USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 946 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 67 TYR OH : rot 180:sc= -0.084 USER MOD Set 1.2: A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 118 GLN : amide:sc= 1.07 K(o=2.3,f=-10!) USER MOD Set 2.2: A 121 LYS NZ :NH3+ -163:sc= 1.2 (180deg=0) USER MOD Set 3.1: A 60 SER OG : rot -57:sc= 1.19 USER MOD Set 3.2: A 116 SER OG : rot 105:sc= -0.583 USER MOD Set 3.3: A 120 HIS : no HD1:sc= -0.74 K(o=-0.14,f=-1.6!) USER MOD Set 4.1: A 96 HIS : no HD1:sc=-0.00737 X(o=1.3,f=1.2) USER MOD Set 4.2: A 100 THR OG1 : rot 91:sc= 1.33 USER MOD Set 5.1: A 80 THR OG1 : rot -23:sc= 1.64 USER MOD Set 5.2: A 94 CYS SG : rot -156:sc= 0.637 USER MOD Set 6.1: A 53 TYR OH : rot 172:sc= -0.391 USER MOD Set 6.2: A 61 HIS : no HD1:sc= -1.03 K(o=-1.4,f=-5.9!) USER MOD Set 7.1: A 33 THR OG1 : rot 113:sc= 1.18 USER MOD Set 7.2: A 71 SER OG : rot -81:sc= 0.116 USER MOD Single : A 8 GLN : amide:sc= -0.0612 K(o=-0.061,f=-0.58) USER MOD Single : A 9 ASN : amide:sc= 0.636 K(o=0.64,f=-0.023) USER MOD Single : A 13 THR OG1 : rot 66:sc= 1.1 USER MOD Single : A 16 SER OG : rot 48:sc= 1.08 USER MOD Single : A 18 LYS NZ :NH3+ 151:sc= 1.31 (180deg=1.08) USER MOD Single : A 21 LYS NZ :NH3+ 176:sc= 0.771 (180deg=0.652) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 80:sc= -0.0863 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 70:sc= 1.25 USER MOD Single : A 35 TYR OH : rot -16:sc= 1.26 USER MOD Single : A 39 HIS : no HD1:sc= -0.554 K(o=-0.55,f=-1.4) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ -118:sc= -0.696 (180deg=-1.58!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot -30:sc= 0.0233 USER MOD Single : A 57 CYS SG : rot -90:sc= -0.561 USER MOD Single : A 62 LYS NZ :NH3+ 133:sc= 2.63 (180deg=1.37) USER MOD Single : A 65 SER OG : rot 164:sc= 0.593 USER MOD Single : A 76 TYR OH : rot 170:sc= 0.898 USER MOD Single : A 82 SER OG : rot 67:sc= 1.12 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -0.314 K(o=-0.31,f=-1.7) USER MOD Single : A 106 GLN : amide:sc= 1.09 K(o=1.1,f=-0.46) USER MOD Single : A 110 SER OG : rot -115:sc= 1.12 USER MOD Single : A 115 LYS NZ :NH3+ -120:sc= 0.00326 (180deg=-2.89!) USER MOD Single : A 117 ASN : amide:sc= -0.65 K(o=-0.65,f=-2) USER MOD Single : A 126 MET CE :methyl 169:sc= -0.0448 (180deg=-0.344) USER MOD ----------------------------------------------------------------- ATOM 78 N ASP A 6 0.893 -9.460 -2.365 1.00 0.00 N ATOM 79 CA ASP A 6 0.986 -10.209 -3.607 1.00 0.00 C ATOM 80 C ASP A 6 -0.384 -10.224 -4.275 1.00 0.00 C ATOM 81 O ASP A 6 -0.485 -10.317 -5.497 1.00 0.00 O ATOM 82 CB ASP A 6 1.448 -11.645 -3.334 1.00 0.00 C ATOM 83 CG ASP A 6 0.573 -12.441 -2.361 1.00 0.00 C ATOM 84 OD1 ASP A 6 0.750 -13.680 -2.344 1.00 0.00 O ATOM 85 OD2 ASP A 6 -0.254 -11.827 -1.653 1.00 0.00 O1- ATOM 0 HA ASP A 6 1.715 -9.733 -4.263 1.00 0.00 H new ATOM 0 HB2 ASP A 6 1.490 -12.182 -4.282 1.00 0.00 H new ATOM 0 HB3 ASP A 6 2.464 -11.614 -2.940 1.00 0.00 H new ATOM 90 N PHE A 7 -1.429 -10.131 -3.449 1.00 0.00 N ATOM 91 CA PHE A 7 -2.810 -10.072 -3.881 1.00 0.00 C ATOM 92 C PHE A 7 -2.998 -8.990 -4.945 1.00 0.00 C ATOM 93 O PHE A 7 -3.766 -9.169 -5.883 1.00 0.00 O ATOM 94 CB PHE A 7 -3.694 -9.757 -2.673 1.00 0.00 C ATOM 95 CG PHE A 7 -5.182 -9.879 -2.941 1.00 0.00 C ATOM 96 CD1 PHE A 7 -5.649 -10.539 -4.090 1.00 0.00 C ATOM 97 CD2 PHE A 7 -6.105 -9.332 -2.039 1.00 0.00 C ATOM 98 CE1 PHE A 7 -7.020 -10.627 -4.354 1.00 0.00 C ATOM 99 CE2 PHE A 7 -7.483 -9.427 -2.297 1.00 0.00 C ATOM 100 CZ PHE A 7 -7.939 -10.071 -3.458 1.00 0.00 C ATOM 0 H PHE A 7 -1.325 -10.094 -2.435 1.00 0.00 H new ATOM 0 HA PHE A 7 -3.088 -11.033 -4.313 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -3.427 -10.429 -1.857 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -3.479 -8.743 -2.335 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -4.943 -10.983 -4.776 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -5.757 -8.837 -1.145 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -7.368 -11.123 -5.248 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -8.192 -9.004 -1.601 1.00 0.00 H new ATOM 0 HZ PHE A 7 -8.998 -10.137 -3.659 1.00 0.00 H new ATOM 110 N GLN A 8 -2.293 -7.863 -4.800 1.00 0.00 N ATOM 111 CA GLN A 8 -2.392 -6.737 -5.714 1.00 0.00 C ATOM 112 C GLN A 8 -2.159 -7.166 -7.161 1.00 0.00 C ATOM 113 O GLN A 8 -2.775 -6.618 -8.073 1.00 0.00 O ATOM 114 CB GLN A 8 -1.350 -5.692 -5.298 1.00 0.00 C ATOM 115 CG GLN A 8 -1.270 -4.569 -6.335 1.00 0.00 C ATOM 116 CD GLN A 8 -2.613 -3.882 -6.536 1.00 0.00 C ATOM 117 OE1 GLN A 8 -3.402 -3.753 -5.604 1.00 0.00 O ATOM 118 NE2 GLN A 8 -2.886 -3.433 -7.757 1.00 0.00 N ATOM 0 H GLN A 8 -1.634 -7.713 -4.036 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.397 -6.319 -5.661 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -1.611 -5.277 -4.324 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -0.374 -6.166 -5.191 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -0.531 -3.834 -6.017 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -0.926 -4.977 -7.285 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -2.208 -3.556 -8.509 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -3.773 -2.965 -7.942 1.00 0.00 H new ATOM 127 N ASN A 9 -1.276 -8.143 -7.383 1.00 0.00 N ATOM 128 CA ASN A 9 -0.993 -8.600 -8.728 1.00 0.00 C ATOM 129 C ASN A 9 -2.172 -9.405 -9.264 1.00 0.00 C ATOM 130 O ASN A 9 -2.433 -9.398 -10.466 1.00 0.00 O ATOM 131 CB ASN A 9 0.285 -9.432 -8.715 1.00 0.00 C ATOM 132 CG ASN A 9 1.429 -8.689 -8.044 1.00 0.00 C ATOM 133 OD1 ASN A 9 2.082 -7.849 -8.659 1.00 0.00 O ATOM 134 ND2 ASN A 9 1.679 -8.995 -6.774 1.00 0.00 N ATOM 0 H ASN A 9 -0.754 -8.623 -6.650 1.00 0.00 H new ATOM 0 HA ASN A 9 -0.846 -7.745 -9.388 1.00 0.00 H new ATOM 0 HB2 ASN A 9 0.103 -10.371 -8.192 1.00 0.00 H new ATOM 0 HB3 ASN A 9 0.565 -9.686 -9.737 1.00 0.00 H new ATOM 0 HD21 ASN A 9 2.436 -8.526 -6.276 1.00 0.00 H new ATOM 0 HD22 ASN A 9 1.114 -9.698 -6.298 1.00 0.00 H new ATOM 141 N PHE A 10 -2.888 -10.100 -8.375 1.00 0.00 N ATOM 142 CA PHE A 10 -4.089 -10.830 -8.726 1.00 0.00 C ATOM 143 C PHE A 10 -5.192 -9.835 -9.068 1.00 0.00 C ATOM 144 O PHE A 10 -5.947 -10.045 -10.015 1.00 0.00 O ATOM 145 CB PHE A 10 -4.520 -11.675 -7.529 1.00 0.00 C ATOM 146 CG PHE A 10 -5.502 -12.772 -7.862 1.00 0.00 C ATOM 147 CD1 PHE A 10 -6.847 -12.462 -8.113 1.00 0.00 C ATOM 148 CD2 PHE A 10 -5.067 -14.102 -7.917 1.00 0.00 C ATOM 149 CE1 PHE A 10 -7.756 -13.484 -8.421 1.00 0.00 C ATOM 150 CE2 PHE A 10 -5.974 -15.125 -8.229 1.00 0.00 C ATOM 151 CZ PHE A 10 -7.316 -14.814 -8.486 1.00 0.00 C ATOM 0 H PHE A 10 -2.641 -10.166 -7.388 1.00 0.00 H new ATOM 0 HA PHE A 10 -3.900 -11.476 -9.584 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -3.634 -12.122 -7.077 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -4.965 -11.021 -6.779 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -7.182 -11.436 -8.069 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -4.032 -14.340 -7.719 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -8.793 -13.247 -8.608 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -5.639 -16.151 -8.271 1.00 0.00 H new ATOM 0 HZ PHE A 10 -8.013 -15.600 -8.735 1.00 0.00 H new ATOM 161 N VAL A 11 -5.280 -8.751 -8.287 1.00 0.00 N ATOM 162 CA VAL A 11 -6.282 -7.722 -8.516 1.00 0.00 C ATOM 163 C VAL A 11 -6.009 -7.067 -9.866 1.00 0.00 C ATOM 164 O VAL A 11 -6.897 -6.999 -10.710 1.00 0.00 O ATOM 165 CB VAL A 11 -6.254 -6.672 -7.400 1.00 0.00 C ATOM 166 CG1 VAL A 11 -7.313 -5.601 -7.659 1.00 0.00 C ATOM 167 CG2 VAL A 11 -6.512 -7.292 -6.027 1.00 0.00 C ATOM 0 H VAL A 11 -4.666 -8.571 -7.493 1.00 0.00 H new ATOM 0 HA VAL A 11 -7.272 -8.177 -8.517 1.00 0.00 H new ATOM 0 HB VAL A 11 -5.257 -6.230 -7.401 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -7.284 -4.860 -6.860 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -7.112 -5.114 -8.613 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -8.299 -6.064 -7.689 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -6.483 -6.513 -5.265 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -7.492 -7.769 -6.022 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -5.745 -8.036 -5.814 1.00 0.00 H new ATOM 177 N ALA A 12 -4.781 -6.585 -10.073 1.00 0.00 N ATOM 178 CA ALA A 12 -4.390 -5.947 -11.319 1.00 0.00 C ATOM 179 C ALA A 12 -4.541 -6.889 -12.510 1.00 0.00 C ATOM 180 O ALA A 12 -4.742 -6.423 -13.631 1.00 0.00 O ATOM 181 CB ALA A 12 -2.940 -5.484 -11.198 1.00 0.00 C ATOM 0 H ALA A 12 -4.035 -6.629 -9.379 1.00 0.00 H new ATOM 0 HA ALA A 12 -5.048 -5.096 -11.495 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -2.633 -5.003 -12.127 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -2.852 -4.774 -10.375 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -2.298 -6.344 -11.005 1.00 0.00 H new ATOM 187 N THR A 13 -4.450 -8.207 -12.295 1.00 0.00 N ATOM 188 CA THR A 13 -4.655 -9.164 -13.374 1.00 0.00 C ATOM 189 C THR A 13 -6.148 -9.242 -13.696 1.00 0.00 C ATOM 190 O THR A 13 -6.538 -9.332 -14.861 1.00 0.00 O ATOM 191 CB THR A 13 -4.090 -10.525 -12.966 1.00 0.00 C ATOM 192 OG1 THR A 13 -2.702 -10.423 -12.749 1.00 0.00 O ATOM 193 CG2 THR A 13 -4.310 -11.555 -14.069 1.00 0.00 C ATOM 0 H THR A 13 -4.237 -8.626 -11.390 1.00 0.00 H new ATOM 0 HA THR A 13 -4.129 -8.843 -14.273 1.00 0.00 H new ATOM 0 HB THR A 13 -4.603 -10.837 -12.056 1.00 0.00 H new ATOM 0 HG1 THR A 13 -2.533 -9.846 -11.975 1.00 0.00 H new ATOM 0 HG21 THR A 13 -3.900 -12.516 -13.757 1.00 0.00 H new ATOM 0 HG22 THR A 13 -5.378 -11.661 -14.260 1.00 0.00 H new ATOM 0 HG23 THR A 13 -3.809 -11.226 -14.980 1.00 0.00 H new ATOM 201 N LEU A 14 -6.992 -9.205 -12.659 1.00 0.00 N ATOM 202 CA LEU A 14 -8.431 -9.216 -12.850 1.00 0.00 C ATOM 203 C LEU A 14 -8.854 -7.946 -13.581 1.00 0.00 C ATOM 204 O LEU A 14 -9.646 -7.982 -14.521 1.00 0.00 O ATOM 205 CB LEU A 14 -9.108 -9.265 -11.478 1.00 0.00 C ATOM 206 CG LEU A 14 -10.593 -9.613 -11.605 1.00 0.00 C ATOM 207 CD1 LEU A 14 -10.764 -11.127 -11.751 1.00 0.00 C ATOM 208 CD2 LEU A 14 -11.315 -9.130 -10.352 1.00 0.00 C ATOM 0 H LEU A 14 -6.696 -9.167 -11.684 1.00 0.00 H new ATOM 0 HA LEU A 14 -8.723 -10.085 -13.440 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -8.611 -10.005 -10.851 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -8.999 -8.301 -10.981 1.00 0.00 H new ATOM 0 HG LEU A 14 -11.012 -9.128 -12.487 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -11.824 -11.367 -11.841 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -10.238 -11.468 -12.643 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -10.352 -11.626 -10.874 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -12.375 -9.371 -10.427 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -10.892 -9.622 -9.476 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -11.194 -8.051 -10.255 1.00 0.00 H new ATOM 220 N GLU A 15 -8.306 -6.818 -13.126 1.00 0.00 N ATOM 221 CA GLU A 15 -8.548 -5.506 -13.701 1.00 0.00 C ATOM 222 C GLU A 15 -8.021 -5.458 -15.132 1.00 0.00 C ATOM 223 O GLU A 15 -8.534 -4.710 -15.962 1.00 0.00 O ATOM 224 CB GLU A 15 -7.820 -4.488 -12.828 1.00 0.00 C ATOM 225 CG GLU A 15 -8.426 -4.445 -11.421 1.00 0.00 C ATOM 226 CD GLU A 15 -9.768 -3.722 -11.396 1.00 0.00 C ATOM 227 OE1 GLU A 15 -10.597 -4.087 -10.533 1.00 0.00 O ATOM 228 OE2 GLU A 15 -9.960 -2.812 -12.232 1.00 0.00 O1- ATOM 0 H GLU A 15 -7.669 -6.797 -12.330 1.00 0.00 H new ATOM 0 HA GLU A 15 -9.615 -5.285 -13.733 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -6.763 -4.746 -12.766 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -7.881 -3.500 -13.285 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -8.556 -5.462 -11.052 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -7.733 -3.946 -10.744 1.00 0.00 H new ATOM 235 N SER A 16 -6.992 -6.260 -15.425 1.00 0.00 N ATOM 236 CA SER A 16 -6.447 -6.340 -16.769 1.00 0.00 C ATOM 237 C SER A 16 -7.437 -7.049 -17.680 1.00 0.00 C ATOM 238 O SER A 16 -7.449 -6.784 -18.880 1.00 0.00 O ATOM 239 CB SER A 16 -5.111 -7.083 -16.768 1.00 0.00 C ATOM 240 OG SER A 16 -4.139 -6.346 -16.059 1.00 0.00 O ATOM 0 H SER A 16 -6.525 -6.860 -14.744 1.00 0.00 H new ATOM 0 HA SER A 16 -6.275 -5.329 -17.138 1.00 0.00 H new ATOM 0 HB2 SER A 16 -5.235 -8.066 -16.313 1.00 0.00 H new ATOM 0 HB3 SER A 16 -4.777 -7.246 -17.793 1.00 0.00 H new ATOM 0 HG SER A 16 -4.510 -6.058 -15.199 1.00 0.00 H new ATOM 246 N PHE A 17 -8.270 -7.946 -17.138 1.00 0.00 N ATOM 247 CA PHE A 17 -9.347 -8.504 -17.940 1.00 0.00 C ATOM 248 C PHE A 17 -10.403 -7.440 -18.220 1.00 0.00 C ATOM 249 O PHE A 17 -10.919 -7.364 -19.331 1.00 0.00 O ATOM 250 CB PHE A 17 -10.042 -9.655 -17.222 1.00 0.00 C ATOM 251 CG PHE A 17 -9.160 -10.763 -16.718 1.00 0.00 C ATOM 252 CD1 PHE A 17 -9.382 -11.285 -15.439 1.00 0.00 C ATOM 253 CD2 PHE A 17 -8.133 -11.277 -17.516 1.00 0.00 C ATOM 254 CE1 PHE A 17 -8.574 -12.321 -14.951 1.00 0.00 C ATOM 255 CE2 PHE A 17 -7.343 -12.329 -17.038 1.00 0.00 C ATOM 256 CZ PHE A 17 -7.554 -12.845 -15.750 1.00 0.00 C ATOM 0 H PHE A 17 -8.218 -8.288 -16.178 1.00 0.00 H new ATOM 0 HA PHE A 17 -8.897 -8.864 -18.865 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -10.593 -9.246 -16.375 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -10.777 -10.087 -17.901 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.178 -10.889 -14.826 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -7.950 -10.864 -18.497 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -8.739 -12.714 -13.959 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -6.567 -12.746 -17.663 1.00 0.00 H new ATOM 0 HZ PHE A 17 -6.930 -13.644 -15.378 1.00 0.00 H new ATOM 266 N LYS A 18 -10.727 -6.616 -17.214 1.00 0.00 N ATOM 267 CA LYS A 18 -11.746 -5.584 -17.366 1.00 0.00 C ATOM 268 C LYS A 18 -11.341 -4.582 -18.438 1.00 0.00 C ATOM 269 O LYS A 18 -12.193 -3.979 -19.084 1.00 0.00 O ATOM 270 CB LYS A 18 -11.953 -4.843 -16.042 1.00 0.00 C ATOM 271 CG LYS A 18 -12.150 -5.810 -14.878 1.00 0.00 C ATOM 272 CD LYS A 18 -12.560 -5.049 -13.622 1.00 0.00 C ATOM 273 CE LYS A 18 -12.616 -6.015 -12.442 1.00 0.00 C ATOM 274 NZ LYS A 18 -12.857 -5.298 -11.181 1.00 0.00 N1+ ATOM 0 H LYS A 18 -10.296 -6.649 -16.290 1.00 0.00 H new ATOM 0 HA LYS A 18 -12.675 -6.071 -17.662 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -11.092 -4.205 -15.843 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -12.821 -4.189 -16.123 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -12.914 -6.545 -15.132 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -11.227 -6.360 -14.693 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -11.848 -4.250 -13.419 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -13.533 -4.579 -13.769 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -13.407 -6.747 -12.605 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -11.679 -6.568 -12.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -13.362 -5.921 -10.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -11.948 -5.014 -10.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -13.432 -4.452 -11.367 1.00 0.00 H new ATOM 288 N ASP A 19 -10.030 -4.417 -18.613 1.00 0.00 N ATOM 289 CA ASP A 19 -9.464 -3.491 -19.585 1.00 0.00 C ATOM 290 C ASP A 19 -9.657 -3.975 -21.026 1.00 0.00 C ATOM 291 O ASP A 19 -9.715 -3.161 -21.944 1.00 0.00 O ATOM 292 CB ASP A 19 -7.971 -3.323 -19.282 1.00 0.00 C ATOM 293 CG ASP A 19 -7.317 -2.204 -20.090 1.00 0.00 C ATOM 294 OD1 ASP A 19 -6.072 -2.245 -20.204 1.00 0.00 O ATOM 295 OD2 ASP A 19 -8.061 -1.327 -20.580 1.00 0.00 O1- ATOM 0 H ASP A 19 -9.328 -4.928 -18.078 1.00 0.00 H new ATOM 0 HA ASP A 19 -9.985 -2.537 -19.499 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -7.843 -3.118 -18.219 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -7.457 -4.261 -19.490 1.00 0.00 H new ATOM 300 N LEU A 20 -9.761 -5.291 -21.237 1.00 0.00 N ATOM 301 CA LEU A 20 -9.894 -5.853 -22.573 1.00 0.00 C ATOM 302 C LEU A 20 -11.292 -5.609 -23.125 1.00 0.00 C ATOM 303 O LEU A 20 -12.248 -5.484 -22.364 1.00 0.00 O ATOM 304 CB LEU A 20 -9.607 -7.354 -22.536 1.00 0.00 C ATOM 305 CG LEU A 20 -8.166 -7.645 -22.120 1.00 0.00 C ATOM 306 CD1 LEU A 20 -7.978 -9.154 -22.029 1.00 0.00 C ATOM 307 CD2 LEU A 20 -7.164 -7.092 -23.131 1.00 0.00 C ATOM 0 H LEU A 20 -9.755 -5.986 -20.490 1.00 0.00 H new ATOM 0 HA LEU A 20 -9.173 -5.362 -23.227 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -10.291 -7.838 -21.839 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -9.796 -7.785 -23.519 1.00 0.00 H new ATOM 0 HG LEU A 20 -7.986 -7.164 -21.159 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -6.953 -9.376 -21.733 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -8.666 -9.562 -21.289 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -8.181 -9.605 -23.000 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -6.150 -7.319 -22.800 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -7.339 -7.550 -24.105 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -7.286 -6.012 -23.211 1.00 0.00 H new ATOM 319 N LYS A 21 -11.414 -5.545 -24.457 1.00 0.00 N ATOM 320 CA LYS A 21 -12.716 -5.395 -25.094 1.00 0.00 C ATOM 321 C LYS A 21 -13.461 -6.726 -25.093 1.00 0.00 C ATOM 322 O LYS A 21 -14.688 -6.744 -25.036 1.00 0.00 O ATOM 323 CB LYS A 21 -12.555 -4.899 -26.535 1.00 0.00 C ATOM 324 CG LYS A 21 -11.764 -3.592 -26.664 1.00 0.00 C ATOM 325 CD LYS A 21 -12.331 -2.421 -25.857 1.00 0.00 C ATOM 326 CE LYS A 21 -11.821 -2.433 -24.416 1.00 0.00 C ATOM 327 NZ LYS A 21 -10.364 -2.206 -24.345 1.00 0.00 N1+ ATOM 0 H LYS A 21 -10.629 -5.595 -25.106 1.00 0.00 H new ATOM 0 HA LYS A 21 -13.290 -4.661 -24.528 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -12.056 -5.672 -27.120 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -13.544 -4.757 -26.971 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -10.737 -3.771 -26.346 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -11.727 -3.307 -27.716 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -12.054 -1.481 -26.334 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -13.420 -2.470 -25.859 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -12.337 -1.663 -23.842 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -12.062 -3.390 -23.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -10.069 -2.154 -23.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -9.867 -2.991 -24.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -10.128 -1.313 -24.823 1.00 0.00 H new ATOM 341 N SER A 22 -12.720 -7.838 -25.157 1.00 0.00 N ATOM 342 CA SER A 22 -13.296 -9.176 -25.155 1.00 0.00 C ATOM 343 C SER A 22 -13.473 -9.691 -23.730 1.00 0.00 C ATOM 344 O SER A 22 -14.290 -10.576 -23.485 1.00 0.00 O ATOM 345 CB SER A 22 -12.358 -10.110 -25.917 1.00 0.00 C ATOM 346 OG SER A 22 -11.129 -10.219 -25.238 1.00 0.00 O ATOM 0 H SER A 22 -11.702 -7.829 -25.212 1.00 0.00 H new ATOM 0 HA SER A 22 -14.276 -9.142 -25.631 1.00 0.00 H new ATOM 0 HB2 SER A 22 -12.815 -11.094 -26.018 1.00 0.00 H new ATOM 0 HB3 SER A 22 -12.193 -9.730 -26.925 1.00 0.00 H new ATOM 0 HG SER A 22 -10.534 -10.821 -25.732 1.00 0.00 H new ATOM 352 N GLY A 23 -12.708 -9.134 -22.790 1.00 0.00 N ATOM 353 CA GLY A 23 -12.772 -9.497 -21.382 1.00 0.00 C ATOM 354 C GLY A 23 -12.155 -10.864 -21.096 1.00 0.00 C ATOM 355 O GLY A 23 -11.769 -11.130 -19.960 1.00 0.00 O ATOM 0 H GLY A 23 -12.019 -8.409 -22.992 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -12.256 -8.740 -20.792 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -13.813 -9.498 -21.058 1.00 0.00 H new ATOM 359 N ILE A 24 -12.061 -11.727 -22.113 1.00 0.00 N ATOM 360 CA ILE A 24 -11.343 -12.987 -21.998 1.00 0.00 C ATOM 361 C ILE A 24 -9.844 -12.713 -22.128 1.00 0.00 C ATOM 362 O ILE A 24 -9.450 -11.776 -22.823 1.00 0.00 O ATOM 363 CB ILE A 24 -11.796 -13.959 -23.093 1.00 0.00 C ATOM 364 CG1 ILE A 24 -13.316 -14.154 -23.085 1.00 0.00 C ATOM 365 CG2 ILE A 24 -11.116 -15.310 -22.875 1.00 0.00 C ATOM 366 CD1 ILE A 24 -13.780 -14.839 -24.372 1.00 0.00 C ATOM 0 H ILE A 24 -12.479 -11.568 -23.030 1.00 0.00 H new ATOM 0 HA ILE A 24 -11.554 -13.440 -21.029 1.00 0.00 H new ATOM 0 HB ILE A 24 -11.515 -13.537 -24.058 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -13.606 -14.754 -22.223 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -13.811 -13.188 -22.982 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -11.434 -16.007 -23.651 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -10.034 -15.184 -22.921 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -11.394 -15.704 -21.897 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -14.862 -14.968 -24.346 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -13.508 -14.224 -25.230 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -13.300 -15.814 -24.458 1.00 0.00 H new ATOM 378 N SER A 25 -9.004 -13.516 -21.472 1.00 0.00 N ATOM 379 CA SER A 25 -7.562 -13.364 -21.584 1.00 0.00 C ATOM 380 C SER A 25 -6.870 -14.665 -21.224 1.00 0.00 C ATOM 381 O SER A 25 -6.432 -14.832 -20.089 1.00 0.00 O ATOM 382 CB SER A 25 -7.077 -12.266 -20.641 1.00 0.00 C ATOM 383 OG SER A 25 -5.677 -12.127 -20.755 1.00 0.00 O ATOM 0 H SER A 25 -9.302 -14.275 -20.860 1.00 0.00 H new ATOM 0 HA SER A 25 -7.322 -13.096 -22.613 1.00 0.00 H new ATOM 0 HB2 SER A 25 -7.567 -11.323 -20.883 1.00 0.00 H new ATOM 0 HB3 SER A 25 -7.346 -12.511 -19.613 1.00 0.00 H new ATOM 0 HG SER A 25 -5.465 -11.596 -21.551 1.00 0.00 H new ATOM 389 N GLY A 26 -6.767 -15.595 -22.174 1.00 0.00 N ATOM 390 CA GLY A 26 -6.139 -16.873 -21.895 1.00 0.00 C ATOM 391 C GLY A 26 -4.799 -16.677 -21.192 1.00 0.00 C ATOM 392 O GLY A 26 -4.422 -17.492 -20.353 1.00 0.00 O ATOM 0 H GLY A 26 -7.107 -15.484 -23.129 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -6.797 -17.478 -21.271 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -5.990 -17.421 -22.826 1.00 0.00 H new ATOM 396 N SER A 27 -4.081 -15.599 -21.525 1.00 0.00 N ATOM 397 CA SER A 27 -2.774 -15.333 -20.951 1.00 0.00 C ATOM 398 C SER A 27 -2.877 -15.004 -19.467 1.00 0.00 C ATOM 399 O SER A 27 -2.324 -15.717 -18.629 1.00 0.00 O ATOM 400 CB SER A 27 -2.109 -14.178 -21.696 1.00 0.00 C ATOM 401 OG SER A 27 -0.719 -14.231 -21.472 1.00 0.00 O ATOM 0 H SER A 27 -4.393 -14.896 -22.195 1.00 0.00 H new ATOM 0 HA SER A 27 -2.167 -16.233 -21.055 1.00 0.00 H new ATOM 0 HB2 SER A 27 -2.322 -14.245 -22.763 1.00 0.00 H new ATOM 0 HB3 SER A 27 -2.511 -13.225 -21.350 1.00 0.00 H new ATOM 0 HG SER A 27 -0.283 -13.494 -21.948 1.00 0.00 H new ATOM 407 N ARG A 28 -3.585 -13.920 -19.127 1.00 0.00 N ATOM 408 CA ARG A 28 -3.662 -13.472 -17.746 1.00 0.00 C ATOM 409 C ARG A 28 -4.543 -14.408 -16.922 1.00 0.00 C ATOM 410 O ARG A 28 -4.360 -14.498 -15.708 1.00 0.00 O ATOM 411 CB ARG A 28 -4.175 -12.030 -17.683 1.00 0.00 C ATOM 412 CG ARG A 28 -3.027 -11.017 -17.719 1.00 0.00 C ATOM 413 CD ARG A 28 -2.346 -10.948 -19.088 1.00 0.00 C ATOM 414 NE ARG A 28 -3.242 -10.393 -20.105 1.00 0.00 N ATOM 415 CZ ARG A 28 -3.515 -9.090 -20.239 1.00 0.00 C ATOM 416 NH1 ARG A 28 -2.950 -8.183 -19.443 1.00 0.00 N1+ ATOM 417 NH2 ARG A 28 -4.365 -8.692 -21.183 1.00 0.00 N ATOM 0 H ARG A 28 -4.106 -13.346 -19.789 1.00 0.00 H new ATOM 0 HA ARG A 28 -2.661 -13.496 -17.316 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -4.848 -11.847 -18.520 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -4.755 -11.890 -16.771 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -3.410 -10.030 -17.457 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -2.288 -11.283 -16.963 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -1.448 -10.334 -19.018 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -2.027 -11.946 -19.388 1.00 0.00 H new ATOM 0 HE ARG A 28 -3.687 -11.042 -20.754 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -2.297 -8.478 -18.717 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -3.170 -7.194 -19.560 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -4.803 -9.378 -21.797 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -4.579 -7.701 -21.292 1.00 0.00 H new ATOM 431 N ILE A 29 -5.495 -15.111 -17.549 1.00 0.00 N ATOM 432 CA ILE A 29 -6.277 -16.117 -16.852 1.00 0.00 C ATOM 433 C ILE A 29 -5.326 -17.196 -16.345 1.00 0.00 C ATOM 434 O ILE A 29 -5.430 -17.596 -15.187 1.00 0.00 O ATOM 435 CB ILE A 29 -7.345 -16.684 -17.794 1.00 0.00 C ATOM 436 CG1 ILE A 29 -8.419 -15.611 -18.026 1.00 0.00 C ATOM 437 CG2 ILE A 29 -7.975 -17.955 -17.213 1.00 0.00 C ATOM 438 CD1 ILE A 29 -9.508 -16.068 -18.998 1.00 0.00 C ATOM 0 H ILE A 29 -5.735 -14.996 -18.534 1.00 0.00 H new ATOM 0 HA ILE A 29 -6.799 -15.686 -15.998 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.880 -16.953 -18.742 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -8.876 -15.348 -17.072 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.947 -14.708 -18.413 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -8.729 -18.335 -17.902 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -7.203 -18.710 -17.067 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -8.442 -17.725 -16.255 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -10.240 -15.271 -19.125 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -9.059 -16.305 -19.962 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -10.002 -16.954 -18.600 1.00 0.00 H new ATOM 450 N LYS A 30 -4.402 -17.672 -17.190 1.00 0.00 N ATOM 451 CA LYS A 30 -3.431 -18.679 -16.769 1.00 0.00 C ATOM 452 C LYS A 30 -2.498 -18.132 -15.694 1.00 0.00 C ATOM 453 O LYS A 30 -2.044 -18.896 -14.844 1.00 0.00 O ATOM 454 CB LYS A 30 -2.598 -19.136 -17.971 1.00 0.00 C ATOM 455 CG LYS A 30 -3.382 -20.103 -18.865 1.00 0.00 C ATOM 456 CD LYS A 30 -2.556 -20.505 -20.093 1.00 0.00 C ATOM 457 CE LYS A 30 -2.381 -19.308 -21.034 1.00 0.00 C ATOM 458 NZ LYS A 30 -1.574 -19.643 -22.217 1.00 0.00 N1+ ATOM 0 H LYS A 30 -4.310 -17.376 -18.162 1.00 0.00 H new ATOM 0 HA LYS A 30 -3.983 -19.523 -16.355 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -2.292 -18.267 -18.554 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -1.687 -19.621 -17.620 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -3.652 -20.993 -18.296 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.313 -19.635 -19.185 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -1.580 -20.874 -19.778 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -3.050 -21.321 -20.620 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -3.361 -18.953 -21.354 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -1.907 -18.489 -20.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -1.483 -18.803 -22.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -0.629 -19.957 -21.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -2.039 -20.406 -22.749 1.00 0.00 H new ATOM 472 N LYS A 31 -2.207 -16.826 -15.719 1.00 0.00 N ATOM 473 CA LYS A 31 -1.304 -16.222 -14.746 1.00 0.00 C ATOM 474 C LYS A 31 -1.863 -16.312 -13.329 1.00 0.00 C ATOM 475 O LYS A 31 -1.224 -16.915 -12.469 1.00 0.00 O ATOM 476 CB LYS A 31 -1.001 -14.764 -15.115 1.00 0.00 C ATOM 477 CG LYS A 31 -0.186 -14.637 -16.408 1.00 0.00 C ATOM 478 CD LYS A 31 1.327 -14.700 -16.187 1.00 0.00 C ATOM 479 CE LYS A 31 1.779 -16.041 -15.610 1.00 0.00 C ATOM 480 NZ LYS A 31 3.247 -16.120 -15.546 1.00 0.00 N1+ ATOM 0 H LYS A 31 -2.586 -16.172 -16.404 1.00 0.00 H new ATOM 0 HA LYS A 31 -0.372 -16.786 -14.771 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -1.939 -14.220 -15.227 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.454 -14.293 -14.298 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -0.478 -15.434 -17.092 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -0.435 -13.693 -16.893 1.00 0.00 H new ATOM 0 HD2 LYS A 31 1.837 -14.525 -17.134 1.00 0.00 H new ATOM 0 HD3 LYS A 31 1.626 -13.898 -15.512 1.00 0.00 H new ATOM 0 HE2 LYS A 31 1.360 -16.171 -14.612 1.00 0.00 H new ATOM 0 HE3 LYS A 31 1.394 -16.854 -16.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 3.528 -17.040 -15.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 3.642 -16.019 -16.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 3.610 -15.357 -14.939 1.00 0.00 H new ATOM 494 N LEU A 32 -3.039 -15.731 -13.061 1.00 0.00 N ATOM 495 CA LEU A 32 -3.568 -15.773 -11.705 1.00 0.00 C ATOM 496 C LEU A 32 -4.139 -17.153 -11.355 1.00 0.00 C ATOM 497 O LEU A 32 -4.337 -17.452 -10.180 1.00 0.00 O ATOM 498 CB LEU A 32 -4.544 -14.617 -11.436 1.00 0.00 C ATOM 499 CG LEU A 32 -5.748 -14.478 -12.369 1.00 0.00 C ATOM 500 CD1 LEU A 32 -6.679 -15.691 -12.367 1.00 0.00 C ATOM 501 CD2 LEU A 32 -6.557 -13.282 -11.878 1.00 0.00 C ATOM 0 H LEU A 32 -3.620 -15.244 -13.743 1.00 0.00 H new ATOM 0 HA LEU A 32 -2.733 -15.619 -11.021 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -4.918 -14.723 -10.418 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -3.980 -13.685 -11.473 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.365 -14.369 -13.384 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.507 -15.515 -13.053 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -6.126 -16.575 -12.685 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -7.068 -15.849 -11.361 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -7.429 -13.145 -12.517 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -6.883 -13.459 -10.853 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -5.938 -12.385 -11.912 1.00 0.00 H new ATOM 513 N THR A 33 -4.405 -18.000 -12.360 1.00 0.00 N ATOM 514 CA THR A 33 -4.838 -19.368 -12.108 1.00 0.00 C ATOM 515 C THR A 33 -3.648 -20.169 -11.593 1.00 0.00 C ATOM 516 O THR A 33 -3.798 -21.006 -10.707 1.00 0.00 O ATOM 517 CB THR A 33 -5.366 -19.982 -13.406 1.00 0.00 C ATOM 518 OG1 THR A 33 -6.543 -19.318 -13.792 1.00 0.00 O ATOM 519 CG2 THR A 33 -5.699 -21.463 -13.251 1.00 0.00 C ATOM 0 H THR A 33 -4.326 -17.757 -13.347 1.00 0.00 H new ATOM 0 HA THR A 33 -5.635 -19.381 -11.365 1.00 0.00 H new ATOM 0 HB THR A 33 -4.580 -19.875 -14.153 1.00 0.00 H new ATOM 0 HG1 THR A 33 -6.379 -18.814 -14.616 1.00 0.00 H new ATOM 0 HG21 THR A 33 -6.070 -21.854 -14.199 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.802 -22.009 -12.960 1.00 0.00 H new ATOM 0 HG23 THR A 33 -6.464 -21.586 -12.484 1.00 0.00 H new ATOM 527 N THR A 34 -2.460 -19.910 -12.147 1.00 0.00 N ATOM 528 CA THR A 34 -1.253 -20.602 -11.733 1.00 0.00 C ATOM 529 C THR A 34 -0.849 -20.161 -10.330 1.00 0.00 C ATOM 530 O THR A 34 -0.362 -20.976 -9.546 1.00 0.00 O ATOM 531 CB THR A 34 -0.139 -20.317 -12.742 1.00 0.00 C ATOM 532 OG1 THR A 34 -0.499 -20.827 -14.007 1.00 0.00 O ATOM 533 CG2 THR A 34 1.167 -20.965 -12.298 1.00 0.00 C ATOM 0 H THR A 34 -2.316 -19.222 -12.886 1.00 0.00 H new ATOM 0 HA THR A 34 -1.435 -21.676 -11.705 1.00 0.00 H new ATOM 0 HB THR A 34 0.001 -19.238 -12.802 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.227 -20.289 -14.381 1.00 0.00 H new ATOM 0 HG21 THR A 34 1.947 -20.751 -13.029 1.00 0.00 H new ATOM 0 HG22 THR A 34 1.460 -20.565 -11.327 1.00 0.00 H new ATOM 0 HG23 THR A 34 1.030 -22.044 -12.220 1.00 0.00 H new ATOM 541 N TYR A 35 -1.047 -18.879 -10.009 1.00 0.00 N ATOM 542 CA TYR A 35 -0.776 -18.373 -8.671 1.00 0.00 C ATOM 543 C TYR A 35 -1.721 -19.027 -7.671 1.00 0.00 C ATOM 544 O TYR A 35 -1.334 -19.307 -6.539 1.00 0.00 O ATOM 545 CB TYR A 35 -0.975 -16.855 -8.651 1.00 0.00 C ATOM 546 CG TYR A 35 -1.047 -16.264 -7.254 1.00 0.00 C ATOM 547 CD1 TYR A 35 0.120 -15.850 -6.596 1.00 0.00 C ATOM 548 CD2 TYR A 35 -2.291 -16.130 -6.622 1.00 0.00 C ATOM 549 CE1 TYR A 35 0.048 -15.305 -5.305 1.00 0.00 C ATOM 550 CE2 TYR A 35 -2.374 -15.585 -5.335 1.00 0.00 C ATOM 551 CZ TYR A 35 -1.205 -15.169 -4.668 1.00 0.00 C ATOM 552 OH TYR A 35 -1.294 -14.637 -3.415 1.00 0.00 O ATOM 0 H TYR A 35 -1.394 -18.177 -10.662 1.00 0.00 H new ATOM 0 HA TYR A 35 0.252 -18.609 -8.397 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -0.155 -16.383 -9.193 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -1.893 -16.611 -9.186 1.00 0.00 H new ATOM 0 HD1 TYR A 35 1.078 -15.951 -7.085 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -3.189 -16.449 -7.130 1.00 0.00 H new ATOM 0 HE1 TYR A 35 0.949 -14.990 -4.800 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -3.335 -15.483 -4.853 1.00 0.00 H new ATOM 0 HH TYR A 35 -0.408 -14.637 -2.996 1.00 0.00 H new ATOM 562 N ALA A 36 -2.965 -19.274 -8.088 1.00 0.00 N ATOM 563 CA ALA A 36 -3.952 -19.907 -7.235 1.00 0.00 C ATOM 564 C ALA A 36 -3.637 -21.381 -7.019 1.00 0.00 C ATOM 565 O ALA A 36 -3.879 -21.902 -5.931 1.00 0.00 O ATOM 566 CB ALA A 36 -5.316 -19.749 -7.897 1.00 0.00 C ATOM 0 H ALA A 36 -3.307 -19.040 -9.020 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.944 -19.431 -6.255 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -6.079 -20.217 -7.275 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.543 -18.689 -8.014 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -5.303 -20.227 -8.876 1.00 0.00 H new ATOM 572 N LEU A 37 -3.099 -22.056 -8.042 1.00 0.00 N ATOM 573 CA LEU A 37 -2.757 -23.467 -7.941 1.00 0.00 C ATOM 574 C LEU A 37 -1.570 -23.665 -7.005 1.00 0.00 C ATOM 575 O LEU A 37 -1.491 -24.690 -6.327 1.00 0.00 O ATOM 576 CB LEU A 37 -2.410 -24.004 -9.333 1.00 0.00 C ATOM 577 CG LEU A 37 -3.556 -24.814 -9.953 1.00 0.00 C ATOM 578 CD1 LEU A 37 -3.804 -26.097 -9.156 1.00 0.00 C ATOM 579 CD2 LEU A 37 -4.855 -24.013 -10.018 1.00 0.00 C ATOM 0 H LEU A 37 -2.893 -21.639 -8.950 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.612 -24.010 -7.537 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.163 -23.170 -9.989 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.521 -24.631 -9.266 1.00 0.00 H new ATOM 0 HG LEU A 37 -3.250 -25.061 -10.970 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.620 -26.657 -9.612 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.901 -26.707 -9.158 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -4.068 -25.842 -8.130 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -5.638 -24.626 -10.464 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -5.152 -23.720 -9.011 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.702 -23.121 -10.625 1.00 0.00 H new ATOM 591 N ASP A 38 -0.655 -22.697 -6.963 1.00 0.00 N ATOM 592 CA ASP A 38 0.474 -22.747 -6.048 1.00 0.00 C ATOM 593 C ASP A 38 0.008 -22.563 -4.601 1.00 0.00 C ATOM 594 O ASP A 38 0.699 -22.979 -3.672 1.00 0.00 O ATOM 595 CB ASP A 38 1.467 -21.652 -6.450 1.00 0.00 C ATOM 596 CG ASP A 38 2.850 -21.834 -5.820 1.00 0.00 C ATOM 597 OD1 ASP A 38 3.125 -22.957 -5.342 1.00 0.00 O ATOM 598 OD2 ASP A 38 3.611 -20.844 -5.829 1.00 0.00 O1- ATOM 0 H ASP A 38 -0.678 -21.868 -7.556 1.00 0.00 H new ATOM 0 HA ASP A 38 0.959 -23.721 -6.108 1.00 0.00 H new ATOM 0 HB2 ASP A 38 1.567 -21.642 -7.535 1.00 0.00 H new ATOM 0 HB3 ASP A 38 1.066 -20.681 -6.158 1.00 0.00 H new ATOM 603 N HIS A 39 -1.162 -21.942 -4.397 1.00 0.00 N ATOM 604 CA HIS A 39 -1.653 -21.616 -3.069 1.00 0.00 C ATOM 605 C HIS A 39 -3.178 -21.597 -2.996 1.00 0.00 C ATOM 606 O HIS A 39 -3.812 -20.632 -3.419 1.00 0.00 O ATOM 607 CB HIS A 39 -1.101 -20.248 -2.669 1.00 0.00 C ATOM 608 CG HIS A 39 0.393 -20.204 -2.499 1.00 0.00 C ATOM 609 ND1 HIS A 39 1.305 -19.877 -3.504 1.00 0.00 N ATOM 610 CD2 HIS A 39 1.072 -20.476 -1.344 1.00 0.00 C ATOM 611 CE1 HIS A 39 2.515 -19.975 -2.932 1.00 0.00 C ATOM 612 NE2 HIS A 39 2.409 -20.330 -1.639 1.00 0.00 N ATOM 0 H HIS A 39 -1.786 -21.656 -5.151 1.00 0.00 H new ATOM 0 HA HIS A 39 -1.313 -22.391 -2.383 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -1.390 -19.518 -3.426 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -1.570 -19.940 -1.734 1.00 0.00 H new ATOM 0 HD2 HIS A 39 0.645 -20.751 -0.391 1.00 0.00 H new ATOM 0 HE1 HIS A 39 3.449 -19.793 -3.442 1.00 0.00 H new ATOM 0 HE2 HIS A 39 3.184 -20.467 -0.990 1.00 0.00 H new ATOM 620 N ILE A 40 -3.767 -22.669 -2.451 1.00 0.00 N ATOM 621 CA ILE A 40 -5.188 -22.697 -2.144 1.00 0.00 C ATOM 622 C ILE A 40 -5.463 -21.852 -0.904 1.00 0.00 C ATOM 623 O ILE A 40 -6.621 -21.599 -0.579 1.00 0.00 O ATOM 624 CB ILE A 40 -5.682 -24.132 -1.913 1.00 0.00 C ATOM 625 CG1 ILE A 40 -4.765 -24.954 -0.991 1.00 0.00 C ATOM 626 CG2 ILE A 40 -5.944 -24.830 -3.249 1.00 0.00 C ATOM 627 CD1 ILE A 40 -3.682 -25.755 -1.718 1.00 0.00 C ATOM 0 H ILE A 40 -3.271 -23.529 -2.215 1.00 0.00 H new ATOM 0 HA ILE A 40 -5.727 -22.287 -2.998 1.00 0.00 H new ATOM 0 HB ILE A 40 -6.628 -24.061 -1.376 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -4.285 -24.279 -0.282 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -5.379 -25.642 -0.410 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -6.293 -25.846 -3.066 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -6.703 -24.279 -3.804 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -5.022 -24.862 -3.830 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -3.084 -26.303 -0.990 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -4.150 -26.459 -2.406 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -3.039 -25.074 -2.277 1.00 0.00 H new ATOM 639 N ASP A 41 -4.407 -21.414 -0.213 1.00 0.00 N ATOM 640 CA ASP A 41 -4.495 -20.617 1.004 1.00 0.00 C ATOM 641 C ASP A 41 -5.289 -19.330 0.804 1.00 0.00 C ATOM 642 O ASP A 41 -5.731 -18.715 1.771 1.00 0.00 O ATOM 643 CB ASP A 41 -3.075 -20.246 1.428 1.00 0.00 C ATOM 644 CG ASP A 41 -2.153 -21.452 1.581 1.00 0.00 C ATOM 645 OD1 ASP A 41 -0.922 -21.226 1.559 1.00 0.00 O ATOM 646 OD2 ASP A 41 -2.679 -22.577 1.716 1.00 0.00 O1- ATOM 0 H ASP A 41 -3.447 -21.611 -0.495 1.00 0.00 H new ATOM 0 HA ASP A 41 -5.010 -21.210 1.760 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -2.650 -19.565 0.691 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -3.116 -19.707 2.374 1.00 0.00 H new ATOM 651 N ILE A 42 -5.464 -18.933 -0.456 1.00 0.00 N ATOM 652 CA ILE A 42 -6.165 -17.716 -0.831 1.00 0.00 C ATOM 653 C ILE A 42 -7.374 -18.017 -1.712 1.00 0.00 C ATOM 654 O ILE A 42 -7.879 -17.123 -2.386 1.00 0.00 O ATOM 655 CB ILE A 42 -5.190 -16.747 -1.501 1.00 0.00 C ATOM 656 CG1 ILE A 42 -4.582 -17.371 -2.766 1.00 0.00 C ATOM 657 CG2 ILE A 42 -4.160 -16.254 -0.482 1.00 0.00 C ATOM 658 CD1 ILE A 42 -3.088 -17.641 -2.651 1.00 0.00 C ATOM 0 H ILE A 42 -5.114 -19.461 -1.256 1.00 0.00 H new ATOM 0 HA ILE A 42 -6.554 -17.240 0.069 1.00 0.00 H new ATOM 0 HB ILE A 42 -5.722 -15.861 -1.847 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -5.097 -18.307 -2.984 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -4.759 -16.706 -3.611 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -3.469 -15.564 -0.967 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -4.671 -15.742 0.333 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -3.605 -17.104 -0.085 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -2.725 -18.081 -3.580 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -2.562 -16.705 -2.464 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -2.905 -18.330 -1.827 1.00 0.00 H new ATOM 670 N GLU A 43 -7.852 -19.265 -1.725 1.00 0.00 N ATOM 671 CA GLU A 43 -9.028 -19.623 -2.510 1.00 0.00 C ATOM 672 C GLU A 43 -10.204 -18.693 -2.197 1.00 0.00 C ATOM 673 O GLU A 43 -11.009 -18.404 -3.079 1.00 0.00 O ATOM 674 CB GLU A 43 -9.374 -21.093 -2.257 1.00 0.00 C ATOM 675 CG GLU A 43 -9.688 -21.425 -0.795 1.00 0.00 C ATOM 676 CD GLU A 43 -11.084 -21.020 -0.338 1.00 0.00 C ATOM 677 OE1 GLU A 43 -11.959 -20.811 -1.204 1.00 0.00 O ATOM 678 OE2 GLU A 43 -11.250 -20.929 0.899 1.00 0.00 O1- ATOM 0 H GLU A 43 -7.442 -20.039 -1.202 1.00 0.00 H new ATOM 0 HA GLU A 43 -8.809 -19.498 -3.570 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -10.233 -21.363 -2.871 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -8.540 -21.712 -2.587 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -9.568 -22.498 -0.646 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -8.954 -20.931 -0.158 1.00 0.00 H new ATOM 685 N SER A 44 -10.307 -18.220 -0.953 1.00 0.00 N ATOM 686 CA SER A 44 -11.401 -17.346 -0.546 1.00 0.00 C ATOM 687 C SER A 44 -11.423 -16.035 -1.337 1.00 0.00 C ATOM 688 O SER A 44 -12.482 -15.623 -1.811 1.00 0.00 O ATOM 689 CB SER A 44 -11.287 -17.076 0.951 1.00 0.00 C ATOM 690 OG SER A 44 -12.292 -16.172 1.352 1.00 0.00 O ATOM 0 H SER A 44 -9.641 -18.431 -0.210 1.00 0.00 H new ATOM 0 HA SER A 44 -12.343 -17.850 -0.762 1.00 0.00 H new ATOM 0 HB2 SER A 44 -11.382 -18.009 1.506 1.00 0.00 H new ATOM 0 HB3 SER A 44 -10.304 -16.666 1.182 1.00 0.00 H new ATOM 0 HG SER A 44 -12.215 -16.003 2.314 1.00 0.00 H new ATOM 696 N LYS A 45 -10.272 -15.362 -1.497 1.00 0.00 N ATOM 697 CA LYS A 45 -10.235 -14.108 -2.244 1.00 0.00 C ATOM 698 C LYS A 45 -10.367 -14.383 -3.741 1.00 0.00 C ATOM 699 O LYS A 45 -10.798 -13.509 -4.492 1.00 0.00 O ATOM 700 CB LYS A 45 -8.945 -13.331 -1.934 1.00 0.00 C ATOM 701 CG LYS A 45 -7.709 -14.155 -2.294 1.00 0.00 C ATOM 702 CD LYS A 45 -6.400 -13.359 -2.288 1.00 0.00 C ATOM 703 CE LYS A 45 -5.982 -12.923 -0.888 1.00 0.00 C ATOM 704 NZ LYS A 45 -4.630 -12.340 -0.887 1.00 0.00 N1+ ATOM 0 H LYS A 45 -9.372 -15.664 -1.124 1.00 0.00 H new ATOM 0 HA LYS A 45 -11.078 -13.490 -1.935 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -8.937 -12.395 -2.492 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -8.918 -13.072 -0.876 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -7.621 -14.983 -1.591 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -7.852 -14.590 -3.283 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -5.608 -13.967 -2.726 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -6.513 -12.478 -2.920 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -6.695 -12.193 -0.505 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -6.011 -13.780 -0.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -4.004 -12.917 -0.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -4.260 -12.320 -1.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -4.670 -11.371 -0.512 1.00 0.00 H new ATOM 718 N ILE A 46 -10.001 -15.591 -4.175 1.00 0.00 N ATOM 719 CA ILE A 46 -10.070 -15.979 -5.574 1.00 0.00 C ATOM 720 C ILE A 46 -11.524 -16.160 -5.986 1.00 0.00 C ATOM 721 O ILE A 46 -11.944 -15.627 -7.012 1.00 0.00 O ATOM 722 CB ILE A 46 -9.271 -17.268 -5.768 1.00 0.00 C ATOM 723 CG1 ILE A 46 -7.783 -16.942 -5.618 1.00 0.00 C ATOM 724 CG2 ILE A 46 -9.546 -17.897 -7.140 1.00 0.00 C ATOM 725 CD1 ILE A 46 -6.948 -18.194 -5.363 1.00 0.00 C ATOM 0 H ILE A 46 -9.649 -16.325 -3.560 1.00 0.00 H new ATOM 0 HA ILE A 46 -9.639 -15.202 -6.206 1.00 0.00 H new ATOM 0 HB ILE A 46 -9.575 -17.995 -5.015 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -7.427 -16.446 -6.521 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -7.646 -16.241 -4.795 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -8.962 -18.811 -7.245 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -10.607 -18.132 -7.226 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -9.265 -17.195 -7.925 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -5.898 -17.917 -5.263 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -7.285 -18.676 -4.445 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -7.063 -18.884 -6.199 1.00 0.00 H new ATOM 737 N ILE A 47 -12.287 -16.909 -5.187 1.00 0.00 N ATOM 738 CA ILE A 47 -13.699 -17.117 -5.466 1.00 0.00 C ATOM 739 C ILE A 47 -14.438 -15.787 -5.385 1.00 0.00 C ATOM 740 O ILE A 47 -15.369 -15.555 -6.150 1.00 0.00 O ATOM 741 CB ILE A 47 -14.289 -18.136 -4.477 1.00 0.00 C ATOM 742 CG1 ILE A 47 -13.663 -19.525 -4.644 1.00 0.00 C ATOM 743 CG2 ILE A 47 -15.808 -18.230 -4.642 1.00 0.00 C ATOM 744 CD1 ILE A 47 -13.853 -20.124 -6.040 1.00 0.00 C ATOM 0 H ILE A 47 -11.948 -17.377 -4.347 1.00 0.00 H new ATOM 0 HA ILE A 47 -13.815 -17.518 -6.473 1.00 0.00 H new ATOM 0 HB ILE A 47 -14.055 -17.780 -3.474 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -12.596 -19.461 -4.428 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -14.097 -20.200 -3.907 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -16.207 -18.956 -3.934 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -16.256 -17.254 -4.452 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -16.045 -18.547 -5.658 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -13.383 -21.107 -6.081 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -14.918 -20.221 -6.252 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -13.393 -19.471 -6.782 1.00 0.00 H new ATOM 756 N SER A 48 -14.036 -14.907 -4.463 1.00 0.00 N ATOM 757 CA SER A 48 -14.703 -13.623 -4.306 1.00 0.00 C ATOM 758 C SER A 48 -14.555 -12.755 -5.555 1.00 0.00 C ATOM 759 O SER A 48 -15.519 -12.129 -5.997 1.00 0.00 O ATOM 760 CB SER A 48 -14.111 -12.917 -3.089 1.00 0.00 C ATOM 761 OG SER A 48 -14.682 -11.636 -2.950 1.00 0.00 O ATOM 0 H SER A 48 -13.258 -15.063 -3.822 1.00 0.00 H new ATOM 0 HA SER A 48 -15.770 -13.791 -4.161 1.00 0.00 H new ATOM 0 HB2 SER A 48 -14.296 -13.506 -2.191 1.00 0.00 H new ATOM 0 HB3 SER A 48 -13.030 -12.832 -3.198 1.00 0.00 H new ATOM 0 HG SER A 48 -14.298 -11.190 -2.166 1.00 0.00 H new ATOM 767 N LEU A 49 -13.354 -12.703 -6.140 1.00 0.00 N ATOM 768 CA LEU A 49 -13.108 -11.843 -7.280 1.00 0.00 C ATOM 769 C LEU A 49 -13.705 -12.380 -8.580 1.00 0.00 C ATOM 770 O LEU A 49 -14.120 -11.580 -9.418 1.00 0.00 O ATOM 771 CB LEU A 49 -11.601 -11.658 -7.430 1.00 0.00 C ATOM 772 CG LEU A 49 -11.018 -10.722 -6.367 1.00 0.00 C ATOM 773 CD1 LEU A 49 -9.532 -10.560 -6.666 1.00 0.00 C ATOM 774 CD2 LEU A 49 -11.670 -9.337 -6.389 1.00 0.00 C ATOM 0 H LEU A 49 -12.546 -13.247 -5.837 1.00 0.00 H new ATOM 0 HA LEU A 49 -13.602 -10.890 -7.092 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -11.110 -12.629 -7.363 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -11.384 -11.258 -8.421 1.00 0.00 H new ATOM 0 HG LEU A 49 -11.201 -11.156 -5.384 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -9.082 -9.897 -5.927 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.044 -11.534 -6.625 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.405 -10.133 -7.661 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.222 -8.712 -5.617 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -11.514 -8.877 -7.365 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -12.739 -9.435 -6.201 1.00 0.00 H new ATOM 786 N ILE A 50 -13.761 -13.700 -8.777 1.00 0.00 N ATOM 787 CA ILE A 50 -14.335 -14.226 -10.012 1.00 0.00 C ATOM 788 C ILE A 50 -15.849 -14.060 -10.018 1.00 0.00 C ATOM 789 O ILE A 50 -16.409 -13.655 -11.036 1.00 0.00 O ATOM 790 CB ILE A 50 -13.961 -15.698 -10.239 1.00 0.00 C ATOM 791 CG1 ILE A 50 -14.405 -16.563 -9.057 1.00 0.00 C ATOM 792 CG2 ILE A 50 -12.465 -15.824 -10.531 1.00 0.00 C ATOM 793 CD1 ILE A 50 -13.764 -17.945 -9.083 1.00 0.00 C ATOM 0 H ILE A 50 -13.426 -14.403 -8.118 1.00 0.00 H new ATOM 0 HA ILE A 50 -13.912 -13.647 -10.833 1.00 0.00 H new ATOM 0 HB ILE A 50 -14.494 -16.071 -11.114 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -14.146 -16.062 -8.124 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -15.490 -16.667 -9.072 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -12.212 -16.872 -10.690 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -12.219 -15.252 -11.426 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -11.895 -15.438 -9.686 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -14.109 -18.522 -8.225 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -14.044 -18.459 -10.003 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -12.680 -17.844 -9.040 1.00 0.00 H new ATOM 805 N ILE A 51 -16.528 -14.363 -8.904 1.00 0.00 N ATOM 806 CA ILE A 51 -17.973 -14.180 -8.869 1.00 0.00 C ATOM 807 C ILE A 51 -18.317 -12.704 -9.067 1.00 0.00 C ATOM 808 O ILE A 51 -19.276 -12.390 -9.766 1.00 0.00 O ATOM 809 CB ILE A 51 -18.582 -14.742 -7.573 1.00 0.00 C ATOM 810 CG1 ILE A 51 -18.157 -13.907 -6.360 1.00 0.00 C ATOM 811 CG2 ILE A 51 -18.206 -16.219 -7.419 1.00 0.00 C ATOM 812 CD1 ILE A 51 -18.733 -14.438 -5.050 1.00 0.00 C ATOM 0 H ILE A 51 -16.112 -14.724 -8.045 1.00 0.00 H new ATOM 0 HA ILE A 51 -18.415 -14.745 -9.690 1.00 0.00 H new ATOM 0 HB ILE A 51 -19.669 -14.678 -7.631 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -17.069 -13.895 -6.295 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -18.480 -12.876 -6.503 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -18.640 -16.611 -6.499 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -18.589 -16.782 -8.270 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -17.121 -16.316 -7.378 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -18.400 -13.809 -4.225 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -19.822 -14.425 -5.100 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -18.389 -15.460 -4.889 1.00 0.00 H new ATOM 824 N ASP A 52 -17.550 -11.792 -8.459 1.00 0.00 N ATOM 825 CA ASP A 52 -17.793 -10.369 -8.644 1.00 0.00 C ATOM 826 C ASP A 52 -17.417 -9.908 -10.051 1.00 0.00 C ATOM 827 O ASP A 52 -18.066 -9.014 -10.589 1.00 0.00 O ATOM 828 CB ASP A 52 -17.041 -9.576 -7.576 1.00 0.00 C ATOM 829 CG ASP A 52 -17.686 -9.716 -6.200 1.00 0.00 C ATOM 830 OD1 ASP A 52 -17.050 -9.253 -5.229 1.00 0.00 O ATOM 831 OD2 ASP A 52 -18.802 -10.279 -6.136 1.00 0.00 O1- ATOM 0 H ASP A 52 -16.768 -12.016 -7.844 1.00 0.00 H new ATOM 0 HA ASP A 52 -18.861 -10.184 -8.532 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -16.008 -9.921 -7.529 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -17.013 -8.524 -7.858 1.00 0.00 H new ATOM 836 N TYR A 53 -16.383 -10.498 -10.662 1.00 0.00 N ATOM 837 CA TYR A 53 -16.017 -10.148 -12.025 1.00 0.00 C ATOM 838 C TYR A 53 -17.112 -10.611 -12.987 1.00 0.00 C ATOM 839 O TYR A 53 -17.370 -9.950 -13.991 1.00 0.00 O ATOM 840 CB TYR A 53 -14.665 -10.777 -12.370 1.00 0.00 C ATOM 841 CG TYR A 53 -14.196 -10.550 -13.792 1.00 0.00 C ATOM 842 CD1 TYR A 53 -14.233 -9.266 -14.359 1.00 0.00 C ATOM 843 CD2 TYR A 53 -13.724 -11.635 -14.549 1.00 0.00 C ATOM 844 CE1 TYR A 53 -13.817 -9.067 -15.686 1.00 0.00 C ATOM 845 CE2 TYR A 53 -13.329 -11.450 -15.885 1.00 0.00 C ATOM 846 CZ TYR A 53 -13.395 -10.165 -16.460 1.00 0.00 C ATOM 847 OH TYR A 53 -13.053 -9.969 -17.765 1.00 0.00 O ATOM 0 H TYR A 53 -15.795 -11.212 -10.233 1.00 0.00 H new ATOM 0 HA TYR A 53 -15.921 -9.066 -12.119 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -13.913 -10.381 -11.688 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -14.725 -11.850 -12.190 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -14.582 -8.429 -13.773 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -13.664 -12.616 -14.102 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -13.821 -8.074 -16.111 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -12.977 -12.288 -16.468 1.00 0.00 H new ATOM 0 HH TYR A 53 -12.663 -10.791 -18.128 1.00 0.00 H new ATOM 857 N SER A 54 -17.760 -11.743 -12.690 1.00 0.00 N ATOM 858 CA SER A 54 -18.849 -12.252 -13.515 1.00 0.00 C ATOM 859 C SER A 54 -20.174 -11.564 -13.196 1.00 0.00 C ATOM 860 O SER A 54 -21.106 -11.617 -13.997 1.00 0.00 O ATOM 861 CB SER A 54 -19.005 -13.754 -13.293 1.00 0.00 C ATOM 862 OG SER A 54 -20.019 -14.247 -14.139 1.00 0.00 O ATOM 0 H SER A 54 -17.544 -12.323 -11.879 1.00 0.00 H new ATOM 0 HA SER A 54 -18.597 -12.044 -14.555 1.00 0.00 H new ATOM 0 HB2 SER A 54 -18.064 -14.263 -13.499 1.00 0.00 H new ATOM 0 HB3 SER A 54 -19.255 -13.955 -12.251 1.00 0.00 H new ATOM 0 HG SER A 54 -20.686 -13.546 -14.293 1.00 0.00 H new ATOM 868 N ARG A 55 -20.278 -10.917 -12.036 1.00 0.00 N ATOM 869 CA ARG A 55 -21.507 -10.263 -11.621 1.00 0.00 C ATOM 870 C ARG A 55 -21.545 -8.782 -11.995 1.00 0.00 C ATOM 871 O ARG A 55 -22.576 -8.297 -12.456 1.00 0.00 O ATOM 872 CB ARG A 55 -21.633 -10.507 -10.119 1.00 0.00 C ATOM 873 CG ARG A 55 -22.948 -10.008 -9.530 1.00 0.00 C ATOM 874 CD ARG A 55 -23.237 -10.856 -8.292 1.00 0.00 C ATOM 875 NE ARG A 55 -22.129 -10.840 -7.332 1.00 0.00 N ATOM 876 CZ ARG A 55 -22.059 -11.653 -6.271 1.00 0.00 C ATOM 877 NH1 ARG A 55 -23.045 -12.509 -5.993 1.00 0.00 N1+ ATOM 878 NH2 ARG A 55 -20.991 -11.616 -5.471 1.00 0.00 N ATOM 0 H ARG A 55 -19.515 -10.835 -11.365 1.00 0.00 H new ATOM 0 HA ARG A 55 -22.365 -10.680 -12.148 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -21.538 -11.575 -9.923 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -20.805 -10.015 -9.608 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -22.876 -8.953 -9.266 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -23.755 -10.100 -10.257 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -24.141 -10.488 -7.806 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -23.435 -11.884 -8.597 1.00 0.00 H new ATOM 0 HE ARG A 55 -21.371 -10.174 -7.481 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -23.868 -12.551 -6.593 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -22.975 -13.121 -5.180 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -20.228 -10.968 -5.668 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -20.938 -12.236 -4.662 1.00 0.00 H new ATOM 892 N LEU A 56 -20.432 -8.066 -11.797 1.00 0.00 N ATOM 893 CA LEU A 56 -20.377 -6.626 -12.019 1.00 0.00 C ATOM 894 C LEU A 56 -20.064 -6.247 -13.463 1.00 0.00 C ATOM 895 O LEU A 56 -20.756 -5.418 -14.050 1.00 0.00 O ATOM 896 CB LEU A 56 -19.291 -6.030 -11.120 1.00 0.00 C ATOM 897 CG LEU A 56 -19.503 -6.353 -9.641 1.00 0.00 C ATOM 898 CD1 LEU A 56 -18.228 -5.966 -8.897 1.00 0.00 C ATOM 899 CD2 LEU A 56 -20.697 -5.582 -9.083 1.00 0.00 C ATOM 0 H LEU A 56 -19.551 -8.471 -11.480 1.00 0.00 H new ATOM 0 HA LEU A 56 -21.366 -6.232 -11.786 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -18.318 -6.408 -11.434 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -19.270 -4.948 -11.252 1.00 0.00 H new ATOM 0 HG LEU A 56 -19.713 -7.415 -9.516 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -18.346 -6.184 -7.836 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -17.388 -6.536 -9.294 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -18.038 -4.901 -9.030 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -20.829 -5.828 -8.029 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -20.519 -4.512 -9.187 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -21.597 -5.856 -9.634 1.00 0.00 H new ATOM 911 N CYS A 57 -19.020 -6.854 -14.029 1.00 0.00 N ATOM 912 CA CYS A 57 -18.484 -6.463 -15.323 1.00 0.00 C ATOM 913 C CYS A 57 -19.388 -6.858 -16.497 1.00 0.00 C ATOM 914 O CYS A 57 -20.316 -7.650 -16.332 1.00 0.00 O ATOM 915 CB CYS A 57 -17.072 -7.041 -15.447 1.00 0.00 C ATOM 916 SG CYS A 57 -16.078 -6.372 -14.087 1.00 0.00 S ATOM 0 H CYS A 57 -18.524 -7.633 -13.597 1.00 0.00 H new ATOM 0 HA CYS A 57 -18.441 -5.375 -15.375 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -17.099 -8.130 -15.400 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -16.633 -6.774 -16.408 1.00 0.00 H new ATOM 0 HG CYS A 57 -15.512 -5.265 -14.467 1.00 0.00 H new ATOM 922 N PRO A 58 -19.115 -6.303 -17.692 1.00 0.00 N ATOM 923 CA PRO A 58 -19.901 -6.463 -18.903 1.00 0.00 C ATOM 924 C PRO A 58 -19.989 -7.907 -19.381 1.00 0.00 C ATOM 925 O PRO A 58 -19.251 -8.777 -18.934 1.00 0.00 O ATOM 926 CB PRO A 58 -19.222 -5.608 -19.975 1.00 0.00 C ATOM 927 CG PRO A 58 -18.379 -4.619 -19.182 1.00 0.00 C ATOM 928 CD PRO A 58 -17.991 -5.438 -17.956 1.00 0.00 C ATOM 0 HA PRO A 58 -20.927 -6.154 -18.703 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -18.606 -6.215 -20.638 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -19.954 -5.097 -20.600 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -17.505 -4.287 -19.743 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -18.944 -3.726 -18.913 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -17.087 -6.017 -18.142 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -17.785 -4.792 -17.103 1.00 0.00 H new ATOM 936 N ASP A 59 -20.917 -8.128 -20.306 1.00 0.00 N ATOM 937 CA ASP A 59 -21.321 -9.441 -20.792 1.00 0.00 C ATOM 938 C ASP A 59 -20.155 -10.294 -21.294 1.00 0.00 C ATOM 939 O ASP A 59 -20.075 -11.481 -20.979 1.00 0.00 O ATOM 940 CB ASP A 59 -22.331 -9.245 -21.925 1.00 0.00 C ATOM 941 CG ASP A 59 -21.861 -8.321 -23.053 1.00 0.00 C ATOM 942 OD1 ASP A 59 -20.785 -7.697 -22.915 1.00 0.00 O ATOM 943 OD2 ASP A 59 -22.603 -8.252 -24.055 1.00 0.00 O1- ATOM 0 H ASP A 59 -21.428 -7.367 -20.755 1.00 0.00 H new ATOM 0 HA ASP A 59 -21.756 -9.981 -19.951 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -22.573 -10.219 -22.350 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -23.253 -8.843 -21.505 1.00 0.00 H new ATOM 948 N SER A 60 -19.247 -9.706 -22.075 1.00 0.00 N ATOM 949 CA SER A 60 -18.115 -10.449 -22.599 1.00 0.00 C ATOM 950 C SER A 60 -17.122 -10.753 -21.480 1.00 0.00 C ATOM 951 O SER A 60 -16.413 -11.757 -21.525 1.00 0.00 O ATOM 952 CB SER A 60 -17.484 -9.662 -23.746 1.00 0.00 C ATOM 953 OG SER A 60 -16.583 -10.486 -24.453 1.00 0.00 O ATOM 0 H SER A 60 -19.278 -8.725 -22.353 1.00 0.00 H new ATOM 0 HA SER A 60 -18.444 -11.409 -22.997 1.00 0.00 H new ATOM 0 HB2 SER A 60 -18.260 -9.296 -24.418 1.00 0.00 H new ATOM 0 HB3 SER A 60 -16.962 -8.788 -23.356 1.00 0.00 H new ATOM 0 HG SER A 60 -15.902 -10.830 -23.837 1.00 0.00 H new ATOM 959 N HIS A 61 -17.069 -9.882 -20.465 1.00 0.00 N ATOM 960 CA HIS A 61 -16.232 -10.089 -19.297 1.00 0.00 C ATOM 961 C HIS A 61 -16.863 -11.139 -18.382 1.00 0.00 C ATOM 962 O HIS A 61 -16.142 -11.846 -17.678 1.00 0.00 O ATOM 963 CB HIS A 61 -16.031 -8.754 -18.578 1.00 0.00 C ATOM 964 CG HIS A 61 -15.445 -7.706 -19.484 1.00 0.00 C ATOM 965 ND1 HIS A 61 -16.146 -7.009 -20.470 1.00 0.00 N ATOM 966 CD2 HIS A 61 -14.146 -7.290 -19.476 1.00 0.00 C ATOM 967 CE1 HIS A 61 -15.243 -6.194 -21.037 1.00 0.00 C ATOM 968 NE2 HIS A 61 -14.038 -6.340 -20.462 1.00 0.00 N ATOM 0 H HIS A 61 -17.608 -9.017 -20.439 1.00 0.00 H new ATOM 0 HA HIS A 61 -15.254 -10.464 -19.598 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -16.988 -8.404 -18.191 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -15.374 -8.900 -17.721 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -13.359 -7.638 -18.824 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -15.457 -5.512 -21.847 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -13.190 -5.833 -20.714 1.00 0.00 H new ATOM 976 N LYS A 62 -18.199 -11.249 -18.385 1.00 0.00 N ATOM 977 CA LYS A 62 -18.878 -12.315 -17.660 1.00 0.00 C ATOM 978 C LYS A 62 -18.456 -13.665 -18.225 1.00 0.00 C ATOM 979 O LYS A 62 -18.224 -14.595 -17.456 1.00 0.00 O ATOM 980 CB LYS A 62 -20.402 -12.174 -17.750 1.00 0.00 C ATOM 981 CG LYS A 62 -20.903 -10.894 -17.083 1.00 0.00 C ATOM 982 CD LYS A 62 -22.430 -10.814 -17.136 1.00 0.00 C ATOM 983 CE LYS A 62 -22.895 -9.543 -16.418 1.00 0.00 C ATOM 984 NZ LYS A 62 -22.892 -9.723 -14.954 1.00 0.00 N1+ ATOM 0 H LYS A 62 -18.822 -10.612 -18.881 1.00 0.00 H new ATOM 0 HA LYS A 62 -18.594 -12.244 -16.610 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -20.704 -12.178 -18.797 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -20.874 -13.036 -17.278 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -20.569 -10.865 -16.046 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -20.472 -10.026 -17.582 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -22.770 -10.805 -18.172 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -22.868 -11.693 -16.664 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -22.242 -8.712 -16.686 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -23.899 -9.280 -16.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -22.432 -8.906 -14.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -23.871 -9.801 -14.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -22.371 -10.590 -14.712 1.00 0.00 H new ATOM 998 N LEU A 63 -18.354 -13.790 -19.555 1.00 0.00 N ATOM 999 CA LEU A 63 -17.897 -15.039 -20.144 1.00 0.00 C ATOM 1000 C LEU A 63 -16.463 -15.306 -19.694 1.00 0.00 C ATOM 1001 O LEU A 63 -16.131 -16.423 -19.304 1.00 0.00 O ATOM 1002 CB LEU A 63 -18.000 -14.972 -21.670 1.00 0.00 C ATOM 1003 CG LEU A 63 -17.830 -16.349 -22.343 1.00 0.00 C ATOM 1004 CD1 LEU A 63 -16.370 -16.777 -22.483 1.00 0.00 C ATOM 1005 CD2 LEU A 63 -18.596 -17.431 -21.598 1.00 0.00 C ATOM 0 H LEU A 63 -18.578 -13.054 -20.225 1.00 0.00 H new ATOM 0 HA LEU A 63 -18.528 -15.862 -19.808 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -18.969 -14.555 -21.946 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -17.240 -14.290 -22.051 1.00 0.00 H new ATOM 0 HG LEU A 63 -18.240 -16.230 -23.346 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -16.322 -17.754 -22.964 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -15.833 -16.047 -23.089 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -15.912 -16.836 -21.496 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -18.454 -18.388 -22.100 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -18.227 -17.499 -20.575 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -19.657 -17.182 -21.585 1.00 0.00 H new ATOM 1017 N GLY A 64 -15.609 -14.276 -19.749 1.00 0.00 N ATOM 1018 CA GLY A 64 -14.212 -14.410 -19.369 1.00 0.00 C ATOM 1019 C GLY A 64 -14.051 -14.811 -17.907 1.00 0.00 C ATOM 1020 O GLY A 64 -13.058 -15.438 -17.544 1.00 0.00 O ATOM 0 H GLY A 64 -15.871 -13.339 -20.056 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -13.734 -15.156 -20.004 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -13.697 -13.465 -19.544 1.00 0.00 H new ATOM 1024 N SER A 65 -15.020 -14.461 -17.057 1.00 0.00 N ATOM 1025 CA SER A 65 -14.959 -14.873 -15.667 1.00 0.00 C ATOM 1026 C SER A 65 -15.298 -16.352 -15.532 1.00 0.00 C ATOM 1027 O SER A 65 -14.684 -17.060 -14.735 1.00 0.00 O ATOM 1028 CB SER A 65 -15.920 -14.047 -14.823 1.00 0.00 C ATOM 1029 OG SER A 65 -15.718 -14.428 -13.477 1.00 0.00 O ATOM 0 H SER A 65 -15.837 -13.904 -17.307 1.00 0.00 H new ATOM 0 HA SER A 65 -13.942 -14.709 -15.310 1.00 0.00 H new ATOM 0 HB2 SER A 65 -15.731 -12.982 -14.955 1.00 0.00 H new ATOM 0 HB3 SER A 65 -16.952 -14.228 -15.125 1.00 0.00 H new ATOM 0 HG SER A 65 -16.114 -13.756 -12.884 1.00 0.00 H new ATOM 1035 N LEU A 66 -16.277 -16.828 -16.310 1.00 0.00 N ATOM 1036 CA LEU A 66 -16.642 -18.233 -16.297 1.00 0.00 C ATOM 1037 C LEU A 66 -15.491 -19.069 -16.848 1.00 0.00 C ATOM 1038 O LEU A 66 -15.391 -20.253 -16.542 1.00 0.00 O ATOM 1039 CB LEU A 66 -17.934 -18.430 -17.093 1.00 0.00 C ATOM 1040 CG LEU A 66 -19.120 -17.729 -16.418 1.00 0.00 C ATOM 1041 CD1 LEU A 66 -20.317 -17.704 -17.364 1.00 0.00 C ATOM 1042 CD2 LEU A 66 -19.545 -18.464 -15.144 1.00 0.00 C ATOM 0 H LEU A 66 -16.825 -16.255 -16.952 1.00 0.00 H new ATOM 0 HA LEU A 66 -16.827 -18.567 -15.276 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.805 -18.039 -18.102 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -18.145 -19.495 -17.189 1.00 0.00 H new ATOM 0 HG LEU A 66 -18.802 -16.717 -16.168 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -21.155 -17.205 -16.877 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -20.051 -17.164 -18.273 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -20.601 -18.725 -17.618 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -20.387 -17.944 -14.688 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -19.840 -19.483 -15.393 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -18.711 -18.489 -14.443 1.00 0.00 H new ATOM 1054 N TYR A 67 -14.617 -18.461 -17.659 1.00 0.00 N ATOM 1055 CA TYR A 67 -13.412 -19.119 -18.140 1.00 0.00 C ATOM 1056 C TYR A 67 -12.383 -19.226 -17.023 1.00 0.00 C ATOM 1057 O TYR A 67 -11.702 -20.248 -16.910 1.00 0.00 O ATOM 1058 CB TYR A 67 -12.789 -18.298 -19.259 1.00 0.00 C ATOM 1059 CG TYR A 67 -13.202 -18.679 -20.655 1.00 0.00 C ATOM 1060 CD1 TYR A 67 -12.415 -18.203 -21.705 1.00 0.00 C ATOM 1061 CD2 TYR A 67 -14.320 -19.484 -20.909 1.00 0.00 C ATOM 1062 CE1 TYR A 67 -12.729 -18.543 -23.027 1.00 0.00 C ATOM 1063 CE2 TYR A 67 -14.633 -19.848 -22.227 1.00 0.00 C ATOM 1064 CZ TYR A 67 -13.824 -19.390 -23.290 1.00 0.00 C ATOM 1065 OH TYR A 67 -14.090 -19.760 -24.572 1.00 0.00 O ATOM 0 H TYR A 67 -14.730 -17.505 -17.995 1.00 0.00 H new ATOM 0 HA TYR A 67 -13.689 -20.112 -18.494 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -13.040 -17.250 -19.099 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -11.705 -18.381 -19.185 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -11.563 -17.572 -21.498 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -14.939 -19.824 -20.092 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -12.134 -18.157 -23.842 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -15.489 -20.476 -22.428 1.00 0.00 H new ATOM 0 HH TYR A 67 -14.876 -20.346 -24.587 1.00 0.00 H new ATOM 1075 N ILE A 68 -12.258 -18.187 -16.193 1.00 0.00 N ATOM 1076 CA ILE A 68 -11.335 -18.280 -15.081 1.00 0.00 C ATOM 1077 C ILE A 68 -11.849 -19.368 -14.149 1.00 0.00 C ATOM 1078 O ILE A 68 -11.098 -20.269 -13.782 1.00 0.00 O ATOM 1079 CB ILE A 68 -11.210 -16.937 -14.360 1.00 0.00 C ATOM 1080 CG1 ILE A 68 -10.492 -15.921 -15.249 1.00 0.00 C ATOM 1081 CG2 ILE A 68 -10.418 -17.101 -13.060 1.00 0.00 C ATOM 1082 CD1 ILE A 68 -10.911 -14.502 -14.879 1.00 0.00 C ATOM 0 H ILE A 68 -12.767 -17.307 -16.271 1.00 0.00 H new ATOM 0 HA ILE A 68 -10.336 -18.534 -15.434 1.00 0.00 H new ATOM 0 HB ILE A 68 -12.215 -16.581 -14.134 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -9.413 -16.029 -15.138 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -10.726 -16.115 -16.296 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -10.338 -16.136 -12.559 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -10.932 -17.807 -12.408 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -9.420 -17.476 -13.287 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -10.391 -13.790 -15.521 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -11.987 -14.394 -15.014 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -10.654 -14.307 -13.838 1.00 0.00 H new ATOM 1094 N ILE A 69 -13.130 -19.272 -13.780 1.00 0.00 N ATOM 1095 CA ILE A 69 -13.830 -20.271 -12.984 1.00 0.00 C ATOM 1096 C ILE A 69 -13.649 -21.678 -13.553 1.00 0.00 C ATOM 1097 O ILE A 69 -13.539 -22.630 -12.783 1.00 0.00 O ATOM 1098 CB ILE A 69 -15.326 -19.914 -12.948 1.00 0.00 C ATOM 1099 CG1 ILE A 69 -15.562 -18.729 -12.010 1.00 0.00 C ATOM 1100 CG2 ILE A 69 -16.170 -21.108 -12.484 1.00 0.00 C ATOM 1101 CD1 ILE A 69 -16.904 -18.053 -12.271 1.00 0.00 C ATOM 0 H ILE A 69 -13.717 -18.478 -14.035 1.00 0.00 H new ATOM 0 HA ILE A 69 -13.410 -20.268 -11.978 1.00 0.00 H new ATOM 0 HB ILE A 69 -15.630 -19.647 -13.960 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -15.524 -19.072 -10.976 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -14.759 -18.002 -12.135 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -17.223 -20.825 -12.469 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -16.028 -21.943 -13.171 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -15.860 -21.406 -11.482 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -17.030 -17.217 -11.583 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -16.933 -17.686 -13.297 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -17.709 -18.772 -12.120 1.00 0.00 H new ATOM 1113 N ASP A 70 -13.617 -21.836 -14.878 1.00 0.00 N ATOM 1114 CA ASP A 70 -13.447 -23.153 -15.473 1.00 0.00 C ATOM 1115 C ASP A 70 -12.039 -23.683 -15.239 1.00 0.00 C ATOM 1116 O ASP A 70 -11.867 -24.786 -14.724 1.00 0.00 O ATOM 1117 CB ASP A 70 -13.715 -23.074 -16.980 1.00 0.00 C ATOM 1118 CG ASP A 70 -13.359 -24.385 -17.674 1.00 0.00 C ATOM 1119 OD1 ASP A 70 -12.527 -24.345 -18.611 1.00 0.00 O ATOM 1120 OD2 ASP A 70 -13.926 -25.418 -17.257 1.00 0.00 O1- ATOM 0 H ASP A 70 -13.706 -21.073 -15.549 1.00 0.00 H new ATOM 0 HA ASP A 70 -14.156 -23.834 -15.002 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.766 -22.842 -17.153 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -13.133 -22.261 -17.413 1.00 0.00 H new ATOM 1125 N SER A 71 -11.030 -22.895 -15.619 1.00 0.00 N ATOM 1126 CA SER A 71 -9.651 -23.339 -15.545 1.00 0.00 C ATOM 1127 C SER A 71 -9.211 -23.498 -14.093 1.00 0.00 C ATOM 1128 O SER A 71 -8.610 -24.513 -13.747 1.00 0.00 O ATOM 1129 CB SER A 71 -8.767 -22.345 -16.300 1.00 0.00 C ATOM 1130 OG SER A 71 -8.877 -21.056 -15.737 1.00 0.00 O ATOM 0 H SER A 71 -11.150 -21.948 -15.980 1.00 0.00 H new ATOM 0 HA SER A 71 -9.554 -24.319 -16.013 1.00 0.00 H new ATOM 0 HB2 SER A 71 -7.729 -22.675 -16.267 1.00 0.00 H new ATOM 0 HB3 SER A 71 -9.058 -22.315 -17.350 1.00 0.00 H new ATOM 0 HG SER A 71 -9.686 -20.619 -16.075 1.00 0.00 H new ATOM 1136 N ILE A 72 -9.500 -22.514 -13.236 1.00 0.00 N ATOM 1137 CA ILE A 72 -9.098 -22.584 -11.838 1.00 0.00 C ATOM 1138 C ILE A 72 -10.000 -23.570 -11.101 1.00 0.00 C ATOM 1139 O ILE A 72 -9.545 -24.268 -10.200 1.00 0.00 O ATOM 1140 CB ILE A 72 -9.130 -21.167 -11.236 1.00 0.00 C ATOM 1141 CG1 ILE A 72 -8.105 -20.992 -10.105 1.00 0.00 C ATOM 1142 CG2 ILE A 72 -10.519 -20.748 -10.751 1.00 0.00 C ATOM 1143 CD1 ILE A 72 -8.578 -21.525 -8.755 1.00 0.00 C ATOM 0 H ILE A 72 -10.008 -21.666 -13.489 1.00 0.00 H new ATOM 0 HA ILE A 72 -8.078 -22.954 -11.739 1.00 0.00 H new ATOM 0 HB ILE A 72 -8.857 -20.506 -12.058 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -7.182 -21.501 -10.382 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -7.867 -19.933 -10.004 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -10.472 -19.740 -10.338 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -11.217 -20.765 -11.588 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -10.859 -21.440 -9.981 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -7.800 -21.365 -8.008 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -9.484 -20.999 -8.454 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -8.788 -22.591 -8.838 1.00 0.00 H new ATOM 1155 N GLY A 73 -11.284 -23.637 -11.475 1.00 0.00 N ATOM 1156 CA GLY A 73 -12.251 -24.471 -10.789 1.00 0.00 C ATOM 1157 C GLY A 73 -11.929 -25.952 -10.951 1.00 0.00 C ATOM 1158 O GLY A 73 -11.876 -26.685 -9.964 1.00 0.00 O ATOM 0 H GLY A 73 -11.670 -23.113 -12.260 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -12.267 -24.215 -9.730 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -13.248 -24.270 -11.180 1.00 0.00 H new ATOM 1162 N ARG A 74 -11.713 -26.400 -12.193 1.00 0.00 N ATOM 1163 CA ARG A 74 -11.381 -27.793 -12.427 1.00 0.00 C ATOM 1164 C ARG A 74 -9.985 -28.096 -11.904 1.00 0.00 C ATOM 1165 O ARG A 74 -9.767 -29.171 -11.351 1.00 0.00 O ATOM 1166 CB ARG A 74 -11.472 -28.121 -13.917 1.00 0.00 C ATOM 1167 CG ARG A 74 -12.935 -28.200 -14.350 1.00 0.00 C ATOM 1168 CD ARG A 74 -13.033 -28.705 -15.788 1.00 0.00 C ATOM 1169 NE ARG A 74 -12.598 -27.686 -16.749 1.00 0.00 N ATOM 1170 CZ ARG A 74 -11.394 -27.634 -17.332 1.00 0.00 C ATOM 1171 NH1 ARG A 74 -10.471 -28.563 -17.083 1.00 0.00 N1+ ATOM 1172 NH2 ARG A 74 -11.113 -26.640 -18.175 1.00 0.00 N ATOM 0 H ARG A 74 -11.763 -25.823 -13.033 1.00 0.00 H new ATOM 0 HA ARG A 74 -12.098 -28.415 -11.892 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -10.954 -27.358 -14.497 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -10.973 -29.069 -14.120 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -13.483 -28.867 -13.685 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -13.399 -27.217 -14.270 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -12.420 -29.599 -15.903 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -14.062 -28.994 -16.004 1.00 0.00 H new ATOM 0 HE ARG A 74 -13.268 -26.957 -16.993 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -10.677 -29.328 -16.440 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -9.558 -28.509 -17.535 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -11.813 -25.925 -18.372 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -10.198 -26.594 -18.623 1.00 0.00 H new ATOM 1186 N ALA A 75 -9.042 -27.164 -12.070 1.00 0.00 N ATOM 1187 CA ALA A 75 -7.684 -27.394 -11.613 1.00 0.00 C ATOM 1188 C ALA A 75 -7.633 -27.478 -10.087 1.00 0.00 C ATOM 1189 O ALA A 75 -6.811 -28.217 -9.553 1.00 0.00 O ATOM 1190 CB ALA A 75 -6.789 -26.276 -12.137 1.00 0.00 C ATOM 0 H ALA A 75 -9.198 -26.258 -12.512 1.00 0.00 H new ATOM 0 HA ALA A 75 -7.324 -28.348 -12.000 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -5.766 -26.440 -11.799 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -6.814 -26.270 -13.227 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -7.146 -25.317 -11.761 1.00 0.00 H new ATOM 1196 N TYR A 76 -8.494 -26.739 -9.377 1.00 0.00 N ATOM 1197 CA TYR A 76 -8.549 -26.841 -7.928 1.00 0.00 C ATOM 1198 C TYR A 76 -9.102 -28.193 -7.516 1.00 0.00 C ATOM 1199 O TYR A 76 -8.565 -28.810 -6.598 1.00 0.00 O ATOM 1200 CB TYR A 76 -9.408 -25.719 -7.335 1.00 0.00 C ATOM 1201 CG TYR A 76 -8.627 -24.542 -6.787 1.00 0.00 C ATOM 1202 CD1 TYR A 76 -9.264 -23.634 -5.930 1.00 0.00 C ATOM 1203 CD2 TYR A 76 -7.276 -24.355 -7.124 1.00 0.00 C ATOM 1204 CE1 TYR A 76 -8.547 -22.567 -5.369 1.00 0.00 C ATOM 1205 CE2 TYR A 76 -6.552 -23.300 -6.558 1.00 0.00 C ATOM 1206 CZ TYR A 76 -7.178 -22.407 -5.669 1.00 0.00 C ATOM 1207 OH TYR A 76 -6.464 -21.393 -5.105 1.00 0.00 O ATOM 0 H TYR A 76 -9.152 -26.074 -9.783 1.00 0.00 H new ATOM 0 HA TYR A 76 -7.535 -26.740 -7.541 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -10.090 -25.358 -8.105 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -10.021 -26.134 -6.535 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -10.312 -23.757 -5.700 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -6.796 -25.026 -7.821 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -9.042 -21.870 -4.709 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -5.508 -23.171 -6.804 1.00 0.00 H new ATOM 0 HH TYR A 76 -5.511 -21.521 -5.292 1.00 0.00 H new ATOM 1217 N LEU A 77 -10.163 -28.679 -8.165 1.00 0.00 N ATOM 1218 CA LEU A 77 -10.669 -29.980 -7.779 1.00 0.00 C ATOM 1219 C LEU A 77 -9.598 -31.018 -8.100 1.00 0.00 C ATOM 1220 O LEU A 77 -9.292 -31.856 -7.253 1.00 0.00 O ATOM 1221 CB LEU A 77 -12.006 -30.256 -8.474 1.00 0.00 C ATOM 1222 CG LEU A 77 -12.643 -31.614 -8.138 1.00 0.00 C ATOM 1223 CD1 LEU A 77 -12.021 -32.768 -8.926 1.00 0.00 C ATOM 1224 CD2 LEU A 77 -12.566 -31.938 -6.644 1.00 0.00 C ATOM 0 H LEU A 77 -10.662 -28.212 -8.922 1.00 0.00 H new ATOM 0 HA LEU A 77 -10.874 -30.023 -6.709 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -12.708 -29.466 -8.206 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -11.857 -30.198 -9.552 1.00 0.00 H new ATOM 0 HG LEU A 77 -13.689 -31.515 -8.429 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -12.509 -33.702 -8.649 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -12.153 -32.592 -9.994 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -10.957 -32.833 -8.698 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -13.029 -32.907 -6.457 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -11.522 -31.969 -6.332 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -13.092 -31.169 -6.077 1.00 0.00 H new ATOM 1236 N ASP A 78 -9.027 -30.971 -9.308 1.00 0.00 N ATOM 1237 CA ASP A 78 -8.022 -31.935 -9.743 1.00 0.00 C ATOM 1238 C ASP A 78 -6.805 -31.959 -8.825 1.00 0.00 C ATOM 1239 O ASP A 78 -6.319 -33.039 -8.492 1.00 0.00 O ATOM 1240 CB ASP A 78 -7.573 -31.611 -11.169 1.00 0.00 C ATOM 1241 CG ASP A 78 -8.565 -32.123 -12.211 1.00 0.00 C ATOM 1242 OD1 ASP A 78 -9.209 -33.157 -11.924 1.00 0.00 O ATOM 1243 OD2 ASP A 78 -8.660 -31.472 -13.275 1.00 0.00 O1- ATOM 0 H ASP A 78 -9.251 -30.263 -10.008 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.486 -32.921 -9.706 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.458 -30.532 -11.277 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.594 -32.055 -11.351 1.00 0.00 H new ATOM 1248 N GLU A 79 -6.303 -30.794 -8.414 1.00 0.00 N ATOM 1249 CA GLU A 79 -5.121 -30.748 -7.580 1.00 0.00 C ATOM 1250 C GLU A 79 -5.389 -31.409 -6.231 1.00 0.00 C ATOM 1251 O GLU A 79 -4.572 -32.193 -5.747 1.00 0.00 O ATOM 1252 CB GLU A 79 -4.707 -29.286 -7.424 1.00 0.00 C ATOM 1253 CG GLU A 79 -3.247 -29.171 -7.009 1.00 0.00 C ATOM 1254 CD GLU A 79 -2.978 -29.642 -5.583 1.00 0.00 C ATOM 1255 OE1 GLU A 79 -3.865 -29.446 -4.722 1.00 0.00 O ATOM 1256 OE2 GLU A 79 -1.877 -30.197 -5.369 1.00 0.00 O1- ATOM 0 H GLU A 79 -6.698 -29.883 -8.647 1.00 0.00 H new ATOM 0 HA GLU A 79 -4.306 -31.304 -8.043 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -4.863 -28.758 -8.365 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -5.339 -28.803 -6.679 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -2.635 -29.755 -7.697 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -2.931 -28.132 -7.105 1.00 0.00 H new ATOM 1263 N THR A 80 -6.536 -31.095 -5.620 1.00 0.00 N ATOM 1264 CA THR A 80 -6.857 -31.622 -4.305 1.00 0.00 C ATOM 1265 C THR A 80 -7.142 -33.119 -4.368 1.00 0.00 C ATOM 1266 O THR A 80 -6.755 -33.838 -3.447 1.00 0.00 O ATOM 1267 CB THR A 80 -8.052 -30.874 -3.719 1.00 0.00 C ATOM 1268 OG1 THR A 80 -9.182 -31.084 -4.533 1.00 0.00 O ATOM 1269 CG2 THR A 80 -7.774 -29.382 -3.569 1.00 0.00 C ATOM 0 H THR A 80 -7.248 -30.482 -6.018 1.00 0.00 H new ATOM 0 HA THR A 80 -5.994 -31.474 -3.656 1.00 0.00 H new ATOM 0 HB THR A 80 -8.240 -31.267 -2.720 1.00 0.00 H new ATOM 0 HG1 THR A 80 -8.893 -31.329 -5.437 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.651 -28.889 -3.149 1.00 0.00 H new ATOM 0 HG22 THR A 80 -6.922 -29.236 -2.905 1.00 0.00 H new ATOM 0 HG23 THR A 80 -7.550 -28.954 -4.546 1.00 0.00 H new ATOM 1277 N ARG A 81 -7.804 -33.607 -5.427 1.00 0.00 N ATOM 1278 CA ARG A 81 -8.057 -35.037 -5.542 1.00 0.00 C ATOM 1279 C ARG A 81 -6.801 -35.799 -5.957 1.00 0.00 C ATOM 1280 O ARG A 81 -6.756 -37.017 -5.803 1.00 0.00 O ATOM 1281 CB ARG A 81 -9.261 -35.332 -6.447 1.00 0.00 C ATOM 1282 CG ARG A 81 -9.095 -34.904 -7.905 1.00 0.00 C ATOM 1283 CD ARG A 81 -8.247 -35.846 -8.756 1.00 0.00 C ATOM 1284 NE ARG A 81 -8.261 -35.382 -10.145 1.00 0.00 N ATOM 1285 CZ ARG A 81 -7.480 -35.844 -11.123 1.00 0.00 C ATOM 1286 NH1 ARG A 81 -6.597 -36.819 -10.900 1.00 0.00 N1+ ATOM 1287 NH2 ARG A 81 -7.596 -35.313 -12.339 1.00 0.00 N ATOM 0 H ARG A 81 -8.164 -33.042 -6.196 1.00 0.00 H new ATOM 0 HA ARG A 81 -8.325 -35.404 -4.551 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -9.463 -36.403 -6.419 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -10.137 -34.831 -6.035 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -10.083 -34.817 -8.358 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -8.645 -33.911 -7.929 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -7.224 -35.875 -8.380 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -8.638 -36.862 -8.695 1.00 0.00 H new ATOM 0 HE ARG A 81 -8.923 -34.644 -10.385 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -6.510 -37.225 -9.968 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -6.009 -37.158 -11.661 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -8.272 -34.568 -12.508 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -7.009 -35.651 -13.101 1.00 0.00 H new ATOM 1301 N SER A 82 -5.786 -35.101 -6.477 1.00 0.00 N ATOM 1302 CA SER A 82 -4.542 -35.739 -6.884 1.00 0.00 C ATOM 1303 C SER A 82 -3.514 -35.778 -5.757 1.00 0.00 C ATOM 1304 O SER A 82 -2.779 -36.756 -5.641 1.00 0.00 O ATOM 1305 CB SER A 82 -3.939 -35.004 -8.080 1.00 0.00 C ATOM 1306 OG SER A 82 -4.868 -34.958 -9.139 1.00 0.00 O ATOM 0 H SER A 82 -5.808 -34.092 -6.624 1.00 0.00 H new ATOM 0 HA SER A 82 -4.788 -36.766 -7.154 1.00 0.00 H new ATOM 0 HB2 SER A 82 -3.656 -33.992 -7.790 1.00 0.00 H new ATOM 0 HB3 SER A 82 -3.029 -35.508 -8.406 1.00 0.00 H new ATOM 0 HG SER A 82 -5.624 -34.388 -8.887 1.00 0.00 H new ATOM 1420 N PRO A 91 -11.909 -22.777 4.905 1.00 0.00 N ATOM 1421 CA PRO A 91 -11.333 -22.213 3.696 1.00 0.00 C ATOM 1422 C PRO A 91 -9.905 -22.714 3.504 1.00 0.00 C ATOM 1423 O PRO A 91 -9.330 -23.336 4.394 1.00 0.00 O ATOM 1424 CB PRO A 91 -11.360 -20.700 3.907 1.00 0.00 C ATOM 1425 CG PRO A 91 -11.258 -20.553 5.424 1.00 0.00 C ATOM 1426 CD PRO A 91 -12.079 -21.744 5.912 1.00 0.00 C ATOM 0 HA PRO A 91 -11.886 -22.503 2.802 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -10.530 -20.208 3.399 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -12.278 -20.257 3.521 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -10.226 -20.599 5.770 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -11.668 -19.605 5.771 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -11.731 -22.086 6.887 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -13.129 -21.476 6.024 1.00 0.00 H new ATOM 1434 N GLY A 92 -9.331 -22.439 2.330 1.00 0.00 N ATOM 1435 CA GLY A 92 -7.953 -22.802 2.036 1.00 0.00 C ATOM 1436 C GLY A 92 -7.835 -24.121 1.283 1.00 0.00 C ATOM 1437 O GLY A 92 -6.754 -24.701 1.251 1.00 0.00 O ATOM 0 H GLY A 92 -9.809 -21.962 1.565 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -7.492 -22.010 1.446 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -7.394 -22.871 2.969 1.00 0.00 H new ATOM 1441 N THR A 93 -8.930 -24.596 0.681 1.00 0.00 N ATOM 1442 CA THR A 93 -8.948 -25.797 -0.143 1.00 0.00 C ATOM 1443 C THR A 93 -10.051 -25.676 -1.179 1.00 0.00 C ATOM 1444 O THR A 93 -10.887 -24.774 -1.110 1.00 0.00 O ATOM 1445 CB THR A 93 -9.214 -27.051 0.694 1.00 0.00 C ATOM 1446 OG1 THR A 93 -10.375 -26.873 1.475 1.00 0.00 O ATOM 1447 CG2 THR A 93 -8.023 -27.408 1.576 1.00 0.00 C ATOM 0 H THR A 93 -9.842 -24.145 0.757 1.00 0.00 H new ATOM 0 HA THR A 93 -7.971 -25.891 -0.616 1.00 0.00 H new ATOM 0 HB THR A 93 -9.369 -27.884 0.008 1.00 0.00 H new ATOM 0 HG1 THR A 93 -10.539 -27.680 2.006 1.00 0.00 H new ATOM 0 HG21 THR A 93 -8.253 -28.303 2.153 1.00 0.00 H new ATOM 0 HG22 THR A 93 -7.150 -27.594 0.951 1.00 0.00 H new ATOM 0 HG23 THR A 93 -7.813 -26.582 2.256 1.00 0.00 H new ATOM 1455 N CYS A 94 -10.056 -26.593 -2.151 1.00 0.00 N ATOM 1456 CA CYS A 94 -11.076 -26.597 -3.177 1.00 0.00 C ATOM 1457 C CYS A 94 -12.426 -26.942 -2.558 1.00 0.00 C ATOM 1458 O CYS A 94 -13.465 -26.702 -3.165 1.00 0.00 O ATOM 1459 CB CYS A 94 -10.705 -27.623 -4.248 1.00 0.00 C ATOM 1460 SG CYS A 94 -11.294 -29.259 -3.742 1.00 0.00 S ATOM 0 H CYS A 94 -9.363 -27.336 -2.240 1.00 0.00 H new ATOM 0 HA CYS A 94 -11.145 -25.610 -3.634 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -11.149 -27.344 -5.204 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -9.625 -27.641 -4.391 1.00 0.00 H new ATOM 0 HG CYS A 94 -10.582 -30.176 -4.326 1.00 0.00 H new ATOM 1466 N ALA A 95 -12.415 -27.506 -1.345 1.00 0.00 N ATOM 1467 CA ALA A 95 -13.639 -27.929 -0.695 1.00 0.00 C ATOM 1468 C ALA A 95 -14.534 -26.721 -0.441 1.00 0.00 C ATOM 1469 O ALA A 95 -15.675 -26.685 -0.895 1.00 0.00 O ATOM 1470 CB ALA A 95 -13.277 -28.629 0.611 1.00 0.00 C ATOM 0 H ALA A 95 -11.568 -27.676 -0.802 1.00 0.00 H new ATOM 0 HA ALA A 95 -14.188 -28.623 -1.332 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -14.188 -28.954 1.114 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -12.651 -29.495 0.398 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -12.734 -27.938 1.256 1.00 0.00 H new ATOM 1476 N HIS A 96 -14.011 -25.732 0.286 1.00 0.00 N ATOM 1477 CA HIS A 96 -14.756 -24.523 0.583 1.00 0.00 C ATOM 1478 C HIS A 96 -14.879 -23.660 -0.667 1.00 0.00 C ATOM 1479 O HIS A 96 -15.873 -22.951 -0.824 1.00 0.00 O ATOM 1480 CB HIS A 96 -14.016 -23.764 1.679 1.00 0.00 C ATOM 1481 CG HIS A 96 -14.724 -22.506 2.102 1.00 0.00 C ATOM 1482 ND1 HIS A 96 -15.756 -22.442 3.037 1.00 0.00 N ATOM 1483 CD2 HIS A 96 -14.459 -21.253 1.629 1.00 0.00 C ATOM 1484 CE1 HIS A 96 -16.089 -21.142 3.105 1.00 0.00 C ATOM 1485 NE2 HIS A 96 -15.331 -20.408 2.272 1.00 0.00 N ATOM 0 H HIS A 96 -13.070 -25.752 0.678 1.00 0.00 H new ATOM 0 HA HIS A 96 -15.762 -24.776 0.918 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -13.894 -24.414 2.545 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -13.016 -23.511 1.327 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -13.714 -20.981 0.896 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -16.862 -20.741 3.743 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -15.393 -19.398 2.140 1.00 0.00 H new ATOM 1493 N ALA A 97 -13.877 -23.720 -1.545 1.00 0.00 N ATOM 1494 CA ALA A 97 -13.860 -22.920 -2.755 1.00 0.00 C ATOM 1495 C ALA A 97 -14.983 -23.324 -3.710 1.00 0.00 C ATOM 1496 O ALA A 97 -15.793 -22.479 -4.087 1.00 0.00 O ATOM 1497 CB ALA A 97 -12.496 -23.075 -3.428 1.00 0.00 C ATOM 0 H ALA A 97 -13.062 -24.323 -1.432 1.00 0.00 H new ATOM 0 HA ALA A 97 -14.026 -21.875 -2.492 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -12.470 -22.478 -4.340 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -11.714 -22.734 -2.749 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -12.330 -24.123 -3.676 1.00 0.00 H new ATOM 1503 N ILE A 98 -15.040 -24.604 -4.104 1.00 0.00 N ATOM 1504 CA ILE A 98 -16.076 -25.048 -5.029 1.00 0.00 C ATOM 1505 C ILE A 98 -17.448 -24.986 -4.363 1.00 0.00 C ATOM 1506 O ILE A 98 -18.438 -24.689 -5.029 1.00 0.00 O ATOM 1507 CB ILE A 98 -15.757 -26.456 -5.560 1.00 0.00 C ATOM 1508 CG1 ILE A 98 -14.686 -26.424 -6.664 1.00 0.00 C ATOM 1509 CG2 ILE A 98 -17.006 -27.088 -6.175 1.00 0.00 C ATOM 1510 CD1 ILE A 98 -13.267 -26.415 -6.111 1.00 0.00 C ATOM 0 H ILE A 98 -14.393 -25.332 -3.801 1.00 0.00 H new ATOM 0 HA ILE A 98 -16.098 -24.375 -5.886 1.00 0.00 H new ATOM 0 HB ILE A 98 -15.396 -27.031 -4.708 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -14.813 -27.291 -7.312 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -14.835 -25.539 -7.283 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -16.765 -28.084 -6.546 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -17.787 -27.162 -5.418 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -17.359 -26.469 -7.000 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -12.555 -26.392 -6.936 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -13.126 -25.534 -5.486 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -13.103 -27.313 -5.515 1.00 0.00 H new ATOM 1522 N ASN A 99 -17.528 -25.259 -3.060 1.00 0.00 N ATOM 1523 CA ASN A 99 -18.798 -25.209 -2.362 1.00 0.00 C ATOM 1524 C ASN A 99 -19.344 -23.784 -2.294 1.00 0.00 C ATOM 1525 O ASN A 99 -20.528 -23.580 -2.546 1.00 0.00 O ATOM 1526 CB ASN A 99 -18.606 -25.752 -0.952 1.00 0.00 C ATOM 1527 CG ASN A 99 -18.548 -27.276 -0.917 1.00 0.00 C ATOM 1528 OD1 ASN A 99 -18.708 -27.945 -1.936 1.00 0.00 O ATOM 1529 ND2 ASN A 99 -18.314 -27.835 0.269 1.00 0.00 N ATOM 0 H ASN A 99 -16.731 -25.514 -2.477 1.00 0.00 H new ATOM 0 HA ASN A 99 -19.519 -25.816 -2.909 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -17.685 -25.347 -0.532 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -19.424 -25.408 -0.319 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -18.263 -28.850 0.353 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -18.186 -27.248 1.093 1.00 0.00 H new ATOM 1536 N THR A 100 -18.498 -22.803 -1.959 1.00 0.00 N ATOM 1537 CA THR A 100 -18.951 -21.424 -1.813 1.00 0.00 C ATOM 1538 C THR A 100 -19.335 -20.843 -3.169 1.00 0.00 C ATOM 1539 O THR A 100 -20.202 -19.975 -3.254 1.00 0.00 O ATOM 1540 CB THR A 100 -17.835 -20.593 -1.173 1.00 0.00 C ATOM 1541 OG1 THR A 100 -17.530 -21.104 0.104 1.00 0.00 O ATOM 1542 CG2 THR A 100 -18.247 -19.130 -1.021 1.00 0.00 C ATOM 0 H THR A 100 -17.502 -22.942 -1.786 1.00 0.00 H new ATOM 0 HA THR A 100 -19.833 -21.400 -1.173 1.00 0.00 H new ATOM 0 HB THR A 100 -16.965 -20.651 -1.827 1.00 0.00 H new ATOM 0 HG1 THR A 100 -16.814 -21.769 0.028 1.00 0.00 H new ATOM 0 HG21 THR A 100 -17.432 -18.568 -0.564 1.00 0.00 H new ATOM 0 HG22 THR A 100 -18.471 -18.711 -2.002 1.00 0.00 H new ATOM 0 HG23 THR A 100 -19.132 -19.065 -0.389 1.00 0.00 H new ATOM 1550 N LEU A 101 -18.690 -21.320 -4.234 1.00 0.00 N ATOM 1551 CA LEU A 101 -18.960 -20.866 -5.581 1.00 0.00 C ATOM 1552 C LEU A 101 -20.287 -21.434 -6.079 1.00 0.00 C ATOM 1553 O LEU A 101 -20.997 -20.773 -6.833 1.00 0.00 O ATOM 1554 CB LEU A 101 -17.795 -21.324 -6.457 1.00 0.00 C ATOM 1555 CG LEU A 101 -17.981 -20.995 -7.941 1.00 0.00 C ATOM 1556 CD1 LEU A 101 -18.104 -19.490 -8.177 1.00 0.00 C ATOM 1557 CD2 LEU A 101 -16.781 -21.519 -8.724 1.00 0.00 C ATOM 0 H LEU A 101 -17.964 -22.035 -4.177 1.00 0.00 H new ATOM 0 HA LEU A 101 -19.048 -19.780 -5.616 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -16.877 -20.856 -6.101 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -17.668 -22.401 -6.345 1.00 0.00 H new ATOM 0 HG LEU A 101 -18.903 -21.470 -8.277 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -18.235 -19.298 -9.242 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -18.965 -19.105 -7.631 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -17.200 -18.992 -7.827 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -16.908 -21.288 -9.782 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -15.871 -21.045 -8.355 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -16.706 -22.599 -8.595 1.00 0.00 H new ATOM 1569 N GLY A 102 -20.626 -22.659 -5.663 1.00 0.00 N ATOM 1570 CA GLY A 102 -21.834 -23.324 -6.117 1.00 0.00 C ATOM 1571 C GLY A 102 -23.107 -22.650 -5.612 1.00 0.00 C ATOM 1572 O GLY A 102 -24.181 -22.892 -6.159 1.00 0.00 O ATOM 0 H GLY A 102 -20.070 -23.207 -5.007 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -21.846 -23.342 -7.207 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -21.820 -24.361 -5.782 1.00 0.00 H new ATOM 1576 N GLU A 103 -23.004 -21.808 -4.577 1.00 0.00 N ATOM 1577 CA GLU A 103 -24.168 -21.126 -4.026 1.00 0.00 C ATOM 1578 C GLU A 103 -24.558 -19.922 -4.875 1.00 0.00 C ATOM 1579 O GLU A 103 -25.718 -19.515 -4.881 1.00 0.00 O ATOM 1580 CB GLU A 103 -23.854 -20.651 -2.606 1.00 0.00 C ATOM 1581 CG GLU A 103 -23.261 -21.793 -1.782 1.00 0.00 C ATOM 1582 CD GLU A 103 -23.423 -21.564 -0.282 1.00 0.00 C ATOM 1583 OE1 GLU A 103 -23.482 -20.379 0.116 1.00 0.00 O ATOM 1584 OE2 GLU A 103 -23.483 -22.581 0.443 1.00 0.00 O1- ATOM 0 H GLU A 103 -22.125 -21.587 -4.109 1.00 0.00 H new ATOM 0 HA GLU A 103 -25.000 -21.830 -4.018 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -23.153 -19.817 -2.641 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -24.763 -20.284 -2.129 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -23.745 -22.729 -2.060 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -22.203 -21.899 -2.020 1.00 0.00 H new ATOM 1591 N VAL A 104 -23.580 -19.358 -5.589 1.00 0.00 N ATOM 1592 CA VAL A 104 -23.802 -18.133 -6.350 1.00 0.00 C ATOM 1593 C VAL A 104 -23.623 -18.326 -7.851 1.00 0.00 C ATOM 1594 O VAL A 104 -23.906 -17.401 -8.611 1.00 0.00 O ATOM 1595 CB VAL A 104 -22.884 -17.021 -5.834 1.00 0.00 C ATOM 1596 CG1 VAL A 104 -23.123 -16.768 -4.347 1.00 0.00 C ATOM 1597 CG2 VAL A 104 -21.410 -17.361 -6.063 1.00 0.00 C ATOM 0 H VAL A 104 -22.633 -19.730 -5.654 1.00 0.00 H new ATOM 0 HA VAL A 104 -24.842 -17.846 -6.199 1.00 0.00 H new ATOM 0 HB VAL A 104 -23.123 -16.118 -6.396 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -22.460 -15.974 -4.002 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -24.159 -16.469 -4.191 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -22.920 -17.680 -3.786 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -20.787 -16.551 -5.685 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -21.164 -18.284 -5.538 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -21.228 -17.491 -7.130 1.00 0.00 H new ATOM 1607 N ILE A 105 -23.166 -19.497 -8.303 1.00 0.00 N ATOM 1608 CA ILE A 105 -22.965 -19.748 -9.721 1.00 0.00 C ATOM 1609 C ILE A 105 -24.268 -19.606 -10.509 1.00 0.00 C ATOM 1610 O ILE A 105 -24.233 -19.362 -11.714 1.00 0.00 O ATOM 1611 CB ILE A 105 -22.366 -21.149 -9.858 1.00 0.00 C ATOM 1612 CG1 ILE A 105 -21.781 -21.348 -11.257 1.00 0.00 C ATOM 1613 CG2 ILE A 105 -23.415 -22.220 -9.546 1.00 0.00 C ATOM 1614 CD1 ILE A 105 -20.907 -22.596 -11.233 1.00 0.00 C ATOM 0 H ILE A 105 -22.929 -20.285 -7.700 1.00 0.00 H new ATOM 0 HA ILE A 105 -22.284 -19.008 -10.142 1.00 0.00 H new ATOM 0 HB ILE A 105 -21.557 -21.249 -9.134 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -22.579 -21.457 -11.991 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -21.194 -20.478 -11.551 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -22.968 -23.209 -9.650 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -23.775 -22.090 -8.526 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -24.250 -22.125 -10.241 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -20.478 -22.759 -12.222 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -20.105 -22.465 -10.507 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -21.512 -23.459 -10.954 1.00 0.00 H new ATOM 1626 N GLN A 106 -25.417 -19.756 -9.843 1.00 0.00 N ATOM 1627 CA GLN A 106 -26.715 -19.560 -10.459 1.00 0.00 C ATOM 1628 C GLN A 106 -26.854 -18.118 -10.950 1.00 0.00 C ATOM 1629 O GLN A 106 -27.481 -17.884 -11.981 1.00 0.00 O ATOM 1630 CB GLN A 106 -27.809 -19.904 -9.439 1.00 0.00 C ATOM 1631 CG GLN A 106 -27.655 -19.127 -8.127 1.00 0.00 C ATOM 1632 CD GLN A 106 -28.721 -19.519 -7.112 1.00 0.00 C ATOM 1633 OE1 GLN A 106 -29.863 -19.786 -7.474 1.00 0.00 O ATOM 1634 NE2 GLN A 106 -28.356 -19.558 -5.829 1.00 0.00 N ATOM 0 H GLN A 106 -25.464 -20.018 -8.858 1.00 0.00 H new ATOM 0 HA GLN A 106 -26.818 -20.216 -11.323 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -28.786 -19.689 -9.872 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -27.782 -20.973 -9.229 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -26.667 -19.314 -7.707 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -27.719 -18.058 -8.328 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -27.398 -19.330 -5.564 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -29.035 -19.816 -5.113 1.00 0.00 H new ATOM 1643 N GLU A 107 -26.276 -17.154 -10.223 1.00 0.00 N ATOM 1644 CA GLU A 107 -26.353 -15.752 -10.602 1.00 0.00 C ATOM 1645 C GLU A 107 -25.477 -15.508 -11.822 1.00 0.00 C ATOM 1646 O GLU A 107 -25.855 -14.777 -12.734 1.00 0.00 O ATOM 1647 CB GLU A 107 -25.827 -14.865 -9.465 1.00 0.00 C ATOM 1648 CG GLU A 107 -26.497 -15.135 -8.116 1.00 0.00 C ATOM 1649 CD GLU A 107 -25.814 -14.336 -7.003 1.00 0.00 C ATOM 1650 OE1 GLU A 107 -25.884 -14.803 -5.842 1.00 0.00 O ATOM 1651 OE2 GLU A 107 -25.232 -13.273 -7.316 1.00 0.00 O1- ATOM 0 H GLU A 107 -25.750 -17.328 -9.367 1.00 0.00 H new ATOM 0 HA GLU A 107 -27.394 -15.510 -10.816 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -24.752 -15.017 -9.364 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -25.977 -13.819 -9.733 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -27.552 -14.867 -8.168 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -26.450 -16.200 -7.888 1.00 0.00 H new ATOM 1658 N LEU A 108 -24.296 -16.131 -11.826 1.00 0.00 N ATOM 1659 CA LEU A 108 -23.294 -15.889 -12.844 1.00 0.00 C ATOM 1660 C LEU A 108 -23.704 -16.523 -14.163 1.00 0.00 C ATOM 1661 O LEU A 108 -23.518 -15.919 -15.218 1.00 0.00 O ATOM 1662 CB LEU A 108 -21.957 -16.463 -12.376 1.00 0.00 C ATOM 1663 CG LEU A 108 -21.632 -16.049 -10.938 1.00 0.00 C ATOM 1664 CD1 LEU A 108 -20.224 -16.528 -10.603 1.00 0.00 C ATOM 1665 CD2 LEU A 108 -21.711 -14.536 -10.726 1.00 0.00 C ATOM 0 H LEU A 108 -24.017 -16.814 -11.122 1.00 0.00 H new ATOM 0 HA LEU A 108 -23.197 -14.815 -13.002 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -21.985 -17.551 -12.444 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -21.163 -16.123 -13.040 1.00 0.00 H new ATOM 0 HG LEU A 108 -22.375 -16.505 -10.284 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -19.976 -16.241 -9.581 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -20.177 -17.613 -10.697 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -19.512 -16.073 -11.291 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -21.471 -14.301 -9.689 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -20.999 -14.039 -11.385 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -22.719 -14.189 -10.953 1.00 0.00 H new ATOM 1677 N LEU A 109 -24.260 -17.736 -14.105 1.00 0.00 N ATOM 1678 CA LEU A 109 -24.716 -18.417 -15.299 1.00 0.00 C ATOM 1679 C LEU A 109 -25.929 -17.690 -15.872 1.00 0.00 C ATOM 1680 O LEU A 109 -25.850 -17.181 -16.986 1.00 0.00 O ATOM 1681 CB LEU A 109 -25.027 -19.879 -14.968 1.00 0.00 C ATOM 1682 CG LEU A 109 -23.762 -20.695 -14.676 1.00 0.00 C ATOM 1683 CD1 LEU A 109 -24.172 -22.059 -14.131 1.00 0.00 C ATOM 1684 CD2 LEU A 109 -22.937 -20.891 -15.947 1.00 0.00 C ATOM 0 H LEU A 109 -24.401 -18.258 -13.240 1.00 0.00 H new ATOM 0 HA LEU A 109 -23.935 -18.408 -16.059 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -25.690 -19.920 -14.104 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -25.563 -20.331 -15.802 1.00 0.00 H new ATOM 0 HG LEU A 109 -23.155 -20.157 -13.947 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -23.280 -22.649 -13.919 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -24.746 -21.927 -13.214 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -24.783 -22.577 -14.870 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -22.045 -21.472 -15.715 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -23.533 -21.421 -16.690 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -22.644 -19.919 -16.344 1.00 0.00 H new ATOM 1696 N SER A 110 -27.038 -17.636 -15.125 1.00 0.00 N ATOM 1697 CA SER A 110 -28.274 -17.017 -15.595 1.00 0.00 C ATOM 1698 C SER A 110 -28.022 -15.667 -16.247 1.00 0.00 C ATOM 1699 O SER A 110 -28.521 -15.402 -17.340 1.00 0.00 O ATOM 1700 CB SER A 110 -29.228 -16.790 -14.416 1.00 0.00 C ATOM 1701 OG SER A 110 -28.578 -16.116 -13.365 1.00 0.00 O ATOM 0 H SER A 110 -27.100 -18.020 -14.182 1.00 0.00 H new ATOM 0 HA SER A 110 -28.707 -17.696 -16.329 1.00 0.00 H new ATOM 0 HB2 SER A 110 -30.090 -16.210 -14.747 1.00 0.00 H new ATOM 0 HB3 SER A 110 -29.606 -17.748 -14.060 1.00 0.00 H new ATOM 0 HG SER A 110 -28.522 -16.705 -12.584 1.00 0.00 H new ATOM 1707 N ASP A 111 -27.250 -14.813 -15.582 1.00 0.00 N ATOM 1708 CA ASP A 111 -27.007 -13.470 -16.064 1.00 0.00 C ATOM 1709 C ASP A 111 -26.118 -13.487 -17.300 1.00 0.00 C ATOM 1710 O ASP A 111 -26.303 -12.674 -18.205 1.00 0.00 O ATOM 1711 CB ASP A 111 -26.347 -12.700 -14.930 1.00 0.00 C ATOM 1712 CG ASP A 111 -26.283 -11.201 -15.199 1.00 0.00 C ATOM 1713 OD1 ASP A 111 -25.363 -10.565 -14.638 1.00 0.00 O ATOM 1714 OD2 ASP A 111 -27.145 -10.708 -15.960 1.00 0.00 O1- ATOM 0 H ASP A 111 -26.782 -15.035 -14.703 1.00 0.00 H new ATOM 0 HA ASP A 111 -27.942 -12.994 -16.357 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -26.899 -12.876 -14.007 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -25.338 -13.081 -14.776 1.00 0.00 H new ATOM 1719 N ALA A 112 -25.151 -14.408 -17.351 1.00 0.00 N ATOM 1720 CA ALA A 112 -24.242 -14.470 -18.477 1.00 0.00 C ATOM 1721 C ALA A 112 -24.949 -15.023 -19.713 1.00 0.00 C ATOM 1722 O ALA A 112 -24.609 -14.643 -20.833 1.00 0.00 O ATOM 1723 CB ALA A 112 -23.027 -15.325 -18.118 1.00 0.00 C ATOM 0 H ALA A 112 -24.986 -15.110 -16.629 1.00 0.00 H new ATOM 0 HA ALA A 112 -23.903 -13.461 -18.710 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -22.348 -15.367 -18.969 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -22.512 -14.885 -17.264 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -23.354 -16.333 -17.864 1.00 0.00 H new ATOM 1729 N ILE A 113 -25.929 -15.916 -19.529 1.00 0.00 N ATOM 1730 CA ILE A 113 -26.705 -16.431 -20.650 1.00 0.00 C ATOM 1731 C ILE A 113 -27.565 -15.306 -21.213 1.00 0.00 C ATOM 1732 O ILE A 113 -27.710 -15.161 -22.424 1.00 0.00 O ATOM 1733 CB ILE A 113 -27.645 -17.562 -20.199 1.00 0.00 C ATOM 1734 CG1 ILE A 113 -26.953 -18.765 -19.552 1.00 0.00 C ATOM 1735 CG2 ILE A 113 -28.449 -18.034 -21.413 1.00 0.00 C ATOM 1736 CD1 ILE A 113 -26.013 -19.526 -20.477 1.00 0.00 C ATOM 0 H ILE A 113 -26.198 -16.291 -18.619 1.00 0.00 H new ATOM 0 HA ILE A 113 -26.011 -16.815 -21.398 1.00 0.00 H new ATOM 0 HB ILE A 113 -28.278 -17.140 -19.418 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -26.389 -18.421 -18.685 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -27.715 -19.452 -19.184 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -29.122 -18.837 -21.114 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -29.030 -17.202 -21.810 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -27.767 -18.400 -22.181 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -25.567 -20.361 -19.936 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -26.572 -19.905 -21.332 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -25.226 -18.858 -20.826 1.00 0.00 H new ATOM 1748 N ALA A 114 -28.136 -14.507 -20.310 1.00 0.00 N ATOM 1749 CA ALA A 114 -29.027 -13.418 -20.661 1.00 0.00 C ATOM 1750 C ALA A 114 -28.274 -12.242 -21.281 1.00 0.00 C ATOM 1751 O ALA A 114 -28.780 -11.616 -22.209 1.00 0.00 O ATOM 1752 CB ALA A 114 -29.742 -12.960 -19.390 1.00 0.00 C ATOM 0 H ALA A 114 -27.986 -14.605 -19.306 1.00 0.00 H new ATOM 0 HA ALA A 114 -29.740 -13.773 -21.405 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -30.419 -12.140 -19.629 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -30.311 -13.791 -18.973 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -29.006 -12.622 -18.660 1.00 0.00 H new ATOM 1758 N LYS A 115 -27.073 -11.931 -20.780 1.00 0.00 N ATOM 1759 CA LYS A 115 -26.340 -10.763 -21.239 1.00 0.00 C ATOM 1760 C LYS A 115 -25.409 -11.042 -22.414 1.00 0.00 C ATOM 1761 O LYS A 115 -25.228 -10.165 -23.254 1.00 0.00 O ATOM 1762 CB LYS A 115 -25.508 -10.201 -20.082 1.00 0.00 C ATOM 1763 CG LYS A 115 -25.489 -8.671 -20.105 1.00 0.00 C ATOM 1764 CD LYS A 115 -26.832 -8.032 -19.709 1.00 0.00 C ATOM 1765 CE LYS A 115 -27.250 -8.402 -18.284 1.00 0.00 C ATOM 1766 NZ LYS A 115 -27.942 -9.704 -18.223 1.00 0.00 N1+ ATOM 0 H LYS A 115 -26.596 -12.474 -20.060 1.00 0.00 H new ATOM 0 HA LYS A 115 -27.088 -10.049 -21.585 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -25.918 -10.548 -19.134 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -24.488 -10.581 -20.146 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -24.713 -8.315 -19.427 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -25.217 -8.334 -21.105 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -26.756 -6.948 -19.794 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -27.605 -8.353 -20.407 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -26.367 -8.432 -17.645 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -27.905 -7.626 -17.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -28.900 -9.570 -17.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -28.004 -10.109 -19.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -27.410 -10.351 -17.606 1.00 0.00 H new ATOM 1780 N SER A 116 -24.816 -12.240 -22.484 1.00 0.00 N ATOM 1781 CA SER A 116 -23.726 -12.467 -23.426 1.00 0.00 C ATOM 1782 C SER A 116 -24.197 -12.948 -24.795 1.00 0.00 C ATOM 1783 O SER A 116 -25.310 -13.448 -24.942 1.00 0.00 O ATOM 1784 CB SER A 116 -22.673 -13.370 -22.778 1.00 0.00 C ATOM 1785 OG SER A 116 -21.407 -13.048 -23.305 1.00 0.00 O ATOM 0 H SER A 116 -25.068 -13.046 -21.912 1.00 0.00 H new ATOM 0 HA SER A 116 -23.255 -11.509 -23.646 1.00 0.00 H new ATOM 0 HB2 SER A 116 -22.676 -13.236 -21.696 1.00 0.00 H new ATOM 0 HB3 SER A 116 -22.906 -14.417 -22.970 1.00 0.00 H new ATOM 0 HG SER A 116 -20.895 -12.542 -22.640 1.00 0.00 H new ATOM 1791 N ASN A 117 -23.331 -12.789 -25.803 1.00 0.00 N ATOM 1792 CA ASN A 117 -23.645 -13.068 -27.198 1.00 0.00 C ATOM 1793 C ASN A 117 -23.669 -14.568 -27.487 1.00 0.00 C ATOM 1794 O ASN A 117 -23.260 -15.369 -26.654 1.00 0.00 O ATOM 1795 CB ASN A 117 -22.614 -12.348 -28.071 1.00 0.00 C ATOM 1796 CG ASN A 117 -22.871 -12.561 -29.555 1.00 0.00 C ATOM 1797 OD1 ASN A 117 -23.924 -12.199 -30.071 1.00 0.00 O ATOM 1798 ND2 ASN A 117 -21.903 -13.155 -30.246 1.00 0.00 N ATOM 0 H ASN A 117 -22.377 -12.457 -25.663 1.00 0.00 H new ATOM 0 HA ASN A 117 -24.646 -12.701 -27.425 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -22.634 -11.281 -27.850 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -21.615 -12.706 -27.822 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -22.020 -13.326 -31.245 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -21.043 -13.440 -29.777 1.00 0.00 H new ATOM 1805 N GLN A 118 -24.152 -14.947 -28.676 1.00 0.00 N ATOM 1806 CA GLN A 118 -24.375 -16.338 -29.062 1.00 0.00 C ATOM 1807 C GLN A 118 -23.132 -17.206 -28.902 1.00 0.00 C ATOM 1808 O GLN A 118 -23.240 -18.368 -28.515 1.00 0.00 O ATOM 1809 CB GLN A 118 -24.838 -16.396 -30.519 1.00 0.00 C ATOM 1810 CG GLN A 118 -25.930 -15.365 -30.810 1.00 0.00 C ATOM 1811 CD GLN A 118 -27.075 -15.457 -29.810 1.00 0.00 C ATOM 1812 OE1 GLN A 118 -27.267 -14.557 -28.997 1.00 0.00 O ATOM 1813 NE2 GLN A 118 -27.844 -16.543 -29.863 1.00 0.00 N ATOM 0 H GLN A 118 -24.402 -14.281 -29.407 1.00 0.00 H new ATOM 0 HA GLN A 118 -25.139 -16.734 -28.393 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -23.988 -16.220 -31.178 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -25.213 -17.395 -30.742 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -25.501 -14.363 -30.781 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -26.315 -15.518 -31.818 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -27.653 -17.270 -30.553 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -28.624 -16.648 -29.214 1.00 0.00 H new ATOM 1822 N ASP A 119 -21.951 -16.656 -29.196 1.00 0.00 N ATOM 1823 CA ASP A 119 -20.714 -17.406 -29.060 1.00 0.00 C ATOM 1824 C ASP A 119 -20.428 -17.647 -27.582 1.00 0.00 C ATOM 1825 O ASP A 119 -20.040 -18.746 -27.192 1.00 0.00 O ATOM 1826 CB ASP A 119 -19.542 -16.667 -29.721 1.00 0.00 C ATOM 1827 CG ASP A 119 -19.409 -15.187 -29.349 1.00 0.00 C ATOM 1828 OD1 ASP A 119 -20.319 -14.650 -28.685 1.00 0.00 O ATOM 1829 OD2 ASP A 119 -18.374 -14.608 -29.744 1.00 0.00 O1- ATOM 0 H ASP A 119 -21.832 -15.699 -29.528 1.00 0.00 H new ATOM 0 HA ASP A 119 -20.828 -18.364 -29.568 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -18.616 -17.176 -29.455 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -19.649 -16.745 -30.803 1.00 0.00 H new ATOM 1834 N HIS A 120 -20.620 -16.617 -26.759 1.00 0.00 N ATOM 1835 CA HIS A 120 -20.429 -16.717 -25.325 1.00 0.00 C ATOM 1836 C HIS A 120 -21.507 -17.597 -24.690 1.00 0.00 C ATOM 1837 O HIS A 120 -21.210 -18.325 -23.745 1.00 0.00 O ATOM 1838 CB HIS A 120 -20.441 -15.318 -24.724 1.00 0.00 C ATOM 1839 CG HIS A 120 -19.346 -14.428 -25.255 1.00 0.00 C ATOM 1840 ND1 HIS A 120 -17.981 -14.734 -25.253 1.00 0.00 N ATOM 1841 CD2 HIS A 120 -19.525 -13.192 -25.808 1.00 0.00 C ATOM 1842 CE1 HIS A 120 -17.376 -13.668 -25.803 1.00 0.00 C ATOM 1843 NE2 HIS A 120 -18.276 -12.728 -26.141 1.00 0.00 N ATOM 0 H HIS A 120 -20.912 -15.692 -27.074 1.00 0.00 H new ATOM 0 HA HIS A 120 -19.467 -17.187 -25.121 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -21.406 -14.853 -24.925 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -20.343 -15.395 -23.641 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -20.465 -12.680 -25.955 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -16.310 -13.578 -25.953 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -18.067 -11.827 -26.570 1.00 0.00 H new ATOM 1851 N LYS A 121 -22.748 -17.545 -25.188 1.00 0.00 N ATOM 1852 CA LYS A 121 -23.814 -18.412 -24.697 1.00 0.00 C ATOM 1853 C LYS A 121 -23.390 -19.866 -24.883 1.00 0.00 C ATOM 1854 O LYS A 121 -23.625 -20.699 -24.007 1.00 0.00 O ATOM 1855 CB LYS A 121 -25.116 -18.146 -25.468 1.00 0.00 C ATOM 1856 CG LYS A 121 -25.761 -16.808 -25.093 1.00 0.00 C ATOM 1857 CD LYS A 121 -26.953 -16.543 -26.013 1.00 0.00 C ATOM 1858 CE LYS A 121 -27.710 -15.285 -25.587 1.00 0.00 C ATOM 1859 NZ LYS A 121 -28.635 -14.835 -26.644 1.00 0.00 N1+ ATOM 0 H LYS A 121 -23.034 -16.909 -25.932 1.00 0.00 H new ATOM 0 HA LYS A 121 -23.991 -18.208 -23.641 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -24.909 -18.158 -26.538 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -25.822 -18.953 -25.271 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -26.087 -16.828 -24.053 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -25.032 -16.003 -25.183 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -26.605 -16.431 -27.040 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -27.627 -17.400 -25.996 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -28.268 -15.486 -24.673 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -27.000 -14.490 -25.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -28.915 -13.850 -26.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -28.163 -14.897 -27.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -29.481 -15.440 -26.646 1.00 0.00 H new ATOM 1873 N GLU A 122 -22.766 -20.172 -26.024 1.00 0.00 N ATOM 1874 CA GLU A 122 -22.309 -21.517 -26.322 1.00 0.00 C ATOM 1875 C GLU A 122 -21.068 -21.866 -25.502 1.00 0.00 C ATOM 1876 O GLU A 122 -20.902 -23.014 -25.093 1.00 0.00 O ATOM 1877 CB GLU A 122 -22.035 -21.633 -27.825 1.00 0.00 C ATOM 1878 CG GLU A 122 -21.465 -23.007 -28.180 1.00 0.00 C ATOM 1879 CD GLU A 122 -22.369 -24.154 -27.724 1.00 0.00 C ATOM 1880 OE1 GLU A 122 -23.595 -23.921 -27.629 1.00 0.00 O ATOM 1881 OE2 GLU A 122 -21.818 -25.248 -27.476 1.00 0.00 O1- ATOM 0 H GLU A 122 -22.568 -19.493 -26.759 1.00 0.00 H new ATOM 0 HA GLU A 122 -23.085 -22.231 -26.048 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -22.958 -21.465 -28.379 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -21.334 -20.856 -28.130 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -21.321 -23.069 -29.259 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -20.483 -23.119 -27.721 1.00 0.00 H new ATOM 1888 N LYS A 123 -20.191 -20.887 -25.253 1.00 0.00 N ATOM 1889 CA LYS A 123 -19.010 -21.116 -24.438 1.00 0.00 C ATOM 1890 C LYS A 123 -19.432 -21.471 -23.017 1.00 0.00 C ATOM 1891 O LYS A 123 -18.801 -22.317 -22.387 1.00 0.00 O ATOM 1892 CB LYS A 123 -18.128 -19.871 -24.474 1.00 0.00 C ATOM 1893 CG LYS A 123 -17.361 -19.846 -25.796 1.00 0.00 C ATOM 1894 CD LYS A 123 -16.599 -18.532 -25.955 1.00 0.00 C ATOM 1895 CE LYS A 123 -15.657 -18.669 -27.145 1.00 0.00 C ATOM 1896 NZ LYS A 123 -14.765 -17.501 -27.262 1.00 0.00 N1+ ATOM 0 H LYS A 123 -20.283 -19.935 -25.606 1.00 0.00 H new ATOM 0 HA LYS A 123 -18.432 -21.952 -24.831 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -18.739 -18.973 -24.375 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -17.433 -19.877 -23.635 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -16.664 -20.683 -25.833 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -18.055 -19.972 -26.627 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -17.293 -17.707 -26.113 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -16.037 -18.307 -25.049 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -15.061 -19.575 -27.036 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -16.238 -18.778 -28.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -14.136 -17.625 -28.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -15.335 -16.640 -27.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -14.194 -17.413 -26.398 1.00 0.00 H new ATOM 1910 N ILE A 124 -20.491 -20.838 -22.504 1.00 0.00 N ATOM 1911 CA ILE A 124 -21.030 -21.197 -21.198 1.00 0.00 C ATOM 1912 C ILE A 124 -21.612 -22.611 -21.242 1.00 0.00 C ATOM 1913 O ILE A 124 -21.464 -23.372 -20.290 1.00 0.00 O ATOM 1914 CB ILE A 124 -22.124 -20.203 -20.800 1.00 0.00 C ATOM 1915 CG1 ILE A 124 -21.536 -18.797 -20.678 1.00 0.00 C ATOM 1916 CG2 ILE A 124 -22.766 -20.614 -19.473 1.00 0.00 C ATOM 1917 CD1 ILE A 124 -22.618 -17.725 -20.800 1.00 0.00 C ATOM 0 H ILE A 124 -20.986 -20.080 -22.973 1.00 0.00 H new ATOM 0 HA ILE A 124 -20.227 -21.165 -20.462 1.00 0.00 H new ATOM 0 HB ILE A 124 -22.891 -20.205 -21.575 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -21.029 -18.696 -19.719 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -20.785 -18.647 -21.453 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -23.541 -19.896 -19.206 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -23.209 -21.605 -19.574 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -22.006 -20.634 -18.692 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -22.164 -16.738 -20.709 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -23.108 -17.811 -21.770 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -23.355 -17.860 -20.008 1.00 0.00 H new ATOM 1929 N ARG A 125 -22.275 -22.971 -22.349 1.00 0.00 N ATOM 1930 CA ARG A 125 -22.923 -24.274 -22.485 1.00 0.00 C ATOM 1931 C ARG A 125 -21.899 -25.405 -22.511 1.00 0.00 C ATOM 1932 O ARG A 125 -22.115 -26.436 -21.876 1.00 0.00 O ATOM 1933 CB ARG A 125 -23.797 -24.267 -23.740 1.00 0.00 C ATOM 1934 CG ARG A 125 -25.074 -23.499 -23.407 1.00 0.00 C ATOM 1935 CD ARG A 125 -25.739 -22.899 -24.642 1.00 0.00 C ATOM 1936 NE ARG A 125 -26.160 -23.904 -25.625 1.00 0.00 N ATOM 1937 CZ ARG A 125 -27.231 -23.747 -26.412 1.00 0.00 C ATOM 1938 NH1 ARG A 125 -27.980 -22.647 -26.318 1.00 0.00 N1+ ATOM 1939 NH2 ARG A 125 -27.562 -24.683 -27.295 1.00 0.00 N ATOM 0 H ARG A 125 -22.375 -22.370 -23.167 1.00 0.00 H new ATOM 0 HA ARG A 125 -23.556 -24.455 -21.616 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -23.272 -23.795 -24.570 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -24.032 -25.286 -24.049 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -25.776 -24.168 -22.910 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -24.840 -22.702 -22.702 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -26.608 -22.319 -24.332 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -25.046 -22.205 -25.117 1.00 0.00 H new ATOM 0 HE ARG A 125 -25.612 -24.760 -25.712 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -27.737 -21.921 -25.644 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -28.795 -22.532 -26.920 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -26.998 -25.529 -27.377 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -28.380 -24.555 -27.891 1.00 0.00 H new ATOM 1953 N MET A 126 -20.783 -25.235 -23.230 1.00 0.00 N ATOM 1954 CA MET A 126 -19.755 -26.261 -23.213 1.00 0.00 C ATOM 1955 C MET A 126 -19.109 -26.309 -21.832 1.00 0.00 C ATOM 1956 O MET A 126 -18.683 -27.373 -21.394 1.00 0.00 O ATOM 1957 CB MET A 126 -18.715 -26.020 -24.306 1.00 0.00 C ATOM 1958 CG MET A 126 -17.906 -24.742 -24.076 1.00 0.00 C ATOM 1959 SD MET A 126 -16.471 -24.556 -25.164 1.00 0.00 S ATOM 1960 CE MET A 126 -17.307 -24.609 -26.767 1.00 0.00 C ATOM 0 H MET A 126 -20.579 -24.422 -23.811 1.00 0.00 H new ATOM 0 HA MET A 126 -20.215 -27.227 -23.420 1.00 0.00 H new ATOM 0 HB2 MET A 126 -18.037 -26.872 -24.351 1.00 0.00 H new ATOM 0 HB3 MET A 126 -19.216 -25.960 -25.272 1.00 0.00 H new ATOM 0 HG2 MET A 126 -18.562 -23.882 -24.211 1.00 0.00 H new ATOM 0 HG3 MET A 126 -17.566 -24.724 -23.041 1.00 0.00 H new ATOM 0 HE1 MET A 126 -16.609 -24.315 -27.551 1.00 0.00 H new ATOM 0 HE2 MET A 126 -17.663 -25.621 -26.959 1.00 0.00 H new ATOM 0 HE3 MET A 126 -18.154 -23.923 -26.759 1.00 0.00 H new ATOM 1970 N LEU A 127 -19.030 -25.170 -21.138 1.00 0.00 N ATOM 1971 CA LEU A 127 -18.485 -25.129 -19.791 1.00 0.00 C ATOM 1972 C LEU A 127 -19.358 -25.964 -18.857 1.00 0.00 C ATOM 1973 O LEU A 127 -18.834 -26.598 -17.948 1.00 0.00 O ATOM 1974 CB LEU A 127 -18.413 -23.673 -19.324 1.00 0.00 C ATOM 1975 CG LEU A 127 -16.976 -23.150 -19.269 1.00 0.00 C ATOM 1976 CD1 LEU A 127 -16.227 -23.291 -20.595 1.00 0.00 C ATOM 1977 CD2 LEU A 127 -17.003 -21.676 -18.879 1.00 0.00 C ATOM 0 H LEU A 127 -19.339 -24.265 -21.494 1.00 0.00 H new ATOM 0 HA LEU A 127 -17.479 -25.549 -19.780 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -18.999 -23.048 -19.998 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -18.866 -23.588 -18.336 1.00 0.00 H new ATOM 0 HG LEU A 127 -16.445 -23.755 -18.534 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -15.215 -22.901 -20.485 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -16.182 -24.343 -20.877 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -16.750 -22.730 -21.370 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -15.984 -21.292 -18.837 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -17.572 -21.114 -19.620 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -17.473 -21.567 -17.902 1.00 0.00 H new ATOM 1989 N LEU A 128 -20.680 -25.980 -19.064 1.00 0.00 N ATOM 1990 CA LEU A 128 -21.555 -26.796 -18.238 1.00 0.00 C ATOM 1991 C LEU A 128 -21.306 -28.275 -18.515 1.00 0.00 C ATOM 1992 O LEU A 128 -21.334 -29.079 -17.586 1.00 0.00 O ATOM 1993 CB LEU A 128 -23.017 -26.426 -18.508 1.00 0.00 C ATOM 1994 CG LEU A 128 -23.345 -25.006 -18.028 1.00 0.00 C ATOM 1995 CD1 LEU A 128 -24.750 -24.621 -18.488 1.00 0.00 C ATOM 1996 CD2 LEU A 128 -23.276 -24.916 -16.502 1.00 0.00 C ATOM 0 H LEU A 128 -21.155 -25.442 -19.789 1.00 0.00 H new ATOM 0 HA LEU A 128 -21.340 -26.606 -17.186 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -23.220 -26.504 -19.576 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -23.671 -27.139 -18.006 1.00 0.00 H new ATOM 0 HG LEU A 128 -22.610 -24.323 -18.454 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -24.981 -23.612 -18.146 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -24.799 -24.655 -19.576 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -25.474 -25.320 -18.070 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -23.512 -23.900 -16.186 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -23.995 -25.609 -16.064 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -22.272 -25.175 -16.167 1.00 0.00 H new ATOM 2008 N ASP A 129 -21.060 -28.646 -19.776 1.00 0.00 N ATOM 2009 CA ASP A 129 -20.719 -30.025 -20.101 1.00 0.00 C ATOM 2010 C ASP A 129 -19.372 -30.394 -19.475 1.00 0.00 C ATOM 2011 O ASP A 129 -19.226 -31.459 -18.880 1.00 0.00 O ATOM 2012 CB ASP A 129 -20.650 -30.179 -21.621 1.00 0.00 C ATOM 2013 CG ASP A 129 -20.174 -31.574 -22.010 1.00 0.00 C ATOM 2014 OD1 ASP A 129 -20.661 -32.542 -21.389 1.00 0.00 O ATOM 2015 OD2 ASP A 129 -19.328 -31.652 -22.924 1.00 0.00 O1- ATOM 0 H ASP A 129 -21.091 -28.015 -20.577 1.00 0.00 H new ATOM 0 HA ASP A 129 -21.482 -30.693 -19.701 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -21.633 -29.993 -22.053 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -19.973 -29.432 -22.035 1.00 0.00 H new ATOM 2020 N ILE A 130 -18.386 -29.506 -19.613 1.00 0.00 N ATOM 2021 CA ILE A 130 -17.045 -29.725 -19.098 1.00 0.00 C ATOM 2022 C ILE A 130 -17.083 -29.887 -17.581 1.00 0.00 C ATOM 2023 O ILE A 130 -16.302 -30.647 -17.005 1.00 0.00 O ATOM 2024 CB ILE A 130 -16.177 -28.542 -19.535 1.00 0.00 C ATOM 2025 CG1 ILE A 130 -15.949 -28.609 -21.049 1.00 0.00 C ATOM 2026 CG2 ILE A 130 -14.831 -28.542 -18.812 1.00 0.00 C ATOM 2027 CD1 ILE A 130 -15.568 -27.234 -21.592 1.00 0.00 C ATOM 0 H ILE A 130 -18.502 -28.611 -20.089 1.00 0.00 H new ATOM 0 HA ILE A 130 -16.617 -30.645 -19.497 1.00 0.00 H new ATOM 0 HB ILE A 130 -16.699 -27.621 -19.276 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -15.160 -29.327 -21.273 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -16.853 -28.965 -21.544 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -14.239 -27.689 -19.145 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -14.996 -28.472 -17.737 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -14.297 -29.465 -19.038 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -15.410 -27.299 -22.668 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -16.371 -26.526 -21.385 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -14.651 -26.894 -21.110 1.00 0.00 H new ATOM 2039 N TRP A 131 -17.995 -29.174 -16.919 1.00 0.00 N ATOM 2040 CA TRP A 131 -18.116 -29.275 -15.476 1.00 0.00 C ATOM 2041 C TRP A 131 -18.885 -30.516 -15.029 1.00 0.00 C ATOM 2042 O TRP A 131 -18.674 -30.989 -13.915 1.00 0.00 O ATOM 2043 CB TRP A 131 -18.733 -27.987 -14.925 1.00 0.00 C ATOM 2044 CG TRP A 131 -17.948 -26.744 -15.220 1.00 0.00 C ATOM 2045 CD1 TRP A 131 -16.670 -26.708 -15.654 1.00 0.00 C ATOM 2046 CD2 TRP A 131 -18.360 -25.345 -15.117 1.00 0.00 C ATOM 2047 NE1 TRP A 131 -16.269 -25.405 -15.840 1.00 0.00 N ATOM 2048 CE2 TRP A 131 -17.270 -24.517 -15.507 1.00 0.00 C ATOM 2049 CE3 TRP A 131 -19.549 -24.693 -14.741 1.00 0.00 C ATOM 2050 CZ2 TRP A 131 -17.352 -23.119 -15.516 1.00 0.00 C ATOM 2051 CZ3 TRP A 131 -19.644 -23.291 -14.749 1.00 0.00 C ATOM 2052 CH2 TRP A 131 -18.549 -22.502 -15.133 1.00 0.00 C ATOM 0 H TRP A 131 -18.651 -28.529 -17.359 1.00 0.00 H new ATOM 0 HA TRP A 131 -17.115 -29.394 -15.061 1.00 0.00 H new ATOM 0 HB2 TRP A 131 -19.736 -27.874 -15.337 1.00 0.00 H new ATOM 0 HB3 TRP A 131 -18.842 -28.085 -13.845 1.00 0.00 H new ATOM 0 HD1 TRP A 131 -16.052 -27.576 -15.830 1.00 0.00 H new ATOM 0 HE1 TRP A 131 -15.348 -25.131 -16.181 1.00 0.00 H new ATOM 0 HE3 TRP A 131 -20.404 -25.281 -14.441 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 -16.502 -22.524 -15.815 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 -20.569 -22.816 -14.457 1.00 0.00 H new ATOM 0 HH2 TRP A 131 -18.629 -21.425 -15.133 1.00 0.00 H new