USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 804 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 44 THR OG1 : rot 47:sc= 1.72 USER MOD Set 1.2: A 47 SER OG : rot -146:sc= 1.5 USER MOD Set 2.1: A 17 LYS NZ :NH3+ 132:sc= 1.13 (180deg=0) USER MOD Set 2.2: A 66 ASN : amide:sc= -0.322 K(o=0.81,f=-15!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.00143 USER MOD Single : A 3 GLN :FLIP amide:sc= -0.536 F(o=-1.4,f=-0.54) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 TYR OH : rot 130:sc= 0 USER MOD Single : A 7 THR OG1 : rot 74:sc= -1.12 USER MOD Single : A 9 ASN : amide:sc= -0.0102 K(o=-0.01,f=-1.1) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= -2.8! (180deg=-2.8!) USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.00603) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 174:sc= -2.74 USER MOD Single : A 41 ASN : amide:sc= -0.0883 X(o=-0.088,f=-0.1) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot -150:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.135 K(o=-0.13,f=-0.91) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 80 GLN : amide:sc= 0 K(o=0,f=-1.6) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 86 ASN : amide:sc= -0.135 K(o=-0.13,f=-1.7!) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 MET CE :methyl -125:sc= -0.0324 (180deg=-0.364) USER MOD Single : A 94 MET CE :methyl 167:sc= 0 (180deg=-0.277) USER MOD Single : A 95 ASN :FLIP amide:sc= -0.0446 F(o=-1.9!,f=-0.045) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 SER OG : rot -53:sc= 1.07 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -5.637 7.560 -22.034 1.00 0.00 N ATOM 2 CA MET A 1 -5.319 6.309 -21.287 1.00 0.00 C ATOM 3 C MET A 1 -5.119 6.617 -19.795 1.00 0.00 C ATOM 4 O MET A 1 -4.013 6.871 -19.356 1.00 0.00 O ATOM 5 CB MET A 1 -4.019 5.797 -21.908 1.00 0.00 C ATOM 6 CG MET A 1 -3.795 4.340 -21.496 1.00 0.00 C ATOM 7 SD MET A 1 -2.227 3.752 -22.185 1.00 0.00 S ATOM 8 CE MET A 1 -1.217 4.021 -20.707 1.00 0.00 C ATOM 0 H1 MET A 1 -5.770 7.339 -23.041 1.00 0.00 H new ATOM 0 H2 MET A 1 -6.509 7.979 -21.654 1.00 0.00 H new ATOM 0 H3 MET A 1 -4.854 8.236 -21.929 1.00 0.00 H new ATOM 0 HA MET A 1 -6.120 5.573 -21.354 1.00 0.00 H new ATOM 0 HB2 MET A 1 -4.067 5.876 -22.994 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.180 6.412 -21.581 1.00 0.00 H new ATOM 0 HG2 MET A 1 -3.781 4.256 -20.409 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.617 3.719 -21.853 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.189 3.720 -20.909 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.239 5.077 -20.438 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.613 3.428 -19.883 1.00 0.00 H new ATOM 20 N SER A 2 -6.177 6.596 -19.009 1.00 0.00 N ATOM 21 CA SER A 2 -6.032 6.889 -17.551 1.00 0.00 C ATOM 22 C SER A 2 -6.550 5.705 -16.718 1.00 0.00 C ATOM 23 O SER A 2 -7.573 5.127 -17.032 1.00 0.00 O ATOM 24 CB SER A 2 -6.891 8.129 -17.310 1.00 0.00 C ATOM 25 OG SER A 2 -8.043 8.071 -18.140 1.00 0.00 O ATOM 0 H SER A 2 -7.127 6.389 -19.318 1.00 0.00 H new ATOM 0 HA SER A 2 -4.993 7.050 -17.263 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.186 8.183 -16.262 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.318 9.030 -17.527 1.00 0.00 H new ATOM 0 HG SER A 2 -8.597 8.865 -17.986 1.00 0.00 H new ATOM 31 N GLN A 3 -5.856 5.338 -15.659 1.00 0.00 N ATOM 32 CA GLN A 3 -6.320 4.193 -14.820 1.00 0.00 C ATOM 33 C GLN A 3 -6.545 4.652 -13.369 1.00 0.00 C ATOM 34 O GLN A 3 -6.220 3.941 -12.436 1.00 0.00 O ATOM 35 CB GLN A 3 -5.186 3.163 -14.889 1.00 0.00 C ATOM 36 CG GLN A 3 -5.587 2.011 -15.818 1.00 0.00 C ATOM 37 CD GLN A 3 -5.760 2.538 -17.247 1.00 0.00 C ATOM 38 OE1 GLN A 3 -6.963 2.705 -17.741 1.00 0.00 O flip ATOM 39 NE2 GLN A 3 -4.788 2.803 -17.927 1.00 0.00 N flip ATOM 0 H GLN A 3 -4.993 5.783 -15.346 1.00 0.00 H new ATOM 0 HA GLN A 3 -7.266 3.781 -15.172 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -4.274 3.636 -15.254 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -4.969 2.780 -13.892 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -4.825 1.232 -15.797 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -6.516 1.558 -15.472 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -3.850 2.675 -17.548 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -4.910 3.153 -18.877 1.00 0.00 H new ATOM 48 N GLU A 4 -7.103 5.831 -13.164 1.00 0.00 N ATOM 49 CA GLU A 4 -7.344 6.308 -11.751 1.00 0.00 C ATOM 50 C GLU A 4 -8.236 5.305 -11.005 1.00 0.00 C ATOM 51 O GLU A 4 -8.023 5.041 -9.836 1.00 0.00 O ATOM 52 CB GLU A 4 -8.046 7.671 -11.852 1.00 0.00 C ATOM 53 CG GLU A 4 -7.124 8.670 -12.553 1.00 0.00 C ATOM 54 CD GLU A 4 -7.354 10.070 -11.976 1.00 0.00 C ATOM 55 OE1 GLU A 4 -8.357 10.673 -12.319 1.00 0.00 O ATOM 56 OE2 GLU A 4 -6.521 10.512 -11.201 1.00 0.00 O ATOM 0 H GLU A 4 -7.398 6.474 -13.899 1.00 0.00 H new ATOM 0 HA GLU A 4 -6.407 6.395 -11.201 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -8.979 7.571 -12.406 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -8.303 8.034 -10.857 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -6.083 8.376 -12.419 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -7.319 8.671 -13.625 1.00 0.00 H new ATOM 63 N GLN A 5 -9.225 4.729 -11.666 1.00 0.00 N ATOM 64 CA GLN A 5 -10.109 3.724 -10.961 1.00 0.00 C ATOM 65 C GLN A 5 -9.235 2.628 -10.321 1.00 0.00 C ATOM 66 O GLN A 5 -9.504 2.181 -9.222 1.00 0.00 O ATOM 67 CB GLN A 5 -11.064 3.128 -12.018 1.00 0.00 C ATOM 68 CG GLN A 5 -10.276 2.360 -13.086 1.00 0.00 C ATOM 69 CD GLN A 5 -11.218 1.966 -14.232 1.00 0.00 C ATOM 70 OE1 GLN A 5 -11.873 0.946 -14.165 1.00 0.00 O ATOM 71 NE2 GLN A 5 -11.316 2.734 -15.291 1.00 0.00 N ATOM 0 H GLN A 5 -9.457 4.905 -12.644 1.00 0.00 H new ATOM 0 HA GLN A 5 -10.687 4.193 -10.164 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -11.778 2.461 -11.535 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -11.640 3.926 -12.487 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -9.462 2.977 -13.466 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -9.824 1.469 -12.650 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -10.768 3.592 -15.351 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -11.941 2.473 -16.054 1.00 0.00 H new ATOM 80 N TYR A 6 -8.167 2.228 -10.982 1.00 0.00 N ATOM 81 CA TYR A 6 -7.256 1.202 -10.369 1.00 0.00 C ATOM 82 C TYR A 6 -6.437 1.878 -9.259 1.00 0.00 C ATOM 83 O TYR A 6 -6.157 1.280 -8.239 1.00 0.00 O ATOM 84 CB TYR A 6 -6.323 0.705 -11.485 1.00 0.00 C ATOM 85 CG TYR A 6 -6.999 -0.399 -12.263 1.00 0.00 C ATOM 86 CD1 TYR A 6 -7.904 -0.082 -13.283 1.00 0.00 C ATOM 87 CD2 TYR A 6 -6.714 -1.736 -11.968 1.00 0.00 C ATOM 88 CE1 TYR A 6 -8.526 -1.105 -14.006 1.00 0.00 C ATOM 89 CE2 TYR A 6 -7.336 -2.760 -12.691 1.00 0.00 C ATOM 90 CZ TYR A 6 -8.242 -2.445 -13.711 1.00 0.00 C ATOM 91 OH TYR A 6 -8.856 -3.454 -14.425 1.00 0.00 O ATOM 0 H TYR A 6 -7.891 2.562 -11.905 1.00 0.00 H new ATOM 0 HA TYR A 6 -7.813 0.369 -9.940 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -6.068 1.529 -12.152 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -5.389 0.341 -11.056 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -8.122 0.951 -13.511 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -6.014 -1.978 -11.182 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -9.226 -0.862 -14.792 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -7.117 -3.793 -12.462 1.00 0.00 H new ATOM 0 HH TYR A 6 -8.180 -4.089 -14.742 1.00 0.00 H new ATOM 101 N THR A 7 -6.055 3.129 -9.449 1.00 0.00 N ATOM 102 CA THR A 7 -5.259 3.839 -8.390 1.00 0.00 C ATOM 103 C THR A 7 -6.122 4.037 -7.135 1.00 0.00 C ATOM 104 O THR A 7 -5.648 3.869 -6.027 1.00 0.00 O ATOM 105 CB THR A 7 -4.857 5.201 -8.994 1.00 0.00 C ATOM 106 OG1 THR A 7 -4.061 4.985 -10.149 1.00 0.00 O ATOM 107 CG2 THR A 7 -4.066 6.031 -7.980 1.00 0.00 C ATOM 0 H THR A 7 -6.259 3.680 -10.283 1.00 0.00 H new ATOM 0 HA THR A 7 -4.379 3.268 -8.095 1.00 0.00 H new ATOM 0 HB THR A 7 -5.762 5.747 -9.260 1.00 0.00 H new ATOM 0 HG1 THR A 7 -4.628 4.669 -10.883 1.00 0.00 H new ATOM 0 HG21 THR A 7 -3.793 6.987 -8.427 1.00 0.00 H new ATOM 0 HG22 THR A 7 -4.679 6.206 -7.096 1.00 0.00 H new ATOM 0 HG23 THR A 7 -3.162 5.492 -7.695 1.00 0.00 H new ATOM 115 N GLU A 8 -7.383 4.383 -7.294 1.00 0.00 N ATOM 116 CA GLU A 8 -8.252 4.575 -6.079 1.00 0.00 C ATOM 117 C GLU A 8 -8.531 3.215 -5.433 1.00 0.00 C ATOM 118 O GLU A 8 -8.490 3.082 -4.224 1.00 0.00 O ATOM 119 CB GLU A 8 -9.559 5.225 -6.559 1.00 0.00 C ATOM 120 CG GLU A 8 -9.395 6.746 -6.576 1.00 0.00 C ATOM 121 CD GLU A 8 -10.763 7.410 -6.405 1.00 0.00 C ATOM 122 OE1 GLU A 8 -11.577 7.286 -7.306 1.00 0.00 O ATOM 123 OE2 GLU A 8 -10.973 8.031 -5.377 1.00 0.00 O ATOM 0 H GLU A 8 -7.841 4.538 -8.192 1.00 0.00 H new ATOM 0 HA GLU A 8 -7.766 5.207 -5.336 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -9.812 4.865 -7.556 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -10.381 4.944 -5.900 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -8.725 7.059 -5.775 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -8.940 7.063 -7.515 1.00 0.00 H new ATOM 130 N ASN A 9 -8.789 2.196 -6.224 1.00 0.00 N ATOM 131 CA ASN A 9 -9.039 0.840 -5.625 1.00 0.00 C ATOM 132 C ASN A 9 -7.711 0.264 -5.115 1.00 0.00 C ATOM 133 O ASN A 9 -7.665 -0.358 -4.069 1.00 0.00 O ATOM 134 CB ASN A 9 -9.622 -0.043 -6.737 1.00 0.00 C ATOM 135 CG ASN A 9 -11.106 0.292 -6.934 1.00 0.00 C ATOM 136 OD1 ASN A 9 -11.455 1.436 -7.145 1.00 0.00 O ATOM 137 ND2 ASN A 9 -12.005 -0.662 -6.873 1.00 0.00 N ATOM 0 H ASN A 9 -8.837 2.241 -7.242 1.00 0.00 H new ATOM 0 HA ASN A 9 -9.732 0.892 -4.785 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -9.076 0.117 -7.667 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -9.508 -1.095 -6.477 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -12.992 -0.441 -7.003 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -11.716 -1.624 -6.696 1.00 0.00 H new ATOM 144 N LEU A 10 -6.623 0.482 -5.828 1.00 0.00 N ATOM 145 CA LEU A 10 -5.301 -0.048 -5.344 1.00 0.00 C ATOM 146 C LEU A 10 -4.927 0.634 -4.021 1.00 0.00 C ATOM 147 O LEU A 10 -4.374 0.008 -3.136 1.00 0.00 O ATOM 148 CB LEU A 10 -4.258 0.283 -6.426 1.00 0.00 C ATOM 149 CG LEU A 10 -2.902 -0.299 -6.021 1.00 0.00 C ATOM 150 CD1 LEU A 10 -2.984 -1.827 -6.018 1.00 0.00 C ATOM 151 CD2 LEU A 10 -1.834 0.154 -7.020 1.00 0.00 C ATOM 0 H LEU A 10 -6.593 0.995 -6.709 1.00 0.00 H new ATOM 0 HA LEU A 10 -5.346 -1.123 -5.171 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -4.571 -0.128 -7.386 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.179 1.363 -6.553 1.00 0.00 H new ATOM 0 HG LEU A 10 -2.638 0.052 -5.023 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -2.018 -2.243 -5.730 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.745 -2.149 -5.307 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.247 -2.179 -7.015 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.868 -0.260 -6.732 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -2.097 -0.197 -8.018 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.776 1.242 -7.022 1.00 0.00 H new ATOM 163 N LYS A 11 -5.231 1.911 -3.865 1.00 0.00 N ATOM 164 CA LYS A 11 -4.886 2.607 -2.571 1.00 0.00 C ATOM 165 C LYS A 11 -5.531 1.874 -1.384 1.00 0.00 C ATOM 166 O LYS A 11 -4.955 1.807 -0.313 1.00 0.00 O ATOM 167 CB LYS A 11 -5.437 4.038 -2.672 1.00 0.00 C ATOM 168 CG LYS A 11 -4.361 4.960 -3.249 1.00 0.00 C ATOM 169 CD LYS A 11 -4.834 6.412 -3.168 1.00 0.00 C ATOM 170 CE LYS A 11 -4.302 7.192 -4.372 1.00 0.00 C ATOM 171 NZ LYS A 11 -5.431 7.214 -5.344 1.00 0.00 N ATOM 0 H LYS A 11 -5.694 2.492 -4.564 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.808 2.614 -2.410 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.323 4.054 -3.307 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -5.744 4.391 -1.688 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -3.429 4.839 -2.696 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -4.155 4.691 -4.285 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -5.923 6.450 -3.150 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -4.483 6.868 -2.242 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -4.005 8.202 -4.089 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -3.423 6.709 -4.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -5.143 7.732 -6.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -5.687 6.239 -5.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -6.251 7.686 -4.913 1.00 0.00 H new ATOM 185 N VAL A 12 -6.714 1.316 -1.559 1.00 0.00 N ATOM 186 CA VAL A 12 -7.360 0.582 -0.415 1.00 0.00 C ATOM 187 C VAL A 12 -6.547 -0.677 -0.095 1.00 0.00 C ATOM 188 O VAL A 12 -6.180 -0.910 1.042 1.00 0.00 O ATOM 189 CB VAL A 12 -8.775 0.203 -0.875 1.00 0.00 C ATOM 190 CG1 VAL A 12 -9.495 -0.546 0.245 1.00 0.00 C ATOM 191 CG2 VAL A 12 -9.555 1.474 -1.221 1.00 0.00 C ATOM 0 H VAL A 12 -7.250 1.336 -2.427 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.400 1.196 0.485 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.710 -0.437 -1.755 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -10.499 -0.814 -0.084 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -8.940 -1.451 0.492 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -9.560 0.092 1.126 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -10.560 1.207 -1.548 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -9.618 2.113 -0.340 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -9.043 2.008 -2.021 1.00 0.00 H new ATOM 201 N ILE A 13 -6.254 -1.485 -1.089 1.00 0.00 N ATOM 202 CA ILE A 13 -5.447 -2.727 -0.823 1.00 0.00 C ATOM 203 C ILE A 13 -4.059 -2.333 -0.293 1.00 0.00 C ATOM 204 O ILE A 13 -3.536 -2.968 0.603 1.00 0.00 O ATOM 205 CB ILE A 13 -5.334 -3.480 -2.162 1.00 0.00 C ATOM 206 CG1 ILE A 13 -6.745 -3.840 -2.663 1.00 0.00 C ATOM 207 CG2 ILE A 13 -4.518 -4.762 -1.965 1.00 0.00 C ATOM 208 CD1 ILE A 13 -6.877 -3.493 -4.149 1.00 0.00 C ATOM 0 H ILE A 13 -6.533 -1.344 -2.060 1.00 0.00 H new ATOM 0 HA ILE A 13 -5.918 -3.362 -0.072 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.836 -2.846 -2.895 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -6.934 -4.903 -2.511 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -7.494 -3.297 -2.086 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.440 -5.293 -2.914 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -3.520 -4.507 -1.608 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -5.013 -5.399 -1.232 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -7.878 -3.751 -4.495 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -6.708 -2.425 -4.290 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -6.139 -4.056 -4.721 1.00 0.00 H new ATOM 220 N VAL A 14 -3.467 -1.280 -0.822 1.00 0.00 N ATOM 221 CA VAL A 14 -2.118 -0.854 -0.307 1.00 0.00 C ATOM 222 C VAL A 14 -2.259 -0.420 1.161 1.00 0.00 C ATOM 223 O VAL A 14 -1.430 -0.749 1.989 1.00 0.00 O ATOM 224 CB VAL A 14 -1.662 0.329 -1.180 1.00 0.00 C ATOM 225 CG1 VAL A 14 -0.298 0.835 -0.698 1.00 0.00 C ATOM 226 CG2 VAL A 14 -1.552 -0.129 -2.639 1.00 0.00 C ATOM 0 H VAL A 14 -3.851 -0.707 -1.574 1.00 0.00 H new ATOM 0 HA VAL A 14 -1.389 -1.663 -0.355 1.00 0.00 H new ATOM 0 HB VAL A 14 -2.391 1.136 -1.103 1.00 0.00 H new ATOM 0 HG11 VAL A 14 0.020 1.672 -1.319 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -0.377 1.162 0.339 1.00 0.00 H new ATOM 0 HG13 VAL A 14 0.435 0.031 -0.770 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -1.229 0.707 -3.259 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -0.825 -0.938 -2.713 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -2.524 -0.483 -2.984 1.00 0.00 H new ATOM 236 N ALA A 15 -3.311 0.305 1.497 1.00 0.00 N ATOM 237 CA ALA A 15 -3.494 0.736 2.930 1.00 0.00 C ATOM 238 C ALA A 15 -3.592 -0.499 3.843 1.00 0.00 C ATOM 239 O ALA A 15 -3.115 -0.479 4.962 1.00 0.00 O ATOM 240 CB ALA A 15 -4.801 1.542 2.991 1.00 0.00 C ATOM 0 H ALA A 15 -4.039 0.612 0.852 1.00 0.00 H new ATOM 0 HA ALA A 15 -2.650 1.337 3.268 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -4.975 1.876 4.014 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.725 2.409 2.334 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.631 0.914 2.668 1.00 0.00 H new ATOM 246 N GLU A 16 -4.202 -1.580 3.383 1.00 0.00 N ATOM 247 CA GLU A 16 -4.310 -2.809 4.252 1.00 0.00 C ATOM 248 C GLU A 16 -2.915 -3.243 4.738 1.00 0.00 C ATOM 249 O GLU A 16 -2.758 -3.678 5.865 1.00 0.00 O ATOM 250 CB GLU A 16 -4.929 -3.915 3.383 1.00 0.00 C ATOM 251 CG GLU A 16 -5.280 -5.120 4.259 1.00 0.00 C ATOM 252 CD GLU A 16 -5.207 -6.399 3.423 1.00 0.00 C ATOM 253 OE1 GLU A 16 -6.133 -6.643 2.668 1.00 0.00 O ATOM 254 OE2 GLU A 16 -4.225 -7.113 3.552 1.00 0.00 O ATOM 0 H GLU A 16 -4.623 -1.663 2.458 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.922 -2.610 5.131 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.824 -3.542 2.885 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -4.229 -4.212 2.602 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -4.591 -5.184 5.101 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -6.281 -5.001 4.675 1.00 0.00 H new ATOM 261 N LYS A 17 -1.898 -3.119 3.906 1.00 0.00 N ATOM 262 CA LYS A 17 -0.519 -3.524 4.355 1.00 0.00 C ATOM 263 C LYS A 17 0.109 -2.390 5.181 1.00 0.00 C ATOM 264 O LYS A 17 0.631 -2.624 6.255 1.00 0.00 O ATOM 265 CB LYS A 17 0.308 -3.786 3.086 1.00 0.00 C ATOM 266 CG LYS A 17 0.228 -5.273 2.726 1.00 0.00 C ATOM 267 CD LYS A 17 1.358 -6.043 3.427 1.00 0.00 C ATOM 268 CE LYS A 17 0.766 -7.150 4.306 1.00 0.00 C ATOM 269 NZ LYS A 17 1.703 -8.299 4.160 1.00 0.00 N ATOM 0 H LYS A 17 -1.961 -2.762 2.953 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.552 -4.416 4.980 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -0.068 -3.180 2.262 1.00 0.00 H new ATOM 0 HB3 LYS A 17 1.346 -3.495 3.248 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -0.739 -5.677 3.025 1.00 0.00 H new ATOM 0 HG3 LYS A 17 0.306 -5.399 1.646 1.00 0.00 H new ATOM 0 HD2 LYS A 17 2.030 -6.475 2.686 1.00 0.00 H new ATOM 0 HD3 LYS A 17 1.952 -5.361 4.036 1.00 0.00 H new ATOM 0 HE2 LYS A 17 0.691 -6.831 5.346 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -0.240 -7.417 3.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 1.936 -8.679 5.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 1.254 -9.042 3.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 2.574 -7.979 3.690 1.00 0.00 H new ATOM 283 N LEU A 18 0.056 -1.162 4.699 1.00 0.00 N ATOM 284 CA LEU A 18 0.652 -0.028 5.494 1.00 0.00 C ATOM 285 C LEU A 18 -0.085 0.100 6.834 1.00 0.00 C ATOM 286 O LEU A 18 0.534 0.169 7.880 1.00 0.00 O ATOM 287 CB LEU A 18 0.458 1.247 4.662 1.00 0.00 C ATOM 288 CG LEU A 18 1.293 1.155 3.389 1.00 0.00 C ATOM 289 CD1 LEU A 18 0.684 2.059 2.316 1.00 0.00 C ATOM 290 CD2 LEU A 18 2.724 1.604 3.692 1.00 0.00 C ATOM 0 H LEU A 18 -0.365 -0.899 3.808 1.00 0.00 H new ATOM 0 HA LEU A 18 1.708 -0.199 5.701 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.595 1.373 4.411 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.754 2.121 5.242 1.00 0.00 H new ATOM 0 HG LEU A 18 1.304 0.126 3.028 1.00 0.00 H new ATOM 0 HD11 LEU A 18 1.279 1.995 1.405 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.336 1.738 2.106 1.00 0.00 H new ATOM 0 HD13 LEU A 18 0.674 3.089 2.671 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.325 1.540 2.785 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.714 2.634 4.049 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.153 0.958 4.458 1.00 0.00 H new ATOM 302 N ALA A 19 -1.403 0.110 6.815 1.00 0.00 N ATOM 303 CA ALA A 19 -2.164 0.210 8.111 1.00 0.00 C ATOM 304 C ALA A 19 -1.930 -1.056 8.958 1.00 0.00 C ATOM 305 O ALA A 19 -2.011 -1.009 10.171 1.00 0.00 O ATOM 306 CB ALA A 19 -3.654 0.336 7.747 1.00 0.00 C ATOM 0 H ALA A 19 -1.977 0.054 5.974 1.00 0.00 H new ATOM 0 HA ALA A 19 -1.832 1.069 8.694 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -4.246 0.411 8.659 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.806 1.229 7.141 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -3.966 -0.543 7.183 1.00 0.00 H new ATOM 312 N GLY A 20 -1.641 -2.191 8.338 1.00 0.00 N ATOM 313 CA GLY A 20 -1.410 -3.437 9.127 1.00 0.00 C ATOM 314 C GLY A 20 -0.003 -3.416 9.749 1.00 0.00 C ATOM 315 O GLY A 20 0.189 -3.898 10.849 1.00 0.00 O ATOM 0 H GLY A 20 -1.558 -2.296 7.327 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -2.162 -3.524 9.912 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -1.518 -4.310 8.483 1.00 0.00 H new ATOM 319 N ILE A 21 0.988 -2.869 9.063 1.00 0.00 N ATOM 320 CA ILE A 21 2.378 -2.843 9.656 1.00 0.00 C ATOM 321 C ILE A 21 2.349 -2.149 11.037 1.00 0.00 C ATOM 322 O ILE A 21 2.141 -0.953 11.112 1.00 0.00 O ATOM 323 CB ILE A 21 3.267 -2.052 8.669 1.00 0.00 C ATOM 324 CG1 ILE A 21 3.374 -2.827 7.350 1.00 0.00 C ATOM 325 CG2 ILE A 21 4.673 -1.869 9.252 1.00 0.00 C ATOM 326 CD1 ILE A 21 3.502 -1.848 6.177 1.00 0.00 C ATOM 0 H ILE A 21 0.898 -2.448 8.138 1.00 0.00 H new ATOM 0 HA ILE A 21 2.766 -3.851 9.803 1.00 0.00 H new ATOM 0 HB ILE A 21 2.818 -1.074 8.496 1.00 0.00 H new ATOM 0 HG12 ILE A 21 4.239 -3.490 7.377 1.00 0.00 H new ATOM 0 HG13 ILE A 21 2.494 -3.456 7.215 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.289 -1.311 8.547 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.609 -1.321 10.192 1.00 0.00 H new ATOM 0 HG23 ILE A 21 5.122 -2.846 9.432 1.00 0.00 H new ATOM 0 HD11 ILE A 21 3.578 -2.406 5.244 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.624 -1.203 6.144 1.00 0.00 H new ATOM 0 HD13 ILE A 21 4.396 -1.238 6.308 1.00 0.00 H new ATOM 338 N PRO A 22 2.559 -2.913 12.092 1.00 0.00 N ATOM 339 CA PRO A 22 2.550 -2.328 13.461 1.00 0.00 C ATOM 340 C PRO A 22 3.777 -1.425 13.720 1.00 0.00 C ATOM 341 O PRO A 22 3.792 -0.679 14.681 1.00 0.00 O ATOM 342 CB PRO A 22 2.587 -3.548 14.375 1.00 0.00 C ATOM 343 CG PRO A 22 3.208 -4.629 13.554 1.00 0.00 C ATOM 344 CD PRO A 22 2.822 -4.364 12.125 1.00 0.00 C ATOM 0 HA PRO A 22 1.683 -1.688 13.621 1.00 0.00 H new ATOM 0 HB2 PRO A 22 3.171 -3.350 15.274 1.00 0.00 H new ATOM 0 HB3 PRO A 22 1.585 -3.827 14.701 1.00 0.00 H new ATOM 0 HG2 PRO A 22 4.292 -4.627 13.668 1.00 0.00 H new ATOM 0 HG3 PRO A 22 2.855 -5.609 13.875 1.00 0.00 H new ATOM 0 HD2 PRO A 22 3.621 -4.641 11.437 1.00 0.00 H new ATOM 0 HD3 PRO A 22 1.940 -4.937 11.836 1.00 0.00 H new ATOM 352 N ASN A 23 4.805 -1.472 12.889 1.00 0.00 N ATOM 353 CA ASN A 23 5.999 -0.598 13.132 1.00 0.00 C ATOM 354 C ASN A 23 6.009 0.589 12.154 1.00 0.00 C ATOM 355 O ASN A 23 7.061 1.053 11.756 1.00 0.00 O ATOM 356 CB ASN A 23 7.221 -1.493 12.901 1.00 0.00 C ATOM 357 CG ASN A 23 8.373 -1.029 13.802 1.00 0.00 C ATOM 358 OD1 ASN A 23 8.370 -1.294 14.988 1.00 0.00 O ATOM 359 ND2 ASN A 23 9.367 -0.342 13.291 1.00 0.00 N ATOM 0 H ASN A 23 4.863 -2.071 12.066 1.00 0.00 H new ATOM 0 HA ASN A 23 5.991 -0.179 14.138 1.00 0.00 H new ATOM 0 HB2 ASN A 23 6.971 -2.531 13.118 1.00 0.00 H new ATOM 0 HB3 ASN A 23 7.524 -1.450 11.855 1.00 0.00 H new ATOM 0 HD21 ASN A 23 10.133 -0.032 13.889 1.00 0.00 H new ATOM 0 HD22 ASN A 23 9.373 -0.117 12.296 1.00 0.00 H new ATOM 366 N PHE A 24 4.853 1.099 11.772 1.00 0.00 N ATOM 367 CA PHE A 24 4.825 2.269 10.833 1.00 0.00 C ATOM 368 C PHE A 24 4.620 3.564 11.636 1.00 0.00 C ATOM 369 O PHE A 24 3.530 3.840 12.098 1.00 0.00 O ATOM 370 CB PHE A 24 3.642 2.027 9.884 1.00 0.00 C ATOM 371 CG PHE A 24 3.988 2.536 8.503 1.00 0.00 C ATOM 372 CD1 PHE A 24 4.636 1.696 7.589 1.00 0.00 C ATOM 373 CD2 PHE A 24 3.661 3.847 8.139 1.00 0.00 C ATOM 374 CE1 PHE A 24 4.954 2.168 6.310 1.00 0.00 C ATOM 375 CE2 PHE A 24 3.980 4.319 6.859 1.00 0.00 C ATOM 376 CZ PHE A 24 4.627 3.479 5.945 1.00 0.00 C ATOM 0 H PHE A 24 3.939 0.757 12.068 1.00 0.00 H new ATOM 0 HA PHE A 24 5.756 2.369 10.275 1.00 0.00 H new ATOM 0 HB2 PHE A 24 3.408 0.963 9.842 1.00 0.00 H new ATOM 0 HB3 PHE A 24 2.753 2.535 10.258 1.00 0.00 H new ATOM 0 HD1 PHE A 24 4.890 0.685 7.871 1.00 0.00 H new ATOM 0 HD2 PHE A 24 3.163 4.495 8.845 1.00 0.00 H new ATOM 0 HE1 PHE A 24 5.452 1.520 5.604 1.00 0.00 H new ATOM 0 HE2 PHE A 24 3.727 5.330 6.578 1.00 0.00 H new ATOM 0 HZ PHE A 24 4.874 3.842 4.958 1.00 0.00 H new ATOM 386 N ASN A 25 5.658 4.358 11.812 1.00 0.00 N ATOM 387 CA ASN A 25 5.504 5.628 12.594 1.00 0.00 C ATOM 388 C ASN A 25 5.501 6.842 11.653 1.00 0.00 C ATOM 389 O ASN A 25 6.075 7.869 11.963 1.00 0.00 O ATOM 390 CB ASN A 25 6.713 5.682 13.534 1.00 0.00 C ATOM 391 CG ASN A 25 6.286 6.268 14.887 1.00 0.00 C ATOM 392 OD1 ASN A 25 5.854 5.542 15.760 1.00 0.00 O ATOM 393 ND2 ASN A 25 6.388 7.556 15.104 1.00 0.00 N ATOM 0 H ASN A 25 6.595 4.181 11.450 1.00 0.00 H new ATOM 0 HA ASN A 25 4.563 5.651 13.144 1.00 0.00 H new ATOM 0 HB2 ASN A 25 7.124 4.682 13.673 1.00 0.00 H new ATOM 0 HB3 ASN A 25 7.502 6.293 13.094 1.00 0.00 H new ATOM 0 HD21 ASN A 25 6.105 7.946 16.003 1.00 0.00 H new ATOM 0 HD22 ASN A 25 6.750 8.169 14.374 1.00 0.00 H new ATOM 400 N GLU A 26 4.857 6.739 10.509 1.00 0.00 N ATOM 401 CA GLU A 26 4.821 7.893 9.562 1.00 0.00 C ATOM 402 C GLU A 26 3.432 7.990 8.913 1.00 0.00 C ATOM 403 O GLU A 26 2.521 7.282 9.302 1.00 0.00 O ATOM 404 CB GLU A 26 5.891 7.575 8.515 1.00 0.00 C ATOM 405 CG GLU A 26 7.201 8.261 8.905 1.00 0.00 C ATOM 406 CD GLU A 26 8.063 8.468 7.660 1.00 0.00 C ATOM 407 OE1 GLU A 26 8.386 7.484 7.016 1.00 0.00 O ATOM 408 OE2 GLU A 26 8.386 9.609 7.371 1.00 0.00 O ATOM 0 H GLU A 26 4.358 5.906 10.196 1.00 0.00 H new ATOM 0 HA GLU A 26 5.009 8.848 10.053 1.00 0.00 H new ATOM 0 HB2 GLU A 26 6.039 6.497 8.445 1.00 0.00 H new ATOM 0 HB3 GLU A 26 5.567 7.917 7.532 1.00 0.00 H new ATOM 0 HG2 GLU A 26 6.994 9.220 9.379 1.00 0.00 H new ATOM 0 HG3 GLU A 26 7.738 7.654 9.634 1.00 0.00 H new ATOM 415 N ASP A 27 3.252 8.850 7.928 1.00 0.00 N ATOM 416 CA ASP A 27 1.895 8.951 7.278 1.00 0.00 C ATOM 417 C ASP A 27 1.537 7.602 6.635 1.00 0.00 C ATOM 418 O ASP A 27 2.320 7.049 5.889 1.00 0.00 O ATOM 419 CB ASP A 27 1.988 10.045 6.200 1.00 0.00 C ATOM 420 CG ASP A 27 2.380 11.377 6.846 1.00 0.00 C ATOM 421 OD1 ASP A 27 3.520 11.499 7.261 1.00 0.00 O ATOM 422 OD2 ASP A 27 1.532 12.252 6.912 1.00 0.00 O ATOM 0 H ASP A 27 3.967 9.473 7.553 1.00 0.00 H new ATOM 0 HA ASP A 27 1.124 9.199 8.007 1.00 0.00 H new ATOM 0 HB2 ASP A 27 2.725 9.765 5.447 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.031 10.146 5.688 1.00 0.00 H new ATOM 427 N ILE A 28 0.371 7.060 6.922 1.00 0.00 N ATOM 428 CA ILE A 28 -0.003 5.738 6.318 1.00 0.00 C ATOM 429 C ILE A 28 -0.935 5.940 5.105 1.00 0.00 C ATOM 430 O ILE A 28 -0.807 5.253 4.110 1.00 0.00 O ATOM 431 CB ILE A 28 -0.664 4.931 7.464 1.00 0.00 C ATOM 432 CG1 ILE A 28 -0.700 3.433 7.110 1.00 0.00 C ATOM 433 CG2 ILE A 28 -2.085 5.433 7.760 1.00 0.00 C ATOM 434 CD1 ILE A 28 -1.597 3.173 5.892 1.00 0.00 C ATOM 0 H ILE A 28 -0.328 7.471 7.540 1.00 0.00 H new ATOM 0 HA ILE A 28 0.858 5.197 5.926 1.00 0.00 H new ATOM 0 HB ILE A 28 -0.061 5.076 8.361 1.00 0.00 H new ATOM 0 HG12 ILE A 28 0.311 3.081 6.903 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -1.067 2.863 7.964 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.518 4.844 8.569 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -2.046 6.482 8.055 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.701 5.330 6.867 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -1.603 2.107 5.666 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.612 3.503 6.111 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.213 3.724 5.033 1.00 0.00 H new ATOM 446 N LYS A 29 -1.850 6.882 5.162 1.00 0.00 N ATOM 447 CA LYS A 29 -2.747 7.109 3.975 1.00 0.00 C ATOM 448 C LYS A 29 -1.972 7.875 2.894 1.00 0.00 C ATOM 449 O LYS A 29 -2.116 7.600 1.716 1.00 0.00 O ATOM 450 CB LYS A 29 -3.943 7.937 4.471 1.00 0.00 C ATOM 451 CG LYS A 29 -5.019 7.001 5.025 1.00 0.00 C ATOM 452 CD LYS A 29 -6.403 7.576 4.723 1.00 0.00 C ATOM 453 CE LYS A 29 -6.626 8.841 5.555 1.00 0.00 C ATOM 454 NZ LYS A 29 -7.153 8.354 6.861 1.00 0.00 N ATOM 0 H LYS A 29 -2.015 7.494 5.961 1.00 0.00 H new ATOM 0 HA LYS A 29 -3.089 6.168 3.543 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.620 8.635 5.244 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -4.350 8.533 3.654 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -4.920 6.012 4.579 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -4.891 6.880 6.101 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.488 7.807 3.661 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -7.172 6.838 4.951 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -5.697 9.396 5.686 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -7.333 9.513 5.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -6.880 9.017 7.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -8.190 8.290 6.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -6.757 7.415 7.067 1.00 0.00 H new ATOM 468 N TYR A 30 -1.134 8.819 3.278 1.00 0.00 N ATOM 469 CA TYR A 30 -0.341 9.574 2.248 1.00 0.00 C ATOM 470 C TYR A 30 0.758 8.672 1.656 1.00 0.00 C ATOM 471 O TYR A 30 1.116 8.821 0.502 1.00 0.00 O ATOM 472 CB TYR A 30 0.282 10.782 2.970 1.00 0.00 C ATOM 473 CG TYR A 30 1.087 11.610 1.995 1.00 0.00 C ATOM 474 CD1 TYR A 30 0.482 12.116 0.839 1.00 0.00 C ATOM 475 CD2 TYR A 30 2.439 11.866 2.248 1.00 0.00 C ATOM 476 CE1 TYR A 30 1.230 12.882 -0.064 1.00 0.00 C ATOM 477 CE2 TYR A 30 3.188 12.631 1.346 1.00 0.00 C ATOM 478 CZ TYR A 30 2.583 13.139 0.190 1.00 0.00 C ATOM 479 OH TYR A 30 3.321 13.894 -0.699 1.00 0.00 O ATOM 0 H TYR A 30 -0.968 9.095 4.246 1.00 0.00 H new ATOM 0 HA TYR A 30 -0.974 9.899 1.423 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -0.502 11.393 3.417 1.00 0.00 H new ATOM 0 HB3 TYR A 30 0.922 10.439 3.783 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -0.561 11.916 0.643 1.00 0.00 H new ATOM 0 HD2 TYR A 30 2.905 11.473 3.140 1.00 0.00 H new ATOM 0 HE1 TYR A 30 0.764 13.274 -0.956 1.00 0.00 H new ATOM 0 HE2 TYR A 30 4.231 12.829 1.542 1.00 0.00 H new ATOM 0 HH TYR A 30 4.241 13.978 -0.372 1.00 0.00 H new ATOM 489 N VAL A 31 1.297 7.736 2.419 1.00 0.00 N ATOM 490 CA VAL A 31 2.366 6.850 1.843 1.00 0.00 C ATOM 491 C VAL A 31 1.758 5.839 0.844 1.00 0.00 C ATOM 492 O VAL A 31 2.419 5.436 -0.095 1.00 0.00 O ATOM 493 CB VAL A 31 3.077 6.158 3.041 1.00 0.00 C ATOM 494 CG1 VAL A 31 2.294 4.932 3.539 1.00 0.00 C ATOM 495 CG2 VAL A 31 4.490 5.725 2.614 1.00 0.00 C ATOM 0 H VAL A 31 1.048 7.553 3.391 1.00 0.00 H new ATOM 0 HA VAL A 31 3.095 7.424 1.272 1.00 0.00 H new ATOM 0 HB VAL A 31 3.131 6.875 3.860 1.00 0.00 H new ATOM 0 HG11 VAL A 31 2.824 4.477 4.376 1.00 0.00 H new ATOM 0 HG12 VAL A 31 1.301 5.242 3.864 1.00 0.00 H new ATOM 0 HG13 VAL A 31 2.202 4.206 2.731 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.991 5.240 3.452 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.420 5.027 1.780 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.062 6.601 2.308 1.00 0.00 H new ATOM 505 N ALA A 32 0.508 5.443 1.015 1.00 0.00 N ATOM 506 CA ALA A 32 -0.100 4.477 0.031 1.00 0.00 C ATOM 507 C ALA A 32 -0.354 5.193 -1.305 1.00 0.00 C ATOM 508 O ALA A 32 -0.175 4.613 -2.359 1.00 0.00 O ATOM 509 CB ALA A 32 -1.426 3.993 0.641 1.00 0.00 C ATOM 0 H ALA A 32 -0.104 5.740 1.775 1.00 0.00 H new ATOM 0 HA ALA A 32 0.564 3.634 -0.161 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -1.904 3.288 -0.040 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -1.230 3.501 1.594 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -2.085 4.846 0.802 1.00 0.00 H new ATOM 515 N GLU A 33 -0.756 6.451 -1.276 1.00 0.00 N ATOM 516 CA GLU A 33 -1.000 7.182 -2.573 1.00 0.00 C ATOM 517 C GLU A 33 0.299 7.224 -3.387 1.00 0.00 C ATOM 518 O GLU A 33 0.295 6.973 -4.578 1.00 0.00 O ATOM 519 CB GLU A 33 -1.449 8.607 -2.210 1.00 0.00 C ATOM 520 CG GLU A 33 -2.791 8.547 -1.476 1.00 0.00 C ATOM 521 CD GLU A 33 -2.845 9.649 -0.416 1.00 0.00 C ATOM 522 OE1 GLU A 33 -2.296 10.710 -0.664 1.00 0.00 O ATOM 523 OE2 GLU A 33 -3.435 9.414 0.625 1.00 0.00 O ATOM 0 H GLU A 33 -0.923 6.994 -0.429 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.761 6.683 -3.173 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -0.699 9.087 -1.581 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.542 9.211 -3.112 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.610 8.669 -2.184 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.918 7.571 -1.007 1.00 0.00 H new ATOM 530 N TYR A 34 1.415 7.511 -2.750 1.00 0.00 N ATOM 531 CA TYR A 34 2.714 7.532 -3.510 1.00 0.00 C ATOM 532 C TYR A 34 3.026 6.108 -3.993 1.00 0.00 C ATOM 533 O TYR A 34 3.481 5.914 -5.106 1.00 0.00 O ATOM 534 CB TYR A 34 3.796 8.027 -2.530 1.00 0.00 C ATOM 535 CG TYR A 34 5.173 8.029 -3.177 1.00 0.00 C ATOM 536 CD1 TYR A 34 5.333 8.262 -4.557 1.00 0.00 C ATOM 537 CD2 TYR A 34 6.301 7.813 -2.377 1.00 0.00 C ATOM 538 CE1 TYR A 34 6.614 8.272 -5.121 1.00 0.00 C ATOM 539 CE2 TYR A 34 7.580 7.828 -2.943 1.00 0.00 C ATOM 540 CZ TYR A 34 7.738 8.057 -4.314 1.00 0.00 C ATOM 541 OH TYR A 34 9.000 8.077 -4.868 1.00 0.00 O ATOM 0 H TYR A 34 1.484 7.728 -1.756 1.00 0.00 H new ATOM 0 HA TYR A 34 2.670 8.186 -4.381 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.550 9.034 -2.192 1.00 0.00 H new ATOM 0 HB3 TYR A 34 3.808 7.388 -1.647 1.00 0.00 H new ATOM 0 HD1 TYR A 34 4.467 8.433 -5.180 1.00 0.00 H new ATOM 0 HD2 TYR A 34 6.183 7.634 -1.318 1.00 0.00 H new ATOM 0 HE1 TYR A 34 6.736 8.446 -6.180 1.00 0.00 H new ATOM 0 HE2 TYR A 34 8.447 7.663 -2.321 1.00 0.00 H new ATOM 0 HH TYR A 34 9.671 8.007 -4.157 1.00 0.00 H new ATOM 551 N ILE A 35 2.760 5.105 -3.177 1.00 0.00 N ATOM 552 CA ILE A 35 3.020 3.688 -3.620 1.00 0.00 C ATOM 553 C ILE A 35 2.184 3.402 -4.879 1.00 0.00 C ATOM 554 O ILE A 35 2.698 2.919 -5.872 1.00 0.00 O ATOM 555 CB ILE A 35 2.597 2.784 -2.440 1.00 0.00 C ATOM 556 CG1 ILE A 35 3.571 2.995 -1.280 1.00 0.00 C ATOM 557 CG2 ILE A 35 2.618 1.309 -2.849 1.00 0.00 C ATOM 558 CD1 ILE A 35 2.945 2.478 0.015 1.00 0.00 C ATOM 0 H ILE A 35 2.379 5.204 -2.236 1.00 0.00 H new ATOM 0 HA ILE A 35 4.065 3.509 -3.872 1.00 0.00 H new ATOM 0 HB ILE A 35 1.583 3.048 -2.141 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.507 2.472 -1.478 1.00 0.00 H new ATOM 0 HG13 ILE A 35 3.812 4.053 -1.182 1.00 0.00 H new ATOM 0 HG21 ILE A 35 2.317 0.692 -2.002 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.927 1.151 -3.677 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.625 1.032 -3.159 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.640 2.629 0.841 1.00 0.00 H new ATOM 0 HD12 ILE A 35 2.021 3.021 0.215 1.00 0.00 H new ATOM 0 HD13 ILE A 35 2.727 1.415 -0.086 1.00 0.00 H new ATOM 570 N VAL A 36 0.908 3.728 -4.859 1.00 0.00 N ATOM 571 CA VAL A 36 0.064 3.501 -6.085 1.00 0.00 C ATOM 572 C VAL A 36 0.595 4.388 -7.219 1.00 0.00 C ATOM 573 O VAL A 36 0.687 3.959 -8.354 1.00 0.00 O ATOM 574 CB VAL A 36 -1.376 3.894 -5.717 1.00 0.00 C ATOM 575 CG1 VAL A 36 -2.289 3.712 -6.932 1.00 0.00 C ATOM 576 CG2 VAL A 36 -1.866 2.998 -4.577 1.00 0.00 C ATOM 0 H VAL A 36 0.420 4.135 -4.061 1.00 0.00 H new ATOM 0 HA VAL A 36 0.096 2.463 -6.417 1.00 0.00 H new ATOM 0 HB VAL A 36 -1.398 4.938 -5.404 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.308 3.992 -6.666 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.940 4.345 -7.748 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -2.270 2.669 -7.249 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -2.887 3.272 -4.312 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -1.842 1.956 -4.897 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -1.219 3.126 -3.709 1.00 0.00 H new ATOM 586 N LEU A 37 0.968 5.621 -6.921 1.00 0.00 N ATOM 587 CA LEU A 37 1.519 6.518 -8.003 1.00 0.00 C ATOM 588 C LEU A 37 2.740 5.838 -8.641 1.00 0.00 C ATOM 589 O LEU A 37 2.880 5.819 -9.851 1.00 0.00 O ATOM 590 CB LEU A 37 1.937 7.833 -7.326 1.00 0.00 C ATOM 591 CG LEU A 37 2.083 8.928 -8.384 1.00 0.00 C ATOM 592 CD1 LEU A 37 0.767 9.696 -8.508 1.00 0.00 C ATOM 593 CD2 LEU A 37 3.198 9.890 -7.970 1.00 0.00 C ATOM 0 H LEU A 37 0.916 6.039 -5.992 1.00 0.00 H new ATOM 0 HA LEU A 37 0.782 6.708 -8.783 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.193 8.125 -6.585 1.00 0.00 H new ATOM 0 HB3 LEU A 37 2.879 7.698 -6.795 1.00 0.00 H new ATOM 0 HG LEU A 37 2.331 8.475 -9.344 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.871 10.476 -9.262 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.028 9.011 -8.802 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.518 10.149 -7.548 1.00 0.00 H new ATOM 0 HD21 LEU A 37 3.303 10.671 -8.723 1.00 0.00 H new ATOM 0 HD22 LEU A 37 2.950 10.343 -7.010 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.136 9.343 -7.881 1.00 0.00 H new ATOM 605 N LEU A 38 3.608 5.248 -7.839 1.00 0.00 N ATOM 606 CA LEU A 38 4.794 4.537 -8.431 1.00 0.00 C ATOM 607 C LEU A 38 4.281 3.347 -9.259 1.00 0.00 C ATOM 608 O LEU A 38 4.744 3.099 -10.356 1.00 0.00 O ATOM 609 CB LEU A 38 5.654 4.039 -7.257 1.00 0.00 C ATOM 610 CG LEU A 38 6.217 5.235 -6.489 1.00 0.00 C ATOM 611 CD1 LEU A 38 6.696 4.777 -5.110 1.00 0.00 C ATOM 612 CD2 LEU A 38 7.395 5.828 -7.265 1.00 0.00 C ATOM 0 H LEU A 38 3.547 5.229 -6.821 1.00 0.00 H new ATOM 0 HA LEU A 38 5.382 5.189 -9.077 1.00 0.00 H new ATOM 0 HB2 LEU A 38 5.055 3.417 -6.592 1.00 0.00 H new ATOM 0 HB3 LEU A 38 6.468 3.416 -7.628 1.00 0.00 H new ATOM 0 HG LEU A 38 5.440 5.990 -6.371 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.097 5.630 -4.563 1.00 0.00 H new ATOM 0 HD12 LEU A 38 5.859 4.352 -4.557 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.474 4.022 -5.227 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.798 6.681 -6.719 1.00 0.00 H new ATOM 0 HD22 LEU A 38 8.172 5.072 -7.381 1.00 0.00 H new ATOM 0 HD23 LEU A 38 7.056 6.154 -8.248 1.00 0.00 H new ATOM 624 N ILE A 39 3.306 2.623 -8.743 1.00 0.00 N ATOM 625 CA ILE A 39 2.738 1.456 -9.514 1.00 0.00 C ATOM 626 C ILE A 39 2.152 1.973 -10.838 1.00 0.00 C ATOM 627 O ILE A 39 2.426 1.435 -11.894 1.00 0.00 O ATOM 628 CB ILE A 39 1.630 0.855 -8.614 1.00 0.00 C ATOM 629 CG1 ILE A 39 2.276 0.208 -7.370 1.00 0.00 C ATOM 630 CG2 ILE A 39 0.789 -0.178 -9.386 1.00 0.00 C ATOM 631 CD1 ILE A 39 2.987 -1.103 -7.738 1.00 0.00 C ATOM 0 H ILE A 39 2.882 2.787 -7.830 1.00 0.00 H new ATOM 0 HA ILE A 39 3.489 0.704 -9.755 1.00 0.00 H new ATOM 0 HB ILE A 39 0.960 1.655 -8.299 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.990 0.901 -6.925 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.511 0.012 -6.619 1.00 0.00 H new ATOM 0 HG21 ILE A 39 0.019 -0.584 -8.730 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.319 0.303 -10.243 1.00 0.00 H new ATOM 0 HG23 ILE A 39 1.433 -0.986 -9.732 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.433 -1.538 -6.844 1.00 0.00 H new ATOM 0 HD12 ILE A 39 2.265 -1.802 -8.160 1.00 0.00 H new ATOM 0 HD13 ILE A 39 3.768 -0.900 -8.471 1.00 0.00 H new ATOM 643 N VAL A 40 1.363 3.025 -10.788 1.00 0.00 N ATOM 644 CA VAL A 40 0.782 3.579 -12.063 1.00 0.00 C ATOM 645 C VAL A 40 1.922 4.063 -12.976 1.00 0.00 C ATOM 646 O VAL A 40 1.845 3.936 -14.183 1.00 0.00 O ATOM 647 CB VAL A 40 -0.128 4.758 -11.667 1.00 0.00 C ATOM 648 CG1 VAL A 40 -0.772 5.360 -12.923 1.00 0.00 C ATOM 649 CG2 VAL A 40 -1.229 4.267 -10.715 1.00 0.00 C ATOM 0 H VAL A 40 1.098 3.519 -9.936 1.00 0.00 H new ATOM 0 HA VAL A 40 0.213 2.823 -12.604 1.00 0.00 H new ATOM 0 HB VAL A 40 0.472 5.518 -11.167 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -1.415 6.193 -12.639 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.008 5.716 -13.596 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.367 4.599 -13.427 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.870 5.104 -10.438 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -1.826 3.502 -11.212 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -0.774 3.846 -9.819 1.00 0.00 H new ATOM 659 N ASN A 41 2.978 4.619 -12.412 1.00 0.00 N ATOM 660 CA ASN A 41 4.114 5.105 -13.272 1.00 0.00 C ATOM 661 C ASN A 41 4.692 3.952 -14.104 1.00 0.00 C ATOM 662 O ASN A 41 5.068 4.144 -15.245 1.00 0.00 O ATOM 663 CB ASN A 41 5.188 5.663 -12.323 1.00 0.00 C ATOM 664 CG ASN A 41 4.934 7.157 -12.084 1.00 0.00 C ATOM 665 OD1 ASN A 41 4.961 7.940 -13.013 1.00 0.00 O ATOM 666 ND2 ASN A 41 4.686 7.594 -10.873 1.00 0.00 N ATOM 0 H ASN A 41 3.101 4.755 -11.409 1.00 0.00 H new ATOM 0 HA ASN A 41 3.769 5.870 -13.967 1.00 0.00 H new ATOM 0 HB2 ASN A 41 5.167 5.124 -11.376 1.00 0.00 H new ATOM 0 HB3 ASN A 41 6.179 5.516 -12.752 1.00 0.00 H new ATOM 0 HD21 ASN A 41 4.517 8.587 -10.714 1.00 0.00 H new ATOM 0 HD22 ASN A 41 4.662 6.941 -10.090 1.00 0.00 H new ATOM 673 N GLY A 42 4.775 2.757 -13.552 1.00 0.00 N ATOM 674 CA GLY A 42 5.341 1.618 -14.347 1.00 0.00 C ATOM 675 C GLY A 42 5.048 0.279 -13.654 1.00 0.00 C ATOM 676 O GLY A 42 4.384 -0.576 -14.210 1.00 0.00 O ATOM 0 H GLY A 42 4.480 2.527 -12.603 1.00 0.00 H new ATOM 0 HA2 GLY A 42 4.911 1.617 -15.349 1.00 0.00 H new ATOM 0 HA3 GLY A 42 6.417 1.747 -14.462 1.00 0.00 H new ATOM 680 N GLY A 43 5.542 0.089 -12.449 1.00 0.00 N ATOM 681 CA GLY A 43 5.292 -1.193 -11.737 1.00 0.00 C ATOM 682 C GLY A 43 6.600 -1.989 -11.644 1.00 0.00 C ATOM 683 O GLY A 43 6.669 -3.125 -12.074 1.00 0.00 O ATOM 0 H GLY A 43 6.104 0.768 -11.936 1.00 0.00 H new ATOM 0 HA2 GLY A 43 4.901 -0.997 -10.739 1.00 0.00 H new ATOM 0 HA3 GLY A 43 4.537 -1.774 -12.266 1.00 0.00 H new ATOM 687 N THR A 44 7.633 -1.410 -11.074 1.00 0.00 N ATOM 688 CA THR A 44 8.924 -2.142 -10.941 1.00 0.00 C ATOM 689 C THR A 44 9.354 -2.127 -9.466 1.00 0.00 C ATOM 690 O THR A 44 9.624 -1.081 -8.912 1.00 0.00 O ATOM 691 CB THR A 44 9.906 -1.369 -11.821 1.00 0.00 C ATOM 692 OG1 THR A 44 9.734 0.027 -11.607 1.00 0.00 O ATOM 693 CG2 THR A 44 9.635 -1.702 -13.293 1.00 0.00 C ATOM 0 H THR A 44 7.632 -0.462 -10.697 1.00 0.00 H new ATOM 0 HA THR A 44 8.866 -3.187 -11.247 1.00 0.00 H new ATOM 0 HB THR A 44 10.928 -1.650 -11.567 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.689 0.207 -10.645 1.00 0.00 H new ATOM 0 HG21 THR A 44 10.333 -1.153 -13.925 1.00 0.00 H new ATOM 0 HG22 THR A 44 9.765 -2.772 -13.454 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.614 -1.418 -13.548 1.00 0.00 H new ATOM 701 N VAL A 45 9.392 -3.275 -8.813 1.00 0.00 N ATOM 702 CA VAL A 45 9.777 -3.298 -7.350 1.00 0.00 C ATOM 703 C VAL A 45 11.095 -2.532 -7.111 1.00 0.00 C ATOM 704 O VAL A 45 11.249 -1.879 -6.097 1.00 0.00 O ATOM 705 CB VAL A 45 9.935 -4.783 -6.944 1.00 0.00 C ATOM 706 CG1 VAL A 45 10.403 -4.882 -5.485 1.00 0.00 C ATOM 707 CG2 VAL A 45 8.588 -5.498 -7.073 1.00 0.00 C ATOM 0 H VAL A 45 9.177 -4.185 -9.221 1.00 0.00 H new ATOM 0 HA VAL A 45 9.010 -2.809 -6.749 1.00 0.00 H new ATOM 0 HB VAL A 45 10.671 -5.248 -7.600 1.00 0.00 H new ATOM 0 HG11 VAL A 45 10.511 -5.931 -5.208 1.00 0.00 H new ATOM 0 HG12 VAL A 45 11.363 -4.377 -5.376 1.00 0.00 H new ATOM 0 HG13 VAL A 45 9.668 -4.409 -4.834 1.00 0.00 H new ATOM 0 HG21 VAL A 45 8.702 -6.543 -6.787 1.00 0.00 H new ATOM 0 HG22 VAL A 45 7.858 -5.020 -6.419 1.00 0.00 H new ATOM 0 HG23 VAL A 45 8.243 -5.440 -8.105 1.00 0.00 H new ATOM 717 N GLU A 46 12.040 -2.603 -8.022 1.00 0.00 N ATOM 718 CA GLU A 46 13.332 -1.863 -7.796 1.00 0.00 C ATOM 719 C GLU A 46 13.069 -0.355 -7.800 1.00 0.00 C ATOM 720 O GLU A 46 13.390 0.331 -6.848 1.00 0.00 O ATOM 721 CB GLU A 46 14.281 -2.249 -8.941 1.00 0.00 C ATOM 722 CG GLU A 46 14.783 -3.679 -8.728 1.00 0.00 C ATOM 723 CD GLU A 46 15.100 -4.316 -10.083 1.00 0.00 C ATOM 724 OE1 GLU A 46 16.044 -3.874 -10.716 1.00 0.00 O ATOM 725 OE2 GLU A 46 14.394 -5.235 -10.462 1.00 0.00 O ATOM 0 H GLU A 46 11.979 -3.128 -8.894 1.00 0.00 H new ATOM 0 HA GLU A 46 13.774 -2.123 -6.834 1.00 0.00 H new ATOM 0 HB2 GLU A 46 13.764 -2.172 -9.897 1.00 0.00 H new ATOM 0 HB3 GLU A 46 15.123 -1.558 -8.978 1.00 0.00 H new ATOM 0 HG2 GLU A 46 15.674 -3.673 -8.100 1.00 0.00 H new ATOM 0 HG3 GLU A 46 14.028 -4.267 -8.206 1.00 0.00 H new ATOM 732 N SER A 47 12.472 0.169 -8.849 1.00 0.00 N ATOM 733 CA SER A 47 12.182 1.645 -8.866 1.00 0.00 C ATOM 734 C SER A 47 11.114 1.967 -7.808 1.00 0.00 C ATOM 735 O SER A 47 11.171 2.999 -7.169 1.00 0.00 O ATOM 736 CB SER A 47 11.670 1.993 -10.270 1.00 0.00 C ATOM 737 OG SER A 47 10.252 1.868 -10.299 1.00 0.00 O ATOM 0 H SER A 47 12.178 -0.348 -9.678 1.00 0.00 H new ATOM 0 HA SER A 47 13.074 2.227 -8.636 1.00 0.00 H new ATOM 0 HB2 SER A 47 11.962 3.009 -10.534 1.00 0.00 H new ATOM 0 HB3 SER A 47 12.120 1.329 -11.008 1.00 0.00 H new ATOM 0 HG SER A 47 9.969 1.555 -11.184 1.00 0.00 H new ATOM 743 N VAL A 48 10.147 1.091 -7.608 1.00 0.00 N ATOM 744 CA VAL A 48 9.093 1.371 -6.571 1.00 0.00 C ATOM 745 C VAL A 48 9.704 1.276 -5.164 1.00 0.00 C ATOM 746 O VAL A 48 9.367 2.057 -4.294 1.00 0.00 O ATOM 747 CB VAL A 48 7.982 0.318 -6.754 1.00 0.00 C ATOM 748 CG1 VAL A 48 6.851 0.590 -5.759 1.00 0.00 C ATOM 749 CG2 VAL A 48 7.428 0.394 -8.182 1.00 0.00 C ATOM 0 H VAL A 48 10.044 0.209 -8.110 1.00 0.00 H new ATOM 0 HA VAL A 48 8.686 2.375 -6.687 1.00 0.00 H new ATOM 0 HB VAL A 48 8.396 -0.675 -6.577 1.00 0.00 H new ATOM 0 HG11 VAL A 48 6.066 -0.155 -5.889 1.00 0.00 H new ATOM 0 HG12 VAL A 48 7.240 0.534 -4.742 1.00 0.00 H new ATOM 0 HG13 VAL A 48 6.441 1.584 -5.937 1.00 0.00 H new ATOM 0 HG21 VAL A 48 6.643 -0.352 -8.308 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.017 1.388 -8.360 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.230 0.200 -8.894 1.00 0.00 H new ATOM 759 N VAL A 49 10.619 0.352 -4.934 1.00 0.00 N ATOM 760 CA VAL A 49 11.249 0.269 -3.568 1.00 0.00 C ATOM 761 C VAL A 49 12.289 1.397 -3.432 1.00 0.00 C ATOM 762 O VAL A 49 12.418 1.997 -2.381 1.00 0.00 O ATOM 763 CB VAL A 49 11.906 -1.124 -3.461 1.00 0.00 C ATOM 764 CG1 VAL A 49 12.736 -1.225 -2.174 1.00 0.00 C ATOM 765 CG2 VAL A 49 10.812 -2.196 -3.430 1.00 0.00 C ATOM 0 H VAL A 49 10.950 -0.332 -5.615 1.00 0.00 H new ATOM 0 HA VAL A 49 10.520 0.392 -2.767 1.00 0.00 H new ATOM 0 HB VAL A 49 12.559 -1.273 -4.321 1.00 0.00 H new ATOM 0 HG11 VAL A 49 13.193 -2.213 -2.112 1.00 0.00 H new ATOM 0 HG12 VAL A 49 13.516 -0.464 -2.184 1.00 0.00 H new ATOM 0 HG13 VAL A 49 12.089 -1.070 -1.311 1.00 0.00 H new ATOM 0 HG21 VAL A 49 11.271 -3.182 -3.354 1.00 0.00 H new ATOM 0 HG22 VAL A 49 10.164 -2.030 -2.569 1.00 0.00 H new ATOM 0 HG23 VAL A 49 10.221 -2.140 -4.344 1.00 0.00 H new ATOM 775 N ASP A 50 13.017 1.702 -4.488 1.00 0.00 N ATOM 776 CA ASP A 50 14.028 2.813 -4.396 1.00 0.00 C ATOM 777 C ASP A 50 13.315 4.166 -4.244 1.00 0.00 C ATOM 778 O ASP A 50 13.807 5.048 -3.563 1.00 0.00 O ATOM 779 CB ASP A 50 14.844 2.785 -5.700 1.00 0.00 C ATOM 780 CG ASP A 50 16.178 3.501 -5.484 1.00 0.00 C ATOM 781 OD1 ASP A 50 16.823 3.223 -4.486 1.00 0.00 O ATOM 782 OD2 ASP A 50 16.532 4.315 -6.320 1.00 0.00 O ATOM 0 H ASP A 50 12.957 1.238 -5.395 1.00 0.00 H new ATOM 0 HA ASP A 50 14.676 2.680 -3.529 1.00 0.00 H new ATOM 0 HB2 ASP A 50 15.018 1.755 -6.010 1.00 0.00 H new ATOM 0 HB3 ASP A 50 14.285 3.269 -6.501 1.00 0.00 H new ATOM 787 N GLU A 51 12.157 4.345 -4.857 1.00 0.00 N ATOM 788 CA GLU A 51 11.440 5.663 -4.706 1.00 0.00 C ATOM 789 C GLU A 51 10.845 5.761 -3.298 1.00 0.00 C ATOM 790 O GLU A 51 10.915 6.800 -2.666 1.00 0.00 O ATOM 791 CB GLU A 51 10.324 5.715 -5.771 1.00 0.00 C ATOM 792 CG GLU A 51 10.706 6.710 -6.871 1.00 0.00 C ATOM 793 CD GLU A 51 10.213 6.196 -8.226 1.00 0.00 C ATOM 794 OE1 GLU A 51 10.660 5.136 -8.633 1.00 0.00 O ATOM 795 OE2 GLU A 51 9.398 6.871 -8.832 1.00 0.00 O ATOM 0 H GLU A 51 11.688 3.653 -5.441 1.00 0.00 H new ATOM 0 HA GLU A 51 12.125 6.499 -4.845 1.00 0.00 H new ATOM 0 HB2 GLU A 51 10.171 4.725 -6.200 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.382 6.012 -5.310 1.00 0.00 H new ATOM 0 HG2 GLU A 51 10.268 7.686 -6.660 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.787 6.844 -6.894 1.00 0.00 H new ATOM 802 N LEU A 52 10.276 4.688 -2.789 1.00 0.00 N ATOM 803 CA LEU A 52 9.703 4.747 -1.400 1.00 0.00 C ATOM 804 C LEU A 52 10.845 4.792 -0.378 1.00 0.00 C ATOM 805 O LEU A 52 10.752 5.476 0.623 1.00 0.00 O ATOM 806 CB LEU A 52 8.855 3.480 -1.207 1.00 0.00 C ATOM 807 CG LEU A 52 7.641 3.535 -2.135 1.00 0.00 C ATOM 808 CD1 LEU A 52 7.048 2.132 -2.281 1.00 0.00 C ATOM 809 CD2 LEU A 52 6.588 4.473 -1.540 1.00 0.00 C ATOM 0 H LEU A 52 10.184 3.790 -3.264 1.00 0.00 H new ATOM 0 HA LEU A 52 9.090 5.637 -1.260 1.00 0.00 H new ATOM 0 HB2 LEU A 52 9.451 2.594 -1.423 1.00 0.00 H new ATOM 0 HB3 LEU A 52 8.530 3.401 -0.170 1.00 0.00 H new ATOM 0 HG LEU A 52 7.947 3.905 -3.114 1.00 0.00 H new ATOM 0 HD11 LEU A 52 6.182 2.170 -2.942 1.00 0.00 H new ATOM 0 HD12 LEU A 52 7.798 1.462 -2.702 1.00 0.00 H new ATOM 0 HD13 LEU A 52 6.741 1.763 -1.302 1.00 0.00 H new ATOM 0 HD21 LEU A 52 5.722 4.513 -2.200 1.00 0.00 H new ATOM 0 HD22 LEU A 52 6.282 4.102 -0.562 1.00 0.00 H new ATOM 0 HD23 LEU A 52 7.010 5.472 -1.433 1.00 0.00 H new ATOM 821 N ALA A 53 11.933 4.087 -0.623 1.00 0.00 N ATOM 822 CA ALA A 53 13.079 4.136 0.351 1.00 0.00 C ATOM 823 C ALA A 53 13.731 5.527 0.302 1.00 0.00 C ATOM 824 O ALA A 53 14.118 6.067 1.321 1.00 0.00 O ATOM 825 CB ALA A 53 14.083 3.057 -0.085 1.00 0.00 C ATOM 0 H ALA A 53 12.075 3.491 -1.439 1.00 0.00 H new ATOM 0 HA ALA A 53 12.744 3.955 1.372 1.00 0.00 H new ATOM 0 HB1 ALA A 53 14.934 3.056 0.596 1.00 0.00 H new ATOM 0 HB2 ALA A 53 13.600 2.080 -0.063 1.00 0.00 H new ATOM 0 HB3 ALA A 53 14.428 3.269 -1.097 1.00 0.00 H new ATOM 831 N SER A 54 13.847 6.119 -0.874 1.00 0.00 N ATOM 832 CA SER A 54 14.471 7.491 -0.960 1.00 0.00 C ATOM 833 C SER A 54 13.679 8.494 -0.102 1.00 0.00 C ATOM 834 O SER A 54 14.252 9.384 0.497 1.00 0.00 O ATOM 835 CB SER A 54 14.423 7.909 -2.437 1.00 0.00 C ATOM 836 OG SER A 54 15.332 8.981 -2.652 1.00 0.00 O ATOM 0 H SER A 54 13.543 5.720 -1.762 1.00 0.00 H new ATOM 0 HA SER A 54 15.496 7.475 -0.589 1.00 0.00 H new ATOM 0 HB2 SER A 54 14.682 7.064 -3.075 1.00 0.00 H new ATOM 0 HB3 SER A 54 13.412 8.214 -2.708 1.00 0.00 H new ATOM 0 HG SER A 54 15.305 9.249 -3.594 1.00 0.00 H new ATOM 842 N LEU A 55 12.370 8.354 -0.025 1.00 0.00 N ATOM 843 CA LEU A 55 11.564 9.306 0.815 1.00 0.00 C ATOM 844 C LEU A 55 11.348 8.702 2.209 1.00 0.00 C ATOM 845 O LEU A 55 11.461 9.384 3.210 1.00 0.00 O ATOM 846 CB LEU A 55 10.219 9.495 0.091 1.00 0.00 C ATOM 847 CG LEU A 55 10.147 10.900 -0.511 1.00 0.00 C ATOM 848 CD1 LEU A 55 9.166 10.901 -1.686 1.00 0.00 C ATOM 849 CD2 LEU A 55 9.664 11.886 0.555 1.00 0.00 C ATOM 0 H LEU A 55 11.832 7.631 -0.502 1.00 0.00 H new ATOM 0 HA LEU A 55 12.071 10.263 0.943 1.00 0.00 H new ATOM 0 HB2 LEU A 55 10.110 8.747 -0.694 1.00 0.00 H new ATOM 0 HB3 LEU A 55 9.396 9.346 0.789 1.00 0.00 H new ATOM 0 HG LEU A 55 11.136 11.197 -0.861 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.114 11.901 -2.116 1.00 0.00 H new ATOM 0 HD12 LEU A 55 9.507 10.197 -2.445 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.177 10.605 -1.335 1.00 0.00 H new ATOM 0 HD21 LEU A 55 9.612 12.887 0.128 1.00 0.00 H new ATOM 0 HD22 LEU A 55 8.675 11.589 0.904 1.00 0.00 H new ATOM 0 HD23 LEU A 55 10.360 11.885 1.394 1.00 0.00 H new ATOM 861 N PHE A 56 11.051 7.422 2.283 1.00 0.00 N ATOM 862 CA PHE A 56 10.845 6.773 3.612 1.00 0.00 C ATOM 863 C PHE A 56 12.039 5.857 3.918 1.00 0.00 C ATOM 864 O PHE A 56 11.945 4.650 3.803 1.00 0.00 O ATOM 865 CB PHE A 56 9.555 5.953 3.482 1.00 0.00 C ATOM 866 CG PHE A 56 8.409 6.861 3.102 1.00 0.00 C ATOM 867 CD1 PHE A 56 8.046 7.920 3.941 1.00 0.00 C ATOM 868 CD2 PHE A 56 7.712 6.643 1.907 1.00 0.00 C ATOM 869 CE1 PHE A 56 6.985 8.762 3.588 1.00 0.00 C ATOM 870 CE2 PHE A 56 6.652 7.485 1.553 1.00 0.00 C ATOM 871 CZ PHE A 56 6.288 8.544 2.392 1.00 0.00 C ATOM 0 H PHE A 56 10.944 6.804 1.479 1.00 0.00 H new ATOM 0 HA PHE A 56 10.767 7.499 4.421 1.00 0.00 H new ATOM 0 HB2 PHE A 56 9.681 5.176 2.728 1.00 0.00 H new ATOM 0 HB3 PHE A 56 9.336 5.450 4.424 1.00 0.00 H new ATOM 0 HD1 PHE A 56 8.585 8.088 4.862 1.00 0.00 H new ATOM 0 HD2 PHE A 56 7.992 5.826 1.259 1.00 0.00 H new ATOM 0 HE1 PHE A 56 6.704 9.579 4.237 1.00 0.00 H new ATOM 0 HE2 PHE A 56 6.114 7.317 0.631 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.470 9.193 2.118 1.00 0.00 H new ATOM 881 N ASP A 57 13.166 6.421 4.309 1.00 0.00 N ATOM 882 CA ASP A 57 14.360 5.566 4.623 1.00 0.00 C ATOM 883 C ASP A 57 14.506 5.350 6.143 1.00 0.00 C ATOM 884 O ASP A 57 15.599 5.122 6.628 1.00 0.00 O ATOM 885 CB ASP A 57 15.575 6.327 4.076 1.00 0.00 C ATOM 886 CG ASP A 57 16.784 5.392 4.028 1.00 0.00 C ATOM 887 OD1 ASP A 57 16.658 4.320 3.458 1.00 0.00 O ATOM 888 OD2 ASP A 57 17.816 5.764 4.562 1.00 0.00 O ATOM 0 H ASP A 57 13.307 7.425 4.422 1.00 0.00 H new ATOM 0 HA ASP A 57 14.262 4.577 4.174 1.00 0.00 H new ATOM 0 HB2 ASP A 57 15.359 6.710 3.079 1.00 0.00 H new ATOM 0 HB3 ASP A 57 15.793 7.188 4.708 1.00 0.00 H new ATOM 893 N SER A 58 13.424 5.402 6.900 1.00 0.00 N ATOM 894 CA SER A 58 13.539 5.177 8.381 1.00 0.00 C ATOM 895 C SER A 58 13.209 3.712 8.720 1.00 0.00 C ATOM 896 O SER A 58 13.837 3.117 9.575 1.00 0.00 O ATOM 897 CB SER A 58 12.525 6.123 9.035 1.00 0.00 C ATOM 898 OG SER A 58 12.903 6.355 10.385 1.00 0.00 O ATOM 0 H SER A 58 12.481 5.588 6.559 1.00 0.00 H new ATOM 0 HA SER A 58 14.549 5.373 8.741 1.00 0.00 H new ATOM 0 HB2 SER A 58 12.485 7.066 8.489 1.00 0.00 H new ATOM 0 HB3 SER A 58 11.526 5.689 8.994 1.00 0.00 H new ATOM 0 HG SER A 58 12.258 6.961 10.806 1.00 0.00 H new ATOM 904 N VAL A 59 12.237 3.123 8.052 1.00 0.00 N ATOM 905 CA VAL A 59 11.888 1.690 8.344 1.00 0.00 C ATOM 906 C VAL A 59 12.711 0.750 7.447 1.00 0.00 C ATOM 907 O VAL A 59 13.162 1.136 6.384 1.00 0.00 O ATOM 908 CB VAL A 59 10.377 1.541 8.069 1.00 0.00 C ATOM 909 CG1 VAL A 59 10.072 1.744 6.574 1.00 0.00 C ATOM 910 CG2 VAL A 59 9.927 0.142 8.501 1.00 0.00 C ATOM 0 H VAL A 59 11.676 3.568 7.325 1.00 0.00 H new ATOM 0 HA VAL A 59 12.117 1.425 9.376 1.00 0.00 H new ATOM 0 HB VAL A 59 9.837 2.300 8.635 1.00 0.00 H new ATOM 0 HG11 VAL A 59 9.001 1.634 6.403 1.00 0.00 H new ATOM 0 HG12 VAL A 59 10.388 2.742 6.271 1.00 0.00 H new ATOM 0 HG13 VAL A 59 10.611 0.999 5.988 1.00 0.00 H new ATOM 0 HG21 VAL A 59 8.860 0.028 8.310 1.00 0.00 H new ATOM 0 HG22 VAL A 59 10.479 -0.609 7.935 1.00 0.00 H new ATOM 0 HG23 VAL A 59 10.121 0.010 9.565 1.00 0.00 H new ATOM 920 N SER A 60 12.919 -0.481 7.870 1.00 0.00 N ATOM 921 CA SER A 60 13.730 -1.439 7.031 1.00 0.00 C ATOM 922 C SER A 60 13.133 -1.572 5.618 1.00 0.00 C ATOM 923 O SER A 60 11.929 -1.533 5.443 1.00 0.00 O ATOM 924 CB SER A 60 13.688 -2.797 7.746 1.00 0.00 C ATOM 925 OG SER A 60 14.524 -2.750 8.894 1.00 0.00 O ATOM 0 H SER A 60 12.568 -0.862 8.749 1.00 0.00 H new ATOM 0 HA SER A 60 14.752 -1.078 6.920 1.00 0.00 H new ATOM 0 HB2 SER A 60 12.665 -3.036 8.037 1.00 0.00 H new ATOM 0 HB3 SER A 60 14.021 -3.586 7.072 1.00 0.00 H new ATOM 0 HG SER A 60 14.498 -3.615 9.353 1.00 0.00 H new ATOM 931 N ARG A 61 13.965 -1.737 4.607 1.00 0.00 N ATOM 932 CA ARG A 61 13.434 -1.880 3.199 1.00 0.00 C ATOM 933 C ARG A 61 12.379 -3.000 3.115 1.00 0.00 C ATOM 934 O ARG A 61 11.477 -2.936 2.299 1.00 0.00 O ATOM 935 CB ARG A 61 14.643 -2.205 2.298 1.00 0.00 C ATOM 936 CG ARG A 61 15.278 -3.535 2.718 1.00 0.00 C ATOM 937 CD ARG A 61 14.574 -4.689 1.993 1.00 0.00 C ATOM 938 NE ARG A 61 15.572 -5.198 1.011 1.00 0.00 N ATOM 939 CZ ARG A 61 15.367 -5.040 -0.268 1.00 0.00 C ATOM 940 NH1 ARG A 61 14.243 -5.432 -0.802 1.00 0.00 N ATOM 941 NH2 ARG A 61 16.287 -4.491 -1.013 1.00 0.00 N ATOM 0 H ARG A 61 14.981 -1.779 4.692 1.00 0.00 H new ATOM 0 HA ARG A 61 12.943 -0.961 2.880 1.00 0.00 H new ATOM 0 HB2 ARG A 61 14.325 -2.259 1.257 1.00 0.00 H new ATOM 0 HB3 ARG A 61 15.380 -1.405 2.365 1.00 0.00 H new ATOM 0 HG2 ARG A 61 16.341 -3.535 2.477 1.00 0.00 H new ATOM 0 HG3 ARG A 61 15.195 -3.665 3.797 1.00 0.00 H new ATOM 0 HD2 ARG A 61 14.276 -5.470 2.692 1.00 0.00 H new ATOM 0 HD3 ARG A 61 13.668 -4.346 1.493 1.00 0.00 H new ATOM 0 HE ARG A 61 16.415 -5.670 1.338 1.00 0.00 H new ATOM 0 HH11 ARG A 61 13.524 -5.862 -0.220 1.00 0.00 H new ATOM 0 HH12 ARG A 61 14.083 -5.308 -1.802 1.00 0.00 H new ATOM 0 HH21 ARG A 61 17.166 -4.186 -0.596 1.00 0.00 H new ATOM 0 HH22 ARG A 61 16.127 -4.367 -2.013 1.00 0.00 H new ATOM 955 N ASP A 62 12.477 -4.025 3.941 1.00 0.00 N ATOM 956 CA ASP A 62 11.458 -5.137 3.874 1.00 0.00 C ATOM 957 C ASP A 62 10.044 -4.578 4.093 1.00 0.00 C ATOM 958 O ASP A 62 9.104 -4.997 3.442 1.00 0.00 O ATOM 959 CB ASP A 62 11.811 -6.135 4.989 1.00 0.00 C ATOM 960 CG ASP A 62 11.348 -7.535 4.585 1.00 0.00 C ATOM 961 OD1 ASP A 62 12.023 -8.151 3.777 1.00 0.00 O ATOM 962 OD2 ASP A 62 10.326 -7.969 5.092 1.00 0.00 O ATOM 0 H ASP A 62 13.204 -4.140 4.647 1.00 0.00 H new ATOM 0 HA ASP A 62 11.475 -5.620 2.897 1.00 0.00 H new ATOM 0 HB2 ASP A 62 12.886 -6.133 5.166 1.00 0.00 H new ATOM 0 HB3 ASP A 62 11.333 -5.838 5.923 1.00 0.00 H new ATOM 967 N THR A 63 9.882 -3.631 4.994 1.00 0.00 N ATOM 968 CA THR A 63 8.509 -3.055 5.224 1.00 0.00 C ATOM 969 C THR A 63 8.046 -2.320 3.957 1.00 0.00 C ATOM 970 O THR A 63 6.903 -2.436 3.555 1.00 0.00 O ATOM 971 CB THR A 63 8.622 -2.078 6.411 1.00 0.00 C ATOM 972 OG1 THR A 63 9.019 -2.795 7.576 1.00 0.00 O ATOM 973 CG2 THR A 63 7.266 -1.412 6.667 1.00 0.00 C ATOM 0 H THR A 63 10.625 -3.237 5.571 1.00 0.00 H new ATOM 0 HA THR A 63 7.780 -3.834 5.445 1.00 0.00 H new ATOM 0 HB THR A 63 9.362 -1.313 6.177 1.00 0.00 H new ATOM 0 HG1 THR A 63 8.652 -2.356 8.371 1.00 0.00 H new ATOM 0 HG21 THR A 63 7.352 -0.723 7.507 1.00 0.00 H new ATOM 0 HG22 THR A 63 6.956 -0.863 5.778 1.00 0.00 H new ATOM 0 HG23 THR A 63 6.524 -2.176 6.899 1.00 0.00 H new ATOM 981 N LEU A 64 8.925 -1.581 3.315 1.00 0.00 N ATOM 982 CA LEU A 64 8.510 -0.860 2.061 1.00 0.00 C ATOM 983 C LEU A 64 8.245 -1.892 0.961 1.00 0.00 C ATOM 984 O LEU A 64 7.235 -1.842 0.286 1.00 0.00 O ATOM 985 CB LEU A 64 9.678 0.060 1.656 1.00 0.00 C ATOM 986 CG LEU A 64 9.965 1.080 2.776 1.00 0.00 C ATOM 987 CD1 LEU A 64 11.385 0.870 3.317 1.00 0.00 C ATOM 988 CD2 LEU A 64 9.842 2.507 2.220 1.00 0.00 C ATOM 0 H LEU A 64 9.896 -1.446 3.598 1.00 0.00 H new ATOM 0 HA LEU A 64 7.604 -0.275 2.217 1.00 0.00 H new ATOM 0 HB2 LEU A 64 10.569 -0.536 1.460 1.00 0.00 H new ATOM 0 HB3 LEU A 64 9.435 0.583 0.731 1.00 0.00 H new ATOM 0 HG LEU A 64 9.244 0.937 3.581 1.00 0.00 H new ATOM 0 HD11 LEU A 64 11.584 1.593 4.108 1.00 0.00 H new ATOM 0 HD12 LEU A 64 11.476 -0.140 3.717 1.00 0.00 H new ATOM 0 HD13 LEU A 64 12.106 1.008 2.511 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.045 3.226 3.014 1.00 0.00 H new ATOM 0 HD22 LEU A 64 10.560 2.646 1.412 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.833 2.663 1.839 1.00 0.00 H new ATOM 1000 N ALA A 65 9.141 -2.842 0.787 1.00 0.00 N ATOM 1001 CA ALA A 65 8.915 -3.891 -0.271 1.00 0.00 C ATOM 1002 C ALA A 65 7.618 -4.665 0.024 1.00 0.00 C ATOM 1003 O ALA A 65 6.911 -5.056 -0.887 1.00 0.00 O ATOM 1004 CB ALA A 65 10.123 -4.841 -0.221 1.00 0.00 C ATOM 0 H ALA A 65 10.005 -2.937 1.321 1.00 0.00 H new ATOM 0 HA ALA A 65 8.816 -3.439 -1.258 1.00 0.00 H new ATOM 0 HB1 ALA A 65 10.004 -5.621 -0.973 1.00 0.00 H new ATOM 0 HB2 ALA A 65 11.036 -4.280 -0.422 1.00 0.00 H new ATOM 0 HB3 ALA A 65 10.187 -5.296 0.767 1.00 0.00 H new ATOM 1010 N ASN A 66 7.293 -4.889 1.285 1.00 0.00 N ATOM 1011 CA ASN A 66 6.027 -5.641 1.604 1.00 0.00 C ATOM 1012 C ASN A 66 4.812 -4.870 1.070 1.00 0.00 C ATOM 1013 O ASN A 66 3.929 -5.451 0.467 1.00 0.00 O ATOM 1014 CB ASN A 66 5.949 -5.761 3.135 1.00 0.00 C ATOM 1015 CG ASN A 66 5.209 -7.050 3.511 1.00 0.00 C ATOM 1016 OD1 ASN A 66 3.994 -7.071 3.548 1.00 0.00 O ATOM 1017 ND2 ASN A 66 5.888 -8.135 3.795 1.00 0.00 N ATOM 0 H ASN A 66 7.839 -4.589 2.093 1.00 0.00 H new ATOM 0 HA ASN A 66 6.029 -6.627 1.139 1.00 0.00 H new ATOM 0 HB2 ASN A 66 6.952 -5.768 3.561 1.00 0.00 H new ATOM 0 HB3 ASN A 66 5.431 -4.897 3.552 1.00 0.00 H new ATOM 0 HD21 ASN A 66 5.397 -8.993 4.046 1.00 0.00 H new ATOM 0 HD22 ASN A 66 6.907 -8.121 3.765 1.00 0.00 H new ATOM 1024 N VAL A 67 4.758 -3.566 1.270 1.00 0.00 N ATOM 1025 CA VAL A 67 3.581 -2.790 0.737 1.00 0.00 C ATOM 1026 C VAL A 67 3.672 -2.708 -0.799 1.00 0.00 C ATOM 1027 O VAL A 67 2.668 -2.771 -1.483 1.00 0.00 O ATOM 1028 CB VAL A 67 3.639 -1.393 1.375 1.00 0.00 C ATOM 1029 CG1 VAL A 67 2.456 -0.557 0.884 1.00 0.00 C ATOM 1030 CG2 VAL A 67 3.560 -1.528 2.899 1.00 0.00 C ATOM 0 H VAL A 67 5.460 -3.017 1.767 1.00 0.00 H new ATOM 0 HA VAL A 67 2.635 -3.272 0.983 1.00 0.00 H new ATOM 0 HB VAL A 67 4.573 -0.905 1.095 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.498 0.434 1.337 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.503 -0.462 -0.201 1.00 0.00 H new ATOM 0 HG13 VAL A 67 1.523 -1.046 1.166 1.00 0.00 H new ATOM 0 HG21 VAL A 67 3.601 -0.539 3.355 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.624 -2.015 3.173 1.00 0.00 H new ATOM 0 HG23 VAL A 67 4.399 -2.126 3.255 1.00 0.00 H new ATOM 1040 N VAL A 68 4.865 -2.601 -1.354 1.00 0.00 N ATOM 1041 CA VAL A 68 4.985 -2.561 -2.856 1.00 0.00 C ATOM 1042 C VAL A 68 4.599 -3.942 -3.424 1.00 0.00 C ATOM 1043 O VAL A 68 3.992 -4.031 -4.474 1.00 0.00 O ATOM 1044 CB VAL A 68 6.459 -2.233 -3.171 1.00 0.00 C ATOM 1045 CG1 VAL A 68 6.700 -2.281 -4.683 1.00 0.00 C ATOM 1046 CG2 VAL A 68 6.784 -0.830 -2.654 1.00 0.00 C ATOM 0 H VAL A 68 5.746 -2.541 -0.843 1.00 0.00 H new ATOM 0 HA VAL A 68 4.327 -1.815 -3.302 1.00 0.00 H new ATOM 0 HB VAL A 68 7.099 -2.969 -2.685 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.744 -2.048 -4.893 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.469 -3.278 -5.057 1.00 0.00 H new ATOM 0 HG13 VAL A 68 6.059 -1.551 -5.177 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.825 -0.593 -2.874 1.00 0.00 H new ATOM 0 HG22 VAL A 68 6.135 -0.103 -3.142 1.00 0.00 H new ATOM 0 HG23 VAL A 68 6.624 -0.793 -1.577 1.00 0.00 H new ATOM 1056 N GLN A 69 4.940 -5.022 -2.738 1.00 0.00 N ATOM 1057 CA GLN A 69 4.571 -6.384 -3.267 1.00 0.00 C ATOM 1058 C GLN A 69 3.045 -6.531 -3.324 1.00 0.00 C ATOM 1059 O GLN A 69 2.503 -6.968 -4.323 1.00 0.00 O ATOM 1060 CB GLN A 69 5.167 -7.417 -2.297 1.00 0.00 C ATOM 1061 CG GLN A 69 5.168 -8.797 -2.956 1.00 0.00 C ATOM 1062 CD GLN A 69 4.975 -9.877 -1.884 1.00 0.00 C ATOM 1063 OE1 GLN A 69 4.156 -9.725 -1.000 1.00 0.00 O ATOM 1064 NE2 GLN A 69 5.697 -10.971 -1.920 1.00 0.00 N ATOM 0 H GLN A 69 5.447 -5.018 -1.853 1.00 0.00 H new ATOM 0 HA GLN A 69 4.958 -6.529 -4.276 1.00 0.00 H new ATOM 0 HB2 GLN A 69 6.183 -7.132 -2.025 1.00 0.00 H new ATOM 0 HB3 GLN A 69 4.586 -7.443 -1.375 1.00 0.00 H new ATOM 0 HG2 GLN A 69 4.371 -8.858 -3.697 1.00 0.00 H new ATOM 0 HG3 GLN A 69 6.107 -8.958 -3.485 1.00 0.00 H new ATOM 0 HE21 GLN A 69 6.386 -11.103 -2.660 1.00 0.00 H new ATOM 0 HE22 GLN A 69 5.570 -11.690 -1.208 1.00 0.00 H new ATOM 1073 N THR A 70 2.341 -6.167 -2.269 1.00 0.00 N ATOM 1074 CA THR A 70 0.838 -6.298 -2.308 1.00 0.00 C ATOM 1075 C THR A 70 0.254 -5.412 -3.424 1.00 0.00 C ATOM 1076 O THR A 70 -0.758 -5.753 -4.008 1.00 0.00 O ATOM 1077 CB THR A 70 0.295 -5.880 -0.926 1.00 0.00 C ATOM 1078 OG1 THR A 70 -1.117 -6.021 -0.918 1.00 0.00 O ATOM 1079 CG2 THR A 70 0.661 -4.428 -0.621 1.00 0.00 C ATOM 0 H THR A 70 2.729 -5.794 -1.403 1.00 0.00 H new ATOM 0 HA THR A 70 0.547 -7.326 -2.525 1.00 0.00 H new ATOM 0 HB THR A 70 0.740 -6.520 -0.164 1.00 0.00 H new ATOM 0 HG1 THR A 70 -1.467 -5.758 -0.041 1.00 0.00 H new ATOM 0 HG21 THR A 70 0.269 -4.152 0.358 1.00 0.00 H new ATOM 0 HG22 THR A 70 1.745 -4.318 -0.622 1.00 0.00 H new ATOM 0 HG23 THR A 70 0.230 -3.777 -1.381 1.00 0.00 H new ATOM 1087 N ALA A 71 0.883 -4.295 -3.750 1.00 0.00 N ATOM 1088 CA ALA A 71 0.332 -3.437 -4.860 1.00 0.00 C ATOM 1089 C ALA A 71 0.392 -4.233 -6.172 1.00 0.00 C ATOM 1090 O ALA A 71 -0.542 -4.219 -6.951 1.00 0.00 O ATOM 1091 CB ALA A 71 1.214 -2.179 -4.954 1.00 0.00 C ATOM 0 H ALA A 71 1.734 -3.948 -3.306 1.00 0.00 H new ATOM 0 HA ALA A 71 -0.703 -3.151 -4.671 1.00 0.00 H new ATOM 0 HB1 ALA A 71 0.843 -1.533 -5.750 1.00 0.00 H new ATOM 0 HB2 ALA A 71 1.183 -1.641 -4.006 1.00 0.00 H new ATOM 0 HB3 ALA A 71 2.241 -2.470 -5.173 1.00 0.00 H new ATOM 1097 N PHE A 72 1.477 -4.949 -6.414 1.00 0.00 N ATOM 1098 CA PHE A 72 1.560 -5.765 -7.677 1.00 0.00 C ATOM 1099 C PHE A 72 0.503 -6.872 -7.618 1.00 0.00 C ATOM 1100 O PHE A 72 -0.296 -7.019 -8.523 1.00 0.00 O ATOM 1101 CB PHE A 72 2.969 -6.373 -7.723 1.00 0.00 C ATOM 1102 CG PHE A 72 3.946 -5.308 -8.142 1.00 0.00 C ATOM 1103 CD1 PHE A 72 3.931 -4.835 -9.456 1.00 0.00 C ATOM 1104 CD2 PHE A 72 4.858 -4.787 -7.218 1.00 0.00 C ATOM 1105 CE1 PHE A 72 4.830 -3.840 -9.849 1.00 0.00 C ATOM 1106 CE2 PHE A 72 5.756 -3.790 -7.611 1.00 0.00 C ATOM 1107 CZ PHE A 72 5.744 -3.316 -8.924 1.00 0.00 C ATOM 0 H PHE A 72 2.292 -5.002 -5.803 1.00 0.00 H new ATOM 0 HA PHE A 72 1.379 -5.160 -8.565 1.00 0.00 H new ATOM 0 HB2 PHE A 72 3.240 -6.770 -6.745 1.00 0.00 H new ATOM 0 HB3 PHE A 72 2.997 -7.207 -8.424 1.00 0.00 H new ATOM 0 HD1 PHE A 72 3.225 -5.238 -10.168 1.00 0.00 H new ATOM 0 HD2 PHE A 72 4.868 -5.154 -6.202 1.00 0.00 H new ATOM 0 HE1 PHE A 72 4.821 -3.475 -10.865 1.00 0.00 H new ATOM 0 HE2 PHE A 72 6.460 -3.386 -6.898 1.00 0.00 H new ATOM 0 HZ PHE A 72 6.438 -2.546 -9.227 1.00 0.00 H new ATOM 1117 N PHE A 73 0.474 -7.638 -6.543 1.00 0.00 N ATOM 1118 CA PHE A 73 -0.570 -8.719 -6.428 1.00 0.00 C ATOM 1119 C PHE A 73 -1.966 -8.074 -6.492 1.00 0.00 C ATOM 1120 O PHE A 73 -2.866 -8.599 -7.120 1.00 0.00 O ATOM 1121 CB PHE A 73 -0.347 -9.401 -5.065 1.00 0.00 C ATOM 1122 CG PHE A 73 -1.379 -10.484 -4.851 1.00 0.00 C ATOM 1123 CD1 PHE A 73 -1.563 -11.479 -5.818 1.00 0.00 C ATOM 1124 CD2 PHE A 73 -2.152 -10.489 -3.684 1.00 0.00 C ATOM 1125 CE1 PHE A 73 -2.520 -12.481 -5.617 1.00 0.00 C ATOM 1126 CE2 PHE A 73 -3.110 -11.490 -3.483 1.00 0.00 C ATOM 1127 CZ PHE A 73 -3.294 -12.486 -4.449 1.00 0.00 C ATOM 0 H PHE A 73 1.116 -7.564 -5.754 1.00 0.00 H new ATOM 0 HA PHE A 73 -0.497 -9.448 -7.235 1.00 0.00 H new ATOM 0 HB2 PHE A 73 0.655 -9.829 -5.023 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -0.412 -8.663 -4.265 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -0.967 -11.474 -6.719 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -2.009 -9.721 -2.939 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -2.662 -13.250 -6.362 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -3.707 -11.494 -2.583 1.00 0.00 H new ATOM 0 HZ PHE A 73 -4.033 -13.259 -4.294 1.00 0.00 H new ATOM 1137 N ALA A 74 -2.149 -6.927 -5.861 1.00 0.00 N ATOM 1138 CA ALA A 74 -3.494 -6.255 -5.919 1.00 0.00 C ATOM 1139 C ALA A 74 -3.820 -5.888 -7.372 1.00 0.00 C ATOM 1140 O ALA A 74 -4.944 -6.040 -7.813 1.00 0.00 O ATOM 1141 CB ALA A 74 -3.401 -4.986 -5.058 1.00 0.00 C ATOM 0 H ALA A 74 -1.438 -6.437 -5.319 1.00 0.00 H new ATOM 0 HA ALA A 74 -4.281 -6.912 -5.549 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -4.359 -4.466 -5.072 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -3.152 -5.259 -4.033 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.627 -4.331 -5.457 1.00 0.00 H new ATOM 1147 N LEU A 75 -2.847 -5.410 -8.129 1.00 0.00 N ATOM 1148 CA LEU A 75 -3.135 -5.044 -9.567 1.00 0.00 C ATOM 1149 C LEU A 75 -3.694 -6.265 -10.315 1.00 0.00 C ATOM 1150 O LEU A 75 -4.621 -6.144 -11.094 1.00 0.00 O ATOM 1151 CB LEU A 75 -1.800 -4.604 -10.209 1.00 0.00 C ATOM 1152 CG LEU A 75 -1.700 -3.071 -10.262 1.00 0.00 C ATOM 1153 CD1 LEU A 75 -2.874 -2.491 -11.059 1.00 0.00 C ATOM 1154 CD2 LEU A 75 -1.710 -2.502 -8.840 1.00 0.00 C ATOM 0 H LEU A 75 -1.886 -5.260 -7.822 1.00 0.00 H new ATOM 0 HA LEU A 75 -3.872 -4.242 -9.620 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -0.965 -5.008 -9.636 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -1.723 -5.013 -11.216 1.00 0.00 H new ATOM 0 HG LEU A 75 -0.768 -2.796 -10.755 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.792 -1.405 -11.089 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.854 -2.885 -12.075 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.812 -2.771 -10.580 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.639 -1.415 -8.882 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.637 -2.786 -8.341 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.862 -2.900 -8.283 1.00 0.00 H new ATOM 1166 N GLU A 76 -3.148 -7.439 -10.077 1.00 0.00 N ATOM 1167 CA GLU A 76 -3.680 -8.660 -10.780 1.00 0.00 C ATOM 1168 C GLU A 76 -5.059 -9.010 -10.210 1.00 0.00 C ATOM 1169 O GLU A 76 -5.976 -9.321 -10.946 1.00 0.00 O ATOM 1170 CB GLU A 76 -2.683 -9.799 -10.518 1.00 0.00 C ATOM 1171 CG GLU A 76 -3.135 -11.056 -11.262 1.00 0.00 C ATOM 1172 CD GLU A 76 -1.911 -11.884 -11.658 1.00 0.00 C ATOM 1173 OE1 GLU A 76 -1.090 -12.141 -10.794 1.00 0.00 O ATOM 1174 OE2 GLU A 76 -1.816 -12.248 -12.820 1.00 0.00 O ATOM 0 H GLU A 76 -2.370 -7.605 -9.438 1.00 0.00 H new ATOM 0 HA GLU A 76 -3.789 -8.491 -11.851 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -1.686 -9.507 -10.849 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -2.618 -10.000 -9.449 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -3.798 -11.647 -10.630 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -3.704 -10.781 -12.150 1.00 0.00 H new ATOM 1181 N ALA A 77 -5.220 -8.943 -8.905 1.00 0.00 N ATOM 1182 CA ALA A 77 -6.565 -9.256 -8.307 1.00 0.00 C ATOM 1183 C ALA A 77 -7.580 -8.178 -8.722 1.00 0.00 C ATOM 1184 O ALA A 77 -8.737 -8.475 -8.954 1.00 0.00 O ATOM 1185 CB ALA A 77 -6.386 -9.260 -6.780 1.00 0.00 C ATOM 0 H ALA A 77 -4.492 -8.690 -8.237 1.00 0.00 H new ATOM 0 HA ALA A 77 -6.937 -10.220 -8.654 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -7.340 -9.483 -6.302 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -5.654 -10.018 -6.501 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -6.037 -8.281 -6.452 1.00 0.00 H new ATOM 1191 N LEU A 78 -7.159 -6.931 -8.829 1.00 0.00 N ATOM 1192 CA LEU A 78 -8.129 -5.856 -9.246 1.00 0.00 C ATOM 1193 C LEU A 78 -8.592 -6.113 -10.688 1.00 0.00 C ATOM 1194 O LEU A 78 -9.752 -5.926 -11.009 1.00 0.00 O ATOM 1195 CB LEU A 78 -7.384 -4.510 -9.160 1.00 0.00 C ATOM 1196 CG LEU A 78 -8.313 -3.446 -8.576 1.00 0.00 C ATOM 1197 CD1 LEU A 78 -8.658 -3.803 -7.128 1.00 0.00 C ATOM 1198 CD2 LEU A 78 -7.613 -2.084 -8.616 1.00 0.00 C ATOM 0 H LEU A 78 -6.206 -6.616 -8.650 1.00 0.00 H new ATOM 0 HA LEU A 78 -9.008 -5.848 -8.601 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -6.496 -4.614 -8.537 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -7.045 -4.207 -10.150 1.00 0.00 H new ATOM 0 HG LEU A 78 -9.230 -3.402 -9.164 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -9.320 -3.043 -6.714 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -9.156 -4.772 -7.101 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -7.743 -3.848 -6.537 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -8.273 -1.323 -8.200 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -6.696 -2.129 -8.029 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -7.371 -1.829 -9.648 1.00 0.00 H new ATOM 1210 N GLN A 79 -7.702 -6.544 -11.564 1.00 0.00 N ATOM 1211 CA GLN A 79 -8.126 -6.811 -12.988 1.00 0.00 C ATOM 1212 C GLN A 79 -9.244 -7.866 -13.019 1.00 0.00 C ATOM 1213 O GLN A 79 -10.162 -7.772 -13.812 1.00 0.00 O ATOM 1214 CB GLN A 79 -6.886 -7.332 -13.732 1.00 0.00 C ATOM 1215 CG GLN A 79 -6.112 -6.153 -14.325 1.00 0.00 C ATOM 1216 CD GLN A 79 -4.701 -6.612 -14.715 1.00 0.00 C ATOM 1217 OE1 GLN A 79 -4.528 -7.699 -15.229 1.00 0.00 O ATOM 1218 NE2 GLN A 79 -3.674 -5.828 -14.493 1.00 0.00 N ATOM 0 H GLN A 79 -6.718 -6.720 -11.360 1.00 0.00 H new ATOM 0 HA GLN A 79 -8.511 -5.905 -13.457 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -6.248 -7.892 -13.049 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -7.186 -8.019 -14.524 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -6.634 -5.764 -15.199 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -6.055 -5.341 -13.601 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -3.814 -4.914 -14.062 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -2.735 -6.132 -14.752 1.00 0.00 H new ATOM 1227 N GLN A 80 -9.177 -8.871 -12.168 1.00 0.00 N ATOM 1228 CA GLN A 80 -10.258 -9.926 -12.172 1.00 0.00 C ATOM 1229 C GLN A 80 -11.624 -9.285 -11.889 1.00 0.00 C ATOM 1230 O GLN A 80 -12.616 -9.642 -12.498 1.00 0.00 O ATOM 1231 CB GLN A 80 -9.905 -10.928 -11.061 1.00 0.00 C ATOM 1232 CG GLN A 80 -8.659 -11.718 -11.461 1.00 0.00 C ATOM 1233 CD GLN A 80 -9.079 -13.013 -12.169 1.00 0.00 C ATOM 1234 OE1 GLN A 80 -10.039 -13.022 -12.914 1.00 0.00 O ATOM 1235 NE2 GLN A 80 -8.401 -14.117 -11.969 1.00 0.00 N ATOM 0 H GLN A 80 -8.435 -9.008 -11.481 1.00 0.00 H new ATOM 0 HA GLN A 80 -10.317 -10.421 -13.142 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -9.728 -10.400 -10.124 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -10.740 -11.608 -10.891 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -8.031 -11.118 -12.120 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -8.064 -11.950 -10.578 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -7.595 -14.114 -11.345 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -8.680 -14.979 -12.438 1.00 0.00 H new ATOM 1244 N GLY A 81 -11.687 -8.342 -10.975 1.00 0.00 N ATOM 1245 CA GLY A 81 -12.990 -7.685 -10.663 1.00 0.00 C ATOM 1246 C GLY A 81 -13.343 -7.917 -9.186 1.00 0.00 C ATOM 1247 O GLY A 81 -14.301 -8.601 -8.877 1.00 0.00 O ATOM 0 H GLY A 81 -10.891 -8.003 -10.435 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -12.929 -6.616 -10.869 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -13.775 -8.089 -11.303 1.00 0.00 H new ATOM 1251 N GLU A 82 -12.582 -7.352 -8.269 1.00 0.00 N ATOM 1252 CA GLU A 82 -12.889 -7.547 -6.819 1.00 0.00 C ATOM 1253 C GLU A 82 -13.264 -6.203 -6.173 1.00 0.00 C ATOM 1254 O GLU A 82 -13.362 -5.196 -6.850 1.00 0.00 O ATOM 1255 CB GLU A 82 -11.597 -8.093 -6.209 1.00 0.00 C ATOM 1256 CG GLU A 82 -11.458 -9.577 -6.552 1.00 0.00 C ATOM 1257 CD GLU A 82 -10.266 -10.167 -5.797 1.00 0.00 C ATOM 1258 OE1 GLU A 82 -10.351 -10.274 -4.584 1.00 0.00 O ATOM 1259 OE2 GLU A 82 -9.287 -10.503 -6.444 1.00 0.00 O ATOM 0 H GLU A 82 -11.768 -6.769 -8.466 1.00 0.00 H new ATOM 0 HA GLU A 82 -13.730 -8.222 -6.661 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -10.740 -7.539 -6.591 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -11.608 -7.958 -5.127 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -12.371 -10.110 -6.285 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -11.319 -9.701 -7.626 1.00 0.00 H new ATOM 1266 N SER A 83 -13.477 -6.175 -4.872 1.00 0.00 N ATOM 1267 CA SER A 83 -13.845 -4.892 -4.203 1.00 0.00 C ATOM 1268 C SER A 83 -12.764 -4.487 -3.187 1.00 0.00 C ATOM 1269 O SER A 83 -12.241 -5.320 -2.471 1.00 0.00 O ATOM 1270 CB SER A 83 -15.165 -5.178 -3.489 1.00 0.00 C ATOM 1271 OG SER A 83 -16.232 -5.096 -4.425 1.00 0.00 O ATOM 0 H SER A 83 -13.411 -6.984 -4.254 1.00 0.00 H new ATOM 0 HA SER A 83 -13.934 -4.072 -4.915 1.00 0.00 H new ATOM 0 HB2 SER A 83 -15.139 -6.169 -3.035 1.00 0.00 H new ATOM 0 HB3 SER A 83 -15.318 -4.462 -2.682 1.00 0.00 H new ATOM 0 HG SER A 83 -17.081 -5.281 -3.971 1.00 0.00 H new ATOM 1277 N ALA A 84 -12.427 -3.215 -3.115 1.00 0.00 N ATOM 1278 CA ALA A 84 -11.378 -2.774 -2.134 1.00 0.00 C ATOM 1279 C ALA A 84 -12.030 -2.222 -0.848 1.00 0.00 C ATOM 1280 O ALA A 84 -11.499 -2.395 0.232 1.00 0.00 O ATOM 1281 CB ALA A 84 -10.566 -1.679 -2.845 1.00 0.00 C ATOM 0 H ALA A 84 -12.829 -2.472 -3.687 1.00 0.00 H new ATOM 0 HA ALA A 84 -10.743 -3.606 -1.831 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.783 -1.316 -2.179 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.113 -2.090 -3.747 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.225 -0.854 -3.114 1.00 0.00 H new ATOM 1287 N GLU A 85 -13.175 -1.564 -0.943 1.00 0.00 N ATOM 1288 CA GLU A 85 -13.834 -1.014 0.304 1.00 0.00 C ATOM 1289 C GLU A 85 -13.976 -2.110 1.373 1.00 0.00 C ATOM 1290 O GLU A 85 -13.827 -1.851 2.552 1.00 0.00 O ATOM 1291 CB GLU A 85 -15.224 -0.508 -0.116 1.00 0.00 C ATOM 1292 CG GLU A 85 -15.069 0.698 -1.045 1.00 0.00 C ATOM 1293 CD GLU A 85 -16.203 0.699 -2.073 1.00 0.00 C ATOM 1294 OE1 GLU A 85 -17.303 0.314 -1.713 1.00 0.00 O ATOM 1295 OE2 GLU A 85 -15.952 1.085 -3.203 1.00 0.00 O ATOM 0 H GLU A 85 -13.675 -1.386 -1.814 1.00 0.00 H new ATOM 0 HA GLU A 85 -13.233 -0.213 0.734 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -15.774 -1.302 -0.622 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -15.803 -0.230 0.765 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -15.088 1.621 -0.466 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -14.105 0.659 -1.551 1.00 0.00 H new ATOM 1302 N ASN A 86 -14.253 -3.335 0.972 1.00 0.00 N ATOM 1303 CA ASN A 86 -14.390 -4.441 1.991 1.00 0.00 C ATOM 1304 C ASN A 86 -13.093 -4.565 2.810 1.00 0.00 C ATOM 1305 O ASN A 86 -13.135 -4.800 4.004 1.00 0.00 O ATOM 1306 CB ASN A 86 -14.646 -5.739 1.207 1.00 0.00 C ATOM 1307 CG ASN A 86 -16.149 -5.889 0.944 1.00 0.00 C ATOM 1308 OD1 ASN A 86 -16.958 -5.501 1.762 1.00 0.00 O ATOM 1309 ND2 ASN A 86 -16.566 -6.441 -0.170 1.00 0.00 N ATOM 0 H ASN A 86 -14.389 -3.616 0.001 1.00 0.00 H new ATOM 0 HA ASN A 86 -15.206 -4.237 2.685 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -14.101 -5.720 0.263 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -14.277 -6.596 1.771 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -17.566 -6.543 -0.346 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -15.891 -6.769 -0.861 1.00 0.00 H new ATOM 1316 N ILE A 87 -11.942 -4.404 2.186 1.00 0.00 N ATOM 1317 CA ILE A 87 -10.654 -4.510 2.962 1.00 0.00 C ATOM 1318 C ILE A 87 -10.598 -3.401 4.032 1.00 0.00 C ATOM 1319 O ILE A 87 -10.131 -3.629 5.132 1.00 0.00 O ATOM 1320 CB ILE A 87 -9.507 -4.344 1.944 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -9.576 -5.477 0.913 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -8.157 -4.399 2.666 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -9.162 -4.945 -0.460 1.00 0.00 C ATOM 0 H ILE A 87 -11.838 -4.207 1.191 1.00 0.00 H new ATOM 0 HA ILE A 87 -10.574 -5.468 3.476 1.00 0.00 H new ATOM 0 HB ILE A 87 -9.608 -3.381 1.443 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.919 -6.294 1.211 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -10.587 -5.881 0.868 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.352 -4.281 1.941 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -8.104 -3.596 3.401 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.053 -5.360 3.171 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -9.211 -5.751 -1.192 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -9.837 -4.142 -0.758 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -8.143 -4.562 -0.410 1.00 0.00 H new ATOM 1335 N VAL A 88 -11.071 -2.206 3.726 1.00 0.00 N ATOM 1336 CA VAL A 88 -11.030 -1.104 4.757 1.00 0.00 C ATOM 1337 C VAL A 88 -11.839 -1.512 6.000 1.00 0.00 C ATOM 1338 O VAL A 88 -11.456 -1.204 7.114 1.00 0.00 O ATOM 1339 CB VAL A 88 -11.642 0.150 4.105 1.00 0.00 C ATOM 1340 CG1 VAL A 88 -11.639 1.310 5.106 1.00 0.00 C ATOM 1341 CG2 VAL A 88 -10.808 0.543 2.885 1.00 0.00 C ATOM 0 H VAL A 88 -11.476 -1.949 2.826 1.00 0.00 H new ATOM 0 HA VAL A 88 -10.007 -0.909 5.078 1.00 0.00 H new ATOM 0 HB VAL A 88 -12.667 -0.067 3.803 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -12.073 2.194 4.639 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -12.227 1.036 5.982 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -10.615 1.526 5.410 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -11.238 1.430 2.421 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -9.785 0.756 3.197 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -10.805 -0.277 2.167 1.00 0.00 H new ATOM 1351 N SER A 89 -12.950 -2.205 5.830 1.00 0.00 N ATOM 1352 CA SER A 89 -13.760 -2.624 7.035 1.00 0.00 C ATOM 1353 C SER A 89 -12.871 -3.421 8.001 1.00 0.00 C ATOM 1354 O SER A 89 -12.918 -3.219 9.200 1.00 0.00 O ATOM 1355 CB SER A 89 -14.907 -3.505 6.518 1.00 0.00 C ATOM 1356 OG SER A 89 -15.716 -2.749 5.626 1.00 0.00 O ATOM 0 H SER A 89 -13.327 -2.495 4.927 1.00 0.00 H new ATOM 0 HA SER A 89 -14.151 -1.759 7.571 1.00 0.00 H new ATOM 0 HB2 SER A 89 -14.506 -4.382 6.009 1.00 0.00 H new ATOM 0 HB3 SER A 89 -15.507 -3.867 7.353 1.00 0.00 H new ATOM 0 HG SER A 89 -16.448 -3.309 5.293 1.00 0.00 H new ATOM 1362 N LYS A 90 -12.041 -4.305 7.486 1.00 0.00 N ATOM 1363 CA LYS A 90 -11.129 -5.083 8.398 1.00 0.00 C ATOM 1364 C LYS A 90 -10.043 -4.148 8.953 1.00 0.00 C ATOM 1365 O LYS A 90 -9.640 -4.280 10.094 1.00 0.00 O ATOM 1366 CB LYS A 90 -10.498 -6.201 7.553 1.00 0.00 C ATOM 1367 CG LYS A 90 -11.420 -7.421 7.552 1.00 0.00 C ATOM 1368 CD LYS A 90 -11.210 -8.221 6.265 1.00 0.00 C ATOM 1369 CE LYS A 90 -12.182 -9.403 6.233 1.00 0.00 C ATOM 1370 NZ LYS A 90 -12.592 -9.525 4.806 1.00 0.00 N ATOM 0 H LYS A 90 -11.955 -4.520 6.493 1.00 0.00 H new ATOM 0 HA LYS A 90 -11.673 -5.506 9.243 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -10.336 -5.853 6.533 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -9.522 -6.470 7.957 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -11.212 -8.047 8.420 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -12.460 -7.104 7.630 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -11.370 -7.582 5.397 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -10.182 -8.580 6.211 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -11.704 -10.317 6.586 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -13.043 -9.224 6.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -13.260 -10.316 4.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -13.050 -8.643 4.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -11.753 -9.702 4.218 1.00 0.00 H new ATOM 1384 N ILE A 91 -9.577 -3.191 8.171 1.00 0.00 N ATOM 1385 CA ILE A 91 -8.532 -2.248 8.699 1.00 0.00 C ATOM 1386 C ILE A 91 -9.173 -1.299 9.722 1.00 0.00 C ATOM 1387 O ILE A 91 -8.576 -0.988 10.736 1.00 0.00 O ATOM 1388 CB ILE A 91 -7.986 -1.456 7.492 1.00 0.00 C ATOM 1389 CG1 ILE A 91 -7.373 -2.418 6.458 1.00 0.00 C ATOM 1390 CG2 ILE A 91 -6.913 -0.472 7.963 1.00 0.00 C ATOM 1391 CD1 ILE A 91 -6.273 -3.266 7.111 1.00 0.00 C ATOM 0 H ILE A 91 -9.870 -3.026 7.208 1.00 0.00 H new ATOM 0 HA ILE A 91 -7.724 -2.785 9.196 1.00 0.00 H new ATOM 0 HB ILE A 91 -8.809 -0.910 7.031 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -8.148 -3.066 6.049 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -6.959 -1.851 5.624 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.530 0.085 7.108 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -7.346 0.222 8.684 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -6.097 -1.021 8.433 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -5.847 -3.942 6.370 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.491 -2.612 7.498 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -6.699 -3.846 7.930 1.00 0.00 H new ATOM 1403 N ARG A 92 -10.385 -0.843 9.474 1.00 0.00 N ATOM 1404 CA ARG A 92 -11.046 0.082 10.461 1.00 0.00 C ATOM 1405 C ARG A 92 -11.270 -0.644 11.794 1.00 0.00 C ATOM 1406 O ARG A 92 -11.119 -0.058 12.850 1.00 0.00 O ATOM 1407 CB ARG A 92 -12.392 0.502 9.851 1.00 0.00 C ATOM 1408 CG ARG A 92 -12.866 1.802 10.504 1.00 0.00 C ATOM 1409 CD ARG A 92 -12.029 2.972 9.982 1.00 0.00 C ATOM 1410 NE ARG A 92 -12.849 4.184 10.258 1.00 0.00 N ATOM 1411 CZ ARG A 92 -12.588 4.925 11.299 1.00 0.00 C ATOM 1412 NH1 ARG A 92 -11.413 5.478 11.428 1.00 0.00 N ATOM 1413 NH2 ARG A 92 -13.502 5.114 12.211 1.00 0.00 N ATOM 0 H ARG A 92 -10.937 -1.066 8.646 1.00 0.00 H new ATOM 0 HA ARG A 92 -10.422 0.954 10.658 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -12.288 0.640 8.775 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -13.132 -0.284 10.001 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -13.920 1.969 10.283 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -12.775 1.731 11.588 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -11.065 3.024 10.487 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -11.825 2.867 8.916 1.00 0.00 H new ATOM 0 HE ARG A 92 -13.615 4.435 9.633 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -10.699 5.331 10.715 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -11.209 6.058 12.242 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -14.421 4.682 12.110 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -13.298 5.694 13.025 1.00 0.00 H new ATOM 1427 N MET A 93 -11.617 -1.916 11.765 1.00 0.00 N ATOM 1428 CA MET A 93 -11.832 -2.653 13.061 1.00 0.00 C ATOM 1429 C MET A 93 -10.484 -2.864 13.762 1.00 0.00 C ATOM 1430 O MET A 93 -10.382 -2.717 14.967 1.00 0.00 O ATOM 1431 CB MET A 93 -12.473 -4.004 12.711 1.00 0.00 C ATOM 1432 CG MET A 93 -13.474 -4.393 13.802 1.00 0.00 C ATOM 1433 SD MET A 93 -15.082 -3.646 13.439 1.00 0.00 S ATOM 1434 CE MET A 93 -15.596 -4.820 12.162 1.00 0.00 C ATOM 0 H MET A 93 -11.758 -2.467 10.918 1.00 0.00 H new ATOM 0 HA MET A 93 -12.477 -2.089 13.735 1.00 0.00 H new ATOM 0 HB2 MET A 93 -12.977 -3.940 11.747 1.00 0.00 H new ATOM 0 HB3 MET A 93 -11.704 -4.770 12.619 1.00 0.00 H new ATOM 0 HG2 MET A 93 -13.568 -5.478 13.854 1.00 0.00 H new ATOM 0 HG3 MET A 93 -13.116 -4.057 14.775 1.00 0.00 H new ATOM 0 HE1 MET A 93 -15.848 -4.279 11.250 1.00 0.00 H new ATOM 0 HE2 MET A 93 -14.782 -5.515 11.958 1.00 0.00 H new ATOM 0 HE3 MET A 93 -16.468 -5.375 12.508 1.00 0.00 H new ATOM 1444 N MET A 94 -9.444 -3.187 13.022 1.00 0.00 N ATOM 1445 CA MET A 94 -8.103 -3.380 13.675 1.00 0.00 C ATOM 1446 C MET A 94 -7.531 -2.015 14.080 1.00 0.00 C ATOM 1447 O MET A 94 -6.953 -1.876 15.143 1.00 0.00 O ATOM 1448 CB MET A 94 -7.193 -4.060 12.638 1.00 0.00 C ATOM 1449 CG MET A 94 -7.537 -5.548 12.556 1.00 0.00 C ATOM 1450 SD MET A 94 -6.810 -6.253 11.056 1.00 0.00 S ATOM 1451 CE MET A 94 -5.089 -6.247 11.614 1.00 0.00 C ATOM 0 H MET A 94 -9.463 -3.323 12.011 1.00 0.00 H new ATOM 0 HA MET A 94 -8.180 -3.993 14.573 1.00 0.00 H new ATOM 0 HB2 MET A 94 -7.322 -3.592 11.662 1.00 0.00 H new ATOM 0 HB3 MET A 94 -6.147 -3.932 12.917 1.00 0.00 H new ATOM 0 HG2 MET A 94 -7.159 -6.069 13.436 1.00 0.00 H new ATOM 0 HG3 MET A 94 -8.619 -5.682 12.547 1.00 0.00 H new ATOM 0 HE1 MET A 94 -4.485 -6.852 10.938 1.00 0.00 H new ATOM 0 HE2 MET A 94 -4.712 -5.224 11.621 1.00 0.00 H new ATOM 0 HE3 MET A 94 -5.031 -6.661 12.621 1.00 0.00 H new ATOM 1461 N ASN A 95 -7.703 -1.000 13.257 1.00 0.00 N ATOM 1462 CA ASN A 95 -7.176 0.358 13.639 1.00 0.00 C ATOM 1463 C ASN A 95 -8.025 0.941 14.780 1.00 0.00 C ATOM 1464 O ASN A 95 -7.508 1.619 15.648 1.00 0.00 O ATOM 1465 CB ASN A 95 -7.269 1.249 12.388 1.00 0.00 C ATOM 1466 CG ASN A 95 -5.971 1.130 11.577 1.00 0.00 C ATOM 1467 OD1 ASN A 95 -5.814 0.142 10.728 1.00 0.00 O flip ATOM 1468 ND2 ASN A 95 -5.084 1.948 11.715 1.00 0.00 N flip ATOM 0 H ASN A 95 -8.176 -1.050 12.355 1.00 0.00 H new ATOM 0 HA ASN A 95 -6.145 0.297 13.986 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -8.121 0.949 11.777 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -7.435 2.286 12.679 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -5.199 2.719 12.373 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -4.224 1.864 11.173 1.00 0.00 H new ATOM 1475 N ALA A 96 -9.319 0.674 14.803 1.00 0.00 N ATOM 1476 CA ALA A 96 -10.166 1.218 15.922 1.00 0.00 C ATOM 1477 C ALA A 96 -9.823 0.494 17.230 1.00 0.00 C ATOM 1478 O ALA A 96 -9.758 1.107 18.279 1.00 0.00 O ATOM 1479 CB ALA A 96 -11.633 0.963 15.537 1.00 0.00 C ATOM 0 H ALA A 96 -9.815 0.114 14.109 1.00 0.00 H new ATOM 0 HA ALA A 96 -9.988 2.283 16.072 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -12.287 1.343 16.322 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -11.857 1.473 14.600 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -11.796 -0.108 15.415 1.00 0.00 H new ATOM 1485 N GLN A 97 -9.587 -0.803 17.181 1.00 0.00 N ATOM 1486 CA GLN A 97 -9.231 -1.539 18.447 1.00 0.00 C ATOM 1487 C GLN A 97 -7.886 -1.025 18.981 1.00 0.00 C ATOM 1488 O GLN A 97 -7.709 -0.871 20.175 1.00 0.00 O ATOM 1489 CB GLN A 97 -9.128 -3.029 18.086 1.00 0.00 C ATOM 1490 CG GLN A 97 -9.385 -3.876 19.335 1.00 0.00 C ATOM 1491 CD GLN A 97 -10.011 -5.216 18.925 1.00 0.00 C ATOM 1492 OE1 GLN A 97 -9.697 -5.745 17.878 1.00 0.00 O ATOM 1493 NE2 GLN A 97 -10.887 -5.794 19.710 1.00 0.00 N ATOM 0 H GLN A 97 -9.624 -1.374 16.337 1.00 0.00 H new ATOM 0 HA GLN A 97 -9.983 -1.383 19.221 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -9.852 -3.277 17.310 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -8.140 -3.249 17.682 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -8.451 -4.047 19.870 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -10.050 -3.345 20.017 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -11.153 -5.352 20.590 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -11.303 -6.686 19.441 1.00 0.00 H new ATOM 1502 N SER A 98 -6.935 -0.752 18.109 1.00 0.00 N ATOM 1503 CA SER A 98 -5.601 -0.239 18.593 1.00 0.00 C ATOM 1504 C SER A 98 -5.783 1.067 19.385 1.00 0.00 C ATOM 1505 O SER A 98 -5.070 1.314 20.340 1.00 0.00 O ATOM 1506 CB SER A 98 -4.745 0.019 17.344 1.00 0.00 C ATOM 1507 OG SER A 98 -3.577 0.737 17.715 1.00 0.00 O ATOM 0 H SER A 98 -7.021 -0.860 17.098 1.00 0.00 H new ATOM 0 HA SER A 98 -5.125 -0.963 19.255 1.00 0.00 H new ATOM 0 HB2 SER A 98 -4.471 -0.926 16.875 1.00 0.00 H new ATOM 0 HB3 SER A 98 -5.316 0.586 16.609 1.00 0.00 H new ATOM 0 HG SER A 98 -3.028 0.902 16.920 1.00 0.00 H new ATOM 1513 N LEU A 99 -6.727 1.907 19.006 1.00 0.00 N ATOM 1514 CA LEU A 99 -6.930 3.191 19.762 1.00 0.00 C ATOM 1515 C LEU A 99 -8.027 3.020 20.822 1.00 0.00 C ATOM 1516 O LEU A 99 -7.911 3.526 21.923 1.00 0.00 O ATOM 1517 CB LEU A 99 -7.348 4.241 18.722 1.00 0.00 C ATOM 1518 CG LEU A 99 -6.106 4.964 18.198 1.00 0.00 C ATOM 1519 CD1 LEU A 99 -5.423 4.103 17.134 1.00 0.00 C ATOM 1520 CD2 LEU A 99 -6.521 6.302 17.581 1.00 0.00 C ATOM 0 H LEU A 99 -7.357 1.761 18.217 1.00 0.00 H new ATOM 0 HA LEU A 99 -6.021 3.491 20.284 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -7.877 3.762 17.898 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -8.037 4.957 19.170 1.00 0.00 H new ATOM 0 HG LEU A 99 -5.413 5.140 19.021 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.538 4.619 16.761 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -5.129 3.149 17.572 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -6.114 3.927 16.310 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -5.638 6.820 17.207 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -7.213 6.124 16.758 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -7.008 6.916 18.338 1.00 0.00 H new ATOM 1532 N GLY A 100 -9.091 2.312 20.507 1.00 0.00 N ATOM 1533 CA GLY A 100 -10.184 2.115 21.505 1.00 0.00 C ATOM 1534 C GLY A 100 -11.257 3.197 21.313 1.00 0.00 C ATOM 1535 O GLY A 100 -11.339 4.134 22.085 1.00 0.00 O ATOM 0 H GLY A 100 -9.245 1.865 19.603 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.625 1.126 21.386 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.780 2.164 22.516 1.00 0.00 H new ATOM 1539 N GLN A 101 -12.082 3.080 20.292 1.00 0.00 N ATOM 1540 CA GLN A 101 -13.144 4.107 20.065 1.00 0.00 C ATOM 1541 C GLN A 101 -14.534 3.465 20.191 1.00 0.00 C ATOM 1542 O GLN A 101 -14.840 2.507 19.507 1.00 0.00 O ATOM 1543 CB GLN A 101 -12.911 4.609 18.640 1.00 0.00 C ATOM 1544 CG GLN A 101 -13.438 6.040 18.510 1.00 0.00 C ATOM 1545 CD GLN A 101 -12.545 6.831 17.546 1.00 0.00 C ATOM 1546 OE1 GLN A 101 -11.678 7.567 17.976 1.00 0.00 O ATOM 1547 NE2 GLN A 101 -12.713 6.711 16.251 1.00 0.00 N ATOM 0 H GLN A 101 -12.062 2.320 19.612 1.00 0.00 H new ATOM 0 HA GLN A 101 -13.100 4.917 20.793 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -11.848 4.579 18.402 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -13.416 3.958 17.927 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -14.465 6.028 18.144 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -13.453 6.523 19.487 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -13.439 6.095 15.886 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -12.118 7.234 15.609 1.00 0.00 H new ATOM 1556 N SER A 102 -15.384 3.981 21.061 1.00 0.00 N ATOM 1557 CA SER A 102 -16.757 3.394 21.227 1.00 0.00 C ATOM 1558 C SER A 102 -16.675 1.879 21.489 1.00 0.00 C ATOM 1559 O SER A 102 -17.486 1.119 20.995 1.00 0.00 O ATOM 1560 CB SER A 102 -17.482 3.673 19.908 1.00 0.00 C ATOM 1561 OG SER A 102 -18.792 3.125 19.968 1.00 0.00 O ATOM 0 H SER A 102 -15.183 4.782 21.660 1.00 0.00 H new ATOM 0 HA SER A 102 -17.281 3.830 22.078 1.00 0.00 H new ATOM 0 HB2 SER A 102 -17.532 4.747 19.727 1.00 0.00 H new ATOM 0 HB3 SER A 102 -16.930 3.235 19.076 1.00 0.00 H new ATOM 0 HG SER A 102 -18.740 2.179 20.218 1.00 0.00 H new ATOM 1567 N ASP A 103 -15.703 1.433 22.262 1.00 0.00 N ATOM 1568 CA ASP A 103 -15.582 -0.029 22.544 1.00 0.00 C ATOM 1569 C ASP A 103 -15.667 -0.292 24.056 1.00 0.00 C ATOM 1570 O ASP A 103 -16.512 -1.042 24.507 1.00 0.00 O ATOM 1571 CB ASP A 103 -14.204 -0.424 22.005 1.00 0.00 C ATOM 1572 CG ASP A 103 -14.070 -1.947 22.014 1.00 0.00 C ATOM 1573 OD1 ASP A 103 -14.109 -2.520 23.092 1.00 0.00 O ATOM 1574 OD2 ASP A 103 -13.931 -2.516 20.944 1.00 0.00 O ATOM 0 H ASP A 103 -14.996 2.020 22.704 1.00 0.00 H new ATOM 0 HA ASP A 103 -16.382 -0.605 22.080 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -14.075 -0.043 20.992 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -13.421 0.024 22.616 1.00 0.00 H new ATOM 1579 N ILE A 104 -14.803 0.316 24.847 1.00 0.00 N ATOM 1580 CA ILE A 104 -14.851 0.090 26.325 1.00 0.00 C ATOM 1581 C ILE A 104 -15.274 1.383 27.041 1.00 0.00 C ATOM 1582 O ILE A 104 -16.239 1.394 27.782 1.00 0.00 O ATOM 1583 CB ILE A 104 -13.424 -0.310 26.719 1.00 0.00 C ATOM 1584 CG1 ILE A 104 -13.025 -1.585 25.972 1.00 0.00 C ATOM 1585 CG2 ILE A 104 -13.357 -0.568 28.227 1.00 0.00 C ATOM 1586 CD1 ILE A 104 -11.507 -1.766 26.045 1.00 0.00 C ATOM 0 H ILE A 104 -14.073 0.954 24.530 1.00 0.00 H new ATOM 0 HA ILE A 104 -15.573 -0.678 26.604 1.00 0.00 H new ATOM 0 HB ILE A 104 -12.741 0.498 26.457 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -13.526 -2.448 26.410 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -13.345 -1.525 24.932 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -12.341 -0.852 28.503 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -13.639 0.338 28.764 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -14.043 -1.374 28.489 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -11.223 -2.674 25.513 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -11.016 -0.908 25.586 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -11.200 -1.845 27.088 1.00 0.00 H new ATOM 1598 N ALA A 105 -14.562 2.472 26.830 1.00 0.00 N ATOM 1599 CA ALA A 105 -14.934 3.752 27.504 1.00 0.00 C ATOM 1600 C ALA A 105 -14.723 4.933 26.553 1.00 0.00 C ATOM 1601 O ALA A 105 -13.625 5.064 26.039 1.00 0.00 O ATOM 1602 CB ALA A 105 -13.994 3.856 28.705 1.00 0.00 C ATOM 1603 OXT ALA A 105 -15.664 5.685 26.356 1.00 0.00 O ATOM 0 H ALA A 105 -13.744 2.524 26.222 1.00 0.00 H new ATOM 0 HA ALA A 105 -15.982 3.770 27.804 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -14.205 4.774 29.254 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -14.145 2.998 29.360 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -12.961 3.870 28.358 1.00 0.00 H new TER 1609 ALA A 105