2.03 O ATOM 0 H GLU B 115 -5.661 2.965 5.649 1.00 0.14 H new ATOM 0 HA GLU B 115 -7.907 1.327 5.555 1.00 0.18 H new ATOM 0 HB2 GLU B 115 -7.512 4.269 4.899 1.00 0.22 H new ATOM 0 HB3 GLU B 115 -9.091 3.518 5.016 1.00 0.22 H new ATOM 0 HG2 GLU B 115 -7.035 3.667 7.248 1.00 0.31 H new ATOM 0 HG3 GLU B 115 -8.454 4.684 7.097 1.00 0.31 H new ATOM 1172 N ILE B 116 -6.871 2.315 2.614 1.00 0.13 N ATOM 1173 CA ILE B 116 -7.032 2.118 1.179 1.00 0.12 C ATOM 1174 C ILE B 116 -6.769 0.663 0.794 1.00 0.10 C ATOM 1175 O ILE B 116 -7.368 0.140 -0.144 1.00 0.12 O ATOM 1176 CB ILE B 116 -6.081 3.046 0.391 1.00 0.10 C ATOM 1177 CG1 ILE B 116 -6.529 4.501 0.540 1.00 0.10 C ATOM 1178 CG2 ILE B 116 -6.024 2.649 -1.079 1.00 0.11 C ATOM 1179 CD1 ILE B 116 -5.472 5.508 0.144 1.00 0.11 C ATOM 0 H ILE B 116 -6.030 2.830 2.876 1.00 0.13 H new ATOM 0 HA ILE B 116 -8.062 2.366 0.924 1.00 0.12 H new ATOM 0 HB ILE B 116 -5.077 2.942 0.803 1.00 0.10 H new ATOM 0 HG12 ILE B 116 -7.418 4.662 -0.070 1.00 0.10 H new ATOM 0 HG13 ILE B 116 -6.817 4.679 1.576 1.00 0.10 H new ATOM 0 HG21 ILE B 116 -5.348 3.318 -1.611 1.00 0.11 H new ATOM 0 HG22 ILE B 116 -5.663 1.624 -1.165 1.00 0.11 H new ATOM 0 HG23 ILE B 116 -7.021 2.720 -1.514 1.00 0.11 H new ATOM 0 HD11 ILE B 116 -5.863 6.517 0.277 1.00 0.11 H new ATOM 0 HD12 ILE B 116 -4.590 5.375 0.771 1.00 0.11 H new ATOM 0 HD13 ILE B 116 -5.200 5.359 -0.901 1.00 0.11 H new ATOM 1191 N PHE B 117 -5.879 0.018 1.536 1.00 0.09 N ATOM 1192 CA PHE B 117 -5.518 -1.374 1.282 1.00 0.09 C ATOM 1193 C PHE B 117 -6.520 -2.335 1.923 1.00 0.11 C ATOM 1194 O PHE B 117 -6.557 -3.518 1.586 1.00 0.15 O ATOM 1195 CB PHE B 117 -4.114 -1.645 1.827 1.00 0.10 C ATOM 1196 CG PHE B 117 -3.509 -2.938 1.359 1.00 0.12 C ATOM 1197 CD1 PHE B 117 -2.791 -2.995 0.175 1.00 0.11 C ATOM 1198 CD2 PHE B 117 -3.667 -4.099 2.098 1.00 0.19 C ATOM 1199 CE1 PHE B 117 -2.240 -4.184 -0.262 1.00 0.13 C ATOM 1200 CE2 PHE B 117 -3.118 -5.292 1.666 1.00 0.23 C ATOM 1201 CZ PHE B 117 -2.374 -5.326 0.503 1.00 0.20 C ATOM 0 H PHE B 117 -5.389 0.439 2.325 1.00 0.09 H new ATOM 0 HA PHE B 117 -5.535 -1.542 0.205 1.00 0.09 H new ATOM 0 HB2 PHE B 117 -3.459 -0.824 1.535 1.00 0.10 H new ATOM 0 HB3 PHE B 117 -4.154 -1.649 2.916 1.00 0.10 H new ATOM 0 HD1 PHE B 117 -2.661 -2.099 -0.413 1.00 0.11 H new ATOM 0 HD2 PHE B 117 -4.225 -4.072 3.022 1.00 0.19 H new ATOM 0 HE1 PHE B 117 -1.706 -4.220 -1.200 1.00 0.13 H new ATOM 0 HE2 PHE B 117 -3.271 -6.196 2.237 1.00 0.23 H new ATOM 0 HZ PHE B 117 -1.898 -6.244 0.192 1.00 0.20 H new ATOM 1211 N THR B 118 -7.333 -1.821 2.841 1.00 0.12 N ATOM 1212 CA THR B 118 -8.321 -2.647 3.534 1.00 0.16 C ATOM 1213 C THR B 118 -9.624 -2.764 2.748 1.00 0.18 C ATOM 1214 O THR B 118 -10.446 -3.635 3.030 1.00 0.34 O ATOM 1215 CB THR B 118 -8.634 -2.092 4.935 1.00 0.19 C ATOM 1216 OG1 THR B 118 -9.092 -0.738 4.838 1.00 0.26 O ATOM 1217 CG2 THR B 118 -7.407 -2.156 5.829 1.00 0.20 C ATOM 0 H THR B 118 -7.329 -0.841 3.123 1.00 0.12 H new ATOM 0 HA THR B 118 -7.876 -3.638 3.626 1.00 0.16 H new ATOM 0 HB THR B 118 -9.418 -2.707 5.377 1.00 0.19 H new ATOM 0 HG1 THR B 118 -8.950 -0.409 3.926 1.00 0.26 H new ATOM 0 HG21 THR B 118 -7.653 -1.758 6.814 1.00 0.20 H new ATOM 0 HG22 THR B 118 -7.082 -3.192 5.927 1.00 0.20 H new ATOM 0 HG23 THR B 118 -6.605 -1.564 5.389 1.00 0.20 H new ATOM 1225 N LEU B 119 -9.810 -1.889 1.765 1.00 0.14 N ATOM 1226 CA LEU B 119 -11.022 -1.910 0.951 1.00 0.14 C ATOM 1227 C LEU B 119 -11.115 -3.220 0.163 1.00 0.15 C ATOM 1228 O LEU B 119 -10.305 -3.473 -0.728 1.00 0.24 O ATOM 1229 CB LEU B 119 -11.043 -0.707 0.010 1.00 0.16 C ATOM 1230 CG LEU B 119 -11.060 0.648 0.721 1.00 0.26 C ATOM 1231 CD1 LEU B 119 -10.778 1.773 -0.260 1.00 0.81 C ATOM 1232 CD2 LEU B 119 -12.392 0.873 1.419 1.00 1.01 C ATOM 0 H LEU B 119 -9.142 -1.160 1.513 1.00 0.14 H new ATOM 0 HA LEU B 119 -11.889 -1.849 1.609 1.00 0.14 H new ATOM 0 HB2 LEU B 119 -10.168 -0.753 -0.639 1.00 0.16 H new ATOM 0 HB3 LEU B 119 -11.921 -0.778 -0.632 1.00 0.16 H new ATOM 0 HG LEU B 119 -10.273 0.644 1.475 1.00 0.26 H new ATOM 0 HD11 LEU B 119 -10.795 2.727 0.266 1.00 0.81 H new ATOM 0 HD12 LEU B 119 -9.797 1.625 -0.711 1.00 0.81 H new ATOM 0 HD13 LEU B 119 -11.540 1.775 -1.040 1.00 0.81 H new ATOM 0 HD21 LEU B 119 -12.382 1.842 1.918 1.00 1.01 H new ATOM 0 HD22 LEU B 119 -13.196 0.852 0.684 1.00 1.01 H new ATOM 0 HD23 LEU B 119 -12.554 0.087 2.157 1.00 1.01 H new ATOM 1244 N PRO B 120 -12.117 -4.067 0.478 1.00 0.21 N ATOM 1245 CA PRO B 120 -12.293 -5.370 -0.179 1.00 0.26 C ATOM 1246 C PRO B 120 -12.692 -5.270 -1.648 1.00 0.26 C ATOM 1247 O PRO B 120 -12.237 -6.062 -2.473 1.00 0.38 O ATOM 1248 CB PRO B 120 -13.411 -6.033 0.630 1.00 0.36 C ATOM 1249 CG PRO B 120 -14.170 -4.904 1.233 1.00 0.38 C ATOM 1250 CD PRO B 120 -13.164 -3.815 1.488 1.00 0.35 C ATOM 0 HA PRO B 120 -11.356 -5.927 -0.192 1.00 0.26 H new ATOM 0 HB2 PRO B 120 -14.051 -6.643 -0.007 1.00 0.36 H new ATOM 0 HB3 PRO B 120 -13.005 -6.691 1.398 1.00 0.36 H new ATOM 0 HG2 PRO B 120 -14.956 -4.559 0.561 1.00 0.38 H new ATOM 0 HG3 PRO B 120 -14.655 -5.211 2.159 1.00 0.38 H new ATOM 0 HD2 PRO B 120 -13.605 -2.825 1.370 1.00 0.35 H new ATOM 0 HD3 PRO B 120 -12.765 -3.867 2.501 1.00 0.35 H new ATOM 1258 N ASN B 121 -13.540 -4.302 -1.975 1.00 0.22 N ATOM 1259 CA ASN B 121 -13.997 -4.131 -3.351 1.00 0.23 C ATOM 1260 C ASN B 121 -12.860 -3.684 -4.259 1.00 0.19 C ATOM 1261 O ASN B 121 -12.857 -3.980 -5.454 1.00 0.22 O ATOM 1262 CB ASN B 121 -15.150 -3.129 -3.423 1.00 0.28 C ATOM 1263 CG ASN B 121 -16.453 -3.714 -2.920 1.00 0.50 C ATOM 1264 OD1 ASN B 121 -17.161 -4.403 -3.655 1.00 0.98 O ATOM 1265 ND2 ASN B 121 -16.782 -3.436 -1.664 1.00 0.50 N ATOM 0 H ASN B 121 -13.923 -3.628 -1.313 1.00 0.22 H new ATOM 0 HA ASN B 121 -14.354 -5.100 -3.699 1.00 0.23 H new ATOM 0 HB2 ASN B 121 -14.899 -2.247 -2.834 1.00 0.28 H new ATOM 0 HB3 ASN B 121 -15.277 -2.798 -4.454 1.00 0.28 H new ATOM 0 HD21 ASN B 121 -17.652 -3.798 -1.273 1.00 0.50 H new ATOM 0 HD22 ASN B 121 -16.165 -2.861 -1.091 1.00 0.50 H new ATOM 1272 N LEU B 122 -11.896 -2.969 -3.692 1.00 0.15 N ATOM 1273 CA LEU B 122 -10.762 -2.486 -4.466 1.00 0.13 C ATOM 1274 C LEU B 122 -9.666 -3.531 -4.553 1.00 0.16 C ATOM 1275 O LEU B 122 -9.190 -4.041 -3.539 1.00 0.24 O ATOM 1276 CB LEU B 122 -10.210 -1.195 -3.863 1.00 0.12 C ATOM 1277 CG LEU B 122 -10.741 0.085 -4.508 1.00 0.14 C ATOM 1278 CD1 LEU B 122 -12.245 -0.001 -4.707 1.00 0.14 C ATOM 1279 CD2 LEU B 122 -10.382 1.293 -3.661 1.00 0.19 C ATOM 0 H LEU B 122 -11.877 -2.713 -2.705 1.00 0.15 H new ATOM 0 HA LEU B 122 -11.116 -2.281 -5.476 1.00 0.13 H new ATOM 0 HB2 LEU B 122 -10.447 -1.176 -2.799 1.00 0.12 H new ATOM 0 HB3 LEU B 122 -9.123 -1.205 -3.947 1.00 0.12 H new ATOM 0 HG LEU B 122 -10.273 0.198 -5.486 1.00 0.14 H new ATOM 0 HD11 LEU B 122 -12.604 0.919 -5.167 1.00 0.14 H new ATOM 0 HD12 LEU B 122 -12.479 -0.846 -5.355 1.00 0.14 H new ATOM 0 HD13 LEU B 122 -12.732 -0.138 -3.742 1.00 0.14 H new ATOM 0 HD21 LEU B 122 -10.767 2.196 -4.134 1.00 0.19 H new ATOM 0 HD22 LEU B 122 -10.823 1.186 -2.670 1.00 0.19 H new ATOM 0 HD23 LEU B 122 -9.298 1.365 -3.570 1.00 0.19 H new ATOM 1291 N ASN B 123 -9.274 -3.842 -5.779 1.00 0.16 N ATOM 1292 CA ASN B 123 -8.229 -4.824 -6.018 1.00 0.20 C ATOM 1293 C ASN B 123 -6.851 -4.188 -5.880 1.00 0.19 C ATOM 1294 O ASN B 123 -6.737 -3.003 -5.571 1.00 0.30 O ATOM 1295 CB ASN B 123 -8.393 -5.454 -7.402 1.00 0.28 C ATOM 1296 CG ASN B 123 -8.705 -4.428 -8.472 1.00 0.91 C ATOM 1297 OD1 ASN B 123 -7.667 -3.897 -9.103 1.00 1.73 O flip ATOM 1298 ND2 ASN B 123 -9.867 -4.119 -8.731 1.00 1.39 N flip ATOM 0 H ASN B 123 -9.665 -3.427 -6.625 1.00 0.16 H new ATOM 0 HA ASN B 123 -8.319 -5.610 -5.268 1.00 0.20 H new ATOM 0 HB2 ASN B 123 -7.478 -5.984 -7.667 1.00 0.28 H new ATOM 0 HB3 ASN B 123 -9.192 -6.194 -7.369 1.00 0.28 H new ATOM 0 HD21 ASN B 123 -10.636 -4.553 -8.220 1.00 1.39 H new ATOM 0 HD22 ASN B 123 -10.062 -3.429 -9.456 1.00 1.39 H new ATOM 1305 N GLY B 124 -5.811 -4.979 -6.112 1.00 0.14 N ATOM 1306 CA GLY B 124 -4.453 -4.480 -5.993 1.00 0.11 C ATOM 1307 C GLY B 124 -4.184 -3.256 -6.849 1.00 0.11 C ATOM 1308 O GLY B 124 -3.557 -2.302 -6.390 1.00 0.17 O ATOM 0 H GLY B 124 -5.883 -5.960 -6.381 1.00 0.14 H new ATOM 0 HA2 GLY B 124 -4.254 -4.236 -4.950 1.00 0.11 H new ATOM 0 HA3 GLY B 124 -3.757 -5.271 -6.274 1.00 0.11 H new ATOM 1312 N ARG B 125 -4.651 -3.277 -8.091 1.00 0.13 N ATOM 1313 CA ARG B 125 -4.440 -2.158 -9.006 1.00 0.14 C ATOM 1314 C ARG B 125 -5.070 -0.871 -8.478 1.00 0.12 C ATOM 1315 O ARG B 125 -4.402 0.157 -8.365 1.00 0.21 O ATOM 1316 CB ARG B 125 -5.020 -2.483 -10.383 1.00 0.20 C ATOM 1317 CG ARG B 125 -4.446 -3.741 -11.010 1.00 0.58 C ATOM 1318 CD ARG B 125 -5.065 -4.015 -12.370 1.00 0.90 C ATOM 1319 NE ARG B 125 -4.535 -5.231 -12.980 1.00 1.75 N ATOM 1320 CZ ARG B 125 -5.119 -5.864 -13.994 1.00 2.18 C ATOM 1321 NH1 ARG B 125 -6.246 -5.393 -14.510 1.00 1.82 N ATOM 1322 NH2 ARG B 125 -4.576 -6.966 -14.491 1.00 3.25 N ATOM 0 H ARG B 125 -5.178 -4.054 -8.489 1.00 0.13 H new ATOM 0 HA ARG B 125 -3.364 -2.002 -9.088 1.00 0.14 H new ATOM 0 HB2 ARG B 125 -6.101 -2.593 -10.295 1.00 0.20 H new ATOM 0 HB3 ARG B 125 -4.839 -1.641 -11.051 1.00 0.20 H new ATOM 0 HG2 ARG B 125 -3.366 -3.637 -11.114 1.00 0.58 H new ATOM 0 HG3 ARG B 125 -4.622 -4.591 -10.351 1.00 0.58 H new ATOM 0 HD2 ARG B 125 -6.146 -4.105 -12.264 1.00 0.90 H new ATOM 0 HD3 ARG B 125 -4.878 -3.168 -13.030 1.00 0.90 H new ATOM 0 HE ARG B 125 -3.668 -5.617 -12.608 1.00 1.75 H new ATOM 0 HH11 ARG B 125 -6.666 -4.545 -14.130 1.00 1.82 H new ATOM 0 HH12 ARG B 125 -6.693 -5.879 -15.287 1.00 1.82 H new ATOM 0 HH21 ARG B 125 -3.709 -7.330 -14.096 1.00 3.25 H new ATOM 0 HH22 ARG B 125 -5.025 -7.450 -15.268 1.00 3.25 H new ATOM 1336 N GLN B 126 -6.357 -0.936 -8.156 1.00 0.12 N ATOM 1337 CA GLN B 126 -7.089 0.225 -7.661 1.00 0.11 C ATOM 1338 C GLN B 126 -6.444 0.813 -6.407 1.00 0.09 C ATOM 1339 O GLN B 126 -6.183 2.014 -6.344 1.00 0.11 O ATOM 1340 CB GLN B 126 -8.542 -0.156 -7.378 1.00 0.13 C ATOM 1341 CG GLN B 126 -9.196 -0.925 -8.515 1.00 0.26 C ATOM 1342 CD GLN B 126 -10.692 -1.078 -8.334 1.00 0.19 C ATOM 1343 OE1 GLN B 126 -11.161 -2.025 -7.705 1.00 0.77 O ATOM 1344 NE2 GLN B 126 -11.450 -0.144 -8.895 1.00 0.64 N ATOM 0 H GLN B 126 -6.918 -1.785 -8.229 1.00 0.12 H new ATOM 0 HA GLN B 126 -7.058 0.992 -8.435 1.00 0.11 H new ATOM 0 HB2 GLN B 126 -8.582 -0.759 -6.471 1.00 0.13 H new ATOM 0 HB3 GLN B 126 -9.116 0.750 -7.184 1.00 0.13 H new ATOM 0 HG2 GLN B 126 -8.999 -0.411 -9.456 1.00 0.26 H new ATOM 0 HG3 GLN B 126 -8.740 -1.912 -8.589 1.00 0.26 H new ATOM 0 HE21 GLN B 126 -11.017 0.624 -9.408 1.00 0.64 H new ATOM 0 HE22 GLN B 126 -12.465 -0.194 -8.813 1.00 0.64 H new ATOM 1353 N VAL B 127 -6.190 -0.029 -5.409 1.00 0.09 N ATOM 1354 CA VAL B 127 -5.580 0.430 -4.163 1.00 0.08 C ATOM 1355 C VAL B 127 -4.179 0.990 -4.404 1.00 0.08 C ATOM 1356 O VAL B 127 -3.860 2.085 -3.945 1.00 0.09 O ATOM 1357 CB VAL B 127 -5.513 -0.698 -3.107 1.00 0.09 C ATOM 1358 CG1 VAL B 127 -6.909 -1.193 -2.760 1.00 0.10 C ATOM 1359 CG2 VAL B 127 -4.644 -1.850 -3.590 1.00 0.10 C ATOM 0 H VAL B 127 -6.396 -1.028 -5.437 1.00 0.09 H new ATOM 0 HA VAL B 127 -6.218 1.226 -3.778 1.00 0.08 H new ATOM 0 HB VAL B 127 -5.058 -0.286 -2.206 1.00 0.09 H new ATOM 0 HG11 VAL B 127 -6.839 -1.986 -2.016 1.00 0.10 H new ATOM 0 HG12 VAL B 127 -7.498 -0.369 -2.358 1.00 0.10 H new ATOM 0 HG13 VAL B 127 -7.392 -1.579 -3.658 1.00 0.10 H new ATOM 0 HG21 VAL B 127 -4.615 -2.628 -2.828 1.00 0.10 H new ATOM 0 HG22 VAL B 127 -5.061 -2.259 -4.510 1.00 0.10 H new ATOM 0 HG23 VAL B 127 -3.633 -1.489 -3.778 1.00 0.10 H new ATOM 1369 N ALA B 128 -3.352 0.249 -5.141 1.00 0.09 N ATOM 1370 CA ALA B 128 -1.986 0.682 -5.434 1.00 0.10 C ATOM 1371 C ALA B 128 -1.979 2.042 -6.125 1.00 0.10 C ATOM 1372 O ALA B 128 -0.946 2.705 -6.203 1.00 0.13 O ATOM 1373 CB ALA B 128 -1.270 -0.352 -6.292 1.00 0.10 C ATOM 0 H ALA B 128 -3.604 -0.653 -5.546 1.00 0.09 H new ATOM 0 HA ALA B 128 -1.454 0.779 -4.488 1.00 0.10 H new ATOM 0 HB1 ALA B 128 -0.255 -0.013 -6.500 1.00 0.10 H new ATOM 0 HB2 ALA B 128 -1.233 -1.303 -5.761 1.00 0.10 H new ATOM 0 HB3 ALA B 128 -1.809 -0.482 -7.231 1.00 0.10 H new ATOM 1379 N ALA B 129 -3.140 2.449 -6.623 1.00 0.08 N ATOM 1380 CA ALA B 129 -3.274 3.730 -7.304 1.00 0.09 C ATOM 1381 C ALA B 129 -3.542 4.845 -6.301 1.00 0.09 C ATOM 1382 O ALA B 129 -3.100 5.980 -6.480 1.00 0.12 O ATOM 1383 CB ALA B 129 -4.390 3.665 -8.336 1.00 0.10 C ATOM 0 H ALA B 129 -4.004 1.909 -6.568 1.00 0.08 H new ATOM 0 HA ALA B 129 -2.337 3.948 -7.817 1.00 0.09 H new ATOM 0 HB1 ALA B 129 -4.479 4.629 -8.837 1.00 0.10 H new ATOM 0 HB2 ALA B 129 -4.161 2.894 -9.071 1.00 0.10 H new ATOM 0 HB3 ALA B 129 -5.331 3.426 -7.840 1.00 0.10 H new ATOM 1389 N PHE B 130 -4.272 4.507 -5.243 1.00 0.08 N ATOM 1390 CA PHE B 130 -4.602 5.464 -4.195 1.00 0.08 C ATOM 1391 C PHE B 130 -3.453 5.586 -3.199 1.00 0.09 C ATOM 1392 O PHE B 130 -3.338 6.585 -2.490 1.00 0.14 O ATOM 1393 CB PHE B 130 -5.891 5.037 -3.484 1.00 0.09 C ATOM 1394 CG PHE B 130 -7.137 5.303 -4.286 1.00 0.09 C ATOM 1395 CD1 PHE B 130 -7.614 6.595 -4.434 1.00 0.11 C ATOM 1396 CD2 PHE B 130 -7.833 4.263 -4.886 1.00 0.14 C ATOM 1397 CE1 PHE B 130 -8.760 6.847 -5.161 1.00 0.13 C ATOM 1398 CE2 PHE B 130 -8.980 4.511 -5.616 1.00 0.17 C ATOM 1399 CZ PHE B 130 -9.432 5.781 -5.781 1.00 0.16 C ATOM 0 H PHE B 130 -4.648 3.571 -5.089 1.00 0.08 H new ATOM 0 HA PHE B 130 -4.761 6.442 -4.649 1.00 0.08 H new ATOM 0 HB2 PHE B 130 -5.835 3.972 -3.257 1.00 0.09 H new ATOM 0 HB3 PHE B 130 -5.962 5.563 -2.532 1.00 0.09 H new ATOM 0 HD1 PHE B 130 -7.083 7.415 -3.975 1.00 0.11 H new ATOM 0 HD2 PHE B 130 -7.475 3.250 -4.781 1.00 0.14 H new ATOM 0 HE1 PHE B 130 -9.137 7.855 -5.252 1.00 0.13 H new ATOM 0 HE2 PHE B 130 -9.521 3.688 -6.059 1.00 0.17 H new ATOM 0 HZ PHE B 130 -10.306 5.971 -6.387 1.00 0.16 H new ATOM 1409 N ILE B 131 -2.601 4.561 -3.151 1.00 0.08 N ATOM 1410 CA ILE B 131 -1.447 4.574 -2.259 1.00 0.09 C ATOM 1411 C ILE B 131 -0.355 5.434 -2.869 1.00 0.10 C ATOM 1412 O ILE B 131 0.247 6.272 -2.202 1.00 0.14 O ATOM 1413 CB ILE B 131 -0.882 3.160 -2.015 1.00 0.10 C ATOM 1414 CG1 ILE B 131 -1.988 2.205 -1.554 1.00 0.11 C ATOM 1415 CG2 ILE B 131 0.248 3.215 -0.994 1.00 0.12 C ATOM 1416 CD1 ILE B 131 -2.459 2.444 -0.137 1.00 0.13 C ATOM 0 H ILE B 131 -2.690 3.717 -3.717 1.00 0.08 H new ATOM 0 HA ILE B 131 -1.777 4.976 -1.301 1.00 0.09 H new ATOM 0 HB ILE B 131 -0.481 2.779 -2.954 1.00 0.10 H new ATOM 0 HG12 ILE B 131 -2.839 2.299 -2.229 1.00 0.11 H new ATOM 0 HG13 ILE B 131 -1.626 1.180 -1.637 1.00 0.11 H new ATOM 0 HG21 ILE B 131 0.639 2.211 -0.830 1.00 0.12 H new ATOM 0 HG22 ILE B 131 1.045 3.858 -1.367 1.00 0.12 H new ATOM 0 HG23 ILE B 131 -0.131 3.615 -0.053 1.00 0.12 H new ATOM 0 HD11 ILE B 131 -3.242 1.727 0.112 1.00 0.13 H new ATOM 0 HD12 ILE B 131 -1.622 2.321 0.550 1.00 0.13 H new ATOM 0 HD13 ILE B 131 -2.853 3.457 -0.051 1.00 0.13 H new ATOM 1428 N SER B 132 -0.110 5.208 -4.156 1.00 0.11 N ATOM 1429 CA SER B 132 0.892 5.967 -4.890 1.00 0.13 C ATOM 1430 C SER B 132 0.520 7.438 -4.870 1.00 0.15 C ATOM 1431 O SER B 132 1.370 8.314 -4.705 1.00 0.21 O ATOM 1432 CB SER B 132 0.968 5.476 -6.333 1.00 0.17 C ATOM 1433 OG SER B 132 2.078 6.042 -7.010 1.00 0.63 O ATOM 0 H SER B 132 -0.594 4.503 -4.712 1.00 0.11 H new ATOM 0 HA SER B 132 1.865 5.828 -4.419 1.00 0.13 H new ATOM 0 HB2 SER B 132 1.046 4.389 -6.346 1.00 0.17 H new ATOM 0 HB3 SER B 132 0.048 5.736 -6.857 1.00 0.17 H new ATOM 0 HG SER B 132 2.104 5.709 -7.931 1.00 0.63 H new ATOM 1439 N SER B 133 -0.770 7.689 -5.046 1.00 0.15 N ATOM 1440 CA SER B 133 -1.306 9.039 -5.036 1.00 0.19 C ATOM 1441 C SER B 133 -1.142 9.662 -3.653 1.00 0.18 C ATOM 1442 O SER B 133 -1.130 10.884 -3.508 1.00 0.26 O ATOM 1443 CB SER B 133 -2.784 9.006 -5.431 1.00 0.23 C ATOM 1444 OG SER B 133 -2.935 8.823 -6.828 1.00 0.74 O ATOM 0 H SER B 133 -1.471 6.964 -5.199 1.00 0.15 H new ATOM 0 HA SER B 133 -0.757 9.647 -5.755 1.00 0.19 H new ATOM 0 HB2 SER B 133 -3.288 8.199 -4.899 1.00 0.23 H new ATOM 0 HB3 SER B 133 -3.265 9.936 -5.129 1.00 0.23 H new ATOM 0 HG SER B 133 -3.004 7.866 -7.027 1.00 0.74 H new ATOM 1450 N LEU B 134 -1.010 8.806 -2.643 1.00 0.13 N ATOM 1451 CA LEU B 134 -0.849 9.259 -1.266 1.00 0.13 C ATOM 1452 C LEU B 134 0.563 9.779 -1.017 1.00 0.15 C ATOM 1453 O LEU B 134 0.748 10.929 -0.618 1.00 0.21 O ATOM 1454 CB LEU B 134 -1.166 8.122 -0.291 1.00 0.14 C ATOM 1455 CG LEU B 134 -2.213 8.446 0.776 1.00 0.17 C ATOM 1456 CD1 LEU B 134 -2.318 7.307 1.775 1.00 0.22 C ATOM 1457 CD2 LEU B 134 -1.875 9.749 1.484 1.00 0.20 C ATOM 0 H LEU B 134 -1.012 7.792 -2.754 1.00 0.13 H new ATOM 0 HA LEU B 134 -1.549 10.078 -1.100 1.00 0.13 H new ATOM 0 HB2 LEU B 134 -1.510 7.260 -0.863 1.00 0.14 H new ATOM 0 HB3 LEU B 134 -0.243 7.826 0.208 1.00 0.14 H new ATOM 0 HG LEU B 134 -3.179 8.567 0.285 1.00 0.17 H new ATOM 0 HD11 LEU B 134 -3.067 7.552 2.528 1.00 0.22 H new ATOM 0 HD12 LEU B 134 -2.610 6.394 1.256 1.00 0.22 H new ATOM 0 HD13 LEU B 134 -1.353 7.157 2.258 1.00 0.22 H new ATOM 0 HD21 LEU B 134 -2.633 9.960 2.239 1.00 0.20 H new ATOM 0 HD22 LEU B 134 -0.900 9.660 1.963 1.00 0.20 H new ATOM 0 HD23 LEU B 134 -1.850 10.562 0.758 1.00 0.20 H new ATOM 1469 N LEU B 135 1.558 8.927 -1.248 1.00 0.17 N ATOM 1470 CA LEU B 135 2.951 9.310 -1.045 1.00 0.22 C ATOM 1471 C LEU B 135 3.345 10.444 -1.987 1.00 0.24 C ATOM 1472 O LEU B 135 4.301 11.175 -1.728 1.00 0.31 O ATOM 1473 CB LEU B 135 3.878 8.105 -1.253 1.00 0.26 C ATOM 1474 CG LEU B 135 3.726 6.944 -0.258 1.00 0.31 C ATOM 1475 CD1 LEU B 135 2.983 7.372 1.000 1.00 0.67 C ATOM 1476 CD2 LEU B 135 3.020 5.773 -0.917 1.00 0.65 C ATOM 0 H LEU B 135 1.426 7.970 -1.575 1.00 0.17 H new ATOM 0 HA LEU B 135 3.057 9.661 -0.018 1.00 0.22 H new ATOM 0 HB2 LEU B 135 3.713 7.717 -2.258 1.00 0.26 H new ATOM 0 HB3 LEU B 135 4.909 8.457 -1.212 1.00 0.26 H new ATOM 0 HG LEU B 135 4.727 6.633 0.041 1.00 0.31 H new ATOM 0 HD11 LEU B 135 2.896 6.523 1.678 1.00 0.67 H new ATOM 0 HD12 LEU B 135 3.533 8.174 1.492 1.00 0.67 H new ATOM 0 HD13 LEU B 135 1.987 7.725 0.732 1.00 0.67 H new ATOM 0 HD21 LEU B 135 2.920 4.958 -0.200 1.00 0.65 H new ATOM 0 HD22 LEU B 135 2.031 6.086 -1.251 1.00 0.65 H new ATOM 0 HD23 LEU B 135 3.602 5.433 -1.774 1.00 0.65 H new ATOM 1488 N ASP B 136 2.603 10.583 -3.083 1.00 0.22 N ATOM 1489 CA ASP B 136 2.872 11.634 -4.058 1.00 0.26 C ATOM 1490 C ASP B 136 2.193 12.936 -3.640 1.00 0.25 C ATOM 1491 O ASP B 136 2.594 14.021 -4.061 1.00 0.29 O ATOM 1492 CB ASP B 136 2.383 11.210 -5.446 1.00 0.29 C ATOM 1493 CG ASP B 136 2.794 12.187 -6.530 1.00 0.37 C ATOM 1494 OD1 ASP B 136 3.958 12.126 -6.975 1.00 0.47 O ATOM 1495 OD2 ASP B 136 1.951 13.017 -6.930 1.00 0.40 O ATOM 0 H ASP B 136 1.813 9.982 -3.317 1.00 0.22 H new ATOM 0 HA ASP B 136 3.949 11.798 -4.099 1.00 0.26 H new ATOM 0 HB2 ASP B 136 2.780 10.223 -5.682 1.00 0.29 H new ATOM 0 HB3 ASP B 136 1.297 11.122 -5.434 1.00 0.29 H new ATOM 1500 N ASP B 137 1.163 12.814 -2.808 1.00 0.24 N ATOM 1501 CA ASP B 137 0.421 13.972 -2.320 1.00 0.27 C ATOM 1502 C ASP B 137 -0.115 13.719 -0.910 1.00 0.22 C ATOM 1503 O ASP B 137 -1.326 13.611 -0.711 1.00 0.24 O ATOM 1504 CB ASP B 137 -0.738 14.300 -3.264 1.00 0.38 C ATOM 1505 CG ASP B 137 -0.268 14.704 -4.647 1.00 1.19 C ATOM 1506 OD1 ASP B 137 -0.012 15.907 -4.857 1.00 1.42 O ATOM 1507 OD2 ASP B 137 -0.155 13.816 -5.518 1.00 2.13 O ATOM 0 H ASP B 137 0.822 11.920 -2.456 1.00 0.24 H new ATOM 0 HA ASP B 137 1.104 14.821 -2.287 1.00 0.27 H new ATOM 0 HB2 ASP B 137 -1.392 13.432 -3.346 1.00 0.38 H new ATOM 0 HB3 ASP B 137 -1.333 15.107 -2.836 1.00 0.38 H new ATOM 1512 N PRO B 138 0.783 13.618 0.087 1.00 0.19 N ATOM 1513 CA PRO B 138 0.396 13.371 1.484 1.00 0.21 C ATOM 1514 C PRO B 138 -0.579 14.412 2.034 1.00 0.22 C ATOM 1515 O PRO B 138 -1.134 14.232 3.118 1.00 0.31 O ATOM 1516 CB PRO B 138 1.725 13.436 2.241 1.00 0.24 C ATOM 1517 CG PRO B 138 2.759 13.128 1.218 1.00 0.25 C ATOM 1518 CD PRO B 138 2.246 13.715 -0.066 1.00 0.23 C ATOM 0 HA PRO B 138 -0.130 12.422 1.586 1.00 0.21 H new ATOM 0 HB2 PRO B 138 1.883 14.421 2.679 1.00 0.24 H new ATOM 0 HB3 PRO B 138 1.750 12.716 3.059 1.00 0.24 H new ATOM 0 HG2 PRO B 138 3.721 13.562 1.490 1.00 0.25 H new ATOM 0 HG3 PRO B 138 2.910 12.052 1.125 1.00 0.25 H new ATOM 0 HD2 PRO B 138 2.571 14.747 -0.196 1.00 0.23 H new ATOM 0 HD3 PRO B 138 2.599 13.158 -0.934 1.00 0.23 H new ATOM 1526 N SER B 139 -0.790 15.496 1.290 1.00 0.20 N ATOM 1527 CA SER B 139 -1.700 16.544 1.727 1.00 0.22 C ATOM 1528 C SER B 139 -3.138 16.154 1.419 1.00 0.19 C ATOM 1529 O SER B 139 -4.059 16.484 2.166 1.00 0.19 O ATOM 1530 CB SER B 139 -1.351 17.873 1.054 1.00 0.28 C ATOM 1531 OG SER B 139 -2.252 18.895 1.445 1.00 1.15 O ATOM 0 H SER B 139 -0.345 15.668 0.388 1.00 0.20 H new ATOM 0 HA SER B 139 -1.595 16.667 2.805 1.00 0.22 H new ATOM 0 HB2 SER B 139 -0.333 18.161 1.317 1.00 0.28 H new ATOM 0 HB3 SER B 139 -1.379 17.754 -0.029 1.00 0.28 H new ATOM 0 HG SER B 139 -2.007 19.734 1.003 1.00 1.15 H new ATOM 1537 N GLN B 140 -3.318 15.446 0.310 1.00 0.18 N ATOM 1538 CA GLN B 140 -4.640 15.000 -0.106 1.00 0.17 C ATOM 1539 C GLN B 140 -4.959 13.626 0.466 1.00 0.15 C ATOM 1540 O GLN B 140 -5.833 12.929 -0.035 1.00 0.14 O ATOM 1541 CB GLN B 140 -4.734 14.955 -1.627 1.00 0.21 C ATOM 1542 CG GLN B 140 -4.590 16.319 -2.266 1.00 0.26 C ATOM 1543 CD GLN B 140 -3.185 16.591 -2.749 1.00 1.09 C ATOM 1544 OE1 GLN B 140 -2.351 17.097 -1.852 1.00 1.74 O flip ATOM 1545 NE2 GLN B 140 -2.852 16.344 -3.908 1.00 1.37 N flip ATOM 0 H GLN B 140 -2.563 15.169 -0.317 1.00 0.18 H new ATOM 0 HA GLN B 140 -5.368 15.715 0.278 1.00 0.17 H new ATOM 0 HB2 GLN B 140 -3.959 14.294 -2.015 1.00 0.21 H new ATOM 0 HB3 GLN B 140 -5.693 14.524 -1.914 1.00 0.21 H new ATOM 0 HG2 GLN B 140 -5.280 16.397 -3.106 1.00 0.26 H new ATOM 0 HG3 GLN B 140 -4.877 17.085 -1.546 1.00 0.26 H new ATOM 0 HE21 GLN B 140 -3.531 15.955 -4.562 1.00 1.37 H new ATOM 0 HE22 GLN B 140 -1.897 16.529 -4.215 1.00 1.37 H new ATOM 1554 N SER B 141 -4.245 13.250 1.517 1.00 0.15 N ATOM 1555 CA SER B 141 -4.435 11.951 2.161 1.00 0.13 C ATOM 1556 C SER B 141 -5.907 11.671 2.461 1.00 0.13 C ATOM 1557 O SER B 141 -6.396 10.567 2.223 1.00 0.18 O ATOM 1558 CB SER B 141 -3.624 11.888 3.455 1.00 0.15 C ATOM 1559 OG SER B 141 -3.771 10.632 4.092 1.00 1.01 O ATOM 0 H SER B 141 -3.523 13.828 1.947 1.00 0.15 H new ATOM 0 HA SER B 141 -4.086 11.186 1.467 1.00 0.13 H new ATOM 0 HB2 SER B 141 -2.571 12.067 3.236 1.00 0.15 H new ATOM 0 HB3 SER B 141 -3.948 12.681 4.129 1.00 0.15 H new ATOM 0 HG SER B 141 -3.241 10.619 4.916 1.00 1.01 H new ATOM 1565 N ALA B 142 -6.605 12.672 2.985 1.00 0.16 N ATOM 1566 CA ALA B 142 -8.016 12.519 3.325 1.00 0.17 C ATOM 1567 C ALA B 142 -8.897 12.492 2.082 1.00 0.17 C ATOM 1568 O ALA B 142 -9.940 11.840 2.070 1.00 0.18 O ATOM 1569 CB ALA B 142 -8.456 13.634 4.259 1.00 0.20 C ATOM 0 H ALA B 142 -6.219 13.595 3.183 1.00 0.16 H new ATOM 0 HA ALA B 142 -8.132 11.561 3.832 1.00 0.17 H new ATOM 0 HB1 ALA B 142 -9.510 13.508 4.505 1.00 0.20 H new ATOM 0 HB2 ALA B 142 -7.864 13.598 5.173 1.00 0.20 H new ATOM 0 HB3 ALA B 142 -8.310 14.597 3.770 1.00 0.20 H new ATOM 1575 N ASN B 143 -8.476 13.195 1.037 1.00 0.17 N ATOM 1576 CA ASN B 143 -9.245 13.241 -0.201 1.00 0.18 C ATOM 1577 C ASN B 143 -8.987 11.993 -1.029 1.00 0.16 C ATOM 1578 O ASN B 143 -9.838 11.553 -1.798 1.00 0.17 O ATOM 1579 CB ASN B 143 -8.885 14.484 -1.009 1.00 0.20 C ATOM 1580 CG ASN B 143 -9.071 15.764 -0.218 1.00 0.23 C ATOM 1581 OD1 ASN B 143 -8.024 16.187 0.482 1.00 0.26 O flip ATOM 1582 ND2 ASN B 143 -10.143 16.368 -0.236 1.00 0.23 N flip ATOM 0 H ASN B 143 -7.612 13.738 1.021 1.00 0.17 H new ATOM 0 HA ASN B 143 -10.304 13.284 0.055 1.00 0.18 H new ATOM 0 HB2 ASN B 143 -7.849 14.412 -1.339 1.00 0.20 H new ATOM 0 HB3 ASN B 143 -9.503 14.522 -1.906 1.00 0.20 H new ATOM 0 HD21 ASN B 143 -10.922 16.008 -0.787 1.00 0.23 H new ATOM 0 HD22 ASN B 143 -10.253 17.229 0.300 1.00 0.23 H new ATOM 1589 N LEU B 144 -7.801 11.430 -0.854 1.00 0.14 N ATOM 1590 CA LEU B 144 -7.397 10.233 -1.566 1.00 0.12 C ATOM 1591 C LEU B 144 -8.061 9.016 -0.947 1.00 0.11 C ATOM 1592 O LEU B 144 -8.514 8.112 -1.649 1.00 0.13 O ATOM 1593 CB LEU B 144 -5.879 10.105 -1.521 1.00 0.12 C ATOM 1594 CG LEU B 144 -5.125 11.168 -2.320 1.00 0.13 C ATOM 1595 CD1 LEU B 144 -3.661 11.181 -1.928 1.00 0.14 C ATOM 1596 CD2 LEU B 144 -5.280 10.923 -3.813 1.00 0.14 C ATOM 0 H LEU B 144 -7.094 11.792 -0.214 1.00 0.14 H new ATOM 0 HA LEU B 144 -7.711 10.300 -2.608 1.00 0.12 H new ATOM 0 HB2 LEU B 144 -5.554 10.153 -0.482 1.00 0.12 H new ATOM 0 HB3 LEU B 144 -5.600 9.121 -1.897 1.00 0.12 H new ATOM 0 HG LEU B 144 -5.552 12.144 -2.089 1.00 0.13 H new ATOM 0 HD11 LEU B 144 -3.137 11.943 -2.505 1.00 0.14 H new ATOM 0 HD12 LEU B 144 -3.571 11.405 -0.865 1.00 0.14 H new ATOM 0 HD13 LEU B 144 -3.221 10.205 -2.132 1.00 0.14 H new ATOM 0 HD21 LEU B 144 -4.737 11.689 -4.366 1.00 0.14 H new ATOM 0 HD22 LEU B 144 -4.879 9.941 -4.064 1.00 0.14 H new ATOM 0 HD23 LEU B 144 -6.336 10.963 -4.081 1.00 0.14 H new ATOM 1608 N LEU B 145 -8.112 9.003 0.379 1.00 0.11 N ATOM 1609 CA LEU B 145 -8.755 7.920 1.100 1.00 0.11 C ATOM 1610 C LEU B 145 -10.256 8.033 0.906 1.00 0.12 C ATOM 1611 O LEU B 145 -10.975 7.034 0.890 1.00 0.11 O ATOM 1612 CB LEU B 145 -8.394 7.971 2.587 1.00 0.12 C ATOM 1613 CG LEU B 145 -9.308 7.166 3.516 1.00 0.13 C ATOM 1614 CD1 LEU B 145 -9.337 5.700 3.109 1.00 0.15 C ATOM 1615 CD2 LEU B 145 -8.854 7.312 4.959 1.00 0.16 C ATOM 0 H LEU B 145 -7.715 9.731 0.973 1.00 0.11 H new ATOM 0 HA LEU B 145 -8.407 6.963 0.712 1.00 0.11 H new ATOM 0 HB2 LEU B 145 -7.373 7.609 2.708 1.00 0.12 H new ATOM 0 HB3 LEU B 145 -8.403 9.012 2.910 1.00 0.12 H new ATOM 0 HG LEU B 145 -10.320 7.561 3.429 1.00 0.13 H new ATOM 0 HD11 LEU B 145 -9.992 5.148 3.783 1.00 0.15 H new ATOM 0 HD12 LEU B 145 -9.710 5.613 2.088 1.00 0.15 H new ATOM 0 HD13 LEU B 145 -8.330 5.287 3.164 1.00 0.15 H new ATOM 0 HD21 LEU B 145 -9.513 6.735 5.608 1.00 0.16 H new ATOM 0 HD22 LEU B 145 -7.833 6.944 5.058 1.00 0.16 H new ATOM 0 HD23 LEU B 145 -8.890 8.363 5.247 1.00 0.16 H new ATOM 1627 N ALA B 146 -10.720 9.270 0.748 1.00 0.16 N ATOM 1628 CA ALA B 146 -12.132 9.530 0.526 1.00 0.17 C ATOM 1629 C ALA B 146 -12.552 8.959 -0.821 1.00 0.16 C ATOM 1630 O ALA B 146 -13.550 8.247 -0.923 1.00 0.17 O ATOM 1631 CB ALA B 146 -12.418 11.023 0.588 1.00 0.20 C ATOM 0 H ALA B 146 -10.135 10.105 0.770 1.00 0.16 H new ATOM 0 HA ALA B 146 -12.710 9.044 1.312 1.00 0.17 H new ATOM 0 HB1 ALA B 146 -13.481 11.197 0.419 1.00 0.20 H new ATOM 0 HB2 ALA B 146 -12.139 11.407 1.569 1.00 0.20 H new ATOM 0 HB3 ALA B 146 -11.840 11.536 -0.180 1.00 0.20 H new ATOM 1637 N GLU B 147 -11.770 9.274 -1.852 1.00 0.18 N ATOM 1638 CA GLU B 147 -12.032 8.783 -3.196 1.00 0.19 C ATOM 1639 C GLU B 147 -12.058 7.268 -3.184 1.00 0.16 C ATOM 1640 O GLU B 147 -12.959 6.638 -3.736 1.00 0.18 O ATOM 1641 CB GLU B 147 -10.947 9.269 -4.153 1.00 0.27 C ATOM 1642 CG GLU B 147 -10.963 10.768 -4.380 1.00 0.18 C ATOM 1643 CD GLU B 147 -11.943 11.185 -5.458 1.00 0.39 C ATOM 1644 OE1 GLU B 147 -11.538 11.240 -6.638 1.00 0.57 O ATOM 1645 OE2 GLU B 147 -13.115 11.457 -5.123 1.00 0.62 O ATOM 0 H GLU B 147 -10.946 9.871 -1.777 1.00 0.18 H new ATOM 0 HA GLU B 147 -12.997 9.163 -3.532 1.00 0.19 H new ATOM 0 HB2 GLU B 147 -9.972 8.980 -3.760 1.00 0.27 H new ATOM 0 HB3 GLU B 147 -11.067 8.764 -5.111 1.00 0.27 H new ATOM 0 HG2 GLU B 147 -11.220 11.270 -3.447 1.00 0.18 H new ATOM 0 HG3 GLU B 147 -9.962 11.100 -4.656 1.00 0.18 H new ATOM 1652 N ALA B 148 -11.044 6.700 -2.548 1.00 0.13 N ATOM 1653 CA ALA B 148 -10.921 5.259 -2.422 1.00 0.12 C ATOM 1654 C ALA B 148 -12.203 4.661 -1.855 1.00 0.14 C ATOM 1655 O ALA B 148 -12.686 3.634 -2.329 1.00 0.20 O ATOM 1656 CB ALA B 148 -9.743 4.923 -1.526 1.00 0.11 C ATOM 0 H ALA B 148 -10.288 7.224 -2.107 1.00 0.13 H new ATOM 0 HA ALA B 148 -10.752 4.831 -3.410 1.00 0.12 H new ATOM 0 HB1 ALA B 148 -9.653 3.841 -1.433 1.00 0.11 H new ATOM 0 HB2 ALA B 148 -8.829 5.327 -1.960 1.00 0.11 H new ATOM 0 HB3 ALA B 148 -9.900 5.360 -0.540 1.00 0.11 H new ATOM 1662 N LYS B 149 -12.742 5.317 -0.833 1.00 0.14 N ATOM 1663 CA LYS B 149 -13.973 4.870 -0.196 1.00 0.17 C ATOM 1664 C LYS B 149 -15.147 4.956 -1.164 1.00 0.17 C ATOM 1665 O LYS B 149 -16.071 4.146 -1.104 1.00 0.22 O ATOM 1666 CB LYS B 149 -14.259 5.713 1.048 1.00 0.24 C ATOM 1667 CG LYS B 149 -13.352 5.397 2.222 1.00 0.34 C ATOM 1668 CD LYS B 149 -13.750 6.192 3.454 1.00 0.42 C ATOM 1669 CE LYS B 149 -12.755 6.000 4.585 1.00 0.59 C ATOM 1670 NZ LYS B 149 -13.157 6.745 5.809 1.00 1.01 N ATOM 0 H LYS B 149 -12.343 6.164 -0.427 1.00 0.14 H new ATOM 0 HA LYS B 149 -13.845 3.829 0.099 1.00 0.17 H new ATOM 0 HB2 LYS B 149 -14.154 6.768 0.793 1.00 0.24 H new ATOM 0 HB3 LYS B 149 -15.295 5.559 1.349 1.00 0.24 H new ATOM 0 HG2 LYS B 149 -13.398 4.331 2.444 1.00 0.34 H new ATOM 0 HG3 LYS B 149 -12.319 5.623 1.958 1.00 0.34 H new ATOM 0 HD2 LYS B 149 -13.815 7.250 3.200 1.00 0.42 H new ATOM 0 HD3 LYS B 149 -14.742 5.882 3.784 1.00 0.42 H new ATOM 0 HE2 LYS B 149 -12.670 4.938 4.817 1.00 0.59 H new ATOM 0 HE3 LYS B 149 -11.769 6.336 4.263 1.00 0.59 H new ATOM 0 HZ1 LYS B 149 -12.452 6.588 6.558 1.00 1.01 H new ATOM 0 HZ2 LYS B 149 -13.214 7.761 5.594 1.00 1.01 H new ATOM 0 HZ3 LYS B 149 -14.086 6.407 6.132 1.00 1.01 H new ATOM 1684 N LYS B 150 -15.106 5.944 -2.055 1.00 0.17 N ATOM 1685 CA LYS B 150 -16.166 6.123 -3.039 1.00 0.20 C ATOM 1686 C LYS B 150 -16.116 5.010 -4.076 1.00 0.21 C ATOM 1687 O LYS B 150 -17.151 4.512 -4.519 1.00 0.30 O ATOM 1688 CB LYS B 150 -16.038 7.484 -3.727 1.00 0.25 C ATOM 1689 CG LYS B 150 -16.072 8.659 -2.762 1.00 0.72 C ATOM 1690 CD LYS B 150 -16.194 9.986 -3.495 1.00 0.81 C ATOM 1691 CE LYS B 150 -17.557 10.142 -4.151 1.00 1.28 C ATOM 1692 NZ LYS B 150 -17.699 11.460 -4.828 1.00 1.99 N ATOM 0 H LYS B 150 -14.353 6.629 -2.114 1.00 0.17 H new ATOM 0 HA LYS B 150 -17.124 6.083 -2.521 1.00 0.20 H new ATOM 0 HB2 LYS B 150 -15.104 7.512 -4.288 1.00 0.25 H new ATOM 0 HB3 LYS B 150 -16.847 7.594 -4.449 1.00 0.25 H new ATOM 0 HG2 LYS B 150 -16.912 8.543 -2.077 1.00 0.72 H new ATOM 0 HG3 LYS B 150 -15.165 8.659 -2.157 1.00 0.72 H new ATOM 0 HD2 LYS B 150 -16.031 10.805 -2.795 1.00 0.81 H new ATOM 0 HD3 LYS B 150 -15.415 10.056 -4.254 1.00 0.81 H new ATOM 0 HE2 LYS B 150 -17.704 9.343 -4.878 1.00 1.28 H new ATOM 0 HE3 LYS B 150 -18.337 10.035 -3.397 1.00 1.28 H new ATOM 0 HZ1 LYS B 150 -18.641 11.527 -5.263 1.00 1.99 H new ATOM 0 HZ2 LYS B 150 -17.584 12.223 -4.130 1.00 1.99 H new ATOM 0 HZ3 LYS B 150 -16.971 11.552 -5.565 1.00 1.99 H new ATOM 1706 N LEU B 151 -14.903 4.623 -4.454 1.00 0.16 N ATOM 1707 CA LEU B 151 -14.709 3.563 -5.432 1.00 0.16 C ATOM 1708 C LEU B 151 -15.141 2.223 -4.848 1.00 0.15 C ATOM 1709 O LEU B 151 -15.859 1.453 -5.486 1.00 0.18 O ATOM 1710 CB LEU B 151 -13.242 3.505 -5.865 1.00 0.16 C ATOM 1711 CG LEU B 151 -12.931 2.508 -6.985 1.00 0.16 C ATOM 1712 CD1 LEU B 151 -13.885 2.694 -8.151 1.00 0.18 C ATOM 1713 CD2 LEU B 151 -11.489 2.661 -7.443 1.00 0.18 C ATOM 0 H LEU B 151 -14.039 5.029 -4.096 1.00 0.16 H new ATOM 0 HA LEU B 151 -15.323 3.777 -6.307 1.00 0.16 H new ATOM 0 HB2 LEU B 151 -12.936 4.499 -6.191 1.00 0.16 H new ATOM 0 HB3 LEU B 151 -12.633 3.253 -4.997 1.00 0.16 H new ATOM 0 HG LEU B 151 -13.066 1.499 -6.595 1.00 0.16 H new ATOM 0 HD11 LEU B 151 -13.646 1.976 -8.935 1.00 0.18 H new ATOM 0 HD12 LEU B 151 -14.909 2.534 -7.813 1.00 0.18 H new ATOM 0 HD13 LEU B 151 -13.786 3.706 -8.544 1.00 0.18 H new ATOM 0 HD21 LEU B 151 -11.282 1.946 -8.239 1.00 0.18 H new ATOM 0 HD22 LEU B 151 -11.331 3.673 -7.814 1.00 0.18 H new ATOM 0 HD23 LEU B 151 -10.819 2.473 -6.604 1.00 0.18 H new ATOM 1725 N ASN B 152 -14.687 1.956 -3.631 1.00 0.13 N ATOM 1726 CA ASN B 152 -15.028 0.722 -2.931 1.00 0.14 C ATOM 1727 C ASN B 152 -16.537 0.603 -2.758 1.00 0.17 C ATOM 1728 O ASN B 152 -17.146 -0.371 -3.198 1.00 0.21 O ATOM 1729 CB ASN B 152 -14.347 0.686 -1.564 1.00 0.20 C ATOM 1730 CG ASN B 152 -14.822 -0.477 -0.715 1.00 0.39 C ATOM 1731 OD1 ASN B 152 -14.144 -1.610 -0.835 1.00 1.39 O flip ATOM 1732 ND2 ASN B 152 -15.787 -0.357 0.039 1.00 0.69 N flip ATOM 0 H ASN B 152 -14.077 2.581 -3.104 1.00 0.13 H new ATOM 0 HA ASN B 152 -14.676 -0.119 -3.529 1.00 0.14 H new ATOM 0 HB2 ASN B 152 -13.268 0.617 -1.700 1.00 0.20 H new ATOM 0 HB3 ASN B 152 -14.543 1.621 -1.038 1.00 0.20 H new ATOM 0 HD21 ASN B 152 -16.279 0.534 0.099 1.00 0.69 H new ATOM 0 HD22 ASN B 152 -16.095 -1.149 0.604 1.00 0.69 H new ATOM 1739 N ASP B 153 -17.130 1.598 -2.107 1.00 0.18 N ATOM 1740 CA ASP B 153 -18.571 1.618 -1.876 1.00 0.23 C ATOM 1741 C ASP B 153 -19.334 1.503 -3.192 1.00 0.25 C ATOM 1742 O ASP B 153 -20.441 0.966 -3.236 1.00 0.31 O ATOM 1743 CB ASP B 153 -18.975 2.903 -1.149 1.00 0.28 C ATOM 1744 CG ASP B 153 -20.479 3.056 -1.032 1.00 1.20 C ATOM 1745 OD1 ASP B 153 -21.081 2.369 -0.181 1.00 1.04 O ATOM 1746 OD2 ASP B 153 -21.054 3.865 -1.790 1.00 2.25 O ATOM 0 H ASP B 153 -16.633 2.404 -1.728 1.00 0.18 H new ATOM 0 HA ASP B 153 -18.826 0.761 -1.253 1.00 0.23 H new ATOM 0 HB2 ASP B 153 -18.534 2.907 -0.152 1.00 0.28 H new ATOM 0 HB3 ASP B 153 -18.566 3.762 -1.681 1.00 0.28 H new ATOM 1751 N ALA B 154 -18.732 2.014 -4.263 1.00 0.23 N ATOM 1752 CA ALA B 154 -19.348 1.970 -5.583 1.00 0.28 C ATOM 1753 C ALA B 154 -19.581 0.532 -6.032 1.00 0.30 C ATOM 1754 O ALA B 154 -20.708 0.137 -6.329 1.00 0.35 O ATOM 1755 CB ALA B 154 -18.479 2.708 -6.592 1.00 0.28 C ATOM 0 H ALA B 154 -17.817 2.464 -4.241 1.00 0.23 H new ATOM 0 HA ALA B 154 -20.318 2.464 -5.524 1.00 0.28 H new ATOM 0 HB1 ALA B 154 -18.949 2.669 -7.575 1.00 0.28 H new ATOM 0 HB2 ALA B 154 -18.368 3.748 -6.284 1.00 0.28 H new ATOM 0 HB3 ALA B 154 -17.497 2.237 -6.640 1.00 0.28 H new ATOM 1761 N GLN B 155 -18.504 -0.248 -6.080 1.00 0.30 N ATOM 1762 CA GLN B 155 -18.587 -1.645 -6.491 1.00 0.35 C ATOM 1763 C GLN B 155 -19.168 -2.505 -5.374 1.00 0.36 C ATOM 1764 O GLN B 155 -19.641 -3.616 -5.614 1.00 0.44 O ATOM 1765 CB GLN B 155 -17.200 -2.162 -6.879 1.00 0.35 C ATOM 1766 CG GLN B 155 -16.495 -1.296 -7.910 1.00 0.36 C ATOM 1767 CD GLN B 155 -15.103 -1.799 -8.239 1.00 0.41 C ATOM 1768 OE1 GLN B 155 -14.920 -2.606 -9.151 1.00 0.51 O ATOM 1769 NE2 GLN B 155 -14.111 -1.322 -7.496 1.00 0.39 N ATOM 0 H GLN B 155 -17.564 0.065 -5.839 1.00 0.30 H new ATOM 0 HA GLN B 155 -19.248 -1.708 -7.355 1.00 0.35 H new ATOM 0 HB2 GLN B 155 -16.581 -2.224 -5.984 1.00 0.35 H new ATOM 0 HB3 GLN B 155 -17.295 -3.175 -7.271 1.00 0.35 H new ATOM 0 HG2 GLN B 155 -17.091 -1.265 -8.822 1.00 0.36 H new ATOM 0 HG3 GLN B 155 -16.429 -0.274 -7.537 1.00 0.36 H new ATOM 0 HE21 GLN B 155 -14.308 -0.655 -6.750 1.00 0.39 H new ATOM 0 HE22 GLN B 155 -13.152 -1.623 -7.671 1.00 0.39 H new