USER MOD reduce.3.24.130724 H: found=0, std=0, add=1184, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1180 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: B 5 GLN : amide:sc= 0.791 K(o=-2.5,f=-1.7) USER MOD Set 1.2: B 9 HIS : no HE2:sc= -3.3! K(o=-2.5!,f=-0.34) USER MOD Set 2.1: A 140 MET CE :methyl -164:sc= -2.27 (180deg=-3.21!) USER MOD Set 2.2: A 141 MET CE :methyl 162:sc= -0.465 (180deg=-0.559) USER MOD Set 3.1: A 105 MET CE :methyl -150:sc= -0.708 (180deg=-3.77!) USER MOD Set 3.2: A 120 MET CE :methyl -165:sc= -0.109 (180deg=-0.653) USER MOD Set 3.3: B 7 THR OG1 : rot 93:sc= 0.747 USER MOD Set 4.1: A 73 LYS NZ :NH3+ -179:sc= 1.05 (180deg=1.01) USER MOD Set 4.2: A 75 THR OG1 : rot 180:sc= 0.0135 USER MOD Set 5.1: A 22 THR OG1 : rot -150:sc= 0 USER MOD Set 5.2: A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 GLN : amide:sc= -0.0184 X(o=-0.018,f=0) USER MOD Single : A 9 LYS NZ :NH3+ -162:sc= -0.0294 (180deg=-0.364) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot -55:sc= 1.14 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0.00352 USER MOD Single : A 26 LYS NZ :NH3+ 152:sc= 1.28 (180deg=-0.0441!) USER MOD Single : A 30 THR OG1 : rot 87:sc= 0.64 USER MOD Single : A 32 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 70:sc= 1.22 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 ASN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc=-0.00413 X(o=-0.0041,f=0.13) USER MOD Single : A 47 MET CE :methyl -179:sc= -0.0209 (180deg=-0.0211) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=-0.093) USER MOD Single : A 56 ASN : amide:sc= 0.758 K(o=0.76,f=-8.6!) USER MOD Single : A 66 THR OG1 : rot 86:sc= 1.28 USER MOD Single : A 67 MET CE :methyl -163:sc= -0.0123 (180deg=-0.226) USER MOD Single : A 68 MET CE :methyl -119:sc=-0.00528 (180deg=-0.749) USER MOD Single : A 71 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.121) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 ASN : amide:sc= 0.087 K(o=0.087,f=-2.6) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -52:sc= 0.781 USER MOD Single : A 103 HIS : no HD1:sc= -1.5 K(o=-1.5,f=-0.84) USER MOD Single : A 106 THR OG1 : rot 68:sc= 0.457 USER MOD Single : A 107 ASN : amide:sc= 1.08 K(o=1.1,f=-0.23) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 167:sc= 1.19 USER MOD Single : A 131 GLN : amide:sc= -0.117 K(o=-0.12,f=-0.84) USER MOD Single : A 133 ASN : amide:sc= 0.252 K(o=0.25,f=-3.1!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= -0.122 K(o=-0.12,f=-1!) USER MOD Single : A 142 THR OG1 : rot 74:sc= 0.864 USER MOD Single : B 1 ARG N :NH3+ -165:sc= 1.31 (180deg=0.912) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 LYS NZ :NH3+ -173:sc= 1.23 (180deg=1.08) USER MOD ----------------------------------------------------------------- ATOM 29 N GLU A 3 0.644 2.697 15.421 1.00 0.00 N ATOM 30 CA GLU A 3 -0.352 1.988 14.679 1.00 0.00 C ATOM 31 C GLU A 3 -0.073 1.854 13.222 1.00 0.00 C ATOM 32 O GLU A 3 -0.322 0.790 12.657 1.00 0.00 O ATOM 33 CB GLU A 3 -1.789 2.438 14.994 1.00 0.00 C ATOM 34 CG GLU A 3 -2.299 3.711 14.317 1.00 0.00 C ATOM 35 CD GLU A 3 -1.565 4.941 14.830 1.00 0.00 C ATOM 36 OE1 GLU A 3 -1.924 5.459 15.921 1.00 0.00 O ATOM 37 OE2 GLU A 3 -0.552 5.364 14.211 1.00 0.00 O ATOM 0 HA GLU A 3 -0.278 0.966 15.051 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -2.462 1.623 14.727 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -1.868 2.576 16.072 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -2.167 3.630 13.238 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -3.368 3.820 14.500 1.00 0.00 H new ATOM 44 N GLN A 4 0.599 2.852 12.620 1.00 0.00 N ATOM 45 CA GLN A 4 1.064 2.839 11.267 1.00 0.00 C ATOM 46 C GLN A 4 2.119 1.788 11.224 1.00 0.00 C ATOM 47 O GLN A 4 2.060 0.905 10.369 1.00 0.00 O ATOM 48 CB GLN A 4 1.618 4.220 10.878 1.00 0.00 C ATOM 49 CG GLN A 4 1.922 4.409 9.390 1.00 0.00 C ATOM 50 CD GLN A 4 2.580 5.752 9.108 1.00 0.00 C ATOM 51 OE1 GLN A 4 2.001 6.816 9.319 1.00 0.00 O ATOM 52 NE2 GLN A 4 3.926 5.749 8.912 1.00 0.00 N ATOM 0 H GLN A 4 0.831 3.718 13.106 1.00 0.00 H new ATOM 0 HA GLN A 4 0.267 2.623 10.555 1.00 0.00 H new ATOM 0 HB2 GLN A 4 0.900 4.980 11.184 1.00 0.00 H new ATOM 0 HB3 GLN A 4 2.532 4.399 11.444 1.00 0.00 H new ATOM 0 HG2 GLN A 4 2.576 3.606 9.049 1.00 0.00 H new ATOM 0 HG3 GLN A 4 0.997 4.331 8.818 1.00 0.00 H new ATOM 0 HE21 GLN A 4 4.414 4.871 8.736 1.00 0.00 H new ATOM 0 HE22 GLN A 4 4.447 6.625 8.941 1.00 0.00 H new ATOM 61 N ILE A 5 3.099 1.762 12.144 1.00 0.00 N ATOM 62 CA ILE A 5 4.110 0.755 12.248 1.00 0.00 C ATOM 63 C ILE A 5 3.558 -0.626 12.329 1.00 0.00 C ATOM 64 O ILE A 5 4.009 -1.506 11.597 1.00 0.00 O ATOM 65 CB ILE A 5 5.175 0.987 13.278 1.00 0.00 C ATOM 66 CG1 ILE A 5 5.786 2.399 13.291 1.00 0.00 C ATOM 67 CG2 ILE A 5 6.331 -0.014 13.120 1.00 0.00 C ATOM 68 CD1 ILE A 5 6.814 2.634 12.185 1.00 0.00 C ATOM 0 H ILE A 5 3.191 2.486 12.857 1.00 0.00 H new ATOM 0 HA ILE A 5 4.633 0.853 11.296 1.00 0.00 H new ATOM 0 HB ILE A 5 4.645 0.852 14.221 1.00 0.00 H new ATOM 0 HG12 ILE A 5 4.986 3.132 13.193 1.00 0.00 H new ATOM 0 HG13 ILE A 5 6.259 2.571 14.258 1.00 0.00 H new ATOM 0 HG21 ILE A 5 7.087 0.180 13.881 1.00 0.00 H new ATOM 0 HG22 ILE A 5 5.952 -1.029 13.236 1.00 0.00 H new ATOM 0 HG23 ILE A 5 6.775 0.096 12.131 1.00 0.00 H new ATOM 0 HD11 ILE A 5 7.201 3.650 12.258 1.00 0.00 H new ATOM 0 HD12 ILE A 5 7.635 1.925 12.294 1.00 0.00 H new ATOM 0 HD13 ILE A 5 6.341 2.495 11.213 1.00 0.00 H new ATOM 80 N ALA A 6 2.598 -0.881 13.237 1.00 0.00 N ATOM 81 CA ALA A 6 1.960 -2.152 13.386 1.00 0.00 C ATOM 82 C ALA A 6 1.419 -2.753 12.135 1.00 0.00 C ATOM 83 O ALA A 6 1.798 -3.848 11.722 1.00 0.00 O ATOM 84 CB ALA A 6 0.762 -2.019 14.340 1.00 0.00 C ATOM 0 H ALA A 6 2.254 -0.177 13.890 1.00 0.00 H new ATOM 0 HA ALA A 6 2.753 -2.803 13.754 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.277 -2.989 14.452 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.109 -1.672 15.313 1.00 0.00 H new ATOM 0 HB3 ALA A 6 0.050 -1.302 13.932 1.00 0.00 H new ATOM 90 N GLU A 7 0.672 -1.980 11.327 1.00 0.00 N ATOM 91 CA GLU A 7 0.145 -2.517 10.111 1.00 0.00 C ATOM 92 C GLU A 7 1.185 -2.647 9.052 1.00 0.00 C ATOM 93 O GLU A 7 1.051 -3.366 8.062 1.00 0.00 O ATOM 94 CB GLU A 7 -1.092 -1.785 9.565 1.00 0.00 C ATOM 95 CG GLU A 7 -0.854 -0.338 9.128 1.00 0.00 C ATOM 96 CD GLU A 7 -2.139 0.440 8.883 1.00 0.00 C ATOM 97 OE1 GLU A 7 -3.155 0.171 9.579 1.00 0.00 O ATOM 98 OE2 GLU A 7 -2.122 1.378 8.042 1.00 0.00 O ATOM 0 H GLU A 7 0.436 -1.004 11.509 1.00 0.00 H new ATOM 0 HA GLU A 7 -0.197 -3.513 10.392 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -1.480 -2.345 8.714 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -1.867 -1.793 10.332 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -0.269 0.173 9.893 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -0.257 -0.335 8.216 1.00 0.00 H new ATOM 105 N PHE A 8 2.317 -1.933 9.184 1.00 0.00 N ATOM 106 CA PHE A 8 3.494 -2.113 8.393 1.00 0.00 C ATOM 107 C PHE A 8 4.211 -3.350 8.813 1.00 0.00 C ATOM 108 O PHE A 8 4.743 -4.059 7.960 1.00 0.00 O ATOM 109 CB PHE A 8 4.473 -0.926 8.382 1.00 0.00 C ATOM 110 CG PHE A 8 4.218 0.230 7.478 1.00 0.00 C ATOM 111 CD1 PHE A 8 3.747 0.118 6.191 1.00 0.00 C ATOM 112 CD2 PHE A 8 4.603 1.481 7.901 1.00 0.00 C ATOM 113 CE1 PHE A 8 3.749 1.218 5.366 1.00 0.00 C ATOM 114 CE2 PHE A 8 4.654 2.590 7.090 1.00 0.00 C ATOM 115 CZ PHE A 8 4.207 2.441 5.798 1.00 0.00 C ATOM 0 H PHE A 8 2.416 -1.192 9.878 1.00 0.00 H new ATOM 0 HA PHE A 8 3.130 -2.196 7.369 1.00 0.00 H new ATOM 0 HB2 PHE A 8 4.527 -0.539 9.399 1.00 0.00 H new ATOM 0 HB3 PHE A 8 5.460 -1.319 8.138 1.00 0.00 H new ATOM 0 HD1 PHE A 8 3.377 -0.830 5.830 1.00 0.00 H new ATOM 0 HD2 PHE A 8 4.883 1.600 8.937 1.00 0.00 H new ATOM 0 HE1 PHE A 8 3.382 1.119 4.355 1.00 0.00 H new ATOM 0 HE2 PHE A 8 5.029 3.536 7.452 1.00 0.00 H new ATOM 0 HZ PHE A 8 4.216 3.284 5.123 1.00 0.00 H new ATOM 125 N LYS A 9 4.251 -3.669 10.119 1.00 0.00 N ATOM 126 CA LYS A 9 4.883 -4.777 10.766 1.00 0.00 C ATOM 127 C LYS A 9 4.334 -6.099 10.353 1.00 0.00 C ATOM 128 O LYS A 9 5.122 -7.024 10.161 1.00 0.00 O ATOM 129 CB LYS A 9 4.784 -4.685 12.298 1.00 0.00 C ATOM 130 CG LYS A 9 5.791 -5.463 13.147 1.00 0.00 C ATOM 131 CD LYS A 9 5.486 -5.048 14.588 1.00 0.00 C ATOM 132 CE LYS A 9 6.212 -5.900 15.631 1.00 0.00 C ATOM 133 NZ LYS A 9 5.680 -7.279 15.549 1.00 0.00 N ATOM 0 H LYS A 9 3.781 -3.074 10.802 1.00 0.00 H new ATOM 0 HA LYS A 9 5.924 -4.714 10.449 1.00 0.00 H new ATOM 0 HB2 LYS A 9 4.864 -3.633 12.572 1.00 0.00 H new ATOM 0 HB3 LYS A 9 3.785 -5.014 12.585 1.00 0.00 H new ATOM 0 HG2 LYS A 9 5.676 -6.538 13.012 1.00 0.00 H new ATOM 0 HG3 LYS A 9 6.816 -5.215 12.872 1.00 0.00 H new ATOM 0 HD2 LYS A 9 5.765 -4.003 14.724 1.00 0.00 H new ATOM 0 HD3 LYS A 9 4.412 -5.116 14.758 1.00 0.00 H new ATOM 0 HE2 LYS A 9 7.286 -5.895 15.446 1.00 0.00 H new ATOM 0 HE3 LYS A 9 6.059 -5.492 16.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 5.918 -7.795 16.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 4.647 -7.246 15.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 6.101 -7.766 14.732 1.00 0.00 H new ATOM 147 N GLU A 10 3.002 -6.123 10.170 1.00 0.00 N ATOM 148 CA GLU A 10 2.191 -7.196 9.684 1.00 0.00 C ATOM 149 C GLU A 10 2.363 -7.475 8.230 1.00 0.00 C ATOM 150 O GLU A 10 2.440 -8.622 7.792 1.00 0.00 O ATOM 151 CB GLU A 10 0.694 -6.962 9.943 1.00 0.00 C ATOM 152 CG GLU A 10 0.417 -6.953 11.448 1.00 0.00 C ATOM 153 CD GLU A 10 0.742 -8.234 12.203 1.00 0.00 C ATOM 154 OE1 GLU A 10 1.900 -8.479 12.636 1.00 0.00 O ATOM 155 OE2 GLU A 10 -0.221 -9.022 12.402 1.00 0.00 O ATOM 0 H GLU A 10 2.436 -5.302 10.386 1.00 0.00 H new ATOM 0 HA GLU A 10 2.543 -8.060 10.248 1.00 0.00 H new ATOM 0 HB2 GLU A 10 0.384 -6.014 9.502 1.00 0.00 H new ATOM 0 HB3 GLU A 10 0.107 -7.744 9.462 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.987 -6.139 11.895 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -0.638 -6.725 11.600 1.00 0.00 H new ATOM 162 N ALA A 11 2.590 -6.435 7.408 1.00 0.00 N ATOM 163 CA ALA A 11 2.964 -6.546 6.032 1.00 0.00 C ATOM 164 C ALA A 11 4.339 -7.085 5.834 1.00 0.00 C ATOM 165 O ALA A 11 4.496 -7.855 4.887 1.00 0.00 O ATOM 166 CB ALA A 11 2.989 -5.159 5.368 1.00 0.00 C ATOM 0 H ALA A 11 2.508 -5.467 7.719 1.00 0.00 H new ATOM 0 HA ALA A 11 2.225 -7.220 5.598 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.275 -5.262 4.321 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.999 -4.708 5.431 1.00 0.00 H new ATOM 0 HB3 ALA A 11 3.711 -4.523 5.881 1.00 0.00 H new ATOM 172 N PHE A 12 5.273 -6.736 6.736 1.00 0.00 N ATOM 173 CA PHE A 12 6.578 -7.318 6.688 1.00 0.00 C ATOM 174 C PHE A 12 6.654 -8.766 7.033 1.00 0.00 C ATOM 175 O PHE A 12 7.537 -9.460 6.529 1.00 0.00 O ATOM 176 CB PHE A 12 7.496 -6.452 7.567 1.00 0.00 C ATOM 177 CG PHE A 12 8.911 -6.754 7.211 1.00 0.00 C ATOM 178 CD1 PHE A 12 9.402 -6.284 6.015 1.00 0.00 C ATOM 179 CD2 PHE A 12 9.773 -7.345 8.104 1.00 0.00 C ATOM 180 CE1 PHE A 12 10.758 -6.272 5.787 1.00 0.00 C ATOM 181 CE2 PHE A 12 11.128 -7.338 7.871 1.00 0.00 C ATOM 182 CZ PHE A 12 11.624 -6.851 6.685 1.00 0.00 C ATOM 0 H PHE A 12 5.129 -6.062 7.488 1.00 0.00 H new ATOM 0 HA PHE A 12 6.907 -7.316 5.649 1.00 0.00 H new ATOM 0 HB2 PHE A 12 7.283 -5.394 7.411 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.318 -6.660 8.622 1.00 0.00 H new ATOM 0 HD1 PHE A 12 8.723 -5.925 5.256 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.384 -7.818 8.994 1.00 0.00 H new ATOM 0 HE1 PHE A 12 11.146 -5.804 4.895 1.00 0.00 H new ATOM 0 HE2 PHE A 12 11.805 -7.716 8.622 1.00 0.00 H new ATOM 0 HZ PHE A 12 12.678 -6.922 6.462 1.00 0.00 H new ATOM 192 N SER A 13 5.830 -9.195 8.005 1.00 0.00 N ATOM 193 CA SER A 13 5.746 -10.576 8.365 1.00 0.00 C ATOM 194 C SER A 13 5.029 -11.310 7.285 1.00 0.00 C ATOM 195 O SER A 13 5.293 -12.473 6.982 1.00 0.00 O ATOM 196 CB SER A 13 5.054 -11.085 9.640 1.00 0.00 C ATOM 197 OG SER A 13 5.520 -10.484 10.840 1.00 0.00 O ATOM 0 H SER A 13 5.219 -8.582 8.544 1.00 0.00 H new ATOM 0 HA SER A 13 6.807 -10.749 8.544 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.982 -10.909 9.552 1.00 0.00 H new ATOM 0 HB3 SER A 13 5.195 -12.164 9.710 1.00 0.00 H new ATOM 0 HG SER A 13 5.032 -10.857 11.604 1.00 0.00 H new ATOM 203 N LEU A 14 4.017 -10.737 6.608 1.00 0.00 N ATOM 204 CA LEU A 14 3.267 -11.394 5.583 1.00 0.00 C ATOM 205 C LEU A 14 4.055 -11.659 4.347 1.00 0.00 C ATOM 206 O LEU A 14 3.854 -12.617 3.601 1.00 0.00 O ATOM 207 CB LEU A 14 2.014 -10.606 5.162 1.00 0.00 C ATOM 208 CG LEU A 14 0.953 -11.334 4.320 1.00 0.00 C ATOM 209 CD1 LEU A 14 0.306 -12.459 5.145 1.00 0.00 C ATOM 210 CD2 LEU A 14 -0.129 -10.486 3.629 1.00 0.00 C ATOM 0 H LEU A 14 3.710 -9.780 6.781 1.00 0.00 H new ATOM 0 HA LEU A 14 2.982 -12.340 6.044 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.529 -10.241 6.067 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.343 -9.731 4.601 1.00 0.00 H new ATOM 0 HG LEU A 14 1.528 -11.722 3.479 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.444 -12.969 4.540 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.071 -13.172 5.451 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.169 -12.035 6.030 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.803 -11.138 3.074 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -0.694 -9.935 4.380 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.343 -9.783 2.942 1.00 0.00 H new ATOM 222 N PHE A 15 5.065 -10.814 4.076 1.00 0.00 N ATOM 223 CA PHE A 15 5.958 -10.962 2.969 1.00 0.00 C ATOM 224 C PHE A 15 6.836 -12.160 3.096 1.00 0.00 C ATOM 225 O PHE A 15 7.170 -12.886 2.162 1.00 0.00 O ATOM 226 CB PHE A 15 6.907 -9.755 2.893 1.00 0.00 C ATOM 227 CG PHE A 15 6.470 -8.912 1.745 1.00 0.00 C ATOM 228 CD1 PHE A 15 6.804 -9.224 0.448 1.00 0.00 C ATOM 229 CD2 PHE A 15 5.929 -7.666 1.961 1.00 0.00 C ATOM 230 CE1 PHE A 15 6.408 -8.487 -0.643 1.00 0.00 C ATOM 231 CE2 PHE A 15 5.725 -6.796 0.916 1.00 0.00 C ATOM 232 CZ PHE A 15 5.879 -7.247 -0.374 1.00 0.00 C ATOM 0 H PHE A 15 5.268 -9.996 4.650 1.00 0.00 H new ATOM 0 HA PHE A 15 5.324 -11.055 2.087 1.00 0.00 H new ATOM 0 HB2 PHE A 15 6.876 -9.184 3.821 1.00 0.00 H new ATOM 0 HB3 PHE A 15 7.937 -10.085 2.756 1.00 0.00 H new ATOM 0 HD1 PHE A 15 7.413 -10.099 0.276 1.00 0.00 H new ATOM 0 HD2 PHE A 15 5.661 -7.367 2.964 1.00 0.00 H new ATOM 0 HE1 PHE A 15 6.507 -8.860 -1.652 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.447 -5.770 1.106 1.00 0.00 H new ATOM 0 HZ PHE A 15 5.577 -6.613 -1.194 1.00 0.00 H new ATOM 242 N ASP A 16 7.344 -12.367 4.324 1.00 0.00 N ATOM 243 CA ASP A 16 8.410 -13.267 4.639 1.00 0.00 C ATOM 244 C ASP A 16 7.931 -14.669 4.801 1.00 0.00 C ATOM 245 O ASP A 16 7.002 -14.958 5.553 1.00 0.00 O ATOM 246 CB ASP A 16 9.021 -12.787 5.966 1.00 0.00 C ATOM 247 CG ASP A 16 10.471 -13.223 6.122 1.00 0.00 C ATOM 248 OD1 ASP A 16 10.835 -14.423 6.251 1.00 0.00 O ATOM 249 OD2 ASP A 16 11.363 -12.354 5.929 1.00 0.00 O ATOM 0 H ASP A 16 6.989 -11.877 5.145 1.00 0.00 H new ATOM 0 HA ASP A 16 9.135 -13.268 3.825 1.00 0.00 H new ATOM 0 HB2 ASP A 16 8.963 -11.700 6.019 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.434 -13.178 6.797 1.00 0.00 H new ATOM 254 N LYS A 17 8.560 -15.627 4.097 1.00 0.00 N ATOM 255 CA LYS A 17 8.312 -17.032 4.190 1.00 0.00 C ATOM 256 C LYS A 17 8.866 -17.665 5.420 1.00 0.00 C ATOM 257 O LYS A 17 8.272 -18.443 6.165 1.00 0.00 O ATOM 258 CB LYS A 17 8.639 -17.747 2.868 1.00 0.00 C ATOM 259 CG LYS A 17 8.057 -17.171 1.575 1.00 0.00 C ATOM 260 CD LYS A 17 6.543 -17.001 1.718 1.00 0.00 C ATOM 261 CE LYS A 17 5.931 -16.472 0.419 1.00 0.00 C ATOM 262 NZ LYS A 17 4.463 -16.453 0.604 1.00 0.00 N ATOM 0 H LYS A 17 9.289 -15.405 3.419 1.00 0.00 H new ATOM 0 HA LYS A 17 7.239 -17.164 4.330 1.00 0.00 H new ATOM 0 HB2 LYS A 17 9.724 -17.774 2.763 1.00 0.00 H new ATOM 0 HB3 LYS A 17 8.301 -18.780 2.955 1.00 0.00 H new ATOM 0 HG2 LYS A 17 8.521 -16.210 1.353 1.00 0.00 H new ATOM 0 HG3 LYS A 17 8.280 -17.833 0.738 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.088 -17.957 1.977 1.00 0.00 H new ATOM 0 HD3 LYS A 17 6.325 -16.313 2.535 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.304 -15.472 0.197 1.00 0.00 H new ATOM 0 HE3 LYS A 17 6.205 -17.108 -0.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.009 -16.098 -0.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.126 -17.417 0.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 4.222 -15.831 1.402 1.00 0.00 H new ATOM 276 N ASP A 18 10.132 -17.309 5.700 1.00 0.00 N ATOM 277 CA ASP A 18 10.873 -17.794 6.823 1.00 0.00 C ATOM 278 C ASP A 18 10.291 -17.338 8.116 1.00 0.00 C ATOM 279 O ASP A 18 10.064 -18.098 9.056 1.00 0.00 O ATOM 280 CB ASP A 18 12.333 -17.309 6.834 1.00 0.00 C ATOM 281 CG ASP A 18 12.858 -17.445 5.412 1.00 0.00 C ATOM 282 OD1 ASP A 18 12.916 -18.582 4.871 1.00 0.00 O ATOM 283 OD2 ASP A 18 13.256 -16.400 4.831 1.00 0.00 O ATOM 0 H ASP A 18 10.661 -16.657 5.121 1.00 0.00 H new ATOM 0 HA ASP A 18 10.828 -18.878 6.721 1.00 0.00 H new ATOM 0 HB2 ASP A 18 12.393 -16.274 7.170 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.932 -17.903 7.525 1.00 0.00 H new ATOM 288 N GLY A 19 10.062 -16.020 8.255 1.00 0.00 N ATOM 289 CA GLY A 19 9.895 -15.408 9.537 1.00 0.00 C ATOM 290 C GLY A 19 11.114 -15.100 10.336 1.00 0.00 C ATOM 291 O GLY A 19 11.091 -15.044 11.564 1.00 0.00 O ATOM 0 H GLY A 19 9.992 -15.372 7.470 1.00 0.00 H new ATOM 0 HA2 GLY A 19 9.348 -14.476 9.392 1.00 0.00 H new ATOM 0 HA3 GLY A 19 9.260 -16.060 10.137 1.00 0.00 H new ATOM 295 N ASP A 20 12.275 -14.915 9.683 1.00 0.00 N ATOM 296 CA ASP A 20 13.494 -14.545 10.334 1.00 0.00 C ATOM 297 C ASP A 20 13.501 -13.087 10.639 1.00 0.00 C ATOM 298 O ASP A 20 13.478 -12.655 11.790 1.00 0.00 O ATOM 299 CB ASP A 20 14.702 -15.018 9.508 1.00 0.00 C ATOM 300 CG ASP A 20 14.785 -14.487 8.084 1.00 0.00 C ATOM 301 OD1 ASP A 20 13.766 -14.115 7.443 1.00 0.00 O ATOM 302 OD2 ASP A 20 15.937 -14.229 7.644 1.00 0.00 O ATOM 0 H ASP A 20 12.369 -15.026 8.673 1.00 0.00 H new ATOM 0 HA ASP A 20 13.570 -15.050 11.297 1.00 0.00 H new ATOM 0 HB2 ASP A 20 15.612 -14.732 10.035 1.00 0.00 H new ATOM 0 HB3 ASP A 20 14.686 -16.107 9.468 1.00 0.00 H new ATOM 307 N GLY A 21 13.568 -12.232 9.603 1.00 0.00 N ATOM 308 CA GLY A 21 13.893 -10.847 9.755 1.00 0.00 C ATOM 309 C GLY A 21 14.095 -9.998 8.547 1.00 0.00 C ATOM 310 O GLY A 21 14.031 -8.770 8.591 1.00 0.00 O ATOM 0 H GLY A 21 13.392 -12.509 8.637 1.00 0.00 H new ATOM 0 HA2 GLY A 21 13.099 -10.389 10.345 1.00 0.00 H new ATOM 0 HA3 GLY A 21 14.805 -10.790 10.349 1.00 0.00 H new ATOM 314 N THR A 22 14.374 -10.532 7.345 1.00 0.00 N ATOM 315 CA THR A 22 14.634 -9.807 6.140 1.00 0.00 C ATOM 316 C THR A 22 13.986 -10.537 5.014 1.00 0.00 C ATOM 317 O THR A 22 13.917 -11.763 4.942 1.00 0.00 O ATOM 318 CB THR A 22 16.074 -9.634 5.759 1.00 0.00 C ATOM 319 OG1 THR A 22 16.781 -10.865 5.738 1.00 0.00 O ATOM 320 CG2 THR A 22 16.739 -8.678 6.764 1.00 0.00 C ATOM 0 H THR A 22 14.421 -11.541 7.206 1.00 0.00 H new ATOM 0 HA THR A 22 14.244 -8.807 6.330 1.00 0.00 H new ATOM 0 HB THR A 22 16.108 -9.226 4.749 1.00 0.00 H new ATOM 0 HG1 THR A 22 17.722 -10.706 5.961 1.00 0.00 H new ATOM 0 HG21 THR A 22 17.788 -8.543 6.499 1.00 0.00 H new ATOM 0 HG22 THR A 22 16.231 -7.714 6.739 1.00 0.00 H new ATOM 0 HG23 THR A 22 16.670 -9.099 7.767 1.00 0.00 H new ATOM 328 N ILE A 23 13.507 -9.776 4.014 1.00 0.00 N ATOM 329 CA ILE A 23 12.829 -10.322 2.880 1.00 0.00 C ATOM 330 C ILE A 23 13.857 -10.445 1.809 1.00 0.00 C ATOM 331 O ILE A 23 14.480 -9.487 1.354 1.00 0.00 O ATOM 332 CB ILE A 23 11.631 -9.543 2.425 1.00 0.00 C ATOM 333 CG1 ILE A 23 10.639 -9.094 3.511 1.00 0.00 C ATOM 334 CG2 ILE A 23 10.808 -10.409 1.457 1.00 0.00 C ATOM 335 CD1 ILE A 23 9.771 -7.931 3.034 1.00 0.00 C ATOM 0 H ILE A 23 13.593 -8.760 3.993 1.00 0.00 H new ATOM 0 HA ILE A 23 12.398 -11.286 3.150 1.00 0.00 H new ATOM 0 HB ILE A 23 12.066 -8.642 1.992 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.002 -9.933 3.792 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.187 -8.797 4.405 1.00 0.00 H new ATOM 0 HG21 ILE A 23 9.935 -9.850 1.121 1.00 0.00 H new ATOM 0 HG22 ILE A 23 11.421 -10.676 0.596 1.00 0.00 H new ATOM 0 HG23 ILE A 23 10.484 -11.316 1.966 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.083 -7.641 3.828 1.00 0.00 H new ATOM 0 HD12 ILE A 23 10.407 -7.084 2.778 1.00 0.00 H new ATOM 0 HD13 ILE A 23 9.203 -8.237 2.155 1.00 0.00 H new ATOM 347 N THR A 24 14.059 -11.689 1.336 1.00 0.00 N ATOM 348 CA THR A 24 14.943 -11.995 0.255 1.00 0.00 C ATOM 349 C THR A 24 14.291 -11.992 -1.085 1.00 0.00 C ATOM 350 O THR A 24 13.081 -11.826 -1.224 1.00 0.00 O ATOM 351 CB THR A 24 15.598 -13.342 0.342 1.00 0.00 C ATOM 352 OG1 THR A 24 14.769 -14.493 0.414 1.00 0.00 O ATOM 353 CG2 THR A 24 16.314 -13.432 1.700 1.00 0.00 C ATOM 0 H THR A 24 13.590 -12.509 1.720 1.00 0.00 H new ATOM 0 HA THR A 24 15.673 -11.192 0.355 1.00 0.00 H new ATOM 0 HB THR A 24 16.181 -13.372 -0.578 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.149 -14.403 1.168 1.00 0.00 H new ATOM 0 HG21 THR A 24 16.800 -14.403 1.791 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.063 -12.643 1.769 1.00 0.00 H new ATOM 0 HG23 THR A 24 15.587 -13.314 2.503 1.00 0.00 H new ATOM 361 N THR A 25 15.121 -12.020 -2.143 1.00 0.00 N ATOM 362 CA THR A 25 14.776 -12.119 -3.528 1.00 0.00 C ATOM 363 C THR A 25 13.841 -13.243 -3.817 1.00 0.00 C ATOM 364 O THR A 25 12.805 -12.981 -4.426 1.00 0.00 O ATOM 365 CB THR A 25 15.905 -12.178 -4.514 1.00 0.00 C ATOM 366 OG1 THR A 25 16.990 -12.926 -3.983 1.00 0.00 O ATOM 367 CG2 THR A 25 16.374 -10.791 -4.984 1.00 0.00 C ATOM 0 H THR A 25 16.131 -11.968 -2.014 1.00 0.00 H new ATOM 0 HA THR A 25 14.289 -11.156 -3.683 1.00 0.00 H new ATOM 0 HB THR A 25 15.519 -12.684 -5.399 1.00 0.00 H new ATOM 0 HG1 THR A 25 17.718 -12.957 -4.638 1.00 0.00 H new ATOM 0 HG21 THR A 25 17.192 -10.905 -5.695 1.00 0.00 H new ATOM 0 HG22 THR A 25 15.546 -10.270 -5.464 1.00 0.00 H new ATOM 0 HG23 THR A 25 16.717 -10.213 -4.126 1.00 0.00 H new ATOM 375 N LYS A 26 14.209 -14.468 -3.401 1.00 0.00 N ATOM 376 CA LYS A 26 13.536 -15.724 -3.283 1.00 0.00 C ATOM 377 C LYS A 26 12.112 -15.648 -2.850 1.00 0.00 C ATOM 378 O LYS A 26 11.188 -16.039 -3.562 1.00 0.00 O ATOM 379 CB LYS A 26 14.260 -16.787 -2.441 1.00 0.00 C ATOM 380 CG LYS A 26 15.584 -17.048 -3.162 1.00 0.00 C ATOM 381 CD LYS A 26 15.468 -17.585 -4.589 1.00 0.00 C ATOM 382 CE LYS A 26 16.806 -18.144 -5.078 1.00 0.00 C ATOM 383 NZ LYS A 26 16.839 -18.229 -6.556 1.00 0.00 N ATOM 0 H LYS A 26 15.172 -14.588 -3.088 1.00 0.00 H new ATOM 0 HA LYS A 26 13.555 -16.051 -4.323 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.430 -16.433 -1.424 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.667 -17.699 -2.366 1.00 0.00 H new ATOM 0 HG2 LYS A 26 16.151 -16.118 -3.189 1.00 0.00 H new ATOM 0 HG3 LYS A 26 16.164 -17.758 -2.572 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.709 -18.366 -4.626 1.00 0.00 H new ATOM 0 HD3 LYS A 26 15.138 -16.788 -5.255 1.00 0.00 H new ATOM 0 HE2 LYS A 26 17.619 -17.508 -4.729 1.00 0.00 H new ATOM 0 HE3 LYS A 26 16.969 -19.133 -4.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.821 -18.142 -6.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.451 -19.145 -6.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 16.268 -17.460 -6.961 1.00 0.00 H new ATOM 397 N GLU A 27 11.883 -15.060 -1.663 1.00 0.00 N ATOM 398 CA GLU A 27 10.599 -14.882 -1.059 1.00 0.00 C ATOM 399 C GLU A 27 9.751 -13.837 -1.698 1.00 0.00 C ATOM 400 O GLU A 27 8.534 -13.911 -1.856 1.00 0.00 O ATOM 401 CB GLU A 27 10.828 -14.338 0.362 1.00 0.00 C ATOM 402 CG GLU A 27 11.573 -15.370 1.211 1.00 0.00 C ATOM 403 CD GLU A 27 11.968 -14.627 2.479 1.00 0.00 C ATOM 404 OE1 GLU A 27 11.167 -14.668 3.451 1.00 0.00 O ATOM 405 OE2 GLU A 27 13.090 -14.063 2.587 1.00 0.00 O ATOM 0 H GLU A 27 12.640 -14.686 -1.091 1.00 0.00 H new ATOM 0 HA GLU A 27 10.103 -15.849 -1.134 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.401 -13.412 0.316 1.00 0.00 H new ATOM 0 HB3 GLU A 27 9.871 -14.098 0.826 1.00 0.00 H new ATOM 0 HG2 GLU A 27 10.938 -16.227 1.437 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.450 -15.752 0.688 1.00 0.00 H new ATOM 412 N LEU A 28 10.409 -12.733 -2.096 1.00 0.00 N ATOM 413 CA LEU A 28 9.862 -11.552 -2.688 1.00 0.00 C ATOM 414 C LEU A 28 9.416 -11.761 -4.094 1.00 0.00 C ATOM 415 O LEU A 28 8.393 -11.167 -4.432 1.00 0.00 O ATOM 416 CB LEU A 28 10.869 -10.391 -2.607 1.00 0.00 C ATOM 417 CG LEU A 28 10.512 -8.943 -2.981 1.00 0.00 C ATOM 418 CD1 LEU A 28 9.297 -8.403 -2.208 1.00 0.00 C ATOM 419 CD2 LEU A 28 11.699 -7.989 -2.766 1.00 0.00 C ATOM 0 H LEU A 28 11.421 -12.664 -1.992 1.00 0.00 H new ATOM 0 HA LEU A 28 8.972 -11.296 -2.112 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.228 -10.365 -1.578 1.00 0.00 H new ATOM 0 HB3 LEU A 28 11.716 -10.672 -3.233 1.00 0.00 H new ATOM 0 HG LEU A 28 10.256 -8.978 -4.040 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.096 -7.377 -2.517 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.426 -9.023 -2.420 1.00 0.00 H new ATOM 0 HD13 LEU A 28 9.507 -8.426 -1.139 1.00 0.00 H new ATOM 0 HD21 LEU A 28 11.406 -6.976 -3.042 1.00 0.00 H new ATOM 0 HD22 LEU A 28 11.996 -8.008 -1.717 1.00 0.00 H new ATOM 0 HD23 LEU A 28 12.537 -8.306 -3.386 1.00 0.00 H new ATOM 431 N GLY A 29 10.183 -12.563 -4.853 1.00 0.00 N ATOM 432 CA GLY A 29 9.952 -13.230 -6.097 1.00 0.00 C ATOM 433 C GLY A 29 8.679 -13.999 -6.190 1.00 0.00 C ATOM 434 O GLY A 29 7.902 -13.826 -7.128 1.00 0.00 O ATOM 0 H GLY A 29 11.127 -12.775 -4.530 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.966 -12.487 -6.895 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.782 -13.912 -6.282 1.00 0.00 H new ATOM 438 N THR A 30 8.315 -14.738 -5.127 1.00 0.00 N ATOM 439 CA THR A 30 7.258 -15.688 -4.974 1.00 0.00 C ATOM 440 C THR A 30 6.015 -14.943 -4.627 1.00 0.00 C ATOM 441 O THR A 30 4.953 -15.164 -5.207 1.00 0.00 O ATOM 442 CB THR A 30 7.672 -16.763 -4.013 1.00 0.00 C ATOM 443 OG1 THR A 30 8.799 -17.513 -4.441 1.00 0.00 O ATOM 444 CG2 THR A 30 6.573 -17.802 -3.730 1.00 0.00 C ATOM 0 H THR A 30 8.839 -14.653 -4.256 1.00 0.00 H new ATOM 0 HA THR A 30 7.040 -16.227 -5.896 1.00 0.00 H new ATOM 0 HB THR A 30 7.904 -16.187 -3.117 1.00 0.00 H new ATOM 0 HG1 THR A 30 9.620 -17.062 -4.154 1.00 0.00 H new ATOM 0 HG21 THR A 30 6.948 -18.546 -3.027 1.00 0.00 H new ATOM 0 HG22 THR A 30 5.703 -17.304 -3.302 1.00 0.00 H new ATOM 0 HG23 THR A 30 6.288 -18.293 -4.660 1.00 0.00 H new ATOM 452 N VAL A 31 6.161 -13.971 -3.710 1.00 0.00 N ATOM 453 CA VAL A 31 5.132 -13.043 -3.359 1.00 0.00 C ATOM 454 C VAL A 31 4.705 -12.216 -4.522 1.00 0.00 C ATOM 455 O VAL A 31 3.500 -12.029 -4.686 1.00 0.00 O ATOM 456 CB VAL A 31 5.450 -12.047 -2.283 1.00 0.00 C ATOM 457 CG1 VAL A 31 4.490 -10.858 -2.113 1.00 0.00 C ATOM 458 CG2 VAL A 31 5.401 -12.813 -0.950 1.00 0.00 C ATOM 0 H VAL A 31 7.028 -13.826 -3.193 1.00 0.00 H new ATOM 0 HA VAL A 31 4.363 -13.722 -2.991 1.00 0.00 H new ATOM 0 HB VAL A 31 6.410 -11.617 -2.570 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.841 -10.220 -1.302 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.456 -10.283 -3.038 1.00 0.00 H new ATOM 0 HG13 VAL A 31 3.492 -11.227 -1.879 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.626 -12.131 -0.130 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.406 -13.234 -0.809 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.136 -13.617 -0.965 1.00 0.00 H new ATOM 468 N MET A 32 5.576 -11.725 -5.422 1.00 0.00 N ATOM 469 CA MET A 32 5.150 -10.933 -6.534 1.00 0.00 C ATOM 470 C MET A 32 4.258 -11.688 -7.459 1.00 0.00 C ATOM 471 O MET A 32 3.207 -11.256 -7.931 1.00 0.00 O ATOM 472 CB MET A 32 6.230 -10.283 -7.416 1.00 0.00 C ATOM 473 CG MET A 32 5.950 -9.384 -8.622 1.00 0.00 C ATOM 474 SD MET A 32 7.140 -8.067 -9.015 1.00 0.00 S ATOM 475 CE MET A 32 6.208 -7.309 -10.377 1.00 0.00 C ATOM 0 H MET A 32 6.583 -11.878 -5.378 1.00 0.00 H new ATOM 0 HA MET A 32 4.642 -10.126 -6.007 1.00 0.00 H new ATOM 0 HB2 MET A 32 6.854 -9.696 -6.742 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.846 -11.102 -7.789 1.00 0.00 H new ATOM 0 HG2 MET A 32 5.862 -10.024 -9.500 1.00 0.00 H new ATOM 0 HG3 MET A 32 4.977 -8.917 -8.469 1.00 0.00 H new ATOM 0 HE1 MET A 32 6.768 -6.462 -10.774 1.00 0.00 H new ATOM 0 HE2 MET A 32 6.054 -8.045 -11.167 1.00 0.00 H new ATOM 0 HE3 MET A 32 5.241 -6.965 -10.009 1.00 0.00 H new ATOM 485 N ARG A 33 4.630 -12.937 -7.789 1.00 0.00 N ATOM 486 CA ARG A 33 3.985 -13.852 -8.679 1.00 0.00 C ATOM 487 C ARG A 33 2.674 -14.348 -8.175 1.00 0.00 C ATOM 488 O ARG A 33 1.742 -14.740 -8.877 1.00 0.00 O ATOM 489 CB ARG A 33 4.993 -14.973 -8.986 1.00 0.00 C ATOM 490 CG ARG A 33 4.562 -15.968 -10.066 1.00 0.00 C ATOM 491 CD ARG A 33 4.116 -15.235 -11.332 1.00 0.00 C ATOM 492 NE ARG A 33 3.846 -16.292 -12.347 1.00 0.00 N ATOM 493 CZ ARG A 33 2.759 -16.327 -13.172 1.00 0.00 C ATOM 494 NH1 ARG A 33 2.023 -15.202 -13.407 1.00 0.00 N ATOM 495 NH2 ARG A 33 2.381 -17.468 -13.819 1.00 0.00 N ATOM 0 H ARG A 33 5.473 -13.347 -7.388 1.00 0.00 H new ATOM 0 HA ARG A 33 3.711 -13.341 -9.602 1.00 0.00 H new ATOM 0 HB2 ARG A 33 5.935 -14.517 -9.291 1.00 0.00 H new ATOM 0 HB3 ARG A 33 5.189 -15.524 -8.066 1.00 0.00 H new ATOM 0 HG2 ARG A 33 5.389 -16.638 -10.301 1.00 0.00 H new ATOM 0 HG3 ARG A 33 3.746 -16.587 -9.692 1.00 0.00 H new ATOM 0 HD2 ARG A 33 3.223 -14.639 -11.143 1.00 0.00 H new ATOM 0 HD3 ARG A 33 4.890 -14.550 -11.679 1.00 0.00 H new ATOM 0 HE ARG A 33 4.526 -17.048 -12.432 1.00 0.00 H new ATOM 0 HH11 ARG A 33 2.283 -14.321 -12.964 1.00 0.00 H new ATOM 0 HH12 ARG A 33 1.213 -15.242 -14.026 1.00 0.00 H new ATOM 0 HH21 ARG A 33 2.916 -18.327 -13.692 1.00 0.00 H new ATOM 0 HH22 ARG A 33 1.563 -17.461 -14.429 1.00 0.00 H new ATOM 509 N SER A 34 2.517 -14.345 -6.839 1.00 0.00 N ATOM 510 CA SER A 34 1.268 -14.616 -6.196 1.00 0.00 C ATOM 511 C SER A 34 0.217 -13.575 -6.371 1.00 0.00 C ATOM 512 O SER A 34 -0.981 -13.807 -6.521 1.00 0.00 O ATOM 513 CB SER A 34 1.598 -14.746 -4.700 1.00 0.00 C ATOM 514 OG SER A 34 2.461 -15.842 -4.438 1.00 0.00 O ATOM 0 H SER A 34 3.278 -14.149 -6.189 1.00 0.00 H new ATOM 0 HA SER A 34 0.842 -15.512 -6.649 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.065 -13.825 -4.351 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.674 -14.869 -4.135 1.00 0.00 H new ATOM 0 HG SER A 34 3.352 -15.651 -4.800 1.00 0.00 H new ATOM 520 N LEU A 35 0.688 -12.334 -6.591 1.00 0.00 N ATOM 521 CA LEU A 35 -0.081 -11.222 -7.056 1.00 0.00 C ATOM 522 C LEU A 35 -0.360 -11.208 -8.520 1.00 0.00 C ATOM 523 O LEU A 35 -1.461 -10.971 -9.013 1.00 0.00 O ATOM 524 CB LEU A 35 0.525 -9.838 -6.768 1.00 0.00 C ATOM 525 CG LEU A 35 0.996 -9.584 -5.326 1.00 0.00 C ATOM 526 CD1 LEU A 35 1.570 -8.163 -5.200 1.00 0.00 C ATOM 527 CD2 LEU A 35 -0.089 -9.832 -4.264 1.00 0.00 C ATOM 0 H LEU A 35 1.667 -12.094 -6.434 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.993 -11.383 -6.481 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.374 -9.691 -7.436 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.216 -9.081 -7.024 1.00 0.00 H new ATOM 0 HG LEU A 35 1.778 -10.316 -5.124 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.900 -7.994 -4.175 1.00 0.00 H new ATOM 0 HD12 LEU A 35 2.417 -8.051 -5.877 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.800 -7.436 -5.458 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.319 -9.632 -3.273 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -0.936 -9.171 -4.448 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -0.420 -10.869 -4.317 1.00 0.00 H new ATOM 539 N GLY A 36 0.660 -11.411 -9.374 1.00 0.00 N ATOM 540 CA GLY A 36 0.532 -11.339 -10.796 1.00 0.00 C ATOM 541 C GLY A 36 1.718 -11.804 -11.570 1.00 0.00 C ATOM 542 O GLY A 36 1.771 -12.971 -11.954 1.00 0.00 O ATOM 0 H GLY A 36 1.606 -11.633 -9.063 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -0.332 -11.932 -11.096 1.00 0.00 H new ATOM 0 HA3 GLY A 36 0.321 -10.306 -11.073 1.00 0.00 H new ATOM 546 N GLN A 37 2.713 -10.933 -11.814 1.00 0.00 N ATOM 547 CA GLN A 37 3.668 -11.098 -12.865 1.00 0.00 C ATOM 548 C GLN A 37 4.941 -11.633 -12.303 1.00 0.00 C ATOM 549 O GLN A 37 5.102 -11.728 -11.088 1.00 0.00 O ATOM 550 CB GLN A 37 3.911 -9.758 -13.581 1.00 0.00 C ATOM 551 CG GLN A 37 2.668 -9.187 -14.265 1.00 0.00 C ATOM 552 CD GLN A 37 2.966 -7.895 -15.011 1.00 0.00 C ATOM 553 OE1 GLN A 37 2.610 -6.804 -14.568 1.00 0.00 O ATOM 554 NE2 GLN A 37 3.573 -7.946 -16.228 1.00 0.00 N ATOM 0 H GLN A 37 2.858 -10.087 -11.263 1.00 0.00 H new ATOM 0 HA GLN A 37 3.279 -11.807 -13.596 1.00 0.00 H new ATOM 0 HB2 GLN A 37 4.281 -9.032 -12.857 1.00 0.00 H new ATOM 0 HB3 GLN A 37 4.695 -9.892 -14.327 1.00 0.00 H new ATOM 0 HG2 GLN A 37 2.268 -9.923 -14.962 1.00 0.00 H new ATOM 0 HG3 GLN A 37 1.896 -9.004 -13.518 1.00 0.00 H new ATOM 0 HE21 GLN A 37 3.875 -8.842 -16.610 1.00 0.00 H new ATOM 0 HE22 GLN A 37 3.726 -7.088 -16.758 1.00 0.00 H new ATOM 563 N ASN A 38 5.897 -12.066 -13.144 1.00 0.00 N ATOM 564 CA ASN A 38 7.137 -12.685 -12.791 1.00 0.00 C ATOM 565 C ASN A 38 8.172 -11.624 -12.645 1.00 0.00 C ATOM 566 O ASN A 38 8.456 -11.003 -13.669 1.00 0.00 O ATOM 567 CB ASN A 38 7.607 -13.676 -13.869 1.00 0.00 C ATOM 568 CG ASN A 38 6.790 -14.960 -13.870 1.00 0.00 C ATOM 569 OD1 ASN A 38 6.806 -15.728 -12.910 1.00 0.00 O ATOM 570 ND2 ASN A 38 5.927 -15.202 -14.893 1.00 0.00 N ATOM 0 H ASN A 38 5.792 -11.975 -14.154 1.00 0.00 H new ATOM 0 HA ASN A 38 6.991 -13.233 -11.860 1.00 0.00 H new ATOM 0 HB2 ASN A 38 7.538 -13.203 -14.849 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.657 -13.917 -13.705 1.00 0.00 H new ATOM 0 HD21 ASN A 38 5.306 -16.010 -14.856 1.00 0.00 H new ATOM 0 HD22 ASN A 38 5.901 -14.575 -15.697 1.00 0.00 H new ATOM 577 N PRO A 39 8.883 -11.309 -11.603 1.00 0.00 N ATOM 578 CA PRO A 39 10.044 -10.469 -11.639 1.00 0.00 C ATOM 579 C PRO A 39 11.219 -11.232 -12.147 1.00 0.00 C ATOM 580 O PRO A 39 11.325 -12.437 -11.923 1.00 0.00 O ATOM 581 CB PRO A 39 10.199 -10.116 -10.161 1.00 0.00 C ATOM 582 CG PRO A 39 9.544 -11.232 -9.331 1.00 0.00 C ATOM 583 CD PRO A 39 8.458 -11.756 -10.285 1.00 0.00 C ATOM 0 HA PRO A 39 9.964 -9.600 -12.292 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.253 -10.018 -9.902 1.00 0.00 H new ATOM 0 HB3 PRO A 39 9.728 -9.157 -9.948 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.258 -12.010 -9.061 1.00 0.00 H new ATOM 0 HG3 PRO A 39 9.120 -10.852 -8.402 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.381 -12.842 -10.240 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.477 -11.356 -10.028 1.00 0.00 H new ATOM 591 N THR A 40 12.295 -10.648 -12.702 1.00 0.00 N ATOM 592 CA THR A 40 13.560 -11.279 -12.922 1.00 0.00 C ATOM 593 C THR A 40 14.450 -11.085 -11.743 1.00 0.00 C ATOM 594 O THR A 40 14.322 -10.030 -11.124 1.00 0.00 O ATOM 595 CB THR A 40 14.159 -11.047 -14.277 1.00 0.00 C ATOM 596 OG1 THR A 40 15.257 -11.922 -14.490 1.00 0.00 O ATOM 597 CG2 THR A 40 14.623 -9.593 -14.466 1.00 0.00 C ATOM 0 H THR A 40 12.281 -9.678 -13.016 1.00 0.00 H new ATOM 0 HA THR A 40 13.393 -12.354 -12.983 1.00 0.00 H new ATOM 0 HB THR A 40 13.376 -11.249 -15.008 1.00 0.00 H new ATOM 0 HG1 THR A 40 15.637 -11.760 -15.379 1.00 0.00 H new ATOM 0 HG21 THR A 40 15.050 -9.474 -15.462 1.00 0.00 H new ATOM 0 HG22 THR A 40 13.772 -8.922 -14.353 1.00 0.00 H new ATOM 0 HG23 THR A 40 15.377 -9.351 -13.717 1.00 0.00 H new ATOM 605 N GLU A 41 15.200 -12.089 -11.254 1.00 0.00 N ATOM 606 CA GLU A 41 15.651 -12.118 -9.897 1.00 0.00 C ATOM 607 C GLU A 41 16.788 -11.175 -9.702 1.00 0.00 C ATOM 608 O GLU A 41 16.830 -10.413 -8.737 1.00 0.00 O ATOM 609 CB GLU A 41 16.063 -13.566 -9.582 1.00 0.00 C ATOM 610 CG GLU A 41 16.625 -13.779 -8.175 1.00 0.00 C ATOM 611 CD GLU A 41 16.927 -15.235 -7.850 1.00 0.00 C ATOM 612 OE1 GLU A 41 15.894 -15.947 -7.735 1.00 0.00 O ATOM 613 OE2 GLU A 41 18.050 -15.756 -7.617 1.00 0.00 O ATOM 0 H GLU A 41 15.498 -12.892 -11.808 1.00 0.00 H new ATOM 0 HA GLU A 41 14.859 -11.799 -9.219 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.196 -14.213 -9.714 1.00 0.00 H new ATOM 0 HB3 GLU A 41 16.811 -13.883 -10.309 1.00 0.00 H new ATOM 0 HG2 GLU A 41 17.539 -13.195 -8.066 1.00 0.00 H new ATOM 0 HG3 GLU A 41 15.912 -13.394 -7.446 1.00 0.00 H new ATOM 620 N ALA A 42 17.693 -11.059 -10.690 1.00 0.00 N ATOM 621 CA ALA A 42 18.823 -10.184 -10.743 1.00 0.00 C ATOM 622 C ALA A 42 18.373 -8.764 -10.774 1.00 0.00 C ATOM 623 O ALA A 42 18.946 -7.961 -10.039 1.00 0.00 O ATOM 624 CB ALA A 42 19.730 -10.503 -11.944 1.00 0.00 C ATOM 0 H ALA A 42 17.625 -11.633 -11.530 1.00 0.00 H new ATOM 0 HA ALA A 42 19.416 -10.342 -9.842 1.00 0.00 H new ATOM 0 HB1 ALA A 42 20.578 -9.818 -11.952 1.00 0.00 H new ATOM 0 HB2 ALA A 42 20.092 -11.528 -11.864 1.00 0.00 H new ATOM 0 HB3 ALA A 42 19.163 -10.389 -12.868 1.00 0.00 H new ATOM 630 N GLU A 43 17.268 -8.401 -11.450 1.00 0.00 N ATOM 631 CA GLU A 43 16.750 -7.071 -11.365 1.00 0.00 C ATOM 632 C GLU A 43 16.098 -6.704 -10.076 1.00 0.00 C ATOM 633 O GLU A 43 16.115 -5.545 -9.667 1.00 0.00 O ATOM 634 CB GLU A 43 15.725 -6.648 -12.430 1.00 0.00 C ATOM 635 CG GLU A 43 16.285 -6.631 -13.853 1.00 0.00 C ATOM 636 CD GLU A 43 15.230 -6.088 -14.806 1.00 0.00 C ATOM 637 OE1 GLU A 43 14.801 -4.912 -14.658 1.00 0.00 O ATOM 638 OE2 GLU A 43 14.822 -6.786 -15.772 1.00 0.00 O ATOM 0 H GLU A 43 16.735 -9.027 -12.054 1.00 0.00 H new ATOM 0 HA GLU A 43 17.696 -6.550 -11.509 1.00 0.00 H new ATOM 0 HB2 GLU A 43 14.874 -7.328 -12.392 1.00 0.00 H new ATOM 0 HB3 GLU A 43 15.350 -5.654 -12.185 1.00 0.00 H new ATOM 0 HG2 GLU A 43 17.182 -6.013 -13.895 1.00 0.00 H new ATOM 0 HG3 GLU A 43 16.578 -7.637 -14.152 1.00 0.00 H new ATOM 645 N LEU A 44 15.564 -7.709 -9.358 1.00 0.00 N ATOM 646 CA LEU A 44 14.918 -7.559 -8.091 1.00 0.00 C ATOM 647 C LEU A 44 15.975 -7.344 -7.062 1.00 0.00 C ATOM 648 O LEU A 44 15.854 -6.501 -6.175 1.00 0.00 O ATOM 649 CB LEU A 44 14.070 -8.818 -7.846 1.00 0.00 C ATOM 650 CG LEU A 44 12.981 -8.744 -6.762 1.00 0.00 C ATOM 651 CD1 LEU A 44 11.776 -7.905 -7.222 1.00 0.00 C ATOM 652 CD2 LEU A 44 12.604 -10.225 -6.582 1.00 0.00 C ATOM 0 H LEU A 44 15.584 -8.677 -9.679 1.00 0.00 H new ATOM 0 HA LEU A 44 14.247 -6.701 -8.051 1.00 0.00 H new ATOM 0 HB2 LEU A 44 13.590 -9.088 -8.787 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.746 -9.633 -7.588 1.00 0.00 H new ATOM 0 HG LEU A 44 13.313 -8.262 -5.843 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.029 -7.877 -6.429 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.104 -6.890 -7.448 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.341 -8.353 -8.115 1.00 0.00 H new ATOM 0 HD21 LEU A 44 11.825 -10.313 -5.825 1.00 0.00 H new ATOM 0 HD22 LEU A 44 12.238 -10.625 -7.528 1.00 0.00 H new ATOM 0 HD23 LEU A 44 13.482 -10.788 -6.266 1.00 0.00 H new ATOM 664 N GLN A 45 17.155 -7.974 -7.201 1.00 0.00 N ATOM 665 CA GLN A 45 18.218 -7.648 -6.300 1.00 0.00 C ATOM 666 C GLN A 45 18.819 -6.312 -6.575 1.00 0.00 C ATOM 667 O GLN A 45 19.269 -5.669 -5.628 1.00 0.00 O ATOM 668 CB GLN A 45 19.163 -8.859 -6.371 1.00 0.00 C ATOM 669 CG GLN A 45 20.462 -8.893 -5.563 1.00 0.00 C ATOM 670 CD GLN A 45 20.298 -8.716 -4.060 1.00 0.00 C ATOM 671 OE1 GLN A 45 19.807 -9.574 -3.329 1.00 0.00 O ATOM 672 NE2 GLN A 45 20.608 -7.462 -3.632 1.00 0.00 N ATOM 0 H GLN A 45 17.370 -8.680 -7.905 1.00 0.00 H new ATOM 0 HA GLN A 45 17.889 -7.506 -5.271 1.00 0.00 H new ATOM 0 HB2 GLN A 45 18.583 -9.734 -6.080 1.00 0.00 H new ATOM 0 HB3 GLN A 45 19.435 -8.991 -7.418 1.00 0.00 H new ATOM 0 HG2 GLN A 45 20.961 -9.844 -5.748 1.00 0.00 H new ATOM 0 HG3 GLN A 45 21.122 -8.109 -5.935 1.00 0.00 H new ATOM 0 HE21 GLN A 45 21.014 -6.788 -4.281 1.00 0.00 H new ATOM 0 HE22 GLN A 45 20.434 -7.196 -2.663 1.00 0.00 H new ATOM 681 N ASP A 46 18.716 -5.782 -7.807 1.00 0.00 N ATOM 682 CA ASP A 46 19.098 -4.467 -8.220 1.00 0.00 C ATOM 683 C ASP A 46 18.211 -3.510 -7.501 1.00 0.00 C ATOM 684 O ASP A 46 18.648 -2.614 -6.780 1.00 0.00 O ATOM 685 CB ASP A 46 19.079 -4.321 -9.751 1.00 0.00 C ATOM 686 CG ASP A 46 19.908 -3.118 -10.176 1.00 0.00 C ATOM 687 OD1 ASP A 46 21.080 -2.890 -9.771 1.00 0.00 O ATOM 688 OD2 ASP A 46 19.350 -2.375 -11.026 1.00 0.00 O ATOM 0 H ASP A 46 18.331 -6.323 -8.581 1.00 0.00 H new ATOM 0 HA ASP A 46 20.133 -4.252 -7.955 1.00 0.00 H new ATOM 0 HB2 ASP A 46 19.473 -5.225 -10.214 1.00 0.00 H new ATOM 0 HB3 ASP A 46 18.053 -4.206 -10.100 1.00 0.00 H new ATOM 693 N MET A 47 16.870 -3.604 -7.545 1.00 0.00 N ATOM 694 CA MET A 47 15.843 -2.817 -6.936 1.00 0.00 C ATOM 695 C MET A 47 15.925 -2.724 -5.451 1.00 0.00 C ATOM 696 O MET A 47 15.750 -1.661 -4.857 1.00 0.00 O ATOM 697 CB MET A 47 14.475 -3.458 -7.222 1.00 0.00 C ATOM 698 CG MET A 47 13.966 -3.307 -8.657 1.00 0.00 C ATOM 699 SD MET A 47 12.919 -4.650 -9.293 1.00 0.00 S ATOM 700 CE MET A 47 13.017 -3.960 -10.970 1.00 0.00 C ATOM 0 H MET A 47 16.448 -4.351 -8.096 1.00 0.00 H new ATOM 0 HA MET A 47 15.971 -1.821 -7.359 1.00 0.00 H new ATOM 0 HB2 MET A 47 14.534 -4.520 -6.986 1.00 0.00 H new ATOM 0 HB3 MET A 47 13.740 -3.021 -6.546 1.00 0.00 H new ATOM 0 HG2 MET A 47 13.403 -2.376 -8.723 1.00 0.00 H new ATOM 0 HG3 MET A 47 14.828 -3.206 -9.316 1.00 0.00 H new ATOM 0 HE1 MET A 47 12.430 -4.575 -11.651 1.00 0.00 H new ATOM 0 HE2 MET A 47 12.624 -2.943 -10.969 1.00 0.00 H new ATOM 0 HE3 MET A 47 14.056 -3.947 -11.298 1.00 0.00 H new ATOM 710 N ILE A 48 16.280 -3.838 -4.785 1.00 0.00 N ATOM 711 CA ILE A 48 16.525 -3.954 -3.380 1.00 0.00 C ATOM 712 C ILE A 48 17.750 -3.165 -3.068 1.00 0.00 C ATOM 713 O ILE A 48 17.714 -2.520 -2.022 1.00 0.00 O ATOM 714 CB ILE A 48 16.644 -5.399 -2.999 1.00 0.00 C ATOM 715 CG1 ILE A 48 15.265 -6.075 -3.074 1.00 0.00 C ATOM 716 CG2 ILE A 48 17.241 -5.764 -1.630 1.00 0.00 C ATOM 717 CD1 ILE A 48 14.272 -5.667 -1.986 1.00 0.00 C ATOM 0 H ILE A 48 16.405 -4.727 -5.269 1.00 0.00 H new ATOM 0 HA ILE A 48 15.698 -3.554 -2.793 1.00 0.00 H new ATOM 0 HB ILE A 48 17.373 -5.755 -3.727 1.00 0.00 H new ATOM 0 HG12 ILE A 48 14.824 -5.854 -4.046 1.00 0.00 H new ATOM 0 HG13 ILE A 48 15.406 -7.155 -3.026 1.00 0.00 H new ATOM 0 HG21 ILE A 48 17.254 -6.848 -1.516 1.00 0.00 H new ATOM 0 HG22 ILE A 48 18.259 -5.380 -1.563 1.00 0.00 H new ATOM 0 HG23 ILE A 48 16.634 -5.323 -0.839 1.00 0.00 H new ATOM 0 HD11 ILE A 48 13.333 -6.201 -2.131 1.00 0.00 H new ATOM 0 HD12 ILE A 48 14.683 -5.915 -1.007 1.00 0.00 H new ATOM 0 HD13 ILE A 48 14.091 -4.594 -2.042 1.00 0.00 H new ATOM 729 N ASN A 49 18.836 -3.079 -3.856 1.00 0.00 N ATOM 730 CA ASN A 49 20.028 -2.378 -3.489 1.00 0.00 C ATOM 731 C ASN A 49 19.896 -0.894 -3.447 1.00 0.00 C ATOM 732 O ASN A 49 20.657 -0.214 -2.760 1.00 0.00 O ATOM 733 CB ASN A 49 21.239 -2.672 -4.390 1.00 0.00 C ATOM 734 CG ASN A 49 21.838 -4.064 -4.249 1.00 0.00 C ATOM 735 OD1 ASN A 49 21.983 -4.651 -3.178 1.00 0.00 O ATOM 736 ND2 ASN A 49 22.290 -4.589 -5.419 1.00 0.00 N ATOM 0 H ASN A 49 18.887 -3.511 -4.779 1.00 0.00 H new ATOM 0 HA ASN A 49 20.194 -2.766 -2.484 1.00 0.00 H new ATOM 0 HB2 ASN A 49 20.941 -2.527 -5.428 1.00 0.00 H new ATOM 0 HB3 ASN A 49 22.016 -1.938 -4.176 1.00 0.00 H new ATOM 0 HD21 ASN A 49 22.763 -5.492 -5.423 1.00 0.00 H new ATOM 0 HD22 ASN A 49 22.156 -4.079 -6.292 1.00 0.00 H new ATOM 743 N GLU A 50 18.875 -0.284 -4.074 1.00 0.00 N ATOM 744 CA GLU A 50 18.643 1.127 -4.036 1.00 0.00 C ATOM 745 C GLU A 50 18.274 1.571 -2.662 1.00 0.00 C ATOM 746 O GLU A 50 18.845 2.506 -2.102 1.00 0.00 O ATOM 747 CB GLU A 50 17.483 1.435 -4.997 1.00 0.00 C ATOM 748 CG GLU A 50 17.238 2.926 -5.236 1.00 0.00 C ATOM 749 CD GLU A 50 16.150 3.094 -6.287 1.00 0.00 C ATOM 750 OE1 GLU A 50 14.991 2.600 -6.254 1.00 0.00 O ATOM 751 OE2 GLU A 50 16.419 3.875 -7.238 1.00 0.00 O ATOM 0 H GLU A 50 18.185 -0.792 -4.628 1.00 0.00 H new ATOM 0 HA GLU A 50 19.551 1.655 -4.328 1.00 0.00 H new ATOM 0 HB2 GLU A 50 17.683 0.954 -5.955 1.00 0.00 H new ATOM 0 HB3 GLU A 50 16.571 0.988 -4.601 1.00 0.00 H new ATOM 0 HG2 GLU A 50 16.940 3.411 -4.306 1.00 0.00 H new ATOM 0 HG3 GLU A 50 18.157 3.409 -5.567 1.00 0.00 H new ATOM 758 N VAL A 51 17.291 0.850 -2.093 1.00 0.00 N ATOM 759 CA VAL A 51 16.672 0.992 -0.812 1.00 0.00 C ATOM 760 C VAL A 51 17.510 0.353 0.241 1.00 0.00 C ATOM 761 O VAL A 51 17.487 0.871 1.356 1.00 0.00 O ATOM 762 CB VAL A 51 15.238 0.554 -0.768 1.00 0.00 C ATOM 763 CG1 VAL A 51 14.260 1.474 -1.518 1.00 0.00 C ATOM 764 CG2 VAL A 51 15.033 -0.899 -1.227 1.00 0.00 C ATOM 0 H VAL A 51 16.881 0.067 -2.602 1.00 0.00 H new ATOM 0 HA VAL A 51 16.621 2.061 -0.604 1.00 0.00 H new ATOM 0 HB VAL A 51 14.995 0.625 0.292 1.00 0.00 H new ATOM 0 HG11 VAL A 51 13.248 1.078 -1.431 1.00 0.00 H new ATOM 0 HG12 VAL A 51 14.296 2.474 -1.085 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.541 1.524 -2.570 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.974 -1.152 -1.171 1.00 0.00 H new ATOM 0 HG22 VAL A 51 15.378 -1.008 -2.255 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.601 -1.568 -0.581 1.00 0.00 H new ATOM 774 N ASP A 52 18.458 -0.573 0.009 1.00 0.00 N ATOM 775 CA ASP A 52 19.346 -1.147 0.971 1.00 0.00 C ATOM 776 C ASP A 52 20.248 -0.165 1.636 1.00 0.00 C ATOM 777 O ASP A 52 21.165 0.194 0.899 1.00 0.00 O ATOM 778 CB ASP A 52 20.137 -2.254 0.255 1.00 0.00 C ATOM 779 CG ASP A 52 20.887 -3.158 1.223 1.00 0.00 C ATOM 780 OD1 ASP A 52 20.176 -3.564 2.181 1.00 0.00 O ATOM 781 OD2 ASP A 52 22.064 -3.546 0.996 1.00 0.00 O ATOM 0 H ASP A 52 18.614 -0.949 -0.926 1.00 0.00 H new ATOM 0 HA ASP A 52 18.754 -1.551 1.792 1.00 0.00 H new ATOM 0 HB2 ASP A 52 19.452 -2.856 -0.342 1.00 0.00 H new ATOM 0 HB3 ASP A 52 20.847 -1.799 -0.436 1.00 0.00 H new ATOM 786 N ALA A 53 20.037 0.268 2.892 1.00 0.00 N ATOM 787 CA ALA A 53 20.743 1.288 3.603 1.00 0.00 C ATOM 788 C ALA A 53 22.051 0.710 4.021 1.00 0.00 C ATOM 789 O ALA A 53 23.078 1.226 3.581 1.00 0.00 O ATOM 790 CB ALA A 53 19.950 1.873 4.784 1.00 0.00 C ATOM 0 H ALA A 53 19.297 -0.139 3.464 1.00 0.00 H new ATOM 0 HA ALA A 53 20.899 2.145 2.948 1.00 0.00 H new ATOM 0 HB1 ALA A 53 20.546 2.641 5.278 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.023 2.313 4.417 1.00 0.00 H new ATOM 0 HB3 ALA A 53 19.719 1.080 5.495 1.00 0.00 H new ATOM 796 N ASP A 54 22.076 -0.375 4.816 1.00 0.00 N ATOM 797 CA ASP A 54 23.201 -1.028 5.410 1.00 0.00 C ATOM 798 C ASP A 54 24.235 -1.595 4.499 1.00 0.00 C ATOM 799 O ASP A 54 25.387 -1.200 4.670 1.00 0.00 O ATOM 800 CB ASP A 54 22.727 -2.125 6.378 1.00 0.00 C ATOM 801 CG ASP A 54 21.652 -3.052 5.829 1.00 0.00 C ATOM 802 OD1 ASP A 54 21.694 -3.454 4.636 1.00 0.00 O ATOM 803 OD2 ASP A 54 20.653 -3.329 6.545 1.00 0.00 O ATOM 0 H ASP A 54 21.207 -0.845 5.069 1.00 0.00 H new ATOM 0 HA ASP A 54 23.715 -0.212 5.919 1.00 0.00 H new ATOM 0 HB2 ASP A 54 23.588 -2.726 6.671 1.00 0.00 H new ATOM 0 HB3 ASP A 54 22.348 -1.650 7.283 1.00 0.00 H new ATOM 808 N GLY A 55 23.810 -2.542 3.643 1.00 0.00 N ATOM 809 CA GLY A 55 24.635 -3.134 2.638 1.00 0.00 C ATOM 810 C GLY A 55 24.652 -4.624 2.633 1.00 0.00 C ATOM 811 O GLY A 55 25.420 -5.264 1.917 1.00 0.00 O ATOM 0 H GLY A 55 22.858 -2.908 3.652 1.00 0.00 H new ATOM 0 HA2 GLY A 55 24.298 -2.786 1.662 1.00 0.00 H new ATOM 0 HA3 GLY A 55 25.656 -2.775 2.769 1.00 0.00 H new ATOM 815 N ASN A 56 23.714 -5.250 3.367 1.00 0.00 N ATOM 816 CA ASN A 56 23.520 -6.667 3.375 1.00 0.00 C ATOM 817 C ASN A 56 22.825 -7.261 2.199 1.00 0.00 C ATOM 818 O ASN A 56 22.960 -8.463 1.972 1.00 0.00 O ATOM 819 CB ASN A 56 22.839 -7.116 4.678 1.00 0.00 C ATOM 820 CG ASN A 56 21.428 -6.561 4.818 1.00 0.00 C ATOM 821 OD1 ASN A 56 20.885 -5.995 3.871 1.00 0.00 O ATOM 822 ND2 ASN A 56 20.784 -6.834 5.984 1.00 0.00 N ATOM 0 H ASN A 56 23.067 -4.751 3.977 1.00 0.00 H new ATOM 0 HA ASN A 56 24.534 -7.060 3.306 1.00 0.00 H new ATOM 0 HB2 ASN A 56 22.803 -8.205 4.709 1.00 0.00 H new ATOM 0 HB3 ASN A 56 23.439 -6.793 5.528 1.00 0.00 H new ATOM 0 HD21 ASN A 56 19.807 -6.567 6.101 1.00 0.00 H new ATOM 0 HD22 ASN A 56 21.278 -7.306 6.741 1.00 0.00 H new ATOM 829 N GLY A 57 22.107 -6.442 1.409 1.00 0.00 N ATOM 830 CA GLY A 57 21.545 -6.975 0.207 1.00 0.00 C ATOM 831 C GLY A 57 20.179 -7.527 0.425 1.00 0.00 C ATOM 832 O GLY A 57 19.701 -8.189 -0.495 1.00 0.00 O ATOM 0 H GLY A 57 21.921 -5.455 1.589 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.503 -6.193 -0.551 1.00 0.00 H new ATOM 0 HA3 GLY A 57 22.195 -7.760 -0.180 1.00 0.00 H new ATOM 836 N THR A 58 19.521 -7.329 1.582 1.00 0.00 N ATOM 837 CA THR A 58 18.150 -7.726 1.674 1.00 0.00 C ATOM 838 C THR A 58 17.380 -6.628 2.323 1.00 0.00 C ATOM 839 O THR A 58 18.003 -5.769 2.945 1.00 0.00 O ATOM 840 CB THR A 58 17.969 -8.973 2.487 1.00 0.00 C ATOM 841 OG1 THR A 58 18.580 -8.936 3.768 1.00 0.00 O ATOM 842 CG2 THR A 58 18.504 -10.239 1.797 1.00 0.00 C ATOM 0 H THR A 58 19.918 -6.911 2.423 1.00 0.00 H new ATOM 0 HA THR A 58 17.795 -7.928 0.664 1.00 0.00 H new ATOM 0 HB THR A 58 16.885 -9.015 2.594 1.00 0.00 H new ATOM 0 HG1 THR A 58 18.415 -9.782 4.234 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.340 -11.102 2.442 1.00 0.00 H new ATOM 0 HG22 THR A 58 17.981 -10.387 0.852 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.571 -10.126 1.607 1.00 0.00 H new ATOM 850 N ILE A 59 16.048 -6.513 2.181 1.00 0.00 N ATOM 851 CA ILE A 59 15.277 -5.416 2.678 1.00 0.00 C ATOM 852 C ILE A 59 14.948 -5.718 4.100 1.00 0.00 C ATOM 853 O ILE A 59 14.200 -6.649 4.394 1.00 0.00 O ATOM 854 CB ILE A 59 14.178 -4.896 1.799 1.00 0.00 C ATOM 855 CG1 ILE A 59 13.593 -3.547 2.249 1.00 0.00 C ATOM 856 CG2 ILE A 59 13.113 -5.949 1.448 1.00 0.00 C ATOM 857 CD1 ILE A 59 12.845 -2.809 1.139 1.00 0.00 C ATOM 0 H ILE A 59 15.484 -7.214 1.700 1.00 0.00 H new ATOM 0 HA ILE A 59 15.880 -4.509 2.648 1.00 0.00 H new ATOM 0 HB ILE A 59 14.673 -4.672 0.854 1.00 0.00 H new ATOM 0 HG12 ILE A 59 12.914 -3.715 3.085 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.401 -2.914 2.616 1.00 0.00 H new ATOM 0 HG21 ILE A 59 12.352 -5.499 0.810 1.00 0.00 H new ATOM 0 HG22 ILE A 59 13.582 -6.780 0.921 1.00 0.00 H new ATOM 0 HG23 ILE A 59 12.649 -6.316 2.363 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.459 -1.866 1.525 1.00 0.00 H new ATOM 0 HD12 ILE A 59 13.526 -2.610 0.311 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.016 -3.424 0.788 1.00 0.00 H new ATOM 869 N ASP A 60 15.536 -4.959 5.042 1.00 0.00 N ATOM 870 CA ASP A 60 15.238 -4.948 6.440 1.00 0.00 C ATOM 871 C ASP A 60 14.023 -4.116 6.664 1.00 0.00 C ATOM 872 O ASP A 60 13.390 -3.598 5.745 1.00 0.00 O ATOM 873 CB ASP A 60 16.454 -4.359 7.176 1.00 0.00 C ATOM 874 CG ASP A 60 17.683 -5.252 7.089 1.00 0.00 C ATOM 875 OD1 ASP A 60 18.339 -5.319 6.015 1.00 0.00 O ATOM 876 OD2 ASP A 60 17.974 -5.825 8.172 1.00 0.00 O ATOM 0 H ASP A 60 16.279 -4.301 4.805 1.00 0.00 H new ATOM 0 HA ASP A 60 15.041 -5.952 6.816 1.00 0.00 H new ATOM 0 HB2 ASP A 60 16.690 -3.382 6.755 1.00 0.00 H new ATOM 0 HB3 ASP A 60 16.198 -4.201 8.224 1.00 0.00 H new ATOM 881 N PHE A 61 13.609 -3.971 7.936 1.00 0.00 N ATOM 882 CA PHE A 61 12.431 -3.255 8.316 1.00 0.00 C ATOM 883 C PHE A 61 12.619 -1.778 8.256 1.00 0.00 C ATOM 884 O PHE A 61 11.652 -1.257 7.703 1.00 0.00 O ATOM 885 CB PHE A 61 11.765 -3.751 9.610 1.00 0.00 C ATOM 886 CG PHE A 61 10.431 -3.175 9.941 1.00 0.00 C ATOM 887 CD1 PHE A 61 9.300 -3.363 9.183 1.00 0.00 C ATOM 888 CD2 PHE A 61 10.267 -2.580 11.170 1.00 0.00 C ATOM 889 CE1 PHE A 61 8.061 -2.920 9.583 1.00 0.00 C ATOM 890 CE2 PHE A 61 9.027 -2.165 11.595 1.00 0.00 C ATOM 891 CZ PHE A 61 7.898 -2.411 10.849 1.00 0.00 C ATOM 0 H PHE A 61 14.114 -4.367 8.729 1.00 0.00 H new ATOM 0 HA PHE A 61 11.693 -3.495 7.551 1.00 0.00 H new ATOM 0 HB2 PHE A 61 11.661 -4.834 9.545 1.00 0.00 H new ATOM 0 HB3 PHE A 61 12.440 -3.545 10.441 1.00 0.00 H new ATOM 0 HD1 PHE A 61 9.388 -3.878 8.238 1.00 0.00 H new ATOM 0 HD2 PHE A 61 11.125 -2.437 11.811 1.00 0.00 H new ATOM 0 HE1 PHE A 61 7.221 -2.972 8.906 1.00 0.00 H new ATOM 0 HE2 PHE A 61 8.938 -1.636 12.532 1.00 0.00 H new ATOM 0 HZ PHE A 61 6.914 -2.210 11.246 1.00 0.00 H new ATOM 901 N PRO A 62 13.577 -1.020 8.701 1.00 0.00 N ATOM 902 CA PRO A 62 13.538 0.397 8.484 1.00 0.00 C ATOM 903 C PRO A 62 13.708 0.769 7.051 1.00 0.00 C ATOM 904 O PRO A 62 13.232 1.844 6.687 1.00 0.00 O ATOM 905 CB PRO A 62 14.746 0.979 9.215 1.00 0.00 C ATOM 906 CG PRO A 62 14.853 -0.016 10.381 1.00 0.00 C ATOM 907 CD PRO A 62 14.559 -1.370 9.716 1.00 0.00 C ATOM 0 HA PRO A 62 12.572 0.767 8.828 1.00 0.00 H new ATOM 0 HB2 PRO A 62 15.642 0.993 8.595 1.00 0.00 H new ATOM 0 HB3 PRO A 62 14.576 2.001 9.553 1.00 0.00 H new ATOM 0 HG2 PRO A 62 15.843 0.002 10.836 1.00 0.00 H new ATOM 0 HG3 PRO A 62 14.135 0.209 11.170 1.00 0.00 H new ATOM 0 HD2 PRO A 62 15.455 -1.809 9.278 1.00 0.00 H new ATOM 0 HD3 PRO A 62 14.165 -2.094 10.429 1.00 0.00 H new ATOM 915 N GLU A 63 14.273 -0.097 6.191 1.00 0.00 N ATOM 916 CA GLU A 63 14.290 0.046 4.769 1.00 0.00 C ATOM 917 C GLU A 63 12.984 -0.076 4.062 1.00 0.00 C ATOM 918 O GLU A 63 12.577 0.693 3.193 1.00 0.00 O ATOM 919 CB GLU A 63 15.335 -0.910 4.168 1.00 0.00 C ATOM 920 CG GLU A 63 16.746 -0.649 4.699 1.00 0.00 C ATOM 921 CD GLU A 63 17.624 -1.848 4.371 1.00 0.00 C ATOM 922 OE1 GLU A 63 17.192 -2.967 3.987 1.00 0.00 O ATOM 923 OE2 GLU A 63 18.859 -1.774 4.612 1.00 0.00 O ATOM 0 H GLU A 63 14.744 -0.945 6.507 1.00 0.00 H new ATOM 0 HA GLU A 63 14.561 1.088 4.601 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.052 -1.939 4.391 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.334 -0.807 3.083 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.157 0.254 4.249 1.00 0.00 H new ATOM 0 HG3 GLU A 63 16.719 -0.484 5.776 1.00 0.00 H new ATOM 930 N PHE A 64 12.241 -1.146 4.398 1.00 0.00 N ATOM 931 CA PHE A 64 10.870 -1.275 4.011 1.00 0.00 C ATOM 932 C PHE A 64 10.127 -0.033 4.367 1.00 0.00 C ATOM 933 O PHE A 64 9.472 0.578 3.524 1.00 0.00 O ATOM 934 CB PHE A 64 10.304 -2.601 4.547 1.00 0.00 C ATOM 935 CG PHE A 64 8.853 -2.830 4.300 1.00 0.00 C ATOM 936 CD1 PHE A 64 8.351 -2.970 3.027 1.00 0.00 C ATOM 937 CD2 PHE A 64 7.992 -2.920 5.368 1.00 0.00 C ATOM 938 CE1 PHE A 64 6.989 -3.055 2.860 1.00 0.00 C ATOM 939 CE2 PHE A 64 6.629 -3.056 5.252 1.00 0.00 C ATOM 940 CZ PHE A 64 6.172 -3.168 3.960 1.00 0.00 C ATOM 0 H PHE A 64 12.595 -1.931 4.945 1.00 0.00 H new ATOM 0 HA PHE A 64 10.754 -1.352 2.930 1.00 0.00 H new ATOM 0 HB2 PHE A 64 10.864 -3.422 4.099 1.00 0.00 H new ATOM 0 HB3 PHE A 64 10.482 -2.643 5.622 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.014 -3.012 2.175 1.00 0.00 H new ATOM 0 HD2 PHE A 64 8.413 -2.881 6.362 1.00 0.00 H new ATOM 0 HE1 PHE A 64 6.562 -3.033 1.868 1.00 0.00 H new ATOM 0 HE2 PHE A 64 5.970 -3.073 6.107 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.120 -3.354 3.802 1.00 0.00 H new ATOM 950 N LEU A 65 10.107 0.315 5.666 1.00 0.00 N ATOM 951 CA LEU A 65 9.538 1.481 6.268 1.00 0.00 C ATOM 952 C LEU A 65 9.786 2.764 5.552 1.00 0.00 C ATOM 953 O LEU A 65 8.858 3.498 5.216 1.00 0.00 O ATOM 954 CB LEU A 65 9.880 1.665 7.756 1.00 0.00 C ATOM 955 CG LEU A 65 9.125 0.775 8.758 1.00 0.00 C ATOM 956 CD1 LEU A 65 9.953 0.901 10.048 1.00 0.00 C ATOM 957 CD2 LEU A 65 7.676 1.262 8.928 1.00 0.00 C ATOM 0 H LEU A 65 10.537 -0.288 6.368 1.00 0.00 H new ATOM 0 HA LEU A 65 8.475 1.257 6.179 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.948 1.489 7.883 1.00 0.00 H new ATOM 0 HB3 LEU A 65 9.695 2.706 8.021 1.00 0.00 H new ATOM 0 HG LEU A 65 9.032 -0.264 8.441 1.00 0.00 H new ATOM 0 HD11 LEU A 65 9.496 0.299 10.834 1.00 0.00 H new ATOM 0 HD12 LEU A 65 10.968 0.549 9.865 1.00 0.00 H new ATOM 0 HD13 LEU A 65 9.982 1.945 10.361 1.00 0.00 H new ATOM 0 HD21 LEU A 65 7.158 0.620 9.640 1.00 0.00 H new ATOM 0 HD22 LEU A 65 7.678 2.287 9.298 1.00 0.00 H new ATOM 0 HD23 LEU A 65 7.164 1.224 7.966 1.00 0.00 H new ATOM 969 N THR A 66 11.058 3.128 5.308 1.00 0.00 N ATOM 970 CA THR A 66 11.636 4.269 4.669 1.00 0.00 C ATOM 971 C THR A 66 11.172 4.421 3.261 1.00 0.00 C ATOM 972 O THR A 66 10.895 5.560 2.891 1.00 0.00 O ATOM 973 CB THR A 66 13.130 4.338 4.778 1.00 0.00 C ATOM 974 OG1 THR A 66 13.663 4.403 6.093 1.00 0.00 O ATOM 975 CG2 THR A 66 13.722 5.563 4.061 1.00 0.00 C ATOM 0 H THR A 66 11.805 2.506 5.617 1.00 0.00 H new ATOM 0 HA THR A 66 11.266 5.127 5.230 1.00 0.00 H new ATOM 0 HB THR A 66 13.411 3.391 4.318 1.00 0.00 H new ATOM 0 HG1 THR A 66 13.761 3.496 6.451 1.00 0.00 H new ATOM 0 HG21 THR A 66 14.806 5.561 4.173 1.00 0.00 H new ATOM 0 HG22 THR A 66 13.466 5.523 3.002 1.00 0.00 H new ATOM 0 HG23 THR A 66 13.313 6.474 4.499 1.00 0.00 H new ATOM 983 N MET A 67 11.089 3.373 2.423 1.00 0.00 N ATOM 984 CA MET A 67 10.506 3.454 1.119 1.00 0.00 C ATOM 985 C MET A 67 9.027 3.617 1.047 1.00 0.00 C ATOM 986 O MET A 67 8.500 4.376 0.235 1.00 0.00 O ATOM 987 CB MET A 67 10.984 2.386 0.121 1.00 0.00 C ATOM 988 CG MET A 67 10.475 0.962 0.353 1.00 0.00 C ATOM 989 SD MET A 67 10.605 -0.247 -0.998 1.00 0.00 S ATOM 990 CE MET A 67 9.190 -1.326 -0.631 1.00 0.00 C ATOM 0 H MET A 67 11.437 2.443 2.658 1.00 0.00 H new ATOM 0 HA MET A 67 10.916 4.412 0.799 1.00 0.00 H new ATOM 0 HB2 MET A 67 10.686 2.696 -0.880 1.00 0.00 H new ATOM 0 HB3 MET A 67 12.074 2.366 0.138 1.00 0.00 H new ATOM 0 HG2 MET A 67 11.010 0.556 1.211 1.00 0.00 H new ATOM 0 HG3 MET A 67 9.424 1.029 0.635 1.00 0.00 H new ATOM 0 HE1 MET A 67 9.302 -2.268 -1.168 1.00 0.00 H new ATOM 0 HE2 MET A 67 9.150 -1.522 0.441 1.00 0.00 H new ATOM 0 HE3 MET A 67 8.268 -0.837 -0.945 1.00 0.00 H new ATOM 1000 N MET A 68 8.247 2.989 1.945 1.00 0.00 N ATOM 1001 CA MET A 68 6.820 3.064 2.002 1.00 0.00 C ATOM 1002 C MET A 68 6.329 4.295 2.685 1.00 0.00 C ATOM 1003 O MET A 68 5.275 4.803 2.307 1.00 0.00 O ATOM 1004 CB MET A 68 6.193 1.861 2.727 1.00 0.00 C ATOM 1005 CG MET A 68 6.298 0.552 1.942 1.00 0.00 C ATOM 1006 SD MET A 68 5.915 0.591 0.165 1.00 0.00 S ATOM 1007 CE MET A 68 4.120 0.712 0.414 1.00 0.00 C ATOM 0 H MET A 68 8.637 2.393 2.675 1.00 0.00 H new ATOM 0 HA MET A 68 6.513 3.074 0.956 1.00 0.00 H new ATOM 0 HB2 MET A 68 6.680 1.735 3.694 1.00 0.00 H new ATOM 0 HB3 MET A 68 5.142 2.073 2.925 1.00 0.00 H new ATOM 0 HG2 MET A 68 7.314 0.174 2.057 1.00 0.00 H new ATOM 0 HG3 MET A 68 5.633 -0.173 2.411 1.00 0.00 H new ATOM 0 HE1 MET A 68 3.631 -0.152 -0.036 1.00 0.00 H new ATOM 0 HE2 MET A 68 3.902 0.737 1.482 1.00 0.00 H new ATOM 0 HE3 MET A 68 3.748 1.624 -0.054 1.00 0.00 H new ATOM 1017 N ALA A 69 6.951 4.792 3.769 1.00 0.00 N ATOM 1018 CA ALA A 69 6.490 5.944 4.481 1.00 0.00 C ATOM 1019 C ALA A 69 6.719 7.292 3.889 1.00 0.00 C ATOM 1020 O ALA A 69 6.084 8.246 4.337 1.00 0.00 O ATOM 1021 CB ALA A 69 6.963 5.987 5.944 1.00 0.00 C ATOM 0 H ALA A 69 7.798 4.381 4.162 1.00 0.00 H new ATOM 0 HA ALA A 69 5.417 5.769 4.404 1.00 0.00 H new ATOM 0 HB1 ALA A 69 6.578 6.886 6.425 1.00 0.00 H new ATOM 0 HB2 ALA A 69 6.595 5.107 6.472 1.00 0.00 H new ATOM 0 HB3 ALA A 69 8.053 5.998 5.974 1.00 0.00 H new ATOM 1027 N ARG A 70 7.505 7.409 2.805 1.00 0.00 N ATOM 1028 CA ARG A 70 7.584 8.682 2.158 1.00 0.00 C ATOM 1029 C ARG A 70 6.548 8.965 1.125 1.00 0.00 C ATOM 1030 O ARG A 70 5.909 8.039 0.628 1.00 0.00 O ATOM 1031 CB ARG A 70 9.031 8.829 1.659 1.00 0.00 C ATOM 1032 CG ARG A 70 9.484 7.715 0.713 1.00 0.00 C ATOM 1033 CD ARG A 70 10.977 7.734 0.378 1.00 0.00 C ATOM 1034 NE ARG A 70 11.195 6.665 -0.636 1.00 0.00 N ATOM 1035 CZ ARG A 70 12.397 6.244 -1.126 1.00 0.00 C ATOM 1036 NH1 ARG A 70 13.574 6.801 -0.714 1.00 0.00 N ATOM 1037 NH2 ARG A 70 12.383 5.098 -1.867 1.00 0.00 N ATOM 0 H ARG A 70 8.062 6.662 2.391 1.00 0.00 H new ATOM 0 HA ARG A 70 7.339 9.458 2.884 1.00 0.00 H new ATOM 0 HB2 ARG A 70 9.132 9.787 1.149 1.00 0.00 H new ATOM 0 HB3 ARG A 70 9.700 8.854 2.520 1.00 0.00 H new ATOM 0 HG2 ARG A 70 9.238 6.753 1.161 1.00 0.00 H new ATOM 0 HG3 ARG A 70 8.916 7.790 -0.214 1.00 0.00 H new ATOM 0 HD2 ARG A 70 11.275 8.707 -0.013 1.00 0.00 H new ATOM 0 HD3 ARG A 70 11.577 7.552 1.269 1.00 0.00 H new ATOM 0 HE ARG A 70 10.363 6.201 -1.001 1.00 0.00 H new ATOM 0 HH11 ARG A 70 13.569 7.551 -0.023 1.00 0.00 H new ATOM 0 HH12 ARG A 70 14.458 6.467 -1.097 1.00 0.00 H new ATOM 0 HH21 ARG A 70 11.504 4.606 -2.028 1.00 0.00 H new ATOM 0 HH22 ARG A 70 13.251 4.734 -2.260 1.00 0.00 H new ATOM 1051 N LYS A 71 6.211 10.248 0.905 1.00 0.00 N ATOM 1052 CA LYS A 71 5.178 10.523 -0.044 1.00 0.00 C ATOM 1053 C LYS A 71 5.696 11.361 -1.161 1.00 0.00 C ATOM 1054 O LYS A 71 6.319 12.412 -1.021 1.00 0.00 O ATOM 1055 CB LYS A 71 4.150 11.283 0.810 1.00 0.00 C ATOM 1056 CG LYS A 71 3.505 10.518 1.968 1.00 0.00 C ATOM 1057 CD LYS A 71 2.443 11.308 2.735 1.00 0.00 C ATOM 1058 CE LYS A 71 1.352 11.937 1.867 1.00 0.00 C ATOM 1059 NZ LYS A 71 0.594 10.791 1.319 1.00 0.00 N ATOM 0 H LYS A 71 6.630 11.060 1.359 1.00 0.00 H new ATOM 0 HA LYS A 71 4.766 9.636 -0.525 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.638 12.168 1.219 1.00 0.00 H new ATOM 0 HB3 LYS A 71 3.355 11.633 0.151 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.051 9.607 1.577 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.286 10.212 2.664 1.00 0.00 H new ATOM 0 HD2 LYS A 71 1.972 10.645 3.460 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.937 12.098 3.300 1.00 0.00 H new ATOM 0 HE2 LYS A 71 0.708 12.592 2.454 1.00 0.00 H new ATOM 0 HE3 LYS A 71 1.782 12.544 1.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -0.269 11.137 0.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.182 10.285 0.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 0.335 10.145 2.092 1.00 0.00 H new ATOM 1073 N MET A 72 5.448 10.929 -2.411 1.00 0.00 N ATOM 1074 CA MET A 72 5.575 11.747 -3.577 1.00 0.00 C ATOM 1075 C MET A 72 4.341 12.538 -3.848 1.00 0.00 C ATOM 1076 O MET A 72 3.383 12.606 -3.080 1.00 0.00 O ATOM 1077 CB MET A 72 5.897 10.863 -4.794 1.00 0.00 C ATOM 1078 CG MET A 72 7.097 9.930 -4.616 1.00 0.00 C ATOM 1079 SD MET A 72 7.518 9.186 -6.220 1.00 0.00 S ATOM 1080 CE MET A 72 8.582 10.442 -6.988 1.00 0.00 C ATOM 0 H MET A 72 5.148 9.976 -2.617 1.00 0.00 H new ATOM 0 HA MET A 72 6.386 12.453 -3.396 1.00 0.00 H new ATOM 0 HB2 MET A 72 5.019 10.261 -5.029 1.00 0.00 H new ATOM 0 HB3 MET A 72 6.081 11.507 -5.654 1.00 0.00 H new ATOM 0 HG2 MET A 72 7.949 10.485 -4.224 1.00 0.00 H new ATOM 0 HG3 MET A 72 6.863 9.151 -3.890 1.00 0.00 H new ATOM 0 HE1 MET A 72 8.900 10.097 -7.972 1.00 0.00 H new ATOM 0 HE2 MET A 72 8.027 11.375 -7.092 1.00 0.00 H new ATOM 0 HE3 MET A 72 9.458 10.609 -6.362 1.00 0.00 H new ATOM 1090 N LYS A 73 4.381 13.333 -4.933 1.00 0.00 N ATOM 1091 CA LYS A 73 3.185 13.895 -5.478 1.00 0.00 C ATOM 1092 C LYS A 73 1.966 13.096 -5.786 1.00 0.00 C ATOM 1093 O LYS A 73 1.967 11.875 -5.934 1.00 0.00 O ATOM 1094 CB LYS A 73 3.525 14.650 -6.774 1.00 0.00 C ATOM 1095 CG LYS A 73 4.081 13.828 -7.939 1.00 0.00 C ATOM 1096 CD LYS A 73 4.158 14.689 -9.202 1.00 0.00 C ATOM 1097 CE LYS A 73 5.006 14.089 -10.324 1.00 0.00 C ATOM 1098 NZ LYS A 73 4.305 12.905 -10.867 1.00 0.00 N ATOM 0 H LYS A 73 5.236 13.585 -5.430 1.00 0.00 H new ATOM 0 HA LYS A 73 2.872 14.468 -4.605 1.00 0.00 H new ATOM 0 HB2 LYS A 73 2.622 15.154 -7.118 1.00 0.00 H new ATOM 0 HB3 LYS A 73 4.251 15.426 -6.532 1.00 0.00 H new ATOM 0 HG2 LYS A 73 5.072 13.450 -7.687 1.00 0.00 H new ATOM 0 HG3 LYS A 73 3.445 12.961 -8.119 1.00 0.00 H new ATOM 0 HD2 LYS A 73 3.148 14.855 -9.576 1.00 0.00 H new ATOM 0 HD3 LYS A 73 4.565 15.665 -8.938 1.00 0.00 H new ATOM 0 HE2 LYS A 73 5.168 14.826 -11.111 1.00 0.00 H new ATOM 0 HE3 LYS A 73 5.988 13.806 -9.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 4.880 12.477 -11.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 4.157 12.210 -10.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 3.385 13.194 -11.256 1.00 0.00 H new ATOM 1112 N ASP A 74 0.823 13.805 -5.829 1.00 0.00 N ATOM 1113 CA ASP A 74 -0.495 13.324 -5.552 1.00 0.00 C ATOM 1114 C ASP A 74 -1.099 12.326 -6.479 1.00 0.00 C ATOM 1115 O ASP A 74 -1.892 11.456 -6.124 1.00 0.00 O ATOM 1116 CB ASP A 74 -1.474 14.493 -5.351 1.00 0.00 C ATOM 1117 CG ASP A 74 -1.088 15.360 -4.161 1.00 0.00 C ATOM 1118 OD1 ASP A 74 -0.094 16.128 -4.270 1.00 0.00 O ATOM 1119 OD2 ASP A 74 -1.810 15.329 -3.129 1.00 0.00 O ATOM 0 H ASP A 74 0.823 14.794 -6.078 1.00 0.00 H new ATOM 0 HA ASP A 74 -0.334 12.754 -4.637 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -1.499 15.105 -6.253 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -2.481 14.102 -5.204 1.00 0.00 H new ATOM 1124 N THR A 75 -0.672 12.534 -7.738 1.00 0.00 N ATOM 1125 CA THR A 75 -0.746 11.678 -8.881 1.00 0.00 C ATOM 1126 C THR A 75 -0.263 10.285 -8.665 1.00 0.00 C ATOM 1127 O THR A 75 -0.979 9.285 -8.644 1.00 0.00 O ATOM 1128 CB THR A 75 -0.208 12.274 -10.148 1.00 0.00 C ATOM 1129 OG1 THR A 75 1.030 12.897 -9.835 1.00 0.00 O ATOM 1130 CG2 THR A 75 -1.184 13.382 -10.578 1.00 0.00 C ATOM 0 H THR A 75 -0.218 13.415 -7.980 1.00 0.00 H new ATOM 0 HA THR A 75 -1.822 11.588 -9.027 1.00 0.00 H new ATOM 0 HB THR A 75 -0.087 11.520 -10.926 1.00 0.00 H new ATOM 0 HG1 THR A 75 1.410 13.296 -10.646 1.00 0.00 H new ATOM 0 HG21 THR A 75 -0.828 13.843 -11.499 1.00 0.00 H new ATOM 0 HG22 THR A 75 -2.172 12.952 -10.745 1.00 0.00 H new ATOM 0 HG23 THR A 75 -1.245 14.137 -9.794 1.00 0.00 H new ATOM 1138 N ASP A 76 1.037 10.224 -8.323 1.00 0.00 N ATOM 1139 CA ASP A 76 1.763 9.008 -8.128 1.00 0.00 C ATOM 1140 C ASP A 76 1.147 8.184 -7.050 1.00 0.00 C ATOM 1141 O ASP A 76 1.045 6.962 -7.152 1.00 0.00 O ATOM 1142 CB ASP A 76 3.212 9.349 -7.741 1.00 0.00 C ATOM 1143 CG ASP A 76 4.012 9.686 -8.991 1.00 0.00 C ATOM 1144 OD1 ASP A 76 4.257 8.717 -9.758 1.00 0.00 O ATOM 1145 OD2 ASP A 76 4.234 10.865 -9.376 1.00 0.00 O ATOM 0 H ASP A 76 1.606 11.058 -8.176 1.00 0.00 H new ATOM 0 HA ASP A 76 1.740 8.434 -9.054 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.225 10.193 -7.051 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.668 8.506 -7.222 1.00 0.00 H new ATOM 1150 N SER A 77 0.853 8.852 -5.920 1.00 0.00 N ATOM 1151 CA SER A 77 0.421 8.279 -4.684 1.00 0.00 C ATOM 1152 C SER A 77 -0.911 7.629 -4.834 1.00 0.00 C ATOM 1153 O SER A 77 -1.254 6.564 -4.322 1.00 0.00 O ATOM 1154 CB SER A 77 0.422 9.376 -3.606 1.00 0.00 C ATOM 1155 OG SER A 77 1.755 9.680 -3.224 1.00 0.00 O ATOM 0 H SER A 77 0.923 9.868 -5.869 1.00 0.00 H new ATOM 0 HA SER A 77 1.108 7.491 -4.376 1.00 0.00 H new ATOM 0 HB2 SER A 77 -0.069 10.272 -3.986 1.00 0.00 H new ATOM 0 HB3 SER A 77 -0.147 9.045 -2.738 1.00 0.00 H new ATOM 0 HG SER A 77 1.747 10.380 -2.539 1.00 0.00 H new ATOM 1161 N GLU A 78 -1.751 8.269 -5.667 1.00 0.00 N ATOM 1162 CA GLU A 78 -3.106 7.863 -5.875 1.00 0.00 C ATOM 1163 C GLU A 78 -3.205 6.768 -6.881 1.00 0.00 C ATOM 1164 O GLU A 78 -4.035 5.871 -6.748 1.00 0.00 O ATOM 1165 CB GLU A 78 -3.910 9.086 -6.346 1.00 0.00 C ATOM 1166 CG GLU A 78 -5.423 8.865 -6.278 1.00 0.00 C ATOM 1167 CD GLU A 78 -6.309 10.055 -6.618 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -6.302 10.953 -5.734 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -7.107 10.003 -7.592 1.00 0.00 O ATOM 0 H GLU A 78 -1.481 9.089 -6.210 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.508 7.477 -4.938 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -3.646 9.947 -5.732 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -3.629 9.327 -7.371 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -5.677 8.049 -6.954 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -5.672 8.533 -5.270 1.00 0.00 H new ATOM 1176 N GLU A 79 -2.367 6.849 -7.930 1.00 0.00 N ATOM 1177 CA GLU A 79 -2.143 5.831 -8.909 1.00 0.00 C ATOM 1178 C GLU A 79 -1.579 4.562 -8.368 1.00 0.00 C ATOM 1179 O GLU A 79 -1.788 3.493 -8.940 1.00 0.00 O ATOM 1180 CB GLU A 79 -1.282 6.318 -10.086 1.00 0.00 C ATOM 1181 CG GLU A 79 -1.210 5.413 -11.317 1.00 0.00 C ATOM 1182 CD GLU A 79 -0.883 6.110 -12.630 1.00 0.00 C ATOM 1183 OE1 GLU A 79 -1.420 7.237 -12.803 1.00 0.00 O ATOM 1184 OE2 GLU A 79 -0.324 5.439 -13.538 1.00 0.00 O ATOM 0 H GLU A 79 -1.808 7.684 -8.105 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.146 5.604 -9.271 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -1.660 7.290 -10.402 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -0.267 6.474 -9.721 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -0.458 4.645 -11.137 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -2.167 4.902 -11.426 1.00 0.00 H new ATOM 1191 N GLU A 80 -0.971 4.599 -7.169 1.00 0.00 N ATOM 1192 CA GLU A 80 -0.511 3.437 -6.475 1.00 0.00 C ATOM 1193 C GLU A 80 -1.617 2.660 -5.848 1.00 0.00 C ATOM 1194 O GLU A 80 -1.709 1.436 -5.923 1.00 0.00 O ATOM 1195 CB GLU A 80 0.509 3.882 -5.413 1.00 0.00 C ATOM 1196 CG GLU A 80 1.439 2.741 -4.996 1.00 0.00 C ATOM 1197 CD GLU A 80 2.376 3.274 -3.922 1.00 0.00 C ATOM 1198 OE1 GLU A 80 1.943 3.464 -2.754 1.00 0.00 O ATOM 1199 OE2 GLU A 80 3.574 3.564 -4.184 1.00 0.00 O ATOM 0 H GLU A 80 -0.794 5.468 -6.665 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.048 2.766 -7.198 1.00 0.00 H new ATOM 0 HB2 GLU A 80 1.102 4.708 -5.804 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.020 4.257 -4.537 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.862 1.898 -4.616 1.00 0.00 H new ATOM 0 HG3 GLU A 80 2.007 2.378 -5.853 1.00 0.00 H new ATOM 1206 N ILE A 81 -2.560 3.355 -5.188 1.00 0.00 N ATOM 1207 CA ILE A 81 -3.799 2.816 -4.718 1.00 0.00 C ATOM 1208 C ILE A 81 -4.594 2.205 -5.820 1.00 0.00 C ATOM 1209 O ILE A 81 -5.104 1.086 -5.823 1.00 0.00 O ATOM 1210 CB ILE A 81 -4.646 3.811 -3.982 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -3.844 4.487 -2.858 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -5.935 3.272 -3.338 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -4.469 5.730 -2.226 1.00 0.00 C ATOM 0 H ILE A 81 -2.452 4.346 -4.971 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.513 2.041 -4.007 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.944 4.500 -4.772 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -3.675 3.753 -2.071 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -2.866 4.761 -3.254 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -6.459 4.086 -2.837 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -6.577 2.848 -4.110 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.683 2.500 -2.611 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -3.809 6.114 -1.448 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.612 6.494 -2.990 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -5.433 5.470 -1.788 1.00 0.00 H new ATOM 1225 N ARG A 82 -4.707 2.995 -6.903 1.00 0.00 N ATOM 1226 CA ARG A 82 -5.409 2.700 -8.113 1.00 0.00 C ATOM 1227 C ARG A 82 -4.947 1.432 -8.745 1.00 0.00 C ATOM 1228 O ARG A 82 -5.705 0.655 -9.323 1.00 0.00 O ATOM 1229 CB ARG A 82 -5.422 3.879 -9.101 1.00 0.00 C ATOM 1230 CG ARG A 82 -6.322 3.764 -10.332 1.00 0.00 C ATOM 1231 CD ARG A 82 -6.298 5.063 -11.139 1.00 0.00 C ATOM 1232 NE ARG A 82 -7.220 4.973 -12.307 1.00 0.00 N ATOM 1233 CZ ARG A 82 -7.658 6.103 -12.933 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -7.403 7.334 -12.403 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -8.302 6.044 -14.136 1.00 0.00 N ATOM 0 H ARG A 82 -4.270 3.916 -6.932 1.00 0.00 H new ATOM 0 HA ARG A 82 -6.448 2.540 -7.825 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -5.717 4.773 -8.552 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -4.400 4.039 -9.446 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -5.989 2.935 -10.957 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -7.343 3.540 -10.023 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -6.590 5.898 -10.502 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -5.284 5.264 -11.484 1.00 0.00 H new ATOM 0 HE ARG A 82 -7.526 4.059 -12.641 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -6.880 7.415 -11.531 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -7.735 8.173 -12.879 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -8.464 5.142 -14.584 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -8.621 6.902 -14.586 1.00 0.00 H new ATOM 1249 N GLU A 83 -3.644 1.115 -8.644 1.00 0.00 N ATOM 1250 CA GLU A 83 -3.062 -0.063 -9.207 1.00 0.00 C ATOM 1251 C GLU A 83 -3.346 -1.230 -8.325 1.00 0.00 C ATOM 1252 O GLU A 83 -3.775 -2.279 -8.803 1.00 0.00 O ATOM 1253 CB GLU A 83 -1.590 0.284 -9.483 1.00 0.00 C ATOM 1254 CG GLU A 83 -0.830 -0.735 -10.334 1.00 0.00 C ATOM 1255 CD GLU A 83 -1.509 -0.925 -11.683 1.00 0.00 C ATOM 1256 OE1 GLU A 83 -1.666 0.055 -12.460 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -1.991 -2.029 -12.052 1.00 0.00 O ATOM 0 H GLU A 83 -2.970 1.702 -8.151 1.00 0.00 H new ATOM 0 HA GLU A 83 -3.487 -0.378 -10.160 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -1.549 1.253 -9.981 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.074 0.394 -8.529 1.00 0.00 H new ATOM 0 HG2 GLU A 83 0.196 -0.399 -10.482 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -0.780 -1.689 -9.809 1.00 0.00 H new ATOM 1264 N ALA A 84 -3.247 -1.030 -6.998 1.00 0.00 N ATOM 1265 CA ALA A 84 -3.389 -2.051 -6.007 1.00 0.00 C ATOM 1266 C ALA A 84 -4.774 -2.595 -5.926 1.00 0.00 C ATOM 1267 O ALA A 84 -4.936 -3.803 -5.761 1.00 0.00 O ATOM 1268 CB ALA A 84 -2.927 -1.520 -4.640 1.00 0.00 C ATOM 0 H ALA A 84 -3.059 -0.111 -6.597 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.754 -2.884 -6.307 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.038 -2.303 -3.889 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.881 -1.221 -4.701 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.535 -0.660 -4.360 1.00 0.00 H new ATOM 1274 N PHE A 85 -5.775 -1.725 -6.146 1.00 0.00 N ATOM 1275 CA PHE A 85 -7.133 -2.059 -6.443 1.00 0.00 C ATOM 1276 C PHE A 85 -7.340 -3.302 -7.239 1.00 0.00 C ATOM 1277 O PHE A 85 -8.065 -4.209 -6.832 1.00 0.00 O ATOM 1278 CB PHE A 85 -7.752 -0.871 -7.199 1.00 0.00 C ATOM 1279 CG PHE A 85 -9.230 -0.859 -7.011 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -10.000 -1.758 -7.710 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -9.856 -0.061 -6.083 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -11.317 -1.955 -7.367 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -11.198 -0.183 -5.808 1.00 0.00 C ATOM 1284 CZ PHE A 85 -11.909 -1.218 -6.369 1.00 0.00 C ATOM 0 H PHE A 85 -5.624 -0.717 -6.114 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.612 -2.261 -5.485 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -7.324 0.064 -6.837 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.513 -0.941 -8.260 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -9.569 -2.311 -8.531 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -9.278 0.683 -5.555 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -11.896 -2.701 -7.891 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -11.688 0.527 -5.158 1.00 0.00 H new ATOM 0 HZ PHE A 85 -12.910 -1.447 -6.033 1.00 0.00 H new ATOM 1294 N ARG A 86 -6.814 -3.397 -8.473 1.00 0.00 N ATOM 1295 CA ARG A 86 -7.094 -4.397 -9.455 1.00 0.00 C ATOM 1296 C ARG A 86 -6.252 -5.623 -9.378 1.00 0.00 C ATOM 1297 O ARG A 86 -6.302 -6.543 -10.194 1.00 0.00 O ATOM 1298 CB ARG A 86 -7.114 -3.802 -10.873 1.00 0.00 C ATOM 1299 CG ARG A 86 -5.831 -3.074 -11.281 1.00 0.00 C ATOM 1300 CD ARG A 86 -6.001 -2.249 -12.558 1.00 0.00 C ATOM 1301 NE ARG A 86 -4.710 -1.660 -13.010 1.00 0.00 N ATOM 1302 CZ ARG A 86 -4.578 -1.025 -14.211 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -5.644 -0.490 -14.875 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -3.297 -0.648 -14.499 1.00 0.00 N ATOM 0 H ARG A 86 -6.135 -2.715 -8.810 1.00 0.00 H new ATOM 0 HA ARG A 86 -8.096 -4.750 -9.210 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -7.302 -4.605 -11.586 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -7.950 -3.106 -10.948 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -5.516 -2.418 -10.469 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -5.035 -3.804 -11.428 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -6.409 -2.880 -13.347 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -6.723 -1.452 -12.382 1.00 0.00 H new ATOM 0 HE ARG A 86 -3.896 -1.734 -12.400 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -6.580 -0.557 -14.475 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -5.505 -0.023 -15.771 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -2.546 -0.849 -13.839 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -3.092 -0.166 -15.374 1.00 0.00 H new ATOM 1318 N VAL A 87 -5.329 -5.759 -8.409 1.00 0.00 N ATOM 1319 CA VAL A 87 -4.810 -7.006 -7.938 1.00 0.00 C ATOM 1320 C VAL A 87 -5.784 -7.819 -7.156 1.00 0.00 C ATOM 1321 O VAL A 87 -5.899 -9.026 -7.364 1.00 0.00 O ATOM 1322 CB VAL A 87 -3.541 -6.762 -7.177 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -2.762 -7.970 -6.628 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -2.687 -6.041 -8.233 1.00 0.00 C ATOM 0 H VAL A 87 -4.923 -4.956 -7.929 1.00 0.00 H new ATOM 0 HA VAL A 87 -4.598 -7.617 -8.816 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.779 -6.234 -6.254 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.872 -7.621 -6.105 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.394 -8.527 -5.937 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.467 -8.618 -7.453 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -1.713 -5.797 -7.809 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -2.553 -6.690 -9.098 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -3.188 -5.124 -8.542 1.00 0.00 H new ATOM 1334 N PHE A 88 -6.571 -7.150 -6.295 1.00 0.00 N ATOM 1335 CA PHE A 88 -7.636 -7.748 -5.550 1.00 0.00 C ATOM 1336 C PHE A 88 -8.700 -8.136 -6.519 1.00 0.00 C ATOM 1337 O PHE A 88 -9.222 -9.245 -6.422 1.00 0.00 O ATOM 1338 CB PHE A 88 -8.231 -7.022 -4.332 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.278 -6.609 -3.264 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -6.443 -5.524 -3.392 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -7.327 -7.217 -2.031 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -5.736 -5.066 -2.305 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -6.579 -6.764 -0.971 1.00 0.00 C ATOM 1344 CZ PHE A 88 -5.744 -5.675 -1.073 1.00 0.00 C ATOM 0 H PHE A 88 -6.461 -6.153 -6.110 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.160 -8.588 -5.045 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -8.750 -6.132 -4.687 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.983 -7.671 -3.884 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -6.342 -5.031 -4.348 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -7.971 -8.073 -1.892 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -5.139 -4.174 -2.427 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -6.649 -7.281 -0.025 1.00 0.00 H new ATOM 0 HZ PHE A 88 -5.141 -5.326 -0.248 1.00 0.00 H new ATOM 1354 N ASP A 89 -9.084 -7.201 -7.407 1.00 0.00 N ATOM 1355 CA ASP A 89 -10.164 -7.471 -8.304 1.00 0.00 C ATOM 1356 C ASP A 89 -9.706 -8.277 -9.471 1.00 0.00 C ATOM 1357 O ASP A 89 -8.879 -7.784 -10.237 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.627 -6.120 -8.875 1.00 0.00 C ATOM 1359 CG ASP A 89 -11.914 -6.130 -9.689 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -12.595 -7.190 -9.701 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -12.294 -5.081 -10.272 1.00 0.00 O ATOM 0 H ASP A 89 -8.658 -6.279 -7.504 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.943 -8.010 -7.765 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -10.754 -5.425 -8.045 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.829 -5.724 -9.503 1.00 0.00 H new ATOM 1366 N LYS A 90 -10.176 -9.516 -9.700 1.00 0.00 N ATOM 1367 CA LYS A 90 -9.606 -10.330 -10.728 1.00 0.00 C ATOM 1368 C LYS A 90 -10.235 -9.989 -12.035 1.00 0.00 C ATOM 1369 O LYS A 90 -9.509 -9.709 -12.988 1.00 0.00 O ATOM 1370 CB LYS A 90 -9.733 -11.822 -10.377 1.00 0.00 C ATOM 1371 CG LYS A 90 -9.004 -12.811 -11.289 1.00 0.00 C ATOM 1372 CD LYS A 90 -7.481 -12.822 -11.152 1.00 0.00 C ATOM 1373 CE LYS A 90 -6.705 -13.781 -12.057 1.00 0.00 C ATOM 1374 NZ LYS A 90 -6.693 -13.206 -13.421 1.00 0.00 N ATOM 0 H LYS A 90 -10.940 -9.950 -9.182 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.538 -10.127 -10.811 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.366 -11.964 -9.360 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.792 -12.081 -10.373 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.379 -13.814 -11.084 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -9.258 -12.582 -12.324 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -7.118 -11.812 -11.340 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.237 -13.062 -10.117 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -5.687 -13.914 -11.690 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -7.173 -14.765 -12.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -6.171 -13.839 -14.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -7.670 -13.100 -13.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -6.230 -12.275 -13.401 1.00 0.00 H new ATOM 1388 N ASP A 91 -11.576 -9.895 -12.087 1.00 0.00 N ATOM 1389 CA ASP A 91 -12.220 -9.795 -13.360 1.00 0.00 C ATOM 1390 C ASP A 91 -12.039 -8.426 -13.919 1.00 0.00 C ATOM 1391 O ASP A 91 -11.783 -8.279 -15.113 1.00 0.00 O ATOM 1392 CB ASP A 91 -13.628 -10.415 -13.367 1.00 0.00 C ATOM 1393 CG ASP A 91 -14.534 -9.714 -12.364 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -14.130 -8.714 -11.712 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -15.716 -10.142 -12.283 1.00 0.00 O ATOM 0 H ASP A 91 -12.197 -9.888 -11.278 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.727 -10.435 -14.092 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -14.058 -10.340 -14.366 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -13.564 -11.476 -13.126 1.00 0.00 H new ATOM 1400 N GLY A 92 -12.128 -7.356 -13.110 1.00 0.00 N ATOM 1401 CA GLY A 92 -11.882 -6.007 -13.515 1.00 0.00 C ATOM 1402 C GLY A 92 -13.172 -5.276 -13.662 1.00 0.00 C ATOM 1403 O GLY A 92 -13.353 -4.501 -14.600 1.00 0.00 O ATOM 0 H GLY A 92 -12.384 -7.435 -12.126 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -11.253 -5.507 -12.779 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -11.338 -5.996 -14.460 1.00 0.00 H new ATOM 1407 N ASN A 93 -14.165 -5.560 -12.801 1.00 0.00 N ATOM 1408 CA ASN A 93 -15.420 -4.876 -12.782 1.00 0.00 C ATOM 1409 C ASN A 93 -15.386 -3.587 -12.036 1.00 0.00 C ATOM 1410 O ASN A 93 -16.121 -2.651 -12.349 1.00 0.00 O ATOM 1411 CB ASN A 93 -16.605 -5.822 -12.527 1.00 0.00 C ATOM 1412 CG ASN A 93 -16.570 -6.534 -11.182 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -15.579 -6.455 -10.458 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -17.618 -7.363 -10.928 1.00 0.00 N ATOM 0 H ASN A 93 -14.092 -6.291 -12.094 1.00 0.00 H new ATOM 0 HA ASN A 93 -15.621 -4.522 -13.793 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -17.531 -5.251 -12.597 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -16.632 -6.571 -13.319 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -17.607 -7.960 -10.101 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -18.415 -7.387 -11.564 1.00 0.00 H new ATOM 1421 N GLY A 94 -14.468 -3.546 -11.054 1.00 0.00 N ATOM 1422 CA GLY A 94 -14.239 -2.391 -10.242 1.00 0.00 C ATOM 1423 C GLY A 94 -14.711 -2.514 -8.834 1.00 0.00 C ATOM 1424 O GLY A 94 -15.089 -1.480 -8.287 1.00 0.00 O ATOM 0 H GLY A 94 -13.869 -4.337 -10.818 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.171 -2.175 -10.235 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.734 -1.536 -10.703 1.00 0.00 H new ATOM 1428 N TYR A 95 -14.858 -3.793 -8.442 1.00 0.00 N ATOM 1429 CA TYR A 95 -15.600 -4.277 -7.320 1.00 0.00 C ATOM 1430 C TYR A 95 -14.863 -5.534 -7.010 1.00 0.00 C ATOM 1431 O TYR A 95 -14.774 -6.499 -7.767 1.00 0.00 O ATOM 1432 CB TYR A 95 -17.052 -4.684 -7.622 1.00 0.00 C ATOM 1433 CG TYR A 95 -17.908 -3.522 -7.993 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -18.271 -2.658 -6.986 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -18.450 -3.398 -9.251 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -19.135 -1.621 -7.248 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -19.348 -2.390 -9.514 1.00 0.00 C ATOM 1438 CZ TYR A 95 -19.624 -1.476 -8.525 1.00 0.00 C ATOM 1439 OH TYR A 95 -20.512 -0.410 -8.783 1.00 0.00 O ATOM 0 H TYR A 95 -14.417 -4.554 -8.958 1.00 0.00 H new ATOM 0 HA TYR A 95 -15.669 -3.509 -6.549 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -17.060 -5.411 -8.435 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -17.476 -5.178 -6.748 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -17.877 -2.794 -5.990 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -18.171 -4.091 -10.031 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -19.424 -0.934 -6.466 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -19.827 -2.318 -10.479 1.00 0.00 H new ATOM 0 HH TYR A 95 -20.778 -0.427 -9.726 1.00 0.00 H new ATOM 1449 N ILE A 96 -14.360 -5.490 -5.763 1.00 0.00 N ATOM 1450 CA ILE A 96 -13.748 -6.623 -5.141 1.00 0.00 C ATOM 1451 C ILE A 96 -14.866 -7.374 -4.504 1.00 0.00 C ATOM 1452 O ILE A 96 -15.504 -6.887 -3.573 1.00 0.00 O ATOM 1453 CB ILE A 96 -12.710 -6.259 -4.121 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -11.911 -5.104 -4.749 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.815 -7.435 -3.697 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -11.123 -4.244 -3.762 1.00 0.00 C ATOM 0 H ILE A 96 -14.378 -4.655 -5.178 1.00 0.00 H new ATOM 0 HA ILE A 96 -13.210 -7.210 -5.885 1.00 0.00 H new ATOM 0 HB ILE A 96 -13.182 -5.963 -3.184 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -11.216 -5.519 -5.479 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -12.601 -4.461 -5.295 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -11.090 -7.093 -2.958 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -12.431 -8.223 -3.264 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -11.288 -7.824 -4.568 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -10.595 -3.459 -4.304 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -11.809 -3.792 -3.045 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -10.402 -4.866 -3.232 1.00 0.00 H new ATOM 1468 N SER A 97 -15.062 -8.616 -4.983 1.00 0.00 N ATOM 1469 CA SER A 97 -15.918 -9.511 -4.268 1.00 0.00 C ATOM 1470 C SER A 97 -15.173 -10.258 -3.217 1.00 0.00 C ATOM 1471 O SER A 97 -13.944 -10.266 -3.185 1.00 0.00 O ATOM 1472 CB SER A 97 -16.719 -10.513 -5.118 1.00 0.00 C ATOM 1473 OG SER A 97 -15.824 -11.336 -5.851 1.00 0.00 O ATOM 0 H SER A 97 -14.645 -8.991 -5.835 1.00 0.00 H new ATOM 0 HA SER A 97 -16.655 -8.840 -3.827 1.00 0.00 H new ATOM 0 HB2 SER A 97 -17.351 -11.127 -4.476 1.00 0.00 H new ATOM 0 HB3 SER A 97 -17.381 -9.980 -5.800 1.00 0.00 H new ATOM 0 HG SER A 97 -15.194 -10.773 -6.348 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.906 -10.934 -2.314 1.00 0.00 N ATOM 1480 CA ALA A 98 -15.383 -11.684 -1.214 1.00 0.00 C ATOM 1481 C ALA A 98 -14.420 -12.772 -1.546 1.00 0.00 C ATOM 1482 O ALA A 98 -13.302 -12.848 -1.038 1.00 0.00 O ATOM 1483 CB ALA A 98 -16.530 -12.259 -0.366 1.00 0.00 C ATOM 0 H ALA A 98 -16.925 -10.958 -2.355 1.00 0.00 H new ATOM 0 HA ALA A 98 -14.796 -10.953 -0.658 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -16.117 -12.827 0.467 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -17.142 -11.443 0.019 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -17.145 -12.914 -0.983 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.765 -13.507 -2.617 1.00 0.00 N ATOM 1490 CA ALA A 99 -14.023 -14.589 -3.186 1.00 0.00 C ATOM 1491 C ALA A 99 -12.695 -14.222 -3.754 1.00 0.00 C ATOM 1492 O ALA A 99 -11.662 -14.806 -3.431 1.00 0.00 O ATOM 1493 CB ALA A 99 -14.976 -15.105 -4.277 1.00 0.00 C ATOM 0 H ALA A 99 -15.632 -13.330 -3.125 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.751 -15.321 -2.426 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -14.516 -15.947 -4.794 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -15.912 -15.427 -3.820 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.177 -14.307 -4.992 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.714 -13.150 -4.566 1.00 0.00 N ATOM 1500 CA GLU A 100 -11.524 -12.546 -5.080 1.00 0.00 C ATOM 1501 C GLU A 100 -10.589 -11.940 -4.092 1.00 0.00 C ATOM 1502 O GLU A 100 -9.376 -12.052 -4.262 1.00 0.00 O ATOM 1503 CB GLU A 100 -11.920 -11.366 -5.983 1.00 0.00 C ATOM 1504 CG GLU A 100 -12.565 -11.680 -7.334 1.00 0.00 C ATOM 1505 CD GLU A 100 -13.205 -10.459 -7.978 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -13.929 -9.700 -7.280 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -12.969 -10.264 -9.201 1.00 0.00 O ATOM 0 H GLU A 100 -13.573 -12.693 -4.872 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.013 -13.379 -5.563 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -12.609 -10.734 -5.423 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -11.024 -10.774 -6.170 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.810 -12.086 -8.007 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -13.321 -12.453 -7.200 1.00 0.00 H new ATOM 1514 N LEU A 101 -11.173 -11.345 -3.036 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.412 -10.957 -1.890 1.00 0.00 C ATOM 1516 C LEU A 101 -9.693 -12.067 -1.202 1.00 0.00 C ATOM 1517 O LEU A 101 -8.470 -12.165 -1.106 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.324 -10.272 -0.858 1.00 0.00 C ATOM 1519 CG LEU A 101 -10.795 -9.930 0.545 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -9.541 -9.045 0.444 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -11.926 -9.244 1.329 1.00 0.00 C ATOM 0 H LEU A 101 -12.169 -11.133 -2.976 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.651 -10.282 -2.281 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.674 -9.342 -1.305 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -12.197 -10.911 -0.726 1.00 0.00 H new ATOM 0 HG LEU A 101 -10.496 -10.834 1.075 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.179 -8.812 1.445 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -8.765 -9.575 -0.108 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -9.789 -8.120 -0.077 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.574 -8.991 2.329 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.228 -8.334 0.810 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.778 -9.919 1.404 1.00 0.00 H new ATOM 1533 N ARG A 102 -10.388 -13.206 -1.036 1.00 0.00 N ATOM 1534 CA ARG A 102 -9.914 -14.420 -0.449 1.00 0.00 C ATOM 1535 C ARG A 102 -8.851 -15.110 -1.234 1.00 0.00 C ATOM 1536 O ARG A 102 -7.758 -15.333 -0.714 1.00 0.00 O ATOM 1537 CB ARG A 102 -11.145 -15.327 -0.283 1.00 0.00 C ATOM 1538 CG ARG A 102 -10.958 -16.420 0.772 1.00 0.00 C ATOM 1539 CD ARG A 102 -12.118 -17.417 0.767 1.00 0.00 C ATOM 1540 NE ARG A 102 -12.042 -18.219 2.021 1.00 0.00 N ATOM 1541 CZ ARG A 102 -13.117 -18.786 2.641 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -14.400 -18.462 2.303 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -12.953 -19.527 3.776 1.00 0.00 N ATOM 0 H ARG A 102 -11.360 -13.282 -1.337 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.434 -14.187 0.501 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -12.005 -14.714 -0.012 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.375 -15.793 -1.241 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -10.023 -16.949 0.586 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.875 -15.963 1.758 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -13.071 -16.892 0.708 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -12.058 -18.067 -0.106 1.00 0.00 H new ATOM 0 HE ARG A 102 -11.124 -18.353 2.444 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -14.576 -17.778 1.567 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -15.182 -18.904 2.786 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -12.021 -19.661 4.168 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -13.763 -19.947 4.232 1.00 0.00 H new ATOM 1557 N HIS A 103 -9.061 -15.310 -2.547 1.00 0.00 N ATOM 1558 CA HIS A 103 -8.148 -15.787 -3.538 1.00 0.00 C ATOM 1559 C HIS A 103 -6.807 -15.139 -3.567 1.00 0.00 C ATOM 1560 O HIS A 103 -5.853 -15.915 -3.615 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.844 -15.697 -4.907 1.00 0.00 C ATOM 1562 CG HIS A 103 -10.109 -16.441 -5.215 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -10.796 -16.306 -6.404 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -10.884 -17.266 -4.461 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -11.949 -17.015 -6.284 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -12.032 -17.645 -5.127 1.00 0.00 N ATOM 0 H HIS A 103 -9.975 -15.114 -2.956 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.910 -16.816 -3.269 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -9.051 -14.642 -5.083 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -8.110 -16.006 -5.651 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -10.631 -17.586 -3.461 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -12.711 -17.058 -7.048 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -12.772 -18.267 -4.801 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.599 -13.816 -3.444 1.00 0.00 N ATOM 1575 CA VAL A 104 -5.300 -13.231 -3.573 1.00 0.00 C ATOM 1576 C VAL A 104 -4.503 -13.543 -2.353 1.00 0.00 C ATOM 1577 O VAL A 104 -3.298 -13.768 -2.462 1.00 0.00 O ATOM 1578 CB VAL A 104 -5.425 -11.801 -4.007 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -5.689 -10.836 -2.839 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -4.172 -11.359 -4.782 1.00 0.00 C ATOM 0 H VAL A 104 -7.341 -13.143 -3.253 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.707 -13.666 -4.377 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.296 -11.755 -4.661 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -5.769 -9.818 -3.219 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -6.619 -11.112 -2.342 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -4.866 -10.893 -2.127 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -4.282 -10.319 -5.088 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -3.295 -11.458 -4.143 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.050 -11.986 -5.665 1.00 0.00 H new ATOM 1590 N MET A 105 -5.137 -13.683 -1.176 1.00 0.00 N ATOM 1591 CA MET A 105 -4.452 -13.946 0.052 1.00 0.00 C ATOM 1592 C MET A 105 -4.075 -15.385 0.129 1.00 0.00 C ATOM 1593 O MET A 105 -3.161 -15.860 0.801 1.00 0.00 O ATOM 1594 CB MET A 105 -5.223 -13.543 1.320 1.00 0.00 C ATOM 1595 CG MET A 105 -5.376 -12.029 1.485 1.00 0.00 C ATOM 1596 SD MET A 105 -5.831 -11.386 3.124 1.00 0.00 S ATOM 1597 CE MET A 105 -6.805 -9.936 2.627 1.00 0.00 C ATOM 0 H MET A 105 -6.149 -13.612 -1.075 1.00 0.00 H new ATOM 0 HA MET A 105 -3.566 -13.312 0.030 1.00 0.00 H new ATOM 0 HB2 MET A 105 -6.212 -14.000 1.295 1.00 0.00 H new ATOM 0 HB3 MET A 105 -4.708 -13.946 2.192 1.00 0.00 H new ATOM 0 HG2 MET A 105 -4.433 -11.565 1.195 1.00 0.00 H new ATOM 0 HG3 MET A 105 -6.129 -11.691 0.774 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.718 -9.161 3.388 1.00 0.00 H new ATOM 0 HE2 MET A 105 -6.431 -9.555 1.677 1.00 0.00 H new ATOM 0 HE3 MET A 105 -7.851 -10.221 2.517 1.00 0.00 H new ATOM 1607 N THR A 106 -4.855 -16.242 -0.553 1.00 0.00 N ATOM 1608 CA THR A 106 -4.611 -17.640 -0.731 1.00 0.00 C ATOM 1609 C THR A 106 -3.468 -17.899 -1.651 1.00 0.00 C ATOM 1610 O THR A 106 -2.658 -18.812 -1.502 1.00 0.00 O ATOM 1611 CB THR A 106 -5.789 -18.477 -1.135 1.00 0.00 C ATOM 1612 OG1 THR A 106 -6.869 -18.171 -0.264 1.00 0.00 O ATOM 1613 CG2 THR A 106 -5.555 -19.996 -1.151 1.00 0.00 C ATOM 0 H THR A 106 -5.714 -15.937 -1.011 1.00 0.00 H new ATOM 0 HA THR A 106 -4.361 -17.966 0.279 1.00 0.00 H new ATOM 0 HB THR A 106 -6.000 -18.221 -2.173 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.177 -17.256 -0.433 1.00 0.00 H new ATOM 0 HG21 THR A 106 -6.471 -20.502 -1.457 1.00 0.00 H new ATOM 0 HG22 THR A 106 -4.757 -20.234 -1.854 1.00 0.00 H new ATOM 0 HG23 THR A 106 -5.271 -20.331 -0.153 1.00 0.00 H new ATOM 1621 N ASN A 107 -3.270 -17.064 -2.686 1.00 0.00 N ATOM 1622 CA ASN A 107 -2.092 -16.913 -3.483 1.00 0.00 C ATOM 1623 C ASN A 107 -0.843 -16.709 -2.696 1.00 0.00 C ATOM 1624 O ASN A 107 0.180 -17.335 -2.969 1.00 0.00 O ATOM 1625 CB ASN A 107 -2.129 -15.973 -4.700 1.00 0.00 C ATOM 1626 CG ASN A 107 -3.238 -16.252 -5.704 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -4.047 -17.175 -5.626 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -3.345 -15.273 -6.642 1.00 0.00 N ATOM 0 H ASN A 107 -4.010 -16.433 -2.993 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.077 -17.904 -3.937 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.233 -14.948 -4.344 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -1.171 -16.035 -5.216 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.115 -15.289 -7.311 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -2.655 -14.523 -6.677 1.00 0.00 H new ATOM 1635 N LEU A 108 -0.957 -15.869 -1.651 1.00 0.00 N ATOM 1636 CA LEU A 108 0.109 -15.480 -0.780 1.00 0.00 C ATOM 1637 C LEU A 108 0.404 -16.435 0.325 1.00 0.00 C ATOM 1638 O LEU A 108 1.520 -16.468 0.842 1.00 0.00 O ATOM 1639 CB LEU A 108 -0.156 -14.074 -0.217 1.00 0.00 C ATOM 1640 CG LEU A 108 -0.086 -12.980 -1.296 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -0.761 -11.646 -0.936 1.00 0.00 C ATOM 1642 CD2 LEU A 108 1.374 -12.788 -1.742 1.00 0.00 C ATOM 0 H LEU A 108 -1.846 -15.436 -1.400 1.00 0.00 H new ATOM 0 HA LEU A 108 1.005 -15.482 -1.401 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.140 -14.054 0.252 1.00 0.00 H new ATOM 0 HB3 LEU A 108 0.573 -13.856 0.563 1.00 0.00 H new ATOM 0 HG LEU A 108 -0.686 -13.343 -2.130 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -0.652 -10.948 -1.766 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -1.820 -11.815 -0.740 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.290 -11.228 -0.046 1.00 0.00 H new ATOM 0 HD21 LEU A 108 1.422 -12.013 -2.507 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.980 -12.491 -0.886 1.00 0.00 H new ATOM 0 HD23 LEU A 108 1.756 -13.724 -2.150 1.00 0.00 H new ATOM 1654 N GLY A 109 -0.558 -17.329 0.614 1.00 0.00 N ATOM 1655 CA GLY A 109 -0.521 -18.358 1.606 1.00 0.00 C ATOM 1656 C GLY A 109 -0.967 -17.977 2.976 1.00 0.00 C ATOM 1657 O GLY A 109 -0.351 -18.363 3.969 1.00 0.00 O ATOM 0 H GLY A 109 -1.442 -17.330 0.105 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -1.142 -19.185 1.263 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.501 -18.732 1.671 1.00 0.00 H new ATOM 1661 N GLU A 110 -2.009 -17.142 3.136 1.00 0.00 N ATOM 1662 CA GLU A 110 -2.676 -16.824 4.360 1.00 0.00 C ATOM 1663 C GLU A 110 -3.871 -17.711 4.435 1.00 0.00 C ATOM 1664 O GLU A 110 -4.520 -18.008 3.434 1.00 0.00 O ATOM 1665 CB GLU A 110 -3.068 -15.337 4.376 1.00 0.00 C ATOM 1666 CG GLU A 110 -3.826 -14.771 5.579 1.00 0.00 C ATOM 1667 CD GLU A 110 -2.978 -14.642 6.836 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -1.930 -15.305 7.058 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -3.270 -13.702 7.622 1.00 0.00 O ATOM 0 H GLU A 110 -2.418 -16.649 2.342 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.034 -16.986 5.225 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -2.152 -14.756 4.264 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.674 -15.149 3.490 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -4.222 -13.790 5.318 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -4.680 -15.413 5.793 1.00 0.00 H new ATOM 1676 N LYS A 111 -4.217 -18.206 5.637 1.00 0.00 N ATOM 1677 CA LYS A 111 -5.343 -19.046 5.905 1.00 0.00 C ATOM 1678 C LYS A 111 -6.467 -18.258 6.483 1.00 0.00 C ATOM 1679 O LYS A 111 -6.509 -18.132 7.706 1.00 0.00 O ATOM 1680 CB LYS A 111 -4.977 -20.197 6.857 1.00 0.00 C ATOM 1681 CG LYS A 111 -6.093 -21.243 6.843 1.00 0.00 C ATOM 1682 CD LYS A 111 -6.099 -22.130 8.090 1.00 0.00 C ATOM 1683 CE LYS A 111 -6.665 -21.401 9.311 1.00 0.00 C ATOM 1684 NZ LYS A 111 -6.614 -22.262 10.513 1.00 0.00 N ATOM 0 H LYS A 111 -3.674 -18.006 6.477 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.657 -19.473 4.953 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -4.034 -20.651 6.551 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -4.834 -19.816 7.868 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -7.055 -20.738 6.759 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -5.984 -21.870 5.958 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -6.691 -23.024 7.896 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -5.083 -22.461 8.304 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -6.097 -20.488 9.489 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -7.695 -21.103 9.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -7.003 -21.745 11.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -7.175 -23.122 10.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -5.627 -22.525 10.710 1.00 0.00 H new ATOM 1698 N LEU A 112 -7.409 -17.696 5.706 1.00 0.00 N ATOM 1699 CA LEU A 112 -8.545 -16.956 6.162 1.00 0.00 C ATOM 1700 C LEU A 112 -9.700 -17.874 6.369 1.00 0.00 C ATOM 1701 O LEU A 112 -10.114 -18.662 5.519 1.00 0.00 O ATOM 1702 CB LEU A 112 -9.073 -16.028 5.054 1.00 0.00 C ATOM 1703 CG LEU A 112 -8.113 -14.880 4.698 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -8.529 -14.251 3.358 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -8.190 -13.849 5.836 1.00 0.00 C ATOM 0 H LEU A 112 -7.374 -17.764 4.689 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.222 -16.427 7.059 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.266 -16.619 4.159 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -10.027 -15.607 5.370 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.090 -15.241 4.590 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -7.846 -13.438 3.110 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -8.493 -15.008 2.574 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.543 -13.861 3.439 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.520 -13.017 5.619 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.212 -13.479 5.924 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.893 -14.319 6.773 1.00 0.00 H new ATOM 1717 N THR A 113 -10.361 -17.773 7.536 1.00 0.00 N ATOM 1718 CA THR A 113 -11.614 -18.427 7.753 1.00 0.00 C ATOM 1719 C THR A 113 -12.729 -17.634 7.163 1.00 0.00 C ATOM 1720 O THR A 113 -12.531 -16.507 6.712 1.00 0.00 O ATOM 1721 CB THR A 113 -11.945 -18.814 9.164 1.00 0.00 C ATOM 1722 OG1 THR A 113 -12.115 -17.670 9.988 1.00 0.00 O ATOM 1723 CG2 THR A 113 -10.924 -19.698 9.900 1.00 0.00 C ATOM 0 H THR A 113 -10.025 -17.235 8.334 1.00 0.00 H new ATOM 0 HA THR A 113 -11.493 -19.381 7.240 1.00 0.00 H new ATOM 0 HB THR A 113 -12.856 -19.396 9.023 1.00 0.00 H new ATOM 0 HG1 THR A 113 -12.536 -17.935 10.833 1.00 0.00 H new ATOM 0 HG21 THR A 113 -11.282 -19.905 10.908 1.00 0.00 H new ATOM 0 HG22 THR A 113 -10.799 -20.636 9.360 1.00 0.00 H new ATOM 0 HG23 THR A 113 -9.967 -19.180 9.954 1.00 0.00 H new ATOM 1731 N ASP A 114 -13.971 -18.148 7.125 1.00 0.00 N ATOM 1732 CA ASP A 114 -15.111 -17.506 6.548 1.00 0.00 C ATOM 1733 C ASP A 114 -15.525 -16.247 7.229 1.00 0.00 C ATOM 1734 O ASP A 114 -15.934 -15.285 6.581 1.00 0.00 O ATOM 1735 CB ASP A 114 -16.249 -18.536 6.469 1.00 0.00 C ATOM 1736 CG ASP A 114 -16.141 -19.484 5.283 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -16.236 -19.084 4.092 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -15.903 -20.684 5.585 1.00 0.00 O ATOM 0 H ASP A 114 -14.192 -19.063 7.519 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.838 -17.167 5.549 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -16.261 -19.121 7.389 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -17.201 -18.008 6.414 1.00 0.00 H new ATOM 1743 N GLU A 115 -15.374 -16.286 8.565 1.00 0.00 N ATOM 1744 CA GLU A 115 -15.423 -15.183 9.475 1.00 0.00 C ATOM 1745 C GLU A 115 -14.490 -14.041 9.263 1.00 0.00 C ATOM 1746 O GLU A 115 -14.918 -12.898 9.411 1.00 0.00 O ATOM 1747 CB GLU A 115 -15.136 -15.634 10.917 1.00 0.00 C ATOM 1748 CG GLU A 115 -15.878 -16.922 11.280 1.00 0.00 C ATOM 1749 CD GLU A 115 -15.067 -18.170 10.960 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -14.057 -18.361 11.688 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -15.396 -18.840 9.945 1.00 0.00 O ATOM 0 H GLU A 115 -15.203 -17.167 9.049 1.00 0.00 H new ATOM 0 HA GLU A 115 -16.436 -14.827 9.285 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -14.064 -15.787 11.041 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -15.427 -14.843 11.608 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -16.119 -16.912 12.343 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -16.824 -16.958 10.739 1.00 0.00 H new ATOM 1758 N GLU A 116 -13.258 -14.238 8.761 1.00 0.00 N ATOM 1759 CA GLU A 116 -12.249 -13.268 8.467 1.00 0.00 C ATOM 1760 C GLU A 116 -12.504 -12.536 7.194 1.00 0.00 C ATOM 1761 O GLU A 116 -12.363 -11.314 7.178 1.00 0.00 O ATOM 1762 CB GLU A 116 -10.810 -13.812 8.475 1.00 0.00 C ATOM 1763 CG GLU A 116 -10.446 -14.281 9.885 1.00 0.00 C ATOM 1764 CD GLU A 116 -9.052 -14.890 9.943 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -8.816 -16.056 9.528 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -8.154 -14.113 10.364 1.00 0.00 O ATOM 0 H GLU A 116 -12.937 -15.180 8.538 1.00 0.00 H new ATOM 0 HA GLU A 116 -12.325 -12.568 9.299 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -10.719 -14.639 7.771 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -10.116 -13.038 8.148 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -10.502 -13.437 10.573 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.177 -15.016 10.222 1.00 0.00 H new ATOM 1773 N VAL A 117 -12.947 -13.290 6.173 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.489 -12.800 4.943 1.00 0.00 C ATOM 1775 C VAL A 117 -14.666 -11.909 5.144 1.00 0.00 C ATOM 1776 O VAL A 117 -14.801 -10.788 4.656 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.792 -13.879 3.946 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -14.311 -13.241 2.646 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -12.535 -14.663 3.532 1.00 0.00 C ATOM 0 H VAL A 117 -12.925 -14.309 6.209 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.690 -12.196 4.513 1.00 0.00 H new ATOM 0 HB VAL A 117 -14.515 -14.541 4.423 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.532 -14.023 1.920 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.218 -12.674 2.856 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.551 -12.573 2.240 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.808 -15.432 2.809 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.813 -13.982 3.082 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -12.092 -15.131 4.411 1.00 0.00 H new ATOM 1789 N ASP A 118 -15.591 -12.374 6.003 1.00 0.00 N ATOM 1790 CA ASP A 118 -16.771 -11.701 6.449 1.00 0.00 C ATOM 1791 C ASP A 118 -16.373 -10.440 7.137 1.00 0.00 C ATOM 1792 O ASP A 118 -16.880 -9.378 6.779 1.00 0.00 O ATOM 1793 CB ASP A 118 -17.715 -12.665 7.186 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.077 -12.021 7.403 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -19.841 -11.888 6.410 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -19.395 -11.637 8.560 1.00 0.00 O ATOM 0 H ASP A 118 -15.504 -13.301 6.420 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.400 -11.370 5.622 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -17.829 -13.583 6.609 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -17.281 -12.944 8.146 1.00 0.00 H new ATOM 1801 N GLU A 119 -15.434 -10.502 8.097 1.00 0.00 N ATOM 1802 CA GLU A 119 -14.939 -9.323 8.738 1.00 0.00 C ATOM 1803 C GLU A 119 -14.329 -8.273 7.875 1.00 0.00 C ATOM 1804 O GLU A 119 -14.517 -7.076 8.087 1.00 0.00 O ATOM 1805 CB GLU A 119 -14.019 -9.533 9.953 1.00 0.00 C ATOM 1806 CG GLU A 119 -13.994 -8.379 10.958 1.00 0.00 C ATOM 1807 CD GLU A 119 -12.801 -8.430 11.901 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -12.832 -9.325 12.787 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -11.905 -7.545 11.852 1.00 0.00 O ATOM 0 H GLU A 119 -15.016 -11.371 8.430 1.00 0.00 H new ATOM 0 HA GLU A 119 -15.903 -8.950 9.084 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -14.331 -10.439 10.472 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -13.004 -9.704 9.595 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -13.980 -7.434 10.415 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -14.913 -8.396 11.544 1.00 0.00 H new ATOM 1816 N MET A 120 -13.508 -8.755 6.925 1.00 0.00 N ATOM 1817 CA MET A 120 -12.986 -7.977 5.845 1.00 0.00 C ATOM 1818 C MET A 120 -13.962 -7.222 5.009 1.00 0.00 C ATOM 1819 O MET A 120 -13.777 -6.012 4.891 1.00 0.00 O ATOM 1820 CB MET A 120 -11.821 -8.652 5.100 1.00 0.00 C ATOM 1821 CG MET A 120 -10.547 -8.858 5.921 1.00 0.00 C ATOM 1822 SD MET A 120 -9.033 -9.325 5.029 1.00 0.00 S ATOM 1823 CE MET A 120 -9.670 -10.940 4.494 1.00 0.00 C ATOM 0 H MET A 120 -13.195 -9.726 6.909 1.00 0.00 H new ATOM 0 HA MET A 120 -12.521 -7.135 6.357 1.00 0.00 H new ATOM 0 HB2 MET A 120 -12.159 -9.622 4.736 1.00 0.00 H new ATOM 0 HB3 MET A 120 -11.575 -8.051 4.225 1.00 0.00 H new ATOM 0 HG2 MET A 120 -10.345 -7.935 6.464 1.00 0.00 H new ATOM 0 HG3 MET A 120 -10.749 -9.628 6.666 1.00 0.00 H new ATOM 0 HE1 MET A 120 -8.844 -11.559 4.144 1.00 0.00 H new ATOM 0 HE2 MET A 120 -10.163 -11.433 5.332 1.00 0.00 H new ATOM 0 HE3 MET A 120 -10.386 -10.799 3.685 1.00 0.00 H new ATOM 1833 N ILE A 121 -14.968 -7.836 4.362 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.022 -7.150 3.680 1.00 0.00 C ATOM 1835 C ILE A 121 -16.808 -6.353 4.663 1.00 0.00 C ATOM 1836 O ILE A 121 -17.068 -5.180 4.401 1.00 0.00 O ATOM 1837 CB ILE A 121 -16.863 -8.132 2.921 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -15.980 -8.828 1.871 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -18.068 -7.361 2.357 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -15.183 -7.884 0.972 1.00 0.00 C ATOM 0 H ILE A 121 -15.051 -8.851 4.312 1.00 0.00 H new ATOM 0 HA ILE A 121 -15.613 -6.454 2.948 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.264 -8.935 3.540 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.284 -9.491 2.385 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.613 -9.455 1.244 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.706 -8.043 1.796 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -18.637 -6.924 3.178 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.716 -6.568 1.697 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.592 -8.467 0.266 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -15.869 -7.237 0.425 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -14.519 -7.273 1.584 1.00 0.00 H new ATOM 1852 N ARG A 122 -17.233 -6.801 5.858 1.00 0.00 N ATOM 1853 CA ARG A 122 -18.003 -5.962 6.723 1.00 0.00 C ATOM 1854 C ARG A 122 -17.430 -4.689 7.245 1.00 0.00 C ATOM 1855 O ARG A 122 -18.180 -3.727 7.405 1.00 0.00 O ATOM 1856 CB ARG A 122 -18.611 -6.663 7.949 1.00 0.00 C ATOM 1857 CG ARG A 122 -19.990 -6.183 8.405 1.00 0.00 C ATOM 1858 CD ARG A 122 -20.645 -6.865 9.609 1.00 0.00 C ATOM 1859 NE ARG A 122 -20.659 -8.337 9.380 1.00 0.00 N ATOM 1860 CZ ARG A 122 -21.727 -8.886 8.730 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -22.884 -8.200 8.503 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -21.597 -10.122 8.165 1.00 0.00 N ATOM 0 H ARG A 122 -17.046 -7.735 6.223 1.00 0.00 H new ATOM 0 HA ARG A 122 -18.740 -5.699 5.965 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -18.677 -7.729 7.733 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -17.919 -6.549 8.783 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -19.912 -5.119 8.630 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -20.670 -6.281 7.559 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -20.095 -6.630 10.520 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -21.661 -6.495 9.745 1.00 0.00 H new ATOM 0 HE ARG A 122 -19.888 -8.922 9.702 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -22.977 -7.236 8.823 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -23.656 -8.651 8.013 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -20.711 -10.623 8.232 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -22.386 -10.545 7.676 1.00 0.00 H new ATOM 1876 N GLU A 123 -16.100 -4.558 7.390 1.00 0.00 N ATOM 1877 CA GLU A 123 -15.421 -3.360 7.774 1.00 0.00 C ATOM 1878 C GLU A 123 -15.301 -2.399 6.642 1.00 0.00 C ATOM 1879 O GLU A 123 -15.639 -1.219 6.719 1.00 0.00 O ATOM 1880 CB GLU A 123 -14.038 -3.703 8.355 1.00 0.00 C ATOM 1881 CG GLU A 123 -13.647 -2.478 9.184 1.00 0.00 C ATOM 1882 CD GLU A 123 -12.246 -2.667 9.748 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -12.034 -3.578 10.593 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -11.358 -1.845 9.395 1.00 0.00 O ATOM 0 H GLU A 123 -15.460 -5.336 7.229 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.017 -2.869 8.543 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -14.080 -4.601 8.972 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -13.313 -3.893 7.564 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -13.683 -1.581 8.565 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -14.360 -2.333 9.996 1.00 0.00 H new ATOM 1891 N ALA A 124 -14.793 -2.906 5.504 1.00 0.00 N ATOM 1892 CA ALA A 124 -14.684 -2.146 4.297 1.00 0.00 C ATOM 1893 C ALA A 124 -15.943 -1.662 3.664 1.00 0.00 C ATOM 1894 O ALA A 124 -16.068 -0.490 3.310 1.00 0.00 O ATOM 1895 CB ALA A 124 -13.994 -3.148 3.357 1.00 0.00 C ATOM 0 H ALA A 124 -14.451 -3.863 5.421 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.168 -1.209 4.507 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -13.847 -2.688 2.380 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.028 -3.432 3.774 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -14.618 -4.035 3.250 1.00 0.00 H new ATOM 1901 N ASP A 125 -16.999 -2.483 3.524 1.00 0.00 N ATOM 1902 CA ASP A 125 -18.215 -2.134 2.858 1.00 0.00 C ATOM 1903 C ASP A 125 -18.999 -1.102 3.593 1.00 0.00 C ATOM 1904 O ASP A 125 -19.339 -1.369 4.745 1.00 0.00 O ATOM 1905 CB ASP A 125 -18.917 -3.490 2.672 1.00 0.00 C ATOM 1906 CG ASP A 125 -20.182 -3.352 1.837 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -20.102 -2.958 0.643 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -21.300 -3.417 2.415 1.00 0.00 O ATOM 0 H ASP A 125 -17.005 -3.434 3.892 1.00 0.00 H new ATOM 0 HA ASP A 125 -18.064 -1.639 1.899 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -18.236 -4.191 2.189 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -19.167 -3.909 3.647 1.00 0.00 H new ATOM 1913 N ILE A 126 -19.397 0.075 3.078 1.00 0.00 N ATOM 1914 CA ILE A 126 -20.329 0.937 3.736 1.00 0.00 C ATOM 1915 C ILE A 126 -21.757 0.764 3.348 1.00 0.00 C ATOM 1916 O ILE A 126 -22.600 0.628 4.234 1.00 0.00 O ATOM 1917 CB ILE A 126 -19.840 2.353 3.663 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -20.509 3.375 4.598 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -19.815 2.898 2.225 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -20.274 3.115 6.085 1.00 0.00 C ATOM 0 H ILE A 126 -19.064 0.436 2.184 1.00 0.00 H new ATOM 0 HA ILE A 126 -20.355 0.631 4.782 1.00 0.00 H new ATOM 0 HB ILE A 126 -18.824 2.251 4.043 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -20.140 4.371 4.352 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -21.582 3.377 4.407 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -19.453 3.926 2.232 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -19.153 2.284 1.615 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -20.822 2.871 1.808 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -20.780 3.881 6.673 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -20.670 2.134 6.350 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -19.205 3.144 6.295 1.00 0.00 H new ATOM 1932 N ASP A 127 -22.000 0.711 2.026 1.00 0.00 N ATOM 1933 CA ASP A 127 -23.324 0.590 1.500 1.00 0.00 C ATOM 1934 C ASP A 127 -24.162 -0.541 1.991 1.00 0.00 C ATOM 1935 O ASP A 127 -25.211 -0.350 2.604 1.00 0.00 O ATOM 1936 CB ASP A 127 -23.434 0.891 -0.004 1.00 0.00 C ATOM 1937 CG ASP A 127 -22.435 0.012 -0.744 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -22.571 -1.241 -0.719 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -21.495 0.545 -1.391 1.00 0.00 O ATOM 0 H ASP A 127 -21.270 0.753 1.315 1.00 0.00 H new ATOM 0 HA ASP A 127 -23.832 1.422 1.988 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -24.446 0.695 -0.357 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -23.228 1.944 -0.196 1.00 0.00 H new ATOM 1944 N GLY A 128 -23.763 -1.800 1.738 1.00 0.00 N ATOM 1945 CA GLY A 128 -24.501 -3.001 1.974 1.00 0.00 C ATOM 1946 C GLY A 128 -24.369 -4.109 0.986 1.00 0.00 C ATOM 1947 O GLY A 128 -24.804 -5.225 1.263 1.00 0.00 O ATOM 0 H GLY A 128 -22.846 -1.992 1.334 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -24.207 -3.387 2.950 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -25.556 -2.737 2.040 1.00 0.00 H new ATOM 1951 N ASP A 129 -23.718 -3.856 -0.164 1.00 0.00 N ATOM 1952 CA ASP A 129 -23.754 -4.857 -1.184 1.00 0.00 C ATOM 1953 C ASP A 129 -22.779 -5.971 -1.005 1.00 0.00 C ATOM 1954 O ASP A 129 -22.887 -7.101 -1.478 1.00 0.00 O ATOM 1955 CB ASP A 129 -23.604 -4.165 -2.549 1.00 0.00 C ATOM 1956 CG ASP A 129 -22.280 -3.494 -2.886 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -21.320 -3.624 -2.080 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -22.192 -2.865 -3.974 1.00 0.00 O ATOM 0 H ASP A 129 -23.194 -3.008 -0.382 1.00 0.00 H new ATOM 0 HA ASP A 129 -24.720 -5.358 -1.117 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -23.804 -4.909 -3.320 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -24.386 -3.410 -2.625 1.00 0.00 H new ATOM 1963 N GLY A 130 -21.694 -5.719 -0.252 1.00 0.00 N ATOM 1964 CA GLY A 130 -20.675 -6.670 0.068 1.00 0.00 C ATOM 1965 C GLY A 130 -19.661 -6.763 -1.020 1.00 0.00 C ATOM 1966 O GLY A 130 -19.004 -7.797 -1.123 1.00 0.00 O ATOM 0 H GLY A 130 -21.518 -4.801 0.156 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -20.187 -6.384 1.000 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.126 -7.649 0.232 1.00 0.00 H new ATOM 1970 N GLN A 131 -19.519 -5.729 -1.868 1.00 0.00 N ATOM 1971 CA GLN A 131 -18.396 -5.643 -2.749 1.00 0.00 C ATOM 1972 C GLN A 131 -17.804 -4.309 -2.448 1.00 0.00 C ATOM 1973 O GLN A 131 -18.501 -3.364 -2.082 1.00 0.00 O ATOM 1974 CB GLN A 131 -18.893 -5.839 -4.191 1.00 0.00 C ATOM 1975 CG GLN A 131 -19.727 -7.118 -4.286 1.00 0.00 C ATOM 1976 CD GLN A 131 -19.850 -7.475 -5.760 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -18.822 -7.534 -6.434 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -21.068 -7.800 -6.270 1.00 0.00 N ATOM 0 H GLN A 131 -20.179 -4.955 -1.944 1.00 0.00 H new ATOM 0 HA GLN A 131 -17.629 -6.406 -2.620 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -19.491 -4.981 -4.498 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -18.044 -5.897 -4.873 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -19.251 -7.928 -3.734 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -20.712 -6.967 -3.844 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -21.900 -7.740 -5.682 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -21.150 -8.104 -7.240 1.00 0.00 H new ATOM 1987 N VAL A 132 -16.477 -4.217 -2.647 1.00 0.00 N ATOM 1988 CA VAL A 132 -15.722 -3.073 -2.240 1.00 0.00 C ATOM 1989 C VAL A 132 -15.316 -2.320 -3.461 1.00 0.00 C ATOM 1990 O VAL A 132 -14.717 -2.829 -4.406 1.00 0.00 O ATOM 1991 CB VAL A 132 -14.452 -3.372 -1.501 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -13.845 -2.174 -0.752 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -14.684 -4.598 -0.602 1.00 0.00 C ATOM 0 H VAL A 132 -15.921 -4.945 -3.096 1.00 0.00 H new ATOM 0 HA VAL A 132 -16.377 -2.525 -1.563 1.00 0.00 H new ATOM 0 HB VAL A 132 -13.683 -3.603 -2.239 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -12.930 -2.486 -0.248 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -13.616 -1.379 -1.462 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -14.558 -1.807 -0.014 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -13.768 -4.828 -0.057 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -15.484 -4.383 0.107 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -14.965 -5.453 -1.218 1.00 0.00 H new ATOM 2003 N ASN A 133 -15.863 -1.091 -3.476 1.00 0.00 N ATOM 2004 CA ASN A 133 -15.687 -0.185 -4.568 1.00 0.00 C ATOM 2005 C ASN A 133 -14.555 0.758 -4.347 1.00 0.00 C ATOM 2006 O ASN A 133 -13.983 0.786 -3.258 1.00 0.00 O ATOM 2007 CB ASN A 133 -16.987 0.448 -5.092 1.00 0.00 C ATOM 2008 CG ASN A 133 -17.549 1.581 -4.246 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -16.988 2.673 -4.325 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -18.609 1.349 -3.427 1.00 0.00 N ATOM 0 H ASN A 133 -16.436 -0.721 -2.718 1.00 0.00 H new ATOM 0 HA ASN A 133 -15.377 -0.795 -5.416 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -16.808 0.824 -6.099 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -17.744 -0.332 -5.173 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -18.975 2.100 -2.841 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -19.039 0.424 -3.399 1.00 0.00 H new ATOM 2017 N TYR A 134 -14.348 1.662 -5.320 1.00 0.00 N ATOM 2018 CA TYR A 134 -13.441 2.768 -5.334 1.00 0.00 C ATOM 2019 C TYR A 134 -13.289 3.483 -4.036 1.00 0.00 C ATOM 2020 O TYR A 134 -12.250 3.477 -3.377 1.00 0.00 O ATOM 2021 CB TYR A 134 -13.868 3.673 -6.502 1.00 0.00 C ATOM 2022 CG TYR A 134 -13.614 2.982 -7.798 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -12.405 2.360 -8.002 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -14.545 2.917 -8.807 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -12.113 1.685 -9.164 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -14.258 2.266 -9.984 1.00 0.00 C ATOM 2027 CZ TYR A 134 -13.038 1.663 -10.180 1.00 0.00 C ATOM 2028 OH TYR A 134 -12.896 0.875 -11.342 1.00 0.00 O ATOM 0 H TYR A 134 -14.875 1.610 -6.192 1.00 0.00 H new ATOM 0 HA TYR A 134 -12.427 2.398 -5.486 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -14.926 3.921 -6.413 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -13.316 4.612 -6.466 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -11.659 2.403 -7.223 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -15.511 3.381 -8.674 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -11.166 1.177 -9.277 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -15.002 2.228 -10.766 1.00 0.00 H new ATOM 0 HH TYR A 134 -13.669 1.013 -11.928 1.00 0.00 H new ATOM 2038 N GLU A 135 -14.418 4.080 -3.614 1.00 0.00 N ATOM 2039 CA GLU A 135 -14.551 4.955 -2.491 1.00 0.00 C ATOM 2040 C GLU A 135 -14.208 4.272 -1.212 1.00 0.00 C ATOM 2041 O GLU A 135 -13.535 4.802 -0.330 1.00 0.00 O ATOM 2042 CB GLU A 135 -15.978 5.526 -2.539 1.00 0.00 C ATOM 2043 CG GLU A 135 -16.270 6.163 -3.899 1.00 0.00 C ATOM 2044 CD GLU A 135 -15.449 7.396 -4.250 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -15.463 8.484 -3.615 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -14.744 7.251 -5.284 1.00 0.00 O ATOM 0 H GLU A 135 -15.306 3.939 -4.096 1.00 0.00 H new ATOM 0 HA GLU A 135 -13.839 5.778 -2.540 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -16.698 4.731 -2.344 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -16.103 6.269 -1.751 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -16.108 5.412 -4.672 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -17.326 6.433 -3.932 1.00 0.00 H new ATOM 2053 N GLU A 136 -14.716 3.028 -1.139 1.00 0.00 N ATOM 2054 CA GLU A 136 -14.653 2.164 -0.001 1.00 0.00 C ATOM 2055 C GLU A 136 -13.325 1.524 0.215 1.00 0.00 C ATOM 2056 O GLU A 136 -12.918 1.150 1.314 1.00 0.00 O ATOM 2057 CB GLU A 136 -15.583 0.950 -0.159 1.00 0.00 C ATOM 2058 CG GLU A 136 -17.066 1.305 -0.290 1.00 0.00 C ATOM 2059 CD GLU A 136 -18.004 0.120 -0.466 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -17.847 -0.671 -1.434 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -19.035 0.045 0.254 1.00 0.00 O ATOM 0 H GLU A 136 -15.202 2.599 -1.927 1.00 0.00 H new ATOM 0 HA GLU A 136 -14.917 2.833 0.818 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -15.277 0.385 -1.040 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -15.453 0.293 0.701 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -17.370 1.859 0.598 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -17.189 1.974 -1.141 1.00 0.00 H new ATOM 2068 N PHE A 137 -12.570 1.494 -0.897 1.00 0.00 N ATOM 2069 CA PHE A 137 -11.223 1.012 -0.896 1.00 0.00 C ATOM 2070 C PHE A 137 -10.324 2.133 -0.503 1.00 0.00 C ATOM 2071 O PHE A 137 -9.520 1.984 0.416 1.00 0.00 O ATOM 2072 CB PHE A 137 -10.862 0.396 -2.258 1.00 0.00 C ATOM 2073 CG PHE A 137 -9.558 -0.326 -2.268 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -9.404 -1.617 -1.821 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -8.539 0.324 -2.924 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -8.164 -2.193 -1.964 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -7.297 -0.258 -3.024 1.00 0.00 C ATOM 2078 CZ PHE A 137 -7.092 -1.506 -2.485 1.00 0.00 C ATOM 0 H PHE A 137 -12.898 1.809 -1.810 1.00 0.00 H new ATOM 0 HA PHE A 137 -11.102 0.208 -0.170 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -11.651 -0.295 -2.554 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -10.834 1.187 -3.007 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -10.225 -2.158 -1.375 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -8.715 1.295 -3.362 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -8.027 -3.219 -1.657 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -6.490 0.260 -3.521 1.00 0.00 H new ATOM 0 HZ PHE A 137 -6.104 -1.941 -2.471 1.00 0.00 H new ATOM 2088 N VAL A 138 -10.491 3.359 -1.030 1.00 0.00 N ATOM 2089 CA VAL A 138 -9.659 4.495 -0.779 1.00 0.00 C ATOM 2090 C VAL A 138 -9.824 5.019 0.606 1.00 0.00 C ATOM 2091 O VAL A 138 -8.872 5.627 1.092 1.00 0.00 O ATOM 2092 CB VAL A 138 -9.808 5.551 -1.834 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -11.063 6.431 -1.705 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -8.569 6.462 -1.798 1.00 0.00 C ATOM 0 H VAL A 138 -11.255 3.570 -1.672 1.00 0.00 H new ATOM 0 HA VAL A 138 -8.626 4.154 -0.845 1.00 0.00 H new ATOM 0 HB VAL A 138 -9.911 5.015 -2.778 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -11.079 7.162 -2.513 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -11.954 5.805 -1.764 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -11.047 6.950 -0.747 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -8.664 7.235 -2.560 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -8.489 6.928 -0.816 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -7.675 5.869 -1.992 1.00 0.00 H new ATOM 2104 N GLN A 139 -11.014 4.803 1.194 1.00 0.00 N ATOM 2105 CA GLN A 139 -11.408 5.257 2.492 1.00 0.00 C ATOM 2106 C GLN A 139 -10.519 4.672 3.535 1.00 0.00 C ATOM 2107 O GLN A 139 -10.015 5.351 4.427 1.00 0.00 O ATOM 2108 CB GLN A 139 -12.873 4.912 2.810 1.00 0.00 C ATOM 2109 CG GLN A 139 -13.364 5.360 4.188 1.00 0.00 C ATOM 2110 CD GLN A 139 -13.530 6.873 4.190 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -14.033 7.378 3.188 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -12.933 7.563 5.199 1.00 0.00 N ATOM 0 H GLN A 139 -11.752 4.274 0.729 1.00 0.00 H new ATOM 0 HA GLN A 139 -11.315 6.343 2.493 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -13.509 5.366 2.050 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -13.001 3.832 2.730 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -14.312 4.877 4.424 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -12.653 5.059 4.957 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -12.540 7.063 5.996 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -12.878 8.581 5.158 1.00 0.00 H new ATOM 2121 N MET A 140 -10.281 3.354 3.409 1.00 0.00 N ATOM 2122 CA MET A 140 -9.558 2.578 4.369 1.00 0.00 C ATOM 2123 C MET A 140 -8.150 2.243 4.017 1.00 0.00 C ATOM 2124 O MET A 140 -7.376 1.839 4.883 1.00 0.00 O ATOM 2125 CB MET A 140 -10.375 1.326 4.732 1.00 0.00 C ATOM 2126 CG MET A 140 -10.424 0.225 3.671 1.00 0.00 C ATOM 2127 SD MET A 140 -11.022 -1.336 4.387 1.00 0.00 S ATOM 2128 CE MET A 140 -10.828 -2.083 2.743 1.00 0.00 C ATOM 0 H MET A 140 -10.604 2.809 2.610 1.00 0.00 H new ATOM 0 HA MET A 140 -9.440 3.222 5.240 1.00 0.00 H new ATOM 0 HB2 MET A 140 -9.964 0.902 5.648 1.00 0.00 H new ATOM 0 HB3 MET A 140 -11.397 1.635 4.954 1.00 0.00 H new ATOM 0 HG2 MET A 140 -11.078 0.530 2.854 1.00 0.00 H new ATOM 0 HG3 MET A 140 -9.431 0.079 3.246 1.00 0.00 H new ATOM 0 HE1 MET A 140 -11.376 -3.024 2.704 1.00 0.00 H new ATOM 0 HE2 MET A 140 -11.219 -1.403 1.986 1.00 0.00 H new ATOM 0 HE3 MET A 140 -9.772 -2.270 2.551 1.00 0.00 H new ATOM 2138 N MET A 141 -7.747 2.481 2.756 1.00 0.00 N ATOM 2139 CA MET A 141 -6.370 2.522 2.373 1.00 0.00 C ATOM 2140 C MET A 141 -5.651 3.813 2.569 1.00 0.00 C ATOM 2141 O MET A 141 -4.506 4.014 2.165 1.00 0.00 O ATOM 2142 CB MET A 141 -6.113 2.211 0.889 1.00 0.00 C ATOM 2143 CG MET A 141 -6.574 0.798 0.526 1.00 0.00 C ATOM 2144 SD MET A 141 -5.468 -0.531 1.089 1.00 0.00 S ATOM 2145 CE MET A 141 -6.619 -1.734 1.815 1.00 0.00 C ATOM 0 H MET A 141 -8.393 2.649 1.985 1.00 0.00 H new ATOM 0 HA MET A 141 -5.993 1.758 3.053 1.00 0.00 H new ATOM 0 HB2 MET A 141 -6.637 2.937 0.268 1.00 0.00 H new ATOM 0 HB3 MET A 141 -5.050 2.315 0.673 1.00 0.00 H new ATOM 0 HG2 MET A 141 -7.564 0.633 0.952 1.00 0.00 H new ATOM 0 HG3 MET A 141 -6.678 0.731 -0.557 1.00 0.00 H new ATOM 0 HE1 MET A 141 -6.127 -2.703 1.900 1.00 0.00 H new ATOM 0 HE2 MET A 141 -6.924 -1.394 2.805 1.00 0.00 H new ATOM 0 HE3 MET A 141 -7.498 -1.828 1.177 1.00 0.00 H new ATOM 2155 N THR A 142 -6.316 4.775 3.234 1.00 0.00 N ATOM 2156 CA THR A 142 -5.776 5.946 3.852 1.00 0.00 C ATOM 2157 C THR A 142 -5.488 5.683 5.323 1.00 0.00 C ATOM 2158 O THR A 142 -4.298 5.462 5.670 1.00 0.00 O ATOM 2159 CB THR A 142 -6.681 7.137 3.740 1.00 0.00 C ATOM 2160 OG1 THR A 142 -7.018 7.350 2.378 1.00 0.00 O ATOM 2161 CG2 THR A 142 -5.935 8.390 4.228 1.00 0.00 C ATOM 0 H THR A 142 -7.328 4.726 3.348 1.00 0.00 H new ATOM 0 HA THR A 142 -4.855 6.176 3.317 1.00 0.00 H new ATOM 0 HB THR A 142 -7.575 6.957 4.337 1.00 0.00 H new ATOM 0 HG1 THR A 142 -7.664 6.671 2.091 1.00 0.00 H new ATOM 0 HG21 THR A 142 -6.590 9.258 4.148 1.00 0.00 H new ATOM 0 HG22 THR A 142 -5.638 8.255 5.268 1.00 0.00 H new ATOM 0 HG23 THR A 142 -5.048 8.547 3.615 1.00 0.00 H new ATOM 2170 N ARG B 1 -8.832 -2.801 9.869 1.00 0.00 N ATOM 2171 CA ARG B 1 -7.742 -2.056 9.201 1.00 0.00 C ATOM 2172 C ARG B 1 -6.527 -2.869 8.913 1.00 0.00 C ATOM 2173 O ARG B 1 -6.113 -2.976 7.759 1.00 0.00 O ATOM 2174 CB ARG B 1 -7.477 -0.754 9.975 1.00 0.00 C ATOM 2175 CG ARG B 1 -6.602 0.217 9.180 1.00 0.00 C ATOM 2176 CD ARG B 1 -6.215 1.478 9.955 1.00 0.00 C ATOM 2177 NE ARG B 1 -5.106 2.088 9.170 1.00 0.00 N ATOM 2178 CZ ARG B 1 -5.234 3.044 8.204 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -6.367 3.743 7.901 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -4.088 3.429 7.571 1.00 0.00 N ATOM 0 H1 ARG B 1 -9.715 -2.255 9.806 1.00 0.00 H new ATOM 0 H2 ARG B 1 -8.960 -3.721 9.402 1.00 0.00 H new ATOM 0 H3 ARG B 1 -8.588 -2.951 10.869 1.00 0.00 H new ATOM 0 HA ARG B 1 -8.073 -1.789 8.197 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -8.426 -0.274 10.214 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -6.991 -0.988 10.922 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -5.694 -0.299 8.868 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -7.131 0.508 8.272 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -7.059 2.162 10.043 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -5.895 1.236 10.968 1.00 0.00 H new ATOM 0 HE ARG B 1 -4.162 1.761 9.373 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -7.228 3.569 8.420 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -6.353 4.439 7.156 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -3.196 3.006 7.828 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -4.123 4.140 6.840 1.00 0.00 H new ATOM 2193 N ARG B 2 -5.953 -3.522 9.938 1.00 0.00 N ATOM 2194 CA ARG B 2 -4.757 -4.302 9.858 1.00 0.00 C ATOM 2195 C ARG B 2 -4.727 -5.380 8.830 1.00 0.00 C ATOM 2196 O ARG B 2 -3.904 -5.326 7.917 1.00 0.00 O ATOM 2197 CB ARG B 2 -4.417 -5.092 11.133 1.00 0.00 C ATOM 2198 CG ARG B 2 -4.303 -4.132 12.319 1.00 0.00 C ATOM 2199 CD ARG B 2 -3.909 -4.953 13.548 1.00 0.00 C ATOM 2200 NE ARG B 2 -3.423 -3.986 14.572 1.00 0.00 N ATOM 2201 CZ ARG B 2 -2.368 -4.111 15.430 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -1.516 -5.177 15.400 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -2.026 -3.097 16.278 1.00 0.00 N ATOM 0 H ARG B 2 -6.347 -3.504 10.879 1.00 0.00 H new ATOM 0 HA ARG B 2 -4.062 -3.494 9.630 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -5.189 -5.836 11.328 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -3.480 -5.632 10.999 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -3.557 -3.363 12.118 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -5.250 -3.620 12.489 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -4.761 -5.519 13.924 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -3.132 -5.675 13.298 1.00 0.00 H new ATOM 0 HE ARG B 2 -3.948 -3.114 14.641 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -1.655 -5.922 14.717 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -0.741 -5.229 16.061 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -2.562 -2.229 16.277 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -1.235 -3.208 16.912 1.00 0.00 H new ATOM 2217 N LYS B 3 -5.674 -6.332 8.774 1.00 0.00 N ATOM 2218 CA LYS B 3 -5.707 -7.233 7.664 1.00 0.00 C ATOM 2219 C LYS B 3 -5.734 -6.769 6.249 1.00 0.00 C ATOM 2220 O LYS B 3 -5.036 -7.253 5.359 1.00 0.00 O ATOM 2221 CB LYS B 3 -6.930 -8.157 7.789 1.00 0.00 C ATOM 2222 CG LYS B 3 -7.053 -9.012 9.052 1.00 0.00 C ATOM 2223 CD LYS B 3 -8.439 -9.659 9.062 1.00 0.00 C ATOM 2224 CE LYS B 3 -8.667 -10.944 9.861 1.00 0.00 C ATOM 2225 NZ LYS B 3 -8.619 -10.774 11.330 1.00 0.00 N ATOM 0 H LYS B 3 -6.399 -6.477 9.476 1.00 0.00 H new ATOM 0 HA LYS B 3 -4.712 -7.662 7.781 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -7.825 -7.540 7.714 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -6.932 -8.827 6.929 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -6.277 -9.777 9.069 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -6.915 -8.397 9.941 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -9.144 -8.915 9.433 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -8.710 -9.866 8.027 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -9.638 -11.358 9.588 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -7.914 -11.676 9.569 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -8.783 -11.692 11.791 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -7.685 -10.409 11.607 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -9.355 -10.101 11.626 1.00 0.00 H new ATOM 2239 N TRP B 4 -6.490 -5.672 6.061 1.00 0.00 N ATOM 2240 CA TRP B 4 -6.469 -5.022 4.787 1.00 0.00 C ATOM 2241 C TRP B 4 -5.167 -4.358 4.499 1.00 0.00 C ATOM 2242 O TRP B 4 -4.493 -4.696 3.527 1.00 0.00 O ATOM 2243 CB TRP B 4 -7.638 -4.046 4.570 1.00 0.00 C ATOM 2244 CG TRP B 4 -8.922 -4.792 4.295 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.018 -4.897 5.102 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -9.364 -5.071 2.953 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.065 -5.441 4.407 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -10.688 -5.506 3.086 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -8.732 -4.996 1.742 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -11.413 -5.887 1.991 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -9.529 -5.311 0.667 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -10.843 -5.706 0.753 1.00 0.00 C ATOM 0 H TRP B 4 -7.096 -5.247 6.763 1.00 0.00 H new ATOM 0 HA TRP B 4 -6.597 -5.831 4.068 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -7.760 -3.417 5.452 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -7.413 -3.383 3.735 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -10.054 -4.595 6.138 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -11.958 -5.742 4.797 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -7.695 -4.713 1.639 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -12.399 -6.315 2.095 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -9.091 -5.243 -0.318 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -11.422 -5.873 -0.143 1.00 0.00 H new ATOM 2263 N GLN B 5 -4.789 -3.376 5.338 1.00 0.00 N ATOM 2264 CA GLN B 5 -3.558 -2.669 5.164 1.00 0.00 C ATOM 2265 C GLN B 5 -2.293 -3.440 5.005 1.00 0.00 C ATOM 2266 O GLN B 5 -1.495 -3.142 4.118 1.00 0.00 O ATOM 2267 CB GLN B 5 -3.488 -1.692 6.350 1.00 0.00 C ATOM 2268 CG GLN B 5 -4.316 -0.452 6.011 1.00 0.00 C ATOM 2269 CD GLN B 5 -3.525 0.367 5.000 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -3.757 0.268 3.796 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -2.563 1.221 5.441 1.00 0.00 N ATOM 0 H GLN B 5 -5.339 -3.071 6.141 1.00 0.00 H new ATOM 0 HA GLN B 5 -3.600 -2.198 4.182 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -3.870 -2.166 7.254 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -2.453 -1.413 6.550 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -5.284 -0.738 5.599 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -4.513 0.134 6.909 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -2.372 1.302 6.440 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -2.033 1.781 4.773 1.00 0.00 H new ATOM 2280 N LYS B 6 -2.110 -4.490 5.825 1.00 0.00 N ATOM 2281 CA LYS B 6 -1.007 -5.395 5.727 1.00 0.00 C ATOM 2282 C LYS B 6 -0.744 -6.062 4.421 1.00 0.00 C ATOM 2283 O LYS B 6 0.389 -6.153 3.950 1.00 0.00 O ATOM 2284 CB LYS B 6 -0.967 -6.512 6.783 1.00 0.00 C ATOM 2285 CG LYS B 6 -1.658 -7.842 6.477 1.00 0.00 C ATOM 2286 CD LYS B 6 -1.701 -8.842 7.634 1.00 0.00 C ATOM 2287 CE LYS B 6 -2.451 -10.137 7.313 1.00 0.00 C ATOM 2288 NZ LYS B 6 -2.596 -11.107 8.421 1.00 0.00 N ATOM 0 H LYS B 6 -2.753 -4.717 6.584 1.00 0.00 H new ATOM 0 HA LYS B 6 -0.227 -4.652 5.893 1.00 0.00 H new ATOM 0 HB2 LYS B 6 0.080 -6.726 6.997 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -1.405 -6.116 7.699 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -2.680 -7.636 6.159 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -1.150 -8.310 5.634 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.680 -9.089 7.925 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -2.171 -8.366 8.494 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -3.447 -9.875 6.956 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -1.938 -10.634 6.490 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -3.012 -11.988 8.058 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -1.662 -11.308 8.831 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -3.216 -10.707 9.154 1.00 0.00 H new ATOM 2302 N THR B 7 -1.892 -6.314 3.767 1.00 0.00 N ATOM 2303 CA THR B 7 -1.937 -6.823 2.431 1.00 0.00 C ATOM 2304 C THR B 7 -1.767 -5.734 1.428 1.00 0.00 C ATOM 2305 O THR B 7 -1.162 -5.965 0.382 1.00 0.00 O ATOM 2306 CB THR B 7 -3.238 -7.558 2.301 1.00 0.00 C ATOM 2307 OG1 THR B 7 -3.496 -8.555 3.279 1.00 0.00 O ATOM 2308 CG2 THR B 7 -3.446 -8.214 0.926 1.00 0.00 C ATOM 0 H THR B 7 -2.813 -6.160 4.178 1.00 0.00 H new ATOM 0 HA THR B 7 -1.111 -7.506 2.232 1.00 0.00 H new ATOM 0 HB THR B 7 -3.943 -6.740 2.453 1.00 0.00 H new ATOM 0 HG1 THR B 7 -4.003 -8.163 4.020 1.00 0.00 H new ATOM 0 HG21 THR B 7 -4.408 -8.726 0.909 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.429 -7.448 0.151 1.00 0.00 H new ATOM 0 HG23 THR B 7 -2.649 -8.934 0.742 1.00 0.00 H new ATOM 2316 N GLY B 8 -2.327 -4.534 1.662 1.00 0.00 N ATOM 2317 CA GLY B 8 -2.252 -3.439 0.746 1.00 0.00 C ATOM 2318 C GLY B 8 -0.849 -2.939 0.690 1.00 0.00 C ATOM 2319 O GLY B 8 -0.444 -2.395 -0.336 1.00 0.00 O ATOM 0 H GLY B 8 -2.847 -4.319 2.513 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -2.577 -3.756 -0.245 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -2.923 -2.640 1.061 1.00 0.00 H new ATOM 2323 N HIS B 9 -0.109 -2.988 1.811 1.00 0.00 N ATOM 2324 CA HIS B 9 1.246 -2.535 1.866 1.00 0.00 C ATOM 2325 C HIS B 9 2.117 -3.511 1.153 1.00 0.00 C ATOM 2326 O HIS B 9 3.149 -3.172 0.575 1.00 0.00 O ATOM 2327 CB HIS B 9 1.701 -2.451 3.333 1.00 0.00 C ATOM 2328 CG HIS B 9 1.107 -1.418 4.244 1.00 0.00 C ATOM 2329 ND1 HIS B 9 0.617 -1.455 5.534 1.00 0.00 N ATOM 2330 CD2 HIS B 9 1.151 -0.112 3.865 1.00 0.00 C ATOM 2331 CE1 HIS B 9 0.241 -0.176 5.803 1.00 0.00 C ATOM 2332 NE2 HIS B 9 0.537 0.663 4.828 1.00 0.00 N ATOM 0 H HIS B 9 -0.459 -3.350 2.698 1.00 0.00 H new ATOM 0 HA HIS B 9 1.318 -1.553 1.399 1.00 0.00 H new ATOM 0 HB2 HIS B 9 1.519 -3.426 3.785 1.00 0.00 H new ATOM 0 HB3 HIS B 9 2.780 -2.298 3.330 1.00 0.00 H new ATOM 0 HD1 HIS B 9 0.551 -2.265 6.151 1.00 0.00 H new ATOM 0 HD2 HIS B 9 1.596 0.260 2.954 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -0.248 0.122 6.718 1.00 0.00 H new ATOM 2340 N ALA B 10 1.717 -4.792 1.066 1.00 0.00 N ATOM 2341 CA ALA B 10 2.294 -5.777 0.205 1.00 0.00 C ATOM 2342 C ALA B 10 2.277 -5.398 -1.235 1.00 0.00 C ATOM 2343 O ALA B 10 3.260 -5.376 -1.974 1.00 0.00 O ATOM 2344 CB ALA B 10 1.823 -7.232 0.371 1.00 0.00 C ATOM 0 H ALA B 10 0.949 -5.160 1.627 1.00 0.00 H new ATOM 0 HA ALA B 10 3.321 -5.774 0.571 1.00 0.00 H new ATOM 0 HB1 ALA B 10 2.344 -7.867 -0.346 1.00 0.00 H new ATOM 0 HB2 ALA B 10 2.042 -7.572 1.383 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.749 -7.289 0.193 1.00 0.00 H new ATOM 2350 N VAL B 11 1.122 -4.881 -1.691 1.00 0.00 N ATOM 2351 CA VAL B 11 0.675 -4.800 -3.047 1.00 0.00 C ATOM 2352 C VAL B 11 1.394 -3.592 -3.543 1.00 0.00 C ATOM 2353 O VAL B 11 2.110 -3.690 -4.538 1.00 0.00 O ATOM 2354 CB VAL B 11 -0.823 -4.786 -3.111 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -1.282 -4.437 -4.537 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -1.280 -6.194 -2.692 1.00 0.00 C ATOM 0 H VAL B 11 0.438 -4.483 -1.048 1.00 0.00 H new ATOM 0 HA VAL B 11 0.903 -5.652 -3.687 1.00 0.00 H new ATOM 0 HB VAL B 11 -1.258 -4.035 -2.452 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -2.371 -4.429 -4.577 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -0.901 -3.453 -4.811 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -0.899 -5.182 -5.235 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -2.368 -6.246 -2.719 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -0.864 -6.931 -3.379 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -0.932 -6.404 -1.681 1.00 0.00 H new ATOM 2366 N ARG B 12 1.205 -2.497 -2.786 1.00 0.00 N ATOM 2367 CA ARG B 12 1.825 -1.219 -2.957 1.00 0.00 C ATOM 2368 C ARG B 12 3.311 -1.324 -2.939 1.00 0.00 C ATOM 2369 O ARG B 12 4.084 -0.650 -3.619 1.00 0.00 O ATOM 2370 CB ARG B 12 1.331 -0.258 -1.863 1.00 0.00 C ATOM 2371 CG ARG B 12 -0.082 0.295 -2.050 1.00 0.00 C ATOM 2372 CD ARG B 12 -0.589 1.117 -0.863 1.00 0.00 C ATOM 2373 NE ARG B 12 -0.073 2.487 -1.139 1.00 0.00 N ATOM 2374 CZ ARG B 12 -0.529 3.712 -0.742 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -1.643 3.833 0.037 1.00 0.00 N ATOM 2376 NH2 ARG B 12 0.170 4.765 -1.257 1.00 0.00 N ATOM 0 H ARG B 12 0.567 -2.507 -1.990 1.00 0.00 H new ATOM 0 HA ARG B 12 1.544 -0.826 -3.934 1.00 0.00 H new ATOM 0 HB2 ARG B 12 1.374 -0.776 -0.905 1.00 0.00 H new ATOM 0 HB3 ARG B 12 2.024 0.581 -1.803 1.00 0.00 H new ATOM 0 HG2 ARG B 12 -0.103 0.917 -2.945 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -0.767 -0.535 -2.223 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -1.677 1.103 -0.802 1.00 0.00 H new ATOM 0 HD3 ARG B 12 -0.211 0.730 0.083 1.00 0.00 H new ATOM 0 HE ARG B 12 0.762 2.515 -1.724 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -2.151 3.000 0.333 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -1.967 4.757 0.323 1.00 0.00 H new ATOM 0 HH21 ARG B 12 0.959 4.597 -1.881 1.00 0.00 H new ATOM 0 HH22 ARG B 12 -0.096 5.720 -1.017 1.00 0.00 H new ATOM 2390 N ALA B 13 3.862 -2.224 -2.106 1.00 0.00 N ATOM 2391 CA ALA B 13 5.284 -2.369 -2.148 1.00 0.00 C ATOM 2392 C ALA B 13 5.917 -3.084 -3.292 1.00 0.00 C ATOM 2393 O ALA B 13 7.081 -2.880 -3.634 1.00 0.00 O ATOM 2394 CB ALA B 13 5.853 -2.931 -0.835 1.00 0.00 C ATOM 0 H ALA B 13 3.363 -2.817 -1.443 1.00 0.00 H new ATOM 0 HA ALA B 13 5.563 -1.328 -2.310 1.00 0.00 H new ATOM 0 HB1 ALA B 13 6.936 -3.022 -0.917 1.00 0.00 H new ATOM 0 HB2 ALA B 13 5.607 -2.257 -0.014 1.00 0.00 H new ATOM 0 HB3 ALA B 13 5.420 -3.912 -0.641 1.00 0.00 H new ATOM 2400 N ILE B 14 5.206 -4.029 -3.931 1.00 0.00 N ATOM 2401 CA ILE B 14 5.571 -4.625 -5.178 1.00 0.00 C ATOM 2402 C ILE B 14 5.515 -3.641 -6.296 1.00 0.00 C ATOM 2403 O ILE B 14 6.300 -3.567 -7.239 1.00 0.00 O ATOM 2404 CB ILE B 14 4.685 -5.814 -5.407 1.00 0.00 C ATOM 2405 CG1 ILE B 14 5.091 -7.004 -4.521 1.00 0.00 C ATOM 2406 CG2 ILE B 14 4.538 -6.323 -6.851 1.00 0.00 C ATOM 2407 CD1 ILE B 14 6.317 -7.834 -4.899 1.00 0.00 C ATOM 0 H ILE B 14 4.331 -4.396 -3.558 1.00 0.00 H new ATOM 0 HA ILE B 14 6.608 -4.959 -5.142 1.00 0.00 H new ATOM 0 HB ILE B 14 3.708 -5.412 -5.137 1.00 0.00 H new ATOM 0 HG12 ILE B 14 5.252 -6.622 -3.513 1.00 0.00 H new ATOM 0 HG13 ILE B 14 4.239 -7.682 -4.472 1.00 0.00 H new ATOM 0 HG21 ILE B 14 3.870 -7.184 -6.867 1.00 0.00 H new ATOM 0 HG22 ILE B 14 4.124 -5.531 -7.475 1.00 0.00 H new ATOM 0 HG23 ILE B 14 5.515 -6.615 -7.235 1.00 0.00 H new ATOM 0 HD11 ILE B 14 6.457 -8.630 -4.168 1.00 0.00 H new ATOM 0 HD12 ILE B 14 6.170 -8.271 -5.887 1.00 0.00 H new ATOM 0 HD13 ILE B 14 7.199 -7.194 -4.913 1.00 0.00 H new ATOM 2419 N GLY B 15 4.568 -2.694 -6.169 1.00 0.00 N ATOM 2420 CA GLY B 15 4.343 -1.691 -7.162 1.00 0.00 C ATOM 2421 C GLY B 15 5.264 -0.521 -7.110 1.00 0.00 C ATOM 2422 O GLY B 15 5.740 -0.012 -8.124 1.00 0.00 O ATOM 0 H GLY B 15 3.948 -2.624 -5.362 1.00 0.00 H new ATOM 0 HA2 GLY B 15 4.425 -2.153 -8.146 1.00 0.00 H new ATOM 0 HA3 GLY B 15 3.319 -1.330 -7.064 1.00 0.00 H new ATOM 2426 N ARG B 16 5.646 -0.063 -5.904 1.00 0.00 N ATOM 2427 CA ARG B 16 6.603 0.962 -5.626 1.00 0.00 C ATOM 2428 C ARG B 16 7.989 0.487 -5.894 1.00 0.00 C ATOM 2429 O ARG B 16 8.822 1.321 -6.248 1.00 0.00 O ATOM 2430 CB ARG B 16 6.494 1.451 -4.171 1.00 0.00 C ATOM 2431 CG ARG B 16 7.106 2.850 -4.069 1.00 0.00 C ATOM 2432 CD ARG B 16 7.036 3.503 -2.687 1.00 0.00 C ATOM 2433 NE ARG B 16 5.589 3.739 -2.422 1.00 0.00 N ATOM 2434 CZ ARG B 16 5.095 4.496 -1.399 1.00 0.00 C ATOM 2435 NH1 ARG B 16 5.855 5.214 -0.522 1.00 0.00 N ATOM 2436 NH2 ARG B 16 3.755 4.463 -1.138 1.00 0.00 N ATOM 0 H ARG B 16 5.247 -0.447 -5.047 1.00 0.00 H new ATOM 0 HA ARG B 16 6.382 1.797 -6.290 1.00 0.00 H new ATOM 0 HB2 ARG B 16 5.450 1.473 -3.858 1.00 0.00 H new ATOM 0 HB3 ARG B 16 7.013 0.763 -3.503 1.00 0.00 H new ATOM 0 HG2 ARG B 16 8.152 2.793 -4.371 1.00 0.00 H new ATOM 0 HG3 ARG B 16 6.603 3.500 -4.784 1.00 0.00 H new ATOM 0 HD2 ARG B 16 7.472 2.856 -1.926 1.00 0.00 H new ATOM 0 HD3 ARG B 16 7.595 4.439 -2.668 1.00 0.00 H new ATOM 0 HE ARG B 16 4.917 3.302 -3.052 1.00 0.00 H new ATOM 0 HH11 ARG B 16 6.872 5.209 -0.605 1.00 0.00 H new ATOM 0 HH12 ARG B 16 5.406 5.755 0.217 1.00 0.00 H new ATOM 0 HH21 ARG B 16 3.139 3.879 -1.704 1.00 0.00 H new ATOM 0 HH22 ARG B 16 3.370 5.023 -0.377 1.00 0.00 H new