USER MOD reduce.3.24.130724 H: found=0, std=0, add=1314, rem=0, adj=39 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= 0.122 USER MOD Set 1.2: A 174 ASN : amide:sc= -0.0577 X(o=0.065,f=0.14) USER MOD Set 2.1: A 124 TYR OH : rot -155:sc= 0.604 USER MOD Set 2.2: A 128 TYR OH : rot 180:sc= 0 USER MOD Set 2.3: A 168 HIS : no HD1:sc= -0.599 K(o=0.0052,f=-9.6!) USER MOD Set 3.1: A 95 SER OG : rot -42:sc= 0.297 USER MOD Set 3.2: A 101 HIS : no HD1:sc= -0.0367 X(o=0.26,f=0.25) USER MOD Set 4.1: A 12 GLN : amide:sc= 0.487 K(o=1.9,f=-2.6) USER MOD Set 4.2: A 91 SER OG : rot -47:sc= 1.39 USER MOD Set 5.1: A 87 LYS NZ :NH3+ 174:sc= 0.0351 (180deg=-0.28) USER MOD Set 5.2: A 103 THR OG1 : rot 180:sc= 0.129 USER MOD Set 6.1: A 26 THR OG1 : rot 180:sc= 0.937 USER MOD Set 6.2: A 29 SER OG : rot 94:sc= 1.09 USER MOD Set 7.1: A 22 SER OG : rot 175:sc= 1.89 USER MOD Set 7.2: A 25 THR OG1 : rot 0:sc= 0.211 USER MOD Single : A 8 LYS NZ :NH3+ -168:sc= 1.26 (180deg=1.26) USER MOD Single : A 15 LYS NZ :NH3+ -155:sc= 1.29 (180deg=1.15) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 HIS : no HE2:sc= -1.51 K(o=-1.5,f=-2.8!) USER MOD Single : A 36 GLN : amide:sc= 1.03 K(o=1,f=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0.019 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 CYS SG : rot -93:sc= -0.809 USER MOD Single : A 46 MET CE :methyl 146:sc= -0.877 (180deg=-3!) USER MOD Single : A 50 ASN : amide:sc= -1.29 K(o=-1.3,f=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 177:sc= 0.72 (180deg=0.689) USER MOD Single : A 54 SER OG : rot -133:sc= 0.725 USER MOD Single : A 61 THR OG1 : rot -169:sc= -0.662 USER MOD Single : A 62 TYR OH : rot 35:sc= 0.805 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 146:sc= -3.12 (180deg=-4.93!) USER MOD Single : A 73 ASN : amide:sc= -4.34! C(o=-4.3!,f=-6.5!) USER MOD Single : A 77 HIS : no HD1:sc= -0.61 K(o=-0.32,f=-4.3!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc= -1.03 K(o=-1,f=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 179:sc= 1.28 (180deg=1.26) USER MOD Single : A 113 LYS NZ :NH3+ -149:sc= -0.28 (180deg=-1.6!) USER MOD Single : A 116 THR OG1 : rot -150:sc= -0.151 USER MOD Single : A 119 HIS : no HD1:sc=-0.00239 K(o=-0.0024,f=-0.9) USER MOD Single : A 120 HIS : no HD1:sc= 0.706 K(o=0.71,f=-7.2!) USER MOD Single : A 127 GLN : amide:sc= 0.314 X(o=0.31,f=0) USER MOD Single : A 130 LYS NZ :NH3+ 179:sc= 1.01 (180deg=1.01) USER MOD Single : A 137 MET CE :methyl -174:sc= 0 (180deg=-0.065) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 THR OG1 : rot 180:sc= -1.08 USER MOD Single : A 156 HIS : no HE2:sc= -2.18 K(o=-2.2,f=-4.2!) USER MOD Single : A 158 SER OG : rot 48:sc= 0.203 USER MOD Single : A 161 LYS NZ :NH3+ -162:sc= 0.375 (180deg=0.243) USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 TYR OH : rot -108:sc= 1.19 USER MOD Single : A 171 ASN : amide:sc= -0.0906 X(o=-0.091,f=-0.29) USER MOD Single : A 173 HIS : no HD1:sc= -2.71! C(o=-2.7!,f=-6.2!) USER MOD Single : A 175 CYS SG : rot -17:sc= 0.617 USER MOD Single : A 179 LYS NZ :NH3+ 147:sc= -0.0848 (180deg=-1.79!) USER MOD ----------------------------------------------------------------- ATOM 92 N LYS A 8 -15.561 8.016 5.796 1.00 71.44 N ATOM 93 CA LYS A 8 -16.002 8.428 4.476 1.00 54.21 C ATOM 94 C LYS A 8 -15.260 7.589 3.454 1.00 3.10 C ATOM 95 O LYS A 8 -15.465 7.707 2.248 1.00 53.44 O ATOM 96 CB LYS A 8 -15.698 9.916 4.232 1.00 11.22 C ATOM 97 CG LYS A 8 -16.047 10.846 5.395 1.00 42.42 C ATOM 98 CD LYS A 8 -14.959 10.880 6.471 1.00 1.53 C ATOM 99 CE LYS A 8 -13.657 11.480 5.964 1.00 3.33 C ATOM 100 NZ LYS A 8 -12.485 10.946 6.703 1.00 51.22 N ATOM 0 HA LYS A 8 -17.080 8.286 4.392 1.00 54.21 H new ATOM 0 HB2 LYS A 8 -14.637 10.022 4.007 1.00 11.22 H new ATOM 0 HB3 LYS A 8 -16.245 10.243 3.348 1.00 11.22 H new ATOM 0 HG2 LYS A 8 -16.206 11.854 5.013 1.00 42.42 H new ATOM 0 HG3 LYS A 8 -16.986 10.523 5.844 1.00 42.42 H new ATOM 0 HD2 LYS A 8 -15.314 11.458 7.324 1.00 1.53 H new ATOM 0 HD3 LYS A 8 -14.774 9.867 6.828 1.00 1.53 H new ATOM 0 HE2 LYS A 8 -13.546 11.265 4.901 1.00 3.33 H new ATOM 0 HE3 LYS A 8 -13.690 12.564 6.068 1.00 3.33 H new ATOM 0 HZ1 LYS A 8 -11.644 11.516 6.479 1.00 51.22 H new ATOM 0 HZ2 LYS A 8 -12.670 10.989 7.725 1.00 51.22 H new ATOM 0 HZ3 LYS A 8 -12.319 9.958 6.423 1.00 51.22 H new ATOM 114 N GLU A 9 -14.397 6.736 3.972 1.00 50.13 N ATOM 115 CA GLU A 9 -13.474 5.969 3.165 1.00 3.31 C ATOM 116 C GLU A 9 -14.052 4.604 2.823 1.00 52.03 C ATOM 117 O GLU A 9 -14.722 3.979 3.648 1.00 72.31 O ATOM 118 CB GLU A 9 -12.138 5.798 3.905 1.00 32.33 C ATOM 119 CG GLU A 9 -11.609 7.080 4.518 1.00 14.22 C ATOM 120 CD GLU A 9 -12.120 7.306 5.930 1.00 15.21 C ATOM 121 OE1 GLU A 9 -11.791 6.502 6.822 1.00 32.12 O ATOM 122 OE2 GLU A 9 -12.857 8.288 6.146 1.00 2.11 O ATOM 0 H GLU A 9 -14.318 6.556 4.973 1.00 50.13 H new ATOM 0 HA GLU A 9 -13.304 6.514 2.236 1.00 3.31 H new ATOM 0 HB2 GLU A 9 -12.262 5.054 4.692 1.00 32.33 H new ATOM 0 HB3 GLU A 9 -11.396 5.406 3.210 1.00 32.33 H new ATOM 0 HG2 GLU A 9 -10.519 7.050 4.530 1.00 14.22 H new ATOM 0 HG3 GLU A 9 -11.898 7.924 3.892 1.00 14.22 H new ATOM 129 N PRO A 10 -13.805 4.135 1.589 1.00 14.34 N ATOM 130 CA PRO A 10 -14.188 2.788 1.158 1.00 25.32 C ATOM 131 C PRO A 10 -13.378 1.731 1.902 1.00 12.43 C ATOM 132 O PRO A 10 -12.389 2.066 2.563 1.00 64.15 O ATOM 133 CB PRO A 10 -13.861 2.779 -0.339 1.00 64.14 C ATOM 134 CG PRO A 10 -12.864 3.863 -0.542 1.00 64.33 C ATOM 135 CD PRO A 10 -13.127 4.891 0.522 1.00 24.11 C ATOM 0 HA PRO A 10 -15.234 2.559 1.361 1.00 25.32 H new ATOM 0 HB2 PRO A 10 -13.457 1.814 -0.645 1.00 64.14 H new ATOM 0 HB3 PRO A 10 -14.756 2.954 -0.936 1.00 64.14 H new ATOM 0 HG2 PRO A 10 -11.848 3.475 -0.464 1.00 64.33 H new ATOM 0 HG3 PRO A 10 -12.963 4.300 -1.536 1.00 64.33 H new ATOM 0 HD2 PRO A 10 -12.201 5.342 0.879 1.00 24.11 H new ATOM 0 HD3 PRO A 10 -13.753 5.701 0.148 1.00 24.11 H new ATOM 143 N GLU A 11 -13.787 0.466 1.800 1.00 64.34 N ATOM 144 CA GLU A 11 -13.143 -0.605 2.561 1.00 72.54 C ATOM 145 C GLU A 11 -11.650 -0.685 2.268 1.00 64.40 C ATOM 146 O GLU A 11 -10.870 -0.906 3.175 1.00 73.45 O ATOM 147 CB GLU A 11 -13.804 -1.969 2.307 1.00 75.11 C ATOM 148 CG GLU A 11 -13.667 -2.483 0.886 1.00 23.50 C ATOM 149 CD GLU A 11 -13.888 -3.973 0.779 1.00 74.42 C ATOM 150 OE1 GLU A 11 -12.934 -4.734 1.034 1.00 50.40 O ATOM 151 OE2 GLU A 11 -15.010 -4.390 0.428 1.00 5.42 O ATOM 0 H GLU A 11 -14.555 0.159 1.203 1.00 64.34 H new ATOM 0 HA GLU A 11 -13.275 -0.355 3.614 1.00 72.54 H new ATOM 0 HB2 GLU A 11 -13.369 -2.701 2.988 1.00 75.11 H new ATOM 0 HB3 GLU A 11 -14.864 -1.896 2.552 1.00 75.11 H new ATOM 0 HG2 GLU A 11 -14.384 -1.967 0.247 1.00 23.50 H new ATOM 0 HG3 GLU A 11 -12.673 -2.240 0.511 1.00 23.50 H new ATOM 158 N GLN A 12 -11.261 -0.456 1.015 1.00 12.24 N ATOM 159 CA GLN A 12 -9.858 -0.558 0.610 1.00 32.04 C ATOM 160 C GLN A 12 -8.997 0.534 1.253 1.00 45.24 C ATOM 161 O GLN A 12 -7.807 0.335 1.493 1.00 64.44 O ATOM 162 CB GLN A 12 -9.745 -0.491 -0.916 1.00 64.31 C ATOM 163 CG GLN A 12 -9.951 0.902 -1.494 1.00 33.45 C ATOM 164 CD GLN A 12 -10.134 0.888 -2.994 1.00 73.04 C ATOM 165 OE1 GLN A 12 -9.169 0.946 -3.744 1.00 75.10 O ATOM 166 NE2 GLN A 12 -11.374 0.817 -3.445 1.00 61.13 N ATOM 0 H GLN A 12 -11.898 -0.198 0.261 1.00 12.24 H new ATOM 0 HA GLN A 12 -9.482 -1.520 0.959 1.00 32.04 H new ATOM 0 HB2 GLN A 12 -8.761 -0.854 -1.213 1.00 64.31 H new ATOM 0 HB3 GLN A 12 -10.480 -1.167 -1.354 1.00 64.31 H new ATOM 0 HG2 GLN A 12 -10.825 1.358 -1.029 1.00 33.45 H new ATOM 0 HG3 GLN A 12 -9.094 1.526 -1.242 1.00 33.45 H new ATOM 0 HE21 GLN A 12 -12.153 0.770 -2.789 1.00 61.13 H new ATOM 0 HE22 GLN A 12 -11.552 0.809 -4.449 1.00 61.13 H new ATOM 175 N LEU A 13 -9.609 1.673 1.562 1.00 70.44 N ATOM 176 CA LEU A 13 -8.878 2.802 2.125 1.00 5.32 C ATOM 177 C LEU A 13 -8.694 2.641 3.626 1.00 24.51 C ATOM 178 O LEU A 13 -7.954 3.396 4.257 1.00 11.01 O ATOM 179 CB LEU A 13 -9.594 4.119 1.824 1.00 41.32 C ATOM 180 CG LEU A 13 -8.935 4.996 0.754 1.00 75.12 C ATOM 181 CD1 LEU A 13 -8.824 4.251 -0.563 1.00 62.44 C ATOM 182 CD2 LEU A 13 -9.722 6.280 0.557 1.00 41.32 C ATOM 0 H LEU A 13 -10.607 1.838 1.432 1.00 70.44 H new ATOM 0 HA LEU A 13 -7.894 2.824 1.657 1.00 5.32 H new ATOM 0 HB2 LEU A 13 -10.613 3.895 1.509 1.00 41.32 H new ATOM 0 HB3 LEU A 13 -9.665 4.694 2.747 1.00 41.32 H new ATOM 0 HG LEU A 13 -7.931 5.246 1.098 1.00 75.12 H new ATOM 0 HD11 LEU A 13 -8.353 4.894 -1.306 1.00 62.44 H new ATOM 0 HD12 LEU A 13 -8.220 3.354 -0.424 1.00 62.44 H new ATOM 0 HD13 LEU A 13 -9.819 3.968 -0.906 1.00 62.44 H new ATOM 0 HD21 LEU A 13 -9.239 6.890 -0.206 1.00 41.32 H new ATOM 0 HD22 LEU A 13 -10.737 6.040 0.241 1.00 41.32 H new ATOM 0 HD23 LEU A 13 -9.756 6.834 1.495 1.00 41.32 H new ATOM 194 N ARG A 14 -9.367 1.662 4.199 1.00 32.53 N ATOM 195 CA ARG A 14 -9.212 1.374 5.611 1.00 14.53 C ATOM 196 C ARG A 14 -8.779 -0.078 5.834 1.00 41.15 C ATOM 197 O ARG A 14 -8.594 -0.510 6.966 1.00 63.21 O ATOM 198 CB ARG A 14 -10.508 1.702 6.365 1.00 55.15 C ATOM 199 CG ARG A 14 -11.766 1.151 5.711 1.00 52.11 C ATOM 200 CD ARG A 14 -13.022 1.784 6.294 1.00 64.20 C ATOM 201 NE ARG A 14 -14.239 1.106 5.843 1.00 74.44 N ATOM 202 CZ ARG A 14 -15.354 1.000 6.572 1.00 40.45 C ATOM 203 NH1 ARG A 14 -15.423 1.532 7.788 1.00 4.11 N ATOM 204 NH2 ARG A 14 -16.402 0.352 6.084 1.00 1.24 N ATOM 0 H ARG A 14 -10.024 1.054 3.710 1.00 32.53 H new ATOM 0 HA ARG A 14 -8.420 2.008 6.010 1.00 14.53 H new ATOM 0 HB2 ARG A 14 -10.436 1.307 7.378 1.00 55.15 H new ATOM 0 HB3 ARG A 14 -10.601 2.785 6.451 1.00 55.15 H new ATOM 0 HG2 ARG A 14 -11.729 1.335 4.637 1.00 52.11 H new ATOM 0 HG3 ARG A 14 -11.805 0.070 5.848 1.00 52.11 H new ATOM 0 HD2 ARG A 14 -12.972 1.753 7.382 1.00 64.20 H new ATOM 0 HD3 ARG A 14 -13.065 2.835 6.007 1.00 64.20 H new ATOM 0 HE ARG A 14 -14.235 0.688 4.913 1.00 74.44 H new ATOM 0 HH11 ARG A 14 -14.620 2.028 8.174 1.00 4.11 H new ATOM 0 HH12 ARG A 14 -16.279 1.445 8.335 1.00 4.11 H new ATOM 0 HH21 ARG A 14 -16.356 -0.064 5.154 1.00 1.24 H new ATOM 0 HH22 ARG A 14 -17.254 0.270 6.638 1.00 1.24 H new ATOM 218 N LYS A 15 -8.630 -0.828 4.752 1.00 10.02 N ATOM 219 CA LYS A 15 -8.155 -2.205 4.831 1.00 31.53 C ATOM 220 C LYS A 15 -6.638 -2.284 4.690 1.00 45.50 C ATOM 221 O LYS A 15 -6.022 -1.488 3.978 1.00 43.12 O ATOM 222 CB LYS A 15 -8.847 -3.043 3.748 1.00 2.12 C ATOM 223 CG LYS A 15 -8.625 -4.546 3.850 1.00 30.33 C ATOM 224 CD LYS A 15 -9.554 -5.309 2.910 1.00 32.35 C ATOM 225 CE LYS A 15 -9.440 -4.814 1.473 1.00 71.14 C ATOM 226 NZ LYS A 15 -10.372 -5.524 0.557 1.00 60.32 N ATOM 0 H LYS A 15 -8.831 -0.506 3.805 1.00 10.02 H new ATOM 0 HA LYS A 15 -8.406 -2.604 5.814 1.00 31.53 H new ATOM 0 HB2 LYS A 15 -9.918 -2.847 3.789 1.00 2.12 H new ATOM 0 HB3 LYS A 15 -8.498 -2.706 2.772 1.00 2.12 H new ATOM 0 HG2 LYS A 15 -7.588 -4.780 3.609 1.00 30.33 H new ATOM 0 HG3 LYS A 15 -8.795 -4.872 4.876 1.00 30.33 H new ATOM 0 HD2 LYS A 15 -9.316 -6.372 2.948 1.00 32.35 H new ATOM 0 HD3 LYS A 15 -10.584 -5.201 3.251 1.00 32.35 H new ATOM 0 HE2 LYS A 15 -9.648 -3.744 1.442 1.00 71.14 H new ATOM 0 HE3 LYS A 15 -8.416 -4.950 1.124 1.00 71.14 H new ATOM 0 HZ1 LYS A 15 -9.999 -5.490 -0.413 1.00 60.32 H new ATOM 0 HZ2 LYS A 15 -10.466 -6.515 0.857 1.00 60.32 H new ATOM 0 HZ3 LYS A 15 -11.304 -5.064 0.586 1.00 60.32 H new ATOM 240 N LEU A 16 -6.053 -3.243 5.400 1.00 43.20 N ATOM 241 CA LEU A 16 -4.620 -3.499 5.365 1.00 63.34 C ATOM 242 C LEU A 16 -4.355 -4.947 4.967 1.00 34.54 C ATOM 243 O LEU A 16 -5.121 -5.841 5.315 1.00 10.43 O ATOM 244 CB LEU A 16 -3.986 -3.224 6.739 1.00 12.33 C ATOM 245 CG LEU A 16 -3.236 -1.895 6.884 1.00 33.42 C ATOM 246 CD1 LEU A 16 -4.090 -0.738 6.423 1.00 11.25 C ATOM 247 CD2 LEU A 16 -2.799 -1.687 8.323 1.00 31.34 C ATOM 0 H LEU A 16 -6.566 -3.869 6.021 1.00 43.20 H new ATOM 0 HA LEU A 16 -4.173 -2.831 4.628 1.00 63.34 H new ATOM 0 HB2 LEU A 16 -4.773 -3.257 7.492 1.00 12.33 H new ATOM 0 HB3 LEU A 16 -3.294 -4.035 6.965 1.00 12.33 H new ATOM 0 HG LEU A 16 -2.350 -1.937 6.251 1.00 33.42 H new ATOM 0 HD11 LEU A 16 -3.534 0.193 6.537 1.00 11.25 H new ATOM 0 HD12 LEU A 16 -4.355 -0.877 5.375 1.00 11.25 H new ATOM 0 HD13 LEU A 16 -4.998 -0.694 7.024 1.00 11.25 H new ATOM 0 HD21 LEU A 16 -2.268 -0.739 8.409 1.00 31.34 H new ATOM 0 HD22 LEU A 16 -3.675 -1.672 8.971 1.00 31.34 H new ATOM 0 HD23 LEU A 16 -2.139 -2.501 8.624 1.00 31.34 H new ATOM 259 N PHE A 17 -3.273 -5.162 4.240 1.00 52.30 N ATOM 260 CA PHE A 17 -2.846 -6.497 3.856 1.00 35.51 C ATOM 261 C PHE A 17 -1.780 -6.987 4.827 1.00 30.41 C ATOM 262 O PHE A 17 -0.715 -6.400 4.934 1.00 61.21 O ATOM 263 CB PHE A 17 -2.299 -6.486 2.420 1.00 62.20 C ATOM 264 CG PHE A 17 -1.469 -7.694 2.062 1.00 43.50 C ATOM 265 CD1 PHE A 17 -2.071 -8.893 1.723 1.00 61.13 C ATOM 266 CD2 PHE A 17 -0.082 -7.621 2.058 1.00 55.32 C ATOM 267 CE1 PHE A 17 -1.308 -9.995 1.388 1.00 75.24 C ATOM 268 CE2 PHE A 17 0.685 -8.720 1.727 1.00 25.23 C ATOM 269 CZ PHE A 17 0.070 -9.910 1.390 1.00 63.44 C ATOM 0 H PHE A 17 -2.665 -4.417 3.899 1.00 52.30 H new ATOM 0 HA PHE A 17 -3.700 -7.174 3.893 1.00 35.51 H new ATOM 0 HB2 PHE A 17 -3.136 -6.416 1.725 1.00 62.20 H new ATOM 0 HB3 PHE A 17 -1.694 -5.590 2.281 1.00 62.20 H new ATOM 0 HD1 PHE A 17 -3.148 -8.968 1.720 1.00 61.13 H new ATOM 0 HD2 PHE A 17 0.403 -6.692 2.317 1.00 55.32 H new ATOM 0 HE1 PHE A 17 -1.790 -10.925 1.124 1.00 75.24 H new ATOM 0 HE2 PHE A 17 1.763 -8.650 1.732 1.00 25.23 H new ATOM 0 HZ PHE A 17 0.666 -10.772 1.129 1.00 63.44 H new ATOM 279 N ILE A 18 -2.066 -8.054 5.533 1.00 14.34 N ATOM 280 CA ILE A 18 -1.125 -8.583 6.500 1.00 3.11 C ATOM 281 C ILE A 18 -0.283 -9.673 5.861 1.00 11.14 C ATOM 282 O ILE A 18 -0.798 -10.726 5.515 1.00 64.01 O ATOM 283 CB ILE A 18 -1.838 -9.159 7.742 1.00 71.13 C ATOM 284 CG1 ILE A 18 -2.930 -8.205 8.236 1.00 63.42 C ATOM 285 CG2 ILE A 18 -0.827 -9.431 8.848 1.00 63.04 C ATOM 286 CD1 ILE A 18 -2.421 -6.823 8.585 1.00 42.14 C ATOM 0 H ILE A 18 -2.940 -8.575 5.459 1.00 14.34 H new ATOM 0 HA ILE A 18 -0.492 -7.757 6.823 1.00 3.11 H new ATOM 0 HB ILE A 18 -2.313 -10.099 7.461 1.00 71.13 H new ATOM 0 HG12 ILE A 18 -3.697 -8.116 7.467 1.00 63.42 H new ATOM 0 HG13 ILE A 18 -3.408 -8.639 9.114 1.00 63.42 H new ATOM 0 HG21 ILE A 18 -1.341 -9.837 9.719 1.00 63.04 H new ATOM 0 HG22 ILE A 18 -0.087 -10.150 8.496 1.00 63.04 H new ATOM 0 HG23 ILE A 18 -0.328 -8.501 9.122 1.00 63.04 H new ATOM 0 HD11 ILE A 18 -3.251 -6.205 8.927 1.00 42.14 H new ATOM 0 HD12 ILE A 18 -1.676 -6.899 9.377 1.00 42.14 H new ATOM 0 HD13 ILE A 18 -1.969 -6.368 7.703 1.00 42.14 H new ATOM 298 N GLY A 19 1.005 -9.416 5.706 1.00 3.44 N ATOM 299 CA GLY A 19 1.883 -10.385 5.088 1.00 24.53 C ATOM 300 C GLY A 19 2.781 -11.054 6.101 1.00 2.10 C ATOM 301 O GLY A 19 3.113 -10.460 7.122 1.00 2.21 O ATOM 0 H GLY A 19 1.459 -8.551 5.998 1.00 3.44 H new ATOM 0 HA2 GLY A 19 1.287 -11.140 4.575 1.00 24.53 H new ATOM 0 HA3 GLY A 19 2.493 -9.892 4.331 1.00 24.53 H new ATOM 305 N GLY A 20 3.161 -12.293 5.833 1.00 53.01 N ATOM 306 CA GLY A 20 4.074 -12.997 6.710 1.00 62.10 C ATOM 307 C GLY A 20 3.433 -13.447 8.012 1.00 30.41 C ATOM 308 O GLY A 20 4.012 -13.268 9.082 1.00 62.22 O ATOM 0 H GLY A 20 2.852 -12.826 5.020 1.00 53.01 H new ATOM 0 HA2 GLY A 20 4.469 -13.868 6.188 1.00 62.10 H new ATOM 0 HA3 GLY A 20 4.921 -12.350 6.935 1.00 62.10 H new ATOM 312 N LEU A 21 2.236 -14.020 7.933 1.00 1.13 N ATOM 313 CA LEU A 21 1.576 -14.588 9.102 1.00 21.42 C ATOM 314 C LEU A 21 2.101 -15.991 9.393 1.00 71.34 C ATOM 315 O LEU A 21 2.922 -16.530 8.645 1.00 25.42 O ATOM 316 CB LEU A 21 0.063 -14.670 8.866 1.00 62.14 C ATOM 317 CG LEU A 21 -0.687 -13.340 8.877 1.00 73.43 C ATOM 318 CD1 LEU A 21 -2.122 -13.533 8.415 1.00 42.13 C ATOM 319 CD2 LEU A 21 -0.665 -12.738 10.268 1.00 55.05 C ATOM 0 H LEU A 21 1.702 -14.103 7.068 1.00 1.13 H new ATOM 0 HA LEU A 21 1.787 -13.940 9.953 1.00 21.42 H new ATOM 0 HB2 LEU A 21 -0.109 -15.154 7.905 1.00 62.14 H new ATOM 0 HB3 LEU A 21 -0.370 -15.315 9.630 1.00 62.14 H new ATOM 0 HG LEU A 21 -0.189 -12.658 8.188 1.00 73.43 H new ATOM 0 HD11 LEU A 21 -2.641 -12.575 8.429 1.00 42.13 H new ATOM 0 HD12 LEU A 21 -2.127 -13.933 7.401 1.00 42.13 H new ATOM 0 HD13 LEU A 21 -2.629 -14.230 9.083 1.00 42.13 H new ATOM 0 HD21 LEU A 21 -1.203 -11.790 10.263 1.00 55.05 H new ATOM 0 HD22 LEU A 21 -1.143 -13.423 10.968 1.00 55.05 H new ATOM 0 HD23 LEU A 21 0.367 -12.568 10.574 1.00 55.05 H new ATOM 331 N SER A 22 1.618 -16.577 10.476 1.00 54.12 N ATOM 332 CA SER A 22 1.931 -17.956 10.802 1.00 51.33 C ATOM 333 C SER A 22 0.949 -18.884 10.092 1.00 15.34 C ATOM 334 O SER A 22 0.043 -18.419 9.398 1.00 22.24 O ATOM 335 CB SER A 22 1.860 -18.165 12.318 1.00 62.42 C ATOM 336 OG SER A 22 0.535 -18.001 12.798 1.00 55.03 O ATOM 0 H SER A 22 1.004 -16.115 11.147 1.00 54.12 H new ATOM 0 HA SER A 22 2.942 -18.186 10.467 1.00 51.33 H new ATOM 0 HB2 SER A 22 2.219 -19.164 12.567 1.00 62.42 H new ATOM 0 HB3 SER A 22 2.520 -17.456 12.817 1.00 62.42 H new ATOM 0 HG SER A 22 0.503 -18.223 13.752 1.00 55.03 H new ATOM 342 N PHE A 23 1.117 -20.187 10.265 1.00 23.23 N ATOM 343 CA PHE A 23 0.179 -21.150 9.699 1.00 24.44 C ATOM 344 C PHE A 23 -1.019 -21.337 10.624 1.00 72.42 C ATOM 345 O PHE A 23 -2.001 -21.991 10.268 1.00 24.24 O ATOM 346 CB PHE A 23 0.860 -22.497 9.459 1.00 62.33 C ATOM 347 CG PHE A 23 1.854 -22.488 8.337 1.00 13.43 C ATOM 348 CD1 PHE A 23 1.436 -22.646 7.027 1.00 40.40 C ATOM 349 CD2 PHE A 23 3.205 -22.330 8.592 1.00 54.21 C ATOM 350 CE1 PHE A 23 2.348 -22.648 5.990 1.00 60.21 C ATOM 351 CE2 PHE A 23 4.122 -22.328 7.561 1.00 23.44 C ATOM 352 CZ PHE A 23 3.694 -22.488 6.257 1.00 41.53 C ATOM 0 H PHE A 23 1.888 -20.601 10.789 1.00 23.23 H new ATOM 0 HA PHE A 23 -0.167 -20.758 8.743 1.00 24.44 H new ATOM 0 HB2 PHE A 23 1.364 -22.805 10.375 1.00 62.33 H new ATOM 0 HB3 PHE A 23 0.096 -23.246 9.248 1.00 62.33 H new ATOM 0 HD1 PHE A 23 0.385 -22.769 6.813 1.00 40.40 H new ATOM 0 HD2 PHE A 23 3.545 -22.207 9.610 1.00 54.21 H new ATOM 0 HE1 PHE A 23 2.010 -22.774 4.972 1.00 60.21 H new ATOM 0 HE2 PHE A 23 5.173 -22.201 7.773 1.00 23.44 H new ATOM 0 HZ PHE A 23 4.410 -22.488 5.448 1.00 41.53 H new ATOM 362 N GLU A 24 -0.946 -20.724 11.799 1.00 42.32 N ATOM 363 CA GLU A 24 -1.955 -20.913 12.829 1.00 34.52 C ATOM 364 C GLU A 24 -2.702 -19.617 13.107 1.00 13.44 C ATOM 365 O GLU A 24 -3.331 -19.465 14.154 1.00 64.14 O ATOM 366 CB GLU A 24 -1.306 -21.430 14.115 1.00 21.53 C ATOM 367 CG GLU A 24 -0.568 -22.740 13.932 1.00 61.35 C ATOM 368 CD GLU A 24 -0.178 -23.380 15.242 1.00 2.32 C ATOM 369 OE1 GLU A 24 0.721 -22.852 15.924 1.00 22.23 O ATOM 370 OE2 GLU A 24 -0.768 -24.421 15.592 1.00 50.13 O ATOM 0 H GLU A 24 -0.193 -20.088 12.061 1.00 42.32 H new ATOM 0 HA GLU A 24 -2.673 -21.650 12.469 1.00 34.52 H new ATOM 0 HB2 GLU A 24 -0.610 -20.679 14.489 1.00 21.53 H new ATOM 0 HB3 GLU A 24 -2.076 -21.559 14.876 1.00 21.53 H new ATOM 0 HG2 GLU A 24 -1.196 -23.430 13.369 1.00 61.35 H new ATOM 0 HG3 GLU A 24 0.328 -22.567 13.337 1.00 61.35 H new ATOM 377 N THR A 25 -2.650 -18.686 12.164 1.00 63.24 N ATOM 378 CA THR A 25 -3.358 -17.429 12.317 1.00 13.52 C ATOM 379 C THR A 25 -4.831 -17.597 11.939 1.00 1.24 C ATOM 380 O THR A 25 -5.156 -18.141 10.881 1.00 75.12 O ATOM 381 CB THR A 25 -2.736 -16.316 11.449 1.00 15.12 C ATOM 382 OG1 THR A 25 -1.310 -16.314 11.598 1.00 34.41 O ATOM 383 CG2 THR A 25 -3.287 -14.952 11.844 1.00 13.42 C ATOM 0 H THR A 25 -2.128 -18.779 11.292 1.00 63.24 H new ATOM 0 HA THR A 25 -3.276 -17.138 13.364 1.00 13.52 H new ATOM 0 HB THR A 25 -2.994 -16.513 10.408 1.00 15.12 H new ATOM 0 HG1 THR A 25 -1.045 -17.024 12.220 1.00 34.41 H new ATOM 0 HG21 THR A 25 -2.835 -14.182 11.219 1.00 13.42 H new ATOM 0 HG22 THR A 25 -4.368 -14.942 11.706 1.00 13.42 H new ATOM 0 HG23 THR A 25 -3.053 -14.754 12.890 1.00 13.42 H new ATOM 391 N THR A 26 -5.706 -17.148 12.824 1.00 14.21 N ATOM 392 CA THR A 26 -7.139 -17.152 12.573 1.00 51.43 C ATOM 393 C THR A 26 -7.657 -15.725 12.588 1.00 54.44 C ATOM 394 O THR A 26 -6.990 -14.836 13.125 1.00 75.31 O ATOM 395 CB THR A 26 -7.890 -17.985 13.626 1.00 73.54 C ATOM 396 OG1 THR A 26 -7.432 -17.633 14.934 1.00 13.34 O ATOM 397 CG2 THR A 26 -7.685 -19.473 13.394 1.00 14.14 C ATOM 0 H THR A 26 -5.444 -16.771 13.735 1.00 14.21 H new ATOM 0 HA THR A 26 -7.314 -17.604 11.597 1.00 51.43 H new ATOM 0 HB THR A 26 -8.955 -17.769 13.538 1.00 73.54 H new ATOM 0 HG1 THR A 26 -7.913 -18.164 15.603 1.00 13.34 H new ATOM 0 HG21 THR A 26 -8.227 -20.038 14.153 1.00 14.14 H new ATOM 0 HG22 THR A 26 -8.058 -19.742 12.406 1.00 14.14 H new ATOM 0 HG23 THR A 26 -6.622 -19.708 13.457 1.00 14.14 H new ATOM 405 N ASP A 27 -8.826 -15.508 11.989 1.00 3.12 N ATOM 406 CA ASP A 27 -9.452 -14.184 11.953 1.00 25.03 C ATOM 407 C ASP A 27 -9.635 -13.625 13.359 1.00 11.12 C ATOM 408 O ASP A 27 -9.340 -12.462 13.610 1.00 61.13 O ATOM 409 CB ASP A 27 -10.804 -14.241 11.231 1.00 13.11 C ATOM 410 CG ASP A 27 -11.740 -13.116 11.644 1.00 41.41 C ATOM 411 OD1 ASP A 27 -11.406 -11.939 11.422 1.00 75.20 O ATOM 412 OD2 ASP A 27 -12.826 -13.412 12.181 1.00 22.22 O ATOM 0 H ASP A 27 -9.363 -16.236 11.518 1.00 3.12 H new ATOM 0 HA ASP A 27 -8.787 -13.519 11.401 1.00 25.03 H new ATOM 0 HB2 ASP A 27 -10.638 -14.193 10.155 1.00 13.11 H new ATOM 0 HB3 ASP A 27 -11.281 -15.199 11.438 1.00 13.11 H new ATOM 417 N GLU A 28 -10.079 -14.476 14.274 1.00 72.22 N ATOM 418 CA GLU A 28 -10.358 -14.058 15.644 1.00 51.04 C ATOM 419 C GLU A 28 -9.089 -13.581 16.357 1.00 14.15 C ATOM 420 O GLU A 28 -9.149 -12.704 17.213 1.00 24.45 O ATOM 421 CB GLU A 28 -11.012 -15.201 16.422 1.00 43.42 C ATOM 422 CG GLU A 28 -10.145 -16.444 16.537 1.00 44.52 C ATOM 423 CD GLU A 28 -10.886 -17.609 17.149 1.00 32.53 C ATOM 424 OE1 GLU A 28 -11.169 -17.569 18.361 1.00 72.14 O ATOM 425 OE2 GLU A 28 -11.195 -18.566 16.418 1.00 33.11 O ATOM 0 H GLU A 28 -10.255 -15.464 14.093 1.00 72.22 H new ATOM 0 HA GLU A 28 -11.048 -13.216 15.603 1.00 51.04 H new ATOM 0 HB2 GLU A 28 -11.261 -14.850 17.423 1.00 43.42 H new ATOM 0 HB3 GLU A 28 -11.950 -15.468 15.936 1.00 43.42 H new ATOM 0 HG2 GLU A 28 -9.785 -16.725 15.547 1.00 44.52 H new ATOM 0 HG3 GLU A 28 -9.268 -16.217 17.142 1.00 44.52 H new ATOM 432 N SER A 29 -7.947 -14.147 15.982 1.00 72.24 N ATOM 433 CA SER A 29 -6.676 -13.782 16.592 1.00 51.32 C ATOM 434 C SER A 29 -6.060 -12.570 15.895 1.00 35.25 C ATOM 435 O SER A 29 -5.544 -11.667 16.552 1.00 22.32 O ATOM 436 CB SER A 29 -5.712 -14.968 16.542 1.00 45.32 C ATOM 437 OG SER A 29 -6.333 -16.145 17.035 1.00 1.32 O ATOM 0 H SER A 29 -7.877 -14.861 15.257 1.00 72.24 H new ATOM 0 HA SER A 29 -6.860 -13.515 17.633 1.00 51.32 H new ATOM 0 HB2 SER A 29 -5.380 -15.129 15.516 1.00 45.32 H new ATOM 0 HB3 SER A 29 -4.824 -14.745 17.133 1.00 45.32 H new ATOM 0 HG SER A 29 -6.713 -16.652 16.287 1.00 1.32 H new ATOM 443 N LEU A 30 -6.131 -12.556 14.564 1.00 44.32 N ATOM 444 CA LEU A 30 -5.567 -11.468 13.769 1.00 54.33 C ATOM 445 C LEU A 30 -6.308 -10.163 14.046 1.00 63.41 C ATOM 446 O LEU A 30 -5.692 -9.133 14.320 1.00 52.43 O ATOM 447 CB LEU A 30 -5.642 -11.807 12.274 1.00 64.43 C ATOM 448 CG LEU A 30 -4.975 -10.798 11.334 1.00 73.22 C ATOM 449 CD1 LEU A 30 -3.487 -10.707 11.620 1.00 11.23 C ATOM 450 CD2 LEU A 30 -5.208 -11.182 9.881 1.00 33.41 C ATOM 0 H LEU A 30 -6.576 -13.290 14.013 1.00 44.32 H new ATOM 0 HA LEU A 30 -4.522 -11.342 14.051 1.00 54.33 H new ATOM 0 HB2 LEU A 30 -5.182 -12.782 12.117 1.00 64.43 H new ATOM 0 HB3 LEU A 30 -6.691 -11.901 11.993 1.00 64.43 H new ATOM 0 HG LEU A 30 -5.425 -9.821 11.510 1.00 73.22 H new ATOM 0 HD11 LEU A 30 -3.030 -9.986 10.943 1.00 11.23 H new ATOM 0 HD12 LEU A 30 -3.333 -10.386 12.650 1.00 11.23 H new ATOM 0 HD13 LEU A 30 -3.028 -11.684 11.473 1.00 11.23 H new ATOM 0 HD21 LEU A 30 -4.726 -10.452 9.230 1.00 33.41 H new ATOM 0 HD22 LEU A 30 -4.787 -12.170 9.694 1.00 33.41 H new ATOM 0 HD23 LEU A 30 -6.278 -11.199 9.676 1.00 33.41 H new ATOM 462 N ARG A 31 -7.635 -10.226 13.971 1.00 53.14 N ATOM 463 CA ARG A 31 -8.498 -9.099 14.286 1.00 74.31 C ATOM 464 C ARG A 31 -8.248 -8.578 15.696 1.00 25.12 C ATOM 465 O ARG A 31 -7.908 -7.416 15.867 1.00 32.11 O ATOM 466 CB ARG A 31 -9.955 -9.526 14.144 1.00 63.00 C ATOM 467 CG ARG A 31 -10.961 -8.432 14.427 1.00 32.24 C ATOM 468 CD ARG A 31 -12.373 -8.972 14.329 1.00 25.40 C ATOM 469 NE ARG A 31 -12.596 -9.689 13.070 1.00 65.14 N ATOM 470 CZ ARG A 31 -13.671 -9.554 12.300 1.00 41.42 C ATOM 471 NH1 ARG A 31 -14.655 -8.727 12.640 1.00 55.22 N ATOM 472 NH2 ARG A 31 -13.757 -10.262 11.183 1.00 52.12 N ATOM 0 H ARG A 31 -8.141 -11.066 13.688 1.00 53.14 H new ATOM 0 HA ARG A 31 -8.274 -8.291 13.589 1.00 74.31 H new ATOM 0 HB2 ARG A 31 -10.115 -9.896 13.131 1.00 63.00 H new ATOM 0 HB3 ARG A 31 -10.144 -10.359 14.821 1.00 63.00 H new ATOM 0 HG2 ARG A 31 -10.791 -8.022 15.422 1.00 32.24 H new ATOM 0 HG3 ARG A 31 -10.828 -7.615 13.718 1.00 32.24 H new ATOM 0 HD2 ARG A 31 -12.565 -9.642 15.167 1.00 25.40 H new ATOM 0 HD3 ARG A 31 -13.083 -8.149 14.409 1.00 25.40 H new ATOM 0 HE ARG A 31 -11.873 -10.339 12.762 1.00 65.14 H new ATOM 0 HH11 ARG A 31 -14.591 -8.185 13.502 1.00 55.22 H new ATOM 0 HH12 ARG A 31 -15.474 -8.634 12.039 1.00 55.22 H new ATOM 0 HH21 ARG A 31 -13.004 -10.900 10.924 1.00 52.12 H new ATOM 0 HH22 ARG A 31 -14.576 -10.169 10.582 1.00 52.12 H new ATOM 486 N SER A 32 -8.410 -9.452 16.689 1.00 52.05 N ATOM 487 CA SER A 32 -8.195 -9.103 18.099 1.00 71.25 C ATOM 488 C SER A 32 -6.862 -8.379 18.324 1.00 44.32 C ATOM 489 O SER A 32 -6.772 -7.482 19.165 1.00 25.35 O ATOM 490 CB SER A 32 -8.238 -10.362 18.960 1.00 65.54 C ATOM 491 OG SER A 32 -8.311 -10.043 20.338 1.00 12.40 O ATOM 0 H SER A 32 -8.693 -10.421 16.542 1.00 52.05 H new ATOM 0 HA SER A 32 -8.996 -8.422 18.386 1.00 71.25 H new ATOM 0 HB2 SER A 32 -9.100 -10.968 18.679 1.00 65.54 H new ATOM 0 HB3 SER A 32 -7.350 -10.965 18.771 1.00 65.54 H new ATOM 0 HG SER A 32 -8.339 -10.869 20.864 1.00 12.40 H new ATOM 497 N HIS A 33 -5.849 -8.750 17.548 1.00 40.02 N ATOM 498 CA HIS A 33 -4.529 -8.158 17.686 1.00 53.20 C ATOM 499 C HIS A 33 -4.504 -6.738 17.121 1.00 73.20 C ATOM 500 O HIS A 33 -4.071 -5.811 17.792 1.00 11.54 O ATOM 501 CB HIS A 33 -3.472 -9.013 16.987 1.00 52.02 C ATOM 502 CG HIS A 33 -2.092 -8.803 17.528 1.00 25.54 C ATOM 503 ND1 HIS A 33 -1.116 -8.169 16.797 1.00 72.52 N ATOM 504 CD2 HIS A 33 -1.579 -9.168 18.726 1.00 43.23 C ATOM 505 CE1 HIS A 33 -0.039 -8.167 17.562 1.00 65.13 C ATOM 506 NE2 HIS A 33 -0.274 -8.761 18.738 1.00 2.23 N ATOM 0 H HIS A 33 -5.920 -9.458 16.818 1.00 40.02 H new ATOM 0 HA HIS A 33 -4.298 -8.115 18.750 1.00 53.20 H new ATOM 0 HB2 HIS A 33 -3.739 -10.065 17.089 1.00 52.02 H new ATOM 0 HB3 HIS A 33 -3.476 -8.785 15.921 1.00 52.02 H new ATOM 0 HD1 HIS A 33 -1.205 -7.780 15.858 1.00 72.52 H new ATOM 0 HD2 HIS A 33 -2.100 -9.682 19.520 1.00 43.23 H new ATOM 0 HE1 HIS A 33 0.911 -7.740 17.275 1.00 65.13 H new ATOM 514 N PHE A 34 -5.002 -6.558 15.907 1.00 63.12 N ATOM 515 CA PHE A 34 -4.935 -5.255 15.248 1.00 64.40 C ATOM 516 C PHE A 34 -5.998 -4.298 15.778 1.00 3.13 C ATOM 517 O PHE A 34 -5.883 -3.081 15.614 1.00 23.23 O ATOM 518 CB PHE A 34 -5.041 -5.417 13.732 1.00 42.03 C ATOM 519 CG PHE A 34 -3.726 -5.767 13.096 1.00 71.33 C ATOM 520 CD1 PHE A 34 -2.840 -4.772 12.717 1.00 71.11 C ATOM 521 CD2 PHE A 34 -3.370 -7.090 12.888 1.00 60.52 C ATOM 522 CE1 PHE A 34 -1.626 -5.089 12.140 1.00 1.11 C ATOM 523 CE2 PHE A 34 -2.157 -7.412 12.312 1.00 23.34 C ATOM 524 CZ PHE A 34 -1.282 -6.411 11.937 1.00 64.14 C ATOM 0 H PHE A 34 -5.454 -7.289 15.359 1.00 63.12 H new ATOM 0 HA PHE A 34 -3.966 -4.813 15.479 1.00 64.40 H new ATOM 0 HB2 PHE A 34 -5.770 -6.195 13.503 1.00 42.03 H new ATOM 0 HB3 PHE A 34 -5.416 -4.491 13.297 1.00 42.03 H new ATOM 0 HD1 PHE A 34 -3.102 -3.736 12.875 1.00 71.11 H new ATOM 0 HD2 PHE A 34 -4.049 -7.878 13.180 1.00 60.52 H new ATOM 0 HE1 PHE A 34 -0.946 -4.303 11.847 1.00 1.11 H new ATOM 0 HE2 PHE A 34 -1.892 -8.447 12.155 1.00 23.34 H new ATOM 0 HZ PHE A 34 -0.333 -6.661 11.487 1.00 64.14 H new ATOM 534 N GLU A 35 -7.023 -4.857 16.418 1.00 30.53 N ATOM 535 CA GLU A 35 -8.039 -4.077 17.119 1.00 1.24 C ATOM 536 C GLU A 35 -7.433 -3.160 18.181 1.00 13.41 C ATOM 537 O GLU A 35 -8.044 -2.168 18.577 1.00 53.34 O ATOM 538 CB GLU A 35 -9.033 -5.004 17.801 1.00 73.02 C ATOM 539 CG GLU A 35 -10.158 -5.485 16.909 1.00 41.43 C ATOM 540 CD GLU A 35 -11.241 -6.189 17.691 1.00 2.02 C ATOM 541 OE1 GLU A 35 -10.973 -7.269 18.254 1.00 44.44 O ATOM 542 OE2 GLU A 35 -12.364 -5.657 17.761 1.00 31.32 O ATOM 0 H GLU A 35 -7.172 -5.865 16.465 1.00 30.53 H new ATOM 0 HA GLU A 35 -8.535 -3.462 16.369 1.00 1.24 H new ATOM 0 HB2 GLU A 35 -8.496 -5.871 18.187 1.00 73.02 H new ATOM 0 HB3 GLU A 35 -9.463 -4.487 18.659 1.00 73.02 H new ATOM 0 HG2 GLU A 35 -10.588 -4.635 16.379 1.00 41.43 H new ATOM 0 HG3 GLU A 35 -9.758 -6.162 16.154 1.00 41.43 H new ATOM 549 N GLN A 36 -6.238 -3.504 18.645 1.00 71.45 N ATOM 550 CA GLN A 36 -5.577 -2.757 19.711 1.00 41.45 C ATOM 551 C GLN A 36 -5.213 -1.340 19.274 1.00 73.40 C ATOM 552 O GLN A 36 -5.033 -0.458 20.112 1.00 54.42 O ATOM 553 CB GLN A 36 -4.316 -3.485 20.175 1.00 23.23 C ATOM 554 CG GLN A 36 -4.569 -4.883 20.721 1.00 74.55 C ATOM 555 CD GLN A 36 -3.286 -5.588 21.125 1.00 53.32 C ATOM 556 OE1 GLN A 36 -2.872 -5.535 22.281 1.00 5.43 O ATOM 557 NE2 GLN A 36 -2.631 -6.227 20.169 1.00 32.03 N ATOM 0 H GLN A 36 -5.703 -4.300 18.298 1.00 71.45 H new ATOM 0 HA GLN A 36 -6.285 -2.687 20.537 1.00 41.45 H new ATOM 0 HB2 GLN A 36 -3.621 -3.554 19.338 1.00 23.23 H new ATOM 0 HB3 GLN A 36 -3.828 -2.889 20.946 1.00 23.23 H new ATOM 0 HG2 GLN A 36 -5.232 -4.819 21.584 1.00 74.55 H new ATOM 0 HG3 GLN A 36 -5.085 -5.477 19.966 1.00 74.55 H new ATOM 0 HE21 GLN A 36 -3.006 -6.249 19.221 1.00 32.03 H new ATOM 0 HE22 GLN A 36 -1.751 -6.697 20.380 1.00 32.03 H new ATOM 566 N TRP A 37 -5.103 -1.122 17.973 1.00 2.44 N ATOM 567 CA TRP A 37 -4.754 0.194 17.454 1.00 44.13 C ATOM 568 C TRP A 37 -5.973 0.909 16.905 1.00 72.01 C ATOM 569 O TRP A 37 -6.000 2.138 16.831 1.00 74.51 O ATOM 570 CB TRP A 37 -3.662 0.075 16.391 1.00 22.15 C ATOM 571 CG TRP A 37 -2.349 -0.314 16.990 1.00 72.33 C ATOM 572 CD1 TRP A 37 -1.374 0.526 17.434 1.00 72.42 C ATOM 573 CD2 TRP A 37 -1.881 -1.644 17.241 1.00 20.13 C ATOM 574 NE1 TRP A 37 -0.329 -0.200 17.952 1.00 12.43 N ATOM 575 CE2 TRP A 37 -0.615 -1.534 17.839 1.00 22.13 C ATOM 576 CE3 TRP A 37 -2.412 -2.914 17.012 1.00 61.41 C ATOM 577 CZ2 TRP A 37 0.126 -2.648 18.219 1.00 70.31 C ATOM 578 CZ3 TRP A 37 -1.677 -4.018 17.388 1.00 43.24 C ATOM 579 CH2 TRP A 37 -0.420 -3.880 17.984 1.00 50.52 C ATOM 0 H TRP A 37 -5.249 -1.835 17.259 1.00 2.44 H new ATOM 0 HA TRP A 37 -4.367 0.793 18.278 1.00 44.13 H new ATOM 0 HB2 TRP A 37 -3.957 -0.666 15.648 1.00 22.15 H new ATOM 0 HB3 TRP A 37 -3.557 1.026 15.869 1.00 22.15 H new ATOM 0 HD1 TRP A 37 -1.416 1.604 17.386 1.00 72.42 H new ATOM 0 HE1 TRP A 37 0.522 0.192 18.355 1.00 12.43 H new ATOM 0 HE3 TRP A 37 -3.381 -3.030 16.549 1.00 61.41 H new ATOM 0 HZ2 TRP A 37 1.096 -2.544 18.682 1.00 70.31 H new ATOM 0 HZ3 TRP A 37 -2.079 -5.006 17.219 1.00 43.24 H new ATOM 0 HH2 TRP A 37 0.132 -4.765 18.265 1.00 50.52 H new ATOM 590 N GLY A 38 -6.979 0.143 16.519 1.00 44.14 N ATOM 591 CA GLY A 38 -8.212 0.734 16.067 1.00 75.13 C ATOM 592 C GLY A 38 -9.288 -0.294 15.821 1.00 22.15 C ATOM 593 O GLY A 38 -9.004 -1.485 15.693 1.00 21.32 O ATOM 0 H GLY A 38 -6.961 -0.877 16.512 1.00 44.14 H new ATOM 0 HA2 GLY A 38 -8.562 1.451 16.810 1.00 75.13 H new ATOM 0 HA3 GLY A 38 -8.029 1.291 15.148 1.00 75.13 H new ATOM 597 N THR A 39 -10.523 0.178 15.778 1.00 35.34 N ATOM 598 CA THR A 39 -11.682 -0.663 15.511 1.00 70.34 C ATOM 599 C THR A 39 -11.553 -1.389 14.169 1.00 35.12 C ATOM 600 O THR A 39 -11.073 -0.819 13.188 1.00 13.42 O ATOM 601 CB THR A 39 -12.954 0.207 15.504 1.00 71.21 C ATOM 602 OG1 THR A 39 -12.900 1.132 16.595 1.00 32.11 O ATOM 603 CG2 THR A 39 -14.217 -0.632 15.615 1.00 4.20 C ATOM 0 H THR A 39 -10.753 1.160 15.928 1.00 35.34 H new ATOM 0 HA THR A 39 -11.743 -1.415 16.297 1.00 70.34 H new ATOM 0 HB THR A 39 -12.991 0.739 14.553 1.00 71.21 H new ATOM 0 HG1 THR A 39 -13.707 1.688 16.593 1.00 32.11 H new ATOM 0 HG21 THR A 39 -15.090 0.021 15.606 1.00 4.20 H new ATOM 0 HG22 THR A 39 -14.271 -1.321 14.772 1.00 4.20 H new ATOM 0 HG23 THR A 39 -14.197 -1.198 16.546 1.00 4.20 H new ATOM 611 N LEU A 40 -12.001 -2.637 14.131 1.00 32.24 N ATOM 612 CA LEU A 40 -11.956 -3.436 12.917 1.00 15.13 C ATOM 613 C LEU A 40 -13.365 -3.851 12.537 1.00 60.24 C ATOM 614 O LEU A 40 -14.085 -4.452 13.334 1.00 24.23 O ATOM 615 CB LEU A 40 -11.083 -4.686 13.081 1.00 71.50 C ATOM 616 CG LEU A 40 -9.585 -4.438 13.274 1.00 20.40 C ATOM 617 CD1 LEU A 40 -8.834 -5.750 13.341 1.00 45.32 C ATOM 618 CD2 LEU A 40 -9.025 -3.603 12.147 1.00 44.41 C ATOM 0 H LEU A 40 -12.403 -3.120 14.935 1.00 32.24 H new ATOM 0 HA LEU A 40 -11.513 -2.824 12.132 1.00 15.13 H new ATOM 0 HB2 LEU A 40 -11.451 -5.252 13.937 1.00 71.50 H new ATOM 0 HB3 LEU A 40 -11.216 -5.316 12.202 1.00 71.50 H new ATOM 0 HG LEU A 40 -9.458 -3.898 14.213 1.00 20.40 H new ATOM 0 HD11 LEU A 40 -7.771 -5.554 13.478 1.00 45.32 H new ATOM 0 HD12 LEU A 40 -9.206 -6.340 14.179 1.00 45.32 H new ATOM 0 HD13 LEU A 40 -8.984 -6.303 12.414 1.00 45.32 H new ATOM 0 HD21 LEU A 40 -7.959 -3.442 12.309 1.00 44.41 H new ATOM 0 HD22 LEU A 40 -9.174 -4.123 11.200 1.00 44.41 H new ATOM 0 HD23 LEU A 40 -9.537 -2.641 12.117 1.00 44.41 H new ATOM 630 N THR A 41 -13.754 -3.530 11.321 1.00 45.21 N ATOM 631 CA THR A 41 -15.090 -3.831 10.847 1.00 11.20 C ATOM 632 C THR A 41 -15.091 -5.119 10.019 1.00 11.35 C ATOM 633 O THR A 41 -16.126 -5.769 9.861 1.00 22.33 O ATOM 634 CB THR A 41 -15.686 -2.640 10.051 1.00 72.01 C ATOM 635 OG1 THR A 41 -16.855 -3.040 9.328 1.00 22.45 O ATOM 636 CG2 THR A 41 -14.666 -2.039 9.093 1.00 4.01 C ATOM 0 H THR A 41 -13.161 -3.058 10.639 1.00 45.21 H new ATOM 0 HA THR A 41 -15.731 -3.991 11.714 1.00 11.20 H new ATOM 0 HB THR A 41 -15.964 -1.877 10.778 1.00 72.01 H new ATOM 0 HG1 THR A 41 -17.214 -2.272 8.835 1.00 22.45 H new ATOM 0 HG21 THR A 41 -15.120 -1.208 8.553 1.00 4.01 H new ATOM 0 HG22 THR A 41 -13.805 -1.679 9.657 1.00 4.01 H new ATOM 0 HG23 THR A 41 -14.342 -2.799 8.382 1.00 4.01 H new ATOM 644 N ASP A 42 -13.920 -5.498 9.519 1.00 64.42 N ATOM 645 CA ASP A 42 -13.767 -6.744 8.774 1.00 25.44 C ATOM 646 C ASP A 42 -12.363 -7.284 8.967 1.00 75.54 C ATOM 647 O ASP A 42 -11.445 -6.519 9.243 1.00 35.14 O ATOM 648 CB ASP A 42 -14.013 -6.521 7.279 1.00 73.45 C ATOM 649 CG ASP A 42 -14.206 -7.817 6.521 1.00 72.04 C ATOM 650 OD1 ASP A 42 -15.346 -8.314 6.460 1.00 33.44 O ATOM 651 OD2 ASP A 42 -13.217 -8.348 5.980 1.00 60.44 O ATOM 0 H ASP A 42 -13.060 -4.959 9.616 1.00 64.42 H new ATOM 0 HA ASP A 42 -14.500 -7.458 9.150 1.00 25.44 H new ATOM 0 HB2 ASP A 42 -14.895 -5.894 7.149 1.00 73.45 H new ATOM 0 HB3 ASP A 42 -13.170 -5.977 6.853 1.00 73.45 H new ATOM 656 N CYS A 43 -12.204 -8.591 8.859 1.00 12.45 N ATOM 657 CA CYS A 43 -10.894 -9.217 8.870 1.00 21.12 C ATOM 658 C CYS A 43 -11.023 -10.650 8.373 1.00 55.21 C ATOM 659 O CYS A 43 -11.991 -11.337 8.705 1.00 1.34 O ATOM 660 CB CYS A 43 -10.298 -9.185 10.287 1.00 50.35 C ATOM 661 SG CYS A 43 -8.918 -10.320 10.560 1.00 24.14 S ATOM 0 H CYS A 43 -12.978 -9.248 8.761 1.00 12.45 H new ATOM 0 HA CYS A 43 -10.222 -8.668 8.211 1.00 21.12 H new ATOM 0 HB2 CYS A 43 -9.962 -8.170 10.501 1.00 50.35 H new ATOM 0 HB3 CYS A 43 -11.087 -9.417 11.002 1.00 50.35 H new ATOM 0 HG CYS A 43 -9.366 -11.439 11.046 1.00 24.14 H new ATOM 667 N VAL A 44 -10.096 -11.078 7.527 1.00 35.11 N ATOM 668 CA VAL A 44 -10.063 -12.460 7.078 1.00 5.02 C ATOM 669 C VAL A 44 -8.630 -12.899 6.785 1.00 63.42 C ATOM 670 O VAL A 44 -7.865 -12.181 6.141 1.00 32.10 O ATOM 671 CB VAL A 44 -10.967 -12.672 5.829 1.00 34.42 C ATOM 672 CG1 VAL A 44 -10.629 -11.680 4.727 1.00 21.43 C ATOM 673 CG2 VAL A 44 -10.868 -14.100 5.306 1.00 72.40 C ATOM 0 H VAL A 44 -9.359 -10.489 7.140 1.00 35.11 H new ATOM 0 HA VAL A 44 -10.457 -13.080 7.884 1.00 5.02 H new ATOM 0 HB VAL A 44 -11.996 -12.496 6.143 1.00 34.42 H new ATOM 0 HG11 VAL A 44 -11.278 -11.855 3.869 1.00 21.43 H new ATOM 0 HG12 VAL A 44 -10.778 -10.664 5.094 1.00 21.43 H new ATOM 0 HG13 VAL A 44 -9.589 -11.809 4.428 1.00 21.43 H new ATOM 0 HG21 VAL A 44 -11.512 -14.213 4.434 1.00 72.40 H new ATOM 0 HG22 VAL A 44 -9.837 -14.314 5.026 1.00 72.40 H new ATOM 0 HG23 VAL A 44 -11.185 -14.795 6.084 1.00 72.40 H new ATOM 683 N VAL A 45 -8.263 -14.064 7.293 1.00 3.33 N ATOM 684 CA VAL A 45 -6.966 -14.644 7.000 1.00 34.33 C ATOM 685 C VAL A 45 -7.076 -15.520 5.760 1.00 14.33 C ATOM 686 O VAL A 45 -7.991 -16.338 5.651 1.00 61.41 O ATOM 687 CB VAL A 45 -6.437 -15.487 8.184 1.00 43.31 C ATOM 688 CG1 VAL A 45 -5.043 -16.027 7.899 1.00 50.43 C ATOM 689 CG2 VAL A 45 -6.435 -14.668 9.462 1.00 61.23 C ATOM 0 H VAL A 45 -8.847 -14.626 7.911 1.00 3.33 H new ATOM 0 HA VAL A 45 -6.261 -13.831 6.827 1.00 34.33 H new ATOM 0 HB VAL A 45 -7.107 -16.337 8.313 1.00 43.31 H new ATOM 0 HG11 VAL A 45 -4.700 -16.615 8.750 1.00 50.43 H new ATOM 0 HG12 VAL A 45 -5.072 -16.657 7.010 1.00 50.43 H new ATOM 0 HG13 VAL A 45 -4.358 -15.196 7.732 1.00 50.43 H new ATOM 0 HG21 VAL A 45 -6.060 -15.277 10.284 1.00 61.23 H new ATOM 0 HG22 VAL A 45 -5.793 -13.796 9.334 1.00 61.23 H new ATOM 0 HG23 VAL A 45 -7.450 -14.341 9.686 1.00 61.23 H new ATOM 699 N MET A 46 -6.161 -15.334 4.820 1.00 51.41 N ATOM 700 CA MET A 46 -6.132 -16.161 3.628 1.00 11.34 C ATOM 701 C MET A 46 -5.609 -17.532 3.994 1.00 32.11 C ATOM 702 O MET A 46 -4.594 -17.658 4.678 1.00 2.13 O ATOM 703 CB MET A 46 -5.262 -15.539 2.535 1.00 52.40 C ATOM 704 CG MET A 46 -5.786 -14.215 1.998 1.00 65.41 C ATOM 705 SD MET A 46 -6.961 -14.403 0.635 1.00 63.53 S ATOM 706 CE MET A 46 -8.457 -14.873 1.502 1.00 65.31 C ATOM 0 H MET A 46 -5.433 -14.621 4.861 1.00 51.41 H new ATOM 0 HA MET A 46 -7.145 -16.240 3.233 1.00 11.34 H new ATOM 0 HB2 MET A 46 -4.257 -15.386 2.929 1.00 52.40 H new ATOM 0 HB3 MET A 46 -5.176 -16.245 1.709 1.00 52.40 H new ATOM 0 HG2 MET A 46 -6.267 -13.668 2.809 1.00 65.41 H new ATOM 0 HG3 MET A 46 -4.944 -13.610 1.661 1.00 65.41 H new ATOM 0 HE1 MET A 46 -9.323 -14.458 0.985 1.00 65.31 H new ATOM 0 HE2 MET A 46 -8.536 -15.960 1.528 1.00 65.31 H new ATOM 0 HE3 MET A 46 -8.424 -14.487 2.521 1.00 65.31 H new ATOM 716 N ARG A 47 -6.295 -18.553 3.525 1.00 72.51 N ATOM 717 CA ARG A 47 -6.011 -19.914 3.946 1.00 44.40 C ATOM 718 C ARG A 47 -6.100 -20.872 2.776 1.00 45.20 C ATOM 719 O ARG A 47 -6.719 -20.574 1.756 1.00 24.41 O ATOM 720 CB ARG A 47 -6.973 -20.355 5.053 1.00 33.32 C ATOM 721 CG ARG A 47 -6.871 -19.508 6.308 1.00 51.11 C ATOM 722 CD ARG A 47 -8.078 -19.676 7.204 1.00 73.24 C ATOM 723 NE ARG A 47 -7.976 -20.866 8.046 1.00 63.12 N ATOM 724 CZ ARG A 47 -8.650 -21.041 9.181 1.00 71.34 C ATOM 725 NH1 ARG A 47 -9.482 -20.103 9.621 1.00 75.33 N ATOM 726 NH2 ARG A 47 -8.490 -22.156 9.878 1.00 63.21 N ATOM 0 H ARG A 47 -7.055 -18.469 2.850 1.00 72.51 H new ATOM 0 HA ARG A 47 -4.994 -19.933 4.337 1.00 44.40 H new ATOM 0 HB2 ARG A 47 -7.995 -20.312 4.676 1.00 33.32 H new ATOM 0 HB3 ARG A 47 -6.771 -21.395 5.308 1.00 33.32 H new ATOM 0 HG2 ARG A 47 -5.970 -19.781 6.858 1.00 51.11 H new ATOM 0 HG3 ARG A 47 -6.769 -18.459 6.030 1.00 51.11 H new ATOM 0 HD2 ARG A 47 -8.186 -18.794 7.835 1.00 73.24 H new ATOM 0 HD3 ARG A 47 -8.977 -19.742 6.592 1.00 73.24 H new ATOM 0 HE ARG A 47 -7.348 -21.611 7.745 1.00 63.12 H new ATOM 0 HH11 ARG A 47 -9.608 -19.242 9.088 1.00 75.33 H new ATOM 0 HH12 ARG A 47 -9.995 -20.244 10.491 1.00 75.33 H new ATOM 0 HH21 ARG A 47 -7.852 -22.878 9.545 1.00 63.21 H new ATOM 0 HH22 ARG A 47 -9.005 -22.292 10.748 1.00 63.21 H new ATOM 740 N ASP A 48 -5.443 -22.003 2.937 1.00 50.44 N ATOM 741 CA ASP A 48 -5.482 -23.084 1.973 1.00 61.54 C ATOM 742 C ASP A 48 -6.885 -23.687 1.934 1.00 2.35 C ATOM 743 O ASP A 48 -7.443 -24.008 2.975 1.00 54.03 O ATOM 744 CB ASP A 48 -4.463 -24.151 2.381 1.00 11.45 C ATOM 745 CG ASP A 48 -4.384 -25.296 1.401 1.00 44.30 C ATOM 746 OD1 ASP A 48 -3.631 -25.193 0.412 1.00 64.40 O ATOM 747 OD2 ASP A 48 -5.070 -26.307 1.625 1.00 40.23 O ATOM 0 H ASP A 48 -4.860 -22.199 3.751 1.00 50.44 H new ATOM 0 HA ASP A 48 -5.235 -22.706 0.981 1.00 61.54 H new ATOM 0 HB2 ASP A 48 -3.480 -23.690 2.473 1.00 11.45 H new ATOM 0 HB3 ASP A 48 -4.726 -24.539 3.365 1.00 11.45 H new ATOM 752 N PRO A 49 -7.485 -23.839 0.746 1.00 33.03 N ATOM 753 CA PRO A 49 -8.847 -24.376 0.620 1.00 23.23 C ATOM 754 C PRO A 49 -8.947 -25.864 0.964 1.00 64.02 C ATOM 755 O PRO A 49 -10.022 -26.355 1.301 1.00 13.53 O ATOM 756 CB PRO A 49 -9.180 -24.147 -0.856 1.00 70.02 C ATOM 757 CG PRO A 49 -7.863 -24.079 -1.547 1.00 22.54 C ATOM 758 CD PRO A 49 -6.906 -23.474 -0.559 1.00 63.43 C ATOM 0 HA PRO A 49 -9.532 -23.890 1.315 1.00 23.23 H new ATOM 0 HB2 PRO A 49 -9.791 -24.958 -1.252 1.00 70.02 H new ATOM 0 HB3 PRO A 49 -9.745 -23.225 -0.994 1.00 70.02 H new ATOM 0 HG2 PRO A 49 -7.532 -25.071 -1.853 1.00 22.54 H new ATOM 0 HG3 PRO A 49 -7.927 -23.472 -2.450 1.00 22.54 H new ATOM 0 HD2 PRO A 49 -5.899 -23.875 -0.678 1.00 63.43 H new ATOM 0 HD3 PRO A 49 -6.835 -22.393 -0.679 1.00 63.43 H new ATOM 766 N ASN A 50 -7.832 -26.577 0.878 1.00 43.31 N ATOM 767 CA ASN A 50 -7.826 -28.023 1.098 1.00 65.31 C ATOM 768 C ASN A 50 -7.705 -28.365 2.581 1.00 43.02 C ATOM 769 O ASN A 50 -8.540 -29.083 3.136 1.00 65.50 O ATOM 770 CB ASN A 50 -6.674 -28.683 0.327 1.00 74.23 C ATOM 771 CG ASN A 50 -6.952 -28.862 -1.158 1.00 41.44 C ATOM 772 OD1 ASN A 50 -6.452 -29.799 -1.780 1.00 44.24 O ATOM 773 ND2 ASN A 50 -7.742 -27.970 -1.738 1.00 41.33 N ATOM 0 H ASN A 50 -6.918 -26.181 0.658 1.00 43.31 H new ATOM 0 HA ASN A 50 -8.777 -28.409 0.731 1.00 65.31 H new ATOM 0 HB2 ASN A 50 -5.775 -28.079 0.449 1.00 74.23 H new ATOM 0 HB3 ASN A 50 -6.465 -29.658 0.768 1.00 74.23 H new ATOM 0 HD21 ASN A 50 -7.954 -28.047 -2.733 1.00 41.33 H new ATOM 0 HD22 ASN A 50 -8.138 -27.207 -1.190 1.00 41.33 H new ATOM 780 N THR A 51 -6.665 -27.841 3.218 1.00 54.34 N ATOM 781 CA THR A 51 -6.345 -28.192 4.599 1.00 74.22 C ATOM 782 C THR A 51 -6.759 -27.085 5.577 1.00 14.42 C ATOM 783 O THR A 51 -6.711 -27.266 6.796 1.00 0.34 O ATOM 784 CB THR A 51 -4.835 -28.481 4.737 1.00 62.44 C ATOM 785 OG1 THR A 51 -4.389 -29.241 3.604 1.00 2.44 O ATOM 786 CG2 THR A 51 -4.525 -29.263 6.008 1.00 63.23 C ATOM 0 H THR A 51 -6.024 -27.167 2.798 1.00 54.34 H new ATOM 0 HA THR A 51 -6.911 -29.088 4.852 1.00 74.22 H new ATOM 0 HB THR A 51 -4.316 -27.524 4.787 1.00 62.44 H new ATOM 0 HG1 THR A 51 -3.430 -29.424 3.690 1.00 2.44 H new ATOM 0 HG21 THR A 51 -3.452 -29.447 6.069 1.00 63.23 H new ATOM 0 HG22 THR A 51 -4.845 -28.687 6.877 1.00 63.23 H new ATOM 0 HG23 THR A 51 -5.056 -30.215 5.988 1.00 63.23 H new ATOM 794 N LYS A 52 -7.156 -25.941 5.023 1.00 63.45 N ATOM 795 CA LYS A 52 -7.672 -24.804 5.799 1.00 61.12 C ATOM 796 C LYS A 52 -6.614 -24.237 6.745 1.00 74.24 C ATOM 797 O LYS A 52 -6.928 -23.773 7.844 1.00 63.24 O ATOM 798 CB LYS A 52 -8.936 -25.185 6.585 1.00 62.22 C ATOM 799 CG LYS A 52 -10.038 -25.832 5.751 1.00 61.13 C ATOM 800 CD LYS A 52 -10.318 -25.064 4.468 1.00 63.42 C ATOM 801 CE LYS A 52 -11.686 -25.413 3.896 1.00 72.22 C ATOM 802 NZ LYS A 52 -11.780 -26.846 3.504 1.00 62.30 N ATOM 0 H LYS A 52 -7.130 -25.771 4.018 1.00 63.45 H new ATOM 0 HA LYS A 52 -7.935 -24.028 5.080 1.00 61.12 H new ATOM 0 HB2 LYS A 52 -8.656 -25.870 7.386 1.00 62.22 H new ATOM 0 HB3 LYS A 52 -9.337 -24.288 7.058 1.00 62.22 H new ATOM 0 HG2 LYS A 52 -9.751 -26.854 5.505 1.00 61.13 H new ATOM 0 HG3 LYS A 52 -10.951 -25.891 6.343 1.00 61.13 H new ATOM 0 HD2 LYS A 52 -10.267 -23.993 4.665 1.00 63.42 H new ATOM 0 HD3 LYS A 52 -9.546 -25.289 3.732 1.00 63.42 H new ATOM 0 HE2 LYS A 52 -12.455 -25.188 4.635 1.00 72.22 H new ATOM 0 HE3 LYS A 52 -11.886 -24.786 3.027 1.00 72.22 H new ATOM 0 HZ1 LYS A 52 -12.742 -27.051 3.168 1.00 62.30 H new ATOM 0 HZ2 LYS A 52 -11.098 -27.043 2.744 1.00 62.30 H new ATOM 0 HZ3 LYS A 52 -11.565 -27.446 4.326 1.00 62.30 H new ATOM 816 N ARG A 53 -5.364 -24.252 6.305 1.00 50.30 N ATOM 817 CA ARG A 53 -4.277 -23.686 7.092 1.00 22.33 C ATOM 818 C ARG A 53 -3.944 -22.324 6.520 1.00 24.33 C ATOM 819 O ARG A 53 -4.251 -22.065 5.363 1.00 11.30 O ATOM 820 CB ARG A 53 -3.039 -24.592 7.067 1.00 51.15 C ATOM 821 CG ARG A 53 -3.311 -26.038 7.466 1.00 71.24 C ATOM 822 CD ARG A 53 -3.973 -26.144 8.835 1.00 70.21 C ATOM 823 NE ARG A 53 -3.183 -25.509 9.893 1.00 71.24 N ATOM 824 CZ ARG A 53 -3.713 -24.967 10.991 1.00 74.24 C ATOM 825 NH1 ARG A 53 -5.028 -24.983 11.179 1.00 61.20 N ATOM 826 NH2 ARG A 53 -2.926 -24.415 11.905 1.00 22.43 N ATOM 0 H ARG A 53 -5.077 -24.649 5.410 1.00 50.30 H new ATOM 0 HA ARG A 53 -4.589 -23.597 8.133 1.00 22.33 H new ATOM 0 HB2 ARG A 53 -2.614 -24.578 6.064 1.00 51.15 H new ATOM 0 HB3 ARG A 53 -2.287 -24.178 7.738 1.00 51.15 H new ATOM 0 HG2 ARG A 53 -3.951 -26.505 6.718 1.00 71.24 H new ATOM 0 HG3 ARG A 53 -2.373 -26.593 7.474 1.00 71.24 H new ATOM 0 HD2 ARG A 53 -4.959 -25.681 8.795 1.00 70.21 H new ATOM 0 HD3 ARG A 53 -4.125 -27.195 9.081 1.00 70.21 H new ATOM 0 HE ARG A 53 -2.169 -25.480 9.784 1.00 71.24 H new ATOM 0 HH11 ARG A 53 -5.638 -25.411 10.482 1.00 61.20 H new ATOM 0 HH12 ARG A 53 -5.428 -24.567 12.020 1.00 61.20 H new ATOM 0 HH21 ARG A 53 -1.915 -24.405 11.769 1.00 22.43 H new ATOM 0 HH22 ARG A 53 -3.332 -24.001 12.744 1.00 22.43 H new ATOM 840 N SER A 54 -3.314 -21.462 7.296 1.00 52.45 N ATOM 841 CA SER A 54 -3.076 -20.100 6.854 1.00 35.12 C ATOM 842 C SER A 54 -2.034 -20.072 5.741 1.00 63.40 C ATOM 843 O SER A 54 -1.050 -20.808 5.774 1.00 3.32 O ATOM 844 CB SER A 54 -2.632 -19.237 8.037 1.00 23.13 C ATOM 845 OG SER A 54 -2.173 -17.962 7.619 1.00 65.32 O ATOM 0 H SER A 54 -2.960 -21.678 8.228 1.00 52.45 H new ATOM 0 HA SER A 54 -4.005 -19.692 6.455 1.00 35.12 H new ATOM 0 HB2 SER A 54 -3.465 -19.114 8.729 1.00 23.13 H new ATOM 0 HB3 SER A 54 -1.838 -19.748 8.581 1.00 23.13 H new ATOM 0 HG SER A 54 -1.324 -17.758 8.064 1.00 65.32 H new ATOM 851 N ARG A 55 -2.269 -19.215 4.754 1.00 2.35 N ATOM 852 CA ARG A 55 -1.363 -19.060 3.626 1.00 15.45 C ATOM 853 C ARG A 55 -0.248 -18.091 3.970 1.00 0.21 C ATOM 854 O ARG A 55 0.574 -17.745 3.123 1.00 25.22 O ATOM 855 CB ARG A 55 -2.118 -18.544 2.406 1.00 23.44 C ATOM 856 CG ARG A 55 -2.876 -19.614 1.652 1.00 14.45 C ATOM 857 CD ARG A 55 -3.732 -19.004 0.560 1.00 4.22 C ATOM 858 NE ARG A 55 -4.157 -20.002 -0.413 1.00 11.12 N ATOM 859 CZ ARG A 55 -5.229 -19.889 -1.189 1.00 1.13 C ATOM 860 NH1 ARG A 55 -6.007 -18.814 -1.116 1.00 45.22 N ATOM 861 NH2 ARG A 55 -5.504 -20.849 -2.057 1.00 43.20 N ATOM 0 H ARG A 55 -3.090 -18.611 4.714 1.00 2.35 H new ATOM 0 HA ARG A 55 -0.934 -20.036 3.400 1.00 15.45 H new ATOM 0 HB2 ARG A 55 -2.819 -17.773 2.725 1.00 23.44 H new ATOM 0 HB3 ARG A 55 -1.409 -18.069 1.727 1.00 23.44 H new ATOM 0 HG2 ARG A 55 -2.173 -20.323 1.215 1.00 14.45 H new ATOM 0 HG3 ARG A 55 -3.506 -20.174 2.343 1.00 14.45 H new ATOM 0 HD2 ARG A 55 -4.609 -18.533 1.005 1.00 4.22 H new ATOM 0 HD3 ARG A 55 -3.171 -18.218 0.054 1.00 4.22 H new ATOM 0 HE ARG A 55 -3.592 -20.846 -0.505 1.00 11.12 H new ATOM 0 HH11 ARG A 55 -5.783 -18.066 -0.460 1.00 45.22 H new ATOM 0 HH12 ARG A 55 -6.828 -18.737 -1.716 1.00 45.22 H new ATOM 0 HH21 ARG A 55 -4.896 -21.665 -2.125 1.00 43.20 H new ATOM 0 HH22 ARG A 55 -6.325 -20.773 -2.658 1.00 43.20 H new ATOM 875 N GLY A 56 -0.216 -17.666 5.220 1.00 2.43 N ATOM 876 CA GLY A 56 0.792 -16.731 5.652 1.00 2.40 C ATOM 877 C GLY A 56 0.461 -15.295 5.331 1.00 22.44 C ATOM 878 O GLY A 56 1.345 -14.447 5.359 1.00 12.20 O ATOM 0 H GLY A 56 -0.873 -17.954 5.945 1.00 2.43 H new ATOM 0 HA2 GLY A 56 0.931 -16.831 6.728 1.00 2.40 H new ATOM 0 HA3 GLY A 56 1.741 -16.990 5.183 1.00 2.40 H new ATOM 882 N PHE A 57 -0.796 -14.999 5.020 1.00 32.12 N ATOM 883 CA PHE A 57 -1.199 -13.623 4.789 1.00 32.53 C ATOM 884 C PHE A 57 -2.710 -13.466 4.930 1.00 4.13 C ATOM 885 O PHE A 57 -3.453 -14.439 4.830 1.00 34.05 O ATOM 886 CB PHE A 57 -0.703 -13.115 3.420 1.00 54.32 C ATOM 887 CG PHE A 57 -1.206 -13.865 2.208 1.00 51.32 C ATOM 888 CD1 PHE A 57 -0.573 -15.021 1.777 1.00 0.21 C ATOM 889 CD2 PHE A 57 -2.285 -13.393 1.480 1.00 21.01 C ATOM 890 CE1 PHE A 57 -1.010 -15.692 0.651 1.00 65.43 C ATOM 891 CE2 PHE A 57 -2.722 -14.056 0.348 1.00 4.31 C ATOM 892 CZ PHE A 57 -2.083 -15.208 -0.064 1.00 63.50 C ATOM 0 H PHE A 57 -1.543 -15.686 4.924 1.00 32.12 H new ATOM 0 HA PHE A 57 -0.729 -13.004 5.553 1.00 32.53 H new ATOM 0 HB2 PHE A 57 -0.990 -12.068 3.319 1.00 54.32 H new ATOM 0 HB3 PHE A 57 0.386 -13.149 3.416 1.00 54.32 H new ATOM 0 HD1 PHE A 57 0.273 -15.402 2.329 1.00 0.21 H new ATOM 0 HD2 PHE A 57 -2.792 -12.495 1.801 1.00 21.01 H new ATOM 0 HE1 PHE A 57 -0.511 -16.595 0.332 1.00 65.43 H new ATOM 0 HE2 PHE A 57 -3.562 -13.673 -0.213 1.00 4.31 H new ATOM 0 HZ PHE A 57 -2.424 -15.729 -0.946 1.00 63.50 H new ATOM 902 N GLY A 58 -3.148 -12.242 5.196 1.00 32.11 N ATOM 903 CA GLY A 58 -4.560 -11.960 5.382 1.00 2.01 C ATOM 904 C GLY A 58 -4.853 -10.481 5.238 1.00 73.25 C ATOM 905 O GLY A 58 -4.029 -9.740 4.709 1.00 70.14 O ATOM 0 H GLY A 58 -2.541 -11.428 5.287 1.00 32.11 H new ATOM 0 HA2 GLY A 58 -5.144 -12.521 4.652 1.00 2.01 H new ATOM 0 HA3 GLY A 58 -4.873 -12.300 6.369 1.00 2.01 H new ATOM 909 N PHE A 59 -6.020 -10.045 5.702 1.00 53.32 N ATOM 910 CA PHE A 59 -6.400 -8.634 5.626 1.00 13.03 C ATOM 911 C PHE A 59 -7.174 -8.220 6.869 1.00 52.33 C ATOM 912 O PHE A 59 -7.893 -9.025 7.460 1.00 61.22 O ATOM 913 CB PHE A 59 -7.279 -8.330 4.400 1.00 14.42 C ATOM 914 CG PHE A 59 -6.932 -9.100 3.160 1.00 44.10 C ATOM 915 CD1 PHE A 59 -6.014 -8.610 2.246 1.00 33.31 C ATOM 916 CD2 PHE A 59 -7.528 -10.321 2.918 1.00 5.01 C ATOM 917 CE1 PHE A 59 -5.703 -9.330 1.109 1.00 33.30 C ATOM 918 CE2 PHE A 59 -7.225 -11.044 1.790 1.00 23.33 C ATOM 919 CZ PHE A 59 -6.307 -10.551 0.881 1.00 13.55 C ATOM 0 H PHE A 59 -6.721 -10.647 6.135 1.00 53.32 H new ATOM 0 HA PHE A 59 -5.469 -8.073 5.544 1.00 13.03 H new ATOM 0 HB2 PHE A 59 -8.318 -8.536 4.658 1.00 14.42 H new ATOM 0 HB3 PHE A 59 -7.210 -7.265 4.178 1.00 14.42 H new ATOM 0 HD1 PHE A 59 -5.537 -7.657 2.424 1.00 33.31 H new ATOM 0 HD2 PHE A 59 -8.243 -10.714 3.626 1.00 5.01 H new ATOM 0 HE1 PHE A 59 -4.989 -8.939 0.400 1.00 33.30 H new ATOM 0 HE2 PHE A 59 -7.703 -11.996 1.613 1.00 23.33 H new ATOM 0 HZ PHE A 59 -6.063 -11.119 -0.005 1.00 13.55 H new ATOM 929 N VAL A 60 -7.026 -6.960 7.250 1.00 53.43 N ATOM 930 CA VAL A 60 -7.814 -6.374 8.327 1.00 1.24 C ATOM 931 C VAL A 60 -8.406 -5.045 7.868 1.00 41.20 C ATOM 932 O VAL A 60 -7.694 -4.173 7.381 1.00 60.23 O ATOM 933 CB VAL A 60 -6.997 -6.154 9.627 1.00 22.44 C ATOM 934 CG1 VAL A 60 -6.737 -7.472 10.336 1.00 22.12 C ATOM 935 CG2 VAL A 60 -5.683 -5.446 9.338 1.00 72.12 C ATOM 0 H VAL A 60 -6.359 -6.316 6.824 1.00 53.43 H new ATOM 0 HA VAL A 60 -8.605 -7.086 8.562 1.00 1.24 H new ATOM 0 HB VAL A 60 -7.592 -5.518 10.283 1.00 22.44 H new ATOM 0 HG11 VAL A 60 -6.163 -7.289 11.244 1.00 22.12 H new ATOM 0 HG12 VAL A 60 -7.687 -7.939 10.595 1.00 22.12 H new ATOM 0 HG13 VAL A 60 -6.175 -8.134 9.678 1.00 22.12 H new ATOM 0 HG21 VAL A 60 -5.133 -5.306 10.268 1.00 72.12 H new ATOM 0 HG22 VAL A 60 -5.088 -6.049 8.652 1.00 72.12 H new ATOM 0 HG23 VAL A 60 -5.885 -4.475 8.886 1.00 72.12 H new ATOM 945 N THR A 61 -9.707 -4.908 7.997 1.00 13.30 N ATOM 946 CA THR A 61 -10.384 -3.683 7.621 1.00 4.32 C ATOM 947 C THR A 61 -10.692 -2.854 8.857 1.00 4.41 C ATOM 948 O THR A 61 -11.442 -3.285 9.734 1.00 4.25 O ATOM 949 CB THR A 61 -11.686 -3.966 6.851 1.00 14.41 C ATOM 950 OG1 THR A 61 -11.445 -4.943 5.830 1.00 21.44 O ATOM 951 CG2 THR A 61 -12.229 -2.698 6.208 1.00 62.43 C ATOM 0 H THR A 61 -10.323 -5.635 8.362 1.00 13.30 H new ATOM 0 HA THR A 61 -9.716 -3.127 6.963 1.00 4.32 H new ATOM 0 HB THR A 61 -12.422 -4.342 7.561 1.00 14.41 H new ATOM 0 HG1 THR A 61 -12.222 -4.993 5.235 1.00 21.44 H new ATOM 0 HG21 THR A 61 -13.149 -2.928 5.671 1.00 62.43 H new ATOM 0 HG22 THR A 61 -12.435 -1.958 6.981 1.00 62.43 H new ATOM 0 HG23 THR A 61 -11.492 -2.299 5.511 1.00 62.43 H new ATOM 959 N TYR A 62 -10.118 -1.665 8.911 1.00 44.53 N ATOM 960 CA TYR A 62 -10.298 -0.773 10.038 1.00 2.10 C ATOM 961 C TYR A 62 -11.572 0.028 9.862 1.00 21.44 C ATOM 962 O TYR A 62 -12.145 0.062 8.776 1.00 42.40 O ATOM 963 CB TYR A 62 -9.100 0.170 10.173 1.00 11.11 C ATOM 964 CG TYR A 62 -7.956 -0.406 10.975 1.00 2.23 C ATOM 965 CD1 TYR A 62 -7.972 -0.352 12.361 1.00 60.22 C ATOM 966 CD2 TYR A 62 -6.865 -1.003 10.356 1.00 4.41 C ATOM 967 CE1 TYR A 62 -6.938 -0.873 13.109 1.00 53.52 C ATOM 968 CE2 TYR A 62 -5.824 -1.528 11.100 1.00 51.54 C ATOM 969 CZ TYR A 62 -5.867 -1.458 12.477 1.00 74.45 C ATOM 970 OH TYR A 62 -4.839 -1.981 13.226 1.00 0.14 O ATOM 0 H TYR A 62 -9.516 -1.293 8.176 1.00 44.53 H new ATOM 0 HA TYR A 62 -10.373 -1.370 10.947 1.00 2.10 H new ATOM 0 HB2 TYR A 62 -8.739 0.428 9.177 1.00 11.11 H new ATOM 0 HB3 TYR A 62 -9.430 1.096 10.643 1.00 11.11 H new ATOM 0 HD1 TYR A 62 -8.811 0.107 12.864 1.00 60.22 H new ATOM 0 HD2 TYR A 62 -6.829 -1.058 9.278 1.00 4.41 H new ATOM 0 HE1 TYR A 62 -6.969 -0.822 14.187 1.00 53.52 H new ATOM 0 HE2 TYR A 62 -4.982 -1.990 10.606 1.00 51.54 H new ATOM 0 HH TYR A 62 -5.199 -2.362 14.054 1.00 0.14 H new ATOM 980 N ALA A 63 -12.024 0.652 10.932 1.00 35.20 N ATOM 981 CA ALA A 63 -13.220 1.471 10.875 1.00 74.24 C ATOM 982 C ALA A 63 -12.936 2.789 10.166 1.00 20.22 C ATOM 983 O ALA A 63 -13.753 3.266 9.388 1.00 62.52 O ATOM 984 CB ALA A 63 -13.756 1.714 12.273 1.00 33.24 C ATOM 0 H ALA A 63 -11.582 0.608 11.850 1.00 35.20 H new ATOM 0 HA ALA A 63 -13.980 0.939 10.303 1.00 74.24 H new ATOM 0 HB1 ALA A 63 -14.654 2.330 12.217 1.00 33.24 H new ATOM 0 HB2 ALA A 63 -13.999 0.760 12.740 1.00 33.24 H new ATOM 0 HB3 ALA A 63 -13.001 2.227 12.868 1.00 33.24 H new ATOM 990 N THR A 64 -11.760 3.348 10.414 1.00 14.33 N ATOM 991 CA THR A 64 -11.383 4.634 9.837 1.00 4.43 C ATOM 992 C THR A 64 -9.971 4.558 9.250 1.00 40.53 C ATOM 993 O THR A 64 -9.158 3.735 9.679 1.00 1.34 O ATOM 994 CB THR A 64 -11.441 5.752 10.905 1.00 74.11 C ATOM 995 OG1 THR A 64 -12.551 5.524 11.786 1.00 5.11 O ATOM 996 CG2 THR A 64 -11.579 7.129 10.265 1.00 10.25 C ATOM 0 H THR A 64 -11.047 2.931 11.013 1.00 14.33 H new ATOM 0 HA THR A 64 -12.091 4.870 9.043 1.00 4.43 H new ATOM 0 HB THR A 64 -10.507 5.727 11.466 1.00 74.11 H new ATOM 0 HG1 THR A 64 -12.583 6.233 12.462 1.00 5.11 H new ATOM 0 HG21 THR A 64 -11.617 7.890 11.044 1.00 10.25 H new ATOM 0 HG22 THR A 64 -10.723 7.316 9.616 1.00 10.25 H new ATOM 0 HG23 THR A 64 -12.496 7.166 9.676 1.00 10.25 H new ATOM 1004 N VAL A 65 -9.687 5.403 8.264 1.00 51.32 N ATOM 1005 CA VAL A 65 -8.364 5.459 7.652 1.00 63.22 C ATOM 1006 C VAL A 65 -7.298 5.930 8.654 1.00 32.13 C ATOM 1007 O VAL A 65 -6.149 5.504 8.584 1.00 22.24 O ATOM 1008 CB VAL A 65 -8.368 6.356 6.383 1.00 34.24 C ATOM 1009 CG1 VAL A 65 -8.710 7.799 6.716 1.00 44.51 C ATOM 1010 CG2 VAL A 65 -7.043 6.280 5.643 1.00 60.40 C ATOM 0 H VAL A 65 -10.359 6.061 7.870 1.00 51.32 H new ATOM 0 HA VAL A 65 -8.105 4.445 7.346 1.00 63.22 H new ATOM 0 HB VAL A 65 -9.147 5.970 5.725 1.00 34.24 H new ATOM 0 HG11 VAL A 65 -8.703 8.395 5.803 1.00 44.51 H new ATOM 0 HG12 VAL A 65 -9.700 7.843 7.170 1.00 44.51 H new ATOM 0 HG13 VAL A 65 -7.973 8.196 7.414 1.00 44.51 H new ATOM 0 HG21 VAL A 65 -7.082 6.919 4.761 1.00 60.40 H new ATOM 0 HG22 VAL A 65 -6.240 6.615 6.299 1.00 60.40 H new ATOM 0 HG23 VAL A 65 -6.856 5.251 5.337 1.00 60.40 H new ATOM 1020 N GLU A 66 -7.670 6.816 9.576 1.00 45.43 N ATOM 1021 CA GLU A 66 -6.769 7.225 10.657 1.00 74.12 C ATOM 1022 C GLU A 66 -6.330 6.042 11.531 1.00 32.32 C ATOM 1023 O GLU A 66 -5.195 6.014 12.013 1.00 52.24 O ATOM 1024 CB GLU A 66 -7.443 8.292 11.514 1.00 22.35 C ATOM 1025 CG GLU A 66 -7.965 9.470 10.706 1.00 22.11 C ATOM 1026 CD GLU A 66 -8.471 10.599 11.574 1.00 31.10 C ATOM 1027 OE1 GLU A 66 -7.641 11.364 12.110 1.00 73.33 O ATOM 1028 OE2 GLU A 66 -9.701 10.727 11.727 1.00 24.24 O ATOM 0 H GLU A 66 -8.586 7.264 9.598 1.00 45.43 H new ATOM 0 HA GLU A 66 -5.869 7.634 10.198 1.00 74.12 H new ATOM 0 HB2 GLU A 66 -8.271 7.840 12.061 1.00 22.35 H new ATOM 0 HB3 GLU A 66 -6.732 8.655 12.256 1.00 22.35 H new ATOM 0 HG2 GLU A 66 -7.170 9.843 10.061 1.00 22.11 H new ATOM 0 HG3 GLU A 66 -8.770 9.130 10.055 1.00 22.11 H new ATOM 1035 N GLU A 67 -7.223 5.065 11.719 1.00 70.12 N ATOM 1036 CA GLU A 67 -6.884 3.842 12.453 1.00 13.22 C ATOM 1037 C GLU A 67 -5.820 3.059 11.689 1.00 64.14 C ATOM 1038 O GLU A 67 -4.957 2.410 12.279 1.00 51.12 O ATOM 1039 CB GLU A 67 -8.112 2.951 12.635 1.00 1.22 C ATOM 1040 CG GLU A 67 -9.329 3.646 13.220 1.00 34.42 C ATOM 1041 CD GLU A 67 -9.160 4.032 14.670 1.00 54.22 C ATOM 1042 OE1 GLU A 67 -8.468 5.027 14.953 1.00 60.21 O ATOM 1043 OE2 GLU A 67 -9.748 3.354 15.532 1.00 60.15 O ATOM 0 H GLU A 67 -8.183 5.097 11.374 1.00 70.12 H new ATOM 0 HA GLU A 67 -6.509 4.133 13.434 1.00 13.22 H new ATOM 0 HB2 GLU A 67 -8.383 2.530 11.667 1.00 1.22 H new ATOM 0 HB3 GLU A 67 -7.843 2.116 13.282 1.00 1.22 H new ATOM 0 HG2 GLU A 67 -9.543 4.541 12.636 1.00 34.42 H new ATOM 0 HG3 GLU A 67 -10.194 2.989 13.125 1.00 34.42 H new ATOM 1050 N VAL A 68 -5.904 3.143 10.364 1.00 61.24 N ATOM 1051 CA VAL A 68 -4.938 2.519 9.468 1.00 22.41 C ATOM 1052 C VAL A 68 -3.548 3.103 9.668 1.00 2.53 C ATOM 1053 O VAL A 68 -2.570 2.367 9.788 1.00 61.14 O ATOM 1054 CB VAL A 68 -5.374 2.694 7.991 1.00 41.54 C ATOM 1055 CG1 VAL A 68 -4.191 2.700 7.023 1.00 71.11 C ATOM 1056 CG2 VAL A 68 -6.355 1.612 7.615 1.00 15.55 C ATOM 0 H VAL A 68 -6.647 3.648 9.881 1.00 61.24 H new ATOM 0 HA VAL A 68 -4.904 1.456 9.706 1.00 22.41 H new ATOM 0 HB VAL A 68 -5.852 3.670 7.908 1.00 41.54 H new ATOM 0 HG11 VAL A 68 -4.556 2.825 6.004 1.00 71.11 H new ATOM 0 HG12 VAL A 68 -3.521 3.523 7.273 1.00 71.11 H new ATOM 0 HG13 VAL A 68 -3.652 1.756 7.102 1.00 71.11 H new ATOM 0 HG21 VAL A 68 -6.658 1.740 6.576 1.00 15.55 H new ATOM 0 HG22 VAL A 68 -5.885 0.636 7.738 1.00 15.55 H new ATOM 0 HG23 VAL A 68 -7.232 1.676 8.259 1.00 15.55 H new ATOM 1066 N ASP A 69 -3.473 4.427 9.719 1.00 72.35 N ATOM 1067 CA ASP A 69 -2.196 5.117 9.813 1.00 10.42 C ATOM 1068 C ASP A 69 -1.469 4.751 11.101 1.00 13.52 C ATOM 1069 O ASP A 69 -0.271 4.484 11.083 1.00 14.14 O ATOM 1070 CB ASP A 69 -2.395 6.626 9.737 1.00 1.35 C ATOM 1071 CG ASP A 69 -1.104 7.344 9.423 1.00 32.22 C ATOM 1072 OD1 ASP A 69 -0.774 7.483 8.228 1.00 40.34 O ATOM 1073 OD2 ASP A 69 -0.408 7.773 10.365 1.00 53.42 O ATOM 0 H ASP A 69 -4.285 5.044 9.697 1.00 72.35 H new ATOM 0 HA ASP A 69 -1.583 4.799 8.970 1.00 10.42 H new ATOM 0 HB2 ASP A 69 -3.136 6.857 8.972 1.00 1.35 H new ATOM 0 HB3 ASP A 69 -2.792 6.989 10.685 1.00 1.35 H new ATOM 1078 N ALA A 70 -2.198 4.755 12.213 1.00 71.12 N ATOM 1079 CA ALA A 70 -1.658 4.309 13.497 1.00 2.25 C ATOM 1080 C ALA A 70 -1.131 2.875 13.439 1.00 21.45 C ATOM 1081 O ALA A 70 -0.096 2.568 14.030 1.00 75.34 O ATOM 1082 CB ALA A 70 -2.710 4.440 14.584 1.00 50.44 C ATOM 0 H ALA A 70 -3.169 5.064 12.252 1.00 71.12 H new ATOM 0 HA ALA A 70 -0.812 4.954 13.733 1.00 2.25 H new ATOM 0 HB1 ALA A 70 -2.295 4.105 15.534 1.00 50.44 H new ATOM 0 HB2 ALA A 70 -3.017 5.482 14.670 1.00 50.44 H new ATOM 0 HB3 ALA A 70 -3.575 3.827 14.329 1.00 50.44 H new ATOM 1088 N ALA A 71 -1.826 2.007 12.713 1.00 34.53 N ATOM 1089 CA ALA A 71 -1.376 0.628 12.545 1.00 31.51 C ATOM 1090 C ALA A 71 -0.089 0.583 11.725 1.00 63.34 C ATOM 1091 O ALA A 71 0.813 -0.213 11.997 1.00 74.51 O ATOM 1092 CB ALA A 71 -2.455 -0.209 11.879 1.00 31.34 C ATOM 0 H ALA A 71 -2.698 2.230 12.233 1.00 34.53 H new ATOM 0 HA ALA A 71 -1.175 0.211 13.532 1.00 31.51 H new ATOM 0 HB1 ALA A 71 -2.101 -1.233 11.762 1.00 31.34 H new ATOM 0 HB2 ALA A 71 -3.353 -0.204 12.497 1.00 31.34 H new ATOM 0 HB3 ALA A 71 -2.686 0.209 10.899 1.00 31.34 H new ATOM 1098 N MET A 72 -0.008 1.463 10.732 1.00 44.35 N ATOM 1099 CA MET A 72 1.170 1.571 9.881 1.00 31.20 C ATOM 1100 C MET A 72 2.355 2.136 10.658 1.00 60.12 C ATOM 1101 O MET A 72 3.495 1.729 10.441 1.00 30.33 O ATOM 1102 CB MET A 72 0.882 2.461 8.663 1.00 52.12 C ATOM 1103 CG MET A 72 -0.230 1.952 7.750 1.00 63.20 C ATOM 1104 SD MET A 72 0.352 0.851 6.440 1.00 20.54 S ATOM 1105 CE MET A 72 0.925 -0.557 7.370 1.00 53.44 C ATOM 0 H MET A 72 -0.754 2.118 10.496 1.00 44.35 H new ATOM 0 HA MET A 72 1.421 0.568 9.537 1.00 31.20 H new ATOM 0 HB2 MET A 72 0.618 3.459 9.013 1.00 52.12 H new ATOM 0 HB3 MET A 72 1.797 2.560 8.078 1.00 52.12 H new ATOM 0 HG2 MET A 72 -0.970 1.426 8.353 1.00 63.20 H new ATOM 0 HG3 MET A 72 -0.736 2.805 7.298 1.00 63.20 H new ATOM 0 HE1 MET A 72 0.742 -1.468 6.801 1.00 53.44 H new ATOM 0 HE2 MET A 72 1.994 -0.457 7.560 1.00 53.44 H new ATOM 0 HE3 MET A 72 0.391 -0.608 8.319 1.00 53.44 H new ATOM 1115 N ASN A 73 2.079 3.051 11.580 1.00 13.42 N ATOM 1116 CA ASN A 73 3.138 3.721 12.329 1.00 32.51 C ATOM 1117 C ASN A 73 3.574 2.899 13.539 1.00 32.53 C ATOM 1118 O ASN A 73 4.555 3.228 14.207 1.00 43.35 O ATOM 1119 CB ASN A 73 2.711 5.156 12.722 1.00 4.14 C ATOM 1120 CG ASN A 73 1.761 5.288 13.913 1.00 24.11 C ATOM 1121 OD1 ASN A 73 1.854 4.586 14.919 1.00 41.21 O ATOM 1122 ND2 ASN A 73 0.824 6.213 13.796 1.00 51.23 N ATOM 0 H ASN A 73 1.134 3.346 11.827 1.00 13.42 H new ATOM 0 HA ASN A 73 4.009 3.807 11.679 1.00 32.51 H new ATOM 0 HB2 ASN A 73 3.611 5.731 12.939 1.00 4.14 H new ATOM 0 HB3 ASN A 73 2.238 5.619 11.856 1.00 4.14 H new ATOM 0 HD21 ASN A 73 0.154 6.359 14.551 1.00 51.23 H new ATOM 0 HD22 ASN A 73 0.771 6.781 12.950 1.00 51.23 H new ATOM 1129 N ALA A 74 2.852 1.817 13.803 1.00 32.42 N ATOM 1130 CA ALA A 74 3.163 0.939 14.924 1.00 34.34 C ATOM 1131 C ALA A 74 3.918 -0.293 14.446 1.00 62.42 C ATOM 1132 O ALA A 74 4.425 -1.076 15.249 1.00 41.32 O ATOM 1133 CB ALA A 74 1.892 0.534 15.647 1.00 55.41 C ATOM 0 H ALA A 74 2.044 1.526 13.253 1.00 32.42 H new ATOM 0 HA ALA A 74 3.800 1.483 15.621 1.00 34.34 H new ATOM 0 HB1 ALA A 74 2.141 -0.122 16.481 1.00 55.41 H new ATOM 0 HB2 ALA A 74 1.388 1.424 16.023 1.00 55.41 H new ATOM 0 HB3 ALA A 74 1.233 0.008 14.957 1.00 55.41 H new ATOM 1139 N ARG A 75 3.947 -0.458 13.126 1.00 54.31 N ATOM 1140 CA ARG A 75 4.692 -1.523 12.465 1.00 31.35 C ATOM 1141 C ARG A 75 6.158 -1.525 12.916 1.00 34.45 C ATOM 1142 O ARG A 75 6.737 -0.458 13.131 1.00 1.25 O ATOM 1143 CB ARG A 75 4.595 -1.300 10.955 1.00 30.03 C ATOM 1144 CG ARG A 75 4.769 -2.552 10.126 1.00 41.05 C ATOM 1145 CD ARG A 75 4.545 -2.279 8.650 1.00 71.23 C ATOM 1146 NE ARG A 75 5.625 -1.482 8.071 1.00 45.12 N ATOM 1147 CZ ARG A 75 6.186 -1.733 6.890 1.00 12.40 C ATOM 1148 NH1 ARG A 75 5.764 -2.756 6.155 1.00 13.42 N ATOM 1149 NH2 ARG A 75 7.167 -0.961 6.443 1.00 63.04 N ATOM 0 H ARG A 75 3.448 0.152 12.479 1.00 54.31 H new ATOM 0 HA ARG A 75 4.270 -2.492 12.731 1.00 31.35 H new ATOM 0 HB2 ARG A 75 3.624 -0.860 10.727 1.00 30.03 H new ATOM 0 HB3 ARG A 75 5.352 -0.574 10.658 1.00 30.03 H new ATOM 0 HG2 ARG A 75 5.772 -2.951 10.275 1.00 41.05 H new ATOM 0 HG3 ARG A 75 4.069 -3.315 10.466 1.00 41.05 H new ATOM 0 HD2 ARG A 75 4.465 -3.225 8.114 1.00 71.23 H new ATOM 0 HD3 ARG A 75 3.598 -1.757 8.518 1.00 71.23 H new ATOM 0 HE ARG A 75 5.970 -0.684 8.605 1.00 45.12 H new ATOM 0 HH11 ARG A 75 5.009 -3.351 6.495 1.00 13.42 H new ATOM 0 HH12 ARG A 75 6.195 -2.946 5.250 1.00 13.42 H new ATOM 0 HH21 ARG A 75 7.493 -0.174 7.004 1.00 63.04 H new ATOM 0 HH22 ARG A 75 7.596 -1.154 5.538 1.00 63.04 H new ATOM 1163 N PRO A 76 6.798 -2.706 13.064 1.00 44.24 N ATOM 1164 CA PRO A 76 6.214 -4.023 12.771 1.00 65.13 C ATOM 1165 C PRO A 76 5.298 -4.556 13.870 1.00 43.25 C ATOM 1166 O PRO A 76 5.222 -4.005 14.965 1.00 14.23 O ATOM 1167 CB PRO A 76 7.437 -4.942 12.619 1.00 20.32 C ATOM 1168 CG PRO A 76 8.641 -4.076 12.803 1.00 11.45 C ATOM 1169 CD PRO A 76 8.179 -2.849 13.528 1.00 14.02 C ATOM 0 HA PRO A 76 5.576 -3.968 11.889 1.00 65.13 H new ATOM 0 HB2 PRO A 76 7.417 -5.741 13.360 1.00 20.32 H new ATOM 0 HB3 PRO A 76 7.446 -5.417 11.638 1.00 20.32 H new ATOM 0 HG2 PRO A 76 9.409 -4.597 13.374 1.00 11.45 H new ATOM 0 HG3 PRO A 76 9.081 -3.815 11.841 1.00 11.45 H new ATOM 0 HD2 PRO A 76 8.233 -2.973 14.610 1.00 14.02 H new ATOM 0 HD3 PRO A 76 8.784 -1.978 13.277 1.00 14.02 H new ATOM 1177 N HIS A 77 4.598 -5.633 13.545 1.00 15.45 N ATOM 1178 CA HIS A 77 3.677 -6.275 14.476 1.00 3.01 C ATOM 1179 C HIS A 77 3.986 -7.759 14.563 1.00 34.05 C ATOM 1180 O HIS A 77 4.655 -8.309 13.690 1.00 2.55 O ATOM 1181 CB HIS A 77 2.217 -6.079 14.044 1.00 55.42 C ATOM 1182 CG HIS A 77 1.763 -4.654 14.037 1.00 5.30 C ATOM 1183 ND1 HIS A 77 1.035 -4.125 15.067 1.00 14.01 N ATOM 1184 CD2 HIS A 77 1.945 -3.706 13.093 1.00 61.14 C ATOM 1185 CE1 HIS A 77 0.790 -2.872 14.728 1.00 22.50 C ATOM 1186 NE2 HIS A 77 1.321 -2.573 13.539 1.00 35.44 N ATOM 0 H HIS A 77 4.651 -6.086 12.633 1.00 15.45 H new ATOM 0 HA HIS A 77 3.809 -5.811 15.453 1.00 3.01 H new ATOM 0 HB2 HIS A 77 2.087 -6.494 13.045 1.00 55.42 H new ATOM 0 HB3 HIS A 77 1.573 -6.650 14.713 1.00 55.42 H new ATOM 0 HD2 HIS A 77 2.481 -3.820 12.163 1.00 61.14 H new ATOM 0 HE1 HIS A 77 0.231 -2.176 15.336 1.00 22.50 H new ATOM 0 HE2 HIS A 77 1.271 -1.675 13.058 1.00 35.44 H new ATOM 1194 N LYS A 78 3.518 -8.404 15.619 1.00 71.25 N ATOM 1195 CA LYS A 78 3.715 -9.835 15.774 1.00 13.33 C ATOM 1196 C LYS A 78 2.424 -10.532 16.203 1.00 3.30 C ATOM 1197 O LYS A 78 2.015 -10.448 17.360 1.00 13.22 O ATOM 1198 CB LYS A 78 4.840 -10.119 16.775 1.00 41.20 C ATOM 1199 CG LYS A 78 4.933 -11.581 17.178 1.00 63.24 C ATOM 1200 CD LYS A 78 6.316 -11.943 17.689 1.00 25.44 C ATOM 1201 CE LYS A 78 7.325 -12.063 16.557 1.00 62.01 C ATOM 1202 NZ LYS A 78 8.686 -12.386 17.063 1.00 72.55 N ATOM 0 H LYS A 78 3.001 -7.961 16.379 1.00 71.25 H new ATOM 0 HA LYS A 78 4.004 -10.238 14.803 1.00 13.33 H new ATOM 0 HB2 LYS A 78 5.790 -9.808 16.341 1.00 41.20 H new ATOM 0 HB3 LYS A 78 4.684 -9.513 17.667 1.00 41.20 H new ATOM 0 HG2 LYS A 78 4.194 -11.792 17.951 1.00 63.24 H new ATOM 0 HG3 LYS A 78 4.687 -12.209 16.322 1.00 63.24 H new ATOM 0 HD2 LYS A 78 6.652 -11.184 18.396 1.00 25.44 H new ATOM 0 HD3 LYS A 78 6.267 -12.886 18.233 1.00 25.44 H new ATOM 0 HE2 LYS A 78 7.002 -12.838 15.862 1.00 62.01 H new ATOM 0 HE3 LYS A 78 7.357 -11.128 15.998 1.00 62.01 H new ATOM 0 HZ1 LYS A 78 9.346 -12.460 16.262 1.00 72.55 H new ATOM 0 HZ2 LYS A 78 9.005 -11.634 17.706 1.00 72.55 H new ATOM 0 HZ3 LYS A 78 8.660 -13.291 17.575 1.00 72.55 H new ATOM 1216 N VAL A 79 1.796 -11.221 15.258 1.00 52.52 N ATOM 1217 CA VAL A 79 0.576 -11.970 15.530 1.00 13.43 C ATOM 1218 C VAL A 79 0.880 -13.463 15.595 1.00 53.32 C ATOM 1219 O VAL A 79 1.497 -14.013 14.681 1.00 12.31 O ATOM 1220 CB VAL A 79 -0.506 -11.724 14.451 1.00 62.13 C ATOM 1221 CG1 VAL A 79 -1.830 -12.362 14.849 1.00 52.31 C ATOM 1222 CG2 VAL A 79 -0.685 -10.235 14.194 1.00 32.32 C ATOM 0 H VAL A 79 2.114 -11.276 14.291 1.00 52.52 H new ATOM 0 HA VAL A 79 0.191 -11.621 16.488 1.00 13.43 H new ATOM 0 HB VAL A 79 -0.169 -12.193 13.527 1.00 62.13 H new ATOM 0 HG11 VAL A 79 -2.572 -12.174 14.073 1.00 52.31 H new ATOM 0 HG12 VAL A 79 -1.695 -13.437 14.969 1.00 52.31 H new ATOM 0 HG13 VAL A 79 -2.172 -11.933 15.791 1.00 52.31 H new ATOM 0 HG21 VAL A 79 -1.450 -10.087 13.432 1.00 32.32 H new ATOM 0 HG22 VAL A 79 -0.990 -9.741 15.116 1.00 32.32 H new ATOM 0 HG23 VAL A 79 0.257 -9.809 13.849 1.00 32.32 H new ATOM 1232 N ASP A 80 0.475 -14.092 16.699 1.00 23.14 N ATOM 1233 CA ASP A 80 0.613 -15.543 16.897 1.00 63.11 C ATOM 1234 C ASP A 80 2.091 -15.951 16.914 1.00 13.23 C ATOM 1235 O ASP A 80 2.482 -16.978 16.359 1.00 73.12 O ATOM 1236 CB ASP A 80 -0.168 -16.320 15.818 1.00 72.02 C ATOM 1237 CG ASP A 80 -0.331 -17.792 16.155 1.00 63.20 C ATOM 1238 OD1 ASP A 80 -0.995 -18.107 17.167 1.00 33.32 O ATOM 1239 OD2 ASP A 80 0.194 -18.640 15.402 1.00 21.41 O ATOM 0 H ASP A 80 0.040 -13.611 17.486 1.00 23.14 H new ATOM 0 HA ASP A 80 0.185 -15.798 17.866 1.00 63.11 H new ATOM 0 HB2 ASP A 80 -1.153 -15.869 15.693 1.00 72.02 H new ATOM 0 HB3 ASP A 80 0.349 -16.226 14.863 1.00 72.02 H new ATOM 1244 N GLY A 81 2.912 -15.130 17.560 1.00 24.44 N ATOM 1245 CA GLY A 81 4.331 -15.417 17.676 1.00 63.02 C ATOM 1246 C GLY A 81 5.052 -15.363 16.343 1.00 63.20 C ATOM 1247 O GLY A 81 6.061 -16.042 16.142 1.00 31.33 O ATOM 0 H GLY A 81 2.617 -14.263 18.009 1.00 24.44 H new ATOM 0 HA2 GLY A 81 4.787 -14.701 18.360 1.00 63.02 H new ATOM 0 HA3 GLY A 81 4.462 -16.406 18.115 1.00 63.02 H new ATOM 1251 N ARG A 82 4.528 -14.563 15.429 1.00 31.03 N ATOM 1252 CA ARG A 82 5.110 -14.430 14.107 1.00 24.13 C ATOM 1253 C ARG A 82 5.235 -12.959 13.739 1.00 33.03 C ATOM 1254 O ARG A 82 4.341 -12.173 14.032 1.00 44.53 O ATOM 1255 CB ARG A 82 4.238 -15.151 13.079 1.00 11.50 C ATOM 1256 CG ARG A 82 4.910 -15.325 11.735 1.00 64.55 C ATOM 1257 CD ARG A 82 5.726 -16.601 11.700 1.00 25.34 C ATOM 1258 NE ARG A 82 6.453 -16.747 10.448 1.00 22.23 N ATOM 1259 CZ ARG A 82 7.592 -17.423 10.316 1.00 31.24 C ATOM 1260 NH1 ARG A 82 8.143 -18.025 11.364 1.00 23.14 N ATOM 1261 NH2 ARG A 82 8.183 -17.490 9.131 1.00 1.01 N ATOM 0 H ARG A 82 3.696 -13.993 15.581 1.00 31.03 H new ATOM 0 HA ARG A 82 6.103 -14.880 14.110 1.00 24.13 H new ATOM 0 HB2 ARG A 82 3.965 -16.131 13.470 1.00 11.50 H new ATOM 0 HB3 ARG A 82 3.312 -14.592 12.944 1.00 11.50 H new ATOM 0 HG2 ARG A 82 4.157 -15.349 10.948 1.00 64.55 H new ATOM 0 HG3 ARG A 82 5.555 -14.470 11.533 1.00 64.55 H new ATOM 0 HD2 ARG A 82 6.431 -16.604 12.531 1.00 25.34 H new ATOM 0 HD3 ARG A 82 5.066 -17.458 11.839 1.00 25.34 H new ATOM 0 HE ARG A 82 6.064 -16.302 9.617 1.00 22.23 H new ATOM 0 HH11 ARG A 82 7.693 -17.971 12.278 1.00 23.14 H new ATOM 0 HH12 ARG A 82 9.016 -18.541 11.255 1.00 23.14 H new ATOM 0 HH21 ARG A 82 7.765 -17.025 8.325 1.00 1.01 H new ATOM 0 HH22 ARG A 82 9.056 -18.007 9.025 1.00 1.01 H new ATOM 1275 N VAL A 83 6.338 -12.592 13.098 1.00 3.12 N ATOM 1276 CA VAL A 83 6.545 -11.209 12.686 1.00 42.31 C ATOM 1277 C VAL A 83 5.735 -10.933 11.430 1.00 75.52 C ATOM 1278 O VAL A 83 6.046 -11.448 10.357 1.00 51.41 O ATOM 1279 CB VAL A 83 8.025 -10.880 12.394 1.00 45.54 C ATOM 1280 CG1 VAL A 83 8.187 -9.390 12.119 1.00 45.11 C ATOM 1281 CG2 VAL A 83 8.925 -11.311 13.538 1.00 73.11 C ATOM 0 H VAL A 83 7.098 -13.227 12.854 1.00 3.12 H new ATOM 0 HA VAL A 83 6.224 -10.581 13.517 1.00 42.31 H new ATOM 0 HB VAL A 83 8.326 -11.439 11.508 1.00 45.54 H new ATOM 0 HG11 VAL A 83 9.235 -9.170 11.914 1.00 45.11 H new ATOM 0 HG12 VAL A 83 7.582 -9.111 11.256 1.00 45.11 H new ATOM 0 HG13 VAL A 83 7.860 -8.822 12.990 1.00 45.11 H new ATOM 0 HG21 VAL A 83 9.960 -11.065 13.300 1.00 73.11 H new ATOM 0 HG22 VAL A 83 8.629 -10.791 14.449 1.00 73.11 H new ATOM 0 HG23 VAL A 83 8.833 -12.387 13.688 1.00 73.11 H new ATOM 1291 N VAL A 84 4.699 -10.131 11.569 1.00 13.23 N ATOM 1292 CA VAL A 84 3.805 -9.857 10.462 1.00 54.15 C ATOM 1293 C VAL A 84 4.056 -8.463 9.904 1.00 64.21 C ATOM 1294 O VAL A 84 4.502 -7.555 10.615 1.00 51.11 O ATOM 1295 CB VAL A 84 2.318 -10.010 10.867 1.00 62.35 C ATOM 1296 CG1 VAL A 84 2.127 -11.271 11.689 1.00 51.44 C ATOM 1297 CG2 VAL A 84 1.804 -8.796 11.629 1.00 41.33 C ATOM 0 H VAL A 84 4.455 -9.657 12.439 1.00 13.23 H new ATOM 0 HA VAL A 84 4.015 -10.595 9.688 1.00 54.15 H new ATOM 0 HB VAL A 84 1.734 -10.086 9.950 1.00 62.35 H new ATOM 0 HG11 VAL A 84 1.078 -11.368 11.968 1.00 51.44 H new ATOM 0 HG12 VAL A 84 2.428 -12.138 11.101 1.00 51.44 H new ATOM 0 HG13 VAL A 84 2.738 -11.214 12.590 1.00 51.44 H new ATOM 0 HG21 VAL A 84 0.757 -8.948 11.892 1.00 41.33 H new ATOM 0 HG22 VAL A 84 2.391 -8.661 12.538 1.00 41.33 H new ATOM 0 HG23 VAL A 84 1.895 -7.908 11.003 1.00 41.33 H new ATOM 1307 N GLU A 85 3.806 -8.318 8.622 1.00 41.42 N ATOM 1308 CA GLU A 85 3.978 -7.048 7.954 1.00 71.42 C ATOM 1309 C GLU A 85 2.655 -6.544 7.401 1.00 13.22 C ATOM 1310 O GLU A 85 2.238 -6.954 6.321 1.00 33.35 O ATOM 1311 CB GLU A 85 4.983 -7.176 6.813 1.00 62.44 C ATOM 1312 CG GLU A 85 5.855 -5.946 6.652 1.00 31.11 C ATOM 1313 CD GLU A 85 6.765 -6.017 5.446 1.00 62.03 C ATOM 1314 OE1 GLU A 85 7.560 -6.973 5.353 1.00 72.45 O ATOM 1315 OE2 GLU A 85 6.700 -5.110 4.593 1.00 42.24 O ATOM 0 H GLU A 85 3.480 -9.072 8.017 1.00 41.42 H new ATOM 0 HA GLU A 85 4.352 -6.335 8.688 1.00 71.42 H new ATOM 0 HB2 GLU A 85 5.618 -8.044 6.991 1.00 62.44 H new ATOM 0 HB3 GLU A 85 4.446 -7.359 5.882 1.00 62.44 H new ATOM 0 HG2 GLU A 85 5.218 -5.065 6.568 1.00 31.11 H new ATOM 0 HG3 GLU A 85 6.460 -5.817 7.549 1.00 31.11 H new ATOM 1322 N PRO A 86 1.958 -5.672 8.142 1.00 63.33 N ATOM 1323 CA PRO A 86 0.779 -5.006 7.619 1.00 55.22 C ATOM 1324 C PRO A 86 1.167 -4.014 6.535 1.00 30.32 C ATOM 1325 O PRO A 86 2.119 -3.248 6.683 1.00 32.43 O ATOM 1326 CB PRO A 86 0.180 -4.291 8.829 1.00 50.00 C ATOM 1327 CG PRO A 86 1.290 -4.160 9.808 1.00 42.54 C ATOM 1328 CD PRO A 86 2.253 -5.282 9.529 1.00 30.12 C ATOM 0 HA PRO A 86 0.073 -5.698 7.160 1.00 55.22 H new ATOM 0 HB2 PRO A 86 -0.214 -3.314 8.551 1.00 50.00 H new ATOM 0 HB3 PRO A 86 -0.648 -4.861 9.250 1.00 50.00 H new ATOM 0 HG2 PRO A 86 1.783 -3.193 9.706 1.00 42.54 H new ATOM 0 HG3 PRO A 86 0.913 -4.219 10.829 1.00 42.54 H new ATOM 0 HD2 PRO A 86 3.287 -4.956 9.640 1.00 30.12 H new ATOM 0 HD3 PRO A 86 2.105 -6.114 10.217 1.00 30.12 H new ATOM 1336 N LYS A 87 0.476 -4.100 5.423 1.00 50.01 N ATOM 1337 CA LYS A 87 0.676 -3.189 4.321 1.00 0.12 C ATOM 1338 C LYS A 87 -0.663 -2.613 3.914 1.00 15.11 C ATOM 1339 O LYS A 87 -1.681 -2.943 4.505 1.00 75.52 O ATOM 1340 CB LYS A 87 1.332 -3.904 3.128 1.00 22.43 C ATOM 1341 CG LYS A 87 2.523 -4.772 3.511 1.00 54.01 C ATOM 1342 CD LYS A 87 3.578 -4.806 2.420 1.00 10.54 C ATOM 1343 CE LYS A 87 4.476 -6.019 2.575 1.00 41.34 C ATOM 1344 NZ LYS A 87 5.546 -6.052 1.549 1.00 1.04 N ATOM 0 H LYS A 87 -0.242 -4.805 5.257 1.00 50.01 H new ATOM 0 HA LYS A 87 1.344 -2.388 4.636 1.00 0.12 H new ATOM 0 HB2 LYS A 87 0.585 -4.526 2.634 1.00 22.43 H new ATOM 0 HB3 LYS A 87 1.656 -3.158 2.403 1.00 22.43 H new ATOM 0 HG2 LYS A 87 2.966 -4.393 4.432 1.00 54.01 H new ATOM 0 HG3 LYS A 87 2.181 -5.786 3.716 1.00 54.01 H new ATOM 0 HD2 LYS A 87 3.096 -4.828 1.443 1.00 10.54 H new ATOM 0 HD3 LYS A 87 4.178 -3.897 2.460 1.00 10.54 H new ATOM 0 HE2 LYS A 87 4.926 -6.013 3.568 1.00 41.34 H new ATOM 0 HE3 LYS A 87 3.876 -6.926 2.503 1.00 41.34 H new ATOM 0 HZ1 LYS A 87 6.196 -6.838 1.751 1.00 1.04 H new ATOM 0 HZ2 LYS A 87 5.122 -6.186 0.609 1.00 1.04 H new ATOM 0 HZ3 LYS A 87 6.072 -5.155 1.567 1.00 1.04 H new ATOM 1358 N ARG A 88 -0.666 -1.766 2.913 1.00 25.30 N ATOM 1359 CA ARG A 88 -1.896 -1.160 2.442 1.00 40.43 C ATOM 1360 C ARG A 88 -2.672 -2.163 1.579 1.00 71.41 C ATOM 1361 O ARG A 88 -2.088 -3.094 1.023 1.00 13.21 O ATOM 1362 CB ARG A 88 -1.547 0.092 1.645 1.00 63.02 C ATOM 1363 CG ARG A 88 -2.334 1.339 2.014 1.00 41.54 C ATOM 1364 CD ARG A 88 -3.732 1.326 1.419 1.00 72.11 C ATOM 1365 NE ARG A 88 -4.392 2.623 1.557 1.00 52.04 N ATOM 1366 CZ ARG A 88 -5.173 2.962 2.578 1.00 13.34 C ATOM 1367 NH1 ARG A 88 -5.404 2.099 3.566 1.00 24.44 N ATOM 1368 NH2 ARG A 88 -5.727 4.167 2.610 1.00 11.00 N ATOM 0 H ARG A 88 0.170 -1.478 2.405 1.00 25.30 H new ATOM 0 HA ARG A 88 -2.529 -0.882 3.285 1.00 40.43 H new ATOM 0 HB2 ARG A 88 -0.485 0.301 1.775 1.00 63.02 H new ATOM 0 HB3 ARG A 88 -1.703 -0.116 0.587 1.00 63.02 H new ATOM 0 HG2 ARG A 88 -2.402 1.417 3.099 1.00 41.54 H new ATOM 0 HG3 ARG A 88 -1.799 2.222 1.664 1.00 41.54 H new ATOM 0 HD2 ARG A 88 -3.676 1.057 0.364 1.00 72.11 H new ATOM 0 HD3 ARG A 88 -4.330 0.559 1.912 1.00 72.11 H new ATOM 0 HE ARG A 88 -4.243 3.314 0.821 1.00 52.04 H new ATOM 0 HH11 ARG A 88 -4.981 1.171 3.542 1.00 24.44 H new ATOM 0 HH12 ARG A 88 -6.004 2.366 4.346 1.00 24.44 H new ATOM 0 HH21 ARG A 88 -5.553 4.829 1.853 1.00 11.00 H new ATOM 0 HH22 ARG A 88 -6.327 4.432 3.391 1.00 11.00 H new ATOM 1382 N ALA A 89 -3.985 -1.992 1.494 1.00 73.21 N ATOM 1383 CA ALA A 89 -4.806 -2.860 0.666 1.00 13.32 C ATOM 1384 C ALA A 89 -5.231 -2.136 -0.598 1.00 54.21 C ATOM 1385 O ALA A 89 -6.197 -1.371 -0.598 1.00 30.44 O ATOM 1386 CB ALA A 89 -6.019 -3.361 1.422 1.00 74.21 C ATOM 0 H ALA A 89 -4.501 -1.263 1.987 1.00 73.21 H new ATOM 0 HA ALA A 89 -4.204 -3.726 0.391 1.00 13.32 H new ATOM 0 HB1 ALA A 89 -6.611 -4.007 0.773 1.00 74.21 H new ATOM 0 HB2 ALA A 89 -5.695 -3.924 2.297 1.00 74.21 H new ATOM 0 HB3 ALA A 89 -6.625 -2.513 1.740 1.00 74.21 H new ATOM 1392 N VAL A 90 -4.491 -2.376 -1.657 1.00 62.23 N ATOM 1393 CA VAL A 90 -4.762 -1.770 -2.942 1.00 44.55 C ATOM 1394 C VAL A 90 -6.005 -2.394 -3.582 1.00 35.44 C ATOM 1395 O VAL A 90 -6.419 -3.500 -3.214 1.00 64.53 O ATOM 1396 CB VAL A 90 -3.538 -1.911 -3.883 1.00 31.02 C ATOM 1397 CG1 VAL A 90 -3.312 -3.359 -4.298 1.00 54.35 C ATOM 1398 CG2 VAL A 90 -3.677 -1.013 -5.097 1.00 3.42 C ATOM 0 H VAL A 90 -3.683 -2.998 -1.652 1.00 62.23 H new ATOM 0 HA VAL A 90 -4.953 -0.709 -2.784 1.00 44.55 H new ATOM 0 HB VAL A 90 -2.659 -1.590 -3.324 1.00 31.02 H new ATOM 0 HG11 VAL A 90 -2.446 -3.418 -4.957 1.00 54.35 H new ATOM 0 HG12 VAL A 90 -3.135 -3.968 -3.412 1.00 54.35 H new ATOM 0 HG13 VAL A 90 -4.193 -3.729 -4.823 1.00 54.35 H new ATOM 0 HG21 VAL A 90 -2.805 -1.132 -5.740 1.00 3.42 H new ATOM 0 HG22 VAL A 90 -4.575 -1.286 -5.651 1.00 3.42 H new ATOM 0 HG23 VAL A 90 -3.751 0.026 -4.775 1.00 3.42 H new ATOM 1408 N SER A 91 -6.620 -1.656 -4.504 1.00 55.01 N ATOM 1409 CA SER A 91 -7.715 -2.174 -5.301 1.00 41.31 C ATOM 1410 C SER A 91 -7.272 -3.457 -5.995 1.00 33.45 C ATOM 1411 O SER A 91 -6.121 -3.563 -6.433 1.00 44.21 O ATOM 1412 CB SER A 91 -8.115 -1.138 -6.352 1.00 32.41 C ATOM 1413 OG SER A 91 -7.819 0.175 -5.910 1.00 22.14 O ATOM 0 H SER A 91 -6.371 -0.689 -4.714 1.00 55.01 H new ATOM 0 HA SER A 91 -8.568 -2.384 -4.656 1.00 41.31 H new ATOM 0 HB2 SER A 91 -7.588 -1.339 -7.285 1.00 32.41 H new ATOM 0 HB3 SER A 91 -9.181 -1.223 -6.564 1.00 32.41 H new ATOM 0 HG SER A 91 -8.145 0.293 -4.993 1.00 22.14 H new ATOM 1419 N ARG A 92 -8.179 -4.425 -6.106 1.00 3.12 N ATOM 1420 CA ARG A 92 -7.849 -5.728 -6.682 1.00 44.21 C ATOM 1421 C ARG A 92 -7.414 -5.594 -8.149 1.00 53.31 C ATOM 1422 O ARG A 92 -6.769 -6.486 -8.699 1.00 74.40 O ATOM 1423 CB ARG A 92 -9.036 -6.690 -6.547 1.00 23.34 C ATOM 1424 CG ARG A 92 -8.683 -8.142 -6.839 1.00 42.32 C ATOM 1425 CD ARG A 92 -7.705 -8.709 -5.817 1.00 12.40 C ATOM 1426 NE ARG A 92 -7.267 -10.056 -6.172 1.00 3.14 N ATOM 1427 CZ ARG A 92 -6.266 -10.708 -5.578 1.00 15.51 C ATOM 1428 NH1 ARG A 92 -5.584 -10.146 -4.587 1.00 52.35 N ATOM 1429 NH2 ARG A 92 -5.943 -11.928 -5.984 1.00 40.12 N ATOM 0 H ARG A 92 -9.149 -4.332 -5.805 1.00 3.12 H new ATOM 0 HA ARG A 92 -7.007 -6.141 -6.126 1.00 44.21 H new ATOM 0 HB2 ARG A 92 -9.437 -6.619 -5.536 1.00 23.34 H new ATOM 0 HB3 ARG A 92 -9.828 -6.374 -7.226 1.00 23.34 H new ATOM 0 HG2 ARG A 92 -9.593 -8.743 -6.842 1.00 42.32 H new ATOM 0 HG3 ARG A 92 -8.249 -8.216 -7.836 1.00 42.32 H new ATOM 0 HD2 ARG A 92 -6.838 -8.053 -5.742 1.00 12.40 H new ATOM 0 HD3 ARG A 92 -8.177 -8.728 -4.835 1.00 12.40 H new ATOM 0 HE ARG A 92 -7.761 -10.532 -6.927 1.00 3.14 H new ATOM 0 HH11 ARG A 92 -5.823 -9.206 -4.272 1.00 52.35 H new ATOM 0 HH12 ARG A 92 -4.821 -10.654 -4.141 1.00 52.35 H new ATOM 0 HH21 ARG A 92 -6.459 -12.365 -6.748 1.00 40.12 H new ATOM 0 HH22 ARG A 92 -5.178 -12.430 -5.533 1.00 40.12 H new ATOM 1443 N GLU A 93 -7.740 -4.455 -8.748 1.00 54.12 N ATOM 1444 CA GLU A 93 -7.338 -4.142 -10.115 1.00 62.22 C ATOM 1445 C GLU A 93 -5.814 -4.017 -10.214 1.00 14.31 C ATOM 1446 O GLU A 93 -5.184 -4.608 -11.091 1.00 11.31 O ATOM 1447 CB GLU A 93 -7.985 -2.834 -10.574 1.00 53.30 C ATOM 1448 CG GLU A 93 -9.420 -2.649 -10.102 1.00 13.51 C ATOM 1449 CD GLU A 93 -10.338 -3.781 -10.510 1.00 74.21 C ATOM 1450 OE1 GLU A 93 -10.543 -3.985 -11.721 1.00 62.24 O ATOM 1451 OE2 GLU A 93 -10.868 -4.468 -9.616 1.00 42.21 O ATOM 0 H GLU A 93 -8.290 -3.722 -8.300 1.00 54.12 H new ATOM 0 HA GLU A 93 -7.671 -4.955 -10.760 1.00 62.22 H new ATOM 0 HB2 GLU A 93 -7.385 -1.999 -10.213 1.00 53.30 H new ATOM 0 HB3 GLU A 93 -7.964 -2.794 -11.663 1.00 53.30 H new ATOM 0 HG2 GLU A 93 -9.428 -2.558 -9.016 1.00 13.51 H new ATOM 0 HG3 GLU A 93 -9.809 -1.713 -10.503 1.00 13.51 H new ATOM 1458 N ASP A 94 -5.231 -3.252 -9.289 1.00 12.31 N ATOM 1459 CA ASP A 94 -3.783 -3.038 -9.250 1.00 5.24 C ATOM 1460 C ASP A 94 -3.094 -4.181 -8.505 1.00 30.43 C ATOM 1461 O ASP A 94 -1.887 -4.365 -8.606 1.00 24.42 O ATOM 1462 CB ASP A 94 -3.456 -1.690 -8.592 1.00 23.12 C ATOM 1463 CG ASP A 94 -1.963 -1.413 -8.495 1.00 33.21 C ATOM 1464 OD1 ASP A 94 -1.368 -0.970 -9.504 1.00 2.14 O ATOM 1465 OD2 ASP A 94 -1.382 -1.644 -7.411 1.00 34.11 O ATOM 0 H ASP A 94 -5.744 -2.767 -8.552 1.00 12.31 H new ATOM 0 HA ASP A 94 -3.409 -3.020 -10.274 1.00 5.24 H new ATOM 0 HB2 ASP A 94 -3.930 -0.891 -9.162 1.00 23.12 H new ATOM 0 HB3 ASP A 94 -3.888 -1.668 -7.592 1.00 23.12 H new ATOM 1470 N SER A 95 -3.880 -4.981 -7.798 1.00 61.14 N ATOM 1471 CA SER A 95 -3.362 -6.152 -7.090 1.00 22.11 C ATOM 1472 C SER A 95 -3.016 -7.282 -8.075 1.00 51.35 C ATOM 1473 O SER A 95 -2.697 -8.400 -7.670 1.00 65.34 O ATOM 1474 CB SER A 95 -4.400 -6.638 -6.072 1.00 34.20 C ATOM 1475 OG SER A 95 -3.855 -7.592 -5.177 1.00 12.32 O ATOM 0 H SER A 95 -4.885 -4.842 -7.697 1.00 61.14 H new ATOM 0 HA SER A 95 -2.448 -5.867 -6.569 1.00 22.11 H new ATOM 0 HB2 SER A 95 -4.781 -5.787 -5.508 1.00 34.20 H new ATOM 0 HB3 SER A 95 -5.247 -7.077 -6.599 1.00 34.20 H new ATOM 0 HG SER A 95 -3.287 -8.219 -5.673 1.00 12.32 H new ATOM 1481 N GLN A 96 -3.065 -6.964 -9.363 1.00 75.53 N ATOM 1482 CA GLN A 96 -2.791 -7.916 -10.427 1.00 15.22 C ATOM 1483 C GLN A 96 -1.296 -7.951 -10.771 1.00 35.01 C ATOM 1484 O GLN A 96 -0.821 -8.913 -11.374 1.00 44.24 O ATOM 1485 CB GLN A 96 -3.617 -7.527 -11.655 1.00 23.32 C ATOM 1486 CG GLN A 96 -3.430 -8.440 -12.856 1.00 4.41 C ATOM 1487 CD GLN A 96 -4.268 -8.020 -14.051 1.00 32.02 C ATOM 1488 OE1 GLN A 96 -4.678 -8.856 -14.857 1.00 72.12 O ATOM 1489 NE2 GLN A 96 -4.520 -6.725 -14.184 1.00 71.13 N ATOM 0 H GLN A 96 -3.298 -6.030 -9.699 1.00 75.53 H new ATOM 0 HA GLN A 96 -3.069 -8.916 -10.094 1.00 15.22 H new ATOM 0 HB2 GLN A 96 -4.672 -7.520 -11.380 1.00 23.32 H new ATOM 0 HB3 GLN A 96 -3.357 -6.509 -11.945 1.00 23.32 H new ATOM 0 HG2 GLN A 96 -2.378 -8.447 -13.141 1.00 4.41 H new ATOM 0 HG3 GLN A 96 -3.692 -9.460 -12.575 1.00 4.41 H new ATOM 0 HE21 GLN A 96 -4.163 -6.063 -13.495 1.00 71.13 H new ATOM 0 HE22 GLN A 96 -5.071 -6.391 -14.975 1.00 71.13 H new ATOM 1498 N ARG A 97 -0.556 -6.912 -10.371 1.00 51.22 N ATOM 1499 CA ARG A 97 0.881 -6.829 -10.681 1.00 1.54 C ATOM 1500 C ARG A 97 1.624 -8.004 -10.048 1.00 65.33 C ATOM 1501 O ARG A 97 1.213 -8.502 -8.996 1.00 33.42 O ATOM 1502 CB ARG A 97 1.518 -5.529 -10.155 1.00 32.43 C ATOM 1503 CG ARG A 97 0.625 -4.303 -10.183 1.00 0.44 C ATOM 1504 CD ARG A 97 0.283 -3.852 -11.591 1.00 4.52 C ATOM 1505 NE ARG A 97 -0.586 -2.680 -11.566 1.00 31.50 N ATOM 1506 CZ ARG A 97 -1.254 -2.210 -12.614 1.00 50.32 C ATOM 1507 NH1 ARG A 97 -1.160 -2.806 -13.800 1.00 12.43 N ATOM 1508 NH2 ARG A 97 -2.019 -1.138 -12.464 1.00 74.12 N ATOM 0 H ARG A 97 -0.920 -6.123 -9.837 1.00 51.22 H new ATOM 0 HA ARG A 97 0.966 -6.850 -11.767 1.00 1.54 H new ATOM 0 HB2 ARG A 97 1.844 -5.695 -9.128 1.00 32.43 H new ATOM 0 HB3 ARG A 97 2.411 -5.319 -10.744 1.00 32.43 H new ATOM 0 HG2 ARG A 97 -0.297 -4.519 -9.642 1.00 0.44 H new ATOM 0 HG3 ARG A 97 1.120 -3.487 -9.656 1.00 0.44 H new ATOM 0 HD2 ARG A 97 1.198 -3.619 -12.135 1.00 4.52 H new ATOM 0 HD3 ARG A 97 -0.209 -4.663 -12.127 1.00 4.52 H new ATOM 0 HE ARG A 97 -0.688 -2.186 -10.680 1.00 31.50 H new ATOM 0 HH11 ARG A 97 -0.571 -3.631 -13.911 1.00 12.43 H new ATOM 0 HH12 ARG A 97 -1.677 -2.437 -14.598 1.00 12.43 H new ATOM 0 HH21 ARG A 97 -2.089 -0.685 -11.553 1.00 74.12 H new ATOM 0 HH22 ARG A 97 -2.538 -0.766 -13.260 1.00 74.12 H new ATOM 1522 N PRO A 98 2.716 -8.475 -10.673 1.00 51.53 N ATOM 1523 CA PRO A 98 3.558 -9.503 -10.067 1.00 52.42 C ATOM 1524 C PRO A 98 4.232 -8.963 -8.809 1.00 54.23 C ATOM 1525 O PRO A 98 5.076 -8.068 -8.881 1.00 30.34 O ATOM 1526 CB PRO A 98 4.592 -9.819 -11.156 1.00 11.12 C ATOM 1527 CG PRO A 98 4.589 -8.640 -12.067 1.00 11.43 C ATOM 1528 CD PRO A 98 3.208 -8.051 -11.998 1.00 1.53 C ATOM 0 HA PRO A 98 2.999 -10.386 -9.756 1.00 52.42 H new ATOM 0 HB2 PRO A 98 5.580 -9.978 -10.724 1.00 11.12 H new ATOM 0 HB3 PRO A 98 4.329 -10.730 -11.693 1.00 11.12 H new ATOM 0 HG2 PRO A 98 5.338 -7.910 -11.759 1.00 11.43 H new ATOM 0 HG3 PRO A 98 4.834 -8.937 -13.087 1.00 11.43 H new ATOM 0 HD2 PRO A 98 3.230 -6.965 -12.089 1.00 1.53 H new ATOM 0 HD3 PRO A 98 2.572 -8.425 -12.800 1.00 1.53 H new ATOM 1536 N GLY A 99 3.849 -9.507 -7.664 1.00 62.43 N ATOM 1537 CA GLY A 99 4.311 -8.973 -6.402 1.00 55.22 C ATOM 1538 C GLY A 99 3.721 -7.601 -6.130 1.00 22.13 C ATOM 1539 O GLY A 99 4.440 -6.660 -5.791 1.00 74.34 O ATOM 0 H GLY A 99 3.225 -10.310 -7.587 1.00 62.43 H new ATOM 0 HA2 GLY A 99 4.038 -9.654 -5.596 1.00 55.22 H new ATOM 0 HA3 GLY A 99 5.399 -8.908 -6.410 1.00 55.22 H new ATOM 1543 N ALA A 100 2.406 -7.487 -6.286 1.00 70.04 N ATOM 1544 CA ALA A 100 1.711 -6.218 -6.098 1.00 1.15 C ATOM 1545 C ALA A 100 1.714 -5.801 -4.635 1.00 63.35 C ATOM 1546 O ALA A 100 1.734 -4.614 -4.317 1.00 53.24 O ATOM 1547 CB ALA A 100 0.283 -6.316 -6.611 1.00 32.34 C ATOM 0 H ALA A 100 1.797 -8.263 -6.544 1.00 70.04 H new ATOM 0 HA ALA A 100 2.242 -5.457 -6.669 1.00 1.15 H new ATOM 0 HB1 ALA A 100 -0.223 -5.362 -6.464 1.00 32.34 H new ATOM 0 HB2 ALA A 100 0.294 -6.561 -7.673 1.00 32.34 H new ATOM 0 HB3 ALA A 100 -0.247 -7.096 -6.064 1.00 32.34 H new ATOM 1553 N HIS A 101 1.704 -6.790 -3.754 1.00 21.33 N ATOM 1554 CA HIS A 101 1.713 -6.538 -2.324 1.00 21.25 C ATOM 1555 C HIS A 101 3.117 -6.673 -1.746 1.00 64.13 C ATOM 1556 O HIS A 101 3.290 -6.878 -0.542 1.00 53.20 O ATOM 1557 CB HIS A 101 0.743 -7.476 -1.608 1.00 44.13 C ATOM 1558 CG HIS A 101 -0.669 -6.977 -1.616 1.00 13.14 C ATOM 1559 ND1 HIS A 101 -1.685 -7.693 -2.198 1.00 42.23 N ATOM 1560 CD2 HIS A 101 -1.175 -5.833 -1.098 1.00 61.12 C ATOM 1561 CE1 HIS A 101 -2.782 -6.975 -2.022 1.00 21.54 C ATOM 1562 NE2 HIS A 101 -2.520 -5.839 -1.360 1.00 42.52 N ATOM 0 H HIS A 101 1.690 -7.778 -4.007 1.00 21.33 H new ATOM 0 HA HIS A 101 1.385 -5.511 -2.164 1.00 21.25 H new ATOM 0 HB2 HIS A 101 0.778 -8.457 -2.082 1.00 44.13 H new ATOM 0 HB3 HIS A 101 1.070 -7.609 -0.577 1.00 44.13 H new ATOM 0 HD2 HIS A 101 -0.624 -5.063 -0.578 1.00 61.12 H new ATOM 0 HE1 HIS A 101 -3.763 -7.267 -2.367 1.00 21.54 H new ATOM 0 HE2 HIS A 101 -3.193 -5.117 -1.101 1.00 42.52 H new ATOM 1570 N LEU A 102 4.122 -6.548 -2.607 1.00 74.25 N ATOM 1571 CA LEU A 102 5.501 -6.469 -2.152 1.00 54.24 C ATOM 1572 C LEU A 102 5.764 -5.071 -1.608 1.00 3.24 C ATOM 1573 O LEU A 102 4.879 -4.214 -1.628 1.00 34.15 O ATOM 1574 CB LEU A 102 6.486 -6.793 -3.284 1.00 52.45 C ATOM 1575 CG LEU A 102 6.496 -8.248 -3.770 1.00 55.12 C ATOM 1576 CD1 LEU A 102 7.543 -8.434 -4.860 1.00 73.44 C ATOM 1577 CD2 LEU A 102 6.754 -9.212 -2.620 1.00 51.23 C ATOM 0 H LEU A 102 4.006 -6.500 -3.619 1.00 74.25 H new ATOM 0 HA LEU A 102 5.653 -7.209 -1.366 1.00 54.24 H new ATOM 0 HB2 LEU A 102 6.258 -6.149 -4.133 1.00 52.45 H new ATOM 0 HB3 LEU A 102 7.491 -6.535 -2.949 1.00 52.45 H new ATOM 0 HG LEU A 102 5.512 -8.472 -4.182 1.00 55.12 H new ATOM 0 HD11 LEU A 102 7.539 -9.471 -5.195 1.00 73.44 H new ATOM 0 HD12 LEU A 102 7.313 -7.780 -5.701 1.00 73.44 H new ATOM 0 HD13 LEU A 102 8.528 -8.184 -4.465 1.00 73.44 H new ATOM 0 HD21 LEU A 102 6.755 -10.235 -2.996 1.00 51.23 H new ATOM 0 HD22 LEU A 102 7.721 -8.990 -2.169 1.00 51.23 H new ATOM 0 HD23 LEU A 102 5.971 -9.102 -1.870 1.00 51.23 H new ATOM 1589 N THR A 103 6.960 -4.836 -1.104 1.00 24.44 N ATOM 1590 CA THR A 103 7.293 -3.537 -0.549 1.00 2.32 C ATOM 1591 C THR A 103 7.682 -2.568 -1.661 1.00 52.13 C ATOM 1592 O THR A 103 8.860 -2.318 -1.912 1.00 2.21 O ATOM 1593 CB THR A 103 8.422 -3.642 0.490 1.00 24.00 C ATOM 1594 OG1 THR A 103 8.229 -4.820 1.286 1.00 71.20 O ATOM 1595 CG2 THR A 103 8.434 -2.424 1.400 1.00 24.34 C ATOM 0 H THR A 103 7.714 -5.522 -1.067 1.00 24.44 H new ATOM 0 HA THR A 103 6.408 -3.155 -0.041 1.00 2.32 H new ATOM 0 HB THR A 103 9.374 -3.695 -0.038 1.00 24.00 H new ATOM 0 HG1 THR A 103 8.949 -4.889 1.948 1.00 71.20 H new ATOM 0 HG21 THR A 103 9.241 -2.521 2.127 1.00 24.34 H new ATOM 0 HG22 THR A 103 8.589 -1.525 0.803 1.00 24.34 H new ATOM 0 HG23 THR A 103 7.481 -2.352 1.924 1.00 24.34 H new ATOM 1603 N VAL A 104 6.667 -2.054 -2.339 1.00 22.52 N ATOM 1604 CA VAL A 104 6.849 -1.136 -3.449 1.00 10.34 C ATOM 1605 C VAL A 104 6.683 0.299 -2.981 1.00 21.11 C ATOM 1606 O VAL A 104 5.577 0.711 -2.640 1.00 34.31 O ATOM 1607 CB VAL A 104 5.817 -1.405 -4.562 1.00 75.10 C ATOM 1608 CG1 VAL A 104 5.987 -0.424 -5.710 1.00 61.14 C ATOM 1609 CG2 VAL A 104 5.921 -2.834 -5.056 1.00 2.13 C ATOM 0 H VAL A 104 5.690 -2.264 -2.132 1.00 22.52 H new ATOM 0 HA VAL A 104 7.855 -1.290 -3.839 1.00 10.34 H new ATOM 0 HB VAL A 104 4.822 -1.261 -4.141 1.00 75.10 H new ATOM 0 HG11 VAL A 104 5.247 -0.635 -6.482 1.00 61.14 H new ATOM 0 HG12 VAL A 104 5.848 0.593 -5.343 1.00 61.14 H new ATOM 0 HG13 VAL A 104 6.988 -0.525 -6.130 1.00 61.14 H new ATOM 0 HG21 VAL A 104 5.184 -3.002 -5.841 1.00 2.13 H new ATOM 0 HG22 VAL A 104 6.921 -3.010 -5.453 1.00 2.13 H new ATOM 0 HG23 VAL A 104 5.733 -3.519 -4.229 1.00 2.13 H new ATOM 1619 N LYS A 105 7.770 1.058 -2.925 1.00 70.22 N ATOM 1620 CA LYS A 105 7.688 2.465 -2.575 1.00 55.31 C ATOM 1621 C LYS A 105 7.927 3.331 -3.808 1.00 32.43 C ATOM 1622 O LYS A 105 8.290 4.496 -3.700 1.00 64.40 O ATOM 1623 CB LYS A 105 8.737 2.793 -1.513 1.00 73.33 C ATOM 1624 CG LYS A 105 8.931 1.695 -0.482 1.00 33.22 C ATOM 1625 CD LYS A 105 9.981 2.082 0.535 1.00 63.52 C ATOM 1626 CE LYS A 105 10.394 0.904 1.399 1.00 11.12 C ATOM 1627 NZ LYS A 105 11.484 1.270 2.339 1.00 72.52 N ATOM 0 H LYS A 105 8.714 0.722 -3.117 1.00 70.22 H new ATOM 0 HA LYS A 105 6.692 2.672 -2.183 1.00 55.31 H new ATOM 0 HB2 LYS A 105 9.690 2.989 -2.005 1.00 73.33 H new ATOM 0 HB3 LYS A 105 8.448 3.711 -1.002 1.00 73.33 H new ATOM 0 HG2 LYS A 105 7.986 1.496 0.024 1.00 33.22 H new ATOM 0 HG3 LYS A 105 9.226 0.772 -0.981 1.00 33.22 H new ATOM 0 HD2 LYS A 105 10.856 2.479 0.020 1.00 63.52 H new ATOM 0 HD3 LYS A 105 9.595 2.880 1.169 1.00 63.52 H new ATOM 0 HE2 LYS A 105 9.532 0.546 1.962 1.00 11.12 H new ATOM 0 HE3 LYS A 105 10.723 0.083 0.762 1.00 11.12 H new ATOM 0 HZ1 LYS A 105 11.740 0.441 2.913 1.00 72.52 H new ATOM 0 HZ2 LYS A 105 12.315 1.588 1.800 1.00 72.52 H new ATOM 0 HZ3 LYS A 105 11.161 2.037 2.963 1.00 72.52 H new ATOM 1641 N LYS A 106 7.734 2.752 -4.978 1.00 15.04 N ATOM 1642 CA LYS A 106 7.930 3.477 -6.225 1.00 13.31 C ATOM 1643 C LYS A 106 6.654 3.474 -7.056 1.00 43.13 C ATOM 1644 O LYS A 106 5.952 2.465 -7.117 1.00 75.33 O ATOM 1645 CB LYS A 106 9.084 2.856 -7.017 1.00 25.44 C ATOM 1646 CG LYS A 106 10.359 3.684 -6.986 1.00 53.51 C ATOM 1647 CD LYS A 106 10.256 4.903 -7.890 1.00 32.42 C ATOM 1648 CE LYS A 106 10.416 4.534 -9.356 1.00 4.11 C ATOM 1649 NZ LYS A 106 11.833 4.263 -9.717 1.00 13.32 N ATOM 0 H LYS A 106 7.442 1.782 -5.094 1.00 15.04 H new ATOM 0 HA LYS A 106 8.180 4.511 -5.989 1.00 13.31 H new ATOM 0 HB2 LYS A 106 9.295 1.864 -6.618 1.00 25.44 H new ATOM 0 HB3 LYS A 106 8.772 2.723 -8.053 1.00 25.44 H new ATOM 0 HG2 LYS A 106 10.561 4.004 -5.964 1.00 53.51 H new ATOM 0 HG3 LYS A 106 11.202 3.068 -7.299 1.00 53.51 H new ATOM 0 HD2 LYS A 106 9.290 5.386 -7.740 1.00 32.42 H new ATOM 0 HD3 LYS A 106 11.021 5.627 -7.612 1.00 32.42 H new ATOM 0 HE2 LYS A 106 9.813 3.653 -9.575 1.00 4.11 H new ATOM 0 HE3 LYS A 106 10.034 5.345 -9.976 1.00 4.11 H new ATOM 0 HZ1 LYS A 106 11.891 3.999 -10.721 1.00 13.32 H new ATOM 0 HZ2 LYS A 106 12.403 5.117 -9.550 1.00 13.32 H new ATOM 0 HZ3 LYS A 106 12.197 3.483 -9.133 1.00 13.32 H new ATOM 1663 N ILE A 107 6.343 4.605 -7.682 1.00 25.11 N ATOM 1664 CA ILE A 107 5.171 4.698 -8.545 1.00 4.25 C ATOM 1665 C ILE A 107 5.509 5.343 -9.882 1.00 2.44 C ATOM 1666 O ILE A 107 6.447 6.136 -9.990 1.00 43.54 O ATOM 1667 CB ILE A 107 4.016 5.484 -7.891 1.00 61.41 C ATOM 1668 CG1 ILE A 107 4.543 6.719 -7.167 1.00 12.10 C ATOM 1669 CG2 ILE A 107 3.246 4.594 -6.940 1.00 4.33 C ATOM 1670 CD1 ILE A 107 3.457 7.576 -6.561 1.00 14.55 C ATOM 0 H ILE A 107 6.884 5.467 -7.608 1.00 25.11 H new ATOM 0 HA ILE A 107 4.844 3.671 -8.707 1.00 4.25 H new ATOM 0 HB ILE A 107 3.339 5.818 -8.677 1.00 61.41 H new ATOM 0 HG12 ILE A 107 5.227 6.403 -6.379 1.00 12.10 H new ATOM 0 HG13 ILE A 107 5.121 7.322 -7.868 1.00 12.10 H new ATOM 0 HG21 ILE A 107 2.434 5.163 -6.486 1.00 4.33 H new ATOM 0 HG22 ILE A 107 2.834 3.747 -7.488 1.00 4.33 H new ATOM 0 HG23 ILE A 107 3.915 4.231 -6.160 1.00 4.33 H new ATOM 0 HD11 ILE A 107 3.907 8.435 -6.063 1.00 14.55 H new ATOM 0 HD12 ILE A 107 2.786 7.922 -7.347 1.00 14.55 H new ATOM 0 HD13 ILE A 107 2.894 6.990 -5.835 1.00 14.55 H new ATOM 1682 N PHE A 108 4.735 4.974 -10.891 1.00 34.24 N ATOM 1683 CA PHE A 108 4.885 5.503 -12.234 1.00 63.45 C ATOM 1684 C PHE A 108 3.857 6.600 -12.464 1.00 61.31 C ATOM 1685 O PHE A 108 2.683 6.425 -12.151 1.00 3.42 O ATOM 1686 CB PHE A 108 4.717 4.360 -13.253 1.00 63.55 C ATOM 1687 CG PHE A 108 4.276 4.791 -14.629 1.00 55.11 C ATOM 1688 CD1 PHE A 108 5.194 5.240 -15.564 1.00 63.44 C ATOM 1689 CD2 PHE A 108 2.935 4.738 -14.985 1.00 73.24 C ATOM 1690 CE1 PHE A 108 4.784 5.630 -16.826 1.00 11.11 C ATOM 1691 CE2 PHE A 108 2.519 5.126 -16.240 1.00 45.44 C ATOM 1692 CZ PHE A 108 3.443 5.573 -17.163 1.00 60.33 C ATOM 0 H PHE A 108 3.980 4.294 -10.798 1.00 34.24 H new ATOM 0 HA PHE A 108 5.878 5.934 -12.360 1.00 63.45 H new ATOM 0 HB2 PHE A 108 5.666 3.830 -13.341 1.00 63.55 H new ATOM 0 HB3 PHE A 108 3.990 3.649 -12.861 1.00 63.55 H new ATOM 0 HD1 PHE A 108 6.241 5.286 -15.305 1.00 63.44 H new ATOM 0 HD2 PHE A 108 2.207 4.388 -14.268 1.00 73.24 H new ATOM 0 HE1 PHE A 108 5.509 5.978 -17.547 1.00 11.11 H new ATOM 0 HE2 PHE A 108 1.472 5.080 -16.501 1.00 45.44 H new ATOM 0 HZ PHE A 108 3.120 5.878 -18.147 1.00 60.33 H new ATOM 1702 N VAL A 109 4.310 7.728 -12.986 1.00 23.34 N ATOM 1703 CA VAL A 109 3.430 8.847 -13.294 1.00 41.40 C ATOM 1704 C VAL A 109 3.516 9.162 -14.781 1.00 2.21 C ATOM 1705 O VAL A 109 4.531 9.654 -15.245 1.00 70.42 O ATOM 1706 CB VAL A 109 3.828 10.108 -12.492 1.00 4.34 C ATOM 1707 CG1 VAL A 109 2.753 11.179 -12.589 1.00 24.32 C ATOM 1708 CG2 VAL A 109 4.112 9.759 -11.041 1.00 23.51 C ATOM 0 H VAL A 109 5.292 7.895 -13.208 1.00 23.34 H new ATOM 0 HA VAL A 109 2.413 8.566 -13.021 1.00 41.40 H new ATOM 0 HB VAL A 109 4.742 10.509 -12.930 1.00 4.34 H new ATOM 0 HG11 VAL A 109 3.059 12.054 -12.016 1.00 24.32 H new ATOM 0 HG12 VAL A 109 2.612 11.460 -13.633 1.00 24.32 H new ATOM 0 HG13 VAL A 109 1.816 10.792 -12.188 1.00 24.32 H new ATOM 0 HG21 VAL A 109 4.390 10.662 -10.497 1.00 23.51 H new ATOM 0 HG22 VAL A 109 3.220 9.324 -10.590 1.00 23.51 H new ATOM 0 HG23 VAL A 109 4.930 9.040 -10.993 1.00 23.51 H new ATOM 1718 N GLY A 110 2.464 8.889 -15.528 1.00 10.45 N ATOM 1719 CA GLY A 110 2.547 9.034 -16.967 1.00 23.34 C ATOM 1720 C GLY A 110 1.549 10.011 -17.540 1.00 60.33 C ATOM 1721 O GLY A 110 0.508 10.278 -16.942 1.00 44.23 O ATOM 0 H GLY A 110 1.562 8.573 -15.173 1.00 10.45 H new ATOM 0 HA2 GLY A 110 3.553 9.359 -17.233 1.00 23.34 H new ATOM 0 HA3 GLY A 110 2.394 8.059 -17.430 1.00 23.34 H new ATOM 1725 N GLY A 111 1.885 10.558 -18.699 1.00 32.25 N ATOM 1726 CA GLY A 111 0.970 11.422 -19.413 1.00 35.03 C ATOM 1727 C GLY A 111 1.242 12.885 -19.164 1.00 74.44 C ATOM 1728 O GLY A 111 0.315 13.664 -18.956 1.00 5.12 O ATOM 0 H GLY A 111 2.784 10.417 -19.160 1.00 32.25 H new ATOM 0 HA2 GLY A 111 1.043 11.219 -20.481 1.00 35.03 H new ATOM 0 HA3 GLY A 111 -0.052 11.190 -19.114 1.00 35.03 H new ATOM 1732 N ILE A 112 2.513 13.262 -19.182 1.00 44.13 N ATOM 1733 CA ILE A 112 2.897 14.645 -18.938 1.00 34.40 C ATOM 1734 C ILE A 112 3.661 15.218 -20.135 1.00 44.55 C ATOM 1735 O ILE A 112 4.793 14.821 -20.427 1.00 44.31 O ATOM 1736 CB ILE A 112 3.724 14.793 -17.627 1.00 44.21 C ATOM 1737 CG1 ILE A 112 4.964 13.900 -17.635 1.00 13.13 C ATOM 1738 CG2 ILE A 112 2.867 14.449 -16.418 1.00 13.21 C ATOM 1739 CD1 ILE A 112 5.784 13.990 -16.366 1.00 74.54 C ATOM 0 H ILE A 112 3.294 12.631 -19.363 1.00 44.13 H new ATOM 0 HA ILE A 112 1.980 15.220 -18.810 1.00 34.40 H new ATOM 0 HB ILE A 112 4.049 15.832 -17.567 1.00 44.21 H new ATOM 0 HG12 ILE A 112 4.655 12.865 -17.786 1.00 13.13 H new ATOM 0 HG13 ILE A 112 5.592 14.172 -18.483 1.00 13.13 H new ATOM 0 HG21 ILE A 112 3.459 14.557 -15.509 1.00 13.21 H new ATOM 0 HG22 ILE A 112 2.011 15.122 -16.375 1.00 13.21 H new ATOM 0 HG23 ILE A 112 2.516 13.421 -16.502 1.00 13.21 H new ATOM 0 HD11 ILE A 112 6.648 13.330 -16.443 1.00 74.54 H new ATOM 0 HD12 ILE A 112 6.123 15.016 -16.224 1.00 74.54 H new ATOM 0 HD13 ILE A 112 5.172 13.689 -15.515 1.00 74.54 H new ATOM 1751 N LYS A 113 3.023 16.134 -20.852 1.00 2.11 N ATOM 1752 CA LYS A 113 3.653 16.771 -22.002 1.00 25.44 C ATOM 1753 C LYS A 113 4.205 18.137 -21.617 1.00 31.32 C ATOM 1754 O LYS A 113 5.391 18.408 -21.815 1.00 22.41 O ATOM 1755 CB LYS A 113 2.658 16.896 -23.166 1.00 0.45 C ATOM 1756 CG LYS A 113 3.174 17.700 -24.359 1.00 24.42 C ATOM 1757 CD LYS A 113 4.413 17.078 -24.999 1.00 11.15 C ATOM 1758 CE LYS A 113 4.066 16.017 -26.036 1.00 54.34 C ATOM 1759 NZ LYS A 113 3.606 14.741 -25.424 1.00 64.44 N ATOM 0 H LYS A 113 2.073 16.452 -20.659 1.00 2.11 H new ATOM 0 HA LYS A 113 4.483 16.145 -22.331 1.00 25.44 H new ATOM 0 HB2 LYS A 113 2.390 15.896 -23.507 1.00 0.45 H new ATOM 0 HB3 LYS A 113 1.744 17.363 -22.798 1.00 0.45 H new ATOM 0 HG2 LYS A 113 2.385 17.779 -25.107 1.00 24.42 H new ATOM 0 HG3 LYS A 113 3.408 18.714 -24.034 1.00 24.42 H new ATOM 0 HD2 LYS A 113 5.006 17.862 -25.471 1.00 11.15 H new ATOM 0 HD3 LYS A 113 5.034 16.632 -24.222 1.00 11.15 H new ATOM 0 HE2 LYS A 113 3.287 16.400 -26.695 1.00 54.34 H new ATOM 0 HE3 LYS A 113 4.941 15.822 -26.657 1.00 54.34 H new ATOM 0 HZ1 LYS A 113 3.877 13.945 -26.036 1.00 64.44 H new ATOM 0 HZ2 LYS A 113 4.048 14.625 -24.490 1.00 64.44 H new ATOM 0 HZ3 LYS A 113 2.572 14.760 -25.318 1.00 64.44 H new ATOM 1773 N GLU A 114 3.344 18.981 -21.052 1.00 4.13 N ATOM 1774 CA GLU A 114 3.730 20.319 -20.609 1.00 44.51 C ATOM 1775 C GLU A 114 4.738 20.232 -19.470 1.00 1.24 C ATOM 1776 O GLU A 114 4.980 19.150 -18.937 1.00 13.40 O ATOM 1777 CB GLU A 114 2.493 21.104 -20.177 1.00 53.53 C ATOM 1778 CG GLU A 114 1.551 21.409 -21.327 1.00 2.41 C ATOM 1779 CD GLU A 114 0.170 21.805 -20.859 1.00 14.23 C ATOM 1780 OE1 GLU A 114 -0.613 20.910 -20.484 1.00 23.31 O ATOM 1781 OE2 GLU A 114 -0.143 23.011 -20.873 1.00 54.33 O ATOM 0 H GLU A 114 2.362 18.758 -20.889 1.00 4.13 H new ATOM 0 HA GLU A 114 4.201 20.843 -21.440 1.00 44.51 H new ATOM 0 HB2 GLU A 114 1.957 20.536 -19.417 1.00 53.53 H new ATOM 0 HB3 GLU A 114 2.807 22.040 -19.714 1.00 53.53 H new ATOM 0 HG2 GLU A 114 1.970 22.214 -21.931 1.00 2.41 H new ATOM 0 HG3 GLU A 114 1.475 20.533 -21.971 1.00 2.41 H new ATOM 1788 N ASP A 115 5.322 21.365 -19.098 1.00 51.04 N ATOM 1789 CA ASP A 115 6.449 21.377 -18.169 1.00 51.33 C ATOM 1790 C ASP A 115 6.033 21.042 -16.738 1.00 72.31 C ATOM 1791 O ASP A 115 5.760 21.926 -15.930 1.00 64.13 O ATOM 1792 CB ASP A 115 7.166 22.729 -18.215 1.00 31.21 C ATOM 1793 CG ASP A 115 8.404 22.751 -17.345 1.00 11.44 C ATOM 1794 OD1 ASP A 115 9.260 21.856 -17.504 1.00 13.14 O ATOM 1795 OD2 ASP A 115 8.527 23.657 -16.502 1.00 65.23 O ATOM 0 H ASP A 115 5.035 22.288 -19.424 1.00 51.04 H new ATOM 0 HA ASP A 115 7.136 20.595 -18.492 1.00 51.33 H new ATOM 0 HB2 ASP A 115 7.444 22.956 -19.244 1.00 31.21 H new ATOM 0 HB3 ASP A 115 6.482 23.512 -17.889 1.00 31.21 H new ATOM 1800 N THR A 116 5.963 19.754 -16.442 1.00 3.21 N ATOM 1801 CA THR A 116 5.741 19.298 -15.088 1.00 3.42 C ATOM 1802 C THR A 116 7.064 19.258 -14.344 1.00 61.30 C ATOM 1803 O THR A 116 8.057 18.719 -14.839 1.00 51.43 O ATOM 1804 CB THR A 116 5.091 17.906 -15.052 1.00 42.20 C ATOM 1805 OG1 THR A 116 4.135 17.796 -16.114 1.00 41.01 O ATOM 1806 CG2 THR A 116 4.403 17.669 -13.710 1.00 22.51 C ATOM 0 H THR A 116 6.058 19.006 -17.129 1.00 3.21 H new ATOM 0 HA THR A 116 5.058 19.998 -14.608 1.00 3.42 H new ATOM 0 HB THR A 116 5.868 17.152 -15.180 1.00 42.20 H new ATOM 0 HG1 THR A 116 3.418 17.184 -15.847 1.00 41.01 H new ATOM 0 HG21 THR A 116 3.949 16.678 -13.704 1.00 22.51 H new ATOM 0 HG22 THR A 116 5.138 17.736 -12.908 1.00 22.51 H new ATOM 0 HG23 THR A 116 3.631 18.423 -13.559 1.00 22.51 H new ATOM 1814 N GLU A 117 7.061 19.822 -13.166 1.00 31.21 N ATOM 1815 CA GLU A 117 8.269 19.941 -12.382 1.00 2.00 C ATOM 1816 C GLU A 117 8.218 19.018 -11.185 1.00 54.01 C ATOM 1817 O GLU A 117 7.152 18.491 -10.836 1.00 73.44 O ATOM 1818 CB GLU A 117 8.474 21.387 -11.936 1.00 2.22 C ATOM 1819 CG GLU A 117 8.700 22.342 -13.096 1.00 4.12 C ATOM 1820 CD GLU A 117 8.848 23.779 -12.652 1.00 4.00 C ATOM 1821 OE1 GLU A 117 7.819 24.431 -12.392 1.00 74.01 O ATOM 1822 OE2 GLU A 117 9.992 24.261 -12.564 1.00 2.15 O ATOM 0 H GLU A 117 6.229 20.211 -12.722 1.00 31.21 H new ATOM 0 HA GLU A 117 9.115 19.649 -13.004 1.00 2.00 H new ATOM 0 HB2 GLU A 117 7.602 21.713 -11.369 1.00 2.22 H new ATOM 0 HB3 GLU A 117 9.329 21.435 -11.262 1.00 2.22 H new ATOM 0 HG2 GLU A 117 9.595 22.041 -13.640 1.00 4.12 H new ATOM 0 HG3 GLU A 117 7.864 22.266 -13.791 1.00 4.12 H new ATOM 1829 N GLU A 118 9.377 18.821 -10.572 1.00 63.43 N ATOM 1830 CA GLU A 118 9.492 18.041 -9.354 1.00 43.02 C ATOM 1831 C GLU A 118 8.537 18.585 -8.299 1.00 63.13 C ATOM 1832 O GLU A 118 7.790 17.828 -7.693 1.00 41.31 O ATOM 1833 CB GLU A 118 10.946 18.071 -8.859 1.00 24.34 C ATOM 1834 CG GLU A 118 11.146 17.558 -7.439 1.00 5.30 C ATOM 1835 CD GLU A 118 11.431 18.674 -6.451 1.00 54.04 C ATOM 1836 OE1 GLU A 118 12.583 19.149 -6.405 1.00 43.32 O ATOM 1837 OE2 GLU A 118 10.501 19.085 -5.729 1.00 73.24 O ATOM 0 H GLU A 118 10.263 19.199 -10.908 1.00 63.43 H new ATOM 0 HA GLU A 118 9.219 17.004 -9.553 1.00 43.02 H new ATOM 0 HB2 GLU A 118 11.558 17.475 -9.536 1.00 24.34 H new ATOM 0 HB3 GLU A 118 11.314 19.096 -8.916 1.00 24.34 H new ATOM 0 HG2 GLU A 118 10.254 17.017 -7.123 1.00 5.30 H new ATOM 0 HG3 GLU A 118 11.972 16.847 -7.426 1.00 5.30 H new ATOM 1844 N HIS A 119 8.526 19.909 -8.154 1.00 54.23 N ATOM 1845 CA HIS A 119 7.698 20.588 -7.159 1.00 14.23 C ATOM 1846 C HIS A 119 6.224 20.224 -7.314 1.00 11.11 C ATOM 1847 O HIS A 119 5.518 20.054 -6.321 1.00 40.15 O ATOM 1848 CB HIS A 119 7.845 22.107 -7.289 1.00 4.12 C ATOM 1849 CG HIS A 119 9.262 22.593 -7.351 1.00 63.22 C ATOM 1850 ND1 HIS A 119 9.907 22.757 -8.555 1.00 51.12 N ATOM 1851 CD2 HIS A 119 10.101 22.939 -6.349 1.00 43.44 C ATOM 1852 CE1 HIS A 119 11.116 23.199 -8.257 1.00 1.23 C ATOM 1853 NE2 HIS A 119 11.279 23.329 -6.932 1.00 75.23 N ATOM 0 H HIS A 119 9.090 20.541 -8.722 1.00 54.23 H new ATOM 0 HA HIS A 119 8.041 20.261 -6.177 1.00 14.23 H new ATOM 0 HB2 HIS A 119 7.323 22.434 -8.188 1.00 4.12 H new ATOM 0 HB3 HIS A 119 7.349 22.581 -6.442 1.00 4.12 H new ATOM 0 HD2 HIS A 119 9.885 22.913 -5.291 1.00 43.44 H new ATOM 0 HE1 HIS A 119 11.877 23.427 -8.988 1.00 1.23 H new ATOM 0 HE2 HIS A 119 12.117 23.655 -6.451 1.00 75.23 H new ATOM 1861 N HIS A 120 5.774 20.103 -8.562 1.00 74.31 N ATOM 1862 CA HIS A 120 4.382 19.784 -8.861 1.00 63.33 C ATOM 1863 C HIS A 120 3.976 18.445 -8.269 1.00 63.11 C ATOM 1864 O HIS A 120 3.081 18.378 -7.420 1.00 31.45 O ATOM 1865 CB HIS A 120 4.135 19.780 -10.370 1.00 64.03 C ATOM 1866 CG HIS A 120 4.143 21.146 -10.981 1.00 33.15 C ATOM 1867 ND1 HIS A 120 5.111 21.525 -11.872 1.00 41.25 N ATOM 1868 CD2 HIS A 120 3.288 22.179 -10.794 1.00 63.11 C ATOM 1869 CE1 HIS A 120 4.829 22.772 -12.208 1.00 34.24 C ATOM 1870 NE2 HIS A 120 3.732 23.211 -11.580 1.00 4.00 N ATOM 0 H HIS A 120 6.361 20.223 -9.388 1.00 74.31 H new ATOM 0 HA HIS A 120 3.769 20.560 -8.403 1.00 63.33 H new ATOM 0 HB2 HIS A 120 4.898 19.170 -10.853 1.00 64.03 H new ATOM 0 HB3 HIS A 120 3.174 19.306 -10.571 1.00 64.03 H new ATOM 0 HD2 HIS A 120 2.422 22.188 -10.149 1.00 63.11 H new ATOM 0 HE1 HIS A 120 5.410 23.362 -12.901 1.00 34.24 H new ATOM 0 HE2 HIS A 120 3.308 24.135 -11.669 1.00 4.00 H new ATOM 1878 N LEU A 121 4.666 17.379 -8.662 1.00 44.31 N ATOM 1879 CA LEU A 121 4.239 16.055 -8.259 1.00 31.25 C ATOM 1880 C LEU A 121 4.727 15.722 -6.851 1.00 34.53 C ATOM 1881 O LEU A 121 4.069 14.985 -6.132 1.00 52.31 O ATOM 1882 CB LEU A 121 4.670 14.992 -9.276 1.00 12.42 C ATOM 1883 CG LEU A 121 6.164 14.895 -9.587 1.00 21.24 C ATOM 1884 CD1 LEU A 121 6.863 13.950 -8.623 1.00 71.11 C ATOM 1885 CD2 LEU A 121 6.353 14.428 -11.017 1.00 20.41 C ATOM 0 H LEU A 121 5.503 17.408 -9.245 1.00 44.31 H new ATOM 0 HA LEU A 121 3.149 16.052 -8.235 1.00 31.25 H new ATOM 0 HB2 LEU A 121 4.336 14.020 -8.913 1.00 12.42 H new ATOM 0 HB3 LEU A 121 4.141 15.182 -10.210 1.00 12.42 H new ATOM 0 HG LEU A 121 6.611 15.882 -9.467 1.00 21.24 H new ATOM 0 HD11 LEU A 121 7.924 13.900 -8.867 1.00 71.11 H new ATOM 0 HD12 LEU A 121 6.742 14.316 -7.603 1.00 71.11 H new ATOM 0 HD13 LEU A 121 6.424 12.956 -8.706 1.00 71.11 H new ATOM 0 HD21 LEU A 121 7.418 14.359 -11.239 1.00 20.41 H new ATOM 0 HD22 LEU A 121 5.891 13.449 -11.144 1.00 20.41 H new ATOM 0 HD23 LEU A 121 5.886 15.140 -11.697 1.00 20.41 H new ATOM 1897 N ARG A 122 5.860 16.291 -6.448 1.00 40.41 N ATOM 1898 CA ARG A 122 6.401 16.062 -5.109 1.00 33.13 C ATOM 1899 C ARG A 122 5.454 16.596 -4.049 1.00 43.21 C ATOM 1900 O ARG A 122 5.057 15.869 -3.149 1.00 60.11 O ATOM 1901 CB ARG A 122 7.779 16.713 -4.961 1.00 2.23 C ATOM 1902 CG ARG A 122 8.353 16.642 -3.553 1.00 73.24 C ATOM 1903 CD ARG A 122 8.195 17.964 -2.828 1.00 54.32 C ATOM 1904 NE ARG A 122 9.039 19.001 -3.415 1.00 43.22 N ATOM 1905 CZ ARG A 122 9.171 20.234 -2.939 1.00 74.21 C ATOM 1906 NH1 ARG A 122 8.515 20.617 -1.849 1.00 13.14 N ATOM 1907 NH2 ARG A 122 9.969 21.085 -3.563 1.00 50.33 N ATOM 0 H ARG A 122 6.422 16.914 -7.028 1.00 40.41 H new ATOM 0 HA ARG A 122 6.509 14.986 -4.970 1.00 33.13 H new ATOM 0 HB2 ARG A 122 8.473 16.230 -5.649 1.00 2.23 H new ATOM 0 HB3 ARG A 122 7.709 17.759 -5.261 1.00 2.23 H new ATOM 0 HG2 ARG A 122 7.850 15.854 -2.992 1.00 73.24 H new ATOM 0 HG3 ARG A 122 9.409 16.375 -3.601 1.00 73.24 H new ATOM 0 HD2 ARG A 122 7.152 18.278 -2.865 1.00 54.32 H new ATOM 0 HD3 ARG A 122 8.452 17.836 -1.776 1.00 54.32 H new ATOM 0 HE ARG A 122 9.567 18.760 -4.254 1.00 43.22 H new ATOM 0 HH11 ARG A 122 7.901 19.961 -1.367 1.00 13.14 H new ATOM 0 HH12 ARG A 122 8.626 21.567 -1.495 1.00 13.14 H new ATOM 0 HH21 ARG A 122 10.474 20.791 -4.399 1.00 50.33 H new ATOM 0 HH22 ARG A 122 10.079 22.035 -3.208 1.00 50.33 H new ATOM 1921 N ASP A 123 5.078 17.862 -4.178 1.00 0.13 N ATOM 1922 CA ASP A 123 4.197 18.504 -3.208 1.00 73.43 C ATOM 1923 C ASP A 123 2.821 17.838 -3.203 1.00 75.12 C ATOM 1924 O ASP A 123 2.115 17.840 -2.192 1.00 61.34 O ATOM 1925 CB ASP A 123 4.076 19.993 -3.528 1.00 50.00 C ATOM 1926 CG ASP A 123 3.180 20.734 -2.560 1.00 51.23 C ATOM 1927 OD1 ASP A 123 3.636 21.045 -1.445 1.00 34.13 O ATOM 1928 OD2 ASP A 123 2.019 21.020 -2.924 1.00 62.13 O ATOM 0 H ASP A 123 5.370 18.466 -4.946 1.00 0.13 H new ATOM 0 HA ASP A 123 4.626 18.391 -2.212 1.00 73.43 H new ATOM 0 HB2 ASP A 123 5.068 20.444 -3.514 1.00 50.00 H new ATOM 0 HB3 ASP A 123 3.686 20.111 -4.539 1.00 50.00 H new ATOM 1933 N TYR A 124 2.463 17.242 -4.335 1.00 24.01 N ATOM 1934 CA TYR A 124 1.206 16.539 -4.472 1.00 71.54 C ATOM 1935 C TYR A 124 1.256 15.151 -3.824 1.00 64.22 C ATOM 1936 O TYR A 124 0.439 14.833 -2.965 1.00 31.12 O ATOM 1937 CB TYR A 124 0.874 16.418 -5.948 1.00 15.51 C ATOM 1938 CG TYR A 124 -0.383 15.652 -6.215 1.00 34.01 C ATOM 1939 CD1 TYR A 124 -1.616 16.226 -5.968 1.00 23.52 C ATOM 1940 CD2 TYR A 124 -0.338 14.357 -6.702 1.00 23.40 C ATOM 1941 CE1 TYR A 124 -2.781 15.533 -6.198 1.00 44.25 C ATOM 1942 CE2 TYR A 124 -1.499 13.652 -6.938 1.00 64.01 C ATOM 1943 CZ TYR A 124 -2.722 14.249 -6.685 1.00 33.03 C ATOM 1944 OH TYR A 124 -3.891 13.565 -6.913 1.00 52.13 O ATOM 0 H TYR A 124 3.038 17.236 -5.177 1.00 24.01 H new ATOM 0 HA TYR A 124 0.431 17.106 -3.956 1.00 71.54 H new ATOM 0 HB2 TYR A 124 0.779 17.417 -6.374 1.00 15.51 H new ATOM 0 HB3 TYR A 124 1.703 15.930 -6.460 1.00 15.51 H new ATOM 0 HD1 TYR A 124 -1.665 17.236 -5.588 1.00 23.52 H new ATOM 0 HD2 TYR A 124 0.617 13.894 -6.899 1.00 23.40 H new ATOM 0 HE1 TYR A 124 -3.737 15.995 -5.997 1.00 44.25 H new ATOM 0 HE2 TYR A 124 -1.455 12.642 -7.317 1.00 64.01 H new ATOM 0 HH TYR A 124 -3.721 12.601 -6.862 1.00 52.13 H new ATOM 1954 N PHE A 125 2.205 14.327 -4.252 1.00 53.11 N ATOM 1955 CA PHE A 125 2.342 12.962 -3.748 1.00 2.42 C ATOM 1956 C PHE A 125 2.754 12.934 -2.269 1.00 71.13 C ATOM 1957 O PHE A 125 2.463 11.971 -1.564 1.00 3.12 O ATOM 1958 CB PHE A 125 3.370 12.183 -4.583 1.00 13.21 C ATOM 1959 CG PHE A 125 2.886 11.741 -5.942 1.00 52.22 C ATOM 1960 CD1 PHE A 125 1.828 10.854 -6.073 1.00 22.45 C ATOM 1961 CD2 PHE A 125 3.509 12.202 -7.088 1.00 22.31 C ATOM 1962 CE1 PHE A 125 1.401 10.440 -7.325 1.00 64.30 C ATOM 1963 CE2 PHE A 125 3.086 11.792 -8.337 1.00 52.14 C ATOM 1964 CZ PHE A 125 2.034 10.909 -8.455 1.00 73.21 C ATOM 0 H PHE A 125 2.899 14.582 -4.955 1.00 53.11 H new ATOM 0 HA PHE A 125 1.364 12.488 -3.835 1.00 2.42 H new ATOM 0 HB2 PHE A 125 4.255 12.805 -4.714 1.00 13.21 H new ATOM 0 HB3 PHE A 125 3.680 11.302 -4.020 1.00 13.21 H new ATOM 0 HD1 PHE A 125 1.331 10.482 -5.189 1.00 22.45 H new ATOM 0 HD2 PHE A 125 4.336 12.891 -7.005 1.00 22.31 H new ATOM 0 HE1 PHE A 125 0.574 9.751 -7.414 1.00 64.30 H new ATOM 0 HE2 PHE A 125 3.580 12.164 -9.223 1.00 52.14 H new ATOM 0 HZ PHE A 125 1.707 10.585 -9.432 1.00 73.21 H new ATOM 1974 N GLU A 126 3.392 14.006 -1.794 1.00 3.02 N ATOM 1975 CA GLU A 126 3.869 14.064 -0.410 1.00 24.22 C ATOM 1976 C GLU A 126 2.710 14.174 0.577 1.00 4.31 C ATOM 1977 O GLU A 126 2.865 13.885 1.763 1.00 53.23 O ATOM 1978 CB GLU A 126 4.846 15.222 -0.198 1.00 75.30 C ATOM 1979 CG GLU A 126 6.280 14.760 -0.013 1.00 24.13 C ATOM 1980 CD GLU A 126 7.166 15.822 0.594 1.00 55.34 C ATOM 1981 OE1 GLU A 126 7.086 16.037 1.816 1.00 40.24 O ATOM 1982 OE2 GLU A 126 7.945 16.449 -0.144 1.00 54.14 O ATOM 0 H GLU A 126 3.590 14.842 -2.344 1.00 3.02 H new ATOM 0 HA GLU A 126 4.397 13.129 -0.221 1.00 24.22 H new ATOM 0 HB2 GLU A 126 4.794 15.895 -1.054 1.00 75.30 H new ATOM 0 HB3 GLU A 126 4.538 15.794 0.677 1.00 75.30 H new ATOM 0 HG2 GLU A 126 6.292 13.876 0.624 1.00 24.13 H new ATOM 0 HG3 GLU A 126 6.688 14.462 -0.979 1.00 24.13 H new ATOM 1989 N GLN A 127 1.560 14.620 0.083 1.00 24.54 N ATOM 1990 CA GLN A 127 0.322 14.594 0.863 1.00 22.44 C ATOM 1991 C GLN A 127 0.003 13.179 1.356 1.00 44.55 C ATOM 1992 O GLN A 127 -0.602 13.004 2.411 1.00 34.35 O ATOM 1993 CB GLN A 127 -0.852 15.113 0.030 1.00 0.23 C ATOM 1994 CG GLN A 127 -0.643 16.511 -0.532 1.00 64.44 C ATOM 1995 CD GLN A 127 -1.845 17.011 -1.309 1.00 52.35 C ATOM 1996 OE1 GLN A 127 -2.729 17.662 -0.759 1.00 75.10 O ATOM 1997 NE2 GLN A 127 -1.889 16.697 -2.595 1.00 12.44 N ATOM 0 H GLN A 127 1.457 15.005 -0.856 1.00 24.54 H new ATOM 0 HA GLN A 127 0.470 15.242 1.727 1.00 22.44 H new ATOM 0 HB2 GLN A 127 -1.031 14.424 -0.795 1.00 0.23 H new ATOM 0 HB3 GLN A 127 -1.751 15.111 0.647 1.00 0.23 H new ATOM 0 HG2 GLN A 127 -0.431 17.200 0.286 1.00 64.44 H new ATOM 0 HG3 GLN A 127 0.231 16.510 -1.183 1.00 64.44 H new ATOM 0 HE21 GLN A 127 -1.134 16.154 -3.014 1.00 12.44 H new ATOM 0 HE22 GLN A 127 -2.678 16.998 -3.167 1.00 12.44 H new ATOM 2006 N TYR A 128 0.415 12.178 0.586 1.00 64.22 N ATOM 2007 CA TYR A 128 0.158 10.781 0.925 1.00 42.20 C ATOM 2008 C TYR A 128 1.236 10.214 1.857 1.00 5.43 C ATOM 2009 O TYR A 128 0.959 9.312 2.656 1.00 53.21 O ATOM 2010 CB TYR A 128 0.081 9.940 -0.352 1.00 64.32 C ATOM 2011 CG TYR A 128 -1.074 10.306 -1.265 1.00 1.20 C ATOM 2012 CD1 TYR A 128 -0.955 11.316 -2.217 1.00 1.52 C ATOM 2013 CD2 TYR A 128 -2.282 9.628 -1.180 1.00 51.20 C ATOM 2014 CE1 TYR A 128 -2.010 11.637 -3.052 1.00 2.54 C ATOM 2015 CE2 TYR A 128 -3.339 9.942 -2.012 1.00 41.23 C ATOM 2016 CZ TYR A 128 -3.198 10.947 -2.946 1.00 62.10 C ATOM 2017 OH TYR A 128 -4.251 11.262 -3.774 1.00 23.34 O ATOM 0 H TYR A 128 0.932 12.309 -0.283 1.00 64.22 H new ATOM 0 HA TYR A 128 -0.795 10.738 1.452 1.00 42.20 H new ATOM 0 HB2 TYR A 128 1.015 10.049 -0.903 1.00 64.32 H new ATOM 0 HB3 TYR A 128 -0.006 8.889 -0.077 1.00 64.32 H new ATOM 0 HD1 TYR A 128 -0.024 11.857 -2.304 1.00 1.52 H new ATOM 0 HD2 TYR A 128 -2.398 8.841 -0.450 1.00 51.20 H new ATOM 0 HE1 TYR A 128 -1.903 12.424 -3.783 1.00 2.54 H new ATOM 0 HE2 TYR A 128 -4.271 9.403 -1.932 1.00 41.23 H new ATOM 0 HH TYR A 128 -5.013 10.681 -3.570 1.00 23.34 H new ATOM 2027 N GLY A 129 2.453 10.743 1.750 1.00 1.41 N ATOM 2028 CA GLY A 129 3.552 10.258 2.573 1.00 40.13 C ATOM 2029 C GLY A 129 4.880 10.911 2.242 1.00 40.53 C ATOM 2030 O GLY A 129 4.938 11.832 1.431 1.00 52.44 O ATOM 0 H GLY A 129 2.699 11.498 1.109 1.00 1.41 H new ATOM 0 HA2 GLY A 129 3.318 10.437 3.622 1.00 40.13 H new ATOM 0 HA3 GLY A 129 3.643 9.179 2.447 1.00 40.13 H new ATOM 2034 N LYS A 130 5.949 10.431 2.871 1.00 72.12 N ATOM 2035 CA LYS A 130 7.283 11.003 2.690 1.00 64.44 C ATOM 2036 C LYS A 130 7.920 10.521 1.388 1.00 21.40 C ATOM 2037 O LYS A 130 7.853 9.340 1.053 1.00 44.31 O ATOM 2038 CB LYS A 130 8.186 10.623 3.872 1.00 22.13 C ATOM 2039 CG LYS A 130 9.608 11.160 3.753 1.00 65.23 C ATOM 2040 CD LYS A 130 10.534 10.549 4.787 1.00 53.44 C ATOM 2041 CE LYS A 130 11.976 10.945 4.528 1.00 35.20 C ATOM 2042 NZ LYS A 130 12.932 10.086 5.273 1.00 53.24 N ATOM 0 H LYS A 130 5.918 9.641 3.516 1.00 72.12 H new ATOM 0 HA LYS A 130 7.177 12.087 2.643 1.00 64.44 H new ATOM 0 HB2 LYS A 130 7.741 10.999 4.793 1.00 22.13 H new ATOM 0 HB3 LYS A 130 8.223 9.537 3.955 1.00 22.13 H new ATOM 0 HG2 LYS A 130 9.992 10.952 2.754 1.00 65.23 H new ATOM 0 HG3 LYS A 130 9.597 12.244 3.871 1.00 65.23 H new ATOM 0 HD2 LYS A 130 10.237 10.875 5.784 1.00 53.44 H new ATOM 0 HD3 LYS A 130 10.442 9.463 4.766 1.00 53.44 H new ATOM 0 HE2 LYS A 130 12.184 10.877 3.460 1.00 35.20 H new ATOM 0 HE3 LYS A 130 12.123 11.986 4.816 1.00 35.20 H new ATOM 0 HZ1 LYS A 130 13.905 10.380 5.055 1.00 53.24 H new ATOM 0 HZ2 LYS A 130 12.762 10.183 6.294 1.00 53.24 H new ATOM 0 HZ3 LYS A 130 12.799 9.094 4.992 1.00 53.24 H new ATOM 2056 N ILE A 131 8.559 11.439 0.677 1.00 21.02 N ATOM 2057 CA ILE A 131 9.246 11.111 -0.563 1.00 50.10 C ATOM 2058 C ILE A 131 10.762 11.184 -0.362 1.00 63.32 C ATOM 2059 O ILE A 131 11.257 12.065 0.339 1.00 25.23 O ATOM 2060 CB ILE A 131 8.812 12.060 -1.707 1.00 61.32 C ATOM 2061 CG1 ILE A 131 7.313 11.903 -1.976 1.00 13.45 C ATOM 2062 CG2 ILE A 131 9.615 11.792 -2.973 1.00 73.24 C ATOM 2063 CD1 ILE A 131 6.782 12.825 -3.054 1.00 74.52 C ATOM 0 H ILE A 131 8.616 12.423 0.940 1.00 21.02 H new ATOM 0 HA ILE A 131 8.973 10.094 -0.844 1.00 50.10 H new ATOM 0 HB ILE A 131 9.010 13.087 -1.398 1.00 61.32 H new ATOM 0 HG12 ILE A 131 7.112 10.871 -2.263 1.00 13.45 H new ATOM 0 HG13 ILE A 131 6.767 12.089 -1.051 1.00 13.45 H new ATOM 0 HG21 ILE A 131 9.290 12.472 -3.761 1.00 73.24 H new ATOM 0 HG22 ILE A 131 10.675 11.949 -2.772 1.00 73.24 H new ATOM 0 HG23 ILE A 131 9.456 10.763 -3.294 1.00 73.24 H new ATOM 0 HD11 ILE A 131 5.714 12.653 -3.186 1.00 74.52 H new ATOM 0 HD12 ILE A 131 6.950 13.861 -2.761 1.00 74.52 H new ATOM 0 HD13 ILE A 131 7.300 12.625 -3.992 1.00 74.52 H new ATOM 2075 N GLU A 132 11.487 10.247 -0.968 1.00 11.03 N ATOM 2076 CA GLU A 132 12.944 10.222 -0.867 1.00 23.13 C ATOM 2077 C GLU A 132 13.582 11.031 -1.992 1.00 71.21 C ATOM 2078 O GLU A 132 14.458 11.862 -1.751 1.00 50.13 O ATOM 2079 CB GLU A 132 13.483 8.789 -0.902 1.00 75.04 C ATOM 2080 CG GLU A 132 12.955 7.898 0.209 1.00 3.32 C ATOM 2081 CD GLU A 132 13.835 6.687 0.449 1.00 35.03 C ATOM 2082 OE1 GLU A 132 14.778 6.783 1.257 1.00 11.44 O ATOM 2083 OE2 GLU A 132 13.588 5.630 -0.165 1.00 25.53 O ATOM 0 H GLU A 132 11.090 9.496 -1.533 1.00 11.03 H new ATOM 0 HA GLU A 132 13.207 10.671 0.091 1.00 23.13 H new ATOM 0 HB2 GLU A 132 13.230 8.341 -1.863 1.00 75.04 H new ATOM 0 HB3 GLU A 132 14.571 8.820 -0.841 1.00 75.04 H new ATOM 0 HG2 GLU A 132 12.880 8.477 1.130 1.00 3.32 H new ATOM 0 HG3 GLU A 132 11.947 7.567 -0.043 1.00 3.32 H new ATOM 2090 N VAL A 133 13.135 10.793 -3.220 1.00 32.00 N ATOM 2091 CA VAL A 133 13.693 11.472 -4.380 1.00 64.50 C ATOM 2092 C VAL A 133 12.684 11.465 -5.535 1.00 23.31 C ATOM 2093 O VAL A 133 11.784 10.621 -5.581 1.00 31.41 O ATOM 2094 CB VAL A 133 15.043 10.830 -4.822 1.00 74.15 C ATOM 2095 CG1 VAL A 133 14.832 9.520 -5.565 1.00 31.30 C ATOM 2096 CG2 VAL A 133 15.859 11.800 -5.663 1.00 71.14 C ATOM 0 H VAL A 133 12.387 10.134 -3.436 1.00 32.00 H new ATOM 0 HA VAL A 133 13.898 12.505 -4.100 1.00 64.50 H new ATOM 0 HB VAL A 133 15.604 10.605 -3.915 1.00 74.15 H new ATOM 0 HG11 VAL A 133 15.798 9.106 -5.855 1.00 31.30 H new ATOM 0 HG12 VAL A 133 14.315 8.813 -4.916 1.00 31.30 H new ATOM 0 HG13 VAL A 133 14.232 9.700 -6.457 1.00 31.30 H new ATOM 0 HG21 VAL A 133 16.796 11.327 -5.958 1.00 71.14 H new ATOM 0 HG22 VAL A 133 15.294 12.073 -6.554 1.00 71.14 H new ATOM 0 HG23 VAL A 133 16.073 12.696 -5.080 1.00 71.14 H new ATOM 2106 N ILE A 134 12.824 12.414 -6.450 1.00 42.11 N ATOM 2107 CA ILE A 134 11.918 12.526 -7.585 1.00 42.40 C ATOM 2108 C ILE A 134 12.677 12.293 -8.882 1.00 11.21 C ATOM 2109 O ILE A 134 13.726 12.891 -9.120 1.00 15.43 O ATOM 2110 CB ILE A 134 11.196 13.903 -7.630 1.00 4.42 C ATOM 2111 CG1 ILE A 134 10.099 13.980 -6.564 1.00 5.34 C ATOM 2112 CG2 ILE A 134 10.592 14.173 -9.006 1.00 11.45 C ATOM 2113 CD1 ILE A 134 10.592 14.375 -5.191 1.00 33.43 C ATOM 0 H ILE A 134 13.560 13.120 -6.428 1.00 42.11 H new ATOM 0 HA ILE A 134 11.151 11.761 -7.465 1.00 42.40 H new ATOM 0 HB ILE A 134 11.947 14.666 -7.426 1.00 4.42 H new ATOM 0 HG12 ILE A 134 9.345 14.698 -6.887 1.00 5.34 H new ATOM 0 HG13 ILE A 134 9.607 13.010 -6.495 1.00 5.34 H new ATOM 0 HG21 ILE A 134 10.095 15.143 -9.001 1.00 11.45 H new ATOM 0 HG22 ILE A 134 11.382 14.173 -9.757 1.00 11.45 H new ATOM 0 HG23 ILE A 134 9.866 13.395 -9.244 1.00 11.45 H new ATOM 0 HD11 ILE A 134 9.752 14.405 -4.498 1.00 33.43 H new ATOM 0 HD12 ILE A 134 11.323 13.645 -4.843 1.00 33.43 H new ATOM 0 HD13 ILE A 134 11.057 15.359 -5.241 1.00 33.43 H new ATOM 2125 N GLU A 135 12.144 11.409 -9.700 1.00 12.10 N ATOM 2126 CA GLU A 135 12.737 11.089 -10.980 1.00 32.02 C ATOM 2127 C GLU A 135 11.952 11.733 -12.122 1.00 1.33 C ATOM 2128 O GLU A 135 10.880 11.270 -12.491 1.00 2.10 O ATOM 2129 CB GLU A 135 12.745 9.569 -11.143 1.00 32.20 C ATOM 2130 CG GLU A 135 13.785 8.866 -10.292 1.00 25.11 C ATOM 2131 CD GLU A 135 13.650 7.361 -10.343 1.00 43.23 C ATOM 2132 OE1 GLU A 135 12.866 6.803 -9.549 1.00 75.12 O ATOM 2133 OE2 GLU A 135 14.329 6.727 -11.179 1.00 70.44 O ATOM 0 H GLU A 135 11.288 10.893 -9.496 1.00 12.10 H new ATOM 0 HA GLU A 135 13.754 11.479 -11.014 1.00 32.02 H new ATOM 0 HB2 GLU A 135 11.759 9.181 -10.889 1.00 32.20 H new ATOM 0 HB3 GLU A 135 12.923 9.327 -12.191 1.00 32.20 H new ATOM 0 HG2 GLU A 135 14.781 9.150 -10.632 1.00 25.11 H new ATOM 0 HG3 GLU A 135 13.692 9.202 -9.259 1.00 25.11 H new ATOM 2140 N ILE A 136 12.487 12.796 -12.690 1.00 24.23 N ATOM 2141 CA ILE A 136 11.874 13.410 -13.859 1.00 23.43 C ATOM 2142 C ILE A 136 12.533 12.832 -15.098 1.00 60.12 C ATOM 2143 O ILE A 136 13.748 12.942 -15.268 1.00 33.42 O ATOM 2144 CB ILE A 136 12.022 14.956 -13.859 1.00 22.32 C ATOM 2145 CG1 ILE A 136 11.431 15.569 -12.578 1.00 54.12 C ATOM 2146 CG2 ILE A 136 11.368 15.564 -15.097 1.00 61.53 C ATOM 2147 CD1 ILE A 136 9.932 15.395 -12.431 1.00 21.44 C ATOM 0 H ILE A 136 13.340 13.253 -12.366 1.00 24.23 H new ATOM 0 HA ILE A 136 10.806 13.193 -13.844 1.00 23.43 H new ATOM 0 HB ILE A 136 13.087 15.189 -13.885 1.00 22.32 H new ATOM 0 HG12 ILE A 136 11.922 15.120 -11.715 1.00 54.12 H new ATOM 0 HG13 ILE A 136 11.664 16.634 -12.559 1.00 54.12 H new ATOM 0 HG21 ILE A 136 11.484 16.648 -15.075 1.00 61.53 H new ATOM 0 HG22 ILE A 136 11.845 15.166 -15.993 1.00 61.53 H new ATOM 0 HG23 ILE A 136 10.307 15.313 -15.108 1.00 61.53 H new ATOM 0 HD11 ILE A 136 9.602 15.857 -11.501 1.00 21.44 H new ATOM 0 HD12 ILE A 136 9.426 15.870 -13.272 1.00 21.44 H new ATOM 0 HD13 ILE A 136 9.689 14.333 -12.415 1.00 21.44 H new ATOM 2159 N MET A 137 11.749 12.197 -15.950 1.00 35.15 N ATOM 2160 CA MET A 137 12.307 11.504 -17.094 1.00 1.44 C ATOM 2161 C MET A 137 12.478 12.461 -18.263 1.00 12.03 C ATOM 2162 O MET A 137 11.501 12.886 -18.881 1.00 12.51 O ATOM 2163 CB MET A 137 11.432 10.310 -17.485 1.00 30.03 C ATOM 2164 CG MET A 137 11.155 9.349 -16.334 1.00 4.02 C ATOM 2165 SD MET A 137 12.643 8.877 -15.425 1.00 22.12 S ATOM 2166 CE MET A 137 13.575 8.030 -16.697 1.00 1.41 C ATOM 0 H MET A 137 10.733 12.147 -15.872 1.00 35.15 H new ATOM 0 HA MET A 137 13.291 11.122 -16.820 1.00 1.44 H new ATOM 0 HB2 MET A 137 10.483 10.679 -17.875 1.00 30.03 H new ATOM 0 HB3 MET A 137 11.918 9.764 -18.293 1.00 30.03 H new ATOM 0 HG2 MET A 137 10.448 9.812 -15.645 1.00 4.02 H new ATOM 0 HG3 MET A 137 10.677 8.451 -16.726 1.00 4.02 H new ATOM 0 HE1 MET A 137 14.470 7.589 -16.259 1.00 1.41 H new ATOM 0 HE2 MET A 137 12.961 7.244 -17.136 1.00 1.41 H new ATOM 0 HE3 MET A 137 13.862 8.741 -17.472 1.00 1.41 H new ATOM 2176 N THR A 138 13.722 12.808 -18.544 1.00 61.30 N ATOM 2177 CA THR A 138 14.039 13.738 -19.613 1.00 31.42 C ATOM 2178 C THR A 138 15.083 13.154 -20.549 1.00 1.53 C ATOM 2179 O THR A 138 15.748 12.171 -20.222 1.00 34.22 O ATOM 2180 CB THR A 138 14.556 15.078 -19.054 1.00 42.03 C ATOM 2181 OG1 THR A 138 15.253 14.857 -17.822 1.00 32.03 O ATOM 2182 CG2 THR A 138 13.413 16.052 -18.830 1.00 42.42 C ATOM 0 H THR A 138 14.536 12.455 -18.041 1.00 61.30 H new ATOM 0 HA THR A 138 13.117 13.916 -20.166 1.00 31.42 H new ATOM 0 HB THR A 138 15.238 15.511 -19.785 1.00 42.03 H new ATOM 0 HG1 THR A 138 15.580 15.712 -17.473 1.00 32.03 H new ATOM 0 HG21 THR A 138 13.806 16.989 -18.435 1.00 42.42 H new ATOM 0 HG22 THR A 138 12.905 16.241 -19.776 1.00 42.42 H new ATOM 0 HG23 THR A 138 12.706 15.626 -18.118 1.00 42.42 H new ATOM 2319 N GLY A 147 7.558 12.156 -21.452 1.00 21.21 N ATOM 2320 CA GLY A 147 6.122 11.968 -21.390 1.00 33.13 C ATOM 2321 C GLY A 147 5.644 11.367 -20.083 1.00 41.53 C ATOM 2322 O GLY A 147 4.448 11.144 -19.906 1.00 60.45 O ATOM 0 HA2 GLY A 147 5.631 12.930 -21.539 1.00 33.13 H new ATOM 0 HA3 GLY A 147 5.813 11.322 -22.212 1.00 33.13 H new ATOM 2326 N PHE A 148 6.564 11.118 -19.161 1.00 73.50 N ATOM 2327 CA PHE A 148 6.226 10.518 -17.885 1.00 15.11 C ATOM 2328 C PHE A 148 7.313 10.821 -16.864 1.00 64.31 C ATOM 2329 O PHE A 148 8.393 11.308 -17.214 1.00 1.25 O ATOM 2330 CB PHE A 148 5.992 8.997 -18.011 1.00 40.22 C ATOM 2331 CG PHE A 148 7.088 8.219 -18.696 1.00 42.54 C ATOM 2332 CD1 PHE A 148 8.249 7.875 -18.023 1.00 24.53 C ATOM 2333 CD2 PHE A 148 6.936 7.809 -20.011 1.00 70.51 C ATOM 2334 CE1 PHE A 148 9.238 7.142 -18.650 1.00 24.44 C ATOM 2335 CE2 PHE A 148 7.923 7.079 -20.643 1.00 43.01 C ATOM 2336 CZ PHE A 148 9.075 6.744 -19.962 1.00 52.32 C ATOM 0 H PHE A 148 7.556 11.325 -19.278 1.00 73.50 H new ATOM 0 HA PHE A 148 5.289 10.956 -17.543 1.00 15.11 H new ATOM 0 HB2 PHE A 148 5.851 8.586 -17.011 1.00 40.22 H new ATOM 0 HB3 PHE A 148 5.062 8.835 -18.556 1.00 40.22 H new ATOM 0 HD1 PHE A 148 8.382 8.183 -16.997 1.00 24.53 H new ATOM 0 HD2 PHE A 148 6.034 8.064 -20.548 1.00 70.51 H new ATOM 0 HE1 PHE A 148 10.138 6.880 -18.114 1.00 24.44 H new ATOM 0 HE2 PHE A 148 7.793 6.770 -21.670 1.00 43.01 H new ATOM 0 HZ PHE A 148 9.848 6.172 -20.454 1.00 52.32 H new ATOM 2346 N ALA A 149 7.007 10.551 -15.610 1.00 75.52 N ATOM 2347 CA ALA A 149 7.920 10.774 -14.514 1.00 31.34 C ATOM 2348 C ALA A 149 7.827 9.621 -13.524 1.00 73.42 C ATOM 2349 O ALA A 149 6.959 8.754 -13.638 1.00 25.51 O ATOM 2350 CB ALA A 149 7.609 12.099 -13.824 1.00 42.21 C ATOM 0 H ALA A 149 6.107 10.166 -15.324 1.00 75.52 H new ATOM 0 HA ALA A 149 8.937 10.823 -14.903 1.00 31.34 H new ATOM 0 HB1 ALA A 149 8.306 12.253 -13.000 1.00 42.21 H new ATOM 0 HB2 ALA A 149 7.709 12.914 -14.540 1.00 42.21 H new ATOM 0 HB3 ALA A 149 6.590 12.078 -13.438 1.00 42.21 H new ATOM 2356 N PHE A 150 8.730 9.620 -12.572 1.00 50.35 N ATOM 2357 CA PHE A 150 8.758 8.625 -11.523 1.00 22.13 C ATOM 2358 C PHE A 150 9.013 9.313 -10.192 1.00 65.24 C ATOM 2359 O PHE A 150 9.620 10.377 -10.142 1.00 22.01 O ATOM 2360 CB PHE A 150 9.849 7.581 -11.792 1.00 25.31 C ATOM 2361 CG PHE A 150 9.486 6.550 -12.826 1.00 70.44 C ATOM 2362 CD1 PHE A 150 8.769 5.419 -12.473 1.00 34.02 C ATOM 2363 CD2 PHE A 150 9.875 6.706 -14.147 1.00 15.24 C ATOM 2364 CE1 PHE A 150 8.446 4.463 -13.417 1.00 33.01 C ATOM 2365 CE2 PHE A 150 9.557 5.753 -15.095 1.00 42.33 C ATOM 2366 CZ PHE A 150 8.841 4.630 -14.730 1.00 43.40 C ATOM 0 H PHE A 150 9.473 10.315 -12.502 1.00 50.35 H new ATOM 0 HA PHE A 150 7.797 8.111 -11.495 1.00 22.13 H new ATOM 0 HB2 PHE A 150 10.755 8.095 -12.113 1.00 25.31 H new ATOM 0 HB3 PHE A 150 10.085 7.072 -10.857 1.00 25.31 H new ATOM 0 HD1 PHE A 150 8.459 5.283 -11.448 1.00 34.02 H new ATOM 0 HD2 PHE A 150 10.433 7.583 -14.439 1.00 15.24 H new ATOM 0 HE1 PHE A 150 7.885 3.586 -13.129 1.00 33.01 H new ATOM 0 HE2 PHE A 150 9.868 5.886 -16.121 1.00 42.33 H new ATOM 0 HZ PHE A 150 8.590 3.884 -15.470 1.00 43.40 H new ATOM 2376 N VAL A 151 8.518 8.740 -9.124 1.00 43.22 N ATOM 2377 CA VAL A 151 8.756 9.300 -7.805 1.00 73.24 C ATOM 2378 C VAL A 151 8.995 8.197 -6.777 1.00 44.21 C ATOM 2379 O VAL A 151 8.251 7.216 -6.699 1.00 33.12 O ATOM 2380 CB VAL A 151 7.609 10.257 -7.374 1.00 4.53 C ATOM 2381 CG1 VAL A 151 6.248 9.621 -7.564 1.00 32.54 C ATOM 2382 CG2 VAL A 151 7.781 10.713 -5.936 1.00 31.42 C ATOM 0 H VAL A 151 7.951 7.892 -9.134 1.00 43.22 H new ATOM 0 HA VAL A 151 9.664 9.900 -7.857 1.00 73.24 H new ATOM 0 HB VAL A 151 7.666 11.132 -8.022 1.00 4.53 H new ATOM 0 HG11 VAL A 151 5.473 10.321 -7.252 1.00 32.54 H new ATOM 0 HG12 VAL A 151 6.108 9.369 -8.615 1.00 32.54 H new ATOM 0 HG13 VAL A 151 6.183 8.715 -6.962 1.00 32.54 H new ATOM 0 HG21 VAL A 151 6.963 11.381 -5.666 1.00 31.42 H new ATOM 0 HG22 VAL A 151 7.775 9.846 -5.276 1.00 31.42 H new ATOM 0 HG23 VAL A 151 8.729 11.241 -5.833 1.00 31.42 H new ATOM 2392 N THR A 152 10.067 8.365 -6.021 1.00 40.34 N ATOM 2393 CA THR A 152 10.501 7.389 -5.045 1.00 64.24 C ATOM 2394 C THR A 152 10.052 7.792 -3.642 1.00 43.14 C ATOM 2395 O THR A 152 10.405 8.863 -3.156 1.00 13.24 O ATOM 2396 CB THR A 152 12.037 7.264 -5.082 1.00 42.40 C ATOM 2397 OG1 THR A 152 12.462 6.732 -6.344 1.00 52.33 O ATOM 2398 CG2 THR A 152 12.550 6.389 -3.953 1.00 73.40 C ATOM 0 H THR A 152 10.663 9.191 -6.071 1.00 40.34 H new ATOM 0 HA THR A 152 10.050 6.428 -5.292 1.00 64.24 H new ATOM 0 HB THR A 152 12.454 8.263 -4.953 1.00 42.40 H new ATOM 0 HG1 THR A 152 13.439 6.659 -6.356 1.00 52.33 H new ATOM 0 HG21 THR A 152 13.637 6.322 -4.009 1.00 73.40 H new ATOM 0 HG22 THR A 152 12.262 6.824 -2.996 1.00 73.40 H new ATOM 0 HG23 THR A 152 12.120 5.391 -4.042 1.00 73.40 H new ATOM 2406 N PHE A 153 9.296 6.926 -2.992 1.00 64.41 N ATOM 2407 CA PHE A 153 8.769 7.200 -1.666 1.00 71.05 C ATOM 2408 C PHE A 153 9.625 6.558 -0.588 1.00 55.13 C ATOM 2409 O PHE A 153 10.382 5.626 -0.854 1.00 52.41 O ATOM 2410 CB PHE A 153 7.341 6.681 -1.551 1.00 21.24 C ATOM 2411 CG PHE A 153 6.300 7.722 -1.810 1.00 52.44 C ATOM 2412 CD1 PHE A 153 6.000 8.125 -3.099 1.00 4.53 C ATOM 2413 CD2 PHE A 153 5.616 8.294 -0.756 1.00 11.41 C ATOM 2414 CE1 PHE A 153 5.032 9.081 -3.327 1.00 34.22 C ATOM 2415 CE2 PHE A 153 4.652 9.248 -0.976 1.00 71.21 C ATOM 2416 CZ PHE A 153 4.358 9.642 -2.258 1.00 41.33 C ATOM 0 H PHE A 153 9.030 6.015 -3.366 1.00 64.41 H new ATOM 0 HA PHE A 153 8.781 8.280 -1.521 1.00 71.05 H new ATOM 0 HB2 PHE A 153 7.204 5.860 -2.255 1.00 21.24 H new ATOM 0 HB3 PHE A 153 7.192 6.272 -0.552 1.00 21.24 H new ATOM 0 HD1 PHE A 153 6.528 7.688 -3.934 1.00 4.53 H new ATOM 0 HD2 PHE A 153 5.842 7.988 0.255 1.00 11.41 H new ATOM 0 HE1 PHE A 153 4.802 9.390 -4.336 1.00 34.22 H new ATOM 0 HE2 PHE A 153 4.126 9.688 -0.141 1.00 71.21 H new ATOM 0 HZ PHE A 153 3.599 10.391 -2.432 1.00 41.33 H new ATOM 2426 N ASP A 154 9.492 7.062 0.630 1.00 32.34 N ATOM 2427 CA ASP A 154 10.206 6.517 1.779 1.00 1.44 C ATOM 2428 C ASP A 154 9.500 5.270 2.293 1.00 10.23 C ATOM 2429 O ASP A 154 10.130 4.353 2.824 1.00 52.34 O ATOM 2430 CB ASP A 154 10.289 7.573 2.887 1.00 31.22 C ATOM 2431 CG ASP A 154 11.069 7.113 4.106 1.00 22.24 C ATOM 2432 OD1 ASP A 154 10.500 6.393 4.951 1.00 53.33 O ATOM 2433 OD2 ASP A 154 12.247 7.499 4.241 1.00 55.14 O ATOM 0 H ASP A 154 8.890 7.855 0.851 1.00 32.34 H new ATOM 0 HA ASP A 154 11.216 6.244 1.473 1.00 1.44 H new ATOM 0 HB2 ASP A 154 10.755 8.473 2.486 1.00 31.22 H new ATOM 0 HB3 ASP A 154 9.279 7.846 3.194 1.00 31.22 H new ATOM 2438 N ASP A 155 8.189 5.236 2.112 1.00 71.41 N ATOM 2439 CA ASP A 155 7.385 4.123 2.590 1.00 53.45 C ATOM 2440 C ASP A 155 6.469 3.596 1.491 1.00 14.32 C ATOM 2441 O ASP A 155 6.069 4.340 0.594 1.00 31.32 O ATOM 2442 CB ASP A 155 6.563 4.551 3.802 1.00 42.43 C ATOM 2443 CG ASP A 155 6.153 3.374 4.656 1.00 33.12 C ATOM 2444 OD1 ASP A 155 6.944 2.977 5.537 1.00 34.41 O ATOM 2445 OD2 ASP A 155 5.052 2.834 4.443 1.00 24.33 O ATOM 0 H ASP A 155 7.659 5.967 1.637 1.00 71.41 H new ATOM 0 HA ASP A 155 8.059 3.318 2.883 1.00 53.45 H new ATOM 0 HB2 ASP A 155 7.143 5.250 4.404 1.00 42.43 H new ATOM 0 HB3 ASP A 155 5.672 5.082 3.466 1.00 42.43 H new ATOM 2450 N HIS A 156 6.141 2.311 1.571 1.00 12.05 N ATOM 2451 CA HIS A 156 5.330 1.650 0.549 1.00 0.22 C ATOM 2452 C HIS A 156 3.845 1.976 0.726 1.00 30.12 C ATOM 2453 O HIS A 156 3.093 2.018 -0.249 1.00 53.20 O ATOM 2454 CB HIS A 156 5.549 0.124 0.593 1.00 50.12 C ATOM 2455 CG HIS A 156 5.037 -0.520 1.846 1.00 2.03 C ATOM 2456 ND1 HIS A 156 3.727 -0.891 1.961 1.00 4.15 N ATOM 2457 CD2 HIS A 156 5.664 -0.748 3.020 1.00 23.10 C ATOM 2458 CE1 HIS A 156 3.582 -1.316 3.193 1.00 22.15 C ATOM 2459 NE2 HIS A 156 4.726 -1.249 3.880 1.00 63.40 N ATOM 0 H HIS A 156 6.425 1.701 2.337 1.00 12.05 H new ATOM 0 HA HIS A 156 5.646 2.025 -0.425 1.00 0.22 H new ATOM 0 HB2 HIS A 156 5.056 -0.330 -0.267 1.00 50.12 H new ATOM 0 HB3 HIS A 156 6.614 -0.085 0.496 1.00 50.12 H new ATOM 0 HD1 HIS A 156 3.009 -0.847 1.237 1.00 4.15 H new ATOM 0 HD2 HIS A 156 6.707 -0.569 3.238 1.00 23.10 H new ATOM 0 HE1 HIS A 156 2.650 -1.677 3.603 1.00 22.15 H new ATOM 2467 N ASP A 157 3.444 2.215 1.980 1.00 21.43 N ATOM 2468 CA ASP A 157 2.039 2.437 2.331 1.00 22.41 C ATOM 2469 C ASP A 157 1.474 3.636 1.585 1.00 63.42 C ATOM 2470 O ASP A 157 0.380 3.573 1.023 1.00 31.32 O ATOM 2471 CB ASP A 157 1.899 2.617 3.853 1.00 32.42 C ATOM 2472 CG ASP A 157 0.748 3.523 4.257 1.00 23.14 C ATOM 2473 OD1 ASP A 157 -0.423 3.141 4.066 1.00 74.44 O ATOM 2474 OD2 ASP A 157 1.021 4.637 4.766 1.00 75.54 O ATOM 0 H ASP A 157 4.081 2.260 2.775 1.00 21.43 H new ATOM 0 HA ASP A 157 1.463 1.562 2.030 1.00 22.41 H new ATOM 0 HB2 ASP A 157 1.760 1.639 4.314 1.00 32.42 H new ATOM 0 HB3 ASP A 157 2.828 3.027 4.249 1.00 32.42 H new ATOM 2479 N SER A 158 2.250 4.709 1.546 1.00 21.12 N ATOM 2480 CA SER A 158 1.851 5.921 0.861 1.00 41.35 C ATOM 2481 C SER A 158 1.711 5.694 -0.645 1.00 3.54 C ATOM 2482 O SER A 158 0.827 6.266 -1.280 1.00 5.03 O ATOM 2483 CB SER A 158 2.869 7.014 1.154 1.00 63.53 C ATOM 2484 OG SER A 158 4.132 6.455 1.486 1.00 14.33 O ATOM 0 H SER A 158 3.168 4.760 1.987 1.00 21.12 H new ATOM 0 HA SER A 158 0.871 6.228 1.228 1.00 41.35 H new ATOM 0 HB2 SER A 158 2.972 7.663 0.285 1.00 63.53 H new ATOM 0 HB3 SER A 158 2.515 7.636 1.976 1.00 63.53 H new ATOM 0 HG SER A 158 4.371 5.771 0.826 1.00 14.33 H new ATOM 2490 N VAL A 159 2.544 4.808 -1.194 1.00 24.53 N ATOM 2491 CA VAL A 159 2.535 4.529 -2.621 1.00 64.35 C ATOM 2492 C VAL A 159 1.283 3.746 -2.993 1.00 42.42 C ATOM 2493 O VAL A 159 0.658 4.002 -4.024 1.00 63.34 O ATOM 2494 CB VAL A 159 3.819 3.759 -3.035 1.00 23.53 C ATOM 2495 CG1 VAL A 159 3.551 2.687 -4.091 1.00 31.13 C ATOM 2496 CG2 VAL A 159 4.858 4.744 -3.535 1.00 14.03 C ATOM 0 H VAL A 159 3.233 4.273 -0.666 1.00 24.53 H new ATOM 0 HA VAL A 159 2.523 5.474 -3.165 1.00 64.35 H new ATOM 0 HB VAL A 159 4.190 3.239 -2.152 1.00 23.53 H new ATOM 0 HG11 VAL A 159 4.484 2.182 -4.342 1.00 31.13 H new ATOM 0 HG12 VAL A 159 2.839 1.961 -3.700 1.00 31.13 H new ATOM 0 HG13 VAL A 159 3.139 3.153 -4.986 1.00 31.13 H new ATOM 0 HG21 VAL A 159 5.760 4.205 -3.826 1.00 14.03 H new ATOM 0 HG22 VAL A 159 4.464 5.283 -4.396 1.00 14.03 H new ATOM 0 HG23 VAL A 159 5.099 5.453 -2.743 1.00 14.03 H new ATOM 2506 N ASP A 160 0.913 2.819 -2.125 1.00 41.15 N ATOM 2507 CA ASP A 160 -0.255 1.985 -2.346 1.00 23.11 C ATOM 2508 C ASP A 160 -1.538 2.814 -2.250 1.00 11.41 C ATOM 2509 O ASP A 160 -2.492 2.573 -2.986 1.00 73.21 O ATOM 2510 CB ASP A 160 -0.281 0.834 -1.352 1.00 10.30 C ATOM 2511 CG ASP A 160 -1.262 -0.242 -1.756 1.00 72.52 C ATOM 2512 OD1 ASP A 160 -0.869 -1.141 -2.526 1.00 55.42 O ATOM 2513 OD2 ASP A 160 -2.422 -0.186 -1.308 1.00 70.33 O ATOM 0 H ASP A 160 1.409 2.625 -1.255 1.00 41.15 H new ATOM 0 HA ASP A 160 -0.196 1.569 -3.352 1.00 23.11 H new ATOM 0 HB2 ASP A 160 0.717 0.403 -1.271 1.00 10.30 H new ATOM 0 HB3 ASP A 160 -0.546 1.213 -0.365 1.00 10.30 H new ATOM 2518 N LYS A 161 -1.534 3.815 -1.361 1.00 1.21 N ATOM 2519 CA LYS A 161 -2.638 4.779 -1.268 1.00 22.22 C ATOM 2520 C LYS A 161 -2.878 5.454 -2.607 1.00 23.42 C ATOM 2521 O LYS A 161 -4.016 5.707 -3.009 1.00 5.33 O ATOM 2522 CB LYS A 161 -2.331 5.884 -0.254 1.00 22.44 C ATOM 2523 CG LYS A 161 -2.162 5.417 1.172 1.00 63.41 C ATOM 2524 CD LYS A 161 -1.835 6.590 2.080 1.00 35.43 C ATOM 2525 CE LYS A 161 -1.286 6.122 3.408 1.00 72.31 C ATOM 2526 NZ LYS A 161 -0.736 7.241 4.216 1.00 25.35 N ATOM 0 H LYS A 161 -0.778 3.979 -0.696 1.00 1.21 H new ATOM 0 HA LYS A 161 -3.517 4.215 -0.955 1.00 22.22 H new ATOM 0 HB2 LYS A 161 -1.419 6.396 -0.563 1.00 22.44 H new ATOM 0 HB3 LYS A 161 -3.135 6.619 -0.286 1.00 22.44 H new ATOM 0 HG2 LYS A 161 -3.076 4.930 1.512 1.00 63.41 H new ATOM 0 HG3 LYS A 161 -1.366 4.675 1.226 1.00 63.41 H new ATOM 0 HD2 LYS A 161 -1.107 7.238 1.592 1.00 35.43 H new ATOM 0 HD3 LYS A 161 -2.733 7.186 2.245 1.00 35.43 H new ATOM 0 HE2 LYS A 161 -2.076 5.625 3.970 1.00 72.31 H new ATOM 0 HE3 LYS A 161 -0.504 5.383 3.235 1.00 72.31 H new ATOM 0 HZ1 LYS A 161 -0.111 6.861 4.955 1.00 25.35 H new ATOM 0 HZ2 LYS A 161 -0.195 7.881 3.600 1.00 25.35 H new ATOM 0 HZ3 LYS A 161 -1.517 7.766 4.659 1.00 25.35 H new ATOM 2540 N ILE A 162 -1.778 5.742 -3.278 1.00 2.42 N ATOM 2541 CA ILE A 162 -1.789 6.479 -4.523 1.00 64.54 C ATOM 2542 C ILE A 162 -2.254 5.620 -5.700 1.00 25.44 C ATOM 2543 O ILE A 162 -3.073 6.063 -6.499 1.00 61.44 O ATOM 2544 CB ILE A 162 -0.388 7.050 -4.800 1.00 44.42 C ATOM 2545 CG1 ILE A 162 -0.081 8.161 -3.810 1.00 32.51 C ATOM 2546 CG2 ILE A 162 -0.283 7.564 -6.218 1.00 65.14 C ATOM 2547 CD1 ILE A 162 1.386 8.308 -3.515 1.00 22.43 C ATOM 0 H ILE A 162 -0.845 5.468 -2.970 1.00 2.42 H new ATOM 0 HA ILE A 162 -2.505 7.294 -4.419 1.00 64.54 H new ATOM 0 HB ILE A 162 0.343 6.250 -4.679 1.00 44.42 H new ATOM 0 HG12 ILE A 162 -0.461 9.104 -4.203 1.00 32.51 H new ATOM 0 HG13 ILE A 162 -0.614 7.966 -2.879 1.00 32.51 H new ATOM 0 HG21 ILE A 162 0.717 7.962 -6.388 1.00 65.14 H new ATOM 0 HG22 ILE A 162 -0.472 6.748 -6.916 1.00 65.14 H new ATOM 0 HG23 ILE A 162 -1.019 8.353 -6.375 1.00 65.14 H new ATOM 0 HD11 ILE A 162 1.534 9.119 -2.801 1.00 22.43 H new ATOM 0 HD12 ILE A 162 1.767 7.378 -3.092 1.00 22.43 H new ATOM 0 HD13 ILE A 162 1.922 8.534 -4.437 1.00 22.43 H new ATOM 2559 N VAL A 163 -1.791 4.378 -5.770 1.00 73.40 N ATOM 2560 CA VAL A 163 -2.072 3.525 -6.931 1.00 34.25 C ATOM 2561 C VAL A 163 -3.504 2.996 -6.880 1.00 14.34 C ATOM 2562 O VAL A 163 -4.005 2.410 -7.840 1.00 2.02 O ATOM 2563 CB VAL A 163 -1.086 2.346 -7.028 1.00 70.43 C ATOM 2564 CG1 VAL A 163 0.337 2.853 -7.074 1.00 2.23 C ATOM 2565 CG2 VAL A 163 -1.263 1.391 -5.868 1.00 41.33 C ATOM 0 H VAL A 163 -1.224 3.937 -5.046 1.00 73.40 H new ATOM 0 HA VAL A 163 -1.949 4.144 -7.819 1.00 34.25 H new ATOM 0 HB VAL A 163 -1.299 1.804 -7.950 1.00 70.43 H new ATOM 0 HG11 VAL A 163 1.022 2.008 -7.142 1.00 2.23 H new ATOM 0 HG12 VAL A 163 0.466 3.496 -7.944 1.00 2.23 H new ATOM 0 HG13 VAL A 163 0.550 3.421 -6.168 1.00 2.23 H new ATOM 0 HG21 VAL A 163 -0.554 0.568 -5.962 1.00 41.33 H new ATOM 0 HG22 VAL A 163 -1.084 1.919 -4.931 1.00 41.33 H new ATOM 0 HG23 VAL A 163 -2.279 0.997 -5.873 1.00 41.33 H new ATOM 2575 N ILE A 164 -4.143 3.208 -5.732 1.00 42.45 N ATOM 2576 CA ILE A 164 -5.562 2.948 -5.556 1.00 42.14 C ATOM 2577 C ILE A 164 -6.381 3.819 -6.516 1.00 13.11 C ATOM 2578 O ILE A 164 -7.470 3.443 -6.956 1.00 63.11 O ATOM 2579 CB ILE A 164 -5.958 3.198 -4.074 1.00 62.33 C ATOM 2580 CG1 ILE A 164 -5.703 1.929 -3.253 1.00 3.20 C ATOM 2581 CG2 ILE A 164 -7.404 3.661 -3.933 1.00 2.12 C ATOM 2582 CD1 ILE A 164 -5.883 2.110 -1.762 1.00 60.44 C ATOM 0 H ILE A 164 -3.684 3.567 -4.895 1.00 42.45 H new ATOM 0 HA ILE A 164 -5.777 1.906 -5.793 1.00 42.14 H new ATOM 0 HB ILE A 164 -5.336 4.006 -3.690 1.00 62.33 H new ATOM 0 HG12 ILE A 164 -6.378 1.145 -3.597 1.00 3.20 H new ATOM 0 HG13 ILE A 164 -4.688 1.583 -3.446 1.00 3.20 H new ATOM 0 HG21 ILE A 164 -7.633 3.822 -2.880 1.00 2.12 H new ATOM 0 HG22 ILE A 164 -7.543 4.593 -4.481 1.00 2.12 H new ATOM 0 HG23 ILE A 164 -8.071 2.899 -4.337 1.00 2.12 H new ATOM 0 HD11 ILE A 164 -5.684 1.166 -1.254 1.00 60.44 H new ATOM 0 HD12 ILE A 164 -5.189 2.869 -1.401 1.00 60.44 H new ATOM 0 HD13 ILE A 164 -6.906 2.425 -1.555 1.00 60.44 H new ATOM 2594 N GLN A 165 -5.824 4.969 -6.867 1.00 24.54 N ATOM 2595 CA GLN A 165 -6.448 5.867 -7.817 1.00 73.11 C ATOM 2596 C GLN A 165 -5.595 5.912 -9.081 1.00 74.31 C ATOM 2597 O GLN A 165 -4.532 6.530 -9.095 1.00 40.10 O ATOM 2598 CB GLN A 165 -6.592 7.260 -7.206 1.00 72.21 C ATOM 2599 CG GLN A 165 -7.160 7.236 -5.795 1.00 25.13 C ATOM 2600 CD GLN A 165 -7.178 8.600 -5.135 1.00 2.53 C ATOM 2601 OE1 GLN A 165 -7.337 9.626 -5.794 1.00 3.55 O ATOM 2602 NE2 GLN A 165 -6.998 8.619 -3.827 1.00 42.24 N ATOM 0 H GLN A 165 -4.932 5.301 -6.501 1.00 24.54 H new ATOM 0 HA GLN A 165 -7.446 5.509 -8.070 1.00 73.11 H new ATOM 0 HB2 GLN A 165 -5.617 7.746 -7.191 1.00 72.21 H new ATOM 0 HB3 GLN A 165 -7.239 7.864 -7.842 1.00 72.21 H new ATOM 0 HG2 GLN A 165 -8.175 6.841 -5.826 1.00 25.13 H new ATOM 0 HG3 GLN A 165 -6.570 6.552 -5.185 1.00 25.13 H new ATOM 0 HE21 GLN A 165 -6.870 7.745 -3.317 1.00 42.24 H new ATOM 0 HE22 GLN A 165 -6.987 9.508 -3.327 1.00 42.24 H new ATOM 2611 N LYS A 166 -6.061 5.224 -10.120 1.00 20.20 N ATOM 2612 CA LYS A 166 -5.302 5.052 -11.360 1.00 70.42 C ATOM 2613 C LYS A 166 -4.912 6.385 -12.001 1.00 43.25 C ATOM 2614 O LYS A 166 -3.852 6.502 -12.604 1.00 71.02 O ATOM 2615 CB LYS A 166 -6.109 4.215 -12.352 1.00 21.35 C ATOM 2616 CG LYS A 166 -5.315 3.791 -13.576 1.00 11.22 C ATOM 2617 CD LYS A 166 -6.138 2.915 -14.507 1.00 75.34 C ATOM 2618 CE LYS A 166 -6.477 1.574 -13.874 1.00 71.30 C ATOM 2619 NZ LYS A 166 -7.400 0.775 -14.723 1.00 72.21 N ATOM 0 H LYS A 166 -6.974 4.770 -10.128 1.00 20.20 H new ATOM 0 HA LYS A 166 -4.377 4.536 -11.102 1.00 70.42 H new ATOM 0 HB2 LYS A 166 -6.482 3.325 -11.845 1.00 21.35 H new ATOM 0 HB3 LYS A 166 -6.979 4.787 -12.674 1.00 21.35 H new ATOM 0 HG2 LYS A 166 -4.977 4.676 -14.114 1.00 11.22 H new ATOM 0 HG3 LYS A 166 -4.423 3.249 -13.261 1.00 11.22 H new ATOM 0 HD2 LYS A 166 -7.059 3.434 -14.773 1.00 75.34 H new ATOM 0 HD3 LYS A 166 -5.586 2.750 -15.432 1.00 75.34 H new ATOM 0 HE2 LYS A 166 -5.559 1.010 -13.706 1.00 71.30 H new ATOM 0 HE3 LYS A 166 -6.933 1.739 -12.898 1.00 71.30 H new ATOM 0 HZ1 LYS A 166 -7.605 -0.131 -14.255 1.00 72.21 H new ATOM 0 HZ2 LYS A 166 -8.286 1.301 -14.863 1.00 72.21 H new ATOM 0 HZ3 LYS A 166 -6.955 0.595 -15.646 1.00 72.21 H new ATOM 2633 N TYR A 167 -5.775 7.374 -11.894 1.00 55.21 N ATOM 2634 CA TYR A 167 -5.480 8.688 -12.437 1.00 12.13 C ATOM 2635 C TYR A 167 -5.580 9.749 -11.354 1.00 32.53 C ATOM 2636 O TYR A 167 -6.528 9.761 -10.572 1.00 55.32 O ATOM 2637 CB TYR A 167 -6.425 9.024 -13.593 1.00 4.42 C ATOM 2638 CG TYR A 167 -6.239 8.132 -14.801 1.00 22.44 C ATOM 2639 CD1 TYR A 167 -6.920 6.927 -14.914 1.00 54.43 C ATOM 2640 CD2 TYR A 167 -5.361 8.484 -15.814 1.00 61.23 C ATOM 2641 CE1 TYR A 167 -6.737 6.104 -16.006 1.00 4.42 C ATOM 2642 CE2 TYR A 167 -5.176 7.667 -16.912 1.00 25.33 C ATOM 2643 CZ TYR A 167 -5.862 6.476 -17.000 1.00 64.12 C ATOM 2644 OH TYR A 167 -5.666 5.647 -18.082 1.00 53.21 O ATOM 0 H TYR A 167 -6.684 7.296 -11.438 1.00 55.21 H new ATOM 0 HA TYR A 167 -4.459 8.673 -12.819 1.00 12.13 H new ATOM 0 HB2 TYR A 167 -7.455 8.942 -13.246 1.00 4.42 H new ATOM 0 HB3 TYR A 167 -6.270 10.061 -13.889 1.00 4.42 H new ATOM 0 HD1 TYR A 167 -7.605 6.629 -14.134 1.00 54.43 H new ATOM 0 HD2 TYR A 167 -4.813 9.412 -15.744 1.00 61.23 H new ATOM 0 HE1 TYR A 167 -7.278 5.172 -16.080 1.00 4.42 H new ATOM 0 HE2 TYR A 167 -4.496 7.961 -17.698 1.00 25.33 H new ATOM 0 HH TYR A 167 -4.778 5.237 -18.023 1.00 53.21 H new ATOM 2654 N HIS A 168 -4.595 10.633 -11.315 1.00 5.21 N ATOM 2655 CA HIS A 168 -4.573 11.730 -10.356 1.00 71.21 C ATOM 2656 C HIS A 168 -4.526 13.060 -11.088 1.00 21.14 C ATOM 2657 O HIS A 168 -4.042 13.134 -12.218 1.00 71.44 O ATOM 2658 CB HIS A 168 -3.367 11.629 -9.417 1.00 62.44 C ATOM 2659 CG HIS A 168 -3.463 10.535 -8.396 1.00 73.13 C ATOM 2660 ND1 HIS A 168 -4.138 10.708 -7.211 1.00 42.43 N ATOM 2661 CD2 HIS A 168 -2.953 9.287 -8.431 1.00 10.15 C ATOM 2662 CE1 HIS A 168 -4.022 9.563 -6.564 1.00 25.23 C ATOM 2663 NE2 HIS A 168 -3.312 8.676 -7.264 1.00 65.23 N ATOM 0 H HIS A 168 -3.792 10.612 -11.943 1.00 5.21 H new ATOM 0 HA HIS A 168 -5.483 11.666 -9.759 1.00 71.21 H new ATOM 0 HB2 HIS A 168 -2.469 11.473 -10.015 1.00 62.44 H new ATOM 0 HB3 HIS A 168 -3.244 12.581 -8.900 1.00 62.44 H new ATOM 0 HD2 HIS A 168 -2.371 8.853 -9.231 1.00 10.15 H new ATOM 0 HE1 HIS A 168 -4.448 9.369 -5.591 1.00 25.23 H new ATOM 0 HE2 HIS A 168 -3.082 7.723 -6.981 1.00 65.23 H new ATOM 2671 N THR A 169 -5.024 14.107 -10.454 1.00 2.33 N ATOM 2672 CA THR A 169 -5.010 15.432 -11.050 1.00 5.02 C ATOM 2673 C THR A 169 -4.277 16.416 -10.145 1.00 64.30 C ATOM 2674 O THR A 169 -4.722 16.711 -9.036 1.00 3.02 O ATOM 2675 CB THR A 169 -6.441 15.930 -11.320 1.00 11.24 C ATOM 2676 OG1 THR A 169 -7.196 14.894 -11.971 1.00 10.32 O ATOM 2677 CG2 THR A 169 -6.439 17.178 -12.193 1.00 32.22 C ATOM 0 H THR A 169 -5.444 14.066 -9.525 1.00 2.33 H new ATOM 0 HA THR A 169 -4.483 15.366 -12.002 1.00 5.02 H new ATOM 0 HB THR A 169 -6.898 16.183 -10.363 1.00 11.24 H new ATOM 0 HG1 THR A 169 -8.107 15.211 -12.141 1.00 10.32 H new ATOM 0 HG21 THR A 169 -7.465 17.504 -12.365 1.00 32.22 H new ATOM 0 HG22 THR A 169 -5.885 17.972 -11.692 1.00 32.22 H new ATOM 0 HG23 THR A 169 -5.965 16.953 -13.148 1.00 32.22 H new ATOM 2685 N VAL A 170 -3.143 16.901 -10.624 1.00 74.34 N ATOM 2686 CA VAL A 170 -2.315 17.829 -9.873 1.00 54.35 C ATOM 2687 C VAL A 170 -2.005 19.065 -10.714 1.00 4.41 C ATOM 2688 O VAL A 170 -1.472 18.951 -11.818 1.00 11.43 O ATOM 2689 CB VAL A 170 -0.997 17.158 -9.394 1.00 2.53 C ATOM 2690 CG1 VAL A 170 -0.361 16.324 -10.501 1.00 20.30 C ATOM 2691 CG2 VAL A 170 -0.009 18.198 -8.875 1.00 1.53 C ATOM 0 H VAL A 170 -2.771 16.662 -11.543 1.00 74.34 H new ATOM 0 HA VAL A 170 -2.875 18.133 -8.989 1.00 54.35 H new ATOM 0 HB VAL A 170 -1.254 16.488 -8.573 1.00 2.53 H new ATOM 0 HG11 VAL A 170 0.558 15.869 -10.132 1.00 20.30 H new ATOM 0 HG12 VAL A 170 -1.054 15.541 -10.811 1.00 20.30 H new ATOM 0 HG13 VAL A 170 -0.132 16.964 -11.353 1.00 20.30 H new ATOM 0 HG21 VAL A 170 0.904 17.701 -8.547 1.00 1.53 H new ATOM 0 HG22 VAL A 170 0.228 18.903 -9.671 1.00 1.53 H new ATOM 0 HG23 VAL A 170 -0.452 18.734 -8.036 1.00 1.53 H new ATOM 2701 N ASN A 171 -2.425 20.233 -10.213 1.00 11.33 N ATOM 2702 CA ASN A 171 -2.114 21.523 -10.840 1.00 70.20 C ATOM 2703 C ASN A 171 -2.922 21.658 -12.133 1.00 25.42 C ATOM 2704 O ASN A 171 -2.517 22.314 -13.089 1.00 13.02 O ATOM 2705 CB ASN A 171 -0.596 21.670 -11.086 1.00 34.24 C ATOM 2706 CG ASN A 171 -0.170 23.092 -11.432 1.00 64.41 C ATOM 2707 OD1 ASN A 171 0.007 23.440 -12.600 1.00 61.41 O ATOM 2708 ND2 ASN A 171 -0.010 23.926 -10.418 1.00 65.02 N ATOM 0 H ASN A 171 -2.987 20.310 -9.366 1.00 11.33 H new ATOM 0 HA ASN A 171 -2.397 22.333 -10.168 1.00 70.20 H new ATOM 0 HB2 ASN A 171 -0.059 21.345 -10.195 1.00 34.24 H new ATOM 0 HB3 ASN A 171 -0.301 21.004 -11.897 1.00 34.24 H new ATOM 0 HD21 ASN A 171 0.269 24.892 -10.591 1.00 65.02 H new ATOM 0 HD22 ASN A 171 -0.165 23.603 -9.463 1.00 65.02 H new ATOM 2715 N GLY A 172 -4.089 21.018 -12.139 1.00 51.30 N ATOM 2716 CA GLY A 172 -4.959 21.041 -13.302 1.00 33.21 C ATOM 2717 C GLY A 172 -4.599 19.977 -14.317 1.00 2.12 C ATOM 2718 O GLY A 172 -5.320 19.766 -15.291 1.00 73.03 O ATOM 0 H GLY A 172 -4.449 20.479 -11.351 1.00 51.30 H new ATOM 0 HA2 GLY A 172 -5.991 20.899 -12.982 1.00 33.21 H new ATOM 0 HA3 GLY A 172 -4.904 22.022 -13.774 1.00 33.21 H new ATOM 2722 N HIS A 173 -3.495 19.289 -14.075 1.00 73.42 N ATOM 2723 CA HIS A 173 -2.980 18.310 -15.017 1.00 51.02 C ATOM 2724 C HIS A 173 -3.310 16.894 -14.554 1.00 32.31 C ATOM 2725 O HIS A 173 -3.126 16.555 -13.388 1.00 72.13 O ATOM 2726 CB HIS A 173 -1.463 18.488 -15.171 1.00 54.45 C ATOM 2727 CG HIS A 173 -0.845 17.568 -16.176 1.00 1.41 C ATOM 2728 ND1 HIS A 173 -0.829 17.872 -17.513 1.00 21.32 N ATOM 2729 CD2 HIS A 173 -0.264 16.362 -15.991 1.00 73.55 C ATOM 2730 CE1 HIS A 173 -0.244 16.848 -18.105 1.00 73.24 C ATOM 2731 NE2 HIS A 173 0.112 15.908 -17.226 1.00 33.01 N ATOM 0 H HIS A 173 -2.936 19.392 -13.228 1.00 73.42 H new ATOM 0 HA HIS A 173 -3.455 18.467 -15.985 1.00 51.02 H new ATOM 0 HB2 HIS A 173 -1.255 19.518 -15.460 1.00 54.45 H new ATOM 0 HB3 HIS A 173 -0.988 18.326 -14.204 1.00 54.45 H new ATOM 0 HD2 HIS A 173 -0.123 15.854 -15.049 1.00 73.55 H new ATOM 0 HE1 HIS A 173 -0.074 16.779 -19.169 1.00 73.24 H new ATOM 0 HE2 HIS A 173 0.575 15.023 -17.435 1.00 33.01 H new ATOM 2739 N ASN A 174 -3.796 16.072 -15.472 1.00 15.34 N ATOM 2740 CA ASN A 174 -4.134 14.695 -15.153 1.00 64.03 C ATOM 2741 C ASN A 174 -2.999 13.755 -15.549 1.00 23.13 C ATOM 2742 O ASN A 174 -2.364 13.930 -16.587 1.00 30.14 O ATOM 2743 CB ASN A 174 -5.438 14.284 -15.844 1.00 21.22 C ATOM 2744 CG ASN A 174 -5.915 12.908 -15.415 1.00 13.30 C ATOM 2745 OD1 ASN A 174 -5.624 11.902 -16.063 1.00 22.33 O ATOM 2746 ND2 ASN A 174 -6.636 12.853 -14.310 1.00 44.32 N ATOM 0 H ASN A 174 -3.965 16.335 -16.443 1.00 15.34 H new ATOM 0 HA ASN A 174 -4.279 14.622 -14.075 1.00 64.03 H new ATOM 0 HB2 ASN A 174 -6.211 15.019 -15.620 1.00 21.22 H new ATOM 0 HB3 ASN A 174 -5.292 14.294 -16.924 1.00 21.22 H new ATOM 0 HD21 ASN A 174 -6.973 11.954 -13.965 1.00 44.32 H new ATOM 0 HD22 ASN A 174 -6.856 13.709 -13.801 1.00 44.32 H new ATOM 2753 N CYS A 175 -2.761 12.759 -14.715 1.00 23.41 N ATOM 2754 CA CYS A 175 -1.667 11.825 -14.919 1.00 54.31 C ATOM 2755 C CYS A 175 -2.084 10.424 -14.500 1.00 35.41 C ATOM 2756 O CYS A 175 -2.907 10.269 -13.598 1.00 13.04 O ATOM 2757 CB CYS A 175 -0.443 12.281 -14.121 1.00 53.12 C ATOM 2758 SG CYS A 175 -0.808 12.717 -12.404 1.00 10.32 S ATOM 0 H CYS A 175 -3.318 12.575 -13.880 1.00 23.41 H new ATOM 0 HA CYS A 175 -1.410 11.803 -15.978 1.00 54.31 H new ATOM 0 HB2 CYS A 175 0.303 11.486 -14.133 1.00 53.12 H new ATOM 0 HB3 CYS A 175 0.002 13.143 -14.618 1.00 53.12 H new ATOM 0 HG CYS A 175 -2.088 12.899 -12.265 1.00 10.32 H new ATOM 2764 N GLU A 176 -1.541 9.412 -15.164 1.00 24.42 N ATOM 2765 CA GLU A 176 -1.803 8.036 -14.777 1.00 13.24 C ATOM 2766 C GLU A 176 -0.746 7.580 -13.787 1.00 64.14 C ATOM 2767 O GLU A 176 0.448 7.739 -14.025 1.00 51.35 O ATOM 2768 CB GLU A 176 -1.818 7.100 -15.988 1.00 41.01 C ATOM 2769 CG GLU A 176 -2.381 5.724 -15.667 1.00 4.41 C ATOM 2770 CD GLU A 176 -2.214 4.733 -16.801 1.00 72.41 C ATOM 2771 OE1 GLU A 176 -3.122 4.643 -17.657 1.00 55.32 O ATOM 2772 OE2 GLU A 176 -1.178 4.033 -16.846 1.00 22.33 O ATOM 0 H GLU A 176 -0.921 9.518 -15.967 1.00 24.42 H new ATOM 0 HA GLU A 176 -2.790 7.996 -14.315 1.00 13.24 H new ATOM 0 HB2 GLU A 176 -2.410 7.553 -16.783 1.00 41.01 H new ATOM 0 HB3 GLU A 176 -0.803 6.991 -16.369 1.00 41.01 H new ATOM 0 HG2 GLU A 176 -1.887 5.335 -14.777 1.00 4.41 H new ATOM 0 HG3 GLU A 176 -3.440 5.818 -15.428 1.00 4.41 H new ATOM 2779 N VAL A 177 -1.193 7.018 -12.682 1.00 42.04 N ATOM 2780 CA VAL A 177 -0.297 6.613 -11.621 1.00 65.40 C ATOM 2781 C VAL A 177 -0.556 5.166 -11.226 1.00 43.31 C ATOM 2782 O VAL A 177 -1.700 4.748 -11.047 1.00 4.15 O ATOM 2783 CB VAL A 177 -0.420 7.523 -10.382 1.00 52.42 C ATOM 2784 CG1 VAL A 177 0.693 7.230 -9.397 1.00 11.31 C ATOM 2785 CG2 VAL A 177 -0.400 8.995 -10.773 1.00 1.15 C ATOM 0 H VAL A 177 -2.178 6.831 -12.496 1.00 42.04 H new ATOM 0 HA VAL A 177 0.718 6.707 -12.006 1.00 65.40 H new ATOM 0 HB VAL A 177 -1.378 7.311 -9.907 1.00 52.42 H new ATOM 0 HG11 VAL A 177 0.591 7.881 -8.529 1.00 11.31 H new ATOM 0 HG12 VAL A 177 0.633 6.189 -9.079 1.00 11.31 H new ATOM 0 HG13 VAL A 177 1.657 7.409 -9.873 1.00 11.31 H new ATOM 0 HG21 VAL A 177 -0.488 9.610 -9.878 1.00 1.15 H new ATOM 0 HG22 VAL A 177 0.537 9.224 -11.280 1.00 1.15 H new ATOM 0 HG23 VAL A 177 -1.235 9.205 -11.442 1.00 1.15 H new ATOM 2795 N ARG A 178 0.521 4.411 -11.102 1.00 10.41 N ATOM 2796 CA ARG A 178 0.430 2.979 -10.826 1.00 61.34 C ATOM 2797 C ARG A 178 1.707 2.483 -10.153 1.00 5.41 C ATOM 2798 O ARG A 178 2.673 3.237 -10.029 1.00 33.31 O ATOM 2799 CB ARG A 178 0.184 2.209 -12.133 1.00 22.23 C ATOM 2800 CG ARG A 178 1.447 1.935 -12.933 1.00 32.23 C ATOM 2801 CD ARG A 178 1.135 1.431 -14.330 1.00 43.22 C ATOM 2802 NE ARG A 178 2.346 0.985 -15.017 1.00 63.41 N ATOM 2803 CZ ARG A 178 2.640 1.258 -16.289 1.00 14.20 C ATOM 2804 NH1 ARG A 178 1.810 1.981 -17.036 1.00 44.40 N ATOM 2805 NH2 ARG A 178 3.776 0.814 -16.810 1.00 45.41 N ATOM 0 H ARG A 178 1.475 4.763 -11.188 1.00 10.41 H new ATOM 0 HA ARG A 178 -0.406 2.805 -10.149 1.00 61.34 H new ATOM 0 HB2 ARG A 178 -0.299 1.260 -11.899 1.00 22.23 H new ATOM 0 HB3 ARG A 178 -0.511 2.776 -12.752 1.00 22.23 H new ATOM 0 HG2 ARG A 178 2.039 2.848 -13.000 1.00 32.23 H new ATOM 0 HG3 ARG A 178 2.056 1.198 -12.409 1.00 32.23 H new ATOM 0 HD2 ARG A 178 0.424 0.607 -14.271 1.00 43.22 H new ATOM 0 HD3 ARG A 178 0.658 2.224 -14.907 1.00 43.22 H new ATOM 0 HE ARG A 178 3.013 0.425 -14.486 1.00 63.41 H new ATOM 0 HH11 ARG A 178 0.939 2.332 -16.637 1.00 44.40 H new ATOM 0 HH12 ARG A 178 2.044 2.184 -18.008 1.00 44.40 H new ATOM 0 HH21 ARG A 178 4.420 0.267 -16.238 1.00 45.41 H new ATOM 0 HH22 ARG A 178 4.006 1.020 -17.782 1.00 45.41 H new ATOM 2819 N LYS A 179 1.701 1.220 -9.714 1.00 33.10 N ATOM 2820 CA LYS A 179 2.878 0.606 -9.095 1.00 11.41 C ATOM 2821 C LYS A 179 4.069 0.620 -10.044 1.00 11.31 C ATOM 2822 O LYS A 179 3.943 0.268 -11.219 1.00 21.04 O ATOM 2823 CB LYS A 179 2.596 -0.849 -8.701 1.00 23.24 C ATOM 2824 CG LYS A 179 1.591 -1.025 -7.576 1.00 13.30 C ATOM 2825 CD LYS A 179 2.150 -0.594 -6.229 1.00 62.51 C ATOM 2826 CE LYS A 179 1.642 -1.489 -5.105 1.00 13.52 C ATOM 2827 NZ LYS A 179 0.154 -1.528 -5.030 1.00 13.15 N ATOM 0 H LYS A 179 0.892 0.603 -9.777 1.00 33.10 H new ATOM 0 HA LYS A 179 3.109 1.193 -8.206 1.00 11.41 H new ATOM 0 HB2 LYS A 179 2.234 -1.384 -9.579 1.00 23.24 H new ATOM 0 HB3 LYS A 179 3.535 -1.319 -8.407 1.00 23.24 H new ATOM 0 HG2 LYS A 179 0.696 -0.444 -7.798 1.00 13.30 H new ATOM 0 HG3 LYS A 179 1.288 -2.071 -7.523 1.00 13.30 H new ATOM 0 HD2 LYS A 179 3.239 -0.626 -6.258 1.00 62.51 H new ATOM 0 HD3 LYS A 179 1.867 0.440 -6.030 1.00 62.51 H new ATOM 0 HE2 LYS A 179 2.021 -2.500 -5.252 1.00 13.52 H new ATOM 0 HE3 LYS A 179 2.041 -1.134 -4.155 1.00 13.52 H new ATOM 0 HZ1 LYS A 179 -0.153 -2.468 -4.707 1.00 13.15 H new ATOM 0 HZ2 LYS A 179 -0.179 -0.806 -4.360 1.00 13.15 H new ATOM 0 HZ3 LYS A 179 -0.246 -1.338 -5.971 1.00 13.15 H new ATOM 2841 N ALA A 180 5.216 1.028 -9.533 1.00 41.33 N ATOM 2842 CA ALA A 180 6.449 0.966 -10.293 1.00 54.41 C ATOM 2843 C ALA A 180 7.400 0.013 -9.603 1.00 72.01 C ATOM 2844 O ALA A 180 7.838 0.253 -8.480 1.00 21.04 O ATOM 2845 CB ALA A 180 7.078 2.339 -10.449 1.00 50.00 C ATOM 0 H ALA A 180 5.319 1.407 -8.592 1.00 41.33 H new ATOM 0 HA ALA A 180 6.229 0.603 -11.297 1.00 54.41 H new ATOM 0 HB1 ALA A 180 8.000 2.254 -11.024 1.00 50.00 H new ATOM 0 HB2 ALA A 180 6.385 2.999 -10.970 1.00 50.00 H new ATOM 0 HB3 ALA A 180 7.301 2.751 -9.465 1.00 50.00 H new ATOM 2851 N LEU A 181 7.696 -1.073 -10.274 1.00 24.24 N ATOM 2852 CA LEU A 181 8.494 -2.131 -9.692 1.00 11.31 C ATOM 2853 C LEU A 181 9.950 -1.969 -10.085 1.00 15.45 C ATOM 2854 O LEU A 181 10.267 -1.210 -11.005 1.00 1.41 O ATOM 2855 CB LEU A 181 7.968 -3.499 -10.142 1.00 70.13 C ATOM 2856 CG LEU A 181 6.487 -3.764 -9.848 1.00 15.03 C ATOM 2857 CD1 LEU A 181 6.053 -5.096 -10.444 1.00 31.51 C ATOM 2858 CD2 LEU A 181 6.232 -3.748 -8.350 1.00 42.02 C ATOM 0 H LEU A 181 7.395 -1.251 -11.232 1.00 24.24 H new ATOM 0 HA LEU A 181 8.420 -2.069 -8.606 1.00 11.31 H new ATOM 0 HB2 LEU A 181 8.131 -3.597 -11.215 1.00 70.13 H new ATOM 0 HB3 LEU A 181 8.561 -4.275 -9.658 1.00 70.13 H new ATOM 0 HG LEU A 181 5.899 -2.971 -10.310 1.00 15.03 H new ATOM 0 HD11 LEU A 181 4.999 -5.266 -10.225 1.00 31.51 H new ATOM 0 HD12 LEU A 181 6.201 -5.077 -11.524 1.00 31.51 H new ATOM 0 HD13 LEU A 181 6.648 -5.900 -10.011 1.00 31.51 H new ATOM 0 HD21 LEU A 181 5.176 -3.938 -8.159 1.00 42.02 H new ATOM 0 HD22 LEU A 181 6.832 -4.521 -7.870 1.00 42.02 H new ATOM 0 HD23 LEU A 181 6.505 -2.774 -7.945 1.00 42.02 H new