USER MOD reduce.3.24.130724 H: found=0, std=0, add=1424, rem=0, adj=51 USER MOD reduce.3.24.130724 removed 1420 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 16 HIS : no HE2:sc= -4.47! C(o=-8.6!,f=-13!) USER MOD Set 1.2: B 86 ASN : amide:sc= -4.15! C(o=-8.6!,f=-13!) USER MOD Set 2.1: A 87 ASN : amide:sc= -2.31 K(o=0.81,f=-0.8!) USER MOD Set 2.2: B 25 LYS NZ :NH3+ 169:sc= 1.28 (180deg=-0.00212) USER MOD Set 2.3: B 26 TYR OH : rot -98:sc= 1.84 USER MOD Set 3.1: A 82 THR OG1 : rot 61:sc= 0.783 USER MOD Set 3.2: B 8 MET CE :methyl -154:sc= -3.36 (180deg=-5.98!) USER MOD Set 4.1: A 26 TYR OH : rot 177:sc= 1.85 USER MOD Set 4.2: B 87 ASN : amide:sc= -1.91 X(o=-0.057,f=-0.22) USER MOD Set 5.1: A 8 MET CE :methyl -157:sc= -4.27 (180deg=-6.41!) USER MOD Set 5.2: B 82 THR OG1 : rot 56:sc= 0.181 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 78:sc= 0.69 USER MOD Single : A 6 THR OG1 : rot 74:sc= 0.664 USER MOD Single : A 10 THR OG1 : rot 11:sc= 0.183 USER MOD Single : A 13 ASN : amide:sc= 0.48 K(o=0.48,f=-0.45) USER MOD Single : A 18 HIS : +bothHN:sc= -3.05! C(o=-3!,f=-18!) USER MOD Single : A 19 SER OG : rot -19:sc= 1.05 USER MOD Single : A 21 LYS NZ :NH3+ 178:sc= -2.67! (180deg=-2.69!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ -117:sc= 0.463 (180deg=-0.896!) USER MOD Single : A 29 SER OG : rot -79:sc= 0.806 USER MOD Single : A 30 LYS NZ :NH3+ -92:sc= -0.372! (180deg=-5.24!) USER MOD Single : A 31 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0176) USER MOD Single : A 34 LYS NZ :NH3+ -102:sc= 0 (180deg=-0.544) USER MOD Single : A 38 GLN :FLIP amide:sc= -0.249 F(o=-1.4,f=-0.25) USER MOD Single : A 39 THR OG1 : rot 72:sc= 1.1 USER MOD Single : A 42 SER OG : rot -108:sc= 1.24 USER MOD Single : A 48 GLN :FLIP amide:sc= -0.813 F(o=-1.8!,f=-0.81) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ -161:sc= -0.0736! (180deg=-2.75!) USER MOD Single : A 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ -121:sc= -3.95! (180deg=-13.1!) USER MOD Single : A 64 ASN : amide:sc= -0.0408 K(o=-0.041,f=-1.4) USER MOD Single : A 72 GLN : amide:sc= -0.31 K(o=-0.31,f=-1.1!) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 MET CE :methyl -121:sc= -1.46 (180deg=-8.63!) USER MOD Single : A 86 ASN : amide:sc= -2.7 K(o=-2.7,f=-7.8!) USER MOD Single : A 92 ASN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 93 SER OG : rot -47:sc= 0.358 USER MOD Single : B 1 GLY N :NH3+ -119:sc= 0.114 (180deg=0) USER MOD Single : B 2 SER OG : rot 112:sc= 0.917 USER MOD Single : B 6 THR OG1 : rot 180:sc= -0.0163 USER MOD Single : B 10 THR OG1 : rot 14:sc= 0.423 USER MOD Single : B 13 ASN : amide:sc= 0.174! K(o=0.17!,f=-0.88) USER MOD Single : B 16 HIS : no HE2:sc= -13.5! C(o=-13!,f=-15!) USER MOD Single : B 18 HIS : no HE2:sc= -3.11! C(o=-3.1!,f=-8.8!) USER MOD Single : B 19 SER OG : rot -40:sc= 0.0687 USER MOD Single : B 21 LYS NZ :NH3+ -170:sc= 0.557 (180deg=0.304) USER MOD Single : B 27 LYS NZ :NH3+ -141:sc= -0.213! (180deg=-6.33!) USER MOD Single : B 29 SER OG : rot 50:sc= -1.42 USER MOD Single : B 30 LYS NZ :NH3+ 150:sc= -0.724 (180deg=-2.52!) USER MOD Single : B 31 LYS NZ :NH3+ -165:sc=-0.00368 (180deg=-0.17) USER MOD Single : B 34 LYS NZ :NH3+ -159:sc= 0.54 (180deg=-1.25!) USER MOD Single : B 38 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 39 THR OG1 : rot 106:sc= 0.76 USER MOD Single : B 42 SER OG : rot 4:sc= 0.86 USER MOD Single : B 48 GLN : amide:sc= -3.6! C(o=-3.6!,f=-4.8!) USER MOD Single : B 49 LYS NZ :NH3+ 160:sc= -0.144 (180deg=-0.968) USER MOD Single : B 56 LYS NZ :NH3+ -135:sc= -0.577 (180deg=-2.34!) USER MOD Single : B 58 MET CE :methyl -176:sc= 0 (180deg=-0.00427) USER MOD Single : B 59 LYS NZ :NH3+ -164:sc=-0.00616 (180deg=-0.64) USER MOD Single : B 64 ASN : amide:sc= -7.47! C(o=-7.5!,f=-9.7!) USER MOD Single : B 72 GLN :FLIP amide:sc= -1.81 F(o=-3.4!,f=-1.8) USER MOD Single : B 74 TYR OH : rot 180:sc= -0.124 USER MOD Single : B 85 MET CE :methyl -161:sc= -3.41! (180deg=-5.89!) USER MOD Single : B 92 ASN : amide:sc= -0.0204 X(o=-0.02,f=0) USER MOD Single : B 93 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.727 8.094 10.949 1.00 0.00 N ATOM 2 CA GLY A 1 -10.428 7.639 10.472 1.00 0.00 C ATOM 3 C GLY A 1 -9.876 6.522 11.353 1.00 0.00 C ATOM 4 O GLY A 1 -9.318 6.781 12.418 1.00 0.00 O ATOM 0 H1 GLY A 1 -12.077 8.853 10.331 1.00 0.00 H new ATOM 0 H2 GLY A 1 -12.399 7.300 10.937 1.00 0.00 H new ATOM 0 H3 GLY A 1 -11.634 8.454 11.920 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -10.519 7.285 9.445 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.729 8.475 10.460 1.00 0.00 H new ATOM 8 N SER A 2 -10.045 5.285 10.908 1.00 0.00 N ATOM 9 CA SER A 2 -9.572 4.115 11.645 1.00 0.00 C ATOM 10 C SER A 2 -8.050 4.004 11.531 1.00 0.00 C ATOM 11 O SER A 2 -7.439 4.685 10.706 1.00 0.00 O ATOM 12 CB SER A 2 -10.234 2.861 11.067 1.00 0.00 C ATOM 13 OG SER A 2 -11.608 3.146 10.796 1.00 0.00 O ATOM 0 H SER A 2 -10.512 5.061 10.029 1.00 0.00 H new ATOM 0 HA SER A 2 -9.835 4.215 12.698 1.00 0.00 H new ATOM 0 HB2 SER A 2 -9.725 2.553 10.153 1.00 0.00 H new ATOM 0 HB3 SER A 2 -10.153 2.033 11.771 1.00 0.00 H new ATOM 0 HG SER A 2 -11.678 3.661 9.965 1.00 0.00 H new ATOM 19 N GLU A 3 -7.442 3.128 12.321 1.00 0.00 N ATOM 20 CA GLU A 3 -5.993 2.951 12.258 1.00 0.00 C ATOM 21 C GLU A 3 -5.565 2.550 10.858 1.00 0.00 C ATOM 22 O GLU A 3 -4.644 3.132 10.297 1.00 0.00 O ATOM 23 CB GLU A 3 -5.526 1.889 13.261 1.00 0.00 C ATOM 24 CG GLU A 3 -5.118 2.556 14.578 1.00 0.00 C ATOM 25 CD GLU A 3 -5.903 1.964 15.719 1.00 0.00 C ATOM 26 OE1 GLU A 3 -5.623 0.849 16.084 1.00 0.00 O ATOM 27 OE2 GLU A 3 -6.780 2.637 16.216 1.00 0.00 O ATOM 0 H GLU A 3 -7.918 2.537 13.003 1.00 0.00 H new ATOM 0 HA GLU A 3 -5.531 3.904 12.515 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -6.325 1.170 13.440 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -4.684 1.333 12.849 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -4.050 2.418 14.750 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -5.296 3.630 14.522 1.00 0.00 H new ATOM 34 N LEU A 4 -6.273 1.599 10.271 1.00 0.00 N ATOM 35 CA LEU A 4 -5.953 1.166 8.913 1.00 0.00 C ATOM 36 C LEU A 4 -6.121 2.328 7.960 1.00 0.00 C ATOM 37 O LEU A 4 -5.264 2.582 7.116 1.00 0.00 O ATOM 38 CB LEU A 4 -6.861 0.001 8.474 1.00 0.00 C ATOM 39 CG LEU A 4 -6.537 -1.296 9.255 1.00 0.00 C ATOM 40 CD1 LEU A 4 -5.035 -1.405 9.552 1.00 0.00 C ATOM 41 CD2 LEU A 4 -7.320 -1.325 10.571 1.00 0.00 C ATOM 0 H LEU A 4 -7.062 1.116 10.702 1.00 0.00 H new ATOM 0 HA LEU A 4 -4.920 0.819 8.897 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.905 0.272 8.633 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -6.737 -0.176 7.406 1.00 0.00 H new ATOM 0 HG LEU A 4 -6.829 -2.143 8.634 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -4.839 -2.326 10.101 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -4.479 -1.416 8.615 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -4.720 -0.551 10.151 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -7.086 -2.241 11.114 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -7.044 -0.463 11.178 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -8.389 -1.292 10.359 1.00 0.00 H new ATOM 53 N GLU A 5 -7.193 3.068 8.149 1.00 0.00 N ATOM 54 CA GLU A 5 -7.457 4.230 7.330 1.00 0.00 C ATOM 55 C GLU A 5 -6.369 5.284 7.588 1.00 0.00 C ATOM 56 O GLU A 5 -5.719 5.773 6.662 1.00 0.00 O ATOM 57 CB GLU A 5 -8.847 4.783 7.704 1.00 0.00 C ATOM 58 CG GLU A 5 -9.930 3.754 7.305 1.00 0.00 C ATOM 59 CD GLU A 5 -11.315 4.205 7.757 1.00 0.00 C ATOM 60 OE1 GLU A 5 -11.427 4.713 8.859 1.00 0.00 O ATOM 61 OE2 GLU A 5 -12.250 4.024 7.008 1.00 0.00 O ATOM 0 H GLU A 5 -7.897 2.884 8.864 1.00 0.00 H new ATOM 0 HA GLU A 5 -7.445 3.969 6.272 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -8.896 4.983 8.774 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -9.024 5.730 7.194 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -9.924 3.618 6.224 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -9.697 2.786 7.750 1.00 0.00 H new ATOM 68 N THR A 6 -6.099 5.521 8.858 1.00 0.00 N ATOM 69 CA THR A 6 -5.060 6.449 9.273 1.00 0.00 C ATOM 70 C THR A 6 -3.682 5.980 8.808 1.00 0.00 C ATOM 71 O THR A 6 -2.870 6.780 8.325 1.00 0.00 O ATOM 72 CB THR A 6 -5.104 6.632 10.792 1.00 0.00 C ATOM 73 OG1 THR A 6 -6.453 6.852 11.183 1.00 0.00 O ATOM 74 CG2 THR A 6 -4.263 7.846 11.194 1.00 0.00 C ATOM 0 H THR A 6 -6.593 5.077 9.632 1.00 0.00 H new ATOM 0 HA THR A 6 -5.245 7.415 8.802 1.00 0.00 H new ATOM 0 HB THR A 6 -4.706 5.742 11.280 1.00 0.00 H new ATOM 0 HG1 THR A 6 -6.951 6.010 11.127 1.00 0.00 H new ATOM 0 HG21 THR A 6 -4.298 7.971 12.276 1.00 0.00 H new ATOM 0 HG22 THR A 6 -3.230 7.693 10.880 1.00 0.00 H new ATOM 0 HG23 THR A 6 -4.660 8.739 10.713 1.00 0.00 H new ATOM 82 N ALA A 7 -3.408 4.694 8.956 1.00 0.00 N ATOM 83 CA ALA A 7 -2.126 4.156 8.540 1.00 0.00 C ATOM 84 C ALA A 7 -1.871 4.532 7.095 1.00 0.00 C ATOM 85 O ALA A 7 -0.803 5.049 6.755 1.00 0.00 O ATOM 86 CB ALA A 7 -2.112 2.628 8.694 1.00 0.00 C ATOM 0 H ALA A 7 -4.050 4.010 9.357 1.00 0.00 H new ATOM 0 HA ALA A 7 -1.341 4.574 9.170 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -1.144 2.239 8.378 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -2.285 2.366 9.738 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -2.897 2.193 8.076 1.00 0.00 H new ATOM 92 N MET A 8 -2.894 4.367 6.268 1.00 0.00 N ATOM 93 CA MET A 8 -2.799 4.757 4.873 1.00 0.00 C ATOM 94 C MET A 8 -2.635 6.268 4.761 1.00 0.00 C ATOM 95 O MET A 8 -1.786 6.753 4.003 1.00 0.00 O ATOM 96 CB MET A 8 -4.034 4.294 4.102 1.00 0.00 C ATOM 97 CG MET A 8 -4.106 2.760 4.127 1.00 0.00 C ATOM 98 SD MET A 8 -2.563 2.061 3.493 1.00 0.00 S ATOM 99 CE MET A 8 -2.704 2.681 1.806 1.00 0.00 C ATOM 0 H MET A 8 -3.793 3.968 6.539 1.00 0.00 H new ATOM 0 HA MET A 8 -1.923 4.277 4.436 1.00 0.00 H new ATOM 0 HB2 MET A 8 -4.934 4.719 4.547 1.00 0.00 H new ATOM 0 HB3 MET A 8 -3.988 4.650 3.073 1.00 0.00 H new ATOM 0 HG2 MET A 8 -4.282 2.412 5.145 1.00 0.00 H new ATOM 0 HG3 MET A 8 -4.946 2.417 3.523 1.00 0.00 H new ATOM 0 HE1 MET A 8 -2.105 2.061 1.139 1.00 0.00 H new ATOM 0 HE2 MET A 8 -3.747 2.648 1.492 1.00 0.00 H new ATOM 0 HE3 MET A 8 -2.345 3.710 1.765 1.00 0.00 H new ATOM 109 N GLU A 9 -3.361 7.007 5.597 1.00 0.00 N ATOM 110 CA GLU A 9 -3.220 8.461 5.630 1.00 0.00 C ATOM 111 C GLU A 9 -1.808 8.818 6.059 1.00 0.00 C ATOM 112 O GLU A 9 -1.220 9.793 5.585 1.00 0.00 O ATOM 113 CB GLU A 9 -4.207 9.088 6.628 1.00 0.00 C ATOM 114 CG GLU A 9 -5.652 8.950 6.127 1.00 0.00 C ATOM 115 CD GLU A 9 -6.634 9.483 7.172 1.00 0.00 C ATOM 116 OE1 GLU A 9 -6.205 9.833 8.257 1.00 0.00 O ATOM 117 OE2 GLU A 9 -7.808 9.516 6.886 1.00 0.00 O ATOM 0 H GLU A 9 -4.045 6.629 6.253 1.00 0.00 H new ATOM 0 HA GLU A 9 -3.430 8.847 4.633 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -4.106 8.603 7.599 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -3.966 10.141 6.771 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -5.773 9.498 5.193 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -5.871 7.904 5.914 1.00 0.00 H new ATOM 124 N THR A 10 -1.278 8.044 6.977 1.00 0.00 N ATOM 125 CA THR A 10 0.051 8.287 7.492 1.00 0.00 C ATOM 126 C THR A 10 1.043 8.224 6.332 1.00 0.00 C ATOM 127 O THR A 10 1.836 9.148 6.122 1.00 0.00 O ATOM 128 CB THR A 10 0.393 7.231 8.559 1.00 0.00 C ATOM 129 OG1 THR A 10 -0.718 7.079 9.447 1.00 0.00 O ATOM 130 CG2 THR A 10 1.610 7.688 9.374 1.00 0.00 C ATOM 0 H THR A 10 -1.749 7.236 7.385 1.00 0.00 H new ATOM 0 HA THR A 10 0.103 9.272 7.957 1.00 0.00 H new ATOM 0 HB THR A 10 0.615 6.285 8.064 1.00 0.00 H new ATOM 0 HG1 THR A 10 -1.497 7.546 9.079 1.00 0.00 H new ATOM 0 HG21 THR A 10 1.847 6.936 10.127 1.00 0.00 H new ATOM 0 HG22 THR A 10 2.465 7.818 8.710 1.00 0.00 H new ATOM 0 HG23 THR A 10 1.385 8.635 9.865 1.00 0.00 H new ATOM 138 N LEU A 11 0.881 7.213 5.488 1.00 0.00 N ATOM 139 CA LEU A 11 1.684 7.106 4.279 1.00 0.00 C ATOM 140 C LEU A 11 1.411 8.309 3.381 1.00 0.00 C ATOM 141 O LEU A 11 2.330 8.881 2.790 1.00 0.00 O ATOM 142 CB LEU A 11 1.357 5.806 3.528 1.00 0.00 C ATOM 143 CG LEU A 11 1.812 4.583 4.345 1.00 0.00 C ATOM 144 CD1 LEU A 11 1.324 3.304 3.662 1.00 0.00 C ATOM 145 CD2 LEU A 11 3.343 4.544 4.443 1.00 0.00 C ATOM 0 H LEU A 11 0.205 6.460 5.618 1.00 0.00 H new ATOM 0 HA LEU A 11 2.738 7.088 4.555 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.285 5.747 3.340 1.00 0.00 H new ATOM 0 HB3 LEU A 11 1.851 5.806 2.556 1.00 0.00 H new ATOM 0 HG LEU A 11 1.391 4.657 5.348 1.00 0.00 H new ATOM 0 HD11 LEU A 11 1.646 2.438 4.240 1.00 0.00 H new ATOM 0 HD12 LEU A 11 0.236 3.316 3.602 1.00 0.00 H new ATOM 0 HD13 LEU A 11 1.742 3.246 2.657 1.00 0.00 H new ATOM 0 HD21 LEU A 11 3.648 3.674 5.024 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.770 4.481 3.442 1.00 0.00 H new ATOM 0 HD23 LEU A 11 3.699 5.450 4.933 1.00 0.00 H new ATOM 157 N ILE A 12 0.144 8.707 3.302 1.00 0.00 N ATOM 158 CA ILE A 12 -0.242 9.859 2.486 1.00 0.00 C ATOM 159 C ILE A 12 0.437 11.115 3.019 1.00 0.00 C ATOM 160 O ILE A 12 0.971 11.919 2.247 1.00 0.00 O ATOM 161 CB ILE A 12 -1.778 10.047 2.507 1.00 0.00 C ATOM 162 CG1 ILE A 12 -2.487 8.890 1.780 1.00 0.00 C ATOM 163 CG2 ILE A 12 -2.167 11.374 1.848 1.00 0.00 C ATOM 164 CD1 ILE A 12 -2.227 8.955 0.267 1.00 0.00 C ATOM 0 H ILE A 12 -0.629 8.254 3.789 1.00 0.00 H new ATOM 0 HA ILE A 12 0.074 9.682 1.458 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.095 10.055 3.550 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -2.134 7.937 2.174 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.559 8.937 1.972 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -3.251 11.488 1.872 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.703 12.199 2.389 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.825 11.380 0.813 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.738 8.128 -0.226 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -2.603 9.900 -0.126 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.156 8.884 0.079 1.00 0.00 H new ATOM 176 N ASN A 13 0.440 11.268 4.330 1.00 0.00 N ATOM 177 CA ASN A 13 1.058 12.436 4.948 1.00 0.00 C ATOM 178 C ASN A 13 2.530 12.479 4.605 1.00 0.00 C ATOM 179 O ASN A 13 3.051 13.520 4.195 1.00 0.00 O ATOM 180 CB ASN A 13 0.890 12.373 6.464 1.00 0.00 C ATOM 181 CG ASN A 13 -0.505 12.827 6.855 1.00 0.00 C ATOM 182 OD1 ASN A 13 -0.743 14.026 7.019 1.00 0.00 O ATOM 183 ND2 ASN A 13 -1.449 11.953 6.996 1.00 0.00 N ATOM 0 H ASN A 13 0.026 10.606 4.987 1.00 0.00 H new ATOM 0 HA ASN A 13 0.572 13.335 4.569 1.00 0.00 H new ATOM 0 HB2 ASN A 13 1.061 11.355 6.814 1.00 0.00 H new ATOM 0 HB3 ASN A 13 1.635 13.006 6.947 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -2.391 12.255 7.243 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -1.251 10.962 6.860 1.00 0.00 H new ATOM 190 N VAL A 14 3.174 11.327 4.669 1.00 0.00 N ATOM 191 CA VAL A 14 4.560 11.214 4.263 1.00 0.00 C ATOM 192 C VAL A 14 4.684 11.503 2.776 1.00 0.00 C ATOM 193 O VAL A 14 5.545 12.274 2.346 1.00 0.00 O ATOM 194 CB VAL A 14 5.069 9.803 4.580 1.00 0.00 C ATOM 195 CG1 VAL A 14 6.466 9.589 3.990 1.00 0.00 C ATOM 196 CG2 VAL A 14 5.128 9.631 6.095 1.00 0.00 C ATOM 0 H VAL A 14 2.757 10.457 4.999 1.00 0.00 H new ATOM 0 HA VAL A 14 5.164 11.939 4.809 1.00 0.00 H new ATOM 0 HB VAL A 14 4.391 9.071 4.141 1.00 0.00 H new ATOM 0 HG11 VAL A 14 6.810 8.582 4.226 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.427 9.715 2.908 1.00 0.00 H new ATOM 0 HG13 VAL A 14 7.156 10.317 4.416 1.00 0.00 H new ATOM 0 HG21 VAL A 14 5.489 8.631 6.334 1.00 0.00 H new ATOM 0 HG22 VAL A 14 5.806 10.372 6.519 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.132 9.767 6.516 1.00 0.00 H new ATOM 206 N PHE A 15 3.798 10.899 1.998 1.00 0.00 N ATOM 207 CA PHE A 15 3.807 11.077 0.556 1.00 0.00 C ATOM 208 C PHE A 15 3.644 12.552 0.222 1.00 0.00 C ATOM 209 O PHE A 15 4.458 13.134 -0.495 1.00 0.00 O ATOM 210 CB PHE A 15 2.648 10.274 -0.056 1.00 0.00 C ATOM 211 CG PHE A 15 2.689 10.343 -1.560 1.00 0.00 C ATOM 212 CD1 PHE A 15 3.521 9.475 -2.274 1.00 0.00 C ATOM 213 CD2 PHE A 15 1.890 11.266 -2.243 1.00 0.00 C ATOM 214 CE1 PHE A 15 3.552 9.529 -3.667 1.00 0.00 C ATOM 215 CE2 PHE A 15 1.924 11.321 -3.638 1.00 0.00 C ATOM 216 CZ PHE A 15 2.753 10.450 -4.349 1.00 0.00 C ATOM 0 H PHE A 15 3.063 10.281 2.343 1.00 0.00 H new ATOM 0 HA PHE A 15 4.753 10.723 0.147 1.00 0.00 H new ATOM 0 HB2 PHE A 15 2.708 9.235 0.267 1.00 0.00 H new ATOM 0 HB3 PHE A 15 1.697 10.665 0.305 1.00 0.00 H new ATOM 0 HD1 PHE A 15 4.139 8.763 -1.747 1.00 0.00 H new ATOM 0 HD2 PHE A 15 1.247 11.936 -1.692 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.194 8.859 -4.219 1.00 0.00 H new ATOM 0 HE2 PHE A 15 1.310 12.036 -4.166 1.00 0.00 H new ATOM 0 HZ PHE A 15 2.776 10.489 -5.428 1.00 0.00 H new ATOM 226 N HIS A 16 2.664 13.180 0.859 1.00 0.00 N ATOM 227 CA HIS A 16 2.446 14.614 0.684 1.00 0.00 C ATOM 228 C HIS A 16 3.607 15.428 1.221 1.00 0.00 C ATOM 229 O HIS A 16 4.026 16.411 0.593 1.00 0.00 O ATOM 230 CB HIS A 16 1.121 15.054 1.328 1.00 0.00 C ATOM 231 CG HIS A 16 0.040 15.036 0.283 1.00 0.00 C ATOM 232 ND1 HIS A 16 -0.395 16.194 -0.333 1.00 0.00 N ATOM 233 CD2 HIS A 16 -0.684 14.014 -0.283 1.00 0.00 C ATOM 234 CE1 HIS A 16 -1.340 15.855 -1.229 1.00 0.00 C ATOM 235 NE2 HIS A 16 -1.557 14.536 -1.244 1.00 0.00 N ATOM 0 H HIS A 16 2.011 12.725 1.497 1.00 0.00 H new ATOM 0 HA HIS A 16 2.382 14.804 -0.387 1.00 0.00 H new ATOM 0 HB2 HIS A 16 0.862 14.386 2.150 1.00 0.00 H new ATOM 0 HB3 HIS A 16 1.221 16.054 1.749 1.00 0.00 H new ATOM 0 HD1 HIS A 16 -0.059 17.138 -0.142 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -0.593 12.969 -0.026 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -1.860 16.562 -1.859 1.00 0.00 H new ATOM 244 N ALA A 17 4.169 15.005 2.344 1.00 0.00 N ATOM 245 CA ALA A 17 5.324 15.698 2.892 1.00 0.00 C ATOM 246 C ALA A 17 6.419 15.742 1.845 1.00 0.00 C ATOM 247 O ALA A 17 6.973 16.801 1.547 1.00 0.00 O ATOM 248 CB ALA A 17 5.838 14.985 4.148 1.00 0.00 C ATOM 0 H ALA A 17 3.851 14.201 2.885 1.00 0.00 H new ATOM 0 HA ALA A 17 5.031 16.711 3.168 1.00 0.00 H new ATOM 0 HB1 ALA A 17 6.702 15.520 4.542 1.00 0.00 H new ATOM 0 HB2 ALA A 17 5.051 14.963 4.902 1.00 0.00 H new ATOM 0 HB3 ALA A 17 6.127 13.965 3.895 1.00 0.00 H new ATOM 254 N HIS A 18 6.676 14.600 1.236 1.00 0.00 N ATOM 255 CA HIS A 18 7.660 14.520 0.170 1.00 0.00 C ATOM 256 C HIS A 18 7.193 15.231 -1.113 1.00 0.00 C ATOM 257 O HIS A 18 7.993 15.875 -1.778 1.00 0.00 O ATOM 258 CB HIS A 18 8.054 13.079 -0.116 1.00 0.00 C ATOM 259 CG HIS A 18 8.887 12.535 1.020 1.00 0.00 C ATOM 260 ND1 HIS A 18 10.252 12.777 1.127 1.00 0.00 N ATOM 261 CD2 HIS A 18 8.560 11.753 2.100 1.00 0.00 C ATOM 262 CE1 HIS A 18 10.684 12.150 2.240 1.00 0.00 C ATOM 263 NE2 HIS A 18 9.692 11.508 2.870 1.00 0.00 N ATOM 0 H HIS A 18 6.219 13.716 1.460 1.00 0.00 H new ATOM 0 HA HIS A 18 8.546 15.048 0.523 1.00 0.00 H new ATOM 0 HB2 HIS A 18 7.161 12.468 -0.247 1.00 0.00 H new ATOM 0 HB3 HIS A 18 8.616 13.025 -1.048 1.00 0.00 H new ATOM 0 HD1 HIS A 18 10.821 13.327 0.483 1.00 0.00 H new ATOM 0 HD2 HIS A 18 7.570 11.383 2.319 1.00 0.00 H new ATOM 0 HE1 HIS A 18 11.708 12.164 2.582 1.00 0.00 H new ATOM 0 HE2 HIS A 18 9.753 10.959 3.728 1.00 0.00 H new ATOM 272 N SER A 19 5.903 15.136 -1.457 1.00 0.00 N ATOM 273 CA SER A 19 5.413 15.796 -2.685 1.00 0.00 C ATOM 274 C SER A 19 5.793 17.274 -2.669 1.00 0.00 C ATOM 275 O SER A 19 6.282 17.829 -3.666 1.00 0.00 O ATOM 276 CB SER A 19 3.882 15.650 -2.820 1.00 0.00 C ATOM 277 OG SER A 19 3.539 14.274 -2.967 1.00 0.00 O ATOM 0 H SER A 19 5.196 14.628 -0.926 1.00 0.00 H new ATOM 0 HA SER A 19 5.880 15.311 -3.542 1.00 0.00 H new ATOM 0 HB2 SER A 19 3.389 16.065 -1.941 1.00 0.00 H new ATOM 0 HB3 SER A 19 3.528 16.216 -3.681 1.00 0.00 H new ATOM 0 HG SER A 19 4.330 13.768 -3.246 1.00 0.00 H new ATOM 283 N GLY A 20 5.665 17.883 -1.509 1.00 0.00 N ATOM 284 CA GLY A 20 6.065 19.264 -1.335 1.00 0.00 C ATOM 285 C GLY A 20 7.564 19.420 -1.553 1.00 0.00 C ATOM 286 O GLY A 20 8.040 20.506 -1.906 1.00 0.00 O ATOM 0 H GLY A 20 5.286 17.443 -0.671 1.00 0.00 H new ATOM 0 HA2 GLY A 20 5.522 19.897 -2.037 1.00 0.00 H new ATOM 0 HA3 GLY A 20 5.801 19.601 -0.333 1.00 0.00 H new ATOM 290 N LYS A 21 8.309 18.342 -1.309 1.00 0.00 N ATOM 291 CA LYS A 21 9.762 18.369 -1.430 1.00 0.00 C ATOM 292 C LYS A 21 10.176 18.679 -2.854 1.00 0.00 C ATOM 293 O LYS A 21 11.066 19.495 -3.073 1.00 0.00 O ATOM 294 CB LYS A 21 10.390 17.040 -0.970 1.00 0.00 C ATOM 295 CG LYS A 21 11.929 17.138 -0.989 1.00 0.00 C ATOM 296 CD LYS A 21 12.464 17.518 0.405 1.00 0.00 C ATOM 297 CE LYS A 21 12.078 18.959 0.783 1.00 0.00 C ATOM 298 NZ LYS A 21 12.318 19.888 -0.356 1.00 0.00 N ATOM 0 H LYS A 21 7.927 17.439 -1.026 1.00 0.00 H new ATOM 0 HA LYS A 21 10.131 19.160 -0.777 1.00 0.00 H new ATOM 0 HB2 LYS A 21 10.047 16.797 0.036 1.00 0.00 H new ATOM 0 HB3 LYS A 21 10.063 16.231 -1.622 1.00 0.00 H new ATOM 0 HG2 LYS A 21 12.356 16.185 -1.301 1.00 0.00 H new ATOM 0 HG3 LYS A 21 12.243 17.883 -1.721 1.00 0.00 H new ATOM 0 HD2 LYS A 21 12.068 16.827 1.149 1.00 0.00 H new ATOM 0 HD3 LYS A 21 13.549 17.415 0.420 1.00 0.00 H new ATOM 0 HE2 LYS A 21 11.028 18.995 1.072 1.00 0.00 H new ATOM 0 HE3 LYS A 21 12.658 19.280 1.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 12.019 20.848 -0.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 13.331 19.894 -0.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 11.772 19.572 -1.183 1.00 0.00 H new ATOM 312 N GLU A 22 9.536 18.025 -3.819 1.00 0.00 N ATOM 313 CA GLU A 22 9.839 18.271 -5.226 1.00 0.00 C ATOM 314 C GLU A 22 8.931 19.367 -5.789 1.00 0.00 C ATOM 315 O GLU A 22 9.210 19.944 -6.848 1.00 0.00 O ATOM 316 CB GLU A 22 9.748 16.972 -6.042 1.00 0.00 C ATOM 317 CG GLU A 22 8.293 16.495 -6.142 1.00 0.00 C ATOM 318 CD GLU A 22 8.265 14.984 -6.145 1.00 0.00 C ATOM 319 OE1 GLU A 22 8.690 14.407 -5.155 1.00 0.00 O ATOM 320 OE2 GLU A 22 7.853 14.422 -7.143 1.00 0.00 O ATOM 0 H GLU A 22 8.811 17.327 -3.655 1.00 0.00 H new ATOM 0 HA GLU A 22 10.866 18.627 -5.303 1.00 0.00 H new ATOM 0 HB2 GLU A 22 10.152 17.135 -7.041 1.00 0.00 H new ATOM 0 HB3 GLU A 22 10.358 16.199 -5.574 1.00 0.00 H new ATOM 0 HG2 GLU A 22 7.713 16.880 -5.303 1.00 0.00 H new ATOM 0 HG3 GLU A 22 7.833 16.881 -7.052 1.00 0.00 H new ATOM 327 N GLY A 23 7.900 19.714 -5.021 1.00 0.00 N ATOM 328 CA GLY A 23 7.001 20.813 -5.370 1.00 0.00 C ATOM 329 C GLY A 23 5.834 20.369 -6.249 1.00 0.00 C ATOM 330 O GLY A 23 5.168 21.207 -6.866 1.00 0.00 O ATOM 0 H GLY A 23 7.665 19.246 -4.146 1.00 0.00 H new ATOM 0 HA2 GLY A 23 6.611 21.261 -4.456 1.00 0.00 H new ATOM 0 HA3 GLY A 23 7.566 21.587 -5.889 1.00 0.00 H new ATOM 334 N ASP A 24 5.540 19.074 -6.263 1.00 0.00 N ATOM 335 CA ASP A 24 4.380 18.573 -7.021 1.00 0.00 C ATOM 336 C ASP A 24 3.106 18.841 -6.247 1.00 0.00 C ATOM 337 O ASP A 24 3.133 18.880 -5.019 1.00 0.00 O ATOM 338 CB ASP A 24 4.490 17.070 -7.279 1.00 0.00 C ATOM 339 CG ASP A 24 3.485 16.666 -8.341 1.00 0.00 C ATOM 340 OD1 ASP A 24 2.330 16.490 -8.008 1.00 0.00 O ATOM 341 OD2 ASP A 24 3.880 16.551 -9.481 1.00 0.00 O ATOM 0 H ASP A 24 6.072 18.357 -5.771 1.00 0.00 H new ATOM 0 HA ASP A 24 4.360 19.094 -7.978 1.00 0.00 H new ATOM 0 HB2 ASP A 24 5.500 16.819 -7.604 1.00 0.00 H new ATOM 0 HB3 ASP A 24 4.304 16.517 -6.358 1.00 0.00 H new ATOM 346 N LYS A 25 1.973 18.913 -6.941 1.00 0.00 N ATOM 347 CA LYS A 25 0.698 19.032 -6.243 1.00 0.00 C ATOM 348 C LYS A 25 0.503 17.830 -5.346 1.00 0.00 C ATOM 349 O LYS A 25 0.191 17.967 -4.159 1.00 0.00 O ATOM 350 CB LYS A 25 -0.489 19.169 -7.210 1.00 0.00 C ATOM 351 CG LYS A 25 -0.537 18.012 -8.226 1.00 0.00 C ATOM 352 CD LYS A 25 -1.803 18.165 -9.084 1.00 0.00 C ATOM 353 CE LYS A 25 -2.056 16.886 -9.893 1.00 0.00 C ATOM 354 NZ LYS A 25 -1.093 16.793 -11.009 1.00 0.00 N ATOM 0 H LYS A 25 1.911 18.892 -7.959 1.00 0.00 H new ATOM 0 HA LYS A 25 0.729 19.944 -5.647 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -1.419 19.193 -6.642 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -0.416 20.117 -7.742 1.00 0.00 H new ATOM 0 HG2 LYS A 25 0.352 18.026 -8.857 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -0.545 17.053 -7.707 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -2.661 18.375 -8.445 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -1.693 19.014 -9.758 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -1.961 16.013 -9.247 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -3.075 16.887 -10.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -1.272 15.924 -11.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -1.203 17.618 -11.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -0.124 16.771 -10.631 1.00 0.00 H new ATOM 368 N TYR A 26 0.836 16.669 -5.881 1.00 0.00 N ATOM 369 CA TYR A 26 0.878 15.441 -5.119 1.00 0.00 C ATOM 370 C TYR A 26 1.466 14.311 -5.956 1.00 0.00 C ATOM 371 O TYR A 26 0.749 13.552 -6.623 1.00 0.00 O ATOM 372 CB TYR A 26 -0.506 15.067 -4.540 1.00 0.00 C ATOM 373 CG TYR A 26 -1.600 15.282 -5.569 1.00 0.00 C ATOM 374 CD1 TYR A 26 -1.923 14.265 -6.464 1.00 0.00 C ATOM 375 CD2 TYR A 26 -2.296 16.496 -5.618 1.00 0.00 C ATOM 376 CE1 TYR A 26 -2.925 14.455 -7.410 1.00 0.00 C ATOM 377 CE2 TYR A 26 -3.302 16.686 -6.569 1.00 0.00 C ATOM 378 CZ TYR A 26 -3.615 15.663 -7.464 1.00 0.00 C ATOM 379 OH TYR A 26 -4.598 15.842 -8.407 1.00 0.00 O ATOM 0 H TYR A 26 1.086 16.555 -6.863 1.00 0.00 H new ATOM 0 HA TYR A 26 1.534 15.604 -4.264 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -0.501 14.025 -4.221 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -0.710 15.670 -3.655 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -1.393 13.325 -6.423 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -2.055 17.285 -4.921 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -3.168 13.664 -8.104 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -3.836 17.624 -6.611 1.00 0.00 H new ATOM 0 HH TYR A 26 -5.016 16.719 -8.281 1.00 0.00 H new ATOM 389 N LYS A 27 2.756 14.138 -5.803 1.00 0.00 N ATOM 390 CA LYS A 27 3.517 13.065 -6.407 1.00 0.00 C ATOM 391 C LYS A 27 4.743 12.867 -5.569 1.00 0.00 C ATOM 392 O LYS A 27 5.073 13.727 -4.756 1.00 0.00 O ATOM 393 CB LYS A 27 3.962 13.396 -7.839 1.00 0.00 C ATOM 394 CG LYS A 27 2.781 13.375 -8.815 1.00 0.00 C ATOM 395 CD LYS A 27 2.346 11.923 -9.098 1.00 0.00 C ATOM 396 CE LYS A 27 3.306 11.276 -10.112 1.00 0.00 C ATOM 397 NZ LYS A 27 3.172 11.933 -11.437 1.00 0.00 N ATOM 0 H LYS A 27 3.328 14.762 -5.234 1.00 0.00 H new ATOM 0 HA LYS A 27 2.889 12.175 -6.455 1.00 0.00 H new ATOM 0 HB2 LYS A 27 4.432 14.379 -7.857 1.00 0.00 H new ATOM 0 HB3 LYS A 27 4.715 12.677 -8.162 1.00 0.00 H new ATOM 0 HG2 LYS A 27 1.946 13.937 -8.398 1.00 0.00 H new ATOM 0 HG3 LYS A 27 3.062 13.866 -9.747 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.341 11.349 -8.172 1.00 0.00 H new ATOM 0 HD3 LYS A 27 1.328 11.909 -9.488 1.00 0.00 H new ATOM 0 HE2 LYS A 27 4.333 11.362 -9.757 1.00 0.00 H new ATOM 0 HE3 LYS A 27 3.088 10.212 -10.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 2.831 11.241 -12.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 2.494 12.719 -11.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 4.097 12.300 -11.738 1.00 0.00 H new ATOM 411 N LEU A 28 5.451 11.801 -5.798 1.00 0.00 N ATOM 412 CA LEU A 28 6.697 11.596 -5.121 1.00 0.00 C ATOM 413 C LEU A 28 7.798 11.384 -6.143 1.00 0.00 C ATOM 414 O LEU A 28 7.642 10.617 -7.092 1.00 0.00 O ATOM 415 CB LEU A 28 6.587 10.403 -4.164 1.00 0.00 C ATOM 416 CG LEU A 28 7.941 10.120 -3.519 1.00 0.00 C ATOM 417 CD1 LEU A 28 8.282 11.246 -2.559 1.00 0.00 C ATOM 418 CD2 LEU A 28 7.874 8.802 -2.760 1.00 0.00 C ATOM 0 H LEU A 28 5.187 11.060 -6.448 1.00 0.00 H new ATOM 0 HA LEU A 28 6.942 12.477 -4.527 1.00 0.00 H new ATOM 0 HB2 LEU A 28 5.845 10.613 -3.393 1.00 0.00 H new ATOM 0 HB3 LEU A 28 6.243 9.522 -4.707 1.00 0.00 H new ATOM 0 HG LEU A 28 8.709 10.053 -4.289 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.249 11.049 -2.095 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.327 12.188 -3.105 1.00 0.00 H new ATOM 0 HD13 LEU A 28 7.516 11.310 -1.787 1.00 0.00 H new ATOM 0 HD21 LEU A 28 8.840 8.598 -2.299 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.109 8.866 -1.986 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.625 7.997 -3.451 1.00 0.00 H new ATOM 430 N SER A 29 8.872 12.109 -6.007 1.00 0.00 N ATOM 431 CA SER A 29 9.970 11.981 -6.928 1.00 0.00 C ATOM 432 C SER A 29 10.786 10.752 -6.564 1.00 0.00 C ATOM 433 O SER A 29 10.815 10.344 -5.394 1.00 0.00 O ATOM 434 CB SER A 29 10.828 13.258 -6.882 1.00 0.00 C ATOM 435 OG SER A 29 11.061 13.637 -5.524 1.00 0.00 O ATOM 0 H SER A 29 9.013 12.796 -5.267 1.00 0.00 H new ATOM 0 HA SER A 29 9.599 11.858 -7.946 1.00 0.00 H new ATOM 0 HB2 SER A 29 11.777 13.087 -7.389 1.00 0.00 H new ATOM 0 HB3 SER A 29 10.323 14.065 -7.413 1.00 0.00 H new ATOM 0 HG SER A 29 10.269 14.093 -5.171 1.00 0.00 H new ATOM 441 N LYS A 30 11.525 10.193 -7.518 1.00 0.00 N ATOM 442 CA LYS A 30 12.373 9.065 -7.167 1.00 0.00 C ATOM 443 C LYS A 30 13.584 9.579 -6.417 1.00 0.00 C ATOM 444 O LYS A 30 14.338 8.815 -5.813 1.00 0.00 O ATOM 445 CB LYS A 30 12.805 8.243 -8.394 1.00 0.00 C ATOM 446 CG LYS A 30 11.592 7.856 -9.267 1.00 0.00 C ATOM 447 CD LYS A 30 10.522 7.114 -8.430 1.00 0.00 C ATOM 448 CE LYS A 30 10.168 5.742 -9.047 1.00 0.00 C ATOM 449 NZ LYS A 30 8.947 5.849 -9.928 1.00 0.00 N ATOM 0 H LYS A 30 11.555 10.486 -8.494 1.00 0.00 H new ATOM 0 HA LYS A 30 11.795 8.390 -6.536 1.00 0.00 H new ATOM 0 HB2 LYS A 30 13.514 8.819 -8.988 1.00 0.00 H new ATOM 0 HB3 LYS A 30 13.322 7.341 -8.066 1.00 0.00 H new ATOM 0 HG2 LYS A 30 11.156 8.752 -9.709 1.00 0.00 H new ATOM 0 HG3 LYS A 30 11.919 7.221 -10.091 1.00 0.00 H new ATOM 0 HD2 LYS A 30 10.888 6.973 -7.413 1.00 0.00 H new ATOM 0 HD3 LYS A 30 9.623 7.726 -8.363 1.00 0.00 H new ATOM 0 HE2 LYS A 30 11.011 5.372 -9.630 1.00 0.00 H new ATOM 0 HE3 LYS A 30 9.987 5.017 -8.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 8.096 5.642 -9.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 8.881 6.812 -10.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 9.022 5.167 -10.709 1.00 0.00 H new ATOM 463 N LYS A 31 13.680 10.900 -6.369 1.00 0.00 N ATOM 464 CA LYS A 31 14.721 11.592 -5.641 1.00 0.00 C ATOM 465 C LYS A 31 14.553 11.233 -4.185 1.00 0.00 C ATOM 466 O LYS A 31 15.502 10.925 -3.470 1.00 0.00 O ATOM 467 CB LYS A 31 14.420 13.089 -5.739 1.00 0.00 C ATOM 468 CG LYS A 31 14.384 13.529 -7.198 1.00 0.00 C ATOM 469 CD LYS A 31 13.921 14.981 -7.272 1.00 0.00 C ATOM 470 CE LYS A 31 13.651 15.348 -8.728 1.00 0.00 C ATOM 471 NZ LYS A 31 14.929 15.475 -9.463 1.00 0.00 N ATOM 0 H LYS A 31 13.027 11.524 -6.842 1.00 0.00 H new ATOM 0 HA LYS A 31 15.710 11.340 -6.024 1.00 0.00 H new ATOM 0 HB2 LYS A 31 13.464 13.306 -5.263 1.00 0.00 H new ATOM 0 HB3 LYS A 31 15.180 13.655 -5.200 1.00 0.00 H new ATOM 0 HG2 LYS A 31 15.372 13.427 -7.646 1.00 0.00 H new ATOM 0 HG3 LYS A 31 13.709 12.890 -7.767 1.00 0.00 H new ATOM 0 HD2 LYS A 31 13.018 15.118 -6.677 1.00 0.00 H new ATOM 0 HD3 LYS A 31 14.682 15.640 -6.854 1.00 0.00 H new ATOM 0 HE2 LYS A 31 13.028 14.585 -9.194 1.00 0.00 H new ATOM 0 HE3 LYS A 31 13.098 16.286 -8.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 14.743 15.823 -10.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 15.550 16.145 -8.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 15.393 14.546 -9.515 1.00 0.00 H new ATOM 485 N GLU A 32 13.312 11.310 -3.770 1.00 0.00 N ATOM 486 CA GLU A 32 12.910 11.069 -2.414 1.00 0.00 C ATOM 487 C GLU A 32 12.609 9.600 -2.204 1.00 0.00 C ATOM 488 O GLU A 32 12.703 9.094 -1.096 1.00 0.00 O ATOM 489 CB GLU A 32 11.666 11.915 -2.140 1.00 0.00 C ATOM 490 CG GLU A 32 12.043 13.394 -2.241 1.00 0.00 C ATOM 491 CD GLU A 32 12.823 13.800 -1.012 1.00 0.00 C ATOM 492 OE1 GLU A 32 12.231 13.834 0.041 1.00 0.00 O ATOM 493 OE2 GLU A 32 14.004 14.049 -1.130 1.00 0.00 O ATOM 0 H GLU A 32 12.536 11.549 -4.387 1.00 0.00 H new ATOM 0 HA GLU A 32 13.711 11.342 -1.727 1.00 0.00 H new ATOM 0 HB2 GLU A 32 10.881 11.676 -2.858 1.00 0.00 H new ATOM 0 HB3 GLU A 32 11.270 11.693 -1.149 1.00 0.00 H new ATOM 0 HG2 GLU A 32 12.639 13.568 -3.137 1.00 0.00 H new ATOM 0 HG3 GLU A 32 11.144 14.004 -2.332 1.00 0.00 H new ATOM 500 N LEU A 33 12.182 8.931 -3.262 1.00 0.00 N ATOM 501 CA LEU A 33 11.729 7.554 -3.133 1.00 0.00 C ATOM 502 C LEU A 33 12.823 6.690 -2.538 1.00 0.00 C ATOM 503 O LEU A 33 12.595 5.975 -1.560 1.00 0.00 O ATOM 504 CB LEU A 33 11.315 7.004 -4.519 1.00 0.00 C ATOM 505 CG LEU A 33 10.675 5.601 -4.409 1.00 0.00 C ATOM 506 CD1 LEU A 33 11.769 4.533 -4.287 1.00 0.00 C ATOM 507 CD2 LEU A 33 9.730 5.525 -3.202 1.00 0.00 C ATOM 0 H LEU A 33 12.139 9.311 -4.208 1.00 0.00 H new ATOM 0 HA LEU A 33 10.867 7.531 -2.467 1.00 0.00 H new ATOM 0 HB2 LEU A 33 10.609 7.690 -4.987 1.00 0.00 H new ATOM 0 HB3 LEU A 33 12.190 6.955 -5.167 1.00 0.00 H new ATOM 0 HG LEU A 33 10.094 5.417 -5.312 1.00 0.00 H new ATOM 0 HD11 LEU A 33 11.309 3.548 -4.210 1.00 0.00 H new ATOM 0 HD12 LEU A 33 12.410 4.566 -5.168 1.00 0.00 H new ATOM 0 HD13 LEU A 33 12.367 4.725 -3.396 1.00 0.00 H new ATOM 0 HD21 LEU A 33 9.292 4.529 -3.145 1.00 0.00 H new ATOM 0 HD22 LEU A 33 10.289 5.728 -2.289 1.00 0.00 H new ATOM 0 HD23 LEU A 33 8.937 6.264 -3.314 1.00 0.00 H new ATOM 519 N LYS A 34 14.019 6.791 -3.086 1.00 0.00 N ATOM 520 CA LYS A 34 15.132 6.016 -2.564 1.00 0.00 C ATOM 521 C LYS A 34 15.517 6.455 -1.149 1.00 0.00 C ATOM 522 O LYS A 34 15.736 5.619 -0.274 1.00 0.00 O ATOM 523 CB LYS A 34 16.338 6.110 -3.510 1.00 0.00 C ATOM 524 CG LYS A 34 16.033 5.347 -4.814 1.00 0.00 C ATOM 525 CD LYS A 34 17.195 5.515 -5.811 1.00 0.00 C ATOM 526 CE LYS A 34 18.375 4.609 -5.421 1.00 0.00 C ATOM 527 NZ LYS A 34 19.388 5.401 -4.672 1.00 0.00 N ATOM 0 H LYS A 34 14.245 7.391 -3.879 1.00 0.00 H new ATOM 0 HA LYS A 34 14.812 4.976 -2.504 1.00 0.00 H new ATOM 0 HB2 LYS A 34 16.559 7.154 -3.731 1.00 0.00 H new ATOM 0 HB3 LYS A 34 17.223 5.691 -3.030 1.00 0.00 H new ATOM 0 HG2 LYS A 34 15.879 4.290 -4.598 1.00 0.00 H new ATOM 0 HG3 LYS A 34 15.109 5.720 -5.255 1.00 0.00 H new ATOM 0 HD2 LYS A 34 16.857 5.268 -6.817 1.00 0.00 H new ATOM 0 HD3 LYS A 34 17.519 6.556 -5.829 1.00 0.00 H new ATOM 0 HE2 LYS A 34 18.022 3.779 -4.808 1.00 0.00 H new ATOM 0 HE3 LYS A 34 18.825 4.177 -6.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 20.180 5.637 -5.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 18.953 6.277 -4.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 19.740 4.843 -3.868 1.00 0.00 H new ATOM 541 N GLU A 35 15.601 7.764 -0.934 1.00 0.00 N ATOM 542 CA GLU A 35 15.988 8.305 0.373 1.00 0.00 C ATOM 543 C GLU A 35 14.888 8.177 1.427 1.00 0.00 C ATOM 544 O GLU A 35 15.152 7.790 2.574 1.00 0.00 O ATOM 545 CB GLU A 35 16.472 9.750 0.243 1.00 0.00 C ATOM 546 CG GLU A 35 17.817 9.751 -0.495 1.00 0.00 C ATOM 547 CD GLU A 35 18.284 11.165 -0.735 1.00 0.00 C ATOM 548 OE1 GLU A 35 17.504 11.946 -1.223 1.00 0.00 O ATOM 549 OE2 GLU A 35 19.415 11.454 -0.428 1.00 0.00 O ATOM 0 H GLU A 35 15.408 8.471 -1.643 1.00 0.00 H new ATOM 0 HA GLU A 35 16.817 7.693 0.729 1.00 0.00 H new ATOM 0 HB2 GLU A 35 15.741 10.346 -0.303 1.00 0.00 H new ATOM 0 HB3 GLU A 35 16.581 10.203 1.229 1.00 0.00 H new ATOM 0 HG2 GLU A 35 18.561 9.210 0.090 1.00 0.00 H new ATOM 0 HG3 GLU A 35 17.718 9.228 -1.446 1.00 0.00 H new ATOM 556 N LEU A 36 13.670 8.516 1.056 1.00 0.00 N ATOM 557 CA LEU A 36 12.558 8.423 1.984 1.00 0.00 C ATOM 558 C LEU A 36 12.281 6.990 2.385 1.00 0.00 C ATOM 559 O LEU A 36 12.050 6.695 3.550 1.00 0.00 O ATOM 560 CB LEU A 36 11.300 9.132 1.429 1.00 0.00 C ATOM 561 CG LEU A 36 10.160 8.143 1.110 1.00 0.00 C ATOM 562 CD1 LEU A 36 9.376 7.802 2.378 1.00 0.00 C ATOM 563 CD2 LEU A 36 9.215 8.786 0.110 1.00 0.00 C ATOM 0 H LEU A 36 13.425 8.856 0.126 1.00 0.00 H new ATOM 0 HA LEU A 36 12.844 8.950 2.894 1.00 0.00 H new ATOM 0 HB2 LEU A 36 10.949 9.865 2.156 1.00 0.00 H new ATOM 0 HB3 LEU A 36 11.565 9.681 0.525 1.00 0.00 H new ATOM 0 HG LEU A 36 10.590 7.229 0.700 1.00 0.00 H new ATOM 0 HD11 LEU A 36 8.576 7.103 2.134 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.045 7.347 3.108 1.00 0.00 H new ATOM 0 HD13 LEU A 36 8.947 8.713 2.797 1.00 0.00 H new ATOM 0 HD21 LEU A 36 8.405 8.094 -0.122 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.801 9.700 0.536 1.00 0.00 H new ATOM 0 HD23 LEU A 36 9.760 9.026 -0.803 1.00 0.00 H new ATOM 575 N LEU A 37 12.299 6.099 1.416 1.00 0.00 N ATOM 576 CA LEU A 37 11.957 4.721 1.690 1.00 0.00 C ATOM 577 C LEU A 37 12.920 4.134 2.701 1.00 0.00 C ATOM 578 O LEU A 37 12.499 3.581 3.720 1.00 0.00 O ATOM 579 CB LEU A 37 11.954 3.903 0.380 1.00 0.00 C ATOM 580 CG LEU A 37 11.659 2.411 0.640 1.00 0.00 C ATOM 581 CD1 LEU A 37 12.910 1.702 1.175 1.00 0.00 C ATOM 582 CD2 LEU A 37 10.512 2.258 1.637 1.00 0.00 C ATOM 0 H LEU A 37 12.543 6.300 0.446 1.00 0.00 H new ATOM 0 HA LEU A 37 10.955 4.680 2.116 1.00 0.00 H new ATOM 0 HB2 LEU A 37 11.206 4.309 -0.301 1.00 0.00 H new ATOM 0 HB3 LEU A 37 12.921 4.002 -0.113 1.00 0.00 H new ATOM 0 HG LEU A 37 11.369 1.952 -0.305 1.00 0.00 H new ATOM 0 HD11 LEU A 37 12.684 0.651 1.353 1.00 0.00 H new ATOM 0 HD12 LEU A 37 13.714 1.782 0.444 1.00 0.00 H new ATOM 0 HD13 LEU A 37 13.222 2.169 2.109 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.318 1.199 1.808 1.00 0.00 H new ATOM 0 HD22 LEU A 37 10.783 2.734 2.579 1.00 0.00 H new ATOM 0 HD23 LEU A 37 9.616 2.731 1.236 1.00 0.00 H new ATOM 594 N GLN A 38 14.201 4.364 2.494 1.00 0.00 N ATOM 595 CA GLN A 38 15.186 3.911 3.456 1.00 0.00 C ATOM 596 C GLN A 38 15.007 4.646 4.773 1.00 0.00 C ATOM 597 O GLN A 38 15.102 4.053 5.844 1.00 0.00 O ATOM 598 CB GLN A 38 16.615 4.102 2.919 1.00 0.00 C ATOM 599 CG GLN A 38 16.897 5.588 2.671 1.00 0.00 C ATOM 600 CD GLN A 38 18.288 5.786 2.093 1.00 0.00 C ATOM 601 OE1 GLN A 38 18.905 4.798 1.545 1.00 0.00 O flip ATOM 602 NE2 GLN A 38 18.828 6.885 2.155 1.00 0.00 N flip ATOM 0 H GLN A 38 14.580 4.853 1.683 1.00 0.00 H new ATOM 0 HA GLN A 38 15.034 2.845 3.625 1.00 0.00 H new ATOM 0 HB2 GLN A 38 17.335 3.703 3.633 1.00 0.00 H new ATOM 0 HB3 GLN A 38 16.740 3.542 1.992 1.00 0.00 H new ATOM 0 HG2 GLN A 38 16.153 5.994 1.986 1.00 0.00 H new ATOM 0 HG3 GLN A 38 16.805 6.141 3.606 1.00 0.00 H new ATOM 0 HE21 GLN A 38 18.341 7.669 2.589 1.00 0.00 H new ATOM 0 HE22 GLN A 38 19.765 7.015 1.773 1.00 0.00 H new ATOM 611 N THR A 39 14.769 5.942 4.684 1.00 0.00 N ATOM 612 CA THR A 39 14.594 6.755 5.866 1.00 0.00 C ATOM 613 C THR A 39 13.347 6.341 6.648 1.00 0.00 C ATOM 614 O THR A 39 13.417 6.073 7.855 1.00 0.00 O ATOM 615 CB THR A 39 14.496 8.229 5.449 1.00 0.00 C ATOM 616 OG1 THR A 39 15.720 8.637 4.830 1.00 0.00 O ATOM 617 CG2 THR A 39 14.199 9.109 6.662 1.00 0.00 C ATOM 0 H THR A 39 14.693 6.451 3.803 1.00 0.00 H new ATOM 0 HA THR A 39 15.453 6.611 6.521 1.00 0.00 H new ATOM 0 HB THR A 39 13.679 8.341 4.736 1.00 0.00 H new ATOM 0 HG1 THR A 39 15.793 8.223 3.945 1.00 0.00 H new ATOM 0 HG21 THR A 39 14.133 10.151 6.348 1.00 0.00 H new ATOM 0 HG22 THR A 39 13.253 8.804 7.110 1.00 0.00 H new ATOM 0 HG23 THR A 39 14.999 9.001 7.395 1.00 0.00 H new ATOM 625 N GLU A 40 12.215 6.297 5.971 1.00 0.00 N ATOM 626 CA GLU A 40 10.958 5.973 6.612 1.00 0.00 C ATOM 627 C GLU A 40 10.885 4.509 7.049 1.00 0.00 C ATOM 628 O GLU A 40 10.373 4.213 8.128 1.00 0.00 O ATOM 629 CB GLU A 40 9.760 6.369 5.728 1.00 0.00 C ATOM 630 CG GLU A 40 9.353 7.848 5.982 1.00 0.00 C ATOM 631 CD GLU A 40 10.251 8.847 5.266 1.00 0.00 C ATOM 632 OE1 GLU A 40 11.438 8.690 5.321 1.00 0.00 O ATOM 633 OE2 GLU A 40 9.727 9.790 4.700 1.00 0.00 O ATOM 0 H GLU A 40 12.142 6.483 4.971 1.00 0.00 H new ATOM 0 HA GLU A 40 10.904 6.567 7.524 1.00 0.00 H new ATOM 0 HB2 GLU A 40 10.016 6.233 4.677 1.00 0.00 H new ATOM 0 HB3 GLU A 40 8.915 5.713 5.937 1.00 0.00 H new ATOM 0 HG2 GLU A 40 8.323 7.996 5.656 1.00 0.00 H new ATOM 0 HG3 GLU A 40 9.380 8.047 7.053 1.00 0.00 H new ATOM 640 N LEU A 41 11.405 3.601 6.227 1.00 0.00 N ATOM 641 CA LEU A 41 11.387 2.166 6.555 1.00 0.00 C ATOM 642 C LEU A 41 12.743 1.714 7.043 1.00 0.00 C ATOM 643 O LEU A 41 13.194 0.605 6.733 1.00 0.00 O ATOM 644 CB LEU A 41 10.983 1.328 5.342 1.00 0.00 C ATOM 645 CG LEU A 41 9.454 1.288 5.217 1.00 0.00 C ATOM 646 CD1 LEU A 41 8.908 2.693 4.941 1.00 0.00 C ATOM 647 CD2 LEU A 41 9.059 0.350 4.078 1.00 0.00 C ATOM 0 H LEU A 41 11.843 3.825 5.333 1.00 0.00 H new ATOM 0 HA LEU A 41 10.651 2.021 7.345 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.419 1.750 4.437 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.374 0.316 5.442 1.00 0.00 H new ATOM 0 HG LEU A 41 9.031 0.923 6.153 1.00 0.00 H new ATOM 0 HD11 LEU A 41 7.822 2.651 4.854 1.00 0.00 H new ATOM 0 HD12 LEU A 41 9.181 3.357 5.761 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.332 3.072 4.011 1.00 0.00 H new ATOM 0 HD21 LEU A 41 7.973 0.322 3.990 1.00 0.00 H new ATOM 0 HD22 LEU A 41 9.490 0.710 3.144 1.00 0.00 H new ATOM 0 HD23 LEU A 41 9.432 -0.653 4.286 1.00 0.00 H new ATOM 659 N SER A 42 13.402 2.569 7.778 1.00 0.00 N ATOM 660 CA SER A 42 14.730 2.277 8.245 1.00 0.00 C ATOM 661 C SER A 42 14.743 0.997 9.069 1.00 0.00 C ATOM 662 O SER A 42 15.648 0.174 8.936 1.00 0.00 O ATOM 663 CB SER A 42 15.262 3.466 9.047 1.00 0.00 C ATOM 664 OG SER A 42 14.162 4.316 9.404 1.00 0.00 O ATOM 0 H SER A 42 13.039 3.477 8.067 1.00 0.00 H new ATOM 0 HA SER A 42 15.386 2.116 7.389 1.00 0.00 H new ATOM 0 HB2 SER A 42 15.775 3.117 9.943 1.00 0.00 H new ATOM 0 HB3 SER A 42 15.992 4.022 8.458 1.00 0.00 H new ATOM 0 HG SER A 42 14.201 5.141 8.876 1.00 0.00 H new ATOM 670 N GLY A 43 13.686 0.780 9.833 1.00 0.00 N ATOM 671 CA GLY A 43 13.556 -0.438 10.616 1.00 0.00 C ATOM 672 C GLY A 43 13.405 -1.666 9.719 1.00 0.00 C ATOM 673 O GLY A 43 14.134 -2.649 9.869 1.00 0.00 O ATOM 0 H GLY A 43 12.906 1.430 9.928 1.00 0.00 H new ATOM 0 HA2 GLY A 43 14.432 -0.557 11.254 1.00 0.00 H new ATOM 0 HA3 GLY A 43 12.691 -0.358 11.274 1.00 0.00 H new ATOM 677 N PHE A 44 12.514 -1.585 8.738 1.00 0.00 N ATOM 678 CA PHE A 44 12.343 -2.680 7.785 1.00 0.00 C ATOM 679 C PHE A 44 13.585 -2.822 6.960 1.00 0.00 C ATOM 680 O PHE A 44 14.084 -3.919 6.737 1.00 0.00 O ATOM 681 CB PHE A 44 11.132 -2.462 6.865 1.00 0.00 C ATOM 682 CG PHE A 44 9.850 -2.855 7.566 1.00 0.00 C ATOM 683 CD1 PHE A 44 9.707 -4.147 8.072 1.00 0.00 C ATOM 684 CD2 PHE A 44 8.806 -1.941 7.692 1.00 0.00 C ATOM 685 CE1 PHE A 44 8.527 -4.527 8.705 1.00 0.00 C ATOM 686 CE2 PHE A 44 7.621 -2.322 8.325 1.00 0.00 C ATOM 687 CZ PHE A 44 7.482 -3.615 8.830 1.00 0.00 C ATOM 0 H PHE A 44 11.904 -0.783 8.580 1.00 0.00 H new ATOM 0 HA PHE A 44 12.162 -3.592 8.355 1.00 0.00 H new ATOM 0 HB2 PHE A 44 11.082 -1.416 6.564 1.00 0.00 H new ATOM 0 HB3 PHE A 44 11.250 -3.050 5.955 1.00 0.00 H new ATOM 0 HD1 PHE A 44 10.516 -4.856 7.972 1.00 0.00 H new ATOM 0 HD2 PHE A 44 8.913 -0.940 7.301 1.00 0.00 H new ATOM 0 HE1 PHE A 44 8.422 -5.527 9.098 1.00 0.00 H new ATOM 0 HE2 PHE A 44 6.811 -1.615 8.424 1.00 0.00 H new ATOM 0 HZ PHE A 44 6.564 -3.909 9.318 1.00 0.00 H new ATOM 697 N LEU A 45 14.118 -1.695 6.580 1.00 0.00 N ATOM 698 CA LEU A 45 15.335 -1.648 5.826 1.00 0.00 C ATOM 699 C LEU A 45 16.488 -2.267 6.606 1.00 0.00 C ATOM 700 O LEU A 45 17.244 -3.071 6.064 1.00 0.00 O ATOM 701 CB LEU A 45 15.635 -0.197 5.443 1.00 0.00 C ATOM 702 CG LEU A 45 17.020 -0.094 4.822 1.00 0.00 C ATOM 703 CD1 LEU A 45 17.115 -0.984 3.579 1.00 0.00 C ATOM 704 CD2 LEU A 45 17.315 1.354 4.444 1.00 0.00 C ATOM 0 H LEU A 45 13.717 -0.780 6.786 1.00 0.00 H new ATOM 0 HA LEU A 45 15.216 -2.236 4.916 1.00 0.00 H new ATOM 0 HB2 LEU A 45 14.885 0.164 4.739 1.00 0.00 H new ATOM 0 HB3 LEU A 45 15.576 0.440 6.326 1.00 0.00 H new ATOM 0 HG LEU A 45 17.755 -0.431 5.553 1.00 0.00 H new ATOM 0 HD11 LEU A 45 18.112 -0.899 3.146 1.00 0.00 H new ATOM 0 HD12 LEU A 45 16.928 -2.021 3.859 1.00 0.00 H new ATOM 0 HD13 LEU A 45 16.373 -0.666 2.846 1.00 0.00 H new ATOM 0 HD21 LEU A 45 18.308 1.419 4.000 1.00 0.00 H new ATOM 0 HD22 LEU A 45 16.573 1.701 3.725 1.00 0.00 H new ATOM 0 HD23 LEU A 45 17.275 1.978 5.337 1.00 0.00 H new ATOM 716 N ASP A 46 16.595 -1.925 7.879 1.00 0.00 N ATOM 717 CA ASP A 46 17.677 -2.437 8.723 1.00 0.00 C ATOM 718 C ASP A 46 17.701 -3.951 8.684 1.00 0.00 C ATOM 719 O ASP A 46 18.768 -4.570 8.627 1.00 0.00 O ATOM 720 CB ASP A 46 17.458 -1.994 10.168 1.00 0.00 C ATOM 721 CG ASP A 46 18.705 -2.225 10.990 1.00 0.00 C ATOM 722 OD1 ASP A 46 19.672 -1.541 10.753 1.00 0.00 O ATOM 723 OD2 ASP A 46 18.678 -3.078 11.851 1.00 0.00 O ATOM 0 H ASP A 46 15.949 -1.296 8.356 1.00 0.00 H new ATOM 0 HA ASP A 46 18.622 -2.044 8.348 1.00 0.00 H new ATOM 0 HB2 ASP A 46 17.190 -0.938 10.194 1.00 0.00 H new ATOM 0 HB3 ASP A 46 16.623 -2.546 10.601 1.00 0.00 H new ATOM 728 N ALA A 47 16.520 -4.538 8.768 1.00 0.00 N ATOM 729 CA ALA A 47 16.361 -5.986 8.785 1.00 0.00 C ATOM 730 C ALA A 47 16.822 -6.634 7.480 1.00 0.00 C ATOM 731 O ALA A 47 17.067 -7.851 7.442 1.00 0.00 O ATOM 732 CB ALA A 47 14.905 -6.359 9.066 1.00 0.00 C ATOM 0 H ALA A 47 15.641 -4.025 8.827 1.00 0.00 H new ATOM 0 HA ALA A 47 16.996 -6.368 9.584 1.00 0.00 H new ATOM 0 HB1 ALA A 47 14.803 -7.444 9.075 1.00 0.00 H new ATOM 0 HB2 ALA A 47 14.607 -5.958 10.035 1.00 0.00 H new ATOM 0 HB3 ALA A 47 14.266 -5.941 8.288 1.00 0.00 H new ATOM 738 N GLN A 48 16.816 -5.868 6.391 1.00 0.00 N ATOM 739 CA GLN A 48 17.149 -6.422 5.074 1.00 0.00 C ATOM 740 C GLN A 48 17.955 -5.443 4.226 1.00 0.00 C ATOM 741 O GLN A 48 17.678 -5.278 3.036 1.00 0.00 O ATOM 742 CB GLN A 48 15.877 -6.877 4.310 1.00 0.00 C ATOM 743 CG GLN A 48 14.632 -6.127 4.811 1.00 0.00 C ATOM 744 CD GLN A 48 14.287 -4.970 3.872 1.00 0.00 C ATOM 745 OE1 GLN A 48 15.237 -4.308 3.280 1.00 0.00 O flip ATOM 746 NE2 GLN A 48 13.116 -4.676 3.659 1.00 0.00 N flip ATOM 0 H GLN A 48 16.588 -4.874 6.390 1.00 0.00 H new ATOM 0 HA GLN A 48 17.773 -7.297 5.255 1.00 0.00 H new ATOM 0 HB2 GLN A 48 16.007 -6.699 3.242 1.00 0.00 H new ATOM 0 HB3 GLN A 48 15.736 -7.950 4.440 1.00 0.00 H new ATOM 0 HG2 GLN A 48 13.788 -6.814 4.876 1.00 0.00 H new ATOM 0 HG3 GLN A 48 14.810 -5.746 5.816 1.00 0.00 H new ATOM 0 HE21 GLN A 48 12.368 -5.193 4.121 1.00 0.00 H new ATOM 0 HE22 GLN A 48 12.890 -3.914 3.019 1.00 0.00 H new ATOM 755 N LYS A 49 18.950 -4.807 4.819 1.00 0.00 N ATOM 756 CA LYS A 49 19.793 -3.876 4.075 1.00 0.00 C ATOM 757 C LYS A 49 20.554 -4.608 2.981 1.00 0.00 C ATOM 758 O LYS A 49 20.755 -4.077 1.888 1.00 0.00 O ATOM 759 CB LYS A 49 20.783 -3.142 4.997 1.00 0.00 C ATOM 760 CG LYS A 49 20.014 -2.201 5.928 1.00 0.00 C ATOM 761 CD LYS A 49 20.983 -1.416 6.824 1.00 0.00 C ATOM 762 CE LYS A 49 21.535 -0.203 6.052 1.00 0.00 C ATOM 763 NZ LYS A 49 21.912 0.872 7.006 1.00 0.00 N ATOM 0 H LYS A 49 19.196 -4.913 5.803 1.00 0.00 H new ATOM 0 HA LYS A 49 19.137 -3.132 3.624 1.00 0.00 H new ATOM 0 HB2 LYS A 49 21.354 -3.863 5.582 1.00 0.00 H new ATOM 0 HB3 LYS A 49 21.499 -2.576 4.402 1.00 0.00 H new ATOM 0 HG2 LYS A 49 19.413 -1.508 5.338 1.00 0.00 H new ATOM 0 HG3 LYS A 49 19.324 -2.776 6.546 1.00 0.00 H new ATOM 0 HD2 LYS A 49 20.470 -1.083 7.726 1.00 0.00 H new ATOM 0 HD3 LYS A 49 21.802 -2.060 7.142 1.00 0.00 H new ATOM 0 HE2 LYS A 49 22.403 -0.500 5.463 1.00 0.00 H new ATOM 0 HE3 LYS A 49 20.785 0.166 5.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 22.284 1.688 6.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 21.075 1.163 7.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 22.642 0.518 7.657 1.00 0.00 H new ATOM 777 N ASP A 50 21.013 -5.811 3.304 1.00 0.00 N ATOM 778 CA ASP A 50 21.819 -6.619 2.389 1.00 0.00 C ATOM 779 C ASP A 50 21.033 -7.824 1.879 1.00 0.00 C ATOM 780 O ASP A 50 21.599 -8.906 1.663 1.00 0.00 O ATOM 781 CB ASP A 50 23.102 -7.088 3.092 1.00 0.00 C ATOM 782 CG ASP A 50 24.299 -6.794 2.227 1.00 0.00 C ATOM 783 OD1 ASP A 50 24.766 -5.679 2.264 1.00 0.00 O ATOM 784 OD2 ASP A 50 24.740 -7.681 1.534 1.00 0.00 O ATOM 0 H ASP A 50 20.839 -6.256 4.205 1.00 0.00 H new ATOM 0 HA ASP A 50 22.083 -5.999 1.532 1.00 0.00 H new ATOM 0 HB2 ASP A 50 23.205 -6.584 4.053 1.00 0.00 H new ATOM 0 HB3 ASP A 50 23.045 -8.157 3.297 1.00 0.00 H new ATOM 789 N VAL A 51 19.746 -7.634 1.664 1.00 0.00 N ATOM 790 CA VAL A 51 18.879 -8.701 1.175 1.00 0.00 C ATOM 791 C VAL A 51 18.418 -8.375 -0.240 1.00 0.00 C ATOM 792 O VAL A 51 18.064 -7.243 -0.537 1.00 0.00 O ATOM 793 CB VAL A 51 17.673 -8.869 2.119 1.00 0.00 C ATOM 794 CG1 VAL A 51 16.624 -9.806 1.510 1.00 0.00 C ATOM 795 CG2 VAL A 51 18.149 -9.430 3.463 1.00 0.00 C ATOM 0 H VAL A 51 19.270 -6.746 1.820 1.00 0.00 H new ATOM 0 HA VAL A 51 19.431 -9.641 1.154 1.00 0.00 H new ATOM 0 HB VAL A 51 17.213 -7.892 2.268 1.00 0.00 H new ATOM 0 HG11 VAL A 51 15.784 -9.907 2.197 1.00 0.00 H new ATOM 0 HG12 VAL A 51 16.272 -9.393 0.565 1.00 0.00 H new ATOM 0 HG13 VAL A 51 17.069 -10.785 1.335 1.00 0.00 H new ATOM 0 HG21 VAL A 51 17.296 -9.549 4.131 1.00 0.00 H new ATOM 0 HG22 VAL A 51 18.624 -10.398 3.305 1.00 0.00 H new ATOM 0 HG23 VAL A 51 18.867 -8.743 3.911 1.00 0.00 H new ATOM 805 N ASP A 52 18.493 -9.351 -1.117 1.00 0.00 N ATOM 806 CA ASP A 52 18.209 -9.143 -2.533 1.00 0.00 C ATOM 807 C ASP A 52 16.825 -8.565 -2.753 1.00 0.00 C ATOM 808 O ASP A 52 16.609 -7.781 -3.682 1.00 0.00 O ATOM 809 CB ASP A 52 18.330 -10.459 -3.284 1.00 0.00 C ATOM 810 CG ASP A 52 17.988 -10.257 -4.739 1.00 0.00 C ATOM 811 OD1 ASP A 52 18.683 -9.514 -5.399 1.00 0.00 O ATOM 812 OD2 ASP A 52 17.034 -10.854 -5.189 1.00 0.00 O ATOM 0 H ASP A 52 18.750 -10.309 -0.878 1.00 0.00 H new ATOM 0 HA ASP A 52 18.938 -8.427 -2.911 1.00 0.00 H new ATOM 0 HB2 ASP A 52 19.344 -10.848 -3.191 1.00 0.00 H new ATOM 0 HB3 ASP A 52 17.663 -11.200 -2.845 1.00 0.00 H new ATOM 817 N ALA A 53 15.881 -8.979 -1.932 1.00 0.00 N ATOM 818 CA ALA A 53 14.509 -8.527 -2.089 1.00 0.00 C ATOM 819 C ALA A 53 14.452 -7.007 -2.180 1.00 0.00 C ATOM 820 O ALA A 53 13.740 -6.457 -3.027 1.00 0.00 O ATOM 821 CB ALA A 53 13.640 -9.009 -0.921 1.00 0.00 C ATOM 0 H ALA A 53 16.034 -9.622 -1.155 1.00 0.00 H new ATOM 0 HA ALA A 53 14.120 -8.952 -3.014 1.00 0.00 H new ATOM 0 HB1 ALA A 53 12.617 -8.659 -1.060 1.00 0.00 H new ATOM 0 HB2 ALA A 53 13.649 -10.098 -0.886 1.00 0.00 H new ATOM 0 HB3 ALA A 53 14.035 -8.613 0.014 1.00 0.00 H new ATOM 827 N VAL A 54 15.243 -6.327 -1.354 1.00 0.00 N ATOM 828 CA VAL A 54 15.265 -4.879 -1.400 1.00 0.00 C ATOM 829 C VAL A 54 15.775 -4.389 -2.760 1.00 0.00 C ATOM 830 O VAL A 54 15.165 -3.501 -3.370 1.00 0.00 O ATOM 831 CB VAL A 54 16.044 -4.254 -0.201 1.00 0.00 C ATOM 832 CG1 VAL A 54 17.535 -4.605 -0.238 1.00 0.00 C ATOM 833 CG2 VAL A 54 15.878 -2.729 -0.201 1.00 0.00 C ATOM 0 H VAL A 54 15.862 -6.749 -0.662 1.00 0.00 H new ATOM 0 HA VAL A 54 14.239 -4.528 -1.291 1.00 0.00 H new ATOM 0 HB VAL A 54 15.623 -4.674 0.712 1.00 0.00 H new ATOM 0 HG11 VAL A 54 18.037 -4.149 0.615 1.00 0.00 H new ATOM 0 HG12 VAL A 54 17.655 -5.687 -0.194 1.00 0.00 H new ATOM 0 HG13 VAL A 54 17.975 -4.229 -1.162 1.00 0.00 H new ATOM 0 HG21 VAL A 54 16.426 -2.303 0.640 1.00 0.00 H new ATOM 0 HG22 VAL A 54 16.269 -2.320 -1.133 1.00 0.00 H new ATOM 0 HG23 VAL A 54 14.821 -2.478 -0.110 1.00 0.00 H new ATOM 843 N ASP A 55 16.807 -5.057 -3.299 1.00 0.00 N ATOM 844 CA ASP A 55 17.302 -4.717 -4.633 1.00 0.00 C ATOM 845 C ASP A 55 16.225 -4.956 -5.640 1.00 0.00 C ATOM 846 O ASP A 55 16.085 -4.207 -6.602 1.00 0.00 O ATOM 847 CB ASP A 55 18.511 -5.575 -5.036 1.00 0.00 C ATOM 848 CG ASP A 55 19.153 -4.989 -6.287 1.00 0.00 C ATOM 849 OD1 ASP A 55 19.613 -3.871 -6.228 1.00 0.00 O ATOM 850 OD2 ASP A 55 19.169 -5.658 -7.298 1.00 0.00 O ATOM 0 H ASP A 55 17.304 -5.820 -2.839 1.00 0.00 H new ATOM 0 HA ASP A 55 17.602 -3.669 -4.606 1.00 0.00 H new ATOM 0 HB2 ASP A 55 19.236 -5.606 -4.223 1.00 0.00 H new ATOM 0 HB3 ASP A 55 18.196 -6.602 -5.222 1.00 0.00 H new ATOM 855 N LYS A 56 15.547 -6.078 -5.500 1.00 0.00 N ATOM 856 CA LYS A 56 14.531 -6.442 -6.462 1.00 0.00 C ATOM 857 C LYS A 56 13.330 -5.517 -6.368 1.00 0.00 C ATOM 858 O LYS A 56 12.859 -4.997 -7.382 1.00 0.00 O ATOM 859 CB LYS A 56 14.095 -7.897 -6.284 1.00 0.00 C ATOM 860 CG LYS A 56 15.281 -8.841 -6.543 1.00 0.00 C ATOM 861 CD LYS A 56 15.841 -8.585 -7.942 1.00 0.00 C ATOM 862 CE LYS A 56 16.528 -9.850 -8.479 1.00 0.00 C ATOM 863 NZ LYS A 56 17.559 -10.308 -7.518 1.00 0.00 N ATOM 0 H LYS A 56 15.680 -6.744 -4.739 1.00 0.00 H new ATOM 0 HA LYS A 56 14.970 -6.335 -7.454 1.00 0.00 H new ATOM 0 HB2 LYS A 56 13.713 -8.049 -5.274 1.00 0.00 H new ATOM 0 HB3 LYS A 56 13.281 -8.127 -6.971 1.00 0.00 H new ATOM 0 HG2 LYS A 56 16.057 -8.681 -5.794 1.00 0.00 H new ATOM 0 HG3 LYS A 56 14.960 -9.879 -6.453 1.00 0.00 H new ATOM 0 HD2 LYS A 56 15.037 -8.286 -8.614 1.00 0.00 H new ATOM 0 HD3 LYS A 56 16.554 -7.761 -7.911 1.00 0.00 H new ATOM 0 HE2 LYS A 56 15.790 -10.636 -8.637 1.00 0.00 H new ATOM 0 HE3 LYS A 56 16.986 -9.643 -9.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 18.227 -10.942 -8.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 18.073 -9.486 -7.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 17.102 -10.818 -6.735 1.00 0.00 H new ATOM 877 N VAL A 57 12.853 -5.294 -5.153 1.00 0.00 N ATOM 878 CA VAL A 57 11.703 -4.429 -4.952 1.00 0.00 C ATOM 879 C VAL A 57 12.024 -2.997 -5.365 1.00 0.00 C ATOM 880 O VAL A 57 11.290 -2.379 -6.137 1.00 0.00 O ATOM 881 CB VAL A 57 11.243 -4.481 -3.491 1.00 0.00 C ATOM 882 CG1 VAL A 57 10.128 -3.462 -3.262 1.00 0.00 C ATOM 883 CG2 VAL A 57 10.719 -5.887 -3.170 1.00 0.00 C ATOM 0 H VAL A 57 13.240 -5.696 -4.299 1.00 0.00 H new ATOM 0 HA VAL A 57 10.890 -4.788 -5.582 1.00 0.00 H new ATOM 0 HB VAL A 57 12.086 -4.246 -2.841 1.00 0.00 H new ATOM 0 HG11 VAL A 57 9.805 -3.504 -2.222 1.00 0.00 H new ATOM 0 HG12 VAL A 57 10.497 -2.462 -3.488 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.285 -3.693 -3.913 1.00 0.00 H new ATOM 0 HG21 VAL A 57 10.392 -5.925 -2.131 1.00 0.00 H new ATOM 0 HG22 VAL A 57 9.879 -6.120 -3.824 1.00 0.00 H new ATOM 0 HG23 VAL A 57 11.514 -6.616 -3.327 1.00 0.00 H new ATOM 893 N MET A 58 13.165 -2.501 -4.915 1.00 0.00 N ATOM 894 CA MET A 58 13.587 -1.162 -5.282 1.00 0.00 C ATOM 895 C MET A 58 13.775 -1.056 -6.786 1.00 0.00 C ATOM 896 O MET A 58 13.638 0.024 -7.372 1.00 0.00 O ATOM 897 CB MET A 58 14.859 -0.748 -4.509 1.00 0.00 C ATOM 898 CG MET A 58 16.114 -1.315 -5.185 1.00 0.00 C ATOM 899 SD MET A 58 17.476 -1.362 -3.988 1.00 0.00 S ATOM 900 CE MET A 58 18.157 0.270 -4.345 1.00 0.00 C ATOM 0 H MET A 58 13.809 -3.000 -4.301 1.00 0.00 H new ATOM 0 HA MET A 58 12.801 -0.462 -4.999 1.00 0.00 H new ATOM 0 HB2 MET A 58 14.925 0.339 -4.463 1.00 0.00 H new ATOM 0 HB3 MET A 58 14.799 -1.108 -3.482 1.00 0.00 H new ATOM 0 HG2 MET A 58 15.914 -2.317 -5.565 1.00 0.00 H new ATOM 0 HG3 MET A 58 16.389 -0.699 -6.041 1.00 0.00 H new ATOM 0 HE1 MET A 58 19.022 0.451 -3.707 1.00 0.00 H new ATOM 0 HE2 MET A 58 18.462 0.316 -5.391 1.00 0.00 H new ATOM 0 HE3 MET A 58 17.400 1.030 -4.154 1.00 0.00 H new ATOM 910 N LYS A 59 14.117 -2.180 -7.401 1.00 0.00 N ATOM 911 CA LYS A 59 14.377 -2.216 -8.827 1.00 0.00 C ATOM 912 C LYS A 59 13.146 -1.804 -9.608 1.00 0.00 C ATOM 913 O LYS A 59 13.231 -0.978 -10.498 1.00 0.00 O ATOM 914 CB LYS A 59 14.783 -3.628 -9.254 1.00 0.00 C ATOM 915 CG LYS A 59 15.601 -3.578 -10.550 1.00 0.00 C ATOM 916 CD LYS A 59 16.919 -2.779 -10.348 1.00 0.00 C ATOM 917 CE LYS A 59 17.536 -3.018 -8.951 1.00 0.00 C ATOM 918 NZ LYS A 59 17.448 -4.454 -8.596 1.00 0.00 N ATOM 0 H LYS A 59 14.220 -3.079 -6.930 1.00 0.00 H new ATOM 0 HA LYS A 59 15.187 -1.518 -9.038 1.00 0.00 H new ATOM 0 HB2 LYS A 59 15.368 -4.100 -8.465 1.00 0.00 H new ATOM 0 HB3 LYS A 59 13.894 -4.241 -9.401 1.00 0.00 H new ATOM 0 HG2 LYS A 59 15.833 -4.592 -10.877 1.00 0.00 H new ATOM 0 HG3 LYS A 59 15.009 -3.116 -11.340 1.00 0.00 H new ATOM 0 HD2 LYS A 59 17.638 -3.067 -11.115 1.00 0.00 H new ATOM 0 HD3 LYS A 59 16.721 -1.715 -10.479 1.00 0.00 H new ATOM 0 HE2 LYS A 59 18.578 -2.697 -8.945 1.00 0.00 H new ATOM 0 HE3 LYS A 59 17.013 -2.418 -8.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 16.903 -4.562 -7.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 16.975 -4.973 -9.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 18.405 -4.837 -8.458 1.00 0.00 H new ATOM 932 N GLU A 60 11.998 -2.362 -9.257 1.00 0.00 N ATOM 933 CA GLU A 60 10.783 -2.035 -9.979 1.00 0.00 C ATOM 934 C GLU A 60 10.508 -0.554 -9.842 1.00 0.00 C ATOM 935 O GLU A 60 10.246 0.134 -10.826 1.00 0.00 O ATOM 936 CB GLU A 60 9.596 -2.866 -9.473 1.00 0.00 C ATOM 937 CG GLU A 60 8.355 -2.567 -10.333 1.00 0.00 C ATOM 938 CD GLU A 60 7.196 -3.477 -9.971 1.00 0.00 C ATOM 939 OE1 GLU A 60 7.421 -4.489 -9.345 1.00 0.00 O ATOM 940 OE2 GLU A 60 6.095 -3.159 -10.345 1.00 0.00 O ATOM 0 H GLU A 60 11.884 -3.029 -8.494 1.00 0.00 H new ATOM 0 HA GLU A 60 10.918 -2.279 -11.033 1.00 0.00 H new ATOM 0 HB2 GLU A 60 9.836 -3.928 -9.519 1.00 0.00 H new ATOM 0 HB3 GLU A 60 9.393 -2.630 -8.428 1.00 0.00 H new ATOM 0 HG2 GLU A 60 8.059 -1.527 -10.197 1.00 0.00 H new ATOM 0 HG3 GLU A 60 8.602 -2.693 -11.387 1.00 0.00 H new ATOM 947 N LEU A 61 10.718 -0.042 -8.646 1.00 0.00 N ATOM 948 CA LEU A 61 10.608 1.385 -8.423 1.00 0.00 C ATOM 949 C LEU A 61 11.645 2.110 -9.265 1.00 0.00 C ATOM 950 O LEU A 61 11.350 3.139 -9.876 1.00 0.00 O ATOM 951 CB LEU A 61 10.799 1.729 -6.937 1.00 0.00 C ATOM 952 CG LEU A 61 9.486 1.518 -6.156 1.00 0.00 C ATOM 953 CD1 LEU A 61 8.518 2.668 -6.427 1.00 0.00 C ATOM 954 CD2 LEU A 61 8.828 0.186 -6.546 1.00 0.00 C ATOM 0 H LEU A 61 10.964 -0.588 -7.820 1.00 0.00 H new ATOM 0 HA LEU A 61 9.609 1.707 -8.716 1.00 0.00 H new ATOM 0 HB2 LEU A 61 11.585 1.105 -6.512 1.00 0.00 H new ATOM 0 HB3 LEU A 61 11.125 2.764 -6.837 1.00 0.00 H new ATOM 0 HG LEU A 61 9.725 1.492 -5.093 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.595 2.506 -5.869 1.00 0.00 H new ATOM 0 HD12 LEU A 61 8.972 3.608 -6.112 1.00 0.00 H new ATOM 0 HD13 LEU A 61 8.295 2.712 -7.493 1.00 0.00 H new ATOM 0 HD21 LEU A 61 7.904 0.058 -5.983 1.00 0.00 H new ATOM 0 HD22 LEU A 61 8.605 0.189 -7.613 1.00 0.00 H new ATOM 0 HD23 LEU A 61 9.507 -0.636 -6.319 1.00 0.00 H new ATOM 966 N ASP A 62 12.859 1.555 -9.305 1.00 0.00 N ATOM 967 CA ASP A 62 13.936 2.129 -10.114 1.00 0.00 C ATOM 968 C ASP A 62 13.590 2.042 -11.590 1.00 0.00 C ATOM 969 O ASP A 62 13.722 3.018 -12.331 1.00 0.00 O ATOM 970 CB ASP A 62 15.261 1.409 -9.855 1.00 0.00 C ATOM 971 CG ASP A 62 16.400 2.217 -10.435 1.00 0.00 C ATOM 972 OD1 ASP A 62 16.636 3.301 -9.942 1.00 0.00 O ATOM 973 OD2 ASP A 62 17.029 1.747 -11.358 1.00 0.00 O ATOM 0 H ASP A 62 13.119 0.714 -8.790 1.00 0.00 H new ATOM 0 HA ASP A 62 14.047 3.175 -9.829 1.00 0.00 H new ATOM 0 HB2 ASP A 62 15.408 1.271 -8.784 1.00 0.00 H new ATOM 0 HB3 ASP A 62 15.241 0.416 -10.304 1.00 0.00 H new ATOM 978 N GLU A 63 13.077 0.896 -11.999 1.00 0.00 N ATOM 979 CA GLU A 63 12.619 0.705 -13.369 1.00 0.00 C ATOM 980 C GLU A 63 11.491 1.659 -13.631 1.00 0.00 C ATOM 981 O GLU A 63 11.452 2.339 -14.656 1.00 0.00 O ATOM 982 CB GLU A 63 12.106 -0.725 -13.543 1.00 0.00 C ATOM 983 CG GLU A 63 13.266 -1.716 -13.470 1.00 0.00 C ATOM 984 CD GLU A 63 14.160 -1.563 -14.680 1.00 0.00 C ATOM 985 OE1 GLU A 63 13.654 -1.684 -15.777 1.00 0.00 O ATOM 986 OE2 GLU A 63 15.332 -1.347 -14.507 1.00 0.00 O ATOM 0 H GLU A 63 12.965 0.078 -11.401 1.00 0.00 H new ATOM 0 HA GLU A 63 13.441 0.884 -14.062 1.00 0.00 H new ATOM 0 HB2 GLU A 63 11.374 -0.953 -12.768 1.00 0.00 H new ATOM 0 HB3 GLU A 63 11.596 -0.822 -14.501 1.00 0.00 H new ATOM 0 HG2 GLU A 63 13.841 -1.547 -12.560 1.00 0.00 H new ATOM 0 HG3 GLU A 63 12.881 -2.735 -13.419 1.00 0.00 H new ATOM 993 N ASN A 64 10.620 1.766 -12.661 1.00 0.00 N ATOM 994 CA ASN A 64 9.522 2.686 -12.744 1.00 0.00 C ATOM 995 C ASN A 64 9.991 4.080 -12.377 1.00 0.00 C ATOM 996 O ASN A 64 9.188 4.982 -12.155 1.00 0.00 O ATOM 997 CB ASN A 64 8.369 2.244 -11.842 1.00 0.00 C ATOM 998 CG ASN A 64 7.038 2.657 -12.464 1.00 0.00 C ATOM 999 OD1 ASN A 64 6.997 3.541 -13.327 1.00 0.00 O ATOM 1000 ND2 ASN A 64 5.947 2.069 -12.094 1.00 0.00 N ATOM 0 H ASN A 64 10.653 1.221 -11.799 1.00 0.00 H new ATOM 0 HA ASN A 64 9.153 2.698 -13.769 1.00 0.00 H new ATOM 0 HB2 ASN A 64 8.397 1.163 -11.704 1.00 0.00 H new ATOM 0 HB3 ASN A 64 8.475 2.694 -10.855 1.00 0.00 H new ATOM 0 HD21 ASN A 64 5.056 2.335 -12.514 1.00 0.00 H new ATOM 0 HD22 ASN A 64 5.977 1.339 -11.382 1.00 0.00 H new ATOM 1007 N GLY A 65 11.304 4.272 -12.343 1.00 0.00 N ATOM 1008 CA GLY A 65 11.876 5.584 -12.079 1.00 0.00 C ATOM 1009 C GLY A 65 11.863 6.405 -13.349 1.00 0.00 C ATOM 1010 O GLY A 65 12.737 7.236 -13.583 1.00 0.00 O ATOM 0 H GLY A 65 11.992 3.535 -12.495 1.00 0.00 H new ATOM 0 HA2 GLY A 65 11.306 6.091 -11.300 1.00 0.00 H new ATOM 0 HA3 GLY A 65 12.897 5.480 -11.711 1.00 0.00 H new ATOM 1014 N ASP A 66 10.851 6.159 -14.162 1.00 0.00 N ATOM 1015 CA ASP A 66 10.677 6.823 -15.440 1.00 0.00 C ATOM 1016 C ASP A 66 10.557 8.322 -15.245 1.00 0.00 C ATOM 1017 O ASP A 66 11.118 9.106 -16.010 1.00 0.00 O ATOM 1018 CB ASP A 66 9.411 6.281 -16.107 1.00 0.00 C ATOM 1019 CG ASP A 66 9.310 6.766 -17.537 1.00 0.00 C ATOM 1020 OD1 ASP A 66 10.138 6.379 -18.328 1.00 0.00 O ATOM 1021 OD2 ASP A 66 8.394 7.508 -17.826 1.00 0.00 O ATOM 0 H ASP A 66 10.117 5.483 -13.949 1.00 0.00 H new ATOM 0 HA ASP A 66 11.544 6.628 -16.072 1.00 0.00 H new ATOM 0 HB2 ASP A 66 9.422 5.191 -16.087 1.00 0.00 H new ATOM 0 HB3 ASP A 66 8.533 6.601 -15.546 1.00 0.00 H new ATOM 1026 N GLY A 67 9.827 8.713 -14.221 1.00 0.00 N ATOM 1027 CA GLY A 67 9.630 10.122 -13.910 1.00 0.00 C ATOM 1028 C GLY A 67 9.520 10.329 -12.411 1.00 0.00 C ATOM 1029 O GLY A 67 10.465 10.804 -11.766 1.00 0.00 O ATOM 0 H GLY A 67 9.355 8.072 -13.583 1.00 0.00 H new ATOM 0 HA2 GLY A 67 10.462 10.706 -14.303 1.00 0.00 H new ATOM 0 HA3 GLY A 67 8.726 10.485 -14.400 1.00 0.00 H new ATOM 1033 N GLU A 68 8.373 9.962 -11.863 1.00 0.00 N ATOM 1034 CA GLU A 68 8.097 10.105 -10.435 1.00 0.00 C ATOM 1035 C GLU A 68 7.732 8.764 -9.830 1.00 0.00 C ATOM 1036 O GLU A 68 7.655 7.753 -10.528 1.00 0.00 O ATOM 1037 CB GLU A 68 6.905 11.054 -10.229 1.00 0.00 C ATOM 1038 CG GLU A 68 7.139 12.371 -10.973 1.00 0.00 C ATOM 1039 CD GLU A 68 6.526 12.311 -12.357 1.00 0.00 C ATOM 1040 OE1 GLU A 68 5.376 11.931 -12.460 1.00 0.00 O ATOM 1041 OE2 GLU A 68 7.204 12.647 -13.297 1.00 0.00 O ATOM 0 H GLU A 68 7.603 9.555 -12.394 1.00 0.00 H new ATOM 0 HA GLU A 68 8.992 10.500 -9.955 1.00 0.00 H new ATOM 0 HB2 GLU A 68 5.990 10.583 -10.589 1.00 0.00 H new ATOM 0 HB3 GLU A 68 6.766 11.249 -9.166 1.00 0.00 H new ATOM 0 HG2 GLU A 68 6.703 13.196 -10.410 1.00 0.00 H new ATOM 0 HG3 GLU A 68 8.208 12.568 -11.050 1.00 0.00 H new ATOM 1048 N VAL A 69 7.365 8.799 -8.574 1.00 0.00 N ATOM 1049 CA VAL A 69 6.755 7.681 -7.903 1.00 0.00 C ATOM 1050 C VAL A 69 5.482 8.191 -7.259 1.00 0.00 C ATOM 1051 O VAL A 69 5.478 9.246 -6.628 1.00 0.00 O ATOM 1052 CB VAL A 69 7.719 7.049 -6.860 1.00 0.00 C ATOM 1053 CG1 VAL A 69 8.391 8.131 -6.030 1.00 0.00 C ATOM 1054 CG2 VAL A 69 6.965 6.099 -5.916 1.00 0.00 C ATOM 0 H VAL A 69 7.484 9.619 -7.980 1.00 0.00 H new ATOM 0 HA VAL A 69 6.526 6.885 -8.612 1.00 0.00 H new ATOM 0 HB VAL A 69 8.472 6.486 -7.411 1.00 0.00 H new ATOM 0 HG11 VAL A 69 9.062 7.670 -5.305 1.00 0.00 H new ATOM 0 HG12 VAL A 69 8.961 8.790 -6.685 1.00 0.00 H new ATOM 0 HG13 VAL A 69 7.632 8.710 -5.504 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.663 5.671 -5.197 1.00 0.00 H new ATOM 0 HG22 VAL A 69 6.191 6.653 -5.385 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.505 5.299 -6.496 1.00 0.00 H new ATOM 1064 N ASP A 70 4.393 7.517 -7.495 1.00 0.00 N ATOM 1065 CA ASP A 70 3.131 7.954 -6.946 1.00 0.00 C ATOM 1066 C ASP A 70 2.818 7.178 -5.683 1.00 0.00 C ATOM 1067 O ASP A 70 3.567 6.271 -5.298 1.00 0.00 O ATOM 1068 CB ASP A 70 2.011 7.845 -7.997 1.00 0.00 C ATOM 1069 CG ASP A 70 0.650 7.726 -7.341 1.00 0.00 C ATOM 1070 OD1 ASP A 70 0.207 8.699 -6.770 1.00 0.00 O ATOM 1071 OD2 ASP A 70 0.074 6.667 -7.397 1.00 0.00 O ATOM 0 H ASP A 70 4.348 6.668 -8.059 1.00 0.00 H new ATOM 0 HA ASP A 70 3.202 9.007 -6.674 1.00 0.00 H new ATOM 0 HB2 ASP A 70 2.030 8.722 -8.644 1.00 0.00 H new ATOM 0 HB3 ASP A 70 2.188 6.977 -8.632 1.00 0.00 H new ATOM 1076 N PHE A 71 1.724 7.513 -5.046 1.00 0.00 N ATOM 1077 CA PHE A 71 1.338 6.861 -3.823 1.00 0.00 C ATOM 1078 C PHE A 71 1.203 5.377 -4.099 1.00 0.00 C ATOM 1079 O PHE A 71 1.675 4.540 -3.325 1.00 0.00 O ATOM 1080 CB PHE A 71 0.009 7.425 -3.318 1.00 0.00 C ATOM 1081 CG PHE A 71 -0.252 6.940 -1.906 1.00 0.00 C ATOM 1082 CD1 PHE A 71 0.532 7.438 -0.865 1.00 0.00 C ATOM 1083 CD2 PHE A 71 -1.274 6.016 -1.629 1.00 0.00 C ATOM 1084 CE1 PHE A 71 0.304 7.026 0.445 1.00 0.00 C ATOM 1085 CE2 PHE A 71 -1.497 5.604 -0.305 1.00 0.00 C ATOM 1086 CZ PHE A 71 -0.710 6.112 0.726 1.00 0.00 C ATOM 0 H PHE A 71 1.081 8.240 -5.359 1.00 0.00 H new ATOM 0 HA PHE A 71 2.092 7.033 -3.055 1.00 0.00 H new ATOM 0 HB2 PHE A 71 0.035 8.514 -3.339 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -0.802 7.112 -3.975 1.00 0.00 H new ATOM 0 HD1 PHE A 71 1.319 8.146 -1.076 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -1.884 5.625 -2.430 1.00 0.00 H new ATOM 0 HE1 PHE A 71 0.915 7.416 1.246 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -2.279 4.893 -0.086 1.00 0.00 H new ATOM 0 HZ PHE A 71 -0.886 5.797 1.744 1.00 0.00 H new ATOM 1096 N GLN A 72 0.605 5.059 -5.237 1.00 0.00 N ATOM 1097 CA GLN A 72 0.440 3.678 -5.637 1.00 0.00 C ATOM 1098 C GLN A 72 1.801 2.978 -5.796 1.00 0.00 C ATOM 1099 O GLN A 72 1.987 1.883 -5.279 1.00 0.00 O ATOM 1100 CB GLN A 72 -0.385 3.588 -6.927 1.00 0.00 C ATOM 1101 CG GLN A 72 -1.832 4.016 -6.641 1.00 0.00 C ATOM 1102 CD GLN A 72 -2.663 3.982 -7.923 1.00 0.00 C ATOM 1103 OE1 GLN A 72 -2.183 3.536 -8.969 1.00 0.00 O ATOM 1104 NE2 GLN A 72 -3.876 4.437 -7.916 1.00 0.00 N ATOM 0 H GLN A 72 0.228 5.740 -5.896 1.00 0.00 H new ATOM 0 HA GLN A 72 -0.104 3.158 -4.848 1.00 0.00 H new ATOM 0 HB2 GLN A 72 0.050 4.228 -7.695 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -0.366 2.569 -7.313 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -2.273 3.353 -5.897 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -1.844 5.021 -6.219 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -4.277 4.807 -7.054 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -4.430 4.426 -8.772 1.00 0.00 H new ATOM 1113 N GLU A 73 2.791 3.655 -6.396 1.00 0.00 N ATOM 1114 CA GLU A 73 4.148 3.081 -6.439 1.00 0.00 C ATOM 1115 C GLU A 73 4.732 3.054 -5.028 1.00 0.00 C ATOM 1116 O GLU A 73 5.479 2.146 -4.653 1.00 0.00 O ATOM 1117 CB GLU A 73 5.103 3.888 -7.333 1.00 0.00 C ATOM 1118 CG GLU A 73 4.731 3.790 -8.815 1.00 0.00 C ATOM 1119 CD GLU A 73 5.750 4.565 -9.655 1.00 0.00 C ATOM 1120 OE1 GLU A 73 6.861 4.794 -9.177 1.00 0.00 O ATOM 1121 OE2 GLU A 73 5.431 4.897 -10.770 1.00 0.00 O ATOM 0 H GLU A 73 2.688 4.566 -6.843 1.00 0.00 H new ATOM 0 HA GLU A 73 4.055 2.078 -6.855 1.00 0.00 H new ATOM 0 HB2 GLU A 73 5.089 4.934 -7.025 1.00 0.00 H new ATOM 0 HB3 GLU A 73 6.122 3.527 -7.191 1.00 0.00 H new ATOM 0 HG2 GLU A 73 4.708 2.746 -9.126 1.00 0.00 H new ATOM 0 HG3 GLU A 73 3.731 4.192 -8.976 1.00 0.00 H new ATOM 1128 N TYR A 74 4.476 4.115 -4.297 1.00 0.00 N ATOM 1129 CA TYR A 74 5.025 4.287 -2.966 1.00 0.00 C ATOM 1130 C TYR A 74 4.563 3.197 -2.003 1.00 0.00 C ATOM 1131 O TYR A 74 5.376 2.612 -1.283 1.00 0.00 O ATOM 1132 CB TYR A 74 4.676 5.688 -2.438 1.00 0.00 C ATOM 1133 CG TYR A 74 5.108 5.855 -0.998 1.00 0.00 C ATOM 1134 CD1 TYR A 74 6.425 5.589 -0.616 1.00 0.00 C ATOM 1135 CD2 TYR A 74 4.180 6.298 -0.047 1.00 0.00 C ATOM 1136 CE1 TYR A 74 6.813 5.759 0.715 1.00 0.00 C ATOM 1137 CE2 TYR A 74 4.568 6.469 1.282 1.00 0.00 C ATOM 1138 CZ TYR A 74 5.882 6.203 1.665 1.00 0.00 C ATOM 1139 OH TYR A 74 6.263 6.368 2.978 1.00 0.00 O ATOM 0 H TYR A 74 3.882 4.884 -4.606 1.00 0.00 H new ATOM 0 HA TYR A 74 6.109 4.193 -3.033 1.00 0.00 H new ATOM 0 HB2 TYR A 74 5.162 6.443 -3.056 1.00 0.00 H new ATOM 0 HB3 TYR A 74 3.602 5.853 -2.519 1.00 0.00 H new ATOM 0 HD1 TYR A 74 7.143 5.252 -1.349 1.00 0.00 H new ATOM 0 HD2 TYR A 74 3.163 6.507 -0.343 1.00 0.00 H new ATOM 0 HE1 TYR A 74 7.830 5.549 1.012 1.00 0.00 H new ATOM 0 HE2 TYR A 74 3.850 6.808 2.015 1.00 0.00 H new ATOM 0 HH TYR A 74 5.498 6.682 3.504 1.00 0.00 H new ATOM 1149 N VAL A 75 3.270 2.919 -1.987 1.00 0.00 N ATOM 1150 CA VAL A 75 2.739 1.928 -1.065 1.00 0.00 C ATOM 1151 C VAL A 75 3.268 0.530 -1.363 1.00 0.00 C ATOM 1152 O VAL A 75 3.605 -0.228 -0.448 1.00 0.00 O ATOM 1153 CB VAL A 75 1.203 1.954 -1.022 1.00 0.00 C ATOM 1154 CG1 VAL A 75 0.742 3.254 -0.351 1.00 0.00 C ATOM 1155 CG2 VAL A 75 0.626 1.883 -2.442 1.00 0.00 C ATOM 0 H VAL A 75 2.577 3.358 -2.593 1.00 0.00 H new ATOM 0 HA VAL A 75 3.095 2.199 -0.071 1.00 0.00 H new ATOM 0 HB VAL A 75 0.849 1.093 -0.456 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.347 3.279 -0.317 1.00 0.00 H new ATOM 0 HG12 VAL A 75 1.138 3.300 0.663 1.00 0.00 H new ATOM 0 HG13 VAL A 75 1.107 4.108 -0.922 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -0.463 1.902 -2.394 1.00 0.00 H new ATOM 0 HG22 VAL A 75 0.979 2.736 -3.021 1.00 0.00 H new ATOM 0 HG23 VAL A 75 0.952 0.960 -2.921 1.00 0.00 H new ATOM 1165 N VAL A 76 3.358 0.191 -2.635 1.00 0.00 N ATOM 1166 CA VAL A 76 3.851 -1.110 -3.016 1.00 0.00 C ATOM 1167 C VAL A 76 5.300 -1.274 -2.614 1.00 0.00 C ATOM 1168 O VAL A 76 5.698 -2.336 -2.138 1.00 0.00 O ATOM 1169 CB VAL A 76 3.661 -1.366 -4.511 1.00 0.00 C ATOM 1170 CG1 VAL A 76 2.177 -1.299 -4.861 1.00 0.00 C ATOM 1171 CG2 VAL A 76 4.424 -0.333 -5.334 1.00 0.00 C ATOM 0 H VAL A 76 3.097 0.796 -3.414 1.00 0.00 H new ATOM 0 HA VAL A 76 3.264 -1.857 -2.481 1.00 0.00 H new ATOM 0 HB VAL A 76 4.049 -2.357 -4.744 1.00 0.00 H new ATOM 0 HG11 VAL A 76 2.046 -1.482 -5.928 1.00 0.00 H new ATOM 0 HG12 VAL A 76 1.635 -2.056 -4.294 1.00 0.00 H new ATOM 0 HG13 VAL A 76 1.789 -0.311 -4.612 1.00 0.00 H new ATOM 0 HG21 VAL A 76 4.276 -0.532 -6.395 1.00 0.00 H new ATOM 0 HG22 VAL A 76 4.055 0.665 -5.097 1.00 0.00 H new ATOM 0 HG23 VAL A 76 5.487 -0.393 -5.098 1.00 0.00 H new ATOM 1181 N LEU A 77 6.084 -0.214 -2.782 1.00 0.00 N ATOM 1182 CA LEU A 77 7.495 -0.270 -2.438 1.00 0.00 C ATOM 1183 C LEU A 77 7.656 -0.554 -0.965 1.00 0.00 C ATOM 1184 O LEU A 77 8.363 -1.487 -0.573 1.00 0.00 O ATOM 1185 CB LEU A 77 8.159 1.076 -2.765 1.00 0.00 C ATOM 1186 CG LEU A 77 9.632 1.078 -2.306 1.00 0.00 C ATOM 1187 CD1 LEU A 77 10.423 -0.023 -3.013 1.00 0.00 C ATOM 1188 CD2 LEU A 77 10.263 2.437 -2.601 1.00 0.00 C ATOM 0 H LEU A 77 5.768 0.683 -3.150 1.00 0.00 H new ATOM 0 HA LEU A 77 7.968 -1.065 -3.015 1.00 0.00 H new ATOM 0 HB2 LEU A 77 8.106 1.263 -3.837 1.00 0.00 H new ATOM 0 HB3 LEU A 77 7.618 1.884 -2.273 1.00 0.00 H new ATOM 0 HG LEU A 77 9.659 0.888 -1.233 1.00 0.00 H new ATOM 0 HD11 LEU A 77 11.459 -0.002 -2.674 1.00 0.00 H new ATOM 0 HD12 LEU A 77 9.984 -0.993 -2.780 1.00 0.00 H new ATOM 0 HD13 LEU A 77 10.391 0.140 -4.090 1.00 0.00 H new ATOM 0 HD21 LEU A 77 11.303 2.434 -2.275 1.00 0.00 H new ATOM 0 HD22 LEU A 77 10.219 2.634 -3.672 1.00 0.00 H new ATOM 0 HD23 LEU A 77 9.718 3.215 -2.067 1.00 0.00 H new ATOM 1200 N VAL A 78 6.940 0.190 -0.146 1.00 0.00 N ATOM 1201 CA VAL A 78 6.992 -0.044 1.272 1.00 0.00 C ATOM 1202 C VAL A 78 6.340 -1.375 1.614 1.00 0.00 C ATOM 1203 O VAL A 78 6.885 -2.162 2.391 1.00 0.00 O ATOM 1204 CB VAL A 78 6.374 1.133 2.056 1.00 0.00 C ATOM 1205 CG1 VAL A 78 7.002 2.451 1.574 1.00 0.00 C ATOM 1206 CG2 VAL A 78 4.865 1.191 1.827 1.00 0.00 C ATOM 0 H VAL A 78 6.325 0.950 -0.438 1.00 0.00 H new ATOM 0 HA VAL A 78 8.037 -0.105 1.578 1.00 0.00 H new ATOM 0 HB VAL A 78 6.570 0.988 3.118 1.00 0.00 H new ATOM 0 HG11 VAL A 78 6.567 3.284 2.126 1.00 0.00 H new ATOM 0 HG12 VAL A 78 8.078 2.425 1.744 1.00 0.00 H new ATOM 0 HG13 VAL A 78 6.806 2.579 0.509 1.00 0.00 H new ATOM 0 HG21 VAL A 78 4.444 2.026 2.387 1.00 0.00 H new ATOM 0 HG22 VAL A 78 4.663 1.327 0.765 1.00 0.00 H new ATOM 0 HG23 VAL A 78 4.409 0.261 2.166 1.00 0.00 H new ATOM 1216 N ALA A 79 5.196 -1.648 0.996 1.00 0.00 N ATOM 1217 CA ALA A 79 4.485 -2.896 1.240 1.00 0.00 C ATOM 1218 C ALA A 79 5.312 -4.092 0.828 1.00 0.00 C ATOM 1219 O ALA A 79 5.435 -5.056 1.586 1.00 0.00 O ATOM 1220 CB ALA A 79 3.159 -2.918 0.502 1.00 0.00 C ATOM 0 H ALA A 79 4.744 -1.025 0.326 1.00 0.00 H new ATOM 0 HA ALA A 79 4.298 -2.955 2.312 1.00 0.00 H new ATOM 0 HB1 ALA A 79 2.648 -3.860 0.700 1.00 0.00 H new ATOM 0 HB2 ALA A 79 2.539 -2.089 0.844 1.00 0.00 H new ATOM 0 HB3 ALA A 79 3.337 -2.820 -0.569 1.00 0.00 H new ATOM 1226 N ALA A 80 5.879 -4.033 -0.369 1.00 0.00 N ATOM 1227 CA ALA A 80 6.690 -5.131 -0.862 1.00 0.00 C ATOM 1228 C ALA A 80 7.834 -5.392 0.100 1.00 0.00 C ATOM 1229 O ALA A 80 8.054 -6.524 0.532 1.00 0.00 O ATOM 1230 CB ALA A 80 7.230 -4.814 -2.255 1.00 0.00 C ATOM 0 H ALA A 80 5.792 -3.244 -1.009 1.00 0.00 H new ATOM 0 HA ALA A 80 6.071 -6.025 -0.932 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.836 -5.648 -2.609 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.398 -4.654 -2.940 1.00 0.00 H new ATOM 0 HB3 ALA A 80 7.843 -3.914 -2.211 1.00 0.00 H new ATOM 1236 N LEU A 81 8.502 -4.327 0.507 1.00 0.00 N ATOM 1237 CA LEU A 81 9.558 -4.445 1.496 1.00 0.00 C ATOM 1238 C LEU A 81 8.979 -4.938 2.812 1.00 0.00 C ATOM 1239 O LEU A 81 9.570 -5.786 3.486 1.00 0.00 O ATOM 1240 CB LEU A 81 10.251 -3.095 1.713 1.00 0.00 C ATOM 1241 CG LEU A 81 11.037 -2.703 0.452 1.00 0.00 C ATOM 1242 CD1 LEU A 81 11.581 -1.289 0.609 1.00 0.00 C ATOM 1243 CD2 LEU A 81 12.202 -3.673 0.232 1.00 0.00 C ATOM 0 H LEU A 81 8.334 -3.379 0.171 1.00 0.00 H new ATOM 0 HA LEU A 81 10.294 -5.160 1.130 1.00 0.00 H new ATOM 0 HB2 LEU A 81 9.511 -2.329 1.944 1.00 0.00 H new ATOM 0 HB3 LEU A 81 10.924 -3.155 2.568 1.00 0.00 H new ATOM 0 HG LEU A 81 10.369 -2.747 -0.408 1.00 0.00 H new ATOM 0 HD11 LEU A 81 12.138 -1.012 -0.286 1.00 0.00 H new ATOM 0 HD12 LEU A 81 10.753 -0.594 0.750 1.00 0.00 H new ATOM 0 HD13 LEU A 81 12.242 -1.247 1.475 1.00 0.00 H new ATOM 0 HD21 LEU A 81 12.751 -3.385 -0.664 1.00 0.00 H new ATOM 0 HD22 LEU A 81 12.870 -3.641 1.093 1.00 0.00 H new ATOM 0 HD23 LEU A 81 11.815 -4.685 0.111 1.00 0.00 H new ATOM 1255 N THR A 82 7.822 -4.399 3.174 1.00 0.00 N ATOM 1256 CA THR A 82 7.192 -4.754 4.430 1.00 0.00 C ATOM 1257 C THR A 82 6.876 -6.250 4.458 1.00 0.00 C ATOM 1258 O THR A 82 7.288 -6.961 5.375 1.00 0.00 O ATOM 1259 CB THR A 82 5.894 -3.944 4.610 1.00 0.00 C ATOM 1260 OG1 THR A 82 6.191 -2.552 4.633 1.00 0.00 O ATOM 1261 CG2 THR A 82 5.208 -4.337 5.923 1.00 0.00 C ATOM 0 H THR A 82 7.306 -3.718 2.616 1.00 0.00 H new ATOM 0 HA THR A 82 7.877 -4.523 5.246 1.00 0.00 H new ATOM 0 HB THR A 82 5.227 -4.160 3.775 1.00 0.00 H new ATOM 0 HG1 THR A 82 6.600 -2.291 3.782 1.00 0.00 H new ATOM 0 HG21 THR A 82 4.291 -3.759 6.042 1.00 0.00 H new ATOM 0 HG22 THR A 82 4.967 -5.400 5.904 1.00 0.00 H new ATOM 0 HG23 THR A 82 5.877 -4.132 6.759 1.00 0.00 H new ATOM 1269 N VAL A 83 6.213 -6.744 3.419 1.00 0.00 N ATOM 1270 CA VAL A 83 5.891 -8.160 3.365 1.00 0.00 C ATOM 1271 C VAL A 83 7.167 -8.988 3.303 1.00 0.00 C ATOM 1272 O VAL A 83 7.317 -9.972 4.037 1.00 0.00 O ATOM 1273 CB VAL A 83 4.933 -8.485 2.195 1.00 0.00 C ATOM 1274 CG1 VAL A 83 5.586 -8.183 0.845 1.00 0.00 C ATOM 1275 CG2 VAL A 83 4.518 -9.958 2.242 1.00 0.00 C ATOM 0 H VAL A 83 5.895 -6.197 2.619 1.00 0.00 H new ATOM 0 HA VAL A 83 5.361 -8.425 4.280 1.00 0.00 H new ATOM 0 HB VAL A 83 4.051 -7.854 2.304 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.889 -8.421 0.042 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.848 -7.126 0.796 1.00 0.00 H new ATOM 0 HG13 VAL A 83 6.487 -8.786 0.734 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.844 -10.173 1.413 1.00 0.00 H new ATOM 0 HG22 VAL A 83 5.404 -10.588 2.162 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.011 -10.163 3.185 1.00 0.00 H new ATOM 1285 N ALA A 84 8.117 -8.544 2.488 1.00 0.00 N ATOM 1286 CA ALA A 84 9.386 -9.237 2.394 1.00 0.00 C ATOM 1287 C ALA A 84 10.036 -9.309 3.765 1.00 0.00 C ATOM 1288 O ALA A 84 10.408 -10.391 4.227 1.00 0.00 O ATOM 1289 CB ALA A 84 10.320 -8.531 1.405 1.00 0.00 C ATOM 0 H ALA A 84 8.031 -7.720 1.893 1.00 0.00 H new ATOM 0 HA ALA A 84 9.203 -10.248 2.029 1.00 0.00 H new ATOM 0 HB1 ALA A 84 11.266 -9.069 1.351 1.00 0.00 H new ATOM 0 HB2 ALA A 84 9.857 -8.511 0.418 1.00 0.00 H new ATOM 0 HB3 ALA A 84 10.502 -7.510 1.741 1.00 0.00 H new ATOM 1295 N MET A 85 10.122 -8.168 4.439 1.00 0.00 N ATOM 1296 CA MET A 85 10.675 -8.129 5.784 1.00 0.00 C ATOM 1297 C MET A 85 9.780 -8.874 6.767 1.00 0.00 C ATOM 1298 O MET A 85 10.258 -9.645 7.596 1.00 0.00 O ATOM 1299 CB MET A 85 10.874 -6.689 6.254 1.00 0.00 C ATOM 1300 CG MET A 85 12.103 -6.607 7.173 1.00 0.00 C ATOM 1301 SD MET A 85 11.569 -6.699 8.907 1.00 0.00 S ATOM 1302 CE MET A 85 12.311 -8.301 9.323 1.00 0.00 C ATOM 0 H MET A 85 9.818 -7.264 4.078 1.00 0.00 H new ATOM 0 HA MET A 85 11.646 -8.624 5.751 1.00 0.00 H new ATOM 0 HB2 MET A 85 11.006 -6.031 5.395 1.00 0.00 H new ATOM 0 HB3 MET A 85 9.987 -6.344 6.786 1.00 0.00 H new ATOM 0 HG2 MET A 85 12.792 -7.421 6.950 1.00 0.00 H new ATOM 0 HG3 MET A 85 12.641 -5.676 6.996 1.00 0.00 H new ATOM 0 HE1 MET A 85 11.531 -8.989 9.650 1.00 0.00 H new ATOM 0 HE2 MET A 85 12.811 -8.709 8.445 1.00 0.00 H new ATOM 0 HE3 MET A 85 13.037 -8.168 10.125 1.00 0.00 H new ATOM 1312 N ASN A 86 8.479 -8.643 6.674 1.00 0.00 N ATOM 1313 CA ASN A 86 7.536 -9.269 7.596 1.00 0.00 C ATOM 1314 C ASN A 86 7.506 -10.770 7.426 1.00 0.00 C ATOM 1315 O ASN A 86 7.191 -11.497 8.363 1.00 0.00 O ATOM 1316 CB ASN A 86 6.134 -8.670 7.489 1.00 0.00 C ATOM 1317 CG ASN A 86 6.055 -7.403 8.339 1.00 0.00 C ATOM 1318 OD1 ASN A 86 5.817 -6.330 7.823 1.00 0.00 O ATOM 1319 ND2 ASN A 86 6.243 -7.467 9.628 1.00 0.00 N ATOM 0 H ASN A 86 8.052 -8.033 5.977 1.00 0.00 H new ATOM 0 HA ASN A 86 7.896 -9.055 8.602 1.00 0.00 H new ATOM 0 HB2 ASN A 86 5.905 -8.438 6.449 1.00 0.00 H new ATOM 0 HB3 ASN A 86 5.391 -9.393 7.825 1.00 0.00 H new ATOM 0 HD21 ASN A 86 6.190 -6.620 10.194 1.00 0.00 H new ATOM 0 HD22 ASN A 86 6.443 -8.364 10.070 1.00 0.00 H new ATOM 1326 N ASN A 87 7.935 -11.239 6.274 1.00 0.00 N ATOM 1327 CA ASN A 87 8.047 -12.671 6.048 1.00 0.00 C ATOM 1328 C ASN A 87 8.974 -13.247 7.101 1.00 0.00 C ATOM 1329 O ASN A 87 8.691 -14.285 7.706 1.00 0.00 O ATOM 1330 CB ASN A 87 8.640 -12.932 4.664 1.00 0.00 C ATOM 1331 CG ASN A 87 8.779 -14.427 4.429 1.00 0.00 C ATOM 1332 OD1 ASN A 87 7.805 -15.161 4.546 1.00 0.00 O ATOM 1333 ND2 ASN A 87 9.924 -14.925 4.093 1.00 0.00 N ATOM 0 H ASN A 87 8.211 -10.658 5.482 1.00 0.00 H new ATOM 0 HA ASN A 87 7.062 -13.135 6.108 1.00 0.00 H new ATOM 0 HB2 ASN A 87 8.001 -12.493 3.897 1.00 0.00 H new ATOM 0 HB3 ASN A 87 9.614 -12.451 4.581 1.00 0.00 H new ATOM 0 HD21 ASN A 87 10.015 -15.927 3.926 1.00 0.00 H new ATOM 0 HD22 ASN A 87 10.736 -14.316 3.995 1.00 0.00 H new ATOM 1340 N PHE A 88 10.025 -12.501 7.393 1.00 0.00 N ATOM 1341 CA PHE A 88 10.974 -12.881 8.420 1.00 0.00 C ATOM 1342 C PHE A 88 10.314 -12.925 9.789 1.00 0.00 C ATOM 1343 O PHE A 88 10.648 -13.770 10.599 1.00 0.00 O ATOM 1344 CB PHE A 88 12.167 -11.923 8.447 1.00 0.00 C ATOM 1345 CG PHE A 88 13.001 -12.120 7.203 1.00 0.00 C ATOM 1346 CD1 PHE A 88 13.895 -13.191 7.118 1.00 0.00 C ATOM 1347 CD2 PHE A 88 12.881 -11.228 6.135 1.00 0.00 C ATOM 1348 CE1 PHE A 88 14.665 -13.369 5.966 1.00 0.00 C ATOM 1349 CE2 PHE A 88 13.651 -11.406 4.983 1.00 0.00 C ATOM 1350 CZ PHE A 88 14.545 -12.477 4.898 1.00 0.00 C ATOM 0 H PHE A 88 10.242 -11.620 6.927 1.00 0.00 H new ATOM 0 HA PHE A 88 11.334 -13.881 8.177 1.00 0.00 H new ATOM 0 HB2 PHE A 88 11.818 -10.892 8.504 1.00 0.00 H new ATOM 0 HB3 PHE A 88 12.772 -12.104 9.335 1.00 0.00 H new ATOM 0 HD1 PHE A 88 13.991 -13.881 7.943 1.00 0.00 H new ATOM 0 HD2 PHE A 88 12.192 -10.399 6.200 1.00 0.00 H new ATOM 0 HE1 PHE A 88 15.354 -14.198 5.901 1.00 0.00 H new ATOM 0 HE2 PHE A 88 13.555 -10.716 4.158 1.00 0.00 H new ATOM 0 HZ PHE A 88 15.142 -12.615 4.008 1.00 0.00 H new ATOM 1360 N PHE A 89 9.364 -12.031 10.045 1.00 0.00 N ATOM 1361 CA PHE A 89 8.706 -12.014 11.360 1.00 0.00 C ATOM 1362 C PHE A 89 8.113 -13.378 11.657 1.00 0.00 C ATOM 1363 O PHE A 89 8.318 -13.934 12.732 1.00 0.00 O ATOM 1364 CB PHE A 89 7.570 -10.968 11.396 1.00 0.00 C ATOM 1365 CG PHE A 89 8.071 -9.629 11.891 1.00 0.00 C ATOM 1366 CD1 PHE A 89 8.882 -8.830 11.079 1.00 0.00 C ATOM 1367 CD2 PHE A 89 7.712 -9.187 13.170 1.00 0.00 C ATOM 1368 CE1 PHE A 89 9.332 -7.592 11.546 1.00 0.00 C ATOM 1369 CE2 PHE A 89 8.162 -7.950 13.635 1.00 0.00 C ATOM 1370 CZ PHE A 89 8.973 -7.153 12.822 1.00 0.00 C ATOM 0 H PHE A 89 9.035 -11.326 9.386 1.00 0.00 H new ATOM 0 HA PHE A 89 9.457 -11.756 12.107 1.00 0.00 H new ATOM 0 HB2 PHE A 89 7.146 -10.854 10.398 1.00 0.00 H new ATOM 0 HB3 PHE A 89 6.768 -11.321 12.044 1.00 0.00 H new ATOM 0 HD1 PHE A 89 9.160 -9.169 10.092 1.00 0.00 H new ATOM 0 HD2 PHE A 89 7.086 -9.804 13.798 1.00 0.00 H new ATOM 0 HE1 PHE A 89 9.958 -6.974 10.919 1.00 0.00 H new ATOM 0 HE2 PHE A 89 7.884 -7.609 14.621 1.00 0.00 H new ATOM 0 HZ PHE A 89 9.322 -6.196 13.181 1.00 0.00 H new ATOM 1380 N TRP A 90 7.395 -13.912 10.695 1.00 0.00 N ATOM 1381 CA TRP A 90 6.772 -15.216 10.848 1.00 0.00 C ATOM 1382 C TRP A 90 7.794 -16.324 10.714 1.00 0.00 C ATOM 1383 O TRP A 90 7.813 -17.272 11.510 1.00 0.00 O ATOM 1384 CB TRP A 90 5.645 -15.376 9.831 1.00 0.00 C ATOM 1385 CG TRP A 90 4.855 -14.111 9.832 1.00 0.00 C ATOM 1386 CD1 TRP A 90 4.949 -13.146 8.900 1.00 0.00 C ATOM 1387 CD2 TRP A 90 3.878 -13.650 10.804 1.00 0.00 C ATOM 1388 NE1 TRP A 90 4.098 -12.119 9.238 1.00 0.00 N ATOM 1389 CE2 TRP A 90 3.412 -12.382 10.403 1.00 0.00 C ATOM 1390 CE3 TRP A 90 3.357 -14.205 11.982 1.00 0.00 C ATOM 1391 CZ2 TRP A 90 2.459 -11.684 11.139 1.00 0.00 C ATOM 1392 CZ3 TRP A 90 2.399 -13.505 12.734 1.00 0.00 C ATOM 1393 CH2 TRP A 90 1.950 -12.249 12.309 1.00 0.00 C ATOM 0 H TRP A 90 7.225 -13.465 9.794 1.00 0.00 H new ATOM 0 HA TRP A 90 6.346 -15.286 11.849 1.00 0.00 H new ATOM 0 HB2 TRP A 90 6.050 -15.574 8.839 1.00 0.00 H new ATOM 0 HB3 TRP A 90 5.011 -16.224 10.092 1.00 0.00 H new ATOM 0 HD1 TRP A 90 5.588 -13.173 8.029 1.00 0.00 H new ATOM 0 HE1 TRP A 90 3.988 -11.265 8.691 1.00 0.00 H new ATOM 0 HE3 TRP A 90 3.694 -15.176 12.313 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 2.117 -10.715 10.808 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 2.008 -13.937 13.643 1.00 0.00 H new ATOM 0 HH2 TRP A 90 1.209 -11.717 12.887 1.00 0.00 H new ATOM 1404 N GLU A 91 8.629 -16.221 9.691 1.00 0.00 N ATOM 1405 CA GLU A 91 9.643 -17.235 9.452 1.00 0.00 C ATOM 1406 C GLU A 91 10.730 -17.249 10.528 1.00 0.00 C ATOM 1407 O GLU A 91 11.240 -18.314 10.875 1.00 0.00 O ATOM 1408 CB GLU A 91 10.248 -17.127 8.060 1.00 0.00 C ATOM 1409 CG GLU A 91 9.203 -17.528 7.000 1.00 0.00 C ATOM 1410 CD GLU A 91 9.820 -17.489 5.604 1.00 0.00 C ATOM 1411 OE1 GLU A 91 11.008 -17.284 5.503 1.00 0.00 O ATOM 1412 OE2 GLU A 91 9.103 -17.695 4.653 1.00 0.00 O ATOM 0 H GLU A 91 8.625 -15.453 9.019 1.00 0.00 H new ATOM 0 HA GLU A 91 9.125 -18.192 9.511 1.00 0.00 H new ATOM 0 HB2 GLU A 91 10.588 -16.107 7.880 1.00 0.00 H new ATOM 0 HB3 GLU A 91 11.123 -17.773 7.983 1.00 0.00 H new ATOM 0 HG2 GLU A 91 8.827 -18.529 7.211 1.00 0.00 H new ATOM 0 HG3 GLU A 91 8.350 -16.851 7.047 1.00 0.00 H new ATOM 1419 N ASN A 92 11.104 -16.077 11.036 1.00 0.00 N ATOM 1420 CA ASN A 92 12.146 -16.003 12.069 1.00 0.00 C ATOM 1421 C ASN A 92 11.799 -16.947 13.197 1.00 0.00 C ATOM 1422 O ASN A 92 10.796 -16.751 13.890 1.00 0.00 O ATOM 1423 CB ASN A 92 12.278 -14.571 12.621 1.00 0.00 C ATOM 1424 CG ASN A 92 13.403 -14.499 13.650 1.00 0.00 C ATOM 1425 OD1 ASN A 92 14.428 -15.174 13.507 1.00 0.00 O ATOM 1426 ND2 ASN A 92 13.277 -13.731 14.686 1.00 0.00 N ATOM 0 H ASN A 92 10.712 -15.177 10.758 1.00 0.00 H new ATOM 0 HA ASN A 92 13.098 -16.287 11.621 1.00 0.00 H new ATOM 0 HB2 ASN A 92 12.478 -13.877 11.805 1.00 0.00 H new ATOM 0 HB3 ASN A 92 11.338 -14.263 13.078 1.00 0.00 H new ATOM 0 HD21 ASN A 92 14.023 -13.685 15.380 1.00 0.00 H new ATOM 0 HD22 ASN A 92 12.432 -13.172 14.807 1.00 0.00 H new ATOM 1433 N SER A 93 12.535 -18.042 13.282 1.00 0.00 N ATOM 1434 CA SER A 93 12.220 -19.105 14.217 1.00 0.00 C ATOM 1435 C SER A 93 13.502 -19.747 14.764 1.00 0.00 C ATOM 1436 O SER A 93 14.533 -19.118 14.692 1.00 0.00 O ATOM 1437 CB SER A 93 11.348 -20.149 13.506 1.00 0.00 C ATOM 1438 OG SER A 93 10.740 -21.005 14.473 1.00 0.00 O ATOM 1439 OXT SER A 93 13.435 -20.855 15.255 1.00 0.00 O ATOM 0 H SER A 93 13.361 -18.217 12.709 1.00 0.00 H new ATOM 0 HA SER A 93 11.673 -18.692 15.065 1.00 0.00 H new ATOM 0 HB2 SER A 93 10.581 -19.653 12.912 1.00 0.00 H new ATOM 0 HB3 SER A 93 11.955 -20.736 12.817 1.00 0.00 H new ATOM 0 HG SER A 93 11.414 -21.296 15.122 1.00 0.00 H new TER 1445 SER A 93 ATOM 1446 N GLY B 1 10.889 0.650 14.084 1.00 0.00 N ATOM 1447 CA GLY B 1 10.624 1.257 12.782 1.00 0.00 C ATOM 1448 C GLY B 1 9.816 2.540 12.928 1.00 0.00 C ATOM 1449 O GLY B 1 9.321 2.858 14.018 1.00 0.00 O ATOM 0 H1 GLY B 1 11.916 0.604 14.243 1.00 0.00 H new ATOM 0 H2 GLY B 1 10.449 1.224 14.831 1.00 0.00 H new ATOM 0 H3 GLY B 1 10.492 -0.311 14.106 1.00 0.00 H new ATOM 0 HA2 GLY B 1 11.567 1.473 12.280 1.00 0.00 H new ATOM 0 HA3 GLY B 1 10.081 0.552 12.152 1.00 0.00 H new ATOM 1453 N SER B 2 9.648 3.251 11.832 1.00 0.00 N ATOM 1454 CA SER B 2 8.872 4.480 11.820 1.00 0.00 C ATOM 1455 C SER B 2 7.378 4.163 11.936 1.00 0.00 C ATOM 1456 O SER B 2 6.961 3.022 11.722 1.00 0.00 O ATOM 1457 CB SER B 2 9.162 5.244 10.527 1.00 0.00 C ATOM 1458 OG SER B 2 10.571 5.230 10.285 1.00 0.00 O ATOM 0 H SER B 2 10.043 2.997 10.926 1.00 0.00 H new ATOM 0 HA SER B 2 9.154 5.099 12.672 1.00 0.00 H new ATOM 0 HB2 SER B 2 8.632 4.786 9.692 1.00 0.00 H new ATOM 0 HB3 SER B 2 8.804 6.270 10.608 1.00 0.00 H new ATOM 0 HG SER B 2 10.762 4.680 9.497 1.00 0.00 H new ATOM 1464 N GLU B 3 6.570 5.173 12.208 1.00 0.00 N ATOM 1465 CA GLU B 3 5.131 4.970 12.305 1.00 0.00 C ATOM 1466 C GLU B 3 4.613 4.393 11.011 1.00 0.00 C ATOM 1467 O GLU B 3 3.676 3.590 11.004 1.00 0.00 O ATOM 1468 CB GLU B 3 4.405 6.274 12.587 1.00 0.00 C ATOM 1469 CG GLU B 3 4.744 6.780 13.993 1.00 0.00 C ATOM 1470 CD GLU B 3 4.013 8.082 14.272 1.00 0.00 C ATOM 1471 OE1 GLU B 3 3.179 8.465 13.469 1.00 0.00 O ATOM 1472 OE2 GLU B 3 4.295 8.684 15.279 1.00 0.00 O ATOM 0 H GLU B 3 6.879 6.132 12.364 1.00 0.00 H new ATOM 0 HA GLU B 3 4.945 4.283 13.130 1.00 0.00 H new ATOM 0 HB2 GLU B 3 4.687 7.022 11.846 1.00 0.00 H new ATOM 0 HB3 GLU B 3 3.329 6.126 12.496 1.00 0.00 H new ATOM 0 HG2 GLU B 3 4.464 6.031 14.734 1.00 0.00 H new ATOM 0 HG3 GLU B 3 5.820 6.932 14.083 1.00 0.00 H new ATOM 1479 N LEU B 4 5.247 4.776 9.913 1.00 0.00 N ATOM 1480 CA LEU B 4 4.875 4.242 8.620 1.00 0.00 C ATOM 1481 C LEU B 4 5.074 2.750 8.663 1.00 0.00 C ATOM 1482 O LEU B 4 4.203 1.982 8.261 1.00 0.00 O ATOM 1483 CB LEU B 4 5.771 4.826 7.514 1.00 0.00 C ATOM 1484 CG LEU B 4 5.534 6.344 7.318 1.00 0.00 C ATOM 1485 CD1 LEU B 4 4.151 6.772 7.820 1.00 0.00 C ATOM 1486 CD2 LEU B 4 6.616 7.145 8.055 1.00 0.00 C ATOM 0 H LEU B 4 6.014 5.448 9.895 1.00 0.00 H new ATOM 0 HA LEU B 4 3.838 4.501 8.403 1.00 0.00 H new ATOM 0 HB2 LEU B 4 6.817 4.652 7.765 1.00 0.00 H new ATOM 0 HB3 LEU B 4 5.577 4.305 6.577 1.00 0.00 H new ATOM 0 HG LEU B 4 5.585 6.549 6.249 1.00 0.00 H new ATOM 0 HD11 LEU B 4 4.023 7.843 7.665 1.00 0.00 H new ATOM 0 HD12 LEU B 4 3.381 6.231 7.270 1.00 0.00 H new ATOM 0 HD13 LEU B 4 4.064 6.546 8.883 1.00 0.00 H new ATOM 0 HD21 LEU B 4 6.441 8.211 7.911 1.00 0.00 H new ATOM 0 HD22 LEU B 4 6.580 6.912 9.119 1.00 0.00 H new ATOM 0 HD23 LEU B 4 7.597 6.882 7.659 1.00 0.00 H new ATOM 1498 N GLU B 5 6.180 2.338 9.262 1.00 0.00 N ATOM 1499 CA GLU B 5 6.458 0.938 9.417 1.00 0.00 C ATOM 1500 C GLU B 5 5.392 0.314 10.313 1.00 0.00 C ATOM 1501 O GLU B 5 4.802 -0.707 9.966 1.00 0.00 O ATOM 1502 CB GLU B 5 7.849 0.734 10.022 1.00 0.00 C ATOM 1503 CG GLU B 5 8.914 1.285 9.067 1.00 0.00 C ATOM 1504 CD GLU B 5 10.299 1.064 9.647 1.00 0.00 C ATOM 1505 OE1 GLU B 5 10.670 -0.076 9.806 1.00 0.00 O ATOM 1506 OE2 GLU B 5 10.965 2.039 9.929 1.00 0.00 O ATOM 0 H GLU B 5 6.892 2.960 9.645 1.00 0.00 H new ATOM 0 HA GLU B 5 6.439 0.454 8.440 1.00 0.00 H new ATOM 0 HB2 GLU B 5 7.915 1.239 10.986 1.00 0.00 H new ATOM 0 HB3 GLU B 5 8.025 -0.326 10.205 1.00 0.00 H new ATOM 0 HG2 GLU B 5 8.834 0.793 8.098 1.00 0.00 H new ATOM 0 HG3 GLU B 5 8.747 2.349 8.899 1.00 0.00 H new ATOM 1513 N THR B 6 5.031 1.024 11.378 1.00 0.00 N ATOM 1514 CA THR B 6 3.946 0.579 12.241 1.00 0.00 C ATOM 1515 C THR B 6 2.662 0.492 11.420 1.00 0.00 C ATOM 1516 O THR B 6 1.942 -0.508 11.464 1.00 0.00 O ATOM 1517 CB THR B 6 3.752 1.563 13.404 1.00 0.00 C ATOM 1518 OG1 THR B 6 5.015 1.903 13.965 1.00 0.00 O ATOM 1519 CG2 THR B 6 2.872 0.925 14.491 1.00 0.00 C ATOM 0 H THR B 6 5.470 1.900 11.661 1.00 0.00 H new ATOM 0 HA THR B 6 4.191 -0.400 12.652 1.00 0.00 H new ATOM 0 HB THR B 6 3.266 2.462 13.025 1.00 0.00 H new ATOM 0 HG1 THR B 6 4.885 2.532 14.705 1.00 0.00 H new ATOM 0 HG21 THR B 6 2.740 1.630 15.312 1.00 0.00 H new ATOM 0 HG22 THR B 6 1.899 0.672 14.069 1.00 0.00 H new ATOM 0 HG23 THR B 6 3.352 0.020 14.863 1.00 0.00 H new ATOM 1527 N ALA B 7 2.412 1.521 10.620 1.00 0.00 N ATOM 1528 CA ALA B 7 1.240 1.548 9.758 1.00 0.00 C ATOM 1529 C ALA B 7 1.267 0.364 8.813 1.00 0.00 C ATOM 1530 O ALA B 7 0.272 -0.354 8.670 1.00 0.00 O ATOM 1531 CB ALA B 7 1.187 2.853 8.960 1.00 0.00 C ATOM 0 H ALA B 7 3.006 2.347 10.551 1.00 0.00 H new ATOM 0 HA ALA B 7 0.349 1.489 10.383 1.00 0.00 H new ATOM 0 HB1 ALA B 7 0.303 2.854 8.322 1.00 0.00 H new ATOM 0 HB2 ALA B 7 1.139 3.698 9.647 1.00 0.00 H new ATOM 0 HB3 ALA B 7 2.081 2.938 8.342 1.00 0.00 H new ATOM 1537 N MET B 8 2.420 0.118 8.214 1.00 0.00 N ATOM 1538 CA MET B 8 2.563 -1.023 7.331 1.00 0.00 C ATOM 1539 C MET B 8 2.390 -2.315 8.111 1.00 0.00 C ATOM 1540 O MET B 8 1.634 -3.201 7.695 1.00 0.00 O ATOM 1541 CB MET B 8 3.907 -0.997 6.602 1.00 0.00 C ATOM 1542 CG MET B 8 3.982 0.244 5.700 1.00 0.00 C ATOM 1543 SD MET B 8 2.556 0.278 4.579 1.00 0.00 S ATOM 1544 CE MET B 8 2.940 -1.217 3.645 1.00 0.00 C ATOM 0 H MET B 8 3.260 0.686 8.322 1.00 0.00 H new ATOM 0 HA MET B 8 1.781 -0.968 6.573 1.00 0.00 H new ATOM 0 HB2 MET B 8 4.723 -0.984 7.324 1.00 0.00 H new ATOM 0 HB3 MET B 8 4.025 -1.901 6.004 1.00 0.00 H new ATOM 0 HG2 MET B 8 3.998 1.147 6.310 1.00 0.00 H new ATOM 0 HG3 MET B 8 4.908 0.231 5.125 1.00 0.00 H new ATOM 0 HE1 MET B 8 2.495 -1.150 2.652 1.00 0.00 H new ATOM 0 HE2 MET B 8 4.021 -1.320 3.552 1.00 0.00 H new ATOM 0 HE3 MET B 8 2.536 -2.085 4.166 1.00 0.00 H new ATOM 1554 N GLU B 9 2.939 -2.351 9.324 1.00 0.00 N ATOM 1555 CA GLU B 9 2.702 -3.485 10.200 1.00 0.00 C ATOM 1556 C GLU B 9 1.222 -3.566 10.532 1.00 0.00 C ATOM 1557 O GLU B 9 0.645 -4.656 10.590 1.00 0.00 O ATOM 1558 CB GLU B 9 3.512 -3.390 11.503 1.00 0.00 C ATOM 1559 CG GLU B 9 5.010 -3.610 11.244 1.00 0.00 C ATOM 1560 CD GLU B 9 5.778 -3.470 12.548 1.00 0.00 C ATOM 1561 OE1 GLU B 9 5.557 -2.503 13.251 1.00 0.00 O ATOM 1562 OE2 GLU B 9 6.576 -4.333 12.835 1.00 0.00 O ATOM 0 H GLU B 9 3.538 -1.622 9.712 1.00 0.00 H new ATOM 0 HA GLU B 9 3.025 -4.383 9.673 1.00 0.00 H new ATOM 0 HB2 GLU B 9 3.359 -2.412 11.959 1.00 0.00 H new ATOM 0 HB3 GLU B 9 3.150 -4.133 12.214 1.00 0.00 H new ATOM 0 HG2 GLU B 9 5.174 -4.600 10.818 1.00 0.00 H new ATOM 0 HG3 GLU B 9 5.374 -2.885 10.516 1.00 0.00 H new ATOM 1569 N THR B 10 0.598 -2.415 10.712 1.00 0.00 N ATOM 1570 CA THR B 10 -0.817 -2.379 11.001 1.00 0.00 C ATOM 1571 C THR B 10 -1.566 -3.053 9.845 1.00 0.00 C ATOM 1572 O THR B 10 -2.391 -3.952 10.063 1.00 0.00 O ATOM 1573 CB THR B 10 -1.292 -0.921 11.189 1.00 0.00 C ATOM 1574 OG1 THR B 10 -0.369 -0.215 12.023 1.00 0.00 O ATOM 1575 CG2 THR B 10 -2.665 -0.906 11.870 1.00 0.00 C ATOM 0 H THR B 10 1.049 -1.501 10.663 1.00 0.00 H new ATOM 0 HA THR B 10 -1.022 -2.913 11.929 1.00 0.00 H new ATOM 0 HB THR B 10 -1.354 -0.445 10.210 1.00 0.00 H new ATOM 0 HG1 THR B 10 0.457 -0.736 12.111 1.00 0.00 H new ATOM 0 HG21 THR B 10 -2.995 0.125 12.000 1.00 0.00 H new ATOM 0 HG22 THR B 10 -3.384 -1.442 11.251 1.00 0.00 H new ATOM 0 HG23 THR B 10 -2.593 -1.390 12.844 1.00 0.00 H new ATOM 1583 N LEU B 11 -1.169 -2.722 8.615 1.00 0.00 N ATOM 1584 CA LEU B 11 -1.726 -3.389 7.441 1.00 0.00 C ATOM 1585 C LEU B 11 -1.375 -4.875 7.469 1.00 0.00 C ATOM 1586 O LEU B 11 -2.219 -5.732 7.188 1.00 0.00 O ATOM 1587 CB LEU B 11 -1.197 -2.760 6.139 1.00 0.00 C ATOM 1588 CG LEU B 11 -1.735 -1.332 5.963 1.00 0.00 C ATOM 1589 CD1 LEU B 11 -1.073 -0.691 4.742 1.00 0.00 C ATOM 1590 CD2 LEU B 11 -3.254 -1.355 5.757 1.00 0.00 C ATOM 0 H LEU B 11 -0.473 -2.005 8.409 1.00 0.00 H new ATOM 0 HA LEU B 11 -2.809 -3.267 7.468 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -0.107 -2.743 6.155 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -1.494 -3.372 5.288 1.00 0.00 H new ATOM 0 HG LEU B 11 -1.507 -0.756 6.860 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -1.452 0.323 4.613 1.00 0.00 H new ATOM 0 HD12 LEU B 11 0.007 -0.659 4.888 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -1.301 -1.279 3.853 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -3.620 -0.336 5.634 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -3.492 -1.936 4.866 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -3.732 -1.810 6.625 1.00 0.00 H new ATOM 1602 N ILE B 12 -0.134 -5.182 7.841 1.00 0.00 N ATOM 1603 CA ILE B 12 0.319 -6.574 7.918 1.00 0.00 C ATOM 1604 C ILE B 12 -0.499 -7.322 8.953 1.00 0.00 C ATOM 1605 O ILE B 12 -0.939 -8.449 8.714 1.00 0.00 O ATOM 1606 CB ILE B 12 1.812 -6.620 8.308 1.00 0.00 C ATOM 1607 CG1 ILE B 12 2.692 -6.076 7.173 1.00 0.00 C ATOM 1608 CG2 ILE B 12 2.244 -8.050 8.656 1.00 0.00 C ATOM 1609 CD1 ILE B 12 2.786 -7.098 6.030 1.00 0.00 C ATOM 0 H ILE B 12 0.574 -4.492 8.093 1.00 0.00 H new ATOM 0 HA ILE B 12 0.188 -7.045 6.944 1.00 0.00 H new ATOM 0 HB ILE B 12 1.941 -5.989 9.188 1.00 0.00 H new ATOM 0 HG12 ILE B 12 2.277 -5.140 6.799 1.00 0.00 H new ATOM 0 HG13 ILE B 12 3.689 -5.853 7.553 1.00 0.00 H new ATOM 0 HG21 ILE B 12 3.300 -8.055 8.927 1.00 0.00 H new ATOM 0 HG22 ILE B 12 1.652 -8.415 9.495 1.00 0.00 H new ATOM 0 HG23 ILE B 12 2.088 -8.697 7.793 1.00 0.00 H new ATOM 0 HD11 ILE B 12 3.413 -6.697 5.234 1.00 0.00 H new ATOM 0 HD12 ILE B 12 3.223 -8.024 6.405 1.00 0.00 H new ATOM 0 HD13 ILE B 12 1.789 -7.300 5.639 1.00 0.00 H new ATOM 1621 N ASN B 13 -0.710 -6.695 10.088 1.00 0.00 N ATOM 1622 CA ASN B 13 -1.454 -7.325 11.163 1.00 0.00 C ATOM 1623 C ASN B 13 -2.861 -7.638 10.715 1.00 0.00 C ATOM 1624 O ASN B 13 -3.352 -8.752 10.914 1.00 0.00 O ATOM 1625 CB ASN B 13 -1.487 -6.406 12.380 1.00 0.00 C ATOM 1626 CG ASN B 13 -0.182 -6.531 13.146 1.00 0.00 C ATOM 1627 OD1 ASN B 13 -0.074 -7.346 14.069 1.00 0.00 O ATOM 1628 ND2 ASN B 13 0.826 -5.795 12.808 1.00 0.00 N ATOM 0 H ASN B 13 -0.379 -5.752 10.294 1.00 0.00 H new ATOM 0 HA ASN B 13 -0.958 -8.257 11.433 1.00 0.00 H new ATOM 0 HB2 ASN B 13 -1.638 -5.374 12.065 1.00 0.00 H new ATOM 0 HB3 ASN B 13 -2.326 -6.669 13.025 1.00 0.00 H new ATOM 0 HD21 ASN B 13 1.713 -5.886 13.303 1.00 0.00 H new ATOM 0 HD22 ASN B 13 0.734 -5.123 12.046 1.00 0.00 H new ATOM 1635 N VAL B 14 -3.485 -6.695 10.034 1.00 0.00 N ATOM 1636 CA VAL B 14 -4.802 -6.941 9.481 1.00 0.00 C ATOM 1637 C VAL B 14 -4.729 -8.002 8.389 1.00 0.00 C ATOM 1638 O VAL B 14 -5.485 -8.971 8.399 1.00 0.00 O ATOM 1639 CB VAL B 14 -5.413 -5.634 8.949 1.00 0.00 C ATOM 1640 CG1 VAL B 14 -6.696 -5.927 8.164 1.00 0.00 C ATOM 1641 CG2 VAL B 14 -5.748 -4.719 10.132 1.00 0.00 C ATOM 0 H VAL B 14 -3.108 -5.765 9.853 1.00 0.00 H new ATOM 0 HA VAL B 14 -5.451 -7.317 10.272 1.00 0.00 H new ATOM 0 HB VAL B 14 -4.694 -5.149 8.288 1.00 0.00 H new ATOM 0 HG11 VAL B 14 -7.117 -4.992 7.794 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -6.466 -6.580 7.322 1.00 0.00 H new ATOM 0 HG13 VAL B 14 -7.418 -6.417 8.817 1.00 0.00 H new ATOM 0 HG21 VAL B 14 -6.182 -3.790 9.762 1.00 0.00 H new ATOM 0 HG22 VAL B 14 -6.463 -5.218 10.787 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -4.838 -4.498 10.690 1.00 0.00 H new ATOM 1651 N PHE B 15 -3.782 -7.837 7.482 1.00 0.00 N ATOM 1652 CA PHE B 15 -3.623 -8.771 6.378 1.00 0.00 C ATOM 1653 C PHE B 15 -3.363 -10.176 6.899 1.00 0.00 C ATOM 1654 O PHE B 15 -3.995 -11.136 6.469 1.00 0.00 O ATOM 1655 CB PHE B 15 -2.446 -8.329 5.503 1.00 0.00 C ATOM 1656 CG PHE B 15 -2.297 -9.253 4.313 1.00 0.00 C ATOM 1657 CD1 PHE B 15 -1.535 -10.421 4.419 1.00 0.00 C ATOM 1658 CD2 PHE B 15 -2.919 -8.938 3.105 1.00 0.00 C ATOM 1659 CE1 PHE B 15 -1.394 -11.266 3.325 1.00 0.00 C ATOM 1660 CE2 PHE B 15 -2.775 -9.787 2.007 1.00 0.00 C ATOM 1661 CZ PHE B 15 -2.011 -10.952 2.120 1.00 0.00 C ATOM 0 H PHE B 15 -3.112 -7.068 7.487 1.00 0.00 H new ATOM 0 HA PHE B 15 -4.542 -8.778 5.791 1.00 0.00 H new ATOM 0 HB2 PHE B 15 -2.603 -7.306 5.160 1.00 0.00 H new ATOM 0 HB3 PHE B 15 -1.528 -8.330 6.090 1.00 0.00 H new ATOM 0 HD1 PHE B 15 -1.055 -10.667 5.354 1.00 0.00 H new ATOM 0 HD2 PHE B 15 -3.511 -8.039 3.020 1.00 0.00 H new ATOM 0 HE1 PHE B 15 -0.805 -12.167 3.411 1.00 0.00 H new ATOM 0 HE2 PHE B 15 -3.254 -9.544 1.070 1.00 0.00 H new ATOM 0 HZ PHE B 15 -1.900 -11.609 1.270 1.00 0.00 H new ATOM 1671 N HIS B 16 -2.428 -10.283 7.827 1.00 0.00 N ATOM 1672 CA HIS B 16 -2.043 -11.572 8.379 1.00 0.00 C ATOM 1673 C HIS B 16 -3.161 -12.189 9.214 1.00 0.00 C ATOM 1674 O HIS B 16 -3.331 -13.410 9.237 1.00 0.00 O ATOM 1675 CB HIS B 16 -0.723 -11.460 9.163 1.00 0.00 C ATOM 1676 CG HIS B 16 0.400 -11.241 8.172 1.00 0.00 C ATOM 1677 ND1 HIS B 16 1.591 -11.948 8.214 1.00 0.00 N ATOM 1678 CD2 HIS B 16 0.496 -10.421 7.076 1.00 0.00 C ATOM 1679 CE1 HIS B 16 2.340 -11.542 7.161 1.00 0.00 C ATOM 1680 NE2 HIS B 16 1.715 -10.616 6.437 1.00 0.00 N ATOM 0 H HIS B 16 -1.919 -9.489 8.216 1.00 0.00 H new ATOM 0 HA HIS B 16 -1.871 -12.254 7.547 1.00 0.00 H new ATOM 0 HB2 HIS B 16 -0.771 -10.633 9.872 1.00 0.00 H new ATOM 0 HB3 HIS B 16 -0.547 -12.366 9.742 1.00 0.00 H new ATOM 0 HD1 HIS B 16 1.855 -12.646 8.910 1.00 0.00 H new ATOM 0 HD2 HIS B 16 -0.265 -9.725 6.756 1.00 0.00 H new ATOM 0 HE1 HIS B 16 3.325 -11.923 6.936 1.00 0.00 H new ATOM 1689 N ALA B 17 -3.919 -11.354 9.912 1.00 0.00 N ATOM 1690 CA ALA B 17 -5.018 -11.857 10.735 1.00 0.00 C ATOM 1691 C ALA B 17 -6.053 -12.574 9.878 1.00 0.00 C ATOM 1692 O ALA B 17 -6.484 -13.683 10.207 1.00 0.00 O ATOM 1693 CB ALA B 17 -5.686 -10.723 11.511 1.00 0.00 C ATOM 0 H ALA B 17 -3.799 -10.341 9.928 1.00 0.00 H new ATOM 0 HA ALA B 17 -4.597 -12.567 11.447 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -6.500 -11.125 12.115 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -4.953 -10.246 12.162 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -6.083 -9.988 10.811 1.00 0.00 H new ATOM 1699 N HIS B 18 -6.414 -11.957 8.762 1.00 0.00 N ATOM 1700 CA HIS B 18 -7.388 -12.543 7.840 1.00 0.00 C ATOM 1701 C HIS B 18 -6.848 -13.816 7.214 1.00 0.00 C ATOM 1702 O HIS B 18 -7.612 -14.707 6.839 1.00 0.00 O ATOM 1703 CB HIS B 18 -7.806 -11.545 6.750 1.00 0.00 C ATOM 1704 CG HIS B 18 -8.689 -10.485 7.357 1.00 0.00 C ATOM 1705 ND1 HIS B 18 -10.045 -10.684 7.586 1.00 0.00 N ATOM 1706 CD2 HIS B 18 -8.414 -9.221 7.816 1.00 0.00 C ATOM 1707 CE1 HIS B 18 -10.520 -9.561 8.167 1.00 0.00 C ATOM 1708 NE2 HIS B 18 -9.566 -8.643 8.329 1.00 0.00 N ATOM 0 H HIS B 18 -6.049 -11.050 8.469 1.00 0.00 H new ATOM 0 HA HIS B 18 -8.275 -12.793 8.423 1.00 0.00 H new ATOM 0 HB2 HIS B 18 -6.924 -11.087 6.302 1.00 0.00 H new ATOM 0 HB3 HIS B 18 -8.337 -12.063 5.951 1.00 0.00 H new ATOM 0 HD1 HIS B 18 -10.581 -11.521 7.358 1.00 0.00 H new ATOM 0 HD2 HIS B 18 -7.444 -8.747 7.783 1.00 0.00 H new ATOM 0 HE1 HIS B 18 -11.549 -9.423 8.465 1.00 0.00 H new ATOM 1717 N SER B 19 -5.538 -13.881 7.065 1.00 0.00 N ATOM 1718 CA SER B 19 -4.900 -15.017 6.424 1.00 0.00 C ATOM 1719 C SER B 19 -5.390 -16.334 7.013 1.00 0.00 C ATOM 1720 O SER B 19 -5.473 -17.349 6.310 1.00 0.00 O ATOM 1721 CB SER B 19 -3.389 -14.924 6.569 1.00 0.00 C ATOM 1722 OG SER B 19 -2.935 -13.642 6.156 1.00 0.00 O ATOM 0 H SER B 19 -4.892 -13.157 7.381 1.00 0.00 H new ATOM 0 HA SER B 19 -5.166 -14.993 5.367 1.00 0.00 H new ATOM 0 HB2 SER B 19 -3.104 -15.102 7.606 1.00 0.00 H new ATOM 0 HB3 SER B 19 -2.910 -15.698 5.969 1.00 0.00 H new ATOM 0 HG SER B 19 -3.428 -13.362 5.357 1.00 0.00 H new ATOM 1728 N GLY B 20 -5.732 -16.320 8.288 1.00 0.00 N ATOM 1729 CA GLY B 20 -6.216 -17.523 8.942 1.00 0.00 C ATOM 1730 C GLY B 20 -7.390 -18.100 8.177 1.00 0.00 C ATOM 1731 O GLY B 20 -7.530 -19.322 8.063 1.00 0.00 O ATOM 0 H GLY B 20 -5.685 -15.496 8.888 1.00 0.00 H new ATOM 0 HA2 GLY B 20 -5.415 -18.260 9.003 1.00 0.00 H new ATOM 0 HA3 GLY B 20 -6.516 -17.294 9.964 1.00 0.00 H new ATOM 1735 N LYS B 21 -8.180 -17.226 7.567 1.00 0.00 N ATOM 1736 CA LYS B 21 -9.281 -17.673 6.737 1.00 0.00 C ATOM 1737 C LYS B 21 -8.750 -18.461 5.539 1.00 0.00 C ATOM 1738 O LYS B 21 -9.230 -19.556 5.241 1.00 0.00 O ATOM 1739 CB LYS B 21 -10.121 -16.467 6.263 1.00 0.00 C ATOM 1740 CG LYS B 21 -10.956 -15.901 7.438 1.00 0.00 C ATOM 1741 CD LYS B 21 -10.152 -14.866 8.240 1.00 0.00 C ATOM 1742 CE LYS B 21 -10.938 -14.473 9.503 1.00 0.00 C ATOM 1743 NZ LYS B 21 -12.239 -13.855 9.135 1.00 0.00 N ATOM 0 H LYS B 21 -8.077 -16.213 7.633 1.00 0.00 H new ATOM 0 HA LYS B 21 -9.923 -18.327 7.327 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -9.466 -15.692 5.867 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -10.782 -16.771 5.451 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -11.866 -15.440 7.053 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -11.264 -16.715 8.094 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -9.181 -15.278 8.516 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -9.961 -13.984 7.628 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -11.109 -15.354 10.121 1.00 0.00 H new ATOM 0 HE3 LYS B 21 -10.352 -13.774 10.100 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 -12.680 -13.444 9.982 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 -12.081 -13.107 8.429 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 -12.867 -14.581 8.735 1.00 0.00 H new ATOM 1757 N GLU B 22 -7.711 -17.933 4.903 1.00 0.00 N ATOM 1758 CA GLU B 22 -7.054 -18.603 3.780 1.00 0.00 C ATOM 1759 C GLU B 22 -6.265 -19.836 4.241 1.00 0.00 C ATOM 1760 O GLU B 22 -6.350 -20.910 3.635 1.00 0.00 O ATOM 1761 CB GLU B 22 -6.137 -17.617 3.063 1.00 0.00 C ATOM 1762 CG GLU B 22 -5.499 -18.276 1.825 1.00 0.00 C ATOM 1763 CD GLU B 22 -4.646 -17.270 1.067 1.00 0.00 C ATOM 1764 OE1 GLU B 22 -4.882 -16.098 1.215 1.00 0.00 O ATOM 1765 OE2 GLU B 22 -3.756 -17.695 0.357 1.00 0.00 O ATOM 0 H GLU B 22 -7.299 -17.032 5.147 1.00 0.00 H new ATOM 0 HA GLU B 22 -7.823 -18.950 3.090 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -6.705 -16.736 2.762 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -5.357 -17.276 3.743 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -4.886 -19.123 2.132 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -6.279 -18.667 1.171 1.00 0.00 H new ATOM 1772 N GLY B 23 -5.521 -19.679 5.323 1.00 0.00 N ATOM 1773 CA GLY B 23 -4.764 -20.789 5.914 1.00 0.00 C ATOM 1774 C GLY B 23 -3.457 -21.104 5.170 1.00 0.00 C ATOM 1775 O GLY B 23 -2.680 -21.948 5.623 1.00 0.00 O ATOM 0 H GLY B 23 -5.420 -18.793 5.818 1.00 0.00 H new ATOM 0 HA2 GLY B 23 -4.533 -20.549 6.952 1.00 0.00 H new ATOM 0 HA3 GLY B 23 -5.391 -21.681 5.925 1.00 0.00 H new ATOM 1779 N ASP B 24 -3.193 -20.415 4.055 1.00 0.00 N ATOM 1780 CA ASP B 24 -1.941 -20.646 3.302 1.00 0.00 C ATOM 1781 C ASP B 24 -0.765 -20.381 4.225 1.00 0.00 C ATOM 1782 O ASP B 24 0.082 -21.250 4.464 1.00 0.00 O ATOM 1783 CB ASP B 24 -1.876 -19.674 2.096 1.00 0.00 C ATOM 1784 CG ASP B 24 -0.602 -19.853 1.265 1.00 0.00 C ATOM 1785 OD1 ASP B 24 0.317 -20.478 1.724 1.00 0.00 O ATOM 1786 OD2 ASP B 24 -0.572 -19.341 0.158 1.00 0.00 O ATOM 0 H ASP B 24 -3.809 -19.707 3.655 1.00 0.00 H new ATOM 0 HA ASP B 24 -1.909 -21.673 2.938 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -2.746 -19.832 1.459 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -1.928 -18.647 2.458 1.00 0.00 H new ATOM 1791 N LYS B 25 -0.827 -19.224 4.834 1.00 0.00 N ATOM 1792 CA LYS B 25 0.091 -18.741 5.851 1.00 0.00 C ATOM 1793 C LYS B 25 -0.127 -17.255 5.968 1.00 0.00 C ATOM 1794 O LYS B 25 -1.276 -16.830 5.971 1.00 0.00 O ATOM 1795 CB LYS B 25 1.565 -19.109 5.580 1.00 0.00 C ATOM 1796 CG LYS B 25 2.039 -18.643 4.192 1.00 0.00 C ATOM 1797 CD LYS B 25 3.530 -18.968 4.083 1.00 0.00 C ATOM 1798 CE LYS B 25 4.120 -18.415 2.787 1.00 0.00 C ATOM 1799 NZ LYS B 25 5.594 -18.596 2.822 1.00 0.00 N ATOM 0 H LYS B 25 -1.562 -18.548 4.625 1.00 0.00 H new ATOM 0 HA LYS B 25 -0.121 -19.235 6.799 1.00 0.00 H new ATOM 0 HB2 LYS B 25 2.196 -18.659 6.347 1.00 0.00 H new ATOM 0 HB3 LYS B 25 1.688 -20.189 5.659 1.00 0.00 H new ATOM 0 HG2 LYS B 25 1.478 -19.148 3.406 1.00 0.00 H new ATOM 0 HG3 LYS B 25 1.870 -17.573 4.068 1.00 0.00 H new ATOM 0 HD2 LYS B 25 4.061 -18.546 4.937 1.00 0.00 H new ATOM 0 HD3 LYS B 25 3.674 -20.048 4.120 1.00 0.00 H new ATOM 0 HE2 LYS B 25 3.696 -18.933 1.927 1.00 0.00 H new ATOM 0 HE3 LYS B 25 3.871 -17.359 2.678 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 5.990 -18.399 1.881 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 6.008 -17.941 3.516 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 5.817 -19.575 3.094 1.00 0.00 H new ATOM 1813 N TYR B 26 0.915 -16.442 5.892 1.00 0.00 N ATOM 1814 CA TYR B 26 0.668 -15.017 5.792 1.00 0.00 C ATOM 1815 C TYR B 26 0.191 -14.715 4.367 1.00 0.00 C ATOM 1816 O TYR B 26 0.999 -14.510 3.457 1.00 0.00 O ATOM 1817 CB TYR B 26 1.944 -14.223 6.108 1.00 0.00 C ATOM 1818 CG TYR B 26 3.170 -15.011 5.713 1.00 0.00 C ATOM 1819 CD1 TYR B 26 3.751 -15.889 6.627 1.00 0.00 C ATOM 1820 CD2 TYR B 26 3.722 -14.860 4.442 1.00 0.00 C ATOM 1821 CE1 TYR B 26 4.888 -16.625 6.265 1.00 0.00 C ATOM 1822 CE2 TYR B 26 4.850 -15.587 4.079 1.00 0.00 C ATOM 1823 CZ TYR B 26 5.436 -16.469 4.984 1.00 0.00 C ATOM 1824 OH TYR B 26 6.544 -17.197 4.609 1.00 0.00 O ATOM 0 H TYR B 26 1.894 -16.727 5.897 1.00 0.00 H new ATOM 0 HA TYR B 26 -0.093 -14.721 6.514 1.00 0.00 H new ATOM 0 HB2 TYR B 26 1.929 -13.272 5.575 1.00 0.00 H new ATOM 0 HB3 TYR B 26 1.981 -13.992 7.173 1.00 0.00 H new ATOM 0 HD1 TYR B 26 3.325 -16.002 7.613 1.00 0.00 H new ATOM 0 HD2 TYR B 26 3.272 -14.176 3.737 1.00 0.00 H new ATOM 0 HE1 TYR B 26 5.339 -17.308 6.969 1.00 0.00 H new ATOM 0 HE2 TYR B 26 5.273 -15.468 3.093 1.00 0.00 H new ATOM 0 HH TYR B 26 7.349 -16.649 4.722 1.00 0.00 H new ATOM 1834 N LYS B 27 -1.122 -14.728 4.180 1.00 0.00 N ATOM 1835 CA LYS B 27 -1.741 -14.561 2.856 1.00 0.00 C ATOM 1836 C LYS B 27 -3.132 -13.995 2.983 1.00 0.00 C ATOM 1837 O LYS B 27 -3.765 -14.138 4.016 1.00 0.00 O ATOM 1838 CB LYS B 27 -1.857 -15.906 2.137 1.00 0.00 C ATOM 1839 CG LYS B 27 -0.497 -16.398 1.648 1.00 0.00 C ATOM 1840 CD LYS B 27 -0.078 -15.605 0.402 1.00 0.00 C ATOM 1841 CE LYS B 27 -1.102 -15.815 -0.735 1.00 0.00 C ATOM 1842 NZ LYS B 27 -1.611 -17.223 -0.734 1.00 0.00 N ATOM 0 H LYS B 27 -1.795 -14.854 4.936 1.00 0.00 H new ATOM 0 HA LYS B 27 -1.104 -13.881 2.290 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -2.291 -16.644 2.811 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -2.536 -15.810 1.290 1.00 0.00 H new ATOM 0 HG2 LYS B 27 0.248 -16.279 2.435 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -0.547 -17.462 1.415 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -0.006 -14.545 0.644 1.00 0.00 H new ATOM 0 HD3 LYS B 27 0.911 -15.925 0.074 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -1.934 -15.122 -0.614 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -0.638 -15.591 -1.695 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -1.715 -17.555 -1.714 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -0.938 -17.835 -0.230 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -2.535 -17.258 -0.257 1.00 0.00 H new ATOM 1856 N LEU B 28 -3.655 -13.470 1.901 1.00 0.00 N ATOM 1857 CA LEU B 28 -5.031 -13.048 1.881 1.00 0.00 C ATOM 1858 C LEU B 28 -5.714 -13.509 0.601 1.00 0.00 C ATOM 1859 O LEU B 28 -5.180 -13.360 -0.498 1.00 0.00 O ATOM 1860 CB LEU B 28 -5.137 -11.539 2.046 1.00 0.00 C ATOM 1861 CG LEU B 28 -6.609 -11.125 2.129 1.00 0.00 C ATOM 1862 CD1 LEU B 28 -7.231 -11.678 3.411 1.00 0.00 C ATOM 1863 CD2 LEU B 28 -6.704 -9.606 2.139 1.00 0.00 C ATOM 0 H LEU B 28 -3.149 -13.326 1.027 1.00 0.00 H new ATOM 0 HA LEU B 28 -5.544 -13.512 2.723 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -4.611 -11.225 2.948 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -4.656 -11.038 1.206 1.00 0.00 H new ATOM 0 HG LEU B 28 -7.145 -11.523 1.267 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -8.278 -11.381 3.465 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -7.162 -12.766 3.409 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -6.696 -11.283 4.275 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -7.751 -9.307 2.198 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -6.165 -9.213 3.002 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -6.264 -9.208 1.225 1.00 0.00 H new ATOM 1875 N SER B 29 -6.895 -14.041 0.733 1.00 0.00 N ATOM 1876 CA SER B 29 -7.662 -14.434 -0.420 1.00 0.00 C ATOM 1877 C SER B 29 -8.859 -13.515 -0.578 1.00 0.00 C ATOM 1878 O SER B 29 -9.150 -12.692 0.305 1.00 0.00 O ATOM 1879 CB SER B 29 -8.070 -15.902 -0.330 1.00 0.00 C ATOM 1880 OG SER B 29 -8.072 -16.305 1.034 1.00 0.00 O ATOM 0 H SER B 29 -7.351 -14.214 1.629 1.00 0.00 H new ATOM 0 HA SER B 29 -7.044 -14.336 -1.312 1.00 0.00 H new ATOM 0 HB2 SER B 29 -9.059 -16.044 -0.765 1.00 0.00 H new ATOM 0 HB3 SER B 29 -7.378 -16.520 -0.903 1.00 0.00 H new ATOM 0 HG SER B 29 -8.582 -15.659 1.565 1.00 0.00 H new ATOM 1886 N LYS B 30 -9.528 -13.613 -1.703 1.00 0.00 N ATOM 1887 CA LYS B 30 -10.650 -12.736 -2.006 1.00 0.00 C ATOM 1888 C LYS B 30 -11.794 -12.957 -1.032 1.00 0.00 C ATOM 1889 O LYS B 30 -12.820 -12.269 -1.086 1.00 0.00 O ATOM 1890 CB LYS B 30 -11.125 -12.929 -3.445 1.00 0.00 C ATOM 1891 CG LYS B 30 -9.964 -12.690 -4.431 1.00 0.00 C ATOM 1892 CD LYS B 30 -9.394 -11.257 -4.264 1.00 0.00 C ATOM 1893 CE LYS B 30 -9.729 -10.379 -5.487 1.00 0.00 C ATOM 1894 NZ LYS B 30 -11.101 -10.684 -5.978 1.00 0.00 N ATOM 0 H LYS B 30 -9.318 -14.294 -2.432 1.00 0.00 H new ATOM 0 HA LYS B 30 -10.305 -11.708 -1.897 1.00 0.00 H new ATOM 0 HB2 LYS B 30 -11.517 -13.938 -3.573 1.00 0.00 H new ATOM 0 HB3 LYS B 30 -11.941 -12.240 -3.661 1.00 0.00 H new ATOM 0 HG2 LYS B 30 -9.176 -13.423 -4.259 1.00 0.00 H new ATOM 0 HG3 LYS B 30 -10.313 -12.832 -5.454 1.00 0.00 H new ATOM 0 HD2 LYS B 30 -9.805 -10.802 -3.363 1.00 0.00 H new ATOM 0 HD3 LYS B 30 -8.313 -11.305 -4.133 1.00 0.00 H new ATOM 0 HE2 LYS B 30 -9.657 -9.325 -5.218 1.00 0.00 H new ATOM 0 HE3 LYS B 30 -9.003 -10.556 -6.281 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 -11.513 -9.832 -6.410 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 -11.055 -11.444 -6.687 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 -11.695 -10.990 -5.181 1.00 0.00 H new ATOM 1908 N LYS B 31 -11.620 -13.922 -0.150 1.00 0.00 N ATOM 1909 CA LYS B 31 -12.621 -14.237 0.849 1.00 0.00 C ATOM 1910 C LYS B 31 -12.836 -13.006 1.725 1.00 0.00 C ATOM 1911 O LYS B 31 -13.860 -12.313 1.635 1.00 0.00 O ATOM 1912 CB LYS B 31 -12.090 -15.381 1.754 1.00 0.00 C ATOM 1913 CG LYS B 31 -11.481 -16.492 0.908 1.00 0.00 C ATOM 1914 CD LYS B 31 -10.731 -17.478 1.817 1.00 0.00 C ATOM 1915 CE LYS B 31 -10.104 -18.558 0.949 1.00 0.00 C ATOM 1916 NZ LYS B 31 -11.166 -19.481 0.470 1.00 0.00 N ATOM 0 H LYS B 31 -10.785 -14.507 -0.106 1.00 0.00 H new ATOM 0 HA LYS B 31 -13.549 -14.536 0.362 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -11.342 -14.990 2.444 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -12.903 -15.781 2.359 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -12.263 -17.013 0.356 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -10.798 -16.069 0.171 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -9.962 -16.957 2.387 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -11.416 -17.923 2.539 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -9.589 -18.106 0.101 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -9.356 -19.110 1.518 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -10.730 -20.349 0.098 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -11.798 -19.723 1.260 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -11.714 -19.018 -0.283 1.00 0.00 H new ATOM 1930 N GLU B 32 -11.833 -12.744 2.545 1.00 0.00 N ATOM 1931 CA GLU B 32 -11.820 -11.667 3.503 1.00 0.00 C ATOM 1932 C GLU B 32 -11.582 -10.318 2.834 1.00 0.00 C ATOM 1933 O GLU B 32 -12.111 -9.307 3.267 1.00 0.00 O ATOM 1934 CB GLU B 32 -10.691 -11.960 4.492 1.00 0.00 C ATOM 1935 CG GLU B 32 -10.969 -13.287 5.199 1.00 0.00 C ATOM 1936 CD GLU B 32 -12.109 -13.119 6.172 1.00 0.00 C ATOM 1937 OE1 GLU B 32 -11.918 -12.427 7.161 1.00 0.00 O ATOM 1938 OE2 GLU B 32 -13.163 -13.660 5.924 1.00 0.00 O ATOM 0 H GLU B 32 -10.977 -13.299 2.557 1.00 0.00 H new ATOM 0 HA GLU B 32 -12.787 -11.608 4.002 1.00 0.00 H new ATOM 0 HB2 GLU B 32 -9.736 -12.007 3.968 1.00 0.00 H new ATOM 0 HB3 GLU B 32 -10.614 -11.155 5.223 1.00 0.00 H new ATOM 0 HG2 GLU B 32 -11.215 -14.055 4.466 1.00 0.00 H new ATOM 0 HG3 GLU B 32 -10.076 -13.623 5.726 1.00 0.00 H new ATOM 1945 N LEU B 33 -10.685 -10.301 1.851 1.00 0.00 N ATOM 1946 CA LEU B 33 -10.216 -9.047 1.250 1.00 0.00 C ATOM 1947 C LEU B 33 -11.363 -8.079 0.972 1.00 0.00 C ATOM 1948 O LEU B 33 -11.375 -6.954 1.483 1.00 0.00 O ATOM 1949 CB LEU B 33 -9.441 -9.359 -0.054 1.00 0.00 C ATOM 1950 CG LEU B 33 -8.927 -8.073 -0.748 1.00 0.00 C ATOM 1951 CD1 LEU B 33 -10.049 -7.421 -1.563 1.00 0.00 C ATOM 1952 CD2 LEU B 33 -8.372 -7.075 0.279 1.00 0.00 C ATOM 0 H LEU B 33 -10.266 -11.140 1.451 1.00 0.00 H new ATOM 0 HA LEU B 33 -9.553 -8.557 1.964 1.00 0.00 H new ATOM 0 HB2 LEU B 33 -8.597 -10.010 0.173 1.00 0.00 H new ATOM 0 HB3 LEU B 33 -10.089 -9.906 -0.739 1.00 0.00 H new ATOM 0 HG LEU B 33 -8.118 -8.355 -1.422 1.00 0.00 H new ATOM 0 HD11 LEU B 33 -9.672 -6.519 -2.044 1.00 0.00 H new ATOM 0 HD12 LEU B 33 -10.399 -8.119 -2.324 1.00 0.00 H new ATOM 0 HD13 LEU B 33 -10.875 -7.161 -0.901 1.00 0.00 H new ATOM 0 HD21 LEU B 33 -8.018 -6.182 -0.236 1.00 0.00 H new ATOM 0 HD22 LEU B 33 -9.159 -6.801 0.982 1.00 0.00 H new ATOM 0 HD23 LEU B 33 -7.545 -7.533 0.821 1.00 0.00 H new ATOM 1964 N LYS B 34 -12.326 -8.515 0.195 1.00 0.00 N ATOM 1965 CA LYS B 34 -13.444 -7.656 -0.160 1.00 0.00 C ATOM 1966 C LYS B 34 -14.234 -7.225 1.070 1.00 0.00 C ATOM 1967 O LYS B 34 -14.558 -6.046 1.234 1.00 0.00 O ATOM 1968 CB LYS B 34 -14.346 -8.356 -1.184 1.00 0.00 C ATOM 1969 CG LYS B 34 -14.891 -9.668 -0.603 1.00 0.00 C ATOM 1970 CD LYS B 34 -15.655 -10.433 -1.685 1.00 0.00 C ATOM 1971 CE LYS B 34 -16.221 -11.721 -1.083 1.00 0.00 C ATOM 1972 NZ LYS B 34 -15.123 -12.479 -0.418 1.00 0.00 N ATOM 0 H LYS B 34 -12.364 -9.453 -0.204 1.00 0.00 H new ATOM 0 HA LYS B 34 -13.044 -6.750 -0.615 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -15.173 -7.701 -1.459 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -13.784 -8.559 -2.095 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -14.071 -10.277 -0.224 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -15.549 -9.458 0.241 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -16.462 -9.817 -2.082 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -14.993 -10.667 -2.519 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -17.004 -11.485 -0.362 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -16.678 -12.330 -1.863 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -15.397 -13.478 -0.326 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -14.257 -12.409 -0.990 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -14.948 -12.080 0.526 1.00 0.00 H new ATOM 1986 N GLU B 35 -14.536 -8.178 1.935 1.00 0.00 N ATOM 1987 CA GLU B 35 -15.285 -7.885 3.144 1.00 0.00 C ATOM 1988 C GLU B 35 -14.464 -7.033 4.105 1.00 0.00 C ATOM 1989 O GLU B 35 -14.939 -6.013 4.616 1.00 0.00 O ATOM 1990 CB GLU B 35 -15.730 -9.190 3.815 1.00 0.00 C ATOM 1991 CG GLU B 35 -16.795 -9.872 2.935 1.00 0.00 C ATOM 1992 CD GLU B 35 -17.207 -11.220 3.501 1.00 0.00 C ATOM 1993 OE1 GLU B 35 -16.636 -11.644 4.484 1.00 0.00 O ATOM 1994 OE2 GLU B 35 -18.105 -11.809 2.947 1.00 0.00 O ATOM 0 H GLU B 35 -14.275 -9.158 1.823 1.00 0.00 H new ATOM 0 HA GLU B 35 -16.171 -7.312 2.871 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -14.875 -9.853 3.952 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -16.136 -8.984 4.805 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -17.670 -9.227 2.856 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -16.404 -10.004 1.926 1.00 0.00 H new ATOM 2001 N LEU B 36 -13.214 -7.411 4.290 1.00 0.00 N ATOM 2002 CA LEU B 36 -12.304 -6.666 5.139 1.00 0.00 C ATOM 2003 C LEU B 36 -12.035 -5.264 4.608 1.00 0.00 C ATOM 2004 O LEU B 36 -12.025 -4.296 5.372 1.00 0.00 O ATOM 2005 CB LEU B 36 -10.996 -7.480 5.389 1.00 0.00 C ATOM 2006 CG LEU B 36 -9.760 -6.822 4.734 1.00 0.00 C ATOM 2007 CD1 LEU B 36 -9.262 -5.656 5.583 1.00 0.00 C ATOM 2008 CD2 LEU B 36 -8.640 -7.862 4.612 1.00 0.00 C ATOM 0 H LEU B 36 -12.802 -8.238 3.859 1.00 0.00 H new ATOM 0 HA LEU B 36 -12.788 -6.523 6.105 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -10.829 -7.574 6.462 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -11.118 -8.489 4.996 1.00 0.00 H new ATOM 0 HG LEU B 36 -10.041 -6.450 3.749 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -8.392 -5.205 5.107 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -10.052 -4.911 5.676 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -8.986 -6.019 6.573 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -7.766 -7.403 4.150 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -8.376 -8.230 5.603 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -8.981 -8.693 3.995 1.00 0.00 H new ATOM 2020 N LEU B 37 -11.817 -5.149 3.303 1.00 0.00 N ATOM 2021 CA LEU B 37 -11.466 -3.856 2.717 1.00 0.00 C ATOM 2022 C LEU B 37 -12.569 -2.834 2.934 1.00 0.00 C ATOM 2023 O LEU B 37 -12.318 -1.729 3.432 1.00 0.00 O ATOM 2024 CB LEU B 37 -11.160 -4.017 1.209 1.00 0.00 C ATOM 2025 CG LEU B 37 -10.823 -2.663 0.545 1.00 0.00 C ATOM 2026 CD1 LEU B 37 -12.103 -1.873 0.238 1.00 0.00 C ATOM 2027 CD2 LEU B 37 -9.899 -1.834 1.439 1.00 0.00 C ATOM 0 H LEU B 37 -11.875 -5.920 2.638 1.00 0.00 H new ATOM 0 HA LEU B 37 -10.571 -3.488 3.219 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -10.324 -4.704 1.079 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -12.020 -4.463 0.709 1.00 0.00 H new ATOM 0 HG LEU B 37 -10.307 -2.871 -0.393 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -11.841 -0.923 -0.229 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -12.733 -2.449 -0.440 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -12.645 -1.684 1.165 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -9.675 -0.885 0.951 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -10.390 -1.644 2.393 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -8.972 -2.381 1.611 1.00 0.00 H new ATOM 2039 N GLN B 38 -13.795 -3.219 2.653 1.00 0.00 N ATOM 2040 CA GLN B 38 -14.904 -2.317 2.881 1.00 0.00 C ATOM 2041 C GLN B 38 -15.038 -2.038 4.365 1.00 0.00 C ATOM 2042 O GLN B 38 -15.336 -0.914 4.780 1.00 0.00 O ATOM 2043 CB GLN B 38 -16.214 -2.890 2.321 1.00 0.00 C ATOM 2044 CG GLN B 38 -16.562 -4.212 3.023 1.00 0.00 C ATOM 2045 CD GLN B 38 -17.915 -4.706 2.548 1.00 0.00 C ATOM 2046 OE1 GLN B 38 -18.948 -4.217 3.011 1.00 0.00 O ATOM 2047 NE2 GLN B 38 -17.977 -5.634 1.647 1.00 0.00 N ATOM 0 H GLN B 38 -14.047 -4.132 2.274 1.00 0.00 H new ATOM 0 HA GLN B 38 -14.702 -1.383 2.356 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -17.022 -2.172 2.462 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -16.117 -3.055 1.248 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -15.797 -4.959 2.811 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -16.576 -4.068 4.103 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -17.119 -6.035 1.268 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -18.884 -5.964 1.317 1.00 0.00 H new ATOM 2056 N THR B 39 -14.858 -3.081 5.151 1.00 0.00 N ATOM 2057 CA THR B 39 -14.998 -2.989 6.582 1.00 0.00 C ATOM 2058 C THR B 39 -13.970 -2.029 7.179 1.00 0.00 C ATOM 2059 O THR B 39 -14.318 -1.149 7.968 1.00 0.00 O ATOM 2060 CB THR B 39 -14.826 -4.389 7.184 1.00 0.00 C ATOM 2061 OG1 THR B 39 -15.830 -5.254 6.663 1.00 0.00 O ATOM 2062 CG2 THR B 39 -14.940 -4.333 8.706 1.00 0.00 C ATOM 0 H THR B 39 -14.611 -4.011 4.812 1.00 0.00 H new ATOM 0 HA THR B 39 -15.988 -2.598 6.818 1.00 0.00 H new ATOM 0 HB THR B 39 -13.839 -4.768 6.920 1.00 0.00 H new ATOM 0 HG1 THR B 39 -15.430 -5.861 6.006 1.00 0.00 H new ATOM 0 HG21 THR B 39 -14.816 -5.335 9.117 1.00 0.00 H new ATOM 0 HG22 THR B 39 -14.165 -3.678 9.105 1.00 0.00 H new ATOM 0 HG23 THR B 39 -15.921 -3.946 8.983 1.00 0.00 H new ATOM 2070 N GLU B 40 -12.701 -2.236 6.847 1.00 0.00 N ATOM 2071 CA GLU B 40 -11.646 -1.422 7.428 1.00 0.00 C ATOM 2072 C GLU B 40 -11.634 -0.008 6.852 1.00 0.00 C ATOM 2073 O GLU B 40 -11.404 0.960 7.576 1.00 0.00 O ATOM 2074 CB GLU B 40 -10.272 -2.085 7.244 1.00 0.00 C ATOM 2075 CG GLU B 40 -10.259 -3.463 7.945 1.00 0.00 C ATOM 2076 CD GLU B 40 -10.490 -3.353 9.446 1.00 0.00 C ATOM 2077 OE1 GLU B 40 -10.326 -2.288 9.994 1.00 0.00 O ATOM 2078 OE2 GLU B 40 -10.841 -4.353 10.031 1.00 0.00 O ATOM 0 H GLU B 40 -12.383 -2.948 6.190 1.00 0.00 H new ATOM 0 HA GLU B 40 -11.856 -1.344 8.495 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -10.055 -2.204 6.183 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -9.492 -1.448 7.660 1.00 0.00 H new ATOM 0 HG2 GLU B 40 -11.030 -4.098 7.507 1.00 0.00 H new ATOM 0 HG3 GLU B 40 -9.302 -3.952 7.762 1.00 0.00 H new ATOM 2085 N LEU B 41 -11.835 0.101 5.541 1.00 0.00 N ATOM 2086 CA LEU B 41 -11.768 1.397 4.859 1.00 0.00 C ATOM 2087 C LEU B 41 -13.138 1.956 4.542 1.00 0.00 C ATOM 2088 O LEU B 41 -13.301 2.696 3.563 1.00 0.00 O ATOM 2089 CB LEU B 41 -10.931 1.313 3.576 1.00 0.00 C ATOM 2090 CG LEU B 41 -9.451 1.570 3.895 1.00 0.00 C ATOM 2091 CD1 LEU B 41 -8.875 0.411 4.711 1.00 0.00 C ATOM 2092 CD2 LEU B 41 -8.667 1.723 2.590 1.00 0.00 C ATOM 0 H LEU B 41 -12.045 -0.688 4.929 1.00 0.00 H new ATOM 0 HA LEU B 41 -11.282 2.080 5.555 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -11.048 0.330 3.120 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -11.287 2.045 2.851 1.00 0.00 H new ATOM 0 HG LEU B 41 -9.368 2.486 4.480 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -7.825 0.607 4.930 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -9.428 0.313 5.645 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -8.960 -0.514 4.140 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -7.616 1.905 2.816 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -8.758 0.810 2.001 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -9.067 2.563 2.022 1.00 0.00 H new ATOM 2104 N SER B 42 -14.116 1.640 5.367 1.00 0.00 N ATOM 2105 CA SER B 42 -15.455 2.152 5.149 1.00 0.00 C ATOM 2106 C SER B 42 -15.411 3.667 4.985 1.00 0.00 C ATOM 2107 O SER B 42 -16.083 4.224 4.124 1.00 0.00 O ATOM 2108 CB SER B 42 -16.367 1.788 6.316 1.00 0.00 C ATOM 2109 OG SER B 42 -16.344 0.370 6.523 1.00 0.00 O ATOM 0 H SER B 42 -14.012 1.039 6.185 1.00 0.00 H new ATOM 0 HA SER B 42 -15.853 1.700 4.241 1.00 0.00 H new ATOM 0 HB2 SER B 42 -16.040 2.302 7.220 1.00 0.00 H new ATOM 0 HB3 SER B 42 -17.385 2.119 6.111 1.00 0.00 H new ATOM 0 HG SER B 42 -15.705 -0.041 5.904 1.00 0.00 H new ATOM 2115 N GLY B 43 -14.565 4.320 5.766 1.00 0.00 N ATOM 2116 CA GLY B 43 -14.414 5.763 5.683 1.00 0.00 C ATOM 2117 C GLY B 43 -13.906 6.175 4.318 1.00 0.00 C ATOM 2118 O GLY B 43 -14.536 6.989 3.638 1.00 0.00 O ATOM 0 H GLY B 43 -13.972 3.873 6.465 1.00 0.00 H new ATOM 0 HA2 GLY B 43 -15.372 6.245 5.880 1.00 0.00 H new ATOM 0 HA3 GLY B 43 -13.721 6.105 6.452 1.00 0.00 H new ATOM 2122 N PHE B 44 -12.826 5.539 3.871 1.00 0.00 N ATOM 2123 CA PHE B 44 -12.287 5.799 2.535 1.00 0.00 C ATOM 2124 C PHE B 44 -13.302 5.422 1.484 1.00 0.00 C ATOM 2125 O PHE B 44 -13.584 6.193 0.568 1.00 0.00 O ATOM 2126 CB PHE B 44 -10.985 5.011 2.297 1.00 0.00 C ATOM 2127 CG PHE B 44 -9.787 5.790 2.798 1.00 0.00 C ATOM 2128 CD1 PHE B 44 -9.358 5.656 4.123 1.00 0.00 C ATOM 2129 CD2 PHE B 44 -9.100 6.641 1.927 1.00 0.00 C ATOM 2130 CE1 PHE B 44 -8.241 6.376 4.571 1.00 0.00 C ATOM 2131 CE2 PHE B 44 -7.986 7.359 2.379 1.00 0.00 C ATOM 2132 CZ PHE B 44 -7.559 7.225 3.699 1.00 0.00 C ATOM 0 H PHE B 44 -12.308 4.844 4.409 1.00 0.00 H new ATOM 0 HA PHE B 44 -12.065 6.864 2.465 1.00 0.00 H new ATOM 0 HB2 PHE B 44 -11.038 4.049 2.807 1.00 0.00 H new ATOM 0 HB3 PHE B 44 -10.870 4.802 1.233 1.00 0.00 H new ATOM 0 HD1 PHE B 44 -9.886 5.000 4.799 1.00 0.00 H new ATOM 0 HD2 PHE B 44 -9.429 6.745 0.904 1.00 0.00 H new ATOM 0 HE1 PHE B 44 -7.908 6.273 5.593 1.00 0.00 H new ATOM 0 HE2 PHE B 44 -7.458 8.017 1.705 1.00 0.00 H new ATOM 0 HZ PHE B 44 -6.700 7.779 4.047 1.00 0.00 H new ATOM 2142 N LEU B 45 -13.891 4.260 1.660 1.00 0.00 N ATOM 2143 CA LEU B 45 -14.915 3.778 0.757 1.00 0.00 C ATOM 2144 C LEU B 45 -16.113 4.716 0.737 1.00 0.00 C ATOM 2145 O LEU B 45 -16.515 5.179 -0.321 1.00 0.00 O ATOM 2146 CB LEU B 45 -15.302 2.339 1.172 1.00 0.00 C ATOM 2147 CG LEU B 45 -16.751 2.007 0.803 1.00 0.00 C ATOM 2148 CD1 LEU B 45 -16.986 2.194 -0.698 1.00 0.00 C ATOM 2149 CD2 LEU B 45 -17.044 0.554 1.186 1.00 0.00 C ATOM 0 H LEU B 45 -13.676 3.625 2.429 1.00 0.00 H new ATOM 0 HA LEU B 45 -14.532 3.756 -0.263 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -14.632 1.629 0.687 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -15.166 2.222 2.247 1.00 0.00 H new ATOM 0 HG LEU B 45 -17.415 2.681 1.344 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -18.022 1.953 -0.937 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -16.782 3.229 -0.972 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -16.322 1.534 -1.255 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -18.074 0.310 0.926 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -16.367 -0.108 0.646 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -16.900 0.424 2.259 1.00 0.00 H new ATOM 2161 N ASP B 46 -16.598 5.088 1.901 1.00 0.00 N ATOM 2162 CA ASP B 46 -17.699 6.043 1.991 1.00 0.00 C ATOM 2163 C ASP B 46 -17.289 7.420 1.488 1.00 0.00 C ATOM 2164 O ASP B 46 -18.070 8.106 0.828 1.00 0.00 O ATOM 2165 CB ASP B 46 -18.216 6.121 3.428 1.00 0.00 C ATOM 2166 CG ASP B 46 -19.308 7.167 3.565 1.00 0.00 C ATOM 2167 OD1 ASP B 46 -20.362 6.985 2.998 1.00 0.00 O ATOM 2168 OD2 ASP B 46 -19.072 8.142 4.251 1.00 0.00 O ATOM 0 H ASP B 46 -16.254 4.750 2.800 1.00 0.00 H new ATOM 0 HA ASP B 46 -18.504 5.689 1.347 1.00 0.00 H new ATOM 0 HB2 ASP B 46 -18.602 5.148 3.731 1.00 0.00 H new ATOM 0 HB3 ASP B 46 -17.393 6.361 4.101 1.00 0.00 H new ATOM 2173 N ALA B 47 -16.082 7.841 1.845 1.00 0.00 N ATOM 2174 CA ALA B 47 -15.607 9.178 1.487 1.00 0.00 C ATOM 2175 C ALA B 47 -15.491 9.353 -0.015 1.00 0.00 C ATOM 2176 O ALA B 47 -15.816 10.420 -0.546 1.00 0.00 O ATOM 2177 CB ALA B 47 -14.258 9.475 2.141 1.00 0.00 C ATOM 0 H ALA B 47 -15.416 7.283 2.379 1.00 0.00 H new ATOM 0 HA ALA B 47 -16.349 9.884 1.859 1.00 0.00 H new ATOM 0 HB1 ALA B 47 -13.929 10.475 1.858 1.00 0.00 H new ATOM 0 HB2 ALA B 47 -14.359 9.419 3.225 1.00 0.00 H new ATOM 0 HB3 ALA B 47 -13.523 8.743 1.807 1.00 0.00 H new ATOM 2183 N GLN B 48 -14.985 8.337 -0.697 1.00 0.00 N ATOM 2184 CA GLN B 48 -14.786 8.424 -2.143 1.00 0.00 C ATOM 2185 C GLN B 48 -15.625 7.386 -2.878 1.00 0.00 C ATOM 2186 O GLN B 48 -15.221 6.871 -3.922 1.00 0.00 O ATOM 2187 CB GLN B 48 -13.300 8.257 -2.494 1.00 0.00 C ATOM 2188 CG GLN B 48 -12.818 6.852 -2.099 1.00 0.00 C ATOM 2189 CD GLN B 48 -12.195 6.176 -3.304 1.00 0.00 C ATOM 2190 OE1 GLN B 48 -11.034 5.795 -3.275 1.00 0.00 O ATOM 2191 NE2 GLN B 48 -12.908 6.012 -4.373 1.00 0.00 N ATOM 0 H GLN B 48 -14.706 7.449 -0.281 1.00 0.00 H new ATOM 0 HA GLN B 48 -15.113 9.412 -2.466 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -13.151 8.414 -3.562 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -12.709 9.012 -1.975 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -12.091 6.919 -1.290 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -13.654 6.260 -1.728 1.00 0.00 H new ATOM 0 HE21 GLN B 48 -13.877 6.331 -4.394 1.00 0.00 H new ATOM 0 HE22 GLN B 48 -12.501 5.564 -5.194 1.00 0.00 H new ATOM 2200 N LYS B 49 -16.759 7.050 -2.300 1.00 0.00 N ATOM 2201 CA LYS B 49 -17.627 6.019 -2.850 1.00 0.00 C ATOM 2202 C LYS B 49 -18.107 6.417 -4.242 1.00 0.00 C ATOM 2203 O LYS B 49 -18.205 5.584 -5.143 1.00 0.00 O ATOM 2204 CB LYS B 49 -18.846 5.808 -1.944 1.00 0.00 C ATOM 2205 CG LYS B 49 -19.609 4.580 -2.431 1.00 0.00 C ATOM 2206 CD LYS B 49 -20.864 4.365 -1.589 1.00 0.00 C ATOM 2207 CE LYS B 49 -21.594 3.121 -2.093 1.00 0.00 C ATOM 2208 NZ LYS B 49 -20.677 1.951 -2.023 1.00 0.00 N ATOM 0 H LYS B 49 -17.107 7.478 -1.442 1.00 0.00 H new ATOM 0 HA LYS B 49 -17.055 5.093 -2.912 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -18.529 5.671 -0.910 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -19.490 6.687 -1.966 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -19.883 4.706 -3.478 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -18.969 3.700 -2.373 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -20.597 4.245 -0.539 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -21.515 5.236 -1.655 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -22.483 2.937 -1.490 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -21.931 3.273 -3.119 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -21.234 1.073 -2.032 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -20.036 1.963 -2.842 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -20.120 1.999 -1.146 1.00 0.00 H new ATOM 2222 N ASP B 50 -18.475 7.680 -4.383 1.00 0.00 N ATOM 2223 CA ASP B 50 -19.003 8.197 -5.647 1.00 0.00 C ATOM 2224 C ASP B 50 -17.951 8.142 -6.739 1.00 0.00 C ATOM 2225 O ASP B 50 -18.275 8.094 -7.931 1.00 0.00 O ATOM 2226 CB ASP B 50 -19.520 9.633 -5.488 1.00 0.00 C ATOM 2227 CG ASP B 50 -20.083 10.130 -6.808 1.00 0.00 C ATOM 2228 OD1 ASP B 50 -21.036 9.544 -7.281 1.00 0.00 O ATOM 2229 OD2 ASP B 50 -19.562 11.090 -7.331 1.00 0.00 O ATOM 0 H ASP B 50 -18.420 8.374 -3.637 1.00 0.00 H new ATOM 0 HA ASP B 50 -19.839 7.560 -5.935 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -20.291 9.668 -4.718 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -18.711 10.285 -5.159 1.00 0.00 H new ATOM 2234 N VAL B 51 -16.699 8.221 -6.342 1.00 0.00 N ATOM 2235 CA VAL B 51 -15.607 8.245 -7.289 1.00 0.00 C ATOM 2236 C VAL B 51 -15.575 6.931 -8.053 1.00 0.00 C ATOM 2237 O VAL B 51 -15.595 5.855 -7.457 1.00 0.00 O ATOM 2238 CB VAL B 51 -14.283 8.458 -6.535 1.00 0.00 C ATOM 2239 CG1 VAL B 51 -13.105 8.498 -7.511 1.00 0.00 C ATOM 2240 CG2 VAL B 51 -14.344 9.765 -5.737 1.00 0.00 C ATOM 0 H VAL B 51 -16.412 8.270 -5.364 1.00 0.00 H new ATOM 0 HA VAL B 51 -15.746 9.062 -7.997 1.00 0.00 H new ATOM 0 HB VAL B 51 -14.136 7.623 -5.850 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -12.179 8.649 -6.957 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -13.052 7.556 -8.056 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -13.244 9.318 -8.216 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -13.404 9.911 -5.205 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -14.509 10.600 -6.418 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -15.163 9.715 -5.019 1.00 0.00 H new ATOM 2250 N ASP B 52 -15.501 7.026 -9.366 1.00 0.00 N ATOM 2251 CA ASP B 52 -15.499 5.849 -10.219 1.00 0.00 C ATOM 2252 C ASP B 52 -14.310 4.979 -9.896 1.00 0.00 C ATOM 2253 O ASP B 52 -14.397 3.749 -9.909 1.00 0.00 O ATOM 2254 CB ASP B 52 -15.456 6.255 -11.688 1.00 0.00 C ATOM 2255 CG ASP B 52 -15.489 5.023 -12.561 1.00 0.00 C ATOM 2256 OD1 ASP B 52 -16.472 4.318 -12.524 1.00 0.00 O ATOM 2257 OD2 ASP B 52 -14.529 4.792 -13.262 1.00 0.00 O ATOM 0 H ASP B 52 -15.441 7.911 -9.870 1.00 0.00 H new ATOM 0 HA ASP B 52 -16.415 5.288 -10.036 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -16.303 6.900 -11.921 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -14.552 6.830 -11.889 1.00 0.00 H new ATOM 2262 N ALA B 53 -13.202 5.622 -9.586 1.00 0.00 N ATOM 2263 CA ALA B 53 -11.991 4.901 -9.247 1.00 0.00 C ATOM 2264 C ALA B 53 -12.265 3.905 -8.132 1.00 0.00 C ATOM 2265 O ALA B 53 -11.644 2.850 -8.078 1.00 0.00 O ATOM 2266 CB ALA B 53 -10.874 5.862 -8.826 1.00 0.00 C ATOM 0 H ALA B 53 -13.115 6.638 -9.562 1.00 0.00 H new ATOM 0 HA ALA B 53 -11.662 4.363 -10.136 1.00 0.00 H new ATOM 0 HB1 ALA B 53 -9.978 5.292 -8.578 1.00 0.00 H new ATOM 0 HB2 ALA B 53 -10.654 6.545 -9.646 1.00 0.00 H new ATOM 0 HB3 ALA B 53 -11.194 6.433 -7.954 1.00 0.00 H new ATOM 2272 N VAL B 54 -13.252 4.205 -7.278 1.00 0.00 N ATOM 2273 CA VAL B 54 -13.593 3.280 -6.210 1.00 0.00 C ATOM 2274 C VAL B 54 -13.994 1.947 -6.815 1.00 0.00 C ATOM 2275 O VAL B 54 -13.430 0.906 -6.466 1.00 0.00 O ATOM 2276 CB VAL B 54 -14.727 3.853 -5.304 1.00 0.00 C ATOM 2277 CG1 VAL B 54 -16.118 3.398 -5.777 1.00 0.00 C ATOM 2278 CG2 VAL B 54 -14.520 3.406 -3.852 1.00 0.00 C ATOM 0 H VAL B 54 -13.810 5.058 -7.309 1.00 0.00 H new ATOM 0 HA VAL B 54 -12.721 3.135 -5.572 1.00 0.00 H new ATOM 0 HB VAL B 54 -14.678 4.940 -5.371 1.00 0.00 H new ATOM 0 HG11 VAL B 54 -16.881 3.818 -5.121 1.00 0.00 H new ATOM 0 HG12 VAL B 54 -16.287 3.744 -6.797 1.00 0.00 H new ATOM 0 HG13 VAL B 54 -16.174 2.310 -5.749 1.00 0.00 H new ATOM 0 HG21 VAL B 54 -15.317 3.812 -3.229 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -14.538 2.317 -3.800 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -13.558 3.771 -3.493 1.00 0.00 H new ATOM 2288 N ASP B 55 -14.860 1.999 -7.823 1.00 0.00 N ATOM 2289 CA ASP B 55 -15.235 0.788 -8.537 1.00 0.00 C ATOM 2290 C ASP B 55 -14.038 0.222 -9.224 1.00 0.00 C ATOM 2291 O ASP B 55 -13.846 -0.985 -9.266 1.00 0.00 O ATOM 2292 CB ASP B 55 -16.287 1.065 -9.615 1.00 0.00 C ATOM 2293 CG ASP B 55 -16.810 -0.255 -10.156 1.00 0.00 C ATOM 2294 OD1 ASP B 55 -17.492 -0.940 -9.429 1.00 0.00 O ATOM 2295 OD2 ASP B 55 -16.512 -0.574 -11.293 1.00 0.00 O ATOM 0 H ASP B 55 -15.307 2.852 -8.158 1.00 0.00 H new ATOM 0 HA ASP B 55 -15.643 0.095 -7.801 1.00 0.00 H new ATOM 0 HB2 ASP B 55 -17.106 1.651 -9.198 1.00 0.00 H new ATOM 0 HB3 ASP B 55 -15.852 1.655 -10.421 1.00 0.00 H new ATOM 2300 N LYS B 56 -13.295 1.099 -9.864 1.00 0.00 N ATOM 2301 CA LYS B 56 -12.202 0.667 -10.690 1.00 0.00 C ATOM 2302 C LYS B 56 -11.140 -0.027 -9.871 1.00 0.00 C ATOM 2303 O LYS B 56 -10.707 -1.112 -10.225 1.00 0.00 O ATOM 2304 CB LYS B 56 -11.610 1.830 -11.487 1.00 0.00 C ATOM 2305 CG LYS B 56 -12.682 2.411 -12.436 1.00 0.00 C ATOM 2306 CD LYS B 56 -13.192 1.309 -13.371 1.00 0.00 C ATOM 2307 CE LYS B 56 -13.809 1.929 -14.635 1.00 0.00 C ATOM 2308 NZ LYS B 56 -15.042 2.661 -14.281 1.00 0.00 N ATOM 0 H LYS B 56 -13.431 2.109 -9.825 1.00 0.00 H new ATOM 0 HA LYS B 56 -12.597 -0.055 -11.405 1.00 0.00 H new ATOM 0 HB2 LYS B 56 -11.254 2.605 -10.808 1.00 0.00 H new ATOM 0 HB3 LYS B 56 -10.749 1.489 -12.061 1.00 0.00 H new ATOM 0 HG2 LYS B 56 -13.509 2.823 -11.858 1.00 0.00 H new ATOM 0 HG3 LYS B 56 -12.261 3.230 -13.019 1.00 0.00 H new ATOM 0 HD2 LYS B 56 -12.371 0.646 -13.646 1.00 0.00 H new ATOM 0 HD3 LYS B 56 -13.935 0.700 -12.856 1.00 0.00 H new ATOM 0 HE2 LYS B 56 -13.095 2.606 -15.105 1.00 0.00 H new ATOM 0 HE3 LYS B 56 -14.034 1.148 -15.362 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 -15.791 2.430 -14.965 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 -15.348 2.385 -13.326 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 -14.857 3.684 -14.303 1.00 0.00 H new ATOM 2322 N VAL B 57 -10.824 0.511 -8.711 1.00 0.00 N ATOM 2323 CA VAL B 57 -9.874 -0.164 -7.849 1.00 0.00 C ATOM 2324 C VAL B 57 -10.431 -1.533 -7.478 1.00 0.00 C ATOM 2325 O VAL B 57 -9.752 -2.557 -7.610 1.00 0.00 O ATOM 2326 CB VAL B 57 -9.596 0.660 -6.583 1.00 0.00 C ATOM 2327 CG1 VAL B 57 -8.664 -0.130 -5.665 1.00 0.00 C ATOM 2328 CG2 VAL B 57 -8.923 1.979 -6.961 1.00 0.00 C ATOM 0 H VAL B 57 -11.198 1.389 -8.350 1.00 0.00 H new ATOM 0 HA VAL B 57 -8.930 -0.281 -8.381 1.00 0.00 H new ATOM 0 HB VAL B 57 -10.537 0.866 -6.073 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -8.463 0.450 -4.764 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -9.137 -1.073 -5.391 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -7.727 -0.331 -6.184 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -8.728 2.560 -6.059 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -7.982 1.774 -7.471 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -9.578 2.545 -7.623 1.00 0.00 H new ATOM 2338 N MET B 58 -11.695 -1.552 -7.110 1.00 0.00 N ATOM 2339 CA MET B 58 -12.360 -2.796 -6.792 1.00 0.00 C ATOM 2340 C MET B 58 -12.347 -3.686 -8.025 1.00 0.00 C ATOM 2341 O MET B 58 -12.107 -4.893 -7.939 1.00 0.00 O ATOM 2342 CB MET B 58 -13.813 -2.505 -6.394 1.00 0.00 C ATOM 2343 CG MET B 58 -13.843 -1.504 -5.232 1.00 0.00 C ATOM 2344 SD MET B 58 -14.057 -2.387 -3.674 1.00 0.00 S ATOM 2345 CE MET B 58 -15.856 -2.555 -3.779 1.00 0.00 C ATOM 0 H MET B 58 -12.281 -0.721 -7.024 1.00 0.00 H new ATOM 0 HA MET B 58 -11.849 -3.293 -5.968 1.00 0.00 H new ATOM 0 HB2 MET B 58 -14.360 -2.103 -7.247 1.00 0.00 H new ATOM 0 HB3 MET B 58 -14.312 -3.429 -6.103 1.00 0.00 H new ATOM 0 HG2 MET B 58 -12.917 -0.929 -5.211 1.00 0.00 H new ATOM 0 HG3 MET B 58 -14.657 -0.793 -5.373 1.00 0.00 H new ATOM 0 HE1 MET B 58 -16.232 -3.020 -2.868 1.00 0.00 H new ATOM 0 HE2 MET B 58 -16.307 -1.570 -3.896 1.00 0.00 H new ATOM 0 HE3 MET B 58 -16.114 -3.176 -4.637 1.00 0.00 H new ATOM 2355 N LYS B 59 -12.615 -3.077 -9.161 1.00 0.00 N ATOM 2356 CA LYS B 59 -12.647 -3.769 -10.434 1.00 0.00 C ATOM 2357 C LYS B 59 -11.254 -4.285 -10.787 1.00 0.00 C ATOM 2358 O LYS B 59 -11.089 -5.416 -11.241 1.00 0.00 O ATOM 2359 CB LYS B 59 -13.151 -2.805 -11.520 1.00 0.00 C ATOM 2360 CG LYS B 59 -13.757 -3.586 -12.678 1.00 0.00 C ATOM 2361 CD LYS B 59 -15.084 -4.217 -12.209 1.00 0.00 C ATOM 2362 CE LYS B 59 -16.264 -3.688 -13.039 1.00 0.00 C ATOM 2363 NZ LYS B 59 -16.233 -2.196 -13.110 1.00 0.00 N ATOM 0 H LYS B 59 -12.819 -2.080 -9.228 1.00 0.00 H new ATOM 0 HA LYS B 59 -13.322 -4.622 -10.368 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -13.895 -2.129 -11.099 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -12.327 -2.188 -11.880 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -13.932 -2.926 -13.528 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -13.068 -4.361 -13.013 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -15.028 -5.302 -12.299 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -15.246 -3.993 -11.155 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -16.224 -4.106 -14.045 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -17.204 -4.016 -12.595 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -17.158 -1.844 -13.430 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -16.022 -1.808 -12.168 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -15.497 -1.896 -13.781 1.00 0.00 H new ATOM 2377 N GLU B 60 -10.264 -3.435 -10.600 1.00 0.00 N ATOM 2378 CA GLU B 60 -8.881 -3.759 -10.913 1.00 0.00 C ATOM 2379 C GLU B 60 -8.351 -4.856 -10.004 1.00 0.00 C ATOM 2380 O GLU B 60 -7.610 -5.738 -10.446 1.00 0.00 O ATOM 2381 CB GLU B 60 -8.022 -2.506 -10.770 1.00 0.00 C ATOM 2382 CG GLU B 60 -8.344 -1.512 -11.899 1.00 0.00 C ATOM 2383 CD GLU B 60 -7.598 -0.204 -11.691 1.00 0.00 C ATOM 2384 OE1 GLU B 60 -6.868 -0.093 -10.734 1.00 0.00 O ATOM 2385 OE2 GLU B 60 -7.767 0.678 -12.496 1.00 0.00 O ATOM 0 H GLU B 60 -10.394 -2.495 -10.225 1.00 0.00 H new ATOM 0 HA GLU B 60 -8.837 -4.124 -11.939 1.00 0.00 H new ATOM 0 HB2 GLU B 60 -8.204 -2.040 -9.802 1.00 0.00 H new ATOM 0 HB3 GLU B 60 -6.966 -2.774 -10.801 1.00 0.00 H new ATOM 0 HG2 GLU B 60 -8.069 -1.945 -12.861 1.00 0.00 H new ATOM 0 HG3 GLU B 60 -9.417 -1.324 -11.930 1.00 0.00 H new ATOM 2392 N LEU B 61 -8.694 -4.787 -8.731 1.00 0.00 N ATOM 2393 CA LEU B 61 -8.200 -5.768 -7.771 1.00 0.00 C ATOM 2394 C LEU B 61 -8.952 -7.082 -7.900 1.00 0.00 C ATOM 2395 O LEU B 61 -8.529 -8.110 -7.358 1.00 0.00 O ATOM 2396 CB LEU B 61 -8.267 -5.229 -6.333 1.00 0.00 C ATOM 2397 CG LEU B 61 -7.023 -4.358 -6.024 1.00 0.00 C ATOM 2398 CD1 LEU B 61 -5.810 -5.246 -5.726 1.00 0.00 C ATOM 2399 CD2 LEU B 61 -6.695 -3.431 -7.205 1.00 0.00 C ATOM 0 H LEU B 61 -9.306 -4.072 -8.337 1.00 0.00 H new ATOM 0 HA LEU B 61 -7.152 -5.957 -8.001 1.00 0.00 H new ATOM 0 HB2 LEU B 61 -9.174 -4.639 -6.201 1.00 0.00 H new ATOM 0 HB3 LEU B 61 -8.322 -6.059 -5.629 1.00 0.00 H new ATOM 0 HG LEU B 61 -7.252 -3.749 -5.149 1.00 0.00 H new ATOM 0 HD11 LEU B 61 -4.944 -4.619 -5.511 1.00 0.00 H new ATOM 0 HD12 LEU B 61 -6.024 -5.877 -4.864 1.00 0.00 H new ATOM 0 HD13 LEU B 61 -5.597 -5.874 -6.591 1.00 0.00 H new ATOM 0 HD21 LEU B 61 -5.818 -2.830 -6.963 1.00 0.00 H new ATOM 0 HD22 LEU B 61 -6.491 -4.030 -8.092 1.00 0.00 H new ATOM 0 HD23 LEU B 61 -7.543 -2.774 -7.398 1.00 0.00 H new ATOM 2411 N ASP B 62 -10.001 -7.082 -8.709 1.00 0.00 N ATOM 2412 CA ASP B 62 -10.713 -8.314 -9.013 1.00 0.00 C ATOM 2413 C ASP B 62 -9.784 -9.260 -9.746 1.00 0.00 C ATOM 2414 O ASP B 62 -9.781 -10.470 -9.505 1.00 0.00 O ATOM 2415 CB ASP B 62 -11.957 -8.038 -9.866 1.00 0.00 C ATOM 2416 CG ASP B 62 -12.857 -9.262 -9.924 1.00 0.00 C ATOM 2417 OD1 ASP B 62 -12.893 -10.005 -8.966 1.00 0.00 O ATOM 2418 OD2 ASP B 62 -13.521 -9.425 -10.923 1.00 0.00 O ATOM 0 H ASP B 62 -10.376 -6.249 -9.164 1.00 0.00 H new ATOM 0 HA ASP B 62 -11.041 -8.767 -8.077 1.00 0.00 H new ATOM 0 HB2 ASP B 62 -12.509 -7.195 -9.450 1.00 0.00 H new ATOM 0 HB3 ASP B 62 -11.656 -7.755 -10.875 1.00 0.00 H new ATOM 2423 N GLU B 63 -8.930 -8.684 -10.579 1.00 0.00 N ATOM 2424 CA GLU B 63 -7.939 -9.447 -11.329 1.00 0.00 C ATOM 2425 C GLU B 63 -6.999 -10.138 -10.373 1.00 0.00 C ATOM 2426 O GLU B 63 -6.572 -11.268 -10.601 1.00 0.00 O ATOM 2427 CB GLU B 63 -7.127 -8.506 -12.210 1.00 0.00 C ATOM 2428 CG GLU B 63 -8.028 -7.922 -13.294 1.00 0.00 C ATOM 2429 CD GLU B 63 -7.255 -6.978 -14.200 1.00 0.00 C ATOM 2430 OE1 GLU B 63 -6.112 -6.684 -13.902 1.00 0.00 O ATOM 2431 OE2 GLU B 63 -7.799 -6.590 -15.205 1.00 0.00 O ATOM 0 H GLU B 63 -8.903 -7.680 -10.755 1.00 0.00 H new ATOM 0 HA GLU B 63 -8.454 -10.185 -11.945 1.00 0.00 H new ATOM 0 HB2 GLU B 63 -6.699 -7.705 -11.607 1.00 0.00 H new ATOM 0 HB3 GLU B 63 -6.294 -9.043 -12.664 1.00 0.00 H new ATOM 0 HG2 GLU B 63 -8.458 -8.729 -13.887 1.00 0.00 H new ATOM 0 HG3 GLU B 63 -8.859 -7.388 -12.832 1.00 0.00 H new ATOM 2438 N ASN B 64 -6.681 -9.450 -9.307 1.00 0.00 N ATOM 2439 CA ASN B 64 -5.779 -9.973 -8.306 1.00 0.00 C ATOM 2440 C ASN B 64 -6.360 -11.217 -7.666 1.00 0.00 C ATOM 2441 O ASN B 64 -5.637 -12.027 -7.102 1.00 0.00 O ATOM 2442 CB ASN B 64 -5.469 -8.910 -7.262 1.00 0.00 C ATOM 2443 CG ASN B 64 -4.401 -7.970 -7.799 1.00 0.00 C ATOM 2444 OD1 ASN B 64 -4.649 -6.775 -7.947 1.00 0.00 O ATOM 2445 ND2 ASN B 64 -3.231 -8.430 -8.114 1.00 0.00 N ATOM 0 H ASN B 64 -7.037 -8.515 -9.106 1.00 0.00 H new ATOM 0 HA ASN B 64 -4.843 -10.251 -8.790 1.00 0.00 H new ATOM 0 HB2 ASN B 64 -6.372 -8.350 -7.018 1.00 0.00 H new ATOM 0 HB3 ASN B 64 -5.126 -9.379 -6.340 1.00 0.00 H new ATOM 0 HD21 ASN B 64 -2.518 -7.801 -8.484 1.00 0.00 H new ATOM 0 HD22 ASN B 64 -3.023 -9.421 -7.992 1.00 0.00 H new ATOM 2452 N GLY B 65 -7.650 -11.443 -7.876 1.00 0.00 N ATOM 2453 CA GLY B 65 -8.281 -12.683 -7.431 1.00 0.00 C ATOM 2454 C GLY B 65 -7.847 -13.845 -8.321 1.00 0.00 C ATOM 2455 O GLY B 65 -8.580 -14.817 -8.490 1.00 0.00 O ATOM 0 H GLY B 65 -8.277 -10.791 -8.347 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -8.008 -12.887 -6.396 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -9.366 -12.578 -7.460 1.00 0.00 H new ATOM 2459 N ASP B 66 -6.635 -13.745 -8.862 1.00 0.00 N ATOM 2460 CA ASP B 66 -6.080 -14.765 -9.745 1.00 0.00 C ATOM 2461 C ASP B 66 -5.996 -16.087 -9.011 1.00 0.00 C ATOM 2462 O ASP B 66 -6.353 -17.142 -9.545 1.00 0.00 O ATOM 2463 CB ASP B 66 -4.676 -14.343 -10.186 1.00 0.00 C ATOM 2464 CG ASP B 66 -4.201 -15.207 -11.324 1.00 0.00 C ATOM 2465 OD1 ASP B 66 -4.762 -15.096 -12.391 1.00 0.00 O ATOM 2466 OD2 ASP B 66 -3.285 -15.965 -11.123 1.00 0.00 O ATOM 0 H ASP B 66 -6.011 -12.954 -8.700 1.00 0.00 H new ATOM 0 HA ASP B 66 -6.724 -14.876 -10.617 1.00 0.00 H new ATOM 0 HB2 ASP B 66 -4.684 -13.297 -10.494 1.00 0.00 H new ATOM 0 HB3 ASP B 66 -3.985 -14.423 -9.347 1.00 0.00 H new ATOM 2471 N GLY B 67 -5.601 -16.003 -7.759 1.00 0.00 N ATOM 2472 CA GLY B 67 -5.541 -17.149 -6.871 1.00 0.00 C ATOM 2473 C GLY B 67 -5.739 -16.674 -5.448 1.00 0.00 C ATOM 2474 O GLY B 67 -6.746 -16.983 -4.807 1.00 0.00 O ATOM 0 H GLY B 67 -5.309 -15.129 -7.322 1.00 0.00 H new ATOM 0 HA2 GLY B 67 -6.310 -17.874 -7.138 1.00 0.00 H new ATOM 0 HA3 GLY B 67 -4.580 -17.653 -6.970 1.00 0.00 H new ATOM 2478 N GLU B 68 -4.848 -15.805 -5.022 1.00 0.00 N ATOM 2479 CA GLU B 68 -4.935 -15.134 -3.739 1.00 0.00 C ATOM 2480 C GLU B 68 -4.592 -13.680 -3.951 1.00 0.00 C ATOM 2481 O GLU B 68 -4.063 -13.321 -5.010 1.00 0.00 O ATOM 2482 CB GLU B 68 -3.936 -15.742 -2.737 1.00 0.00 C ATOM 2483 CG GLU B 68 -3.878 -17.266 -2.893 1.00 0.00 C ATOM 2484 CD GLU B 68 -2.660 -17.657 -3.693 1.00 0.00 C ATOM 2485 OE1 GLU B 68 -2.750 -17.682 -4.896 1.00 0.00 O ATOM 2486 OE2 GLU B 68 -1.640 -17.927 -3.084 1.00 0.00 O ATOM 0 H GLU B 68 -4.027 -15.539 -5.566 1.00 0.00 H new ATOM 0 HA GLU B 68 -5.941 -15.248 -3.336 1.00 0.00 H new ATOM 0 HB2 GLU B 68 -2.946 -15.316 -2.898 1.00 0.00 H new ATOM 0 HB3 GLU B 68 -4.231 -15.486 -1.719 1.00 0.00 H new ATOM 0 HG2 GLU B 68 -3.846 -17.739 -1.912 1.00 0.00 H new ATOM 0 HG3 GLU B 68 -4.780 -17.624 -3.390 1.00 0.00 H new ATOM 2493 N VAL B 69 -4.744 -12.877 -2.923 1.00 0.00 N ATOM 2494 CA VAL B 69 -4.293 -11.508 -2.987 1.00 0.00 C ATOM 2495 C VAL B 69 -3.269 -11.302 -1.876 1.00 0.00 C ATOM 2496 O VAL B 69 -3.517 -11.626 -0.718 1.00 0.00 O ATOM 2497 CB VAL B 69 -5.511 -10.553 -2.858 1.00 0.00 C ATOM 2498 CG1 VAL B 69 -6.395 -10.957 -1.674 1.00 0.00 C ATOM 2499 CG2 VAL B 69 -5.060 -9.099 -2.697 1.00 0.00 C ATOM 0 H VAL B 69 -5.174 -13.147 -2.038 1.00 0.00 H new ATOM 0 HA VAL B 69 -3.818 -11.286 -3.943 1.00 0.00 H new ATOM 0 HB VAL B 69 -6.091 -10.635 -3.777 1.00 0.00 H new ATOM 0 HG11 VAL B 69 -7.242 -10.274 -1.603 1.00 0.00 H new ATOM 0 HG12 VAL B 69 -6.760 -11.973 -1.822 1.00 0.00 H new ATOM 0 HG13 VAL B 69 -5.813 -10.911 -0.753 1.00 0.00 H new ATOM 0 HG21 VAL B 69 -5.935 -8.454 -2.609 1.00 0.00 H new ATOM 0 HG22 VAL B 69 -4.448 -9.005 -1.800 1.00 0.00 H new ATOM 0 HG23 VAL B 69 -4.476 -8.801 -3.567 1.00 0.00 H new ATOM 2509 N ASP B 70 -2.084 -10.856 -2.234 1.00 0.00 N ATOM 2510 CA ASP B 70 -1.024 -10.762 -1.245 1.00 0.00 C ATOM 2511 C ASP B 70 -0.984 -9.404 -0.598 1.00 0.00 C ATOM 2512 O ASP B 70 -1.804 -8.531 -0.892 1.00 0.00 O ATOM 2513 CB ASP B 70 0.349 -11.137 -1.821 1.00 0.00 C ATOM 2514 CG ASP B 70 1.062 -9.913 -2.336 1.00 0.00 C ATOM 2515 OD1 ASP B 70 0.721 -9.456 -3.399 1.00 0.00 O ATOM 2516 OD2 ASP B 70 1.939 -9.440 -1.647 1.00 0.00 O ATOM 0 H ASP B 70 -1.831 -10.559 -3.176 1.00 0.00 H new ATOM 0 HA ASP B 70 -1.260 -11.494 -0.473 1.00 0.00 H new ATOM 0 HB2 ASP B 70 0.952 -11.619 -1.052 1.00 0.00 H new ATOM 0 HB3 ASP B 70 0.226 -11.859 -2.628 1.00 0.00 H new ATOM 2521 N PHE B 71 -0.034 -9.231 0.285 1.00 0.00 N ATOM 2522 CA PHE B 71 0.110 -7.986 1.002 1.00 0.00 C ATOM 2523 C PHE B 71 0.346 -6.859 0.015 1.00 0.00 C ATOM 2524 O PHE B 71 -0.275 -5.795 0.105 1.00 0.00 O ATOM 2525 CB PHE B 71 1.265 -8.066 1.998 1.00 0.00 C ATOM 2526 CG PHE B 71 1.263 -6.828 2.863 1.00 0.00 C ATOM 2527 CD1 PHE B 71 0.220 -6.628 3.768 1.00 0.00 C ATOM 2528 CD2 PHE B 71 2.297 -5.887 2.771 1.00 0.00 C ATOM 2529 CE1 PHE B 71 0.205 -5.499 4.579 1.00 0.00 C ATOM 2530 CE2 PHE B 71 2.278 -4.752 3.588 1.00 0.00 C ATOM 2531 CZ PHE B 71 1.234 -4.560 4.491 1.00 0.00 C ATOM 0 H PHE B 71 0.657 -9.941 0.527 1.00 0.00 H new ATOM 0 HA PHE B 71 -0.806 -7.793 1.560 1.00 0.00 H new ATOM 0 HB2 PHE B 71 1.165 -8.957 2.618 1.00 0.00 H new ATOM 0 HB3 PHE B 71 2.213 -8.152 1.467 1.00 0.00 H new ATOM 0 HD1 PHE B 71 -0.578 -7.352 3.839 1.00 0.00 H new ATOM 0 HD2 PHE B 71 3.106 -6.038 2.072 1.00 0.00 H new ATOM 0 HE1 PHE B 71 -0.604 -5.348 5.278 1.00 0.00 H new ATOM 0 HE2 PHE B 71 3.073 -4.024 3.519 1.00 0.00 H new ATOM 0 HZ PHE B 71 1.221 -3.684 5.123 1.00 0.00 H new ATOM 2541 N GLN B 72 1.211 -7.112 -0.952 1.00 0.00 N ATOM 2542 CA GLN B 72 1.498 -6.132 -1.979 1.00 0.00 C ATOM 2543 C GLN B 72 0.226 -5.755 -2.719 1.00 0.00 C ATOM 2544 O GLN B 72 -0.045 -4.577 -2.942 1.00 0.00 O ATOM 2545 CB GLN B 72 2.548 -6.679 -2.957 1.00 0.00 C ATOM 2546 CG GLN B 72 3.646 -5.639 -3.182 1.00 0.00 C ATOM 2547 CD GLN B 72 3.340 -4.849 -4.444 1.00 0.00 C ATOM 2548 OE1 GLN B 72 2.193 -4.241 -4.558 1.00 0.00 O flip ATOM 2549 NE2 GLN B 72 4.159 -4.796 -5.357 1.00 0.00 N flip ATOM 0 H GLN B 72 1.725 -7.988 -1.045 1.00 0.00 H new ATOM 0 HA GLN B 72 1.900 -5.236 -1.505 1.00 0.00 H new ATOM 0 HB2 GLN B 72 2.981 -7.598 -2.562 1.00 0.00 H new ATOM 0 HB3 GLN B 72 2.076 -6.932 -3.906 1.00 0.00 H new ATOM 0 HG2 GLN B 72 3.708 -4.968 -2.325 1.00 0.00 H new ATOM 0 HG3 GLN B 72 4.615 -6.130 -3.273 1.00 0.00 H new ATOM 0 HE21 GLN B 72 5.056 -5.273 -5.266 1.00 0.00 H new ATOM 0 HE22 GLN B 72 3.942 -4.275 -6.207 1.00 0.00 H new ATOM 2558 N GLU B 73 -0.565 -6.753 -3.060 1.00 0.00 N ATOM 2559 CA GLU B 73 -1.850 -6.528 -3.707 1.00 0.00 C ATOM 2560 C GLU B 73 -2.849 -5.895 -2.728 1.00 0.00 C ATOM 2561 O GLU B 73 -3.668 -5.053 -3.101 1.00 0.00 O ATOM 2562 CB GLU B 73 -2.368 -7.833 -4.306 1.00 0.00 C ATOM 2563 CG GLU B 73 -1.449 -8.205 -5.485 1.00 0.00 C ATOM 2564 CD GLU B 73 -1.808 -9.549 -6.082 1.00 0.00 C ATOM 2565 OE1 GLU B 73 -2.734 -10.170 -5.621 1.00 0.00 O ATOM 2566 OE2 GLU B 73 -1.132 -9.948 -7.010 1.00 0.00 O ATOM 0 H GLU B 73 -0.342 -7.735 -2.900 1.00 0.00 H new ATOM 0 HA GLU B 73 -1.722 -5.819 -4.525 1.00 0.00 H new ATOM 0 HB2 GLU B 73 -2.368 -8.624 -3.556 1.00 0.00 H new ATOM 0 HB3 GLU B 73 -3.397 -7.716 -4.646 1.00 0.00 H new ATOM 0 HG2 GLU B 73 -1.518 -7.436 -6.255 1.00 0.00 H new ATOM 0 HG3 GLU B 73 -0.413 -8.224 -5.145 1.00 0.00 H new ATOM 2573 N TYR B 74 -2.765 -6.296 -1.477 1.00 0.00 N ATOM 2574 CA TYR B 74 -3.617 -5.745 -0.430 1.00 0.00 C ATOM 2575 C TYR B 74 -3.401 -4.243 -0.266 1.00 0.00 C ATOM 2576 O TYR B 74 -4.367 -3.479 -0.154 1.00 0.00 O ATOM 2577 CB TYR B 74 -3.363 -6.478 0.902 1.00 0.00 C ATOM 2578 CG TYR B 74 -4.130 -5.835 2.046 1.00 0.00 C ATOM 2579 CD1 TYR B 74 -5.516 -5.658 1.964 1.00 0.00 C ATOM 2580 CD2 TYR B 74 -3.443 -5.432 3.203 1.00 0.00 C ATOM 2581 CE1 TYR B 74 -6.212 -5.078 3.030 1.00 0.00 C ATOM 2582 CE2 TYR B 74 -4.142 -4.852 4.267 1.00 0.00 C ATOM 2583 CZ TYR B 74 -5.525 -4.676 4.180 1.00 0.00 C ATOM 2584 OH TYR B 74 -6.208 -4.103 5.228 1.00 0.00 O ATOM 0 H TYR B 74 -2.111 -7.008 -1.153 1.00 0.00 H new ATOM 0 HA TYR B 74 -4.655 -5.897 -0.725 1.00 0.00 H new ATOM 0 HB2 TYR B 74 -3.659 -7.523 0.806 1.00 0.00 H new ATOM 0 HB3 TYR B 74 -2.296 -6.468 1.127 1.00 0.00 H new ATOM 0 HD1 TYR B 74 -6.048 -5.969 1.077 1.00 0.00 H new ATOM 0 HD2 TYR B 74 -2.374 -5.570 3.271 1.00 0.00 H new ATOM 0 HE1 TYR B 74 -7.281 -4.940 2.965 1.00 0.00 H new ATOM 0 HE2 TYR B 74 -3.613 -4.540 5.155 1.00 0.00 H new ATOM 0 HH TYR B 74 -5.580 -3.884 5.947 1.00 0.00 H new ATOM 2594 N VAL B 75 -2.143 -3.816 -0.225 1.00 0.00 N ATOM 2595 CA VAL B 75 -1.850 -2.409 0.002 1.00 0.00 C ATOM 2596 C VAL B 75 -2.356 -1.532 -1.127 1.00 0.00 C ATOM 2597 O VAL B 75 -2.857 -0.435 -0.890 1.00 0.00 O ATOM 2598 CB VAL B 75 -0.358 -2.157 0.281 1.00 0.00 C ATOM 2599 CG1 VAL B 75 0.054 -2.891 1.566 1.00 0.00 C ATOM 2600 CG2 VAL B 75 0.496 -2.648 -0.891 1.00 0.00 C ATOM 0 H VAL B 75 -1.325 -4.413 -0.344 1.00 0.00 H new ATOM 0 HA VAL B 75 -2.395 -2.127 0.903 1.00 0.00 H new ATOM 0 HB VAL B 75 -0.198 -1.086 0.404 1.00 0.00 H new ATOM 0 HG11 VAL B 75 1.111 -2.713 1.764 1.00 0.00 H new ATOM 0 HG12 VAL B 75 -0.539 -2.521 2.402 1.00 0.00 H new ATOM 0 HG13 VAL B 75 -0.117 -3.961 1.445 1.00 0.00 H new ATOM 0 HG21 VAL B 75 1.549 -2.462 -0.677 1.00 0.00 H new ATOM 0 HG22 VAL B 75 0.338 -3.717 -1.034 1.00 0.00 H new ATOM 0 HG23 VAL B 75 0.210 -2.115 -1.798 1.00 0.00 H new ATOM 2610 N VAL B 76 -2.246 -2.013 -2.355 1.00 0.00 N ATOM 2611 CA VAL B 76 -2.696 -1.229 -3.484 1.00 0.00 C ATOM 2612 C VAL B 76 -4.194 -0.989 -3.420 1.00 0.00 C ATOM 2613 O VAL B 76 -4.661 0.106 -3.722 1.00 0.00 O ATOM 2614 CB VAL B 76 -2.286 -1.854 -4.825 1.00 0.00 C ATOM 2615 CG1 VAL B 76 -0.768 -1.879 -4.945 1.00 0.00 C ATOM 2616 CG2 VAL B 76 -2.823 -3.272 -4.948 1.00 0.00 C ATOM 0 H VAL B 76 -1.856 -2.926 -2.589 1.00 0.00 H new ATOM 0 HA VAL B 76 -2.197 -0.262 -3.422 1.00 0.00 H new ATOM 0 HB VAL B 76 -2.708 -1.247 -5.626 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -0.486 -2.324 -5.899 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -0.382 -0.861 -4.891 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -0.348 -2.470 -4.131 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -2.520 -3.694 -5.906 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -2.423 -3.884 -4.139 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -3.911 -3.256 -4.887 1.00 0.00 H new ATOM 2626 N LEU B 77 -4.942 -2.000 -2.995 1.00 0.00 N ATOM 2627 CA LEU B 77 -6.385 -1.859 -2.896 1.00 0.00 C ATOM 2628 C LEU B 77 -6.746 -0.763 -1.914 1.00 0.00 C ATOM 2629 O LEU B 77 -7.479 0.165 -2.253 1.00 0.00 O ATOM 2630 CB LEU B 77 -7.015 -3.190 -2.459 1.00 0.00 C ATOM 2631 CG LEU B 77 -8.534 -3.028 -2.247 1.00 0.00 C ATOM 2632 CD1 LEU B 77 -9.205 -2.485 -3.507 1.00 0.00 C ATOM 2633 CD2 LEU B 77 -9.144 -4.382 -1.903 1.00 0.00 C ATOM 0 H LEU B 77 -4.579 -2.912 -2.718 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.776 -1.587 -3.876 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -6.827 -3.953 -3.215 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -6.548 -3.534 -1.536 1.00 0.00 H new ATOM 0 HG LEU B 77 -8.695 -2.322 -1.432 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -10.276 -2.380 -3.332 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -8.780 -1.512 -3.755 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -9.038 -3.175 -4.334 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -10.218 -4.270 -1.753 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -8.963 -5.081 -2.720 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -8.688 -4.765 -0.990 1.00 0.00 H new ATOM 2645 N VAL B 78 -6.135 -0.794 -0.747 1.00 0.00 N ATOM 2646 CA VAL B 78 -6.341 0.279 0.203 1.00 0.00 C ATOM 2647 C VAL B 78 -5.680 1.569 -0.287 1.00 0.00 C ATOM 2648 O VAL B 78 -6.289 2.643 -0.269 1.00 0.00 O ATOM 2649 CB VAL B 78 -5.861 -0.113 1.624 1.00 0.00 C ATOM 2650 CG1 VAL B 78 -6.664 -1.317 2.123 1.00 0.00 C ATOM 2651 CG2 VAL B 78 -4.378 -0.484 1.618 1.00 0.00 C ATOM 0 H VAL B 78 -5.505 -1.534 -0.438 1.00 0.00 H new ATOM 0 HA VAL B 78 -7.413 0.462 0.275 1.00 0.00 H new ATOM 0 HB VAL B 78 -6.011 0.744 2.280 1.00 0.00 H new ATOM 0 HG11 VAL B 78 -6.325 -1.591 3.122 1.00 0.00 H new ATOM 0 HG12 VAL B 78 -7.723 -1.060 2.157 1.00 0.00 H new ATOM 0 HG13 VAL B 78 -6.517 -2.159 1.446 1.00 0.00 H new ATOM 0 HG21 VAL B 78 -4.067 -0.755 2.627 1.00 0.00 H new ATOM 0 HG22 VAL B 78 -4.217 -1.330 0.949 1.00 0.00 H new ATOM 0 HG23 VAL B 78 -3.791 0.368 1.274 1.00 0.00 H new ATOM 2661 N ALA B 79 -4.444 1.451 -0.764 1.00 0.00 N ATOM 2662 CA ALA B 79 -3.686 2.611 -1.231 1.00 0.00 C ATOM 2663 C ALA B 79 -4.347 3.294 -2.403 1.00 0.00 C ATOM 2664 O ALA B 79 -4.430 4.528 -2.439 1.00 0.00 O ATOM 2665 CB ALA B 79 -2.267 2.222 -1.615 1.00 0.00 C ATOM 0 H ALA B 79 -3.945 0.565 -0.838 1.00 0.00 H new ATOM 0 HA ALA B 79 -3.659 3.312 -0.397 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -1.728 3.105 -1.958 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -1.758 1.800 -0.748 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -2.296 1.481 -2.414 1.00 0.00 H new ATOM 2671 N ALA B 80 -4.772 2.515 -3.387 1.00 0.00 N ATOM 2672 CA ALA B 80 -5.365 3.094 -4.572 1.00 0.00 C ATOM 2673 C ALA B 80 -6.590 3.899 -4.187 1.00 0.00 C ATOM 2674 O ALA B 80 -6.756 5.042 -4.619 1.00 0.00 O ATOM 2675 CB ALA B 80 -5.733 2.011 -5.581 1.00 0.00 C ATOM 0 H ALA B 80 -4.717 1.497 -3.385 1.00 0.00 H new ATOM 0 HA ALA B 80 -4.636 3.754 -5.042 1.00 0.00 H new ATOM 0 HB1 ALA B 80 -6.177 2.472 -6.463 1.00 0.00 H new ATOM 0 HB2 ALA B 80 -4.836 1.463 -5.870 1.00 0.00 H new ATOM 0 HB3 ALA B 80 -6.449 1.323 -5.131 1.00 0.00 H new ATOM 2681 N LEU B 81 -7.377 3.351 -3.274 1.00 0.00 N ATOM 2682 CA LEU B 81 -8.500 4.085 -2.709 1.00 0.00 C ATOM 2683 C LEU B 81 -7.979 5.278 -1.913 1.00 0.00 C ATOM 2684 O LEU B 81 -8.530 6.383 -1.973 1.00 0.00 O ATOM 2685 CB LEU B 81 -9.322 3.178 -1.788 1.00 0.00 C ATOM 2686 CG LEU B 81 -9.996 2.064 -2.607 1.00 0.00 C ATOM 2687 CD1 LEU B 81 -10.692 1.082 -1.667 1.00 0.00 C ATOM 2688 CD2 LEU B 81 -11.024 2.667 -3.568 1.00 0.00 C ATOM 0 H LEU B 81 -7.260 2.405 -2.910 1.00 0.00 H new ATOM 0 HA LEU B 81 -9.137 4.433 -3.522 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -8.677 2.740 -1.026 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -10.078 3.765 -1.267 1.00 0.00 H new ATOM 0 HG LEU B 81 -9.234 1.539 -3.182 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -11.168 0.295 -2.251 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -9.958 0.641 -0.993 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -11.448 1.609 -1.085 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -11.496 1.870 -4.143 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -11.784 3.202 -2.999 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -10.525 3.358 -4.247 1.00 0.00 H new ATOM 2700 N THR B 82 -6.902 5.048 -1.163 1.00 0.00 N ATOM 2701 CA THR B 82 -6.328 6.090 -0.334 1.00 0.00 C ATOM 2702 C THR B 82 -5.861 7.262 -1.189 1.00 0.00 C ATOM 2703 O THR B 82 -6.248 8.406 -0.948 1.00 0.00 O ATOM 2704 CB THR B 82 -5.158 5.541 0.497 1.00 0.00 C ATOM 2705 OG1 THR B 82 -5.552 4.349 1.161 1.00 0.00 O ATOM 2706 CG2 THR B 82 -4.722 6.573 1.543 1.00 0.00 C ATOM 0 H THR B 82 -6.416 4.152 -1.117 1.00 0.00 H new ATOM 0 HA THR B 82 -7.102 6.443 0.348 1.00 0.00 H new ATOM 0 HB THR B 82 -4.326 5.330 -0.175 1.00 0.00 H new ATOM 0 HG1 THR B 82 -5.877 3.700 0.503 1.00 0.00 H new ATOM 0 HG21 THR B 82 -3.892 6.172 2.126 1.00 0.00 H new ATOM 0 HG22 THR B 82 -4.405 7.488 1.042 1.00 0.00 H new ATOM 0 HG23 THR B 82 -5.558 6.794 2.207 1.00 0.00 H new ATOM 2714 N VAL B 83 -5.091 6.971 -2.230 1.00 0.00 N ATOM 2715 CA VAL B 83 -4.634 8.022 -3.122 1.00 0.00 C ATOM 2716 C VAL B 83 -5.829 8.666 -3.816 1.00 0.00 C ATOM 2717 O VAL B 83 -5.921 9.893 -3.903 1.00 0.00 O ATOM 2718 CB VAL B 83 -3.602 7.486 -4.141 1.00 0.00 C ATOM 2719 CG1 VAL B 83 -4.234 6.454 -5.051 1.00 0.00 C ATOM 2720 CG2 VAL B 83 -3.035 8.622 -4.991 1.00 0.00 C ATOM 0 H VAL B 83 -4.776 6.032 -2.473 1.00 0.00 H new ATOM 0 HA VAL B 83 -4.126 8.786 -2.533 1.00 0.00 H new ATOM 0 HB VAL B 83 -2.793 7.023 -3.576 1.00 0.00 H new ATOM 0 HG11 VAL B 83 -3.490 6.090 -5.760 1.00 0.00 H new ATOM 0 HG12 VAL B 83 -4.604 5.621 -4.454 1.00 0.00 H new ATOM 0 HG13 VAL B 83 -5.063 6.907 -5.595 1.00 0.00 H new ATOM 0 HG21 VAL B 83 -2.311 8.220 -5.700 1.00 0.00 H new ATOM 0 HG22 VAL B 83 -3.845 9.108 -5.535 1.00 0.00 H new ATOM 0 HG23 VAL B 83 -2.544 9.350 -4.345 1.00 0.00 H new ATOM 2730 N ALA B 84 -6.777 7.838 -4.248 1.00 0.00 N ATOM 2731 CA ALA B 84 -7.970 8.352 -4.894 1.00 0.00 C ATOM 2732 C ALA B 84 -8.691 9.324 -3.976 1.00 0.00 C ATOM 2733 O ALA B 84 -8.931 10.478 -4.349 1.00 0.00 O ATOM 2734 CB ALA B 84 -8.909 7.209 -5.284 1.00 0.00 C ATOM 0 H ALA B 84 -6.739 6.822 -4.162 1.00 0.00 H new ATOM 0 HA ALA B 84 -7.667 8.878 -5.799 1.00 0.00 H new ATOM 0 HB1 ALA B 84 -9.797 7.616 -5.767 1.00 0.00 H new ATOM 0 HB2 ALA B 84 -8.397 6.537 -5.973 1.00 0.00 H new ATOM 0 HB3 ALA B 84 -9.202 6.658 -4.390 1.00 0.00 H new ATOM 2740 N MET B 85 -8.971 8.890 -2.750 1.00 0.00 N ATOM 2741 CA MET B 85 -9.619 9.771 -1.781 1.00 0.00 C ATOM 2742 C MET B 85 -8.685 10.912 -1.429 1.00 0.00 C ATOM 2743 O MET B 85 -9.108 12.057 -1.299 1.00 0.00 O ATOM 2744 CB MET B 85 -10.022 9.023 -0.509 1.00 0.00 C ATOM 2745 CG MET B 85 -10.842 9.967 0.390 1.00 0.00 C ATOM 2746 SD MET B 85 -11.275 9.123 1.926 1.00 0.00 S ATOM 2747 CE MET B 85 -9.853 9.666 2.903 1.00 0.00 C ATOM 0 H MET B 85 -8.764 7.952 -2.408 1.00 0.00 H new ATOM 0 HA MET B 85 -10.529 10.159 -2.239 1.00 0.00 H new ATOM 0 HB2 MET B 85 -10.609 8.140 -0.762 1.00 0.00 H new ATOM 0 HB3 MET B 85 -9.135 8.675 0.020 1.00 0.00 H new ATOM 0 HG2 MET B 85 -10.267 10.867 0.608 1.00 0.00 H new ATOM 0 HG3 MET B 85 -11.746 10.284 -0.129 1.00 0.00 H new ATOM 0 HE1 MET B 85 -9.731 9.009 3.764 1.00 0.00 H new ATOM 0 HE2 MET B 85 -8.954 9.629 2.288 1.00 0.00 H new ATOM 0 HE3 MET B 85 -10.016 10.688 3.246 1.00 0.00 H new ATOM 2757 N ASN B 86 -7.404 10.595 -1.309 1.00 0.00 N ATOM 2758 CA ASN B 86 -6.401 11.598 -0.994 1.00 0.00 C ATOM 2759 C ASN B 86 -6.404 12.674 -2.051 1.00 0.00 C ATOM 2760 O ASN B 86 -6.382 13.856 -1.738 1.00 0.00 O ATOM 2761 CB ASN B 86 -5.024 10.947 -0.936 1.00 0.00 C ATOM 2762 CG ASN B 86 -3.925 11.988 -0.733 1.00 0.00 C ATOM 2763 OD1 ASN B 86 -4.100 12.961 -0.002 1.00 0.00 O ATOM 2764 ND2 ASN B 86 -2.795 11.839 -1.340 1.00 0.00 N ATOM 0 H ASN B 86 -7.036 9.651 -1.425 1.00 0.00 H new ATOM 0 HA ASN B 86 -6.633 12.043 -0.026 1.00 0.00 H new ATOM 0 HB2 ASN B 86 -4.996 10.222 -0.122 1.00 0.00 H new ATOM 0 HB3 ASN B 86 -4.841 10.397 -1.859 1.00 0.00 H new ATOM 0 HD21 ASN B 86 -2.053 12.527 -1.212 1.00 0.00 H new ATOM 0 HD22 ASN B 86 -2.645 11.034 -1.948 1.00 0.00 H new ATOM 2771 N ASN B 87 -6.526 12.265 -3.301 1.00 0.00 N ATOM 2772 CA ASN B 87 -6.581 13.214 -4.403 1.00 0.00 C ATOM 2773 C ASN B 87 -7.783 14.127 -4.214 1.00 0.00 C ATOM 2774 O ASN B 87 -7.672 15.349 -4.301 1.00 0.00 O ATOM 2775 CB ASN B 87 -6.715 12.461 -5.728 1.00 0.00 C ATOM 2776 CG ASN B 87 -6.038 13.232 -6.845 1.00 0.00 C ATOM 2777 OD1 ASN B 87 -5.270 12.650 -7.613 1.00 0.00 O ATOM 2778 ND2 ASN B 87 -6.259 14.500 -6.984 1.00 0.00 N ATOM 0 H ASN B 87 -6.589 11.286 -3.580 1.00 0.00 H new ATOM 0 HA ASN B 87 -5.666 13.807 -4.420 1.00 0.00 H new ATOM 0 HB2 ASN B 87 -6.268 11.471 -5.638 1.00 0.00 H new ATOM 0 HB3 ASN B 87 -7.769 12.314 -5.965 1.00 0.00 H new ATOM 0 HD21 ASN B 87 -5.797 15.019 -7.730 1.00 0.00 H new ATOM 0 HD22 ASN B 87 -6.895 14.980 -6.347 1.00 0.00 H new ATOM 2785 N PHE B 88 -8.900 13.525 -3.828 1.00 0.00 N ATOM 2786 CA PHE B 88 -10.107 14.269 -3.480 1.00 0.00 C ATOM 2787 C PHE B 88 -9.928 15.072 -2.210 1.00 0.00 C ATOM 2788 O PHE B 88 -10.568 16.089 -2.030 1.00 0.00 O ATOM 2789 CB PHE B 88 -11.332 13.352 -3.374 1.00 0.00 C ATOM 2790 CG PHE B 88 -11.883 13.110 -4.758 1.00 0.00 C ATOM 2791 CD1 PHE B 88 -12.714 14.070 -5.347 1.00 0.00 C ATOM 2792 CD2 PHE B 88 -11.561 11.944 -5.458 1.00 0.00 C ATOM 2793 CE1 PHE B 88 -13.220 13.865 -6.630 1.00 0.00 C ATOM 2794 CE2 PHE B 88 -12.071 11.739 -6.745 1.00 0.00 C ATOM 2795 CZ PHE B 88 -12.899 12.699 -7.331 1.00 0.00 C ATOM 0 H PHE B 88 -8.997 12.513 -3.747 1.00 0.00 H new ATOM 0 HA PHE B 88 -10.285 14.971 -4.295 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -11.056 12.406 -2.908 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -12.092 13.810 -2.741 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -12.964 14.971 -4.807 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -10.919 11.202 -5.006 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -13.860 14.608 -7.083 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -11.824 10.837 -7.286 1.00 0.00 H new ATOM 0 HZ PHE B 88 -13.291 12.541 -8.325 1.00 0.00 H new ATOM 2805 N PHE B 89 -9.147 14.553 -1.287 1.00 0.00 N ATOM 2806 CA PHE B 89 -9.012 15.169 0.017 1.00 0.00 C ATOM 2807 C PHE B 89 -8.636 16.632 -0.165 1.00 0.00 C ATOM 2808 O PHE B 89 -9.246 17.526 0.424 1.00 0.00 O ATOM 2809 CB PHE B 89 -7.883 14.464 0.769 1.00 0.00 C ATOM 2810 CG PHE B 89 -8.138 14.503 2.243 1.00 0.00 C ATOM 2811 CD1 PHE B 89 -7.795 15.622 3.004 1.00 0.00 C ATOM 2812 CD2 PHE B 89 -8.723 13.397 2.849 1.00 0.00 C ATOM 2813 CE1 PHE B 89 -8.046 15.626 4.382 1.00 0.00 C ATOM 2814 CE2 PHE B 89 -8.973 13.395 4.211 1.00 0.00 C ATOM 2815 CZ PHE B 89 -8.638 14.508 4.986 1.00 0.00 C ATOM 0 H PHE B 89 -8.595 13.705 -1.415 1.00 0.00 H new ATOM 0 HA PHE B 89 -9.948 15.090 0.571 1.00 0.00 H new ATOM 0 HB2 PHE B 89 -7.804 13.430 0.434 1.00 0.00 H new ATOM 0 HB3 PHE B 89 -6.931 14.945 0.545 1.00 0.00 H new ATOM 0 HD1 PHE B 89 -7.339 16.480 2.533 1.00 0.00 H new ATOM 0 HD2 PHE B 89 -8.984 12.534 2.254 1.00 0.00 H new ATOM 0 HE1 PHE B 89 -7.784 16.488 4.978 1.00 0.00 H new ATOM 0 HE2 PHE B 89 -9.428 12.532 4.675 1.00 0.00 H new ATOM 0 HZ PHE B 89 -8.835 14.507 6.048 1.00 0.00 H new ATOM 2825 N TRP B 90 -7.652 16.866 -1.012 1.00 0.00 N ATOM 2826 CA TRP B 90 -7.210 18.218 -1.341 1.00 0.00 C ATOM 2827 C TRP B 90 -8.151 18.865 -2.342 1.00 0.00 C ATOM 2828 O TRP B 90 -8.360 20.076 -2.321 1.00 0.00 O ATOM 2829 CB TRP B 90 -5.780 18.180 -1.890 1.00 0.00 C ATOM 2830 CG TRP B 90 -4.986 17.295 -0.999 1.00 0.00 C ATOM 2831 CD1 TRP B 90 -4.708 16.005 -1.249 1.00 0.00 C ATOM 2832 CD2 TRP B 90 -4.382 17.604 0.286 1.00 0.00 C ATOM 2833 NE1 TRP B 90 -3.999 15.490 -0.192 1.00 0.00 N ATOM 2834 CE2 TRP B 90 -3.757 16.439 0.776 1.00 0.00 C ATOM 2835 CE3 TRP B 90 -4.324 18.768 1.068 1.00 0.00 C ATOM 2836 CZ2 TRP B 90 -3.096 16.423 1.998 1.00 0.00 C ATOM 2837 CZ3 TRP B 90 -3.652 18.761 2.301 1.00 0.00 C ATOM 2838 CH2 TRP B 90 -3.039 17.589 2.763 1.00 0.00 C ATOM 0 H TRP B 90 -7.134 16.130 -1.493 1.00 0.00 H new ATOM 0 HA TRP B 90 -7.222 18.820 -0.432 1.00 0.00 H new ATOM 0 HB2 TRP B 90 -5.771 17.803 -2.913 1.00 0.00 H new ATOM 0 HB3 TRP B 90 -5.352 19.182 -1.916 1.00 0.00 H new ATOM 0 HD1 TRP B 90 -4.995 15.461 -2.137 1.00 0.00 H new ATOM 0 HE1 TRP B 90 -3.689 14.520 -0.131 1.00 0.00 H new ATOM 0 HE3 TRP B 90 -4.799 19.674 0.720 1.00 0.00 H new ATOM 0 HZ2 TRP B 90 -2.630 15.516 2.353 1.00 0.00 H new ATOM 0 HZ3 TRP B 90 -3.608 19.662 2.895 1.00 0.00 H new ATOM 0 HH2 TRP B 90 -2.522 17.588 3.711 1.00 0.00 H new ATOM 2849 N GLU B 91 -8.622 18.072 -3.288 1.00 0.00 N ATOM 2850 CA GLU B 91 -9.447 18.584 -4.389 1.00 0.00 C ATOM 2851 C GLU B 91 -10.941 18.561 -4.063 1.00 0.00 C ATOM 2852 O GLU B 91 -11.777 18.780 -4.947 1.00 0.00 O ATOM 2853 CB GLU B 91 -9.172 17.793 -5.665 1.00 0.00 C ATOM 2854 CG GLU B 91 -7.730 18.072 -6.123 1.00 0.00 C ATOM 2855 CD GLU B 91 -7.368 17.237 -7.335 1.00 0.00 C ATOM 2856 OE1 GLU B 91 -8.164 16.421 -7.746 1.00 0.00 O ATOM 2857 OE2 GLU B 91 -6.289 17.424 -7.836 1.00 0.00 O ATOM 0 H GLU B 91 -8.452 17.067 -3.323 1.00 0.00 H new ATOM 0 HA GLU B 91 -9.169 19.627 -4.539 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -9.311 16.727 -5.485 1.00 0.00 H new ATOM 0 HB3 GLU B 91 -9.877 18.079 -6.445 1.00 0.00 H new ATOM 0 HG2 GLU B 91 -7.620 19.130 -6.361 1.00 0.00 H new ATOM 0 HG3 GLU B 91 -7.039 17.855 -5.309 1.00 0.00 H new ATOM 2864 N ASN B 92 -11.277 18.232 -2.830 1.00 0.00 N ATOM 2865 CA ASN B 92 -12.672 18.125 -2.437 1.00 0.00 C ATOM 2866 C ASN B 92 -13.367 19.443 -2.647 1.00 0.00 C ATOM 2867 O ASN B 92 -13.020 20.449 -2.018 1.00 0.00 O ATOM 2868 CB ASN B 92 -12.796 17.706 -0.974 1.00 0.00 C ATOM 2869 CG ASN B 92 -14.214 17.966 -0.469 1.00 0.00 C ATOM 2870 OD1 ASN B 92 -14.399 18.637 0.543 1.00 0.00 O ATOM 2871 ND2 ASN B 92 -15.228 17.482 -1.118 1.00 0.00 N ATOM 0 H ASN B 92 -10.608 18.035 -2.086 1.00 0.00 H new ATOM 0 HA ASN B 92 -13.143 17.362 -3.057 1.00 0.00 H new ATOM 0 HB2 ASN B 92 -12.553 16.649 -0.869 1.00 0.00 H new ATOM 0 HB3 ASN B 92 -12.079 18.259 -0.368 1.00 0.00 H new ATOM 0 HD21 ASN B 92 -16.177 17.659 -0.788 1.00 0.00 H new ATOM 0 HD22 ASN B 92 -15.076 16.925 -1.959 1.00 0.00 H new ATOM 2878 N SER B 93 -14.314 19.447 -3.555 1.00 0.00 N ATOM 2879 CA SER B 93 -15.037 20.641 -3.902 1.00 0.00 C ATOM 2880 C SER B 93 -16.481 20.534 -3.436 1.00 0.00 C ATOM 2881 O SER B 93 -16.879 21.337 -2.632 1.00 0.00 O ATOM 2882 CB SER B 93 -14.971 20.846 -5.416 1.00 0.00 C ATOM 2883 OG SER B 93 -14.162 21.980 -5.707 1.00 0.00 O ATOM 2884 OXT SER B 93 -17.163 19.642 -3.880 1.00 0.00 O ATOM 0 H SER B 93 -14.604 18.618 -4.074 1.00 0.00 H new ATOM 0 HA SER B 93 -14.585 21.500 -3.406 1.00 0.00 H new ATOM 0 HB2 SER B 93 -14.558 19.959 -5.896 1.00 0.00 H new ATOM 0 HB3 SER B 93 -15.974 20.989 -5.818 1.00 0.00 H new ATOM 0 HG SER B 93 -14.118 22.110 -6.677 1.00 0.00 H new TER 2890 SER B 93