USER MOD reduce.3.24.130724 H: found=0, std=0, add=1314, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1308 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 169 THR OG1 : rot 180:sc= 0.613 USER MOD Set 1.2: A 174 ASN : amide:sc= -0.126 K(o=0.49,f=-3.5!) USER MOD Set 2.1: A 124 TYR OH : rot -148:sc= 0.0582! USER MOD Set 2.2: A 128 TYR OH : rot 180:sc= 0 USER MOD Set 2.3: A 168 HIS : no HD1:sc= -1.77! C(o=-1.7!,f=-12!) USER MOD Set 3.1: A 116 THR OG1 : rot 54:sc= -0.098 USER MOD Set 3.2: A 171 ASN : amide:sc= -0.404 X(o=-0.5,f=-0.82) USER MOD Set 4.1: A 95 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 101 HIS : no HD1:sc= -0.0474 X(o=-0.047,f=0.18) USER MOD Set 5.1: A 12 GLN : amide:sc= 0.76 K(o=1.1,f=-0.46) USER MOD Set 5.2: A 91 SER OG : rot 76:sc= 0.334 USER MOD Set 6.1: A 87 LYS NZ :NH3+ -110:sc= -0.275 (180deg=-0.858) USER MOD Set 6.2: A 103 THR OG1 : rot 180:sc= 0.0477 USER MOD Set 6.3: A 156 HIS : no HD1:sc= -3.54 K(o=-3.8,f=-2.6) USER MOD Set 7.1: A 33 HIS : no HD1:sc= -2.39 K(o=-1.6,f=-5.8!) USER MOD Set 7.2: A 77 HIS : no HD1:sc= 0.795 K(o=-1.6,f=-10!) USER MOD Set 8.1: A 26 THR OG1 : rot 180:sc= 0.886 USER MOD Set 8.2: A 29 SER OG : rot 100:sc= 1.04 USER MOD Set 9.1: A 22 SER OG : rot 176:sc= 2.06 USER MOD Set 9.2: A 25 THR OG1 : rot 3:sc= 0.412 USER MOD Single : A 8 LYS NZ :NH3+ -167:sc= -0.0227 (180deg=-0.181) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 89:sc= 0.798 USER MOD Single : A 36 GLN : amide:sc= 0.449 X(o=0.45,f=0) USER MOD Single : A 39 THR OG1 : rot 81:sc= 0.697 USER MOD Single : A 41 THR OG1 : rot -102:sc= 0.319 USER MOD Single : A 43 CYS SG : rot -123:sc= -1.03 USER MOD Single : A 46 MET CE :methyl 154:sc= -0.837 (180deg=-2.53!) USER MOD Single : A 50 ASN : amide:sc= -1.75! K(o=-1.8!,f=-0.018) USER MOD Single : A 51 THR OG1 : rot 74:sc= 0.741 USER MOD Single : A 52 LYS NZ :NH3+ 134:sc= -0.16 (180deg=-0.791) USER MOD Single : A 54 SER OG : rot -130:sc= 0.652 USER MOD Single : A 61 THR OG1 : rot 180:sc= -0.786 USER MOD Single : A 62 TYR OH : rot -150:sc= 0.332 USER MOD Single : A 64 THR OG1 : rot 79:sc= 0.00116 USER MOD Single : A 72 MET CE :methyl 151:sc= -1.56 (180deg=-2.82!) USER MOD Single : A 73 ASN : amide:sc= -1 K(o=-1,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc= -0.371 K(o=-0.37,f=-4.2!) USER MOD Single : A 105 LYS NZ :NH3+ 156:sc= 1.11 (180deg=0.703) USER MOD Single : A 106 LYS NZ :NH3+ 164:sc= 1.27 (180deg=1.14) USER MOD Single : A 113 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00833) USER MOD Single : A 119 HIS : no HD1:sc= -0.628 K(o=-0.63,f=0.052) USER MOD Single : A 120 HIS : no HD1:sc= 0.98 K(o=0.98,f=-5.4!) USER MOD Single : A 127 GLN : amide:sc= 0.493 X(o=0.49,f=0) USER MOD Single : A 130 LYS NZ :NH3+ -168:sc= 1.27 (180deg=1.14) USER MOD Single : A 137 MET CE :methyl -169:sc= -0.0157 (180deg=-0.233) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 THR OG1 : rot 180:sc= -1.67! USER MOD Single : A 158 SER OG : rot 140:sc= -0.8 USER MOD Single : A 161 LYS NZ :NH3+ -167:sc= 1.05 (180deg=0.932) USER MOD Single : A 165 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 166 LYS NZ :NH3+ 163:sc= 1.26 (180deg=1.14) USER MOD Single : A 167 TYR OH : rot 180:sc= 0 USER MOD Single : A 173 HIS : no HD1:sc= -1.32 K(o=-1.3,f=-2.2!) USER MOD Single : A 175 CYS SG : rot -0:sc= 0.188 USER MOD Single : A 179 LYS NZ :NH3+ 161:sc= 2.69 (180deg=2) USER MOD ----------------------------------------------------------------- ATOM 92 N LYS A 8 -16.018 7.801 5.531 1.00 61.01 N ATOM 93 CA LYS A 8 -16.435 8.015 4.155 1.00 14.12 C ATOM 94 C LYS A 8 -15.459 7.344 3.199 1.00 73.50 C ATOM 95 O LYS A 8 -15.462 7.607 1.996 1.00 24.53 O ATOM 96 CB LYS A 8 -16.514 9.517 3.865 1.00 1.23 C ATOM 97 CG LYS A 8 -17.291 10.305 4.913 1.00 34.34 C ATOM 98 CD LYS A 8 -18.734 9.836 5.011 1.00 1.41 C ATOM 99 CE LYS A 8 -19.510 10.616 6.057 1.00 22.20 C ATOM 100 NZ LYS A 8 -18.930 10.465 7.417 1.00 33.31 N ATOM 0 HA LYS A 8 -17.421 7.574 4.010 1.00 14.12 H new ATOM 0 HB2 LYS A 8 -15.503 9.918 3.798 1.00 1.23 H new ATOM 0 HB3 LYS A 8 -16.981 9.666 2.892 1.00 1.23 H new ATOM 0 HG2 LYS A 8 -16.806 10.197 5.883 1.00 34.34 H new ATOM 0 HG3 LYS A 8 -17.269 11.365 4.662 1.00 34.34 H new ATOM 0 HD2 LYS A 8 -19.219 9.947 4.041 1.00 1.41 H new ATOM 0 HD3 LYS A 8 -18.755 8.775 5.259 1.00 1.41 H new ATOM 0 HE2 LYS A 8 -19.523 11.671 5.785 1.00 22.20 H new ATOM 0 HE3 LYS A 8 -20.546 10.277 6.066 1.00 22.20 H new ATOM 0 HZ1 LYS A 8 -19.603 10.824 8.123 1.00 33.31 H new ATOM 0 HZ2 LYS A 8 -18.737 9.460 7.602 1.00 33.31 H new ATOM 0 HZ3 LYS A 8 -18.043 11.005 7.478 1.00 33.31 H new ATOM 114 N GLU A 9 -14.632 6.468 3.745 1.00 43.11 N ATOM 115 CA GLU A 9 -13.615 5.787 2.970 1.00 2.11 C ATOM 116 C GLU A 9 -14.085 4.385 2.593 1.00 71.04 C ATOM 117 O GLU A 9 -14.643 3.669 3.428 1.00 23.14 O ATOM 118 CB GLU A 9 -12.297 5.701 3.755 1.00 2.03 C ATOM 119 CG GLU A 9 -11.754 7.048 4.196 1.00 73.11 C ATOM 120 CD GLU A 9 -12.255 7.463 5.567 1.00 33.43 C ATOM 121 OE1 GLU A 9 -11.734 6.947 6.578 1.00 65.01 O ATOM 122 OE2 GLU A 9 -13.166 8.315 5.642 1.00 20.12 O ATOM 0 H GLU A 9 -14.648 6.212 4.732 1.00 43.11 H new ATOM 0 HA GLU A 9 -13.442 6.362 2.060 1.00 2.11 H new ATOM 0 HB2 GLU A 9 -12.450 5.076 4.635 1.00 2.03 H new ATOM 0 HB3 GLU A 9 -11.549 5.204 3.137 1.00 2.03 H new ATOM 0 HG2 GLU A 9 -10.665 7.009 4.209 1.00 73.11 H new ATOM 0 HG3 GLU A 9 -12.038 7.806 3.466 1.00 73.11 H new ATOM 129 N PRO A 10 -13.885 3.986 1.325 1.00 25.21 N ATOM 130 CA PRO A 10 -14.193 2.630 0.862 1.00 22.15 C ATOM 131 C PRO A 10 -13.299 1.584 1.520 1.00 74.14 C ATOM 132 O PRO A 10 -12.290 1.923 2.145 1.00 71.25 O ATOM 133 CB PRO A 10 -13.932 2.682 -0.643 1.00 2.23 C ATOM 134 CG PRO A 10 -13.030 3.846 -0.846 1.00 50.33 C ATOM 135 CD PRO A 10 -13.360 4.831 0.240 1.00 30.03 C ATOM 0 HA PRO A 10 -15.214 2.341 1.113 1.00 22.15 H new ATOM 0 HB2 PRO A 10 -13.469 1.760 -0.994 1.00 2.23 H new ATOM 0 HB3 PRO A 10 -14.862 2.803 -1.199 1.00 2.23 H new ATOM 0 HG2 PRO A 10 -11.985 3.542 -0.790 1.00 50.33 H new ATOM 0 HG3 PRO A 10 -13.182 4.288 -1.831 1.00 50.33 H new ATOM 0 HD2 PRO A 10 -12.479 5.389 0.557 1.00 30.03 H new ATOM 0 HD3 PRO A 10 -14.098 5.562 -0.092 1.00 30.03 H new ATOM 143 N GLU A 11 -13.672 0.321 1.368 1.00 24.11 N ATOM 144 CA GLU A 11 -12.970 -0.789 2.007 1.00 1.43 C ATOM 145 C GLU A 11 -11.472 -0.805 1.672 1.00 34.24 C ATOM 146 O GLU A 11 -10.655 -1.045 2.545 1.00 42.32 O ATOM 147 CB GLU A 11 -13.629 -2.132 1.636 1.00 22.53 C ATOM 148 CG GLU A 11 -13.427 -2.589 0.189 1.00 11.24 C ATOM 149 CD GLU A 11 -14.065 -1.666 -0.832 1.00 20.14 C ATOM 150 OE1 GLU A 11 -15.295 -1.726 -1.003 1.00 5.01 O ATOM 151 OE2 GLU A 11 -13.333 -0.872 -1.466 1.00 71.51 O ATOM 0 H GLU A 11 -14.469 0.035 0.799 1.00 24.11 H new ATOM 0 HA GLU A 11 -13.051 -0.643 3.084 1.00 1.43 H new ATOM 0 HB2 GLU A 11 -13.239 -2.904 2.300 1.00 22.53 H new ATOM 0 HB3 GLU A 11 -14.699 -2.057 1.829 1.00 22.53 H new ATOM 0 HG2 GLU A 11 -12.359 -2.661 -0.015 1.00 11.24 H new ATOM 0 HG3 GLU A 11 -13.842 -3.590 0.071 1.00 11.24 H new ATOM 158 N GLN A 12 -11.121 -0.510 0.423 1.00 11.54 N ATOM 159 CA GLN A 12 -9.721 -0.560 -0.019 1.00 42.32 C ATOM 160 C GLN A 12 -8.859 0.503 0.670 1.00 34.10 C ATOM 161 O GLN A 12 -7.663 0.313 0.862 1.00 62.33 O ATOM 162 CB GLN A 12 -9.641 -0.405 -1.540 1.00 44.32 C ATOM 163 CG GLN A 12 -10.048 0.969 -2.054 1.00 44.33 C ATOM 164 CD GLN A 12 -10.650 0.912 -3.440 1.00 33.21 C ATOM 165 OE1 GLN A 12 -9.958 1.061 -4.446 1.00 63.41 O ATOM 166 NE2 GLN A 12 -11.946 0.671 -3.501 1.00 43.01 N ATOM 0 H GLN A 12 -11.782 -0.234 -0.303 1.00 11.54 H new ATOM 0 HA GLN A 12 -9.324 -1.534 0.266 1.00 42.32 H new ATOM 0 HB2 GLN A 12 -8.620 -0.612 -1.861 1.00 44.32 H new ATOM 0 HB3 GLN A 12 -10.279 -1.157 -2.004 1.00 44.32 H new ATOM 0 HG2 GLN A 12 -10.768 1.412 -1.366 1.00 44.33 H new ATOM 0 HG3 GLN A 12 -9.175 1.622 -2.067 1.00 44.33 H new ATOM 0 HE21 GLN A 12 -12.484 0.554 -2.642 1.00 43.01 H new ATOM 0 HE22 GLN A 12 -12.410 0.602 -4.407 1.00 43.01 H new ATOM 175 N LEU A 13 -9.479 1.605 1.073 1.00 24.42 N ATOM 176 CA LEU A 13 -8.745 2.705 1.681 1.00 53.13 C ATOM 177 C LEU A 13 -8.427 2.416 3.141 1.00 53.32 C ATOM 178 O LEU A 13 -7.486 2.976 3.698 1.00 74.22 O ATOM 179 CB LEU A 13 -9.538 4.009 1.568 1.00 54.34 C ATOM 180 CG LEU A 13 -9.049 4.983 0.492 1.00 41.31 C ATOM 181 CD1 LEU A 13 -9.114 4.346 -0.881 1.00 44.15 C ATOM 182 CD2 LEU A 13 -9.879 6.249 0.504 1.00 15.33 C ATOM 0 H LEU A 13 -10.484 1.760 0.990 1.00 24.42 H new ATOM 0 HA LEU A 13 -7.805 2.813 1.140 1.00 53.13 H new ATOM 0 HB2 LEU A 13 -10.581 3.764 1.366 1.00 54.34 H new ATOM 0 HB3 LEU A 13 -9.511 4.516 2.533 1.00 54.34 H new ATOM 0 HG LEU A 13 -8.012 5.234 0.715 1.00 41.31 H new ATOM 0 HD11 LEU A 13 -8.762 5.057 -1.629 1.00 44.15 H new ATOM 0 HD12 LEU A 13 -8.484 3.457 -0.900 1.00 44.15 H new ATOM 0 HD13 LEU A 13 -10.143 4.065 -1.104 1.00 44.15 H new ATOM 0 HD21 LEU A 13 -9.517 6.929 -0.267 1.00 15.33 H new ATOM 0 HD22 LEU A 13 -10.923 6.002 0.309 1.00 15.33 H new ATOM 0 HD23 LEU A 13 -9.796 6.729 1.479 1.00 15.33 H new ATOM 194 N ARG A 14 -9.198 1.526 3.751 1.00 33.23 N ATOM 195 CA ARG A 14 -9.049 1.254 5.170 1.00 44.10 C ATOM 196 C ARG A 14 -8.703 -0.212 5.447 1.00 4.31 C ATOM 197 O ARG A 14 -8.558 -0.611 6.597 1.00 14.23 O ATOM 198 CB ARG A 14 -10.314 1.665 5.933 1.00 34.03 C ATOM 199 CG ARG A 14 -11.610 1.158 5.321 1.00 14.22 C ATOM 200 CD ARG A 14 -12.814 1.727 6.051 1.00 2.20 C ATOM 201 NE ARG A 14 -14.082 1.360 5.420 1.00 74.34 N ATOM 202 CZ ARG A 14 -15.263 1.407 6.039 1.00 3.22 C ATOM 203 NH1 ARG A 14 -15.342 1.808 7.303 1.00 0.13 N ATOM 204 NH2 ARG A 14 -16.368 1.059 5.394 1.00 1.20 N ATOM 0 H ARG A 14 -9.928 0.985 3.287 1.00 33.23 H new ATOM 0 HA ARG A 14 -8.211 1.853 5.526 1.00 44.10 H new ATOM 0 HB2 ARG A 14 -10.242 1.297 6.957 1.00 34.03 H new ATOM 0 HB3 ARG A 14 -10.353 2.753 5.987 1.00 34.03 H new ATOM 0 HG2 ARG A 14 -11.653 1.437 4.268 1.00 14.22 H new ATOM 0 HG3 ARG A 14 -11.635 0.069 5.364 1.00 14.22 H new ATOM 0 HD2 ARG A 14 -12.810 1.372 7.082 1.00 2.20 H new ATOM 0 HD3 ARG A 14 -12.732 2.813 6.087 1.00 2.20 H new ATOM 0 HE ARG A 14 -14.062 1.050 4.449 1.00 74.34 H new ATOM 0 HH11 ARG A 14 -14.497 2.082 7.805 1.00 0.13 H new ATOM 0 HH12 ARG A 14 -16.247 1.842 7.772 1.00 0.13 H new ATOM 0 HH21 ARG A 14 -16.317 0.754 4.422 1.00 1.20 H new ATOM 0 HH22 ARG A 14 -17.269 1.096 5.870 1.00 1.20 H new ATOM 218 N LYS A 15 -8.606 -1.023 4.408 1.00 51.22 N ATOM 219 CA LYS A 15 -8.168 -2.400 4.575 1.00 35.22 C ATOM 220 C LYS A 15 -6.669 -2.551 4.337 1.00 11.43 C ATOM 221 O LYS A 15 -6.080 -1.880 3.489 1.00 41.24 O ATOM 222 CB LYS A 15 -8.969 -3.324 3.646 1.00 3.14 C ATOM 223 CG LYS A 15 -8.613 -4.802 3.750 1.00 44.33 C ATOM 224 CD LYS A 15 -9.649 -5.687 3.065 1.00 74.40 C ATOM 225 CE LYS A 15 -9.955 -5.228 1.646 1.00 65.14 C ATOM 226 NZ LYS A 15 -11.051 -6.017 1.028 1.00 22.55 N ATOM 0 H LYS A 15 -8.822 -0.756 3.447 1.00 51.22 H new ATOM 0 HA LYS A 15 -8.357 -2.690 5.609 1.00 35.22 H new ATOM 0 HB2 LYS A 15 -10.030 -3.204 3.865 1.00 3.14 H new ATOM 0 HB3 LYS A 15 -8.818 -3.000 2.616 1.00 3.14 H new ATOM 0 HG2 LYS A 15 -7.635 -4.972 3.299 1.00 44.33 H new ATOM 0 HG3 LYS A 15 -8.533 -5.083 4.800 1.00 44.33 H new ATOM 0 HD2 LYS A 15 -9.287 -6.715 3.042 1.00 74.40 H new ATOM 0 HD3 LYS A 15 -10.568 -5.686 3.651 1.00 74.40 H new ATOM 0 HE2 LYS A 15 -10.230 -4.173 1.658 1.00 65.14 H new ATOM 0 HE3 LYS A 15 -9.057 -5.316 1.035 1.00 65.14 H new ATOM 0 HZ1 LYS A 15 -11.226 -5.671 0.063 1.00 22.55 H new ATOM 0 HZ2 LYS A 15 -10.779 -7.020 0.992 1.00 22.55 H new ATOM 0 HZ3 LYS A 15 -11.916 -5.913 1.595 1.00 22.55 H new ATOM 240 N LEU A 16 -6.072 -3.433 5.119 1.00 33.05 N ATOM 241 CA LEU A 16 -4.672 -3.777 4.988 1.00 12.32 C ATOM 242 C LEU A 16 -4.533 -5.236 4.588 1.00 53.32 C ATOM 243 O LEU A 16 -5.330 -6.074 4.992 1.00 44.40 O ATOM 244 CB LEU A 16 -3.912 -3.542 6.301 1.00 41.23 C ATOM 245 CG LEU A 16 -3.777 -2.087 6.743 1.00 25.04 C ATOM 246 CD1 LEU A 16 -2.951 -1.990 8.014 1.00 2.32 C ATOM 247 CD2 LEU A 16 -3.162 -1.242 5.645 1.00 23.41 C ATOM 0 H LEU A 16 -6.551 -3.933 5.868 1.00 33.05 H new ATOM 0 HA LEU A 16 -4.243 -3.135 4.219 1.00 12.32 H new ATOM 0 HB2 LEU A 16 -4.415 -4.097 7.093 1.00 41.23 H new ATOM 0 HB3 LEU A 16 -2.912 -3.965 6.200 1.00 41.23 H new ATOM 0 HG LEU A 16 -4.776 -1.702 6.948 1.00 25.04 H new ATOM 0 HD11 LEU A 16 -2.866 -0.945 8.314 1.00 2.32 H new ATOM 0 HD12 LEU A 16 -3.437 -2.557 8.808 1.00 2.32 H new ATOM 0 HD13 LEU A 16 -1.956 -2.398 7.834 1.00 2.32 H new ATOM 0 HD21 LEU A 16 -3.077 -0.210 5.985 1.00 23.41 H new ATOM 0 HD22 LEU A 16 -2.172 -1.627 5.401 1.00 23.41 H new ATOM 0 HD23 LEU A 16 -3.795 -1.281 4.758 1.00 23.41 H new ATOM 259 N PHE A 17 -3.527 -5.525 3.792 1.00 40.21 N ATOM 260 CA PHE A 17 -3.176 -6.888 3.456 1.00 62.43 C ATOM 261 C PHE A 17 -2.063 -7.336 4.386 1.00 42.21 C ATOM 262 O PHE A 17 -1.116 -6.598 4.622 1.00 15.52 O ATOM 263 CB PHE A 17 -2.730 -6.977 1.988 1.00 23.01 C ATOM 264 CG PHE A 17 -1.893 -8.189 1.663 1.00 24.13 C ATOM 265 CD1 PHE A 17 -2.484 -9.393 1.322 1.00 74.33 C ATOM 266 CD2 PHE A 17 -0.509 -8.114 1.694 1.00 51.41 C ATOM 267 CE1 PHE A 17 -1.709 -10.495 1.021 1.00 42.20 C ATOM 268 CE2 PHE A 17 0.268 -9.213 1.395 1.00 43.24 C ATOM 269 CZ PHE A 17 -0.333 -10.406 1.057 1.00 2.10 C ATOM 0 H PHE A 17 -2.929 -4.821 3.359 1.00 40.21 H new ATOM 0 HA PHE A 17 -4.041 -7.540 3.578 1.00 62.43 H new ATOM 0 HB2 PHE A 17 -3.615 -6.981 1.352 1.00 23.01 H new ATOM 0 HB3 PHE A 17 -2.162 -6.081 1.739 1.00 23.01 H new ATOM 0 HD1 PHE A 17 -3.561 -9.471 1.291 1.00 74.33 H new ATOM 0 HD2 PHE A 17 -0.032 -7.181 1.956 1.00 51.41 H new ATOM 0 HE1 PHE A 17 -2.181 -11.430 0.757 1.00 42.20 H new ATOM 0 HE2 PHE A 17 1.345 -9.139 1.426 1.00 43.24 H new ATOM 0 HZ PHE A 17 0.272 -11.269 0.821 1.00 2.10 H new ATOM 279 N ILE A 18 -2.182 -8.523 4.933 1.00 42.32 N ATOM 280 CA ILE A 18 -1.174 -9.034 5.838 1.00 42.33 C ATOM 281 C ILE A 18 -0.431 -10.183 5.187 1.00 70.21 C ATOM 282 O ILE A 18 -1.002 -11.242 4.951 1.00 34.43 O ATOM 283 CB ILE A 18 -1.790 -9.517 7.167 1.00 44.11 C ATOM 284 CG1 ILE A 18 -2.809 -8.501 7.702 1.00 65.33 C ATOM 285 CG2 ILE A 18 -0.692 -9.760 8.193 1.00 5.44 C ATOM 286 CD1 ILE A 18 -2.230 -7.121 7.940 1.00 61.34 C ATOM 0 H ILE A 18 -2.966 -9.155 4.769 1.00 42.32 H new ATOM 0 HA ILE A 18 -0.486 -8.217 6.057 1.00 42.33 H new ATOM 0 HB ILE A 18 -2.315 -10.454 6.982 1.00 44.11 H new ATOM 0 HG12 ILE A 18 -3.634 -8.421 6.994 1.00 65.33 H new ATOM 0 HG13 ILE A 18 -3.226 -8.876 8.637 1.00 65.33 H new ATOM 0 HG21 ILE A 18 -1.137 -10.101 9.128 1.00 5.44 H new ATOM 0 HG22 ILE A 18 -0.006 -10.520 7.819 1.00 5.44 H new ATOM 0 HG23 ILE A 18 -0.146 -8.833 8.368 1.00 5.44 H new ATOM 0 HD11 ILE A 18 -3.010 -6.459 8.317 1.00 61.34 H new ATOM 0 HD12 ILE A 18 -1.424 -7.186 8.671 1.00 61.34 H new ATOM 0 HD13 ILE A 18 -1.839 -6.724 7.003 1.00 61.34 H new ATOM 298 N GLY A 19 0.834 -9.969 4.885 1.00 34.33 N ATOM 299 CA GLY A 19 1.622 -11.010 4.272 1.00 23.11 C ATOM 300 C GLY A 19 2.597 -11.617 5.250 1.00 74.21 C ATOM 301 O GLY A 19 2.996 -10.966 6.214 1.00 62.21 O ATOM 0 H GLY A 19 1.330 -9.094 5.053 1.00 34.33 H new ATOM 0 HA2 GLY A 19 0.962 -11.787 3.886 1.00 23.11 H new ATOM 0 HA3 GLY A 19 2.166 -10.602 3.421 1.00 23.11 H new ATOM 305 N GLY A 20 2.966 -12.865 5.015 1.00 75.54 N ATOM 306 CA GLY A 20 3.958 -13.513 5.847 1.00 32.11 C ATOM 307 C GLY A 20 3.450 -13.880 7.224 1.00 30.35 C ATOM 308 O GLY A 20 4.170 -13.729 8.209 1.00 40.14 O ATOM 0 H GLY A 20 2.596 -13.443 4.261 1.00 75.54 H new ATOM 0 HA2 GLY A 20 4.307 -14.416 5.345 1.00 32.11 H new ATOM 0 HA3 GLY A 20 4.819 -12.853 5.951 1.00 32.11 H new ATOM 312 N LEU A 21 2.215 -14.361 7.299 1.00 44.41 N ATOM 313 CA LEU A 21 1.661 -14.862 8.548 1.00 14.11 C ATOM 314 C LEU A 21 2.194 -16.261 8.829 1.00 53.30 C ATOM 315 O LEU A 21 2.929 -16.827 8.019 1.00 25.14 O ATOM 316 CB LEU A 21 0.132 -14.901 8.467 1.00 52.43 C ATOM 317 CG LEU A 21 -0.559 -13.545 8.545 1.00 43.10 C ATOM 318 CD1 LEU A 21 -1.999 -13.651 8.082 1.00 45.24 C ATOM 319 CD2 LEU A 21 -0.503 -13.009 9.962 1.00 41.43 C ATOM 0 H LEU A 21 1.577 -14.414 6.505 1.00 44.41 H new ATOM 0 HA LEU A 21 1.959 -14.195 9.357 1.00 14.11 H new ATOM 0 HB2 LEU A 21 -0.154 -15.383 7.532 1.00 52.43 H new ATOM 0 HB3 LEU A 21 -0.242 -15.528 9.276 1.00 52.43 H new ATOM 0 HG LEU A 21 -0.035 -12.853 7.885 1.00 43.10 H new ATOM 0 HD11 LEU A 21 -2.475 -12.672 8.145 1.00 45.24 H new ATOM 0 HD12 LEU A 21 -2.025 -14.001 7.050 1.00 45.24 H new ATOM 0 HD13 LEU A 21 -2.535 -14.356 8.717 1.00 45.24 H new ATOM 0 HD21 LEU A 21 -1.000 -12.040 10.004 1.00 41.43 H new ATOM 0 HD22 LEU A 21 -1.006 -13.704 10.634 1.00 41.43 H new ATOM 0 HD23 LEU A 21 0.537 -12.897 10.268 1.00 41.43 H new ATOM 331 N SER A 22 1.823 -16.821 9.965 1.00 31.13 N ATOM 332 CA SER A 22 2.253 -18.160 10.316 1.00 2.44 C ATOM 333 C SER A 22 1.330 -19.192 9.675 1.00 72.23 C ATOM 334 O SER A 22 0.383 -18.842 8.970 1.00 21.01 O ATOM 335 CB SER A 22 2.270 -18.325 11.838 1.00 45.32 C ATOM 336 OG SER A 22 0.970 -18.179 12.382 1.00 1.51 O ATOM 0 H SER A 22 1.226 -16.370 10.659 1.00 31.13 H new ATOM 0 HA SER A 22 3.264 -18.318 9.939 1.00 2.44 H new ATOM 0 HB2 SER A 22 2.667 -19.307 12.096 1.00 45.32 H new ATOM 0 HB3 SER A 22 2.937 -17.585 12.280 1.00 45.32 H new ATOM 0 HG SER A 22 0.996 -18.359 13.345 1.00 1.51 H new ATOM 342 N PHE A 23 1.609 -20.460 9.929 1.00 22.31 N ATOM 343 CA PHE A 23 0.783 -21.550 9.432 1.00 71.42 C ATOM 344 C PHE A 23 -0.399 -21.779 10.377 1.00 42.40 C ATOM 345 O PHE A 23 -1.341 -22.510 10.061 1.00 60.23 O ATOM 346 CB PHE A 23 1.640 -22.814 9.317 1.00 42.11 C ATOM 347 CG PHE A 23 0.983 -23.968 8.614 1.00 54.43 C ATOM 348 CD1 PHE A 23 0.654 -23.886 7.273 1.00 41.42 C ATOM 349 CD2 PHE A 23 0.713 -25.141 9.297 1.00 11.12 C ATOM 350 CE1 PHE A 23 0.065 -24.956 6.626 1.00 64.22 C ATOM 351 CE2 PHE A 23 0.128 -26.213 8.657 1.00 22.41 C ATOM 352 CZ PHE A 23 -0.197 -26.120 7.319 1.00 62.11 C ATOM 0 H PHE A 23 2.410 -20.763 10.483 1.00 22.31 H new ATOM 0 HA PHE A 23 0.388 -21.298 8.448 1.00 71.42 H new ATOM 0 HB2 PHE A 23 2.560 -22.563 8.789 1.00 42.11 H new ATOM 0 HB3 PHE A 23 1.924 -23.134 10.319 1.00 42.11 H new ATOM 0 HD1 PHE A 23 0.859 -22.977 6.726 1.00 41.42 H new ATOM 0 HD2 PHE A 23 0.964 -25.218 10.345 1.00 11.12 H new ATOM 0 HE1 PHE A 23 -0.190 -24.881 5.579 1.00 64.22 H new ATOM 0 HE2 PHE A 23 -0.075 -27.123 9.201 1.00 22.41 H new ATOM 0 HZ PHE A 23 -0.656 -26.958 6.815 1.00 62.11 H new ATOM 362 N GLU A 24 -0.358 -21.113 11.526 1.00 34.13 N ATOM 363 CA GLU A 24 -1.358 -21.309 12.563 1.00 33.05 C ATOM 364 C GLU A 24 -2.122 -20.019 12.866 1.00 75.14 C ATOM 365 O GLU A 24 -2.743 -19.902 13.920 1.00 34.33 O ATOM 366 CB GLU A 24 -0.692 -21.835 13.840 1.00 62.43 C ATOM 367 CG GLU A 24 -0.006 -23.178 13.661 1.00 31.11 C ATOM 368 CD GLU A 24 0.520 -23.747 14.962 1.00 65.04 C ATOM 369 OE1 GLU A 24 -0.265 -24.392 15.691 1.00 65.34 O ATOM 370 OE2 GLU A 24 1.718 -23.560 15.262 1.00 54.04 O ATOM 0 H GLU A 24 0.362 -20.430 11.761 1.00 34.13 H new ATOM 0 HA GLU A 24 -2.077 -22.042 12.196 1.00 33.05 H new ATOM 0 HB2 GLU A 24 0.041 -21.105 14.184 1.00 62.43 H new ATOM 0 HB3 GLU A 24 -1.446 -21.923 14.623 1.00 62.43 H new ATOM 0 HG2 GLU A 24 -0.709 -23.884 13.219 1.00 31.11 H new ATOM 0 HG3 GLU A 24 0.820 -23.068 12.958 1.00 31.11 H new ATOM 377 N THR A 25 -2.106 -19.066 11.936 1.00 45.04 N ATOM 378 CA THR A 25 -2.808 -17.802 12.141 1.00 74.04 C ATOM 379 C THR A 25 -4.317 -17.977 11.965 1.00 13.51 C ATOM 380 O THR A 25 -4.773 -18.589 10.997 1.00 1.32 O ATOM 381 CB THR A 25 -2.328 -16.708 11.165 1.00 25.11 C ATOM 382 OG1 THR A 25 -0.903 -16.593 11.207 1.00 72.32 O ATOM 383 CG2 THR A 25 -2.951 -15.364 11.519 1.00 35.14 C ATOM 0 H THR A 25 -1.620 -19.144 11.043 1.00 45.04 H new ATOM 0 HA THR A 25 -2.584 -17.491 13.161 1.00 74.04 H new ATOM 0 HB THR A 25 -2.638 -16.993 10.160 1.00 25.11 H new ATOM 0 HG1 THR A 25 -0.538 -17.273 11.811 1.00 72.32 H new ATOM 0 HG21 THR A 25 -2.601 -14.605 10.820 1.00 35.14 H new ATOM 0 HG22 THR A 25 -4.037 -15.439 11.459 1.00 35.14 H new ATOM 0 HG23 THR A 25 -2.662 -15.085 12.532 1.00 35.14 H new ATOM 391 N THR A 26 -5.081 -17.462 12.920 1.00 51.32 N ATOM 392 CA THR A 26 -6.529 -17.426 12.810 1.00 61.44 C ATOM 393 C THR A 26 -7.023 -15.987 12.727 1.00 12.23 C ATOM 394 O THR A 26 -6.303 -15.054 13.092 1.00 61.33 O ATOM 395 CB THR A 26 -7.194 -18.136 13.997 1.00 42.51 C ATOM 396 OG1 THR A 26 -6.477 -17.844 15.202 1.00 43.42 O ATOM 397 CG2 THR A 26 -7.238 -19.638 13.766 1.00 11.21 C ATOM 0 H THR A 26 -4.716 -17.061 13.784 1.00 51.32 H new ATOM 0 HA THR A 26 -6.804 -17.952 11.896 1.00 61.44 H new ATOM 0 HB THR A 26 -8.217 -17.773 14.092 1.00 42.51 H new ATOM 0 HG1 THR A 26 -6.907 -18.298 15.957 1.00 43.42 H new ATOM 0 HG21 THR A 26 -7.713 -20.123 14.619 1.00 11.21 H new ATOM 0 HG22 THR A 26 -7.810 -19.851 12.863 1.00 11.21 H new ATOM 0 HG23 THR A 26 -6.223 -20.018 13.651 1.00 11.21 H new ATOM 405 N ASP A 27 -8.245 -15.823 12.232 1.00 44.03 N ATOM 406 CA ASP A 27 -8.858 -14.508 12.036 1.00 73.32 C ATOM 407 C ASP A 27 -9.021 -13.791 13.364 1.00 52.40 C ATOM 408 O ASP A 27 -8.814 -12.580 13.454 1.00 71.14 O ATOM 409 CB ASP A 27 -10.232 -14.644 11.370 1.00 12.33 C ATOM 410 CG ASP A 27 -10.244 -15.641 10.232 1.00 4.34 C ATOM 411 OD1 ASP A 27 -10.301 -16.859 10.504 1.00 41.22 O ATOM 412 OD2 ASP A 27 -10.201 -15.217 9.067 1.00 24.41 O ATOM 0 H ASP A 27 -8.844 -16.600 11.953 1.00 44.03 H new ATOM 0 HA ASP A 27 -8.199 -13.928 11.389 1.00 73.32 H new ATOM 0 HB2 ASP A 27 -10.964 -14.948 12.119 1.00 12.33 H new ATOM 0 HB3 ASP A 27 -10.545 -13.670 10.995 1.00 12.33 H new ATOM 417 N GLU A 28 -9.380 -14.560 14.386 1.00 1.22 N ATOM 418 CA GLU A 28 -9.563 -14.039 15.739 1.00 3.40 C ATOM 419 C GLU A 28 -8.264 -13.446 16.288 1.00 11.14 C ATOM 420 O GLU A 28 -8.267 -12.375 16.894 1.00 15.02 O ATOM 421 CB GLU A 28 -10.067 -15.152 16.668 1.00 50.43 C ATOM 422 CG GLU A 28 -9.282 -16.452 16.552 1.00 0.53 C ATOM 423 CD GLU A 28 -9.731 -17.504 17.542 1.00 61.12 C ATOM 424 OE1 GLU A 28 -10.713 -18.211 17.255 1.00 4.25 O ATOM 425 OE2 GLU A 28 -9.094 -17.635 18.607 1.00 34.30 O ATOM 0 H GLU A 28 -9.553 -15.562 14.302 1.00 1.22 H new ATOM 0 HA GLU A 28 -10.305 -13.242 15.695 1.00 3.40 H new ATOM 0 HB2 GLU A 28 -10.020 -14.801 17.699 1.00 50.43 H new ATOM 0 HB3 GLU A 28 -11.116 -15.351 16.446 1.00 50.43 H new ATOM 0 HG2 GLU A 28 -9.387 -16.844 15.541 1.00 0.53 H new ATOM 0 HG3 GLU A 28 -8.223 -16.245 16.705 1.00 0.53 H new ATOM 432 N SER A 29 -7.160 -14.138 16.044 1.00 12.11 N ATOM 433 CA SER A 29 -5.860 -13.719 16.543 1.00 60.33 C ATOM 434 C SER A 29 -5.319 -12.551 15.725 1.00 54.15 C ATOM 435 O SER A 29 -4.711 -11.626 16.269 1.00 12.53 O ATOM 436 CB SER A 29 -4.884 -14.895 16.504 1.00 4.11 C ATOM 437 OG SER A 29 -5.454 -16.044 17.110 1.00 13.22 O ATOM 0 H SER A 29 -7.141 -15.000 15.498 1.00 12.11 H new ATOM 0 HA SER A 29 -5.973 -13.387 17.575 1.00 60.33 H new ATOM 0 HB2 SER A 29 -4.617 -15.118 15.471 1.00 4.11 H new ATOM 0 HB3 SER A 29 -3.962 -14.626 17.020 1.00 4.11 H new ATOM 0 HG SER A 29 -5.799 -16.643 16.415 1.00 13.22 H new ATOM 443 N LEU A 30 -5.561 -12.591 14.419 1.00 22.42 N ATOM 444 CA LEU A 30 -5.116 -11.535 13.521 1.00 11.13 C ATOM 445 C LEU A 30 -5.829 -10.226 13.843 1.00 64.52 C ATOM 446 O LEU A 30 -5.200 -9.165 13.891 1.00 33.34 O ATOM 447 CB LEU A 30 -5.360 -11.943 12.061 1.00 12.21 C ATOM 448 CG LEU A 30 -4.788 -10.994 11.000 1.00 34.24 C ATOM 449 CD1 LEU A 30 -3.290 -10.823 11.186 1.00 34.10 C ATOM 450 CD2 LEU A 30 -5.087 -11.512 9.603 1.00 4.03 C ATOM 0 H LEU A 30 -6.066 -13.348 13.958 1.00 22.42 H new ATOM 0 HA LEU A 30 -4.046 -11.383 13.662 1.00 11.13 H new ATOM 0 HB2 LEU A 30 -4.933 -12.934 11.904 1.00 12.21 H new ATOM 0 HB3 LEU A 30 -6.435 -12.030 11.902 1.00 12.21 H new ATOM 0 HG LEU A 30 -5.266 -10.022 11.121 1.00 34.24 H new ATOM 0 HD11 LEU A 30 -2.904 -10.146 10.424 1.00 34.10 H new ATOM 0 HD12 LEU A 30 -3.091 -10.408 12.174 1.00 34.10 H new ATOM 0 HD13 LEU A 30 -2.799 -11.792 11.094 1.00 34.10 H new ATOM 0 HD21 LEU A 30 -4.673 -10.826 8.864 1.00 4.03 H new ATOM 0 HD22 LEU A 30 -4.637 -12.496 9.476 1.00 4.03 H new ATOM 0 HD23 LEU A 30 -6.166 -11.586 9.466 1.00 4.03 H new ATOM 462 N ARG A 31 -7.141 -10.310 14.077 1.00 72.13 N ATOM 463 CA ARG A 31 -7.939 -9.158 14.462 1.00 1.25 C ATOM 464 C ARG A 31 -7.426 -8.582 15.762 1.00 42.24 C ATOM 465 O ARG A 31 -7.084 -7.416 15.832 1.00 34.10 O ATOM 466 CB ARG A 31 -9.412 -9.562 14.625 1.00 64.32 C ATOM 467 CG ARG A 31 -10.304 -8.443 15.146 1.00 40.53 C ATOM 468 CD ARG A 31 -11.544 -8.987 15.840 1.00 33.50 C ATOM 469 NE ARG A 31 -12.364 -9.834 14.973 1.00 14.20 N ATOM 470 CZ ARG A 31 -13.650 -10.111 15.205 1.00 4.34 C ATOM 471 NH1 ARG A 31 -14.266 -9.603 16.268 1.00 72.31 N ATOM 472 NH2 ARG A 31 -14.321 -10.899 14.374 1.00 2.22 N ATOM 0 H ARG A 31 -7.672 -11.178 14.004 1.00 72.13 H new ATOM 0 HA ARG A 31 -7.860 -8.404 13.679 1.00 1.25 H new ATOM 0 HB2 ARG A 31 -9.795 -9.900 13.662 1.00 64.32 H new ATOM 0 HB3 ARG A 31 -9.473 -10.410 15.308 1.00 64.32 H new ATOM 0 HG2 ARG A 31 -9.740 -7.823 15.843 1.00 40.53 H new ATOM 0 HG3 ARG A 31 -10.603 -7.801 14.318 1.00 40.53 H new ATOM 0 HD2 ARG A 31 -11.240 -9.561 16.716 1.00 33.50 H new ATOM 0 HD3 ARG A 31 -12.147 -8.153 16.199 1.00 33.50 H new ATOM 0 HE ARG A 31 -11.928 -10.236 14.143 1.00 14.20 H new ATOM 0 HH11 ARG A 31 -13.756 -8.998 16.912 1.00 72.31 H new ATOM 0 HH12 ARG A 31 -15.248 -9.818 16.440 1.00 72.31 H new ATOM 0 HH21 ARG A 31 -13.855 -11.294 13.557 1.00 2.22 H new ATOM 0 HH22 ARG A 31 -15.303 -11.110 14.552 1.00 2.22 H new ATOM 486 N SER A 32 -7.355 -9.441 16.765 1.00 64.20 N ATOM 487 CA SER A 32 -6.904 -9.088 18.099 1.00 1.44 C ATOM 488 C SER A 32 -5.609 -8.276 18.100 1.00 3.42 C ATOM 489 O SER A 32 -5.460 -7.333 18.881 1.00 41.05 O ATOM 490 CB SER A 32 -6.700 -10.375 18.872 1.00 35.13 C ATOM 491 OG SER A 32 -7.936 -10.919 19.290 1.00 75.02 O ATOM 0 H SER A 32 -7.615 -10.423 16.672 1.00 64.20 H new ATOM 0 HA SER A 32 -7.662 -8.454 18.560 1.00 1.44 H new ATOM 0 HB2 SER A 32 -6.173 -11.098 18.249 1.00 35.13 H new ATOM 0 HB3 SER A 32 -6.070 -10.185 19.741 1.00 35.13 H new ATOM 0 HG SER A 32 -8.283 -11.515 18.594 1.00 75.02 H new ATOM 497 N HIS A 33 -4.688 -8.642 17.221 1.00 54.54 N ATOM 498 CA HIS A 33 -3.413 -7.949 17.122 1.00 2.34 C ATOM 499 C HIS A 33 -3.601 -6.532 16.577 1.00 24.14 C ATOM 500 O HIS A 33 -3.299 -5.564 17.261 1.00 22.11 O ATOM 501 CB HIS A 33 -2.424 -8.728 16.247 1.00 75.04 C ATOM 502 CG HIS A 33 -1.073 -8.076 16.151 1.00 40.21 C ATOM 503 ND1 HIS A 33 -0.111 -8.271 17.107 1.00 1.13 N ATOM 504 CD2 HIS A 33 -0.592 -7.231 15.210 1.00 22.32 C ATOM 505 CE1 HIS A 33 0.926 -7.547 16.728 1.00 62.22 C ATOM 506 NE2 HIS A 33 0.680 -6.891 15.586 1.00 32.43 N ATOM 0 H HIS A 33 -4.800 -9.416 16.566 1.00 54.54 H new ATOM 0 HA HIS A 33 -2.998 -7.881 18.128 1.00 2.34 H new ATOM 0 HB2 HIS A 33 -2.306 -9.734 16.651 1.00 75.04 H new ATOM 0 HB3 HIS A 33 -2.841 -8.833 15.245 1.00 75.04 H new ATOM 0 HD2 HIS A 33 -1.113 -6.889 14.328 1.00 22.32 H new ATOM 0 HE1 HIS A 33 1.858 -7.491 17.271 1.00 62.22 H new ATOM 0 HE2 HIS A 33 1.315 -6.262 15.094 1.00 32.43 H new ATOM 514 N PHE A 34 -4.116 -6.411 15.361 1.00 60.10 N ATOM 515 CA PHE A 34 -4.203 -5.109 14.701 1.00 50.43 C ATOM 516 C PHE A 34 -5.260 -4.208 15.341 1.00 73.15 C ATOM 517 O PHE A 34 -5.170 -2.981 15.266 1.00 33.20 O ATOM 518 CB PHE A 34 -4.467 -5.292 13.204 1.00 34.33 C ATOM 519 CG PHE A 34 -3.243 -5.722 12.442 1.00 2.10 C ATOM 520 CD1 PHE A 34 -2.943 -7.065 12.276 1.00 13.21 C ATOM 521 CD2 PHE A 34 -2.382 -4.777 11.903 1.00 63.45 C ATOM 522 CE1 PHE A 34 -1.810 -7.455 11.585 1.00 41.44 C ATOM 523 CE2 PHE A 34 -1.250 -5.163 11.210 1.00 24.40 C ATOM 524 CZ PHE A 34 -0.963 -6.504 11.052 1.00 20.54 C ATOM 0 H PHE A 34 -4.478 -7.191 14.812 1.00 60.10 H new ATOM 0 HA PHE A 34 -3.244 -4.607 14.830 1.00 50.43 H new ATOM 0 HB2 PHE A 34 -5.253 -6.034 13.067 1.00 34.33 H new ATOM 0 HB3 PHE A 34 -4.837 -4.355 12.788 1.00 34.33 H new ATOM 0 HD1 PHE A 34 -3.601 -7.815 12.690 1.00 13.21 H new ATOM 0 HD2 PHE A 34 -2.599 -3.726 12.026 1.00 63.45 H new ATOM 0 HE1 PHE A 34 -1.588 -8.505 11.462 1.00 41.44 H new ATOM 0 HE2 PHE A 34 -0.591 -4.416 10.793 1.00 24.40 H new ATOM 0 HZ PHE A 34 -0.078 -6.808 10.513 1.00 20.54 H new ATOM 534 N GLU A 35 -6.242 -4.823 15.990 1.00 64.31 N ATOM 535 CA GLU A 35 -7.298 -4.095 16.691 1.00 14.21 C ATOM 536 C GLU A 35 -6.738 -3.241 17.840 1.00 2.12 C ATOM 537 O GLU A 35 -7.376 -2.286 18.283 1.00 31.23 O ATOM 538 CB GLU A 35 -8.341 -5.078 17.226 1.00 51.32 C ATOM 539 CG GLU A 35 -9.613 -4.418 17.708 1.00 34.21 C ATOM 540 CD GLU A 35 -10.691 -5.407 18.074 1.00 63.14 C ATOM 541 OE1 GLU A 35 -10.740 -5.827 19.246 1.00 71.44 O ATOM 542 OE2 GLU A 35 -11.508 -5.756 17.197 1.00 73.00 O ATOM 0 H GLU A 35 -6.330 -5.838 16.046 1.00 64.31 H new ATOM 0 HA GLU A 35 -7.767 -3.418 15.977 1.00 14.21 H new ATOM 0 HB2 GLU A 35 -8.589 -5.793 16.441 1.00 51.32 H new ATOM 0 HB3 GLU A 35 -7.904 -5.645 18.047 1.00 51.32 H new ATOM 0 HG2 GLU A 35 -9.387 -3.798 18.576 1.00 34.21 H new ATOM 0 HG3 GLU A 35 -9.987 -3.753 16.930 1.00 34.21 H new ATOM 549 N GLN A 36 -5.542 -3.587 18.315 1.00 30.33 N ATOM 550 CA GLN A 36 -4.878 -2.827 19.378 1.00 11.54 C ATOM 551 C GLN A 36 -4.588 -1.394 18.942 1.00 1.45 C ATOM 552 O GLN A 36 -4.533 -0.484 19.769 1.00 30.13 O ATOM 553 CB GLN A 36 -3.563 -3.492 19.782 1.00 75.13 C ATOM 554 CG GLN A 36 -3.712 -4.909 20.309 1.00 11.41 C ATOM 555 CD GLN A 36 -2.373 -5.547 20.613 1.00 25.31 C ATOM 556 OE1 GLN A 36 -1.881 -5.487 21.739 1.00 34.41 O ATOM 557 NE2 GLN A 36 -1.759 -6.133 19.599 1.00 35.40 N ATOM 0 H GLN A 36 -5.010 -4.391 17.981 1.00 30.33 H new ATOM 0 HA GLN A 36 -5.559 -2.811 20.229 1.00 11.54 H new ATOM 0 HB2 GLN A 36 -2.897 -3.506 18.919 1.00 75.13 H new ATOM 0 HB3 GLN A 36 -3.081 -2.882 20.546 1.00 75.13 H new ATOM 0 HG2 GLN A 36 -4.321 -4.897 21.213 1.00 11.41 H new ATOM 0 HG3 GLN A 36 -4.243 -5.514 19.575 1.00 11.41 H new ATOM 0 HE21 GLN A 36 -2.203 -6.160 18.681 1.00 35.40 H new ATOM 0 HE22 GLN A 36 -0.842 -6.558 19.735 1.00 35.40 H new ATOM 566 N TRP A 37 -4.421 -1.196 17.644 1.00 10.35 N ATOM 567 CA TRP A 37 -4.076 0.114 17.118 1.00 41.53 C ATOM 568 C TRP A 37 -5.307 0.844 16.606 1.00 64.21 C ATOM 569 O TRP A 37 -5.330 2.074 16.559 1.00 54.15 O ATOM 570 CB TRP A 37 -3.014 -0.013 16.025 1.00 1.23 C ATOM 571 CG TRP A 37 -1.658 -0.307 16.589 1.00 72.02 C ATOM 572 CD1 TRP A 37 -0.735 0.604 17.005 1.00 32.22 C ATOM 573 CD2 TRP A 37 -1.078 -1.597 16.814 1.00 4.30 C ATOM 574 NE1 TRP A 37 0.379 -0.038 17.481 1.00 22.34 N ATOM 575 CE2 TRP A 37 0.197 -1.389 17.372 1.00 15.11 C ATOM 576 CE3 TRP A 37 -1.511 -2.907 16.602 1.00 50.34 C ATOM 577 CZ2 TRP A 37 1.042 -2.438 17.717 1.00 23.14 C ATOM 578 CZ3 TRP A 37 -0.672 -3.948 16.946 1.00 22.11 C ATOM 579 CH2 TRP A 37 0.591 -3.709 17.498 1.00 41.14 C ATOM 0 H TRP A 37 -4.519 -1.925 16.937 1.00 10.35 H new ATOM 0 HA TRP A 37 -3.660 0.709 17.931 1.00 41.53 H new ATOM 0 HB2 TRP A 37 -3.299 -0.806 15.334 1.00 1.23 H new ATOM 0 HB3 TRP A 37 -2.974 0.912 15.450 1.00 1.23 H new ATOM 0 HD1 TRP A 37 -0.862 1.676 16.966 1.00 32.22 H new ATOM 0 HE1 TRP A 37 1.210 0.419 17.856 1.00 22.34 H new ATOM 0 HE3 TRP A 37 -2.484 -3.103 16.177 1.00 50.34 H new ATOM 0 HZ2 TRP A 37 2.018 -2.255 18.142 1.00 23.14 H new ATOM 0 HZ3 TRP A 37 -0.997 -4.966 16.786 1.00 22.11 H new ATOM 0 HH2 TRP A 37 1.222 -4.546 17.756 1.00 41.14 H new ATOM 590 N GLY A 38 -6.335 0.094 16.241 1.00 33.43 N ATOM 591 CA GLY A 38 -7.564 0.712 15.798 1.00 53.01 C ATOM 592 C GLY A 38 -8.682 -0.285 15.595 1.00 24.23 C ATOM 593 O GLY A 38 -8.449 -1.492 15.562 1.00 32.32 O ATOM 0 H GLY A 38 -6.340 -0.926 16.244 1.00 33.43 H new ATOM 0 HA2 GLY A 38 -7.876 1.456 16.531 1.00 53.01 H new ATOM 0 HA3 GLY A 38 -7.382 1.242 14.863 1.00 53.01 H new ATOM 597 N THR A 39 -9.891 0.236 15.464 1.00 14.13 N ATOM 598 CA THR A 39 -11.084 -0.569 15.264 1.00 22.23 C ATOM 599 C THR A 39 -11.001 -1.374 13.971 1.00 33.54 C ATOM 600 O THR A 39 -10.532 -0.879 12.950 1.00 73.21 O ATOM 601 CB THR A 39 -12.325 0.339 15.206 1.00 51.13 C ATOM 602 OG1 THR A 39 -12.200 1.385 16.174 1.00 11.02 O ATOM 603 CG2 THR A 39 -13.605 -0.441 15.466 1.00 33.43 C ATOM 0 H THR A 39 -10.073 1.239 15.494 1.00 14.13 H new ATOM 0 HA THR A 39 -11.161 -1.261 16.103 1.00 22.23 H new ATOM 0 HB THR A 39 -12.384 0.760 14.202 1.00 51.13 H new ATOM 0 HG1 THR A 39 -11.628 2.096 15.816 1.00 11.02 H new ATOM 0 HG21 THR A 39 -14.459 0.234 15.417 1.00 33.43 H new ATOM 0 HG22 THR A 39 -13.715 -1.221 14.713 1.00 33.43 H new ATOM 0 HG23 THR A 39 -13.559 -0.896 16.455 1.00 33.43 H new ATOM 611 N LEU A 40 -11.487 -2.603 14.016 1.00 33.33 N ATOM 612 CA LEU A 40 -11.492 -3.463 12.849 1.00 1.10 C ATOM 613 C LEU A 40 -12.924 -3.820 12.493 1.00 0.41 C ATOM 614 O LEU A 40 -13.666 -4.346 13.320 1.00 13.44 O ATOM 615 CB LEU A 40 -10.678 -4.741 13.083 1.00 25.23 C ATOM 616 CG LEU A 40 -9.165 -4.550 13.219 1.00 30.30 C ATOM 617 CD1 LEU A 40 -8.474 -5.892 13.334 1.00 52.04 C ATOM 618 CD2 LEU A 40 -8.605 -3.786 12.035 1.00 30.23 C ATOM 0 H LEU A 40 -11.885 -3.028 14.854 1.00 33.33 H new ATOM 0 HA LEU A 40 -11.026 -2.922 12.026 1.00 1.10 H new ATOM 0 HB2 LEU A 40 -11.047 -5.224 13.988 1.00 25.23 H new ATOM 0 HB3 LEU A 40 -10.866 -5.426 12.256 1.00 25.23 H new ATOM 0 HG LEU A 40 -8.980 -3.971 14.124 1.00 30.30 H new ATOM 0 HD11 LEU A 40 -7.399 -5.741 13.430 1.00 52.04 H new ATOM 0 HD12 LEU A 40 -8.846 -6.419 14.213 1.00 52.04 H new ATOM 0 HD13 LEU A 40 -8.679 -6.484 12.442 1.00 52.04 H new ATOM 0 HD21 LEU A 40 -7.529 -3.664 12.157 1.00 30.23 H new ATOM 0 HD22 LEU A 40 -8.806 -4.339 11.117 1.00 30.23 H new ATOM 0 HD23 LEU A 40 -9.077 -2.805 11.979 1.00 30.23 H new ATOM 630 N THR A 41 -13.310 -3.516 11.271 1.00 12.45 N ATOM 631 CA THR A 41 -14.650 -3.799 10.796 1.00 33.31 C ATOM 632 C THR A 41 -14.705 -5.182 10.165 1.00 74.12 C ATOM 633 O THR A 41 -15.759 -5.819 10.120 1.00 50.44 O ATOM 634 CB THR A 41 -15.099 -2.738 9.777 1.00 35.42 C ATOM 635 OG1 THR A 41 -14.057 -2.511 8.819 1.00 55.44 O ATOM 636 CG2 THR A 41 -15.435 -1.433 10.477 1.00 34.24 C ATOM 0 H THR A 41 -12.707 -3.068 10.581 1.00 12.45 H new ATOM 0 HA THR A 41 -15.328 -3.772 11.649 1.00 33.31 H new ATOM 0 HB THR A 41 -15.991 -3.105 9.268 1.00 35.42 H new ATOM 0 HG1 THR A 41 -13.586 -1.680 9.039 1.00 55.44 H new ATOM 0 HG21 THR A 41 -15.750 -0.695 9.739 1.00 34.24 H new ATOM 0 HG22 THR A 41 -16.242 -1.600 11.191 1.00 34.24 H new ATOM 0 HG23 THR A 41 -14.554 -1.066 11.004 1.00 34.24 H new ATOM 644 N ASP A 42 -13.553 -5.639 9.689 1.00 12.32 N ATOM 645 CA ASP A 42 -13.429 -6.960 9.095 1.00 33.34 C ATOM 646 C ASP A 42 -12.010 -7.473 9.269 1.00 54.35 C ATOM 647 O ASP A 42 -11.077 -6.687 9.381 1.00 33.22 O ATOM 648 CB ASP A 42 -13.765 -6.911 7.603 1.00 24.13 C ATOM 649 CG ASP A 42 -14.061 -8.281 7.025 1.00 11.32 C ATOM 650 OD1 ASP A 42 -15.149 -8.829 7.307 1.00 53.02 O ATOM 651 OD2 ASP A 42 -13.209 -8.815 6.285 1.00 65.21 O ATOM 0 H ASP A 42 -12.684 -5.106 9.705 1.00 12.32 H new ATOM 0 HA ASP A 42 -14.128 -7.629 9.597 1.00 33.34 H new ATOM 0 HB2 ASP A 42 -14.628 -6.262 7.450 1.00 24.13 H new ATOM 0 HB3 ASP A 42 -12.931 -6.465 7.061 1.00 24.13 H new ATOM 656 N CYS A 43 -11.855 -8.780 9.321 1.00 14.02 N ATOM 657 CA CYS A 43 -10.546 -9.402 9.361 1.00 55.33 C ATOM 658 C CYS A 43 -10.666 -10.849 8.929 1.00 41.01 C ATOM 659 O CYS A 43 -11.446 -11.612 9.505 1.00 24.14 O ATOM 660 CB CYS A 43 -9.942 -9.318 10.768 1.00 54.02 C ATOM 661 SG CYS A 43 -8.505 -10.387 11.021 1.00 71.41 S ATOM 0 H CYS A 43 -12.632 -9.441 9.337 1.00 14.02 H new ATOM 0 HA CYS A 43 -9.883 -8.870 8.679 1.00 55.33 H new ATOM 0 HB2 CYS A 43 -9.653 -8.286 10.966 1.00 54.02 H new ATOM 0 HB3 CYS A 43 -10.709 -9.580 11.497 1.00 54.02 H new ATOM 0 HG CYS A 43 -8.733 -11.191 12.017 1.00 71.41 H new ATOM 667 N VAL A 44 -9.909 -11.228 7.916 1.00 22.11 N ATOM 668 CA VAL A 44 -9.946 -12.587 7.428 1.00 54.14 C ATOM 669 C VAL A 44 -8.554 -13.037 7.001 1.00 25.51 C ATOM 670 O VAL A 44 -7.922 -12.437 6.129 1.00 42.13 O ATOM 671 CB VAL A 44 -10.976 -12.766 6.273 1.00 62.13 C ATOM 672 CG1 VAL A 44 -10.772 -11.740 5.171 1.00 70.15 C ATOM 673 CG2 VAL A 44 -10.916 -14.175 5.704 1.00 64.12 C ATOM 0 H VAL A 44 -9.264 -10.614 7.419 1.00 22.11 H new ATOM 0 HA VAL A 44 -10.279 -13.223 8.248 1.00 54.14 H new ATOM 0 HB VAL A 44 -11.967 -12.604 6.698 1.00 62.13 H new ATOM 0 HG11 VAL A 44 -11.510 -11.899 4.385 1.00 70.15 H new ATOM 0 HG12 VAL A 44 -10.889 -10.737 5.581 1.00 70.15 H new ATOM 0 HG13 VAL A 44 -9.770 -11.847 4.755 1.00 70.15 H new ATOM 0 HG21 VAL A 44 -11.645 -14.274 4.899 1.00 64.12 H new ATOM 0 HG22 VAL A 44 -9.917 -14.368 5.314 1.00 64.12 H new ATOM 0 HG23 VAL A 44 -11.144 -14.895 6.490 1.00 64.12 H new ATOM 683 N VAL A 45 -8.066 -14.069 7.659 1.00 3.05 N ATOM 684 CA VAL A 45 -6.825 -14.698 7.265 1.00 62.21 C ATOM 685 C VAL A 45 -7.147 -15.755 6.225 1.00 42.02 C ATOM 686 O VAL A 45 -8.099 -16.523 6.384 1.00 72.33 O ATOM 687 CB VAL A 45 -6.066 -15.320 8.471 1.00 15.24 C ATOM 688 CG1 VAL A 45 -6.939 -16.303 9.223 1.00 53.43 C ATOM 689 CG2 VAL A 45 -4.779 -16.000 8.024 1.00 52.13 C ATOM 0 H VAL A 45 -8.514 -14.490 8.473 1.00 3.05 H new ATOM 0 HA VAL A 45 -6.159 -13.941 6.850 1.00 62.21 H new ATOM 0 HB VAL A 45 -5.808 -14.502 9.144 1.00 15.24 H new ATOM 0 HG11 VAL A 45 -6.379 -16.720 10.060 1.00 53.43 H new ATOM 0 HG12 VAL A 45 -7.825 -15.790 9.598 1.00 53.43 H new ATOM 0 HG13 VAL A 45 -7.242 -17.107 8.553 1.00 53.43 H new ATOM 0 HG21 VAL A 45 -4.272 -16.425 8.890 1.00 52.13 H new ATOM 0 HG22 VAL A 45 -5.014 -16.794 7.316 1.00 52.13 H new ATOM 0 HG23 VAL A 45 -4.128 -15.268 7.545 1.00 52.13 H new ATOM 699 N MET A 46 -6.396 -15.774 5.142 1.00 24.03 N ATOM 700 CA MET A 46 -6.658 -16.725 4.089 1.00 51.33 C ATOM 701 C MET A 46 -6.132 -18.083 4.471 1.00 11.21 C ATOM 702 O MET A 46 -4.944 -18.364 4.368 1.00 40.01 O ATOM 703 CB MET A 46 -6.049 -16.302 2.769 1.00 13.14 C ATOM 704 CG MET A 46 -6.545 -14.964 2.245 1.00 25.13 C ATOM 705 SD MET A 46 -7.976 -15.092 1.145 1.00 43.21 S ATOM 706 CE MET A 46 -9.272 -15.574 2.281 1.00 2.41 C ATOM 0 H MET A 46 -5.609 -15.148 4.972 1.00 24.03 H new ATOM 0 HA MET A 46 -7.739 -16.767 3.960 1.00 51.33 H new ATOM 0 HB2 MET A 46 -4.966 -16.255 2.882 1.00 13.14 H new ATOM 0 HB3 MET A 46 -6.259 -17.070 2.024 1.00 13.14 H new ATOM 0 HG2 MET A 46 -6.805 -14.328 3.091 1.00 25.13 H new ATOM 0 HG3 MET A 46 -5.733 -14.470 1.712 1.00 25.13 H new ATOM 0 HE1 MET A 46 -10.237 -15.253 1.889 1.00 2.41 H new ATOM 0 HE2 MET A 46 -9.270 -16.658 2.397 1.00 2.41 H new ATOM 0 HE3 MET A 46 -9.099 -15.105 3.250 1.00 2.41 H new ATOM 716 N ARG A 47 -7.024 -18.882 4.978 1.00 51.03 N ATOM 717 CA ARG A 47 -6.723 -20.251 5.305 1.00 34.22 C ATOM 718 C ARG A 47 -7.166 -21.137 4.165 1.00 11.32 C ATOM 719 O ARG A 47 -7.964 -20.726 3.323 1.00 12.23 O ATOM 720 CB ARG A 47 -7.416 -20.656 6.611 1.00 51.45 C ATOM 721 CG ARG A 47 -6.902 -19.896 7.823 1.00 35.10 C ATOM 722 CD ARG A 47 -7.883 -19.945 8.984 1.00 14.40 C ATOM 723 NE ARG A 47 -7.954 -21.267 9.610 1.00 1.21 N ATOM 724 CZ ARG A 47 -8.906 -21.632 10.471 1.00 21.52 C ATOM 725 NH1 ARG A 47 -9.865 -20.777 10.806 1.00 1.34 N ATOM 726 NH2 ARG A 47 -8.901 -22.854 10.990 1.00 14.41 N ATOM 0 H ARG A 47 -7.985 -18.605 5.178 1.00 51.03 H new ATOM 0 HA ARG A 47 -5.649 -20.364 5.451 1.00 34.22 H new ATOM 0 HB2 ARG A 47 -8.488 -20.488 6.513 1.00 51.45 H new ATOM 0 HB3 ARG A 47 -7.275 -21.724 6.774 1.00 51.45 H new ATOM 0 HG2 ARG A 47 -5.947 -20.318 8.137 1.00 35.10 H new ATOM 0 HG3 ARG A 47 -6.717 -18.858 7.548 1.00 35.10 H new ATOM 0 HD2 ARG A 47 -7.590 -19.209 9.732 1.00 14.40 H new ATOM 0 HD3 ARG A 47 -8.874 -19.662 8.629 1.00 14.40 H new ATOM 0 HE ARG A 47 -7.233 -21.949 9.374 1.00 1.21 H new ATOM 0 HH11 ARG A 47 -9.875 -19.839 10.405 1.00 1.34 H new ATOM 0 HH12 ARG A 47 -10.592 -21.058 11.464 1.00 1.34 H new ATOM 0 HH21 ARG A 47 -8.169 -23.515 10.731 1.00 14.41 H new ATOM 0 HH22 ARG A 47 -9.629 -23.132 11.648 1.00 14.41 H new ATOM 740 N ASP A 48 -6.635 -22.336 4.127 1.00 35.34 N ATOM 741 CA ASP A 48 -7.013 -23.300 3.122 1.00 11.10 C ATOM 742 C ASP A 48 -8.428 -23.786 3.401 1.00 53.32 C ATOM 743 O ASP A 48 -8.716 -24.220 4.501 1.00 41.33 O ATOM 744 CB ASP A 48 -6.033 -24.470 3.146 1.00 12.23 C ATOM 745 CG ASP A 48 -6.217 -25.410 1.983 1.00 35.34 C ATOM 746 OD1 ASP A 48 -5.790 -25.064 0.862 1.00 34.14 O ATOM 747 OD2 ASP A 48 -6.769 -26.506 2.189 1.00 34.12 O ATOM 0 H ASP A 48 -5.933 -22.669 4.788 1.00 35.34 H new ATOM 0 HA ASP A 48 -6.985 -22.839 2.135 1.00 11.10 H new ATOM 0 HB2 ASP A 48 -5.014 -24.084 3.138 1.00 12.23 H new ATOM 0 HB3 ASP A 48 -6.157 -25.023 4.077 1.00 12.23 H new ATOM 752 N PRO A 49 -9.341 -23.695 2.431 1.00 73.10 N ATOM 753 CA PRO A 49 -10.733 -24.107 2.645 1.00 44.22 C ATOM 754 C PRO A 49 -10.882 -25.612 2.873 1.00 43.13 C ATOM 755 O PRO A 49 -11.886 -26.068 3.413 1.00 0.33 O ATOM 756 CB PRO A 49 -11.437 -23.683 1.355 1.00 14.44 C ATOM 757 CG PRO A 49 -10.362 -23.550 0.334 1.00 24.11 C ATOM 758 CD PRO A 49 -9.112 -23.166 1.075 1.00 70.04 C ATOM 0 HA PRO A 49 -11.151 -23.652 3.543 1.00 44.22 H new ATOM 0 HB2 PRO A 49 -12.176 -24.424 1.051 1.00 14.44 H new ATOM 0 HB3 PRO A 49 -11.967 -22.740 1.490 1.00 14.44 H new ATOM 0 HG2 PRO A 49 -10.221 -24.487 -0.205 1.00 24.11 H new ATOM 0 HG3 PRO A 49 -10.622 -22.793 -0.406 1.00 24.11 H new ATOM 0 HD2 PRO A 49 -8.224 -23.603 0.618 1.00 70.04 H new ATOM 0 HD3 PRO A 49 -8.967 -22.086 1.085 1.00 70.04 H new ATOM 766 N ASN A 50 -9.891 -26.380 2.439 1.00 0.41 N ATOM 767 CA ASN A 50 -9.913 -27.830 2.612 1.00 60.53 C ATOM 768 C ASN A 50 -9.338 -28.234 3.969 1.00 12.42 C ATOM 769 O ASN A 50 -10.001 -28.898 4.762 1.00 13.25 O ATOM 770 CB ASN A 50 -9.134 -28.532 1.492 1.00 41.40 C ATOM 771 CG ASN A 50 -9.852 -28.536 0.147 1.00 72.52 C ATOM 772 OD1 ASN A 50 -9.706 -29.473 -0.637 1.00 11.43 O ATOM 773 ND2 ASN A 50 -10.622 -27.497 -0.137 1.00 51.53 N ATOM 0 H ASN A 50 -9.061 -26.025 1.964 1.00 0.41 H new ATOM 0 HA ASN A 50 -10.956 -28.144 2.566 1.00 60.53 H new ATOM 0 HB2 ASN A 50 -8.167 -28.044 1.375 1.00 41.40 H new ATOM 0 HB3 ASN A 50 -8.937 -29.562 1.790 1.00 41.40 H new ATOM 0 HD21 ASN A 50 -11.116 -27.457 -1.028 1.00 51.53 H new ATOM 0 HD22 ASN A 50 -10.721 -26.737 0.536 1.00 51.53 H new ATOM 780 N THR A 51 -8.106 -27.798 4.233 1.00 74.13 N ATOM 781 CA THR A 51 -7.348 -28.248 5.402 1.00 42.13 C ATOM 782 C THR A 51 -7.507 -27.301 6.593 1.00 13.20 C ATOM 783 O THR A 51 -7.187 -27.660 7.723 1.00 2.21 O ATOM 784 CB THR A 51 -5.853 -28.371 5.052 1.00 24.20 C ATOM 785 OG1 THR A 51 -5.709 -28.725 3.668 1.00 1.44 O ATOM 786 CG2 THR A 51 -5.170 -29.424 5.911 1.00 53.31 C ATOM 0 H THR A 51 -7.608 -27.128 3.648 1.00 74.13 H new ATOM 0 HA THR A 51 -7.749 -29.221 5.686 1.00 42.13 H new ATOM 0 HB THR A 51 -5.381 -27.408 5.245 1.00 24.20 H new ATOM 0 HG1 THR A 51 -5.907 -27.945 3.109 1.00 1.44 H new ATOM 0 HG21 THR A 51 -4.116 -29.487 5.640 1.00 53.31 H new ATOM 0 HG22 THR A 51 -5.259 -29.150 6.962 1.00 53.31 H new ATOM 0 HG23 THR A 51 -5.645 -30.391 5.747 1.00 53.31 H new ATOM 794 N LYS A 52 -7.989 -26.093 6.312 1.00 3.14 N ATOM 795 CA LYS A 52 -8.273 -25.064 7.328 1.00 23.22 C ATOM 796 C LYS A 52 -7.000 -24.577 8.018 1.00 35.44 C ATOM 797 O LYS A 52 -7.029 -24.142 9.170 1.00 63.52 O ATOM 798 CB LYS A 52 -9.283 -25.567 8.369 1.00 72.15 C ATOM 799 CG LYS A 52 -10.539 -26.195 7.779 1.00 34.23 C ATOM 800 CD LYS A 52 -11.158 -25.341 6.683 1.00 73.10 C ATOM 801 CE LYS A 52 -12.600 -25.742 6.414 1.00 40.31 C ATOM 802 NZ LYS A 52 -13.457 -25.626 7.624 1.00 55.43 N ATOM 0 H LYS A 52 -8.199 -25.790 5.361 1.00 3.14 H new ATOM 0 HA LYS A 52 -8.714 -24.218 6.801 1.00 23.22 H new ATOM 0 HB2 LYS A 52 -8.792 -26.300 9.009 1.00 72.15 H new ATOM 0 HB3 LYS A 52 -9.575 -24.732 9.007 1.00 72.15 H new ATOM 0 HG2 LYS A 52 -10.295 -27.177 7.375 1.00 34.23 H new ATOM 0 HG3 LYS A 52 -11.271 -26.349 8.572 1.00 34.23 H new ATOM 0 HD2 LYS A 52 -11.119 -24.291 6.972 1.00 73.10 H new ATOM 0 HD3 LYS A 52 -10.574 -25.442 5.768 1.00 73.10 H new ATOM 0 HE2 LYS A 52 -13.007 -25.113 5.622 1.00 40.31 H new ATOM 0 HE3 LYS A 52 -12.627 -26.769 6.051 1.00 40.31 H new ATOM 0 HZ1 LYS A 52 -14.347 -25.149 7.375 1.00 55.43 H new ATOM 0 HZ2 LYS A 52 -13.665 -26.575 7.994 1.00 55.43 H new ATOM 0 HZ3 LYS A 52 -12.959 -25.073 8.350 1.00 55.43 H new ATOM 816 N ARG A 53 -5.884 -24.623 7.305 1.00 12.34 N ATOM 817 CA ARG A 53 -4.623 -24.130 7.844 1.00 3.32 C ATOM 818 C ARG A 53 -4.269 -22.824 7.158 1.00 54.31 C ATOM 819 O ARG A 53 -4.704 -22.586 6.036 1.00 30.24 O ATOM 820 CB ARG A 53 -3.498 -25.152 7.654 1.00 54.41 C ATOM 821 CG ARG A 53 -3.810 -26.548 8.186 1.00 0.23 C ATOM 822 CD ARG A 53 -4.391 -26.512 9.593 1.00 52.12 C ATOM 823 NE ARG A 53 -3.514 -25.834 10.550 1.00 61.51 N ATOM 824 CZ ARG A 53 -3.945 -25.005 11.503 1.00 1.31 C ATOM 825 NH1 ARG A 53 -5.244 -24.744 11.633 1.00 71.35 N ATOM 826 NH2 ARG A 53 -3.076 -24.438 12.325 1.00 45.51 N ATOM 0 H ARG A 53 -5.825 -24.994 6.357 1.00 12.34 H new ATOM 0 HA ARG A 53 -4.739 -23.966 8.915 1.00 3.32 H new ATOM 0 HB2 ARG A 53 -3.268 -25.226 6.591 1.00 54.41 H new ATOM 0 HB3 ARG A 53 -2.601 -24.781 8.149 1.00 54.41 H new ATOM 0 HG2 ARG A 53 -4.515 -27.041 7.516 1.00 0.23 H new ATOM 0 HG3 ARG A 53 -2.899 -27.147 8.186 1.00 0.23 H new ATOM 0 HD2 ARG A 53 -5.356 -26.007 9.570 1.00 52.12 H new ATOM 0 HD3 ARG A 53 -4.573 -27.532 9.933 1.00 52.12 H new ATOM 0 HE ARG A 53 -2.511 -26.006 10.484 1.00 61.51 H new ATOM 0 HH11 ARG A 53 -5.917 -25.179 11.002 1.00 71.35 H new ATOM 0 HH12 ARG A 53 -5.566 -24.109 12.364 1.00 71.35 H new ATOM 0 HH21 ARG A 53 -2.080 -24.635 12.229 1.00 45.51 H new ATOM 0 HH22 ARG A 53 -3.403 -23.804 13.054 1.00 45.51 H new ATOM 840 N SER A 54 -3.483 -21.984 7.813 1.00 40.32 N ATOM 841 CA SER A 54 -3.201 -20.650 7.298 1.00 14.50 C ATOM 842 C SER A 54 -2.294 -20.713 6.073 1.00 3.13 C ATOM 843 O SER A 54 -1.308 -21.451 6.053 1.00 72.52 O ATOM 844 CB SER A 54 -2.559 -19.796 8.393 1.00 12.21 C ATOM 845 OG SER A 54 -2.264 -18.486 7.936 1.00 75.23 O ATOM 0 H SER A 54 -3.029 -22.200 8.701 1.00 40.32 H new ATOM 0 HA SER A 54 -4.142 -20.193 6.993 1.00 14.50 H new ATOM 0 HB2 SER A 54 -3.230 -19.739 9.250 1.00 12.21 H new ATOM 0 HB3 SER A 54 -1.643 -20.276 8.737 1.00 12.21 H new ATOM 0 HG SER A 54 -1.334 -18.265 8.154 1.00 75.23 H new ATOM 851 N ARG A 55 -2.645 -19.935 5.054 1.00 24.35 N ATOM 852 CA ARG A 55 -1.854 -19.855 3.831 1.00 13.13 C ATOM 853 C ARG A 55 -0.766 -18.799 3.960 1.00 43.14 C ATOM 854 O ARG A 55 -0.049 -18.509 3.003 1.00 54.04 O ATOM 855 CB ARG A 55 -2.750 -19.547 2.628 1.00 53.40 C ATOM 856 CG ARG A 55 -3.640 -20.709 2.224 1.00 2.52 C ATOM 857 CD ARG A 55 -4.722 -20.282 1.244 1.00 33.50 C ATOM 858 NE ARG A 55 -5.226 -21.427 0.477 1.00 55.41 N ATOM 859 CZ ARG A 55 -5.938 -21.332 -0.647 1.00 11.02 C ATOM 860 NH1 ARG A 55 -6.244 -20.145 -1.155 1.00 35.03 N ATOM 861 NH2 ARG A 55 -6.349 -22.436 -1.264 1.00 73.12 N ATOM 0 H ARG A 55 -3.478 -19.347 5.052 1.00 24.35 H new ATOM 0 HA ARG A 55 -1.379 -20.823 3.672 1.00 13.13 H new ATOM 0 HB2 ARG A 55 -3.375 -18.685 2.861 1.00 53.40 H new ATOM 0 HB3 ARG A 55 -2.124 -19.267 1.781 1.00 53.40 H new ATOM 0 HG2 ARG A 55 -3.031 -21.493 1.773 1.00 2.52 H new ATOM 0 HG3 ARG A 55 -4.104 -21.137 3.113 1.00 2.52 H new ATOM 0 HD2 ARG A 55 -5.544 -19.815 1.787 1.00 33.50 H new ATOM 0 HD3 ARG A 55 -4.323 -19.532 0.562 1.00 33.50 H new ATOM 0 HE ARG A 55 -5.017 -22.362 0.828 1.00 55.41 H new ATOM 0 HH11 ARG A 55 -5.934 -19.294 -0.685 1.00 35.03 H new ATOM 0 HH12 ARG A 55 -6.789 -20.083 -2.015 1.00 35.03 H new ATOM 0 HH21 ARG A 55 -6.120 -23.352 -0.878 1.00 73.12 H new ATOM 0 HH22 ARG A 55 -6.894 -22.367 -2.124 1.00 73.12 H new ATOM 875 N GLY A 56 -0.645 -18.226 5.150 1.00 3.12 N ATOM 876 CA GLY A 56 0.418 -17.281 5.414 1.00 51.31 C ATOM 877 C GLY A 56 0.113 -15.864 4.971 1.00 43.01 C ATOM 878 O GLY A 56 1.025 -15.048 4.869 1.00 11.14 O ATOM 0 H GLY A 56 -1.267 -18.401 5.939 1.00 3.12 H new ATOM 0 HA2 GLY A 56 0.629 -17.278 6.483 1.00 51.31 H new ATOM 0 HA3 GLY A 56 1.324 -17.620 4.911 1.00 51.31 H new ATOM 882 N PHE A 57 -1.148 -15.554 4.696 1.00 12.23 N ATOM 883 CA PHE A 57 -1.528 -14.183 4.376 1.00 4.23 C ATOM 884 C PHE A 57 -3.006 -13.946 4.676 1.00 74.34 C ATOM 885 O PHE A 57 -3.790 -14.890 4.727 1.00 63.04 O ATOM 886 CB PHE A 57 -1.204 -13.848 2.910 1.00 13.04 C ATOM 887 CG PHE A 57 -2.071 -14.532 1.881 1.00 75.51 C ATOM 888 CD1 PHE A 57 -1.873 -15.864 1.550 1.00 55.52 C ATOM 889 CD2 PHE A 57 -3.068 -13.828 1.226 1.00 42.32 C ATOM 890 CE1 PHE A 57 -2.656 -16.476 0.590 1.00 33.21 C ATOM 891 CE2 PHE A 57 -3.847 -14.434 0.262 1.00 23.42 C ATOM 892 CZ PHE A 57 -3.641 -15.759 -0.055 1.00 12.31 C ATOM 0 H PHE A 57 -1.917 -16.224 4.688 1.00 12.23 H new ATOM 0 HA PHE A 57 -0.943 -13.515 5.008 1.00 4.23 H new ATOM 0 HB2 PHE A 57 -1.291 -12.770 2.774 1.00 13.04 H new ATOM 0 HB3 PHE A 57 -0.164 -14.111 2.716 1.00 13.04 H new ATOM 0 HD1 PHE A 57 -1.099 -16.429 2.048 1.00 55.52 H new ATOM 0 HD2 PHE A 57 -3.238 -12.791 1.473 1.00 42.32 H new ATOM 0 HE1 PHE A 57 -2.496 -17.516 0.345 1.00 33.21 H new ATOM 0 HE2 PHE A 57 -4.617 -13.871 -0.244 1.00 23.42 H new ATOM 0 HZ PHE A 57 -4.251 -16.236 -0.808 1.00 12.31 H new ATOM 902 N GLY A 58 -3.369 -12.685 4.898 1.00 14.33 N ATOM 903 CA GLY A 58 -4.742 -12.330 5.200 1.00 0.10 C ATOM 904 C GLY A 58 -5.004 -10.857 4.960 1.00 41.35 C ATOM 905 O GLY A 58 -4.215 -10.194 4.296 1.00 11.34 O ATOM 0 H GLY A 58 -2.725 -11.894 4.873 1.00 14.33 H new ATOM 0 HA2 GLY A 58 -5.416 -12.925 4.584 1.00 0.10 H new ATOM 0 HA3 GLY A 58 -4.961 -12.574 6.239 1.00 0.10 H new ATOM 909 N PHE A 59 -6.120 -10.349 5.481 1.00 33.14 N ATOM 910 CA PHE A 59 -6.465 -8.932 5.352 1.00 62.44 C ATOM 911 C PHE A 59 -7.186 -8.455 6.607 1.00 12.02 C ATOM 912 O PHE A 59 -7.950 -9.209 7.216 1.00 42.35 O ATOM 913 CB PHE A 59 -7.383 -8.651 4.143 1.00 11.43 C ATOM 914 CG PHE A 59 -7.215 -9.576 2.970 1.00 1.00 C ATOM 915 CD1 PHE A 59 -7.896 -10.775 2.935 1.00 74.11 C ATOM 916 CD2 PHE A 59 -6.388 -9.245 1.907 1.00 5.24 C ATOM 917 CE1 PHE A 59 -7.761 -11.638 1.874 1.00 34.40 C ATOM 918 CE2 PHE A 59 -6.246 -10.106 0.833 1.00 74.11 C ATOM 919 CZ PHE A 59 -6.933 -11.306 0.817 1.00 23.12 C ATOM 0 H PHE A 59 -6.804 -10.900 5.999 1.00 33.14 H new ATOM 0 HA PHE A 59 -5.526 -8.398 5.207 1.00 62.44 H new ATOM 0 HB2 PHE A 59 -8.419 -8.702 4.477 1.00 11.43 H new ATOM 0 HB3 PHE A 59 -7.207 -7.630 3.805 1.00 11.43 H new ATOM 0 HD1 PHE A 59 -8.546 -11.040 3.755 1.00 74.11 H new ATOM 0 HD2 PHE A 59 -5.851 -8.308 1.917 1.00 5.24 H new ATOM 0 HE1 PHE A 59 -8.300 -12.574 1.866 1.00 34.40 H new ATOM 0 HE2 PHE A 59 -5.600 -9.841 0.009 1.00 74.11 H new ATOM 0 HZ PHE A 59 -6.823 -11.982 -0.018 1.00 23.12 H new ATOM 929 N VAL A 60 -6.952 -7.206 6.977 1.00 34.43 N ATOM 930 CA VAL A 60 -7.647 -6.584 8.099 1.00 63.03 C ATOM 931 C VAL A 60 -8.254 -5.248 7.669 1.00 21.32 C ATOM 932 O VAL A 60 -7.550 -4.348 7.221 1.00 23.45 O ATOM 933 CB VAL A 60 -6.721 -6.363 9.329 1.00 34.14 C ATOM 934 CG1 VAL A 60 -6.415 -7.678 10.022 1.00 21.12 C ATOM 935 CG2 VAL A 60 -5.424 -5.669 8.936 1.00 3.21 C ATOM 0 H VAL A 60 -6.279 -6.596 6.513 1.00 34.43 H new ATOM 0 HA VAL A 60 -8.435 -7.273 8.402 1.00 63.03 H new ATOM 0 HB VAL A 60 -7.258 -5.716 10.023 1.00 34.14 H new ATOM 0 HG11 VAL A 60 -5.766 -7.496 10.878 1.00 21.12 H new ATOM 0 HG12 VAL A 60 -7.344 -8.135 10.362 1.00 21.12 H new ATOM 0 HG13 VAL A 60 -5.915 -8.349 9.324 1.00 21.12 H new ATOM 0 HG21 VAL A 60 -4.802 -5.531 9.821 1.00 3.21 H new ATOM 0 HG22 VAL A 60 -4.890 -6.281 8.209 1.00 3.21 H new ATOM 0 HG23 VAL A 60 -5.650 -4.697 8.497 1.00 3.21 H new ATOM 945 N THR A 61 -9.563 -5.133 7.776 1.00 31.03 N ATOM 946 CA THR A 61 -10.241 -3.891 7.445 1.00 32.45 C ATOM 947 C THR A 61 -10.460 -3.066 8.702 1.00 32.31 C ATOM 948 O THR A 61 -11.077 -3.534 9.656 1.00 22.13 O ATOM 949 CB THR A 61 -11.598 -4.140 6.754 1.00 5.32 C ATOM 950 OG1 THR A 61 -11.450 -5.123 5.725 1.00 72.15 O ATOM 951 CG2 THR A 61 -12.139 -2.854 6.138 1.00 54.25 C ATOM 0 H THR A 61 -10.180 -5.883 8.089 1.00 31.03 H new ATOM 0 HA THR A 61 -9.602 -3.348 6.748 1.00 32.45 H new ATOM 0 HB THR A 61 -12.300 -4.495 7.509 1.00 5.32 H new ATOM 0 HG1 THR A 61 -12.316 -5.277 5.292 1.00 72.15 H new ATOM 0 HG21 THR A 61 -13.096 -3.056 5.657 1.00 54.25 H new ATOM 0 HG22 THR A 61 -12.276 -2.106 6.919 1.00 54.25 H new ATOM 0 HG23 THR A 61 -11.432 -2.480 5.397 1.00 54.25 H new ATOM 959 N TYR A 62 -9.940 -1.851 8.704 1.00 2.13 N ATOM 960 CA TYR A 62 -10.118 -0.946 9.822 1.00 64.14 C ATOM 961 C TYR A 62 -11.421 -0.190 9.677 1.00 13.30 C ATOM 962 O TYR A 62 -12.083 -0.264 8.639 1.00 71.44 O ATOM 963 CB TYR A 62 -8.953 0.039 9.911 1.00 20.54 C ATOM 964 CG TYR A 62 -7.760 -0.495 10.668 1.00 72.02 C ATOM 965 CD1 TYR A 62 -6.755 -1.216 10.030 1.00 14.41 C ATOM 966 CD2 TYR A 62 -7.644 -0.281 12.032 1.00 2.21 C ATOM 967 CE1 TYR A 62 -5.674 -1.702 10.736 1.00 14.42 C ATOM 968 CE2 TYR A 62 -6.567 -0.765 12.742 1.00 52.43 C ATOM 969 CZ TYR A 62 -5.585 -1.473 12.089 1.00 22.54 C ATOM 970 OH TYR A 62 -4.511 -1.957 12.793 1.00 71.12 O ATOM 0 H TYR A 62 -9.387 -1.468 7.937 1.00 2.13 H new ATOM 0 HA TYR A 62 -10.145 -1.535 10.739 1.00 64.14 H new ATOM 0 HB2 TYR A 62 -8.640 0.310 8.902 1.00 20.54 H new ATOM 0 HB3 TYR A 62 -9.298 0.953 10.394 1.00 20.54 H new ATOM 0 HD1 TYR A 62 -6.822 -1.398 8.967 1.00 14.41 H new ATOM 0 HD2 TYR A 62 -8.412 0.276 12.548 1.00 2.21 H new ATOM 0 HE1 TYR A 62 -4.901 -2.260 10.228 1.00 14.42 H new ATOM 0 HE2 TYR A 62 -6.494 -0.589 13.805 1.00 52.43 H new ATOM 0 HH TYR A 62 -4.784 -2.151 13.714 1.00 71.12 H new ATOM 980 N ALA A 63 -11.801 0.518 10.722 1.00 42.01 N ATOM 981 CA ALA A 63 -12.973 1.364 10.664 1.00 33.03 C ATOM 982 C ALA A 63 -12.666 2.608 9.847 1.00 61.22 C ATOM 983 O ALA A 63 -13.355 2.906 8.884 1.00 74.12 O ATOM 984 CB ALA A 63 -13.443 1.733 12.062 1.00 21.34 C ATOM 0 H ALA A 63 -11.316 0.523 11.619 1.00 42.01 H new ATOM 0 HA ALA A 63 -13.781 0.816 10.179 1.00 33.03 H new ATOM 0 HB1 ALA A 63 -14.325 2.369 11.993 1.00 21.34 H new ATOM 0 HB2 ALA A 63 -13.692 0.826 12.613 1.00 21.34 H new ATOM 0 HB3 ALA A 63 -12.649 2.268 12.583 1.00 21.34 H new ATOM 990 N THR A 64 -11.594 3.294 10.206 1.00 2.43 N ATOM 991 CA THR A 64 -11.227 4.545 9.559 1.00 61.01 C ATOM 992 C THR A 64 -9.816 4.451 8.971 1.00 1.33 C ATOM 993 O THR A 64 -8.975 3.709 9.490 1.00 64.31 O ATOM 994 CB THR A 64 -11.298 5.700 10.580 1.00 5.32 C ATOM 995 OG1 THR A 64 -12.502 5.584 11.346 1.00 74.41 O ATOM 996 CG2 THR A 64 -11.268 7.057 9.897 1.00 14.44 C ATOM 0 H THR A 64 -10.957 3.004 10.948 1.00 2.43 H new ATOM 0 HA THR A 64 -11.928 4.739 8.747 1.00 61.01 H new ATOM 0 HB THR A 64 -10.425 5.628 11.229 1.00 5.32 H new ATOM 0 HG1 THR A 64 -12.385 4.899 12.037 1.00 74.41 H new ATOM 0 HG21 THR A 64 -11.320 7.844 10.649 1.00 14.44 H new ATOM 0 HG22 THR A 64 -10.343 7.158 9.329 1.00 14.44 H new ATOM 0 HG23 THR A 64 -12.120 7.144 9.222 1.00 14.44 H new ATOM 1004 N VAL A 65 -9.557 5.190 7.885 1.00 42.32 N ATOM 1005 CA VAL A 65 -8.240 5.173 7.249 1.00 71.23 C ATOM 1006 C VAL A 65 -7.159 5.726 8.191 1.00 44.43 C ATOM 1007 O VAL A 65 -6.019 5.265 8.174 1.00 52.12 O ATOM 1008 CB VAL A 65 -8.242 5.944 5.899 1.00 43.13 C ATOM 1009 CG1 VAL A 65 -8.590 7.410 6.087 1.00 11.31 C ATOM 1010 CG2 VAL A 65 -6.908 5.808 5.182 1.00 72.24 C ATOM 0 H VAL A 65 -10.238 5.801 7.434 1.00 42.32 H new ATOM 0 HA VAL A 65 -8.002 4.131 7.034 1.00 71.23 H new ATOM 0 HB VAL A 65 -9.016 5.491 5.279 1.00 43.13 H new ATOM 0 HG11 VAL A 65 -8.581 7.913 5.120 1.00 11.31 H new ATOM 0 HG12 VAL A 65 -9.582 7.494 6.530 1.00 11.31 H new ATOM 0 HG13 VAL A 65 -7.857 7.876 6.746 1.00 11.31 H new ATOM 0 HG21 VAL A 65 -6.942 6.358 4.242 1.00 72.24 H new ATOM 0 HG22 VAL A 65 -6.114 6.212 5.810 1.00 72.24 H new ATOM 0 HG23 VAL A 65 -6.710 4.756 4.979 1.00 72.24 H new ATOM 1020 N GLU A 66 -7.516 6.726 8.999 1.00 43.34 N ATOM 1021 CA GLU A 66 -6.631 7.244 10.045 1.00 2.42 C ATOM 1022 C GLU A 66 -6.092 6.142 10.966 1.00 74.21 C ATOM 1023 O GLU A 66 -4.913 6.150 11.322 1.00 54.40 O ATOM 1024 CB GLU A 66 -7.367 8.295 10.877 1.00 4.25 C ATOM 1025 CG GLU A 66 -8.045 9.371 10.041 1.00 61.54 C ATOM 1026 CD GLU A 66 -8.483 10.567 10.861 1.00 33.33 C ATOM 1027 OE1 GLU A 66 -9.474 10.457 11.613 1.00 43.44 O ATOM 1028 OE2 GLU A 66 -7.836 11.626 10.758 1.00 60.01 O ATOM 0 H GLU A 66 -8.419 7.197 8.948 1.00 43.34 H new ATOM 0 HA GLU A 66 -5.774 7.693 9.543 1.00 2.42 H new ATOM 0 HB2 GLU A 66 -8.117 7.799 11.492 1.00 4.25 H new ATOM 0 HB3 GLU A 66 -6.659 8.768 11.558 1.00 4.25 H new ATOM 0 HG2 GLU A 66 -7.360 9.703 9.261 1.00 61.54 H new ATOM 0 HG3 GLU A 66 -8.913 8.942 9.541 1.00 61.54 H new ATOM 1035 N GLU A 67 -6.949 5.194 11.337 1.00 61.12 N ATOM 1036 CA GLU A 67 -6.547 4.082 12.200 1.00 23.54 C ATOM 1037 C GLU A 67 -5.591 3.146 11.465 1.00 61.42 C ATOM 1038 O GLU A 67 -4.746 2.490 12.075 1.00 24.32 O ATOM 1039 CB GLU A 67 -7.779 3.313 12.667 1.00 62.40 C ATOM 1040 CG GLU A 67 -8.705 4.133 13.547 1.00 55.23 C ATOM 1041 CD GLU A 67 -9.999 3.416 13.859 1.00 41.03 C ATOM 1042 OE1 GLU A 67 -10.861 3.330 12.966 1.00 22.04 O ATOM 1043 OE2 GLU A 67 -10.168 2.950 15.004 1.00 62.22 O ATOM 0 H GLU A 67 -7.929 5.172 11.054 1.00 61.12 H new ATOM 0 HA GLU A 67 -6.029 4.488 13.069 1.00 23.54 H new ATOM 0 HB2 GLU A 67 -8.333 2.965 11.795 1.00 62.40 H new ATOM 0 HB3 GLU A 67 -7.459 2.427 13.216 1.00 62.40 H new ATOM 0 HG2 GLU A 67 -8.194 4.375 14.479 1.00 55.23 H new ATOM 0 HG3 GLU A 67 -8.928 5.078 13.052 1.00 55.23 H new ATOM 1050 N VAL A 68 -5.737 3.103 10.148 1.00 22.10 N ATOM 1051 CA VAL A 68 -4.846 2.336 9.287 1.00 32.23 C ATOM 1052 C VAL A 68 -3.429 2.902 9.320 1.00 72.21 C ATOM 1053 O VAL A 68 -2.460 2.155 9.427 1.00 21.21 O ATOM 1054 CB VAL A 68 -5.357 2.335 7.835 1.00 21.15 C ATOM 1055 CG1 VAL A 68 -4.281 1.892 6.864 1.00 13.51 C ATOM 1056 CG2 VAL A 68 -6.565 1.447 7.710 1.00 45.04 C ATOM 0 H VAL A 68 -6.475 3.598 9.647 1.00 22.10 H new ATOM 0 HA VAL A 68 -4.829 1.314 9.664 1.00 32.23 H new ATOM 0 HB VAL A 68 -5.634 3.358 7.580 1.00 21.15 H new ATOM 0 HG11 VAL A 68 -4.679 1.904 5.849 1.00 13.51 H new ATOM 0 HG12 VAL A 68 -3.431 2.571 6.928 1.00 13.51 H new ATOM 0 HG13 VAL A 68 -3.958 0.882 7.115 1.00 13.51 H new ATOM 0 HG21 VAL A 68 -6.917 1.455 6.678 1.00 45.04 H new ATOM 0 HG22 VAL A 68 -6.299 0.429 7.995 1.00 45.04 H new ATOM 0 HG23 VAL A 68 -7.355 1.813 8.366 1.00 45.04 H new ATOM 1066 N ASP A 69 -3.327 4.221 9.219 1.00 41.24 N ATOM 1067 CA ASP A 69 -2.034 4.902 9.228 1.00 51.04 C ATOM 1068 C ASP A 69 -1.259 4.583 10.504 1.00 32.15 C ATOM 1069 O ASP A 69 -0.062 4.302 10.457 1.00 41.12 O ATOM 1070 CB ASP A 69 -2.228 6.410 9.096 1.00 11.34 C ATOM 1071 CG ASP A 69 -0.934 7.134 8.796 1.00 30.33 C ATOM 1072 OD1 ASP A 69 -0.582 7.263 7.605 1.00 62.53 O ATOM 1073 OD2 ASP A 69 -0.267 7.583 9.748 1.00 2.14 O ATOM 0 H ASP A 69 -4.128 4.846 9.129 1.00 41.24 H new ATOM 0 HA ASP A 69 -1.456 4.543 8.376 1.00 51.04 H new ATOM 0 HB2 ASP A 69 -2.947 6.613 8.302 1.00 11.34 H new ATOM 0 HB3 ASP A 69 -2.654 6.801 10.020 1.00 11.34 H new ATOM 1078 N ALA A 70 -1.956 4.639 11.639 1.00 22.33 N ATOM 1079 CA ALA A 70 -1.406 4.199 12.925 1.00 71.23 C ATOM 1080 C ALA A 70 -0.806 2.790 12.844 1.00 31.41 C ATOM 1081 O ALA A 70 0.276 2.543 13.367 1.00 74.01 O ATOM 1082 CB ALA A 70 -2.478 4.253 14.002 1.00 30.10 C ATOM 0 H ALA A 70 -2.913 4.988 11.695 1.00 22.33 H new ATOM 0 HA ALA A 70 -0.598 4.883 13.185 1.00 71.23 H new ATOM 0 HB1 ALA A 70 -2.056 3.924 14.952 1.00 30.10 H new ATOM 0 HB2 ALA A 70 -2.842 5.275 14.102 1.00 30.10 H new ATOM 0 HB3 ALA A 70 -3.305 3.599 13.726 1.00 30.10 H new ATOM 1088 N ALA A 71 -1.485 1.888 12.147 1.00 71.04 N ATOM 1089 CA ALA A 71 -1.007 0.517 12.004 1.00 0.00 C ATOM 1090 C ALA A 71 0.199 0.453 11.068 1.00 61.02 C ATOM 1091 O ALA A 71 1.139 -0.302 11.300 1.00 23.24 O ATOM 1092 CB ALA A 71 -2.114 -0.384 11.490 1.00 51.32 C ATOM 0 H ALA A 71 -2.367 2.080 11.672 1.00 71.04 H new ATOM 0 HA ALA A 71 -0.698 0.166 12.989 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -1.738 -1.402 11.390 1.00 51.32 H new ATOM 0 HB2 ALA A 71 -2.948 -0.373 12.192 1.00 51.32 H new ATOM 0 HB3 ALA A 71 -2.453 -0.026 10.518 1.00 51.32 H new ATOM 1098 N MET A 72 0.174 1.263 10.019 1.00 4.44 N ATOM 1099 CA MET A 72 1.258 1.291 9.039 1.00 0.23 C ATOM 1100 C MET A 72 2.534 1.871 9.648 1.00 40.51 C ATOM 1101 O MET A 72 3.637 1.457 9.304 1.00 33.01 O ATOM 1102 CB MET A 72 0.848 2.102 7.804 1.00 60.41 C ATOM 1103 CG MET A 72 -0.354 1.533 7.058 1.00 74.44 C ATOM 1104 SD MET A 72 0.093 0.466 5.665 1.00 72.24 S ATOM 1105 CE MET A 72 0.817 -0.942 6.495 1.00 61.04 C ATOM 0 H MET A 72 -0.587 1.913 9.822 1.00 4.44 H new ATOM 0 HA MET A 72 1.459 0.264 8.735 1.00 0.23 H new ATOM 0 HB2 MET A 72 0.622 3.123 8.111 1.00 60.41 H new ATOM 0 HB3 MET A 72 1.695 2.156 7.120 1.00 60.41 H new ATOM 0 HG2 MET A 72 -0.969 0.965 7.757 1.00 74.44 H new ATOM 0 HG3 MET A 72 -0.966 2.357 6.691 1.00 74.44 H new ATOM 0 HE1 MET A 72 0.666 -1.837 5.892 1.00 61.04 H new ATOM 0 HE2 MET A 72 1.885 -0.773 6.633 1.00 61.04 H new ATOM 0 HE3 MET A 72 0.342 -1.075 7.467 1.00 61.04 H new ATOM 1115 N ASN A 73 2.365 2.812 10.568 1.00 44.12 N ATOM 1116 CA ASN A 73 3.496 3.443 11.247 1.00 34.35 C ATOM 1117 C ASN A 73 3.933 2.615 12.468 1.00 13.54 C ATOM 1118 O ASN A 73 4.995 2.848 13.042 1.00 62.34 O ATOM 1119 CB ASN A 73 3.125 4.892 11.628 1.00 12.23 C ATOM 1120 CG ASN A 73 3.048 5.153 13.125 1.00 54.21 C ATOM 1121 OD1 ASN A 73 4.008 5.620 13.738 1.00 64.23 O ATOM 1122 ND2 ASN A 73 1.911 4.846 13.721 1.00 54.24 N ATOM 0 H ASN A 73 1.452 3.158 10.864 1.00 44.12 H new ATOM 0 HA ASN A 73 4.351 3.479 10.572 1.00 34.35 H new ATOM 0 HB2 ASN A 73 3.860 5.568 11.192 1.00 12.23 H new ATOM 0 HB3 ASN A 73 2.162 5.136 11.180 1.00 12.23 H new ATOM 0 HD21 ASN A 73 1.805 4.994 14.725 1.00 54.24 H new ATOM 0 HD22 ASN A 73 1.138 4.461 13.178 1.00 54.24 H new ATOM 1129 N ALA A 74 3.121 1.622 12.826 1.00 12.33 N ATOM 1130 CA ALA A 74 3.425 0.750 13.959 1.00 44.10 C ATOM 1131 C ALA A 74 4.181 -0.483 13.487 1.00 0.52 C ATOM 1132 O ALA A 74 4.647 -1.290 14.287 1.00 33.22 O ATOM 1133 CB ALA A 74 2.152 0.344 14.680 1.00 71.15 C ATOM 0 H ALA A 74 2.247 1.401 12.348 1.00 12.33 H new ATOM 0 HA ALA A 74 4.054 1.301 14.658 1.00 44.10 H new ATOM 0 HB1 ALA A 74 2.401 -0.305 15.520 1.00 71.15 H new ATOM 0 HB2 ALA A 74 1.642 1.235 15.048 1.00 71.15 H new ATOM 0 HB3 ALA A 74 1.498 -0.190 13.991 1.00 71.15 H new ATOM 1139 N ARG A 75 4.244 -0.627 12.171 1.00 21.33 N ATOM 1140 CA ARG A 75 5.017 -1.667 11.505 1.00 50.43 C ATOM 1141 C ARG A 75 6.478 -1.664 11.975 1.00 61.12 C ATOM 1142 O ARG A 75 7.055 -0.597 12.189 1.00 33.42 O ATOM 1143 CB ARG A 75 4.937 -1.405 10.006 1.00 1.12 C ATOM 1144 CG ARG A 75 5.252 -2.601 9.138 1.00 34.02 C ATOM 1145 CD ARG A 75 5.209 -2.230 7.669 1.00 14.51 C ATOM 1146 NE ARG A 75 6.144 -1.140 7.383 1.00 35.32 N ATOM 1147 CZ ARG A 75 5.817 0.028 6.822 1.00 13.24 C ATOM 1148 NH1 ARG A 75 4.567 0.282 6.454 1.00 41.51 N ATOM 1149 NH2 ARG A 75 6.745 0.962 6.673 1.00 11.35 N ATOM 0 H ARG A 75 3.750 -0.013 11.523 1.00 21.33 H new ATOM 0 HA ARG A 75 4.609 -2.648 11.749 1.00 50.43 H new ATOM 0 HB2 ARG A 75 3.934 -1.053 9.766 1.00 1.12 H new ATOM 0 HB3 ARG A 75 5.626 -0.599 9.755 1.00 1.12 H new ATOM 0 HG2 ARG A 75 6.239 -2.989 9.390 1.00 34.02 H new ATOM 0 HG3 ARG A 75 4.536 -3.398 9.337 1.00 34.02 H new ATOM 0 HD2 ARG A 75 5.460 -3.100 7.062 1.00 14.51 H new ATOM 0 HD3 ARG A 75 4.198 -1.930 7.394 1.00 14.51 H new ATOM 0 HE ARG A 75 7.123 -1.284 7.632 1.00 35.32 H new ATOM 0 HH11 ARG A 75 3.840 -0.419 6.598 1.00 41.51 H new ATOM 0 HH12 ARG A 75 4.333 1.178 6.027 1.00 41.51 H new ATOM 0 HH21 ARG A 75 7.700 0.787 6.985 1.00 11.35 H new ATOM 0 HH22 ARG A 75 6.504 1.856 6.246 1.00 11.35 H new ATOM 1163 N PRO A 76 7.118 -2.848 12.129 1.00 14.04 N ATOM 1164 CA PRO A 76 6.538 -4.158 11.809 1.00 65.43 C ATOM 1165 C PRO A 76 5.578 -4.669 12.872 1.00 23.32 C ATOM 1166 O PRO A 76 5.486 -4.120 13.968 1.00 32.32 O ATOM 1167 CB PRO A 76 7.759 -5.089 11.714 1.00 33.23 C ATOM 1168 CG PRO A 76 8.961 -4.226 11.917 1.00 44.21 C ATOM 1169 CD PRO A 76 8.481 -3.002 12.637 1.00 45.41 C ATOM 0 HA PRO A 76 5.943 -4.106 10.897 1.00 65.43 H new ATOM 0 HB2 PRO A 76 7.710 -5.872 12.470 1.00 33.23 H new ATOM 0 HB3 PRO A 76 7.796 -5.585 10.744 1.00 33.23 H new ATOM 0 HG2 PRO A 76 9.721 -4.747 12.500 1.00 44.21 H new ATOM 0 HG3 PRO A 76 9.417 -3.962 10.962 1.00 44.21 H new ATOM 0 HD2 PRO A 76 8.498 -3.135 13.719 1.00 45.41 H new ATOM 0 HD3 PRO A 76 9.098 -2.132 12.413 1.00 45.41 H new ATOM 1177 N HIS A 77 4.862 -5.722 12.522 1.00 60.45 N ATOM 1178 CA HIS A 77 3.899 -6.332 13.420 1.00 74.43 C ATOM 1179 C HIS A 77 4.206 -7.806 13.583 1.00 52.53 C ATOM 1180 O HIS A 77 4.828 -8.413 12.713 1.00 30.23 O ATOM 1181 CB HIS A 77 2.476 -6.159 12.890 1.00 11.53 C ATOM 1182 CG HIS A 77 1.965 -4.760 12.966 1.00 44.13 C ATOM 1183 ND1 HIS A 77 1.147 -4.353 13.987 1.00 61.25 N ATOM 1184 CD2 HIS A 77 2.173 -3.726 12.123 1.00 61.54 C ATOM 1185 CE1 HIS A 77 0.875 -3.085 13.745 1.00 61.03 C ATOM 1186 NE2 HIS A 77 1.477 -2.665 12.628 1.00 42.35 N ATOM 0 H HIS A 77 4.931 -6.177 11.612 1.00 60.45 H new ATOM 0 HA HIS A 77 3.972 -5.836 14.388 1.00 74.43 H new ATOM 0 HB2 HIS A 77 2.443 -6.491 11.852 1.00 11.53 H new ATOM 0 HB3 HIS A 77 1.808 -6.810 13.454 1.00 11.53 H new ATOM 0 HD2 HIS A 77 2.773 -3.736 11.225 1.00 61.54 H new ATOM 0 HE1 HIS A 77 0.247 -2.466 14.369 1.00 61.03 H new ATOM 0 HE2 HIS A 77 1.426 -1.728 12.228 1.00 42.35 H new ATOM 1194 N LYS A 78 3.788 -8.375 14.694 1.00 75.31 N ATOM 1195 CA LYS A 78 4.018 -9.782 14.948 1.00 4.12 C ATOM 1196 C LYS A 78 2.747 -10.470 15.435 1.00 23.13 C ATOM 1197 O LYS A 78 2.318 -10.271 16.569 1.00 22.12 O ATOM 1198 CB LYS A 78 5.148 -9.964 15.961 1.00 52.32 C ATOM 1199 CG LYS A 78 5.344 -11.403 16.393 1.00 11.35 C ATOM 1200 CD LYS A 78 6.768 -11.673 16.822 1.00 64.23 C ATOM 1201 CE LYS A 78 7.688 -11.847 15.628 1.00 24.12 C ATOM 1202 NZ LYS A 78 9.104 -12.004 16.049 1.00 15.01 N ATOM 0 H LYS A 78 3.287 -7.885 15.436 1.00 75.31 H new ATOM 0 HA LYS A 78 4.313 -10.250 14.008 1.00 4.12 H new ATOM 0 HB2 LYS A 78 6.077 -9.593 15.528 1.00 52.32 H new ATOM 0 HB3 LYS A 78 4.940 -9.354 16.840 1.00 52.32 H new ATOM 0 HG2 LYS A 78 4.667 -11.630 17.217 1.00 11.35 H new ATOM 0 HG3 LYS A 78 5.080 -12.068 15.571 1.00 11.35 H new ATOM 0 HD2 LYS A 78 7.125 -10.849 17.440 1.00 64.23 H new ATOM 0 HD3 LYS A 78 6.799 -12.571 17.439 1.00 64.23 H new ATOM 0 HE2 LYS A 78 7.379 -12.721 15.054 1.00 24.12 H new ATOM 0 HE3 LYS A 78 7.597 -10.984 14.969 1.00 24.12 H new ATOM 0 HZ1 LYS A 78 9.705 -12.121 15.208 1.00 15.01 H new ATOM 0 HZ2 LYS A 78 9.405 -11.159 16.576 1.00 15.01 H new ATOM 0 HZ3 LYS A 78 9.194 -12.842 16.658 1.00 15.01 H new ATOM 1216 N VAL A 79 2.151 -11.274 14.566 1.00 51.30 N ATOM 1217 CA VAL A 79 0.951 -12.023 14.908 1.00 33.13 C ATOM 1218 C VAL A 79 1.274 -13.507 15.011 1.00 21.01 C ATOM 1219 O VAL A 79 1.878 -14.065 14.094 1.00 51.23 O ATOM 1220 CB VAL A 79 -0.169 -11.831 13.858 1.00 13.33 C ATOM 1221 CG1 VAL A 79 -1.490 -12.381 14.373 1.00 33.12 C ATOM 1222 CG2 VAL A 79 -0.314 -10.365 13.475 1.00 61.40 C ATOM 0 H VAL A 79 2.482 -11.425 13.613 1.00 51.30 H new ATOM 0 HA VAL A 79 0.597 -11.642 15.866 1.00 33.13 H new ATOM 0 HB VAL A 79 0.111 -12.388 12.964 1.00 13.33 H new ATOM 0 HG11 VAL A 79 -2.263 -12.236 13.619 1.00 33.12 H new ATOM 0 HG12 VAL A 79 -1.384 -13.445 14.583 1.00 33.12 H new ATOM 0 HG13 VAL A 79 -1.771 -11.857 15.287 1.00 33.12 H new ATOM 0 HG21 VAL A 79 -1.108 -10.259 12.736 1.00 61.40 H new ATOM 0 HG22 VAL A 79 -0.562 -9.780 14.361 1.00 61.40 H new ATOM 0 HG23 VAL A 79 0.624 -10.004 13.054 1.00 61.40 H new ATOM 1232 N ASP A 80 0.903 -14.120 16.143 1.00 51.33 N ATOM 1233 CA ASP A 80 1.075 -15.563 16.369 1.00 15.31 C ATOM 1234 C ASP A 80 2.566 -15.921 16.459 1.00 72.32 C ATOM 1235 O ASP A 80 2.987 -17.028 16.128 1.00 63.23 O ATOM 1236 CB ASP A 80 0.372 -16.372 15.261 1.00 4.51 C ATOM 1237 CG ASP A 80 0.167 -17.832 15.626 1.00 52.52 C ATOM 1238 OD1 ASP A 80 -0.624 -18.113 16.549 1.00 52.40 O ATOM 1239 OD2 ASP A 80 0.791 -18.703 14.986 1.00 30.22 O ATOM 0 H ASP A 80 0.475 -13.630 16.929 1.00 51.33 H new ATOM 0 HA ASP A 80 0.610 -15.824 17.320 1.00 15.31 H new ATOM 0 HB2 ASP A 80 -0.596 -15.918 15.047 1.00 4.51 H new ATOM 0 HB3 ASP A 80 0.962 -16.312 14.346 1.00 4.51 H new ATOM 1244 N GLY A 81 3.360 -14.965 16.937 1.00 31.25 N ATOM 1245 CA GLY A 81 4.794 -15.166 17.040 1.00 3.34 C ATOM 1246 C GLY A 81 5.465 -15.157 15.682 1.00 64.04 C ATOM 1247 O GLY A 81 6.491 -15.802 15.480 1.00 30.32 O ATOM 0 H GLY A 81 3.033 -14.053 17.255 1.00 31.25 H new ATOM 0 HA2 GLY A 81 5.226 -14.384 17.664 1.00 3.34 H new ATOM 0 HA3 GLY A 81 4.993 -16.116 17.537 1.00 3.34 H new ATOM 1251 N ARG A 82 4.875 -14.423 14.754 1.00 51.22 N ATOM 1252 CA ARG A 82 5.370 -14.355 13.391 1.00 72.13 C ATOM 1253 C ARG A 82 5.480 -12.903 12.945 1.00 31.54 C ATOM 1254 O ARG A 82 4.601 -12.104 13.237 1.00 10.31 O ATOM 1255 CB ARG A 82 4.414 -15.109 12.469 1.00 30.40 C ATOM 1256 CG ARG A 82 4.791 -15.020 11.008 1.00 63.42 C ATOM 1257 CD ARG A 82 5.740 -16.130 10.618 1.00 44.43 C ATOM 1258 NE ARG A 82 6.127 -16.052 9.214 1.00 21.20 N ATOM 1259 CZ ARG A 82 6.702 -17.050 8.546 1.00 3.44 C ATOM 1260 NH1 ARG A 82 6.952 -18.202 9.159 1.00 52.04 N ATOM 1261 NH2 ARG A 82 7.038 -16.892 7.272 1.00 12.31 N ATOM 0 H ARG A 82 4.042 -13.859 14.924 1.00 51.22 H new ATOM 0 HA ARG A 82 6.359 -14.811 13.344 1.00 72.13 H new ATOM 0 HB2 ARG A 82 4.386 -16.157 12.766 1.00 30.40 H new ATOM 0 HB3 ARG A 82 3.407 -14.714 12.601 1.00 30.40 H new ATOM 0 HG2 ARG A 82 3.892 -15.075 10.394 1.00 63.42 H new ATOM 0 HG3 ARG A 82 5.255 -14.054 10.808 1.00 63.42 H new ATOM 0 HD2 ARG A 82 6.632 -16.080 11.243 1.00 44.43 H new ATOM 0 HD3 ARG A 82 5.269 -17.094 10.811 1.00 44.43 H new ATOM 0 HE ARG A 82 5.946 -15.181 8.714 1.00 21.20 H new ATOM 0 HH11 ARG A 82 6.703 -18.322 10.141 1.00 52.04 H new ATOM 0 HH12 ARG A 82 7.392 -18.967 8.648 1.00 52.04 H new ATOM 0 HH21 ARG A 82 6.856 -16.005 6.803 1.00 12.31 H new ATOM 0 HH22 ARG A 82 7.478 -17.658 6.762 1.00 12.31 H new ATOM 1275 N VAL A 83 6.550 -12.572 12.235 1.00 14.24 N ATOM 1276 CA VAL A 83 6.735 -11.214 11.739 1.00 44.51 C ATOM 1277 C VAL A 83 5.883 -11.019 10.491 1.00 1.34 C ATOM 1278 O VAL A 83 6.133 -11.647 9.463 1.00 14.53 O ATOM 1279 CB VAL A 83 8.203 -10.908 11.373 1.00 2.53 C ATOM 1280 CG1 VAL A 83 8.372 -9.433 11.034 1.00 71.15 C ATOM 1281 CG2 VAL A 83 9.148 -11.311 12.491 1.00 51.23 C ATOM 0 H VAL A 83 7.299 -13.220 11.990 1.00 14.24 H new ATOM 0 HA VAL A 83 6.439 -10.537 12.540 1.00 44.51 H new ATOM 0 HB VAL A 83 8.458 -11.499 10.494 1.00 2.53 H new ATOM 0 HG11 VAL A 83 9.413 -9.235 10.778 1.00 71.15 H new ATOM 0 HG12 VAL A 83 7.736 -9.179 10.186 1.00 71.15 H new ATOM 0 HG13 VAL A 83 8.088 -8.827 11.895 1.00 71.15 H new ATOM 0 HG21 VAL A 83 10.173 -11.082 12.201 1.00 51.23 H new ATOM 0 HG22 VAL A 83 8.896 -10.760 13.397 1.00 51.23 H new ATOM 0 HG23 VAL A 83 9.054 -12.381 12.679 1.00 51.23 H new ATOM 1291 N VAL A 84 4.877 -10.170 10.583 1.00 14.31 N ATOM 1292 CA VAL A 84 3.956 -9.977 9.477 1.00 43.35 C ATOM 1293 C VAL A 84 4.238 -8.671 8.748 1.00 65.41 C ATOM 1294 O VAL A 84 4.725 -7.695 9.336 1.00 13.33 O ATOM 1295 CB VAL A 84 2.481 -10.018 9.940 1.00 41.00 C ATOM 1296 CG1 VAL A 84 2.264 -11.182 10.886 1.00 52.52 C ATOM 1297 CG2 VAL A 84 2.057 -8.710 10.592 1.00 43.23 C ATOM 0 H VAL A 84 4.676 -9.605 11.408 1.00 14.31 H new ATOM 0 HA VAL A 84 4.115 -10.805 8.787 1.00 43.35 H new ATOM 0 HB VAL A 84 1.857 -10.156 9.057 1.00 41.00 H new ATOM 0 HG11 VAL A 84 1.222 -11.202 11.206 1.00 52.52 H new ATOM 0 HG12 VAL A 84 2.505 -12.115 10.376 1.00 52.52 H new ATOM 0 HG13 VAL A 84 2.909 -11.068 11.757 1.00 52.52 H new ATOM 0 HG21 VAL A 84 1.015 -8.780 10.903 1.00 43.23 H new ATOM 0 HG22 VAL A 84 2.684 -8.518 11.463 1.00 43.23 H new ATOM 0 HG23 VAL A 84 2.169 -7.894 9.878 1.00 43.23 H new ATOM 1307 N GLU A 85 3.951 -8.677 7.465 1.00 10.33 N ATOM 1308 CA GLU A 85 4.175 -7.524 6.621 1.00 54.13 C ATOM 1309 C GLU A 85 2.849 -6.944 6.139 1.00 61.32 C ATOM 1310 O GLU A 85 2.264 -7.432 5.170 1.00 43.35 O ATOM 1311 CB GLU A 85 5.048 -7.922 5.432 1.00 21.30 C ATOM 1312 CG GLU A 85 6.026 -6.845 5.010 1.00 5.33 C ATOM 1313 CD GLU A 85 7.029 -7.331 3.987 1.00 74.05 C ATOM 1314 OE1 GLU A 85 8.003 -8.001 4.375 1.00 51.41 O ATOM 1315 OE2 GLU A 85 6.854 -7.039 2.788 1.00 72.22 O ATOM 0 H GLU A 85 3.556 -9.481 6.977 1.00 10.33 H new ATOM 0 HA GLU A 85 4.688 -6.756 7.200 1.00 54.13 H new ATOM 0 HB2 GLU A 85 5.603 -8.825 5.686 1.00 21.30 H new ATOM 0 HB3 GLU A 85 4.406 -8.169 4.587 1.00 21.30 H new ATOM 0 HG2 GLU A 85 5.474 -6.001 4.598 1.00 5.33 H new ATOM 0 HG3 GLU A 85 6.558 -6.480 5.888 1.00 5.33 H new ATOM 1322 N PRO A 86 2.344 -5.907 6.828 1.00 61.25 N ATOM 1323 CA PRO A 86 1.106 -5.244 6.441 1.00 54.22 C ATOM 1324 C PRO A 86 1.302 -4.309 5.247 1.00 33.34 C ATOM 1325 O PRO A 86 2.294 -3.584 5.154 1.00 64.41 O ATOM 1326 CB PRO A 86 0.711 -4.463 7.692 1.00 24.03 C ATOM 1327 CG PRO A 86 1.982 -4.214 8.427 1.00 24.42 C ATOM 1328 CD PRO A 86 2.937 -5.313 8.041 1.00 63.14 C ATOM 0 HA PRO A 86 0.343 -5.952 6.118 1.00 54.22 H new ATOM 0 HB2 PRO A 86 0.220 -3.526 7.430 1.00 24.03 H new ATOM 0 HB3 PRO A 86 0.010 -5.031 8.303 1.00 24.03 H new ATOM 0 HG2 PRO A 86 2.392 -3.238 8.168 1.00 24.42 H new ATOM 0 HG3 PRO A 86 1.811 -4.212 9.503 1.00 24.42 H new ATOM 0 HD2 PRO A 86 3.935 -4.921 7.844 1.00 63.14 H new ATOM 0 HD3 PRO A 86 3.036 -6.051 8.837 1.00 63.14 H new ATOM 1336 N LYS A 87 0.339 -4.354 4.345 1.00 12.13 N ATOM 1337 CA LYS A 87 0.325 -3.549 3.132 1.00 1.21 C ATOM 1338 C LYS A 87 -1.054 -2.944 3.016 1.00 54.03 C ATOM 1339 O LYS A 87 -1.942 -3.343 3.748 1.00 51.43 O ATOM 1340 CB LYS A 87 0.606 -4.411 1.888 1.00 44.45 C ATOM 1341 CG LYS A 87 1.826 -5.309 2.004 1.00 22.20 C ATOM 1342 CD LYS A 87 3.106 -4.596 1.637 1.00 15.34 C ATOM 1343 CE LYS A 87 4.289 -5.518 1.828 1.00 62.14 C ATOM 1344 NZ LYS A 87 5.578 -4.800 1.733 1.00 52.02 N ATOM 0 H LYS A 87 -0.474 -4.964 4.435 1.00 12.13 H new ATOM 0 HA LYS A 87 1.099 -2.784 3.188 1.00 1.21 H new ATOM 0 HB2 LYS A 87 -0.268 -5.031 1.687 1.00 44.45 H new ATOM 0 HB3 LYS A 87 0.735 -3.754 1.028 1.00 44.45 H new ATOM 0 HG2 LYS A 87 1.902 -5.683 3.025 1.00 22.20 H new ATOM 0 HG3 LYS A 87 1.698 -6.176 1.356 1.00 22.20 H new ATOM 0 HD2 LYS A 87 3.060 -4.261 0.601 1.00 15.34 H new ATOM 0 HD3 LYS A 87 3.225 -3.706 2.255 1.00 15.34 H new ATOM 0 HE2 LYS A 87 4.216 -6.003 2.802 1.00 62.14 H new ATOM 0 HE3 LYS A 87 4.258 -6.307 1.076 1.00 62.14 H new ATOM 0 HZ1 LYS A 87 6.067 -5.078 0.858 1.00 52.02 H new ATOM 0 HZ2 LYS A 87 5.404 -3.775 1.721 1.00 52.02 H new ATOM 0 HZ3 LYS A 87 6.171 -5.041 2.553 1.00 52.02 H new ATOM 1358 N ARG A 88 -1.252 -1.997 2.127 1.00 40.42 N ATOM 1359 CA ARG A 88 -2.593 -1.489 1.898 1.00 54.41 C ATOM 1360 C ARG A 88 -3.315 -2.410 0.926 1.00 3.40 C ATOM 1361 O ARG A 88 -2.693 -2.979 0.026 1.00 52.22 O ATOM 1362 CB ARG A 88 -2.554 -0.060 1.353 1.00 21.52 C ATOM 1363 CG ARG A 88 -3.926 0.598 1.212 1.00 33.30 C ATOM 1364 CD ARG A 88 -4.569 0.875 2.566 1.00 41.22 C ATOM 1365 NE ARG A 88 -4.351 2.254 3.021 1.00 71.35 N ATOM 1366 CZ ARG A 88 -3.253 2.677 3.660 1.00 13.22 C ATOM 1367 NH1 ARG A 88 -2.261 1.843 3.932 1.00 52.44 N ATOM 1368 NH2 ARG A 88 -3.157 3.939 4.051 1.00 43.30 N ATOM 0 H ARG A 88 -0.521 -1.568 1.559 1.00 40.42 H new ATOM 0 HA ARG A 88 -3.130 -1.465 2.846 1.00 54.41 H new ATOM 0 HB2 ARG A 88 -1.937 0.551 2.012 1.00 21.52 H new ATOM 0 HB3 ARG A 88 -2.067 -0.069 0.378 1.00 21.52 H new ATOM 0 HG2 ARG A 88 -3.825 1.533 0.661 1.00 33.30 H new ATOM 0 HG3 ARG A 88 -4.579 -0.048 0.626 1.00 33.30 H new ATOM 0 HD2 ARG A 88 -5.640 0.682 2.502 1.00 41.22 H new ATOM 0 HD3 ARG A 88 -4.164 0.184 3.305 1.00 41.22 H new ATOM 0 HE ARG A 88 -5.086 2.937 2.838 1.00 71.35 H new ATOM 0 HH11 ARG A 88 -2.327 0.864 3.654 1.00 52.44 H new ATOM 0 HH12 ARG A 88 -1.431 2.180 4.419 1.00 52.44 H new ATOM 0 HH21 ARG A 88 -3.920 4.590 3.865 1.00 43.30 H new ATOM 0 HH22 ARG A 88 -2.320 4.260 4.538 1.00 43.30 H new ATOM 1382 N ALA A 89 -4.603 -2.624 1.151 1.00 50.22 N ATOM 1383 CA ALA A 89 -5.407 -3.339 0.183 1.00 60.40 C ATOM 1384 C ALA A 89 -5.674 -2.449 -1.013 1.00 43.40 C ATOM 1385 O ALA A 89 -6.631 -1.675 -1.033 1.00 23.22 O ATOM 1386 CB ALA A 89 -6.708 -3.816 0.795 1.00 12.02 C ATOM 0 H ALA A 89 -5.104 -2.316 1.984 1.00 50.22 H new ATOM 0 HA ALA A 89 -4.855 -4.221 -0.143 1.00 60.40 H new ATOM 0 HB1 ALA A 89 -7.290 -4.349 0.043 1.00 12.02 H new ATOM 0 HB2 ALA A 89 -6.494 -4.484 1.630 1.00 12.02 H new ATOM 0 HB3 ALA A 89 -7.278 -2.958 1.153 1.00 12.02 H new ATOM 1392 N VAL A 90 -4.803 -2.563 -1.993 1.00 64.34 N ATOM 1393 CA VAL A 90 -4.897 -1.789 -3.209 1.00 54.23 C ATOM 1394 C VAL A 90 -6.141 -2.190 -4.003 1.00 1.33 C ATOM 1395 O VAL A 90 -6.685 -3.284 -3.808 1.00 12.14 O ATOM 1396 CB VAL A 90 -3.605 -1.951 -4.052 1.00 4.14 C ATOM 1397 CG1 VAL A 90 -3.431 -3.381 -4.537 1.00 32.13 C ATOM 1398 CG2 VAL A 90 -3.583 -0.974 -5.209 1.00 25.11 C ATOM 0 H VAL A 90 -4.006 -3.199 -1.967 1.00 64.34 H new ATOM 0 HA VAL A 90 -4.996 -0.735 -2.951 1.00 54.23 H new ATOM 0 HB VAL A 90 -2.759 -1.721 -3.404 1.00 4.14 H new ATOM 0 HG11 VAL A 90 -2.516 -3.457 -5.124 1.00 32.13 H new ATOM 0 HG12 VAL A 90 -3.369 -4.051 -3.679 1.00 32.13 H new ATOM 0 HG13 VAL A 90 -4.283 -3.662 -5.156 1.00 32.13 H new ATOM 0 HG21 VAL A 90 -2.666 -1.110 -5.783 1.00 25.11 H new ATOM 0 HG22 VAL A 90 -4.444 -1.153 -5.853 1.00 25.11 H new ATOM 0 HG23 VAL A 90 -3.623 0.045 -4.825 1.00 25.11 H new ATOM 1408 N SER A 91 -6.592 -1.286 -4.872 1.00 21.12 N ATOM 1409 CA SER A 91 -7.783 -1.487 -5.680 1.00 34.33 C ATOM 1410 C SER A 91 -7.700 -2.809 -6.441 1.00 20.22 C ATOM 1411 O SER A 91 -6.616 -3.220 -6.860 1.00 25.42 O ATOM 1412 CB SER A 91 -7.928 -0.319 -6.655 1.00 52.01 C ATOM 1413 OG SER A 91 -9.269 -0.171 -7.071 1.00 34.52 O ATOM 0 H SER A 91 -6.134 -0.389 -5.032 1.00 21.12 H new ATOM 0 HA SER A 91 -8.657 -1.529 -5.030 1.00 34.33 H new ATOM 0 HB2 SER A 91 -7.587 0.601 -6.180 1.00 52.01 H new ATOM 0 HB3 SER A 91 -7.290 -0.484 -7.523 1.00 52.01 H new ATOM 0 HG SER A 91 -9.791 0.243 -6.352 1.00 34.52 H new ATOM 1419 N ARG A 92 -8.858 -3.454 -6.604 1.00 12.34 N ATOM 1420 CA ARG A 92 -8.963 -4.842 -7.079 1.00 45.42 C ATOM 1421 C ARG A 92 -8.129 -5.123 -8.336 1.00 51.11 C ATOM 1422 O ARG A 92 -7.486 -6.173 -8.435 1.00 40.41 O ATOM 1423 CB ARG A 92 -10.438 -5.178 -7.339 1.00 12.23 C ATOM 1424 CG ARG A 92 -10.850 -6.585 -6.919 1.00 74.33 C ATOM 1425 CD ARG A 92 -10.265 -7.648 -7.835 1.00 60.14 C ATOM 1426 NE ARG A 92 -10.624 -8.997 -7.413 1.00 60.03 N ATOM 1427 CZ ARG A 92 -10.192 -10.109 -8.002 1.00 21.42 C ATOM 1428 NH1 ARG A 92 -9.384 -10.041 -9.052 1.00 23.32 N ATOM 1429 NH2 ARG A 92 -10.570 -11.291 -7.534 1.00 42.23 N ATOM 0 H ARG A 92 -9.762 -3.024 -6.408 1.00 12.34 H new ATOM 0 HA ARG A 92 -8.555 -5.480 -6.295 1.00 45.42 H new ATOM 0 HB2 ARG A 92 -11.061 -4.457 -6.809 1.00 12.23 H new ATOM 0 HB3 ARG A 92 -10.643 -5.055 -8.402 1.00 12.23 H new ATOM 0 HG2 ARG A 92 -10.522 -6.768 -5.896 1.00 74.33 H new ATOM 0 HG3 ARG A 92 -11.937 -6.661 -6.924 1.00 74.33 H new ATOM 0 HD2 ARG A 92 -10.617 -7.482 -8.853 1.00 60.14 H new ATOM 0 HD3 ARG A 92 -9.179 -7.552 -7.854 1.00 60.14 H new ATOM 0 HE ARG A 92 -11.248 -9.095 -6.612 1.00 60.03 H new ATOM 0 HH11 ARG A 92 -9.091 -9.133 -9.412 1.00 23.32 H new ATOM 0 HH12 ARG A 92 -9.056 -10.897 -9.499 1.00 23.32 H new ATOM 0 HH21 ARG A 92 -11.190 -11.345 -6.726 1.00 42.23 H new ATOM 0 HH22 ARG A 92 -10.241 -12.146 -7.983 1.00 42.23 H new ATOM 1443 N GLU A 93 -8.135 -4.193 -9.284 1.00 0.33 N ATOM 1444 CA GLU A 93 -7.395 -4.366 -10.530 1.00 44.41 C ATOM 1445 C GLU A 93 -5.895 -4.486 -10.271 1.00 21.20 C ATOM 1446 O GLU A 93 -5.259 -5.440 -10.720 1.00 22.10 O ATOM 1447 CB GLU A 93 -7.673 -3.205 -11.479 1.00 31.34 C ATOM 1448 CG GLU A 93 -6.984 -3.345 -12.825 1.00 15.45 C ATOM 1449 CD GLU A 93 -7.558 -2.412 -13.861 1.00 23.32 C ATOM 1450 OE1 GLU A 93 -7.099 -1.259 -13.948 1.00 51.10 O ATOM 1451 OE2 GLU A 93 -8.480 -2.825 -14.593 1.00 70.52 O ATOM 0 H GLU A 93 -8.644 -3.312 -9.214 1.00 0.33 H new ATOM 0 HA GLU A 93 -7.734 -5.292 -10.994 1.00 44.41 H new ATOM 0 HB2 GLU A 93 -8.749 -3.125 -11.637 1.00 31.34 H new ATOM 0 HB3 GLU A 93 -7.350 -2.276 -11.009 1.00 31.34 H new ATOM 0 HG2 GLU A 93 -5.919 -3.144 -12.708 1.00 15.45 H new ATOM 0 HG3 GLU A 93 -7.078 -4.373 -13.174 1.00 15.45 H new ATOM 1458 N ASP A 94 -5.348 -3.539 -9.519 1.00 11.21 N ATOM 1459 CA ASP A 94 -3.921 -3.534 -9.221 1.00 1.13 C ATOM 1460 C ASP A 94 -3.571 -4.680 -8.279 1.00 25.04 C ATOM 1461 O ASP A 94 -2.484 -5.234 -8.349 1.00 12.13 O ATOM 1462 CB ASP A 94 -3.500 -2.199 -8.609 1.00 55.45 C ATOM 1463 CG ASP A 94 -1.993 -2.063 -8.481 1.00 1.11 C ATOM 1464 OD1 ASP A 94 -1.334 -1.760 -9.498 1.00 44.24 O ATOM 1465 OD2 ASP A 94 -1.465 -2.256 -7.362 1.00 4.54 O ATOM 0 H ASP A 94 -5.869 -2.766 -9.105 1.00 11.21 H new ATOM 0 HA ASP A 94 -3.377 -3.670 -10.156 1.00 1.13 H new ATOM 0 HB2 ASP A 94 -3.883 -1.385 -9.224 1.00 55.45 H new ATOM 0 HB3 ASP A 94 -3.955 -2.096 -7.624 1.00 55.45 H new ATOM 1470 N SER A 95 -4.534 -5.061 -7.439 1.00 60.25 N ATOM 1471 CA SER A 95 -4.362 -6.161 -6.485 1.00 34.25 C ATOM 1472 C SER A 95 -4.154 -7.499 -7.201 1.00 73.21 C ATOM 1473 O SER A 95 -3.662 -8.458 -6.608 1.00 50.34 O ATOM 1474 CB SER A 95 -5.584 -6.249 -5.559 1.00 41.00 C ATOM 1475 OG SER A 95 -5.421 -7.251 -4.564 1.00 43.44 O ATOM 0 H SER A 95 -5.452 -4.619 -7.399 1.00 60.25 H new ATOM 0 HA SER A 95 -3.470 -5.954 -5.894 1.00 34.25 H new ATOM 0 HB2 SER A 95 -5.747 -5.284 -5.080 1.00 41.00 H new ATOM 0 HB3 SER A 95 -6.474 -6.465 -6.151 1.00 41.00 H new ATOM 0 HG SER A 95 -6.217 -7.277 -3.993 1.00 43.44 H new ATOM 1481 N GLN A 96 -4.525 -7.556 -8.472 1.00 1.05 N ATOM 1482 CA GLN A 96 -4.400 -8.773 -9.259 1.00 23.15 C ATOM 1483 C GLN A 96 -3.106 -8.758 -10.079 1.00 42.51 C ATOM 1484 O GLN A 96 -2.773 -9.728 -10.756 1.00 62.25 O ATOM 1485 CB GLN A 96 -5.617 -8.913 -10.172 1.00 71.00 C ATOM 1486 CG GLN A 96 -5.780 -10.294 -10.784 1.00 2.04 C ATOM 1487 CD GLN A 96 -5.912 -11.387 -9.745 1.00 32.24 C ATOM 1488 OE1 GLN A 96 -7.012 -11.710 -9.298 1.00 64.54 O ATOM 1489 NE2 GLN A 96 -4.789 -11.962 -9.352 1.00 42.13 N ATOM 0 H GLN A 96 -4.918 -6.766 -8.983 1.00 1.05 H new ATOM 0 HA GLN A 96 -4.357 -9.630 -8.587 1.00 23.15 H new ATOM 0 HB2 GLN A 96 -6.514 -8.672 -9.602 1.00 71.00 H new ATOM 0 HB3 GLN A 96 -5.542 -8.179 -10.974 1.00 71.00 H new ATOM 0 HG2 GLN A 96 -6.662 -10.300 -11.425 1.00 2.04 H new ATOM 0 HG3 GLN A 96 -4.922 -10.507 -11.421 1.00 2.04 H new ATOM 0 HE21 GLN A 96 -3.898 -11.664 -9.748 1.00 42.13 H new ATOM 0 HE22 GLN A 96 -4.814 -12.704 -8.652 1.00 42.13 H new ATOM 1498 N ARG A 97 -2.365 -7.664 -9.990 1.00 11.03 N ATOM 1499 CA ARG A 97 -1.150 -7.496 -10.777 1.00 74.42 C ATOM 1500 C ARG A 97 0.063 -8.057 -10.039 1.00 32.45 C ATOM 1501 O ARG A 97 0.084 -8.102 -8.807 1.00 3.41 O ATOM 1502 CB ARG A 97 -0.932 -6.017 -11.100 1.00 15.33 C ATOM 1503 CG ARG A 97 -2.084 -5.378 -11.862 1.00 10.30 C ATOM 1504 CD ARG A 97 -2.276 -6.017 -13.228 1.00 12.13 C ATOM 1505 NE ARG A 97 -1.067 -5.923 -14.049 1.00 43.23 N ATOM 1506 CZ ARG A 97 -0.877 -6.591 -15.186 1.00 14.55 C ATOM 1507 NH1 ARG A 97 -1.821 -7.406 -15.652 1.00 53.43 N ATOM 1508 NH2 ARG A 97 0.263 -6.452 -15.851 1.00 51.44 N ATOM 0 H ARG A 97 -2.583 -6.877 -9.379 1.00 11.03 H new ATOM 0 HA ARG A 97 -1.268 -8.051 -11.708 1.00 74.42 H new ATOM 0 HB2 ARG A 97 -0.777 -5.471 -10.170 1.00 15.33 H new ATOM 0 HB3 ARG A 97 -0.019 -5.914 -11.687 1.00 15.33 H new ATOM 0 HG2 ARG A 97 -3.002 -5.475 -11.282 1.00 10.30 H new ATOM 0 HG3 ARG A 97 -1.894 -4.311 -11.982 1.00 10.30 H new ATOM 0 HD2 ARG A 97 -2.550 -7.065 -13.104 1.00 12.13 H new ATOM 0 HD3 ARG A 97 -3.104 -5.530 -13.744 1.00 12.13 H new ATOM 0 HE ARG A 97 -0.321 -5.305 -13.729 1.00 43.23 H new ATOM 0 HH11 ARG A 97 -2.695 -7.521 -15.138 1.00 53.43 H new ATOM 0 HH12 ARG A 97 -1.671 -7.915 -16.523 1.00 53.43 H new ATOM 0 HH21 ARG A 97 0.991 -5.835 -15.491 1.00 51.44 H new ATOM 0 HH22 ARG A 97 0.411 -6.962 -16.722 1.00 51.44 H new ATOM 1522 N PRO A 98 1.084 -8.515 -10.784 1.00 32.43 N ATOM 1523 CA PRO A 98 2.327 -9.024 -10.197 1.00 53.04 C ATOM 1524 C PRO A 98 3.104 -7.934 -9.456 1.00 62.12 C ATOM 1525 O PRO A 98 3.511 -6.932 -10.044 1.00 52.43 O ATOM 1526 CB PRO A 98 3.123 -9.531 -11.403 1.00 55.01 C ATOM 1527 CG PRO A 98 2.541 -8.840 -12.587 1.00 0.53 C ATOM 1528 CD PRO A 98 1.097 -8.589 -12.259 1.00 13.15 C ATOM 0 HA PRO A 98 2.137 -9.796 -9.451 1.00 53.04 H new ATOM 0 HB2 PRO A 98 4.183 -9.301 -11.297 1.00 55.01 H new ATOM 0 HB3 PRO A 98 3.039 -10.613 -11.501 1.00 55.01 H new ATOM 0 HG2 PRO A 98 3.063 -7.904 -12.787 1.00 0.53 H new ATOM 0 HG3 PRO A 98 2.636 -9.455 -13.482 1.00 0.53 H new ATOM 0 HD2 PRO A 98 0.738 -7.664 -12.710 1.00 13.15 H new ATOM 0 HD3 PRO A 98 0.457 -9.392 -12.626 1.00 13.15 H new ATOM 1536 N GLY A 99 3.289 -8.135 -8.159 1.00 64.43 N ATOM 1537 CA GLY A 99 3.987 -7.157 -7.347 1.00 13.31 C ATOM 1538 C GLY A 99 3.043 -6.168 -6.692 1.00 20.01 C ATOM 1539 O GLY A 99 3.451 -5.081 -6.296 1.00 53.42 O ATOM 0 H GLY A 99 2.967 -8.960 -7.653 1.00 64.43 H new ATOM 0 HA2 GLY A 99 4.561 -7.672 -6.576 1.00 13.31 H new ATOM 0 HA3 GLY A 99 4.701 -6.616 -7.968 1.00 13.31 H new ATOM 1543 N ALA A 100 1.779 -6.558 -6.574 1.00 11.33 N ATOM 1544 CA ALA A 100 0.751 -5.701 -5.996 1.00 32.22 C ATOM 1545 C ALA A 100 0.974 -5.470 -4.509 1.00 71.55 C ATOM 1546 O ALA A 100 0.962 -4.339 -4.036 1.00 72.03 O ATOM 1547 CB ALA A 100 -0.616 -6.319 -6.205 1.00 62.34 C ATOM 0 H ALA A 100 1.439 -7.472 -6.874 1.00 11.33 H new ATOM 0 HA ALA A 100 0.809 -4.737 -6.502 1.00 32.22 H new ATOM 0 HB1 ALA A 100 -1.378 -5.672 -5.770 1.00 62.34 H new ATOM 0 HB2 ALA A 100 -0.804 -6.434 -7.272 1.00 62.34 H new ATOM 0 HB3 ALA A 100 -0.651 -7.296 -5.723 1.00 62.34 H new ATOM 1553 N HIS A 101 1.185 -6.547 -3.781 1.00 32.12 N ATOM 1554 CA HIS A 101 1.275 -6.481 -2.334 1.00 62.03 C ATOM 1555 C HIS A 101 2.715 -6.607 -1.861 1.00 13.11 C ATOM 1556 O HIS A 101 2.978 -7.040 -0.738 1.00 61.23 O ATOM 1557 CB HIS A 101 0.394 -7.559 -1.710 1.00 3.24 C ATOM 1558 CG HIS A 101 -1.069 -7.249 -1.806 1.00 3.12 C ATOM 1559 ND1 HIS A 101 -1.969 -8.170 -2.284 1.00 4.23 N ATOM 1560 CD2 HIS A 101 -1.731 -6.111 -1.479 1.00 2.02 C ATOM 1561 CE1 HIS A 101 -3.150 -7.580 -2.234 1.00 51.44 C ATOM 1562 NE2 HIS A 101 -3.055 -6.333 -1.754 1.00 43.42 N ATOM 0 H HIS A 101 1.298 -7.484 -4.168 1.00 32.12 H new ATOM 0 HA HIS A 101 0.916 -5.504 -2.010 1.00 62.03 H new ATOM 0 HB2 HIS A 101 0.591 -8.511 -2.203 1.00 3.24 H new ATOM 0 HB3 HIS A 101 0.666 -7.680 -0.661 1.00 3.24 H new ATOM 0 HD2 HIS A 101 -1.298 -5.206 -1.079 1.00 2.02 H new ATOM 0 HE1 HIS A 101 -4.075 -8.044 -2.541 1.00 51.44 H new ATOM 0 HE2 HIS A 101 -3.822 -5.674 -1.619 1.00 43.42 H new ATOM 1570 N LEU A 102 3.645 -6.230 -2.726 1.00 51.44 N ATOM 1571 CA LEU A 102 5.050 -6.181 -2.358 1.00 40.43 C ATOM 1572 C LEU A 102 5.371 -4.832 -1.721 1.00 11.13 C ATOM 1573 O LEU A 102 4.471 -4.040 -1.441 1.00 51.22 O ATOM 1574 CB LEU A 102 5.941 -6.414 -3.583 1.00 53.02 C ATOM 1575 CG LEU A 102 5.907 -7.822 -4.184 1.00 54.33 C ATOM 1576 CD1 LEU A 102 6.848 -7.905 -5.374 1.00 72.02 C ATOM 1577 CD2 LEU A 102 6.285 -8.869 -3.146 1.00 13.01 C ATOM 0 H LEU A 102 3.451 -5.954 -3.688 1.00 51.44 H new ATOM 0 HA LEU A 102 5.249 -6.974 -1.637 1.00 40.43 H new ATOM 0 HB2 LEU A 102 5.652 -5.704 -4.357 1.00 53.02 H new ATOM 0 HB3 LEU A 102 6.970 -6.184 -3.307 1.00 53.02 H new ATOM 0 HG LEU A 102 4.889 -8.024 -4.517 1.00 54.33 H new ATOM 0 HD11 LEU A 102 6.816 -8.910 -5.794 1.00 72.02 H new ATOM 0 HD12 LEU A 102 6.540 -7.185 -6.132 1.00 72.02 H new ATOM 0 HD13 LEU A 102 7.864 -7.679 -5.051 1.00 72.02 H new ATOM 0 HD21 LEU A 102 6.253 -9.860 -3.600 1.00 13.01 H new ATOM 0 HD22 LEU A 102 7.292 -8.671 -2.779 1.00 13.01 H new ATOM 0 HD23 LEU A 102 5.581 -8.828 -2.315 1.00 13.01 H new ATOM 1589 N THR A 103 6.644 -4.566 -1.480 1.00 73.10 N ATOM 1590 CA THR A 103 7.046 -3.314 -0.863 1.00 4.51 C ATOM 1591 C THR A 103 7.352 -2.262 -1.923 1.00 11.31 C ATOM 1592 O THR A 103 8.459 -1.721 -1.991 1.00 42.31 O ATOM 1593 CB THR A 103 8.259 -3.511 0.062 1.00 65.41 C ATOM 1594 OG1 THR A 103 8.307 -4.874 0.507 1.00 25.32 O ATOM 1595 CG2 THR A 103 8.147 -2.605 1.269 1.00 12.15 C ATOM 0 H THR A 103 7.414 -5.198 -1.701 1.00 73.10 H new ATOM 0 HA THR A 103 6.212 -2.963 -0.256 1.00 4.51 H new ATOM 0 HB THR A 103 9.166 -3.267 -0.492 1.00 65.41 H new ATOM 0 HG1 THR A 103 9.081 -4.999 1.095 1.00 25.32 H new ATOM 0 HG21 THR A 103 9.011 -2.753 1.917 1.00 12.15 H new ATOM 0 HG22 THR A 103 8.113 -1.566 0.942 1.00 12.15 H new ATOM 0 HG23 THR A 103 7.236 -2.843 1.819 1.00 12.15 H new ATOM 1603 N VAL A 104 6.347 -1.982 -2.736 1.00 0.20 N ATOM 1604 CA VAL A 104 6.455 -1.023 -3.822 1.00 72.12 C ATOM 1605 C VAL A 104 6.317 0.390 -3.288 1.00 54.05 C ATOM 1606 O VAL A 104 5.231 0.790 -2.871 1.00 12.35 O ATOM 1607 CB VAL A 104 5.357 -1.253 -4.879 1.00 63.00 C ATOM 1608 CG1 VAL A 104 5.472 -0.241 -6.007 1.00 11.33 C ATOM 1609 CG2 VAL A 104 5.414 -2.669 -5.417 1.00 74.51 C ATOM 0 H VAL A 104 5.427 -2.417 -2.660 1.00 0.20 H new ATOM 0 HA VAL A 104 7.433 -1.159 -4.283 1.00 72.12 H new ATOM 0 HB VAL A 104 4.389 -1.113 -4.397 1.00 63.00 H new ATOM 0 HG11 VAL A 104 4.687 -0.423 -6.741 1.00 11.33 H new ATOM 0 HG12 VAL A 104 5.366 0.766 -5.604 1.00 11.33 H new ATOM 0 HG13 VAL A 104 6.446 -0.339 -6.486 1.00 11.33 H new ATOM 0 HG21 VAL A 104 4.630 -2.807 -6.161 1.00 74.51 H new ATOM 0 HG22 VAL A 104 6.386 -2.844 -5.878 1.00 74.51 H new ATOM 0 HG23 VAL A 104 5.267 -3.375 -4.600 1.00 74.51 H new ATOM 1619 N LYS A 105 7.409 1.141 -3.254 1.00 34.11 N ATOM 1620 CA LYS A 105 7.349 2.534 -2.859 1.00 44.05 C ATOM 1621 C LYS A 105 7.631 3.436 -4.054 1.00 51.14 C ATOM 1622 O LYS A 105 7.906 4.617 -3.901 1.00 31.41 O ATOM 1623 CB LYS A 105 8.378 2.801 -1.763 1.00 10.21 C ATOM 1624 CG LYS A 105 8.467 1.691 -0.734 1.00 32.44 C ATOM 1625 CD LYS A 105 9.476 2.017 0.344 1.00 44.15 C ATOM 1626 CE LYS A 105 9.635 0.872 1.325 1.00 20.53 C ATOM 1627 NZ LYS A 105 10.438 1.271 2.509 1.00 1.20 N ATOM 0 H LYS A 105 8.342 0.807 -3.495 1.00 34.11 H new ATOM 0 HA LYS A 105 6.349 2.750 -2.482 1.00 44.05 H new ATOM 0 HB2 LYS A 105 9.357 2.940 -2.221 1.00 10.21 H new ATOM 0 HB3 LYS A 105 8.126 3.734 -1.259 1.00 10.21 H new ATOM 0 HG2 LYS A 105 7.488 1.533 -0.282 1.00 32.44 H new ATOM 0 HG3 LYS A 105 8.746 0.759 -1.225 1.00 32.44 H new ATOM 0 HD2 LYS A 105 10.439 2.241 -0.114 1.00 44.15 H new ATOM 0 HD3 LYS A 105 9.162 2.914 0.878 1.00 44.15 H new ATOM 0 HE2 LYS A 105 8.652 0.532 1.650 1.00 20.53 H new ATOM 0 HE3 LYS A 105 10.115 0.030 0.827 1.00 20.53 H new ATOM 0 HZ1 LYS A 105 10.201 0.655 3.313 1.00 1.20 H new ATOM 0 HZ2 LYS A 105 11.450 1.179 2.289 1.00 1.20 H new ATOM 0 HZ3 LYS A 105 10.226 2.259 2.756 1.00 1.20 H new ATOM 1641 N LYS A 106 7.570 2.867 -5.242 1.00 72.20 N ATOM 1642 CA LYS A 106 7.782 3.627 -6.464 1.00 42.42 C ATOM 1643 C LYS A 106 6.496 3.690 -7.274 1.00 2.24 C ATOM 1644 O LYS A 106 5.747 2.716 -7.329 1.00 14.14 O ATOM 1645 CB LYS A 106 8.902 2.985 -7.286 1.00 33.14 C ATOM 1646 CG LYS A 106 10.254 3.647 -7.106 1.00 33.11 C ATOM 1647 CD LYS A 106 10.380 4.886 -7.973 1.00 71.43 C ATOM 1648 CE LYS A 106 10.574 4.528 -9.438 1.00 61.10 C ATOM 1649 NZ LYS A 106 11.973 4.139 -9.742 1.00 11.40 N ATOM 0 H LYS A 106 7.375 1.877 -5.390 1.00 72.20 H new ATOM 0 HA LYS A 106 8.075 4.644 -6.205 1.00 42.42 H new ATOM 0 HB2 LYS A 106 8.984 1.933 -7.011 1.00 33.14 H new ATOM 0 HB3 LYS A 106 8.630 3.018 -8.341 1.00 33.14 H new ATOM 0 HG2 LYS A 106 10.393 3.917 -6.059 1.00 33.11 H new ATOM 0 HG3 LYS A 106 11.044 2.941 -7.360 1.00 33.11 H new ATOM 0 HD2 LYS A 106 9.486 5.500 -7.863 1.00 71.43 H new ATOM 0 HD3 LYS A 106 11.223 5.486 -7.630 1.00 71.43 H new ATOM 0 HE2 LYS A 106 9.906 3.708 -9.701 1.00 61.10 H new ATOM 0 HE3 LYS A 106 10.293 5.379 -10.058 1.00 61.10 H new ATOM 0 HZ1 LYS A 106 12.006 3.652 -10.660 1.00 11.40 H new ATOM 0 HZ2 LYS A 106 12.570 4.990 -9.780 1.00 11.40 H new ATOM 0 HZ3 LYS A 106 12.325 3.502 -8.999 1.00 11.40 H new ATOM 1663 N ILE A 107 6.215 4.836 -7.883 1.00 50.45 N ATOM 1664 CA ILE A 107 5.029 4.979 -8.720 1.00 54.40 C ATOM 1665 C ILE A 107 5.377 5.562 -10.080 1.00 41.24 C ATOM 1666 O ILE A 107 6.325 6.340 -10.216 1.00 24.24 O ATOM 1667 CB ILE A 107 3.964 5.882 -8.066 1.00 64.04 C ATOM 1668 CG1 ILE A 107 4.625 7.095 -7.399 1.00 44.53 C ATOM 1669 CG2 ILE A 107 3.134 5.091 -7.072 1.00 21.10 C ATOM 1670 CD1 ILE A 107 3.653 8.019 -6.706 1.00 13.30 C ATOM 0 H ILE A 107 6.789 5.676 -7.814 1.00 50.45 H new ATOM 0 HA ILE A 107 4.624 3.974 -8.839 1.00 54.40 H new ATOM 0 HB ILE A 107 3.294 6.251 -8.842 1.00 64.04 H new ATOM 0 HG12 ILE A 107 5.357 6.743 -6.672 1.00 44.53 H new ATOM 0 HG13 ILE A 107 5.172 7.659 -8.155 1.00 44.53 H new ATOM 0 HG21 ILE A 107 2.388 5.744 -6.620 1.00 21.10 H new ATOM 0 HG22 ILE A 107 2.634 4.270 -7.587 1.00 21.10 H new ATOM 0 HG23 ILE A 107 3.783 4.689 -6.294 1.00 21.10 H new ATOM 0 HD11 ILE A 107 4.197 8.851 -6.260 1.00 13.30 H new ATOM 0 HD12 ILE A 107 2.935 8.402 -7.431 1.00 13.30 H new ATOM 0 HD13 ILE A 107 3.124 7.472 -5.926 1.00 13.30 H new ATOM 1682 N PHE A 108 4.600 5.167 -11.075 1.00 75.11 N ATOM 1683 CA PHE A 108 4.722 5.690 -12.423 1.00 42.40 C ATOM 1684 C PHE A 108 3.696 6.798 -12.625 1.00 61.15 C ATOM 1685 O PHE A 108 2.533 6.639 -12.259 1.00 3.32 O ATOM 1686 CB PHE A 108 4.515 4.552 -13.442 1.00 35.51 C ATOM 1687 CG PHE A 108 4.048 4.994 -14.807 1.00 12.25 C ATOM 1688 CD1 PHE A 108 4.954 5.369 -15.787 1.00 32.41 C ATOM 1689 CD2 PHE A 108 2.695 5.025 -15.109 1.00 71.34 C ATOM 1690 CE1 PHE A 108 4.518 5.766 -17.038 1.00 14.43 C ATOM 1691 CE2 PHE A 108 2.252 5.418 -16.351 1.00 33.33 C ATOM 1692 CZ PHE A 108 3.163 5.791 -17.321 1.00 50.54 C ATOM 0 H PHE A 108 3.863 4.470 -10.968 1.00 75.11 H new ATOM 0 HA PHE A 108 5.718 6.105 -12.574 1.00 42.40 H new ATOM 0 HB2 PHE A 108 5.454 4.010 -13.554 1.00 35.51 H new ATOM 0 HB3 PHE A 108 3.788 3.849 -13.036 1.00 35.51 H new ATOM 0 HD1 PHE A 108 6.012 5.351 -15.571 1.00 32.41 H new ATOM 0 HD2 PHE A 108 1.977 4.736 -14.356 1.00 71.34 H new ATOM 0 HE1 PHE A 108 5.234 6.056 -17.793 1.00 14.43 H new ATOM 0 HE2 PHE A 108 1.194 5.435 -16.567 1.00 33.33 H new ATOM 0 HZ PHE A 108 2.819 6.101 -18.297 1.00 50.54 H new ATOM 1702 N VAL A 109 4.133 7.913 -13.184 1.00 1.43 N ATOM 1703 CA VAL A 109 3.250 9.040 -13.455 1.00 44.23 C ATOM 1704 C VAL A 109 3.315 9.390 -14.936 1.00 4.44 C ATOM 1705 O VAL A 109 4.321 9.898 -15.399 1.00 11.33 O ATOM 1706 CB VAL A 109 3.662 10.284 -12.632 1.00 61.50 C ATOM 1707 CG1 VAL A 109 2.622 11.389 -12.749 1.00 74.33 C ATOM 1708 CG2 VAL A 109 3.896 9.917 -11.175 1.00 32.02 C ATOM 0 H VAL A 109 5.103 8.065 -13.462 1.00 1.43 H new ATOM 0 HA VAL A 109 2.237 8.752 -13.173 1.00 44.23 H new ATOM 0 HB VAL A 109 4.599 10.660 -13.043 1.00 61.50 H new ATOM 0 HG11 VAL A 109 2.938 12.250 -12.160 1.00 74.33 H new ATOM 0 HG12 VAL A 109 2.518 11.682 -13.794 1.00 74.33 H new ATOM 0 HG13 VAL A 109 1.663 11.027 -12.377 1.00 74.33 H new ATOM 0 HG21 VAL A 109 4.184 10.808 -10.617 1.00 32.02 H new ATOM 0 HG22 VAL A 109 2.980 9.505 -10.752 1.00 32.02 H new ATOM 0 HG23 VAL A 109 4.692 9.175 -11.110 1.00 32.02 H new ATOM 1718 N GLY A 110 2.252 9.132 -15.678 1.00 65.24 N ATOM 1719 CA GLY A 110 2.294 9.358 -17.109 1.00 52.52 C ATOM 1720 C GLY A 110 1.172 10.240 -17.602 1.00 60.41 C ATOM 1721 O GLY A 110 0.072 10.218 -17.057 1.00 54.51 O ATOM 0 H GLY A 110 1.366 8.773 -15.321 1.00 65.24 H new ATOM 0 HA2 GLY A 110 3.249 9.814 -17.371 1.00 52.52 H new ATOM 0 HA3 GLY A 110 2.247 8.398 -17.624 1.00 52.52 H new ATOM 1725 N GLY A 111 1.448 11.009 -18.640 1.00 12.11 N ATOM 1726 CA GLY A 111 0.450 11.901 -19.188 1.00 43.42 C ATOM 1727 C GLY A 111 0.704 13.343 -18.809 1.00 24.12 C ATOM 1728 O GLY A 111 -0.210 14.167 -18.818 1.00 42.22 O ATOM 0 H GLY A 111 2.350 11.032 -19.116 1.00 12.11 H new ATOM 0 HA2 GLY A 111 0.440 11.809 -20.274 1.00 43.42 H new ATOM 0 HA3 GLY A 111 -0.536 11.602 -18.833 1.00 43.42 H new ATOM 1732 N ILE A 112 1.946 13.652 -18.469 1.00 14.14 N ATOM 1733 CA ILE A 112 2.314 15.011 -18.102 1.00 12.32 C ATOM 1734 C ILE A 112 2.781 15.790 -19.334 1.00 74.44 C ATOM 1735 O ILE A 112 3.979 15.966 -19.580 1.00 23.21 O ATOM 1736 CB ILE A 112 3.378 15.044 -16.973 1.00 1.11 C ATOM 1737 CG1 ILE A 112 4.585 14.161 -17.306 1.00 12.32 C ATOM 1738 CG2 ILE A 112 2.750 14.590 -15.664 1.00 24.32 C ATOM 1739 CD1 ILE A 112 5.699 14.234 -16.284 1.00 21.30 C ATOM 0 H ILE A 112 2.715 12.982 -18.440 1.00 14.14 H new ATOM 0 HA ILE A 112 1.424 15.498 -17.704 1.00 12.32 H new ATOM 0 HB ILE A 112 3.734 16.070 -16.876 1.00 1.11 H new ATOM 0 HG12 ILE A 112 4.253 13.127 -17.394 1.00 12.32 H new ATOM 0 HG13 ILE A 112 4.979 14.453 -18.280 1.00 12.32 H new ATOM 0 HG21 ILE A 112 3.500 14.614 -14.873 1.00 24.32 H new ATOM 0 HG22 ILE A 112 1.927 15.256 -15.405 1.00 24.32 H new ATOM 0 HG23 ILE A 112 2.372 13.574 -15.775 1.00 24.32 H new ATOM 0 HD11 ILE A 112 6.517 13.582 -16.590 1.00 21.30 H new ATOM 0 HD12 ILE A 112 6.060 15.260 -16.212 1.00 21.30 H new ATOM 0 HD13 ILE A 112 5.323 13.913 -15.313 1.00 21.30 H new ATOM 1751 N LYS A 113 1.807 16.226 -20.127 1.00 20.22 N ATOM 1752 CA LYS A 113 2.075 16.950 -21.364 1.00 60.51 C ATOM 1753 C LYS A 113 2.700 18.309 -21.078 1.00 53.14 C ATOM 1754 O LYS A 113 3.735 18.662 -21.650 1.00 22.45 O ATOM 1755 CB LYS A 113 0.781 17.127 -22.167 1.00 53.23 C ATOM 1756 CG LYS A 113 0.972 17.840 -23.496 1.00 64.42 C ATOM 1757 CD LYS A 113 1.858 17.043 -24.438 1.00 31.21 C ATOM 1758 CE LYS A 113 2.058 17.768 -25.756 1.00 14.52 C ATOM 1759 NZ LYS A 113 0.837 17.735 -26.601 1.00 72.33 N ATOM 0 H LYS A 113 0.815 16.088 -19.931 1.00 20.22 H new ATOM 0 HA LYS A 113 2.782 16.364 -21.951 1.00 60.51 H new ATOM 0 HB2 LYS A 113 0.343 16.146 -22.352 1.00 53.23 H new ATOM 0 HB3 LYS A 113 0.065 17.687 -21.565 1.00 53.23 H new ATOM 0 HG2 LYS A 113 0.001 18.006 -23.963 1.00 64.42 H new ATOM 0 HG3 LYS A 113 1.415 18.821 -23.323 1.00 64.42 H new ATOM 0 HD2 LYS A 113 2.825 16.866 -23.968 1.00 31.21 H new ATOM 0 HD3 LYS A 113 1.410 16.067 -24.622 1.00 31.21 H new ATOM 0 HE2 LYS A 113 2.336 18.804 -25.561 1.00 14.52 H new ATOM 0 HE3 LYS A 113 2.886 17.312 -26.298 1.00 14.52 H new ATOM 0 HZ1 LYS A 113 1.033 18.197 -27.512 1.00 72.33 H new ATOM 0 HZ2 LYS A 113 0.556 16.747 -26.767 1.00 72.33 H new ATOM 0 HZ3 LYS A 113 0.066 18.238 -26.117 1.00 72.33 H new ATOM 1773 N GLU A 114 2.069 19.067 -20.191 1.00 55.14 N ATOM 1774 CA GLU A 114 2.584 20.367 -19.792 1.00 71.23 C ATOM 1775 C GLU A 114 3.868 20.186 -19.001 1.00 52.10 C ATOM 1776 O GLU A 114 4.095 19.124 -18.417 1.00 73.02 O ATOM 1777 CB GLU A 114 1.540 21.120 -18.963 1.00 53.44 C ATOM 1778 CG GLU A 114 1.871 22.585 -18.717 1.00 1.35 C ATOM 1779 CD GLU A 114 2.261 23.317 -19.986 1.00 43.45 C ATOM 1780 OE1 GLU A 114 1.376 23.590 -20.821 1.00 11.12 O ATOM 1781 OE2 GLU A 114 3.460 23.614 -20.153 1.00 14.32 O ATOM 0 H GLU A 114 1.197 18.801 -19.734 1.00 55.14 H new ATOM 0 HA GLU A 114 2.800 20.957 -20.683 1.00 71.23 H new ATOM 0 HB2 GLU A 114 0.577 21.058 -19.470 1.00 53.44 H new ATOM 0 HB3 GLU A 114 1.427 20.619 -18.002 1.00 53.44 H new ATOM 0 HG2 GLU A 114 1.008 23.078 -18.268 1.00 1.35 H new ATOM 0 HG3 GLU A 114 2.687 22.653 -17.998 1.00 1.35 H new ATOM 1788 N ASP A 115 4.710 21.213 -19.004 1.00 45.22 N ATOM 1789 CA ASP A 115 5.988 21.166 -18.312 1.00 52.24 C ATOM 1790 C ASP A 115 5.789 20.962 -16.822 1.00 2.44 C ATOM 1791 O ASP A 115 5.469 21.894 -16.084 1.00 21.13 O ATOM 1792 CB ASP A 115 6.791 22.439 -18.568 1.00 33.33 C ATOM 1793 CG ASP A 115 7.554 22.372 -19.869 1.00 22.03 C ATOM 1794 OD1 ASP A 115 6.973 22.703 -20.923 1.00 45.14 O ATOM 1795 OD2 ASP A 115 8.730 21.964 -19.845 1.00 52.10 O ATOM 0 H ASP A 115 4.526 22.095 -19.483 1.00 45.22 H new ATOM 0 HA ASP A 115 6.549 20.318 -18.704 1.00 52.24 H new ATOM 0 HB2 ASP A 115 6.117 23.296 -18.586 1.00 33.33 H new ATOM 0 HB3 ASP A 115 7.489 22.600 -17.746 1.00 33.33 H new ATOM 1800 N THR A 116 5.943 19.723 -16.399 1.00 1.41 N ATOM 1801 CA THR A 116 5.781 19.365 -15.015 1.00 10.11 C ATOM 1802 C THR A 116 7.140 19.307 -14.338 1.00 33.34 C ATOM 1803 O THR A 116 8.100 18.750 -14.871 1.00 60.14 O ATOM 1804 CB THR A 116 5.037 18.024 -14.877 1.00 61.04 C ATOM 1805 OG1 THR A 116 3.845 18.059 -15.678 1.00 64.22 O ATOM 1806 CG2 THR A 116 4.664 17.747 -13.423 1.00 2.40 C ATOM 0 H THR A 116 6.184 18.941 -17.009 1.00 1.41 H new ATOM 0 HA THR A 116 5.177 20.127 -14.523 1.00 10.11 H new ATOM 0 HB THR A 116 5.697 17.227 -15.218 1.00 61.04 H new ATOM 0 HG1 THR A 116 4.078 18.295 -16.600 1.00 64.22 H new ATOM 0 HG21 THR A 116 4.140 16.794 -13.357 1.00 2.40 H new ATOM 0 HG22 THR A 116 5.569 17.706 -12.817 1.00 2.40 H new ATOM 0 HG23 THR A 116 4.016 18.543 -13.055 1.00 2.40 H new ATOM 1814 N GLU A 117 7.199 19.907 -13.174 1.00 0.41 N ATOM 1815 CA GLU A 117 8.441 20.033 -12.448 1.00 54.25 C ATOM 1816 C GLU A 117 8.418 19.165 -11.208 1.00 43.31 C ATOM 1817 O GLU A 117 7.362 18.666 -10.806 1.00 34.13 O ATOM 1818 CB GLU A 117 8.703 21.489 -12.089 1.00 75.25 C ATOM 1819 CG GLU A 117 8.805 22.391 -13.306 1.00 31.30 C ATOM 1820 CD GLU A 117 9.250 23.795 -12.965 1.00 61.44 C ATOM 1821 OE1 GLU A 117 8.701 24.389 -12.014 1.00 63.24 O ATOM 1822 OE2 GLU A 117 10.167 24.306 -13.639 1.00 72.45 O ATOM 0 H GLU A 117 6.393 20.320 -12.705 1.00 0.41 H new ATOM 0 HA GLU A 117 9.255 19.691 -13.087 1.00 54.25 H new ATOM 0 HB2 GLU A 117 7.901 21.848 -11.444 1.00 75.25 H new ATOM 0 HB3 GLU A 117 9.628 21.555 -11.516 1.00 75.25 H new ATOM 0 HG2 GLU A 117 9.508 21.955 -14.016 1.00 31.30 H new ATOM 0 HG3 GLU A 117 7.835 22.433 -13.802 1.00 31.30 H new ATOM 1829 N GLU A 118 9.587 18.995 -10.613 1.00 71.24 N ATOM 1830 CA GLU A 118 9.757 18.125 -9.459 1.00 2.34 C ATOM 1831 C GLU A 118 8.885 18.568 -8.291 1.00 11.13 C ATOM 1832 O GLU A 118 8.196 17.756 -7.693 1.00 21.11 O ATOM 1833 CB GLU A 118 11.229 18.103 -9.050 1.00 42.42 C ATOM 1834 CG GLU A 118 11.500 17.433 -7.719 1.00 41.30 C ATOM 1835 CD GLU A 118 12.978 17.355 -7.425 1.00 54.30 C ATOM 1836 OE1 GLU A 118 13.638 16.451 -7.964 1.00 70.01 O ATOM 1837 OE2 GLU A 118 13.493 18.213 -6.679 1.00 74.45 O ATOM 0 H GLU A 118 10.445 19.456 -10.916 1.00 71.24 H new ATOM 0 HA GLU A 118 9.442 17.119 -9.737 1.00 2.34 H new ATOM 0 HB2 GLU A 118 11.801 17.590 -9.824 1.00 42.42 H new ATOM 0 HB3 GLU A 118 11.597 19.128 -9.008 1.00 42.42 H new ATOM 0 HG2 GLU A 118 10.999 17.986 -6.924 1.00 41.30 H new ATOM 0 HG3 GLU A 118 11.076 16.429 -7.724 1.00 41.30 H new ATOM 1844 N HIS A 119 8.880 19.858 -7.997 1.00 50.12 N ATOM 1845 CA HIS A 119 8.119 20.364 -6.860 1.00 51.04 C ATOM 1846 C HIS A 119 6.617 20.268 -7.106 1.00 63.12 C ATOM 1847 O HIS A 119 5.842 20.233 -6.157 1.00 64.41 O ATOM 1848 CB HIS A 119 8.518 21.802 -6.530 1.00 13.21 C ATOM 1849 CG HIS A 119 9.943 21.941 -6.083 1.00 32.44 C ATOM 1850 ND1 HIS A 119 10.723 22.995 -6.489 1.00 33.22 N ATOM 1851 CD2 HIS A 119 10.675 21.136 -5.278 1.00 11.11 C ATOM 1852 CE1 HIS A 119 11.904 22.810 -5.925 1.00 65.13 C ATOM 1853 NE2 HIS A 119 11.920 21.695 -5.182 1.00 71.51 N ATOM 0 H HIS A 119 9.388 20.570 -8.522 1.00 50.12 H new ATOM 0 HA HIS A 119 8.358 19.736 -6.002 1.00 51.04 H new ATOM 0 HB2 HIS A 119 8.359 22.425 -7.410 1.00 13.21 H new ATOM 0 HB3 HIS A 119 7.861 22.182 -5.747 1.00 13.21 H new ATOM 0 HD2 HIS A 119 10.340 20.226 -4.802 1.00 11.11 H new ATOM 0 HE1 HIS A 119 12.748 23.473 -6.047 1.00 65.13 H new ATOM 0 HE2 HIS A 119 12.709 21.332 -4.647 1.00 71.51 H new ATOM 1861 N HIS A 120 6.218 20.200 -8.380 1.00 25.45 N ATOM 1862 CA HIS A 120 4.810 20.024 -8.745 1.00 51.11 C ATOM 1863 C HIS A 120 4.277 18.704 -8.199 1.00 45.44 C ATOM 1864 O HIS A 120 3.373 18.687 -7.356 1.00 53.32 O ATOM 1865 CB HIS A 120 4.624 20.075 -10.265 1.00 3.31 C ATOM 1866 CG HIS A 120 4.803 21.445 -10.857 1.00 44.31 C ATOM 1867 ND1 HIS A 120 5.046 21.619 -12.198 1.00 1.45 N ATOM 1868 CD2 HIS A 120 4.759 22.660 -10.257 1.00 24.32 C ATOM 1869 CE1 HIS A 120 5.145 22.924 -12.384 1.00 25.23 C ATOM 1870 NE2 HIS A 120 4.978 23.595 -11.236 1.00 13.05 N ATOM 0 H HIS A 120 6.852 20.264 -9.176 1.00 25.45 H new ATOM 0 HA HIS A 120 4.246 20.844 -8.302 1.00 51.11 H new ATOM 0 HB2 HIS A 120 5.336 19.393 -10.731 1.00 3.31 H new ATOM 0 HB3 HIS A 120 3.626 19.712 -10.511 1.00 3.31 H new ATOM 0 HD2 HIS A 120 4.585 22.854 -9.209 1.00 24.32 H new ATOM 0 HE1 HIS A 120 5.336 23.390 -13.339 1.00 25.23 H new ATOM 0 HE2 HIS A 120 5.008 24.607 -11.114 1.00 13.05 H new ATOM 1878 N LEU A 121 4.882 17.598 -8.618 1.00 44.33 N ATOM 1879 CA LEU A 121 4.367 16.289 -8.237 1.00 22.21 C ATOM 1880 C LEU A 121 4.890 15.869 -6.861 1.00 45.25 C ATOM 1881 O LEU A 121 4.272 15.047 -6.193 1.00 44.15 O ATOM 1882 CB LEU A 121 4.659 15.223 -9.312 1.00 2.40 C ATOM 1883 CG LEU A 121 6.074 14.633 -9.354 1.00 42.14 C ATOM 1884 CD1 LEU A 121 6.161 13.541 -10.398 1.00 1.33 C ATOM 1885 CD2 LEU A 121 7.096 15.695 -9.662 1.00 11.32 C ATOM 0 H LEU A 121 5.713 17.580 -9.210 1.00 44.33 H new ATOM 0 HA LEU A 121 3.283 16.372 -8.164 1.00 22.21 H new ATOM 0 HB2 LEU A 121 3.956 14.402 -9.172 1.00 2.40 H new ATOM 0 HB3 LEU A 121 4.448 15.661 -10.287 1.00 2.40 H new ATOM 0 HG LEU A 121 6.286 14.215 -8.370 1.00 42.14 H new ATOM 0 HD11 LEU A 121 7.172 13.133 -10.415 1.00 1.33 H new ATOM 0 HD12 LEU A 121 5.454 12.748 -10.155 1.00 1.33 H new ATOM 0 HD13 LEU A 121 5.920 13.954 -11.378 1.00 1.33 H new ATOM 0 HD21 LEU A 121 8.090 15.248 -9.685 1.00 11.32 H new ATOM 0 HD22 LEU A 121 6.876 16.141 -10.632 1.00 11.32 H new ATOM 0 HD23 LEU A 121 7.063 16.466 -8.892 1.00 11.32 H new ATOM 1897 N ARG A 122 5.998 16.461 -6.421 1.00 55.35 N ATOM 1898 CA ARG A 122 6.528 16.189 -5.089 1.00 54.54 C ATOM 1899 C ARG A 122 5.560 16.702 -4.033 1.00 54.03 C ATOM 1900 O ARG A 122 5.153 15.958 -3.155 1.00 60.34 O ATOM 1901 CB ARG A 122 7.909 16.836 -4.901 1.00 12.22 C ATOM 1902 CG ARG A 122 8.585 16.509 -3.573 1.00 20.53 C ATOM 1903 CD ARG A 122 8.278 17.533 -2.496 1.00 42.52 C ATOM 1904 NE ARG A 122 9.017 18.784 -2.674 1.00 31.30 N ATOM 1905 CZ ARG A 122 8.697 19.929 -2.067 1.00 32.23 C ATOM 1906 NH1 ARG A 122 7.654 19.977 -1.244 1.00 71.31 N ATOM 1907 NH2 ARG A 122 9.428 21.023 -2.268 1.00 52.11 N ATOM 0 H ARG A 122 6.544 17.129 -6.965 1.00 55.35 H new ATOM 0 HA ARG A 122 6.643 15.111 -4.979 1.00 54.54 H new ATOM 0 HB2 ARG A 122 8.560 16.516 -5.714 1.00 12.22 H new ATOM 0 HB3 ARG A 122 7.804 17.918 -4.984 1.00 12.22 H new ATOM 0 HG2 ARG A 122 8.260 15.524 -3.237 1.00 20.53 H new ATOM 0 HG3 ARG A 122 9.663 16.455 -3.722 1.00 20.53 H new ATOM 0 HD2 ARG A 122 7.209 17.745 -2.497 1.00 42.52 H new ATOM 0 HD3 ARG A 122 8.518 17.110 -1.520 1.00 42.52 H new ATOM 0 HE ARG A 122 9.824 18.781 -3.298 1.00 31.30 H new ATOM 0 HH11 ARG A 122 7.098 19.139 -1.076 1.00 71.31 H new ATOM 0 HH12 ARG A 122 7.410 20.852 -0.780 1.00 71.31 H new ATOM 0 HH21 ARG A 122 10.237 20.989 -2.888 1.00 52.11 H new ATOM 0 HH22 ARG A 122 9.179 21.895 -1.802 1.00 52.11 H new ATOM 1921 N ASP A 123 5.183 17.974 -4.146 1.00 50.14 N ATOM 1922 CA ASP A 123 4.258 18.602 -3.198 1.00 61.33 C ATOM 1923 C ASP A 123 2.917 17.876 -3.203 1.00 30.23 C ATOM 1924 O ASP A 123 2.244 17.766 -2.177 1.00 61.42 O ATOM 1925 CB ASP A 123 4.058 20.074 -3.567 1.00 10.44 C ATOM 1926 CG ASP A 123 3.245 20.847 -2.548 1.00 72.22 C ATOM 1927 OD1 ASP A 123 2.001 20.836 -2.635 1.00 22.03 O ATOM 1928 OD2 ASP A 123 3.851 21.498 -1.672 1.00 41.32 O ATOM 0 H ASP A 123 5.505 18.595 -4.888 1.00 50.14 H new ATOM 0 HA ASP A 123 4.684 18.538 -2.197 1.00 61.33 H new ATOM 0 HB2 ASP A 123 5.033 20.548 -3.678 1.00 10.44 H new ATOM 0 HB3 ASP A 123 3.563 20.133 -4.536 1.00 10.44 H new ATOM 1933 N TYR A 124 2.566 17.348 -4.365 1.00 2.21 N ATOM 1934 CA TYR A 124 1.318 16.648 -4.544 1.00 20.11 C ATOM 1935 C TYR A 124 1.324 15.276 -3.862 1.00 73.51 C ATOM 1936 O TYR A 124 0.480 14.993 -3.018 1.00 23.12 O ATOM 1937 CB TYR A 124 1.045 16.497 -6.024 1.00 1.22 C ATOM 1938 CG TYR A 124 -0.212 15.743 -6.298 1.00 62.11 C ATOM 1939 CD1 TYR A 124 -1.434 16.324 -6.040 1.00 60.31 C ATOM 1940 CD2 TYR A 124 -0.176 14.446 -6.776 1.00 30.33 C ATOM 1941 CE1 TYR A 124 -2.602 15.641 -6.255 1.00 34.04 C ATOM 1942 CE2 TYR A 124 -1.345 13.747 -6.991 1.00 64.20 C ATOM 1943 CZ TYR A 124 -2.558 14.359 -6.725 1.00 10.12 C ATOM 1944 OH TYR A 124 -3.735 13.690 -6.924 1.00 75.25 O ATOM 0 H TYR A 124 3.142 17.396 -5.205 1.00 2.21 H new ATOM 0 HA TYR A 124 0.527 17.233 -4.074 1.00 20.11 H new ATOM 0 HB2 TYR A 124 0.980 17.484 -6.481 1.00 1.22 H new ATOM 0 HB3 TYR A 124 1.883 15.983 -6.494 1.00 1.22 H new ATOM 0 HD1 TYR A 124 -1.472 17.335 -5.662 1.00 60.31 H new ATOM 0 HD2 TYR A 124 0.775 13.977 -6.982 1.00 30.33 H new ATOM 0 HE1 TYR A 124 -3.552 16.113 -6.054 1.00 34.04 H new ATOM 0 HE2 TYR A 124 -1.315 12.733 -7.363 1.00 64.20 H new ATOM 0 HH TYR A 124 -3.599 12.733 -6.762 1.00 75.25 H new ATOM 1954 N PHE A 125 2.260 14.425 -4.253 1.00 23.22 N ATOM 1955 CA PHE A 125 2.355 13.075 -3.701 1.00 54.40 C ATOM 1956 C PHE A 125 2.734 13.090 -2.212 1.00 73.55 C ATOM 1957 O PHE A 125 2.453 12.137 -1.488 1.00 73.32 O ATOM 1958 CB PHE A 125 3.352 12.238 -4.509 1.00 43.42 C ATOM 1959 CG PHE A 125 2.869 11.847 -5.884 1.00 54.14 C ATOM 1960 CD1 PHE A 125 1.740 11.054 -6.052 1.00 42.44 C ATOM 1961 CD2 PHE A 125 3.553 12.266 -7.011 1.00 3.11 C ATOM 1962 CE1 PHE A 125 1.312 10.690 -7.320 1.00 73.22 C ATOM 1963 CE2 PHE A 125 3.127 11.906 -8.275 1.00 44.11 C ATOM 1964 CZ PHE A 125 2.007 11.119 -8.429 1.00 4.43 C ATOM 0 H PHE A 125 2.969 14.643 -4.953 1.00 23.22 H new ATOM 0 HA PHE A 125 1.369 12.616 -3.777 1.00 54.40 H new ATOM 0 HB2 PHE A 125 4.281 12.799 -4.610 1.00 43.42 H new ATOM 0 HB3 PHE A 125 3.586 11.333 -3.949 1.00 43.42 H new ATOM 0 HD1 PHE A 125 1.190 10.718 -5.186 1.00 42.44 H new ATOM 0 HD2 PHE A 125 4.432 12.883 -6.901 1.00 3.11 H new ATOM 0 HE1 PHE A 125 0.435 10.071 -7.438 1.00 73.22 H new ATOM 0 HE2 PHE A 125 3.673 12.242 -9.144 1.00 44.11 H new ATOM 0 HZ PHE A 125 1.674 10.839 -9.418 1.00 4.43 H new ATOM 1974 N GLU A 126 3.330 14.194 -1.759 1.00 51.40 N ATOM 1975 CA GLU A 126 3.753 14.344 -0.363 1.00 32.33 C ATOM 1976 C GLU A 126 2.553 14.360 0.582 1.00 60.24 C ATOM 1977 O GLU A 126 2.680 14.045 1.765 1.00 34.31 O ATOM 1978 CB GLU A 126 4.552 15.629 -0.177 1.00 63.23 C ATOM 1979 CG GLU A 126 6.032 15.410 0.053 1.00 73.13 C ATOM 1980 CD GLU A 126 6.730 16.664 0.535 1.00 44.01 C ATOM 1981 OE1 GLU A 126 6.483 17.747 -0.032 1.00 44.11 O ATOM 1982 OE2 GLU A 126 7.537 16.573 1.481 1.00 13.13 O ATOM 0 H GLU A 126 3.533 15.005 -2.344 1.00 51.40 H new ATOM 0 HA GLU A 126 4.381 13.486 -0.122 1.00 32.33 H new ATOM 0 HB2 GLU A 126 4.421 16.256 -1.059 1.00 63.23 H new ATOM 0 HB3 GLU A 126 4.142 16.180 0.669 1.00 63.23 H new ATOM 0 HG2 GLU A 126 6.170 14.615 0.786 1.00 73.13 H new ATOM 0 HG3 GLU A 126 6.495 15.072 -0.874 1.00 73.13 H new ATOM 1989 N GLN A 127 1.398 14.761 0.056 1.00 75.22 N ATOM 1990 CA GLN A 127 0.141 14.714 0.805 1.00 24.42 C ATOM 1991 C GLN A 127 -0.150 13.299 1.316 1.00 10.02 C ATOM 1992 O GLN A 127 -0.759 13.122 2.370 1.00 62.11 O ATOM 1993 CB GLN A 127 -1.024 15.178 -0.076 1.00 14.34 C ATOM 1994 CG GLN A 127 -0.857 16.574 -0.661 1.00 64.24 C ATOM 1995 CD GLN A 127 -2.037 16.978 -1.520 1.00 4.24 C ATOM 1996 OE1 GLN A 127 -3.008 17.559 -1.038 1.00 32.22 O ATOM 1997 NE2 GLN A 127 -1.964 16.663 -2.799 1.00 60.03 N ATOM 0 H GLN A 127 1.305 15.125 -0.892 1.00 75.22 H new ATOM 0 HA GLN A 127 0.245 15.382 1.660 1.00 24.42 H new ATOM 0 HB2 GLN A 127 -1.150 14.468 -0.893 1.00 14.34 H new ATOM 0 HB3 GLN A 127 -1.941 15.152 0.513 1.00 14.34 H new ATOM 0 HG2 GLN A 127 -0.736 17.294 0.149 1.00 64.24 H new ATOM 0 HG3 GLN A 127 0.054 16.610 -1.258 1.00 64.24 H new ATOM 0 HE21 GLN A 127 -1.141 16.181 -3.159 1.00 60.03 H new ATOM 0 HE22 GLN A 127 -2.731 16.902 -3.428 1.00 60.03 H new ATOM 2006 N TYR A 128 0.292 12.303 0.558 1.00 21.43 N ATOM 2007 CA TYR A 128 0.039 10.906 0.888 1.00 41.23 C ATOM 2008 C TYR A 128 1.098 10.342 1.839 1.00 0.20 C ATOM 2009 O TYR A 128 0.813 9.431 2.618 1.00 43.11 O ATOM 2010 CB TYR A 128 -0.026 10.075 -0.392 1.00 43.20 C ATOM 2011 CG TYR A 128 -1.180 10.452 -1.299 1.00 3.40 C ATOM 2012 CD1 TYR A 128 -2.422 9.850 -1.149 1.00 52.54 C ATOM 2013 CD2 TYR A 128 -1.032 11.409 -2.303 1.00 0.55 C ATOM 2014 CE1 TYR A 128 -3.483 10.186 -1.968 1.00 52.43 C ATOM 2015 CE2 TYR A 128 -2.089 11.749 -3.125 1.00 50.04 C ATOM 2016 CZ TYR A 128 -3.312 11.135 -2.953 1.00 43.13 C ATOM 2017 OH TYR A 128 -4.369 11.476 -3.766 1.00 52.54 O ATOM 0 H TYR A 128 0.832 12.439 -0.297 1.00 21.43 H new ATOM 0 HA TYR A 128 -0.919 10.852 1.404 1.00 41.23 H new ATOM 0 HB2 TYR A 128 0.909 10.192 -0.939 1.00 43.20 H new ATOM 0 HB3 TYR A 128 -0.111 9.021 -0.128 1.00 43.20 H new ATOM 0 HD1 TYR A 128 -2.561 9.106 -0.379 1.00 52.54 H new ATOM 0 HD2 TYR A 128 -0.076 11.892 -2.440 1.00 0.55 H new ATOM 0 HE1 TYR A 128 -4.442 9.707 -1.837 1.00 52.43 H new ATOM 0 HE2 TYR A 128 -1.958 12.492 -3.898 1.00 50.04 H new ATOM 0 HH TYR A 128 -4.082 12.159 -4.407 1.00 52.54 H new ATOM 2027 N GLY A 129 2.311 10.883 1.772 1.00 62.41 N ATOM 2028 CA GLY A 129 3.375 10.416 2.649 1.00 1.33 C ATOM 2029 C GLY A 129 4.731 11.013 2.331 1.00 51.42 C ATOM 2030 O GLY A 129 4.844 11.918 1.503 1.00 24.33 O ATOM 0 H GLY A 129 2.577 11.631 1.132 1.00 62.41 H new ATOM 0 HA2 GLY A 129 3.115 10.655 3.680 1.00 1.33 H new ATOM 0 HA3 GLY A 129 3.440 9.330 2.580 1.00 1.33 H new ATOM 2034 N LYS A 130 5.764 10.510 3.005 1.00 73.50 N ATOM 2035 CA LYS A 130 7.128 11.004 2.841 1.00 53.43 C ATOM 2036 C LYS A 130 7.758 10.500 1.547 1.00 61.30 C ATOM 2037 O LYS A 130 7.782 9.298 1.276 1.00 63.23 O ATOM 2038 CB LYS A 130 7.981 10.560 4.036 1.00 23.41 C ATOM 2039 CG LYS A 130 9.467 10.858 3.883 1.00 12.14 C ATOM 2040 CD LYS A 130 10.279 10.207 4.987 1.00 33.20 C ATOM 2041 CE LYS A 130 11.771 10.392 4.770 1.00 30.14 C ATOM 2042 NZ LYS A 130 12.568 9.436 5.580 1.00 22.21 N ATOM 0 H LYS A 130 5.678 9.749 3.679 1.00 73.50 H new ATOM 0 HA LYS A 130 7.088 12.092 2.792 1.00 53.43 H new ATOM 0 HB2 LYS A 130 7.613 11.054 4.935 1.00 23.41 H new ATOM 0 HB3 LYS A 130 7.850 9.488 4.185 1.00 23.41 H new ATOM 0 HG2 LYS A 130 9.814 10.499 2.914 1.00 12.14 H new ATOM 0 HG3 LYS A 130 9.627 11.936 3.899 1.00 12.14 H new ATOM 0 HD2 LYS A 130 9.995 10.635 5.948 1.00 33.20 H new ATOM 0 HD3 LYS A 130 10.047 9.143 5.031 1.00 33.20 H new ATOM 0 HE2 LYS A 130 12.004 10.257 3.714 1.00 30.14 H new ATOM 0 HE3 LYS A 130 12.053 11.412 5.030 1.00 30.14 H new ATOM 0 HZ1 LYS A 130 13.569 9.719 5.566 1.00 22.21 H new ATOM 0 HZ2 LYS A 130 12.221 9.438 6.560 1.00 22.21 H new ATOM 0 HZ3 LYS A 130 12.473 8.480 5.181 1.00 22.21 H new ATOM 2056 N ILE A 131 8.293 11.428 0.774 1.00 10.51 N ATOM 2057 CA ILE A 131 8.981 11.102 -0.460 1.00 32.32 C ATOM 2058 C ILE A 131 10.493 11.136 -0.240 1.00 11.52 C ATOM 2059 O ILE A 131 11.010 12.025 0.437 1.00 3.33 O ATOM 2060 CB ILE A 131 8.595 12.088 -1.586 1.00 31.23 C ATOM 2061 CG1 ILE A 131 7.082 12.056 -1.820 1.00 25.24 C ATOM 2062 CG2 ILE A 131 9.340 11.758 -2.870 1.00 14.44 C ATOM 2063 CD1 ILE A 131 6.609 12.998 -2.904 1.00 31.44 C ATOM 0 H ILE A 131 8.262 12.426 0.984 1.00 10.51 H new ATOM 0 HA ILE A 131 8.680 10.099 -0.762 1.00 32.32 H new ATOM 0 HB ILE A 131 8.880 13.094 -1.277 1.00 31.23 H new ATOM 0 HG12 ILE A 131 6.786 11.040 -2.081 1.00 25.24 H new ATOM 0 HG13 ILE A 131 6.575 12.306 -0.888 1.00 25.24 H new ATOM 0 HG21 ILE A 131 9.053 12.464 -3.649 1.00 14.44 H new ATOM 0 HG22 ILE A 131 10.414 11.827 -2.696 1.00 14.44 H new ATOM 0 HG23 ILE A 131 9.088 10.746 -3.187 1.00 14.44 H new ATOM 0 HD11 ILE A 131 5.527 12.917 -3.010 1.00 31.44 H new ATOM 0 HD12 ILE A 131 6.872 14.022 -2.637 1.00 31.44 H new ATOM 0 HD13 ILE A 131 7.086 12.735 -3.848 1.00 31.44 H new ATOM 2075 N GLU A 132 11.192 10.156 -0.797 1.00 64.32 N ATOM 2076 CA GLU A 132 12.645 10.105 -0.693 1.00 31.10 C ATOM 2077 C GLU A 132 13.287 10.914 -1.813 1.00 71.22 C ATOM 2078 O GLU A 132 14.119 11.784 -1.564 1.00 70.21 O ATOM 2079 CB GLU A 132 13.156 8.665 -0.750 1.00 55.02 C ATOM 2080 CG GLU A 132 12.615 7.769 0.348 1.00 34.44 C ATOM 2081 CD GLU A 132 13.480 6.543 0.565 1.00 73.11 C ATOM 2082 OE1 GLU A 132 14.461 6.630 1.331 1.00 23.33 O ATOM 2083 OE2 GLU A 132 13.198 5.490 -0.038 1.00 22.04 O ATOM 0 H GLU A 132 10.778 9.387 -1.324 1.00 64.32 H new ATOM 0 HA GLU A 132 12.920 10.534 0.270 1.00 31.10 H new ATOM 0 HB2 GLU A 132 12.892 8.236 -1.717 1.00 55.02 H new ATOM 0 HB3 GLU A 132 14.244 8.675 -0.692 1.00 55.02 H new ATOM 0 HG2 GLU A 132 12.550 8.335 1.277 1.00 34.44 H new ATOM 0 HG3 GLU A 132 11.602 7.457 0.094 1.00 34.44 H new ATOM 2090 N VAL A 133 12.886 10.633 -3.046 1.00 60.32 N ATOM 2091 CA VAL A 133 13.466 11.291 -4.203 1.00 53.20 C ATOM 2092 C VAL A 133 12.476 11.277 -5.371 1.00 34.23 C ATOM 2093 O VAL A 133 11.577 10.434 -5.423 1.00 64.30 O ATOM 2094 CB VAL A 133 14.812 10.629 -4.610 1.00 44.01 C ATOM 2095 CG1 VAL A 133 14.599 9.303 -5.324 1.00 54.43 C ATOM 2096 CG2 VAL A 133 15.644 11.566 -5.466 1.00 53.03 C ATOM 0 H VAL A 133 12.160 9.952 -3.268 1.00 60.32 H new ATOM 0 HA VAL A 133 13.676 12.327 -3.937 1.00 53.20 H new ATOM 0 HB VAL A 133 15.358 10.424 -3.689 1.00 44.01 H new ATOM 0 HG11 VAL A 133 15.565 8.874 -5.591 1.00 54.43 H new ATOM 0 HG12 VAL A 133 14.067 8.617 -4.665 1.00 54.43 H new ATOM 0 HG13 VAL A 133 14.012 9.467 -6.228 1.00 54.43 H new ATOM 0 HG21 VAL A 133 16.580 11.077 -5.736 1.00 53.03 H new ATOM 0 HG22 VAL A 133 15.092 11.818 -6.371 1.00 53.03 H new ATOM 0 HG23 VAL A 133 15.859 12.476 -4.906 1.00 53.03 H new ATOM 2106 N ILE A 134 12.627 12.222 -6.286 1.00 74.41 N ATOM 2107 CA ILE A 134 11.735 12.339 -7.429 1.00 3.52 C ATOM 2108 C ILE A 134 12.507 12.096 -8.716 1.00 53.45 C ATOM 2109 O ILE A 134 13.575 12.670 -8.939 1.00 31.10 O ATOM 2110 CB ILE A 134 11.039 13.729 -7.488 1.00 2.34 C ATOM 2111 CG1 ILE A 134 10.010 13.871 -6.368 1.00 61.25 C ATOM 2112 CG2 ILE A 134 10.365 13.964 -8.837 1.00 40.44 C ATOM 2113 CD1 ILE A 134 10.605 14.275 -5.042 1.00 32.43 C ATOM 0 H ILE A 134 13.366 12.925 -6.258 1.00 74.41 H new ATOM 0 HA ILE A 134 10.957 11.584 -7.315 1.00 3.52 H new ATOM 0 HB ILE A 134 11.816 14.482 -7.357 1.00 2.34 H new ATOM 0 HG12 ILE A 134 9.266 14.611 -6.662 1.00 61.25 H new ATOM 0 HG13 ILE A 134 9.486 12.923 -6.247 1.00 61.25 H new ATOM 0 HG21 ILE A 134 9.890 14.945 -8.840 1.00 40.44 H new ATOM 0 HG22 ILE A 134 11.112 13.920 -9.630 1.00 40.44 H new ATOM 0 HG23 ILE A 134 9.611 13.195 -9.006 1.00 40.44 H new ATOM 0 HD11 ILE A 134 9.813 14.355 -4.297 1.00 32.43 H new ATOM 0 HD12 ILE A 134 11.328 13.524 -4.724 1.00 32.43 H new ATOM 0 HD13 ILE A 134 11.105 15.238 -5.146 1.00 32.43 H new ATOM 2125 N GLU A 135 11.983 11.214 -9.535 1.00 43.53 N ATOM 2126 CA GLU A 135 12.584 10.908 -10.814 1.00 53.44 C ATOM 2127 C GLU A 135 11.825 11.589 -11.952 1.00 64.54 C ATOM 2128 O GLU A 135 10.742 11.162 -12.333 1.00 4.23 O ATOM 2129 CB GLU A 135 12.585 9.390 -10.994 1.00 61.30 C ATOM 2130 CG GLU A 135 13.646 8.691 -10.165 1.00 10.41 C ATOM 2131 CD GLU A 135 13.612 7.187 -10.313 1.00 42.35 C ATOM 2132 OE1 GLU A 135 13.929 6.684 -11.407 1.00 14.32 O ATOM 2133 OE2 GLU A 135 13.288 6.496 -9.329 1.00 73.05 O ATOM 0 H GLU A 135 11.131 10.690 -9.335 1.00 43.53 H new ATOM 0 HA GLU A 135 13.607 11.285 -10.839 1.00 53.44 H new ATOM 0 HB2 GLU A 135 11.605 8.998 -10.723 1.00 61.30 H new ATOM 0 HB3 GLU A 135 12.743 9.155 -12.047 1.00 61.30 H new ATOM 0 HG2 GLU A 135 14.629 9.058 -10.459 1.00 10.41 H new ATOM 0 HG3 GLU A 135 13.509 8.951 -9.115 1.00 10.41 H new ATOM 2140 N ILE A 136 12.393 12.657 -12.487 1.00 72.32 N ATOM 2141 CA ILE A 136 11.816 13.318 -13.649 1.00 41.04 C ATOM 2142 C ILE A 136 12.408 12.712 -14.905 1.00 43.44 C ATOM 2143 O ILE A 136 13.627 12.723 -15.088 1.00 40.15 O ATOM 2144 CB ILE A 136 12.068 14.849 -13.641 1.00 44.34 C ATOM 2145 CG1 ILE A 136 11.488 15.493 -12.371 1.00 65.43 C ATOM 2146 CG2 ILE A 136 11.471 15.501 -14.885 1.00 11.34 C ATOM 2147 CD1 ILE A 136 9.979 15.388 -12.253 1.00 1.41 C ATOM 0 H ILE A 136 13.250 13.085 -12.138 1.00 72.32 H new ATOM 0 HA ILE A 136 10.737 13.167 -13.620 1.00 41.04 H new ATOM 0 HB ILE A 136 13.146 15.012 -13.648 1.00 44.34 H new ATOM 0 HG12 ILE A 136 11.943 15.023 -11.499 1.00 65.43 H new ATOM 0 HG13 ILE A 136 11.770 16.546 -12.350 1.00 65.43 H new ATOM 0 HG21 ILE A 136 11.659 16.574 -14.859 1.00 11.34 H new ATOM 0 HG22 ILE A 136 11.931 15.073 -15.776 1.00 11.34 H new ATOM 0 HG23 ILE A 136 10.396 15.322 -14.910 1.00 11.34 H new ATOM 0 HD11 ILE A 136 9.652 15.867 -11.330 1.00 1.41 H new ATOM 0 HD12 ILE A 136 9.512 15.884 -13.104 1.00 1.41 H new ATOM 0 HD13 ILE A 136 9.687 14.338 -12.240 1.00 1.41 H new ATOM 2159 N MET A 137 11.560 12.162 -15.757 1.00 4.02 N ATOM 2160 CA MET A 137 12.035 11.480 -16.939 1.00 64.21 C ATOM 2161 C MET A 137 12.035 12.422 -18.129 1.00 4.13 C ATOM 2162 O MET A 137 10.986 12.876 -18.599 1.00 65.52 O ATOM 2163 CB MET A 137 11.187 10.244 -17.231 1.00 51.30 C ATOM 2164 CG MET A 137 10.975 9.347 -16.018 1.00 75.13 C ATOM 2165 SD MET A 137 12.510 8.873 -15.198 1.00 22.20 S ATOM 2166 CE MET A 137 13.325 7.975 -16.510 1.00 65.40 C ATOM 0 H MET A 137 10.546 12.176 -15.650 1.00 4.02 H new ATOM 0 HA MET A 137 13.058 11.152 -16.757 1.00 64.21 H new ATOM 0 HB2 MET A 137 10.216 10.562 -17.611 1.00 51.30 H new ATOM 0 HB3 MET A 137 11.665 9.665 -18.021 1.00 51.30 H new ATOM 0 HG2 MET A 137 10.334 9.862 -15.303 1.00 75.13 H new ATOM 0 HG3 MET A 137 10.446 8.447 -16.330 1.00 75.13 H new ATOM 0 HE1 MET A 137 14.193 7.452 -16.108 1.00 65.40 H new ATOM 0 HE2 MET A 137 12.633 7.251 -16.940 1.00 65.40 H new ATOM 0 HE3 MET A 137 13.647 8.673 -17.283 1.00 65.40 H new ATOM 2176 N THR A 138 13.225 12.710 -18.605 1.00 44.21 N ATOM 2177 CA THR A 138 13.414 13.615 -19.713 1.00 73.23 C ATOM 2178 C THR A 138 14.458 13.057 -20.659 1.00 31.43 C ATOM 2179 O THR A 138 15.189 12.129 -20.316 1.00 71.40 O ATOM 2180 CB THR A 138 13.857 15.015 -19.237 1.00 54.52 C ATOM 2181 OG1 THR A 138 14.601 14.911 -18.014 1.00 3.31 O ATOM 2182 CG2 THR A 138 12.661 15.934 -19.039 1.00 14.20 C ATOM 0 H THR A 138 14.091 12.321 -18.232 1.00 44.21 H new ATOM 0 HA THR A 138 12.457 13.715 -20.225 1.00 73.23 H new ATOM 0 HB THR A 138 14.493 15.446 -20.010 1.00 54.52 H new ATOM 0 HG1 THR A 138 14.878 15.805 -17.723 1.00 3.31 H new ATOM 0 HG21 THR A 138 13.005 16.912 -18.704 1.00 14.20 H new ATOM 0 HG22 THR A 138 12.125 16.042 -19.982 1.00 14.20 H new ATOM 0 HG23 THR A 138 11.995 15.507 -18.289 1.00 14.20 H new ATOM 2319 N GLY A 147 7.056 12.904 -21.188 1.00 2.43 N ATOM 2320 CA GLY A 147 5.631 12.739 -20.950 1.00 1.34 C ATOM 2321 C GLY A 147 5.294 11.876 -19.746 1.00 21.12 C ATOM 2322 O GLY A 147 4.128 11.548 -19.531 1.00 61.40 O ATOM 0 HA2 GLY A 147 5.181 13.722 -20.815 1.00 1.34 H new ATOM 0 HA3 GLY A 147 5.175 12.299 -21.837 1.00 1.34 H new ATOM 2326 N PHE A 148 6.292 11.522 -18.944 1.00 64.42 N ATOM 2327 CA PHE A 148 6.062 10.712 -17.761 1.00 34.30 C ATOM 2328 C PHE A 148 7.166 10.947 -16.738 1.00 61.15 C ATOM 2329 O PHE A 148 8.256 11.407 -17.080 1.00 3.03 O ATOM 2330 CB PHE A 148 5.927 9.210 -18.101 1.00 2.31 C ATOM 2331 CG PHE A 148 7.146 8.557 -18.701 1.00 54.32 C ATOM 2332 CD1 PHE A 148 8.110 7.974 -17.893 1.00 20.51 C ATOM 2333 CD2 PHE A 148 7.314 8.504 -20.072 1.00 51.01 C ATOM 2334 CE1 PHE A 148 9.215 7.356 -18.445 1.00 33.10 C ATOM 2335 CE2 PHE A 148 8.420 7.891 -20.628 1.00 74.31 C ATOM 2336 CZ PHE A 148 9.372 7.316 -19.814 1.00 72.11 C ATOM 0 H PHE A 148 7.266 11.785 -19.094 1.00 64.42 H new ATOM 0 HA PHE A 148 5.111 11.022 -17.327 1.00 34.30 H new ATOM 0 HB2 PHE A 148 5.663 8.674 -17.190 1.00 2.31 H new ATOM 0 HB3 PHE A 148 5.095 9.088 -18.795 1.00 2.31 H new ATOM 0 HD1 PHE A 148 7.996 8.003 -16.819 1.00 20.51 H new ATOM 0 HD2 PHE A 148 6.570 8.948 -20.717 1.00 51.01 H new ATOM 0 HE1 PHE A 148 9.957 6.904 -17.803 1.00 33.10 H new ATOM 0 HE2 PHE A 148 8.539 7.862 -21.701 1.00 74.31 H new ATOM 0 HZ PHE A 148 10.237 6.836 -20.247 1.00 72.11 H new ATOM 2346 N ALA A 149 6.857 10.657 -15.488 1.00 33.43 N ATOM 2347 CA ALA A 149 7.781 10.822 -14.389 1.00 35.22 C ATOM 2348 C ALA A 149 7.665 9.640 -13.431 1.00 32.33 C ATOM 2349 O ALA A 149 6.830 8.752 -13.617 1.00 23.23 O ATOM 2350 CB ALA A 149 7.515 12.135 -13.657 1.00 4.03 C ATOM 0 H ALA A 149 5.945 10.296 -15.207 1.00 33.43 H new ATOM 0 HA ALA A 149 8.796 10.855 -14.785 1.00 35.22 H new ATOM 0 HB1 ALA A 149 8.220 12.242 -12.833 1.00 4.03 H new ATOM 0 HB2 ALA A 149 7.637 12.968 -14.349 1.00 4.03 H new ATOM 0 HB3 ALA A 149 6.498 12.134 -13.266 1.00 4.03 H new ATOM 2356 N PHE A 150 8.502 9.645 -12.414 1.00 74.33 N ATOM 2357 CA PHE A 150 8.519 8.600 -11.403 1.00 42.14 C ATOM 2358 C PHE A 150 8.757 9.216 -10.032 1.00 10.53 C ATOM 2359 O PHE A 150 9.409 10.248 -9.910 1.00 74.11 O ATOM 2360 CB PHE A 150 9.605 7.567 -11.708 1.00 22.42 C ATOM 2361 CG PHE A 150 9.219 6.543 -12.738 1.00 41.23 C ATOM 2362 CD1 PHE A 150 8.586 5.370 -12.367 1.00 24.25 C ATOM 2363 CD2 PHE A 150 9.499 6.753 -14.076 1.00 60.43 C ATOM 2364 CE1 PHE A 150 8.237 4.426 -13.313 1.00 24.13 C ATOM 2365 CE2 PHE A 150 9.155 5.815 -15.025 1.00 74.52 C ATOM 2366 CZ PHE A 150 8.522 4.648 -14.645 1.00 15.13 C ATOM 0 H PHE A 150 9.195 10.378 -12.262 1.00 74.33 H new ATOM 0 HA PHE A 150 7.554 8.094 -11.410 1.00 42.14 H new ATOM 0 HB2 PHE A 150 10.499 8.088 -12.050 1.00 22.42 H new ATOM 0 HB3 PHE A 150 9.869 7.053 -10.784 1.00 22.42 H new ATOM 0 HD1 PHE A 150 8.362 5.190 -11.326 1.00 24.25 H new ATOM 0 HD2 PHE A 150 9.993 7.664 -14.381 1.00 60.43 H new ATOM 0 HE1 PHE A 150 7.742 3.515 -13.011 1.00 24.13 H new ATOM 0 HE2 PHE A 150 9.380 5.993 -16.066 1.00 74.52 H new ATOM 0 HZ PHE A 150 8.251 3.912 -15.387 1.00 15.13 H new ATOM 2376 N VAL A 151 8.208 8.597 -9.007 1.00 22.21 N ATOM 2377 CA VAL A 151 8.347 9.103 -7.644 1.00 73.00 C ATOM 2378 C VAL A 151 8.714 7.978 -6.685 1.00 71.35 C ATOM 2379 O VAL A 151 8.089 6.914 -6.691 1.00 34.33 O ATOM 2380 CB VAL A 151 7.052 9.801 -7.151 1.00 40.13 C ATOM 2381 CG1 VAL A 151 7.210 10.314 -5.727 1.00 41.44 C ATOM 2382 CG2 VAL A 151 6.672 10.945 -8.072 1.00 11.34 C ATOM 0 H VAL A 151 7.659 7.741 -9.085 1.00 22.21 H new ATOM 0 HA VAL A 151 9.148 9.842 -7.660 1.00 73.00 H new ATOM 0 HB VAL A 151 6.255 9.058 -7.164 1.00 40.13 H new ATOM 0 HG11 VAL A 151 6.286 10.798 -5.410 1.00 41.44 H new ATOM 0 HG12 VAL A 151 7.429 9.479 -5.062 1.00 41.44 H new ATOM 0 HG13 VAL A 151 8.028 11.033 -5.688 1.00 41.44 H new ATOM 0 HG21 VAL A 151 5.761 11.419 -7.706 1.00 11.34 H new ATOM 0 HG22 VAL A 151 7.479 11.678 -8.094 1.00 11.34 H new ATOM 0 HG23 VAL A 151 6.503 10.561 -9.078 1.00 11.34 H new ATOM 2392 N THR A 152 9.738 8.222 -5.877 1.00 54.23 N ATOM 2393 CA THR A 152 10.192 7.266 -4.883 1.00 24.04 C ATOM 2394 C THR A 152 9.730 7.682 -3.485 1.00 53.25 C ATOM 2395 O THR A 152 10.012 8.791 -3.037 1.00 2.03 O ATOM 2396 CB THR A 152 11.729 7.170 -4.890 1.00 71.12 C ATOM 2397 OG1 THR A 152 12.192 6.659 -6.143 1.00 1.24 O ATOM 2398 CG2 THR A 152 12.230 6.292 -3.754 1.00 72.44 C ATOM 0 H THR A 152 10.275 9.089 -5.895 1.00 54.23 H new ATOM 0 HA THR A 152 9.763 6.296 -5.134 1.00 24.04 H new ATOM 0 HB THR A 152 12.126 8.175 -4.747 1.00 71.12 H new ATOM 0 HG1 THR A 152 13.170 6.605 -6.133 1.00 1.24 H new ATOM 0 HG21 THR A 152 13.318 6.243 -3.785 1.00 72.44 H new ATOM 0 HG22 THR A 152 11.912 6.714 -2.801 1.00 72.44 H new ATOM 0 HG23 THR A 152 11.819 5.288 -3.861 1.00 72.44 H new ATOM 2406 N PHE A 153 9.047 6.786 -2.796 1.00 21.12 N ATOM 2407 CA PHE A 153 8.548 7.058 -1.459 1.00 60.34 C ATOM 2408 C PHE A 153 9.371 6.335 -0.408 1.00 72.14 C ATOM 2409 O PHE A 153 10.106 5.396 -0.714 1.00 41.23 O ATOM 2410 CB PHE A 153 7.093 6.627 -1.341 1.00 34.30 C ATOM 2411 CG PHE A 153 6.114 7.727 -1.612 1.00 54.25 C ATOM 2412 CD1 PHE A 153 5.789 8.089 -2.907 1.00 4.31 C ATOM 2413 CD2 PHE A 153 5.515 8.393 -0.563 1.00 32.44 C ATOM 2414 CE1 PHE A 153 4.880 9.098 -3.144 1.00 72.22 C ATOM 2415 CE2 PHE A 153 4.609 9.403 -0.793 1.00 44.41 C ATOM 2416 CZ PHE A 153 4.290 9.754 -2.083 1.00 33.23 C ATOM 0 H PHE A 153 8.823 5.854 -3.144 1.00 21.12 H new ATOM 0 HA PHE A 153 8.628 8.132 -1.288 1.00 60.34 H new ATOM 0 HB2 PHE A 153 6.908 5.809 -2.037 1.00 34.30 H new ATOM 0 HB3 PHE A 153 6.919 6.237 -0.338 1.00 34.30 H new ATOM 0 HD1 PHE A 153 6.251 7.577 -3.738 1.00 4.31 H new ATOM 0 HD2 PHE A 153 5.760 8.118 0.452 1.00 32.44 H new ATOM 0 HE1 PHE A 153 4.630 9.374 -4.158 1.00 72.22 H new ATOM 0 HE2 PHE A 153 4.150 9.918 0.038 1.00 44.41 H new ATOM 0 HZ PHE A 153 3.577 10.544 -2.266 1.00 33.23 H new ATOM 2426 N ASP A 154 9.238 6.784 0.832 1.00 21.31 N ATOM 2427 CA ASP A 154 9.906 6.146 1.960 1.00 51.44 C ATOM 2428 C ASP A 154 9.097 4.946 2.443 1.00 15.14 C ATOM 2429 O ASP A 154 9.651 3.972 2.957 1.00 10.34 O ATOM 2430 CB ASP A 154 10.093 7.153 3.099 1.00 41.12 C ATOM 2431 CG ASP A 154 10.957 6.626 4.232 1.00 71.00 C ATOM 2432 OD1 ASP A 154 10.457 5.854 5.074 1.00 33.43 O ATOM 2433 OD2 ASP A 154 12.141 7.005 4.301 1.00 33.35 O ATOM 0 H ASP A 154 8.670 7.593 1.084 1.00 21.31 H new ATOM 0 HA ASP A 154 10.886 5.797 1.636 1.00 51.44 H new ATOM 0 HB2 ASP A 154 10.544 8.062 2.701 1.00 41.12 H new ATOM 0 HB3 ASP A 154 9.116 7.429 3.495 1.00 41.12 H new ATOM 2438 N ASP A 155 7.784 5.016 2.261 1.00 4.23 N ATOM 2439 CA ASP A 155 6.895 3.949 2.691 1.00 72.14 C ATOM 2440 C ASP A 155 6.046 3.464 1.520 1.00 62.12 C ATOM 2441 O ASP A 155 5.655 4.254 0.659 1.00 54.42 O ATOM 2442 CB ASP A 155 5.984 4.435 3.824 1.00 50.22 C ATOM 2443 CG ASP A 155 5.536 3.309 4.741 1.00 13.43 C ATOM 2444 OD1 ASP A 155 5.079 2.261 4.243 1.00 15.31 O ATOM 2445 OD2 ASP A 155 5.656 3.460 5.971 1.00 74.11 O ATOM 0 H ASP A 155 7.312 5.804 1.817 1.00 4.23 H new ATOM 0 HA ASP A 155 7.504 3.122 3.057 1.00 72.14 H new ATOM 0 HB2 ASP A 155 6.511 5.188 4.411 1.00 50.22 H new ATOM 0 HB3 ASP A 155 5.107 4.920 3.396 1.00 50.22 H new ATOM 2450 N HIS A 156 5.769 2.165 1.489 1.00 11.44 N ATOM 2451 CA HIS A 156 4.908 1.584 0.461 1.00 55.31 C ATOM 2452 C HIS A 156 3.455 1.984 0.705 1.00 2.34 C ATOM 2453 O HIS A 156 2.657 2.061 -0.228 1.00 53.24 O ATOM 2454 CB HIS A 156 5.045 0.048 0.431 1.00 21.23 C ATOM 2455 CG HIS A 156 4.629 -0.649 1.702 1.00 52.14 C ATOM 2456 ND1 HIS A 156 3.309 -0.772 2.059 1.00 44.33 N ATOM 2457 CD2 HIS A 156 5.393 -1.207 2.666 1.00 74.11 C ATOM 2458 CE1 HIS A 156 3.307 -1.387 3.222 1.00 13.14 C ATOM 2459 NE2 HIS A 156 4.545 -1.673 3.628 1.00 54.21 N ATOM 0 H HIS A 156 6.129 1.491 2.165 1.00 11.44 H new ATOM 0 HA HIS A 156 5.223 1.970 -0.508 1.00 55.31 H new ATOM 0 HB2 HIS A 156 4.446 -0.340 -0.393 1.00 21.23 H new ATOM 0 HB3 HIS A 156 6.083 -0.206 0.217 1.00 21.23 H new ATOM 0 HD2 HIS A 156 6.471 -1.272 2.674 1.00 74.11 H new ATOM 0 HE1 HIS A 156 2.414 -1.630 3.779 1.00 13.14 H new ATOM 0 HE2 HIS A 156 4.807 -2.149 4.491 1.00 54.21 H new ATOM 2467 N ASP A 157 3.148 2.255 1.975 1.00 35.13 N ATOM 2468 CA ASP A 157 1.806 2.627 2.414 1.00 55.44 C ATOM 2469 C ASP A 157 1.285 3.832 1.646 1.00 42.44 C ATOM 2470 O ASP A 157 0.145 3.837 1.183 1.00 42.14 O ATOM 2471 CB ASP A 157 1.824 2.908 3.928 1.00 30.14 C ATOM 2472 CG ASP A 157 0.908 4.042 4.356 1.00 65.20 C ATOM 2473 OD1 ASP A 157 -0.298 3.794 4.573 1.00 52.24 O ATOM 2474 OD2 ASP A 157 1.395 5.190 4.472 1.00 10.44 O ATOM 0 H ASP A 157 3.831 2.222 2.732 1.00 35.13 H new ATOM 0 HA ASP A 157 1.129 1.798 2.210 1.00 55.44 H new ATOM 0 HB2 ASP A 157 1.535 2.001 4.459 1.00 30.14 H new ATOM 0 HB3 ASP A 157 2.844 3.144 4.231 1.00 30.14 H new ATOM 2479 N SER A 158 2.136 4.833 1.489 1.00 50.23 N ATOM 2480 CA SER A 158 1.751 6.065 0.836 1.00 14.32 C ATOM 2481 C SER A 158 1.571 5.861 -0.667 1.00 13.22 C ATOM 2482 O SER A 158 0.689 6.463 -1.277 1.00 44.04 O ATOM 2483 CB SER A 158 2.808 7.120 1.118 1.00 11.42 C ATOM 2484 OG SER A 158 3.208 7.079 2.481 1.00 71.44 O ATOM 0 H SER A 158 3.104 4.812 1.809 1.00 50.23 H new ATOM 0 HA SER A 158 0.791 6.396 1.231 1.00 14.32 H new ATOM 0 HB2 SER A 158 3.673 6.956 0.475 1.00 11.42 H new ATOM 0 HB3 SER A 158 2.415 8.108 0.879 1.00 11.42 H new ATOM 0 HG SER A 158 4.177 7.211 2.542 1.00 71.44 H new ATOM 2490 N VAL A 159 2.372 4.966 -1.246 1.00 31.22 N ATOM 2491 CA VAL A 159 2.312 4.693 -2.672 1.00 1.33 C ATOM 2492 C VAL A 159 1.045 3.925 -3.003 1.00 10.12 C ATOM 2493 O VAL A 159 0.398 4.181 -4.020 1.00 40.42 O ATOM 2494 CB VAL A 159 3.570 3.914 -3.134 1.00 31.31 C ATOM 2495 CG1 VAL A 159 3.276 2.946 -4.278 1.00 41.00 C ATOM 2496 CG2 VAL A 159 4.643 4.899 -3.544 1.00 55.14 C ATOM 0 H VAL A 159 3.070 4.419 -0.743 1.00 31.22 H new ATOM 0 HA VAL A 159 2.291 5.641 -3.210 1.00 1.33 H new ATOM 0 HB VAL A 159 3.913 3.310 -2.294 1.00 31.31 H new ATOM 0 HG11 VAL A 159 4.192 2.428 -4.561 1.00 41.00 H new ATOM 0 HG12 VAL A 159 2.532 2.218 -3.956 1.00 41.00 H new ATOM 0 HG13 VAL A 159 2.894 3.501 -5.135 1.00 41.00 H new ATOM 0 HG21 VAL A 159 5.530 4.356 -3.870 1.00 55.14 H new ATOM 0 HG22 VAL A 159 4.275 5.518 -4.363 1.00 55.14 H new ATOM 0 HG23 VAL A 159 4.898 5.534 -2.695 1.00 55.14 H new ATOM 2506 N ASP A 160 0.686 3.011 -2.119 1.00 74.04 N ATOM 2507 CA ASP A 160 -0.494 2.199 -2.323 1.00 10.30 C ATOM 2508 C ASP A 160 -1.759 3.051 -2.250 1.00 72.14 C ATOM 2509 O ASP A 160 -2.713 2.809 -2.985 1.00 24.35 O ATOM 2510 CB ASP A 160 -0.553 1.051 -1.332 1.00 52.52 C ATOM 2511 CG ASP A 160 -1.276 -0.139 -1.921 1.00 22.25 C ATOM 2512 OD1 ASP A 160 -0.624 -0.943 -2.624 1.00 52.34 O ATOM 2513 OD2 ASP A 160 -2.493 -0.259 -1.708 1.00 22.45 O ATOM 0 H ASP A 160 1.194 2.815 -1.257 1.00 74.04 H new ATOM 0 HA ASP A 160 -0.433 1.768 -3.322 1.00 10.30 H new ATOM 0 HB2 ASP A 160 0.458 0.761 -1.046 1.00 52.52 H new ATOM 0 HB3 ASP A 160 -1.061 1.376 -0.424 1.00 52.52 H new ATOM 2518 N LYS A 161 -1.741 4.080 -1.389 1.00 43.14 N ATOM 2519 CA LYS A 161 -2.832 5.068 -1.333 1.00 11.43 C ATOM 2520 C LYS A 161 -3.036 5.709 -2.698 1.00 34.23 C ATOM 2521 O LYS A 161 -4.161 5.942 -3.141 1.00 72.22 O ATOM 2522 CB LYS A 161 -2.516 6.196 -0.349 1.00 2.40 C ATOM 2523 CG LYS A 161 -2.267 5.763 1.079 1.00 23.22 C ATOM 2524 CD LYS A 161 -1.866 6.958 1.931 1.00 31.04 C ATOM 2525 CE LYS A 161 -1.375 6.539 3.304 1.00 11.15 C ATOM 2526 NZ LYS A 161 -0.916 7.698 4.113 1.00 41.04 N ATOM 0 H LYS A 161 -0.987 4.250 -0.724 1.00 43.14 H new ATOM 0 HA LYS A 161 -3.725 4.532 -1.012 1.00 11.43 H new ATOM 0 HB2 LYS A 161 -1.636 6.731 -0.707 1.00 2.40 H new ATOM 0 HB3 LYS A 161 -3.345 6.904 -0.356 1.00 2.40 H new ATOM 0 HG2 LYS A 161 -3.166 5.301 1.488 1.00 23.22 H new ATOM 0 HG3 LYS A 161 -1.481 5.009 1.106 1.00 23.22 H new ATOM 0 HD2 LYS A 161 -1.083 7.520 1.422 1.00 31.04 H new ATOM 0 HD3 LYS A 161 -2.719 7.628 2.040 1.00 31.04 H new ATOM 0 HE2 LYS A 161 -2.176 6.023 3.833 1.00 11.15 H new ATOM 0 HE3 LYS A 161 -0.556 5.828 3.194 1.00 11.15 H new ATOM 0 HZ1 LYS A 161 -0.391 7.356 4.943 1.00 41.04 H new ATOM 0 HZ2 LYS A 161 -0.296 8.301 3.535 1.00 41.04 H new ATOM 0 HZ3 LYS A 161 -1.740 8.250 4.427 1.00 41.04 H new ATOM 2540 N ILE A 162 -1.918 5.992 -3.340 1.00 22.24 N ATOM 2541 CA ILE A 162 -1.893 6.698 -4.603 1.00 3.31 C ATOM 2542 C ILE A 162 -2.364 5.824 -5.765 1.00 23.04 C ATOM 2543 O ILE A 162 -3.199 6.245 -6.553 1.00 75.11 O ATOM 2544 CB ILE A 162 -0.473 7.230 -4.870 1.00 21.51 C ATOM 2545 CG1 ILE A 162 -0.151 8.343 -3.885 1.00 0.52 C ATOM 2546 CG2 ILE A 162 -0.329 7.725 -6.292 1.00 24.30 C ATOM 2547 CD1 ILE A 162 1.320 8.483 -3.593 1.00 35.13 C ATOM 0 H ILE A 162 -0.994 5.735 -2.994 1.00 22.24 H new ATOM 0 HA ILE A 162 -2.590 7.533 -4.532 1.00 3.31 H new ATOM 0 HB ILE A 162 0.233 6.411 -4.733 1.00 21.51 H new ATOM 0 HG12 ILE A 162 -0.526 9.287 -4.281 1.00 0.52 H new ATOM 0 HG13 ILE A 162 -0.682 8.156 -2.952 1.00 0.52 H new ATOM 0 HG21 ILE A 162 0.685 8.094 -6.448 1.00 24.30 H new ATOM 0 HG22 ILE A 162 -0.528 6.907 -6.984 1.00 24.30 H new ATOM 0 HG23 ILE A 162 -1.040 8.532 -6.470 1.00 24.30 H new ATOM 0 HD11 ILE A 162 1.474 9.296 -2.883 1.00 35.13 H new ATOM 0 HD12 ILE A 162 1.697 7.553 -3.167 1.00 35.13 H new ATOM 0 HD13 ILE A 162 1.855 8.702 -4.517 1.00 35.13 H new ATOM 2559 N VAL A 163 -1.885 4.590 -5.837 1.00 63.13 N ATOM 2560 CA VAL A 163 -2.177 3.730 -6.988 1.00 21.21 C ATOM 2561 C VAL A 163 -3.613 3.202 -6.929 1.00 24.45 C ATOM 2562 O VAL A 163 -4.114 2.606 -7.883 1.00 50.32 O ATOM 2563 CB VAL A 163 -1.188 2.554 -7.075 1.00 54.24 C ATOM 2564 CG1 VAL A 163 0.238 3.069 -7.080 1.00 52.32 C ATOM 2565 CG2 VAL A 163 -1.402 1.586 -5.929 1.00 63.21 C ATOM 0 H VAL A 163 -1.298 4.160 -5.123 1.00 63.13 H new ATOM 0 HA VAL A 163 -2.065 4.340 -7.884 1.00 21.21 H new ATOM 0 HB VAL A 163 -1.368 2.019 -8.007 1.00 54.24 H new ATOM 0 HG11 VAL A 163 0.928 2.228 -7.142 1.00 52.32 H new ATOM 0 HG12 VAL A 163 0.385 3.723 -7.939 1.00 52.32 H new ATOM 0 HG13 VAL A 163 0.427 3.627 -6.163 1.00 52.32 H new ATOM 0 HG21 VAL A 163 -0.692 0.763 -6.011 1.00 63.21 H new ATOM 0 HG22 VAL A 163 -1.250 2.104 -4.982 1.00 63.21 H new ATOM 0 HG23 VAL A 163 -2.418 1.194 -5.969 1.00 63.21 H new ATOM 2575 N ILE A 164 -4.251 3.426 -5.783 1.00 14.13 N ATOM 2576 CA ILE A 164 -5.672 3.175 -5.612 1.00 22.22 C ATOM 2577 C ILE A 164 -6.479 4.062 -6.567 1.00 13.33 C ATOM 2578 O ILE A 164 -7.533 3.668 -7.072 1.00 62.43 O ATOM 2579 CB ILE A 164 -6.086 3.418 -4.136 1.00 64.45 C ATOM 2580 CG1 ILE A 164 -5.775 2.170 -3.299 1.00 13.44 C ATOM 2581 CG2 ILE A 164 -7.557 3.799 -4.018 1.00 12.40 C ATOM 2582 CD1 ILE A 164 -5.903 2.378 -1.803 1.00 73.30 C ATOM 0 H ILE A 164 -3.792 3.788 -4.947 1.00 14.13 H new ATOM 0 HA ILE A 164 -5.884 2.133 -5.853 1.00 22.22 H new ATOM 0 HB ILE A 164 -5.507 4.258 -3.753 1.00 64.45 H new ATOM 0 HG12 ILE A 164 -6.447 1.367 -3.602 1.00 13.44 H new ATOM 0 HG13 ILE A 164 -4.761 1.839 -3.523 1.00 13.44 H new ATOM 0 HG21 ILE A 164 -7.808 3.961 -2.970 1.00 12.40 H new ATOM 0 HG22 ILE A 164 -7.742 4.714 -4.581 1.00 12.40 H new ATOM 0 HG23 ILE A 164 -8.174 2.995 -4.419 1.00 12.40 H new ATOM 0 HD11 ILE A 164 -5.667 1.449 -1.285 1.00 73.30 H new ATOM 0 HD12 ILE A 164 -5.211 3.158 -1.484 1.00 73.30 H new ATOM 0 HD13 ILE A 164 -6.923 2.678 -1.563 1.00 73.30 H new ATOM 2594 N GLN A 165 -5.947 5.246 -6.841 1.00 25.24 N ATOM 2595 CA GLN A 165 -6.559 6.164 -7.782 1.00 5.02 C ATOM 2596 C GLN A 165 -5.716 6.203 -9.049 1.00 2.54 C ATOM 2597 O GLN A 165 -4.638 6.791 -9.063 1.00 14.41 O ATOM 2598 CB GLN A 165 -6.676 7.566 -7.178 1.00 41.21 C ATOM 2599 CG GLN A 165 -7.378 7.597 -5.831 1.00 12.21 C ATOM 2600 CD GLN A 165 -7.568 9.004 -5.295 1.00 12.11 C ATOM 2601 OE1 GLN A 165 -7.720 9.964 -6.053 1.00 21.44 O ATOM 2602 NE2 GLN A 165 -7.548 9.136 -3.980 1.00 13.42 N ATOM 0 H GLN A 165 -5.085 5.592 -6.419 1.00 25.24 H new ATOM 0 HA GLN A 165 -7.566 5.819 -8.018 1.00 5.02 H new ATOM 0 HB2 GLN A 165 -5.677 7.988 -7.066 1.00 41.21 H new ATOM 0 HB3 GLN A 165 -7.217 8.207 -7.874 1.00 41.21 H new ATOM 0 HG2 GLN A 165 -8.351 7.115 -5.923 1.00 12.21 H new ATOM 0 HG3 GLN A 165 -6.800 7.015 -5.113 1.00 12.21 H new ATOM 0 HE21 GLN A 165 -7.420 8.316 -3.387 1.00 13.42 H new ATOM 0 HE22 GLN A 165 -7.661 10.058 -3.558 1.00 13.42 H new ATOM 2611 N LYS A 166 -6.206 5.538 -10.094 1.00 34.23 N ATOM 2612 CA LYS A 166 -5.479 5.404 -11.358 1.00 52.12 C ATOM 2613 C LYS A 166 -5.048 6.752 -11.937 1.00 32.32 C ATOM 2614 O LYS A 166 -3.996 6.859 -12.555 1.00 64.20 O ATOM 2615 CB LYS A 166 -6.339 4.659 -12.378 1.00 11.51 C ATOM 2616 CG LYS A 166 -5.601 4.325 -13.661 1.00 14.40 C ATOM 2617 CD LYS A 166 -6.459 3.495 -14.597 1.00 52.21 C ATOM 2618 CE LYS A 166 -6.596 2.062 -14.112 1.00 12.34 C ATOM 2619 NZ LYS A 166 -7.458 1.253 -15.013 1.00 22.24 N ATOM 0 H LYS A 166 -7.116 5.077 -10.090 1.00 34.23 H new ATOM 0 HA LYS A 166 -4.572 4.838 -11.145 1.00 52.12 H new ATOM 0 HB2 LYS A 166 -6.705 3.736 -11.928 1.00 11.51 H new ATOM 0 HB3 LYS A 166 -7.212 5.266 -12.618 1.00 11.51 H new ATOM 0 HG2 LYS A 166 -5.303 5.247 -14.161 1.00 14.40 H new ATOM 0 HG3 LYS A 166 -4.687 3.780 -13.425 1.00 14.40 H new ATOM 0 HD2 LYS A 166 -7.447 3.947 -14.681 1.00 52.21 H new ATOM 0 HD3 LYS A 166 -6.020 3.501 -15.595 1.00 52.21 H new ATOM 0 HE2 LYS A 166 -5.609 1.605 -14.047 1.00 12.34 H new ATOM 0 HE3 LYS A 166 -7.017 2.057 -13.106 1.00 12.34 H new ATOM 0 HZ1 LYS A 166 -7.302 0.242 -14.827 1.00 22.24 H new ATOM 0 HZ2 LYS A 166 -8.457 1.487 -14.840 1.00 22.24 H new ATOM 0 HZ3 LYS A 166 -7.219 1.463 -16.003 1.00 22.24 H new ATOM 2633 N TYR A 167 -5.864 7.772 -11.755 1.00 5.13 N ATOM 2634 CA TYR A 167 -5.529 9.096 -12.253 1.00 23.01 C ATOM 2635 C TYR A 167 -5.504 10.117 -11.127 1.00 64.31 C ATOM 2636 O TYR A 167 -6.353 10.096 -10.236 1.00 54.45 O ATOM 2637 CB TYR A 167 -6.524 9.532 -13.325 1.00 61.01 C ATOM 2638 CG TYR A 167 -6.358 8.805 -14.643 1.00 62.54 C ATOM 2639 CD1 TYR A 167 -6.955 7.572 -14.862 1.00 40.25 C ATOM 2640 CD2 TYR A 167 -5.595 9.355 -15.666 1.00 43.20 C ATOM 2641 CE1 TYR A 167 -6.799 6.909 -16.062 1.00 63.31 C ATOM 2642 CE2 TYR A 167 -5.437 8.699 -16.870 1.00 63.30 C ATOM 2643 CZ TYR A 167 -6.040 7.477 -17.062 1.00 73.35 C ATOM 2644 OH TYR A 167 -5.885 6.820 -18.258 1.00 51.02 O ATOM 0 H TYR A 167 -6.759 7.713 -11.269 1.00 5.13 H new ATOM 0 HA TYR A 167 -4.532 9.042 -12.691 1.00 23.01 H new ATOM 0 HB2 TYR A 167 -7.537 9.369 -12.956 1.00 61.01 H new ATOM 0 HB3 TYR A 167 -6.415 10.603 -13.495 1.00 61.01 H new ATOM 0 HD1 TYR A 167 -7.551 7.124 -14.081 1.00 40.25 H new ATOM 0 HD2 TYR A 167 -5.118 10.312 -15.516 1.00 43.20 H new ATOM 0 HE1 TYR A 167 -7.270 5.949 -16.217 1.00 63.31 H new ATOM 0 HE2 TYR A 167 -4.844 9.142 -17.656 1.00 63.30 H new ATOM 0 HH TYR A 167 -5.322 7.356 -18.855 1.00 51.02 H new ATOM 2654 N HIS A 168 -4.512 10.992 -11.168 1.00 14.12 N ATOM 2655 CA HIS A 168 -4.386 12.081 -10.205 1.00 21.40 C ATOM 2656 C HIS A 168 -4.167 13.400 -10.931 1.00 53.22 C ATOM 2657 O HIS A 168 -3.516 13.436 -11.970 1.00 64.54 O ATOM 2658 CB HIS A 168 -3.206 11.837 -9.267 1.00 64.34 C ATOM 2659 CG HIS A 168 -3.412 10.729 -8.282 1.00 24.31 C ATOM 2660 ND1 HIS A 168 -4.135 10.906 -7.125 1.00 73.14 N ATOM 2661 CD2 HIS A 168 -2.961 9.466 -8.327 1.00 43.02 C ATOM 2662 CE1 HIS A 168 -4.105 9.739 -6.507 1.00 22.31 C ATOM 2663 NE2 HIS A 168 -3.403 8.843 -7.196 1.00 62.23 N ATOM 0 H HIS A 168 -3.771 10.970 -11.868 1.00 14.12 H new ATOM 0 HA HIS A 168 -5.308 12.124 -9.625 1.00 21.40 H new ATOM 0 HB2 HIS A 168 -2.323 11.614 -9.866 1.00 64.34 H new ATOM 0 HB3 HIS A 168 -2.997 12.757 -8.721 1.00 64.34 H new ATOM 0 HD2 HIS A 168 -2.362 9.026 -9.110 1.00 43.02 H new ATOM 0 HE1 HIS A 168 -4.589 9.538 -5.563 1.00 22.31 H new ATOM 0 HE2 HIS A 168 -3.228 7.874 -6.929 1.00 62.23 H new ATOM 2671 N THR A 169 -4.688 14.482 -10.378 1.00 40.15 N ATOM 2672 CA THR A 169 -4.531 15.788 -10.997 1.00 41.34 C ATOM 2673 C THR A 169 -3.488 16.620 -10.262 1.00 3.40 C ATOM 2674 O THR A 169 -3.664 16.974 -9.097 1.00 45.34 O ATOM 2675 CB THR A 169 -5.864 16.559 -11.045 1.00 42.41 C ATOM 2676 OG1 THR A 169 -6.879 15.736 -11.637 1.00 74.54 O ATOM 2677 CG2 THR A 169 -5.722 17.849 -11.848 1.00 13.24 C ATOM 0 H THR A 169 -5.220 14.483 -9.508 1.00 40.15 H new ATOM 0 HA THR A 169 -4.195 15.615 -12.019 1.00 41.34 H new ATOM 0 HB THR A 169 -6.146 16.816 -10.024 1.00 42.41 H new ATOM 0 HG1 THR A 169 -7.725 16.229 -11.664 1.00 74.54 H new ATOM 0 HG21 THR A 169 -6.677 18.373 -11.866 1.00 13.24 H new ATOM 0 HG22 THR A 169 -4.968 18.485 -11.385 1.00 13.24 H new ATOM 0 HG23 THR A 169 -5.419 17.611 -12.868 1.00 13.24 H new ATOM 2685 N VAL A 170 -2.399 16.914 -10.954 1.00 63.22 N ATOM 2686 CA VAL A 170 -1.340 17.750 -10.416 1.00 41.54 C ATOM 2687 C VAL A 170 -0.804 18.654 -11.522 1.00 12.30 C ATOM 2688 O VAL A 170 -0.800 18.257 -12.689 1.00 34.50 O ATOM 2689 CB VAL A 170 -0.201 16.897 -9.795 1.00 51.24 C ATOM 2690 CG1 VAL A 170 0.336 15.868 -10.778 1.00 70.43 C ATOM 2691 CG2 VAL A 170 0.928 17.776 -9.288 1.00 2.45 C ATOM 0 H VAL A 170 -2.225 16.580 -11.902 1.00 63.22 H new ATOM 0 HA VAL A 170 -1.750 18.364 -9.614 1.00 41.54 H new ATOM 0 HB VAL A 170 -0.632 16.361 -8.950 1.00 51.24 H new ATOM 0 HG11 VAL A 170 1.131 15.292 -10.304 1.00 70.43 H new ATOM 0 HG12 VAL A 170 -0.469 15.197 -11.078 1.00 70.43 H new ATOM 0 HG13 VAL A 170 0.731 16.376 -11.658 1.00 70.43 H new ATOM 0 HG21 VAL A 170 1.711 17.151 -8.859 1.00 2.45 H new ATOM 0 HG22 VAL A 170 1.338 18.355 -10.116 1.00 2.45 H new ATOM 0 HG23 VAL A 170 0.546 18.455 -8.525 1.00 2.45 H new ATOM 2701 N ASN A 171 -0.382 19.876 -11.160 1.00 62.14 N ATOM 2702 CA ASN A 171 0.084 20.871 -12.136 1.00 55.21 C ATOM 2703 C ASN A 171 -1.022 21.175 -13.170 1.00 31.04 C ATOM 2704 O ASN A 171 -0.768 21.532 -14.320 1.00 32.11 O ATOM 2705 CB ASN A 171 1.405 20.383 -12.782 1.00 31.20 C ATOM 2706 CG ASN A 171 2.016 21.350 -13.786 1.00 31.23 C ATOM 2707 OD1 ASN A 171 1.907 22.572 -13.650 1.00 30.54 O ATOM 2708 ND2 ASN A 171 2.657 20.806 -14.810 1.00 54.33 N ATOM 0 H ASN A 171 -0.354 20.199 -10.193 1.00 62.14 H new ATOM 0 HA ASN A 171 0.298 21.815 -11.635 1.00 55.21 H new ATOM 0 HB2 ASN A 171 2.132 20.193 -11.992 1.00 31.20 H new ATOM 0 HB3 ASN A 171 1.220 19.431 -13.280 1.00 31.20 H new ATOM 0 HD21 ASN A 171 3.082 21.402 -15.521 1.00 54.33 H new ATOM 0 HD22 ASN A 171 2.726 19.791 -14.888 1.00 54.33 H new ATOM 2715 N GLY A 172 -2.270 21.042 -12.722 1.00 42.21 N ATOM 2716 CA GLY A 172 -3.416 21.338 -13.558 1.00 65.24 C ATOM 2717 C GLY A 172 -3.748 20.225 -14.536 1.00 3.33 C ATOM 2718 O GLY A 172 -4.702 20.338 -15.306 1.00 33.23 O ATOM 0 H GLY A 172 -2.506 20.730 -11.780 1.00 42.21 H new ATOM 0 HA2 GLY A 172 -4.282 21.525 -12.923 1.00 65.24 H new ATOM 0 HA3 GLY A 172 -3.224 22.256 -14.114 1.00 65.24 H new ATOM 2722 N HIS A 173 -2.984 19.142 -14.496 1.00 1.30 N ATOM 2723 CA HIS A 173 -3.138 18.070 -15.469 1.00 32.35 C ATOM 2724 C HIS A 173 -3.449 16.756 -14.786 1.00 74.22 C ATOM 2725 O HIS A 173 -2.823 16.394 -13.790 1.00 70.22 O ATOM 2726 CB HIS A 173 -1.880 17.936 -16.334 1.00 31.25 C ATOM 2727 CG HIS A 173 -1.781 18.985 -17.398 1.00 54.21 C ATOM 2728 ND1 HIS A 173 -1.930 18.676 -18.727 1.00 72.12 N ATOM 2729 CD2 HIS A 173 -1.579 20.316 -17.275 1.00 62.43 C ATOM 2730 CE1 HIS A 173 -1.822 19.820 -19.378 1.00 54.02 C ATOM 2731 NE2 HIS A 173 -1.610 20.842 -18.539 1.00 54.22 N ATOM 0 H HIS A 173 -2.253 18.983 -13.802 1.00 1.30 H new ATOM 0 HA HIS A 173 -3.978 18.326 -16.115 1.00 32.35 H new ATOM 0 HB2 HIS A 173 -0.999 17.992 -15.694 1.00 31.25 H new ATOM 0 HB3 HIS A 173 -1.872 16.951 -16.802 1.00 31.25 H new ATOM 0 HD2 HIS A 173 -1.423 20.861 -16.355 1.00 62.43 H new ATOM 0 HE1 HIS A 173 -1.895 19.919 -20.451 1.00 54.02 H new ATOM 0 HE2 HIS A 173 -1.494 21.823 -18.793 1.00 54.22 H new ATOM 2739 N ASN A 174 -4.437 16.057 -15.312 1.00 62.01 N ATOM 2740 CA ASN A 174 -4.806 14.756 -14.790 1.00 13.44 C ATOM 2741 C ASN A 174 -3.944 13.677 -15.440 1.00 50.23 C ATOM 2742 O ASN A 174 -4.096 13.370 -16.618 1.00 32.11 O ATOM 2743 CB ASN A 174 -6.295 14.499 -15.040 1.00 11.03 C ATOM 2744 CG ASN A 174 -6.776 13.195 -14.441 1.00 54.31 C ATOM 2745 OD1 ASN A 174 -6.785 12.165 -15.106 1.00 33.22 O ATOM 2746 ND2 ASN A 174 -7.184 13.230 -13.183 1.00 5.23 N ATOM 0 H ASN A 174 -5.000 16.370 -16.103 1.00 62.01 H new ATOM 0 HA ASN A 174 -4.633 14.730 -13.714 1.00 13.44 H new ATOM 0 HB2 ASN A 174 -6.876 15.321 -14.622 1.00 11.03 H new ATOM 0 HB3 ASN A 174 -6.482 14.491 -16.114 1.00 11.03 H new ATOM 0 HD21 ASN A 174 -7.522 12.379 -12.733 1.00 5.23 H new ATOM 0 HD22 ASN A 174 -7.161 14.108 -12.664 1.00 5.23 H new ATOM 2753 N CYS A 175 -3.038 13.120 -14.664 1.00 13.34 N ATOM 2754 CA CYS A 175 -2.084 12.143 -15.158 1.00 43.31 C ATOM 2755 C CYS A 175 -2.347 10.777 -14.543 1.00 43.04 C ATOM 2756 O CYS A 175 -2.957 10.681 -13.479 1.00 50.15 O ATOM 2757 CB CYS A 175 -0.664 12.607 -14.837 1.00 30.51 C ATOM 2758 SG CYS A 175 -0.462 13.210 -13.143 1.00 50.11 S ATOM 0 H CYS A 175 -2.940 13.331 -13.671 1.00 13.34 H new ATOM 0 HA CYS A 175 -2.197 12.054 -16.239 1.00 43.31 H new ATOM 0 HB2 CYS A 175 0.026 11.779 -15.003 1.00 30.51 H new ATOM 0 HB3 CYS A 175 -0.384 13.399 -15.531 1.00 30.51 H new ATOM 0 HG CYS A 175 -1.599 13.136 -12.518 1.00 50.11 H new ATOM 2764 N GLU A 176 -1.896 9.729 -15.213 1.00 31.02 N ATOM 2765 CA GLU A 176 -2.083 8.377 -14.722 1.00 71.04 C ATOM 2766 C GLU A 176 -0.964 8.012 -13.759 1.00 61.23 C ATOM 2767 O GLU A 176 0.209 8.259 -14.030 1.00 34.32 O ATOM 2768 CB GLU A 176 -2.116 7.369 -15.876 1.00 32.33 C ATOM 2769 CG GLU A 176 -2.468 5.959 -15.430 1.00 63.54 C ATOM 2770 CD GLU A 176 -2.181 4.913 -16.485 1.00 33.51 C ATOM 2771 OE1 GLU A 176 -1.053 4.385 -16.519 1.00 52.24 O ATOM 2772 OE2 GLU A 176 -3.086 4.614 -17.288 1.00 50.23 O ATOM 0 H GLU A 176 -1.397 9.791 -16.100 1.00 31.02 H new ATOM 0 HA GLU A 176 -3.040 8.338 -14.202 1.00 71.04 H new ATOM 0 HB2 GLU A 176 -2.842 7.700 -16.618 1.00 32.33 H new ATOM 0 HB3 GLU A 176 -1.143 7.356 -16.366 1.00 32.33 H new ATOM 0 HG2 GLU A 176 -1.906 5.719 -14.527 1.00 63.54 H new ATOM 0 HG3 GLU A 176 -3.525 5.921 -15.167 1.00 63.54 H new ATOM 2779 N VAL A 177 -1.344 7.429 -12.641 1.00 70.51 N ATOM 2780 CA VAL A 177 -0.396 7.015 -11.629 1.00 24.11 C ATOM 2781 C VAL A 177 -0.670 5.576 -11.225 1.00 22.32 C ATOM 2782 O VAL A 177 -1.813 5.198 -10.967 1.00 70.02 O ATOM 2783 CB VAL A 177 -0.435 7.906 -10.375 1.00 64.24 C ATOM 2784 CG1 VAL A 177 0.739 7.595 -9.467 1.00 22.14 C ATOM 2785 CG2 VAL A 177 -0.444 9.384 -10.748 1.00 24.31 C ATOM 0 H VAL A 177 -2.317 7.229 -12.409 1.00 70.51 H new ATOM 0 HA VAL A 177 0.597 7.109 -12.069 1.00 24.11 H new ATOM 0 HB VAL A 177 -1.359 7.690 -9.839 1.00 64.24 H new ATOM 0 HG11 VAL A 177 0.696 8.234 -8.585 1.00 22.14 H new ATOM 0 HG12 VAL A 177 0.695 6.550 -9.160 1.00 22.14 H new ATOM 0 HG13 VAL A 177 1.671 7.777 -10.002 1.00 22.14 H new ATOM 0 HG21 VAL A 177 -0.472 9.988 -9.841 1.00 24.31 H new ATOM 0 HG22 VAL A 177 0.456 9.622 -11.315 1.00 24.31 H new ATOM 0 HG23 VAL A 177 -1.323 9.601 -11.355 1.00 24.31 H new ATOM 2795 N ARG A 178 0.382 4.783 -11.179 1.00 65.42 N ATOM 2796 CA ARG A 178 0.245 3.359 -10.907 1.00 13.40 C ATOM 2797 C ARG A 178 1.516 2.798 -10.281 1.00 22.11 C ATOM 2798 O ARG A 178 2.516 3.503 -10.166 1.00 3.11 O ATOM 2799 CB ARG A 178 -0.110 2.614 -12.203 1.00 65.43 C ATOM 2800 CG ARG A 178 1.072 2.334 -13.115 1.00 33.41 C ATOM 2801 CD ARG A 178 0.616 2.039 -14.535 1.00 4.44 C ATOM 2802 NE ARG A 178 1.715 1.578 -15.379 1.00 62.01 N ATOM 2803 CZ ARG A 178 1.783 1.770 -16.696 1.00 64.32 C ATOM 2804 NH1 ARG A 178 0.818 2.423 -17.334 1.00 51.31 N ATOM 2805 NH2 ARG A 178 2.827 1.310 -17.374 1.00 34.11 N ATOM 0 H ARG A 178 1.342 5.096 -11.326 1.00 65.42 H new ATOM 0 HA ARG A 178 -0.563 3.214 -10.189 1.00 13.40 H new ATOM 0 HB2 ARG A 178 -0.585 1.668 -11.944 1.00 65.43 H new ATOM 0 HB3 ARG A 178 -0.846 3.200 -12.753 1.00 65.43 H new ATOM 0 HG2 ARG A 178 1.744 3.192 -13.117 1.00 33.41 H new ATOM 0 HG3 ARG A 178 1.639 1.487 -12.729 1.00 33.41 H new ATOM 0 HD2 ARG A 178 -0.167 1.281 -14.514 1.00 4.44 H new ATOM 0 HD3 ARG A 178 0.178 2.938 -14.969 1.00 4.44 H new ATOM 0 HE ARG A 178 2.481 1.076 -14.931 1.00 62.01 H new ATOM 0 HH11 ARG A 178 0.016 2.782 -16.816 1.00 51.31 H new ATOM 0 HH12 ARG A 178 0.879 2.565 -18.342 1.00 51.31 H new ATOM 0 HH21 ARG A 178 3.572 0.812 -16.887 1.00 34.11 H new ATOM 0 HH22 ARG A 178 2.884 1.454 -18.382 1.00 34.11 H new ATOM 2819 N LYS A 179 1.466 1.533 -9.870 1.00 11.34 N ATOM 2820 CA LYS A 179 2.595 0.884 -9.210 1.00 51.32 C ATOM 2821 C LYS A 179 3.787 0.765 -10.145 1.00 23.52 C ATOM 2822 O LYS A 179 3.658 0.325 -11.289 1.00 73.14 O ATOM 2823 CB LYS A 179 2.202 -0.509 -8.719 1.00 72.02 C ATOM 2824 CG LYS A 179 1.146 -0.507 -7.629 1.00 70.34 C ATOM 2825 CD LYS A 179 1.749 -0.287 -6.250 1.00 53.13 C ATOM 2826 CE LYS A 179 1.595 -1.519 -5.374 1.00 11.41 C ATOM 2827 NZ LYS A 179 0.168 -1.837 -5.086 1.00 73.20 N ATOM 0 H LYS A 179 0.649 0.934 -9.984 1.00 11.34 H new ATOM 0 HA LYS A 179 2.875 1.505 -8.360 1.00 51.32 H new ATOM 0 HB2 LYS A 179 1.835 -1.090 -9.565 1.00 72.02 H new ATOM 0 HB3 LYS A 179 3.092 -1.016 -8.347 1.00 72.02 H new ATOM 0 HG2 LYS A 179 0.415 0.275 -7.834 1.00 70.34 H new ATOM 0 HG3 LYS A 179 0.609 -1.456 -7.643 1.00 70.34 H new ATOM 0 HD2 LYS A 179 2.806 -0.039 -6.349 1.00 53.13 H new ATOM 0 HD3 LYS A 179 1.265 0.564 -5.771 1.00 53.13 H new ATOM 0 HE2 LYS A 179 2.062 -2.372 -5.866 1.00 11.41 H new ATOM 0 HE3 LYS A 179 2.126 -1.362 -4.435 1.00 11.41 H new ATOM 0 HZ1 LYS A 179 0.089 -2.826 -4.775 1.00 73.20 H new ATOM 0 HZ2 LYS A 179 -0.183 -1.209 -4.335 1.00 73.20 H new ATOM 0 HZ3 LYS A 179 -0.399 -1.698 -5.947 1.00 73.20 H new ATOM 2841 N ALA A 180 4.940 1.162 -9.646 1.00 65.43 N ATOM 2842 CA ALA A 180 6.183 1.029 -10.373 1.00 5.35 C ATOM 2843 C ALA A 180 7.147 0.220 -9.540 1.00 24.33 C ATOM 2844 O ALA A 180 7.488 0.608 -8.430 1.00 35.43 O ATOM 2845 CB ALA A 180 6.779 2.390 -10.693 1.00 11.43 C ATOM 0 H ALA A 180 5.040 1.586 -8.724 1.00 65.43 H new ATOM 0 HA ALA A 180 5.991 0.523 -11.319 1.00 5.35 H new ATOM 0 HB1 ALA A 180 7.713 2.259 -11.240 1.00 11.43 H new ATOM 0 HB2 ALA A 180 6.078 2.960 -11.303 1.00 11.43 H new ATOM 0 HB3 ALA A 180 6.974 2.929 -9.766 1.00 11.43 H new ATOM 2851 N LEU A 181 7.564 -0.913 -10.051 1.00 71.52 N ATOM 2852 CA LEU A 181 8.461 -1.770 -9.307 1.00 64.34 C ATOM 2853 C LEU A 181 9.859 -1.176 -9.310 1.00 44.33 C ATOM 2854 O LEU A 181 10.416 -0.886 -10.371 1.00 31.24 O ATOM 2855 CB LEU A 181 8.467 -3.183 -9.890 1.00 54.34 C ATOM 2856 CG LEU A 181 7.088 -3.835 -10.041 1.00 54.21 C ATOM 2857 CD1 LEU A 181 7.229 -5.266 -10.535 1.00 42.12 C ATOM 2858 CD2 LEU A 181 6.317 -3.792 -8.725 1.00 72.11 C ATOM 0 H LEU A 181 7.300 -1.263 -10.972 1.00 71.52 H new ATOM 0 HA LEU A 181 8.112 -1.838 -8.277 1.00 64.34 H new ATOM 0 HB2 LEU A 181 8.945 -3.152 -10.869 1.00 54.34 H new ATOM 0 HB3 LEU A 181 9.083 -3.818 -9.254 1.00 54.34 H new ATOM 0 HG LEU A 181 6.522 -3.268 -10.780 1.00 54.21 H new ATOM 0 HD11 LEU A 181 6.241 -5.715 -10.637 1.00 42.12 H new ATOM 0 HD12 LEU A 181 7.731 -5.269 -11.503 1.00 42.12 H new ATOM 0 HD13 LEU A 181 7.817 -5.842 -9.820 1.00 42.12 H new ATOM 0 HD21 LEU A 181 5.342 -4.261 -8.859 1.00 72.11 H new ATOM 0 HD22 LEU A 181 6.876 -4.329 -7.958 1.00 72.11 H new ATOM 0 HD23 LEU A 181 6.182 -2.755 -8.416 1.00 72.11 H new