USER MOD reduce.3.24.130724 H: found=0, std=0, add=1066, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1061 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 113 GLN : amide:sc= -0.937! K(o=-0.93!,f=-2.2) USER MOD Set 1.2: A 114 LYS NZ :NH3+ -165:sc= 0.00818 (180deg=0) USER MOD Set 2.1: A 112 MET CE :methyl -136:sc= -0.328 (180deg=-1.23) USER MOD Set 2.2: A 135 MET CE :methyl 147:sc= -0.832 (180deg=-1.28) USER MOD Set 3.1: A 85 THR OG1 : rot -131:sc= 1.12 USER MOD Set 3.2: A 98 GLN : amide:sc= -2.12 K(o=-1,f=-6.2!) USER MOD Set 4.1: A 66 SER OG : rot -17:sc= 0.63 USER MOD Set 4.2: A 69 SER OG : rot -60:sc= 0.809 USER MOD Single : A 10 GLN : amide:sc= -0.297 X(o=-0.3,f=-0.28) USER MOD Single : A 12 HIS : no HD1:sc= 0 X(o=0,f=-0.0065) USER MOD Single : A 14 GLN : amide:sc= -0.455 X(o=-0.46,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 32 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00177) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl 177:sc= -1.88 (180deg=-1.96) USER MOD Single : A 43 TYR OH : rot -0:sc= 1.29 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -1.48 K(o=-1.5,f=-0.42) USER MOD Single : A 52 LYS NZ :NH3+ -176:sc= 1.04 (180deg=0.898) USER MOD Single : A 53 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0942) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 162:sc= -0.127 (180deg=-0.733) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 MET CE :methyl -168:sc= -0.458 (180deg=-0.556) USER MOD Single : A 70 LYS NZ :NH3+ -177:sc= 1.26 (180deg=1.13) USER MOD Single : A 72 ASN : amide:sc= -1.13 K(o=-1.1,f=-8!) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 SER OG : rot 180:sc= -2.02 USER MOD Single : A 87 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0.771 USER MOD Single : A 99 SER OG : rot 37:sc= 0.0208 USER MOD Single : A 102 GLN : amide:sc= -0.806 K(o=-0.81,f=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 115 ASN : amide:sc= -3.18 K(o=-3.2,f=-9.4!) USER MOD Single : A 118 LYS NZ :NH3+ -154:sc= 0.483 (180deg=0.216) USER MOD Single : A 124 THR OG1 : rot 80:sc= 0.0907 USER MOD Single : A 125 LYS NZ :NH3+ 170:sc= 1.22 (180deg=1.07) USER MOD Single : A 134 HIS : no HE2:sc= 1.08 K(o=1.1,f=-3.2!) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 TYR OH : rot 11:sc= 1.04 USER MOD Single : A 139 SER OG : rot -151:sc= -1.73! USER MOD ----------------------------------------------------------------- ATOM 97 N GLU A 7 35.956 -2.800 2.877 1.00 0.00 N ATOM 98 CA GLU A 7 34.879 -2.594 3.794 1.00 0.00 C ATOM 99 C GLU A 7 33.582 -2.557 3.009 1.00 0.00 C ATOM 100 O GLU A 7 33.420 -1.700 2.129 1.00 0.00 O ATOM 101 CB GLU A 7 35.057 -1.277 4.535 1.00 0.00 C ATOM 102 CG GLU A 7 36.292 -1.211 5.411 1.00 0.00 C ATOM 103 CD GLU A 7 36.413 0.119 6.095 1.00 0.00 C ATOM 104 OE1 GLU A 7 35.821 0.302 7.180 1.00 0.00 O ATOM 105 OE2 GLU A 7 37.087 1.019 5.550 1.00 0.00 O ATOM 0 HA GLU A 7 34.863 -3.404 4.524 1.00 0.00 H new ATOM 0 HB2 GLU A 7 35.100 -0.468 3.806 1.00 0.00 H new ATOM 0 HB3 GLU A 7 34.178 -1.101 5.155 1.00 0.00 H new ATOM 0 HG2 GLU A 7 36.251 -2.003 6.159 1.00 0.00 H new ATOM 0 HG3 GLU A 7 37.179 -1.391 4.804 1.00 0.00 H new ATOM 112 N PRO A 8 32.664 -3.494 3.251 1.00 0.00 N ATOM 113 CA PRO A 8 31.379 -3.487 2.593 1.00 0.00 C ATOM 114 C PRO A 8 30.461 -2.460 3.243 1.00 0.00 C ATOM 115 O PRO A 8 30.770 -1.910 4.306 1.00 0.00 O ATOM 116 CB PRO A 8 30.816 -4.892 2.823 1.00 0.00 C ATOM 117 CG PRO A 8 31.853 -5.642 3.607 1.00 0.00 C ATOM 118 CD PRO A 8 32.795 -4.623 4.178 1.00 0.00 C ATOM 0 HA PRO A 8 31.461 -3.233 1.536 1.00 0.00 H new ATOM 0 HB2 PRO A 8 29.873 -4.848 3.369 1.00 0.00 H new ATOM 0 HB3 PRO A 8 30.612 -5.389 1.874 1.00 0.00 H new ATOM 0 HG2 PRO A 8 31.388 -6.225 4.402 1.00 0.00 H new ATOM 0 HG3 PRO A 8 32.387 -6.344 2.967 1.00 0.00 H new ATOM 0 HD2 PRO A 8 32.519 -4.344 5.195 1.00 0.00 H new ATOM 0 HD3 PRO A 8 33.818 -4.997 4.216 1.00 0.00 H new ATOM 126 N LEU A 9 29.348 -2.226 2.643 1.00 0.00 N ATOM 127 CA LEU A 9 28.429 -1.243 3.148 1.00 0.00 C ATOM 128 C LEU A 9 27.264 -1.959 3.764 1.00 0.00 C ATOM 129 O LEU A 9 26.544 -2.643 3.061 1.00 0.00 O ATOM 130 CB LEU A 9 27.933 -0.330 2.006 1.00 0.00 C ATOM 131 CG LEU A 9 27.810 1.183 2.336 1.00 0.00 C ATOM 132 CD1 LEU A 9 26.743 1.455 3.388 1.00 0.00 C ATOM 133 CD2 LEU A 9 29.148 1.739 2.800 1.00 0.00 C ATOM 0 H LEU A 9 29.041 -2.701 1.794 1.00 0.00 H new ATOM 0 HA LEU A 9 28.929 -0.621 3.890 1.00 0.00 H new ATOM 0 HB2 LEU A 9 28.612 -0.441 1.160 1.00 0.00 H new ATOM 0 HB3 LEU A 9 26.957 -0.689 1.681 1.00 0.00 H new ATOM 0 HG LEU A 9 27.508 1.687 1.418 1.00 0.00 H new ATOM 0 HD11 LEU A 9 26.693 2.526 3.587 1.00 0.00 H new ATOM 0 HD12 LEU A 9 25.776 1.108 3.024 1.00 0.00 H new ATOM 0 HD13 LEU A 9 26.996 0.927 4.307 1.00 0.00 H new ATOM 0 HD21 LEU A 9 29.042 2.800 3.027 1.00 0.00 H new ATOM 0 HD22 LEU A 9 29.472 1.207 3.695 1.00 0.00 H new ATOM 0 HD23 LEU A 9 29.889 1.608 2.012 1.00 0.00 H new ATOM 145 N GLN A 10 27.107 -1.840 5.055 1.00 0.00 N ATOM 146 CA GLN A 10 25.995 -2.443 5.742 1.00 0.00 C ATOM 147 C GLN A 10 24.791 -1.537 5.637 1.00 0.00 C ATOM 148 O GLN A 10 24.673 -0.537 6.363 1.00 0.00 O ATOM 149 CB GLN A 10 26.332 -2.754 7.198 1.00 0.00 C ATOM 150 CG GLN A 10 27.267 -3.919 7.379 1.00 0.00 C ATOM 151 CD GLN A 10 27.563 -4.262 8.831 1.00 0.00 C ATOM 152 OE1 GLN A 10 27.568 -3.406 9.708 1.00 0.00 O ATOM 153 NE2 GLN A 10 27.793 -5.524 9.100 1.00 0.00 N ATOM 0 H GLN A 10 27.745 -1.323 5.660 1.00 0.00 H new ATOM 0 HA GLN A 10 25.766 -3.396 5.266 1.00 0.00 H new ATOM 0 HB2 GLN A 10 26.779 -1.870 7.653 1.00 0.00 H new ATOM 0 HB3 GLN A 10 25.407 -2.957 7.738 1.00 0.00 H new ATOM 0 HG2 GLN A 10 26.838 -4.794 6.891 1.00 0.00 H new ATOM 0 HG3 GLN A 10 28.206 -3.699 6.871 1.00 0.00 H new ATOM 0 HE21 GLN A 10 27.783 -6.215 8.350 1.00 0.00 H new ATOM 0 HE22 GLN A 10 27.982 -5.815 10.059 1.00 0.00 H new ATOM 162 N VAL A 11 23.936 -1.861 4.711 1.00 0.00 N ATOM 163 CA VAL A 11 22.794 -1.044 4.402 1.00 0.00 C ATOM 164 C VAL A 11 21.540 -1.692 4.923 1.00 0.00 C ATOM 165 O VAL A 11 21.249 -2.835 4.591 1.00 0.00 O ATOM 166 CB VAL A 11 22.576 -0.897 2.877 1.00 0.00 C ATOM 167 CG1 VAL A 11 21.746 0.325 2.558 1.00 0.00 C ATOM 168 CG2 VAL A 11 23.863 -0.939 2.081 1.00 0.00 C ATOM 0 H VAL A 11 24.010 -2.705 4.144 1.00 0.00 H new ATOM 0 HA VAL A 11 22.987 -0.073 4.858 1.00 0.00 H new ATOM 0 HB VAL A 11 22.011 -1.774 2.559 1.00 0.00 H new ATOM 0 HG11 VAL A 11 21.610 0.401 1.479 1.00 0.00 H new ATOM 0 HG12 VAL A 11 20.773 0.240 3.041 1.00 0.00 H new ATOM 0 HG13 VAL A 11 22.256 1.217 2.923 1.00 0.00 H new ATOM 0 HG21 VAL A 11 23.638 -0.831 1.020 1.00 0.00 H new ATOM 0 HG22 VAL A 11 24.514 -0.125 2.399 1.00 0.00 H new ATOM 0 HG23 VAL A 11 24.364 -1.892 2.250 1.00 0.00 H new ATOM 178 N HIS A 12 20.823 -0.994 5.732 1.00 0.00 N ATOM 179 CA HIS A 12 19.521 -1.439 6.140 1.00 0.00 C ATOM 180 C HIS A 12 18.500 -0.703 5.310 1.00 0.00 C ATOM 181 O HIS A 12 18.314 0.498 5.466 1.00 0.00 O ATOM 182 CB HIS A 12 19.258 -1.172 7.616 1.00 0.00 C ATOM 183 CG HIS A 12 20.022 -2.029 8.586 1.00 0.00 C ATOM 184 ND1 HIS A 12 19.434 -2.671 9.655 1.00 0.00 N ATOM 185 CD2 HIS A 12 21.342 -2.322 8.660 1.00 0.00 C ATOM 186 CE1 HIS A 12 20.383 -3.317 10.327 1.00 0.00 C ATOM 187 NE2 HIS A 12 21.564 -3.142 9.765 1.00 0.00 N ATOM 0 H HIS A 12 21.113 -0.102 6.132 1.00 0.00 H new ATOM 0 HA HIS A 12 19.458 -2.517 5.991 1.00 0.00 H new ATOM 0 HB2 HIS A 12 19.491 -0.127 7.823 1.00 0.00 H new ATOM 0 HB3 HIS A 12 18.193 -1.305 7.805 1.00 0.00 H new ATOM 0 HD2 HIS A 12 22.101 -1.976 7.973 1.00 0.00 H new ATOM 0 HE1 HIS A 12 20.210 -3.907 11.215 1.00 0.00 H new ATOM 0 HE2 HIS A 12 22.456 -3.528 10.075 1.00 0.00 H new ATOM 195 N VAL A 13 17.905 -1.380 4.397 1.00 0.00 N ATOM 196 CA VAL A 13 16.923 -0.794 3.555 1.00 0.00 C ATOM 197 C VAL A 13 15.545 -1.128 4.031 1.00 0.00 C ATOM 198 O VAL A 13 15.268 -2.257 4.487 1.00 0.00 O ATOM 199 CB VAL A 13 17.083 -1.202 2.067 1.00 0.00 C ATOM 200 CG1 VAL A 13 18.420 -0.810 1.569 1.00 0.00 C ATOM 201 CG2 VAL A 13 16.882 -2.673 1.841 1.00 0.00 C ATOM 0 H VAL A 13 18.086 -2.366 4.210 1.00 0.00 H new ATOM 0 HA VAL A 13 17.075 0.284 3.613 1.00 0.00 H new ATOM 0 HB VAL A 13 16.305 -0.675 1.516 1.00 0.00 H new ATOM 0 HG11 VAL A 13 18.519 -1.102 0.524 1.00 0.00 H new ATOM 0 HG12 VAL A 13 18.539 0.270 1.657 1.00 0.00 H new ATOM 0 HG13 VAL A 13 19.189 -1.309 2.159 1.00 0.00 H new ATOM 0 HG21 VAL A 13 17.006 -2.899 0.782 1.00 0.00 H new ATOM 0 HG22 VAL A 13 17.616 -3.234 2.420 1.00 0.00 H new ATOM 0 HG23 VAL A 13 15.878 -2.956 2.157 1.00 0.00 H new ATOM 211 N GLN A 14 14.714 -0.154 3.987 1.00 0.00 N ATOM 212 CA GLN A 14 13.337 -0.346 4.280 1.00 0.00 C ATOM 213 C GLN A 14 12.635 -0.352 2.959 1.00 0.00 C ATOM 214 O GLN A 14 12.660 0.648 2.235 1.00 0.00 O ATOM 215 CB GLN A 14 12.784 0.749 5.194 1.00 0.00 C ATOM 216 CG GLN A 14 11.343 0.499 5.625 1.00 0.00 C ATOM 217 CD GLN A 14 10.798 1.570 6.544 1.00 0.00 C ATOM 218 OE1 GLN A 14 10.926 1.485 7.772 1.00 0.00 O ATOM 219 NE2 GLN A 14 10.159 2.556 5.977 1.00 0.00 N ATOM 0 H GLN A 14 14.967 0.804 3.746 1.00 0.00 H new ATOM 0 HA GLN A 14 13.185 -1.279 4.822 1.00 0.00 H new ATOM 0 HB2 GLN A 14 13.414 0.826 6.080 1.00 0.00 H new ATOM 0 HB3 GLN A 14 12.841 1.707 4.678 1.00 0.00 H new ATOM 0 HG2 GLN A 14 10.712 0.435 4.739 1.00 0.00 H new ATOM 0 HG3 GLN A 14 11.284 -0.466 6.128 1.00 0.00 H new ATOM 0 HE21 GLN A 14 10.074 2.592 4.961 1.00 0.00 H new ATOM 0 HE22 GLN A 14 9.744 3.291 6.550 1.00 0.00 H new ATOM 228 N LEU A 15 12.096 -1.470 2.606 1.00 0.00 N ATOM 229 CA LEU A 15 11.463 -1.614 1.348 1.00 0.00 C ATOM 230 C LEU A 15 9.971 -1.518 1.526 1.00 0.00 C ATOM 231 O LEU A 15 9.376 -2.320 2.240 1.00 0.00 O ATOM 232 CB LEU A 15 11.859 -2.951 0.722 1.00 0.00 C ATOM 233 CG LEU A 15 13.359 -3.184 0.523 1.00 0.00 C ATOM 234 CD1 LEU A 15 13.616 -4.544 -0.108 1.00 0.00 C ATOM 235 CD2 LEU A 15 13.980 -2.070 -0.310 1.00 0.00 C ATOM 0 H LEU A 15 12.084 -2.309 3.186 1.00 0.00 H new ATOM 0 HA LEU A 15 11.783 -0.817 0.677 1.00 0.00 H new ATOM 0 HB2 LEU A 15 11.468 -3.752 1.349 1.00 0.00 H new ATOM 0 HB3 LEU A 15 11.367 -3.035 -0.247 1.00 0.00 H new ATOM 0 HG LEU A 15 13.834 -3.172 1.504 1.00 0.00 H new ATOM 0 HD11 LEU A 15 14.688 -4.687 -0.240 1.00 0.00 H new ATOM 0 HD12 LEU A 15 13.222 -5.326 0.541 1.00 0.00 H new ATOM 0 HD13 LEU A 15 13.121 -4.594 -1.078 1.00 0.00 H new ATOM 0 HD21 LEU A 15 15.046 -2.261 -0.436 1.00 0.00 H new ATOM 0 HD22 LEU A 15 13.500 -2.036 -1.288 1.00 0.00 H new ATOM 0 HD23 LEU A 15 13.840 -1.115 0.197 1.00 0.00 H new ATOM 247 N GLU A 16 9.392 -0.507 0.941 1.00 0.00 N ATOM 248 CA GLU A 16 7.964 -0.309 0.972 1.00 0.00 C ATOM 249 C GLU A 16 7.400 -0.855 -0.308 1.00 0.00 C ATOM 250 O GLU A 16 8.053 -0.788 -1.352 1.00 0.00 O ATOM 251 CB GLU A 16 7.606 1.174 1.023 1.00 0.00 C ATOM 252 CG GLU A 16 8.138 1.960 2.198 1.00 0.00 C ATOM 253 CD GLU A 16 7.814 3.435 2.053 1.00 0.00 C ATOM 254 OE1 GLU A 16 8.445 4.119 1.231 1.00 0.00 O ATOM 255 OE2 GLU A 16 6.905 3.941 2.738 1.00 0.00 O ATOM 0 H GLU A 16 9.900 0.211 0.424 1.00 0.00 H new ATOM 0 HA GLU A 16 7.564 -0.804 1.857 1.00 0.00 H new ATOM 0 HB2 GLU A 16 7.968 1.643 0.108 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.520 1.262 1.018 1.00 0.00 H new ATOM 0 HG2 GLU A 16 7.705 1.578 3.122 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.217 1.826 2.272 1.00 0.00 H new ATOM 262 N LYS A 17 6.221 -1.383 -0.258 1.00 0.00 N ATOM 263 CA LYS A 17 5.574 -1.855 -1.455 1.00 0.00 C ATOM 264 C LYS A 17 4.185 -1.336 -1.497 1.00 0.00 C ATOM 265 O LYS A 17 3.356 -1.754 -0.700 1.00 0.00 O ATOM 266 CB LYS A 17 5.553 -3.377 -1.547 1.00 0.00 C ATOM 267 CG LYS A 17 6.906 -4.030 -1.702 1.00 0.00 C ATOM 268 CD LYS A 17 6.749 -5.521 -1.866 1.00 0.00 C ATOM 269 CE LYS A 17 8.081 -6.201 -2.061 1.00 0.00 C ATOM 270 NZ LYS A 17 7.930 -7.656 -2.232 1.00 0.00 N ATOM 0 H LYS A 17 5.679 -1.502 0.598 1.00 0.00 H new ATOM 0 HA LYS A 17 6.148 -1.488 -2.306 1.00 0.00 H new ATOM 0 HB2 LYS A 17 5.077 -3.773 -0.650 1.00 0.00 H new ATOM 0 HB3 LYS A 17 4.929 -3.665 -2.393 1.00 0.00 H new ATOM 0 HG2 LYS A 17 7.422 -3.614 -2.567 1.00 0.00 H new ATOM 0 HG3 LYS A 17 7.523 -3.816 -0.830 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.254 -5.934 -0.987 1.00 0.00 H new ATOM 0 HD3 LYS A 17 6.105 -5.728 -2.721 1.00 0.00 H new ATOM 0 HE2 LYS A 17 8.579 -5.782 -2.935 1.00 0.00 H new ATOM 0 HE3 LYS A 17 8.721 -6.000 -1.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 8.866 -8.089 -2.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 7.477 -8.060 -1.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 7.340 -7.848 -3.066 1.00 0.00 H new ATOM 284 N VAL A 18 3.913 -0.420 -2.394 1.00 0.00 N ATOM 285 CA VAL A 18 2.597 0.143 -2.462 1.00 0.00 C ATOM 286 C VAL A 18 1.773 -0.705 -3.421 1.00 0.00 C ATOM 287 O VAL A 18 1.992 -0.695 -4.633 1.00 0.00 O ATOM 288 CB VAL A 18 2.594 1.648 -2.914 1.00 0.00 C ATOM 289 CG1 VAL A 18 1.244 2.298 -2.679 1.00 0.00 C ATOM 290 CG2 VAL A 18 3.718 2.441 -2.246 1.00 0.00 C ATOM 0 H VAL A 18 4.578 -0.056 -3.076 1.00 0.00 H new ATOM 0 HA VAL A 18 2.165 0.134 -1.461 1.00 0.00 H new ATOM 0 HB VAL A 18 2.781 1.661 -3.988 1.00 0.00 H new ATOM 0 HG11 VAL A 18 1.280 3.338 -3.003 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.480 1.767 -3.247 1.00 0.00 H new ATOM 0 HG13 VAL A 18 1.000 2.257 -1.617 1.00 0.00 H new ATOM 0 HG21 VAL A 18 3.683 3.477 -2.584 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.593 2.408 -1.164 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.680 2.004 -2.514 1.00 0.00 H new ATOM 300 N TYR A 19 0.916 -1.514 -2.870 1.00 0.00 N ATOM 301 CA TYR A 19 0.032 -2.337 -3.662 1.00 0.00 C ATOM 302 C TYR A 19 -1.188 -1.528 -4.020 1.00 0.00 C ATOM 303 O TYR A 19 -1.316 -0.376 -3.595 1.00 0.00 O ATOM 304 CB TYR A 19 -0.413 -3.568 -2.876 1.00 0.00 C ATOM 305 CG TYR A 19 0.662 -4.586 -2.574 1.00 0.00 C ATOM 306 CD1 TYR A 19 1.606 -4.372 -1.588 1.00 0.00 C ATOM 307 CD2 TYR A 19 0.696 -5.783 -3.252 1.00 0.00 C ATOM 308 CE1 TYR A 19 2.546 -5.323 -1.285 1.00 0.00 C ATOM 309 CE2 TYR A 19 1.633 -6.743 -2.962 1.00 0.00 C ATOM 310 CZ TYR A 19 2.561 -6.507 -1.971 1.00 0.00 C ATOM 311 OH TYR A 19 3.501 -7.465 -1.659 1.00 0.00 O ATOM 0 H TYR A 19 0.806 -1.626 -1.862 1.00 0.00 H new ATOM 0 HA TYR A 19 0.562 -2.663 -4.557 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -0.846 -3.235 -1.933 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -1.208 -4.063 -3.434 1.00 0.00 H new ATOM 0 HD1 TYR A 19 1.603 -3.438 -1.046 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -0.030 -5.971 -4.029 1.00 0.00 H new ATOM 0 HE1 TYR A 19 3.272 -5.138 -0.507 1.00 0.00 H new ATOM 0 HE2 TYR A 19 1.643 -7.676 -3.506 1.00 0.00 H new ATOM 0 HH TYR A 19 3.376 -8.247 -2.237 1.00 0.00 H new ATOM 321 N LEU A 20 -2.089 -2.113 -4.783 1.00 0.00 N ATOM 322 CA LEU A 20 -3.332 -1.438 -5.097 1.00 0.00 C ATOM 323 C LEU A 20 -4.166 -1.385 -3.850 1.00 0.00 C ATOM 324 O LEU A 20 -4.659 -0.343 -3.474 1.00 0.00 O ATOM 325 CB LEU A 20 -4.112 -2.178 -6.175 1.00 0.00 C ATOM 326 CG LEU A 20 -3.460 -2.313 -7.538 1.00 0.00 C ATOM 327 CD1 LEU A 20 -4.325 -3.187 -8.419 1.00 0.00 C ATOM 328 CD2 LEU A 20 -3.258 -0.950 -8.181 1.00 0.00 C ATOM 0 H LEU A 20 -1.987 -3.042 -5.192 1.00 0.00 H new ATOM 0 HA LEU A 20 -3.103 -0.439 -5.467 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -4.331 -3.180 -5.805 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -5.068 -1.671 -6.307 1.00 0.00 H new ATOM 0 HG LEU A 20 -2.479 -2.773 -7.417 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -3.861 -3.287 -9.400 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -4.429 -4.172 -7.964 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -5.310 -2.732 -8.528 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -2.789 -1.074 -9.157 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -4.223 -0.458 -8.302 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -2.617 -0.339 -7.545 1.00 0.00 H new ATOM 340 N ASP A 21 -4.221 -2.543 -3.205 1.00 0.00 N ATOM 341 CA ASP A 21 -4.998 -2.834 -1.983 1.00 0.00 C ATOM 342 C ASP A 21 -4.896 -1.773 -0.902 1.00 0.00 C ATOM 343 O ASP A 21 -5.885 -1.416 -0.280 1.00 0.00 O ATOM 344 CB ASP A 21 -4.514 -4.164 -1.425 1.00 0.00 C ATOM 345 CG ASP A 21 -4.961 -4.432 -0.003 1.00 0.00 C ATOM 346 OD1 ASP A 21 -6.059 -4.978 0.193 1.00 0.00 O ATOM 347 OD2 ASP A 21 -4.173 -4.153 0.910 1.00 0.00 O ATOM 0 H ASP A 21 -3.699 -3.357 -3.530 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.048 -2.859 -2.273 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -4.874 -4.968 -2.066 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.425 -4.188 -1.464 1.00 0.00 H new ATOM 352 N GLY A 22 -3.716 -1.282 -0.685 1.00 0.00 N ATOM 353 CA GLY A 22 -3.538 -0.354 0.374 1.00 0.00 C ATOM 354 C GLY A 22 -2.492 -0.806 1.323 1.00 0.00 C ATOM 355 O GLY A 22 -1.843 0.017 1.972 1.00 0.00 O ATOM 0 H GLY A 22 -2.877 -1.507 -1.220 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -3.264 0.618 -0.035 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.480 -0.222 0.906 1.00 0.00 H new ATOM 359 N ASP A 23 -2.345 -2.109 1.455 1.00 0.00 N ATOM 360 CA ASP A 23 -1.302 -2.661 2.288 1.00 0.00 C ATOM 361 C ASP A 23 0.037 -2.349 1.700 1.00 0.00 C ATOM 362 O ASP A 23 0.327 -2.709 0.557 1.00 0.00 O ATOM 363 CB ASP A 23 -1.440 -4.177 2.461 1.00 0.00 C ATOM 364 CG ASP A 23 -0.396 -4.753 3.399 1.00 0.00 C ATOM 365 OD1 ASP A 23 -0.492 -4.528 4.625 1.00 0.00 O ATOM 366 OD2 ASP A 23 0.509 -5.488 2.947 1.00 0.00 O ATOM 0 H ASP A 23 -2.935 -2.803 0.996 1.00 0.00 H new ATOM 0 HA ASP A 23 -1.398 -2.203 3.272 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -2.434 -4.406 2.844 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -1.355 -4.660 1.487 1.00 0.00 H new ATOM 371 N VAL A 24 0.808 -1.608 2.424 1.00 0.00 N ATOM 372 CA VAL A 24 2.141 -1.342 2.028 1.00 0.00 C ATOM 373 C VAL A 24 2.993 -2.302 2.793 1.00 0.00 C ATOM 374 O VAL A 24 2.992 -2.291 4.033 1.00 0.00 O ATOM 375 CB VAL A 24 2.582 0.120 2.329 1.00 0.00 C ATOM 376 CG1 VAL A 24 3.974 0.391 1.780 1.00 0.00 C ATOM 377 CG2 VAL A 24 1.582 1.122 1.773 1.00 0.00 C ATOM 0 H VAL A 24 0.528 -1.173 3.303 1.00 0.00 H new ATOM 0 HA VAL A 24 2.237 -1.461 0.949 1.00 0.00 H new ATOM 0 HB VAL A 24 2.612 0.240 3.412 1.00 0.00 H new ATOM 0 HG11 VAL A 24 4.259 1.419 2.003 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.687 -0.292 2.242 1.00 0.00 H new ATOM 0 HG13 VAL A 24 3.975 0.240 0.700 1.00 0.00 H new ATOM 0 HG21 VAL A 24 1.917 2.134 1.999 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.505 0.998 0.693 1.00 0.00 H new ATOM 0 HG23 VAL A 24 0.606 0.953 2.228 1.00 0.00 H new ATOM 387 N SER A 25 3.641 -3.173 2.089 1.00 0.00 N ATOM 388 CA SER A 25 4.470 -4.149 2.714 1.00 0.00 C ATOM 389 C SER A 25 5.779 -3.503 3.091 1.00 0.00 C ATOM 390 O SER A 25 6.523 -3.047 2.229 1.00 0.00 O ATOM 391 CB SER A 25 4.672 -5.353 1.784 1.00 0.00 C ATOM 392 OG SER A 25 5.320 -6.442 2.432 1.00 0.00 O ATOM 0 H SER A 25 3.610 -3.227 1.071 1.00 0.00 H new ATOM 0 HA SER A 25 3.993 -4.524 3.620 1.00 0.00 H new ATOM 0 HB2 SER A 25 3.704 -5.683 1.407 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.262 -5.046 0.921 1.00 0.00 H new ATOM 0 HG SER A 25 5.424 -7.184 1.800 1.00 0.00 H new ATOM 398 N ILE A 26 6.000 -3.404 4.372 1.00 0.00 N ATOM 399 CA ILE A 26 7.195 -2.837 4.906 1.00 0.00 C ATOM 400 C ILE A 26 8.152 -3.960 5.206 1.00 0.00 C ATOM 401 O ILE A 26 7.913 -4.790 6.093 1.00 0.00 O ATOM 402 CB ILE A 26 6.915 -2.011 6.190 1.00 0.00 C ATOM 403 CG1 ILE A 26 5.892 -0.895 5.912 1.00 0.00 C ATOM 404 CG2 ILE A 26 8.200 -1.425 6.764 1.00 0.00 C ATOM 405 CD1 ILE A 26 6.271 0.043 4.788 1.00 0.00 C ATOM 0 H ILE A 26 5.340 -3.722 5.082 1.00 0.00 H new ATOM 0 HA ILE A 26 7.624 -2.152 4.175 1.00 0.00 H new ATOM 0 HB ILE A 26 6.494 -2.689 6.932 1.00 0.00 H new ATOM 0 HG12 ILE A 26 4.931 -1.352 5.677 1.00 0.00 H new ATOM 0 HG13 ILE A 26 5.754 -0.312 6.823 1.00 0.00 H new ATOM 0 HG21 ILE A 26 7.969 -0.852 7.662 1.00 0.00 H new ATOM 0 HG22 ILE A 26 8.888 -2.233 7.015 1.00 0.00 H new ATOM 0 HG23 ILE A 26 8.663 -0.770 6.026 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.492 0.796 4.664 1.00 0.00 H new ATOM 0 HD12 ILE A 26 7.215 0.533 5.026 1.00 0.00 H new ATOM 0 HD13 ILE A 26 6.379 -0.523 3.863 1.00 0.00 H new ATOM 417 N GLU A 27 9.182 -4.010 4.450 1.00 0.00 N ATOM 418 CA GLU A 27 10.176 -5.026 4.552 1.00 0.00 C ATOM 419 C GLU A 27 11.479 -4.404 5.023 1.00 0.00 C ATOM 420 O GLU A 27 11.760 -3.240 4.730 1.00 0.00 O ATOM 421 CB GLU A 27 10.364 -5.643 3.175 1.00 0.00 C ATOM 422 CG GLU A 27 11.433 -6.697 3.091 1.00 0.00 C ATOM 423 CD GLU A 27 11.043 -7.956 3.806 1.00 0.00 C ATOM 424 OE1 GLU A 27 10.244 -8.724 3.259 1.00 0.00 O ATOM 425 OE2 GLU A 27 11.515 -8.194 4.931 1.00 0.00 O ATOM 0 H GLU A 27 9.369 -3.326 3.717 1.00 0.00 H new ATOM 0 HA GLU A 27 9.872 -5.792 5.265 1.00 0.00 H new ATOM 0 HB2 GLU A 27 9.418 -6.081 2.857 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.601 -4.849 2.467 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.636 -6.923 2.044 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.358 -6.310 3.519 1.00 0.00 H new ATOM 432 N HIS A 28 12.261 -5.168 5.736 1.00 0.00 N ATOM 433 CA HIS A 28 13.534 -4.708 6.242 1.00 0.00 C ATOM 434 C HIS A 28 14.610 -5.625 5.717 1.00 0.00 C ATOM 435 O HIS A 28 14.584 -6.833 5.976 1.00 0.00 O ATOM 436 CB HIS A 28 13.562 -4.699 7.786 1.00 0.00 C ATOM 437 CG HIS A 28 12.487 -3.868 8.429 1.00 0.00 C ATOM 438 ND1 HIS A 28 11.820 -4.228 9.576 1.00 0.00 N ATOM 439 CD2 HIS A 28 11.978 -2.671 8.067 1.00 0.00 C ATOM 440 CE1 HIS A 28 10.946 -3.274 9.869 1.00 0.00 C ATOM 441 NE2 HIS A 28 11.001 -2.296 8.980 1.00 0.00 N ATOM 0 H HIS A 28 12.036 -6.131 5.986 1.00 0.00 H new ATOM 0 HA HIS A 28 13.700 -3.684 5.907 1.00 0.00 H new ATOM 0 HB2 HIS A 28 13.472 -5.725 8.143 1.00 0.00 H new ATOM 0 HB3 HIS A 28 14.533 -4.331 8.116 1.00 0.00 H new ATOM 0 HD2 HIS A 28 12.282 -2.096 7.205 1.00 0.00 H new ATOM 0 HE1 HIS A 28 10.280 -3.293 10.719 1.00 0.00 H new ATOM 0 HE2 HIS A 28 10.442 -1.443 8.968 1.00 0.00 H new ATOM 449 N LYS A 29 15.521 -5.085 4.963 1.00 0.00 N ATOM 450 CA LYS A 29 16.590 -5.862 4.373 1.00 0.00 C ATOM 451 C LYS A 29 17.910 -5.257 4.735 1.00 0.00 C ATOM 452 O LYS A 29 18.158 -4.111 4.446 1.00 0.00 O ATOM 453 CB LYS A 29 16.460 -5.864 2.858 1.00 0.00 C ATOM 454 CG LYS A 29 15.228 -6.542 2.319 1.00 0.00 C ATOM 455 CD LYS A 29 15.368 -8.046 2.250 1.00 0.00 C ATOM 456 CE LYS A 29 16.380 -8.446 1.183 1.00 0.00 C ATOM 457 NZ LYS A 29 16.486 -9.902 1.022 1.00 0.00 N ATOM 0 H LYS A 29 15.551 -4.091 4.734 1.00 0.00 H new ATOM 0 HA LYS A 29 16.527 -6.883 4.750 1.00 0.00 H new ATOM 0 HB2 LYS A 29 16.469 -4.832 2.508 1.00 0.00 H new ATOM 0 HB3 LYS A 29 17.338 -6.352 2.435 1.00 0.00 H new ATOM 0 HG2 LYS A 29 14.375 -6.290 2.949 1.00 0.00 H new ATOM 0 HG3 LYS A 29 15.013 -6.156 1.323 1.00 0.00 H new ATOM 0 HD2 LYS A 29 15.683 -8.431 3.220 1.00 0.00 H new ATOM 0 HD3 LYS A 29 14.401 -8.496 2.027 1.00 0.00 H new ATOM 0 HE2 LYS A 29 16.094 -7.999 0.231 1.00 0.00 H new ATOM 0 HE3 LYS A 29 17.358 -8.041 1.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 17.187 -10.120 0.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 16.785 -10.330 1.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 15.561 -10.289 0.745 1.00 0.00 H new ATOM 471 N HIS A 30 18.732 -5.996 5.376 1.00 0.00 N ATOM 472 CA HIS A 30 20.055 -5.501 5.688 1.00 0.00 C ATOM 473 C HIS A 30 21.086 -6.225 4.855 1.00 0.00 C ATOM 474 O HIS A 30 21.250 -7.445 4.977 1.00 0.00 O ATOM 475 CB HIS A 30 20.377 -5.505 7.219 1.00 0.00 C ATOM 476 CG HIS A 30 20.298 -6.830 7.951 1.00 0.00 C ATOM 477 ND1 HIS A 30 19.227 -7.216 8.729 1.00 0.00 N ATOM 478 CD2 HIS A 30 21.207 -7.834 8.056 1.00 0.00 C ATOM 479 CE1 HIS A 30 19.507 -8.401 9.268 1.00 0.00 C ATOM 480 NE2 HIS A 30 20.701 -8.826 8.893 1.00 0.00 N ATOM 0 H HIS A 30 18.534 -6.942 5.702 1.00 0.00 H new ATOM 0 HA HIS A 30 20.088 -4.446 5.417 1.00 0.00 H new ATOM 0 HB2 HIS A 30 21.383 -5.108 7.351 1.00 0.00 H new ATOM 0 HB3 HIS A 30 19.694 -4.810 7.708 1.00 0.00 H new ATOM 0 HD2 HIS A 30 22.170 -7.859 7.568 1.00 0.00 H new ATOM 0 HE1 HIS A 30 18.845 -8.944 9.926 1.00 0.00 H new ATOM 0 HE2 HIS A 30 21.157 -9.698 9.161 1.00 0.00 H new ATOM 488 N GLU A 31 21.733 -5.514 3.964 1.00 0.00 N ATOM 489 CA GLU A 31 22.697 -6.155 3.094 1.00 0.00 C ATOM 490 C GLU A 31 24.008 -5.410 3.044 1.00 0.00 C ATOM 491 O GLU A 31 24.050 -4.204 3.235 1.00 0.00 O ATOM 492 CB GLU A 31 22.115 -6.341 1.694 1.00 0.00 C ATOM 493 CG GLU A 31 21.816 -5.071 0.922 1.00 0.00 C ATOM 494 CD GLU A 31 21.091 -5.388 -0.358 1.00 0.00 C ATOM 495 OE1 GLU A 31 21.748 -5.700 -1.385 1.00 0.00 O ATOM 496 OE2 GLU A 31 19.855 -5.399 -0.350 1.00 0.00 O ATOM 0 H GLU A 31 21.616 -4.511 3.821 1.00 0.00 H new ATOM 0 HA GLU A 31 22.911 -7.137 3.515 1.00 0.00 H new ATOM 0 HB2 GLU A 31 22.812 -6.942 1.110 1.00 0.00 H new ATOM 0 HB3 GLU A 31 21.193 -6.916 1.779 1.00 0.00 H new ATOM 0 HG2 GLU A 31 21.211 -4.401 1.533 1.00 0.00 H new ATOM 0 HG3 GLU A 31 22.745 -4.547 0.700 1.00 0.00 H new ATOM 503 N LYS A 32 25.078 -6.144 2.847 1.00 0.00 N ATOM 504 CA LYS A 32 26.373 -5.558 2.689 1.00 0.00 C ATOM 505 C LYS A 32 26.733 -5.464 1.242 1.00 0.00 C ATOM 506 O LYS A 32 26.800 -6.469 0.541 1.00 0.00 O ATOM 507 CB LYS A 32 27.438 -6.328 3.414 1.00 0.00 C ATOM 508 CG LYS A 32 27.386 -6.220 4.922 1.00 0.00 C ATOM 509 CD LYS A 32 28.612 -6.859 5.574 1.00 0.00 C ATOM 510 CE LYS A 32 28.930 -8.227 4.992 1.00 0.00 C ATOM 511 NZ LYS A 32 27.832 -9.212 5.191 1.00 0.00 N ATOM 0 H LYS A 32 25.067 -7.163 2.793 1.00 0.00 H new ATOM 0 HA LYS A 32 26.321 -4.560 3.124 1.00 0.00 H new ATOM 0 HB2 LYS A 32 27.359 -7.379 3.136 1.00 0.00 H new ATOM 0 HB3 LYS A 32 28.413 -5.981 3.073 1.00 0.00 H new ATOM 0 HG2 LYS A 32 27.325 -5.171 5.210 1.00 0.00 H new ATOM 0 HG3 LYS A 32 26.482 -6.705 5.291 1.00 0.00 H new ATOM 0 HD2 LYS A 32 29.473 -6.203 5.444 1.00 0.00 H new ATOM 0 HD3 LYS A 32 28.442 -6.954 6.646 1.00 0.00 H new ATOM 0 HE2 LYS A 32 29.130 -8.125 3.925 1.00 0.00 H new ATOM 0 HE3 LYS A 32 29.841 -8.609 5.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 28.112 -10.130 4.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 27.644 -9.322 6.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 26.972 -8.874 4.715 1.00 0.00 H new ATOM 525 N VAL A 33 26.980 -4.280 0.803 1.00 0.00 N ATOM 526 CA VAL A 33 27.289 -4.048 -0.584 1.00 0.00 C ATOM 527 C VAL A 33 28.759 -3.694 -0.701 1.00 0.00 C ATOM 528 O VAL A 33 29.278 -2.995 0.137 1.00 0.00 O ATOM 529 CB VAL A 33 26.444 -2.900 -1.168 1.00 0.00 C ATOM 530 CG1 VAL A 33 26.537 -2.916 -2.636 1.00 0.00 C ATOM 531 CG2 VAL A 33 25.022 -2.981 -0.706 1.00 0.00 C ATOM 0 H VAL A 33 26.976 -3.441 1.384 1.00 0.00 H new ATOM 0 HA VAL A 33 27.061 -4.954 -1.146 1.00 0.00 H new ATOM 0 HB VAL A 33 26.840 -1.951 -0.805 1.00 0.00 H new ATOM 0 HG11 VAL A 33 25.939 -2.103 -3.047 1.00 0.00 H new ATOM 0 HG12 VAL A 33 27.577 -2.789 -2.936 1.00 0.00 H new ATOM 0 HG13 VAL A 33 26.164 -3.868 -3.014 1.00 0.00 H new ATOM 0 HG21 VAL A 33 24.452 -2.157 -1.136 1.00 0.00 H new ATOM 0 HG22 VAL A 33 24.588 -3.928 -1.027 1.00 0.00 H new ATOM 0 HG23 VAL A 33 24.989 -2.917 0.382 1.00 0.00 H new ATOM 541 N PHE A 34 29.428 -4.162 -1.718 1.00 0.00 N ATOM 542 CA PHE A 34 30.844 -3.913 -1.843 1.00 0.00 C ATOM 543 C PHE A 34 31.114 -2.666 -2.678 1.00 0.00 C ATOM 544 O PHE A 34 32.248 -2.245 -2.831 1.00 0.00 O ATOM 545 CB PHE A 34 31.525 -5.128 -2.419 1.00 0.00 C ATOM 546 CG PHE A 34 31.236 -6.382 -1.638 1.00 0.00 C ATOM 547 CD1 PHE A 34 31.750 -6.555 -0.365 1.00 0.00 C ATOM 548 CD2 PHE A 34 30.431 -7.376 -2.173 1.00 0.00 C ATOM 549 CE1 PHE A 34 31.472 -7.699 0.360 1.00 0.00 C ATOM 550 CE2 PHE A 34 30.148 -8.521 -1.455 1.00 0.00 C ATOM 551 CZ PHE A 34 30.672 -8.685 -0.187 1.00 0.00 C ATOM 0 H PHE A 34 29.021 -4.716 -2.471 1.00 0.00 H new ATOM 0 HA PHE A 34 31.258 -3.724 -0.852 1.00 0.00 H new ATOM 0 HB2 PHE A 34 31.202 -5.265 -3.451 1.00 0.00 H new ATOM 0 HB3 PHE A 34 32.602 -4.959 -2.442 1.00 0.00 H new ATOM 0 HD1 PHE A 34 32.375 -5.788 0.067 1.00 0.00 H new ATOM 0 HD2 PHE A 34 30.020 -7.253 -3.164 1.00 0.00 H new ATOM 0 HE1 PHE A 34 31.879 -7.822 1.353 1.00 0.00 H new ATOM 0 HE2 PHE A 34 29.518 -9.287 -1.884 1.00 0.00 H new ATOM 0 HZ PHE A 34 30.457 -9.582 0.376 1.00 0.00 H new ATOM 561 N SER A 35 30.062 -2.116 -3.231 1.00 0.00 N ATOM 562 CA SER A 35 30.099 -0.860 -3.936 1.00 0.00 C ATOM 563 C SER A 35 28.721 -0.260 -3.883 1.00 0.00 C ATOM 564 O SER A 35 27.776 -0.874 -4.345 1.00 0.00 O ATOM 565 CB SER A 35 30.500 -1.071 -5.395 1.00 0.00 C ATOM 566 OG SER A 35 30.432 0.137 -6.138 1.00 0.00 O ATOM 0 H SER A 35 29.135 -2.540 -3.203 1.00 0.00 H new ATOM 0 HA SER A 35 30.832 -0.201 -3.471 1.00 0.00 H new ATOM 0 HB2 SER A 35 31.514 -1.469 -5.440 1.00 0.00 H new ATOM 0 HB3 SER A 35 29.845 -1.815 -5.849 1.00 0.00 H new ATOM 0 HG SER A 35 30.696 -0.034 -7.066 1.00 0.00 H new ATOM 572 N MET A 36 28.585 0.930 -3.334 1.00 0.00 N ATOM 573 CA MET A 36 27.279 1.579 -3.251 1.00 0.00 C ATOM 574 C MET A 36 26.669 1.786 -4.604 1.00 0.00 C ATOM 575 O MET A 36 25.467 1.703 -4.759 1.00 0.00 O ATOM 576 CB MET A 36 27.332 2.891 -2.495 1.00 0.00 C ATOM 577 CG MET A 36 27.404 2.720 -1.001 1.00 0.00 C ATOM 578 SD MET A 36 26.048 3.556 -0.158 1.00 0.00 S ATOM 579 CE MET A 36 24.651 2.728 -0.910 1.00 0.00 C ATOM 0 H MET A 36 29.354 1.470 -2.939 1.00 0.00 H new ATOM 0 HA MET A 36 26.642 0.896 -2.689 1.00 0.00 H new ATOM 0 HB2 MET A 36 28.200 3.460 -2.830 1.00 0.00 H new ATOM 0 HB3 MET A 36 26.449 3.480 -2.743 1.00 0.00 H new ATOM 0 HG2 MET A 36 27.383 1.658 -0.756 1.00 0.00 H new ATOM 0 HG3 MET A 36 28.354 3.112 -0.637 1.00 0.00 H new ATOM 0 HE1 MET A 36 23.727 3.091 -0.459 1.00 0.00 H new ATOM 0 HE2 MET A 36 24.638 2.935 -1.980 1.00 0.00 H new ATOM 0 HE3 MET A 36 24.735 1.653 -0.749 1.00 0.00 H new ATOM 589 N ASP A 37 27.507 1.958 -5.587 1.00 0.00 N ATOM 590 CA ASP A 37 27.049 2.182 -6.967 1.00 0.00 C ATOM 591 C ASP A 37 26.338 0.929 -7.486 1.00 0.00 C ATOM 592 O ASP A 37 25.358 1.008 -8.238 1.00 0.00 O ATOM 593 CB ASP A 37 28.221 2.564 -7.881 1.00 0.00 C ATOM 594 CG ASP A 37 27.788 2.871 -9.306 1.00 0.00 C ATOM 595 OD1 ASP A 37 27.357 4.012 -9.583 1.00 0.00 O ATOM 596 OD2 ASP A 37 27.876 1.975 -10.188 1.00 0.00 O ATOM 0 H ASP A 37 28.521 1.951 -5.477 1.00 0.00 H new ATOM 0 HA ASP A 37 26.345 3.014 -6.971 1.00 0.00 H new ATOM 0 HB2 ASP A 37 28.729 3.434 -7.466 1.00 0.00 H new ATOM 0 HB3 ASP A 37 28.945 1.749 -7.895 1.00 0.00 H new ATOM 601 N ASP A 38 26.791 -0.217 -6.999 1.00 0.00 N ATOM 602 CA ASP A 38 26.212 -1.516 -7.351 1.00 0.00 C ATOM 603 C ASP A 38 24.851 -1.638 -6.669 1.00 0.00 C ATOM 604 O ASP A 38 23.880 -2.134 -7.254 1.00 0.00 O ATOM 605 CB ASP A 38 27.131 -2.621 -6.843 1.00 0.00 C ATOM 606 CG ASP A 38 26.789 -3.999 -7.340 1.00 0.00 C ATOM 607 OD1 ASP A 38 26.010 -4.712 -6.684 1.00 0.00 O ATOM 608 OD2 ASP A 38 27.345 -4.415 -8.371 1.00 0.00 O ATOM 0 H ASP A 38 27.572 -0.278 -6.346 1.00 0.00 H new ATOM 0 HA ASP A 38 26.099 -1.603 -8.432 1.00 0.00 H new ATOM 0 HB2 ASP A 38 28.155 -2.387 -7.136 1.00 0.00 H new ATOM 0 HB3 ASP A 38 27.104 -2.625 -5.753 1.00 0.00 H new ATOM 613 N PHE A 39 24.794 -1.131 -5.426 1.00 0.00 N ATOM 614 CA PHE A 39 23.594 -1.101 -4.629 1.00 0.00 C ATOM 615 C PHE A 39 22.514 -0.258 -5.324 1.00 0.00 C ATOM 616 O PHE A 39 21.354 -0.658 -5.423 1.00 0.00 O ATOM 617 CB PHE A 39 23.894 -0.477 -3.263 1.00 0.00 C ATOM 618 CG PHE A 39 22.692 -0.296 -2.390 1.00 0.00 C ATOM 619 CD1 PHE A 39 22.230 -1.320 -1.584 1.00 0.00 C ATOM 620 CD2 PHE A 39 22.035 0.905 -2.376 1.00 0.00 C ATOM 621 CE1 PHE A 39 21.132 -1.135 -0.782 1.00 0.00 C ATOM 622 CE2 PHE A 39 20.945 1.097 -1.587 1.00 0.00 C ATOM 623 CZ PHE A 39 20.494 0.090 -0.789 1.00 0.00 C ATOM 0 H PHE A 39 25.604 -0.728 -4.955 1.00 0.00 H new ATOM 0 HA PHE A 39 23.238 -2.124 -4.505 1.00 0.00 H new ATOM 0 HB2 PHE A 39 24.616 -1.105 -2.741 1.00 0.00 H new ATOM 0 HB3 PHE A 39 24.367 0.493 -3.416 1.00 0.00 H new ATOM 0 HD1 PHE A 39 22.737 -2.273 -1.586 1.00 0.00 H new ATOM 0 HD2 PHE A 39 22.388 1.712 -3.001 1.00 0.00 H new ATOM 0 HE1 PHE A 39 20.772 -1.936 -0.154 1.00 0.00 H new ATOM 0 HE2 PHE A 39 20.436 2.049 -1.593 1.00 0.00 H new ATOM 0 HZ PHE A 39 19.632 0.250 -0.158 1.00 0.00 H new ATOM 633 N TRP A 40 22.919 0.922 -5.806 1.00 0.00 N ATOM 634 CA TRP A 40 21.995 1.855 -6.448 1.00 0.00 C ATOM 635 C TRP A 40 21.414 1.266 -7.708 1.00 0.00 C ATOM 636 O TRP A 40 20.226 1.411 -7.977 1.00 0.00 O ATOM 637 CB TRP A 40 22.656 3.219 -6.727 1.00 0.00 C ATOM 638 CG TRP A 40 23.145 3.902 -5.477 1.00 0.00 C ATOM 639 CD1 TRP A 40 24.402 4.369 -5.225 1.00 0.00 C ATOM 640 CD2 TRP A 40 22.382 4.160 -4.298 1.00 0.00 C ATOM 641 NE1 TRP A 40 24.476 4.862 -3.944 1.00 0.00 N ATOM 642 CE2 TRP A 40 23.242 4.763 -3.365 1.00 0.00 C ATOM 643 CE3 TRP A 40 21.054 3.938 -3.942 1.00 0.00 C ATOM 644 CZ2 TRP A 40 22.813 5.136 -2.100 1.00 0.00 C ATOM 645 CZ3 TRP A 40 20.633 4.310 -2.692 1.00 0.00 C ATOM 646 CH2 TRP A 40 21.507 4.898 -1.786 1.00 0.00 C ATOM 0 H TRP A 40 23.883 1.251 -5.762 1.00 0.00 H new ATOM 0 HA TRP A 40 21.177 2.029 -5.749 1.00 0.00 H new ATOM 0 HB2 TRP A 40 23.494 3.078 -7.409 1.00 0.00 H new ATOM 0 HB3 TRP A 40 21.940 3.867 -7.232 1.00 0.00 H new ATOM 0 HD1 TRP A 40 25.220 4.354 -5.930 1.00 0.00 H new ATOM 0 HE1 TRP A 40 25.313 5.239 -3.499 1.00 0.00 H new ATOM 0 HE3 TRP A 40 20.368 3.480 -4.639 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 23.486 5.596 -1.392 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 19.605 4.143 -2.406 1.00 0.00 H new ATOM 0 HH2 TRP A 40 21.143 5.174 -0.807 1.00 0.00 H new ATOM 657 N ALA A 41 22.241 0.552 -8.440 1.00 0.00 N ATOM 658 CA ALA A 41 21.808 -0.114 -9.660 1.00 0.00 C ATOM 659 C ALA A 41 20.846 -1.237 -9.320 1.00 0.00 C ATOM 660 O ALA A 41 19.881 -1.488 -10.045 1.00 0.00 O ATOM 661 CB ALA A 41 23.000 -0.656 -10.431 1.00 0.00 C ATOM 0 H ALA A 41 23.226 0.414 -8.213 1.00 0.00 H new ATOM 0 HA ALA A 41 21.298 0.614 -10.291 1.00 0.00 H new ATOM 0 HB1 ALA A 41 22.652 -1.149 -11.339 1.00 0.00 H new ATOM 0 HB2 ALA A 41 23.666 0.165 -10.697 1.00 0.00 H new ATOM 0 HB3 ALA A 41 23.538 -1.373 -9.812 1.00 0.00 H new ATOM 667 N ALA A 42 21.088 -1.874 -8.184 1.00 0.00 N ATOM 668 CA ALA A 42 20.262 -2.966 -7.720 1.00 0.00 C ATOM 669 C ALA A 42 18.830 -2.503 -7.429 1.00 0.00 C ATOM 670 O ALA A 42 17.866 -3.167 -7.794 1.00 0.00 O ATOM 671 CB ALA A 42 20.880 -3.592 -6.482 1.00 0.00 C ATOM 0 H ALA A 42 21.863 -1.645 -7.562 1.00 0.00 H new ATOM 0 HA ALA A 42 20.211 -3.713 -8.512 1.00 0.00 H new ATOM 0 HB1 ALA A 42 20.252 -4.414 -6.138 1.00 0.00 H new ATOM 0 HB2 ALA A 42 21.873 -3.970 -6.723 1.00 0.00 H new ATOM 0 HB3 ALA A 42 20.958 -2.842 -5.695 1.00 0.00 H new ATOM 677 N TYR A 43 18.696 -1.348 -6.814 1.00 0.00 N ATOM 678 CA TYR A 43 17.392 -0.844 -6.441 1.00 0.00 C ATOM 679 C TYR A 43 16.957 0.309 -7.320 1.00 0.00 C ATOM 680 O TYR A 43 16.004 1.000 -6.994 1.00 0.00 O ATOM 681 CB TYR A 43 17.382 -0.431 -4.974 1.00 0.00 C ATOM 682 CG TYR A 43 17.475 -1.592 -4.010 1.00 0.00 C ATOM 683 CD1 TYR A 43 18.695 -2.162 -3.664 1.00 0.00 C ATOM 684 CD2 TYR A 43 16.329 -2.130 -3.465 1.00 0.00 C ATOM 685 CE1 TYR A 43 18.749 -3.236 -2.792 1.00 0.00 C ATOM 686 CE2 TYR A 43 16.376 -3.196 -2.607 1.00 0.00 C ATOM 687 CZ TYR A 43 17.578 -3.744 -2.268 1.00 0.00 C ATOM 688 OH TYR A 43 17.602 -4.832 -1.427 1.00 0.00 O ATOM 0 H TYR A 43 19.475 -0.740 -6.561 1.00 0.00 H new ATOM 0 HA TYR A 43 16.675 -1.652 -6.587 1.00 0.00 H new ATOM 0 HB2 TYR A 43 18.216 0.247 -4.792 1.00 0.00 H new ATOM 0 HB3 TYR A 43 16.468 0.126 -4.770 1.00 0.00 H new ATOM 0 HD1 TYR A 43 19.609 -1.763 -4.079 1.00 0.00 H new ATOM 0 HD2 TYR A 43 15.372 -1.701 -3.721 1.00 0.00 H new ATOM 0 HE1 TYR A 43 19.700 -3.673 -2.524 1.00 0.00 H new ATOM 0 HE2 TYR A 43 15.462 -3.602 -2.199 1.00 0.00 H new ATOM 0 HH TYR A 43 18.527 -5.130 -1.304 1.00 0.00 H new ATOM 698 N ALA A 44 17.633 0.482 -8.451 1.00 0.00 N ATOM 699 CA ALA A 44 17.324 1.538 -9.431 1.00 0.00 C ATOM 700 C ALA A 44 15.847 1.570 -9.902 1.00 0.00 C ATOM 701 O ALA A 44 15.399 2.566 -10.474 1.00 0.00 O ATOM 702 CB ALA A 44 18.246 1.431 -10.631 1.00 0.00 C ATOM 0 H ALA A 44 18.419 -0.108 -8.723 1.00 0.00 H new ATOM 0 HA ALA A 44 17.490 2.478 -8.904 1.00 0.00 H new ATOM 0 HB1 ALA A 44 18.005 2.218 -11.346 1.00 0.00 H new ATOM 0 HB2 ALA A 44 19.281 1.540 -10.306 1.00 0.00 H new ATOM 0 HB3 ALA A 44 18.115 0.458 -11.105 1.00 0.00 H new ATOM 708 N GLY A 45 15.115 0.494 -9.703 1.00 0.00 N ATOM 709 CA GLY A 45 13.724 0.471 -10.093 1.00 0.00 C ATOM 710 C GLY A 45 12.812 0.916 -8.966 1.00 0.00 C ATOM 711 O GLY A 45 11.654 1.233 -9.183 1.00 0.00 O ATOM 0 H GLY A 45 15.457 -0.368 -9.278 1.00 0.00 H new ATOM 0 HA2 GLY A 45 13.578 1.121 -10.956 1.00 0.00 H new ATOM 0 HA3 GLY A 45 13.451 -0.537 -10.404 1.00 0.00 H new ATOM 715 N TRP A 46 13.309 0.860 -7.759 1.00 0.00 N ATOM 716 CA TRP A 46 12.593 1.319 -6.602 1.00 0.00 C ATOM 717 C TRP A 46 12.700 2.840 -6.548 1.00 0.00 C ATOM 718 O TRP A 46 13.598 3.428 -7.159 1.00 0.00 O ATOM 719 CB TRP A 46 13.226 0.739 -5.327 1.00 0.00 C ATOM 720 CG TRP A 46 13.277 -0.749 -5.237 1.00 0.00 C ATOM 721 CD1 TRP A 46 14.027 -1.592 -5.995 1.00 0.00 C ATOM 722 CD2 TRP A 46 12.584 -1.564 -4.306 1.00 0.00 C ATOM 723 NE1 TRP A 46 13.797 -2.885 -5.633 1.00 0.00 N ATOM 724 CE2 TRP A 46 12.917 -2.899 -4.592 1.00 0.00 C ATOM 725 CE3 TRP A 46 11.694 -1.298 -3.273 1.00 0.00 C ATOM 726 CZ2 TRP A 46 12.392 -3.960 -3.879 1.00 0.00 C ATOM 727 CZ3 TRP A 46 11.174 -2.351 -2.568 1.00 0.00 C ATOM 728 CH2 TRP A 46 11.522 -3.668 -2.878 1.00 0.00 C ATOM 0 H TRP A 46 14.236 0.489 -7.551 1.00 0.00 H new ATOM 0 HA TRP A 46 11.552 1.001 -6.665 1.00 0.00 H new ATOM 0 HB2 TRP A 46 14.243 1.123 -5.244 1.00 0.00 H new ATOM 0 HB3 TRP A 46 12.672 1.116 -4.467 1.00 0.00 H new ATOM 0 HD1 TRP A 46 14.708 -1.281 -6.773 1.00 0.00 H new ATOM 0 HE1 TRP A 46 14.214 -3.707 -6.069 1.00 0.00 H new ATOM 0 HE3 TRP A 46 11.418 -0.282 -3.031 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 12.663 -4.980 -4.109 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 10.484 -2.160 -1.759 1.00 0.00 H new ATOM 0 HH2 TRP A 46 11.088 -4.475 -2.307 1.00 0.00 H new ATOM 739 N THR A 47 11.802 3.462 -5.858 1.00 0.00 N ATOM 740 CA THR A 47 11.826 4.861 -5.675 1.00 0.00 C ATOM 741 C THR A 47 12.649 5.167 -4.431 1.00 0.00 C ATOM 742 O THR A 47 12.323 4.684 -3.335 1.00 0.00 O ATOM 743 CB THR A 47 10.395 5.347 -5.466 1.00 0.00 C ATOM 744 OG1 THR A 47 9.572 4.903 -6.549 1.00 0.00 O ATOM 745 CG2 THR A 47 10.332 6.849 -5.356 1.00 0.00 C ATOM 0 H THR A 47 11.019 2.996 -5.400 1.00 0.00 H new ATOM 0 HA THR A 47 12.262 5.357 -6.542 1.00 0.00 H new ATOM 0 HB THR A 47 10.029 4.927 -4.529 1.00 0.00 H new ATOM 0 HG1 THR A 47 8.653 5.215 -6.411 1.00 0.00 H new ATOM 0 HG21 THR A 47 9.298 7.160 -5.208 1.00 0.00 H new ATOM 0 HG22 THR A 47 10.935 7.177 -4.509 1.00 0.00 H new ATOM 0 HG23 THR A 47 10.718 7.297 -6.271 1.00 0.00 H new ATOM 753 N LEU A 48 13.720 5.906 -4.603 1.00 0.00 N ATOM 754 CA LEU A 48 14.556 6.304 -3.500 1.00 0.00 C ATOM 755 C LEU A 48 13.822 7.406 -2.758 1.00 0.00 C ATOM 756 O LEU A 48 13.614 8.496 -3.299 1.00 0.00 O ATOM 757 CB LEU A 48 15.948 6.763 -4.042 1.00 0.00 C ATOM 758 CG LEU A 48 17.101 7.071 -3.035 1.00 0.00 C ATOM 759 CD1 LEU A 48 16.973 8.430 -2.376 1.00 0.00 C ATOM 760 CD2 LEU A 48 17.183 6.001 -1.972 1.00 0.00 C ATOM 0 H LEU A 48 14.034 6.247 -5.512 1.00 0.00 H new ATOM 0 HA LEU A 48 14.748 5.482 -2.810 1.00 0.00 H new ATOM 0 HB2 LEU A 48 16.305 5.989 -4.721 1.00 0.00 H new ATOM 0 HB3 LEU A 48 15.787 7.661 -4.638 1.00 0.00 H new ATOM 0 HG LEU A 48 18.018 7.082 -3.624 1.00 0.00 H new ATOM 0 HD11 LEU A 48 17.805 8.581 -1.689 1.00 0.00 H new ATOM 0 HD12 LEU A 48 16.988 9.208 -3.140 1.00 0.00 H new ATOM 0 HD13 LEU A 48 16.034 8.480 -1.825 1.00 0.00 H new ATOM 0 HD21 LEU A 48 17.993 6.236 -1.281 1.00 0.00 H new ATOM 0 HD22 LEU A 48 16.241 5.958 -1.425 1.00 0.00 H new ATOM 0 HD23 LEU A 48 17.374 5.036 -2.441 1.00 0.00 H new ATOM 772 N VAL A 49 13.357 7.097 -1.567 1.00 0.00 N ATOM 773 CA VAL A 49 12.606 8.049 -0.775 1.00 0.00 C ATOM 774 C VAL A 49 13.559 8.851 0.089 1.00 0.00 C ATOM 775 O VAL A 49 13.520 10.095 0.102 1.00 0.00 O ATOM 776 CB VAL A 49 11.491 7.358 0.075 1.00 0.00 C ATOM 777 CG1 VAL A 49 10.739 8.364 0.938 1.00 0.00 C ATOM 778 CG2 VAL A 49 10.518 6.647 -0.847 1.00 0.00 C ATOM 0 H VAL A 49 13.487 6.188 -1.123 1.00 0.00 H new ATOM 0 HA VAL A 49 12.088 8.729 -1.451 1.00 0.00 H new ATOM 0 HB VAL A 49 11.969 6.638 0.739 1.00 0.00 H new ATOM 0 HG11 VAL A 49 9.972 7.847 1.515 1.00 0.00 H new ATOM 0 HG12 VAL A 49 11.436 8.853 1.618 1.00 0.00 H new ATOM 0 HG13 VAL A 49 10.270 9.113 0.299 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.741 6.165 -0.254 1.00 0.00 H new ATOM 0 HG22 VAL A 49 10.063 7.371 -1.523 1.00 0.00 H new ATOM 0 HG23 VAL A 49 11.051 5.894 -1.427 1.00 0.00 H new ATOM 788 N GLU A 50 14.442 8.159 0.773 1.00 0.00 N ATOM 789 CA GLU A 50 15.456 8.810 1.564 1.00 0.00 C ATOM 790 C GLU A 50 16.608 7.868 1.743 1.00 0.00 C ATOM 791 O GLU A 50 16.453 6.655 1.591 1.00 0.00 O ATOM 792 CB GLU A 50 14.932 9.210 2.947 1.00 0.00 C ATOM 793 CG GLU A 50 14.512 8.038 3.775 1.00 0.00 C ATOM 794 CD GLU A 50 14.186 8.389 5.186 1.00 0.00 C ATOM 795 OE1 GLU A 50 13.018 8.727 5.478 1.00 0.00 O ATOM 796 OE2 GLU A 50 15.082 8.304 6.033 1.00 0.00 O ATOM 0 H GLU A 50 14.476 7.140 0.796 1.00 0.00 H new ATOM 0 HA GLU A 50 15.762 9.716 1.041 1.00 0.00 H new ATOM 0 HB2 GLU A 50 15.707 9.763 3.477 1.00 0.00 H new ATOM 0 HB3 GLU A 50 14.085 9.885 2.827 1.00 0.00 H new ATOM 0 HG2 GLU A 50 13.640 7.573 3.315 1.00 0.00 H new ATOM 0 HG3 GLU A 50 15.310 7.296 3.769 1.00 0.00 H new ATOM 803 N GLN A 51 17.741 8.407 2.002 1.00 0.00 N ATOM 804 CA GLN A 51 18.877 7.644 2.355 1.00 0.00 C ATOM 805 C GLN A 51 19.680 8.355 3.407 1.00 0.00 C ATOM 806 O GLN A 51 19.740 9.587 3.438 1.00 0.00 O ATOM 807 CB GLN A 51 19.740 7.337 1.151 1.00 0.00 C ATOM 808 CG GLN A 51 20.199 8.542 0.367 1.00 0.00 C ATOM 809 CD GLN A 51 21.173 8.150 -0.699 1.00 0.00 C ATOM 810 OE1 GLN A 51 22.380 8.160 -0.495 1.00 0.00 O ATOM 811 NE2 GLN A 51 20.665 7.730 -1.805 1.00 0.00 N ATOM 0 H GLN A 51 17.907 9.413 1.974 1.00 0.00 H new ATOM 0 HA GLN A 51 18.524 6.695 2.759 1.00 0.00 H new ATOM 0 HB2 GLN A 51 20.618 6.784 1.485 1.00 0.00 H new ATOM 0 HB3 GLN A 51 19.184 6.679 0.483 1.00 0.00 H new ATOM 0 HG2 GLN A 51 19.339 9.035 -0.085 1.00 0.00 H new ATOM 0 HG3 GLN A 51 20.662 9.263 1.040 1.00 0.00 H new ATOM 0 HE21 GLN A 51 19.654 7.737 -1.937 1.00 0.00 H new ATOM 0 HE22 GLN A 51 21.274 7.390 -2.549 1.00 0.00 H new ATOM 820 N LYS A 52 20.219 7.586 4.288 1.00 0.00 N ATOM 821 CA LYS A 52 21.121 8.036 5.286 1.00 0.00 C ATOM 822 C LYS A 52 22.220 7.003 5.425 1.00 0.00 C ATOM 823 O LYS A 52 22.100 5.901 4.868 1.00 0.00 O ATOM 824 CB LYS A 52 20.417 8.411 6.622 1.00 0.00 C ATOM 825 CG LYS A 52 19.235 7.539 7.069 1.00 0.00 C ATOM 826 CD LYS A 52 18.754 8.014 8.443 1.00 0.00 C ATOM 827 CE LYS A 52 17.416 7.440 8.907 1.00 0.00 C ATOM 828 NZ LYS A 52 16.243 8.155 8.340 1.00 0.00 N ATOM 0 H LYS A 52 20.034 6.584 4.333 1.00 0.00 H new ATOM 0 HA LYS A 52 21.572 8.979 4.979 1.00 0.00 H new ATOM 0 HB2 LYS A 52 21.166 8.394 7.414 1.00 0.00 H new ATOM 0 HB3 LYS A 52 20.064 9.439 6.539 1.00 0.00 H new ATOM 0 HG2 LYS A 52 18.424 7.604 6.343 1.00 0.00 H new ATOM 0 HG3 LYS A 52 19.537 6.493 7.117 1.00 0.00 H new ATOM 0 HD2 LYS A 52 19.514 7.760 9.182 1.00 0.00 H new ATOM 0 HD3 LYS A 52 18.677 9.101 8.425 1.00 0.00 H new ATOM 0 HE2 LYS A 52 17.362 6.388 8.626 1.00 0.00 H new ATOM 0 HE3 LYS A 52 17.368 7.482 9.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 15.369 7.763 8.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 16.308 9.167 8.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 16.230 8.036 7.307 1.00 0.00 H new ATOM 842 N LYS A 53 23.280 7.319 6.113 1.00 0.00 N ATOM 843 CA LYS A 53 24.417 6.425 6.149 1.00 0.00 C ATOM 844 C LYS A 53 24.117 5.233 7.053 1.00 0.00 C ATOM 845 O LYS A 53 24.149 5.335 8.274 1.00 0.00 O ATOM 846 CB LYS A 53 25.690 7.178 6.587 1.00 0.00 C ATOM 847 CG LYS A 53 27.009 6.589 6.056 1.00 0.00 C ATOM 848 CD LYS A 53 27.321 5.205 6.605 1.00 0.00 C ATOM 849 CE LYS A 53 28.556 4.613 5.942 1.00 0.00 C ATOM 850 NZ LYS A 53 29.771 5.438 6.155 1.00 0.00 N ATOM 0 H LYS A 53 23.387 8.178 6.653 1.00 0.00 H new ATOM 0 HA LYS A 53 24.602 6.042 5.145 1.00 0.00 H new ATOM 0 HB2 LYS A 53 25.613 8.214 6.257 1.00 0.00 H new ATOM 0 HB3 LYS A 53 25.729 7.193 7.676 1.00 0.00 H new ATOM 0 HG2 LYS A 53 26.963 6.538 4.968 1.00 0.00 H new ATOM 0 HG3 LYS A 53 27.827 7.264 6.309 1.00 0.00 H new ATOM 0 HD2 LYS A 53 27.477 5.265 7.682 1.00 0.00 H new ATOM 0 HD3 LYS A 53 26.468 4.546 6.443 1.00 0.00 H new ATOM 0 HE2 LYS A 53 28.729 3.611 6.334 1.00 0.00 H new ATOM 0 HE3 LYS A 53 28.375 4.510 4.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 30.605 4.926 5.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 29.674 6.337 5.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 29.887 5.629 7.171 1.00 0.00 H new ATOM 864 N GLY A 54 23.751 4.138 6.434 1.00 0.00 N ATOM 865 CA GLY A 54 23.482 2.922 7.154 1.00 0.00 C ATOM 866 C GLY A 54 22.078 2.429 6.915 1.00 0.00 C ATOM 867 O GLY A 54 21.779 1.254 7.127 1.00 0.00 O ATOM 0 H GLY A 54 23.632 4.066 5.423 1.00 0.00 H new ATOM 0 HA2 GLY A 54 24.194 2.154 6.850 1.00 0.00 H new ATOM 0 HA3 GLY A 54 23.632 3.090 8.220 1.00 0.00 H new ATOM 871 N TYR A 55 21.207 3.313 6.474 1.00 0.00 N ATOM 872 CA TYR A 55 19.845 2.985 6.231 1.00 0.00 C ATOM 873 C TYR A 55 19.340 3.728 5.009 1.00 0.00 C ATOM 874 O TYR A 55 19.517 4.936 4.892 1.00 0.00 O ATOM 875 CB TYR A 55 19.041 3.343 7.480 1.00 0.00 C ATOM 876 CG TYR A 55 17.560 3.512 7.290 1.00 0.00 C ATOM 877 CD1 TYR A 55 17.082 4.740 6.933 1.00 0.00 C ATOM 878 CD2 TYR A 55 16.662 2.480 7.483 1.00 0.00 C ATOM 879 CE1 TYR A 55 15.755 4.978 6.763 1.00 0.00 C ATOM 880 CE2 TYR A 55 15.305 2.693 7.323 1.00 0.00 C ATOM 881 CZ TYR A 55 14.854 3.949 6.959 1.00 0.00 C ATOM 882 OH TYR A 55 13.500 4.174 6.811 1.00 0.00 O ATOM 0 H TYR A 55 21.442 4.286 6.277 1.00 0.00 H new ATOM 0 HA TYR A 55 19.735 1.920 6.027 1.00 0.00 H new ATOM 0 HB2 TYR A 55 19.204 2.566 8.227 1.00 0.00 H new ATOM 0 HB3 TYR A 55 19.442 4.270 7.891 1.00 0.00 H new ATOM 0 HD1 TYR A 55 17.781 5.549 6.781 1.00 0.00 H new ATOM 0 HD2 TYR A 55 17.022 1.500 7.761 1.00 0.00 H new ATOM 0 HE1 TYR A 55 15.409 5.960 6.478 1.00 0.00 H new ATOM 0 HE2 TYR A 55 14.604 1.887 7.481 1.00 0.00 H new ATOM 0 HH TYR A 55 13.010 3.343 6.984 1.00 0.00 H new ATOM 892 N VAL A 56 18.718 3.024 4.122 1.00 0.00 N ATOM 893 CA VAL A 56 18.150 3.619 2.945 1.00 0.00 C ATOM 894 C VAL A 56 16.683 3.195 2.843 1.00 0.00 C ATOM 895 O VAL A 56 16.335 2.072 3.177 1.00 0.00 O ATOM 896 CB VAL A 56 18.931 3.207 1.660 1.00 0.00 C ATOM 897 CG1 VAL A 56 18.268 3.763 0.435 1.00 0.00 C ATOM 898 CG2 VAL A 56 20.374 3.690 1.702 1.00 0.00 C ATOM 0 H VAL A 56 18.586 2.015 4.188 1.00 0.00 H new ATOM 0 HA VAL A 56 18.220 4.704 3.026 1.00 0.00 H new ATOM 0 HB VAL A 56 18.925 2.118 1.620 1.00 0.00 H new ATOM 0 HG11 VAL A 56 18.829 3.464 -0.450 1.00 0.00 H new ATOM 0 HG12 VAL A 56 17.250 3.379 0.366 1.00 0.00 H new ATOM 0 HG13 VAL A 56 18.242 4.851 0.497 1.00 0.00 H new ATOM 0 HG21 VAL A 56 20.887 3.384 0.790 1.00 0.00 H new ATOM 0 HG22 VAL A 56 20.392 4.777 1.781 1.00 0.00 H new ATOM 0 HG23 VAL A 56 20.878 3.255 2.565 1.00 0.00 H new ATOM 908 N LEU A 57 15.841 4.090 2.434 1.00 0.00 N ATOM 909 CA LEU A 57 14.441 3.821 2.298 1.00 0.00 C ATOM 910 C LEU A 57 14.010 3.874 0.830 1.00 0.00 C ATOM 911 O LEU A 57 14.101 4.933 0.161 1.00 0.00 O ATOM 912 CB LEU A 57 13.655 4.785 3.201 1.00 0.00 C ATOM 913 CG LEU A 57 12.164 5.002 2.932 1.00 0.00 C ATOM 914 CD1 LEU A 57 11.389 3.740 2.833 1.00 0.00 C ATOM 915 CD2 LEU A 57 11.545 5.930 3.954 1.00 0.00 C ATOM 0 H LEU A 57 16.108 5.041 2.181 1.00 0.00 H new ATOM 0 HA LEU A 57 14.220 2.806 2.628 1.00 0.00 H new ATOM 0 HB2 LEU A 57 13.757 4.432 4.227 1.00 0.00 H new ATOM 0 HB3 LEU A 57 14.144 5.758 3.149 1.00 0.00 H new ATOM 0 HG LEU A 57 12.110 5.475 1.952 1.00 0.00 H new ATOM 0 HD11 LEU A 57 10.341 3.971 2.642 1.00 0.00 H new ATOM 0 HD12 LEU A 57 11.782 3.135 2.016 1.00 0.00 H new ATOM 0 HD13 LEU A 57 11.474 3.187 3.768 1.00 0.00 H new ATOM 0 HD21 LEU A 57 10.486 6.061 3.732 1.00 0.00 H new ATOM 0 HD22 LEU A 57 11.657 5.501 4.950 1.00 0.00 H new ATOM 0 HD23 LEU A 57 12.046 6.897 3.918 1.00 0.00 H new ATOM 927 N PHE A 58 13.566 2.724 0.344 1.00 0.00 N ATOM 928 CA PHE A 58 13.080 2.546 -1.021 1.00 0.00 C ATOM 929 C PHE A 58 11.650 2.053 -1.031 1.00 0.00 C ATOM 930 O PHE A 58 11.219 1.339 -0.134 1.00 0.00 O ATOM 931 CB PHE A 58 13.916 1.512 -1.786 1.00 0.00 C ATOM 932 CG PHE A 58 15.177 2.001 -2.416 1.00 0.00 C ATOM 933 CD1 PHE A 58 15.133 2.648 -3.633 1.00 0.00 C ATOM 934 CD2 PHE A 58 16.397 1.781 -1.831 1.00 0.00 C ATOM 935 CE1 PHE A 58 16.278 3.072 -4.254 1.00 0.00 C ATOM 936 CE2 PHE A 58 17.552 2.207 -2.445 1.00 0.00 C ATOM 937 CZ PHE A 58 17.492 2.849 -3.660 1.00 0.00 C ATOM 0 H PHE A 58 13.532 1.868 0.898 1.00 0.00 H new ATOM 0 HA PHE A 58 13.155 3.523 -1.499 1.00 0.00 H new ATOM 0 HB2 PHE A 58 14.170 0.705 -1.099 1.00 0.00 H new ATOM 0 HB3 PHE A 58 13.291 1.080 -2.568 1.00 0.00 H new ATOM 0 HD1 PHE A 58 14.178 2.824 -4.105 1.00 0.00 H new ATOM 0 HD2 PHE A 58 16.452 1.270 -0.881 1.00 0.00 H new ATOM 0 HE1 PHE A 58 16.224 3.579 -5.206 1.00 0.00 H new ATOM 0 HE2 PHE A 58 18.508 2.037 -1.972 1.00 0.00 H new ATOM 0 HZ PHE A 58 18.400 3.177 -4.145 1.00 0.00 H new ATOM 947 N ARG A 59 10.929 2.419 -2.044 1.00 0.00 N ATOM 948 CA ARG A 59 9.604 1.904 -2.234 1.00 0.00 C ATOM 949 C ARG A 59 9.452 1.389 -3.636 1.00 0.00 C ATOM 950 O ARG A 59 10.048 1.914 -4.567 1.00 0.00 O ATOM 951 CB ARG A 59 8.518 2.932 -1.921 1.00 0.00 C ATOM 952 CG ARG A 59 8.569 4.186 -2.743 1.00 0.00 C ATOM 953 CD ARG A 59 7.420 5.098 -2.405 1.00 0.00 C ATOM 954 NE ARG A 59 7.309 5.330 -0.955 1.00 0.00 N ATOM 955 CZ ARG A 59 6.477 6.192 -0.359 1.00 0.00 C ATOM 956 NH1 ARG A 59 5.758 7.056 -1.077 1.00 0.00 N ATOM 957 NH2 ARG A 59 6.387 6.192 0.959 1.00 0.00 N ATOM 0 H ARG A 59 11.237 3.078 -2.759 1.00 0.00 H new ATOM 0 HA ARG A 59 9.471 1.086 -1.526 1.00 0.00 H new ATOM 0 HB2 ARG A 59 7.544 2.463 -2.063 1.00 0.00 H new ATOM 0 HB3 ARG A 59 8.590 3.204 -0.868 1.00 0.00 H new ATOM 0 HG2 ARG A 59 9.512 4.703 -2.567 1.00 0.00 H new ATOM 0 HG3 ARG A 59 8.537 3.932 -3.803 1.00 0.00 H new ATOM 0 HD2 ARG A 59 7.552 6.052 -2.916 1.00 0.00 H new ATOM 0 HD3 ARG A 59 6.491 4.664 -2.775 1.00 0.00 H new ATOM 0 HE ARG A 59 7.922 4.784 -0.350 1.00 0.00 H new ATOM 0 HH11 ARG A 59 5.838 7.065 -2.094 1.00 0.00 H new ATOM 0 HH12 ARG A 59 5.128 7.707 -0.609 1.00 0.00 H new ATOM 0 HH21 ARG A 59 6.947 5.541 1.508 1.00 0.00 H new ATOM 0 HH22 ARG A 59 5.757 6.843 1.427 1.00 0.00 H new ATOM 971 N LYS A 60 8.718 0.351 -3.769 1.00 0.00 N ATOM 972 CA LYS A 60 8.416 -0.253 -5.039 1.00 0.00 C ATOM 973 C LYS A 60 6.927 -0.479 -5.082 1.00 0.00 C ATOM 974 O LYS A 60 6.375 -1.158 -4.223 1.00 0.00 O ATOM 975 CB LYS A 60 9.150 -1.588 -5.152 1.00 0.00 C ATOM 976 CG LYS A 60 8.833 -2.428 -6.369 1.00 0.00 C ATOM 977 CD LYS A 60 9.534 -1.942 -7.625 1.00 0.00 C ATOM 978 CE LYS A 60 11.044 -2.144 -7.563 1.00 0.00 C ATOM 979 NZ LYS A 60 11.640 -2.006 -8.904 1.00 0.00 N ATOM 0 H LYS A 60 8.289 -0.130 -2.978 1.00 0.00 H new ATOM 0 HA LYS A 60 8.731 0.386 -5.864 1.00 0.00 H new ATOM 0 HB2 LYS A 60 10.222 -1.391 -5.143 1.00 0.00 H new ATOM 0 HB3 LYS A 60 8.927 -2.177 -4.263 1.00 0.00 H new ATOM 0 HG2 LYS A 60 9.121 -3.461 -6.175 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.756 -2.424 -6.536 1.00 0.00 H new ATOM 0 HD2 LYS A 60 9.134 -2.473 -8.489 1.00 0.00 H new ATOM 0 HD3 LYS A 60 9.317 -0.884 -7.772 1.00 0.00 H new ATOM 0 HE2 LYS A 60 11.487 -1.414 -6.885 1.00 0.00 H new ATOM 0 HE3 LYS A 60 11.268 -3.131 -7.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 12.663 -1.841 -8.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 11.476 -2.877 -9.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 11.202 -1.202 -9.397 1.00 0.00 H new ATOM 993 N GLN A 61 6.268 0.108 -6.015 1.00 0.00 N ATOM 994 CA GLN A 61 4.856 -0.063 -6.098 1.00 0.00 C ATOM 995 C GLN A 61 4.455 -0.718 -7.389 1.00 0.00 C ATOM 996 O GLN A 61 4.949 -0.367 -8.472 1.00 0.00 O ATOM 997 CB GLN A 61 4.132 1.223 -5.784 1.00 0.00 C ATOM 998 CG GLN A 61 4.445 2.385 -6.651 1.00 0.00 C ATOM 999 CD GLN A 61 4.004 3.667 -6.008 1.00 0.00 C ATOM 1000 OE1 GLN A 61 2.873 4.124 -6.185 1.00 0.00 O ATOM 1001 NE2 GLN A 61 4.895 4.269 -5.275 1.00 0.00 N ATOM 0 H GLN A 61 6.678 0.709 -6.730 1.00 0.00 H new ATOM 0 HA GLN A 61 4.538 -0.762 -5.325 1.00 0.00 H new ATOM 0 HB2 GLN A 61 3.060 1.034 -5.840 1.00 0.00 H new ATOM 0 HB3 GLN A 61 4.354 1.497 -4.753 1.00 0.00 H new ATOM 0 HG2 GLN A 61 5.517 2.421 -6.845 1.00 0.00 H new ATOM 0 HG3 GLN A 61 3.950 2.268 -7.615 1.00 0.00 H new ATOM 0 HE21 GLN A 61 5.820 3.856 -5.155 1.00 0.00 H new ATOM 0 HE22 GLN A 61 4.669 5.154 -4.821 1.00 0.00 H new ATOM 1010 N MET A 62 3.581 -1.677 -7.266 1.00 0.00 N ATOM 1011 CA MET A 62 3.242 -2.573 -8.348 1.00 0.00 C ATOM 1012 C MET A 62 1.744 -2.648 -8.514 1.00 0.00 C ATOM 1013 O MET A 62 0.990 -2.410 -7.557 1.00 0.00 O ATOM 1014 CB MET A 62 3.807 -3.960 -8.017 1.00 0.00 C ATOM 1015 CG MET A 62 5.330 -3.991 -7.911 1.00 0.00 C ATOM 1016 SD MET A 62 5.974 -5.502 -7.164 1.00 0.00 S ATOM 1017 CE MET A 62 5.380 -5.331 -5.471 1.00 0.00 C ATOM 0 H MET A 62 3.074 -1.865 -6.401 1.00 0.00 H new ATOM 0 HA MET A 62 3.668 -2.208 -9.282 1.00 0.00 H new ATOM 0 HB2 MET A 62 3.379 -4.302 -7.075 1.00 0.00 H new ATOM 0 HB3 MET A 62 3.490 -4.665 -8.786 1.00 0.00 H new ATOM 0 HG2 MET A 62 5.757 -3.878 -8.907 1.00 0.00 H new ATOM 0 HG3 MET A 62 5.662 -3.135 -7.323 1.00 0.00 H new ATOM 0 HE1 MET A 62 5.870 -6.070 -4.837 1.00 0.00 H new ATOM 0 HE2 MET A 62 5.608 -4.330 -5.105 1.00 0.00 H new ATOM 0 HE3 MET A 62 4.302 -5.489 -5.446 1.00 0.00 H new ATOM 1027 N ASP A 63 1.314 -2.958 -9.705 1.00 0.00 N ATOM 1028 CA ASP A 63 -0.101 -3.054 -10.013 1.00 0.00 C ATOM 1029 C ASP A 63 -0.637 -4.443 -9.773 1.00 0.00 C ATOM 1030 O ASP A 63 -0.561 -5.314 -10.644 1.00 0.00 O ATOM 1031 CB ASP A 63 -0.410 -2.607 -11.447 1.00 0.00 C ATOM 1032 CG ASP A 63 -1.870 -2.803 -11.839 1.00 0.00 C ATOM 1033 OD1 ASP A 63 -2.709 -1.966 -11.479 1.00 0.00 O ATOM 1034 OD2 ASP A 63 -2.184 -3.792 -12.569 1.00 0.00 O ATOM 0 H ASP A 63 1.928 -3.153 -10.496 1.00 0.00 H new ATOM 0 HA ASP A 63 -0.607 -2.372 -9.330 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -0.150 -1.554 -11.556 1.00 0.00 H new ATOM 0 HB3 ASP A 63 0.222 -3.164 -12.138 1.00 0.00 H new ATOM 1039 N ASP A 64 -1.086 -4.653 -8.567 1.00 0.00 N ATOM 1040 CA ASP A 64 -1.791 -5.848 -8.133 1.00 0.00 C ATOM 1041 C ASP A 64 -2.118 -5.638 -6.671 1.00 0.00 C ATOM 1042 O ASP A 64 -1.645 -4.655 -6.065 1.00 0.00 O ATOM 1043 CB ASP A 64 -0.981 -7.157 -8.347 1.00 0.00 C ATOM 1044 CG ASP A 64 -1.823 -8.415 -8.145 1.00 0.00 C ATOM 1045 OD1 ASP A 64 -2.791 -8.630 -8.901 1.00 0.00 O ATOM 1046 OD2 ASP A 64 -1.554 -9.185 -7.218 1.00 0.00 O ATOM 0 H ASP A 64 -0.970 -3.970 -7.818 1.00 0.00 H new ATOM 0 HA ASP A 64 -2.689 -5.983 -8.736 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -0.566 -7.161 -9.355 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -0.139 -7.174 -7.656 1.00 0.00 H new ATOM 1051 N ILE A 65 -2.924 -6.476 -6.112 1.00 0.00 N ATOM 1052 CA ILE A 65 -3.314 -6.340 -4.733 1.00 0.00 C ATOM 1053 C ILE A 65 -2.383 -7.171 -3.859 1.00 0.00 C ATOM 1054 O ILE A 65 -1.575 -7.942 -4.377 1.00 0.00 O ATOM 1055 CB ILE A 65 -4.791 -6.742 -4.524 1.00 0.00 C ATOM 1056 CG1 ILE A 65 -5.023 -8.194 -4.985 1.00 0.00 C ATOM 1057 CG2 ILE A 65 -5.716 -5.758 -5.247 1.00 0.00 C ATOM 1058 CD1 ILE A 65 -6.473 -8.649 -4.984 1.00 0.00 C ATOM 0 H ILE A 65 -3.336 -7.277 -6.590 1.00 0.00 H new ATOM 0 HA ILE A 65 -3.228 -5.293 -4.443 1.00 0.00 H new ATOM 0 HB ILE A 65 -5.027 -6.695 -3.461 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -4.624 -8.306 -5.993 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -4.450 -8.859 -4.340 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -6.754 -6.053 -5.092 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -5.561 -4.754 -4.851 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -5.493 -5.765 -6.314 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -6.530 -9.683 -5.324 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -6.877 -8.576 -3.974 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -7.054 -8.015 -5.653 1.00 0.00 H new ATOM 1070 N SER A 66 -2.486 -7.028 -2.573 1.00 0.00 N ATOM 1071 CA SER A 66 -1.584 -7.695 -1.675 1.00 0.00 C ATOM 1072 C SER A 66 -2.011 -9.155 -1.520 1.00 0.00 C ATOM 1073 O SER A 66 -3.154 -9.508 -1.861 1.00 0.00 O ATOM 1074 CB SER A 66 -1.560 -6.954 -0.311 1.00 0.00 C ATOM 1075 OG SER A 66 -2.843 -6.929 0.289 1.00 0.00 O ATOM 0 H SER A 66 -3.191 -6.451 -2.115 1.00 0.00 H new ATOM 0 HA SER A 66 -0.571 -7.680 -2.078 1.00 0.00 H new ATOM 0 HB2 SER A 66 -0.854 -7.445 0.358 1.00 0.00 H new ATOM 0 HB3 SER A 66 -1.205 -5.934 -0.456 1.00 0.00 H new ATOM 0 HG SER A 66 -3.523 -7.141 -0.384 1.00 0.00 H new ATOM 1081 N PRO A 67 -1.113 -10.052 -1.048 1.00 0.00 N ATOM 1082 CA PRO A 67 -1.493 -11.426 -0.771 1.00 0.00 C ATOM 1083 C PRO A 67 -2.624 -11.464 0.255 1.00 0.00 C ATOM 1084 O PRO A 67 -3.436 -12.370 0.264 1.00 0.00 O ATOM 1085 CB PRO A 67 -0.240 -12.085 -0.184 1.00 0.00 C ATOM 1086 CG PRO A 67 0.889 -11.125 -0.373 1.00 0.00 C ATOM 1087 CD PRO A 67 0.325 -9.801 -0.817 1.00 0.00 C ATOM 0 HA PRO A 67 -1.845 -11.936 -1.668 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -0.382 -12.310 0.873 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -0.031 -13.030 -0.685 1.00 0.00 H new ATOM 0 HG2 PRO A 67 1.445 -11.007 0.557 1.00 0.00 H new ATOM 0 HG3 PRO A 67 1.589 -11.506 -1.116 1.00 0.00 H new ATOM 0 HD2 PRO A 67 0.474 -9.034 -0.057 1.00 0.00 H new ATOM 0 HD3 PRO A 67 0.814 -9.449 -1.725 1.00 0.00 H new ATOM 1095 N LEU A 68 -2.703 -10.419 1.066 1.00 0.00 N ATOM 1096 CA LEU A 68 -3.688 -10.324 2.107 1.00 0.00 C ATOM 1097 C LEU A 68 -5.088 -10.072 1.507 1.00 0.00 C ATOM 1098 O LEU A 68 -6.084 -10.571 2.021 1.00 0.00 O ATOM 1099 CB LEU A 68 -3.287 -9.232 3.112 1.00 0.00 C ATOM 1100 CG LEU A 68 -3.491 -9.558 4.610 1.00 0.00 C ATOM 1101 CD1 LEU A 68 -4.958 -9.764 4.947 1.00 0.00 C ATOM 1102 CD2 LEU A 68 -2.683 -10.798 4.994 1.00 0.00 C ATOM 0 H LEU A 68 -2.078 -9.615 1.011 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.735 -11.270 2.646 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -2.235 -8.995 2.956 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -3.854 -8.331 2.880 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.136 -8.703 5.186 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -5.059 -9.991 6.008 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -5.515 -8.856 4.715 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -5.353 -10.593 4.360 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.834 -11.018 6.051 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -3.013 -11.647 4.396 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.625 -10.614 4.810 1.00 0.00 H new ATOM 1114 N SER A 69 -5.161 -9.357 0.397 1.00 0.00 N ATOM 1115 CA SER A 69 -6.439 -9.121 -0.277 1.00 0.00 C ATOM 1116 C SER A 69 -6.968 -10.448 -0.840 1.00 0.00 C ATOM 1117 O SER A 69 -8.157 -10.651 -1.016 1.00 0.00 O ATOM 1118 CB SER A 69 -6.222 -8.172 -1.432 1.00 0.00 C ATOM 1119 OG SER A 69 -5.312 -7.169 -1.089 1.00 0.00 O ATOM 0 H SER A 69 -4.356 -8.928 -0.060 1.00 0.00 H new ATOM 0 HA SER A 69 -7.151 -8.700 0.433 1.00 0.00 H new ATOM 0 HB2 SER A 69 -5.853 -8.724 -2.297 1.00 0.00 H new ATOM 0 HB3 SER A 69 -7.172 -7.723 -1.722 1.00 0.00 H new ATOM 0 HG SER A 69 -5.659 -6.658 -0.328 1.00 0.00 H new ATOM 1125 N LYS A 70 -6.054 -11.335 -1.114 1.00 0.00 N ATOM 1126 CA LYS A 70 -6.367 -12.620 -1.673 1.00 0.00 C ATOM 1127 C LYS A 70 -6.787 -13.608 -0.574 1.00 0.00 C ATOM 1128 O LYS A 70 -7.439 -14.621 -0.846 1.00 0.00 O ATOM 1129 CB LYS A 70 -5.145 -13.098 -2.446 1.00 0.00 C ATOM 1130 CG LYS A 70 -4.656 -12.016 -3.395 1.00 0.00 C ATOM 1131 CD LYS A 70 -3.411 -12.385 -4.152 1.00 0.00 C ATOM 1132 CE LYS A 70 -2.926 -11.168 -4.924 1.00 0.00 C ATOM 1133 NZ LYS A 70 -1.817 -11.460 -5.854 1.00 0.00 N ATOM 0 H LYS A 70 -5.058 -11.184 -0.954 1.00 0.00 H new ATOM 0 HA LYS A 70 -7.217 -12.549 -2.352 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -4.350 -13.366 -1.750 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -5.393 -13.998 -3.009 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -5.448 -11.787 -4.108 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.467 -11.106 -2.826 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -2.638 -12.727 -3.463 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -3.616 -13.209 -4.836 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -3.760 -10.749 -5.487 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -2.604 -10.404 -4.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -1.503 -10.578 -6.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -1.024 -11.880 -5.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -2.141 -12.128 -6.582 1.00 0.00 H new ATOM 1147 N VAL A 71 -6.425 -13.309 0.669 1.00 0.00 N ATOM 1148 CA VAL A 71 -6.808 -14.176 1.795 1.00 0.00 C ATOM 1149 C VAL A 71 -8.080 -13.640 2.441 1.00 0.00 C ATOM 1150 O VAL A 71 -8.903 -14.391 2.959 1.00 0.00 O ATOM 1151 CB VAL A 71 -5.676 -14.314 2.885 1.00 0.00 C ATOM 1152 CG1 VAL A 71 -4.356 -14.575 2.248 1.00 0.00 C ATOM 1153 CG2 VAL A 71 -5.575 -13.118 3.810 1.00 0.00 C ATOM 0 H VAL A 71 -5.876 -12.489 0.928 1.00 0.00 H new ATOM 0 HA VAL A 71 -6.975 -15.173 1.386 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.962 -15.166 3.502 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.591 -14.666 3.019 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -4.405 -15.501 1.675 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.103 -13.749 1.583 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -4.776 -13.283 4.533 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.357 -12.224 3.226 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -6.520 -12.985 4.337 1.00 0.00 H new ATOM 1163 N ASN A 72 -8.227 -12.340 2.394 1.00 0.00 N ATOM 1164 CA ASN A 72 -9.358 -11.676 3.009 1.00 0.00 C ATOM 1165 C ASN A 72 -10.144 -10.898 1.945 1.00 0.00 C ATOM 1166 O ASN A 72 -11.197 -11.352 1.498 1.00 0.00 O ATOM 1167 CB ASN A 72 -8.862 -10.745 4.124 1.00 0.00 C ATOM 1168 CG ASN A 72 -9.952 -10.250 5.055 1.00 0.00 C ATOM 1169 OD1 ASN A 72 -9.911 -9.128 5.506 1.00 0.00 O ATOM 1170 ND2 ASN A 72 -10.878 -11.100 5.413 1.00 0.00 N ATOM 0 H ASN A 72 -7.571 -11.711 1.931 1.00 0.00 H new ATOM 0 HA ASN A 72 -10.026 -12.415 3.451 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -8.109 -11.270 4.712 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -8.369 -9.885 3.671 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -11.590 -10.824 6.089 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -10.888 -12.040 5.017 1.00 0.00 H new ATOM 1177 N GLY A 73 -9.602 -9.751 1.521 1.00 0.00 N ATOM 1178 CA GLY A 73 -10.213 -8.965 0.443 1.00 0.00 C ATOM 1179 C GLY A 73 -11.427 -8.179 0.871 1.00 0.00 C ATOM 1180 O GLY A 73 -12.407 -8.112 0.141 1.00 0.00 O ATOM 0 H GLY A 73 -8.747 -9.348 1.905 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -9.469 -8.276 0.043 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -10.495 -9.637 -0.368 1.00 0.00 H new ATOM 1184 N TYR A 74 -11.303 -7.483 1.976 1.00 0.00 N ATOM 1185 CA TYR A 74 -12.386 -6.787 2.590 1.00 0.00 C ATOM 1186 C TYR A 74 -12.140 -5.332 2.511 1.00 0.00 C ATOM 1187 O TYR A 74 -11.255 -4.776 3.168 1.00 0.00 O ATOM 1188 CB TYR A 74 -12.566 -7.188 4.059 1.00 0.00 C ATOM 1189 CG TYR A 74 -13.483 -8.364 4.317 1.00 0.00 C ATOM 1190 CD1 TYR A 74 -13.181 -9.635 3.874 1.00 0.00 C ATOM 1191 CD2 TYR A 74 -14.650 -8.187 5.042 1.00 0.00 C ATOM 1192 CE1 TYR A 74 -14.015 -10.699 4.145 1.00 0.00 C ATOM 1193 CE2 TYR A 74 -15.490 -9.238 5.316 1.00 0.00 C ATOM 1194 CZ TYR A 74 -15.168 -10.492 4.866 1.00 0.00 C ATOM 1195 OH TYR A 74 -15.999 -11.552 5.146 1.00 0.00 O ATOM 0 H TYR A 74 -10.420 -7.389 2.478 1.00 0.00 H new ATOM 0 HA TYR A 74 -13.298 -7.052 2.055 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -11.585 -7.419 4.475 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -12.949 -6.327 4.606 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -12.277 -9.799 3.306 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -14.905 -7.200 5.400 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -13.765 -11.689 3.793 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -16.396 -9.078 5.881 1.00 0.00 H new ATOM 0 HH TYR A 74 -16.769 -11.236 5.664 1.00 0.00 H new ATOM 1205 N ILE A 75 -12.871 -4.740 1.681 1.00 0.00 N ATOM 1206 CA ILE A 75 -12.883 -3.345 1.551 1.00 0.00 C ATOM 1207 C ILE A 75 -13.877 -2.843 2.555 1.00 0.00 C ATOM 1208 O ILE A 75 -15.041 -3.259 2.548 1.00 0.00 O ATOM 1209 CB ILE A 75 -13.248 -2.987 0.120 1.00 0.00 C ATOM 1210 CG1 ILE A 75 -12.067 -3.323 -0.790 1.00 0.00 C ATOM 1211 CG2 ILE A 75 -13.673 -1.521 -0.032 1.00 0.00 C ATOM 1212 CD1 ILE A 75 -12.371 -3.241 -2.264 1.00 0.00 C ATOM 0 H ILE A 75 -13.505 -5.222 1.044 1.00 0.00 H new ATOM 0 HA ILE A 75 -11.914 -2.885 1.745 1.00 0.00 H new ATOM 0 HB ILE A 75 -14.117 -3.577 -0.172 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -11.245 -2.644 -0.563 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -11.721 -4.331 -0.559 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -13.922 -1.321 -1.074 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -14.545 -1.328 0.593 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -12.854 -0.871 0.277 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -11.478 -3.495 -2.834 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -13.170 -3.941 -2.510 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -12.686 -2.228 -2.515 1.00 0.00 H new ATOM 1224 N GLY A 76 -13.411 -2.022 3.428 1.00 0.00 N ATOM 1225 CA GLY A 76 -14.182 -1.609 4.523 1.00 0.00 C ATOM 1226 C GLY A 76 -14.444 -0.148 4.543 1.00 0.00 C ATOM 1227 O GLY A 76 -13.539 0.686 4.728 1.00 0.00 O ATOM 0 H GLY A 76 -12.474 -1.620 3.393 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -15.133 -2.141 4.509 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -13.672 -1.892 5.444 1.00 0.00 H new ATOM 1231 N VAL A 77 -15.656 0.180 4.371 1.00 0.00 N ATOM 1232 CA VAL A 77 -16.020 1.527 4.372 1.00 0.00 C ATOM 1233 C VAL A 77 -16.829 1.839 5.595 1.00 0.00 C ATOM 1234 O VAL A 77 -17.718 1.075 5.989 1.00 0.00 O ATOM 1235 CB VAL A 77 -16.730 1.929 3.069 1.00 0.00 C ATOM 1236 CG1 VAL A 77 -17.147 3.386 3.056 1.00 0.00 C ATOM 1237 CG2 VAL A 77 -15.852 1.609 1.871 1.00 0.00 C ATOM 0 H VAL A 77 -16.422 -0.477 4.226 1.00 0.00 H new ATOM 0 HA VAL A 77 -15.115 2.133 4.412 1.00 0.00 H new ATOM 0 HB VAL A 77 -17.647 1.342 3.008 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -17.643 3.614 2.113 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -17.833 3.576 3.882 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -16.265 4.018 3.164 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -16.367 1.899 0.955 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -14.914 2.159 1.950 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -15.644 0.539 1.848 1.00 0.00 H new ATOM 1247 N SER A 78 -16.468 2.903 6.242 1.00 0.00 N ATOM 1248 CA SER A 78 -17.154 3.328 7.417 1.00 0.00 C ATOM 1249 C SER A 78 -18.149 4.409 7.019 1.00 0.00 C ATOM 1250 O SER A 78 -18.041 4.930 5.911 1.00 0.00 O ATOM 1251 CB SER A 78 -16.142 3.829 8.423 1.00 0.00 C ATOM 1252 OG SER A 78 -15.158 2.831 8.666 1.00 0.00 O ATOM 0 H SER A 78 -15.688 3.501 5.968 1.00 0.00 H new ATOM 0 HA SER A 78 -17.702 2.508 7.881 1.00 0.00 H new ATOM 0 HB2 SER A 78 -15.666 4.736 8.051 1.00 0.00 H new ATOM 0 HB3 SER A 78 -16.643 4.091 9.355 1.00 0.00 H new ATOM 0 HG SER A 78 -14.507 3.166 9.317 1.00 0.00 H new ATOM 1258 N ASP A 79 -19.072 4.755 7.919 1.00 0.00 N ATOM 1259 CA ASP A 79 -20.195 5.700 7.656 1.00 0.00 C ATOM 1260 C ASP A 79 -19.732 7.032 7.046 1.00 0.00 C ATOM 1261 O ASP A 79 -20.413 7.620 6.210 1.00 0.00 O ATOM 1262 CB ASP A 79 -21.008 5.958 8.929 1.00 0.00 C ATOM 1263 CG ASP A 79 -22.320 6.676 8.655 1.00 0.00 C ATOM 1264 OD1 ASP A 79 -22.343 7.932 8.592 1.00 0.00 O ATOM 1265 OD2 ASP A 79 -23.364 5.990 8.510 1.00 0.00 O ATOM 0 H ASP A 79 -19.073 4.389 8.871 1.00 0.00 H new ATOM 0 HA ASP A 79 -20.830 5.213 6.916 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -21.215 5.008 9.421 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -20.412 6.552 9.621 1.00 0.00 H new ATOM 1270 N ASN A 80 -18.549 7.478 7.427 1.00 0.00 N ATOM 1271 CA ASN A 80 -17.961 8.708 6.876 1.00 0.00 C ATOM 1272 C ASN A 80 -17.294 8.457 5.521 1.00 0.00 C ATOM 1273 O ASN A 80 -16.475 9.247 5.062 1.00 0.00 O ATOM 1274 CB ASN A 80 -16.961 9.345 7.850 1.00 0.00 C ATOM 1275 CG ASN A 80 -17.619 9.951 9.071 1.00 0.00 C ATOM 1276 OD1 ASN A 80 -18.038 11.096 9.053 1.00 0.00 O ATOM 1277 ND2 ASN A 80 -17.684 9.214 10.133 1.00 0.00 N ATOM 0 H ASN A 80 -17.965 7.010 8.120 1.00 0.00 H new ATOM 0 HA ASN A 80 -18.783 9.408 6.727 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -16.244 8.589 8.170 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -16.398 10.118 7.328 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -18.095 9.587 10.989 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -17.324 8.260 10.114 1.00 0.00 H new ATOM 1284 N GLY A 81 -17.637 7.341 4.913 1.00 0.00 N ATOM 1285 CA GLY A 81 -17.185 6.988 3.605 1.00 0.00 C ATOM 1286 C GLY A 81 -15.743 6.632 3.582 1.00 0.00 C ATOM 1287 O GLY A 81 -15.072 6.856 2.608 1.00 0.00 O ATOM 0 H GLY A 81 -18.253 6.645 5.334 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -17.770 6.146 3.236 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -17.362 7.821 2.925 1.00 0.00 H new ATOM 1291 N VAL A 82 -15.280 6.086 4.655 1.00 0.00 N ATOM 1292 CA VAL A 82 -13.885 5.731 4.788 1.00 0.00 C ATOM 1293 C VAL A 82 -13.589 4.505 3.912 1.00 0.00 C ATOM 1294 O VAL A 82 -13.981 3.435 4.241 1.00 0.00 O ATOM 1295 CB VAL A 82 -13.548 5.456 6.271 1.00 0.00 C ATOM 1296 CG1 VAL A 82 -12.062 5.258 6.469 1.00 0.00 C ATOM 1297 CG2 VAL A 82 -14.061 6.593 7.145 1.00 0.00 C ATOM 0 H VAL A 82 -15.849 5.868 5.473 1.00 0.00 H new ATOM 0 HA VAL A 82 -13.258 6.557 4.452 1.00 0.00 H new ATOM 0 HB VAL A 82 -14.046 4.533 6.567 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -11.858 5.067 7.522 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.726 4.409 5.874 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -11.530 6.156 6.153 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -13.818 6.389 8.188 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -13.591 7.528 6.839 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -15.142 6.678 7.034 1.00 0.00 H new ATOM 1307 N ILE A 83 -12.863 4.732 2.827 1.00 0.00 N ATOM 1308 CA ILE A 83 -12.562 3.768 1.704 1.00 0.00 C ATOM 1309 C ILE A 83 -11.398 2.833 2.031 1.00 0.00 C ATOM 1310 O ILE A 83 -10.559 2.511 1.202 1.00 0.00 O ATOM 1311 CB ILE A 83 -12.359 4.524 0.330 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -13.566 5.417 0.086 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -12.216 3.548 -0.863 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -14.876 4.667 0.153 1.00 0.00 C ATOM 0 H ILE A 83 -12.428 5.641 2.668 1.00 0.00 H new ATOM 0 HA ILE A 83 -13.437 3.128 1.592 1.00 0.00 H new ATOM 0 HB ILE A 83 -11.438 5.103 0.399 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -13.574 6.218 0.825 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -13.472 5.887 -0.893 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -12.079 4.116 -1.783 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -11.353 2.902 -0.703 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -13.116 2.938 -0.944 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -15.700 5.357 -0.029 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -14.885 3.883 -0.604 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -14.989 4.219 1.140 1.00 0.00 H new ATOM 1326 N SER A 84 -11.303 2.461 3.237 1.00 0.00 N ATOM 1327 CA SER A 84 -10.095 1.791 3.650 1.00 0.00 C ATOM 1328 C SER A 84 -10.262 0.280 3.582 1.00 0.00 C ATOM 1329 O SER A 84 -11.348 -0.218 3.646 1.00 0.00 O ATOM 1330 CB SER A 84 -9.759 2.255 5.039 1.00 0.00 C ATOM 1331 OG SER A 84 -9.762 3.673 5.046 1.00 0.00 O ATOM 0 H SER A 84 -12.012 2.592 3.959 1.00 0.00 H new ATOM 0 HA SER A 84 -9.274 2.040 2.977 1.00 0.00 H new ATOM 0 HB2 SER A 84 -10.486 1.870 5.754 1.00 0.00 H new ATOM 0 HB3 SER A 84 -8.783 1.876 5.341 1.00 0.00 H new ATOM 0 HG SER A 84 -9.546 3.996 5.946 1.00 0.00 H new ATOM 1337 N THR A 85 -9.214 -0.439 3.370 1.00 0.00 N ATOM 1338 CA THR A 85 -9.341 -1.855 3.427 1.00 0.00 C ATOM 1339 C THR A 85 -9.071 -2.304 4.851 1.00 0.00 C ATOM 1340 O THR A 85 -8.316 -1.627 5.609 1.00 0.00 O ATOM 1341 CB THR A 85 -8.452 -2.593 2.388 1.00 0.00 C ATOM 1342 OG1 THR A 85 -7.080 -2.253 2.559 1.00 0.00 O ATOM 1343 CG2 THR A 85 -8.888 -2.228 0.975 1.00 0.00 C ATOM 0 H THR A 85 -8.282 -0.083 3.161 1.00 0.00 H new ATOM 0 HA THR A 85 -10.359 -2.127 3.148 1.00 0.00 H new ATOM 0 HB THR A 85 -8.570 -3.665 2.544 1.00 0.00 H new ATOM 0 HG1 THR A 85 -6.693 -2.009 1.692 1.00 0.00 H new ATOM 0 HG21 THR A 85 -8.259 -2.750 0.254 1.00 0.00 H new ATOM 0 HG22 THR A 85 -9.928 -2.520 0.828 1.00 0.00 H new ATOM 0 HG23 THR A 85 -8.790 -1.152 0.830 1.00 0.00 H new ATOM 1351 N PHE A 86 -9.715 -3.367 5.257 1.00 0.00 N ATOM 1352 CA PHE A 86 -9.592 -3.848 6.609 1.00 0.00 C ATOM 1353 C PHE A 86 -9.423 -5.336 6.623 1.00 0.00 C ATOM 1354 O PHE A 86 -9.584 -5.997 5.601 1.00 0.00 O ATOM 1355 CB PHE A 86 -10.837 -3.528 7.446 1.00 0.00 C ATOM 1356 CG PHE A 86 -11.031 -2.103 7.847 1.00 0.00 C ATOM 1357 CD1 PHE A 86 -11.458 -1.170 6.943 1.00 0.00 C ATOM 1358 CD2 PHE A 86 -10.820 -1.720 9.152 1.00 0.00 C ATOM 1359 CE1 PHE A 86 -11.673 0.139 7.324 1.00 0.00 C ATOM 1360 CE2 PHE A 86 -11.038 -0.419 9.553 1.00 0.00 C ATOM 1361 CZ PHE A 86 -11.467 0.515 8.635 1.00 0.00 C ATOM 0 H PHE A 86 -10.335 -3.920 4.665 1.00 0.00 H new ATOM 0 HA PHE A 86 -8.722 -3.348 7.035 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -11.715 -3.845 6.883 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -10.803 -4.134 8.351 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -11.629 -1.461 5.917 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -10.479 -2.449 9.872 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -12.002 0.867 6.597 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -10.873 -0.133 10.581 1.00 0.00 H new ATOM 0 HZ PHE A 86 -11.641 1.536 8.941 1.00 0.00 H new ATOM 1371 N HIS A 87 -9.103 -5.854 7.777 1.00 0.00 N ATOM 1372 CA HIS A 87 -9.065 -7.266 7.978 1.00 0.00 C ATOM 1373 C HIS A 87 -10.390 -7.687 8.605 1.00 0.00 C ATOM 1374 O HIS A 87 -10.644 -7.426 9.794 1.00 0.00 O ATOM 1375 CB HIS A 87 -7.881 -7.681 8.870 1.00 0.00 C ATOM 1376 CG HIS A 87 -7.801 -9.166 9.116 1.00 0.00 C ATOM 1377 ND1 HIS A 87 -8.268 -9.783 10.259 1.00 0.00 N ATOM 1378 CD2 HIS A 87 -7.308 -10.155 8.335 1.00 0.00 C ATOM 1379 CE1 HIS A 87 -8.052 -11.088 10.144 1.00 0.00 C ATOM 1380 NE2 HIS A 87 -7.468 -11.376 8.987 1.00 0.00 N ATOM 0 H HIS A 87 -8.862 -5.304 8.601 1.00 0.00 H new ATOM 0 HA HIS A 87 -8.923 -7.767 7.020 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -6.953 -7.348 8.405 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -7.961 -7.166 9.828 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -6.861 -10.019 7.361 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -8.317 -11.819 10.893 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -7.194 -12.298 8.647 1.00 0.00 H new ATOM 1388 N GLY A 88 -11.227 -8.280 7.804 1.00 0.00 N ATOM 1389 CA GLY A 88 -12.519 -8.720 8.260 1.00 0.00 C ATOM 1390 C GLY A 88 -13.520 -7.592 8.237 1.00 0.00 C ATOM 1391 O GLY A 88 -13.328 -6.614 7.510 1.00 0.00 O ATOM 0 H GLY A 88 -11.037 -8.473 6.821 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -12.872 -9.535 7.629 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -12.435 -9.114 9.273 1.00 0.00 H new ATOM 1395 N ARG A 89 -14.593 -7.741 8.997 1.00 0.00 N ATOM 1396 CA ARG A 89 -15.622 -6.717 9.119 1.00 0.00 C ATOM 1397 C ARG A 89 -15.034 -5.347 9.456 1.00 0.00 C ATOM 1398 O ARG A 89 -14.219 -5.221 10.377 1.00 0.00 O ATOM 1399 CB ARG A 89 -16.659 -7.109 10.167 1.00 0.00 C ATOM 1400 CG ARG A 89 -17.668 -8.112 9.696 1.00 0.00 C ATOM 1401 CD ARG A 89 -18.678 -7.443 8.782 1.00 0.00 C ATOM 1402 NE ARG A 89 -19.391 -6.339 9.450 1.00 0.00 N ATOM 1403 CZ ARG A 89 -20.703 -6.317 9.688 1.00 0.00 C ATOM 1404 NH1 ARG A 89 -21.428 -7.427 9.547 1.00 0.00 N ATOM 1405 NH2 ARG A 89 -21.272 -5.204 10.125 1.00 0.00 N ATOM 0 H ARG A 89 -14.777 -8.578 9.549 1.00 0.00 H new ATOM 0 HA ARG A 89 -16.108 -6.642 8.146 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -16.143 -7.513 11.038 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -17.183 -6.211 10.495 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -17.167 -8.923 9.167 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -18.177 -8.556 10.551 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -18.168 -7.061 7.898 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -19.400 -8.184 8.438 1.00 0.00 H new ATOM 0 HE ARG A 89 -18.841 -5.534 9.752 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -20.979 -8.296 9.256 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -22.431 -7.407 9.730 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -20.707 -4.369 10.278 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -22.275 -5.182 10.308 1.00 0.00 H new ATOM 1419 N PRO A 90 -15.418 -4.310 8.695 1.00 0.00 N ATOM 1420 CA PRO A 90 -14.952 -2.952 8.916 1.00 0.00 C ATOM 1421 C PRO A 90 -15.555 -2.368 10.172 1.00 0.00 C ATOM 1422 O PRO A 90 -16.673 -1.826 10.160 1.00 0.00 O ATOM 1423 CB PRO A 90 -15.439 -2.167 7.698 1.00 0.00 C ATOM 1424 CG PRO A 90 -16.007 -3.180 6.762 1.00 0.00 C ATOM 1425 CD PRO A 90 -16.335 -4.386 7.563 1.00 0.00 C ATOM 0 HA PRO A 90 -13.870 -2.916 9.038 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -16.192 -1.432 7.982 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.619 -1.620 7.232 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -16.899 -2.791 6.270 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -15.290 -3.423 5.978 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -17.375 -4.379 7.889 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.187 -5.300 6.989 1.00 0.00 H new ATOM 1433 N GLU A 91 -14.860 -2.550 11.243 1.00 0.00 N ATOM 1434 CA GLU A 91 -15.261 -2.098 12.530 1.00 0.00 C ATOM 1435 C GLU A 91 -14.004 -1.577 13.228 1.00 0.00 C ATOM 1436 O GLU A 91 -12.894 -1.913 12.802 1.00 0.00 O ATOM 1437 CB GLU A 91 -15.911 -3.279 13.302 1.00 0.00 C ATOM 1438 CG GLU A 91 -14.984 -4.453 13.550 1.00 0.00 C ATOM 1439 CD GLU A 91 -15.675 -5.638 14.173 1.00 0.00 C ATOM 1440 OE1 GLU A 91 -16.194 -6.494 13.436 1.00 0.00 O ATOM 1441 OE2 GLU A 91 -15.692 -5.756 15.410 1.00 0.00 O ATOM 0 H GLU A 91 -13.963 -3.036 11.245 1.00 0.00 H new ATOM 0 HA GLU A 91 -16.002 -1.301 12.478 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -16.277 -2.912 14.261 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -16.778 -3.629 12.742 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -14.536 -4.759 12.605 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -14.170 -4.133 14.200 1.00 0.00 H new ATOM 1448 N PRO A 92 -14.136 -0.760 14.289 1.00 0.00 N ATOM 1449 CA PRO A 92 -12.982 -0.194 15.007 1.00 0.00 C ATOM 1450 C PRO A 92 -12.168 -1.255 15.737 1.00 0.00 C ATOM 1451 O PRO A 92 -11.029 -1.018 16.144 1.00 0.00 O ATOM 1452 CB PRO A 92 -13.595 0.774 16.012 1.00 0.00 C ATOM 1453 CG PRO A 92 -15.034 0.396 16.124 1.00 0.00 C ATOM 1454 CD PRO A 92 -15.411 -0.303 14.852 1.00 0.00 C ATOM 0 HA PRO A 92 -12.288 0.281 14.314 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -13.096 0.700 16.978 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -13.488 1.805 15.676 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -15.195 -0.256 16.983 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -15.653 1.280 16.275 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -16.082 -1.140 15.044 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -15.928 0.370 14.168 1.00 0.00 H new ATOM 1462 N ALA A 93 -12.754 -2.410 15.908 1.00 0.00 N ATOM 1463 CA ALA A 93 -12.071 -3.510 16.525 1.00 0.00 C ATOM 1464 C ALA A 93 -11.187 -4.216 15.502 1.00 0.00 C ATOM 1465 O ALA A 93 -10.365 -5.071 15.849 1.00 0.00 O ATOM 1466 CB ALA A 93 -13.064 -4.459 17.152 1.00 0.00 C ATOM 0 H ALA A 93 -13.713 -2.612 15.625 1.00 0.00 H new ATOM 0 HA ALA A 93 -11.428 -3.134 17.320 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -12.531 -5.289 17.616 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -13.644 -3.931 17.909 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -13.735 -4.843 16.384 1.00 0.00 H new ATOM 1472 N SER A 94 -11.351 -3.856 14.246 1.00 0.00 N ATOM 1473 CA SER A 94 -10.542 -4.397 13.194 1.00 0.00 C ATOM 1474 C SER A 94 -9.433 -3.412 12.855 1.00 0.00 C ATOM 1475 O SER A 94 -9.487 -2.238 13.258 1.00 0.00 O ATOM 1476 CB SER A 94 -11.391 -4.690 11.970 1.00 0.00 C ATOM 1477 OG SER A 94 -12.393 -5.651 12.255 1.00 0.00 O ATOM 0 H SER A 94 -12.049 -3.181 13.935 1.00 0.00 H new ATOM 0 HA SER A 94 -10.097 -5.335 13.527 1.00 0.00 H new ATOM 0 HB2 SER A 94 -11.857 -3.769 11.619 1.00 0.00 H new ATOM 0 HB3 SER A 94 -10.755 -5.053 11.163 1.00 0.00 H new ATOM 0 HG SER A 94 -12.926 -5.816 11.450 1.00 0.00 H new ATOM 1483 N GLU A 95 -8.434 -3.871 12.164 1.00 0.00 N ATOM 1484 CA GLU A 95 -7.317 -3.043 11.807 1.00 0.00 C ATOM 1485 C GLU A 95 -7.486 -2.428 10.432 1.00 0.00 C ATOM 1486 O GLU A 95 -7.728 -3.145 9.451 1.00 0.00 O ATOM 1487 CB GLU A 95 -6.023 -3.837 11.849 1.00 0.00 C ATOM 1488 CG GLU A 95 -5.668 -4.350 13.221 1.00 0.00 C ATOM 1489 CD GLU A 95 -4.333 -5.021 13.247 1.00 0.00 C ATOM 1490 OE1 GLU A 95 -3.305 -4.313 13.205 1.00 0.00 O ATOM 1491 OE2 GLU A 95 -4.278 -6.265 13.364 1.00 0.00 O ATOM 0 H GLU A 95 -8.368 -4.832 11.830 1.00 0.00 H new ATOM 0 HA GLU A 95 -7.273 -2.237 12.540 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -6.104 -4.682 11.165 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.210 -3.209 11.485 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -5.669 -3.521 13.928 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -6.432 -5.053 13.553 1.00 0.00 H new ATOM 1498 N PRO A 96 -7.400 -1.090 10.342 1.00 0.00 N ATOM 1499 CA PRO A 96 -7.395 -0.410 9.075 1.00 0.00 C ATOM 1500 C PRO A 96 -6.023 -0.544 8.447 1.00 0.00 C ATOM 1501 O PRO A 96 -4.988 -0.227 9.066 1.00 0.00 O ATOM 1502 CB PRO A 96 -7.708 1.048 9.406 1.00 0.00 C ATOM 1503 CG PRO A 96 -7.397 1.218 10.853 1.00 0.00 C ATOM 1504 CD PRO A 96 -7.307 -0.155 11.478 1.00 0.00 C ATOM 0 HA PRO A 96 -8.117 -0.817 8.367 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -7.108 1.724 8.796 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -8.754 1.278 9.202 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -6.458 1.756 10.980 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -8.172 1.809 11.342 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -6.370 -0.283 12.020 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -8.114 -0.319 12.193 1.00 0.00 H new ATOM 1512 N ILE A 97 -6.008 -1.030 7.262 1.00 0.00 N ATOM 1513 CA ILE A 97 -4.781 -1.324 6.563 1.00 0.00 C ATOM 1514 C ILE A 97 -4.125 -0.034 6.052 1.00 0.00 C ATOM 1515 O ILE A 97 -2.902 0.095 6.034 1.00 0.00 O ATOM 1516 CB ILE A 97 -5.087 -2.301 5.413 1.00 0.00 C ATOM 1517 CG1 ILE A 97 -5.735 -3.571 5.988 1.00 0.00 C ATOM 1518 CG2 ILE A 97 -3.834 -2.638 4.622 1.00 0.00 C ATOM 1519 CD1 ILE A 97 -6.306 -4.490 4.946 1.00 0.00 C ATOM 0 H ILE A 97 -6.851 -1.243 6.729 1.00 0.00 H new ATOM 0 HA ILE A 97 -4.070 -1.792 7.243 1.00 0.00 H new ATOM 0 HB ILE A 97 -5.781 -1.824 4.721 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -4.991 -4.115 6.569 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -6.529 -3.282 6.677 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -4.086 -3.330 3.818 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -3.415 -1.726 4.198 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -3.100 -3.101 5.282 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -6.745 -5.362 5.431 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -7.075 -3.965 4.380 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -5.513 -4.811 4.270 1.00 0.00 H new ATOM 1531 N GLN A 98 -4.950 0.898 5.663 1.00 0.00 N ATOM 1532 CA GLN A 98 -4.536 2.207 5.173 1.00 0.00 C ATOM 1533 C GLN A 98 -5.801 3.043 5.157 1.00 0.00 C ATOM 1534 O GLN A 98 -6.813 2.585 5.673 1.00 0.00 O ATOM 1535 CB GLN A 98 -3.950 2.110 3.715 1.00 0.00 C ATOM 1536 CG GLN A 98 -4.995 2.113 2.573 1.00 0.00 C ATOM 1537 CD GLN A 98 -6.007 0.992 2.639 1.00 0.00 C ATOM 1538 OE1 GLN A 98 -7.152 1.159 2.281 1.00 0.00 O ATOM 1539 NE2 GLN A 98 -5.593 -0.136 3.060 1.00 0.00 N ATOM 0 H GLN A 98 -5.963 0.775 5.674 1.00 0.00 H new ATOM 0 HA GLN A 98 -3.755 2.634 5.802 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -3.267 2.945 3.561 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -3.359 1.197 3.640 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -5.526 3.065 2.588 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -4.471 2.055 1.619 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -4.623 -0.246 3.355 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -6.232 -0.930 3.103 1.00 0.00 H new ATOM 1548 N SER A 99 -5.756 4.221 4.587 1.00 0.00 N ATOM 1549 CA SER A 99 -6.942 4.983 4.355 1.00 0.00 C ATOM 1550 C SER A 99 -6.824 5.733 3.012 1.00 0.00 C ATOM 1551 O SER A 99 -5.889 6.520 2.806 1.00 0.00 O ATOM 1552 CB SER A 99 -7.225 5.922 5.536 1.00 0.00 C ATOM 1553 OG SER A 99 -6.062 6.670 5.885 1.00 0.00 O ATOM 0 H SER A 99 -4.896 4.671 4.274 1.00 0.00 H new ATOM 0 HA SER A 99 -7.799 4.313 4.282 1.00 0.00 H new ATOM 0 HB2 SER A 99 -8.036 6.603 5.277 1.00 0.00 H new ATOM 0 HB3 SER A 99 -7.559 5.341 6.395 1.00 0.00 H new ATOM 0 HG SER A 99 -5.568 6.905 5.072 1.00 0.00 H new ATOM 1559 N PHE A 100 -7.718 5.433 2.081 1.00 0.00 N ATOM 1560 CA PHE A 100 -7.696 6.091 0.782 1.00 0.00 C ATOM 1561 C PHE A 100 -8.514 7.377 0.769 1.00 0.00 C ATOM 1562 O PHE A 100 -7.959 8.476 0.699 1.00 0.00 O ATOM 1563 CB PHE A 100 -8.171 5.169 -0.349 1.00 0.00 C ATOM 1564 CG PHE A 100 -7.240 4.051 -0.693 1.00 0.00 C ATOM 1565 CD1 PHE A 100 -6.013 4.317 -1.279 1.00 0.00 C ATOM 1566 CD2 PHE A 100 -7.595 2.743 -0.459 1.00 0.00 C ATOM 1567 CE1 PHE A 100 -5.157 3.294 -1.620 1.00 0.00 C ATOM 1568 CE2 PHE A 100 -6.745 1.713 -0.804 1.00 0.00 C ATOM 1569 CZ PHE A 100 -5.525 1.989 -1.384 1.00 0.00 C ATOM 0 H PHE A 100 -8.461 4.745 2.198 1.00 0.00 H new ATOM 0 HA PHE A 100 -6.651 6.344 0.604 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -9.135 4.744 -0.069 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -8.335 5.771 -1.242 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -5.724 5.340 -1.471 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -8.548 2.520 -0.001 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -4.201 3.515 -2.071 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -7.035 0.689 -0.620 1.00 0.00 H new ATOM 0 HZ PHE A 100 -4.859 1.182 -1.653 1.00 0.00 H new ATOM 1579 N PHE A 101 -9.819 7.240 0.857 1.00 0.00 N ATOM 1580 CA PHE A 101 -10.744 8.373 0.747 1.00 0.00 C ATOM 1581 C PHE A 101 -11.801 8.341 1.833 1.00 0.00 C ATOM 1582 O PHE A 101 -11.928 7.347 2.567 1.00 0.00 O ATOM 1583 CB PHE A 101 -11.488 8.332 -0.610 1.00 0.00 C ATOM 1584 CG PHE A 101 -10.751 8.852 -1.811 1.00 0.00 C ATOM 1585 CD1 PHE A 101 -9.626 8.223 -2.300 1.00 0.00 C ATOM 1586 CD2 PHE A 101 -11.210 9.983 -2.452 1.00 0.00 C ATOM 1587 CE1 PHE A 101 -8.965 8.713 -3.406 1.00 0.00 C ATOM 1588 CE2 PHE A 101 -10.560 10.482 -3.560 1.00 0.00 C ATOM 1589 CZ PHE A 101 -9.433 9.845 -4.039 1.00 0.00 C ATOM 0 H PHE A 101 -10.280 6.343 1.007 1.00 0.00 H new ATOM 0 HA PHE A 101 -10.141 9.276 0.841 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -11.772 7.299 -0.809 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -12.411 8.902 -0.507 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -9.257 7.334 -1.810 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -12.091 10.485 -2.081 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -8.083 8.212 -3.776 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -10.931 11.369 -4.052 1.00 0.00 H new ATOM 0 HZ PHE A 101 -8.919 10.232 -4.907 1.00 0.00 H new ATOM 1599 N GLN A 102 -12.538 9.434 1.915 1.00 0.00 N ATOM 1600 CA GLN A 102 -13.737 9.556 2.712 1.00 0.00 C ATOM 1601 C GLN A 102 -14.821 10.103 1.824 1.00 0.00 C ATOM 1602 O GLN A 102 -14.698 11.197 1.272 1.00 0.00 O ATOM 1603 CB GLN A 102 -13.543 10.437 3.933 1.00 0.00 C ATOM 1604 CG GLN A 102 -13.090 9.697 5.160 1.00 0.00 C ATOM 1605 CD GLN A 102 -12.765 10.644 6.272 1.00 0.00 C ATOM 1606 OE1 GLN A 102 -11.626 11.076 6.425 1.00 0.00 O ATOM 1607 NE2 GLN A 102 -13.759 11.022 7.015 1.00 0.00 N ATOM 0 H GLN A 102 -12.307 10.289 1.409 1.00 0.00 H new ATOM 0 HA GLN A 102 -14.008 8.573 3.098 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -12.811 11.210 3.697 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -14.482 10.944 4.154 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -13.871 9.008 5.482 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -12.212 9.096 4.922 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -14.690 10.638 6.855 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -13.609 11.703 7.760 1.00 0.00 H new ATOM 1616 N ILE A 103 -15.856 9.354 1.677 1.00 0.00 N ATOM 1617 CA ILE A 103 -16.894 9.674 0.736 1.00 0.00 C ATOM 1618 C ILE A 103 -18.235 9.844 1.421 1.00 0.00 C ATOM 1619 O ILE A 103 -18.372 9.622 2.638 1.00 0.00 O ATOM 1620 CB ILE A 103 -17.020 8.584 -0.371 1.00 0.00 C ATOM 1621 CG1 ILE A 103 -17.585 7.277 0.194 1.00 0.00 C ATOM 1622 CG2 ILE A 103 -15.654 8.323 -1.004 1.00 0.00 C ATOM 1623 CD1 ILE A 103 -17.880 6.246 -0.862 1.00 0.00 C ATOM 0 H ILE A 103 -16.016 8.496 2.204 1.00 0.00 H new ATOM 0 HA ILE A 103 -16.610 10.619 0.273 1.00 0.00 H new ATOM 0 HB ILE A 103 -17.711 8.954 -1.129 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -16.874 6.861 0.908 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -18.500 7.494 0.745 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -15.751 7.560 -1.776 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -15.277 9.244 -1.449 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -14.958 7.978 -0.239 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -18.277 5.347 -0.391 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -18.614 6.643 -1.563 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -16.963 6.001 -1.397 1.00 0.00 H new ATOM 1635 N ASP A 104 -19.222 10.210 0.650 1.00 0.00 N ATOM 1636 CA ASP A 104 -20.539 10.414 1.179 1.00 0.00 C ATOM 1637 C ASP A 104 -21.378 9.183 1.001 1.00 0.00 C ATOM 1638 O ASP A 104 -21.872 8.894 -0.112 1.00 0.00 O ATOM 1639 CB ASP A 104 -21.244 11.603 0.524 1.00 0.00 C ATOM 1640 CG ASP A 104 -20.590 12.924 0.808 1.00 0.00 C ATOM 1641 OD1 ASP A 104 -20.578 13.356 1.971 1.00 0.00 O ATOM 1642 OD2 ASP A 104 -20.117 13.576 -0.128 1.00 0.00 O ATOM 0 H ASP A 104 -19.136 10.374 -0.353 1.00 0.00 H new ATOM 0 HA ASP A 104 -20.421 10.629 2.241 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -21.274 11.447 -0.554 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -22.277 11.637 0.870 1.00 0.00 H new ATOM 1647 N LEU A 105 -21.577 8.449 2.078 1.00 0.00 N ATOM 1648 CA LEU A 105 -22.411 7.275 2.015 1.00 0.00 C ATOM 1649 C LEU A 105 -23.825 7.687 1.805 1.00 0.00 C ATOM 1650 O LEU A 105 -24.605 6.981 1.182 1.00 0.00 O ATOM 1651 CB LEU A 105 -22.306 6.376 3.232 1.00 0.00 C ATOM 1652 CG LEU A 105 -20.979 5.677 3.494 1.00 0.00 C ATOM 1653 CD1 LEU A 105 -21.214 4.539 4.457 1.00 0.00 C ATOM 1654 CD2 LEU A 105 -20.338 5.171 2.205 1.00 0.00 C ATOM 0 H LEU A 105 -21.176 8.645 2.995 1.00 0.00 H new ATOM 0 HA LEU A 105 -22.050 6.681 1.175 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -22.547 6.974 4.111 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -23.076 5.609 3.148 1.00 0.00 H new ATOM 0 HG LEU A 105 -20.283 6.395 3.928 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -20.271 4.029 4.654 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -21.617 4.930 5.391 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -21.924 3.835 4.022 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -19.393 4.679 2.437 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -21.008 4.461 1.720 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -20.154 6.011 1.536 1.00 0.00 H new ATOM 1666 N GLU A 106 -24.131 8.859 2.284 1.00 0.00 N ATOM 1667 CA GLU A 106 -25.421 9.455 2.098 1.00 0.00 C ATOM 1668 C GLU A 106 -25.700 9.705 0.594 1.00 0.00 C ATOM 1669 O GLU A 106 -26.855 9.756 0.173 1.00 0.00 O ATOM 1670 CB GLU A 106 -25.510 10.756 2.893 1.00 0.00 C ATOM 1671 CG GLU A 106 -24.412 11.749 2.560 1.00 0.00 C ATOM 1672 CD GLU A 106 -24.555 13.053 3.291 1.00 0.00 C ATOM 1673 OE1 GLU A 106 -25.590 13.729 3.134 1.00 0.00 O ATOM 1674 OE2 GLU A 106 -23.636 13.427 4.033 1.00 0.00 O ATOM 0 H GLU A 106 -23.482 9.434 2.822 1.00 0.00 H new ATOM 0 HA GLU A 106 -26.183 8.768 2.466 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -26.478 11.221 2.705 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -25.469 10.525 3.957 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -23.445 11.308 2.803 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -24.415 11.939 1.487 1.00 0.00 H new ATOM 1681 N ARG A 107 -24.632 9.827 -0.213 1.00 0.00 N ATOM 1682 CA ARG A 107 -24.785 10.060 -1.640 1.00 0.00 C ATOM 1683 C ARG A 107 -24.783 8.722 -2.406 1.00 0.00 C ATOM 1684 O ARG A 107 -25.182 8.670 -3.574 1.00 0.00 O ATOM 1685 CB ARG A 107 -23.718 11.054 -2.177 1.00 0.00 C ATOM 1686 CG ARG A 107 -22.601 10.442 -3.015 1.00 0.00 C ATOM 1687 CD ARG A 107 -21.605 11.490 -3.511 1.00 0.00 C ATOM 1688 NE ARG A 107 -22.245 12.591 -4.239 1.00 0.00 N ATOM 1689 CZ ARG A 107 -21.787 13.168 -5.370 1.00 0.00 C ATOM 1690 NH1 ARG A 107 -20.784 12.624 -6.063 1.00 0.00 N ATOM 1691 NH2 ARG A 107 -22.377 14.266 -5.826 1.00 0.00 N ATOM 0 H ARG A 107 -23.665 9.767 0.105 1.00 0.00 H new ATOM 0 HA ARG A 107 -25.752 10.534 -1.810 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -24.224 11.811 -2.777 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -23.269 11.569 -1.328 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -22.073 9.695 -2.422 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -23.034 9.923 -3.870 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -21.058 11.895 -2.660 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -20.874 11.009 -4.161 1.00 0.00 H new ATOM 0 HE ARG A 107 -23.117 12.954 -3.855 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -20.351 11.759 -5.740 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -20.450 13.074 -6.916 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -23.169 14.666 -5.323 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -22.039 14.710 -6.680 1.00 0.00 H new ATOM 1705 N LEU A 108 -24.308 7.639 -1.739 1.00 0.00 N ATOM 1706 CA LEU A 108 -24.392 6.270 -2.316 1.00 0.00 C ATOM 1707 C LEU A 108 -25.815 5.901 -2.644 1.00 0.00 C ATOM 1708 O LEU A 108 -26.762 6.481 -2.090 1.00 0.00 O ATOM 1709 CB LEU A 108 -23.828 5.187 -1.377 1.00 0.00 C ATOM 1710 CG LEU A 108 -22.398 4.707 -1.619 1.00 0.00 C ATOM 1711 CD1 LEU A 108 -22.215 4.117 -2.983 1.00 0.00 C ATOM 1712 CD2 LEU A 108 -21.405 5.772 -1.333 1.00 0.00 C ATOM 0 H LEU A 108 -23.871 7.683 -0.819 1.00 0.00 H new ATOM 0 HA LEU A 108 -23.786 6.303 -3.221 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -23.886 5.566 -0.357 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -24.486 4.320 -1.433 1.00 0.00 H new ATOM 0 HG LEU A 108 -22.215 3.899 -0.910 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -21.182 3.792 -3.103 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -22.881 3.262 -3.102 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -22.449 4.867 -3.738 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -20.400 5.392 -1.517 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -21.593 6.628 -1.981 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -21.491 6.080 -0.291 1.00 0.00 H new ATOM 1724 N GLU A 109 -25.952 4.919 -3.523 1.00 0.00 N ATOM 1725 CA GLU A 109 -27.248 4.429 -3.966 1.00 0.00 C ATOM 1726 C GLU A 109 -28.054 3.956 -2.742 1.00 0.00 C ATOM 1727 O GLU A 109 -28.972 4.644 -2.297 1.00 0.00 O ATOM 1728 CB GLU A 109 -27.042 3.279 -4.951 1.00 0.00 C ATOM 1729 CG GLU A 109 -25.998 3.547 -6.032 1.00 0.00 C ATOM 1730 CD GLU A 109 -26.280 4.767 -6.876 1.00 0.00 C ATOM 1731 OE1 GLU A 109 -27.049 4.669 -7.860 1.00 0.00 O ATOM 1732 OE2 GLU A 109 -25.709 5.831 -6.600 1.00 0.00 O ATOM 0 H GLU A 109 -25.162 4.437 -3.951 1.00 0.00 H new ATOM 0 HA GLU A 109 -27.801 5.224 -4.466 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -26.749 2.389 -4.394 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -27.994 3.055 -5.432 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -25.023 3.664 -5.559 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -25.934 2.675 -6.683 1.00 0.00 H new ATOM 1739 N SER A 110 -27.682 2.804 -2.196 1.00 0.00 N ATOM 1740 CA SER A 110 -28.252 2.316 -0.958 1.00 0.00 C ATOM 1741 C SER A 110 -27.451 1.103 -0.474 1.00 0.00 C ATOM 1742 O SER A 110 -26.586 1.232 0.385 1.00 0.00 O ATOM 1743 CB SER A 110 -29.762 1.986 -1.094 1.00 0.00 C ATOM 1744 OG SER A 110 -30.360 1.720 0.169 1.00 0.00 O ATOM 0 H SER A 110 -26.978 2.188 -2.602 1.00 0.00 H new ATOM 0 HA SER A 110 -28.185 3.109 -0.213 1.00 0.00 H new ATOM 0 HB2 SER A 110 -30.275 2.821 -1.571 1.00 0.00 H new ATOM 0 HB3 SER A 110 -29.888 1.121 -1.745 1.00 0.00 H new ATOM 0 HG SER A 110 -31.311 1.518 0.045 1.00 0.00 H new ATOM 1750 N HIS A 111 -27.645 -0.040 -1.111 1.00 0.00 N ATOM 1751 CA HIS A 111 -26.996 -1.285 -0.674 1.00 0.00 C ATOM 1752 C HIS A 111 -25.504 -1.296 -0.934 1.00 0.00 C ATOM 1753 O HIS A 111 -24.773 -2.044 -0.312 1.00 0.00 O ATOM 1754 CB HIS A 111 -27.683 -2.536 -1.240 1.00 0.00 C ATOM 1755 CG HIS A 111 -29.026 -2.813 -0.625 1.00 0.00 C ATOM 1756 ND1 HIS A 111 -29.267 -3.849 0.248 1.00 0.00 N ATOM 1757 CD2 HIS A 111 -30.206 -2.161 -0.762 1.00 0.00 C ATOM 1758 CE1 HIS A 111 -30.543 -3.800 0.613 1.00 0.00 C ATOM 1759 NE2 HIS A 111 -31.166 -2.791 0.025 1.00 0.00 N ATOM 0 H HIS A 111 -28.243 -0.141 -1.931 1.00 0.00 H new ATOM 0 HA HIS A 111 -27.120 -1.317 0.408 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -27.803 -2.419 -2.317 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -27.036 -3.399 -1.083 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -30.374 -1.293 -1.382 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -31.010 -4.492 1.298 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -32.147 -2.529 0.127 1.00 0.00 H new ATOM 1767 N MET A 112 -25.067 -0.460 -1.835 1.00 0.00 N ATOM 1768 CA MET A 112 -23.646 -0.291 -2.123 1.00 0.00 C ATOM 1769 C MET A 112 -22.865 0.144 -0.894 1.00 0.00 C ATOM 1770 O MET A 112 -21.880 -0.464 -0.556 1.00 0.00 O ATOM 1771 CB MET A 112 -23.437 0.703 -3.256 1.00 0.00 C ATOM 1772 CG MET A 112 -23.387 0.092 -4.631 1.00 0.00 C ATOM 1773 SD MET A 112 -21.869 -0.834 -4.899 1.00 0.00 S ATOM 1774 CE MET A 112 -20.666 0.494 -4.770 1.00 0.00 C ATOM 0 H MET A 112 -25.678 0.131 -2.399 1.00 0.00 H new ATOM 0 HA MET A 112 -23.265 -1.264 -2.432 1.00 0.00 H new ATOM 0 HB2 MET A 112 -24.242 1.437 -3.229 1.00 0.00 H new ATOM 0 HB3 MET A 112 -22.507 1.243 -3.080 1.00 0.00 H new ATOM 0 HG2 MET A 112 -24.244 -0.568 -4.766 1.00 0.00 H new ATOM 0 HG3 MET A 112 -23.470 0.879 -5.381 1.00 0.00 H new ATOM 0 HE1 MET A 112 -19.929 0.396 -5.567 1.00 0.00 H new ATOM 0 HE2 MET A 112 -21.173 1.455 -4.860 1.00 0.00 H new ATOM 0 HE3 MET A 112 -20.164 0.438 -3.804 1.00 0.00 H new ATOM 1784 N GLN A 113 -23.323 1.174 -0.200 1.00 0.00 N ATOM 1785 CA GLN A 113 -22.610 1.605 0.982 1.00 0.00 C ATOM 1786 C GLN A 113 -22.688 0.530 2.050 1.00 0.00 C ATOM 1787 O GLN A 113 -21.733 0.283 2.752 1.00 0.00 O ATOM 1788 CB GLN A 113 -23.097 2.958 1.533 1.00 0.00 C ATOM 1789 CG GLN A 113 -24.562 3.036 1.779 1.00 0.00 C ATOM 1790 CD GLN A 113 -24.939 3.759 3.062 1.00 0.00 C ATOM 1791 OE1 GLN A 113 -24.998 3.148 4.127 1.00 0.00 O ATOM 1792 NE2 GLN A 113 -25.263 5.010 2.974 1.00 0.00 N ATOM 0 H GLN A 113 -24.160 1.710 -0.428 1.00 0.00 H new ATOM 0 HA GLN A 113 -21.572 1.759 0.687 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -22.574 3.165 2.467 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -22.818 3.743 0.830 1.00 0.00 H new ATOM 0 HG2 GLN A 113 -25.034 3.542 0.937 1.00 0.00 H new ATOM 0 HG3 GLN A 113 -24.968 2.025 1.812 1.00 0.00 H new ATOM 0 HE21 GLN A 113 -25.204 5.490 2.076 1.00 0.00 H new ATOM 0 HE22 GLN A 113 -25.577 5.515 3.803 1.00 0.00 H new ATOM 1801 N LYS A 114 -23.821 -0.154 2.097 1.00 0.00 N ATOM 1802 CA LYS A 114 -24.060 -1.204 3.064 1.00 0.00 C ATOM 1803 C LYS A 114 -23.123 -2.397 2.834 1.00 0.00 C ATOM 1804 O LYS A 114 -22.682 -3.049 3.799 1.00 0.00 O ATOM 1805 CB LYS A 114 -25.507 -1.669 2.976 1.00 0.00 C ATOM 1806 CG LYS A 114 -26.536 -0.554 3.085 1.00 0.00 C ATOM 1807 CD LYS A 114 -26.492 0.145 4.428 1.00 0.00 C ATOM 1808 CE LYS A 114 -27.562 1.216 4.524 1.00 0.00 C ATOM 1809 NZ LYS A 114 -27.461 1.985 5.774 1.00 0.00 N ATOM 0 H LYS A 114 -24.602 0.008 1.461 1.00 0.00 H new ATOM 0 HA LYS A 114 -23.862 -0.799 4.056 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -25.651 -2.188 2.028 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -25.691 -2.395 3.768 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -26.363 0.175 2.293 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -27.532 -0.966 2.926 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -26.632 -0.585 5.226 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -25.510 0.594 4.575 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -27.475 1.893 3.674 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -28.546 0.752 4.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -28.339 2.522 5.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -27.314 1.334 6.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -26.658 2.643 5.713 1.00 0.00 H new ATOM 1823 N ASN A 115 -22.808 -2.673 1.570 1.00 0.00 N ATOM 1824 CA ASN A 115 -21.939 -3.795 1.231 1.00 0.00 C ATOM 1825 C ASN A 115 -20.538 -3.505 1.706 1.00 0.00 C ATOM 1826 O ASN A 115 -19.853 -4.374 2.231 1.00 0.00 O ATOM 1827 CB ASN A 115 -22.014 -4.194 -0.304 1.00 0.00 C ATOM 1828 CG ASN A 115 -21.278 -3.330 -1.349 1.00 0.00 C ATOM 1829 OD1 ASN A 115 -20.237 -2.776 -1.120 1.00 0.00 O ATOM 1830 ND2 ASN A 115 -21.848 -3.247 -2.521 1.00 0.00 N ATOM 0 H ASN A 115 -23.140 -2.137 0.768 1.00 0.00 H new ATOM 0 HA ASN A 115 -22.297 -4.682 1.755 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -21.635 -5.212 -0.396 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -23.067 -4.219 -0.584 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -21.409 -2.703 -3.264 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -22.732 -3.726 -2.693 1.00 0.00 H new ATOM 1837 N LEU A 116 -20.165 -2.263 1.580 1.00 0.00 N ATOM 1838 CA LEU A 116 -18.885 -1.769 2.020 1.00 0.00 C ATOM 1839 C LEU A 116 -18.827 -1.723 3.557 1.00 0.00 C ATOM 1840 O LEU A 116 -17.760 -1.888 4.150 1.00 0.00 O ATOM 1841 CB LEU A 116 -18.671 -0.376 1.463 1.00 0.00 C ATOM 1842 CG LEU A 116 -18.769 -0.208 -0.063 1.00 0.00 C ATOM 1843 CD1 LEU A 116 -18.899 1.250 -0.418 1.00 0.00 C ATOM 1844 CD2 LEU A 116 -17.551 -0.813 -0.751 1.00 0.00 C ATOM 0 H LEU A 116 -20.755 -1.546 1.158 1.00 0.00 H new ATOM 0 HA LEU A 116 -18.103 -2.438 1.661 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -19.402 0.288 1.924 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -17.685 -0.033 1.778 1.00 0.00 H new ATOM 0 HG LEU A 116 -19.657 -0.736 -0.411 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -18.968 1.356 -1.501 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -19.798 1.658 0.044 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -18.026 1.792 -0.055 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -17.641 -0.683 -1.830 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.649 -0.313 -0.399 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -17.492 -1.876 -0.517 1.00 0.00 H new ATOM 1856 N LEU A 117 -19.985 -1.491 4.191 1.00 0.00 N ATOM 1857 CA LEU A 117 -20.100 -1.466 5.652 1.00 0.00 C ATOM 1858 C LEU A 117 -19.756 -2.804 6.255 1.00 0.00 C ATOM 1859 O LEU A 117 -19.143 -2.873 7.318 1.00 0.00 O ATOM 1860 CB LEU A 117 -21.513 -1.109 6.111 1.00 0.00 C ATOM 1861 CG LEU A 117 -22.077 0.224 5.684 1.00 0.00 C ATOM 1862 CD1 LEU A 117 -23.424 0.444 6.314 1.00 0.00 C ATOM 1863 CD2 LEU A 117 -21.139 1.344 6.027 1.00 0.00 C ATOM 0 H LEU A 117 -20.865 -1.316 3.705 1.00 0.00 H new ATOM 0 HA LEU A 117 -19.398 -0.703 5.989 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -22.187 -1.887 5.754 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -21.531 -1.146 7.200 1.00 0.00 H new ATOM 0 HG LEU A 117 -22.197 0.213 4.601 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -23.820 1.409 5.998 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -24.105 -0.348 6.002 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -23.325 0.430 7.399 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -21.572 2.292 5.707 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -20.975 1.365 7.104 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -20.187 1.190 5.519 1.00 0.00 H new ATOM 1875 N LYS A 118 -20.190 -3.867 5.620 1.00 0.00 N ATOM 1876 CA LYS A 118 -19.888 -5.169 6.134 1.00 0.00 C ATOM 1877 C LYS A 118 -18.681 -5.799 5.450 1.00 0.00 C ATOM 1878 O LYS A 118 -18.215 -6.865 5.838 1.00 0.00 O ATOM 1879 CB LYS A 118 -21.135 -6.072 6.194 1.00 0.00 C ATOM 1880 CG LYS A 118 -21.884 -6.278 4.906 1.00 0.00 C ATOM 1881 CD LYS A 118 -21.128 -7.169 3.955 1.00 0.00 C ATOM 1882 CE LYS A 118 -21.842 -7.416 2.659 1.00 0.00 C ATOM 1883 NZ LYS A 118 -21.037 -8.303 1.804 1.00 0.00 N ATOM 0 H LYS A 118 -20.743 -3.852 4.763 1.00 0.00 H new ATOM 0 HA LYS A 118 -19.580 -5.047 7.172 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -20.830 -7.049 6.570 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -21.825 -5.651 6.925 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -22.859 -6.717 5.119 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -22.066 -5.313 4.433 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -20.158 -6.719 3.744 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -20.937 -8.125 4.442 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -22.816 -7.867 2.851 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -22.023 -6.470 2.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -21.274 -8.132 0.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -20.027 -8.111 1.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -21.241 -9.294 2.043 1.00 0.00 H new ATOM 1897 N GLY A 119 -18.174 -5.126 4.447 1.00 0.00 N ATOM 1898 CA GLY A 119 -17.006 -5.584 3.781 1.00 0.00 C ATOM 1899 C GLY A 119 -17.320 -6.516 2.646 1.00 0.00 C ATOM 1900 O GLY A 119 -18.348 -7.219 2.643 1.00 0.00 O ATOM 0 H GLY A 119 -18.562 -4.257 4.081 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -16.449 -4.728 3.400 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -16.359 -6.092 4.496 1.00 0.00 H new ATOM 1904 N ILE A 120 -16.477 -6.522 1.681 1.00 0.00 N ATOM 1905 CA ILE A 120 -16.647 -7.401 0.569 1.00 0.00 C ATOM 1906 C ILE A 120 -15.840 -8.639 0.889 1.00 0.00 C ATOM 1907 O ILE A 120 -14.759 -8.517 1.385 1.00 0.00 O ATOM 1908 CB ILE A 120 -16.166 -6.742 -0.764 1.00 0.00 C ATOM 1909 CG1 ILE A 120 -16.742 -5.318 -0.889 1.00 0.00 C ATOM 1910 CG2 ILE A 120 -16.612 -7.575 -1.961 1.00 0.00 C ATOM 1911 CD1 ILE A 120 -18.247 -5.250 -0.705 1.00 0.00 C ATOM 0 H ILE A 120 -15.652 -5.924 1.633 1.00 0.00 H new ATOM 0 HA ILE A 120 -17.700 -7.641 0.418 1.00 0.00 H new ATOM 0 HB ILE A 120 -15.077 -6.693 -0.749 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -16.265 -4.676 -0.148 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -16.486 -4.917 -1.870 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -16.269 -7.102 -2.881 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -16.186 -8.576 -1.887 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -17.700 -7.643 -1.972 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -18.580 -4.217 -0.807 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -18.734 -5.864 -1.462 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -18.509 -5.620 0.286 1.00 0.00 H new ATOM 1923 N PRO A 121 -16.376 -9.834 0.692 1.00 0.00 N ATOM 1924 CA PRO A 121 -15.678 -11.066 1.061 1.00 0.00 C ATOM 1925 C PRO A 121 -14.769 -11.635 -0.034 1.00 0.00 C ATOM 1926 O PRO A 121 -14.250 -12.750 0.100 1.00 0.00 O ATOM 1927 CB PRO A 121 -16.833 -12.009 1.322 1.00 0.00 C ATOM 1928 CG PRO A 121 -17.878 -11.594 0.343 1.00 0.00 C ATOM 1929 CD PRO A 121 -17.725 -10.112 0.156 1.00 0.00 C ATOM 0 HA PRO A 121 -14.997 -10.906 1.897 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -16.539 -13.048 1.173 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -17.192 -11.923 2.347 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -17.752 -12.119 -0.604 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -18.874 -11.837 0.713 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -17.806 -9.829 -0.894 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -18.493 -9.558 0.695 1.00 0.00 H new ATOM 1937 N PHE A 122 -14.579 -10.893 -1.092 1.00 0.00 N ATOM 1938 CA PHE A 122 -13.776 -11.345 -2.208 1.00 0.00 C ATOM 1939 C PHE A 122 -13.451 -10.166 -3.082 1.00 0.00 C ATOM 1940 O PHE A 122 -14.333 -9.372 -3.389 1.00 0.00 O ATOM 1941 CB PHE A 122 -14.555 -12.403 -3.026 1.00 0.00 C ATOM 1942 CG PHE A 122 -13.800 -12.976 -4.197 1.00 0.00 C ATOM 1943 CD1 PHE A 122 -12.885 -13.997 -4.013 1.00 0.00 C ATOM 1944 CD2 PHE A 122 -14.010 -12.494 -5.478 1.00 0.00 C ATOM 1945 CE1 PHE A 122 -12.194 -14.524 -5.082 1.00 0.00 C ATOM 1946 CE2 PHE A 122 -13.323 -13.019 -6.550 1.00 0.00 C ATOM 1947 CZ PHE A 122 -12.414 -14.035 -6.352 1.00 0.00 C ATOM 0 H PHE A 122 -14.973 -9.960 -1.209 1.00 0.00 H new ATOM 0 HA PHE A 122 -12.856 -11.797 -1.838 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -14.840 -13.218 -2.361 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -15.478 -11.952 -3.392 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -12.710 -14.385 -3.020 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -14.721 -11.697 -5.638 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -11.481 -15.320 -4.925 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -13.497 -12.635 -7.544 1.00 0.00 H new ATOM 0 HZ PHE A 122 -11.874 -14.448 -7.191 1.00 0.00 H new ATOM 1957 N ARG A 123 -12.204 -10.028 -3.471 1.00 0.00 N ATOM 1958 CA ARG A 123 -11.840 -8.952 -4.339 1.00 0.00 C ATOM 1959 C ARG A 123 -10.614 -9.332 -5.160 1.00 0.00 C ATOM 1960 O ARG A 123 -9.688 -9.966 -4.650 1.00 0.00 O ATOM 1961 CB ARG A 123 -11.564 -7.670 -3.532 1.00 0.00 C ATOM 1962 CG ARG A 123 -11.590 -6.379 -4.354 1.00 0.00 C ATOM 1963 CD ARG A 123 -13.026 -5.955 -4.729 1.00 0.00 C ATOM 1964 NE ARG A 123 -13.742 -6.941 -5.552 1.00 0.00 N ATOM 1965 CZ ARG A 123 -15.072 -7.057 -5.650 1.00 0.00 C ATOM 1966 NH1 ARG A 123 -15.885 -6.193 -5.033 1.00 0.00 N ATOM 1967 NH2 ARG A 123 -15.576 -8.034 -6.381 1.00 0.00 N ATOM 0 H ARG A 123 -11.438 -10.644 -3.199 1.00 0.00 H new ATOM 0 HA ARG A 123 -12.673 -8.759 -5.015 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -12.304 -7.592 -2.735 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -10.589 -7.761 -3.054 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -11.113 -5.580 -3.787 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -11.005 -6.517 -5.263 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -13.593 -5.779 -3.815 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -12.986 -5.008 -5.267 1.00 0.00 H new ATOM 0 HE ARG A 123 -13.176 -7.593 -6.095 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -15.494 -5.432 -4.478 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -16.896 -6.295 -5.118 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -14.954 -8.685 -6.860 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -16.587 -8.137 -6.467 1.00 0.00 H new ATOM 1981 N THR A 124 -10.645 -9.014 -6.432 1.00 0.00 N ATOM 1982 CA THR A 124 -9.521 -9.207 -7.301 1.00 0.00 C ATOM 1983 C THR A 124 -9.016 -7.802 -7.743 1.00 0.00 C ATOM 1984 O THR A 124 -9.648 -6.799 -7.395 1.00 0.00 O ATOM 1985 CB THR A 124 -9.938 -10.105 -8.489 1.00 0.00 C ATOM 1986 OG1 THR A 124 -10.716 -11.203 -7.971 1.00 0.00 O ATOM 1987 CG2 THR A 124 -8.719 -10.672 -9.193 1.00 0.00 C ATOM 0 H THR A 124 -11.461 -8.611 -6.892 1.00 0.00 H new ATOM 0 HA THR A 124 -8.701 -9.720 -6.799 1.00 0.00 H new ATOM 0 HB THR A 124 -10.510 -9.510 -9.201 1.00 0.00 H new ATOM 0 HG1 THR A 124 -11.635 -10.904 -7.808 1.00 0.00 H new ATOM 0 HG21 THR A 124 -9.038 -11.300 -10.025 1.00 0.00 H new ATOM 0 HG22 THR A 124 -8.104 -9.855 -9.571 1.00 0.00 H new ATOM 0 HG23 THR A 124 -8.138 -11.269 -8.490 1.00 0.00 H new ATOM 1995 N LYS A 125 -7.927 -7.717 -8.510 1.00 0.00 N ATOM 1996 CA LYS A 125 -7.279 -6.446 -8.783 1.00 0.00 C ATOM 1997 C LYS A 125 -8.082 -5.497 -9.665 1.00 0.00 C ATOM 1998 O LYS A 125 -8.137 -4.300 -9.392 1.00 0.00 O ATOM 1999 CB LYS A 125 -5.809 -6.650 -9.243 1.00 0.00 C ATOM 2000 CG LYS A 125 -5.557 -7.577 -10.460 1.00 0.00 C ATOM 2001 CD LYS A 125 -5.962 -6.964 -11.798 1.00 0.00 C ATOM 2002 CE LYS A 125 -5.142 -5.727 -12.138 1.00 0.00 C ATOM 2003 NZ LYS A 125 -3.700 -6.015 -12.362 1.00 0.00 N ATOM 0 H LYS A 125 -7.479 -8.520 -8.951 1.00 0.00 H new ATOM 0 HA LYS A 125 -7.242 -5.915 -7.832 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -5.391 -5.670 -9.475 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -5.245 -7.045 -8.398 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -4.499 -7.835 -10.495 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -6.107 -8.507 -10.316 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -5.840 -7.706 -12.587 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -7.019 -6.700 -11.769 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -5.555 -5.262 -13.033 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -5.239 -5.003 -11.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -3.234 -5.171 -12.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -3.253 -6.272 -11.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -3.604 -6.804 -13.032 1.00 0.00 H new ATOM 2017 N ALA A 126 -8.769 -6.029 -10.650 1.00 0.00 N ATOM 2018 CA ALA A 126 -9.521 -5.183 -11.562 1.00 0.00 C ATOM 2019 C ALA A 126 -10.811 -4.796 -10.917 1.00 0.00 C ATOM 2020 O ALA A 126 -11.372 -3.730 -11.179 1.00 0.00 O ATOM 2021 CB ALA A 126 -9.771 -5.884 -12.875 1.00 0.00 C ATOM 0 H ALA A 126 -8.826 -7.029 -10.843 1.00 0.00 H new ATOM 0 HA ALA A 126 -8.938 -4.287 -11.777 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -10.335 -5.227 -13.537 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -8.818 -6.136 -13.340 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -10.340 -6.796 -12.698 1.00 0.00 H new ATOM 2027 N GLU A 127 -11.250 -5.648 -10.022 1.00 0.00 N ATOM 2028 CA GLU A 127 -12.462 -5.407 -9.301 1.00 0.00 C ATOM 2029 C GLU A 127 -12.222 -4.320 -8.279 1.00 0.00 C ATOM 2030 O GLU A 127 -13.089 -3.504 -8.009 1.00 0.00 O ATOM 2031 CB GLU A 127 -12.892 -6.636 -8.588 1.00 0.00 C ATOM 2032 CG GLU A 127 -12.808 -7.895 -9.387 1.00 0.00 C ATOM 2033 CD GLU A 127 -13.472 -9.000 -8.641 1.00 0.00 C ATOM 2034 OE1 GLU A 127 -13.082 -9.232 -7.488 1.00 0.00 O ATOM 2035 OE2 GLU A 127 -14.413 -9.618 -9.156 1.00 0.00 O ATOM 0 H GLU A 127 -10.777 -6.519 -9.779 1.00 0.00 H new ATOM 0 HA GLU A 127 -13.237 -5.107 -10.007 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -12.281 -6.751 -7.693 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -13.922 -6.503 -8.256 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -13.287 -7.756 -10.356 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -11.765 -8.147 -9.580 1.00 0.00 H new ATOM 2042 N PHE A 128 -11.024 -4.328 -7.713 1.00 0.00 N ATOM 2043 CA PHE A 128 -10.614 -3.356 -6.743 1.00 0.00 C ATOM 2044 C PHE A 128 -10.649 -1.960 -7.338 1.00 0.00 C ATOM 2045 O PHE A 128 -11.293 -1.073 -6.799 1.00 0.00 O ATOM 2046 CB PHE A 128 -9.210 -3.689 -6.225 1.00 0.00 C ATOM 2047 CG PHE A 128 -8.676 -2.675 -5.271 1.00 0.00 C ATOM 2048 CD1 PHE A 128 -8.017 -1.559 -5.745 1.00 0.00 C ATOM 2049 CD2 PHE A 128 -8.846 -2.829 -3.913 1.00 0.00 C ATOM 2050 CE1 PHE A 128 -7.542 -0.606 -4.883 1.00 0.00 C ATOM 2051 CE2 PHE A 128 -8.371 -1.882 -3.033 1.00 0.00 C ATOM 2052 CZ PHE A 128 -7.718 -0.767 -3.517 1.00 0.00 C ATOM 0 H PHE A 128 -10.309 -5.024 -7.926 1.00 0.00 H new ATOM 0 HA PHE A 128 -11.310 -3.384 -5.905 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -9.233 -4.662 -5.735 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -8.529 -3.775 -7.072 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -7.874 -1.435 -6.808 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -9.357 -3.702 -3.534 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -7.033 0.266 -5.265 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -8.509 -2.011 -1.970 1.00 0.00 H new ATOM 0 HZ PHE A 128 -7.344 -0.020 -2.832 1.00 0.00 H new ATOM 2062 N GLU A 129 -9.958 -1.766 -8.448 1.00 0.00 N ATOM 2063 CA GLU A 129 -9.937 -0.469 -9.079 1.00 0.00 C ATOM 2064 C GLU A 129 -11.333 -0.068 -9.558 1.00 0.00 C ATOM 2065 O GLU A 129 -11.640 1.109 -9.631 1.00 0.00 O ATOM 2066 CB GLU A 129 -8.907 -0.386 -10.215 1.00 0.00 C ATOM 2067 CG GLU A 129 -9.040 -1.481 -11.238 1.00 0.00 C ATOM 2068 CD GLU A 129 -8.452 -1.116 -12.579 1.00 0.00 C ATOM 2069 OE1 GLU A 129 -9.180 -0.512 -13.412 1.00 0.00 O ATOM 2070 OE2 GLU A 129 -7.281 -1.427 -12.842 1.00 0.00 O ATOM 0 H GLU A 129 -9.411 -2.485 -8.922 1.00 0.00 H new ATOM 0 HA GLU A 129 -9.621 0.248 -8.322 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -9.007 0.578 -10.714 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -7.905 -0.421 -9.787 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -8.548 -2.379 -10.865 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -10.095 -1.725 -11.365 1.00 0.00 H new ATOM 2077 N ASP A 130 -12.183 -1.060 -9.823 1.00 0.00 N ATOM 2078 CA ASP A 130 -13.563 -0.809 -10.257 1.00 0.00 C ATOM 2079 C ASP A 130 -14.386 -0.253 -9.108 1.00 0.00 C ATOM 2080 O ASP A 130 -15.071 0.762 -9.238 1.00 0.00 O ATOM 2081 CB ASP A 130 -14.223 -2.088 -10.750 1.00 0.00 C ATOM 2082 CG ASP A 130 -15.631 -1.860 -11.274 1.00 0.00 C ATOM 2083 OD1 ASP A 130 -16.589 -1.889 -10.488 1.00 0.00 O ATOM 2084 OD2 ASP A 130 -15.802 -1.674 -12.489 1.00 0.00 O ATOM 0 H ASP A 130 -11.942 -2.048 -9.745 1.00 0.00 H new ATOM 0 HA ASP A 130 -13.523 -0.086 -11.072 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -13.613 -2.525 -11.540 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -14.256 -2.812 -9.936 1.00 0.00 H new ATOM 2089 N VAL A 131 -14.313 -0.907 -7.979 1.00 0.00 N ATOM 2090 CA VAL A 131 -15.039 -0.445 -6.817 1.00 0.00 C ATOM 2091 C VAL A 131 -14.442 0.884 -6.315 1.00 0.00 C ATOM 2092 O VAL A 131 -15.157 1.770 -5.863 1.00 0.00 O ATOM 2093 CB VAL A 131 -15.123 -1.536 -5.690 1.00 0.00 C ATOM 2094 CG1 VAL A 131 -13.764 -1.980 -5.228 1.00 0.00 C ATOM 2095 CG2 VAL A 131 -15.954 -1.063 -4.512 1.00 0.00 C ATOM 0 H VAL A 131 -13.764 -1.755 -7.835 1.00 0.00 H new ATOM 0 HA VAL A 131 -16.071 -0.258 -7.113 1.00 0.00 H new ATOM 0 HB VAL A 131 -15.621 -2.398 -6.134 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -13.873 -2.734 -4.449 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -13.214 -2.403 -6.069 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -13.217 -1.125 -4.831 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -15.988 -1.845 -3.754 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -15.505 -0.165 -4.087 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -16.966 -0.838 -4.848 1.00 0.00 H new ATOM 2105 N ILE A 132 -13.144 1.039 -6.474 1.00 0.00 N ATOM 2106 CA ILE A 132 -12.459 2.258 -6.098 1.00 0.00 C ATOM 2107 C ILE A 132 -12.821 3.438 -7.017 1.00 0.00 C ATOM 2108 O ILE A 132 -13.013 4.560 -6.532 1.00 0.00 O ATOM 2109 CB ILE A 132 -10.910 2.042 -5.962 1.00 0.00 C ATOM 2110 CG1 ILE A 132 -10.523 1.722 -4.498 1.00 0.00 C ATOM 2111 CG2 ILE A 132 -10.103 3.219 -6.492 1.00 0.00 C ATOM 2112 CD1 ILE A 132 -11.227 0.524 -3.890 1.00 0.00 C ATOM 0 H ILE A 132 -12.534 0.323 -6.868 1.00 0.00 H new ATOM 0 HA ILE A 132 -12.818 2.532 -5.106 1.00 0.00 H new ATOM 0 HB ILE A 132 -10.658 1.184 -6.585 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -9.447 1.553 -4.452 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -10.734 2.597 -3.884 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -9.039 3.014 -6.372 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.327 3.368 -7.548 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -10.364 4.119 -5.935 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -10.887 0.384 -2.864 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -12.304 0.693 -3.896 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -10.997 -0.368 -4.473 1.00 0.00 H new ATOM 2124 N GLU A 133 -12.967 3.186 -8.323 1.00 0.00 N ATOM 2125 CA GLU A 133 -13.346 4.252 -9.255 1.00 0.00 C ATOM 2126 C GLU A 133 -14.754 4.725 -8.966 1.00 0.00 C ATOM 2127 O GLU A 133 -15.103 5.888 -9.175 1.00 0.00 O ATOM 2128 CB GLU A 133 -13.172 3.859 -10.714 1.00 0.00 C ATOM 2129 CG GLU A 133 -13.964 2.681 -11.166 1.00 0.00 C ATOM 2130 CD GLU A 133 -13.680 2.298 -12.589 1.00 0.00 C ATOM 2131 OE1 GLU A 133 -12.539 1.898 -12.894 1.00 0.00 O ATOM 2132 OE2 GLU A 133 -14.574 2.425 -13.450 1.00 0.00 O ATOM 0 H GLU A 133 -12.831 2.271 -8.752 1.00 0.00 H new ATOM 0 HA GLU A 133 -12.659 5.082 -9.092 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -13.440 4.713 -11.335 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -12.116 3.654 -10.892 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -13.747 1.833 -10.517 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -15.026 2.901 -11.059 1.00 0.00 H new ATOM 2139 N HIS A 134 -15.540 3.817 -8.460 1.00 0.00 N ATOM 2140 CA HIS A 134 -16.841 4.115 -7.955 1.00 0.00 C ATOM 2141 C HIS A 134 -16.711 5.022 -6.744 1.00 0.00 C ATOM 2142 O HIS A 134 -17.216 6.119 -6.731 1.00 0.00 O ATOM 2143 CB HIS A 134 -17.519 2.825 -7.553 1.00 0.00 C ATOM 2144 CG HIS A 134 -18.316 2.170 -8.612 1.00 0.00 C ATOM 2145 ND1 HIS A 134 -17.814 1.283 -9.538 1.00 0.00 N ATOM 2146 CD2 HIS A 134 -19.629 2.281 -8.865 1.00 0.00 C ATOM 2147 CE1 HIS A 134 -18.820 0.894 -10.317 1.00 0.00 C ATOM 2148 NE2 HIS A 134 -19.959 1.474 -9.950 1.00 0.00 N ATOM 0 H HIS A 134 -15.285 2.832 -8.388 1.00 0.00 H new ATOM 0 HA HIS A 134 -17.433 4.617 -8.720 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -16.757 2.125 -7.210 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -18.171 3.027 -6.703 1.00 0.00 H new ATOM 0 HD1 HIS A 134 -16.843 0.978 -9.613 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -20.321 2.900 -8.313 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -18.724 0.199 -11.138 1.00 0.00 H new ATOM 2156 N MET A 135 -15.979 4.562 -5.755 1.00 0.00 N ATOM 2157 CA MET A 135 -15.788 5.299 -4.496 1.00 0.00 C ATOM 2158 C MET A 135 -15.299 6.736 -4.723 1.00 0.00 C ATOM 2159 O MET A 135 -15.807 7.680 -4.112 1.00 0.00 O ATOM 2160 CB MET A 135 -14.823 4.566 -3.575 1.00 0.00 C ATOM 2161 CG MET A 135 -15.230 3.145 -3.166 1.00 0.00 C ATOM 2162 SD MET A 135 -16.829 3.024 -2.323 1.00 0.00 S ATOM 2163 CE MET A 135 -18.008 2.863 -3.676 1.00 0.00 C ATOM 0 H MET A 135 -15.492 3.666 -5.787 1.00 0.00 H new ATOM 0 HA MET A 135 -16.768 5.354 -4.021 1.00 0.00 H new ATOM 0 HB2 MET A 135 -13.851 4.517 -4.065 1.00 0.00 H new ATOM 0 HB3 MET A 135 -14.694 5.160 -2.670 1.00 0.00 H new ATOM 0 HG2 MET A 135 -15.258 2.519 -4.058 1.00 0.00 H new ATOM 0 HG3 MET A 135 -14.459 2.735 -2.513 1.00 0.00 H new ATOM 0 HE1 MET A 135 -18.840 2.233 -3.361 1.00 0.00 H new ATOM 0 HE2 MET A 135 -18.383 3.849 -3.951 1.00 0.00 H new ATOM 0 HE3 MET A 135 -17.515 2.410 -4.536 1.00 0.00 H new ATOM 2173 N LYS A 136 -14.366 6.915 -5.637 1.00 0.00 N ATOM 2174 CA LYS A 136 -13.836 8.244 -5.911 1.00 0.00 C ATOM 2175 C LYS A 136 -14.859 9.186 -6.565 1.00 0.00 C ATOM 2176 O LYS A 136 -14.703 10.403 -6.529 1.00 0.00 O ATOM 2177 CB LYS A 136 -12.524 8.214 -6.676 1.00 0.00 C ATOM 2178 CG LYS A 136 -12.593 7.476 -7.975 1.00 0.00 C ATOM 2179 CD LYS A 136 -11.268 7.494 -8.710 1.00 0.00 C ATOM 2180 CE LYS A 136 -10.142 6.883 -7.890 1.00 0.00 C ATOM 2181 NZ LYS A 136 -8.878 6.828 -8.653 1.00 0.00 N ATOM 0 H LYS A 136 -13.960 6.168 -6.200 1.00 0.00 H new ATOM 0 HA LYS A 136 -13.617 8.666 -4.930 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -12.204 9.238 -6.868 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -11.760 7.754 -6.049 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -12.891 6.444 -7.790 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -13.363 7.922 -8.605 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -11.368 6.948 -9.648 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -11.011 8.522 -8.966 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -9.994 7.468 -6.982 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -10.423 5.877 -7.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -8.134 6.406 -8.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -9.013 6.249 -9.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -8.597 7.791 -8.929 1.00 0.00 H new ATOM 2195 N THR A 137 -15.909 8.644 -7.162 1.00 0.00 N ATOM 2196 CA THR A 137 -16.941 9.506 -7.689 1.00 0.00 C ATOM 2197 C THR A 137 -17.929 9.818 -6.549 1.00 0.00 C ATOM 2198 O THR A 137 -18.572 10.862 -6.521 1.00 0.00 O ATOM 2199 CB THR A 137 -17.668 8.910 -8.955 1.00 0.00 C ATOM 2200 OG1 THR A 137 -18.328 9.961 -9.675 1.00 0.00 O ATOM 2201 CG2 THR A 137 -18.724 7.873 -8.592 1.00 0.00 C ATOM 0 H THR A 137 -16.063 7.644 -7.289 1.00 0.00 H new ATOM 0 HA THR A 137 -16.479 10.426 -8.049 1.00 0.00 H new ATOM 0 HB THR A 137 -16.896 8.430 -9.557 1.00 0.00 H new ATOM 0 HG1 THR A 137 -18.777 9.587 -10.462 1.00 0.00 H new ATOM 0 HG21 THR A 137 -19.192 7.497 -9.502 1.00 0.00 H new ATOM 0 HG22 THR A 137 -18.254 7.047 -8.057 1.00 0.00 H new ATOM 0 HG23 THR A 137 -19.482 8.332 -7.957 1.00 0.00 H new ATOM 2209 N TYR A 138 -17.977 8.920 -5.567 1.00 0.00 N ATOM 2210 CA TYR A 138 -18.811 9.096 -4.401 1.00 0.00 C ATOM 2211 C TYR A 138 -18.141 9.930 -3.348 1.00 0.00 C ATOM 2212 O TYR A 138 -18.736 10.223 -2.305 1.00 0.00 O ATOM 2213 CB TYR A 138 -19.230 7.781 -3.813 1.00 0.00 C ATOM 2214 CG TYR A 138 -20.243 7.071 -4.622 1.00 0.00 C ATOM 2215 CD1 TYR A 138 -21.563 7.413 -4.516 1.00 0.00 C ATOM 2216 CD2 TYR A 138 -19.888 6.062 -5.472 1.00 0.00 C ATOM 2217 CE1 TYR A 138 -22.528 6.756 -5.258 1.00 0.00 C ATOM 2218 CE2 TYR A 138 -20.819 5.390 -6.212 1.00 0.00 C ATOM 2219 CZ TYR A 138 -22.145 5.739 -6.108 1.00 0.00 C ATOM 2220 OH TYR A 138 -23.092 5.038 -6.817 1.00 0.00 O ATOM 0 H TYR A 138 -17.437 8.055 -5.566 1.00 0.00 H new ATOM 0 HA TYR A 138 -19.701 9.625 -4.743 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -18.352 7.144 -3.704 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -19.628 7.949 -2.812 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -21.856 8.206 -3.844 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -18.847 5.789 -5.561 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -23.568 7.036 -5.173 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -20.516 4.591 -6.873 1.00 0.00 H new ATOM 0 HH TYR A 138 -23.958 5.491 -6.743 1.00 0.00 H new ATOM 2230 N SER A 139 -16.916 10.318 -3.614 1.00 0.00 N ATOM 2231 CA SER A 139 -16.125 11.206 -2.742 1.00 0.00 C ATOM 2232 C SER A 139 -16.678 12.644 -2.717 1.00 0.00 C ATOM 2233 O SER A 139 -15.970 13.588 -2.377 1.00 0.00 O ATOM 2234 CB SER A 139 -14.684 11.201 -3.228 1.00 0.00 C ATOM 2235 OG SER A 139 -14.211 9.868 -3.352 1.00 0.00 O ATOM 0 H SER A 139 -16.416 10.029 -4.455 1.00 0.00 H new ATOM 0 HA SER A 139 -16.185 10.832 -1.720 1.00 0.00 H new ATOM 0 HB2 SER A 139 -14.616 11.709 -4.190 1.00 0.00 H new ATOM 0 HB3 SER A 139 -14.056 11.754 -2.530 1.00 0.00 H new ATOM 0 HG SER A 139 -13.242 9.850 -3.210 1.00 0.00 H new ATOM 2241 N GLY A 140 -17.943 12.771 -2.982 1.00 0.00 N ATOM 2242 CA GLY A 140 -18.558 14.069 -3.038 1.00 0.00 C ATOM 2243 C GLY A 140 -18.534 14.628 -4.435 1.00 0.00 C ATOM 2244 O GLY A 140 -19.427 15.429 -4.781 1.00 0.00 O ATOM 2245 OXT GLY A 140 -17.636 14.256 -5.227 1.00 0.00 O ATOM 0 H GLY A 140 -18.574 11.991 -3.164 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -19.589 14.000 -2.690 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -18.038 14.749 -2.363 1.00 0.00 H new