USER MOD reduce.3.24.130724 H: found=0, std=0, add=872, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 870 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 Single : A 1 MET CE :methyl -150:sc= -7.5! (180deg=-10.8!) USER MOD Single : A 1 MET N :NH3+ -172:sc= -0.969 (180deg=-1.23) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 132:sc= 0.496 (180deg=0.0153) USER MOD Single : A 8 ASN : amide:sc= -2.09! C(o=-2.1!,f=-10!) USER MOD Single : A 9 HIS :FLIP no HD1:sc= -1.23 F(o=-2.4,f=-1.2) USER MOD Single : A 10 ASN : amide:sc= -1.14 K(o=-1.1,f=-7.9!) USER MOD Single : A 15 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0293) USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 LYS NZ :NH3+ -175:sc= 0.251 (180deg=0.211) USER MOD Single : A 31 ASN : amide:sc= -0.0346 X(o=-0.035,f=-0.044) USER MOD Single : A 32 LYS NZ :NH3+ 172:sc= 0.615 (180deg=0.581) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= 0.206 X(o=0.21,f=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 173:sc= 0.496 (180deg=0.474) USER MOD Single : A 45 LYS NZ :NH3+ 164:sc= -0.0641 (180deg=-0.58) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 150:sc= -5.24 (180deg=-9.68!) USER MOD Single : B 1 MET N :NH3+ -157:sc= -0.0906 (180deg=-0.69) USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 LYS NZ :NH3+ 131:sc= 0.512 (180deg=0.014) USER MOD Single : B 8 ASN : amide:sc= -2.15! C(o=-2.1!,f=-10!) USER MOD Single : B 9 HIS :FLIP no HD1:sc= -1.26 F(o=-2.4!,f=-1.3) USER MOD Single : B 10 ASN : amide:sc= -1.12 K(o=-1.1,f=-7.9!) USER MOD Single : B 15 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0252) USER MOD Single : B 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 21 LYS NZ :NH3+ -171:sc= 0.245 (180deg=0.201) USER MOD Single : B 31 ASN : amide:sc= -0.0355 X(o=-0.035,f=-0.044) USER MOD Single : B 32 LYS NZ :NH3+ 173:sc= 0.612 (180deg=0.574) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000546) USER MOD Single : B 35 ASN : amide:sc= 0.207 X(o=0.21,f=0) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 LYS NZ :NH3+ 174:sc= 0.485 (180deg=0.467) USER MOD Single : B 45 LYS NZ :NH3+ 164:sc= -0.0652 (180deg=-0.595) USER MOD Single : B 46 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -10.857 15.288 7.925 1.00 0.00 N ATOM 2 CA MET A 1 -9.932 14.250 7.380 1.00 0.00 C ATOM 3 C MET A 1 -10.342 13.902 5.946 1.00 0.00 C ATOM 4 O MET A 1 -11.344 13.245 5.719 1.00 0.00 O ATOM 5 CB MET A 1 -9.989 12.990 8.251 1.00 0.00 C ATOM 6 CG MET A 1 -9.423 13.300 9.639 1.00 0.00 C ATOM 7 SD MET A 1 -9.916 12.010 10.815 1.00 0.00 S ATOM 8 CE MET A 1 -11.695 12.026 10.480 1.00 0.00 C ATOM 0 H1 MET A 1 -10.501 15.623 8.843 1.00 0.00 H new ATOM 0 H2 MET A 1 -10.911 16.088 7.262 1.00 0.00 H new ATOM 0 H3 MET A 1 -11.804 14.878 8.050 1.00 0.00 H new ATOM 0 HA MET A 1 -8.914 14.640 7.383 1.00 0.00 H new ATOM 0 HB2 MET A 1 -11.018 12.641 8.336 1.00 0.00 H new ATOM 0 HB3 MET A 1 -9.418 12.187 7.785 1.00 0.00 H new ATOM 0 HG2 MET A 1 -8.336 13.363 9.591 1.00 0.00 H new ATOM 0 HG3 MET A 1 -9.784 14.271 9.979 1.00 0.00 H new ATOM 0 HE1 MET A 1 -12.238 11.746 11.383 1.00 0.00 H new ATOM 0 HE2 MET A 1 -11.998 13.026 10.170 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.922 11.316 9.685 1.00 0.00 H new ATOM 20 N LYS A 2 -9.571 14.339 4.981 1.00 0.00 N ATOM 21 CA LYS A 2 -9.896 14.047 3.556 1.00 0.00 C ATOM 22 C LYS A 2 -9.564 12.590 3.235 1.00 0.00 C ATOM 23 O LYS A 2 -8.683 11.990 3.826 1.00 0.00 O ATOM 24 CB LYS A 2 -9.099 14.971 2.628 1.00 0.00 C ATOM 25 CG LYS A 2 -7.613 14.963 3.010 1.00 0.00 C ATOM 26 CD LYS A 2 -7.168 16.382 3.379 1.00 0.00 C ATOM 27 CE LYS A 2 -6.312 16.340 4.648 1.00 0.00 C ATOM 28 NZ LYS A 2 -5.549 17.614 4.781 1.00 0.00 N ATOM 0 H LYS A 2 -8.724 14.890 5.124 1.00 0.00 H new ATOM 0 HA LYS A 2 -10.961 14.219 3.399 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -9.217 14.647 1.594 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -9.491 15.986 2.691 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -7.447 14.289 3.851 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -7.016 14.589 2.179 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -6.599 16.820 2.559 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -8.039 17.017 3.537 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -6.947 16.192 5.522 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -5.624 15.495 4.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -4.969 17.583 5.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -4.932 17.737 3.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -6.213 18.412 4.840 1.00 0.00 H new ATOM 42 N ILE A 3 -10.271 12.029 2.294 1.00 0.00 N ATOM 43 CA ILE A 3 -10.034 10.609 1.896 1.00 0.00 C ATOM 44 C ILE A 3 -8.788 10.530 1.008 1.00 0.00 C ATOM 45 O ILE A 3 -8.779 10.995 -0.118 1.00 0.00 O ATOM 46 CB ILE A 3 -11.264 10.074 1.141 1.00 0.00 C ATOM 47 CG1 ILE A 3 -12.367 9.717 2.146 1.00 0.00 C ATOM 48 CG2 ILE A 3 -10.889 8.818 0.347 1.00 0.00 C ATOM 49 CD1 ILE A 3 -13.370 10.867 2.254 1.00 0.00 C ATOM 0 H ILE A 3 -11.013 12.499 1.776 1.00 0.00 H new ATOM 0 HA ILE A 3 -9.874 9.999 2.785 1.00 0.00 H new ATOM 0 HB ILE A 3 -11.619 10.844 0.456 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -12.877 8.807 1.830 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -11.928 9.514 3.123 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -11.766 8.447 -0.183 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -10.107 9.062 -0.372 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -10.527 8.050 1.031 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -14.149 10.604 2.970 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -12.856 11.767 2.591 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -13.820 11.050 1.278 1.00 0.00 H new ATOM 61 N LYS A 4 -7.743 9.931 1.519 1.00 0.00 N ATOM 62 CA LYS A 4 -6.484 9.787 0.735 1.00 0.00 C ATOM 63 C LYS A 4 -6.560 8.508 -0.104 1.00 0.00 C ATOM 64 O LYS A 4 -6.114 8.477 -1.236 1.00 0.00 O ATOM 65 CB LYS A 4 -5.293 9.700 1.697 1.00 0.00 C ATOM 66 CG LYS A 4 -4.024 10.187 0.993 1.00 0.00 C ATOM 67 CD LYS A 4 -3.154 8.987 0.610 1.00 0.00 C ATOM 68 CE LYS A 4 -1.740 9.464 0.268 1.00 0.00 C ATOM 69 NZ LYS A 4 -0.929 9.564 1.516 1.00 0.00 N ATOM 0 H LYS A 4 -7.710 9.532 2.457 1.00 0.00 H new ATOM 0 HA LYS A 4 -6.356 10.648 0.079 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -5.484 10.305 2.583 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -5.161 8.672 2.036 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -4.287 10.757 0.102 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -3.468 10.858 1.648 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -3.118 8.274 1.433 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -3.589 8.467 -0.243 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -1.270 8.770 -0.428 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -1.783 10.433 -0.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -0.011 9.097 1.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -0.775 10.565 1.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -1.435 9.099 2.297 1.00 0.00 H new ATOM 83 N ARG A 5 -7.127 7.458 0.448 1.00 0.00 N ATOM 84 CA ARG A 5 -7.241 6.171 -0.303 1.00 0.00 C ATOM 85 C ARG A 5 -8.549 5.462 0.070 1.00 0.00 C ATOM 86 O ARG A 5 -9.209 5.817 1.029 1.00 0.00 O ATOM 87 CB ARG A 5 -6.061 5.263 0.053 1.00 0.00 C ATOM 88 CG ARG A 5 -4.773 5.810 -0.572 1.00 0.00 C ATOM 89 CD ARG A 5 -3.566 5.074 0.017 1.00 0.00 C ATOM 90 NE ARG A 5 -3.316 5.553 1.408 1.00 0.00 N ATOM 91 CZ ARG A 5 -2.342 5.038 2.111 1.00 0.00 C ATOM 92 NH1 ARG A 5 -2.544 3.950 2.809 1.00 0.00 N ATOM 93 NH2 ARG A 5 -1.165 5.609 2.114 1.00 0.00 N ATOM 0 H ARG A 5 -7.516 7.441 1.391 1.00 0.00 H new ATOM 0 HA ARG A 5 -7.235 6.383 -1.372 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -5.952 5.202 1.136 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -6.248 4.251 -0.306 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -4.798 5.681 -1.654 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -4.689 6.880 -0.380 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -3.748 3.999 0.019 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -2.685 5.246 -0.601 1.00 0.00 H new ATOM 0 HE ARG A 5 -3.905 6.282 1.810 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -3.461 3.504 2.804 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -1.784 3.548 3.358 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -1.008 6.456 1.568 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -0.405 5.207 2.663 1.00 0.00 H new ATOM 107 N ILE A 6 -8.918 4.456 -0.687 1.00 0.00 N ATOM 108 CA ILE A 6 -10.177 3.700 -0.400 1.00 0.00 C ATOM 109 C ILE A 6 -9.828 2.248 -0.058 1.00 0.00 C ATOM 110 O ILE A 6 -9.179 1.558 -0.825 1.00 0.00 O ATOM 111 CB ILE A 6 -11.094 3.722 -1.633 1.00 0.00 C ATOM 112 CG1 ILE A 6 -11.201 5.151 -2.191 1.00 0.00 C ATOM 113 CG2 ILE A 6 -12.489 3.212 -1.251 1.00 0.00 C ATOM 114 CD1 ILE A 6 -11.843 6.078 -1.153 1.00 0.00 C ATOM 0 H ILE A 6 -8.396 4.124 -1.498 1.00 0.00 H new ATOM 0 HA ILE A 6 -10.692 4.167 0.440 1.00 0.00 H new ATOM 0 HB ILE A 6 -10.668 3.074 -2.399 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -10.211 5.521 -2.456 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -11.796 5.149 -3.105 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -13.136 3.229 -2.128 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -12.413 2.191 -0.876 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -12.911 3.852 -0.476 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -11.913 7.087 -1.560 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -12.841 5.715 -0.909 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -11.232 6.093 -0.251 1.00 0.00 H new ATOM 126 N LEU A 7 -10.268 1.781 1.084 1.00 0.00 N ATOM 127 CA LEU A 7 -9.989 0.376 1.487 1.00 0.00 C ATOM 128 C LEU A 7 -11.165 -0.494 1.041 1.00 0.00 C ATOM 129 O LEU A 7 -10.991 -1.515 0.404 1.00 0.00 O ATOM 130 CB LEU A 7 -9.825 0.310 3.003 1.00 0.00 C ATOM 131 CG LEU A 7 -8.683 1.235 3.422 1.00 0.00 C ATOM 132 CD1 LEU A 7 -8.922 1.750 4.843 1.00 0.00 C ATOM 133 CD2 LEU A 7 -7.362 0.471 3.376 1.00 0.00 C ATOM 0 H LEU A 7 -10.813 2.321 1.757 1.00 0.00 H new ATOM 0 HA LEU A 7 -9.071 0.017 1.021 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -10.751 0.609 3.495 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -9.614 -0.713 3.314 1.00 0.00 H new ATOM 0 HG LEU A 7 -8.641 2.081 2.736 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -8.104 2.408 5.134 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -9.861 2.302 4.877 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -8.972 0.907 5.532 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -6.549 1.132 3.675 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.409 -0.378 4.058 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -7.184 0.113 2.362 1.00 0.00 H new ATOM 145 N ASN A 8 -12.364 -0.057 1.347 1.00 0.00 N ATOM 146 CA ASN A 8 -13.593 -0.802 0.926 1.00 0.00 C ATOM 147 C ASN A 8 -14.837 0.058 1.224 1.00 0.00 C ATOM 148 O ASN A 8 -14.730 1.245 1.474 1.00 0.00 O ATOM 149 CB ASN A 8 -13.669 -2.181 1.616 1.00 0.00 C ATOM 150 CG ASN A 8 -14.041 -2.052 3.093 1.00 0.00 C ATOM 151 OD1 ASN A 8 -15.182 -1.819 3.428 1.00 0.00 O ATOM 152 ND2 ASN A 8 -13.129 -2.230 4.002 1.00 0.00 N ATOM 0 H ASN A 8 -12.545 0.795 1.877 1.00 0.00 H new ATOM 0 HA ASN A 8 -13.552 -0.991 -0.147 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -14.406 -2.803 1.108 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -12.708 -2.687 1.525 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -13.376 -2.173 4.990 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -12.167 -2.427 3.727 1.00 0.00 H new ATOM 159 N HIS A 9 -16.013 -0.523 1.169 1.00 0.00 N ATOM 160 CA HIS A 9 -17.274 0.257 1.414 1.00 0.00 C ATOM 161 C HIS A 9 -17.272 0.917 2.807 1.00 0.00 C ATOM 162 O HIS A 9 -17.888 1.951 3.004 1.00 0.00 O ATOM 163 CB HIS A 9 -18.475 -0.690 1.310 1.00 0.00 C ATOM 164 CG HIS A 9 -19.742 0.109 1.170 1.00 0.00 C ATOM 165 ND1 HIS A 9 -20.732 0.424 2.068 1.00 0.00 N flip ATOM 166 CD2 HIS A 9 -20.117 0.699 -0.027 1.00 0.00 C flip ATOM 167 CE1 HIS A 9 -21.705 1.195 1.440 1.00 0.00 C flip ATOM 168 NE2 HIS A 9 -21.285 1.331 0.180 1.00 0.00 N flip ATOM 0 H HIS A 9 -16.156 -1.512 0.963 1.00 0.00 H new ATOM 0 HA HIS A 9 -17.337 1.046 0.665 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -18.355 -1.352 0.452 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -18.529 -1.323 2.196 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -19.570 0.658 -0.957 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -22.607 1.597 1.878 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -21.789 1.851 -0.538 1.00 0.00 H new ATOM 176 N ASN A 10 -16.619 0.320 3.774 1.00 0.00 N ATOM 177 CA ASN A 10 -16.608 0.889 5.154 1.00 0.00 C ATOM 178 C ASN A 10 -15.218 1.395 5.543 1.00 0.00 C ATOM 179 O ASN A 10 -15.094 2.273 6.375 1.00 0.00 O ATOM 180 CB ASN A 10 -17.027 -0.196 6.148 1.00 0.00 C ATOM 181 CG ASN A 10 -18.095 -1.105 5.525 1.00 0.00 C ATOM 182 OD1 ASN A 10 -19.187 -0.664 5.222 1.00 0.00 O ATOM 183 ND2 ASN A 10 -17.822 -2.365 5.315 1.00 0.00 N ATOM 0 H ASN A 10 -16.089 -0.545 3.663 1.00 0.00 H new ATOM 0 HA ASN A 10 -17.302 1.729 5.177 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -16.159 -0.789 6.437 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -17.416 0.264 7.056 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -18.524 -2.976 4.898 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -16.907 -2.738 5.568 1.00 0.00 H new ATOM 190 N ALA A 11 -14.174 0.846 4.977 1.00 0.00 N ATOM 191 CA ALA A 11 -12.810 1.296 5.355 1.00 0.00 C ATOM 192 C ALA A 11 -12.265 2.276 4.318 1.00 0.00 C ATOM 193 O ALA A 11 -12.338 2.044 3.125 1.00 0.00 O ATOM 194 CB ALA A 11 -11.885 0.085 5.464 1.00 0.00 C ATOM 0 H ALA A 11 -14.211 0.109 4.273 1.00 0.00 H new ATOM 0 HA ALA A 11 -12.859 1.803 6.318 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -10.884 0.416 5.741 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -12.266 -0.597 6.225 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -11.844 -0.429 4.504 1.00 0.00 H new ATOM 200 N ILE A 12 -11.715 3.369 4.780 1.00 0.00 N ATOM 201 CA ILE A 12 -11.141 4.394 3.861 1.00 0.00 C ATOM 202 C ILE A 12 -9.903 5.007 4.523 1.00 0.00 C ATOM 203 O ILE A 12 -9.912 5.314 5.703 1.00 0.00 O ATOM 204 CB ILE A 12 -12.180 5.497 3.600 1.00 0.00 C ATOM 205 CG1 ILE A 12 -13.475 4.886 3.045 1.00 0.00 C ATOM 206 CG2 ILE A 12 -11.621 6.506 2.594 1.00 0.00 C ATOM 207 CD1 ILE A 12 -13.229 4.309 1.649 1.00 0.00 C ATOM 0 H ILE A 12 -11.639 3.597 5.771 1.00 0.00 H new ATOM 0 HA ILE A 12 -10.869 3.930 2.913 1.00 0.00 H new ATOM 0 HB ILE A 12 -12.399 6.002 4.541 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -13.832 4.102 3.713 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -14.255 5.646 3.000 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -12.360 7.286 2.412 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -10.712 6.954 2.995 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -11.392 5.997 1.658 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -14.154 3.878 1.265 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -12.894 5.103 0.981 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -12.464 3.535 1.705 1.00 0.00 H new ATOM 219 N VAL A 13 -8.843 5.197 3.775 1.00 0.00 N ATOM 220 CA VAL A 13 -7.613 5.798 4.362 1.00 0.00 C ATOM 221 C VAL A 13 -7.720 7.318 4.267 1.00 0.00 C ATOM 222 O VAL A 13 -7.668 7.882 3.192 1.00 0.00 O ATOM 223 CB VAL A 13 -6.369 5.327 3.597 1.00 0.00 C ATOM 224 CG1 VAL A 13 -5.117 5.680 4.404 1.00 0.00 C ATOM 225 CG2 VAL A 13 -6.428 3.811 3.384 1.00 0.00 C ATOM 0 H VAL A 13 -8.780 4.961 2.785 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.520 5.487 5.403 1.00 0.00 H new ATOM 0 HB VAL A 13 -6.335 5.822 2.626 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -4.230 5.347 3.864 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -5.070 6.759 4.549 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -5.158 5.185 5.374 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -5.541 3.485 2.840 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -6.466 3.309 4.351 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -7.319 3.559 2.809 1.00 0.00 H new ATOM 235 N VAL A 14 -7.867 7.982 5.384 1.00 0.00 N ATOM 236 CA VAL A 14 -7.976 9.469 5.365 1.00 0.00 C ATOM 237 C VAL A 14 -6.704 10.081 5.959 1.00 0.00 C ATOM 238 O VAL A 14 -5.878 9.391 6.528 1.00 0.00 O ATOM 239 CB VAL A 14 -9.203 9.923 6.173 1.00 0.00 C ATOM 240 CG1 VAL A 14 -10.478 9.382 5.521 1.00 0.00 C ATOM 241 CG2 VAL A 14 -9.109 9.404 7.612 1.00 0.00 C ATOM 0 H VAL A 14 -7.916 7.557 6.310 1.00 0.00 H new ATOM 0 HA VAL A 14 -8.094 9.805 4.335 1.00 0.00 H new ATOM 0 HB VAL A 14 -9.232 11.013 6.187 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -11.346 9.705 6.096 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -10.555 9.762 4.502 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -10.442 8.293 5.500 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.983 9.732 8.175 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -9.070 8.315 7.604 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -8.207 9.796 8.082 1.00 0.00 H new ATOM 251 N LYS A 15 -6.544 11.371 5.827 1.00 0.00 N ATOM 252 CA LYS A 15 -5.330 12.046 6.376 1.00 0.00 C ATOM 253 C LYS A 15 -5.707 13.421 6.934 1.00 0.00 C ATOM 254 O LYS A 15 -6.692 14.020 6.535 1.00 0.00 O ATOM 255 CB LYS A 15 -4.277 12.205 5.271 1.00 0.00 C ATOM 256 CG LYS A 15 -4.922 12.794 4.012 1.00 0.00 C ATOM 257 CD LYS A 15 -3.830 13.182 3.012 1.00 0.00 C ATOM 258 CE LYS A 15 -4.473 13.616 1.692 1.00 0.00 C ATOM 259 NZ LYS A 15 -4.377 15.097 1.551 1.00 0.00 N ATOM 0 H LYS A 15 -7.206 11.991 5.360 1.00 0.00 H new ATOM 0 HA LYS A 15 -4.916 11.436 7.179 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -3.472 12.855 5.615 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -3.830 11.238 5.042 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -5.599 12.067 3.563 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -5.519 13.668 4.272 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -3.224 13.992 3.417 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -3.162 12.338 2.842 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -3.974 13.128 0.855 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -5.517 13.305 1.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -4.874 15.396 0.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -4.813 15.553 2.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -3.377 15.376 1.490 1.00 0.00 H new ATOM 273 N ASP A 16 -4.924 13.919 7.857 1.00 0.00 N ATOM 274 CA ASP A 16 -5.211 15.251 8.461 1.00 0.00 C ATOM 275 C ASP A 16 -3.894 15.991 8.733 1.00 0.00 C ATOM 276 O ASP A 16 -2.819 15.513 8.407 1.00 0.00 O ATOM 277 CB ASP A 16 -5.976 15.055 9.777 1.00 0.00 C ATOM 278 CG ASP A 16 -7.001 16.182 9.955 1.00 0.00 C ATOM 279 OD1 ASP A 16 -8.043 16.115 9.324 1.00 0.00 O ATOM 280 OD2 ASP A 16 -6.724 17.091 10.721 1.00 0.00 O ATOM 0 H ASP A 16 -4.092 13.454 8.220 1.00 0.00 H new ATOM 0 HA ASP A 16 -5.815 15.841 7.772 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -6.481 14.089 9.774 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -5.280 15.049 10.616 1.00 0.00 H new ATOM 285 N GLN A 17 -3.978 17.156 9.330 1.00 0.00 N ATOM 286 CA GLN A 17 -2.755 17.955 9.640 1.00 0.00 C ATOM 287 C GLN A 17 -1.786 17.123 10.475 1.00 0.00 C ATOM 288 O GLN A 17 -0.591 17.123 10.236 1.00 0.00 O ATOM 289 CB GLN A 17 -3.155 19.204 10.430 1.00 0.00 C ATOM 290 CG GLN A 17 -3.124 20.429 9.513 1.00 0.00 C ATOM 291 CD GLN A 17 -4.409 20.481 8.680 1.00 0.00 C ATOM 292 OE1 GLN A 17 -5.363 21.132 9.055 1.00 0.00 O ATOM 293 NE2 GLN A 17 -4.474 19.817 7.556 1.00 0.00 N ATOM 0 H GLN A 17 -4.855 17.591 9.618 1.00 0.00 H new ATOM 0 HA GLN A 17 -2.270 18.243 8.707 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -4.153 19.077 10.848 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -2.474 19.349 11.269 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -3.027 21.338 10.107 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -2.255 20.383 8.857 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -3.673 19.270 7.240 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -5.325 19.846 6.995 1.00 0.00 H new ATOM 302 N ASN A 18 -2.296 16.427 11.454 1.00 0.00 N ATOM 303 CA ASN A 18 -1.421 15.593 12.323 1.00 0.00 C ATOM 304 C ASN A 18 -0.743 14.496 11.494 1.00 0.00 C ATOM 305 O ASN A 18 0.467 14.371 11.510 1.00 0.00 O ATOM 306 CB ASN A 18 -2.256 14.958 13.438 1.00 0.00 C ATOM 307 CG ASN A 18 -2.304 15.898 14.645 1.00 0.00 C ATOM 308 OD1 ASN A 18 -1.549 15.739 15.584 1.00 0.00 O ATOM 309 ND2 ASN A 18 -3.165 16.881 14.661 1.00 0.00 N ATOM 0 H ASN A 18 -3.288 16.401 11.690 1.00 0.00 H new ATOM 0 HA ASN A 18 -0.652 16.227 12.764 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -3.266 14.758 13.080 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -1.825 14.000 13.728 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -3.202 17.513 15.461 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -3.799 17.016 13.874 1.00 0.00 H new ATOM 316 N GLU A 19 -1.512 13.704 10.771 1.00 0.00 N ATOM 317 CA GLU A 19 -0.918 12.609 9.938 1.00 0.00 C ATOM 318 C GLU A 19 -2.039 11.777 9.294 1.00 0.00 C ATOM 319 O GLU A 19 -3.213 12.086 9.420 1.00 0.00 O ATOM 320 CB GLU A 19 -0.057 11.692 10.823 1.00 0.00 C ATOM 321 CG GLU A 19 1.249 11.345 10.097 1.00 0.00 C ATOM 322 CD GLU A 19 2.260 12.484 10.267 1.00 0.00 C ATOM 323 OE1 GLU A 19 2.952 12.493 11.273 1.00 0.00 O ATOM 324 OE2 GLU A 19 2.325 13.328 9.387 1.00 0.00 O ATOM 0 H GLU A 19 -2.529 13.773 10.725 1.00 0.00 H new ATOM 0 HA GLU A 19 -0.299 13.054 9.159 1.00 0.00 H new ATOM 0 HB2 GLU A 19 0.163 12.186 11.769 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -0.605 10.780 11.060 1.00 0.00 H new ATOM 0 HG2 GLU A 19 1.662 10.418 10.496 1.00 0.00 H new ATOM 0 HG3 GLU A 19 1.053 11.177 9.038 1.00 0.00 H new ATOM 331 N GLU A 20 -1.676 10.719 8.610 1.00 0.00 N ATOM 332 CA GLU A 20 -2.694 9.841 7.954 1.00 0.00 C ATOM 333 C GLU A 20 -3.381 8.969 9.010 1.00 0.00 C ATOM 334 O GLU A 20 -2.788 8.601 10.008 1.00 0.00 O ATOM 335 CB GLU A 20 -2.009 8.944 6.919 1.00 0.00 C ATOM 336 CG GLU A 20 -3.060 8.355 5.972 1.00 0.00 C ATOM 337 CD GLU A 20 -2.372 7.504 4.900 1.00 0.00 C ATOM 338 OE1 GLU A 20 -2.044 6.364 5.193 1.00 0.00 O ATOM 339 OE2 GLU A 20 -2.190 8.004 3.802 1.00 0.00 O ATOM 0 H GLU A 20 -0.709 10.424 8.477 1.00 0.00 H new ATOM 0 HA GLU A 20 -3.439 10.464 7.459 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -1.276 9.519 6.353 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -1.467 8.142 7.420 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -3.769 7.746 6.534 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -3.630 9.157 5.503 1.00 0.00 H new ATOM 346 N LYS A 21 -4.631 8.638 8.790 1.00 0.00 N ATOM 347 CA LYS A 21 -5.380 7.790 9.767 1.00 0.00 C ATOM 348 C LYS A 21 -6.371 6.891 9.018 1.00 0.00 C ATOM 349 O LYS A 21 -7.122 7.347 8.174 1.00 0.00 O ATOM 350 CB LYS A 21 -6.154 8.670 10.770 1.00 0.00 C ATOM 351 CG LYS A 21 -6.087 10.150 10.366 1.00 0.00 C ATOM 352 CD LYS A 21 -6.580 11.022 11.524 1.00 0.00 C ATOM 353 CE LYS A 21 -5.394 11.426 12.405 1.00 0.00 C ATOM 354 NZ LYS A 21 -4.807 12.703 11.904 1.00 0.00 N ATOM 0 H LYS A 21 -5.167 8.922 7.970 1.00 0.00 H new ATOM 0 HA LYS A 21 -4.662 7.178 10.313 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -7.194 8.348 10.815 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -5.737 8.542 11.769 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -5.064 10.420 10.104 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -6.699 10.324 9.481 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -7.078 11.911 11.137 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -7.316 10.477 12.115 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -5.720 11.545 13.438 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -4.639 10.640 12.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -3.952 12.930 12.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -4.558 12.600 10.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -5.501 13.470 12.012 1.00 0.00 H new ATOM 368 N ILE A 22 -6.386 5.619 9.336 1.00 0.00 N ATOM 369 CA ILE A 22 -7.333 4.678 8.670 1.00 0.00 C ATOM 370 C ILE A 22 -8.706 4.810 9.333 1.00 0.00 C ATOM 371 O ILE A 22 -8.837 4.673 10.537 1.00 0.00 O ATOM 372 CB ILE A 22 -6.829 3.236 8.816 1.00 0.00 C ATOM 373 CG1 ILE A 22 -5.541 3.051 8.000 1.00 0.00 C ATOM 374 CG2 ILE A 22 -7.902 2.261 8.317 1.00 0.00 C ATOM 375 CD1 ILE A 22 -5.835 3.210 6.505 1.00 0.00 C ATOM 0 H ILE A 22 -5.777 5.192 10.034 1.00 0.00 H new ATOM 0 HA ILE A 22 -7.405 4.920 7.610 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.620 3.034 9.866 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -4.796 3.783 8.312 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -5.118 2.065 8.192 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -7.541 1.238 8.422 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -8.811 2.387 8.906 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -8.118 2.464 7.268 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -4.914 3.077 5.937 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -6.564 2.461 6.196 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.236 4.206 6.317 1.00 0.00 H new ATOM 387 N LEU A 23 -9.725 5.081 8.559 1.00 0.00 N ATOM 388 CA LEU A 23 -11.088 5.231 9.139 1.00 0.00 C ATOM 389 C LEU A 23 -11.972 4.053 8.723 1.00 0.00 C ATOM 390 O LEU A 23 -12.118 3.754 7.550 1.00 0.00 O ATOM 391 CB LEU A 23 -11.709 6.544 8.650 1.00 0.00 C ATOM 392 CG LEU A 23 -11.899 7.496 9.835 1.00 0.00 C ATOM 393 CD1 LEU A 23 -10.563 7.708 10.553 1.00 0.00 C ATOM 394 CD2 LEU A 23 -12.415 8.841 9.322 1.00 0.00 C ATOM 0 H LEU A 23 -9.669 5.205 7.548 1.00 0.00 H new ATOM 0 HA LEU A 23 -11.013 5.246 10.226 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.066 7.005 7.900 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -12.668 6.348 8.171 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.617 7.064 10.532 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.706 8.386 11.394 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -10.190 6.751 10.917 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.841 8.138 9.859 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.552 9.522 10.162 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.693 9.265 8.624 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -13.368 8.695 8.814 1.00 0.00 H new ATOM 406 N LEU A 24 -12.563 3.386 9.686 1.00 0.00 N ATOM 407 CA LEU A 24 -13.447 2.224 9.380 1.00 0.00 C ATOM 408 C LEU A 24 -14.869 2.540 9.851 1.00 0.00 C ATOM 409 O LEU A 24 -15.144 2.574 11.036 1.00 0.00 O ATOM 410 CB LEU A 24 -12.934 0.968 10.103 1.00 0.00 C ATOM 411 CG LEU A 24 -11.406 0.883 10.005 1.00 0.00 C ATOM 412 CD1 LEU A 24 -10.885 -0.113 11.043 1.00 0.00 C ATOM 413 CD2 LEU A 24 -11.008 0.414 8.603 1.00 0.00 C ATOM 0 H LEU A 24 -12.468 3.602 10.678 1.00 0.00 H new ATOM 0 HA LEU A 24 -13.444 2.040 8.306 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -13.237 0.994 11.150 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -13.383 0.078 9.663 1.00 0.00 H new ATOM 0 HG LEU A 24 -10.974 1.866 10.194 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -9.799 -0.175 10.975 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.168 0.221 12.041 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -11.317 -1.096 10.853 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.922 0.354 8.534 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -11.439 -0.569 8.412 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -11.380 1.123 7.863 1.00 0.00 H new ATOM 425 N GLY A 25 -15.768 2.771 8.927 1.00 0.00 N ATOM 426 CA GLY A 25 -17.178 3.087 9.294 1.00 0.00 C ATOM 427 C GLY A 25 -18.116 2.434 8.280 1.00 0.00 C ATOM 428 O GLY A 25 -17.966 2.615 7.090 1.00 0.00 O ATOM 0 H GLY A 25 -15.581 2.753 7.924 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -17.396 2.722 10.298 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -17.331 4.166 9.307 1.00 0.00 H new ATOM 432 N ALA A 26 -19.070 1.665 8.748 1.00 0.00 N ATOM 433 CA ALA A 26 -20.025 0.974 7.831 1.00 0.00 C ATOM 434 C ALA A 26 -20.679 1.982 6.878 1.00 0.00 C ATOM 435 O ALA A 26 -21.587 2.712 7.243 1.00 0.00 O ATOM 436 CB ALA A 26 -21.106 0.269 8.648 1.00 0.00 C ATOM 0 H ALA A 26 -19.228 1.486 9.740 1.00 0.00 H new ATOM 0 HA ALA A 26 -19.474 0.240 7.243 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -21.801 -0.234 7.975 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -20.643 -0.466 9.307 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -21.647 1.003 9.246 1.00 0.00 H new ATOM 442 N GLY A 27 -20.218 2.007 5.656 1.00 0.00 N ATOM 443 CA GLY A 27 -20.784 2.937 4.633 1.00 0.00 C ATOM 444 C GLY A 27 -20.002 4.259 4.588 1.00 0.00 C ATOM 445 O GLY A 27 -20.432 5.203 3.950 1.00 0.00 O ATOM 0 H GLY A 27 -19.461 1.413 5.317 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -20.757 2.462 3.652 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -21.831 3.139 4.861 1.00 0.00 H new ATOM 449 N ILE A 28 -18.864 4.342 5.246 1.00 0.00 N ATOM 450 CA ILE A 28 -18.068 5.597 5.229 1.00 0.00 C ATOM 451 C ILE A 28 -17.638 5.908 3.786 1.00 0.00 C ATOM 452 O ILE A 28 -17.655 7.051 3.364 1.00 0.00 O ATOM 453 CB ILE A 28 -16.854 5.418 6.154 1.00 0.00 C ATOM 454 CG1 ILE A 28 -16.607 6.714 6.910 1.00 0.00 C ATOM 455 CG2 ILE A 28 -15.598 5.049 5.355 1.00 0.00 C ATOM 456 CD1 ILE A 28 -15.872 6.407 8.214 1.00 0.00 C ATOM 0 H ILE A 28 -18.458 3.584 5.795 1.00 0.00 H new ATOM 0 HA ILE A 28 -18.660 6.438 5.590 1.00 0.00 H new ATOM 0 HB ILE A 28 -17.067 4.607 6.851 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -16.017 7.398 6.299 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -17.554 7.211 7.121 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -14.756 4.929 6.036 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -15.768 4.115 4.820 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -15.376 5.841 4.640 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -15.694 7.334 8.758 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -16.479 5.739 8.825 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -14.919 5.928 7.990 1.00 0.00 H new ATOM 468 N ALA A 29 -17.279 4.895 3.025 1.00 0.00 N ATOM 469 CA ALA A 29 -16.880 5.119 1.602 1.00 0.00 C ATOM 470 C ALA A 29 -18.087 5.676 0.844 1.00 0.00 C ATOM 471 O ALA A 29 -17.957 6.564 0.020 1.00 0.00 O ATOM 472 CB ALA A 29 -16.441 3.796 0.970 1.00 0.00 C ATOM 0 H ALA A 29 -17.247 3.923 3.333 1.00 0.00 H new ATOM 0 HA ALA A 29 -16.049 5.822 1.555 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -16.152 3.966 -0.067 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -15.592 3.393 1.522 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -17.266 3.085 1.004 1.00 0.00 H new ATOM 478 N PHE A 30 -19.266 5.176 1.146 1.00 0.00 N ATOM 479 CA PHE A 30 -20.497 5.683 0.482 1.00 0.00 C ATOM 480 C PHE A 30 -20.761 7.108 0.976 1.00 0.00 C ATOM 481 O PHE A 30 -20.488 7.435 2.119 1.00 0.00 O ATOM 482 CB PHE A 30 -21.683 4.779 0.841 1.00 0.00 C ATOM 483 CG PHE A 30 -22.908 5.210 0.066 1.00 0.00 C ATOM 484 CD1 PHE A 30 -23.080 4.794 -1.260 1.00 0.00 C ATOM 485 CD2 PHE A 30 -23.871 6.024 0.675 1.00 0.00 C ATOM 486 CE1 PHE A 30 -24.214 5.194 -1.977 1.00 0.00 C ATOM 487 CE2 PHE A 30 -25.005 6.424 -0.041 1.00 0.00 C ATOM 488 CZ PHE A 30 -25.175 6.009 -1.368 1.00 0.00 C ATOM 0 H PHE A 30 -19.421 4.434 1.829 1.00 0.00 H new ATOM 0 HA PHE A 30 -20.369 5.682 -0.601 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -21.443 3.741 0.612 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -21.881 4.832 1.912 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -22.338 4.165 -1.729 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -23.738 6.343 1.698 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -24.347 4.874 -3.000 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -25.748 7.052 0.429 1.00 0.00 H new ATOM 0 HZ PHE A 30 -26.049 6.318 -1.922 1.00 0.00 H new ATOM 498 N ASN A 31 -21.280 7.951 0.120 1.00 0.00 N ATOM 499 CA ASN A 31 -21.568 9.369 0.512 1.00 0.00 C ATOM 500 C ASN A 31 -20.252 10.150 0.674 1.00 0.00 C ATOM 501 O ASN A 31 -20.190 11.134 1.388 1.00 0.00 O ATOM 502 CB ASN A 31 -22.357 9.388 1.829 1.00 0.00 C ATOM 503 CG ASN A 31 -23.139 10.700 1.947 1.00 0.00 C ATOM 504 OD1 ASN A 31 -22.763 11.580 2.696 1.00 0.00 O ATOM 505 ND2 ASN A 31 -24.220 10.870 1.233 1.00 0.00 N ATOM 0 H ASN A 31 -21.520 7.717 -0.844 1.00 0.00 H new ATOM 0 HA ASN A 31 -22.162 9.843 -0.269 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -23.042 8.541 1.865 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -21.676 9.283 2.673 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -24.747 11.740 1.305 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -24.537 10.132 0.604 1.00 0.00 H new ATOM 512 N LYS A 32 -19.208 9.720 0.005 1.00 0.00 N ATOM 513 CA LYS A 32 -17.893 10.430 0.100 1.00 0.00 C ATOM 514 C LYS A 32 -16.940 9.914 -0.988 1.00 0.00 C ATOM 515 O LYS A 32 -17.172 8.878 -1.591 1.00 0.00 O ATOM 516 CB LYS A 32 -17.274 10.183 1.481 1.00 0.00 C ATOM 517 CG LYS A 32 -17.041 11.523 2.182 1.00 0.00 C ATOM 518 CD LYS A 32 -18.000 11.661 3.370 1.00 0.00 C ATOM 519 CE LYS A 32 -18.803 12.960 3.241 1.00 0.00 C ATOM 520 NZ LYS A 32 -18.533 13.837 4.417 1.00 0.00 N ATOM 0 H LYS A 32 -19.211 8.903 -0.606 1.00 0.00 H new ATOM 0 HA LYS A 32 -18.054 11.499 -0.042 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -17.934 9.557 2.081 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -16.331 9.645 1.378 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -16.009 11.589 2.526 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -17.196 12.343 1.480 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -18.676 10.807 3.404 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -17.439 11.661 4.304 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -18.532 13.476 2.320 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -19.868 12.736 3.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -18.969 14.768 4.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -18.935 13.404 5.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -17.506 13.951 4.536 1.00 0.00 H new ATOM 534 N LYS A 33 -15.868 10.630 -1.244 1.00 0.00 N ATOM 535 CA LYS A 33 -14.895 10.191 -2.292 1.00 0.00 C ATOM 536 C LYS A 33 -13.493 10.741 -1.978 1.00 0.00 C ATOM 537 O LYS A 33 -13.294 11.445 -1.003 1.00 0.00 O ATOM 538 CB LYS A 33 -15.355 10.702 -3.665 1.00 0.00 C ATOM 539 CG LYS A 33 -15.475 12.231 -3.643 1.00 0.00 C ATOM 540 CD LYS A 33 -14.617 12.831 -4.762 1.00 0.00 C ATOM 541 CE LYS A 33 -15.370 12.743 -6.093 1.00 0.00 C ATOM 542 NZ LYS A 33 -16.239 13.945 -6.258 1.00 0.00 N ATOM 0 H LYS A 33 -15.627 11.500 -0.770 1.00 0.00 H new ATOM 0 HA LYS A 33 -14.852 9.102 -2.304 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -14.644 10.396 -4.433 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -16.316 10.257 -3.924 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -16.516 12.526 -3.772 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -15.152 12.617 -2.676 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -14.381 13.871 -4.535 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -13.669 12.297 -4.833 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -14.662 12.678 -6.919 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -15.976 11.837 -6.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -16.749 13.883 -7.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -16.924 13.988 -5.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -15.651 14.802 -6.251 1.00 0.00 H new ATOM 556 N LYS A 34 -12.523 10.416 -2.804 1.00 0.00 N ATOM 557 CA LYS A 34 -11.128 10.901 -2.580 1.00 0.00 C ATOM 558 C LYS A 34 -11.093 12.427 -2.600 1.00 0.00 C ATOM 559 O LYS A 34 -11.723 13.065 -3.426 1.00 0.00 O ATOM 560 CB LYS A 34 -10.211 10.351 -3.679 1.00 0.00 C ATOM 561 CG LYS A 34 -8.777 10.244 -3.150 1.00 0.00 C ATOM 562 CD LYS A 34 -7.788 10.466 -4.298 1.00 0.00 C ATOM 563 CE LYS A 34 -6.873 11.649 -3.969 1.00 0.00 C ATOM 564 NZ LYS A 34 -7.628 12.926 -4.127 1.00 0.00 N ATOM 0 H LYS A 34 -12.644 9.830 -3.630 1.00 0.00 H new ATOM 0 HA LYS A 34 -10.782 10.551 -1.607 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -10.563 9.372 -4.003 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -10.239 11.005 -4.551 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -8.612 10.983 -2.366 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -8.616 9.263 -2.702 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -7.193 9.567 -4.457 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.329 10.659 -5.225 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -6.499 11.560 -2.949 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -6.005 11.644 -4.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -7.005 13.728 -3.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.964 13.012 -5.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -8.443 12.930 -3.481 1.00 0.00 H new ATOM 578 N ASN A 35 -10.359 12.997 -1.673 1.00 0.00 N ATOM 579 CA ASN A 35 -10.228 14.485 -1.557 1.00 0.00 C ATOM 580 C ASN A 35 -11.378 15.060 -0.715 1.00 0.00 C ATOM 581 O ASN A 35 -11.258 16.137 -0.158 1.00 0.00 O ATOM 582 CB ASN A 35 -10.214 15.145 -2.945 1.00 0.00 C ATOM 583 CG ASN A 35 -9.146 16.243 -2.982 1.00 0.00 C ATOM 584 OD1 ASN A 35 -8.241 16.197 -3.791 1.00 0.00 O ATOM 585 ND2 ASN A 35 -9.212 17.235 -2.135 1.00 0.00 N ATOM 0 H ASN A 35 -9.831 12.477 -0.973 1.00 0.00 H new ATOM 0 HA ASN A 35 -9.282 14.702 -1.062 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -10.009 14.398 -3.712 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -11.193 15.569 -3.167 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -8.504 17.969 -2.154 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -9.971 17.275 -1.455 1.00 0.00 H new ATOM 592 N ASP A 36 -12.483 14.353 -0.601 1.00 0.00 N ATOM 593 CA ASP A 36 -13.623 14.860 0.216 1.00 0.00 C ATOM 594 C ASP A 36 -13.376 14.520 1.688 1.00 0.00 C ATOM 595 O ASP A 36 -12.653 13.596 2.009 1.00 0.00 O ATOM 596 CB ASP A 36 -14.924 14.196 -0.252 1.00 0.00 C ATOM 597 CG ASP A 36 -16.127 15.034 0.196 1.00 0.00 C ATOM 598 OD1 ASP A 36 -16.500 15.939 -0.531 1.00 0.00 O ATOM 599 OD2 ASP A 36 -16.656 14.753 1.260 1.00 0.00 O ATOM 0 H ASP A 36 -12.638 13.446 -1.042 1.00 0.00 H new ATOM 0 HA ASP A 36 -13.707 15.940 0.098 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -14.922 14.097 -1.338 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -14.997 13.189 0.159 1.00 0.00 H new ATOM 604 N ILE A 37 -13.977 15.260 2.583 1.00 0.00 N ATOM 605 CA ILE A 37 -13.792 14.990 4.039 1.00 0.00 C ATOM 606 C ILE A 37 -14.631 13.771 4.433 1.00 0.00 C ATOM 607 O ILE A 37 -15.693 13.535 3.889 1.00 0.00 O ATOM 608 CB ILE A 37 -14.236 16.206 4.861 1.00 0.00 C ATOM 609 CG1 ILE A 37 -13.615 17.486 4.280 1.00 0.00 C ATOM 610 CG2 ILE A 37 -13.790 16.034 6.316 1.00 0.00 C ATOM 611 CD1 ILE A 37 -12.085 17.402 4.336 1.00 0.00 C ATOM 0 H ILE A 37 -14.592 16.044 2.366 1.00 0.00 H new ATOM 0 HA ILE A 37 -12.738 14.795 4.239 1.00 0.00 H new ATOM 0 HB ILE A 37 -15.322 16.286 4.821 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -13.942 17.623 3.249 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -13.960 18.354 4.842 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -14.107 16.899 6.898 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -14.241 15.133 6.731 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -12.704 15.947 6.356 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -11.655 18.314 3.922 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -11.765 17.287 5.372 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -11.746 16.545 3.754 1.00 0.00 H new ATOM 623 N VAL A 38 -14.156 13.000 5.376 1.00 0.00 N ATOM 624 CA VAL A 38 -14.907 11.789 5.821 1.00 0.00 C ATOM 625 C VAL A 38 -16.066 12.198 6.734 1.00 0.00 C ATOM 626 O VAL A 38 -15.942 13.089 7.557 1.00 0.00 O ATOM 627 CB VAL A 38 -13.968 10.836 6.581 1.00 0.00 C ATOM 628 CG1 VAL A 38 -13.459 11.500 7.863 1.00 0.00 C ATOM 629 CG2 VAL A 38 -14.727 9.560 6.957 1.00 0.00 C ATOM 0 H VAL A 38 -13.273 13.159 5.861 1.00 0.00 H new ATOM 0 HA VAL A 38 -15.302 11.280 4.942 1.00 0.00 H new ATOM 0 HB VAL A 38 -13.122 10.595 5.937 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -12.796 10.814 8.390 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -12.913 12.409 7.610 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -14.305 11.751 8.503 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -14.061 8.886 7.495 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -15.576 9.815 7.592 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -15.085 9.070 6.052 1.00 0.00 H new ATOM 639 N ASP A 39 -17.183 11.531 6.600 1.00 0.00 N ATOM 640 CA ASP A 39 -18.356 11.839 7.460 1.00 0.00 C ATOM 641 C ASP A 39 -18.059 11.319 8.872 1.00 0.00 C ATOM 642 O ASP A 39 -17.723 10.160 9.036 1.00 0.00 O ATOM 643 CB ASP A 39 -19.602 11.142 6.897 1.00 0.00 C ATOM 644 CG ASP A 39 -20.852 11.633 7.635 1.00 0.00 C ATOM 645 OD1 ASP A 39 -21.336 12.701 7.296 1.00 0.00 O ATOM 646 OD2 ASP A 39 -21.303 10.933 8.525 1.00 0.00 O ATOM 0 H ASP A 39 -17.330 10.781 5.925 1.00 0.00 H new ATOM 0 HA ASP A 39 -18.539 12.913 7.486 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -19.694 11.348 5.831 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -19.506 10.062 7.006 1.00 0.00 H new ATOM 651 N PRO A 40 -18.175 12.191 9.847 1.00 0.00 N ATOM 652 CA PRO A 40 -17.899 11.844 11.255 1.00 0.00 C ATOM 653 C PRO A 40 -18.987 10.924 11.814 1.00 0.00 C ATOM 654 O PRO A 40 -18.700 10.015 12.574 1.00 0.00 O ATOM 655 CB PRO A 40 -17.872 13.198 11.968 1.00 0.00 C ATOM 656 CG PRO A 40 -18.659 14.176 11.068 1.00 0.00 C ATOM 657 CD PRO A 40 -18.608 13.591 9.644 1.00 0.00 C ATOM 0 HA PRO A 40 -16.967 11.295 11.385 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -18.327 13.127 12.956 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -16.848 13.541 12.113 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -19.689 14.276 11.410 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -18.216 15.172 11.095 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -19.582 13.641 9.157 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -17.908 14.138 9.013 1.00 0.00 H new ATOM 665 N SER A 41 -20.226 11.128 11.426 1.00 0.00 N ATOM 666 CA SER A 41 -21.321 10.236 11.914 1.00 0.00 C ATOM 667 C SER A 41 -21.034 8.807 11.429 1.00 0.00 C ATOM 668 O SER A 41 -21.416 7.839 12.062 1.00 0.00 O ATOM 669 CB SER A 41 -22.665 10.711 11.357 1.00 0.00 C ATOM 670 OG SER A 41 -23.692 10.421 12.296 1.00 0.00 O ATOM 0 H SER A 41 -20.522 11.872 10.794 1.00 0.00 H new ATOM 0 HA SER A 41 -21.366 10.261 13.003 1.00 0.00 H new ATOM 0 HB2 SER A 41 -22.631 11.782 11.157 1.00 0.00 H new ATOM 0 HB3 SER A 41 -22.874 10.216 10.408 1.00 0.00 H new ATOM 0 HG SER A 41 -24.554 10.726 11.943 1.00 0.00 H new ATOM 676 N LYS A 42 -20.347 8.681 10.313 1.00 0.00 N ATOM 677 CA LYS A 42 -20.003 7.338 9.766 1.00 0.00 C ATOM 678 C LYS A 42 -18.708 6.824 10.417 1.00 0.00 C ATOM 679 O LYS A 42 -18.489 5.630 10.494 1.00 0.00 O ATOM 680 CB LYS A 42 -19.806 7.439 8.251 1.00 0.00 C ATOM 681 CG LYS A 42 -21.155 7.691 7.570 1.00 0.00 C ATOM 682 CD LYS A 42 -21.540 6.471 6.730 1.00 0.00 C ATOM 683 CE LYS A 42 -22.752 6.810 5.857 1.00 0.00 C ATOM 684 NZ LYS A 42 -22.295 7.453 4.591 1.00 0.00 N ATOM 0 H LYS A 42 -20.009 9.466 9.756 1.00 0.00 H new ATOM 0 HA LYS A 42 -20.815 6.644 9.984 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -19.113 8.248 8.018 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -19.362 6.519 7.870 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -21.922 7.886 8.320 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -21.095 8.577 6.938 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -20.701 6.169 6.103 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -21.772 5.628 7.380 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -23.316 5.904 5.633 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -23.424 7.479 6.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -23.106 7.574 3.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -21.880 8.383 4.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -21.580 6.851 4.134 1.00 0.00 H new ATOM 698 N ILE A 43 -17.851 7.715 10.885 1.00 0.00 N ATOM 699 CA ILE A 43 -16.569 7.277 11.532 1.00 0.00 C ATOM 700 C ILE A 43 -16.880 6.332 12.697 1.00 0.00 C ATOM 701 O ILE A 43 -17.382 6.742 13.730 1.00 0.00 O ATOM 702 CB ILE A 43 -15.796 8.495 12.058 1.00 0.00 C ATOM 703 CG1 ILE A 43 -15.294 9.333 10.879 1.00 0.00 C ATOM 704 CG2 ILE A 43 -14.596 8.021 12.888 1.00 0.00 C ATOM 705 CD1 ILE A 43 -14.656 10.625 11.396 1.00 0.00 C ATOM 0 H ILE A 43 -17.988 8.725 10.845 1.00 0.00 H new ATOM 0 HA ILE A 43 -15.959 6.761 10.791 1.00 0.00 H new ATOM 0 HB ILE A 43 -16.456 9.099 12.680 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -14.567 8.764 10.300 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -16.121 9.568 10.209 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -14.047 8.886 13.261 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -14.948 7.424 13.729 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -13.938 7.416 12.264 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -14.300 11.218 10.553 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -15.396 11.197 11.956 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -13.817 10.381 12.048 1.00 0.00 H new ATOM 717 N GLU A 44 -16.579 5.070 12.530 1.00 0.00 N ATOM 718 CA GLU A 44 -16.836 4.074 13.610 1.00 0.00 C ATOM 719 C GLU A 44 -15.511 3.695 14.279 1.00 0.00 C ATOM 720 O GLU A 44 -15.476 3.341 15.444 1.00 0.00 O ATOM 721 CB GLU A 44 -17.478 2.823 13.009 1.00 0.00 C ATOM 722 CG GLU A 44 -18.961 3.089 12.738 1.00 0.00 C ATOM 723 CD GLU A 44 -19.735 1.767 12.752 1.00 0.00 C ATOM 724 OE1 GLU A 44 -19.843 1.155 11.700 1.00 0.00 O ATOM 725 OE2 GLU A 44 -20.208 1.389 13.811 1.00 0.00 O ATOM 0 H GLU A 44 -16.162 4.685 11.683 1.00 0.00 H new ATOM 0 HA GLU A 44 -17.508 4.507 14.351 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -16.972 2.551 12.083 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -17.368 1.981 13.692 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -19.363 3.765 13.493 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -19.081 3.582 11.773 1.00 0.00 H new ATOM 732 N LYS A 45 -14.421 3.769 13.547 1.00 0.00 N ATOM 733 CA LYS A 45 -13.089 3.416 14.125 1.00 0.00 C ATOM 734 C LYS A 45 -12.013 4.355 13.567 1.00 0.00 C ATOM 735 O LYS A 45 -11.903 4.544 12.368 1.00 0.00 O ATOM 736 CB LYS A 45 -12.741 1.969 13.763 1.00 0.00 C ATOM 737 CG LYS A 45 -13.080 1.048 14.938 1.00 0.00 C ATOM 738 CD LYS A 45 -13.136 -0.404 14.452 1.00 0.00 C ATOM 739 CE LYS A 45 -14.591 -0.803 14.184 1.00 0.00 C ATOM 740 NZ LYS A 45 -14.980 -0.391 12.803 1.00 0.00 N ATOM 0 H LYS A 45 -14.401 4.061 12.570 1.00 0.00 H new ATOM 0 HA LYS A 45 -13.130 3.522 15.209 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -13.296 1.662 12.876 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -11.681 1.889 13.520 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -12.330 1.151 15.722 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -14.038 1.334 15.373 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -12.545 -0.517 13.543 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -12.699 -1.065 15.200 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -14.710 -1.880 14.299 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -15.248 -0.330 14.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -15.850 -0.888 12.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -15.146 0.635 12.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -14.216 -0.633 12.140 1.00 0.00 H new ATOM 754 N THR A 46 -11.215 4.936 14.433 1.00 0.00 N ATOM 755 CA THR A 46 -10.135 5.860 13.974 1.00 0.00 C ATOM 756 C THR A 46 -8.771 5.217 14.252 1.00 0.00 C ATOM 757 O THR A 46 -8.350 5.097 15.389 1.00 0.00 O ATOM 758 CB THR A 46 -10.245 7.200 14.717 1.00 0.00 C ATOM 759 OG1 THR A 46 -11.532 7.762 14.493 1.00 0.00 O ATOM 760 CG2 THR A 46 -9.173 8.165 14.205 1.00 0.00 C ATOM 0 H THR A 46 -11.268 4.807 15.443 1.00 0.00 H new ATOM 0 HA THR A 46 -10.239 6.042 12.904 1.00 0.00 H new ATOM 0 HB THR A 46 -10.100 7.032 15.784 1.00 0.00 H new ATOM 0 HG1 THR A 46 -11.603 8.616 14.968 1.00 0.00 H new ATOM 0 HG21 THR A 46 -9.255 9.114 14.735 1.00 0.00 H new ATOM 0 HG22 THR A 46 -8.186 7.737 14.378 1.00 0.00 H new ATOM 0 HG23 THR A 46 -9.314 8.332 13.137 1.00 0.00 H new ATOM 768 N PHE A 47 -8.086 4.799 13.215 1.00 0.00 N ATOM 769 CA PHE A 47 -6.752 4.154 13.382 1.00 0.00 C ATOM 770 C PHE A 47 -5.655 5.092 12.875 1.00 0.00 C ATOM 771 O PHE A 47 -5.810 5.760 11.872 1.00 0.00 O ATOM 772 CB PHE A 47 -6.705 2.859 12.573 1.00 0.00 C ATOM 773 CG PHE A 47 -7.338 1.734 13.356 1.00 0.00 C ATOM 774 CD1 PHE A 47 -8.732 1.614 13.418 1.00 0.00 C ATOM 775 CD2 PHE A 47 -6.526 0.808 14.016 1.00 0.00 C ATOM 776 CE1 PHE A 47 -9.310 0.566 14.143 1.00 0.00 C ATOM 777 CE2 PHE A 47 -7.103 -0.238 14.741 1.00 0.00 C ATOM 778 CZ PHE A 47 -8.495 -0.360 14.804 1.00 0.00 C ATOM 0 H PHE A 47 -8.402 4.880 12.248 1.00 0.00 H new ATOM 0 HA PHE A 47 -6.593 3.939 14.439 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -7.229 2.993 11.627 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -5.672 2.609 12.333 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -9.360 2.329 12.907 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -5.451 0.901 13.966 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -10.385 0.472 14.192 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -6.474 -0.952 15.252 1.00 0.00 H new ATOM 0 HZ PHE A 47 -8.941 -1.169 15.363 1.00 0.00 H new ATOM 788 N ILE A 48 -4.551 5.141 13.568 1.00 0.00 N ATOM 789 CA ILE A 48 -3.420 6.025 13.152 1.00 0.00 C ATOM 790 C ILE A 48 -2.096 5.291 13.384 1.00 0.00 C ATOM 791 O ILE A 48 -1.947 4.560 14.347 1.00 0.00 O ATOM 792 CB ILE A 48 -3.433 7.322 13.975 1.00 0.00 C ATOM 793 CG1 ILE A 48 -4.788 7.472 14.686 1.00 0.00 C ATOM 794 CG2 ILE A 48 -3.197 8.514 13.044 1.00 0.00 C ATOM 795 CD1 ILE A 48 -4.910 8.866 15.292 1.00 0.00 C ATOM 0 H ILE A 48 -4.380 4.600 14.416 1.00 0.00 H new ATOM 0 HA ILE A 48 -3.529 6.273 12.096 1.00 0.00 H new ATOM 0 HB ILE A 48 -2.643 7.287 14.725 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -5.600 7.302 13.978 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -4.883 6.718 15.467 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -3.206 9.436 13.625 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -2.231 8.405 12.551 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -3.986 8.551 12.293 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -5.873 8.962 15.793 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -4.108 9.020 16.014 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -4.836 9.614 14.502 1.00 0.00 H new ATOM 807 N ARG A 49 -1.134 5.481 12.508 1.00 0.00 N ATOM 808 CA ARG A 49 0.188 4.797 12.672 1.00 0.00 C ATOM 809 C ARG A 49 0.790 5.181 14.030 1.00 0.00 C ATOM 810 O ARG A 49 1.223 6.302 14.234 1.00 0.00 O ATOM 811 CB ARG A 49 1.134 5.224 11.543 1.00 0.00 C ATOM 812 CG ARG A 49 0.759 4.484 10.256 1.00 0.00 C ATOM 813 CD ARG A 49 1.268 5.265 9.039 1.00 0.00 C ATOM 814 NE ARG A 49 0.530 6.557 8.920 1.00 0.00 N ATOM 815 CZ ARG A 49 0.844 7.403 7.975 1.00 0.00 C ATOM 816 NH1 ARG A 49 0.632 7.093 6.721 1.00 0.00 N ATOM 817 NH2 ARG A 49 1.369 8.560 8.283 1.00 0.00 N ATOM 0 H ARG A 49 -1.210 6.081 11.687 1.00 0.00 H new ATOM 0 HA ARG A 49 0.049 3.717 12.629 1.00 0.00 H new ATOM 0 HB2 ARG A 49 1.070 6.301 11.388 1.00 0.00 H new ATOM 0 HB3 ARG A 49 2.166 5.002 11.815 1.00 0.00 H new ATOM 0 HG2 ARG A 49 1.190 3.483 10.263 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -0.323 4.365 10.196 1.00 0.00 H new ATOM 0 HD2 ARG A 49 2.337 5.454 9.138 1.00 0.00 H new ATOM 0 HD3 ARG A 49 1.132 4.674 8.134 1.00 0.00 H new ATOM 0 HE ARG A 49 -0.219 6.779 9.576 1.00 0.00 H new ATOM 0 HH11 ARG A 49 0.221 6.191 6.481 1.00 0.00 H new ATOM 0 HH12 ARG A 49 0.877 7.754 5.984 1.00 0.00 H new ATOM 0 HH21 ARG A 49 1.533 8.802 9.260 1.00 0.00 H new ATOM 0 HH22 ARG A 49 1.614 9.221 7.546 1.00 0.00 H new ATOM 928 N MET B 1 0.175 -10.967 15.029 1.00 0.00 N ATOM 929 CA MET B 1 -1.021 -10.164 14.639 1.00 0.00 C ATOM 930 C MET B 1 -1.952 -11.016 13.768 1.00 0.00 C ATOM 931 O MET B 1 -1.758 -11.143 12.571 1.00 0.00 O ATOM 932 CB MET B 1 -0.572 -8.930 13.851 1.00 0.00 C ATOM 933 CG MET B 1 -0.404 -7.740 14.800 1.00 0.00 C ATOM 934 SD MET B 1 1.152 -6.871 14.448 1.00 0.00 S ATOM 935 CE MET B 1 1.183 -7.076 12.648 1.00 0.00 C ATOM 0 H1 MET B 1 0.594 -10.569 15.894 1.00 0.00 H new ATOM 0 H2 MET B 1 -0.110 -11.952 15.204 1.00 0.00 H new ATOM 0 H3 MET B 1 0.876 -10.941 14.261 1.00 0.00 H new ATOM 0 HA MET B 1 -1.554 -9.849 15.536 1.00 0.00 H new ATOM 0 HB2 MET B 1 0.369 -9.136 13.341 1.00 0.00 H new ATOM 0 HB3 MET B 1 -1.306 -8.692 13.081 1.00 0.00 H new ATOM 0 HG2 MET B 1 -1.245 -7.055 14.688 1.00 0.00 H new ATOM 0 HG3 MET B 1 -0.410 -8.086 15.834 1.00 0.00 H new ATOM 0 HE1 MET B 1 1.700 -6.230 12.194 1.00 0.00 H new ATOM 0 HE2 MET B 1 1.706 -7.998 12.396 1.00 0.00 H new ATOM 0 HE3 MET B 1 0.162 -7.123 12.269 1.00 0.00 H new ATOM 947 N LYS B 2 -2.962 -11.597 14.365 1.00 0.00 N ATOM 948 CA LYS B 2 -3.917 -12.441 13.593 1.00 0.00 C ATOM 949 C LYS B 2 -4.893 -11.548 12.826 1.00 0.00 C ATOM 950 O LYS B 2 -5.203 -10.444 13.235 1.00 0.00 O ATOM 951 CB LYS B 2 -4.699 -13.365 14.536 1.00 0.00 C ATOM 952 CG LYS B 2 -5.285 -12.567 15.708 1.00 0.00 C ATOM 953 CD LYS B 2 -4.751 -13.128 17.030 1.00 0.00 C ATOM 954 CE LYS B 2 -4.336 -11.975 17.949 1.00 0.00 C ATOM 955 NZ LYS B 2 -4.205 -12.471 19.349 1.00 0.00 N ATOM 0 H LYS B 2 -3.165 -11.521 15.362 1.00 0.00 H new ATOM 0 HA LYS B 2 -3.352 -13.052 12.889 1.00 0.00 H new ATOM 0 HB2 LYS B 2 -5.501 -13.859 13.988 1.00 0.00 H new ATOM 0 HB3 LYS B 2 -4.042 -14.148 14.914 1.00 0.00 H new ATOM 0 HG2 LYS B 2 -5.018 -11.514 15.614 1.00 0.00 H new ATOM 0 HG3 LYS B 2 -6.373 -12.623 15.691 1.00 0.00 H new ATOM 0 HD2 LYS B 2 -5.516 -13.735 17.514 1.00 0.00 H new ATOM 0 HD3 LYS B 2 -3.899 -13.781 16.842 1.00 0.00 H new ATOM 0 HE2 LYS B 2 -3.389 -11.552 17.613 1.00 0.00 H new ATOM 0 HE3 LYS B 2 -5.076 -11.176 17.904 1.00 0.00 H new ATOM 0 HZ1 LYS B 2 -3.923 -11.686 19.970 1.00 0.00 H new ATOM 0 HZ2 LYS B 2 -5.117 -12.855 19.668 1.00 0.00 H new ATOM 0 HZ3 LYS B 2 -3.483 -13.218 19.386 1.00 0.00 H new ATOM 969 N ILE B 3 -5.371 -12.035 11.716 1.00 0.00 N ATOM 970 CA ILE B 3 -6.331 -11.250 10.882 1.00 0.00 C ATOM 971 C ILE B 3 -7.723 -11.302 11.519 1.00 0.00 C ATOM 972 O ILE B 3 -8.373 -12.333 11.543 1.00 0.00 O ATOM 973 CB ILE B 3 -6.372 -11.830 9.458 1.00 0.00 C ATOM 974 CG1 ILE B 3 -5.138 -11.358 8.676 1.00 0.00 C ATOM 975 CG2 ILE B 3 -7.633 -11.353 8.731 1.00 0.00 C ATOM 976 CD1 ILE B 3 -4.053 -12.433 8.712 1.00 0.00 C ATOM 0 H ILE B 3 -5.136 -12.955 11.344 1.00 0.00 H new ATOM 0 HA ILE B 3 -6.006 -10.211 10.829 1.00 0.00 H new ATOM 0 HB ILE B 3 -6.380 -12.918 9.522 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -5.413 -11.141 7.644 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -4.758 -10.431 9.106 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -7.652 -11.769 7.724 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -8.516 -11.685 9.278 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -7.630 -10.265 8.673 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -3.182 -12.089 8.155 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -3.769 -12.628 9.746 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -4.434 -13.349 8.261 1.00 0.00 H new ATOM 988 N LYS B 4 -8.178 -10.185 12.026 1.00 0.00 N ATOM 989 CA LYS B 4 -9.525 -10.122 12.656 1.00 0.00 C ATOM 990 C LYS B 4 -10.568 -9.823 11.576 1.00 0.00 C ATOM 991 O LYS B 4 -11.662 -10.360 11.597 1.00 0.00 O ATOM 992 CB LYS B 4 -9.543 -9.009 13.709 1.00 0.00 C ATOM 993 CG LYS B 4 -10.605 -9.317 14.770 1.00 0.00 C ATOM 994 CD LYS B 4 -11.831 -8.429 14.542 1.00 0.00 C ATOM 995 CE LYS B 4 -12.716 -8.444 15.792 1.00 0.00 C ATOM 996 NZ LYS B 4 -12.240 -7.414 16.759 1.00 0.00 N ATOM 0 H LYS B 4 -7.664 -9.304 12.029 1.00 0.00 H new ATOM 0 HA LYS B 4 -9.755 -11.074 13.134 1.00 0.00 H new ATOM 0 HB2 LYS B 4 -8.562 -8.922 14.177 1.00 0.00 H new ATOM 0 HB3 LYS B 4 -9.756 -8.051 13.235 1.00 0.00 H new ATOM 0 HG2 LYS B 4 -10.890 -10.368 14.719 1.00 0.00 H new ATOM 0 HG3 LYS B 4 -10.199 -9.145 15.767 1.00 0.00 H new ATOM 0 HD2 LYS B 4 -11.517 -7.409 14.318 1.00 0.00 H new ATOM 0 HD3 LYS B 4 -12.395 -8.785 13.680 1.00 0.00 H new ATOM 0 HE2 LYS B 4 -13.752 -8.247 15.518 1.00 0.00 H new ATOM 0 HE3 LYS B 4 -12.691 -9.430 16.255 1.00 0.00 H new ATOM 0 HZ1 LYS B 4 -13.046 -6.841 17.081 1.00 0.00 H new ATOM 0 HZ2 LYS B 4 -11.800 -7.882 17.577 1.00 0.00 H new ATOM 0 HZ3 LYS B 4 -11.541 -6.799 16.295 1.00 0.00 H new ATOM 1010 N ARG B 5 -10.232 -8.971 10.632 1.00 0.00 N ATOM 1011 CA ARG B 5 -11.192 -8.624 9.542 1.00 0.00 C ATOM 1012 C ARG B 5 -10.431 -8.392 8.230 1.00 0.00 C ATOM 1013 O ARG B 5 -9.221 -8.264 8.216 1.00 0.00 O ATOM 1014 CB ARG B 5 -11.951 -7.347 9.913 1.00 0.00 C ATOM 1015 CG ARG B 5 -12.942 -7.637 11.043 1.00 0.00 C ATOM 1016 CD ARG B 5 -13.482 -6.317 11.603 1.00 0.00 C ATOM 1017 NE ARG B 5 -12.434 -5.660 12.438 1.00 0.00 N ATOM 1018 CZ ARG B 5 -12.675 -4.503 12.997 1.00 0.00 C ATOM 1019 NH1 ARG B 5 -12.453 -3.398 12.332 1.00 0.00 N ATOM 1020 NH2 ARG B 5 -13.141 -4.451 14.217 1.00 0.00 N ATOM 0 H ARG B 5 -9.328 -8.501 10.574 1.00 0.00 H new ATOM 0 HA ARG B 5 -11.895 -9.447 9.414 1.00 0.00 H new ATOM 0 HB2 ARG B 5 -11.248 -6.574 10.224 1.00 0.00 H new ATOM 0 HB3 ARG B 5 -12.482 -6.964 9.042 1.00 0.00 H new ATOM 0 HG2 ARG B 5 -13.764 -8.250 10.672 1.00 0.00 H new ATOM 0 HG3 ARG B 5 -12.452 -8.206 11.833 1.00 0.00 H new ATOM 0 HD2 ARG B 5 -13.777 -5.658 10.787 1.00 0.00 H new ATOM 0 HD3 ARG B 5 -14.374 -6.502 12.201 1.00 0.00 H new ATOM 0 HE ARG B 5 -11.530 -6.113 12.572 1.00 0.00 H new ATOM 0 HH11 ARG B 5 -12.092 -3.440 11.379 1.00 0.00 H new ATOM 0 HH12 ARG B 5 -12.641 -2.495 12.767 1.00 0.00 H new ATOM 0 HH21 ARG B 5 -13.317 -5.313 14.733 1.00 0.00 H new ATOM 0 HH22 ARG B 5 -13.329 -3.548 14.653 1.00 0.00 H new ATOM 1034 N ILE B 6 -11.143 -8.332 7.130 1.00 0.00 N ATOM 1035 CA ILE B 6 -10.492 -8.105 5.804 1.00 0.00 C ATOM 1036 C ILE B 6 -10.983 -6.779 5.218 1.00 0.00 C ATOM 1037 O ILE B 6 -12.173 -6.562 5.062 1.00 0.00 O ATOM 1038 CB ILE B 6 -10.851 -9.247 4.840 1.00 0.00 C ATOM 1039 CG1 ILE B 6 -10.664 -10.607 5.533 1.00 0.00 C ATOM 1040 CG2 ILE B 6 -9.959 -9.176 3.595 1.00 0.00 C ATOM 1041 CD1 ILE B 6 -9.193 -10.810 5.912 1.00 0.00 C ATOM 0 H ILE B 6 -12.158 -8.432 7.096 1.00 0.00 H new ATOM 0 HA ILE B 6 -9.411 -8.074 5.938 1.00 0.00 H new ATOM 0 HB ILE B 6 -11.895 -9.141 4.544 1.00 0.00 H new ATOM 0 HG12 ILE B 6 -11.287 -10.657 6.426 1.00 0.00 H new ATOM 0 HG13 ILE B 6 -10.990 -11.409 4.871 1.00 0.00 H new ATOM 0 HG21 ILE B 6 -10.218 -9.988 2.915 1.00 0.00 H new ATOM 0 HG22 ILE B 6 -10.110 -8.220 3.093 1.00 0.00 H new ATOM 0 HG23 ILE B 6 -8.914 -9.269 3.890 1.00 0.00 H new ATOM 0 HD11 ILE B 6 -9.074 -11.776 6.402 1.00 0.00 H new ATOM 0 HD12 ILE B 6 -8.578 -10.781 5.012 1.00 0.00 H new ATOM 0 HD13 ILE B 6 -8.880 -10.018 6.592 1.00 0.00 H new ATOM 1053 N LEU B 7 -10.073 -5.898 4.883 1.00 0.00 N ATOM 1054 CA LEU B 7 -10.463 -4.589 4.295 1.00 0.00 C ATOM 1055 C LEU B 7 -10.435 -4.723 2.770 1.00 0.00 C ATOM 1056 O LEU B 7 -11.379 -4.375 2.087 1.00 0.00 O ATOM 1057 CB LEU B 7 -9.478 -3.517 4.751 1.00 0.00 C ATOM 1058 CG LEU B 7 -9.488 -3.450 6.279 1.00 0.00 C ATOM 1059 CD1 LEU B 7 -8.124 -2.980 6.790 1.00 0.00 C ATOM 1060 CD2 LEU B 7 -10.566 -2.473 6.740 1.00 0.00 C ATOM 0 H LEU B 7 -9.069 -6.036 4.995 1.00 0.00 H new ATOM 0 HA LEU B 7 -11.463 -4.303 4.621 1.00 0.00 H new ATOM 0 HB2 LEU B 7 -8.476 -3.749 4.391 1.00 0.00 H new ATOM 0 HB3 LEU B 7 -9.752 -2.550 4.330 1.00 0.00 H new ATOM 0 HG LEU B 7 -9.698 -4.442 6.678 1.00 0.00 H new ATOM 0 HD11 LEU B 7 -8.139 -2.935 7.879 1.00 0.00 H new ATOM 0 HD12 LEU B 7 -7.353 -3.680 6.467 1.00 0.00 H new ATOM 0 HD13 LEU B 7 -7.907 -1.990 6.389 1.00 0.00 H new ATOM 0 HD21 LEU B 7 -10.573 -2.426 7.829 1.00 0.00 H new ATOM 0 HD22 LEU B 7 -10.357 -1.483 6.335 1.00 0.00 H new ATOM 0 HD23 LEU B 7 -11.540 -2.812 6.386 1.00 0.00 H new ATOM 1072 N ASN B 8 -9.360 -5.267 2.251 1.00 0.00 N ATOM 1073 CA ASN B 8 -9.237 -5.489 0.776 1.00 0.00 C ATOM 1074 C ASN B 8 -7.985 -6.342 0.491 1.00 0.00 C ATOM 1075 O ASN B 8 -7.426 -6.949 1.387 1.00 0.00 O ATOM 1076 CB ASN B 8 -9.204 -4.148 0.013 1.00 0.00 C ATOM 1077 CG ASN B 8 -7.872 -3.424 0.204 1.00 0.00 C ATOM 1078 OD1 ASN B 8 -6.876 -3.788 -0.382 1.00 0.00 O ATOM 1079 ND2 ASN B 8 -7.816 -2.383 0.981 1.00 0.00 N ATOM 0 H ASN B 8 -8.552 -5.570 2.795 1.00 0.00 H new ATOM 0 HA ASN B 8 -10.113 -6.030 0.419 1.00 0.00 H new ATOM 0 HB2 ASN B 8 -9.371 -4.329 -1.049 1.00 0.00 H new ATOM 0 HB3 ASN B 8 -10.018 -3.511 0.360 1.00 0.00 H new ATOM 0 HD21 ASN B 8 -6.937 -1.878 1.094 1.00 0.00 H new ATOM 0 HD22 ASN B 8 -8.651 -2.071 1.477 1.00 0.00 H new ATOM 1086 N HIS B 9 -7.560 -6.415 -0.749 1.00 0.00 N ATOM 1087 CA HIS B 9 -6.365 -7.253 -1.109 1.00 0.00 C ATOM 1088 C HIS B 9 -5.107 -6.810 -0.338 1.00 0.00 C ATOM 1089 O HIS B 9 -4.226 -7.610 -0.077 1.00 0.00 O ATOM 1090 CB HIS B 9 -6.102 -7.126 -2.613 1.00 0.00 C ATOM 1091 CG HIS B 9 -5.176 -8.225 -3.062 1.00 0.00 C ATOM 1092 ND1 HIS B 9 -3.836 -8.231 -3.357 1.00 0.00 N flip ATOM 1093 CD2 HIS B 9 -5.613 -9.525 -3.260 1.00 0.00 C flip ATOM 1094 CE1 HIS B 9 -3.444 -9.513 -3.732 1.00 0.00 C flip ATOM 1095 NE2 HIS B 9 -4.553 -10.253 -3.656 1.00 0.00 N flip ATOM 0 H HIS B 9 -7.991 -5.927 -1.534 1.00 0.00 H new ATOM 0 HA HIS B 9 -6.580 -8.287 -0.840 1.00 0.00 H new ATOM 0 HB2 HIS B 9 -7.042 -7.183 -3.162 1.00 0.00 H new ATOM 0 HB3 HIS B 9 -5.662 -6.154 -2.834 1.00 0.00 H new ATOM 0 HD2 HIS B 9 -6.621 -9.888 -3.122 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -2.456 -9.839 -4.022 1.00 0.00 H new ATOM 0 HE2 HIS B 9 -4.592 -11.249 -3.872 1.00 0.00 H new ATOM 1103 N ASN B 10 -5.002 -5.547 -0.001 1.00 0.00 N ATOM 1104 CA ASN B 10 -3.792 -5.047 0.717 1.00 0.00 C ATOM 1105 C ASN B 10 -4.122 -4.624 2.149 1.00 0.00 C ATOM 1106 O ASN B 10 -3.261 -4.640 3.007 1.00 0.00 O ATOM 1107 CB ASN B 10 -3.230 -3.836 -0.032 1.00 0.00 C ATOM 1108 CG ASN B 10 -3.409 -4.016 -1.546 1.00 0.00 C ATOM 1109 OD1 ASN B 10 -2.837 -4.910 -2.138 1.00 0.00 O ATOM 1110 ND2 ASN B 10 -4.188 -3.198 -2.201 1.00 0.00 N ATOM 0 H ASN B 10 -5.709 -4.838 -0.195 1.00 0.00 H new ATOM 0 HA ASN B 10 -3.064 -5.857 0.754 1.00 0.00 H new ATOM 0 HB2 ASN B 10 -3.738 -2.929 0.296 1.00 0.00 H new ATOM 0 HB3 ASN B 10 -2.173 -3.712 0.204 1.00 0.00 H new ATOM 0 HD21 ASN B 10 -4.315 -3.310 -3.207 1.00 0.00 H new ATOM 0 HD22 ASN B 10 -4.669 -2.447 -1.707 1.00 0.00 H new ATOM 1117 N ALA B 11 -5.339 -4.229 2.417 1.00 0.00 N ATOM 1118 CA ALA B 11 -5.682 -3.786 3.794 1.00 0.00 C ATOM 1119 C ALA B 11 -6.386 -4.908 4.555 1.00 0.00 C ATOM 1120 O ALA B 11 -7.296 -5.540 4.054 1.00 0.00 O ATOM 1121 CB ALA B 11 -6.589 -2.557 3.722 1.00 0.00 C ATOM 0 H ALA B 11 -6.104 -4.195 1.744 1.00 0.00 H new ATOM 0 HA ALA B 11 -4.764 -3.531 4.324 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -6.841 -2.231 4.731 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -6.071 -1.753 3.200 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -7.502 -2.810 3.184 1.00 0.00 H new ATOM 1127 N ILE B 12 -5.960 -5.146 5.768 1.00 0.00 N ATOM 1128 CA ILE B 12 -6.577 -6.211 6.609 1.00 0.00 C ATOM 1129 C ILE B 12 -6.580 -5.744 8.068 1.00 0.00 C ATOM 1130 O ILE B 12 -5.602 -5.200 8.553 1.00 0.00 O ATOM 1131 CB ILE B 12 -5.758 -7.507 6.490 1.00 0.00 C ATOM 1132 CG1 ILE B 12 -5.643 -7.930 5.018 1.00 0.00 C ATOM 1133 CG2 ILE B 12 -6.435 -8.622 7.289 1.00 0.00 C ATOM 1134 CD1 ILE B 12 -7.016 -8.340 4.479 1.00 0.00 C ATOM 0 H ILE B 12 -5.198 -4.638 6.217 1.00 0.00 H new ATOM 0 HA ILE B 12 -7.596 -6.401 6.274 1.00 0.00 H new ATOM 0 HB ILE B 12 -4.759 -7.328 6.888 1.00 0.00 H new ATOM 0 HG12 ILE B 12 -5.242 -7.108 4.426 1.00 0.00 H new ATOM 0 HG13 ILE B 12 -4.944 -8.761 4.924 1.00 0.00 H new ATOM 0 HG21 ILE B 12 -5.851 -9.538 7.202 1.00 0.00 H new ATOM 0 HG22 ILE B 12 -6.499 -8.331 8.337 1.00 0.00 H new ATOM 0 HG23 ILE B 12 -7.438 -8.792 6.898 1.00 0.00 H new ATOM 0 HD11 ILE B 12 -6.923 -8.638 3.435 1.00 0.00 H new ATOM 0 HD12 ILE B 12 -7.401 -9.177 5.062 1.00 0.00 H new ATOM 0 HD13 ILE B 12 -7.703 -7.498 4.556 1.00 0.00 H new ATOM 1146 N VAL B 13 -7.664 -5.958 8.774 1.00 0.00 N ATOM 1147 CA VAL B 13 -7.721 -5.533 10.201 1.00 0.00 C ATOM 1148 C VAL B 13 -7.162 -6.657 11.069 1.00 0.00 C ATOM 1149 O VAL B 13 -7.764 -7.705 11.198 1.00 0.00 O ATOM 1150 CB VAL B 13 -9.168 -5.242 10.617 1.00 0.00 C ATOM 1151 CG1 VAL B 13 -9.170 -4.499 11.955 1.00 0.00 C ATOM 1152 CG2 VAL B 13 -9.856 -4.379 9.553 1.00 0.00 C ATOM 0 H VAL B 13 -8.509 -6.408 8.421 1.00 0.00 H new ATOM 0 HA VAL B 13 -7.132 -4.625 10.329 1.00 0.00 H new ATOM 0 HB VAL B 13 -9.709 -6.183 10.717 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -10.197 -4.290 12.254 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -8.689 -5.116 12.714 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -8.625 -3.561 11.851 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -10.883 -4.177 9.857 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -9.318 -3.437 9.445 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -9.857 -4.908 8.600 1.00 0.00 H new ATOM 1162 N VAL B 14 -6.016 -6.448 11.663 1.00 0.00 N ATOM 1163 CA VAL B 14 -5.414 -7.503 12.526 1.00 0.00 C ATOM 1164 C VAL B 14 -5.486 -7.065 13.992 1.00 0.00 C ATOM 1165 O VAL B 14 -5.803 -5.930 14.297 1.00 0.00 O ATOM 1166 CB VAL B 14 -3.950 -7.749 12.125 1.00 0.00 C ATOM 1167 CG1 VAL B 14 -3.892 -8.272 10.687 1.00 0.00 C ATOM 1168 CG2 VAL B 14 -3.150 -6.446 12.223 1.00 0.00 C ATOM 0 H VAL B 14 -5.471 -5.589 11.586 1.00 0.00 H new ATOM 0 HA VAL B 14 -5.971 -8.431 12.396 1.00 0.00 H new ATOM 0 HB VAL B 14 -3.518 -8.486 12.802 1.00 0.00 H new ATOM 0 HG11 VAL B 14 -2.854 -8.446 10.405 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -4.448 -9.207 10.617 1.00 0.00 H new ATOM 0 HG13 VAL B 14 -4.333 -7.536 10.014 1.00 0.00 H new ATOM 0 HG21 VAL B 14 -2.115 -6.632 11.937 1.00 0.00 H new ATOM 0 HG22 VAL B 14 -3.583 -5.702 11.554 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -3.182 -6.076 13.248 1.00 0.00 H new ATOM 1178 N LYS B 15 -5.197 -7.960 14.898 1.00 0.00 N ATOM 1179 CA LYS B 15 -5.244 -7.614 16.349 1.00 0.00 C ATOM 1180 C LYS B 15 -4.110 -8.325 17.091 1.00 0.00 C ATOM 1181 O LYS B 15 -3.624 -9.359 16.664 1.00 0.00 O ATOM 1182 CB LYS B 15 -6.596 -8.037 16.943 1.00 0.00 C ATOM 1183 CG LYS B 15 -6.924 -9.476 16.531 1.00 0.00 C ATOM 1184 CD LYS B 15 -8.133 -9.972 17.325 1.00 0.00 C ATOM 1185 CE LYS B 15 -8.560 -11.347 16.803 1.00 0.00 C ATOM 1186 NZ LYS B 15 -8.169 -12.400 17.785 1.00 0.00 N ATOM 0 H LYS B 15 -4.928 -8.923 14.694 1.00 0.00 H new ATOM 0 HA LYS B 15 -5.125 -6.536 16.461 1.00 0.00 H new ATOM 0 HB2 LYS B 15 -6.565 -7.960 18.030 1.00 0.00 H new ATOM 0 HB3 LYS B 15 -7.381 -7.364 16.598 1.00 0.00 H new ATOM 0 HG2 LYS B 15 -7.134 -9.520 15.462 1.00 0.00 H new ATOM 0 HG3 LYS B 15 -6.066 -10.122 16.714 1.00 0.00 H new ATOM 0 HD2 LYS B 15 -7.884 -10.035 18.384 1.00 0.00 H new ATOM 0 HD3 LYS B 15 -8.957 -9.264 17.232 1.00 0.00 H new ATOM 0 HE2 LYS B 15 -9.638 -11.367 16.643 1.00 0.00 H new ATOM 0 HE3 LYS B 15 -8.091 -11.543 15.839 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 -8.383 -13.339 17.391 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 -7.150 -12.331 17.981 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 -8.701 -12.266 18.668 1.00 0.00 H new ATOM 1200 N ASP B 16 -3.689 -7.771 18.198 1.00 0.00 N ATOM 1201 CA ASP B 16 -2.588 -8.390 18.989 1.00 0.00 C ATOM 1202 C ASP B 16 -2.877 -8.236 20.489 1.00 0.00 C ATOM 1203 O ASP B 16 -3.913 -7.729 20.884 1.00 0.00 O ATOM 1204 CB ASP B 16 -1.264 -7.698 18.641 1.00 0.00 C ATOM 1205 CG ASP B 16 -0.122 -8.719 18.670 1.00 0.00 C ATOM 1206 OD1 ASP B 16 0.005 -9.468 17.714 1.00 0.00 O ATOM 1207 OD2 ASP B 16 0.608 -8.735 19.648 1.00 0.00 O ATOM 0 H ASP B 16 -4.066 -6.908 18.590 1.00 0.00 H new ATOM 0 HA ASP B 16 -2.518 -9.451 18.748 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -1.330 -7.241 17.654 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -1.065 -6.895 19.351 1.00 0.00 H new ATOM 1212 N GLN B 17 -1.961 -8.673 21.320 1.00 0.00 N ATOM 1213 CA GLN B 17 -2.147 -8.566 22.799 1.00 0.00 C ATOM 1214 C GLN B 17 -2.409 -7.115 23.189 1.00 0.00 C ATOM 1215 O GLN B 17 -3.272 -6.828 23.998 1.00 0.00 O ATOM 1216 CB GLN B 17 -0.878 -9.053 23.502 1.00 0.00 C ATOM 1217 CG GLN B 17 -1.110 -10.452 24.080 1.00 0.00 C ATOM 1218 CD GLN B 17 -0.957 -11.499 22.971 1.00 0.00 C ATOM 1219 OE1 GLN B 17 0.108 -12.053 22.788 1.00 0.00 O ATOM 1220 NE2 GLN B 17 -1.984 -11.794 22.219 1.00 0.00 N ATOM 0 H GLN B 17 -1.083 -9.104 21.031 1.00 0.00 H new ATOM 0 HA GLN B 17 -2.998 -9.177 23.098 1.00 0.00 H new ATOM 0 HB2 GLN B 17 -0.046 -9.074 22.798 1.00 0.00 H new ATOM 0 HB3 GLN B 17 -0.604 -8.361 24.299 1.00 0.00 H new ATOM 0 HG2 GLN B 17 -0.397 -10.649 24.880 1.00 0.00 H new ATOM 0 HG3 GLN B 17 -2.106 -10.515 24.518 1.00 0.00 H new ATOM 0 HE21 GLN B 17 -2.879 -11.329 22.372 1.00 0.00 H new ATOM 0 HE22 GLN B 17 -1.891 -12.489 21.479 1.00 0.00 H new ATOM 1229 N ASN B 18 -1.662 -6.207 22.621 1.00 0.00 N ATOM 1230 CA ASN B 18 -1.846 -4.766 22.950 1.00 0.00 C ATOM 1231 C ASN B 18 -3.249 -4.304 22.537 1.00 0.00 C ATOM 1232 O ASN B 18 -3.982 -3.764 23.344 1.00 0.00 O ATOM 1233 CB ASN B 18 -0.791 -3.933 22.219 1.00 0.00 C ATOM 1234 CG ASN B 18 0.465 -3.816 23.086 1.00 0.00 C ATOM 1235 OD1 ASN B 18 0.656 -2.829 23.770 1.00 0.00 O ATOM 1236 ND2 ASN B 18 1.338 -4.788 23.089 1.00 0.00 N ATOM 0 H ASN B 18 -0.929 -6.404 21.940 1.00 0.00 H new ATOM 0 HA ASN B 18 -1.733 -4.631 24.026 1.00 0.00 H new ATOM 0 HB2 ASN B 18 -0.544 -4.398 21.265 1.00 0.00 H new ATOM 0 HB3 ASN B 18 -1.186 -2.941 21.998 1.00 0.00 H new ATOM 0 HD21 ASN B 18 2.177 -4.718 23.664 1.00 0.00 H new ATOM 0 HD22 ASN B 18 1.180 -5.617 22.516 1.00 0.00 H new ATOM 1243 N GLU B 19 -3.626 -4.514 21.290 1.00 0.00 N ATOM 1244 CA GLU B 19 -4.983 -4.087 20.818 1.00 0.00 C ATOM 1245 C GLU B 19 -5.115 -4.351 19.309 1.00 0.00 C ATOM 1246 O GLU B 19 -4.232 -4.912 18.682 1.00 0.00 O ATOM 1247 CB GLU B 19 -5.176 -2.584 21.083 1.00 0.00 C ATOM 1248 CG GLU B 19 -6.585 -2.330 21.633 1.00 0.00 C ATOM 1249 CD GLU B 19 -6.619 -2.618 23.137 1.00 0.00 C ATOM 1250 OE1 GLU B 19 -6.281 -1.725 23.901 1.00 0.00 O ATOM 1251 OE2 GLU B 19 -6.983 -3.724 23.502 1.00 0.00 O ATOM 0 H GLU B 19 -3.047 -4.964 20.581 1.00 0.00 H new ATOM 0 HA GLU B 19 -5.741 -4.655 21.358 1.00 0.00 H new ATOM 0 HB2 GLU B 19 -4.429 -2.232 21.795 1.00 0.00 H new ATOM 0 HB3 GLU B 19 -5.028 -2.021 20.161 1.00 0.00 H new ATOM 0 HG2 GLU B 19 -6.877 -1.297 21.445 1.00 0.00 H new ATOM 0 HG3 GLU B 19 -7.306 -2.964 21.116 1.00 0.00 H new ATOM 1258 N GLU B 20 -6.217 -3.940 18.728 1.00 0.00 N ATOM 1259 CA GLU B 20 -6.435 -4.143 17.263 1.00 0.00 C ATOM 1260 C GLU B 20 -5.596 -3.136 16.471 1.00 0.00 C ATOM 1261 O GLU B 20 -5.344 -2.031 16.921 1.00 0.00 O ATOM 1262 CB GLU B 20 -7.916 -3.944 16.931 1.00 0.00 C ATOM 1263 CG GLU B 20 -8.221 -4.542 15.552 1.00 0.00 C ATOM 1264 CD GLU B 20 -9.714 -4.398 15.243 1.00 0.00 C ATOM 1265 OE1 GLU B 20 -10.116 -3.321 14.829 1.00 0.00 O ATOM 1266 OE2 GLU B 20 -10.431 -5.370 15.421 1.00 0.00 O ATOM 0 H GLU B 20 -6.981 -3.468 19.212 1.00 0.00 H new ATOM 0 HA GLU B 20 -6.135 -5.156 16.993 1.00 0.00 H new ATOM 0 HB2 GLU B 20 -8.536 -4.421 17.690 1.00 0.00 H new ATOM 0 HB3 GLU B 20 -8.161 -2.882 16.940 1.00 0.00 H new ATOM 0 HG2 GLU B 20 -7.632 -4.036 14.788 1.00 0.00 H new ATOM 0 HG3 GLU B 20 -7.936 -5.594 15.530 1.00 0.00 H new ATOM 1273 N LYS B 21 -5.160 -3.516 15.293 1.00 0.00 N ATOM 1274 CA LYS B 21 -4.333 -2.598 14.453 1.00 0.00 C ATOM 1275 C LYS B 21 -4.642 -2.836 12.969 1.00 0.00 C ATOM 1276 O LYS B 21 -4.653 -3.960 12.501 1.00 0.00 O ATOM 1277 CB LYS B 21 -2.830 -2.840 14.701 1.00 0.00 C ATOM 1278 CG LYS B 21 -2.611 -4.074 15.588 1.00 0.00 C ATOM 1279 CD LYS B 21 -1.159 -4.107 16.073 1.00 0.00 C ATOM 1280 CE LYS B 21 -1.049 -3.374 17.413 1.00 0.00 C ATOM 1281 NZ LYS B 21 -1.276 -4.334 18.533 1.00 0.00 N ATOM 0 H LYS B 21 -5.344 -4.429 14.877 1.00 0.00 H new ATOM 0 HA LYS B 21 -4.576 -1.571 14.724 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -2.318 -2.977 13.749 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -2.390 -1.963 15.176 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -3.289 -4.046 16.441 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -2.839 -4.981 15.029 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -0.825 -5.139 16.183 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -0.508 -3.638 15.336 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -0.064 -2.916 17.508 1.00 0.00 H new ATOM 0 HE3 LYS B 21 -1.781 -2.568 17.458 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 -1.352 -3.811 19.429 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 -2.156 -4.862 18.364 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 -0.478 -4.999 18.587 1.00 0.00 H new ATOM 1295 N ILE B 22 -4.877 -1.779 12.228 1.00 0.00 N ATOM 1296 CA ILE B 22 -5.166 -1.921 10.771 1.00 0.00 C ATOM 1297 C ILE B 22 -3.844 -2.096 10.022 1.00 0.00 C ATOM 1298 O ILE B 22 -2.941 -1.287 10.144 1.00 0.00 O ATOM 1299 CB ILE B 22 -5.887 -0.667 10.256 1.00 0.00 C ATOM 1300 CG1 ILE B 22 -7.292 -0.586 10.872 1.00 0.00 C ATOM 1301 CG2 ILE B 22 -5.994 -0.726 8.728 1.00 0.00 C ATOM 1302 CD1 ILE B 22 -8.150 -1.756 10.386 1.00 0.00 C ATOM 0 H ILE B 22 -4.880 -0.820 12.575 1.00 0.00 H new ATOM 0 HA ILE B 22 -5.806 -2.788 10.606 1.00 0.00 H new ATOM 0 HB ILE B 22 -5.319 0.218 10.543 1.00 0.00 H new ATOM 0 HG12 ILE B 22 -7.222 -0.604 11.960 1.00 0.00 H new ATOM 0 HG13 ILE B 22 -7.763 0.358 10.599 1.00 0.00 H new ATOM 0 HG21 ILE B 22 -6.506 0.165 8.364 1.00 0.00 H new ATOM 0 HG22 ILE B 22 -4.995 -0.772 8.295 1.00 0.00 H new ATOM 0 HG23 ILE B 22 -6.557 -1.613 8.437 1.00 0.00 H new ATOM 0 HD11 ILE B 22 -9.143 -1.688 10.829 1.00 0.00 H new ATOM 0 HD12 ILE B 22 -8.234 -1.719 9.300 1.00 0.00 H new ATOM 0 HD13 ILE B 22 -7.685 -2.696 10.682 1.00 0.00 H new ATOM 1314 N LEU B 23 -3.722 -3.148 9.255 1.00 0.00 N ATOM 1315 CA LEU B 23 -2.459 -3.387 8.502 1.00 0.00 C ATOM 1316 C LEU B 23 -2.691 -3.183 7.003 1.00 0.00 C ATOM 1317 O LEU B 23 -3.572 -3.780 6.413 1.00 0.00 O ATOM 1318 CB LEU B 23 -1.972 -4.815 8.763 1.00 0.00 C ATOM 1319 CG LEU B 23 -0.640 -4.776 9.517 1.00 0.00 C ATOM 1320 CD1 LEU B 23 -0.798 -3.977 10.814 1.00 0.00 C ATOM 1321 CD2 LEU B 23 -0.211 -6.203 9.852 1.00 0.00 C ATOM 0 H LEU B 23 -4.446 -3.853 9.118 1.00 0.00 H new ATOM 0 HA LEU B 23 -1.703 -2.678 8.839 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -2.714 -5.362 9.344 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -1.851 -5.347 7.819 1.00 0.00 H new ATOM 0 HG LEU B 23 0.114 -4.299 8.892 1.00 0.00 H new ATOM 0 HD11 LEU B 23 0.154 -3.954 11.345 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -1.107 -2.959 10.579 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -1.553 -4.449 11.443 1.00 0.00 H new ATOM 0 HD21 LEU B 23 0.737 -6.181 10.389 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -0.971 -6.674 10.476 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -0.093 -6.773 8.931 1.00 0.00 H new ATOM 1333 N LEU B 24 -1.895 -2.340 6.390 1.00 0.00 N ATOM 1334 CA LEU B 24 -2.040 -2.077 4.929 1.00 0.00 C ATOM 1335 C LEU B 24 -0.760 -2.516 4.213 1.00 0.00 C ATOM 1336 O LEU B 24 0.273 -1.884 4.332 1.00 0.00 O ATOM 1337 CB LEU B 24 -2.277 -0.578 4.684 1.00 0.00 C ATOM 1338 CG LEU B 24 -3.260 -0.019 5.719 1.00 0.00 C ATOM 1339 CD1 LEU B 24 -3.177 1.509 5.725 1.00 0.00 C ATOM 1340 CD2 LEU B 24 -4.684 -0.450 5.361 1.00 0.00 C ATOM 0 H LEU B 24 -1.145 -1.820 6.846 1.00 0.00 H new ATOM 0 HA LEU B 24 -2.892 -2.637 4.544 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -1.331 -0.039 4.742 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -2.670 -0.424 3.679 1.00 0.00 H new ATOM 0 HG LEU B 24 -3.004 -0.403 6.706 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -3.875 1.908 6.460 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -2.164 1.817 5.982 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -3.433 1.891 4.737 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -5.381 -0.051 6.098 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -4.942 -0.068 4.373 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -4.744 -1.538 5.356 1.00 0.00 H new ATOM 1352 N GLY B 25 -0.830 -3.594 3.473 1.00 0.00 N ATOM 1353 CA GLY B 25 0.369 -4.096 2.738 1.00 0.00 C ATOM 1354 C GLY B 25 -0.073 -4.651 1.384 1.00 0.00 C ATOM 1355 O GLY B 25 -0.958 -5.478 1.312 1.00 0.00 O ATOM 0 H GLY B 25 -1.674 -4.152 3.346 1.00 0.00 H new ATOM 0 HA2 GLY B 25 1.089 -3.290 2.597 1.00 0.00 H new ATOM 0 HA3 GLY B 25 0.868 -4.872 3.318 1.00 0.00 H new ATOM 1359 N ALA B 26 0.531 -4.187 0.317 1.00 0.00 N ATOM 1360 CA ALA B 26 0.155 -4.662 -1.049 1.00 0.00 C ATOM 1361 C ALA B 26 0.215 -6.192 -1.122 1.00 0.00 C ATOM 1362 O ALA B 26 1.274 -6.788 -1.226 1.00 0.00 O ATOM 1363 CB ALA B 26 1.109 -4.064 -2.082 1.00 0.00 C ATOM 0 H ALA B 26 1.277 -3.491 0.336 1.00 0.00 H new ATOM 0 HA ALA B 26 -0.865 -4.340 -1.261 1.00 0.00 H new ATOM 0 HB1 ALA B 26 0.832 -4.412 -3.077 1.00 0.00 H new ATOM 0 HB2 ALA B 26 1.047 -2.976 -2.048 1.00 0.00 H new ATOM 0 HB3 ALA B 26 2.129 -4.376 -1.859 1.00 0.00 H new ATOM 1369 N GLY B 27 -0.931 -6.818 -1.076 1.00 0.00 N ATOM 1370 CA GLY B 27 -1.004 -8.307 -1.152 1.00 0.00 C ATOM 1371 C GLY B 27 -0.995 -8.939 0.248 1.00 0.00 C ATOM 1372 O GLY B 27 -0.860 -10.142 0.378 1.00 0.00 O ATOM 0 H GLY B 27 -1.834 -6.353 -0.988 1.00 0.00 H new ATOM 0 HA2 GLY B 27 -1.910 -8.602 -1.681 1.00 0.00 H new ATOM 0 HA3 GLY B 27 -0.161 -8.685 -1.730 1.00 0.00 H new ATOM 1376 N ILE B 28 -1.140 -8.152 1.295 1.00 0.00 N ATOM 1377 CA ILE B 28 -1.144 -8.716 2.671 1.00 0.00 C ATOM 1378 C ILE B 28 -2.327 -9.688 2.822 1.00 0.00 C ATOM 1379 O ILE B 28 -2.197 -10.734 3.431 1.00 0.00 O ATOM 1380 CB ILE B 28 -1.239 -7.554 3.675 1.00 0.00 C ATOM 1381 CG1 ILE B 28 -0.345 -7.853 4.868 1.00 0.00 C ATOM 1382 CG2 ILE B 28 -2.679 -7.352 4.156 1.00 0.00 C ATOM 1383 CD1 ILE B 28 0.065 -6.540 5.532 1.00 0.00 C ATOM 0 H ILE B 28 -1.256 -7.140 1.245 1.00 0.00 H new ATOM 0 HA ILE B 28 -0.227 -9.273 2.864 1.00 0.00 H new ATOM 0 HB ILE B 28 -0.915 -6.640 3.178 1.00 0.00 H new ATOM 0 HG12 ILE B 28 -0.871 -8.486 5.582 1.00 0.00 H new ATOM 0 HG13 ILE B 28 0.539 -8.403 4.546 1.00 0.00 H new ATOM 0 HG21 ILE B 28 -2.713 -6.524 4.864 1.00 0.00 H new ATOM 0 HG22 ILE B 28 -3.319 -7.127 3.303 1.00 0.00 H new ATOM 0 HG23 ILE B 28 -3.031 -8.261 4.644 1.00 0.00 H new ATOM 0 HD11 ILE B 28 0.706 -6.750 6.388 1.00 0.00 H new ATOM 0 HD12 ILE B 28 0.607 -5.923 4.815 1.00 0.00 H new ATOM 0 HD13 ILE B 28 -0.825 -6.008 5.867 1.00 0.00 H new ATOM 1395 N ALA B 29 -3.465 -9.357 2.248 1.00 0.00 N ATOM 1396 CA ALA B 29 -4.647 -10.270 2.326 1.00 0.00 C ATOM 1397 C ALA B 29 -4.296 -11.575 1.611 1.00 0.00 C ATOM 1398 O ALA B 29 -4.641 -12.652 2.064 1.00 0.00 O ATOM 1399 CB ALA B 29 -5.853 -9.617 1.645 1.00 0.00 C ATOM 0 H ALA B 29 -3.622 -8.493 1.730 1.00 0.00 H new ATOM 0 HA ALA B 29 -4.898 -10.468 3.368 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -6.711 -10.286 1.705 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -6.089 -8.678 2.146 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -5.618 -9.421 0.599 1.00 0.00 H new ATOM 1405 N PHE B 30 -3.582 -11.482 0.508 1.00 0.00 N ATOM 1406 CA PHE B 30 -3.168 -12.704 -0.232 1.00 0.00 C ATOM 1407 C PHE B 30 -2.126 -13.447 0.607 1.00 0.00 C ATOM 1408 O PHE B 30 -1.330 -12.839 1.302 1.00 0.00 O ATOM 1409 CB PHE B 30 -2.559 -12.305 -1.582 1.00 0.00 C ATOM 1410 CG PHE B 30 -2.258 -13.543 -2.395 1.00 0.00 C ATOM 1411 CD1 PHE B 30 -3.278 -14.174 -3.117 1.00 0.00 C ATOM 1412 CD2 PHE B 30 -0.957 -14.062 -2.424 1.00 0.00 C ATOM 1413 CE1 PHE B 30 -2.998 -15.321 -3.867 1.00 0.00 C ATOM 1414 CE2 PHE B 30 -0.677 -15.209 -3.175 1.00 0.00 C ATOM 1415 CZ PHE B 30 -1.698 -15.839 -3.896 1.00 0.00 C ATOM 0 H PHE B 30 -3.271 -10.603 0.094 1.00 0.00 H new ATOM 0 HA PHE B 30 -4.030 -13.347 -0.411 1.00 0.00 H new ATOM 0 HB2 PHE B 30 -3.249 -11.661 -2.126 1.00 0.00 H new ATOM 0 HB3 PHE B 30 -1.645 -11.732 -1.424 1.00 0.00 H new ATOM 0 HD1 PHE B 30 -4.281 -13.775 -3.095 1.00 0.00 H new ATOM 0 HD2 PHE B 30 -0.170 -13.577 -1.866 1.00 0.00 H new ATOM 0 HE1 PHE B 30 -3.785 -15.807 -4.424 1.00 0.00 H new ATOM 0 HE2 PHE B 30 0.326 -15.608 -3.198 1.00 0.00 H new ATOM 0 HZ PHE B 30 -1.483 -16.725 -4.475 1.00 0.00 H new ATOM 1425 N ASN B 31 -2.135 -14.756 0.551 1.00 0.00 N ATOM 1426 CA ASN B 31 -1.157 -15.570 1.345 1.00 0.00 C ATOM 1427 C ASN B 31 -1.505 -15.506 2.841 1.00 0.00 C ATOM 1428 O ASN B 31 -0.656 -15.692 3.693 1.00 0.00 O ATOM 1429 CB ASN B 31 0.263 -15.034 1.112 1.00 0.00 C ATOM 1430 CG ASN B 31 1.288 -16.134 1.408 1.00 0.00 C ATOM 1431 OD1 ASN B 31 1.944 -16.109 2.431 1.00 0.00 O ATOM 1432 ND2 ASN B 31 1.454 -17.104 0.550 1.00 0.00 N ATOM 0 H ASN B 31 -2.784 -15.302 -0.016 1.00 0.00 H new ATOM 0 HA ASN B 31 -1.209 -16.609 1.020 1.00 0.00 H new ATOM 0 HB2 ASN B 31 0.369 -14.693 0.082 1.00 0.00 H new ATOM 0 HB3 ASN B 31 0.446 -14.172 1.753 1.00 0.00 H new ATOM 0 HD21 ASN B 31 2.134 -17.841 0.738 1.00 0.00 H new ATOM 0 HD22 ASN B 31 0.904 -17.125 -0.309 1.00 0.00 H new ATOM 1439 N LYS B 32 -2.754 -15.257 3.160 1.00 0.00 N ATOM 1440 CA LYS B 32 -3.179 -15.188 4.594 1.00 0.00 C ATOM 1441 C LYS B 32 -4.712 -15.181 4.688 1.00 0.00 C ATOM 1442 O LYS B 32 -5.402 -14.955 3.708 1.00 0.00 O ATOM 1443 CB LYS B 32 -2.622 -13.912 5.235 1.00 0.00 C ATOM 1444 CG LYS B 32 -1.746 -14.284 6.436 1.00 0.00 C ATOM 1445 CD LYS B 32 -0.279 -13.974 6.124 1.00 0.00 C ATOM 1446 CE LYS B 32 0.574 -15.230 6.333 1.00 0.00 C ATOM 1447 NZ LYS B 32 1.603 -14.969 7.381 1.00 0.00 N ATOM 0 H LYS B 32 -3.501 -15.098 2.484 1.00 0.00 H new ATOM 0 HA LYS B 32 -2.792 -16.060 5.121 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -2.038 -13.351 4.505 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -3.440 -13.266 5.554 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -2.065 -13.727 7.317 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -1.862 -15.343 6.668 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -0.182 -13.625 5.096 1.00 0.00 H new ATOM 0 HD3 LYS B 32 0.077 -13.170 6.768 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -0.059 -16.066 6.631 1.00 0.00 H new ATOM 0 HE3 LYS B 32 1.057 -15.513 5.398 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 2.102 -15.854 7.606 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 2.285 -14.266 7.031 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 1.141 -14.605 8.238 1.00 0.00 H new ATOM 1461 N LYS B 33 -5.249 -15.429 5.862 1.00 0.00 N ATOM 1462 CA LYS B 33 -6.735 -15.442 6.029 1.00 0.00 C ATOM 1463 C LYS B 33 -7.108 -15.092 7.480 1.00 0.00 C ATOM 1464 O LYS B 33 -6.252 -14.871 8.317 1.00 0.00 O ATOM 1465 CB LYS B 33 -7.278 -16.833 5.675 1.00 0.00 C ATOM 1466 CG LYS B 33 -6.623 -17.896 6.568 1.00 0.00 C ATOM 1467 CD LYS B 33 -7.708 -18.697 7.296 1.00 0.00 C ATOM 1468 CE LYS B 33 -8.276 -19.766 6.357 1.00 0.00 C ATOM 1469 NZ LYS B 33 -7.450 -21.004 6.448 1.00 0.00 N ATOM 0 H LYS B 33 -4.719 -15.623 6.711 1.00 0.00 H new ATOM 0 HA LYS B 33 -7.175 -14.700 5.363 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -8.360 -16.854 5.805 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -7.079 -17.054 4.626 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -6.008 -18.563 5.964 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -5.961 -17.420 7.292 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -7.291 -19.166 8.187 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -8.504 -18.031 7.629 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -9.310 -19.986 6.624 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -8.283 -19.397 5.332 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -7.838 -21.728 5.810 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -6.470 -20.789 6.173 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -7.465 -21.360 7.425 1.00 0.00 H new ATOM 1483 N LYS B 34 -8.389 -15.041 7.772 1.00 0.00 N ATOM 1484 CA LYS B 34 -8.849 -14.708 9.154 1.00 0.00 C ATOM 1485 C LYS B 34 -8.316 -15.737 10.147 1.00 0.00 C ATOM 1486 O LYS B 34 -8.318 -16.928 9.889 1.00 0.00 O ATOM 1487 CB LYS B 34 -10.382 -14.698 9.197 1.00 0.00 C ATOM 1488 CG LYS B 34 -10.862 -13.758 10.307 1.00 0.00 C ATOM 1489 CD LYS B 34 -12.187 -14.273 10.880 1.00 0.00 C ATOM 1490 CE LYS B 34 -12.033 -14.525 12.383 1.00 0.00 C ATOM 1491 NZ LYS B 34 -11.233 -15.764 12.608 1.00 0.00 N ATOM 0 H LYS B 34 -9.139 -15.218 7.103 1.00 0.00 H new ATOM 0 HA LYS B 34 -8.470 -13.723 9.426 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -10.780 -14.374 8.235 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -10.757 -15.706 9.374 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -10.112 -13.698 11.096 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -10.992 -12.750 9.913 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -12.979 -13.546 10.702 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -12.480 -15.193 10.375 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -11.543 -13.674 12.855 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -13.014 -14.625 12.847 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -11.146 -15.940 13.629 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -11.709 -16.571 12.157 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -10.286 -15.646 12.195 1.00 0.00 H new ATOM 1505 N ASN B 35 -7.851 -15.258 11.279 1.00 0.00 N ATOM 1506 CA ASN B 35 -7.289 -16.139 12.351 1.00 0.00 C ATOM 1507 C ASN B 35 -5.799 -16.416 12.090 1.00 0.00 C ATOM 1508 O ASN B 35 -5.062 -16.743 13.004 1.00 0.00 O ATOM 1509 CB ASN B 35 -8.062 -17.465 12.434 1.00 0.00 C ATOM 1510 CG ASN B 35 -8.293 -17.836 13.903 1.00 0.00 C ATOM 1511 OD1 ASN B 35 -9.420 -17.988 14.331 1.00 0.00 O ATOM 1512 ND2 ASN B 35 -7.268 -17.988 14.698 1.00 0.00 N ATOM 0 H ASN B 35 -7.839 -14.264 11.508 1.00 0.00 H new ATOM 0 HA ASN B 35 -7.393 -15.619 13.303 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -9.017 -17.373 11.917 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -7.503 -18.255 11.933 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -7.414 -18.234 15.677 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -6.321 -17.861 14.340 1.00 0.00 H new ATOM 1519 N ASP B 36 -5.343 -16.279 10.862 1.00 0.00 N ATOM 1520 CA ASP B 36 -3.905 -16.522 10.560 1.00 0.00 C ATOM 1521 C ASP B 36 -3.101 -15.262 10.894 1.00 0.00 C ATOM 1522 O ASP B 36 -3.628 -14.164 10.914 1.00 0.00 O ATOM 1523 CB ASP B 36 -3.743 -16.854 9.072 1.00 0.00 C ATOM 1524 CG ASP B 36 -2.410 -17.577 8.840 1.00 0.00 C ATOM 1525 OD1 ASP B 36 -2.389 -18.791 8.963 1.00 0.00 O ATOM 1526 OD2 ASP B 36 -1.436 -16.905 8.542 1.00 0.00 O ATOM 0 H ASP B 36 -5.912 -16.009 10.060 1.00 0.00 H new ATOM 0 HA ASP B 36 -3.541 -17.358 11.157 1.00 0.00 H new ATOM 0 HB2 ASP B 36 -4.570 -17.481 8.738 1.00 0.00 H new ATOM 0 HB3 ASP B 36 -3.778 -15.939 8.480 1.00 0.00 H new ATOM 1531 N ILE B 37 -1.827 -15.412 11.150 1.00 0.00 N ATOM 1532 CA ILE B 37 -0.976 -14.231 11.476 1.00 0.00 C ATOM 1533 C ILE B 37 -0.659 -13.470 10.187 1.00 0.00 C ATOM 1534 O ILE B 37 -0.529 -14.053 9.127 1.00 0.00 O ATOM 1535 CB ILE B 37 0.331 -14.690 12.135 1.00 0.00 C ATOM 1536 CG1 ILE B 37 0.028 -15.701 13.254 1.00 0.00 C ATOM 1537 CG2 ILE B 37 1.064 -13.481 12.721 1.00 0.00 C ATOM 1538 CD1 ILE B 37 -0.846 -15.047 14.331 1.00 0.00 C ATOM 0 H ILE B 37 -1.338 -16.307 11.147 1.00 0.00 H new ATOM 0 HA ILE B 37 -1.511 -13.581 12.168 1.00 0.00 H new ATOM 0 HB ILE B 37 0.960 -15.167 11.383 1.00 0.00 H new ATOM 0 HG12 ILE B 37 -0.481 -16.572 12.840 1.00 0.00 H new ATOM 0 HG13 ILE B 37 0.959 -16.056 13.696 1.00 0.00 H new ATOM 0 HG21 ILE B 37 1.992 -13.810 13.189 1.00 0.00 H new ATOM 0 HG22 ILE B 37 1.290 -12.772 11.925 1.00 0.00 H new ATOM 0 HG23 ILE B 37 0.432 -12.999 13.467 1.00 0.00 H new ATOM 0 HD11 ILE B 37 -1.055 -15.771 15.119 1.00 0.00 H new ATOM 0 HD12 ILE B 37 -0.321 -14.191 14.755 1.00 0.00 H new ATOM 0 HD13 ILE B 37 -1.784 -14.714 13.886 1.00 0.00 H new ATOM 1550 N VAL B 38 -0.538 -12.171 10.276 1.00 0.00 N ATOM 1551 CA VAL B 38 -0.234 -11.349 9.066 1.00 0.00 C ATOM 1552 C VAL B 38 1.250 -11.469 8.712 1.00 0.00 C ATOM 1553 O VAL B 38 2.110 -11.490 9.577 1.00 0.00 O ATOM 1554 CB VAL B 38 -0.580 -9.873 9.329 1.00 0.00 C ATOM 1555 CG1 VAL B 38 0.327 -9.299 10.423 1.00 0.00 C ATOM 1556 CG2 VAL B 38 -0.374 -9.064 8.045 1.00 0.00 C ATOM 0 H VAL B 38 -0.637 -11.640 11.141 1.00 0.00 H new ATOM 0 HA VAL B 38 -0.835 -11.716 8.234 1.00 0.00 H new ATOM 0 HB VAL B 38 -1.619 -9.811 9.652 1.00 0.00 H new ATOM 0 HG11 VAL B 38 0.070 -8.254 10.598 1.00 0.00 H new ATOM 0 HG12 VAL B 38 0.189 -9.865 11.344 1.00 0.00 H new ATOM 0 HG13 VAL B 38 1.368 -9.369 10.106 1.00 0.00 H new ATOM 0 HG21 VAL B 38 -0.619 -8.018 8.231 1.00 0.00 H new ATOM 0 HG22 VAL B 38 0.666 -9.142 7.728 1.00 0.00 H new ATOM 0 HG23 VAL B 38 -1.022 -9.455 7.261 1.00 0.00 H new ATOM 1566 N ASP B 39 1.548 -11.523 7.440 1.00 0.00 N ATOM 1567 CA ASP B 39 2.965 -11.613 6.998 1.00 0.00 C ATOM 1568 C ASP B 39 3.622 -10.250 7.243 1.00 0.00 C ATOM 1569 O ASP B 39 3.118 -9.240 6.787 1.00 0.00 O ATOM 1570 CB ASP B 39 3.016 -11.960 5.504 1.00 0.00 C ATOM 1571 CG ASP B 39 4.456 -12.284 5.095 1.00 0.00 C ATOM 1572 OD1 ASP B 39 4.886 -13.401 5.336 1.00 0.00 O ATOM 1573 OD2 ASP B 39 5.105 -11.410 4.544 1.00 0.00 O ATOM 0 H ASP B 39 0.862 -11.508 6.685 1.00 0.00 H new ATOM 0 HA ASP B 39 3.492 -12.390 7.552 1.00 0.00 H new ATOM 0 HB2 ASP B 39 2.369 -12.812 5.297 1.00 0.00 H new ATOM 0 HB3 ASP B 39 2.640 -11.124 4.914 1.00 0.00 H new ATOM 1578 N PRO B 40 4.717 -10.255 7.968 1.00 0.00 N ATOM 1579 CA PRO B 40 5.446 -9.017 8.307 1.00 0.00 C ATOM 1580 C PRO B 40 6.143 -8.440 7.071 1.00 0.00 C ATOM 1581 O PRO B 40 6.192 -7.236 6.893 1.00 0.00 O ATOM 1582 CB PRO B 40 6.448 -9.462 9.373 1.00 0.00 C ATOM 1583 CG PRO B 40 6.619 -10.988 9.197 1.00 0.00 C ATOM 1584 CD PRO B 40 5.341 -11.488 8.496 1.00 0.00 C ATOM 0 HA PRO B 40 4.794 -8.221 8.666 1.00 0.00 H new ATOM 0 HB2 PRO B 40 7.401 -8.947 9.250 1.00 0.00 H new ATOM 0 HB3 PRO B 40 6.084 -9.224 10.372 1.00 0.00 H new ATOM 0 HG2 PRO B 40 7.503 -11.214 8.601 1.00 0.00 H new ATOM 0 HG3 PRO B 40 6.751 -11.478 10.162 1.00 0.00 H new ATOM 0 HD2 PRO B 40 5.573 -12.192 7.697 1.00 0.00 H new ATOM 0 HD3 PRO B 40 4.680 -12.004 9.192 1.00 0.00 H new ATOM 1592 N SER B 41 6.655 -9.285 6.202 1.00 0.00 N ATOM 1593 CA SER B 41 7.314 -8.777 4.961 1.00 0.00 C ATOM 1594 C SER B 41 6.269 -8.018 4.131 1.00 0.00 C ATOM 1595 O SER B 41 6.591 -7.099 3.400 1.00 0.00 O ATOM 1596 CB SER B 41 7.866 -9.952 4.148 1.00 0.00 C ATOM 1597 OG SER B 41 9.026 -9.532 3.441 1.00 0.00 O ATOM 0 H SER B 41 6.643 -10.300 6.302 1.00 0.00 H new ATOM 0 HA SER B 41 8.139 -8.113 5.222 1.00 0.00 H new ATOM 0 HB2 SER B 41 8.110 -10.783 4.809 1.00 0.00 H new ATOM 0 HB3 SER B 41 7.111 -10.312 3.449 1.00 0.00 H new ATOM 0 HG SER B 41 9.382 -10.283 2.921 1.00 0.00 H new ATOM 1603 N LYS B 42 5.015 -8.396 4.262 1.00 0.00 N ATOM 1604 CA LYS B 42 3.921 -7.711 3.515 1.00 0.00 C ATOM 1605 C LYS B 42 3.456 -6.469 4.290 1.00 0.00 C ATOM 1606 O LYS B 42 2.942 -5.533 3.705 1.00 0.00 O ATOM 1607 CB LYS B 42 2.742 -8.674 3.342 1.00 0.00 C ATOM 1608 CG LYS B 42 3.118 -9.777 2.348 1.00 0.00 C ATOM 1609 CD LYS B 42 2.272 -9.633 1.080 1.00 0.00 C ATOM 1610 CE LYS B 42 2.461 -10.868 0.193 1.00 0.00 C ATOM 1611 NZ LYS B 42 1.518 -11.942 0.618 1.00 0.00 N ATOM 0 H LYS B 42 4.706 -9.160 4.863 1.00 0.00 H new ATOM 0 HA LYS B 42 4.292 -7.405 2.537 1.00 0.00 H new ATOM 0 HB2 LYS B 42 2.475 -9.113 4.303 1.00 0.00 H new ATOM 0 HB3 LYS B 42 1.867 -8.132 2.984 1.00 0.00 H new ATOM 0 HG2 LYS B 42 4.177 -9.712 2.100 1.00 0.00 H new ATOM 0 HG3 LYS B 42 2.955 -10.757 2.797 1.00 0.00 H new ATOM 0 HD2 LYS B 42 1.220 -9.519 1.343 1.00 0.00 H new ATOM 0 HD3 LYS B 42 2.563 -8.734 0.536 1.00 0.00 H new ATOM 0 HE2 LYS B 42 2.285 -10.608 -0.851 1.00 0.00 H new ATOM 0 HE3 LYS B 42 3.489 -11.224 0.264 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 1.577 -12.739 -0.047 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 1.771 -12.268 1.572 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 0.547 -11.569 0.626 1.00 0.00 H new ATOM 1625 N ILE B 43 3.634 -6.451 5.601 1.00 0.00 N ATOM 1626 CA ILE B 43 3.203 -5.265 6.415 1.00 0.00 C ATOM 1627 C ILE B 43 3.880 -4.000 5.876 1.00 0.00 C ATOM 1628 O ILE B 43 5.073 -3.803 6.034 1.00 0.00 O ATOM 1629 CB ILE B 43 3.593 -5.463 7.887 1.00 0.00 C ATOM 1630 CG1 ILE B 43 2.767 -6.603 8.489 1.00 0.00 C ATOM 1631 CG2 ILE B 43 3.316 -4.172 8.667 1.00 0.00 C ATOM 1632 CD1 ILE B 43 3.245 -6.893 9.915 1.00 0.00 C ATOM 0 H ILE B 43 4.059 -7.208 6.137 1.00 0.00 H new ATOM 0 HA ILE B 43 2.120 -5.162 6.344 1.00 0.00 H new ATOM 0 HB ILE B 43 4.653 -5.709 7.949 1.00 0.00 H new ATOM 0 HG12 ILE B 43 1.711 -6.334 8.497 1.00 0.00 H new ATOM 0 HG13 ILE B 43 2.863 -7.498 7.874 1.00 0.00 H new ATOM 0 HG21 ILE B 43 3.593 -4.312 9.712 1.00 0.00 H new ATOM 0 HG22 ILE B 43 3.903 -3.357 8.242 1.00 0.00 H new ATOM 0 HG23 ILE B 43 2.256 -3.928 8.602 1.00 0.00 H new ATOM 0 HD11 ILE B 43 2.654 -7.705 10.339 1.00 0.00 H new ATOM 0 HD12 ILE B 43 4.296 -7.181 9.895 1.00 0.00 H new ATOM 0 HD13 ILE B 43 3.126 -5.999 10.528 1.00 0.00 H new ATOM 1644 N GLU B 44 3.116 -3.143 5.250 1.00 0.00 N ATOM 1645 CA GLU B 44 3.680 -1.878 4.698 1.00 0.00 C ATOM 1646 C GLU B 44 3.263 -0.705 5.592 1.00 0.00 C ATOM 1647 O GLU B 44 3.960 0.290 5.684 1.00 0.00 O ATOM 1648 CB GLU B 44 3.147 -1.656 3.282 1.00 0.00 C ATOM 1649 CG GLU B 44 3.900 -2.560 2.305 1.00 0.00 C ATOM 1650 CD GLU B 44 3.863 -1.947 0.901 1.00 0.00 C ATOM 1651 OE1 GLU B 44 2.933 -2.245 0.169 1.00 0.00 O ATOM 1652 OE2 GLU B 44 4.768 -1.193 0.580 1.00 0.00 O ATOM 0 H GLU B 44 2.115 -3.268 5.097 1.00 0.00 H new ATOM 0 HA GLU B 44 4.767 -1.946 4.668 1.00 0.00 H new ATOM 0 HB2 GLU B 44 2.079 -1.873 3.246 1.00 0.00 H new ATOM 0 HB3 GLU B 44 3.270 -0.611 2.996 1.00 0.00 H new ATOM 0 HG2 GLU B 44 4.933 -2.684 2.631 1.00 0.00 H new ATOM 0 HG3 GLU B 44 3.449 -3.552 2.291 1.00 0.00 H new ATOM 1659 N LYS B 45 2.130 -0.819 6.249 1.00 0.00 N ATOM 1660 CA LYS B 45 1.653 0.281 7.141 1.00 0.00 C ATOM 1661 C LYS B 45 0.975 -0.311 8.383 1.00 0.00 C ATOM 1662 O LYS B 45 0.110 -1.164 8.282 1.00 0.00 O ATOM 1663 CB LYS B 45 0.650 1.156 6.383 1.00 0.00 C ATOM 1664 CG LYS B 45 1.357 2.403 5.845 1.00 0.00 C ATOM 1665 CD LYS B 45 0.498 3.049 4.754 1.00 0.00 C ATOM 1666 CE LYS B 45 0.996 2.604 3.374 1.00 0.00 C ATOM 1667 NZ LYS B 45 0.362 1.304 3.005 1.00 0.00 N ATOM 0 H LYS B 45 1.515 -1.632 6.203 1.00 0.00 H new ATOM 0 HA LYS B 45 2.506 0.885 7.450 1.00 0.00 H new ATOM 0 HB2 LYS B 45 0.210 0.592 5.560 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -0.167 1.446 7.044 1.00 0.00 H new ATOM 0 HG2 LYS B 45 1.530 3.113 6.654 1.00 0.00 H new ATOM 0 HG3 LYS B 45 2.334 2.135 5.442 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -0.546 2.765 4.884 1.00 0.00 H new ATOM 0 HD3 LYS B 45 0.545 4.135 4.836 1.00 0.00 H new ATOM 0 HE2 LYS B 45 0.755 3.362 2.628 1.00 0.00 H new ATOM 0 HE3 LYS B 45 2.081 2.500 3.384 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 0.479 1.138 1.985 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 0.816 0.533 3.535 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -0.651 1.334 3.237 1.00 0.00 H new ATOM 1681 N THR B 46 1.363 0.143 9.553 1.00 0.00 N ATOM 1682 CA THR B 46 0.749 -0.375 10.812 1.00 0.00 C ATOM 1683 C THR B 46 -0.073 0.742 11.466 1.00 0.00 C ATOM 1684 O THR B 46 0.467 1.705 11.982 1.00 0.00 O ATOM 1685 CB THR B 46 1.853 -0.845 11.773 1.00 0.00 C ATOM 1686 OG1 THR B 46 2.641 -1.844 11.136 1.00 0.00 O ATOM 1687 CG2 THR B 46 1.220 -1.427 13.039 1.00 0.00 C ATOM 0 H THR B 46 2.082 0.854 9.687 1.00 0.00 H new ATOM 0 HA THR B 46 0.098 -1.219 10.583 1.00 0.00 H new ATOM 0 HB THR B 46 2.484 0.003 12.041 1.00 0.00 H new ATOM 0 HG1 THR B 46 3.346 -2.143 11.747 1.00 0.00 H new ATOM 0 HG21 THR B 46 2.005 -1.759 13.718 1.00 0.00 H new ATOM 0 HG22 THR B 46 0.616 -0.663 13.528 1.00 0.00 H new ATOM 0 HG23 THR B 46 0.588 -2.274 12.773 1.00 0.00 H new ATOM 1695 N PHE B 47 -1.378 0.615 11.439 1.00 0.00 N ATOM 1696 CA PHE B 47 -2.265 1.651 12.043 1.00 0.00 C ATOM 1697 C PHE B 47 -2.916 1.101 13.313 1.00 0.00 C ATOM 1698 O PHE B 47 -3.307 -0.047 13.375 1.00 0.00 O ATOM 1699 CB PHE B 47 -3.363 2.027 11.049 1.00 0.00 C ATOM 1700 CG PHE B 47 -2.847 3.051 10.068 1.00 0.00 C ATOM 1701 CD1 PHE B 47 -2.044 2.655 8.991 1.00 0.00 C ATOM 1702 CD2 PHE B 47 -3.177 4.399 10.236 1.00 0.00 C ATOM 1703 CE1 PHE B 47 -1.572 3.612 8.085 1.00 0.00 C ATOM 1704 CE2 PHE B 47 -2.707 5.354 9.331 1.00 0.00 C ATOM 1705 CZ PHE B 47 -1.904 4.962 8.257 1.00 0.00 C ATOM 0 H PHE B 47 -1.869 -0.174 11.018 1.00 0.00 H new ATOM 0 HA PHE B 47 -1.668 2.529 12.288 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -3.701 1.139 10.515 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -4.226 2.426 11.582 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -1.790 1.614 8.860 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -3.796 4.703 11.067 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -0.952 3.310 7.254 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -2.964 6.395 9.462 1.00 0.00 H new ATOM 0 HZ PHE B 47 -1.539 5.701 7.559 1.00 0.00 H new ATOM 1715 N ILE B 48 -3.030 1.920 14.323 1.00 0.00 N ATOM 1716 CA ILE B 48 -3.655 1.478 15.606 1.00 0.00 C ATOM 1717 C ILE B 48 -4.523 2.613 16.160 1.00 0.00 C ATOM 1718 O ILE B 48 -4.179 3.776 16.044 1.00 0.00 O ATOM 1719 CB ILE B 48 -2.566 1.126 16.630 1.00 0.00 C ATOM 1720 CG1 ILE B 48 -1.212 0.977 15.916 1.00 0.00 C ATOM 1721 CG2 ILE B 48 -2.934 -0.187 17.328 1.00 0.00 C ATOM 1722 CD1 ILE B 48 -0.182 0.379 16.869 1.00 0.00 C ATOM 0 H ILE B 48 -2.713 2.889 14.315 1.00 0.00 H new ATOM 0 HA ILE B 48 -4.268 0.596 15.421 1.00 0.00 H new ATOM 0 HB ILE B 48 -2.490 1.922 17.371 1.00 0.00 H new ATOM 0 HG12 ILE B 48 -1.322 0.339 15.039 1.00 0.00 H new ATOM 0 HG13 ILE B 48 -0.870 1.949 15.561 1.00 0.00 H new ATOM 0 HG21 ILE B 48 -2.163 -0.441 18.056 1.00 0.00 H new ATOM 0 HG22 ILE B 48 -3.891 -0.072 17.838 1.00 0.00 H new ATOM 0 HG23 ILE B 48 -3.010 -0.984 16.588 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.774 0.277 16.355 1.00 0.00 H new ATOM 0 HD12 ILE B 48 -0.062 1.034 17.732 1.00 0.00 H new ATOM 0 HD13 ILE B 48 -0.521 -0.602 17.202 1.00 0.00 H new ATOM 1734 N ARG B 49 -5.643 2.282 16.763 1.00 0.00 N ATOM 1735 CA ARG B 49 -6.539 3.338 17.331 1.00 0.00 C ATOM 1736 C ARG B 49 -5.755 4.170 18.355 1.00 0.00 C ATOM 1737 O ARG B 49 -5.439 3.705 19.437 1.00 0.00 O ATOM 1738 CB ARG B 49 -7.747 2.681 18.009 1.00 0.00 C ATOM 1739 CG ARG B 49 -8.743 2.219 16.942 1.00 0.00 C ATOM 1740 CD ARG B 49 -9.631 1.104 17.505 1.00 0.00 C ATOM 1741 NE ARG B 49 -8.811 -0.117 17.763 1.00 0.00 N ATOM 1742 CZ ARG B 49 -9.364 -1.174 18.295 1.00 0.00 C ATOM 1743 NH1 ARG B 49 -10.271 -1.844 17.630 1.00 0.00 N ATOM 1744 NH2 ARG B 49 -9.010 -1.563 19.491 1.00 0.00 N ATOM 0 H ARG B 49 -5.974 1.325 16.885 1.00 0.00 H new ATOM 0 HA ARG B 49 -6.892 3.988 16.530 1.00 0.00 H new ATOM 0 HB2 ARG B 49 -7.422 1.832 18.611 1.00 0.00 H new ATOM 0 HB3 ARG B 49 -8.226 3.388 18.687 1.00 0.00 H new ATOM 0 HG2 ARG B 49 -9.359 3.058 16.619 1.00 0.00 H new ATOM 0 HG3 ARG B 49 -8.207 1.860 16.063 1.00 0.00 H new ATOM 0 HD2 ARG B 49 -10.105 1.436 18.429 1.00 0.00 H new ATOM 0 HD3 ARG B 49 -10.431 0.874 16.801 1.00 0.00 H new ATOM 0 HE ARG B 49 -7.819 -0.126 17.524 1.00 0.00 H new ATOM 0 HH11 ARG B 49 -10.546 -1.541 16.696 1.00 0.00 H new ATOM 0 HH12 ARG B 49 -10.702 -2.669 18.046 1.00 0.00 H new ATOM 0 HH21 ARG B 49 -8.302 -1.041 20.008 1.00 0.00 H new ATOM 0 HH22 ARG B 49 -9.441 -2.388 19.907 1.00 0.00 H new