USER MOD reduce.3.24.130724 H: found=0, std=0, add=1121, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1123 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 109 MET CE :methyl 174:sc= -1.75 (180deg=-1.2) USER MOD Set 1.2: A 124 MET CE :methyl -136:sc= -1.69 (180deg=-2.23!) USER MOD Set 1.3: M 18 LYS NZ :NH3+ -158:sc= -0.662 (180deg=-1.24) USER MOD Set 2.1: A 60 ASN : amide:sc= -0.972 K(o=-1.4,f=-12!) USER MOD Set 2.2: A 62 THR OG1 : rot -170:sc= -0.424 USER MOD Set 3.1: A 49 GLN : amide:sc= -0.739 X(o=-2.3,f=-2.5) USER MOD Set 3.2: A 53 ASN : amide:sc= -1.58 K(o=-2.3,f=-4!) USER MOD Single : A 8 GLN : amide:sc= -0.291 K(o=-0.29,f=-2.8!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 75:sc= 0.513 USER MOD Single : A 28 THR OG1 : rot -77:sc= 1.03 USER MOD Single : A 29 THR OG1 : rot 180:sc= -0.0179 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 68:sc= 1.26 USER MOD Single : A 36 MET CE :methyl -129:sc= -4.89 (180deg=-13.2!) USER MOD Single : A 38 SER OG : rot 86:sc= -4.1! USER MOD Single : A 41 GLN : amide:sc= -3.56 K(o=-3.6,f=-5.7!) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.524 USER MOD Single : A 51 MET CE :methyl -160:sc= -2.69! (180deg=-3.81!) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl 157:sc= -1.06 (180deg=-3.22!) USER MOD Single : A 72 MET CE :methyl 170:sc= -2.34 (180deg=-2.87!) USER MOD Single : A 94 LYS NZ :NH3+ -115:sc= -0.495 (180deg=-1.79!) USER MOD Single : A 97 ASN : amide:sc= -0.103 K(o=-0.1,f=-8.7!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= -0.043 USER MOD Single : A 107 HIS : no HD1:sc= -0.0217 X(o=-0.022,f=-0.35) USER MOD Single : A 110 THR OG1 : rot 80:sc= 1.17 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -0.545 K(o=-0.54,f=-1.2) USER MOD Single : A 137 ASN : amide:sc= -0.889 K(o=-0.89,f=-14!) USER MOD Single : A 138 TYR OH : rot 180:sc= -0.208 USER MOD Single : A 143 GLN : amide:sc= -1.75! C(o=-1.8!,f=-4.3!) USER MOD Single : A 144 MET CE :methyl 163:sc= -1.26 (180deg=-2.78!) USER MOD Single : A 145 MET CE :methyl -165:sc= -3.78 (180deg=-4.9!) USER MOD Single : A 146 THR OG1 : rot 70:sc= 1.22 USER MOD Single : M 15 LYS NZ :NH3+ 162:sc= -0.265 (180deg=-0.849) USER MOD Single : M 30 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0184) USER MOD Single : M 32 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0499) USER MOD Single : M 33 HIS : no HD1:sc= 0 X(o=0,f=-0.0023) USER MOD Single : M 38 SER OG : rot -136:sc= 1.44 USER MOD ----------------------------------------------------------------- ATOM 103 N GLN A 8 -16.599 -21.873 -1.054 1.00 4.45 N ATOM 104 CA GLN A 8 -15.306 -21.245 -0.804 1.00 15.40 C ATOM 105 C GLN A 8 -14.873 -20.399 -1.997 1.00 2.13 C ATOM 106 O GLN A 8 -14.475 -19.244 -1.839 1.00 71.22 O ATOM 107 CB GLN A 8 -14.248 -22.308 -0.506 1.00 10.12 C ATOM 108 CG GLN A 8 -12.916 -21.731 -0.054 1.00 52.30 C ATOM 109 CD GLN A 8 -12.966 -21.184 1.359 1.00 33.32 C ATOM 110 OE1 GLN A 8 -14.036 -21.086 1.962 1.00 63.14 O ATOM 111 NE2 GLN A 8 -11.806 -20.825 1.897 1.00 74.13 N ATOM 0 HA GLN A 8 -15.408 -20.592 0.063 1.00 15.40 H new ATOM 0 HB2 GLN A 8 -14.625 -22.978 0.267 1.00 10.12 H new ATOM 0 HB3 GLN A 8 -14.089 -22.911 -1.400 1.00 10.12 H new ATOM 0 HG2 GLN A 8 -12.151 -22.505 -0.113 1.00 52.30 H new ATOM 0 HG3 GLN A 8 -12.618 -20.935 -0.737 1.00 52.30 H new ATOM 0 HE21 GLN A 8 -10.943 -20.923 1.362 1.00 74.13 H new ATOM 0 HE22 GLN A 8 -11.778 -20.451 2.846 1.00 74.13 H new ATOM 120 N ILE A 9 -14.952 -20.981 -3.188 1.00 61.24 N ATOM 121 CA ILE A 9 -14.568 -20.280 -4.408 1.00 31.35 C ATOM 122 C ILE A 9 -15.498 -19.103 -4.681 1.00 75.51 C ATOM 123 O ILE A 9 -15.047 -17.997 -4.974 1.00 5.12 O ATOM 124 CB ILE A 9 -14.579 -21.223 -5.626 1.00 2.43 C ATOM 125 CG1 ILE A 9 -13.659 -22.420 -5.380 1.00 31.35 C ATOM 126 CG2 ILE A 9 -14.156 -20.472 -6.880 1.00 1.14 C ATOM 127 CD1 ILE A 9 -13.774 -23.497 -6.435 1.00 60.43 C ATOM 0 H ILE A 9 -15.278 -21.936 -3.335 1.00 61.24 H new ATOM 0 HA ILE A 9 -13.554 -19.910 -4.255 1.00 31.35 H new ATOM 0 HB ILE A 9 -15.594 -21.593 -5.772 1.00 2.43 H new ATOM 0 HG12 ILE A 9 -12.627 -22.072 -5.338 1.00 31.35 H new ATOM 0 HG13 ILE A 9 -13.890 -22.851 -4.406 1.00 31.35 H new ATOM 0 HG21 ILE A 9 -14.169 -21.151 -7.732 1.00 1.14 H new ATOM 0 HG22 ILE A 9 -14.847 -19.649 -7.062 1.00 1.14 H new ATOM 0 HG23 ILE A 9 -13.149 -20.077 -6.745 1.00 1.14 H new ATOM 0 HD11 ILE A 9 -13.094 -24.314 -6.196 1.00 60.43 H new ATOM 0 HD12 ILE A 9 -14.797 -23.873 -6.462 1.00 60.43 H new ATOM 0 HD13 ILE A 9 -13.515 -23.082 -7.409 1.00 60.43 H new ATOM 139 N ALA A 10 -16.801 -19.350 -4.582 1.00 24.12 N ATOM 140 CA ALA A 10 -17.795 -18.310 -4.815 1.00 20.13 C ATOM 141 C ALA A 10 -17.559 -17.111 -3.903 1.00 0.11 C ATOM 142 O ALA A 10 -17.931 -15.986 -4.234 1.00 53.20 O ATOM 143 CB ALA A 10 -19.197 -18.865 -4.608 1.00 42.44 C ATOM 0 H ALA A 10 -17.192 -20.261 -4.342 1.00 24.12 H new ATOM 0 HA ALA A 10 -17.698 -17.973 -5.847 1.00 20.13 H new ATOM 0 HB1 ALA A 10 -19.930 -18.078 -4.785 1.00 42.44 H new ATOM 0 HB2 ALA A 10 -19.370 -19.685 -5.305 1.00 42.44 H new ATOM 0 HB3 ALA A 10 -19.297 -19.230 -3.586 1.00 42.44 H new ATOM 149 N GLU A 11 -16.939 -17.360 -2.754 1.00 1.14 N ATOM 150 CA GLU A 11 -16.655 -16.299 -1.794 1.00 34.31 C ATOM 151 C GLU A 11 -15.551 -15.381 -2.309 1.00 12.52 C ATOM 152 O GLU A 11 -15.652 -14.157 -2.214 1.00 62.13 O ATOM 153 CB GLU A 11 -16.249 -16.897 -0.445 1.00 52.21 C ATOM 154 CG GLU A 11 -15.987 -15.854 0.628 1.00 1.14 C ATOM 155 CD GLU A 11 -15.649 -16.471 1.971 1.00 31.45 C ATOM 156 OE1 GLU A 11 -14.675 -17.250 2.039 1.00 0.42 O ATOM 157 OE2 GLU A 11 -16.359 -16.176 2.955 1.00 15.42 O ATOM 0 H GLU A 11 -16.624 -18.286 -2.465 1.00 1.14 H new ATOM 0 HA GLU A 11 -17.562 -15.709 -1.663 1.00 34.31 H new ATOM 0 HB2 GLU A 11 -17.037 -17.568 -0.103 1.00 52.21 H new ATOM 0 HB3 GLU A 11 -15.352 -17.501 -0.580 1.00 52.21 H new ATOM 0 HG2 GLU A 11 -15.166 -15.210 0.311 1.00 1.14 H new ATOM 0 HG3 GLU A 11 -16.867 -15.219 0.735 1.00 1.14 H new ATOM 164 N PHE A 12 -14.497 -15.979 -2.853 1.00 73.44 N ATOM 165 CA PHE A 12 -13.373 -15.216 -3.382 1.00 61.22 C ATOM 166 C PHE A 12 -13.727 -14.588 -4.727 1.00 5.41 C ATOM 167 O PHE A 12 -13.454 -13.411 -4.966 1.00 71.15 O ATOM 168 CB PHE A 12 -12.145 -16.116 -3.534 1.00 62.24 C ATOM 169 CG PHE A 12 -11.652 -16.682 -2.234 1.00 23.44 C ATOM 170 CD1 PHE A 12 -11.518 -15.873 -1.117 1.00 22.00 C ATOM 171 CD2 PHE A 12 -11.323 -18.024 -2.127 1.00 65.13 C ATOM 172 CE1 PHE A 12 -11.063 -16.392 0.081 1.00 55.51 C ATOM 173 CE2 PHE A 12 -10.868 -18.548 -0.932 1.00 31.32 C ATOM 174 CZ PHE A 12 -10.739 -17.731 0.174 1.00 54.00 C ATOM 0 H PHE A 12 -14.398 -16.990 -2.939 1.00 73.44 H new ATOM 0 HA PHE A 12 -13.144 -14.417 -2.677 1.00 61.22 H new ATOM 0 HB2 PHE A 12 -12.387 -16.936 -4.210 1.00 62.24 H new ATOM 0 HB3 PHE A 12 -11.342 -15.545 -4.000 1.00 62.24 H new ATOM 0 HD1 PHE A 12 -11.772 -14.825 -1.183 1.00 22.00 H new ATOM 0 HD2 PHE A 12 -11.423 -18.668 -2.988 1.00 65.13 H new ATOM 0 HE1 PHE A 12 -10.961 -15.750 0.944 1.00 55.51 H new ATOM 0 HE2 PHE A 12 -10.614 -19.595 -0.863 1.00 31.32 H new ATOM 0 HZ PHE A 12 -10.385 -18.139 1.110 1.00 54.00 H new ATOM 184 N LYS A 13 -14.335 -15.381 -5.602 1.00 41.12 N ATOM 185 CA LYS A 13 -14.727 -14.905 -6.923 1.00 54.42 C ATOM 186 C LYS A 13 -15.616 -13.670 -6.814 1.00 52.34 C ATOM 187 O LYS A 13 -15.667 -12.849 -7.730 1.00 12.24 O ATOM 188 CB LYS A 13 -15.461 -16.008 -7.689 1.00 30.23 C ATOM 189 CG LYS A 13 -16.082 -15.535 -8.992 1.00 30.14 C ATOM 190 CD LYS A 13 -16.852 -16.650 -9.679 1.00 52.13 C ATOM 191 CE LYS A 13 -15.966 -17.431 -10.637 1.00 23.42 C ATOM 192 NZ LYS A 13 -16.764 -18.282 -11.562 1.00 62.52 N ATOM 0 H LYS A 13 -14.567 -16.357 -5.420 1.00 41.12 H new ATOM 0 HA LYS A 13 -13.822 -14.634 -7.467 1.00 54.42 H new ATOM 0 HB2 LYS A 13 -14.762 -16.817 -7.902 1.00 30.23 H new ATOM 0 HB3 LYS A 13 -16.243 -16.422 -7.053 1.00 30.23 H new ATOM 0 HG2 LYS A 13 -16.751 -14.698 -8.794 1.00 30.14 H new ATOM 0 HG3 LYS A 13 -15.300 -15.168 -9.657 1.00 30.14 H new ATOM 0 HD2 LYS A 13 -17.263 -17.326 -8.929 1.00 52.13 H new ATOM 0 HD3 LYS A 13 -17.696 -16.228 -10.224 1.00 52.13 H new ATOM 0 HE2 LYS A 13 -15.357 -16.737 -11.216 1.00 23.42 H new ATOM 0 HE3 LYS A 13 -15.280 -18.058 -10.068 1.00 23.42 H new ATOM 0 HZ1 LYS A 13 -16.124 -18.798 -12.199 1.00 62.52 H new ATOM 0 HZ2 LYS A 13 -17.326 -18.962 -11.011 1.00 62.52 H new ATOM 0 HZ3 LYS A 13 -17.401 -17.682 -12.124 1.00 62.52 H new ATOM 206 N GLU A 14 -16.313 -13.545 -5.689 1.00 52.13 N ATOM 207 CA GLU A 14 -17.199 -12.409 -5.462 1.00 70.13 C ATOM 208 C GLU A 14 -16.397 -11.134 -5.216 1.00 71.34 C ATOM 209 O GLU A 14 -16.755 -10.061 -5.699 1.00 42.54 O ATOM 210 CB GLU A 14 -18.121 -12.683 -4.272 1.00 5.42 C ATOM 211 CG GLU A 14 -19.392 -13.427 -4.644 1.00 42.34 C ATOM 212 CD GLU A 14 -20.475 -12.504 -5.169 1.00 32.41 C ATOM 213 OE1 GLU A 14 -20.430 -11.297 -4.853 1.00 3.12 O ATOM 214 OE2 GLU A 14 -21.368 -12.989 -5.895 1.00 31.45 O ATOM 0 H GLU A 14 -16.281 -14.216 -4.921 1.00 52.13 H new ATOM 0 HA GLU A 14 -17.805 -12.269 -6.357 1.00 70.13 H new ATOM 0 HB2 GLU A 14 -17.576 -13.263 -3.527 1.00 5.42 H new ATOM 0 HB3 GLU A 14 -18.389 -11.735 -3.805 1.00 5.42 H new ATOM 0 HG2 GLU A 14 -19.161 -14.178 -5.400 1.00 42.34 H new ATOM 0 HG3 GLU A 14 -19.766 -13.960 -3.770 1.00 42.34 H new ATOM 221 N ALA A 15 -15.311 -11.262 -4.461 1.00 60.03 N ATOM 222 CA ALA A 15 -14.457 -10.122 -4.152 1.00 52.21 C ATOM 223 C ALA A 15 -13.887 -9.502 -5.423 1.00 72.14 C ATOM 224 O ALA A 15 -13.784 -8.281 -5.538 1.00 44.42 O ATOM 225 CB ALA A 15 -13.333 -10.543 -3.218 1.00 5.44 C ATOM 0 H ALA A 15 -15.002 -12.144 -4.052 1.00 60.03 H new ATOM 0 HA ALA A 15 -15.066 -9.368 -3.653 1.00 52.21 H new ATOM 0 HB1 ALA A 15 -12.703 -9.682 -2.996 1.00 5.44 H new ATOM 0 HB2 ALA A 15 -13.756 -10.932 -2.292 1.00 5.44 H new ATOM 0 HB3 ALA A 15 -12.733 -11.317 -3.696 1.00 5.44 H new ATOM 231 N PHE A 16 -13.518 -10.352 -6.376 1.00 40.32 N ATOM 232 CA PHE A 16 -12.957 -9.887 -7.639 1.00 65.13 C ATOM 233 C PHE A 16 -13.870 -8.855 -8.293 1.00 40.44 C ATOM 234 O PHE A 16 -13.431 -7.764 -8.659 1.00 63.41 O ATOM 235 CB PHE A 16 -12.738 -11.066 -8.589 1.00 75.44 C ATOM 236 CG PHE A 16 -12.018 -10.693 -9.853 1.00 41.22 C ATOM 237 CD1 PHE A 16 -12.722 -10.266 -10.968 1.00 31.43 C ATOM 238 CD2 PHE A 16 -10.636 -10.768 -9.927 1.00 34.52 C ATOM 239 CE1 PHE A 16 -12.062 -9.921 -12.132 1.00 71.42 C ATOM 240 CE2 PHE A 16 -9.971 -10.424 -11.088 1.00 60.53 C ATOM 241 CZ PHE A 16 -10.685 -10.002 -12.193 1.00 3.43 C ATOM 0 H PHE A 16 -13.597 -11.366 -6.297 1.00 40.32 H new ATOM 0 HA PHE A 16 -11.997 -9.415 -7.429 1.00 65.13 H new ATOM 0 HB2 PHE A 16 -12.169 -11.838 -8.071 1.00 75.44 H new ATOM 0 HB3 PHE A 16 -13.705 -11.500 -8.846 1.00 75.44 H new ATOM 0 HD1 PHE A 16 -13.799 -10.202 -10.927 1.00 31.43 H new ATOM 0 HD2 PHE A 16 -10.073 -11.099 -9.067 1.00 34.52 H new ATOM 0 HE1 PHE A 16 -12.623 -9.588 -12.993 1.00 71.42 H new ATOM 0 HE2 PHE A 16 -8.894 -10.485 -11.132 1.00 60.53 H new ATOM 0 HZ PHE A 16 -10.167 -9.736 -13.103 1.00 3.43 H new ATOM 251 N SER A 17 -15.143 -9.207 -8.438 1.00 35.01 N ATOM 252 CA SER A 17 -16.119 -8.314 -9.052 1.00 1.32 C ATOM 253 C SER A 17 -16.137 -6.961 -8.346 1.00 21.41 C ATOM 254 O SER A 17 -16.418 -5.931 -8.959 1.00 74.15 O ATOM 255 CB SER A 17 -17.513 -8.942 -9.011 1.00 54.42 C ATOM 256 OG SER A 17 -18.520 -7.962 -9.201 1.00 45.00 O ATOM 0 H SER A 17 -15.523 -10.105 -8.139 1.00 35.01 H new ATOM 0 HA SER A 17 -15.829 -8.158 -10.091 1.00 1.32 H new ATOM 0 HB2 SER A 17 -17.594 -9.706 -9.784 1.00 54.42 H new ATOM 0 HB3 SER A 17 -17.663 -9.441 -8.053 1.00 54.42 H new ATOM 0 HG SER A 17 -19.402 -8.389 -9.172 1.00 45.00 H new ATOM 262 N LEU A 18 -15.835 -6.973 -7.052 1.00 43.53 N ATOM 263 CA LEU A 18 -15.816 -5.747 -6.261 1.00 25.45 C ATOM 264 C LEU A 18 -14.696 -4.819 -6.721 1.00 15.20 C ATOM 265 O LEU A 18 -14.901 -3.615 -6.881 1.00 63.34 O ATOM 266 CB LEU A 18 -15.641 -6.078 -4.777 1.00 74.22 C ATOM 267 CG LEU A 18 -16.019 -4.970 -3.794 1.00 31.14 C ATOM 268 CD1 LEU A 18 -17.466 -4.546 -3.997 1.00 25.44 C ATOM 269 CD2 LEU A 18 -15.792 -5.429 -2.361 1.00 1.25 C ATOM 0 H LEU A 18 -15.600 -7.817 -6.529 1.00 43.53 H new ATOM 0 HA LEU A 18 -16.768 -5.236 -6.405 1.00 25.45 H new ATOM 0 HB2 LEU A 18 -16.241 -6.959 -4.549 1.00 74.22 H new ATOM 0 HB3 LEU A 18 -14.599 -6.348 -4.606 1.00 74.22 H new ATOM 0 HG LEU A 18 -15.380 -4.108 -3.984 1.00 31.14 H new ATOM 0 HD11 LEU A 18 -17.717 -3.757 -3.288 1.00 25.44 H new ATOM 0 HD12 LEU A 18 -17.598 -4.176 -5.014 1.00 25.44 H new ATOM 0 HD13 LEU A 18 -18.122 -5.401 -3.834 1.00 25.44 H new ATOM 0 HD21 LEU A 18 -16.066 -4.628 -1.675 1.00 1.25 H new ATOM 0 HD22 LEU A 18 -16.406 -6.307 -2.158 1.00 1.25 H new ATOM 0 HD23 LEU A 18 -14.741 -5.682 -2.222 1.00 1.25 H new ATOM 281 N PHE A 19 -13.514 -5.386 -6.934 1.00 61.31 N ATOM 282 CA PHE A 19 -12.362 -4.610 -7.378 1.00 11.44 C ATOM 283 C PHE A 19 -12.484 -4.252 -8.856 1.00 62.20 C ATOM 284 O PHE A 19 -11.925 -3.255 -9.313 1.00 3.13 O ATOM 285 CB PHE A 19 -11.069 -5.391 -7.135 1.00 72.20 C ATOM 286 CG PHE A 19 -10.630 -5.392 -5.699 1.00 3.02 C ATOM 287 CD1 PHE A 19 -11.149 -6.312 -4.802 1.00 52.21 C ATOM 288 CD2 PHE A 19 -9.697 -4.473 -5.245 1.00 61.34 C ATOM 289 CE1 PHE A 19 -10.747 -6.314 -3.480 1.00 30.01 C ATOM 290 CE2 PHE A 19 -9.291 -4.471 -3.924 1.00 65.13 C ATOM 291 CZ PHE A 19 -9.816 -5.393 -3.041 1.00 23.44 C ATOM 0 H PHE A 19 -13.328 -6.381 -6.806 1.00 61.31 H new ATOM 0 HA PHE A 19 -12.334 -3.686 -6.800 1.00 11.44 H new ATOM 0 HB2 PHE A 19 -11.209 -6.421 -7.465 1.00 72.20 H new ATOM 0 HB3 PHE A 19 -10.276 -4.965 -7.749 1.00 72.20 H new ATOM 0 HD1 PHE A 19 -11.876 -7.036 -5.140 1.00 52.21 H new ATOM 0 HD2 PHE A 19 -9.282 -3.750 -5.932 1.00 61.34 H new ATOM 0 HE1 PHE A 19 -11.160 -7.035 -2.791 1.00 30.01 H new ATOM 0 HE2 PHE A 19 -8.564 -3.749 -3.583 1.00 65.13 H new ATOM 0 HZ PHE A 19 -9.499 -5.394 -2.008 1.00 23.44 H new ATOM 301 N ASP A 20 -13.218 -5.074 -9.598 1.00 43.35 N ATOM 302 CA ASP A 20 -13.414 -4.845 -11.025 1.00 61.34 C ATOM 303 C ASP A 20 -14.458 -3.759 -11.263 1.00 50.12 C ATOM 304 O ASP A 20 -15.661 -4.018 -11.219 1.00 61.10 O ATOM 305 CB ASP A 20 -13.841 -6.141 -11.717 1.00 11.20 C ATOM 306 CG ASP A 20 -13.370 -6.212 -13.156 1.00 43.51 C ATOM 307 OD1 ASP A 20 -12.694 -5.263 -13.607 1.00 10.52 O ATOM 308 OD2 ASP A 20 -13.676 -7.216 -13.832 1.00 25.15 O ATOM 0 H ASP A 20 -13.687 -5.904 -9.235 1.00 43.35 H new ATOM 0 HA ASP A 20 -12.466 -4.511 -11.448 1.00 61.34 H new ATOM 0 HB2 ASP A 20 -13.443 -6.992 -11.165 1.00 11.20 H new ATOM 0 HB3 ASP A 20 -14.928 -6.223 -11.689 1.00 11.20 H new ATOM 313 N LYS A 21 -13.990 -2.541 -11.515 1.00 14.14 N ATOM 314 CA LYS A 21 -14.882 -1.414 -11.760 1.00 14.22 C ATOM 315 C LYS A 21 -15.621 -1.583 -13.083 1.00 54.34 C ATOM 316 O LYS A 21 -16.848 -1.488 -13.137 1.00 3.10 O ATOM 317 CB LYS A 21 -14.092 -0.104 -11.768 1.00 44.45 C ATOM 318 CG LYS A 21 -14.954 1.129 -11.558 1.00 31.34 C ATOM 319 CD LYS A 21 -15.271 1.342 -10.087 1.00 54.31 C ATOM 320 CE LYS A 21 -14.195 2.168 -9.399 1.00 31.22 C ATOM 321 NZ LYS A 21 -14.335 3.620 -9.696 1.00 15.33 N ATOM 0 H LYS A 21 -12.997 -2.309 -11.555 1.00 14.14 H new ATOM 0 HA LYS A 21 -15.617 -1.383 -10.955 1.00 14.22 H new ATOM 0 HB2 LYS A 21 -13.333 -0.143 -10.987 1.00 44.45 H new ATOM 0 HB3 LYS A 21 -13.567 -0.012 -12.719 1.00 44.45 H new ATOM 0 HG2 LYS A 21 -14.439 2.006 -11.951 1.00 31.34 H new ATOM 0 HG3 LYS A 21 -15.882 1.026 -12.120 1.00 31.34 H new ATOM 0 HD2 LYS A 21 -16.234 1.844 -9.990 1.00 54.31 H new ATOM 0 HD3 LYS A 21 -15.363 0.376 -9.590 1.00 54.31 H new ATOM 0 HE2 LYS A 21 -14.250 2.011 -8.322 1.00 31.22 H new ATOM 0 HE3 LYS A 21 -13.212 1.825 -9.721 1.00 31.22 H new ATOM 0 HZ1 LYS A 21 -13.583 4.148 -9.209 1.00 15.33 H new ATOM 0 HZ2 LYS A 21 -14.257 3.774 -10.722 1.00 15.33 H new ATOM 0 HZ3 LYS A 21 -15.263 3.954 -9.365 1.00 15.33 H new ATOM 335 N ASP A 22 -14.868 -1.835 -14.148 1.00 51.52 N ATOM 336 CA ASP A 22 -15.452 -2.019 -15.472 1.00 32.44 C ATOM 337 C ASP A 22 -16.023 -3.426 -15.622 1.00 31.01 C ATOM 338 O ASP A 22 -16.719 -3.724 -16.592 1.00 25.31 O ATOM 339 CB ASP A 22 -14.404 -1.762 -16.556 1.00 32.35 C ATOM 340 CG ASP A 22 -13.364 -2.863 -16.628 1.00 12.01 C ATOM 341 OD1 ASP A 22 -13.230 -3.618 -15.642 1.00 63.43 O ATOM 342 OD2 ASP A 22 -12.685 -2.970 -17.670 1.00 53.53 O ATOM 0 H ASP A 22 -13.852 -1.917 -14.121 1.00 51.52 H new ATOM 0 HA ASP A 22 -16.265 -1.302 -15.587 1.00 32.44 H new ATOM 0 HB2 ASP A 22 -14.900 -1.671 -17.522 1.00 32.35 H new ATOM 0 HB3 ASP A 22 -13.909 -0.811 -16.361 1.00 32.35 H new ATOM 347 N GLY A 23 -15.723 -4.288 -14.655 1.00 1.22 N ATOM 348 CA GLY A 23 -16.213 -5.653 -14.699 1.00 50.02 C ATOM 349 C GLY A 23 -15.902 -6.338 -16.015 1.00 22.20 C ATOM 350 O GLY A 23 -16.746 -7.041 -16.572 1.00 3.24 O ATOM 0 H GLY A 23 -15.149 -4.065 -13.842 1.00 1.22 H new ATOM 0 HA2 GLY A 23 -15.768 -6.222 -13.883 1.00 50.02 H new ATOM 0 HA3 GLY A 23 -17.291 -5.654 -14.538 1.00 50.02 H new ATOM 354 N ASP A 24 -14.688 -6.133 -16.514 1.00 51.25 N ATOM 355 CA ASP A 24 -14.268 -6.736 -17.774 1.00 5.40 C ATOM 356 C ASP A 24 -13.657 -8.114 -17.540 1.00 1.24 C ATOM 357 O ASP A 24 -13.503 -8.903 -18.471 1.00 54.41 O ATOM 358 CB ASP A 24 -13.259 -5.832 -18.485 1.00 53.30 C ATOM 359 CG ASP A 24 -11.941 -5.737 -17.742 1.00 34.24 C ATOM 360 OD1 ASP A 24 -11.955 -5.822 -16.496 1.00 13.15 O ATOM 361 OD2 ASP A 24 -10.896 -5.579 -18.406 1.00 30.51 O ATOM 0 H ASP A 24 -13.978 -5.554 -16.066 1.00 51.25 H new ATOM 0 HA ASP A 24 -15.149 -6.851 -18.405 1.00 5.40 H new ATOM 0 HB2 ASP A 24 -13.079 -6.214 -19.490 1.00 53.30 H new ATOM 0 HB3 ASP A 24 -13.684 -4.834 -18.594 1.00 53.30 H new ATOM 366 N GLY A 25 -13.309 -8.397 -16.288 1.00 12.43 N ATOM 367 CA GLY A 25 -12.718 -9.679 -15.954 1.00 32.24 C ATOM 368 C GLY A 25 -11.225 -9.584 -15.709 1.00 13.50 C ATOM 369 O GLY A 25 -10.520 -10.593 -15.720 1.00 31.14 O ATOM 0 H GLY A 25 -13.426 -7.761 -15.499 1.00 12.43 H new ATOM 0 HA2 GLY A 25 -13.204 -10.079 -15.064 1.00 32.24 H new ATOM 0 HA3 GLY A 25 -12.906 -10.384 -16.764 1.00 32.24 H new ATOM 373 N THR A 26 -10.740 -8.365 -15.489 1.00 61.52 N ATOM 374 CA THR A 26 -9.321 -8.141 -15.244 1.00 1.01 C ATOM 375 C THR A 26 -9.097 -6.867 -14.437 1.00 52.14 C ATOM 376 O THR A 26 -9.634 -5.809 -14.768 1.00 75.53 O ATOM 377 CB THR A 26 -8.531 -8.045 -16.563 1.00 31.42 C ATOM 378 OG1 THR A 26 -9.370 -7.524 -17.600 1.00 1.25 O ATOM 379 CG2 THR A 26 -7.997 -9.409 -16.974 1.00 21.23 C ATOM 0 H THR A 26 -11.309 -7.519 -15.476 1.00 61.52 H new ATOM 0 HA THR A 26 -8.960 -8.997 -14.674 1.00 1.01 H new ATOM 0 HB THR A 26 -7.687 -7.373 -16.407 1.00 31.42 H new ATOM 0 HG1 THR A 26 -9.490 -6.560 -17.470 1.00 1.25 H new ATOM 0 HG21 THR A 26 -7.443 -9.316 -17.908 1.00 21.23 H new ATOM 0 HG22 THR A 26 -7.336 -9.790 -16.196 1.00 21.23 H new ATOM 0 HG23 THR A 26 -8.829 -10.099 -17.113 1.00 21.23 H new ATOM 387 N ILE A 27 -8.301 -6.974 -13.379 1.00 32.41 N ATOM 388 CA ILE A 27 -8.006 -5.829 -12.527 1.00 24.53 C ATOM 389 C ILE A 27 -6.783 -5.070 -13.031 1.00 21.35 C ATOM 390 O ILE A 27 -5.702 -5.641 -13.182 1.00 51.02 O ATOM 391 CB ILE A 27 -7.763 -6.261 -11.068 1.00 61.03 C ATOM 392 CG1 ILE A 27 -8.875 -7.202 -10.600 1.00 40.11 C ATOM 393 CG2 ILE A 27 -7.677 -5.042 -10.162 1.00 41.35 C ATOM 394 CD1 ILE A 27 -8.671 -7.727 -9.196 1.00 62.34 C ATOM 0 H ILE A 27 -7.849 -7.842 -13.091 1.00 32.41 H new ATOM 0 HA ILE A 27 -8.877 -5.175 -12.564 1.00 24.53 H new ATOM 0 HB ILE A 27 -6.815 -6.796 -11.016 1.00 61.03 H new ATOM 0 HG12 ILE A 27 -9.829 -6.676 -10.648 1.00 40.11 H new ATOM 0 HG13 ILE A 27 -8.941 -8.045 -11.288 1.00 40.11 H new ATOM 0 HG21 ILE A 27 -7.505 -5.364 -9.135 1.00 41.35 H new ATOM 0 HG22 ILE A 27 -6.853 -4.406 -10.486 1.00 41.35 H new ATOM 0 HG23 ILE A 27 -8.611 -4.482 -10.216 1.00 41.35 H new ATOM 0 HD11 ILE A 27 -9.497 -8.387 -8.931 1.00 62.34 H new ATOM 0 HD12 ILE A 27 -7.734 -8.281 -9.147 1.00 62.34 H new ATOM 0 HD13 ILE A 27 -8.635 -6.892 -8.497 1.00 62.34 H new ATOM 406 N THR A 28 -6.960 -3.778 -13.287 1.00 42.15 N ATOM 407 CA THR A 28 -5.871 -2.939 -13.773 1.00 75.24 C ATOM 408 C THR A 28 -5.239 -2.145 -12.636 1.00 74.10 C ATOM 409 O THR A 28 -5.623 -2.291 -11.475 1.00 5.43 O ATOM 410 CB THR A 28 -6.358 -1.961 -14.859 1.00 41.21 C ATOM 411 OG1 THR A 28 -7.254 -1.001 -14.288 1.00 5.33 O ATOM 412 CG2 THR A 28 -7.057 -2.707 -15.986 1.00 11.44 C ATOM 0 H THR A 28 -7.847 -3.289 -13.166 1.00 42.15 H new ATOM 0 HA THR A 28 -5.125 -3.607 -14.204 1.00 75.24 H new ATOM 0 HB THR A 28 -5.489 -1.447 -15.269 1.00 41.21 H new ATOM 0 HG1 THR A 28 -8.132 -1.414 -14.152 1.00 5.33 H new ATOM 0 HG21 THR A 28 -7.392 -1.995 -16.741 1.00 11.44 H new ATOM 0 HG22 THR A 28 -6.363 -3.416 -16.438 1.00 11.44 H new ATOM 0 HG23 THR A 28 -7.917 -3.245 -15.588 1.00 11.44 H new ATOM 420 N THR A 29 -4.268 -1.303 -12.976 1.00 74.14 N ATOM 421 CA THR A 29 -3.583 -0.486 -11.984 1.00 3.35 C ATOM 422 C THR A 29 -4.491 0.622 -11.461 1.00 23.52 C ATOM 423 O THR A 29 -4.487 0.931 -10.269 1.00 51.22 O ATOM 424 CB THR A 29 -2.303 0.146 -12.563 1.00 1.11 C ATOM 425 OG1 THR A 29 -2.642 1.085 -13.589 1.00 44.34 O ATOM 426 CG2 THR A 29 -1.381 -0.923 -13.131 1.00 0.45 C ATOM 0 H THR A 29 -3.939 -1.170 -13.932 1.00 74.14 H new ATOM 0 HA THR A 29 -3.313 -1.149 -11.162 1.00 3.35 H new ATOM 0 HB THR A 29 -1.782 0.662 -11.757 1.00 1.11 H new ATOM 0 HG1 THR A 29 -1.823 1.484 -13.951 1.00 44.34 H new ATOM 0 HG21 THR A 29 -0.484 -0.453 -13.534 1.00 0.45 H new ATOM 0 HG22 THR A 29 -1.102 -1.620 -12.341 1.00 0.45 H new ATOM 0 HG23 THR A 29 -1.896 -1.463 -13.926 1.00 0.45 H new ATOM 434 N LYS A 30 -5.269 1.215 -12.359 1.00 41.51 N ATOM 435 CA LYS A 30 -6.185 2.288 -11.989 1.00 21.21 C ATOM 436 C LYS A 30 -7.326 1.756 -11.128 1.00 72.42 C ATOM 437 O LYS A 30 -7.621 2.303 -10.066 1.00 75.14 O ATOM 438 CB LYS A 30 -6.748 2.961 -13.243 1.00 35.44 C ATOM 439 CG LYS A 30 -5.787 3.942 -13.891 1.00 31.14 C ATOM 440 CD LYS A 30 -5.549 5.155 -13.007 1.00 53.34 C ATOM 441 CE LYS A 30 -4.966 6.316 -13.799 1.00 75.45 C ATOM 442 NZ LYS A 30 -4.345 7.337 -12.911 1.00 63.44 N ATOM 0 H LYS A 30 -5.284 0.971 -13.349 1.00 41.51 H new ATOM 0 HA LYS A 30 -5.628 3.024 -11.409 1.00 21.21 H new ATOM 0 HB2 LYS A 30 -7.014 2.193 -13.969 1.00 35.44 H new ATOM 0 HB3 LYS A 30 -7.668 3.485 -12.982 1.00 35.44 H new ATOM 0 HG2 LYS A 30 -4.838 3.445 -14.091 1.00 31.14 H new ATOM 0 HG3 LYS A 30 -6.187 4.264 -14.852 1.00 31.14 H new ATOM 0 HD2 LYS A 30 -6.489 5.462 -12.548 1.00 53.34 H new ATOM 0 HD3 LYS A 30 -4.870 4.889 -12.197 1.00 53.34 H new ATOM 0 HE2 LYS A 30 -4.219 5.940 -14.498 1.00 75.45 H new ATOM 0 HE3 LYS A 30 -5.752 6.782 -14.393 1.00 75.45 H new ATOM 0 HZ1 LYS A 30 -3.960 8.111 -13.489 1.00 63.44 H new ATOM 0 HZ2 LYS A 30 -5.063 7.715 -12.261 1.00 63.44 H new ATOM 0 HZ3 LYS A 30 -3.578 6.899 -12.362 1.00 63.44 H new ATOM 456 N GLU A 31 -7.963 0.685 -11.593 1.00 64.00 N ATOM 457 CA GLU A 31 -9.071 0.080 -10.864 1.00 61.40 C ATOM 458 C GLU A 31 -8.628 -0.368 -9.474 1.00 61.00 C ATOM 459 O GLU A 31 -9.369 -0.232 -8.500 1.00 34.22 O ATOM 460 CB GLU A 31 -9.631 -1.113 -11.642 1.00 22.44 C ATOM 461 CG GLU A 31 -10.555 -0.718 -12.781 1.00 15.45 C ATOM 462 CD GLU A 31 -10.611 -1.764 -13.877 1.00 52.40 C ATOM 463 OE1 GLU A 31 -9.619 -2.505 -14.040 1.00 33.03 O ATOM 464 OE2 GLU A 31 -11.646 -1.841 -14.572 1.00 45.32 O ATOM 0 H GLU A 31 -7.731 0.219 -12.470 1.00 64.00 H new ATOM 0 HA GLU A 31 -9.853 0.832 -10.753 1.00 61.40 H new ATOM 0 HB2 GLU A 31 -8.802 -1.695 -12.044 1.00 22.44 H new ATOM 0 HB3 GLU A 31 -10.173 -1.762 -10.954 1.00 22.44 H new ATOM 0 HG2 GLU A 31 -11.559 -0.554 -12.389 1.00 15.45 H new ATOM 0 HG3 GLU A 31 -10.219 0.229 -13.204 1.00 15.45 H new ATOM 471 N LEU A 32 -7.415 -0.903 -9.390 1.00 42.20 N ATOM 472 CA LEU A 32 -6.872 -1.372 -8.120 1.00 4.31 C ATOM 473 C LEU A 32 -6.462 -0.198 -7.236 1.00 53.21 C ATOM 474 O LEU A 32 -6.926 -0.069 -6.104 1.00 4.22 O ATOM 475 CB LEU A 32 -5.669 -2.285 -8.363 1.00 71.31 C ATOM 476 CG LEU A 32 -5.337 -3.271 -7.242 1.00 75.01 C ATOM 477 CD1 LEU A 32 -4.291 -4.273 -7.704 1.00 43.44 C ATOM 478 CD2 LEU A 32 -4.857 -2.528 -6.004 1.00 34.44 C ATOM 0 H LEU A 32 -6.789 -1.023 -10.186 1.00 42.20 H new ATOM 0 HA LEU A 32 -7.651 -1.936 -7.607 1.00 4.31 H new ATOM 0 HB2 LEU A 32 -5.847 -2.852 -9.277 1.00 71.31 H new ATOM 0 HB3 LEU A 32 -4.794 -1.660 -8.541 1.00 71.31 H new ATOM 0 HG LEU A 32 -6.244 -3.818 -6.985 1.00 75.01 H new ATOM 0 HD11 LEU A 32 -4.068 -4.966 -6.893 1.00 43.44 H new ATOM 0 HD12 LEU A 32 -4.672 -4.828 -8.561 1.00 43.44 H new ATOM 0 HD13 LEU A 32 -3.382 -3.744 -7.990 1.00 43.44 H new ATOM 0 HD21 LEU A 32 -4.625 -3.245 -5.216 1.00 34.44 H new ATOM 0 HD22 LEU A 32 -3.962 -1.955 -6.248 1.00 34.44 H new ATOM 0 HD23 LEU A 32 -5.639 -1.851 -5.660 1.00 34.44 H new ATOM 490 N GLY A 33 -5.592 0.658 -7.763 1.00 63.02 N ATOM 491 CA GLY A 33 -5.136 1.811 -7.009 1.00 53.55 C ATOM 492 C GLY A 33 -6.284 2.633 -6.457 1.00 31.24 C ATOM 493 O GLY A 33 -6.259 3.048 -5.297 1.00 74.14 O ATOM 0 H GLY A 33 -5.195 0.574 -8.699 1.00 63.02 H new ATOM 0 HA2 GLY A 33 -4.504 1.477 -6.186 1.00 53.55 H new ATOM 0 HA3 GLY A 33 -4.518 2.440 -7.650 1.00 53.55 H new ATOM 497 N THR A 34 -7.294 2.871 -7.288 1.00 31.51 N ATOM 498 CA THR A 34 -8.455 3.650 -6.877 1.00 42.20 C ATOM 499 C THR A 34 -9.114 3.046 -5.642 1.00 60.04 C ATOM 500 O THR A 34 -9.426 3.753 -4.684 1.00 61.10 O ATOM 501 CB THR A 34 -9.497 3.744 -8.007 1.00 50.24 C ATOM 502 OG1 THR A 34 -8.916 4.366 -9.159 1.00 12.42 O ATOM 503 CG2 THR A 34 -10.715 4.537 -7.556 1.00 65.02 C ATOM 0 H THR A 34 -7.331 2.535 -8.250 1.00 31.51 H new ATOM 0 HA THR A 34 -8.096 4.651 -6.640 1.00 42.20 H new ATOM 0 HB THR A 34 -9.816 2.733 -8.262 1.00 50.24 H new ATOM 0 HG1 THR A 34 -8.237 3.773 -9.543 1.00 12.42 H new ATOM 0 HG21 THR A 34 -11.437 4.590 -8.371 1.00 65.02 H new ATOM 0 HG22 THR A 34 -11.172 4.045 -6.698 1.00 65.02 H new ATOM 0 HG23 THR A 34 -10.410 5.545 -7.276 1.00 65.02 H new ATOM 511 N VAL A 35 -9.323 1.734 -5.671 1.00 72.43 N ATOM 512 CA VAL A 35 -9.944 1.034 -4.553 1.00 70.41 C ATOM 513 C VAL A 35 -9.089 1.139 -3.296 1.00 3.34 C ATOM 514 O VAL A 35 -9.578 1.514 -2.230 1.00 65.40 O ATOM 515 CB VAL A 35 -10.175 -0.454 -4.880 1.00 43.34 C ATOM 516 CG1 VAL A 35 -10.791 -1.173 -3.690 1.00 73.04 C ATOM 517 CG2 VAL A 35 -11.053 -0.597 -6.114 1.00 63.42 C ATOM 0 H VAL A 35 -9.071 1.134 -6.457 1.00 72.43 H new ATOM 0 HA VAL A 35 -10.907 1.513 -4.376 1.00 70.41 H new ATOM 0 HB VAL A 35 -9.211 -0.916 -5.093 1.00 43.34 H new ATOM 0 HG11 VAL A 35 -10.947 -2.222 -3.940 1.00 73.04 H new ATOM 0 HG12 VAL A 35 -10.121 -1.099 -2.834 1.00 73.04 H new ATOM 0 HG13 VAL A 35 -11.748 -0.713 -3.442 1.00 73.04 H new ATOM 0 HG21 VAL A 35 -11.206 -1.654 -6.331 1.00 63.42 H new ATOM 0 HG22 VAL A 35 -12.016 -0.121 -5.932 1.00 63.42 H new ATOM 0 HG23 VAL A 35 -10.566 -0.119 -6.964 1.00 63.42 H new ATOM 527 N MET A 36 -7.809 0.807 -3.428 1.00 4.34 N ATOM 528 CA MET A 36 -6.884 0.867 -2.301 1.00 70.34 C ATOM 529 C MET A 36 -6.942 2.231 -1.622 1.00 32.04 C ATOM 530 O MET A 36 -6.782 2.336 -0.406 1.00 0.15 O ATOM 531 CB MET A 36 -5.457 0.578 -2.770 1.00 64.11 C ATOM 532 CG MET A 36 -5.112 -0.902 -2.791 1.00 25.33 C ATOM 533 SD MET A 36 -3.391 -1.208 -3.234 1.00 62.31 S ATOM 534 CE MET A 36 -2.676 -1.519 -1.622 1.00 22.24 C ATOM 0 H MET A 36 -7.389 0.494 -4.303 1.00 4.34 H new ATOM 0 HA MET A 36 -7.182 0.108 -1.577 1.00 70.34 H new ATOM 0 HB2 MET A 36 -5.322 0.988 -3.771 1.00 64.11 H new ATOM 0 HB3 MET A 36 -4.756 1.097 -2.116 1.00 64.11 H new ATOM 0 HG2 MET A 36 -5.312 -1.332 -1.810 1.00 25.33 H new ATOM 0 HG3 MET A 36 -5.762 -1.413 -3.501 1.00 25.33 H new ATOM 0 HE1 MET A 36 -1.793 -0.894 -1.489 1.00 22.24 H new ATOM 0 HE2 MET A 36 -3.407 -1.284 -0.848 1.00 22.24 H new ATOM 0 HE3 MET A 36 -2.392 -2.569 -1.546 1.00 22.24 H new ATOM 544 N ARG A 37 -7.172 3.273 -2.414 1.00 70.22 N ATOM 545 CA ARG A 37 -7.250 4.630 -1.888 1.00 44.33 C ATOM 546 C ARG A 37 -8.324 4.735 -0.810 1.00 23.15 C ATOM 547 O ARG A 37 -8.054 5.173 0.309 1.00 41.23 O ATOM 548 CB ARG A 37 -7.546 5.621 -3.016 1.00 31.40 C ATOM 549 CG ARG A 37 -7.460 7.076 -2.587 1.00 2.13 C ATOM 550 CD ARG A 37 -7.672 8.017 -3.762 1.00 51.22 C ATOM 551 NE ARG A 37 -7.597 9.419 -3.361 1.00 50.52 N ATOM 552 CZ ARG A 37 -6.454 10.075 -3.192 1.00 53.55 C ATOM 553 NH1 ARG A 37 -5.297 9.459 -3.389 1.00 50.35 N ATOM 554 NH2 ARG A 37 -6.468 11.351 -2.826 1.00 62.25 N ATOM 0 H ARG A 37 -7.308 3.203 -3.423 1.00 70.22 H new ATOM 0 HA ARG A 37 -6.286 4.875 -1.441 1.00 44.33 H new ATOM 0 HB2 ARG A 37 -6.844 5.450 -3.832 1.00 31.40 H new ATOM 0 HB3 ARG A 37 -8.544 5.425 -3.408 1.00 31.40 H new ATOM 0 HG2 ARG A 37 -8.209 7.275 -1.820 1.00 2.13 H new ATOM 0 HG3 ARG A 37 -6.485 7.267 -2.138 1.00 2.13 H new ATOM 0 HD2 ARG A 37 -6.921 7.818 -4.526 1.00 51.22 H new ATOM 0 HD3 ARG A 37 -8.645 7.820 -4.213 1.00 51.22 H new ATOM 0 HE ARG A 37 -8.470 9.922 -3.202 1.00 50.52 H new ATOM 0 HH11 ARG A 37 -5.283 8.479 -3.671 1.00 50.35 H new ATOM 0 HH12 ARG A 37 -4.421 9.965 -3.259 1.00 50.35 H new ATOM 0 HH21 ARG A 37 -7.357 11.828 -2.674 1.00 62.25 H new ATOM 0 HH22 ARG A 37 -5.590 11.854 -2.696 1.00 62.25 H new ATOM 568 N SER A 38 -9.542 4.330 -1.154 1.00 31.15 N ATOM 569 CA SER A 38 -10.658 4.382 -0.216 1.00 40.13 C ATOM 570 C SER A 38 -10.382 3.512 1.006 1.00 4.44 C ATOM 571 O SER A 38 -10.911 3.759 2.091 1.00 4.30 O ATOM 572 CB SER A 38 -11.948 3.925 -0.900 1.00 41.13 C ATOM 573 OG SER A 38 -12.858 3.379 0.039 1.00 5.22 O ATOM 0 H SER A 38 -9.782 3.962 -2.075 1.00 31.15 H new ATOM 0 HA SER A 38 -10.775 5.414 0.114 1.00 40.13 H new ATOM 0 HB2 SER A 38 -12.411 4.769 -1.411 1.00 41.13 H new ATOM 0 HB3 SER A 38 -11.715 3.180 -1.661 1.00 41.13 H new ATOM 0 HG SER A 38 -13.390 4.100 0.436 1.00 5.22 H new ATOM 579 N LEU A 39 -9.549 2.493 0.823 1.00 14.24 N ATOM 580 CA LEU A 39 -9.201 1.585 1.911 1.00 52.13 C ATOM 581 C LEU A 39 -8.139 2.201 2.815 1.00 24.23 C ATOM 582 O LEU A 39 -7.957 1.775 3.955 1.00 4.21 O ATOM 583 CB LEU A 39 -8.700 0.254 1.349 1.00 62.33 C ATOM 584 CG LEU A 39 -9.673 -0.502 0.443 1.00 41.54 C ATOM 585 CD1 LEU A 39 -9.087 -1.844 0.032 1.00 54.54 C ATOM 586 CD2 LEU A 39 -11.012 -0.693 1.140 1.00 42.20 C ATOM 0 H LEU A 39 -9.102 2.275 -0.068 1.00 14.24 H new ATOM 0 HA LEU A 39 -10.098 1.407 2.505 1.00 52.13 H new ATOM 0 HB2 LEU A 39 -7.784 0.441 0.789 1.00 62.33 H new ATOM 0 HB3 LEU A 39 -8.436 -0.394 2.185 1.00 62.33 H new ATOM 0 HG LEU A 39 -9.836 0.091 -0.457 1.00 41.54 H new ATOM 0 HD11 LEU A 39 -9.793 -2.368 -0.612 1.00 54.54 H new ATOM 0 HD12 LEU A 39 -8.154 -1.684 -0.508 1.00 54.54 H new ATOM 0 HD13 LEU A 39 -8.893 -2.444 0.921 1.00 54.54 H new ATOM 0 HD21 LEU A 39 -11.692 -1.233 0.481 1.00 42.20 H new ATOM 0 HD22 LEU A 39 -10.867 -1.264 2.057 1.00 42.20 H new ATOM 0 HD23 LEU A 39 -11.438 0.281 1.382 1.00 42.20 H new ATOM 598 N GLY A 40 -7.440 3.208 2.299 1.00 71.40 N ATOM 599 CA GLY A 40 -6.406 3.867 3.074 1.00 2.33 C ATOM 600 C GLY A 40 -5.012 3.412 2.688 1.00 35.03 C ATOM 601 O GLY A 40 -4.099 3.422 3.513 1.00 33.12 O ATOM 0 H GLY A 40 -7.572 3.579 1.358 1.00 71.40 H new ATOM 0 HA2 GLY A 40 -6.484 4.945 2.935 1.00 2.33 H new ATOM 0 HA3 GLY A 40 -6.569 3.669 4.133 1.00 2.33 H new ATOM 605 N GLN A 41 -4.850 3.011 1.432 1.00 63.53 N ATOM 606 CA GLN A 41 -3.558 2.547 0.940 1.00 43.13 C ATOM 607 C GLN A 41 -3.173 3.272 -0.346 1.00 72.41 C ATOM 608 O GLN A 41 -3.735 3.010 -1.409 1.00 1.11 O ATOM 609 CB GLN A 41 -3.592 1.037 0.698 1.00 53.15 C ATOM 610 CG GLN A 41 -2.259 0.351 0.945 1.00 63.33 C ATOM 611 CD GLN A 41 -2.418 -1.064 1.465 1.00 32.23 C ATOM 612 OE1 GLN A 41 -3.447 -1.412 2.045 1.00 72.30 O ATOM 613 NE2 GLN A 41 -1.398 -1.889 1.261 1.00 61.13 N ATOM 0 H GLN A 41 -5.596 2.998 0.737 1.00 63.53 H new ATOM 0 HA GLN A 41 -2.808 2.769 1.699 1.00 43.13 H new ATOM 0 HB2 GLN A 41 -4.346 0.591 1.346 1.00 53.15 H new ATOM 0 HB3 GLN A 41 -3.903 0.849 -0.330 1.00 53.15 H new ATOM 0 HG2 GLN A 41 -1.688 0.331 0.017 1.00 63.33 H new ATOM 0 HG3 GLN A 41 -1.682 0.935 1.662 1.00 63.33 H new ATOM 0 HE21 GLN A 41 -0.564 -1.559 0.776 1.00 61.13 H new ATOM 0 HE22 GLN A 41 -1.448 -2.853 1.590 1.00 61.13 H new ATOM 622 N ASN A 42 -2.212 4.184 -0.241 1.00 32.41 N ATOM 623 CA ASN A 42 -1.753 4.947 -1.396 1.00 31.12 C ATOM 624 C ASN A 42 -0.344 4.525 -1.801 1.00 40.32 C ATOM 625 O ASN A 42 0.640 5.213 -1.527 1.00 54.44 O ATOM 626 CB ASN A 42 -1.780 6.445 -1.087 1.00 12.14 C ATOM 627 CG ASN A 42 -1.757 7.295 -2.342 1.00 53.03 C ATOM 628 OD1 ASN A 42 -0.748 7.924 -2.661 1.00 71.24 O ATOM 629 ND2 ASN A 42 -2.873 7.318 -3.062 1.00 33.34 N ATOM 0 H ASN A 42 -1.736 4.413 0.632 1.00 32.41 H new ATOM 0 HA ASN A 42 -2.428 4.742 -2.227 1.00 31.12 H new ATOM 0 HB2 ASN A 42 -2.675 6.678 -0.510 1.00 12.14 H new ATOM 0 HB3 ASN A 42 -0.923 6.700 -0.463 1.00 12.14 H new ATOM 0 HD21 ASN A 42 -2.917 7.873 -3.917 1.00 33.34 H new ATOM 0 HD22 ASN A 42 -3.686 6.781 -2.760 1.00 33.34 H new ATOM 636 N PRO A 43 -0.242 3.367 -2.470 1.00 53.22 N ATOM 637 CA PRO A 43 1.041 2.828 -2.929 1.00 4.11 C ATOM 638 C PRO A 43 1.643 3.650 -4.064 1.00 32.40 C ATOM 639 O PRO A 43 0.936 4.384 -4.755 1.00 43.14 O ATOM 640 CB PRO A 43 0.681 1.423 -3.418 1.00 44.02 C ATOM 641 CG PRO A 43 -0.760 1.507 -3.785 1.00 11.24 C ATOM 642 CD PRO A 43 -1.373 2.495 -2.831 1.00 2.21 C ATOM 0 HA PRO A 43 1.793 2.840 -2.140 1.00 4.11 H new ATOM 0 HB2 PRO A 43 1.291 1.133 -4.274 1.00 44.02 H new ATOM 0 HB3 PRO A 43 0.849 0.678 -2.640 1.00 44.02 H new ATOM 0 HG2 PRO A 43 -0.881 1.835 -4.818 1.00 11.24 H new ATOM 0 HG3 PRO A 43 -1.242 0.533 -3.701 1.00 11.24 H new ATOM 0 HD2 PRO A 43 -2.181 3.058 -3.299 1.00 2.21 H new ATOM 0 HD3 PRO A 43 -1.794 2.000 -1.956 1.00 2.21 H new ATOM 650 N THR A 44 2.953 3.521 -4.252 1.00 13.11 N ATOM 651 CA THR A 44 3.649 4.252 -5.303 1.00 4.22 C ATOM 652 C THR A 44 3.399 3.623 -6.669 1.00 11.53 C ATOM 653 O THR A 44 3.010 2.460 -6.764 1.00 52.11 O ATOM 654 CB THR A 44 5.167 4.300 -5.043 1.00 32.14 C ATOM 655 OG1 THR A 44 5.696 2.971 -4.983 1.00 73.51 O ATOM 656 CG2 THR A 44 5.470 5.031 -3.743 1.00 64.44 C ATOM 0 H THR A 44 3.553 2.917 -3.690 1.00 13.11 H new ATOM 0 HA THR A 44 3.254 5.268 -5.296 1.00 4.22 H new ATOM 0 HB THR A 44 5.637 4.841 -5.864 1.00 32.14 H new ATOM 0 HG1 THR A 44 6.661 3.010 -4.819 1.00 73.51 H new ATOM 0 HG21 THR A 44 6.548 5.052 -3.580 1.00 64.44 H new ATOM 0 HG22 THR A 44 5.092 6.051 -3.803 1.00 64.44 H new ATOM 0 HG23 THR A 44 4.988 4.513 -2.914 1.00 64.44 H new ATOM 664 N GLU A 45 3.625 4.401 -7.723 1.00 64.43 N ATOM 665 CA GLU A 45 3.424 3.918 -9.084 1.00 73.14 C ATOM 666 C GLU A 45 4.165 2.603 -9.311 1.00 14.21 C ATOM 667 O GLU A 45 3.657 1.698 -9.972 1.00 15.11 O ATOM 668 CB GLU A 45 3.898 4.964 -10.096 1.00 34.24 C ATOM 669 CG GLU A 45 2.831 5.982 -10.464 1.00 21.44 C ATOM 670 CD GLU A 45 3.032 6.561 -11.850 1.00 54.25 C ATOM 671 OE1 GLU A 45 3.519 5.828 -12.736 1.00 32.12 O ATOM 672 OE2 GLU A 45 2.700 7.749 -12.050 1.00 25.21 O ATOM 0 H GLU A 45 3.947 5.367 -7.661 1.00 64.43 H new ATOM 0 HA GLU A 45 2.357 3.743 -9.225 1.00 73.14 H new ATOM 0 HB2 GLU A 45 4.762 5.488 -9.687 1.00 34.24 H new ATOM 0 HB3 GLU A 45 4.232 4.457 -11.001 1.00 34.24 H new ATOM 0 HG2 GLU A 45 1.850 5.510 -10.410 1.00 21.44 H new ATOM 0 HG3 GLU A 45 2.837 6.790 -9.732 1.00 21.44 H new ATOM 679 N ALA A 46 5.369 2.507 -8.758 1.00 21.24 N ATOM 680 CA ALA A 46 6.180 1.304 -8.897 1.00 72.54 C ATOM 681 C ALA A 46 5.629 0.168 -8.041 1.00 42.04 C ATOM 682 O ALA A 46 5.749 -1.004 -8.398 1.00 14.42 O ATOM 683 CB ALA A 46 7.626 1.595 -8.524 1.00 52.12 C ATOM 0 H ALA A 46 5.805 3.248 -8.209 1.00 21.24 H new ATOM 0 HA ALA A 46 6.142 0.989 -9.940 1.00 72.54 H new ATOM 0 HB1 ALA A 46 8.220 0.687 -8.633 1.00 52.12 H new ATOM 0 HB2 ALA A 46 8.023 2.369 -9.181 1.00 52.12 H new ATOM 0 HB3 ALA A 46 7.673 1.938 -7.490 1.00 52.12 H new ATOM 689 N GLU A 47 5.027 0.524 -6.911 1.00 32.31 N ATOM 690 CA GLU A 47 4.459 -0.467 -6.004 1.00 25.21 C ATOM 691 C GLU A 47 3.224 -1.121 -6.616 1.00 50.13 C ATOM 692 O GLU A 47 3.089 -2.345 -6.612 1.00 33.20 O ATOM 693 CB GLU A 47 4.097 0.182 -4.666 1.00 72.55 C ATOM 694 CG GLU A 47 3.891 -0.818 -3.541 1.00 21.31 C ATOM 695 CD GLU A 47 3.613 -0.149 -2.209 1.00 51.53 C ATOM 696 OE1 GLU A 47 3.908 1.058 -2.080 1.00 5.04 O ATOM 697 OE2 GLU A 47 3.100 -0.830 -1.297 1.00 63.13 O ATOM 0 H GLU A 47 4.920 1.490 -6.602 1.00 32.31 H new ATOM 0 HA GLU A 47 5.210 -1.239 -5.834 1.00 25.21 H new ATOM 0 HB2 GLU A 47 4.888 0.877 -4.383 1.00 72.55 H new ATOM 0 HB3 GLU A 47 3.187 0.769 -4.791 1.00 72.55 H new ATOM 0 HG2 GLU A 47 3.060 -1.476 -3.793 1.00 21.31 H new ATOM 0 HG3 GLU A 47 4.778 -1.445 -3.450 1.00 21.31 H new ATOM 704 N LEU A 48 2.325 -0.296 -7.142 1.00 32.23 N ATOM 705 CA LEU A 48 1.099 -0.793 -7.758 1.00 2.42 C ATOM 706 C LEU A 48 1.413 -1.803 -8.856 1.00 73.24 C ATOM 707 O LEU A 48 0.874 -2.909 -8.867 1.00 34.44 O ATOM 708 CB LEU A 48 0.288 0.369 -8.334 1.00 41.22 C ATOM 709 CG LEU A 48 -0.472 1.225 -7.321 1.00 13.04 C ATOM 710 CD1 LEU A 48 -0.825 2.577 -7.921 1.00 74.34 C ATOM 711 CD2 LEU A 48 -1.727 0.505 -6.849 1.00 71.31 C ATOM 0 H LEU A 48 2.422 0.719 -7.154 1.00 32.23 H new ATOM 0 HA LEU A 48 0.510 -1.292 -6.988 1.00 2.42 H new ATOM 0 HB2 LEU A 48 0.965 1.017 -8.892 1.00 41.22 H new ATOM 0 HB3 LEU A 48 -0.429 -0.034 -9.049 1.00 41.22 H new ATOM 0 HG LEU A 48 0.174 1.391 -6.459 1.00 13.04 H new ATOM 0 HD11 LEU A 48 -1.366 3.172 -7.185 1.00 74.34 H new ATOM 0 HD12 LEU A 48 0.089 3.098 -8.208 1.00 74.34 H new ATOM 0 HD13 LEU A 48 -1.452 2.432 -8.801 1.00 74.34 H new ATOM 0 HD21 LEU A 48 -2.255 1.129 -6.128 1.00 71.31 H new ATOM 0 HD22 LEU A 48 -2.376 0.307 -7.702 1.00 71.31 H new ATOM 0 HD23 LEU A 48 -1.450 -0.438 -6.378 1.00 71.31 H new ATOM 723 N GLN A 49 2.289 -1.416 -9.778 1.00 12.54 N ATOM 724 CA GLN A 49 2.675 -2.289 -10.879 1.00 51.05 C ATOM 725 C GLN A 49 3.306 -3.576 -10.359 1.00 32.04 C ATOM 726 O GLN A 49 3.221 -4.624 -10.999 1.00 34.11 O ATOM 727 CB GLN A 49 3.652 -1.569 -11.811 1.00 15.22 C ATOM 728 CG GLN A 49 3.873 -2.287 -13.132 1.00 43.54 C ATOM 729 CD GLN A 49 2.574 -2.673 -13.812 1.00 24.33 C ATOM 730 OE1 GLN A 49 1.576 -1.958 -13.722 1.00 4.41 O ATOM 731 NE2 GLN A 49 2.580 -3.811 -14.497 1.00 2.31 N ATOM 0 H GLN A 49 2.744 -0.503 -9.784 1.00 12.54 H new ATOM 0 HA GLN A 49 1.775 -2.547 -11.437 1.00 51.05 H new ATOM 0 HB2 GLN A 49 3.278 -0.565 -12.011 1.00 15.22 H new ATOM 0 HB3 GLN A 49 4.610 -1.457 -11.303 1.00 15.22 H new ATOM 0 HG2 GLN A 49 4.450 -1.645 -13.798 1.00 43.54 H new ATOM 0 HG3 GLN A 49 4.468 -3.184 -12.959 1.00 43.54 H new ATOM 0 HE21 GLN A 49 3.430 -4.373 -14.545 1.00 2.31 H new ATOM 0 HE22 GLN A 49 1.735 -4.123 -14.975 1.00 2.31 H new ATOM 740 N ASP A 50 3.939 -3.489 -9.194 1.00 32.41 N ATOM 741 CA ASP A 50 4.584 -4.648 -8.586 1.00 51.52 C ATOM 742 C ASP A 50 3.549 -5.684 -8.160 1.00 22.15 C ATOM 743 O ASP A 50 3.704 -6.876 -8.425 1.00 43.31 O ATOM 744 CB ASP A 50 5.421 -4.218 -7.380 1.00 53.43 C ATOM 745 CG ASP A 50 6.409 -5.285 -6.951 1.00 54.52 C ATOM 746 OD1 ASP A 50 6.438 -6.357 -7.590 1.00 35.01 O ATOM 747 OD2 ASP A 50 7.152 -5.047 -5.976 1.00 63.42 O ATOM 0 H ASP A 50 4.019 -2.629 -8.652 1.00 32.41 H new ATOM 0 HA ASP A 50 5.239 -5.101 -9.330 1.00 51.52 H new ATOM 0 HB2 ASP A 50 5.962 -3.303 -7.624 1.00 53.43 H new ATOM 0 HB3 ASP A 50 4.759 -3.984 -6.547 1.00 53.43 H new ATOM 752 N MET A 51 2.495 -5.222 -7.496 1.00 54.21 N ATOM 753 CA MET A 51 1.434 -6.109 -7.033 1.00 25.44 C ATOM 754 C MET A 51 0.804 -6.859 -8.202 1.00 34.44 C ATOM 755 O MET A 51 0.792 -8.090 -8.227 1.00 71.51 O ATOM 756 CB MET A 51 0.363 -5.313 -6.285 1.00 5.10 C ATOM 757 CG MET A 51 0.931 -4.353 -5.252 1.00 34.14 C ATOM 758 SD MET A 51 -0.278 -3.891 -3.996 1.00 22.45 S ATOM 759 CE MET A 51 0.229 -4.941 -2.636 1.00 21.41 C ATOM 0 H MET A 51 2.353 -4.238 -7.266 1.00 54.21 H new ATOM 0 HA MET A 51 1.875 -6.837 -6.352 1.00 25.44 H new ATOM 0 HB2 MET A 51 -0.229 -4.749 -7.006 1.00 5.10 H new ATOM 0 HB3 MET A 51 -0.315 -6.008 -5.789 1.00 5.10 H new ATOM 0 HG2 MET A 51 1.793 -4.813 -4.769 1.00 34.14 H new ATOM 0 HG3 MET A 51 1.289 -3.454 -5.755 1.00 34.14 H new ATOM 0 HE1 MET A 51 -0.595 -5.046 -1.931 1.00 21.41 H new ATOM 0 HE2 MET A 51 0.507 -5.923 -3.019 1.00 21.41 H new ATOM 0 HE3 MET A 51 1.084 -4.493 -2.130 1.00 21.41 H new ATOM 769 N ILE A 52 0.280 -6.110 -9.166 1.00 63.21 N ATOM 770 CA ILE A 52 -0.351 -6.705 -10.337 1.00 73.23 C ATOM 771 C ILE A 52 0.609 -7.642 -11.063 1.00 54.43 C ATOM 772 O ILE A 52 0.207 -8.688 -11.569 1.00 74.42 O ATOM 773 CB ILE A 52 -0.841 -5.627 -11.322 1.00 13.35 C ATOM 774 CG1 ILE A 52 -1.834 -4.689 -10.632 1.00 1.24 C ATOM 775 CG2 ILE A 52 -1.477 -6.274 -12.543 1.00 1.11 C ATOM 776 CD1 ILE A 52 -2.275 -3.531 -11.500 1.00 32.41 C ATOM 0 H ILE A 52 0.280 -5.090 -9.159 1.00 63.21 H new ATOM 0 HA ILE A 52 -1.208 -7.274 -9.978 1.00 73.23 H new ATOM 0 HB ILE A 52 0.017 -5.040 -11.651 1.00 13.35 H new ATOM 0 HG12 ILE A 52 -2.711 -5.261 -10.330 1.00 1.24 H new ATOM 0 HG13 ILE A 52 -1.379 -4.298 -9.722 1.00 1.24 H new ATOM 0 HG21 ILE A 52 -1.818 -5.499 -13.229 1.00 1.11 H new ATOM 0 HG22 ILE A 52 -0.743 -6.905 -13.044 1.00 1.11 H new ATOM 0 HG23 ILE A 52 -2.326 -6.882 -12.232 1.00 1.11 H new ATOM 0 HD11 ILE A 52 -2.978 -2.908 -10.946 1.00 32.41 H new ATOM 0 HD12 ILE A 52 -1.406 -2.936 -11.781 1.00 32.41 H new ATOM 0 HD13 ILE A 52 -2.759 -3.914 -12.399 1.00 32.41 H new ATOM 788 N ASN A 53 1.880 -7.258 -11.109 1.00 2.24 N ATOM 789 CA ASN A 53 2.899 -8.064 -11.772 1.00 12.04 C ATOM 790 C ASN A 53 3.173 -9.345 -10.990 1.00 10.15 C ATOM 791 O ASN A 53 3.449 -10.392 -11.573 1.00 64.30 O ATOM 792 CB ASN A 53 4.192 -7.262 -11.928 1.00 2.33 C ATOM 793 CG ASN A 53 4.172 -6.364 -13.150 1.00 31.12 C ATOM 794 OD1 ASN A 53 3.262 -6.442 -13.976 1.00 2.43 O ATOM 795 ND2 ASN A 53 5.178 -5.506 -13.270 1.00 63.14 N ATOM 0 H ASN A 53 2.229 -6.394 -10.695 1.00 2.24 H new ATOM 0 HA ASN A 53 2.526 -8.335 -12.760 1.00 12.04 H new ATOM 0 HB2 ASN A 53 4.349 -6.655 -11.037 1.00 2.33 H new ATOM 0 HB3 ASN A 53 5.036 -7.948 -11.999 1.00 2.33 H new ATOM 0 HD21 ASN A 53 5.218 -4.876 -14.071 1.00 63.14 H new ATOM 0 HD22 ASN A 53 5.910 -5.476 -12.561 1.00 63.14 H new ATOM 802 N GLU A 54 3.094 -9.252 -9.666 1.00 35.13 N ATOM 803 CA GLU A 54 3.333 -10.404 -8.804 1.00 43.22 C ATOM 804 C GLU A 54 2.320 -11.511 -9.081 1.00 42.23 C ATOM 805 O GLU A 54 2.622 -12.695 -8.933 1.00 71.25 O ATOM 806 CB GLU A 54 3.264 -9.991 -7.332 1.00 42.14 C ATOM 807 CG GLU A 54 4.482 -9.214 -6.861 1.00 15.45 C ATOM 808 CD GLU A 54 4.144 -8.196 -5.789 1.00 1.54 C ATOM 809 OE1 GLU A 54 3.092 -8.349 -5.134 1.00 0.10 O ATOM 810 OE2 GLU A 54 4.933 -7.245 -5.605 1.00 23.13 O ATOM 0 H GLU A 54 2.867 -8.392 -9.167 1.00 35.13 H new ATOM 0 HA GLU A 54 4.331 -10.786 -9.020 1.00 43.22 H new ATOM 0 HB2 GLU A 54 2.373 -9.383 -7.175 1.00 42.14 H new ATOM 0 HB3 GLU A 54 3.153 -10.884 -6.717 1.00 42.14 H new ATOM 0 HG2 GLU A 54 5.226 -9.911 -6.474 1.00 15.45 H new ATOM 0 HG3 GLU A 54 4.935 -8.704 -7.711 1.00 15.45 H new ATOM 817 N VAL A 55 1.116 -11.116 -9.484 1.00 23.14 N ATOM 818 CA VAL A 55 0.058 -12.073 -9.782 1.00 70.51 C ATOM 819 C VAL A 55 -0.219 -12.137 -11.280 1.00 14.21 C ATOM 820 O VAL A 55 -1.269 -12.618 -11.707 1.00 50.45 O ATOM 821 CB VAL A 55 -1.246 -11.717 -9.044 1.00 51.33 C ATOM 822 CG1 VAL A 55 -1.129 -12.045 -7.564 1.00 31.13 C ATOM 823 CG2 VAL A 55 -1.588 -10.249 -9.248 1.00 14.42 C ATOM 0 H VAL A 55 0.850 -10.140 -9.611 1.00 23.14 H new ATOM 0 HA VAL A 55 0.406 -13.047 -9.438 1.00 70.51 H new ATOM 0 HB VAL A 55 -2.055 -12.317 -9.461 1.00 51.33 H new ATOM 0 HG11 VAL A 55 -2.060 -11.787 -7.059 1.00 31.13 H new ATOM 0 HG12 VAL A 55 -0.934 -13.110 -7.442 1.00 31.13 H new ATOM 0 HG13 VAL A 55 -0.309 -11.474 -7.128 1.00 31.13 H new ATOM 0 HG21 VAL A 55 -2.512 -10.014 -8.720 1.00 14.42 H new ATOM 0 HG22 VAL A 55 -0.780 -9.630 -8.859 1.00 14.42 H new ATOM 0 HG23 VAL A 55 -1.717 -10.050 -10.312 1.00 14.42 H new ATOM 833 N ASP A 56 0.728 -11.649 -12.072 1.00 44.25 N ATOM 834 CA ASP A 56 0.587 -11.651 -13.524 1.00 24.10 C ATOM 835 C ASP A 56 1.151 -12.936 -14.123 1.00 33.13 C ATOM 836 O ASP A 56 2.356 -13.055 -14.339 1.00 23.42 O ATOM 837 CB ASP A 56 1.297 -10.438 -14.128 1.00 72.45 C ATOM 838 CG ASP A 56 0.808 -10.119 -15.528 1.00 35.45 C ATOM 839 OD1 ASP A 56 -0.116 -10.811 -16.006 1.00 32.05 O ATOM 840 OD2 ASP A 56 1.348 -9.178 -16.144 1.00 53.32 O ATOM 0 H ASP A 56 1.602 -11.247 -11.734 1.00 44.25 H new ATOM 0 HA ASP A 56 -0.475 -11.596 -13.761 1.00 24.10 H new ATOM 0 HB2 ASP A 56 1.140 -9.572 -13.485 1.00 72.45 H new ATOM 0 HB3 ASP A 56 2.370 -10.625 -14.155 1.00 72.45 H new ATOM 845 N ALA A 57 0.270 -13.895 -14.387 1.00 72.41 N ATOM 846 CA ALA A 57 0.679 -15.171 -14.961 1.00 71.15 C ATOM 847 C ALA A 57 0.693 -15.108 -16.485 1.00 5.20 C ATOM 848 O ALA A 57 1.638 -15.568 -17.126 1.00 23.51 O ATOM 849 CB ALA A 57 -0.243 -16.284 -14.486 1.00 55.13 C ATOM 0 H ALA A 57 -0.732 -13.813 -14.213 1.00 72.41 H new ATOM 0 HA ALA A 57 1.693 -15.385 -14.622 1.00 71.15 H new ATOM 0 HB1 ALA A 57 0.075 -17.231 -14.923 1.00 55.13 H new ATOM 0 HB2 ALA A 57 -0.200 -16.353 -13.399 1.00 55.13 H new ATOM 0 HB3 ALA A 57 -1.265 -16.067 -14.795 1.00 55.13 H new ATOM 855 N ASP A 58 -0.359 -14.536 -17.059 1.00 12.44 N ATOM 856 CA ASP A 58 -0.467 -14.412 -18.508 1.00 12.23 C ATOM 857 C ASP A 58 0.320 -13.206 -19.010 1.00 50.42 C ATOM 858 O ASP A 58 0.355 -12.930 -20.209 1.00 14.55 O ATOM 859 CB ASP A 58 -1.934 -14.288 -18.922 1.00 51.14 C ATOM 860 CG ASP A 58 -2.523 -12.936 -18.570 1.00 72.12 C ATOM 861 OD1 ASP A 58 -1.958 -12.253 -17.690 1.00 62.24 O ATOM 862 OD2 ASP A 58 -3.549 -12.561 -19.175 1.00 11.22 O ATOM 0 H ASP A 58 -1.150 -14.150 -16.543 1.00 12.44 H new ATOM 0 HA ASP A 58 -0.045 -15.311 -18.958 1.00 12.23 H new ATOM 0 HB2 ASP A 58 -2.020 -14.450 -19.996 1.00 51.14 H new ATOM 0 HB3 ASP A 58 -2.514 -15.072 -18.434 1.00 51.14 H new ATOM 867 N GLY A 59 0.951 -12.489 -18.084 1.00 74.14 N ATOM 868 CA GLY A 59 1.728 -11.320 -18.453 1.00 33.21 C ATOM 869 C GLY A 59 0.924 -10.321 -19.261 1.00 50.02 C ATOM 870 O GLY A 59 1.300 -9.972 -20.379 1.00 74.05 O ATOM 0 H GLY A 59 0.938 -12.697 -17.086 1.00 74.14 H new ATOM 0 HA2 GLY A 59 2.101 -10.836 -17.551 1.00 33.21 H new ATOM 0 HA3 GLY A 59 2.598 -11.633 -19.030 1.00 33.21 H new ATOM 874 N ASN A 60 -0.187 -9.861 -18.695 1.00 3.43 N ATOM 875 CA ASN A 60 -1.047 -8.897 -19.372 1.00 32.15 C ATOM 876 C ASN A 60 -1.060 -7.564 -18.630 1.00 30.04 C ATOM 877 O ASN A 60 -1.481 -6.543 -19.173 1.00 21.54 O ATOM 878 CB ASN A 60 -2.471 -9.445 -19.484 1.00 14.30 C ATOM 879 CG ASN A 60 -3.090 -9.731 -18.129 1.00 4.50 C ATOM 880 OD1 ASN A 60 -2.432 -9.607 -17.096 1.00 1.23 O ATOM 881 ND2 ASN A 60 -4.361 -10.116 -18.128 1.00 45.51 N ATOM 0 H ASN A 60 -0.513 -10.140 -17.770 1.00 3.43 H new ATOM 0 HA ASN A 60 -0.648 -8.731 -20.373 1.00 32.15 H new ATOM 0 HB2 ASN A 60 -3.092 -8.727 -20.020 1.00 14.30 H new ATOM 0 HB3 ASN A 60 -2.459 -10.361 -20.075 1.00 14.30 H new ATOM 0 HD21 ASN A 60 -4.831 -10.322 -17.246 1.00 45.51 H new ATOM 0 HD22 ASN A 60 -4.868 -10.205 -19.009 1.00 45.51 H new ATOM 888 N GLY A 61 -0.595 -7.581 -17.384 1.00 61.40 N ATOM 889 CA GLY A 61 -0.561 -6.369 -16.588 1.00 0.42 C ATOM 890 C GLY A 61 -1.832 -6.165 -15.788 1.00 11.34 C ATOM 891 O GLY A 61 -2.152 -5.044 -15.389 1.00 63.13 O ATOM 0 H GLY A 61 -0.241 -8.413 -16.912 1.00 61.40 H new ATOM 0 HA2 GLY A 61 0.290 -6.408 -15.908 1.00 0.42 H new ATOM 0 HA3 GLY A 61 -0.406 -5.512 -17.243 1.00 0.42 H new ATOM 895 N THR A 62 -2.562 -7.251 -15.552 1.00 1.32 N ATOM 896 CA THR A 62 -3.807 -7.186 -14.797 1.00 3.14 C ATOM 897 C THR A 62 -4.074 -8.496 -14.064 1.00 54.14 C ATOM 898 O THR A 62 -3.455 -9.519 -14.358 1.00 34.25 O ATOM 899 CB THR A 62 -5.004 -6.869 -15.713 1.00 23.22 C ATOM 900 OG1 THR A 62 -5.114 -7.865 -16.736 1.00 15.10 O ATOM 901 CG2 THR A 62 -4.850 -5.496 -16.349 1.00 42.00 C ATOM 0 H THR A 62 -2.312 -8.186 -15.873 1.00 1.32 H new ATOM 0 HA THR A 62 -3.694 -6.382 -14.069 1.00 3.14 H new ATOM 0 HB THR A 62 -5.909 -6.871 -15.106 1.00 23.22 H new ATOM 0 HG1 THR A 62 -5.771 -7.577 -17.403 1.00 15.10 H new ATOM 0 HG21 THR A 62 -5.707 -5.294 -16.991 1.00 42.00 H new ATOM 0 HG22 THR A 62 -4.795 -4.737 -15.568 1.00 42.00 H new ATOM 0 HG23 THR A 62 -3.937 -5.471 -16.944 1.00 42.00 H new ATOM 909 N ILE A 63 -5.000 -8.457 -13.112 1.00 21.31 N ATOM 910 CA ILE A 63 -5.350 -9.643 -12.339 1.00 51.33 C ATOM 911 C ILE A 63 -6.554 -10.357 -12.944 1.00 30.11 C ATOM 912 O ILE A 63 -7.662 -9.821 -12.961 1.00 73.43 O ATOM 913 CB ILE A 63 -5.661 -9.288 -10.873 1.00 40.43 C ATOM 914 CG1 ILE A 63 -4.564 -8.389 -10.300 1.00 3.33 C ATOM 915 CG2 ILE A 63 -5.806 -10.553 -10.041 1.00 44.01 C ATOM 916 CD1 ILE A 63 -4.821 -7.956 -8.873 1.00 53.14 C ATOM 0 H ILE A 63 -5.521 -7.618 -12.857 1.00 21.31 H new ATOM 0 HA ILE A 63 -4.485 -10.306 -12.368 1.00 51.33 H new ATOM 0 HB ILE A 63 -6.605 -8.744 -10.838 1.00 40.43 H new ATOM 0 HG12 ILE A 63 -3.612 -8.918 -10.345 1.00 3.33 H new ATOM 0 HG13 ILE A 63 -4.466 -7.503 -10.928 1.00 3.33 H new ATOM 0 HG21 ILE A 63 -6.026 -10.286 -9.007 1.00 44.01 H new ATOM 0 HG22 ILE A 63 -6.619 -11.159 -10.440 1.00 44.01 H new ATOM 0 HG23 ILE A 63 -4.877 -11.122 -10.079 1.00 44.01 H new ATOM 0 HD11 ILE A 63 -4.003 -7.321 -8.532 1.00 53.14 H new ATOM 0 HD12 ILE A 63 -5.757 -7.399 -8.825 1.00 53.14 H new ATOM 0 HD13 ILE A 63 -4.889 -8.835 -8.233 1.00 53.14 H new ATOM 928 N ASP A 64 -6.329 -11.570 -13.437 1.00 41.22 N ATOM 929 CA ASP A 64 -7.396 -12.360 -14.040 1.00 62.04 C ATOM 930 C ASP A 64 -8.269 -13.003 -12.967 1.00 51.23 C ATOM 931 O ASP A 64 -8.116 -12.723 -11.778 1.00 72.31 O ATOM 932 CB ASP A 64 -6.808 -13.439 -14.951 1.00 21.11 C ATOM 933 CG ASP A 64 -5.604 -12.947 -15.730 1.00 12.50 C ATOM 934 OD1 ASP A 64 -5.571 -11.747 -16.074 1.00 12.31 O ATOM 935 OD2 ASP A 64 -4.696 -13.761 -15.997 1.00 24.15 O ATOM 0 H ASP A 64 -5.417 -12.028 -13.431 1.00 41.22 H new ATOM 0 HA ASP A 64 -8.017 -11.691 -14.636 1.00 62.04 H new ATOM 0 HB2 ASP A 64 -6.520 -14.301 -14.349 1.00 21.11 H new ATOM 0 HB3 ASP A 64 -7.574 -13.779 -15.648 1.00 21.11 H new ATOM 940 N PHE A 65 -9.186 -13.865 -13.396 1.00 3.55 N ATOM 941 CA PHE A 65 -10.085 -14.546 -12.472 1.00 13.32 C ATOM 942 C PHE A 65 -9.307 -15.460 -11.530 1.00 33.10 C ATOM 943 O PHE A 65 -9.361 -15.325 -10.307 1.00 42.54 O ATOM 944 CB PHE A 65 -11.126 -15.358 -13.246 1.00 3.05 C ATOM 945 CG PHE A 65 -11.679 -16.518 -12.469 1.00 32.33 C ATOM 946 CD1 PHE A 65 -12.247 -16.325 -11.220 1.00 14.12 C ATOM 947 CD2 PHE A 65 -11.632 -17.802 -12.987 1.00 63.14 C ATOM 948 CE1 PHE A 65 -12.757 -17.391 -10.503 1.00 4.13 C ATOM 949 CE2 PHE A 65 -12.140 -18.872 -12.275 1.00 23.10 C ATOM 950 CZ PHE A 65 -12.704 -18.666 -11.031 1.00 42.14 C ATOM 0 H PHE A 65 -9.326 -14.108 -14.377 1.00 3.55 H new ATOM 0 HA PHE A 65 -10.595 -13.789 -11.876 1.00 13.32 H new ATOM 0 HB2 PHE A 65 -11.946 -14.701 -13.535 1.00 3.05 H new ATOM 0 HB3 PHE A 65 -10.675 -15.729 -14.166 1.00 3.05 H new ATOM 0 HD1 PHE A 65 -12.292 -15.330 -10.802 1.00 14.12 H new ATOM 0 HD2 PHE A 65 -11.193 -17.969 -13.959 1.00 63.14 H new ATOM 0 HE1 PHE A 65 -13.197 -17.227 -9.530 1.00 4.13 H new ATOM 0 HE2 PHE A 65 -12.096 -19.868 -12.691 1.00 23.10 H new ATOM 0 HZ PHE A 65 -13.103 -19.500 -10.473 1.00 42.14 H new ATOM 960 N PRO A 66 -8.567 -16.415 -12.111 1.00 63.34 N ATOM 961 CA PRO A 66 -7.763 -17.371 -11.344 1.00 34.53 C ATOM 962 C PRO A 66 -6.563 -16.713 -10.672 1.00 14.30 C ATOM 963 O PRO A 66 -6.139 -17.128 -9.594 1.00 60.34 O ATOM 964 CB PRO A 66 -7.299 -18.375 -12.402 1.00 35.40 C ATOM 965 CG PRO A 66 -7.320 -17.613 -13.682 1.00 22.12 C ATOM 966 CD PRO A 66 -8.456 -16.635 -13.563 1.00 62.13 C ATOM 0 HA PRO A 66 -8.332 -17.821 -10.531 1.00 34.53 H new ATOM 0 HB2 PRO A 66 -6.300 -18.750 -12.181 1.00 35.40 H new ATOM 0 HB3 PRO A 66 -7.961 -19.240 -12.445 1.00 35.40 H new ATOM 0 HG2 PRO A 66 -6.375 -17.095 -13.843 1.00 22.12 H new ATOM 0 HG3 PRO A 66 -7.467 -18.280 -14.531 1.00 22.12 H new ATOM 0 HD2 PRO A 66 -8.245 -15.707 -14.095 1.00 62.13 H new ATOM 0 HD3 PRO A 66 -9.379 -17.038 -13.980 1.00 62.13 H new ATOM 974 N GLU A 67 -6.022 -15.684 -11.316 1.00 3.51 N ATOM 975 CA GLU A 67 -4.870 -14.968 -10.779 1.00 63.43 C ATOM 976 C GLU A 67 -5.170 -14.420 -9.387 1.00 41.34 C ATOM 977 O GLU A 67 -4.337 -14.498 -8.484 1.00 41.42 O ATOM 978 CB GLU A 67 -4.470 -13.825 -11.715 1.00 30.42 C ATOM 979 CG GLU A 67 -3.866 -14.296 -13.027 1.00 54.14 C ATOM 980 CD GLU A 67 -3.117 -13.195 -13.753 1.00 23.25 C ATOM 981 OE1 GLU A 67 -3.218 -12.027 -13.323 1.00 11.20 O ATOM 982 OE2 GLU A 67 -2.429 -13.502 -14.749 1.00 14.41 O ATOM 0 H GLU A 67 -6.362 -15.327 -12.209 1.00 3.51 H new ATOM 0 HA GLU A 67 -4.041 -15.671 -10.702 1.00 63.43 H new ATOM 0 HB2 GLU A 67 -5.349 -13.216 -11.927 1.00 30.42 H new ATOM 0 HB3 GLU A 67 -3.753 -13.183 -11.204 1.00 30.42 H new ATOM 0 HG2 GLU A 67 -3.186 -15.126 -12.833 1.00 54.14 H new ATOM 0 HG3 GLU A 67 -4.658 -14.677 -13.671 1.00 54.14 H new ATOM 989 N PHE A 68 -6.366 -13.864 -9.222 1.00 62.12 N ATOM 990 CA PHE A 68 -6.777 -13.301 -7.941 1.00 44.34 C ATOM 991 C PHE A 68 -7.022 -14.403 -6.916 1.00 33.52 C ATOM 992 O PHE A 68 -6.728 -14.242 -5.731 1.00 13.34 O ATOM 993 CB PHE A 68 -8.042 -12.458 -8.113 1.00 42.54 C ATOM 994 CG PHE A 68 -8.634 -11.994 -6.814 1.00 13.44 C ATOM 995 CD1 PHE A 68 -8.120 -10.886 -6.159 1.00 22.45 C ATOM 996 CD2 PHE A 68 -9.706 -12.664 -6.247 1.00 71.40 C ATOM 997 CE1 PHE A 68 -8.663 -10.458 -4.962 1.00 22.01 C ATOM 998 CE2 PHE A 68 -10.254 -12.240 -5.051 1.00 24.42 C ATOM 999 CZ PHE A 68 -9.732 -11.135 -4.408 1.00 23.10 C ATOM 0 H PHE A 68 -7.067 -13.791 -9.959 1.00 62.12 H new ATOM 0 HA PHE A 68 -5.971 -12.664 -7.577 1.00 44.34 H new ATOM 0 HB2 PHE A 68 -7.809 -11.589 -8.728 1.00 42.54 H new ATOM 0 HB3 PHE A 68 -8.787 -13.041 -8.655 1.00 42.54 H new ATOM 0 HD1 PHE A 68 -7.286 -10.351 -6.589 1.00 22.45 H new ATOM 0 HD2 PHE A 68 -10.119 -13.528 -6.746 1.00 71.40 H new ATOM 0 HE1 PHE A 68 -8.252 -9.595 -4.460 1.00 22.01 H new ATOM 0 HE2 PHE A 68 -11.089 -12.772 -4.620 1.00 24.42 H new ATOM 0 HZ PHE A 68 -10.159 -10.801 -3.474 1.00 23.10 H new ATOM 1009 N LEU A 69 -7.564 -15.524 -7.380 1.00 23.33 N ATOM 1010 CA LEU A 69 -7.850 -16.655 -6.504 1.00 34.22 C ATOM 1011 C LEU A 69 -6.561 -17.283 -5.985 1.00 45.22 C ATOM 1012 O LEU A 69 -6.374 -17.438 -4.778 1.00 21.02 O ATOM 1013 CB LEU A 69 -8.679 -17.704 -7.247 1.00 65.54 C ATOM 1014 CG LEU A 69 -9.416 -18.720 -6.374 1.00 12.21 C ATOM 1015 CD1 LEU A 69 -10.348 -18.011 -5.403 1.00 70.30 C ATOM 1016 CD2 LEU A 69 -10.191 -19.703 -7.238 1.00 74.53 C ATOM 0 H LEU A 69 -7.814 -15.674 -8.357 1.00 23.33 H new ATOM 0 HA LEU A 69 -8.421 -16.287 -5.652 1.00 34.22 H new ATOM 0 HB2 LEU A 69 -9.413 -17.187 -7.865 1.00 65.54 H new ATOM 0 HB3 LEU A 69 -8.019 -18.247 -7.923 1.00 65.54 H new ATOM 0 HG LEU A 69 -8.678 -19.278 -5.797 1.00 12.21 H new ATOM 0 HD11 LEU A 69 -10.864 -18.749 -4.790 1.00 70.30 H new ATOM 0 HD12 LEU A 69 -9.768 -17.347 -4.761 1.00 70.30 H new ATOM 0 HD13 LEU A 69 -11.080 -17.428 -5.962 1.00 70.30 H new ATOM 0 HD21 LEU A 69 -10.709 -20.419 -6.600 1.00 74.53 H new ATOM 0 HD22 LEU A 69 -10.919 -19.161 -7.842 1.00 74.53 H new ATOM 0 HD23 LEU A 69 -9.501 -20.235 -7.893 1.00 74.53 H new ATOM 1028 N THR A 70 -5.671 -17.641 -6.906 1.00 3.12 N ATOM 1029 CA THR A 70 -4.398 -18.250 -6.542 1.00 62.41 C ATOM 1030 C THR A 70 -3.607 -17.351 -5.598 1.00 73.35 C ATOM 1031 O THR A 70 -2.830 -17.832 -4.775 1.00 3.25 O ATOM 1032 CB THR A 70 -3.541 -18.548 -7.787 1.00 52.23 C ATOM 1033 OG1 THR A 70 -2.377 -19.294 -7.414 1.00 74.15 O ATOM 1034 CG2 THR A 70 -3.123 -17.258 -8.477 1.00 74.13 C ATOM 0 H THR A 70 -5.809 -17.519 -7.909 1.00 3.12 H new ATOM 0 HA THR A 70 -4.630 -19.187 -6.037 1.00 62.41 H new ATOM 0 HB THR A 70 -4.141 -19.136 -8.482 1.00 52.23 H new ATOM 0 HG1 THR A 70 -1.839 -19.481 -8.211 1.00 74.15 H new ATOM 0 HG21 THR A 70 -2.519 -17.493 -9.353 1.00 74.13 H new ATOM 0 HG22 THR A 70 -4.011 -16.706 -8.786 1.00 74.13 H new ATOM 0 HG23 THR A 70 -2.539 -16.649 -7.787 1.00 74.13 H new ATOM 1042 N MET A 71 -3.812 -16.044 -5.724 1.00 60.11 N ATOM 1043 CA MET A 71 -3.119 -15.078 -4.880 1.00 3.10 C ATOM 1044 C MET A 71 -3.461 -15.296 -3.410 1.00 33.23 C ATOM 1045 O MET A 71 -2.588 -15.237 -2.544 1.00 54.23 O ATOM 1046 CB MET A 71 -3.484 -13.651 -5.295 1.00 35.44 C ATOM 1047 CG MET A 71 -2.751 -12.581 -4.502 1.00 71.33 C ATOM 1048 SD MET A 71 -3.331 -10.917 -4.882 1.00 4.43 S ATOM 1049 CE MET A 71 -5.066 -11.059 -4.464 1.00 14.12 C ATOM 0 H MET A 71 -4.452 -15.630 -6.402 1.00 60.11 H new ATOM 0 HA MET A 71 -2.047 -15.223 -5.010 1.00 3.10 H new ATOM 0 HB2 MET A 71 -3.263 -13.522 -6.354 1.00 35.44 H new ATOM 0 HB3 MET A 71 -4.558 -13.510 -5.174 1.00 35.44 H new ATOM 0 HG2 MET A 71 -2.879 -12.772 -3.437 1.00 71.33 H new ATOM 0 HG3 MET A 71 -1.683 -12.646 -4.711 1.00 71.33 H new ATOM 0 HE1 MET A 71 -5.470 -10.070 -4.248 1.00 14.12 H new ATOM 0 HE2 MET A 71 -5.607 -11.498 -5.302 1.00 14.12 H new ATOM 0 HE3 MET A 71 -5.178 -11.696 -3.586 1.00 14.12 H new ATOM 1059 N MET A 72 -4.737 -15.548 -3.135 1.00 21.41 N ATOM 1060 CA MET A 72 -5.193 -15.776 -1.769 1.00 34.32 C ATOM 1061 C MET A 72 -4.888 -17.203 -1.324 1.00 64.13 C ATOM 1062 O MET A 72 -4.388 -17.426 -0.222 1.00 35.11 O ATOM 1063 CB MET A 72 -6.695 -15.506 -1.658 1.00 51.04 C ATOM 1064 CG MET A 72 -7.028 -14.074 -1.270 1.00 70.45 C ATOM 1065 SD MET A 72 -8.791 -13.823 -0.989 1.00 72.14 S ATOM 1066 CE MET A 72 -8.756 -12.508 0.226 1.00 32.35 C ATOM 0 H MET A 72 -5.473 -15.599 -3.840 1.00 21.41 H new ATOM 0 HA MET A 72 -4.657 -15.088 -1.115 1.00 34.32 H new ATOM 0 HB2 MET A 72 -7.168 -15.735 -2.613 1.00 51.04 H new ATOM 0 HB3 MET A 72 -7.124 -16.183 -0.919 1.00 51.04 H new ATOM 0 HG2 MET A 72 -6.479 -13.809 -0.366 1.00 70.45 H new ATOM 0 HG3 MET A 72 -6.690 -13.400 -2.057 1.00 70.45 H new ATOM 0 HE1 MET A 72 -9.764 -12.119 0.370 1.00 32.35 H new ATOM 0 HE2 MET A 72 -8.378 -12.896 1.172 1.00 32.35 H new ATOM 0 HE3 MET A 72 -8.105 -11.707 -0.124 1.00 32.35 H new ATOM 1076 N ALA A 73 -5.191 -18.165 -2.189 1.00 62.44 N ATOM 1077 CA ALA A 73 -4.947 -19.570 -1.886 1.00 65.00 C ATOM 1078 C ALA A 73 -3.499 -19.797 -1.465 1.00 3.14 C ATOM 1079 O ALA A 73 -3.207 -20.687 -0.666 1.00 11.14 O ATOM 1080 CB ALA A 73 -5.290 -20.437 -3.088 1.00 74.11 C ATOM 0 H ALA A 73 -5.606 -17.997 -3.106 1.00 62.44 H new ATOM 0 HA ALA A 73 -5.590 -19.853 -1.052 1.00 65.00 H new ATOM 0 HB1 ALA A 73 -5.103 -21.483 -2.847 1.00 74.11 H new ATOM 0 HB2 ALA A 73 -6.342 -20.306 -3.343 1.00 74.11 H new ATOM 0 HB3 ALA A 73 -4.672 -20.144 -3.936 1.00 74.11 H new ATOM 1265 N ILE A 85 9.397 -29.538 7.051 1.00 35.51 N ATOM 1266 CA ILE A 85 9.758 -30.891 6.644 1.00 2.51 C ATOM 1267 C ILE A 85 11.163 -31.250 7.117 1.00 52.32 C ATOM 1268 O ILE A 85 11.379 -32.311 7.703 1.00 43.35 O ATOM 1269 CB ILE A 85 9.685 -31.057 5.115 1.00 43.43 C ATOM 1270 CG1 ILE A 85 8.310 -30.628 4.598 1.00 22.13 C ATOM 1271 CG2 ILE A 85 9.979 -32.497 4.724 1.00 73.33 C ATOM 1272 CD1 ILE A 85 8.199 -30.646 3.090 1.00 52.02 C ATOM 0 HA ILE A 85 9.037 -31.564 7.109 1.00 2.51 H new ATOM 0 HB ILE A 85 10.439 -30.416 4.658 1.00 43.43 H new ATOM 0 HG12 ILE A 85 7.551 -31.288 5.018 1.00 22.13 H new ATOM 0 HG13 ILE A 85 8.093 -29.622 4.958 1.00 22.13 H new ATOM 0 HG21 ILE A 85 9.924 -32.598 3.640 1.00 73.33 H new ATOM 0 HG22 ILE A 85 10.978 -32.769 5.063 1.00 73.33 H new ATOM 0 HG23 ILE A 85 9.246 -33.157 5.188 1.00 73.33 H new ATOM 0 HD11 ILE A 85 7.198 -30.331 2.795 1.00 52.02 H new ATOM 0 HD12 ILE A 85 8.935 -29.964 2.663 1.00 52.02 H new ATOM 0 HD13 ILE A 85 8.384 -31.656 2.724 1.00 52.02 H new ATOM 1284 N ARG A 86 12.114 -30.358 6.860 1.00 51.32 N ATOM 1285 CA ARG A 86 13.498 -30.580 7.260 1.00 62.25 C ATOM 1286 C ARG A 86 13.654 -30.455 8.772 1.00 1.22 C ATOM 1287 O ARG A 86 14.536 -31.072 9.368 1.00 63.34 O ATOM 1288 CB ARG A 86 14.421 -29.583 6.557 1.00 51.24 C ATOM 1289 CG ARG A 86 15.886 -29.988 6.579 1.00 74.24 C ATOM 1290 CD ARG A 86 16.783 -28.862 6.088 1.00 34.42 C ATOM 1291 NE ARG A 86 16.790 -27.728 7.008 1.00 23.45 N ATOM 1292 CZ ARG A 86 17.458 -26.603 6.782 1.00 4.20 C ATOM 1293 NH1 ARG A 86 18.169 -26.461 5.671 1.00 34.54 N ATOM 1294 NH2 ARG A 86 17.416 -25.615 7.667 1.00 23.44 N ATOM 0 H ARG A 86 11.951 -29.475 6.377 1.00 51.32 H new ATOM 0 HA ARG A 86 13.776 -31.592 6.966 1.00 62.25 H new ATOM 0 HB2 ARG A 86 14.099 -29.471 5.522 1.00 51.24 H new ATOM 0 HB3 ARG A 86 14.316 -28.607 7.031 1.00 51.24 H new ATOM 0 HG2 ARG A 86 16.172 -30.267 7.593 1.00 74.24 H new ATOM 0 HG3 ARG A 86 16.031 -30.869 5.953 1.00 74.24 H new ATOM 0 HD2 ARG A 86 17.800 -29.236 5.965 1.00 34.42 H new ATOM 0 HD3 ARG A 86 16.444 -28.530 5.106 1.00 34.42 H new ATOM 0 HE ARG A 86 16.252 -27.804 7.871 1.00 23.45 H new ATOM 0 HH11 ARG A 86 18.204 -27.217 4.987 1.00 34.54 H new ATOM 0 HH12 ARG A 86 18.681 -25.596 5.500 1.00 34.54 H new ATOM 0 HH21 ARG A 86 16.870 -25.719 8.522 1.00 23.44 H new ATOM 0 HH22 ARG A 86 17.930 -24.751 7.492 1.00 23.44 H new ATOM 1308 N GLU A 87 12.791 -29.651 9.386 1.00 25.14 N ATOM 1309 CA GLU A 87 12.835 -29.444 10.829 1.00 22.32 C ATOM 1310 C GLU A 87 12.350 -30.686 11.572 1.00 52.12 C ATOM 1311 O GLU A 87 12.771 -30.954 12.697 1.00 42.25 O ATOM 1312 CB GLU A 87 11.981 -28.236 11.220 1.00 71.52 C ATOM 1313 CG GLU A 87 12.387 -27.605 12.541 1.00 61.41 C ATOM 1314 CD GLU A 87 13.481 -26.568 12.380 1.00 40.31 C ATOM 1315 OE1 GLU A 87 14.129 -26.549 11.313 1.00 43.21 O ATOM 1316 OE2 GLU A 87 13.688 -25.774 13.322 1.00 62.03 O ATOM 0 H GLU A 87 12.054 -29.133 8.907 1.00 25.14 H new ATOM 0 HA GLU A 87 13.870 -29.254 11.111 1.00 22.32 H new ATOM 0 HB2 GLU A 87 12.047 -27.485 10.433 1.00 71.52 H new ATOM 0 HB3 GLU A 87 10.937 -28.544 11.280 1.00 71.52 H new ATOM 0 HG2 GLU A 87 11.515 -27.139 13.000 1.00 61.41 H new ATOM 0 HG3 GLU A 87 12.728 -28.385 13.222 1.00 61.41 H new ATOM 1323 N ALA A 88 11.460 -31.440 10.934 1.00 44.32 N ATOM 1324 CA ALA A 88 10.918 -32.653 11.532 1.00 23.31 C ATOM 1325 C ALA A 88 11.928 -33.795 11.469 1.00 54.31 C ATOM 1326 O ALA A 88 12.008 -34.617 12.382 1.00 41.21 O ATOM 1327 CB ALA A 88 9.624 -33.051 10.838 1.00 63.41 C ATOM 0 H ALA A 88 11.100 -31.231 10.003 1.00 44.32 H new ATOM 0 HA ALA A 88 10.706 -32.448 12.581 1.00 23.31 H new ATOM 0 HB1 ALA A 88 9.230 -33.959 11.295 1.00 63.41 H new ATOM 0 HB2 ALA A 88 8.894 -32.248 10.940 1.00 63.41 H new ATOM 0 HB3 ALA A 88 9.819 -33.232 9.781 1.00 63.41 H new ATOM 1333 N PHE A 89 12.696 -33.840 10.385 1.00 15.03 N ATOM 1334 CA PHE A 89 13.699 -34.882 10.202 1.00 31.24 C ATOM 1335 C PHE A 89 14.685 -34.898 11.367 1.00 61.14 C ATOM 1336 O PHE A 89 14.963 -35.949 11.945 1.00 74.03 O ATOM 1337 CB PHE A 89 14.450 -34.671 8.886 1.00 72.40 C ATOM 1338 CG PHE A 89 14.946 -35.947 8.268 1.00 22.21 C ATOM 1339 CD1 PHE A 89 14.057 -36.935 7.877 1.00 14.01 C ATOM 1340 CD2 PHE A 89 16.302 -36.159 8.078 1.00 42.54 C ATOM 1341 CE1 PHE A 89 14.511 -38.110 7.309 1.00 31.10 C ATOM 1342 CE2 PHE A 89 16.762 -37.332 7.510 1.00 44.44 C ATOM 1343 CZ PHE A 89 15.865 -38.308 7.124 1.00 63.21 C ATOM 0 H PHE A 89 12.643 -33.167 9.620 1.00 15.03 H new ATOM 0 HA PHE A 89 13.187 -35.843 10.169 1.00 31.24 H new ATOM 0 HB2 PHE A 89 13.792 -34.166 8.179 1.00 72.40 H new ATOM 0 HB3 PHE A 89 15.297 -34.009 9.063 1.00 72.40 H new ATOM 0 HD1 PHE A 89 12.997 -36.785 8.018 1.00 14.01 H new ATOM 0 HD2 PHE A 89 17.008 -35.398 8.377 1.00 42.54 H new ATOM 0 HE1 PHE A 89 13.807 -38.873 7.010 1.00 31.10 H new ATOM 0 HE2 PHE A 89 17.822 -37.485 7.368 1.00 44.44 H new ATOM 0 HZ PHE A 89 16.222 -39.225 6.678 1.00 63.21 H new ATOM 1353 N ARG A 90 15.211 -33.725 11.704 1.00 25.44 N ATOM 1354 CA ARG A 90 16.168 -33.604 12.798 1.00 40.11 C ATOM 1355 C ARG A 90 15.531 -34.006 14.125 1.00 71.33 C ATOM 1356 O ARG A 90 16.219 -34.434 15.052 1.00 42.05 O ATOM 1357 CB ARG A 90 16.694 -32.170 12.887 1.00 61.14 C ATOM 1358 CG ARG A 90 15.619 -31.146 13.210 1.00 11.25 C ATOM 1359 CD ARG A 90 16.224 -29.840 13.702 1.00 34.02 C ATOM 1360 NE ARG A 90 16.838 -29.983 15.019 1.00 32.15 N ATOM 1361 CZ ARG A 90 17.108 -28.958 15.820 1.00 53.22 C ATOM 1362 NH1 ARG A 90 16.818 -27.721 15.439 1.00 65.21 N ATOM 1363 NH2 ARG A 90 17.668 -29.169 17.004 1.00 14.42 N ATOM 0 H ARG A 90 14.991 -32.846 11.236 1.00 25.44 H new ATOM 0 HA ARG A 90 17.000 -34.278 12.595 1.00 40.11 H new ATOM 0 HB2 ARG A 90 17.470 -32.123 13.651 1.00 61.14 H new ATOM 0 HB3 ARG A 90 17.164 -31.905 11.940 1.00 61.14 H new ATOM 0 HG2 ARG A 90 15.016 -30.957 12.322 1.00 11.25 H new ATOM 0 HG3 ARG A 90 14.949 -31.547 13.971 1.00 11.25 H new ATOM 0 HD2 ARG A 90 16.973 -29.496 12.988 1.00 34.02 H new ATOM 0 HD3 ARG A 90 15.449 -29.075 13.745 1.00 34.02 H new ATOM 0 HE ARG A 90 17.073 -30.922 15.342 1.00 32.15 H new ATOM 0 HH11 ARG A 90 16.387 -27.555 14.530 1.00 65.21 H new ATOM 0 HH12 ARG A 90 17.026 -26.935 16.055 1.00 65.21 H new ATOM 0 HH21 ARG A 90 17.892 -30.119 17.300 1.00 14.42 H new ATOM 0 HH22 ARG A 90 17.875 -28.381 17.618 1.00 14.42 H new ATOM 1377 N VAL A 91 14.212 -33.866 14.209 1.00 52.43 N ATOM 1378 CA VAL A 91 13.481 -34.215 15.421 1.00 4.33 C ATOM 1379 C VAL A 91 13.376 -35.727 15.584 1.00 44.14 C ATOM 1380 O VAL A 91 13.606 -36.263 16.668 1.00 75.21 O ATOM 1381 CB VAL A 91 12.065 -33.610 15.417 1.00 74.32 C ATOM 1382 CG1 VAL A 91 11.309 -34.011 16.675 1.00 42.51 C ATOM 1383 CG2 VAL A 91 12.132 -32.096 15.284 1.00 21.44 C ATOM 0 H VAL A 91 13.627 -33.513 13.451 1.00 52.43 H new ATOM 0 HA VAL A 91 14.042 -33.801 16.259 1.00 4.33 H new ATOM 0 HB VAL A 91 11.524 -34.003 14.556 1.00 74.32 H new ATOM 0 HG11 VAL A 91 10.311 -33.574 16.654 1.00 42.51 H new ATOM 0 HG12 VAL A 91 11.229 -35.097 16.721 1.00 42.51 H new ATOM 0 HG13 VAL A 91 11.845 -33.649 17.552 1.00 42.51 H new ATOM 0 HG21 VAL A 91 11.122 -31.686 15.283 1.00 21.44 H new ATOM 0 HG22 VAL A 91 12.691 -31.681 16.123 1.00 21.44 H new ATOM 0 HG23 VAL A 91 12.631 -31.834 14.351 1.00 21.44 H new ATOM 1393 N PHE A 92 13.029 -36.410 14.498 1.00 31.21 N ATOM 1394 CA PHE A 92 12.893 -37.862 14.519 1.00 10.15 C ATOM 1395 C PHE A 92 14.262 -38.536 14.528 1.00 32.32 C ATOM 1396 O PHE A 92 14.445 -39.586 15.145 1.00 74.14 O ATOM 1397 CB PHE A 92 12.085 -38.338 13.310 1.00 2.32 C ATOM 1398 CG PHE A 92 10.827 -37.549 13.082 1.00 65.24 C ATOM 1399 CD1 PHE A 92 9.983 -37.245 14.137 1.00 22.13 C ATOM 1400 CD2 PHE A 92 10.489 -37.112 11.811 1.00 62.51 C ATOM 1401 CE1 PHE A 92 8.825 -36.519 13.931 1.00 61.35 C ATOM 1402 CE2 PHE A 92 9.333 -36.386 11.598 1.00 32.01 C ATOM 1403 CZ PHE A 92 8.499 -36.090 12.659 1.00 62.21 C ATOM 0 H PHE A 92 12.837 -35.981 13.593 1.00 31.21 H new ATOM 0 HA PHE A 92 12.365 -38.139 15.431 1.00 10.15 H new ATOM 0 HB2 PHE A 92 12.709 -38.277 12.419 1.00 2.32 H new ATOM 0 HB3 PHE A 92 11.826 -39.388 13.446 1.00 2.32 H new ATOM 0 HD1 PHE A 92 10.233 -37.579 15.133 1.00 22.13 H new ATOM 0 HD2 PHE A 92 11.137 -37.342 10.978 1.00 62.51 H new ATOM 0 HE1 PHE A 92 8.176 -36.288 14.763 1.00 61.35 H new ATOM 0 HE2 PHE A 92 9.081 -36.050 10.603 1.00 32.01 H new ATOM 0 HZ PHE A 92 7.594 -35.524 12.494 1.00 62.21 H new ATOM 1413 N ASP A 93 15.220 -37.926 13.839 1.00 14.45 N ATOM 1414 CA ASP A 93 16.572 -38.465 13.767 1.00 24.55 C ATOM 1415 C ASP A 93 17.232 -38.463 15.143 1.00 63.41 C ATOM 1416 O ASP A 93 17.835 -37.471 15.553 1.00 63.41 O ATOM 1417 CB ASP A 93 17.416 -37.655 12.782 1.00 20.11 C ATOM 1418 CG ASP A 93 18.616 -38.430 12.274 1.00 52.15 C ATOM 1419 OD1 ASP A 93 18.729 -39.631 12.599 1.00 54.42 O ATOM 1420 OD2 ASP A 93 19.442 -37.836 11.550 1.00 54.15 O ATOM 0 H ASP A 93 15.085 -37.057 13.322 1.00 14.45 H new ATOM 0 HA ASP A 93 16.507 -39.495 13.416 1.00 24.55 H new ATOM 0 HB2 ASP A 93 16.796 -37.356 11.937 1.00 20.11 H new ATOM 0 HB3 ASP A 93 17.757 -36.740 13.267 1.00 20.11 H new ATOM 1425 N LYS A 94 17.113 -39.581 15.852 1.00 10.53 N ATOM 1426 CA LYS A 94 17.697 -39.709 17.182 1.00 65.21 C ATOM 1427 C LYS A 94 19.196 -39.981 17.094 1.00 52.04 C ATOM 1428 O LYS A 94 20.001 -39.281 17.708 1.00 54.50 O ATOM 1429 CB LYS A 94 17.009 -40.835 17.957 1.00 1.44 C ATOM 1430 CG LYS A 94 16.963 -40.600 19.457 1.00 24.24 C ATOM 1431 CD LYS A 94 16.277 -41.747 20.180 1.00 1.04 C ATOM 1432 CE LYS A 94 14.836 -41.911 19.723 1.00 33.03 C ATOM 1433 NZ LYS A 94 14.721 -42.855 18.578 1.00 61.34 N ATOM 0 H LYS A 94 16.617 -40.411 15.528 1.00 10.53 H new ATOM 0 HA LYS A 94 17.546 -38.767 17.710 1.00 65.21 H new ATOM 0 HB2 LYS A 94 15.991 -40.952 17.585 1.00 1.44 H new ATOM 0 HB3 LYS A 94 17.530 -41.772 17.760 1.00 1.44 H new ATOM 0 HG2 LYS A 94 17.977 -40.482 19.839 1.00 24.24 H new ATOM 0 HG3 LYS A 94 16.434 -39.670 19.664 1.00 24.24 H new ATOM 0 HD2 LYS A 94 16.825 -42.672 19.999 1.00 1.04 H new ATOM 0 HD3 LYS A 94 16.301 -41.567 21.255 1.00 1.04 H new ATOM 0 HE2 LYS A 94 14.231 -42.273 20.554 1.00 33.03 H new ATOM 0 HE3 LYS A 94 14.434 -40.940 19.435 1.00 33.03 H new ATOM 0 HZ1 LYS A 94 14.387 -42.342 17.737 1.00 61.34 H new ATOM 0 HZ2 LYS A 94 15.651 -43.276 18.380 1.00 61.34 H new ATOM 0 HZ3 LYS A 94 14.044 -43.608 18.816 1.00 61.34 H new ATOM 1447 N ASP A 95 19.563 -41.000 16.325 1.00 21.42 N ATOM 1448 CA ASP A 95 20.965 -41.363 16.155 1.00 43.15 C ATOM 1449 C ASP A 95 21.688 -40.343 15.280 1.00 12.32 C ATOM 1450 O ASP A 95 22.911 -40.376 15.151 1.00 12.14 O ATOM 1451 CB ASP A 95 21.082 -42.757 15.536 1.00 2.10 C ATOM 1452 CG ASP A 95 20.483 -42.825 14.145 1.00 21.21 C ATOM 1453 OD1 ASP A 95 19.872 -41.826 13.712 1.00 13.33 O ATOM 1454 OD2 ASP A 95 20.626 -43.878 13.489 1.00 43.20 O ATOM 0 H ASP A 95 18.909 -41.589 15.809 1.00 21.42 H new ATOM 0 HA ASP A 95 21.435 -41.370 17.139 1.00 43.15 H new ATOM 0 HB2 ASP A 95 22.133 -43.044 15.490 1.00 2.10 H new ATOM 0 HB3 ASP A 95 20.582 -43.480 16.180 1.00 2.10 H new ATOM 1459 N GLY A 96 20.922 -39.437 14.680 1.00 54.20 N ATOM 1460 CA GLY A 96 21.506 -38.421 13.824 1.00 11.44 C ATOM 1461 C GLY A 96 22.235 -39.013 12.635 1.00 21.40 C ATOM 1462 O GLY A 96 23.240 -38.469 12.180 1.00 11.53 O ATOM 0 H GLY A 96 19.907 -39.389 14.771 1.00 54.20 H new ATOM 0 HA2 GLY A 96 20.720 -37.754 13.469 1.00 11.44 H new ATOM 0 HA3 GLY A 96 22.200 -37.815 14.406 1.00 11.44 H new ATOM 1466 N ASN A 97 21.729 -40.134 12.131 1.00 72.10 N ATOM 1467 CA ASN A 97 22.340 -40.803 10.988 1.00 4.23 C ATOM 1468 C ASN A 97 21.834 -40.211 9.677 1.00 72.05 C ATOM 1469 O ASN A 97 22.428 -40.419 8.619 1.00 13.43 O ATOM 1470 CB ASN A 97 22.045 -42.304 11.031 1.00 4.53 C ATOM 1471 CG ASN A 97 20.583 -42.613 10.778 1.00 54.30 C ATOM 1472 OD1 ASN A 97 19.719 -41.748 10.926 1.00 1.20 O ATOM 1473 ND2 ASN A 97 20.298 -43.852 10.394 1.00 13.31 N ATOM 0 H ASN A 97 20.897 -40.598 12.496 1.00 72.10 H new ATOM 0 HA ASN A 97 23.418 -40.650 11.043 1.00 4.23 H new ATOM 0 HB2 ASN A 97 22.655 -42.813 10.285 1.00 4.53 H new ATOM 0 HB3 ASN A 97 22.334 -42.701 12.004 1.00 4.53 H new ATOM 0 HD21 ASN A 97 19.331 -44.119 10.209 1.00 13.31 H new ATOM 0 HD22 ASN A 97 21.046 -44.537 10.284 1.00 13.31 H new ATOM 1480 N GLY A 98 20.731 -39.472 9.754 1.00 43.33 N ATOM 1481 CA GLY A 98 20.163 -38.861 8.566 1.00 3.42 C ATOM 1482 C GLY A 98 19.232 -39.796 7.822 1.00 60.55 C ATOM 1483 O GLY A 98 18.939 -39.585 6.644 1.00 23.24 O ATOM 0 H GLY A 98 20.221 -39.286 10.617 1.00 43.33 H new ATOM 0 HA2 GLY A 98 19.618 -37.961 8.850 1.00 3.42 H new ATOM 0 HA3 GLY A 98 20.968 -38.550 7.901 1.00 3.42 H new ATOM 1487 N TYR A 99 18.767 -40.834 8.507 1.00 34.53 N ATOM 1488 CA TYR A 99 17.866 -41.809 7.902 1.00 2.31 C ATOM 1489 C TYR A 99 16.787 -42.241 8.890 1.00 2.24 C ATOM 1490 O TYR A 99 17.004 -42.239 10.103 1.00 53.04 O ATOM 1491 CB TYR A 99 18.651 -43.030 7.421 1.00 44.00 C ATOM 1492 CG TYR A 99 19.204 -42.882 6.021 1.00 11.23 C ATOM 1493 CD1 TYR A 99 20.285 -42.048 5.764 1.00 11.34 C ATOM 1494 CD2 TYR A 99 18.645 -43.577 4.956 1.00 41.13 C ATOM 1495 CE1 TYR A 99 20.792 -41.909 4.487 1.00 1.21 C ATOM 1496 CE2 TYR A 99 19.147 -43.445 3.675 1.00 32.23 C ATOM 1497 CZ TYR A 99 20.220 -42.610 3.446 1.00 51.30 C ATOM 1498 OH TYR A 99 20.723 -42.475 2.172 1.00 23.14 O ATOM 0 H TYR A 99 18.999 -41.023 9.482 1.00 34.53 H new ATOM 0 HA TYR A 99 17.382 -41.337 7.047 1.00 2.31 H new ATOM 0 HB2 TYR A 99 19.475 -43.216 8.110 1.00 44.00 H new ATOM 0 HB3 TYR A 99 18.002 -43.905 7.456 1.00 44.00 H new ATOM 0 HD1 TYR A 99 20.737 -41.499 6.577 1.00 11.34 H new ATOM 0 HD2 TYR A 99 17.804 -44.231 5.132 1.00 41.13 H new ATOM 0 HE1 TYR A 99 21.632 -41.255 4.304 1.00 1.21 H new ATOM 0 HE2 TYR A 99 18.701 -43.993 2.858 1.00 32.23 H new ATOM 0 HH TYR A 99 20.208 -43.037 1.556 1.00 23.14 H new ATOM 1508 N ILE A 100 15.625 -42.611 8.363 1.00 63.01 N ATOM 1509 CA ILE A 100 14.513 -43.048 9.197 1.00 13.53 C ATOM 1510 C ILE A 100 14.166 -44.508 8.931 1.00 20.51 C ATOM 1511 O ILE A 100 13.946 -44.907 7.787 1.00 1.53 O ATOM 1512 CB ILE A 100 13.260 -42.183 8.962 1.00 32.32 C ATOM 1513 CG1 ILE A 100 13.566 -40.713 9.254 1.00 14.13 C ATOM 1514 CG2 ILE A 100 12.109 -42.673 9.828 1.00 14.31 C ATOM 1515 CD1 ILE A 100 12.389 -39.792 9.017 1.00 20.21 C ATOM 0 H ILE A 100 15.429 -42.617 7.362 1.00 63.01 H new ATOM 0 HA ILE A 100 14.833 -42.937 10.233 1.00 13.53 H new ATOM 0 HB ILE A 100 12.966 -42.272 7.916 1.00 32.32 H new ATOM 0 HG12 ILE A 100 13.890 -40.617 10.290 1.00 14.13 H new ATOM 0 HG13 ILE A 100 14.399 -40.393 8.629 1.00 14.13 H new ATOM 0 HG21 ILE A 100 11.231 -42.052 9.651 1.00 14.31 H new ATOM 0 HG22 ILE A 100 11.879 -43.708 9.575 1.00 14.31 H new ATOM 0 HG23 ILE A 100 12.392 -42.610 10.879 1.00 14.31 H new ATOM 0 HD11 ILE A 100 12.678 -38.766 9.244 1.00 20.21 H new ATOM 0 HD12 ILE A 100 12.079 -39.859 7.974 1.00 20.21 H new ATOM 0 HD13 ILE A 100 11.561 -40.087 9.662 1.00 20.21 H new ATOM 1527 N SER A 101 14.117 -45.303 9.996 1.00 45.13 N ATOM 1528 CA SER A 101 13.799 -46.721 9.877 1.00 23.03 C ATOM 1529 C SER A 101 12.500 -47.049 10.607 1.00 61.12 C ATOM 1530 O SER A 101 11.787 -46.154 11.059 1.00 35.31 O ATOM 1531 CB SER A 101 14.941 -47.570 10.439 1.00 23.11 C ATOM 1532 OG SER A 101 15.087 -47.370 11.834 1.00 2.33 O ATOM 0 H SER A 101 14.293 -44.989 10.950 1.00 45.13 H new ATOM 0 HA SER A 101 13.670 -46.952 8.820 1.00 23.03 H new ATOM 0 HB2 SER A 101 14.748 -48.624 10.238 1.00 23.11 H new ATOM 0 HB3 SER A 101 15.872 -47.314 9.933 1.00 23.11 H new ATOM 0 HG SER A 101 15.822 -47.925 12.169 1.00 2.33 H new ATOM 1538 N ALA A 102 12.200 -48.339 10.717 1.00 61.13 N ATOM 1539 CA ALA A 102 10.989 -48.787 11.392 1.00 14.23 C ATOM 1540 C ALA A 102 11.065 -48.518 12.891 1.00 12.24 C ATOM 1541 O ALA A 102 10.107 -48.035 13.494 1.00 33.34 O ATOM 1542 CB ALA A 102 10.755 -50.267 11.131 1.00 70.30 C ATOM 0 H ALA A 102 12.780 -49.092 10.347 1.00 61.13 H new ATOM 0 HA ALA A 102 10.149 -48.222 10.990 1.00 14.23 H new ATOM 0 HB1 ALA A 102 9.847 -50.587 11.642 1.00 70.30 H new ATOM 0 HB2 ALA A 102 10.647 -50.435 10.059 1.00 70.30 H new ATOM 0 HB3 ALA A 102 11.603 -50.841 11.505 1.00 70.30 H new ATOM 1548 N ALA A 103 12.210 -48.834 13.487 1.00 11.12 N ATOM 1549 CA ALA A 103 12.411 -48.625 14.916 1.00 50.13 C ATOM 1550 C ALA A 103 12.350 -47.142 15.267 1.00 25.45 C ATOM 1551 O ALA A 103 11.820 -46.765 16.312 1.00 45.43 O ATOM 1552 CB ALA A 103 13.741 -49.219 15.354 1.00 62.51 C ATOM 0 H ALA A 103 13.013 -49.236 13.003 1.00 11.12 H new ATOM 0 HA ALA A 103 11.607 -49.131 15.449 1.00 50.13 H new ATOM 0 HB1 ALA A 103 13.878 -49.056 16.423 1.00 62.51 H new ATOM 0 HB2 ALA A 103 13.747 -50.289 15.147 1.00 62.51 H new ATOM 0 HB3 ALA A 103 14.552 -48.738 14.807 1.00 62.51 H new ATOM 1558 N GLU A 104 12.897 -46.308 14.389 1.00 4.42 N ATOM 1559 CA GLU A 104 12.906 -44.866 14.609 1.00 31.15 C ATOM 1560 C GLU A 104 11.530 -44.266 14.335 1.00 0.35 C ATOM 1561 O GLU A 104 10.977 -43.546 15.168 1.00 32.45 O ATOM 1562 CB GLU A 104 13.953 -44.198 13.716 1.00 3.45 C ATOM 1563 CG GLU A 104 15.377 -44.634 14.017 1.00 63.43 C ATOM 1564 CD GLU A 104 16.405 -43.598 13.604 1.00 74.20 C ATOM 1565 OE1 GLU A 104 16.055 -42.400 13.564 1.00 12.14 O ATOM 1566 OE2 GLU A 104 17.557 -43.985 13.320 1.00 24.04 O ATOM 0 H GLU A 104 13.339 -46.605 13.519 1.00 4.42 H new ATOM 0 HA GLU A 104 13.161 -44.685 15.653 1.00 31.15 H new ATOM 0 HB2 GLU A 104 13.726 -44.422 12.674 1.00 3.45 H new ATOM 0 HB3 GLU A 104 13.881 -43.117 13.832 1.00 3.45 H new ATOM 0 HG2 GLU A 104 15.474 -44.831 15.085 1.00 63.43 H new ATOM 0 HG3 GLU A 104 15.583 -45.571 13.500 1.00 63.43 H new ATOM 1573 N LEU A 105 10.983 -44.565 13.162 1.00 24.55 N ATOM 1574 CA LEU A 105 9.672 -44.056 12.777 1.00 41.42 C ATOM 1575 C LEU A 105 8.628 -44.378 13.841 1.00 0.42 C ATOM 1576 O LEU A 105 7.915 -43.492 14.313 1.00 32.11 O ATOM 1577 CB LEU A 105 9.247 -44.650 11.433 1.00 70.00 C ATOM 1578 CG LEU A 105 7.846 -44.277 10.947 1.00 10.11 C ATOM 1579 CD1 LEU A 105 7.801 -42.819 10.517 1.00 52.01 C ATOM 1580 CD2 LEU A 105 7.418 -45.186 9.804 1.00 43.20 C ATOM 0 H LEU A 105 11.427 -45.158 12.461 1.00 24.55 H new ATOM 0 HA LEU A 105 9.744 -42.973 12.682 1.00 41.42 H new ATOM 0 HB2 LEU A 105 9.967 -44.338 10.677 1.00 70.00 H new ATOM 0 HB3 LEU A 105 9.308 -45.736 11.503 1.00 70.00 H new ATOM 0 HG LEU A 105 7.148 -44.413 11.773 1.00 10.11 H new ATOM 0 HD11 LEU A 105 6.796 -42.572 10.174 1.00 52.01 H new ATOM 0 HD12 LEU A 105 8.063 -42.182 11.362 1.00 52.01 H new ATOM 0 HD13 LEU A 105 8.511 -42.657 9.706 1.00 52.01 H new ATOM 0 HD21 LEU A 105 6.419 -44.906 9.471 1.00 43.20 H new ATOM 0 HD22 LEU A 105 8.119 -45.083 8.975 1.00 43.20 H new ATOM 0 HD23 LEU A 105 7.410 -46.221 10.146 1.00 43.20 H new ATOM 1592 N ARG A 106 8.546 -45.650 14.216 1.00 33.01 N ATOM 1593 CA ARG A 106 7.590 -46.089 15.226 1.00 53.33 C ATOM 1594 C ARG A 106 7.710 -45.245 16.492 1.00 64.34 C ATOM 1595 O ARG A 106 6.706 -44.840 17.078 1.00 5.03 O ATOM 1596 CB ARG A 106 7.811 -47.565 15.561 1.00 54.15 C ATOM 1597 CG ARG A 106 6.746 -48.148 16.475 1.00 75.12 C ATOM 1598 CD ARG A 106 7.230 -49.419 17.155 1.00 4.43 C ATOM 1599 NE ARG A 106 6.174 -50.060 17.933 1.00 72.41 N ATOM 1600 CZ ARG A 106 6.397 -51.018 18.826 1.00 10.22 C ATOM 1601 NH1 ARG A 106 7.632 -51.442 19.054 1.00 44.31 N ATOM 1602 NH2 ARG A 106 5.383 -51.553 19.494 1.00 1.03 N ATOM 0 H ARG A 106 9.130 -46.395 13.836 1.00 33.01 H new ATOM 0 HA ARG A 106 6.587 -45.962 14.820 1.00 53.33 H new ATOM 0 HB2 ARG A 106 7.837 -48.139 14.635 1.00 54.15 H new ATOM 0 HB3 ARG A 106 8.786 -47.679 16.034 1.00 54.15 H new ATOM 0 HG2 ARG A 106 6.471 -47.412 17.231 1.00 75.12 H new ATOM 0 HG3 ARG A 106 5.847 -48.363 15.897 1.00 75.12 H new ATOM 0 HD2 ARG A 106 7.599 -50.115 16.402 1.00 4.43 H new ATOM 0 HD3 ARG A 106 8.070 -49.183 17.809 1.00 4.43 H new ATOM 0 HE ARG A 106 5.212 -49.756 17.783 1.00 72.41 H new ATOM 0 HH11 ARG A 106 8.414 -51.033 18.543 1.00 44.31 H new ATOM 0 HH12 ARG A 106 7.800 -52.178 19.740 1.00 44.31 H new ATOM 0 HH21 ARG A 106 4.431 -51.229 19.322 1.00 1.03 H new ATOM 0 HH22 ARG A 106 5.555 -52.288 20.179 1.00 1.03 H new ATOM 1616 N HIS A 107 8.946 -44.985 16.908 1.00 71.14 N ATOM 1617 CA HIS A 107 9.198 -44.190 18.104 1.00 1.01 C ATOM 1618 C HIS A 107 8.486 -42.843 18.022 1.00 72.25 C ATOM 1619 O HIS A 107 8.026 -42.310 19.031 1.00 11.42 O ATOM 1620 CB HIS A 107 10.700 -43.975 18.292 1.00 42.11 C ATOM 1621 CG HIS A 107 11.054 -43.320 19.592 1.00 74.23 C ATOM 1622 ND1 HIS A 107 11.006 -43.977 20.803 1.00 71.40 N ATOM 1623 CD2 HIS A 107 11.464 -42.060 19.865 1.00 12.43 C ATOM 1624 CE1 HIS A 107 11.370 -43.149 21.766 1.00 72.05 C ATOM 1625 NE2 HIS A 107 11.653 -41.979 21.223 1.00 43.31 N ATOM 0 H HIS A 107 9.788 -45.313 16.434 1.00 71.14 H new ATOM 0 HA HIS A 107 8.806 -44.736 18.962 1.00 1.01 H new ATOM 0 HB2 HIS A 107 11.207 -44.938 18.230 1.00 42.11 H new ATOM 0 HB3 HIS A 107 11.076 -43.363 17.472 1.00 42.11 H new ATOM 0 HD2 HIS A 107 11.615 -41.266 19.149 1.00 12.43 H new ATOM 0 HE1 HIS A 107 11.426 -43.388 22.818 1.00 72.05 H new ATOM 0 HE2 HIS A 107 11.962 -41.150 21.730 1.00 43.31 H new ATOM 1633 N VAL A 108 8.399 -42.298 16.812 1.00 31.22 N ATOM 1634 CA VAL A 108 7.743 -41.014 16.598 1.00 73.13 C ATOM 1635 C VAL A 108 6.234 -41.129 16.788 1.00 25.13 C ATOM 1636 O VAL A 108 5.624 -40.322 17.489 1.00 70.22 O ATOM 1637 CB VAL A 108 8.031 -40.465 15.188 1.00 74.23 C ATOM 1638 CG1 VAL A 108 7.313 -39.141 14.973 1.00 23.12 C ATOM 1639 CG2 VAL A 108 9.528 -40.311 14.972 1.00 5.42 C ATOM 0 H VAL A 108 8.775 -42.726 15.966 1.00 31.22 H new ATOM 0 HA VAL A 108 8.148 -40.324 17.339 1.00 73.13 H new ATOM 0 HB VAL A 108 7.653 -41.178 14.455 1.00 74.23 H new ATOM 0 HG11 VAL A 108 7.528 -38.769 13.971 1.00 23.12 H new ATOM 0 HG12 VAL A 108 6.238 -39.288 15.082 1.00 23.12 H new ATOM 0 HG13 VAL A 108 7.657 -38.416 15.711 1.00 23.12 H new ATOM 0 HG21 VAL A 108 9.713 -39.922 13.971 1.00 5.42 H new ATOM 0 HG22 VAL A 108 9.933 -39.619 15.711 1.00 5.42 H new ATOM 0 HG23 VAL A 108 10.013 -41.281 15.080 1.00 5.42 H new ATOM 1649 N MET A 109 5.639 -42.138 16.160 1.00 5.12 N ATOM 1650 CA MET A 109 4.202 -42.360 16.262 1.00 13.42 C ATOM 1651 C MET A 109 3.805 -42.702 17.695 1.00 53.42 C ATOM 1652 O MET A 109 2.682 -42.430 18.121 1.00 53.40 O ATOM 1653 CB MET A 109 3.769 -43.484 15.319 1.00 42.44 C ATOM 1654 CG MET A 109 2.384 -43.281 14.727 1.00 35.24 C ATOM 1655 SD MET A 109 2.313 -41.889 13.584 1.00 71.24 S ATOM 1656 CE MET A 109 1.111 -42.486 12.397 1.00 31.35 C ATOM 0 H MET A 109 6.130 -42.814 15.575 1.00 5.12 H new ATOM 0 HA MET A 109 3.696 -41.439 15.973 1.00 13.42 H new ATOM 0 HB2 MET A 109 4.493 -43.566 14.508 1.00 42.44 H new ATOM 0 HB3 MET A 109 3.788 -44.430 15.861 1.00 42.44 H new ATOM 0 HG2 MET A 109 2.079 -44.189 14.207 1.00 35.24 H new ATOM 0 HG3 MET A 109 1.669 -43.120 15.534 1.00 35.24 H new ATOM 0 HE1 MET A 109 0.879 -41.694 11.685 1.00 31.35 H new ATOM 0 HE2 MET A 109 1.521 -43.344 11.865 1.00 31.35 H new ATOM 0 HE3 MET A 109 0.201 -42.783 12.919 1.00 31.35 H new ATOM 1666 N THR A 110 4.733 -43.300 18.435 1.00 70.22 N ATOM 1667 CA THR A 110 4.479 -43.680 19.819 1.00 62.54 C ATOM 1668 C THR A 110 4.193 -42.457 20.681 1.00 14.14 C ATOM 1669 O THR A 110 3.440 -42.533 21.652 1.00 42.43 O ATOM 1670 CB THR A 110 5.672 -44.449 20.418 1.00 61.03 C ATOM 1671 OG1 THR A 110 6.089 -45.484 19.520 1.00 34.23 O ATOM 1672 CG2 THR A 110 5.304 -45.055 21.764 1.00 63.34 C ATOM 0 H THR A 110 5.668 -43.532 18.099 1.00 70.22 H new ATOM 0 HA THR A 110 3.604 -44.329 19.813 1.00 62.54 H new ATOM 0 HB THR A 110 6.492 -43.746 20.566 1.00 61.03 H new ATOM 0 HG1 THR A 110 6.647 -45.098 18.813 1.00 34.23 H new ATOM 0 HG21 THR A 110 6.162 -45.593 22.168 1.00 63.34 H new ATOM 0 HG22 THR A 110 5.016 -44.262 22.454 1.00 63.34 H new ATOM 0 HG23 THR A 110 4.470 -45.745 21.636 1.00 63.34 H new ATOM 1680 N ASN A 111 4.797 -41.330 20.321 1.00 41.53 N ATOM 1681 CA ASN A 111 4.606 -40.089 21.063 1.00 42.31 C ATOM 1682 C ASN A 111 3.234 -39.487 20.773 1.00 45.01 C ATOM 1683 O ASN A 111 2.685 -38.745 21.588 1.00 51.20 O ATOM 1684 CB ASN A 111 5.702 -39.083 20.706 1.00 5.21 C ATOM 1685 CG ASN A 111 6.912 -39.199 21.614 1.00 72.43 C ATOM 1686 OD1 ASN A 111 7.338 -40.301 21.960 1.00 34.34 O ATOM 1687 ND2 ASN A 111 7.471 -38.060 22.003 1.00 10.34 N ATOM 0 H ASN A 111 5.423 -41.250 19.520 1.00 41.53 H new ATOM 0 HA ASN A 111 4.665 -40.319 22.127 1.00 42.31 H new ATOM 0 HB2 ASN A 111 6.011 -39.238 19.672 1.00 5.21 H new ATOM 0 HB3 ASN A 111 5.299 -38.072 20.770 1.00 5.21 H new ATOM 0 HD21 ASN A 111 8.288 -38.075 22.614 1.00 10.34 H new ATOM 0 HD22 ASN A 111 7.084 -37.169 21.691 1.00 10.34 H new ATOM 1694 N LEU A 112 2.687 -39.812 19.607 1.00 35.23 N ATOM 1695 CA LEU A 112 1.378 -39.305 19.209 1.00 41.21 C ATOM 1696 C LEU A 112 0.270 -39.944 20.040 1.00 1.31 C ATOM 1697 O LEU A 112 -0.800 -39.364 20.217 1.00 54.33 O ATOM 1698 CB LEU A 112 1.136 -39.574 17.723 1.00 52.44 C ATOM 1699 CG LEU A 112 1.564 -38.464 16.761 1.00 33.14 C ATOM 1700 CD1 LEU A 112 0.642 -37.261 16.891 1.00 64.13 C ATOM 1701 CD2 LEU A 112 3.008 -38.062 17.020 1.00 24.11 C ATOM 0 H LEU A 112 3.129 -40.424 18.921 1.00 35.23 H new ATOM 0 HA LEU A 112 1.364 -38.229 19.385 1.00 41.21 H new ATOM 0 HB2 LEU A 112 1.663 -40.488 17.449 1.00 52.44 H new ATOM 0 HB3 LEU A 112 0.073 -39.764 17.577 1.00 52.44 H new ATOM 0 HG LEU A 112 1.491 -38.844 15.742 1.00 33.14 H new ATOM 0 HD11 LEU A 112 0.961 -36.481 16.199 1.00 64.13 H new ATOM 0 HD12 LEU A 112 -0.380 -37.559 16.656 1.00 64.13 H new ATOM 0 HD13 LEU A 112 0.683 -36.880 17.911 1.00 64.13 H new ATOM 0 HD21 LEU A 112 3.296 -37.272 16.327 1.00 24.11 H new ATOM 0 HD22 LEU A 112 3.107 -37.701 18.044 1.00 24.11 H new ATOM 0 HD23 LEU A 112 3.658 -38.925 16.875 1.00 24.11 H new ATOM 1713 N GLY A 113 0.536 -41.142 20.550 1.00 22.34 N ATOM 1714 CA GLY A 113 -0.447 -41.839 21.359 1.00 61.20 C ATOM 1715 C GLY A 113 -1.202 -42.893 20.573 1.00 11.22 C ATOM 1716 O GLY A 113 -2.287 -43.315 20.973 1.00 45.01 O ATOM 0 H GLY A 113 1.415 -41.643 20.418 1.00 22.34 H new ATOM 0 HA2 GLY A 113 0.052 -42.310 22.206 1.00 61.20 H new ATOM 0 HA3 GLY A 113 -1.155 -41.118 21.767 1.00 61.20 H new ATOM 1720 N GLU A 114 -0.628 -43.317 19.452 1.00 52.15 N ATOM 1721 CA GLU A 114 -1.257 -44.326 18.607 1.00 43.10 C ATOM 1722 C GLU A 114 -0.587 -45.684 18.792 1.00 23.41 C ATOM 1723 O GLU A 114 0.574 -45.873 18.426 1.00 13.42 O ATOM 1724 CB GLU A 114 -1.188 -43.907 17.137 1.00 60.21 C ATOM 1725 CG GLU A 114 -2.347 -44.424 16.302 1.00 72.41 C ATOM 1726 CD GLU A 114 -2.686 -45.871 16.607 1.00 52.44 C ATOM 1727 OE1 GLU A 114 -3.450 -46.111 17.565 1.00 3.03 O ATOM 1728 OE2 GLU A 114 -2.188 -46.762 15.887 1.00 12.44 O ATOM 0 H GLU A 114 0.270 -42.978 19.108 1.00 52.15 H new ATOM 0 HA GLU A 114 -2.302 -44.412 18.904 1.00 43.10 H new ATOM 0 HB2 GLU A 114 -1.166 -42.819 17.079 1.00 60.21 H new ATOM 0 HB3 GLU A 114 -0.253 -44.268 16.709 1.00 60.21 H new ATOM 0 HG2 GLU A 114 -3.225 -43.803 16.482 1.00 72.41 H new ATOM 0 HG3 GLU A 114 -2.100 -44.328 15.245 1.00 72.41 H new ATOM 1735 N LYS A 115 -1.326 -46.629 19.363 1.00 31.14 N ATOM 1736 CA LYS A 115 -0.806 -47.971 19.598 1.00 74.14 C ATOM 1737 C LYS A 115 -0.514 -48.679 18.279 1.00 72.34 C ATOM 1738 O LYS A 115 -1.390 -48.804 17.422 1.00 73.12 O ATOM 1739 CB LYS A 115 -1.804 -48.791 20.419 1.00 55.34 C ATOM 1740 CG LYS A 115 -1.610 -48.660 21.919 1.00 22.23 C ATOM 1741 CD LYS A 115 -2.496 -49.630 22.683 1.00 52.20 C ATOM 1742 CE LYS A 115 -1.885 -51.022 22.734 1.00 1.44 C ATOM 1743 NZ LYS A 115 -0.909 -51.158 23.851 1.00 41.12 N ATOM 0 H LYS A 115 -2.288 -46.490 19.672 1.00 31.14 H new ATOM 0 HA LYS A 115 0.126 -47.880 20.156 1.00 74.14 H new ATOM 0 HB2 LYS A 115 -2.816 -48.478 20.163 1.00 55.34 H new ATOM 0 HB3 LYS A 115 -1.715 -49.841 20.140 1.00 55.34 H new ATOM 0 HG2 LYS A 115 -0.565 -48.846 22.169 1.00 22.23 H new ATOM 0 HG3 LYS A 115 -1.835 -47.639 22.228 1.00 22.23 H new ATOM 0 HD2 LYS A 115 -2.650 -49.262 23.697 1.00 52.20 H new ATOM 0 HD3 LYS A 115 -3.476 -49.679 22.209 1.00 52.20 H new ATOM 0 HE2 LYS A 115 -2.677 -51.762 22.851 1.00 1.44 H new ATOM 0 HE3 LYS A 115 -1.387 -51.235 21.788 1.00 1.44 H new ATOM 0 HZ1 LYS A 115 -0.515 -52.120 23.852 1.00 41.12 H new ATOM 0 HZ2 LYS A 115 -0.140 -50.469 23.726 1.00 41.12 H new ATOM 0 HZ3 LYS A 115 -1.390 -50.980 24.756 1.00 41.12 H new ATOM 1757 N LEU A 116 0.721 -49.142 18.122 1.00 30.42 N ATOM 1758 CA LEU A 116 1.128 -49.840 16.907 1.00 23.15 C ATOM 1759 C LEU A 116 2.006 -51.043 17.239 1.00 40.23 C ATOM 1760 O LEU A 116 2.581 -51.126 18.325 1.00 75.32 O ATOM 1761 CB LEU A 116 1.879 -48.887 15.976 1.00 64.30 C ATOM 1762 CG LEU A 116 1.202 -47.544 15.702 1.00 43.11 C ATOM 1763 CD1 LEU A 116 2.241 -46.472 15.413 1.00 42.33 C ATOM 1764 CD2 LEU A 116 0.223 -47.667 14.543 1.00 2.24 C ATOM 0 H LEU A 116 1.458 -49.047 18.821 1.00 30.42 H new ATOM 0 HA LEU A 116 0.230 -50.197 16.403 1.00 23.15 H new ATOM 0 HB2 LEU A 116 2.863 -48.695 16.403 1.00 64.30 H new ATOM 0 HB3 LEU A 116 2.038 -49.392 15.023 1.00 64.30 H new ATOM 0 HG LEU A 116 0.645 -47.251 16.592 1.00 43.11 H new ATOM 0 HD11 LEU A 116 1.741 -45.523 15.220 1.00 42.33 H new ATOM 0 HD12 LEU A 116 2.903 -46.365 16.273 1.00 42.33 H new ATOM 0 HD13 LEU A 116 2.825 -46.758 14.539 1.00 42.33 H new ATOM 0 HD21 LEU A 116 -0.250 -46.702 14.362 1.00 2.24 H new ATOM 0 HD22 LEU A 116 0.758 -47.983 13.647 1.00 2.24 H new ATOM 0 HD23 LEU A 116 -0.541 -48.405 14.789 1.00 2.24 H new ATOM 1776 N THR A 117 2.108 -51.973 16.294 1.00 35.12 N ATOM 1777 CA THR A 117 2.916 -53.171 16.485 1.00 50.43 C ATOM 1778 C THR A 117 4.036 -53.248 15.454 1.00 41.54 C ATOM 1779 O THR A 117 4.041 -52.505 14.472 1.00 41.41 O ATOM 1780 CB THR A 117 2.059 -54.447 16.392 1.00 63.44 C ATOM 1781 OG1 THR A 117 1.601 -54.633 15.048 1.00 53.32 O ATOM 1782 CG2 THR A 117 0.867 -54.369 17.333 1.00 23.14 C ATOM 0 H THR A 117 1.641 -51.919 15.389 1.00 35.12 H new ATOM 0 HA THR A 117 3.349 -53.105 17.483 1.00 50.43 H new ATOM 0 HB THR A 117 2.678 -55.295 16.685 1.00 63.44 H new ATOM 0 HG1 THR A 117 1.058 -55.447 14.997 1.00 53.32 H new ATOM 0 HG21 THR A 117 0.277 -55.282 17.249 1.00 23.14 H new ATOM 0 HG22 THR A 117 1.220 -54.258 18.358 1.00 23.14 H new ATOM 0 HG23 THR A 117 0.249 -53.512 17.067 1.00 23.14 H new ATOM 1790 N ASP A 118 4.983 -54.151 15.682 1.00 1.41 N ATOM 1791 CA ASP A 118 6.108 -54.326 14.771 1.00 3.12 C ATOM 1792 C ASP A 118 5.622 -54.526 13.339 1.00 2.31 C ATOM 1793 O ASP A 118 6.254 -54.064 12.390 1.00 61.25 O ATOM 1794 CB ASP A 118 6.962 -55.519 15.204 1.00 13.04 C ATOM 1795 CG ASP A 118 7.523 -55.352 16.603 1.00 75.20 C ATOM 1796 OD1 ASP A 118 8.300 -54.399 16.821 1.00 21.31 O ATOM 1797 OD2 ASP A 118 7.183 -56.174 17.480 1.00 43.03 O ATOM 0 H ASP A 118 4.994 -54.773 16.490 1.00 1.41 H new ATOM 0 HA ASP A 118 6.716 -53.422 14.806 1.00 3.12 H new ATOM 0 HB2 ASP A 118 6.360 -56.427 15.163 1.00 13.04 H new ATOM 0 HB3 ASP A 118 7.783 -55.649 14.499 1.00 13.04 H new ATOM 1802 N GLU A 119 4.496 -55.217 13.193 1.00 63.33 N ATOM 1803 CA GLU A 119 3.927 -55.479 11.876 1.00 64.40 C ATOM 1804 C GLU A 119 3.314 -54.213 11.286 1.00 2.42 C ATOM 1805 O GLU A 119 3.369 -53.990 10.077 1.00 1.54 O ATOM 1806 CB GLU A 119 2.867 -56.579 11.964 1.00 62.33 C ATOM 1807 CG GLU A 119 2.189 -56.878 10.637 1.00 20.13 C ATOM 1808 CD GLU A 119 1.217 -58.038 10.727 1.00 31.45 C ATOM 1809 OE1 GLU A 119 1.177 -58.697 11.788 1.00 64.33 O ATOM 1810 OE2 GLU A 119 0.496 -58.288 9.739 1.00 43.33 O ATOM 0 H GLU A 119 3.960 -55.605 13.969 1.00 63.33 H new ATOM 0 HA GLU A 119 4.732 -55.811 11.220 1.00 64.40 H new ATOM 0 HB2 GLU A 119 3.332 -57.491 12.339 1.00 62.33 H new ATOM 0 HB3 GLU A 119 2.110 -56.285 12.691 1.00 62.33 H new ATOM 0 HG2 GLU A 119 1.658 -55.989 10.296 1.00 20.13 H new ATOM 0 HG3 GLU A 119 2.948 -57.102 9.888 1.00 20.13 H new ATOM 1817 N GLU A 120 2.730 -53.387 12.150 1.00 61.55 N ATOM 1818 CA GLU A 120 2.105 -52.144 11.714 1.00 63.13 C ATOM 1819 C GLU A 120 3.144 -51.185 11.141 1.00 5.51 C ATOM 1820 O GLU A 120 2.929 -50.569 10.097 1.00 52.00 O ATOM 1821 CB GLU A 120 1.370 -51.481 12.880 1.00 4.53 C ATOM 1822 CG GLU A 120 0.383 -50.410 12.447 1.00 33.14 C ATOM 1823 CD GLU A 120 -0.747 -50.966 11.603 1.00 34.11 C ATOM 1824 OE1 GLU A 120 -1.016 -52.182 11.697 1.00 14.21 O ATOM 1825 OE2 GLU A 120 -1.363 -50.185 10.848 1.00 11.51 O ATOM 0 H GLU A 120 2.677 -53.557 13.154 1.00 61.55 H new ATOM 0 HA GLU A 120 1.386 -52.383 10.930 1.00 63.13 H new ATOM 0 HB2 GLU A 120 0.838 -52.246 13.445 1.00 4.53 H new ATOM 0 HB3 GLU A 120 2.102 -51.037 13.555 1.00 4.53 H new ATOM 0 HG2 GLU A 120 -0.033 -49.926 13.331 1.00 33.14 H new ATOM 0 HG3 GLU A 120 0.911 -49.642 11.881 1.00 33.14 H new ATOM 1832 N VAL A 121 4.273 -51.062 11.833 1.00 70.01 N ATOM 1833 CA VAL A 121 5.347 -50.178 11.394 1.00 34.41 C ATOM 1834 C VAL A 121 5.818 -50.542 9.991 1.00 44.13 C ATOM 1835 O VAL A 121 6.089 -49.666 9.169 1.00 3.34 O ATOM 1836 CB VAL A 121 6.547 -50.232 12.358 1.00 60.54 C ATOM 1837 CG1 VAL A 121 7.648 -49.291 11.893 1.00 54.11 C ATOM 1838 CG2 VAL A 121 6.108 -49.895 13.774 1.00 1.24 C ATOM 0 H VAL A 121 4.467 -51.563 12.700 1.00 70.01 H new ATOM 0 HA VAL A 121 4.942 -49.166 11.387 1.00 34.41 H new ATOM 0 HB VAL A 121 6.946 -51.246 12.358 1.00 60.54 H new ATOM 0 HG11 VAL A 121 8.488 -49.343 12.586 1.00 54.11 H new ATOM 0 HG12 VAL A 121 7.981 -49.584 10.897 1.00 54.11 H new ATOM 0 HG13 VAL A 121 7.266 -48.271 11.862 1.00 54.11 H new ATOM 0 HG21 VAL A 121 6.969 -49.938 14.442 1.00 1.24 H new ATOM 0 HG22 VAL A 121 5.683 -48.891 13.794 1.00 1.24 H new ATOM 0 HG23 VAL A 121 5.357 -50.614 14.103 1.00 1.24 H new ATOM 1848 N ASP A 122 5.914 -51.839 9.722 1.00 22.44 N ATOM 1849 CA ASP A 122 6.352 -52.320 8.417 1.00 41.10 C ATOM 1850 C ASP A 122 5.534 -51.679 7.300 1.00 64.22 C ATOM 1851 O ASP A 122 6.089 -51.161 6.331 1.00 30.51 O ATOM 1852 CB ASP A 122 6.233 -53.843 8.344 1.00 12.02 C ATOM 1853 CG ASP A 122 6.769 -54.404 7.042 1.00 62.11 C ATOM 1854 OD1 ASP A 122 6.023 -54.397 6.040 1.00 31.24 O ATOM 1855 OD2 ASP A 122 7.936 -54.849 7.024 1.00 34.30 O ATOM 0 H ASP A 122 5.694 -52.577 10.391 1.00 22.44 H new ATOM 0 HA ASP A 122 7.397 -52.039 8.285 1.00 41.10 H new ATOM 0 HB2 ASP A 122 6.776 -54.287 9.178 1.00 12.02 H new ATOM 0 HB3 ASP A 122 5.187 -54.129 8.456 1.00 12.02 H new ATOM 1860 N GLU A 123 4.213 -51.720 7.442 1.00 3.43 N ATOM 1861 CA GLU A 123 3.320 -51.144 6.444 1.00 70.55 C ATOM 1862 C GLU A 123 3.648 -49.674 6.203 1.00 13.40 C ATOM 1863 O GLU A 123 3.435 -49.150 5.110 1.00 64.44 O ATOM 1864 CB GLU A 123 1.863 -51.288 6.888 1.00 53.35 C ATOM 1865 CG GLU A 123 0.859 -50.958 5.796 1.00 74.43 C ATOM 1866 CD GLU A 123 0.740 -52.060 4.761 1.00 72.32 C ATOM 1867 OE1 GLU A 123 0.550 -53.229 5.159 1.00 44.14 O ATOM 1868 OE2 GLU A 123 0.836 -51.755 3.554 1.00 4.40 O ATOM 0 H GLU A 123 3.738 -52.146 8.238 1.00 3.43 H new ATOM 0 HA GLU A 123 3.463 -51.687 5.510 1.00 70.55 H new ATOM 0 HB2 GLU A 123 1.695 -52.310 7.228 1.00 53.35 H new ATOM 0 HB3 GLU A 123 1.686 -50.635 7.742 1.00 53.35 H new ATOM 0 HG2 GLU A 123 -0.118 -50.781 6.247 1.00 74.43 H new ATOM 0 HG3 GLU A 123 1.155 -50.032 5.303 1.00 74.43 H new ATOM 1875 N MET A 124 4.166 -49.013 7.233 1.00 13.23 N ATOM 1876 CA MET A 124 4.523 -47.603 7.134 1.00 4.42 C ATOM 1877 C MET A 124 5.777 -47.418 6.285 1.00 22.12 C ATOM 1878 O MET A 124 5.748 -46.738 5.259 1.00 5.33 O ATOM 1879 CB MET A 124 4.745 -47.012 8.528 1.00 44.43 C ATOM 1880 CG MET A 124 4.335 -45.552 8.641 1.00 24.33 C ATOM 1881 SD MET A 124 3.786 -45.112 10.302 1.00 65.35 S ATOM 1882 CE MET A 124 3.751 -43.325 10.184 1.00 24.30 C ATOM 0 H MET A 124 4.348 -49.431 8.145 1.00 13.23 H new ATOM 0 HA MET A 124 3.698 -47.078 6.652 1.00 4.42 H new ATOM 0 HB2 MET A 124 4.182 -47.597 9.256 1.00 44.43 H new ATOM 0 HB3 MET A 124 5.799 -47.106 8.790 1.00 44.43 H new ATOM 0 HG2 MET A 124 5.177 -44.919 8.361 1.00 24.33 H new ATOM 0 HG3 MET A 124 3.533 -45.348 7.931 1.00 24.33 H new ATOM 0 HE1 MET A 124 4.197 -42.892 11.080 1.00 24.30 H new ATOM 0 HE2 MET A 124 4.316 -43.007 9.308 1.00 24.30 H new ATOM 0 HE3 MET A 124 2.719 -42.987 10.093 1.00 24.30 H new ATOM 1892 N ILE A 125 6.875 -48.027 6.719 1.00 22.44 N ATOM 1893 CA ILE A 125 8.138 -47.930 5.998 1.00 22.22 C ATOM 1894 C ILE A 125 7.973 -48.350 4.541 1.00 10.34 C ATOM 1895 O ILE A 125 8.604 -47.786 3.647 1.00 24.42 O ATOM 1896 CB ILE A 125 9.228 -48.801 6.651 1.00 32.00 C ATOM 1897 CG1 ILE A 125 9.525 -48.307 8.069 1.00 75.44 C ATOM 1898 CG2 ILE A 125 10.492 -48.790 5.805 1.00 62.00 C ATOM 1899 CD1 ILE A 125 10.174 -46.942 8.109 1.00 25.12 C ATOM 0 H ILE A 125 6.916 -48.593 7.567 1.00 22.44 H new ATOM 0 HA ILE A 125 8.446 -46.885 6.040 1.00 22.22 H new ATOM 0 HB ILE A 125 8.864 -49.827 6.713 1.00 32.00 H new ATOM 0 HG12 ILE A 125 8.595 -48.275 8.636 1.00 75.44 H new ATOM 0 HG13 ILE A 125 10.177 -49.025 8.566 1.00 75.44 H new ATOM 0 HG21 ILE A 125 11.253 -49.410 6.279 1.00 62.00 H new ATOM 0 HG22 ILE A 125 10.270 -49.184 4.813 1.00 62.00 H new ATOM 0 HG23 ILE A 125 10.861 -47.768 5.715 1.00 62.00 H new ATOM 0 HD11 ILE A 125 10.356 -46.656 9.145 1.00 25.12 H new ATOM 0 HD12 ILE A 125 11.121 -46.973 7.570 1.00 25.12 H new ATOM 0 HD13 ILE A 125 9.514 -46.212 7.641 1.00 25.12 H new ATOM 1911 N ARG A 126 7.119 -49.341 4.310 1.00 32.21 N ATOM 1912 CA ARG A 126 6.870 -49.836 2.962 1.00 73.14 C ATOM 1913 C ARG A 126 6.247 -48.749 2.090 1.00 63.30 C ATOM 1914 O ARG A 126 6.474 -48.705 0.881 1.00 14.03 O ATOM 1915 CB ARG A 126 5.951 -51.058 3.006 1.00 75.24 C ATOM 1916 CG ARG A 126 5.916 -51.841 1.703 1.00 32.34 C ATOM 1917 CD ARG A 126 5.498 -53.285 1.933 1.00 64.52 C ATOM 1918 NE ARG A 126 5.516 -54.063 0.697 1.00 74.12 N ATOM 1919 CZ ARG A 126 5.528 -55.391 0.664 1.00 30.01 C ATOM 1920 NH1 ARG A 126 5.525 -56.085 1.794 1.00 73.34 N ATOM 1921 NH2 ARG A 126 5.543 -56.027 -0.500 1.00 61.14 N ATOM 0 H ARG A 126 6.588 -49.817 5.039 1.00 32.21 H new ATOM 0 HA ARG A 126 7.826 -50.125 2.526 1.00 73.14 H new ATOM 0 HB2 ARG A 126 6.278 -51.719 3.809 1.00 75.24 H new ATOM 0 HB3 ARG A 126 4.940 -50.733 3.252 1.00 75.24 H new ATOM 0 HG2 ARG A 126 5.222 -51.366 1.010 1.00 32.34 H new ATOM 0 HG3 ARG A 126 6.900 -51.816 1.235 1.00 32.34 H new ATOM 0 HD2 ARG A 126 6.167 -53.745 2.661 1.00 64.52 H new ATOM 0 HD3 ARG A 126 4.496 -53.309 2.362 1.00 64.52 H new ATOM 0 HE ARG A 126 5.520 -53.559 -0.190 1.00 74.12 H new ATOM 0 HH11 ARG A 126 5.513 -55.599 2.691 1.00 73.34 H new ATOM 0 HH12 ARG A 126 5.534 -57.105 1.766 1.00 73.34 H new ATOM 0 HH21 ARG A 126 5.545 -55.496 -1.371 1.00 61.14 H new ATOM 0 HH22 ARG A 126 5.552 -57.047 -0.524 1.00 61.14 H new ATOM 1935 N GLU A 127 5.462 -47.876 2.713 1.00 43.43 N ATOM 1936 CA GLU A 127 4.807 -46.790 1.993 1.00 74.33 C ATOM 1937 C GLU A 127 5.813 -45.714 1.597 1.00 0.53 C ATOM 1938 O GLU A 127 5.873 -45.301 0.440 1.00 45.34 O ATOM 1939 CB GLU A 127 3.697 -46.177 2.850 1.00 43.12 C ATOM 1940 CG GLU A 127 2.666 -45.402 2.047 1.00 2.51 C ATOM 1941 CD GLU A 127 3.164 -44.033 1.625 1.00 2.23 C ATOM 1942 OE1 GLU A 127 4.139 -43.543 2.232 1.00 2.51 O ATOM 1943 OE2 GLU A 127 2.578 -43.452 0.688 1.00 63.14 O ATOM 0 H GLU A 127 5.264 -47.899 3.713 1.00 43.43 H new ATOM 0 HA GLU A 127 4.368 -47.203 1.085 1.00 74.33 H new ATOM 0 HB2 GLU A 127 3.194 -46.972 3.401 1.00 43.12 H new ATOM 0 HB3 GLU A 127 4.145 -45.512 3.588 1.00 43.12 H new ATOM 0 HG2 GLU A 127 2.396 -45.975 1.160 1.00 2.51 H new ATOM 0 HG3 GLU A 127 1.759 -45.287 2.641 1.00 2.51 H new ATOM 1950 N ALA A 128 6.601 -45.263 2.568 1.00 32.02 N ATOM 1951 CA ALA A 128 7.605 -44.236 2.322 1.00 3.13 C ATOM 1952 C ALA A 128 8.745 -44.777 1.466 1.00 41.33 C ATOM 1953 O ALA A 128 9.408 -44.025 0.752 1.00 44.55 O ATOM 1954 CB ALA A 128 8.142 -43.697 3.640 1.00 44.22 C ATOM 0 H ALA A 128 6.563 -45.593 3.532 1.00 32.02 H new ATOM 0 HA ALA A 128 7.130 -43.421 1.775 1.00 3.13 H new ATOM 0 HB1 ALA A 128 8.891 -42.931 3.441 1.00 44.22 H new ATOM 0 HB2 ALA A 128 7.324 -43.264 4.216 1.00 44.22 H new ATOM 0 HB3 ALA A 128 8.596 -44.509 4.208 1.00 44.22 H new ATOM 1960 N ASP A 129 8.968 -46.084 1.543 1.00 73.05 N ATOM 1961 CA ASP A 129 10.028 -46.726 0.774 1.00 52.34 C ATOM 1962 C ASP A 129 9.634 -46.851 -0.695 1.00 22.42 C ATOM 1963 O ASP A 129 9.098 -47.876 -1.118 1.00 52.21 O ATOM 1964 CB ASP A 129 10.341 -48.107 1.351 1.00 70.14 C ATOM 1965 CG ASP A 129 11.567 -48.734 0.718 1.00 63.54 C ATOM 1966 OD1 ASP A 129 12.326 -48.006 0.043 1.00 34.31 O ATOM 1967 OD2 ASP A 129 11.769 -49.953 0.897 1.00 24.43 O ATOM 0 H ASP A 129 8.429 -46.720 2.130 1.00 73.05 H new ATOM 0 HA ASP A 129 10.920 -46.103 0.840 1.00 52.34 H new ATOM 0 HB2 ASP A 129 10.494 -48.022 2.427 1.00 70.14 H new ATOM 0 HB3 ASP A 129 9.483 -48.763 1.202 1.00 70.14 H new ATOM 1972 N ILE A 130 9.903 -45.803 -1.466 1.00 20.21 N ATOM 1973 CA ILE A 130 9.577 -45.797 -2.886 1.00 53.15 C ATOM 1974 C ILE A 130 10.620 -46.563 -3.693 1.00 55.25 C ATOM 1975 O ILE A 130 10.280 -47.364 -4.565 1.00 12.34 O ATOM 1976 CB ILE A 130 9.473 -44.361 -3.434 1.00 24.10 C ATOM 1977 CG1 ILE A 130 8.409 -43.575 -2.666 1.00 53.33 C ATOM 1978 CG2 ILE A 130 9.154 -44.383 -4.921 1.00 72.02 C ATOM 1979 CD1 ILE A 130 8.856 -42.187 -2.262 1.00 63.35 C ATOM 0 H ILE A 130 10.346 -44.947 -1.131 1.00 20.21 H new ATOM 0 HA ILE A 130 8.609 -46.287 -2.989 1.00 53.15 H new ATOM 0 HB ILE A 130 10.434 -43.865 -3.297 1.00 24.10 H new ATOM 0 HG12 ILE A 130 7.513 -43.494 -3.282 1.00 53.33 H new ATOM 0 HG13 ILE A 130 8.132 -44.133 -1.772 1.00 53.33 H new ATOM 0 HG21 ILE A 130 9.084 -43.361 -5.293 1.00 72.02 H new ATOM 0 HG22 ILE A 130 9.945 -44.910 -5.455 1.00 72.02 H new ATOM 0 HG23 ILE A 130 8.205 -44.894 -5.082 1.00 72.02 H new ATOM 0 HD11 ILE A 130 8.051 -41.688 -1.722 1.00 63.35 H new ATOM 0 HD12 ILE A 130 9.734 -42.260 -1.620 1.00 63.35 H new ATOM 0 HD13 ILE A 130 9.106 -41.611 -3.153 1.00 63.35 H new ATOM 1991 N ASP A 131 11.890 -46.313 -3.397 1.00 11.34 N ATOM 1992 CA ASP A 131 12.984 -46.981 -4.092 1.00 54.13 C ATOM 1993 C ASP A 131 13.087 -48.442 -3.665 1.00 42.34 C ATOM 1994 O ASP A 131 13.840 -49.219 -4.252 1.00 14.42 O ATOM 1995 CB ASP A 131 14.305 -46.262 -3.819 1.00 4.33 C ATOM 1996 CG ASP A 131 14.556 -46.054 -2.338 1.00 31.10 C ATOM 1997 OD1 ASP A 131 14.047 -46.860 -1.531 1.00 60.30 O ATOM 1998 OD2 ASP A 131 15.262 -45.086 -1.986 1.00 54.01 O ATOM 0 H ASP A 131 12.188 -45.652 -2.680 1.00 11.34 H new ATOM 0 HA ASP A 131 12.776 -46.948 -5.162 1.00 54.13 H new ATOM 0 HB2 ASP A 131 15.125 -46.840 -4.246 1.00 4.33 H new ATOM 0 HB3 ASP A 131 14.300 -45.296 -4.323 1.00 4.33 H new ATOM 2003 N GLY A 132 12.326 -48.808 -2.638 1.00 64.54 N ATOM 2004 CA GLY A 132 12.348 -50.175 -2.149 1.00 44.35 C ATOM 2005 C GLY A 132 13.709 -50.578 -1.618 1.00 24.40 C ATOM 2006 O GLY A 132 14.194 -51.674 -1.901 1.00 34.42 O ATOM 0 H GLY A 132 11.695 -48.183 -2.136 1.00 64.54 H new ATOM 0 HA2 GLY A 132 11.605 -50.287 -1.359 1.00 44.35 H new ATOM 0 HA3 GLY A 132 12.061 -50.851 -2.955 1.00 44.35 H new ATOM 2010 N ASP A 133 14.329 -49.691 -0.847 1.00 73.15 N ATOM 2011 CA ASP A 133 15.643 -49.960 -0.276 1.00 31.35 C ATOM 2012 C ASP A 133 15.515 -50.640 1.084 1.00 31.20 C ATOM 2013 O ASP A 133 16.477 -51.209 1.598 1.00 1.01 O ATOM 2014 CB ASP A 133 16.438 -48.661 -0.137 1.00 63.31 C ATOM 2015 CG ASP A 133 15.835 -47.719 0.885 1.00 15.24 C ATOM 2016 OD1 ASP A 133 14.641 -47.885 1.214 1.00 20.11 O ATOM 2017 OD2 ASP A 133 16.556 -46.816 1.358 1.00 54.54 O ATOM 0 H ASP A 133 13.942 -48.779 -0.603 1.00 73.15 H new ATOM 0 HA ASP A 133 16.174 -50.632 -0.950 1.00 31.35 H new ATOM 0 HB2 ASP A 133 17.463 -48.895 0.150 1.00 63.31 H new ATOM 0 HB3 ASP A 133 16.484 -48.161 -1.105 1.00 63.31 H new ATOM 2022 N GLY A 134 14.319 -50.576 1.662 1.00 22.02 N ATOM 2023 CA GLY A 134 14.088 -51.188 2.957 1.00 34.34 C ATOM 2024 C GLY A 134 14.088 -50.176 4.086 1.00 44.04 C ATOM 2025 O GLY A 134 13.979 -50.542 5.255 1.00 10.15 O ATOM 0 H GLY A 134 13.507 -50.111 1.256 1.00 22.02 H new ATOM 0 HA2 GLY A 134 13.132 -51.711 2.943 1.00 34.34 H new ATOM 0 HA3 GLY A 134 14.858 -51.936 3.144 1.00 34.34 H new ATOM 2029 N GLN A 135 14.214 -48.900 3.734 1.00 32.40 N ATOM 2030 CA GLN A 135 14.231 -47.833 4.727 1.00 11.11 C ATOM 2031 C GLN A 135 13.639 -46.548 4.156 1.00 64.41 C ATOM 2032 O GLN A 135 13.356 -46.461 2.961 1.00 34.02 O ATOM 2033 CB GLN A 135 15.660 -47.580 5.210 1.00 1.30 C ATOM 2034 CG GLN A 135 15.738 -47.067 6.639 1.00 34.41 C ATOM 2035 CD GLN A 135 17.002 -47.509 7.350 1.00 51.14 C ATOM 2036 OE1 GLN A 135 17.488 -48.621 7.143 1.00 72.31 O ATOM 2037 NE2 GLN A 135 17.543 -46.637 8.193 1.00 73.12 N ATOM 0 H GLN A 135 14.306 -48.581 2.770 1.00 32.40 H new ATOM 0 HA GLN A 135 13.620 -48.148 5.573 1.00 11.11 H new ATOM 0 HB2 GLN A 135 16.230 -48.506 5.134 1.00 1.30 H new ATOM 0 HB3 GLN A 135 16.136 -46.858 4.547 1.00 1.30 H new ATOM 0 HG2 GLN A 135 15.691 -45.978 6.633 1.00 34.41 H new ATOM 0 HG3 GLN A 135 14.870 -47.420 7.196 1.00 34.41 H new ATOM 0 HE21 GLN A 135 17.106 -45.726 8.334 1.00 73.12 H new ATOM 0 HE22 GLN A 135 18.395 -46.878 8.699 1.00 73.12 H new ATOM 2046 N VAL A 136 13.455 -45.553 5.018 1.00 65.15 N ATOM 2047 CA VAL A 136 12.898 -44.272 4.599 1.00 64.53 C ATOM 2048 C VAL A 136 13.926 -43.155 4.735 1.00 3.11 C ATOM 2049 O VAL A 136 14.306 -42.779 5.843 1.00 22.32 O ATOM 2050 CB VAL A 136 11.648 -43.908 5.421 1.00 21.33 C ATOM 2051 CG1 VAL A 136 11.108 -42.551 4.999 1.00 55.22 C ATOM 2052 CG2 VAL A 136 10.583 -44.984 5.275 1.00 31.55 C ATOM 0 H VAL A 136 13.683 -45.609 6.011 1.00 65.15 H new ATOM 0 HA VAL A 136 12.617 -44.377 3.551 1.00 64.53 H new ATOM 0 HB VAL A 136 11.930 -43.849 6.472 1.00 21.33 H new ATOM 0 HG11 VAL A 136 10.225 -42.311 5.591 1.00 55.22 H new ATOM 0 HG12 VAL A 136 11.871 -41.790 5.160 1.00 55.22 H new ATOM 0 HG13 VAL A 136 10.841 -42.578 3.943 1.00 55.22 H new ATOM 0 HG21 VAL A 136 9.707 -44.711 5.863 1.00 31.55 H new ATOM 0 HG22 VAL A 136 10.302 -45.078 4.226 1.00 31.55 H new ATOM 0 HG23 VAL A 136 10.976 -45.936 5.632 1.00 31.55 H new ATOM 2062 N ASN A 137 14.373 -42.627 3.600 1.00 55.01 N ATOM 2063 CA ASN A 137 15.357 -41.551 3.592 1.00 24.44 C ATOM 2064 C ASN A 137 14.673 -40.188 3.586 1.00 5.41 C ATOM 2065 O ASN A 137 13.457 -40.092 3.422 1.00 70.33 O ATOM 2066 CB ASN A 137 16.275 -41.680 2.375 1.00 74.15 C ATOM 2067 CG ASN A 137 15.501 -41.901 1.089 1.00 21.50 C ATOM 2068 OD1 ASN A 137 14.355 -41.472 0.959 1.00 12.44 O ATOM 2069 ND2 ASN A 137 16.127 -42.576 0.131 1.00 14.40 N ATOM 0 H ASN A 137 14.069 -42.927 2.674 1.00 55.01 H new ATOM 0 HA ASN A 137 15.955 -41.633 4.500 1.00 24.44 H new ATOM 0 HB2 ASN A 137 16.880 -40.778 2.282 1.00 74.15 H new ATOM 0 HB3 ASN A 137 16.964 -42.511 2.529 1.00 74.15 H new ATOM 0 HD21 ASN A 137 15.657 -42.757 -0.756 1.00 14.40 H new ATOM 0 HD22 ASN A 137 17.078 -42.913 0.282 1.00 14.40 H new ATOM 2076 N TYR A 138 15.464 -39.135 3.766 1.00 74.04 N ATOM 2077 CA TYR A 138 14.935 -37.776 3.782 1.00 34.45 C ATOM 2078 C TYR A 138 14.145 -37.483 2.510 1.00 30.35 C ATOM 2079 O TYR A 138 13.034 -36.958 2.565 1.00 53.23 O ATOM 2080 CB TYR A 138 16.073 -36.766 3.934 1.00 54.50 C ATOM 2081 CG TYR A 138 15.605 -35.328 3.963 1.00 5.25 C ATOM 2082 CD1 TYR A 138 14.711 -34.887 4.931 1.00 3.20 C ATOM 2083 CD2 TYR A 138 16.059 -34.410 3.024 1.00 63.10 C ATOM 2084 CE1 TYR A 138 14.281 -33.574 4.961 1.00 24.31 C ATOM 2085 CE2 TYR A 138 15.636 -33.095 3.047 1.00 31.33 C ATOM 2086 CZ TYR A 138 14.747 -32.682 4.017 1.00 34.44 C ATOM 2087 OH TYR A 138 14.322 -31.374 4.045 1.00 52.21 O ATOM 0 H TYR A 138 16.473 -39.197 3.903 1.00 74.04 H new ATOM 0 HA TYR A 138 14.261 -37.685 4.634 1.00 34.45 H new ATOM 0 HB2 TYR A 138 16.618 -36.981 4.853 1.00 54.50 H new ATOM 0 HB3 TYR A 138 16.775 -36.895 3.110 1.00 54.50 H new ATOM 0 HD1 TYR A 138 14.346 -35.582 5.673 1.00 3.20 H new ATOM 0 HD2 TYR A 138 16.755 -34.730 2.263 1.00 63.10 H new ATOM 0 HE1 TYR A 138 13.584 -33.248 5.719 1.00 24.31 H new ATOM 0 HE2 TYR A 138 15.999 -32.395 2.310 1.00 31.33 H new ATOM 0 HH TYR A 138 14.744 -30.877 3.314 1.00 52.21 H new ATOM 2097 N GLU A 139 14.728 -37.828 1.367 1.00 64.22 N ATOM 2098 CA GLU A 139 14.080 -37.602 0.081 1.00 72.04 C ATOM 2099 C GLU A 139 12.670 -38.187 0.072 1.00 43.43 C ATOM 2100 O GLU A 139 11.709 -37.509 -0.290 1.00 0.13 O ATOM 2101 CB GLU A 139 14.907 -38.220 -1.049 1.00 21.05 C ATOM 2102 CG GLU A 139 14.373 -37.907 -2.436 1.00 40.11 C ATOM 2103 CD GLU A 139 14.852 -36.566 -2.957 1.00 1.33 C ATOM 2104 OE1 GLU A 139 16.082 -36.376 -3.062 1.00 61.25 O ATOM 2105 OE2 GLU A 139 13.998 -35.706 -3.258 1.00 21.11 O ATOM 0 H GLU A 139 15.648 -38.265 1.305 1.00 64.22 H new ATOM 0 HA GLU A 139 14.010 -36.526 -0.077 1.00 72.04 H new ATOM 0 HB2 GLU A 139 15.933 -37.861 -0.975 1.00 21.05 H new ATOM 0 HB3 GLU A 139 14.937 -39.301 -0.916 1.00 21.05 H new ATOM 0 HG2 GLU A 139 14.682 -38.692 -3.126 1.00 40.11 H new ATOM 0 HG3 GLU A 139 13.283 -37.915 -2.412 1.00 40.11 H new ATOM 2112 N GLU A 140 12.557 -39.449 0.472 1.00 61.42 N ATOM 2113 CA GLU A 140 11.266 -40.125 0.508 1.00 34.54 C ATOM 2114 C GLU A 140 10.356 -39.504 1.564 1.00 32.01 C ATOM 2115 O GLU A 140 9.135 -39.477 1.409 1.00 33.14 O ATOM 2116 CB GLU A 140 11.454 -41.617 0.795 1.00 14.33 C ATOM 2117 CG GLU A 140 11.960 -42.407 -0.399 1.00 64.23 C ATOM 2118 CD GLU A 140 12.254 -43.855 -0.059 1.00 30.34 C ATOM 2119 OE1 GLU A 140 12.254 -44.193 1.144 1.00 40.21 O ATOM 2120 OE2 GLU A 140 12.484 -44.651 -0.993 1.00 51.53 O ATOM 0 H GLU A 140 13.343 -40.024 0.775 1.00 61.42 H new ATOM 0 HA GLU A 140 10.795 -40.006 -0.468 1.00 34.54 H new ATOM 0 HB2 GLU A 140 12.156 -41.734 1.621 1.00 14.33 H new ATOM 0 HB3 GLU A 140 10.503 -42.038 1.122 1.00 14.33 H new ATOM 0 HG2 GLU A 140 11.218 -42.369 -1.196 1.00 64.23 H new ATOM 0 HG3 GLU A 140 12.865 -41.937 -0.783 1.00 64.23 H new ATOM 2127 N PHE A 141 10.960 -39.006 2.638 1.00 53.21 N ATOM 2128 CA PHE A 141 10.205 -38.386 3.721 1.00 41.22 C ATOM 2129 C PHE A 141 9.562 -37.082 3.258 1.00 12.33 C ATOM 2130 O PHE A 141 8.366 -36.862 3.455 1.00 65.04 O ATOM 2131 CB PHE A 141 11.118 -38.120 4.920 1.00 74.20 C ATOM 2132 CG PHE A 141 10.462 -37.314 6.005 1.00 64.30 C ATOM 2133 CD1 PHE A 141 10.528 -35.930 5.994 1.00 22.41 C ATOM 2134 CD2 PHE A 141 9.781 -37.941 7.036 1.00 2.22 C ATOM 2135 CE1 PHE A 141 9.926 -35.186 6.991 1.00 41.32 C ATOM 2136 CE2 PHE A 141 9.177 -37.201 8.035 1.00 31.53 C ATOM 2137 CZ PHE A 141 9.250 -35.822 8.013 1.00 24.43 C ATOM 0 H PHE A 141 11.970 -39.020 2.782 1.00 53.21 H new ATOM 0 HA PHE A 141 9.415 -39.074 4.020 1.00 41.22 H new ATOM 0 HB2 PHE A 141 11.447 -39.073 5.335 1.00 74.20 H new ATOM 0 HB3 PHE A 141 12.010 -37.596 4.578 1.00 74.20 H new ATOM 0 HD1 PHE A 141 11.056 -35.427 5.197 1.00 22.41 H new ATOM 0 HD2 PHE A 141 9.722 -39.019 7.059 1.00 2.22 H new ATOM 0 HE1 PHE A 141 9.984 -34.108 6.971 1.00 41.32 H new ATOM 0 HE2 PHE A 141 8.648 -37.701 8.833 1.00 31.53 H new ATOM 0 HZ PHE A 141 8.779 -35.243 8.793 1.00 24.43 H new ATOM 2147 N VAL A 142 10.364 -36.219 2.643 1.00 1.41 N ATOM 2148 CA VAL A 142 9.875 -34.936 2.152 1.00 75.22 C ATOM 2149 C VAL A 142 8.815 -35.129 1.073 1.00 70.32 C ATOM 2150 O VAL A 142 7.832 -34.391 1.016 1.00 41.10 O ATOM 2151 CB VAL A 142 11.020 -34.079 1.583 1.00 45.51 C ATOM 2152 CG1 VAL A 142 10.487 -32.753 1.062 1.00 4.40 C ATOM 2153 CG2 VAL A 142 12.092 -33.854 2.639 1.00 41.11 C ATOM 0 H VAL A 142 11.356 -36.385 2.473 1.00 1.41 H new ATOM 0 HA VAL A 142 9.433 -34.419 3.004 1.00 75.22 H new ATOM 0 HB VAL A 142 11.471 -34.615 0.748 1.00 45.51 H new ATOM 0 HG11 VAL A 142 11.311 -32.161 0.664 1.00 4.40 H new ATOM 0 HG12 VAL A 142 9.759 -32.939 0.273 1.00 4.40 H new ATOM 0 HG13 VAL A 142 10.009 -32.208 1.876 1.00 4.40 H new ATOM 0 HG21 VAL A 142 12.894 -33.246 2.220 1.00 41.11 H new ATOM 0 HG22 VAL A 142 11.657 -33.339 3.496 1.00 41.11 H new ATOM 0 HG23 VAL A 142 12.495 -34.815 2.959 1.00 41.11 H new ATOM 2163 N GLN A 143 9.022 -36.127 0.219 1.00 3.14 N ATOM 2164 CA GLN A 143 8.084 -36.417 -0.858 1.00 42.25 C ATOM 2165 C GLN A 143 6.689 -36.689 -0.307 1.00 34.50 C ATOM 2166 O GLN A 143 5.687 -36.311 -0.913 1.00 14.12 O ATOM 2167 CB GLN A 143 8.567 -37.618 -1.674 1.00 12.31 C ATOM 2168 CG GLN A 143 7.663 -37.959 -2.847 1.00 73.42 C ATOM 2169 CD GLN A 143 8.247 -39.036 -3.740 1.00 31.41 C ATOM 2170 OE1 GLN A 143 9.345 -39.536 -3.493 1.00 1.53 O ATOM 2171 NE2 GLN A 143 7.514 -39.401 -4.785 1.00 71.23 N ATOM 0 H GLN A 143 9.831 -36.748 0.253 1.00 3.14 H new ATOM 0 HA GLN A 143 8.034 -35.543 -1.507 1.00 42.25 H new ATOM 0 HB2 GLN A 143 9.571 -37.413 -2.047 1.00 12.31 H new ATOM 0 HB3 GLN A 143 8.641 -38.486 -1.019 1.00 12.31 H new ATOM 0 HG2 GLN A 143 6.695 -38.290 -2.471 1.00 73.42 H new ATOM 0 HG3 GLN A 143 7.485 -37.060 -3.437 1.00 73.42 H new ATOM 0 HE21 GLN A 143 6.609 -38.960 -4.952 1.00 71.23 H new ATOM 0 HE22 GLN A 143 7.855 -40.122 -5.421 1.00 71.23 H new ATOM 2180 N MET A 144 6.632 -37.349 0.845 1.00 14.15 N ATOM 2181 CA MET A 144 5.358 -37.671 1.479 1.00 62.32 C ATOM 2182 C MET A 144 4.735 -36.430 2.109 1.00 12.01 C ATOM 2183 O MET A 144 3.596 -36.075 1.807 1.00 50.31 O ATOM 2184 CB MET A 144 5.553 -38.754 2.542 1.00 74.33 C ATOM 2185 CG MET A 144 4.264 -39.458 2.935 1.00 70.21 C ATOM 2186 SD MET A 144 3.631 -40.528 1.629 1.00 32.43 S ATOM 2187 CE MET A 144 2.127 -41.136 2.389 1.00 11.01 C ATOM 0 H MET A 144 7.452 -37.671 1.359 1.00 14.15 H new ATOM 0 HA MET A 144 4.682 -38.044 0.710 1.00 62.32 H new ATOM 0 HB2 MET A 144 6.262 -39.493 2.170 1.00 74.33 H new ATOM 0 HB3 MET A 144 5.997 -38.304 3.430 1.00 74.33 H new ATOM 0 HG2 MET A 144 4.438 -40.051 3.833 1.00 70.21 H new ATOM 0 HG3 MET A 144 3.509 -38.713 3.186 1.00 70.21 H new ATOM 0 HE1 MET A 144 1.477 -41.558 1.623 1.00 11.01 H new ATOM 0 HE2 MET A 144 2.374 -41.907 3.119 1.00 11.01 H new ATOM 0 HE3 MET A 144 1.614 -40.314 2.888 1.00 11.01 H new ATOM 2197 N MET A 145 5.489 -35.775 2.986 1.00 35.01 N ATOM 2198 CA MET A 145 5.009 -34.573 3.658 1.00 50.32 C ATOM 2199 C MET A 145 4.657 -33.488 2.645 1.00 55.02 C ATOM 2200 O MET A 145 3.875 -32.582 2.936 1.00 74.12 O ATOM 2201 CB MET A 145 6.066 -34.052 4.633 1.00 10.34 C ATOM 2202 CG MET A 145 5.531 -33.023 5.617 1.00 60.42 C ATOM 2203 SD MET A 145 6.518 -32.924 7.123 1.00 55.32 S ATOM 2204 CE MET A 145 6.312 -34.580 7.773 1.00 71.15 C ATOM 0 H MET A 145 6.434 -36.056 3.248 1.00 35.01 H new ATOM 0 HA MET A 145 4.108 -34.833 4.214 1.00 50.32 H new ATOM 0 HB2 MET A 145 6.481 -34.893 5.189 1.00 10.34 H new ATOM 0 HB3 MET A 145 6.885 -33.609 4.066 1.00 10.34 H new ATOM 0 HG2 MET A 145 5.508 -32.045 5.137 1.00 60.42 H new ATOM 0 HG3 MET A 145 4.503 -33.275 5.877 1.00 60.42 H new ATOM 0 HE1 MET A 145 6.631 -34.604 8.815 1.00 71.15 H new ATOM 0 HE2 MET A 145 5.263 -34.869 7.708 1.00 71.15 H new ATOM 0 HE3 MET A 145 6.917 -35.277 7.192 1.00 71.15 H new ATOM 2214 N THR A 146 5.239 -33.585 1.453 1.00 34.25 N ATOM 2215 CA THR A 146 4.987 -32.612 0.398 1.00 1.23 C ATOM 2216 C THR A 146 3.821 -33.045 -0.483 1.00 10.03 C ATOM 2217 O THR A 146 2.980 -32.230 -0.860 1.00 53.11 O ATOM 2218 CB THR A 146 6.233 -32.405 -0.484 1.00 11.03 C ATOM 2219 OG1 THR A 146 7.323 -31.927 0.313 1.00 71.15 O ATOM 2220 CG2 THR A 146 5.945 -31.417 -1.604 1.00 11.33 C ATOM 0 H THR A 146 5.888 -34.328 1.195 1.00 34.25 H new ATOM 0 HA THR A 146 4.738 -31.671 0.889 1.00 1.23 H new ATOM 0 HB THR A 146 6.501 -33.364 -0.927 1.00 11.03 H new ATOM 0 HG1 THR A 146 7.630 -32.641 0.910 1.00 71.15 H new ATOM 0 HG21 THR A 146 6.839 -31.287 -2.213 1.00 11.33 H new ATOM 0 HG22 THR A 146 5.135 -31.798 -2.226 1.00 11.33 H new ATOM 0 HG23 THR A 146 5.654 -30.457 -1.177 1.00 11.33 H new ATOM 2351 N LYS M 15 -1.957 -43.569 7.918 1.00 3.02 N ATOM 2352 CA LYS M 15 -1.346 -43.072 9.145 1.00 25.23 C ATOM 2353 C LYS M 15 -0.284 -42.021 8.837 1.00 22.14 C ATOM 2354 O LYS M 15 -0.099 -41.071 9.598 1.00 54.22 O ATOM 2355 CB LYS M 15 -0.722 -44.227 9.933 1.00 51.23 C ATOM 2356 CG LYS M 15 -1.616 -45.451 10.026 1.00 24.55 C ATOM 2357 CD LYS M 15 -1.290 -46.287 11.254 1.00 52.55 C ATOM 2358 CE LYS M 15 -0.280 -47.378 10.933 1.00 15.01 C ATOM 2359 NZ LYS M 15 0.972 -46.821 10.351 1.00 22.35 N ATOM 0 HA LYS M 15 -2.127 -42.609 9.748 1.00 25.23 H new ATOM 0 HB2 LYS M 15 0.220 -44.510 9.463 1.00 51.23 H new ATOM 0 HB3 LYS M 15 -0.485 -43.883 10.940 1.00 51.23 H new ATOM 0 HG2 LYS M 15 -2.660 -45.139 10.064 1.00 24.55 H new ATOM 0 HG3 LYS M 15 -1.497 -46.059 9.129 1.00 24.55 H new ATOM 0 HD2 LYS M 15 -0.894 -45.643 12.039 1.00 52.55 H new ATOM 0 HD3 LYS M 15 -2.204 -46.738 11.642 1.00 52.55 H new ATOM 0 HE2 LYS M 15 -0.043 -47.932 11.841 1.00 15.01 H new ATOM 0 HE3 LYS M 15 -0.722 -48.087 10.233 1.00 15.01 H new ATOM 0 HZ1 LYS M 15 1.734 -47.525 10.428 1.00 22.35 H new ATOM 0 HZ2 LYS M 15 0.816 -46.588 9.350 1.00 22.35 H new ATOM 0 HZ3 LYS M 15 1.243 -45.961 10.869 1.00 22.35 H new ATOM 2373 N TRP M 16 0.410 -42.198 7.719 1.00 53.33 N ATOM 2374 CA TRP M 16 1.452 -41.263 7.310 1.00 1.13 C ATOM 2375 C TRP M 16 0.929 -39.831 7.310 1.00 3.44 C ATOM 2376 O TRP M 16 1.683 -38.886 7.543 1.00 60.14 O ATOM 2377 CB TRP M 16 1.977 -41.627 5.920 1.00 34.34 C ATOM 2378 CG TRP M 16 3.114 -42.603 5.952 1.00 43.52 C ATOM 2379 CD1 TRP M 16 3.063 -43.932 5.643 1.00 0.10 C ATOM 2380 CD2 TRP M 16 4.471 -42.325 6.314 1.00 43.31 C ATOM 2381 NE1 TRP M 16 4.307 -44.497 5.791 1.00 34.24 N ATOM 2382 CE2 TRP M 16 5.188 -43.532 6.201 1.00 21.21 C ATOM 2383 CE3 TRP M 16 5.151 -41.173 6.720 1.00 22.42 C ATOM 2384 CZ2 TRP M 16 6.549 -43.618 6.482 1.00 61.44 C ATOM 2385 CZ3 TRP M 16 6.502 -41.261 6.998 1.00 11.25 C ATOM 2386 CH2 TRP M 16 7.190 -42.476 6.878 1.00 55.25 C ATOM 0 H TRP M 16 0.270 -42.980 7.079 1.00 53.33 H new ATOM 0 HA TRP M 16 2.269 -41.332 8.028 1.00 1.13 H new ATOM 0 HB2 TRP M 16 1.163 -42.048 5.330 1.00 34.34 H new ATOM 0 HB3 TRP M 16 2.301 -40.719 5.412 1.00 34.34 H new ATOM 0 HD1 TRP M 16 2.176 -44.461 5.329 1.00 0.10 H new ATOM 0 HE1 TRP M 16 4.537 -45.476 5.623 1.00 34.24 H new ATOM 0 HE3 TRP M 16 4.630 -40.232 6.815 1.00 22.42 H new ATOM 0 HZ2 TRP M 16 7.080 -44.554 6.391 1.00 61.44 H new ATOM 0 HZ3 TRP M 16 7.037 -40.378 7.313 1.00 11.25 H new ATOM 0 HH2 TRP M 16 8.246 -42.512 7.102 1.00 55.25 H new ATOM 2397 N GLU M 17 -0.365 -39.677 7.049 1.00 71.41 N ATOM 2398 CA GLU M 17 -0.987 -38.359 7.019 1.00 42.21 C ATOM 2399 C GLU M 17 -0.724 -37.603 8.318 1.00 25.55 C ATOM 2400 O GLU M 17 -0.483 -36.396 8.311 1.00 63.13 O ATOM 2401 CB GLU M 17 -2.494 -38.486 6.787 1.00 62.14 C ATOM 2402 CG GLU M 17 -3.189 -37.155 6.557 1.00 0.34 C ATOM 2403 CD GLU M 17 -3.609 -36.486 7.852 1.00 55.34 C ATOM 2404 OE1 GLU M 17 -4.379 -37.105 8.616 1.00 23.12 O ATOM 2405 OE2 GLU M 17 -3.170 -35.344 8.100 1.00 51.41 O ATOM 0 H GLU M 17 -1.003 -40.449 6.855 1.00 71.41 H new ATOM 0 HA GLU M 17 -0.546 -37.797 6.196 1.00 42.21 H new ATOM 0 HB2 GLU M 17 -2.667 -39.130 5.925 1.00 62.14 H new ATOM 0 HB3 GLU M 17 -2.945 -38.978 7.649 1.00 62.14 H new ATOM 0 HG2 GLU M 17 -2.521 -36.490 6.009 1.00 0.34 H new ATOM 0 HG3 GLU M 17 -4.068 -37.311 5.931 1.00 0.34 H new ATOM 2412 N LYS M 18 -0.772 -38.323 9.434 1.00 23.23 N ATOM 2413 CA LYS M 18 -0.538 -37.724 10.743 1.00 51.22 C ATOM 2414 C LYS M 18 0.880 -37.170 10.842 1.00 32.23 C ATOM 2415 O LYS M 18 1.152 -36.278 11.646 1.00 45.34 O ATOM 2416 CB LYS M 18 -0.773 -38.755 11.848 1.00 30.45 C ATOM 2417 CG LYS M 18 -0.828 -38.152 13.241 1.00 30.14 C ATOM 2418 CD LYS M 18 -1.743 -38.947 14.158 1.00 72.05 C ATOM 2419 CE LYS M 18 -1.246 -40.372 14.342 1.00 24.45 C ATOM 2420 NZ LYS M 18 -1.812 -41.295 13.319 1.00 4.44 N ATOM 0 H LYS M 18 -0.971 -39.323 9.458 1.00 23.23 H new ATOM 0 HA LYS M 18 -1.241 -36.900 10.869 1.00 51.22 H new ATOM 0 HB2 LYS M 18 -1.708 -39.279 11.651 1.00 30.45 H new ATOM 0 HB3 LYS M 18 0.023 -39.499 11.814 1.00 30.45 H new ATOM 0 HG2 LYS M 18 0.176 -38.121 13.665 1.00 30.14 H new ATOM 0 HG3 LYS M 18 -1.179 -37.122 13.179 1.00 30.14 H new ATOM 0 HD2 LYS M 18 -1.805 -38.454 15.128 1.00 72.05 H new ATOM 0 HD3 LYS M 18 -2.751 -38.963 13.743 1.00 72.05 H new ATOM 0 HE2 LYS M 18 -0.158 -40.387 14.282 1.00 24.45 H new ATOM 0 HE3 LYS M 18 -1.515 -40.725 15.338 1.00 24.45 H new ATOM 0 HZ1 LYS M 18 -1.769 -42.272 13.672 1.00 4.44 H new ATOM 0 HZ2 LYS M 18 -2.802 -41.038 13.130 1.00 4.44 H new ATOM 0 HZ3 LYS M 18 -1.261 -41.220 12.440 1.00 4.44 H new ATOM 2434 N ILE M 19 1.777 -37.704 10.021 1.00 65.20 N ATOM 2435 CA ILE M 19 3.166 -37.261 10.016 1.00 61.14 C ATOM 2436 C ILE M 19 3.294 -35.862 9.423 1.00 3.23 C ATOM 2437 O ILE M 19 4.135 -35.071 9.850 1.00 5.33 O ATOM 2438 CB ILE M 19 4.062 -38.228 9.219 1.00 4.41 C ATOM 2439 CG1 ILE M 19 3.758 -39.676 9.607 1.00 63.24 C ATOM 2440 CG2 ILE M 19 5.530 -37.907 9.458 1.00 43.24 C ATOM 2441 CD1 ILE M 19 3.919 -39.953 11.085 1.00 14.41 C ATOM 0 H ILE M 19 1.567 -38.444 9.351 1.00 65.20 H new ATOM 0 HA ILE M 19 3.496 -37.245 11.055 1.00 61.14 H new ATOM 0 HB ILE M 19 3.851 -38.104 8.157 1.00 4.41 H new ATOM 0 HG12 ILE M 19 2.737 -39.916 9.310 1.00 63.24 H new ATOM 0 HG13 ILE M 19 4.417 -40.339 9.048 1.00 63.24 H new ATOM 0 HG21 ILE M 19 6.151 -38.598 8.888 1.00 43.24 H new ATOM 0 HG22 ILE M 19 5.736 -36.886 9.137 1.00 43.24 H new ATOM 0 HG23 ILE M 19 5.756 -38.007 10.520 1.00 43.24 H new ATOM 0 HD11 ILE M 19 3.687 -40.999 11.287 1.00 14.41 H new ATOM 0 HD12 ILE M 19 4.946 -39.745 11.384 1.00 14.41 H new ATOM 0 HD13 ILE M 19 3.240 -39.315 11.651 1.00 14.41 H new ATOM 2453 N ARG M 20 2.453 -35.563 8.439 1.00 44.43 N ATOM 2454 CA ARG M 20 2.472 -34.258 7.788 1.00 61.22 C ATOM 2455 C ARG M 20 2.180 -33.146 8.791 1.00 52.13 C ATOM 2456 O ARG M 20 2.603 -32.004 8.608 1.00 2.33 O ATOM 2457 CB ARG M 20 1.449 -34.217 6.651 1.00 12.25 C ATOM 2458 CG ARG M 20 1.648 -33.053 5.695 1.00 51.24 C ATOM 2459 CD ARG M 20 0.527 -32.976 4.669 1.00 24.44 C ATOM 2460 NE ARG M 20 0.239 -34.279 4.075 1.00 22.04 N ATOM 2461 CZ ARG M 20 -0.907 -34.574 3.473 1.00 60.55 C ATOM 2462 NH1 ARG M 20 -1.867 -33.664 3.384 1.00 71.40 N ATOM 2463 NH2 ARG M 20 -1.094 -35.782 2.956 1.00 34.42 N ATOM 0 H ARG M 20 1.750 -36.206 8.075 1.00 44.43 H new ATOM 0 HA ARG M 20 3.469 -34.099 7.376 1.00 61.22 H new ATOM 0 HB2 ARG M 20 1.504 -35.150 6.090 1.00 12.25 H new ATOM 0 HB3 ARG M 20 0.447 -34.159 7.077 1.00 12.25 H new ATOM 0 HG2 ARG M 20 1.691 -32.121 6.259 1.00 51.24 H new ATOM 0 HG3 ARG M 20 2.604 -33.161 5.183 1.00 51.24 H new ATOM 0 HD2 ARG M 20 -0.374 -32.587 5.144 1.00 24.44 H new ATOM 0 HD3 ARG M 20 0.802 -32.272 3.883 1.00 24.44 H new ATOM 0 HE ARG M 20 0.957 -35.001 4.125 1.00 22.04 H new ATOM 0 HH11 ARG M 20 -1.726 -32.734 3.779 1.00 71.40 H new ATOM 0 HH12 ARG M 20 -2.746 -33.894 2.921 1.00 71.40 H new ATOM 0 HH21 ARG M 20 -0.357 -36.484 3.021 1.00 34.42 H new ATOM 0 HH22 ARG M 20 -1.975 -36.008 2.494 1.00 34.42 H new ATOM 2630 N LYS M 30 1.595 -9.698 -0.879 1.00 42.03 N ATOM 2631 CA LYS M 30 1.187 -8.663 0.064 1.00 62.44 C ATOM 2632 C LYS M 30 0.082 -7.794 -0.527 1.00 43.35 C ATOM 2633 O LYS M 30 0.011 -6.594 -0.258 1.00 4.21 O ATOM 2634 CB LYS M 30 2.386 -7.793 0.447 1.00 11.33 C ATOM 2635 CG LYS M 30 3.188 -7.302 -0.746 1.00 21.34 C ATOM 2636 CD LYS M 30 3.850 -5.964 -0.461 1.00 33.53 C ATOM 2637 CE LYS M 30 4.356 -5.310 -1.737 1.00 12.10 C ATOM 2638 NZ LYS M 30 5.390 -6.141 -2.414 1.00 10.41 N ATOM 0 HA LYS M 30 0.801 -9.152 0.958 1.00 62.44 H new ATOM 0 HB2 LYS M 30 2.033 -6.933 1.016 1.00 11.33 H new ATOM 0 HB3 LYS M 30 3.042 -8.363 1.105 1.00 11.33 H new ATOM 0 HG2 LYS M 30 3.950 -8.039 -1.001 1.00 21.34 H new ATOM 0 HG3 LYS M 30 2.533 -7.208 -1.612 1.00 21.34 H new ATOM 0 HD2 LYS M 30 3.138 -5.302 0.031 1.00 33.53 H new ATOM 0 HD3 LYS M 30 4.681 -6.108 0.230 1.00 33.53 H new ATOM 0 HE2 LYS M 30 3.520 -5.145 -2.417 1.00 12.10 H new ATOM 0 HE3 LYS M 30 4.773 -4.331 -1.502 1.00 12.10 H new ATOM 0 HZ1 LYS M 30 5.794 -5.610 -3.212 1.00 10.41 H new ATOM 0 HZ2 LYS M 30 6.144 -6.377 -1.737 1.00 10.41 H new ATOM 0 HZ3 LYS M 30 4.955 -7.017 -2.766 1.00 10.41 H new ATOM 2652 N LEU M 31 -0.779 -8.406 -1.333 1.00 2.41 N ATOM 2653 CA LEU M 31 -1.882 -7.687 -1.961 1.00 72.21 C ATOM 2654 C LEU M 31 -3.222 -8.310 -1.584 1.00 35.11 C ATOM 2655 O LEU M 31 -4.224 -7.610 -1.431 1.00 22.22 O ATOM 2656 CB LEU M 31 -1.717 -7.687 -3.482 1.00 23.22 C ATOM 2657 CG LEU M 31 -2.958 -7.311 -4.292 1.00 4.40 C ATOM 2658 CD1 LEU M 31 -3.413 -5.901 -3.947 1.00 64.02 C ATOM 2659 CD2 LEU M 31 -2.679 -7.433 -5.783 1.00 24.21 C ATOM 0 H LEU M 31 -0.735 -9.398 -1.567 1.00 2.41 H new ATOM 0 HA LEU M 31 -1.865 -6.659 -1.600 1.00 72.21 H new ATOM 0 HB2 LEU M 31 -0.916 -6.995 -3.740 1.00 23.22 H new ATOM 0 HB3 LEU M 31 -1.393 -8.680 -3.792 1.00 23.22 H new ATOM 0 HG LEU M 31 -3.760 -8.003 -4.035 1.00 4.40 H new ATOM 0 HD11 LEU M 31 -4.297 -5.650 -4.533 1.00 64.02 H new ATOM 0 HD12 LEU M 31 -3.654 -5.846 -2.885 1.00 64.02 H new ATOM 0 HD13 LEU M 31 -2.615 -5.195 -4.175 1.00 64.02 H new ATOM 0 HD21 LEU M 31 -3.573 -7.162 -6.344 1.00 24.21 H new ATOM 0 HD22 LEU M 31 -1.862 -6.765 -6.056 1.00 24.21 H new ATOM 0 HD23 LEU M 31 -2.401 -8.460 -6.018 1.00 24.21 H new ATOM 2671 N LYS M 32 -3.234 -9.630 -1.433 1.00 70.24 N ATOM 2672 CA LYS M 32 -4.450 -10.349 -1.070 1.00 43.25 C ATOM 2673 C LYS M 32 -5.102 -9.727 0.160 1.00 74.00 C ATOM 2674 O LYS M 32 -6.326 -9.613 0.235 1.00 33.22 O ATOM 2675 CB LYS M 32 -4.135 -11.823 -0.804 1.00 53.42 C ATOM 2676 CG LYS M 32 -3.083 -12.036 0.270 1.00 11.43 C ATOM 2677 CD LYS M 32 -2.281 -13.302 0.022 1.00 34.44 C ATOM 2678 CE LYS M 32 -1.942 -14.011 1.325 1.00 44.22 C ATOM 2679 NZ LYS M 32 -1.193 -13.125 2.259 1.00 30.10 N ATOM 0 H LYS M 32 -2.414 -10.224 -1.557 1.00 70.24 H new ATOM 0 HA LYS M 32 -5.148 -10.278 -1.904 1.00 43.25 H new ATOM 0 HB2 LYS M 32 -5.051 -12.334 -0.509 1.00 53.42 H new ATOM 0 HB3 LYS M 32 -3.795 -12.286 -1.730 1.00 53.42 H new ATOM 0 HG2 LYS M 32 -2.411 -11.178 0.298 1.00 11.43 H new ATOM 0 HG3 LYS M 32 -3.565 -12.095 1.246 1.00 11.43 H new ATOM 0 HD2 LYS M 32 -2.849 -13.974 -0.622 1.00 34.44 H new ATOM 0 HD3 LYS M 32 -1.362 -13.054 -0.508 1.00 34.44 H new ATOM 0 HE2 LYS M 32 -2.861 -14.350 1.804 1.00 44.22 H new ATOM 0 HE3 LYS M 32 -1.347 -14.899 1.111 1.00 44.22 H new ATOM 0 HZ1 LYS M 32 -0.834 -13.687 3.057 1.00 30.10 H new ATOM 0 HZ2 LYS M 32 -0.394 -12.687 1.757 1.00 30.10 H new ATOM 0 HZ3 LYS M 32 -1.827 -12.382 2.616 1.00 30.10 H new ATOM 2693 N HIS M 33 -4.278 -9.325 1.122 1.00 11.31 N ATOM 2694 CA HIS M 33 -4.776 -8.712 2.349 1.00 41.14 C ATOM 2695 C HIS M 33 -5.740 -7.572 2.034 1.00 44.20 C ATOM 2696 O HIS M 33 -6.727 -7.368 2.741 1.00 71.31 O ATOM 2697 CB HIS M 33 -3.612 -8.193 3.193 1.00 1.12 C ATOM 2698 CG HIS M 33 -4.026 -7.699 4.545 1.00 53.41 C ATOM 2699 ND1 HIS M 33 -3.532 -6.540 5.107 1.00 74.24 N ATOM 2700 CD2 HIS M 33 -4.895 -8.212 5.447 1.00 1.13 C ATOM 2701 CE1 HIS M 33 -4.078 -6.363 6.297 1.00 61.33 C ATOM 2702 NE2 HIS M 33 -4.909 -7.364 6.527 1.00 2.21 N ATOM 0 H HIS M 33 -3.263 -9.412 1.076 1.00 11.31 H new ATOM 0 HA HIS M 33 -5.314 -9.473 2.914 1.00 41.14 H new ATOM 0 HB2 HIS M 33 -2.879 -8.990 3.315 1.00 1.12 H new ATOM 0 HB3 HIS M 33 -3.117 -7.384 2.656 1.00 1.12 H new ATOM 0 HD2 HIS M 33 -5.470 -9.119 5.338 1.00 1.13 H new ATOM 0 HE1 HIS M 33 -3.879 -5.540 6.968 1.00 61.33 H new ATOM 0 HE2 HIS M 33 -5.470 -7.487 7.370 1.00 2.21 H new ATOM 2710 N ILE M 34 -5.446 -6.832 0.970 1.00 4.55 N ATOM 2711 CA ILE M 34 -6.286 -5.713 0.563 1.00 12.41 C ATOM 2712 C ILE M 34 -7.751 -6.127 0.480 1.00 33.34 C ATOM 2713 O ILE M 34 -8.645 -5.370 0.860 1.00 4.00 O ATOM 2714 CB ILE M 34 -5.847 -5.145 -0.800 1.00 31.52 C ATOM 2715 CG1 ILE M 34 -4.388 -4.688 -0.740 1.00 72.23 C ATOM 2716 CG2 ILE M 34 -6.752 -3.994 -1.211 1.00 15.12 C ATOM 2717 CD1 ILE M 34 -4.130 -3.627 0.306 1.00 23.12 C ATOM 0 H ILE M 34 -4.633 -6.987 0.375 1.00 4.55 H new ATOM 0 HA ILE M 34 -6.171 -4.940 1.323 1.00 12.41 H new ATOM 0 HB ILE M 34 -5.931 -5.932 -1.549 1.00 31.52 H new ATOM 0 HG12 ILE M 34 -3.754 -5.550 -0.535 1.00 72.23 H new ATOM 0 HG13 ILE M 34 -4.096 -4.302 -1.717 1.00 72.23 H new ATOM 0 HG21 ILE M 34 -6.429 -3.604 -2.176 1.00 15.12 H new ATOM 0 HG22 ILE M 34 -7.780 -4.349 -1.289 1.00 15.12 H new ATOM 0 HG23 ILE M 34 -6.697 -3.203 -0.463 1.00 15.12 H new ATOM 0 HD11 ILE M 34 -3.076 -3.351 0.292 1.00 23.12 H new ATOM 0 HD12 ILE M 34 -4.738 -2.748 0.091 1.00 23.12 H new ATOM 0 HD13 ILE M 34 -4.390 -4.016 1.290 1.00 23.12 H new ATOM 2729 N VAL M 35 -7.991 -7.336 -0.017 1.00 73.41 N ATOM 2730 CA VAL M 35 -9.348 -7.854 -0.147 1.00 70.21 C ATOM 2731 C VAL M 35 -10.129 -7.682 1.151 1.00 42.40 C ATOM 2732 O VAL M 35 -11.313 -7.347 1.135 1.00 52.33 O ATOM 2733 CB VAL M 35 -9.345 -9.344 -0.537 1.00 72.23 C ATOM 2734 CG1 VAL M 35 -10.768 -9.862 -0.677 1.00 74.41 C ATOM 2735 CG2 VAL M 35 -8.563 -9.556 -1.825 1.00 10.22 C ATOM 0 H VAL M 35 -7.263 -7.975 -0.336 1.00 73.41 H new ATOM 0 HA VAL M 35 -9.831 -7.280 -0.937 1.00 70.21 H new ATOM 0 HB VAL M 35 -8.855 -9.908 0.256 1.00 72.23 H new ATOM 0 HG11 VAL M 35 -10.746 -10.916 -0.953 1.00 74.41 H new ATOM 0 HG12 VAL M 35 -11.292 -9.746 0.272 1.00 74.41 H new ATOM 0 HG13 VAL M 35 -11.287 -9.295 -1.450 1.00 74.41 H new ATOM 0 HG21 VAL M 35 -8.571 -10.614 -2.086 1.00 10.22 H new ATOM 0 HG22 VAL M 35 -9.023 -8.981 -2.629 1.00 10.22 H new ATOM 0 HG23 VAL M 35 -7.534 -9.225 -1.685 1.00 10.22 H new ATOM 2745 N TRP M 36 -9.457 -7.912 2.273 1.00 15.24 N ATOM 2746 CA TRP M 36 -10.089 -7.781 3.582 1.00 63.22 C ATOM 2747 C TRP M 36 -10.632 -6.371 3.786 1.00 62.22 C ATOM 2748 O TRP M 36 -11.711 -6.187 4.348 1.00 22.31 O ATOM 2749 CB TRP M 36 -9.090 -8.121 4.689 1.00 22.40 C ATOM 2750 CG TRP M 36 -8.787 -9.586 4.786 1.00 4.00 C ATOM 2751 CD1 TRP M 36 -8.885 -10.511 3.786 1.00 24.23 C ATOM 2752 CD2 TRP M 36 -8.338 -10.293 5.947 1.00 32.23 C ATOM 2753 NE1 TRP M 36 -8.524 -11.751 4.256 1.00 32.12 N ATOM 2754 CE2 TRP M 36 -8.184 -11.644 5.579 1.00 41.03 C ATOM 2755 CE3 TRP M 36 -8.050 -9.917 7.262 1.00 51.31 C ATOM 2756 CZ2 TRP M 36 -7.756 -12.616 6.478 1.00 23.54 C ATOM 2757 CZ3 TRP M 36 -7.626 -10.883 8.154 1.00 64.24 C ATOM 2758 CH2 TRP M 36 -7.481 -12.220 7.759 1.00 42.11 C ATOM 0 H TRP M 36 -8.476 -8.190 2.304 1.00 15.24 H new ATOM 0 HA TRP M 36 -10.923 -8.481 3.627 1.00 63.22 H new ATOM 0 HB2 TRP M 36 -8.163 -7.576 4.512 1.00 22.40 H new ATOM 0 HB3 TRP M 36 -9.485 -7.775 5.644 1.00 22.40 H new ATOM 0 HD1 TRP M 36 -9.200 -10.299 2.775 1.00 24.23 H new ATOM 0 HE1 TRP M 36 -8.511 -12.612 3.709 1.00 32.12 H new ATOM 0 HE3 TRP M 36 -8.157 -8.889 7.575 1.00 51.31 H new ATOM 0 HZ2 TRP M 36 -7.645 -13.647 6.176 1.00 23.54 H new ATOM 0 HZ3 TRP M 36 -7.402 -10.603 9.173 1.00 64.24 H new ATOM 0 HH2 TRP M 36 -7.146 -12.952 8.479 1.00 42.11 H new ATOM 2769 N ALA M 37 -9.878 -5.379 3.325 1.00 5.31 N ATOM 2770 CA ALA M 37 -10.285 -3.985 3.456 1.00 73.45 C ATOM 2771 C ALA M 37 -11.562 -3.711 2.669 1.00 74.24 C ATOM 2772 O ALA M 37 -12.251 -2.720 2.910 1.00 10.13 O ATOM 2773 CB ALA M 37 -9.168 -3.063 2.991 1.00 53.24 C ATOM 0 H ALA M 37 -8.982 -5.514 2.857 1.00 5.31 H new ATOM 0 HA ALA M 37 -10.488 -3.788 4.509 1.00 73.45 H new ATOM 0 HB1 ALA M 37 -9.486 -2.026 3.094 1.00 53.24 H new ATOM 0 HB2 ALA M 37 -8.279 -3.233 3.599 1.00 53.24 H new ATOM 0 HB3 ALA M 37 -8.937 -3.269 1.946 1.00 53.24 H new ATOM 2779 N SER M 38 -11.872 -4.595 1.726 1.00 74.32 N ATOM 2780 CA SER M 38 -13.065 -4.446 0.900 1.00 41.30 C ATOM 2781 C SER M 38 -14.324 -4.754 1.704 1.00 75.44 C ATOM 2782 O SER M 38 -15.430 -4.381 1.313 1.00 55.13 O ATOM 2783 CB SER M 38 -12.986 -5.367 -0.319 1.00 44.42 C ATOM 2784 OG SER M 38 -11.642 -5.560 -0.726 1.00 1.22 O ATOM 0 H SER M 38 -11.314 -5.422 1.515 1.00 74.32 H new ATOM 0 HA SER M 38 -13.115 -3.411 0.561 1.00 41.30 H new ATOM 0 HB2 SER M 38 -13.439 -6.329 -0.082 1.00 44.42 H new ATOM 0 HB3 SER M 38 -13.560 -4.938 -1.140 1.00 44.42 H new ATOM 0 HG SER M 38 -11.581 -5.484 -1.701 1.00 1.22 H new ATOM 2790 N ARG M 39 -14.148 -5.439 2.829 1.00 63.11 N ATOM 2791 CA ARG M 39 -15.269 -5.800 3.688 1.00 52.12 C ATOM 2792 C ARG M 39 -16.034 -4.557 4.135 1.00 64.24 C ATOM 2793 O ARG M 39 -17.225 -4.625 4.435 1.00 50.23 O ATOM 2794 CB ARG M 39 -14.774 -6.574 4.911 1.00 70.23 C ATOM 2795 CG ARG M 39 -14.082 -5.702 5.945 1.00 44.52 C ATOM 2796 CD ARG M 39 -13.230 -6.531 6.893 1.00 12.24 C ATOM 2797 NE ARG M 39 -12.242 -5.716 7.596 1.00 71.52 N ATOM 2798 CZ ARG M 39 -11.232 -6.225 8.292 1.00 24.20 C ATOM 2799 NH1 ARG M 39 -11.076 -7.539 8.378 1.00 74.11 N ATOM 2800 NH2 ARG M 39 -10.373 -5.419 8.904 1.00 54.13 N ATOM 0 H ARG M 39 -13.239 -5.755 3.167 1.00 63.11 H new ATOM 0 HA ARG M 39 -15.944 -6.435 3.114 1.00 52.12 H new ATOM 0 HB2 ARG M 39 -15.620 -7.076 5.380 1.00 70.23 H new ATOM 0 HB3 ARG M 39 -14.084 -7.351 4.583 1.00 70.23 H new ATOM 0 HG2 ARG M 39 -13.456 -4.966 5.441 1.00 44.52 H new ATOM 0 HG3 ARG M 39 -14.829 -5.149 6.515 1.00 44.52 H new ATOM 0 HD2 ARG M 39 -13.874 -7.027 7.619 1.00 12.24 H new ATOM 0 HD3 ARG M 39 -12.721 -7.314 6.332 1.00 12.24 H new ATOM 0 HE ARG M 39 -12.333 -4.701 7.550 1.00 71.52 H new ATOM 0 HH11 ARG M 39 -11.733 -8.162 7.909 1.00 74.11 H new ATOM 0 HH12 ARG M 39 -10.299 -7.926 8.913 1.00 74.11 H new ATOM 0 HH21 ARG M 39 -10.488 -4.408 8.840 1.00 54.13 H new ATOM 0 HH22 ARG M 39 -9.598 -5.811 9.438 1.00 54.13 H new ATOM 2814 N GLU M 40 -15.339 -3.424 4.176 1.00 20.43 N ATOM 2815 CA GLU M 40 -15.953 -2.167 4.588 1.00 61.42 C ATOM 2816 C GLU M 40 -16.629 -1.479 3.405 1.00 22.33 C ATOM 2817 O GLU M 40 -17.776 -1.041 3.500 1.00 32.51 O ATOM 2818 CB GLU M 40 -14.903 -1.238 5.201 1.00 72.22 C ATOM 2819 CG GLU M 40 -15.494 -0.005 5.863 1.00 53.11 C ATOM 2820 CD GLU M 40 -16.311 -0.339 7.096 1.00 23.51 C ATOM 2821 OE1 GLU M 40 -15.714 -0.787 8.098 1.00 13.32 O ATOM 2822 OE2 GLU M 40 -17.545 -0.155 7.059 1.00 10.44 O ATOM 0 H GLU M 40 -14.352 -3.351 3.929 1.00 20.43 H new ATOM 0 HA GLU M 40 -16.712 -2.391 5.338 1.00 61.42 H new ATOM 0 HB2 GLU M 40 -14.324 -1.794 5.939 1.00 72.22 H new ATOM 0 HB3 GLU M 40 -14.208 -0.924 4.422 1.00 72.22 H new ATOM 0 HG2 GLU M 40 -14.689 0.676 6.139 1.00 53.11 H new ATOM 0 HG3 GLU M 40 -16.124 0.521 5.146 1.00 53.11 H new ATOM 2829 N LEU M 41 -15.910 -1.387 2.292 1.00 4.13 N ATOM 2830 CA LEU M 41 -16.438 -0.751 1.090 1.00 32.43 C ATOM 2831 C LEU M 41 -17.654 -1.508 0.564 1.00 2.12 C ATOM 2832 O LEU M 41 -17.745 -2.727 0.702 1.00 64.33 O ATOM 2833 CB LEU M 41 -15.359 -0.683 0.009 1.00 64.02 C ATOM 2834 CG LEU M 41 -14.462 0.555 0.033 1.00 40.41 C ATOM 2835 CD1 LEU M 41 -13.400 0.467 -1.052 1.00 22.51 C ATOM 2836 CD2 LEU M 41 -15.293 1.819 -0.134 1.00 73.03 C ATOM 0 H LEU M 41 -14.960 -1.745 2.197 1.00 4.13 H new ATOM 0 HA LEU M 41 -16.747 0.261 1.350 1.00 32.43 H new ATOM 0 HB2 LEU M 41 -14.727 -1.567 0.098 1.00 64.02 H new ATOM 0 HB3 LEU M 41 -15.845 -0.736 -0.965 1.00 64.02 H new ATOM 0 HG LEU M 41 -13.961 0.598 1.000 1.00 40.41 H new ATOM 0 HD11 LEU M 41 -12.772 1.357 -1.019 1.00 22.51 H new ATOM 0 HD12 LEU M 41 -12.785 -0.418 -0.888 1.00 22.51 H new ATOM 0 HD13 LEU M 41 -13.881 0.399 -2.028 1.00 22.51 H new ATOM 0 HD21 LEU M 41 -14.638 2.690 -0.114 1.00 73.03 H new ATOM 0 HD22 LEU M 41 -15.822 1.784 -1.087 1.00 73.03 H new ATOM 0 HD23 LEU M 41 -16.015 1.890 0.679 1.00 73.03 H new