USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 844 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: C 13 ASN : amide:sc= -0.633 K(o=-0.63,f=-1.5!) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: C 11 SER OG : rot 180:sc= 0 USER MOD Set 2.2: C 21 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 13 ASN : amide:sc= 0.119 K(o=0.14,f=-1.6!) USER MOD Set 3.2: A 19 THR OG1 : rot 180:sc= 0.0215 USER MOD Set 4.1: A 11 SER OG : rot 180:sc= 0.0871 USER MOD Set 4.2: A 21 THR OG1 : rot -70:sc= 0.0913 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -163:sc= -0.0193 (180deg=-0.277) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.883 X(o=-0.88,f=-0.55) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.0079) USER MOD Single : A 35 ASN : amide:sc= -0.0559 K(o=-0.056,f=-1.7) USER MOD Single : A 38 LYS NZ :NH3+ 150:sc= -0.185 (180deg=-0.906) USER MOD Single : A 43 HIS : no HE2:sc= -1.17 K(o=-1.2,f=-2) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0.808 K(o=0.81,f=0) USER MOD Single : C 1 MET CE :methyl 174:sc=-0.00128 (180deg=-0.0241) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 7 LYS NZ :NH3+ -165:sc= -0.0301 (180deg=-0.252) USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= 0.0177 K(o=0.018,f=-1.2) USER MOD Single : C 29 GLN : amide:sc= 0 X(o=0,f=-0.0036) USER MOD Single : C 35 ASN : amide:sc= -0.037 K(o=-0.037,f=-1.9) USER MOD Single : C 38 LYS NZ :NH3+ 138:sc= -0.61 (180deg=-2.68!) USER MOD Single : C 43 HIS : no HE2:sc= -1.03 K(o=-1,f=-1.6) USER MOD Single : C 48 TYR OH : rot 3:sc= 1.16 USER MOD Single : C 49 GLN : amide:sc= 0.919 K(o=0.92,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.015 3.051 -1.766 1.00 0.00 N ATOM 2 CA MET A 1 -11.984 2.504 -0.861 1.00 0.00 C ATOM 3 C MET A 1 -12.013 0.986 -0.872 1.00 0.00 C ATOM 4 O MET A 1 -13.070 0.391 -0.700 1.00 0.00 O ATOM 5 CB MET A 1 -12.209 2.979 0.575 1.00 0.00 C ATOM 6 CG MET A 1 -11.184 2.357 1.524 1.00 0.00 C ATOM 7 SD MET A 1 -9.517 3.042 1.387 1.00 0.00 S ATOM 8 CE MET A 1 -9.782 4.471 2.463 1.00 0.00 C ATOM 0 H1 MET A 1 -12.980 4.090 -1.745 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.838 2.718 -2.735 1.00 0.00 H new ATOM 0 H3 MET A 1 -13.955 2.730 -1.456 1.00 0.00 H new ATOM 0 HA MET A 1 -11.018 2.860 -1.218 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.137 4.066 0.618 1.00 0.00 H new ATOM 0 HB3 MET A 1 -13.216 2.713 0.896 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.532 2.486 2.549 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.138 1.284 1.336 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.863 5.053 2.528 1.00 0.00 H new ATOM 0 HE2 MET A 1 -10.577 5.093 2.053 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.066 4.129 3.458 1.00 0.00 H new ATOM 20 N LEU A 2 -10.854 0.356 -1.072 1.00 0.00 N ATOM 21 CA LEU A 2 -10.722 -1.089 -1.023 1.00 0.00 C ATOM 22 C LEU A 2 -9.588 -1.397 -0.049 1.00 0.00 C ATOM 23 O LEU A 2 -8.420 -1.155 -0.350 1.00 0.00 O ATOM 24 CB LEU A 2 -10.477 -1.610 -2.446 1.00 0.00 C ATOM 25 CG LEU A 2 -10.535 -3.136 -2.606 1.00 0.00 C ATOM 26 CD1 LEU A 2 -9.124 -3.698 -2.621 1.00 0.00 C ATOM 27 CD2 LEU A 2 -11.301 -3.858 -1.498 1.00 0.00 C ATOM 0 H LEU A 2 -9.980 0.842 -1.273 1.00 0.00 H new ATOM 0 HA LEU A 2 -11.621 -1.592 -0.666 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -11.216 -1.163 -3.111 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -9.499 -1.263 -2.779 1.00 0.00 H new ATOM 0 HG LEU A 2 -11.067 -3.309 -3.542 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -9.165 -4.781 -2.735 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -8.569 -3.267 -3.454 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -8.624 -3.450 -1.685 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -11.293 -4.931 -1.689 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -10.827 -3.657 -0.537 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -12.331 -3.502 -1.476 1.00 0.00 H new ATOM 39 N ILE A 3 -9.943 -1.933 1.122 1.00 0.00 N ATOM 40 CA ILE A 3 -8.987 -2.278 2.160 1.00 0.00 C ATOM 41 C ILE A 3 -8.477 -3.693 1.929 1.00 0.00 C ATOM 42 O ILE A 3 -9.214 -4.557 1.449 1.00 0.00 O ATOM 43 CB ILE A 3 -9.619 -2.204 3.562 1.00 0.00 C ATOM 44 CG1 ILE A 3 -10.013 -0.775 3.946 1.00 0.00 C ATOM 45 CG2 ILE A 3 -8.593 -2.678 4.595 1.00 0.00 C ATOM 46 CD1 ILE A 3 -11.414 -0.418 3.467 1.00 0.00 C ATOM 0 H ILE A 3 -10.911 -2.138 1.371 1.00 0.00 H new ATOM 0 HA ILE A 3 -8.169 -1.559 2.111 1.00 0.00 H new ATOM 0 HB ILE A 3 -10.512 -2.829 3.546 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -9.962 -0.664 5.029 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -9.295 -0.075 3.519 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -9.031 -2.629 5.592 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -8.304 -3.706 4.376 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -7.713 -2.037 4.554 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -11.650 0.604 3.762 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -11.460 -0.502 2.381 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -12.136 -1.101 3.914 1.00 0.00 H new ATOM 58 N LEU A 4 -7.210 -3.917 2.278 1.00 0.00 N ATOM 59 CA LEU A 4 -6.565 -5.217 2.257 1.00 0.00 C ATOM 60 C LEU A 4 -5.646 -5.296 3.475 1.00 0.00 C ATOM 61 O LEU A 4 -5.264 -4.264 4.028 1.00 0.00 O ATOM 62 CB LEU A 4 -5.760 -5.371 0.955 1.00 0.00 C ATOM 63 CG LEU A 4 -6.643 -5.299 -0.298 1.00 0.00 C ATOM 64 CD1 LEU A 4 -5.774 -5.233 -1.552 1.00 0.00 C ATOM 65 CD2 LEU A 4 -7.548 -6.526 -0.406 1.00 0.00 C ATOM 0 H LEU A 4 -6.590 -3.170 2.592 1.00 0.00 H new ATOM 0 HA LEU A 4 -7.300 -6.021 2.294 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -5.002 -4.589 0.906 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.233 -6.325 0.969 1.00 0.00 H new ATOM 0 HG LEU A 4 -7.257 -4.402 -0.214 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -6.412 -5.182 -2.434 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -5.141 -4.346 -1.510 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.148 -6.123 -1.608 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -8.162 -6.447 -1.303 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -6.936 -7.426 -0.463 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -8.193 -6.581 0.471 1.00 0.00 H new ATOM 77 N THR A 5 -5.291 -6.511 3.898 1.00 0.00 N ATOM 78 CA THR A 5 -4.375 -6.698 5.020 1.00 0.00 C ATOM 79 C THR A 5 -3.160 -7.484 4.558 1.00 0.00 C ATOM 80 O THR A 5 -3.279 -8.410 3.759 1.00 0.00 O ATOM 81 CB THR A 5 -5.048 -7.427 6.187 1.00 0.00 C ATOM 82 OG1 THR A 5 -5.596 -8.649 5.756 1.00 0.00 O ATOM 83 CG2 THR A 5 -6.155 -6.585 6.802 1.00 0.00 C ATOM 0 H THR A 5 -5.625 -7.379 3.479 1.00 0.00 H new ATOM 0 HA THR A 5 -4.071 -5.713 5.374 1.00 0.00 H new ATOM 0 HB THR A 5 -4.280 -7.609 6.939 1.00 0.00 H new ATOM 0 HG1 THR A 5 -6.020 -9.103 6.514 1.00 0.00 H new ATOM 0 HG21 THR A 5 -6.612 -7.131 7.627 1.00 0.00 H new ATOM 0 HG22 THR A 5 -5.737 -5.650 7.174 1.00 0.00 H new ATOM 0 HG23 THR A 5 -6.911 -6.370 6.047 1.00 0.00 H new ATOM 91 N ARG A 6 -1.983 -7.108 5.071 1.00 0.00 N ATOM 92 CA ARG A 6 -0.735 -7.773 4.713 1.00 0.00 C ATOM 93 C ARG A 6 0.207 -7.829 5.911 1.00 0.00 C ATOM 94 O ARG A 6 0.382 -6.833 6.609 1.00 0.00 O ATOM 95 CB ARG A 6 -0.051 -6.977 3.592 1.00 0.00 C ATOM 96 CG ARG A 6 -0.776 -6.996 2.247 1.00 0.00 C ATOM 97 CD ARG A 6 -0.553 -8.309 1.484 1.00 0.00 C ATOM 98 NE ARG A 6 -1.299 -9.432 2.058 1.00 0.00 N ATOM 99 CZ ARG A 6 -1.407 -10.635 1.485 1.00 0.00 C ATOM 100 NH1 ARG A 6 -0.850 -10.883 0.305 1.00 0.00 N ATOM 101 NH2 ARG A 6 -2.082 -11.605 2.091 1.00 0.00 N ATOM 0 H ARG A 6 -1.874 -6.343 5.737 1.00 0.00 H new ATOM 0 HA ARG A 6 -0.960 -8.789 4.387 1.00 0.00 H new ATOM 0 HB2 ARG A 6 0.055 -5.941 3.915 1.00 0.00 H new ATOM 0 HB3 ARG A 6 0.955 -7.371 3.450 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -1.844 -6.850 2.410 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -0.429 -6.161 1.638 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -0.850 -8.175 0.444 1.00 0.00 H new ATOM 0 HD3 ARG A 6 0.511 -8.548 1.483 1.00 0.00 H new ATOM 0 HE ARG A 6 -1.766 -9.286 2.953 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -0.330 -10.150 -0.178 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -0.942 -11.806 -0.118 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -2.520 -11.433 2.996 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -2.163 -12.522 1.651 1.00 0.00 H new ATOM 115 N LYS A 7 0.809 -8.997 6.140 1.00 0.00 N ATOM 116 CA LYS A 7 1.860 -9.168 7.136 1.00 0.00 C ATOM 117 C LYS A 7 3.131 -8.579 6.535 1.00 0.00 C ATOM 118 O LYS A 7 3.254 -8.535 5.310 1.00 0.00 O ATOM 119 CB LYS A 7 2.046 -10.657 7.445 1.00 0.00 C ATOM 120 CG LYS A 7 2.002 -10.980 8.941 1.00 0.00 C ATOM 121 CD LYS A 7 0.627 -10.680 9.552 1.00 0.00 C ATOM 122 CE LYS A 7 0.574 -11.148 11.009 1.00 0.00 C ATOM 123 NZ LYS A 7 0.663 -12.617 11.117 1.00 0.00 N ATOM 0 H LYS A 7 0.578 -9.853 5.636 1.00 0.00 H new ATOM 0 HA LYS A 7 1.610 -8.668 8.072 1.00 0.00 H new ATOM 0 HB2 LYS A 7 1.268 -11.226 6.935 1.00 0.00 H new ATOM 0 HB3 LYS A 7 3.001 -10.988 7.038 1.00 0.00 H new ATOM 0 HG2 LYS A 7 2.245 -12.032 9.092 1.00 0.00 H new ATOM 0 HG3 LYS A 7 2.764 -10.399 9.460 1.00 0.00 H new ATOM 0 HD2 LYS A 7 0.425 -9.610 9.500 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -0.151 -11.180 8.975 1.00 0.00 H new ATOM 0 HE2 LYS A 7 1.392 -10.692 11.567 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -0.354 -10.806 11.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 0.341 -12.916 12.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 0.062 -13.056 10.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 1.649 -12.916 10.977 1.00 0.00 H new ATOM 137 N VAL A 8 4.085 -8.123 7.354 1.00 0.00 N ATOM 138 CA VAL A 8 5.300 -7.563 6.769 1.00 0.00 C ATOM 139 C VAL A 8 6.002 -8.615 5.905 1.00 0.00 C ATOM 140 O VAL A 8 6.190 -9.753 6.331 1.00 0.00 O ATOM 141 CB VAL A 8 6.235 -6.971 7.829 1.00 0.00 C ATOM 142 CG1 VAL A 8 5.501 -5.889 8.620 1.00 0.00 C ATOM 143 CG2 VAL A 8 6.774 -8.011 8.805 1.00 0.00 C ATOM 0 H VAL A 8 4.044 -8.129 8.373 1.00 0.00 H new ATOM 0 HA VAL A 8 5.012 -6.731 6.126 1.00 0.00 H new ATOM 0 HB VAL A 8 7.086 -6.555 7.291 1.00 0.00 H new ATOM 0 HG11 VAL A 8 6.170 -5.471 9.372 1.00 0.00 H new ATOM 0 HG12 VAL A 8 5.178 -5.099 7.942 1.00 0.00 H new ATOM 0 HG13 VAL A 8 4.630 -6.324 9.110 1.00 0.00 H new ATOM 0 HG21 VAL A 8 7.429 -7.526 9.529 1.00 0.00 H new ATOM 0 HG22 VAL A 8 5.943 -8.484 9.328 1.00 0.00 H new ATOM 0 HG23 VAL A 8 7.336 -8.767 8.257 1.00 0.00 H new ATOM 153 N GLY A 9 6.384 -8.226 4.685 1.00 0.00 N ATOM 154 CA GLY A 9 7.058 -9.101 3.734 1.00 0.00 C ATOM 155 C GLY A 9 6.147 -9.513 2.571 1.00 0.00 C ATOM 156 O GLY A 9 6.638 -9.990 1.550 1.00 0.00 O ATOM 0 H GLY A 9 6.230 -7.282 4.330 1.00 0.00 H new ATOM 0 HA2 GLY A 9 7.939 -8.595 3.340 1.00 0.00 H new ATOM 0 HA3 GLY A 9 7.408 -9.994 4.251 1.00 0.00 H new ATOM 160 N GLU A 10 4.829 -9.331 2.710 1.00 0.00 N ATOM 161 CA GLU A 10 3.871 -9.685 1.668 1.00 0.00 C ATOM 162 C GLU A 10 3.726 -8.558 0.642 1.00 0.00 C ATOM 163 O GLU A 10 4.394 -7.529 0.750 1.00 0.00 O ATOM 164 CB GLU A 10 2.525 -10.039 2.309 1.00 0.00 C ATOM 165 CG GLU A 10 2.669 -11.250 3.232 1.00 0.00 C ATOM 166 CD GLU A 10 1.314 -11.757 3.719 1.00 0.00 C ATOM 167 OE1 GLU A 10 0.507 -10.914 4.173 1.00 0.00 O ATOM 168 OE2 GLU A 10 1.093 -12.984 3.630 1.00 0.00 O ATOM 0 H GLU A 10 4.402 -8.935 3.547 1.00 0.00 H new ATOM 0 HA GLU A 10 4.240 -10.557 1.129 1.00 0.00 H new ATOM 0 HB2 GLU A 10 2.150 -9.186 2.875 1.00 0.00 H new ATOM 0 HB3 GLU A 10 1.791 -10.253 1.532 1.00 0.00 H new ATOM 0 HG2 GLU A 10 3.188 -12.050 2.704 1.00 0.00 H new ATOM 0 HG3 GLU A 10 3.286 -10.982 4.089 1.00 0.00 H new ATOM 175 N SER A 11 2.855 -8.737 -0.361 1.00 0.00 N ATOM 176 CA SER A 11 2.732 -7.782 -1.454 1.00 0.00 C ATOM 177 C SER A 11 1.286 -7.616 -1.927 1.00 0.00 C ATOM 178 O SER A 11 0.401 -8.396 -1.574 1.00 0.00 O ATOM 179 CB SER A 11 3.606 -8.242 -2.624 1.00 0.00 C ATOM 180 OG SER A 11 4.968 -8.209 -2.259 1.00 0.00 O ATOM 0 H SER A 11 2.227 -9.538 -0.431 1.00 0.00 H new ATOM 0 HA SER A 11 3.064 -6.812 -1.084 1.00 0.00 H new ATOM 0 HB2 SER A 11 3.326 -9.253 -2.921 1.00 0.00 H new ATOM 0 HB3 SER A 11 3.438 -7.598 -3.488 1.00 0.00 H new ATOM 0 HG SER A 11 5.516 -8.507 -3.015 1.00 0.00 H new ATOM 186 N ILE A 12 1.073 -6.574 -2.736 1.00 0.00 N ATOM 187 CA ILE A 12 -0.217 -6.133 -3.258 1.00 0.00 C ATOM 188 C ILE A 12 0.006 -5.644 -4.696 1.00 0.00 C ATOM 189 O ILE A 12 1.145 -5.426 -5.096 1.00 0.00 O ATOM 190 CB ILE A 12 -0.752 -5.011 -2.343 1.00 0.00 C ATOM 191 CG1 ILE A 12 -1.021 -5.507 -0.915 1.00 0.00 C ATOM 192 CG2 ILE A 12 -2.014 -4.348 -2.902 1.00 0.00 C ATOM 193 CD1 ILE A 12 -2.204 -6.473 -0.828 1.00 0.00 C ATOM 0 H ILE A 12 1.840 -5.985 -3.060 1.00 0.00 H new ATOM 0 HA ILE A 12 -0.954 -6.936 -3.273 1.00 0.00 H new ATOM 0 HB ILE A 12 0.040 -4.263 -2.309 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -0.127 -6.001 -0.534 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -1.211 -4.650 -0.269 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.347 -3.567 -2.219 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.794 -3.910 -3.875 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -2.800 -5.095 -3.010 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.342 -6.787 0.207 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.107 -5.975 -1.180 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -2.007 -7.347 -1.449 1.00 0.00 H new ATOM 205 N ASN A 13 -1.060 -5.472 -5.486 1.00 0.00 N ATOM 206 CA ASN A 13 -0.948 -5.064 -6.880 1.00 0.00 C ATOM 207 C ASN A 13 -2.029 -4.061 -7.279 1.00 0.00 C ATOM 208 O ASN A 13 -3.111 -4.027 -6.693 1.00 0.00 O ATOM 209 CB ASN A 13 -1.048 -6.302 -7.776 1.00 0.00 C ATOM 210 CG ASN A 13 0.314 -6.951 -7.964 1.00 0.00 C ATOM 211 OD1 ASN A 13 0.614 -7.974 -7.360 1.00 0.00 O ATOM 212 ND2 ASN A 13 1.147 -6.352 -8.809 1.00 0.00 N ATOM 0 H ASN A 13 -2.020 -5.613 -5.172 1.00 0.00 H new ATOM 0 HA ASN A 13 0.017 -4.573 -7.006 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.739 -7.020 -7.334 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.458 -6.021 -8.746 1.00 0.00 H new ATOM 0 HD21 ASN A 13 2.074 -6.743 -8.974 1.00 0.00 H new ATOM 0 HD22 ASN A 13 0.859 -5.501 -9.292 1.00 0.00 H new ATOM 219 N ILE A 14 -1.712 -3.250 -8.291 1.00 0.00 N ATOM 220 CA ILE A 14 -2.593 -2.213 -8.813 1.00 0.00 C ATOM 221 C ILE A 14 -2.417 -2.138 -10.328 1.00 0.00 C ATOM 222 O ILE A 14 -1.306 -2.297 -10.839 1.00 0.00 O ATOM 223 CB ILE A 14 -2.252 -0.862 -8.166 1.00 0.00 C ATOM 224 CG1 ILE A 14 -2.353 -0.956 -6.636 1.00 0.00 C ATOM 225 CG2 ILE A 14 -3.198 0.225 -8.694 1.00 0.00 C ATOM 226 CD1 ILE A 14 -1.977 0.356 -5.946 1.00 0.00 C ATOM 0 H ILE A 14 -0.817 -3.300 -8.777 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.630 -2.452 -8.579 1.00 0.00 H new ATOM 0 HB ILE A 14 -1.227 -0.599 -8.428 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -3.370 -1.231 -6.358 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.699 -1.752 -6.279 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -2.950 1.180 -8.231 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -3.090 0.308 -9.775 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -4.227 -0.039 -8.452 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.065 0.237 -4.866 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -0.950 0.619 -6.200 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -2.648 1.148 -6.280 1.00 0.00 H new ATOM 238 N GLY A 15 -3.518 -1.895 -11.047 1.00 0.00 N ATOM 239 CA GLY A 15 -3.499 -1.838 -12.498 1.00 0.00 C ATOM 240 C GLY A 15 -2.932 -3.135 -13.070 1.00 0.00 C ATOM 241 O GLY A 15 -3.209 -4.220 -12.563 1.00 0.00 O ATOM 0 H GLY A 15 -4.437 -1.734 -10.636 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -4.508 -1.676 -12.876 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -2.896 -0.992 -12.828 1.00 0.00 H new ATOM 245 N ASP A 16 -2.131 -3.008 -14.128 1.00 0.00 N ATOM 246 CA ASP A 16 -1.452 -4.131 -14.754 1.00 0.00 C ATOM 247 C ASP A 16 0.036 -3.806 -14.933 1.00 0.00 C ATOM 248 O ASP A 16 0.760 -4.523 -15.621 1.00 0.00 O ATOM 249 CB ASP A 16 -2.145 -4.476 -16.072 1.00 0.00 C ATOM 250 CG ASP A 16 -1.635 -5.795 -16.648 1.00 0.00 C ATOM 251 OD1 ASP A 16 -1.632 -6.791 -15.889 1.00 0.00 O ATOM 252 OD2 ASP A 16 -1.255 -5.802 -17.840 1.00 0.00 O ATOM 0 H ASP A 16 -1.937 -2.112 -14.575 1.00 0.00 H new ATOM 0 HA ASP A 16 -1.510 -5.013 -14.116 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -3.221 -4.541 -15.912 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.977 -3.675 -16.792 1.00 0.00 H new ATOM 257 N ASP A 17 0.487 -2.711 -14.312 1.00 0.00 N ATOM 258 CA ASP A 17 1.852 -2.223 -14.425 1.00 0.00 C ATOM 259 C ASP A 17 2.400 -1.733 -13.081 1.00 0.00 C ATOM 260 O ASP A 17 3.482 -1.150 -13.051 1.00 0.00 O ATOM 261 CB ASP A 17 1.913 -1.093 -15.457 1.00 0.00 C ATOM 262 CG ASP A 17 1.462 -1.563 -16.836 1.00 0.00 C ATOM 263 OD1 ASP A 17 2.302 -2.164 -17.542 1.00 0.00 O ATOM 264 OD2 ASP A 17 0.282 -1.320 -17.178 1.00 0.00 O ATOM 0 H ASP A 17 -0.101 -2.135 -13.709 1.00 0.00 H new ATOM 0 HA ASP A 17 2.476 -3.056 -14.749 1.00 0.00 H new ATOM 0 HB2 ASP A 17 1.282 -0.267 -15.130 1.00 0.00 H new ATOM 0 HB3 ASP A 17 2.932 -0.711 -15.518 1.00 0.00 H new ATOM 269 N ILE A 18 1.679 -1.953 -11.970 1.00 0.00 N ATOM 270 CA ILE A 18 2.149 -1.508 -10.665 1.00 0.00 C ATOM 271 C ILE A 18 2.063 -2.642 -9.648 1.00 0.00 C ATOM 272 O ILE A 18 1.163 -3.479 -9.694 1.00 0.00 O ATOM 273 CB ILE A 18 1.353 -0.279 -10.190 1.00 0.00 C ATOM 274 CG1 ILE A 18 1.424 0.885 -11.187 1.00 0.00 C ATOM 275 CG2 ILE A 18 1.916 0.206 -8.851 1.00 0.00 C ATOM 276 CD1 ILE A 18 0.266 0.844 -12.187 1.00 0.00 C ATOM 0 H ILE A 18 0.779 -2.432 -11.957 1.00 0.00 H new ATOM 0 HA ILE A 18 3.195 -1.216 -10.758 1.00 0.00 H new ATOM 0 HB ILE A 18 0.312 -0.589 -10.096 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.404 1.830 -10.645 1.00 0.00 H new ATOM 0 HG13 ILE A 18 2.371 0.846 -11.725 1.00 0.00 H new ATOM 0 HG21 ILE A 18 1.353 1.076 -8.513 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.832 -0.590 -8.111 1.00 0.00 H new ATOM 0 HG23 ILE A 18 2.964 0.477 -8.974 1.00 0.00 H new ATOM 0 HD11 ILE A 18 0.351 1.684 -12.876 1.00 0.00 H new ATOM 0 HD12 ILE A 18 0.302 -0.090 -12.747 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -0.681 0.909 -11.650 1.00 0.00 H new ATOM 288 N THR A 19 3.020 -2.651 -8.717 1.00 0.00 N ATOM 289 CA THR A 19 3.098 -3.614 -7.630 1.00 0.00 C ATOM 290 C THR A 19 3.486 -2.868 -6.359 1.00 0.00 C ATOM 291 O THR A 19 4.101 -1.805 -6.426 1.00 0.00 O ATOM 292 CB THR A 19 4.133 -4.695 -7.970 1.00 0.00 C ATOM 293 OG1 THR A 19 3.817 -5.298 -9.202 1.00 0.00 O ATOM 294 CG2 THR A 19 4.182 -5.793 -6.911 1.00 0.00 C ATOM 0 H THR A 19 3.778 -1.969 -8.703 1.00 0.00 H new ATOM 0 HA THR A 19 2.136 -4.105 -7.482 1.00 0.00 H new ATOM 0 HB THR A 19 5.103 -4.199 -8.015 1.00 0.00 H new ATOM 0 HG1 THR A 19 4.484 -5.985 -9.410 1.00 0.00 H new ATOM 0 HG21 THR A 19 4.928 -6.537 -7.192 1.00 0.00 H new ATOM 0 HG22 THR A 19 4.449 -5.358 -5.948 1.00 0.00 H new ATOM 0 HG23 THR A 19 3.205 -6.270 -6.836 1.00 0.00 H new ATOM 302 N ILE A 20 3.124 -3.426 -5.203 1.00 0.00 N ATOM 303 CA ILE A 20 3.342 -2.810 -3.900 1.00 0.00 C ATOM 304 C ILE A 20 3.858 -3.886 -2.950 1.00 0.00 C ATOM 305 O ILE A 20 3.503 -5.054 -3.086 1.00 0.00 O ATOM 306 CB ILE A 20 2.007 -2.247 -3.388 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.348 -1.260 -4.359 1.00 0.00 C ATOM 308 CG2 ILE A 20 2.180 -1.595 -2.014 1.00 0.00 C ATOM 309 CD1 ILE A 20 2.134 0.046 -4.495 1.00 0.00 C ATOM 0 H ILE A 20 2.663 -4.334 -5.149 1.00 0.00 H new ATOM 0 HA ILE A 20 4.067 -1.998 -3.966 1.00 0.00 H new ATOM 0 HB ILE A 20 1.336 -3.102 -3.304 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.255 -1.728 -5.339 1.00 0.00 H new ATOM 0 HG13 ILE A 20 0.338 -1.038 -4.015 1.00 0.00 H new ATOM 0 HG21 ILE A 20 1.221 -1.204 -1.673 1.00 0.00 H new ATOM 0 HG22 ILE A 20 2.543 -2.337 -1.302 1.00 0.00 H new ATOM 0 HG23 ILE A 20 2.899 -0.779 -2.086 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.622 0.707 -5.194 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.204 0.531 -3.522 1.00 0.00 H new ATOM 0 HD13 ILE A 20 3.136 -0.169 -4.866 1.00 0.00 H new ATOM 321 N THR A 21 4.696 -3.500 -1.984 1.00 0.00 N ATOM 322 CA THR A 21 5.249 -4.442 -1.023 1.00 0.00 C ATOM 323 C THR A 21 5.375 -3.778 0.342 1.00 0.00 C ATOM 324 O THR A 21 5.927 -2.685 0.457 1.00 0.00 O ATOM 325 CB THR A 21 6.627 -4.912 -1.507 1.00 0.00 C ATOM 326 OG1 THR A 21 6.527 -5.459 -2.802 1.00 0.00 O ATOM 327 CG2 THR A 21 7.208 -5.977 -0.578 1.00 0.00 C ATOM 0 H THR A 21 5.004 -2.537 -1.851 1.00 0.00 H new ATOM 0 HA THR A 21 4.585 -5.302 -0.935 1.00 0.00 H new ATOM 0 HB THR A 21 7.284 -4.043 -1.512 1.00 0.00 H new ATOM 0 HG1 THR A 21 6.046 -6.312 -2.761 1.00 0.00 H new ATOM 0 HG21 THR A 21 8.184 -6.289 -0.948 1.00 0.00 H new ATOM 0 HG22 THR A 21 7.315 -5.565 0.426 1.00 0.00 H new ATOM 0 HG23 THR A 21 6.539 -6.837 -0.548 1.00 0.00 H new ATOM 335 N ILE A 22 4.864 -4.442 1.382 1.00 0.00 N ATOM 336 CA ILE A 22 4.994 -3.973 2.752 1.00 0.00 C ATOM 337 C ILE A 22 6.366 -4.404 3.275 1.00 0.00 C ATOM 338 O ILE A 22 6.539 -5.509 3.794 1.00 0.00 O ATOM 339 CB ILE A 22 3.820 -4.478 3.609 1.00 0.00 C ATOM 340 CG1 ILE A 22 4.051 -4.224 5.102 1.00 0.00 C ATOM 341 CG2 ILE A 22 3.522 -5.964 3.403 1.00 0.00 C ATOM 342 CD1 ILE A 22 4.319 -2.751 5.386 1.00 0.00 C ATOM 0 H ILE A 22 4.350 -5.318 1.292 1.00 0.00 H new ATOM 0 HA ILE A 22 4.942 -2.885 2.803 1.00 0.00 H new ATOM 0 HB ILE A 22 2.957 -3.905 3.269 1.00 0.00 H new ATOM 0 HG12 ILE A 22 3.178 -4.551 5.667 1.00 0.00 H new ATOM 0 HG13 ILE A 22 4.895 -4.821 5.447 1.00 0.00 H new ATOM 0 HG21 ILE A 22 2.684 -6.258 4.035 1.00 0.00 H new ATOM 0 HG22 ILE A 22 3.268 -6.143 2.358 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.401 -6.552 3.669 1.00 0.00 H new ATOM 0 HD11 ILE A 22 4.478 -2.610 6.455 1.00 0.00 H new ATOM 0 HD12 ILE A 22 5.208 -2.431 4.842 1.00 0.00 H new ATOM 0 HD13 ILE A 22 3.463 -2.157 5.065 1.00 0.00 H new ATOM 354 N LEU A 23 7.349 -3.515 3.134 1.00 0.00 N ATOM 355 CA LEU A 23 8.719 -3.801 3.523 1.00 0.00 C ATOM 356 C LEU A 23 8.834 -3.982 5.035 1.00 0.00 C ATOM 357 O LEU A 23 9.687 -4.740 5.494 1.00 0.00 O ATOM 358 CB LEU A 23 9.628 -2.659 3.062 1.00 0.00 C ATOM 359 CG LEU A 23 9.461 -2.331 1.578 1.00 0.00 C ATOM 360 CD1 LEU A 23 10.401 -1.191 1.209 1.00 0.00 C ATOM 361 CD2 LEU A 23 9.789 -3.523 0.686 1.00 0.00 C ATOM 0 H LEU A 23 7.213 -2.581 2.748 1.00 0.00 H new ATOM 0 HA LEU A 23 9.028 -4.732 3.048 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.413 -1.769 3.653 1.00 0.00 H new ATOM 0 HB3 LEU A 23 10.667 -2.927 3.256 1.00 0.00 H new ATOM 0 HG LEU A 23 8.418 -2.056 1.419 1.00 0.00 H new ATOM 0 HD11 LEU A 23 10.286 -0.953 0.152 1.00 0.00 H new ATOM 0 HD12 LEU A 23 10.160 -0.312 1.807 1.00 0.00 H new ATOM 0 HD13 LEU A 23 11.431 -1.491 1.404 1.00 0.00 H new ATOM 0 HD21 LEU A 23 9.656 -3.243 -0.359 1.00 0.00 H new ATOM 0 HD22 LEU A 23 10.822 -3.828 0.851 1.00 0.00 H new ATOM 0 HD23 LEU A 23 9.123 -4.352 0.927 1.00 0.00 H new ATOM 373 N GLY A 24 7.987 -3.298 5.817 1.00 0.00 N ATOM 374 CA GLY A 24 7.965 -3.496 7.261 1.00 0.00 C ATOM 375 C GLY A 24 7.405 -2.296 8.013 1.00 0.00 C ATOM 376 O GLY A 24 6.847 -1.379 7.405 1.00 0.00 O ATOM 0 H GLY A 24 7.317 -2.611 5.472 1.00 0.00 H new ATOM 0 HA2 GLY A 24 7.366 -4.376 7.493 1.00 0.00 H new ATOM 0 HA3 GLY A 24 8.977 -3.698 7.611 1.00 0.00 H new ATOM 380 N VAL A 25 7.555 -2.302 9.342 1.00 0.00 N ATOM 381 CA VAL A 25 7.130 -1.193 10.190 1.00 0.00 C ATOM 382 C VAL A 25 8.229 -0.839 11.182 1.00 0.00 C ATOM 383 O VAL A 25 9.142 -1.632 11.422 1.00 0.00 O ATOM 384 CB VAL A 25 5.823 -1.520 10.935 1.00 0.00 C ATOM 385 CG1 VAL A 25 4.785 -2.135 9.996 1.00 0.00 C ATOM 386 CG2 VAL A 25 6.074 -2.483 12.098 1.00 0.00 C ATOM 0 H VAL A 25 7.975 -3.077 9.856 1.00 0.00 H new ATOM 0 HA VAL A 25 6.939 -0.334 9.546 1.00 0.00 H new ATOM 0 HB VAL A 25 5.439 -0.577 11.324 1.00 0.00 H new ATOM 0 HG11 VAL A 25 3.874 -2.354 10.554 1.00 0.00 H new ATOM 0 HG12 VAL A 25 4.559 -1.433 9.193 1.00 0.00 H new ATOM 0 HG13 VAL A 25 5.180 -3.057 9.571 1.00 0.00 H new ATOM 0 HG21 VAL A 25 5.132 -2.695 12.605 1.00 0.00 H new ATOM 0 HG22 VAL A 25 6.498 -3.412 11.716 1.00 0.00 H new ATOM 0 HG23 VAL A 25 6.771 -2.029 12.802 1.00 0.00 H new ATOM 396 N SER A 26 8.132 0.356 11.757 1.00 0.00 N ATOM 397 CA SER A 26 9.051 0.844 12.773 1.00 0.00 C ATOM 398 C SER A 26 8.292 1.848 13.632 1.00 0.00 C ATOM 399 O SER A 26 8.210 3.031 13.305 1.00 0.00 O ATOM 400 CB SER A 26 10.291 1.461 12.117 1.00 0.00 C ATOM 401 OG SER A 26 9.927 2.380 11.106 1.00 0.00 O ATOM 0 H SER A 26 7.397 1.023 11.523 1.00 0.00 H new ATOM 0 HA SER A 26 9.410 0.031 13.404 1.00 0.00 H new ATOM 0 HB2 SER A 26 10.893 1.966 12.873 1.00 0.00 H new ATOM 0 HB3 SER A 26 10.911 0.673 11.690 1.00 0.00 H new ATOM 0 HG SER A 26 10.735 2.761 10.704 1.00 0.00 H new ATOM 407 N GLY A 27 7.730 1.371 14.744 1.00 0.00 N ATOM 408 CA GLY A 27 6.821 2.183 15.527 1.00 0.00 C ATOM 409 C GLY A 27 5.512 2.300 14.762 1.00 0.00 C ATOM 410 O GLY A 27 4.909 1.285 14.417 1.00 0.00 O ATOM 0 H GLY A 27 7.891 0.434 15.113 1.00 0.00 H new ATOM 0 HA2 GLY A 27 6.652 1.730 16.504 1.00 0.00 H new ATOM 0 HA3 GLY A 27 7.248 3.170 15.703 1.00 0.00 H new ATOM 414 N GLN A 28 5.080 3.530 14.497 1.00 0.00 N ATOM 415 CA GLN A 28 3.848 3.786 13.762 1.00 0.00 C ATOM 416 C GLN A 28 4.175 4.094 12.309 1.00 0.00 C ATOM 417 O GLN A 28 3.275 4.377 11.521 1.00 0.00 O ATOM 418 CB GLN A 28 3.075 4.925 14.434 1.00 0.00 C ATOM 419 CG GLN A 28 2.115 4.365 15.488 1.00 0.00 C ATOM 420 CD GLN A 28 2.763 3.273 16.335 1.00 0.00 C ATOM 421 OE1 GLN A 28 3.491 3.548 17.282 1.00 0.00 O ATOM 422 NE2 GLN A 28 2.495 2.013 15.991 1.00 0.00 N ATOM 0 H GLN A 28 5.574 4.374 14.786 1.00 0.00 H new ATOM 0 HA GLN A 28 3.210 2.902 13.776 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.772 5.621 14.900 1.00 0.00 H new ATOM 0 HB3 GLN A 28 2.517 5.486 13.685 1.00 0.00 H new ATOM 0 HG2 GLN A 28 1.778 5.174 16.137 1.00 0.00 H new ATOM 0 HG3 GLN A 28 1.230 3.963 14.994 1.00 0.00 H new ATOM 0 HE21 GLN A 28 1.885 1.820 15.197 1.00 0.00 H new ATOM 0 HE22 GLN A 28 2.900 1.242 16.522 1.00 0.00 H new ATOM 431 N GLN A 29 5.460 4.042 11.946 1.00 0.00 N ATOM 432 CA GLN A 29 5.857 4.160 10.559 1.00 0.00 C ATOM 433 C GLN A 29 5.650 2.829 9.861 1.00 0.00 C ATOM 434 O GLN A 29 5.560 1.781 10.500 1.00 0.00 O ATOM 435 CB GLN A 29 7.331 4.522 10.442 1.00 0.00 C ATOM 436 CG GLN A 29 7.598 6.004 10.685 1.00 0.00 C ATOM 437 CD GLN A 29 9.006 6.333 10.219 1.00 0.00 C ATOM 438 OE1 GLN A 29 9.196 7.005 9.210 1.00 0.00 O ATOM 439 NE2 GLN A 29 10.011 5.858 10.953 1.00 0.00 N ATOM 0 H GLN A 29 6.234 3.919 12.599 1.00 0.00 H new ATOM 0 HA GLN A 29 5.252 4.943 10.102 1.00 0.00 H new ATOM 0 HB2 GLN A 29 7.903 3.932 11.159 1.00 0.00 H new ATOM 0 HB3 GLN A 29 7.689 4.251 9.449 1.00 0.00 H new ATOM 0 HG2 GLN A 29 6.871 6.611 10.146 1.00 0.00 H new ATOM 0 HG3 GLN A 29 7.487 6.238 11.744 1.00 0.00 H new ATOM 0 HE21 GLN A 29 9.816 5.303 11.786 1.00 0.00 H new ATOM 0 HE22 GLN A 29 10.975 6.050 10.682 1.00 0.00 H new ATOM 448 N VAL A 30 5.580 2.889 8.536 1.00 0.00 N ATOM 449 CA VAL A 30 5.475 1.720 7.692 1.00 0.00 C ATOM 450 C VAL A 30 6.332 1.965 6.463 1.00 0.00 C ATOM 451 O VAL A 30 6.091 2.922 5.729 1.00 0.00 O ATOM 452 CB VAL A 30 4.014 1.514 7.285 1.00 0.00 C ATOM 453 CG1 VAL A 30 3.889 0.245 6.449 1.00 0.00 C ATOM 454 CG2 VAL A 30 3.102 1.379 8.507 1.00 0.00 C ATOM 0 H VAL A 30 5.595 3.767 8.017 1.00 0.00 H new ATOM 0 HA VAL A 30 5.814 0.827 8.217 1.00 0.00 H new ATOM 0 HB VAL A 30 3.706 2.388 6.711 1.00 0.00 H new ATOM 0 HG11 VAL A 30 2.848 0.100 6.160 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.504 0.337 5.554 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.225 -0.611 7.034 1.00 0.00 H new ATOM 0 HG21 VAL A 30 2.073 1.234 8.179 1.00 0.00 H new ATOM 0 HG22 VAL A 30 3.417 0.522 9.103 1.00 0.00 H new ATOM 0 HG23 VAL A 30 3.166 2.284 9.111 1.00 0.00 H new ATOM 464 N ARG A 31 7.334 1.111 6.231 1.00 0.00 N ATOM 465 CA ARG A 31 8.086 1.161 4.991 1.00 0.00 C ATOM 466 C ARG A 31 7.253 0.463 3.930 1.00 0.00 C ATOM 467 O ARG A 31 6.969 -0.731 4.037 1.00 0.00 O ATOM 468 CB ARG A 31 9.440 0.457 5.101 1.00 0.00 C ATOM 469 CG ARG A 31 10.502 1.345 5.748 1.00 0.00 C ATOM 470 CD ARG A 31 11.893 0.867 5.325 1.00 0.00 C ATOM 471 NE ARG A 31 12.172 -0.509 5.745 1.00 0.00 N ATOM 472 CZ ARG A 31 13.236 -1.203 5.325 1.00 0.00 C ATOM 473 NH1 ARG A 31 14.119 -0.657 4.490 1.00 0.00 N ATOM 474 NH2 ARG A 31 13.423 -2.451 5.739 1.00 0.00 N ATOM 0 H ARG A 31 7.635 0.387 6.883 1.00 0.00 H new ATOM 0 HA ARG A 31 8.285 2.203 4.742 1.00 0.00 H new ATOM 0 HB2 ARG A 31 9.326 -0.456 5.686 1.00 0.00 H new ATOM 0 HB3 ARG A 31 9.774 0.159 4.107 1.00 0.00 H new ATOM 0 HG2 ARG A 31 10.356 2.383 5.448 1.00 0.00 H new ATOM 0 HG3 ARG A 31 10.408 1.310 6.833 1.00 0.00 H new ATOM 0 HD2 ARG A 31 11.982 0.936 4.241 1.00 0.00 H new ATOM 0 HD3 ARG A 31 12.645 1.531 5.750 1.00 0.00 H new ATOM 0 HE ARG A 31 11.523 -0.960 6.390 1.00 0.00 H new ATOM 0 HH11 ARG A 31 13.988 0.300 4.164 1.00 0.00 H new ATOM 0 HH12 ARG A 31 14.926 -1.196 4.177 1.00 0.00 H new ATOM 0 HH21 ARG A 31 12.755 -2.882 6.378 1.00 0.00 H new ATOM 0 HH22 ARG A 31 14.235 -2.979 5.418 1.00 0.00 H new ATOM 488 N ILE A 32 6.870 1.230 2.912 1.00 0.00 N ATOM 489 CA ILE A 32 6.083 0.736 1.801 1.00 0.00 C ATOM 490 C ILE A 32 6.916 0.904 0.540 1.00 0.00 C ATOM 491 O ILE A 32 7.435 1.990 0.281 1.00 0.00 O ATOM 492 CB ILE A 32 4.768 1.523 1.689 1.00 0.00 C ATOM 493 CG1 ILE A 32 4.118 1.677 3.073 1.00 0.00 C ATOM 494 CG2 ILE A 32 3.841 0.802 0.704 1.00 0.00 C ATOM 495 CD1 ILE A 32 2.747 2.352 3.014 1.00 0.00 C ATOM 0 H ILE A 32 7.103 2.220 2.841 1.00 0.00 H new ATOM 0 HA ILE A 32 5.827 -0.313 1.948 1.00 0.00 H new ATOM 0 HB ILE A 32 4.964 2.527 1.313 1.00 0.00 H new ATOM 0 HG12 ILE A 32 4.014 0.694 3.532 1.00 0.00 H new ATOM 0 HG13 ILE A 32 4.777 2.260 3.716 1.00 0.00 H new ATOM 0 HG21 ILE A 32 2.904 1.352 0.617 1.00 0.00 H new ATOM 0 HG22 ILE A 32 4.321 0.746 -0.273 1.00 0.00 H new ATOM 0 HG23 ILE A 32 3.638 -0.206 1.067 1.00 0.00 H new ATOM 0 HD11 ILE A 32 2.338 2.433 4.021 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.850 3.348 2.583 1.00 0.00 H new ATOM 0 HD13 ILE A 32 2.075 1.757 2.396 1.00 0.00 H new ATOM 507 N GLY A 33 7.043 -0.169 -0.236 1.00 0.00 N ATOM 508 CA GLY A 33 7.784 -0.135 -1.476 1.00 0.00 C ATOM 509 C GLY A 33 6.803 -0.154 -2.635 1.00 0.00 C ATOM 510 O GLY A 33 5.716 -0.715 -2.520 1.00 0.00 O ATOM 0 H GLY A 33 6.635 -1.078 -0.017 1.00 0.00 H new ATOM 0 HA2 GLY A 33 8.403 0.761 -1.521 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.456 -0.991 -1.537 1.00 0.00 H new ATOM 514 N ILE A 34 7.187 0.462 -3.754 1.00 0.00 N ATOM 515 CA ILE A 34 6.343 0.519 -4.929 1.00 0.00 C ATOM 516 C ILE A 34 7.193 0.175 -6.141 1.00 0.00 C ATOM 517 O ILE A 34 8.373 0.523 -6.192 1.00 0.00 O ATOM 518 CB ILE A 34 5.719 1.915 -5.050 1.00 0.00 C ATOM 519 CG1 ILE A 34 4.948 2.255 -3.761 1.00 0.00 C ATOM 520 CG2 ILE A 34 4.798 1.963 -6.274 1.00 0.00 C ATOM 521 CD1 ILE A 34 4.370 3.668 -3.764 1.00 0.00 C ATOM 0 H ILE A 34 8.087 0.930 -3.863 1.00 0.00 H new ATOM 0 HA ILE A 34 5.525 -0.198 -4.857 1.00 0.00 H new ATOM 0 HB ILE A 34 6.505 2.659 -5.183 1.00 0.00 H new ATOM 0 HG12 ILE A 34 4.138 1.538 -3.629 1.00 0.00 H new ATOM 0 HG13 ILE A 34 5.615 2.143 -2.906 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.356 2.956 -6.358 1.00 0.00 H new ATOM 0 HG22 ILE A 34 5.375 1.746 -7.173 1.00 0.00 H new ATOM 0 HG23 ILE A 34 4.007 1.222 -6.163 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.839 3.846 -2.829 1.00 0.00 H new ATOM 0 HD12 ILE A 34 5.179 4.392 -3.865 1.00 0.00 H new ATOM 0 HD13 ILE A 34 3.679 3.777 -4.600 1.00 0.00 H new ATOM 533 N ASN A 35 6.597 -0.504 -7.118 1.00 0.00 N ATOM 534 CA ASN A 35 7.304 -0.928 -8.309 1.00 0.00 C ATOM 535 C ASN A 35 6.435 -0.637 -9.524 1.00 0.00 C ATOM 536 O ASN A 35 5.474 -1.355 -9.801 1.00 0.00 O ATOM 537 CB ASN A 35 7.656 -2.411 -8.182 1.00 0.00 C ATOM 538 CG ASN A 35 8.562 -2.890 -9.309 1.00 0.00 C ATOM 539 OD1 ASN A 35 8.954 -2.122 -10.181 1.00 0.00 O ATOM 540 ND2 ASN A 35 8.902 -4.176 -9.295 1.00 0.00 N ATOM 0 H ASN A 35 5.613 -0.772 -7.100 1.00 0.00 H new ATOM 0 HA ASN A 35 8.239 -0.380 -8.430 1.00 0.00 H new ATOM 0 HB2 ASN A 35 8.148 -2.584 -7.225 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.739 -3.001 -8.181 1.00 0.00 H new ATOM 0 HD21 ASN A 35 9.507 -4.551 -10.025 1.00 0.00 H new ATOM 0 HD22 ASN A 35 8.558 -4.787 -8.554 1.00 0.00 H new ATOM 547 N ALA A 36 6.787 0.428 -10.241 1.00 0.00 N ATOM 548 CA ALA A 36 6.073 0.881 -11.419 1.00 0.00 C ATOM 549 C ALA A 36 7.083 1.446 -12.417 1.00 0.00 C ATOM 550 O ALA A 36 8.151 1.903 -12.009 1.00 0.00 O ATOM 551 CB ALA A 36 5.074 1.960 -10.997 1.00 0.00 C ATOM 0 H ALA A 36 7.594 1.008 -10.010 1.00 0.00 H new ATOM 0 HA ALA A 36 5.533 0.058 -11.888 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.528 2.312 -11.872 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.372 1.543 -10.274 1.00 0.00 H new ATOM 0 HB3 ALA A 36 5.609 2.794 -10.543 1.00 0.00 H new ATOM 557 N PRO A 37 6.770 1.431 -13.719 1.00 0.00 N ATOM 558 CA PRO A 37 7.628 2.003 -14.740 1.00 0.00 C ATOM 559 C PRO A 37 7.690 3.514 -14.560 1.00 0.00 C ATOM 560 O PRO A 37 6.731 4.115 -14.081 1.00 0.00 O ATOM 561 CB PRO A 37 6.981 1.617 -16.073 1.00 0.00 C ATOM 562 CG PRO A 37 5.506 1.402 -15.723 1.00 0.00 C ATOM 563 CD PRO A 37 5.567 0.864 -14.297 1.00 0.00 C ATOM 0 HA PRO A 37 8.654 1.638 -14.689 1.00 0.00 H new ATOM 0 HB2 PRO A 37 7.104 2.403 -16.818 1.00 0.00 H new ATOM 0 HB3 PRO A 37 7.429 0.713 -16.487 1.00 0.00 H new ATOM 0 HG2 PRO A 37 4.938 2.331 -15.780 1.00 0.00 H new ATOM 0 HG3 PRO A 37 5.029 0.694 -16.401 1.00 0.00 H new ATOM 0 HD2 PRO A 37 4.684 1.156 -13.729 1.00 0.00 H new ATOM 0 HD3 PRO A 37 5.604 -0.225 -14.290 1.00 0.00 H new ATOM 571 N LYS A 38 8.806 4.144 -14.944 1.00 0.00 N ATOM 572 CA LYS A 38 8.913 5.597 -14.860 1.00 0.00 C ATOM 573 C LYS A 38 7.892 6.257 -15.790 1.00 0.00 C ATOM 574 O LYS A 38 7.744 7.476 -15.794 1.00 0.00 O ATOM 575 CB LYS A 38 10.327 6.069 -15.214 1.00 0.00 C ATOM 576 CG LYS A 38 11.457 5.415 -14.408 1.00 0.00 C ATOM 577 CD LYS A 38 11.370 5.580 -12.888 1.00 0.00 C ATOM 578 CE LYS A 38 10.843 4.285 -12.259 1.00 0.00 C ATOM 579 NZ LYS A 38 11.747 3.144 -12.497 1.00 0.00 N ATOM 0 H LYS A 38 9.634 3.675 -15.310 1.00 0.00 H new ATOM 0 HA LYS A 38 8.704 5.891 -13.832 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.501 5.879 -16.273 1.00 0.00 H new ATOM 0 HB3 LYS A 38 10.379 7.148 -15.071 1.00 0.00 H new ATOM 0 HG2 LYS A 38 11.474 4.350 -14.639 1.00 0.00 H new ATOM 0 HG3 LYS A 38 12.407 5.830 -14.746 1.00 0.00 H new ATOM 0 HD2 LYS A 38 12.352 5.820 -12.481 1.00 0.00 H new ATOM 0 HD3 LYS A 38 10.710 6.411 -12.640 1.00 0.00 H new ATOM 0 HE2 LYS A 38 10.717 4.429 -11.186 1.00 0.00 H new ATOM 0 HE3 LYS A 38 9.858 4.058 -12.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 11.673 2.472 -11.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 11.480 2.668 -13.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 12.726 3.486 -12.570 1.00 0.00 H new ATOM 593 N ASP A 39 7.188 5.440 -16.585 1.00 0.00 N ATOM 594 CA ASP A 39 6.132 5.865 -17.489 1.00 0.00 C ATOM 595 C ASP A 39 4.926 6.413 -16.725 1.00 0.00 C ATOM 596 O ASP A 39 4.027 7.000 -17.325 1.00 0.00 O ATOM 597 CB ASP A 39 5.710 4.656 -18.325 1.00 0.00 C ATOM 598 CG ASP A 39 4.827 5.068 -19.504 1.00 0.00 C ATOM 599 OD1 ASP A 39 5.311 5.873 -20.330 1.00 0.00 O ATOM 600 OD2 ASP A 39 3.679 4.571 -19.569 1.00 0.00 O ATOM 0 H ASP A 39 7.350 4.433 -16.611 1.00 0.00 H new ATOM 0 HA ASP A 39 6.506 6.667 -18.125 1.00 0.00 H new ATOM 0 HB2 ASP A 39 6.597 4.142 -18.696 1.00 0.00 H new ATOM 0 HB3 ASP A 39 5.171 3.948 -17.696 1.00 0.00 H new ATOM 605 N VAL A 40 4.905 6.227 -15.401 1.00 0.00 N ATOM 606 CA VAL A 40 3.837 6.710 -14.537 1.00 0.00 C ATOM 607 C VAL A 40 4.446 7.325 -13.283 1.00 0.00 C ATOM 608 O VAL A 40 5.589 7.035 -12.937 1.00 0.00 O ATOM 609 CB VAL A 40 2.872 5.572 -14.172 1.00 0.00 C ATOM 610 CG1 VAL A 40 2.308 4.904 -15.431 1.00 0.00 C ATOM 611 CG2 VAL A 40 3.546 4.507 -13.310 1.00 0.00 C ATOM 0 H VAL A 40 5.641 5.730 -14.899 1.00 0.00 H new ATOM 0 HA VAL A 40 3.263 7.470 -15.068 1.00 0.00 H new ATOM 0 HB VAL A 40 2.062 6.025 -13.601 1.00 0.00 H new ATOM 0 HG11 VAL A 40 1.628 4.102 -15.144 1.00 0.00 H new ATOM 0 HG12 VAL A 40 1.768 5.642 -16.024 1.00 0.00 H new ATOM 0 HG13 VAL A 40 3.126 4.492 -16.022 1.00 0.00 H new ATOM 0 HG21 VAL A 40 2.828 3.721 -13.075 1.00 0.00 H new ATOM 0 HG22 VAL A 40 4.388 4.078 -13.853 1.00 0.00 H new ATOM 0 HG23 VAL A 40 3.904 4.960 -12.385 1.00 0.00 H new ATOM 621 N ALA A 41 3.681 8.175 -12.598 1.00 0.00 N ATOM 622 CA ALA A 41 4.177 8.881 -11.429 1.00 0.00 C ATOM 623 C ALA A 41 3.772 8.172 -10.139 1.00 0.00 C ATOM 624 O ALA A 41 2.766 7.464 -10.096 1.00 0.00 O ATOM 625 CB ALA A 41 3.613 10.303 -11.446 1.00 0.00 C ATOM 0 H ALA A 41 2.713 8.388 -12.838 1.00 0.00 H new ATOM 0 HA ALA A 41 5.266 8.904 -11.462 1.00 0.00 H new ATOM 0 HB1 ALA A 41 3.975 10.849 -10.575 1.00 0.00 H new ATOM 0 HB2 ALA A 41 3.937 10.812 -12.354 1.00 0.00 H new ATOM 0 HB3 ALA A 41 2.524 10.263 -11.422 1.00 0.00 H new ATOM 631 N VAL A 42 4.569 8.369 -9.085 1.00 0.00 N ATOM 632 CA VAL A 42 4.238 7.874 -7.752 1.00 0.00 C ATOM 633 C VAL A 42 4.917 8.765 -6.719 1.00 0.00 C ATOM 634 O VAL A 42 6.104 9.064 -6.836 1.00 0.00 O ATOM 635 CB VAL A 42 4.660 6.403 -7.617 1.00 0.00 C ATOM 636 CG1 VAL A 42 6.013 6.120 -8.266 1.00 0.00 C ATOM 637 CG2 VAL A 42 4.746 5.959 -6.160 1.00 0.00 C ATOM 0 H VAL A 42 5.455 8.873 -9.134 1.00 0.00 H new ATOM 0 HA VAL A 42 3.162 7.912 -7.585 1.00 0.00 H new ATOM 0 HB VAL A 42 3.881 5.842 -8.133 1.00 0.00 H new ATOM 0 HG11 VAL A 42 6.263 5.066 -8.142 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.964 6.358 -9.329 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.779 6.733 -7.792 1.00 0.00 H new ATOM 0 HG21 VAL A 42 5.048 4.913 -6.116 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.480 6.571 -5.636 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.772 6.076 -5.686 1.00 0.00 H new ATOM 647 N HIS A 43 4.161 9.193 -5.704 1.00 0.00 N ATOM 648 CA HIS A 43 4.660 10.087 -4.668 1.00 0.00 C ATOM 649 C HIS A 43 3.836 9.925 -3.399 1.00 0.00 C ATOM 650 O HIS A 43 2.745 9.362 -3.440 1.00 0.00 O ATOM 651 CB HIS A 43 4.499 11.542 -5.122 1.00 0.00 C ATOM 652 CG HIS A 43 5.058 11.836 -6.487 1.00 0.00 C ATOM 653 ND1 HIS A 43 6.377 12.208 -6.762 1.00 0.00 N ATOM 654 CD2 HIS A 43 4.346 11.784 -7.651 1.00 0.00 C ATOM 655 CE1 HIS A 43 6.427 12.367 -8.093 1.00 0.00 C ATOM 656 NE2 HIS A 43 5.225 12.119 -8.653 1.00 0.00 N ATOM 0 H HIS A 43 3.184 8.926 -5.582 1.00 0.00 H new ATOM 0 HA HIS A 43 5.707 9.845 -4.484 1.00 0.00 H new ATOM 0 HB2 HIS A 43 3.439 11.796 -5.115 1.00 0.00 H new ATOM 0 HB3 HIS A 43 4.987 12.192 -4.396 1.00 0.00 H new ATOM 0 HD1 HIS A 43 7.138 12.332 -6.094 1.00 0.00 H new ATOM 0 HD2 HIS A 43 3.302 11.531 -7.762 1.00 0.00 H new ATOM 0 HE1 HIS A 43 7.311 12.655 -8.643 1.00 0.00 H new ATOM 664 N ARG A 44 4.341 10.415 -2.265 1.00 0.00 N ATOM 665 CA ARG A 44 3.537 10.442 -1.052 1.00 0.00 C ATOM 666 C ARG A 44 2.557 11.618 -1.165 1.00 0.00 C ATOM 667 O ARG A 44 2.781 12.529 -1.957 1.00 0.00 O ATOM 668 CB ARG A 44 4.454 10.480 0.176 1.00 0.00 C ATOM 669 CG ARG A 44 4.789 11.900 0.615 1.00 0.00 C ATOM 670 CD ARG A 44 5.977 11.900 1.578 1.00 0.00 C ATOM 671 NE ARG A 44 7.244 11.895 0.837 1.00 0.00 N ATOM 672 CZ ARG A 44 8.069 12.947 0.751 1.00 0.00 C ATOM 673 NH1 ARG A 44 7.836 14.070 1.425 1.00 0.00 N ATOM 674 NH2 ARG A 44 9.148 12.887 -0.016 1.00 0.00 N ATOM 0 H ARG A 44 5.284 10.790 -2.166 1.00 0.00 H new ATOM 0 HA ARG A 44 2.939 9.539 -0.928 1.00 0.00 H new ATOM 0 HB2 ARG A 44 3.973 9.953 1.000 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.377 9.946 -0.048 1.00 0.00 H new ATOM 0 HG2 ARG A 44 5.021 12.511 -0.257 1.00 0.00 H new ATOM 0 HG3 ARG A 44 3.922 12.351 1.098 1.00 0.00 H new ATOM 0 HD2 ARG A 44 5.930 12.778 2.222 1.00 0.00 H new ATOM 0 HD3 ARG A 44 5.926 11.026 2.227 1.00 0.00 H new ATOM 0 HE ARG A 44 7.513 11.036 0.357 1.00 0.00 H new ATOM 0 HH11 ARG A 44 7.014 14.144 2.024 1.00 0.00 H new ATOM 0 HH12 ARG A 44 8.480 14.857 1.343 1.00 0.00 H new ATOM 0 HH21 ARG A 44 9.352 12.038 -0.543 1.00 0.00 H new ATOM 0 HH22 ARG A 44 9.774 13.690 -0.079 1.00 0.00 H new ATOM 688 N GLU A 45 1.474 11.606 -0.386 1.00 0.00 N ATOM 689 CA GLU A 45 0.376 12.555 -0.565 1.00 0.00 C ATOM 690 C GLU A 45 0.781 14.027 -0.388 1.00 0.00 C ATOM 691 O GLU A 45 0.108 14.901 -0.930 1.00 0.00 O ATOM 692 CB GLU A 45 -0.762 12.142 0.378 1.00 0.00 C ATOM 693 CG GLU A 45 -2.040 12.957 0.175 1.00 0.00 C ATOM 694 CD GLU A 45 -2.125 14.192 1.076 1.00 0.00 C ATOM 695 OE1 GLU A 45 -1.140 14.484 1.789 1.00 0.00 O ATOM 696 OE2 GLU A 45 -3.195 14.843 1.042 1.00 0.00 O ATOM 0 H GLU A 45 1.334 10.945 0.379 1.00 0.00 H new ATOM 0 HA GLU A 45 0.044 12.507 -1.602 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -0.985 11.086 0.227 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -0.428 12.253 1.410 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -2.099 13.272 -0.867 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -2.903 12.318 0.364 1.00 0.00 H new ATOM 703 N GLU A 46 1.856 14.325 0.352 1.00 0.00 N ATOM 704 CA GLU A 46 2.289 15.708 0.555 1.00 0.00 C ATOM 705 C GLU A 46 3.200 16.194 -0.574 1.00 0.00 C ATOM 706 O GLU A 46 3.571 17.365 -0.607 1.00 0.00 O ATOM 707 CB GLU A 46 2.968 15.850 1.917 1.00 0.00 C ATOM 708 CG GLU A 46 4.347 15.195 1.945 1.00 0.00 C ATOM 709 CD GLU A 46 4.769 14.851 3.370 1.00 0.00 C ATOM 710 OE1 GLU A 46 4.208 13.871 3.911 1.00 0.00 O ATOM 711 OE2 GLU A 46 5.652 15.564 3.901 1.00 0.00 O ATOM 0 H GLU A 46 2.438 13.628 0.817 1.00 0.00 H new ATOM 0 HA GLU A 46 1.404 16.344 0.538 1.00 0.00 H new ATOM 0 HB2 GLU A 46 3.065 16.907 2.164 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.338 15.399 2.684 1.00 0.00 H new ATOM 0 HG2 GLU A 46 4.334 14.289 1.339 1.00 0.00 H new ATOM 0 HG3 GLU A 46 5.080 15.867 1.499 1.00 0.00 H new ATOM 718 N ILE A 47 3.563 15.294 -1.496 1.00 0.00 N ATOM 719 CA ILE A 47 4.409 15.616 -2.641 1.00 0.00 C ATOM 720 C ILE A 47 3.593 15.533 -3.921 1.00 0.00 C ATOM 721 O ILE A 47 3.838 16.298 -4.848 1.00 0.00 O ATOM 722 CB ILE A 47 5.605 14.657 -2.666 1.00 0.00 C ATOM 723 CG1 ILE A 47 6.523 14.897 -1.459 1.00 0.00 C ATOM 724 CG2 ILE A 47 6.399 14.807 -3.963 1.00 0.00 C ATOM 725 CD1 ILE A 47 7.035 16.338 -1.361 1.00 0.00 C ATOM 0 H ILE A 47 3.274 14.316 -1.464 1.00 0.00 H new ATOM 0 HA ILE A 47 4.789 16.634 -2.558 1.00 0.00 H new ATOM 0 HB ILE A 47 5.215 13.640 -2.613 1.00 0.00 H new ATOM 0 HG12 ILE A 47 5.982 14.648 -0.546 1.00 0.00 H new ATOM 0 HG13 ILE A 47 7.375 14.220 -1.520 1.00 0.00 H new ATOM 0 HG21 ILE A 47 7.242 14.116 -3.956 1.00 0.00 H new ATOM 0 HG22 ILE A 47 5.754 14.583 -4.813 1.00 0.00 H new ATOM 0 HG23 ILE A 47 6.769 15.829 -4.047 1.00 0.00 H new ATOM 0 HD11 ILE A 47 7.677 16.437 -0.486 1.00 0.00 H new ATOM 0 HD12 ILE A 47 7.603 16.584 -2.258 1.00 0.00 H new ATOM 0 HD13 ILE A 47 6.189 17.019 -1.269 1.00 0.00 H new ATOM 737 N TYR A 48 2.624 14.616 -3.990 1.00 0.00 N ATOM 738 CA TYR A 48 1.790 14.490 -5.172 1.00 0.00 C ATOM 739 C TYR A 48 1.113 15.814 -5.512 1.00 0.00 C ATOM 740 O TYR A 48 1.019 16.180 -6.683 1.00 0.00 O ATOM 741 CB TYR A 48 0.734 13.416 -4.924 1.00 0.00 C ATOM 742 CG TYR A 48 -0.397 13.461 -5.924 1.00 0.00 C ATOM 743 CD1 TYR A 48 -0.128 13.483 -7.300 1.00 0.00 C ATOM 744 CD2 TYR A 48 -1.720 13.494 -5.465 1.00 0.00 C ATOM 745 CE1 TYR A 48 -1.182 13.568 -8.223 1.00 0.00 C ATOM 746 CE2 TYR A 48 -2.778 13.559 -6.377 1.00 0.00 C ATOM 747 CZ TYR A 48 -2.514 13.603 -7.764 1.00 0.00 C ATOM 748 OH TYR A 48 -3.544 13.682 -8.654 1.00 0.00 O ATOM 0 H TYR A 48 2.404 13.957 -3.243 1.00 0.00 H new ATOM 0 HA TYR A 48 2.419 14.209 -6.017 1.00 0.00 H new ATOM 0 HB2 TYR A 48 1.206 12.434 -4.961 1.00 0.00 H new ATOM 0 HB3 TYR A 48 0.329 13.537 -3.919 1.00 0.00 H new ATOM 0 HD1 TYR A 48 0.892 13.434 -7.650 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -1.923 13.469 -4.405 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -0.973 13.606 -9.282 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -3.797 13.576 -6.021 1.00 0.00 H new ATOM 0 HH TYR A 48 -4.395 13.695 -8.169 1.00 0.00 H new ATOM 758 N GLN A 49 0.643 16.538 -4.494 1.00 0.00 N ATOM 759 CA GLN A 49 -0.033 17.812 -4.694 1.00 0.00 C ATOM 760 C GLN A 49 0.911 18.847 -5.298 1.00 0.00 C ATOM 761 O GLN A 49 0.454 19.831 -5.878 1.00 0.00 O ATOM 762 CB GLN A 49 -0.567 18.318 -3.353 1.00 0.00 C ATOM 763 CG GLN A 49 -1.609 17.359 -2.778 1.00 0.00 C ATOM 764 CD GLN A 49 -2.090 17.834 -1.415 1.00 0.00 C ATOM 765 OE1 GLN A 49 -2.824 18.813 -1.309 1.00 0.00 O ATOM 766 NE2 GLN A 49 -1.678 17.142 -0.358 1.00 0.00 N ATOM 0 H GLN A 49 0.722 16.257 -3.517 1.00 0.00 H new ATOM 0 HA GLN A 49 -0.859 17.661 -5.389 1.00 0.00 H new ATOM 0 HB2 GLN A 49 0.257 18.429 -2.649 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -1.010 19.305 -3.484 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -2.455 17.283 -3.461 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -1.181 16.361 -2.689 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -1.069 16.334 -0.484 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -1.971 17.419 0.579 1.00 0.00 H new ATOM 775 N ARG A 50 2.224 18.635 -5.168 1.00 0.00 N ATOM 776 CA ARG A 50 3.217 19.577 -5.664 1.00 0.00 C ATOM 777 C ARG A 50 3.532 19.321 -7.132 1.00 0.00 C ATOM 778 O ARG A 50 3.752 20.274 -7.875 1.00 0.00 O ATOM 779 CB ARG A 50 4.466 19.476 -4.792 1.00 0.00 C ATOM 780 CG ARG A 50 5.477 20.538 -5.212 1.00 0.00 C ATOM 781 CD ARG A 50 6.675 20.492 -4.264 1.00 0.00 C ATOM 782 NE ARG A 50 6.335 20.993 -2.925 1.00 0.00 N ATOM 783 CZ ARG A 50 6.291 22.285 -2.593 1.00 0.00 C ATOM 784 NH1 ARG A 50 6.570 23.235 -3.485 1.00 0.00 N ATOM 785 NH2 ARG A 50 5.966 22.639 -1.353 1.00 0.00 N ATOM 0 H ARG A 50 2.621 17.810 -4.718 1.00 0.00 H new ATOM 0 HA ARG A 50 2.822 20.591 -5.604 1.00 0.00 H new ATOM 0 HB2 ARG A 50 4.200 19.609 -3.743 1.00 0.00 H new ATOM 0 HB3 ARG A 50 4.907 18.484 -4.886 1.00 0.00 H new ATOM 0 HG2 ARG A 50 5.802 20.363 -6.237 1.00 0.00 H new ATOM 0 HG3 ARG A 50 5.016 21.526 -5.188 1.00 0.00 H new ATOM 0 HD2 ARG A 50 7.037 19.467 -4.187 1.00 0.00 H new ATOM 0 HD3 ARG A 50 7.489 21.087 -4.678 1.00 0.00 H new ATOM 0 HE ARG A 50 6.118 20.308 -2.201 1.00 0.00 H new ATOM 0 HH11 ARG A 50 6.822 22.980 -4.440 1.00 0.00 H new ATOM 0 HH12 ARG A 50 6.531 24.217 -3.213 1.00 0.00 H new ATOM 0 HH21 ARG A 50 5.751 21.924 -0.658 1.00 0.00 H new ATOM 0 HH22 ARG A 50 5.932 23.626 -1.097 1.00 0.00 H new ATOM 799 N ILE A 51 3.561 18.059 -7.569 1.00 0.00 N ATOM 800 CA ILE A 51 3.785 17.758 -8.979 1.00 0.00 C ATOM 801 C ILE A 51 2.647 18.358 -9.811 1.00 0.00 C ATOM 802 O ILE A 51 2.779 18.538 -11.018 1.00 0.00 O ATOM 803 CB ILE A 51 3.947 16.244 -9.201 1.00 0.00 C ATOM 804 CG1 ILE A 51 5.317 15.752 -8.722 1.00 0.00 C ATOM 805 CG2 ILE A 51 3.874 15.883 -10.690 1.00 0.00 C ATOM 806 CD1 ILE A 51 5.430 15.690 -7.204 1.00 0.00 C ATOM 0 H ILE A 51 3.434 17.241 -6.973 1.00 0.00 H new ATOM 0 HA ILE A 51 4.719 18.214 -9.308 1.00 0.00 H new ATOM 0 HB ILE A 51 3.138 15.777 -8.640 1.00 0.00 H new ATOM 0 HG12 ILE A 51 5.506 14.761 -9.136 1.00 0.00 H new ATOM 0 HG13 ILE A 51 6.091 16.413 -9.112 1.00 0.00 H new ATOM 0 HG21 ILE A 51 3.992 14.806 -10.810 1.00 0.00 H new ATOM 0 HG22 ILE A 51 2.908 16.189 -11.092 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.670 16.397 -11.229 1.00 0.00 H new ATOM 0 HD11 ILE A 51 6.423 15.335 -6.927 1.00 0.00 H new ATOM 0 HD12 ILE A 51 5.271 16.684 -6.786 1.00 0.00 H new ATOM 0 HD13 ILE A 51 4.677 15.007 -6.811 1.00 0.00 H new ATOM 1635 N MET C 1 12.106 0.015 -7.699 1.00 0.00 N ATOM 1636 CA MET C 1 11.513 0.155 -6.356 1.00 0.00 C ATOM 1637 C MET C 1 11.632 1.586 -5.857 1.00 0.00 C ATOM 1638 O MET C 1 12.716 2.158 -5.903 1.00 0.00 O ATOM 1639 CB MET C 1 12.208 -0.756 -5.347 1.00 0.00 C ATOM 1640 CG MET C 1 11.582 -0.619 -3.958 1.00 0.00 C ATOM 1641 SD MET C 1 10.000 -1.467 -3.770 1.00 0.00 S ATOM 1642 CE MET C 1 10.670 -3.121 -3.485 1.00 0.00 C ATOM 0 H1 MET C 1 12.013 -0.970 -8.019 1.00 0.00 H new ATOM 0 H2 MET C 1 11.611 0.643 -8.364 1.00 0.00 H new ATOM 0 H3 MET C 1 13.113 0.273 -7.663 1.00 0.00 H new ATOM 0 HA MET C 1 10.463 -0.125 -6.444 1.00 0.00 H new ATOM 0 HB2 MET C 1 12.139 -1.792 -5.680 1.00 0.00 H new ATOM 0 HB3 MET C 1 13.268 -0.507 -5.298 1.00 0.00 H new ATOM 0 HG2 MET C 1 12.280 -1.009 -3.217 1.00 0.00 H new ATOM 0 HG3 MET C 1 11.442 0.439 -3.738 1.00 0.00 H new ATOM 0 HE1 MET C 1 9.858 -3.804 -3.234 1.00 0.00 H new ATOM 0 HE2 MET C 1 11.173 -3.470 -4.387 1.00 0.00 H new ATOM 0 HE3 MET C 1 11.383 -3.088 -2.662 1.00 0.00 H new ATOM 1654 N LEU C 2 10.530 2.158 -5.375 1.00 0.00 N ATOM 1655 CA LEU C 2 10.524 3.482 -4.775 1.00 0.00 C ATOM 1656 C LEU C 2 9.885 3.344 -3.395 1.00 0.00 C ATOM 1657 O LEU C 2 8.669 3.172 -3.287 1.00 0.00 O ATOM 1658 CB LEU C 2 9.765 4.439 -5.701 1.00 0.00 C ATOM 1659 CG LEU C 2 9.875 5.931 -5.351 1.00 0.00 C ATOM 1660 CD1 LEU C 2 8.552 6.409 -4.776 1.00 0.00 C ATOM 1661 CD2 LEU C 2 10.979 6.269 -4.351 1.00 0.00 C ATOM 0 H LEU C 2 9.614 1.710 -5.392 1.00 0.00 H new ATOM 0 HA LEU C 2 11.524 3.897 -4.651 1.00 0.00 H new ATOM 0 HB2 LEU C 2 10.129 4.295 -6.719 1.00 0.00 H new ATOM 0 HB3 LEU C 2 8.711 4.160 -5.697 1.00 0.00 H new ATOM 0 HG LEU C 2 10.129 6.435 -6.283 1.00 0.00 H new ATOM 0 HD11 LEU C 2 8.625 7.467 -4.526 1.00 0.00 H new ATOM 0 HD12 LEU C 2 7.762 6.264 -5.512 1.00 0.00 H new ATOM 0 HD13 LEU C 2 8.319 5.839 -3.877 1.00 0.00 H new ATOM 0 HD21 LEU C 2 10.983 7.343 -4.163 1.00 0.00 H new ATOM 0 HD22 LEU C 2 10.799 5.738 -3.417 1.00 0.00 H new ATOM 0 HD23 LEU C 2 11.944 5.968 -4.759 1.00 0.00 H new ATOM 1673 N ILE C 3 10.708 3.412 -2.344 1.00 0.00 N ATOM 1674 CA ILE C 3 10.259 3.285 -0.968 1.00 0.00 C ATOM 1675 C ILE C 3 9.725 4.630 -0.487 1.00 0.00 C ATOM 1676 O ILE C 3 10.239 5.680 -0.860 1.00 0.00 O ATOM 1677 CB ILE C 3 11.403 2.834 -0.039 1.00 0.00 C ATOM 1678 CG1 ILE C 3 11.851 1.401 -0.334 1.00 0.00 C ATOM 1679 CG2 ILE C 3 10.896 2.845 1.407 1.00 0.00 C ATOM 1680 CD1 ILE C 3 12.897 1.317 -1.440 1.00 0.00 C ATOM 0 H ILE C 3 11.713 3.558 -2.433 1.00 0.00 H new ATOM 0 HA ILE C 3 9.475 2.528 -0.936 1.00 0.00 H new ATOM 0 HB ILE C 3 12.239 3.516 -0.198 1.00 0.00 H new ATOM 0 HG12 ILE C 3 12.257 0.959 0.576 1.00 0.00 H new ATOM 0 HG13 ILE C 3 10.983 0.806 -0.617 1.00 0.00 H new ATOM 0 HG21 ILE C 3 11.696 2.528 2.076 1.00 0.00 H new ATOM 0 HG22 ILE C 3 10.579 3.853 1.674 1.00 0.00 H new ATOM 0 HG23 ILE C 3 10.052 2.162 1.502 1.00 0.00 H new ATOM 0 HD11 ILE C 3 13.173 0.275 -1.601 1.00 0.00 H new ATOM 0 HD12 ILE C 3 12.486 1.730 -2.361 1.00 0.00 H new ATOM 0 HD13 ILE C 3 13.780 1.885 -1.149 1.00 0.00 H new ATOM 1692 N LEU C 4 8.689 4.575 0.351 1.00 0.00 N ATOM 1693 CA LEU C 4 8.136 5.731 1.029 1.00 0.00 C ATOM 1694 C LEU C 4 7.738 5.293 2.434 1.00 0.00 C ATOM 1695 O LEU C 4 7.121 4.241 2.602 1.00 0.00 O ATOM 1696 CB LEU C 4 6.903 6.238 0.266 1.00 0.00 C ATOM 1697 CG LEU C 4 7.237 6.772 -1.134 1.00 0.00 C ATOM 1698 CD1 LEU C 4 5.949 7.089 -1.889 1.00 0.00 C ATOM 1699 CD2 LEU C 4 8.066 8.050 -1.056 1.00 0.00 C ATOM 0 H LEU C 4 8.207 3.705 0.577 1.00 0.00 H new ATOM 0 HA LEU C 4 8.866 6.539 1.075 1.00 0.00 H new ATOM 0 HB2 LEU C 4 6.180 5.427 0.176 1.00 0.00 H new ATOM 0 HB3 LEU C 4 6.425 7.028 0.845 1.00 0.00 H new ATOM 0 HG LEU C 4 7.809 6.002 -1.651 1.00 0.00 H new ATOM 0 HD11 LEU C 4 6.193 7.468 -2.882 1.00 0.00 H new ATOM 0 HD12 LEU C 4 5.350 6.183 -1.983 1.00 0.00 H new ATOM 0 HD13 LEU C 4 5.383 7.843 -1.342 1.00 0.00 H new ATOM 0 HD21 LEU C 4 8.286 8.403 -2.064 1.00 0.00 H new ATOM 0 HD22 LEU C 4 7.506 8.815 -0.518 1.00 0.00 H new ATOM 0 HD23 LEU C 4 8.999 7.847 -0.531 1.00 0.00 H new ATOM 1711 N THR C 5 8.086 6.095 3.445 1.00 0.00 N ATOM 1712 CA THR C 5 7.659 5.831 4.811 1.00 0.00 C ATOM 1713 C THR C 5 6.378 6.597 5.066 1.00 0.00 C ATOM 1714 O THR C 5 6.172 7.678 4.511 1.00 0.00 O ATOM 1715 CB THR C 5 8.722 6.245 5.837 1.00 0.00 C ATOM 1716 OG1 THR C 5 9.101 7.584 5.637 1.00 0.00 O ATOM 1717 CG2 THR C 5 9.955 5.357 5.726 1.00 0.00 C ATOM 0 H THR C 5 8.662 6.930 3.337 1.00 0.00 H new ATOM 0 HA THR C 5 7.502 4.758 4.925 1.00 0.00 H new ATOM 0 HB THR C 5 8.288 6.133 6.831 1.00 0.00 H new ATOM 0 HG1 THR C 5 9.778 7.835 6.300 1.00 0.00 H new ATOM 0 HG21 THR C 5 10.695 5.669 6.463 1.00 0.00 H new ATOM 0 HG22 THR C 5 9.674 4.320 5.910 1.00 0.00 H new ATOM 0 HG23 THR C 5 10.379 5.446 4.726 1.00 0.00 H new ATOM 1725 N ARG C 6 5.505 6.042 5.906 1.00 0.00 N ATOM 1726 CA ARG C 6 4.236 6.682 6.206 1.00 0.00 C ATOM 1727 C ARG C 6 3.796 6.328 7.623 1.00 0.00 C ATOM 1728 O ARG C 6 3.885 5.164 8.011 1.00 0.00 O ATOM 1729 CB ARG C 6 3.231 6.160 5.175 1.00 0.00 C ATOM 1730 CG ARG C 6 1.958 6.996 5.071 1.00 0.00 C ATOM 1731 CD ARG C 6 2.156 8.288 4.275 1.00 0.00 C ATOM 1732 NE ARG C 6 2.822 9.344 5.043 1.00 0.00 N ATOM 1733 CZ ARG C 6 3.037 10.576 4.573 1.00 0.00 C ATOM 1734 NH1 ARG C 6 2.620 10.926 3.360 1.00 0.00 N ATOM 1735 NH2 ARG C 6 3.679 11.472 5.316 1.00 0.00 N ATOM 0 H ARG C 6 5.657 5.155 6.386 1.00 0.00 H new ATOM 0 HA ARG C 6 4.312 7.768 6.153 1.00 0.00 H new ATOM 0 HB2 ARG C 6 3.713 6.127 4.198 1.00 0.00 H new ATOM 0 HB3 ARG C 6 2.961 5.136 5.432 1.00 0.00 H new ATOM 0 HG2 ARG C 6 1.176 6.401 4.599 1.00 0.00 H new ATOM 0 HG3 ARG C 6 1.609 7.243 6.074 1.00 0.00 H new ATOM 0 HD2 ARG C 6 2.744 8.071 3.383 1.00 0.00 H new ATOM 0 HD3 ARG C 6 1.185 8.651 3.937 1.00 0.00 H new ATOM 0 HE ARG C 6 3.139 9.126 5.988 1.00 0.00 H new ATOM 0 HH11 ARG C 6 2.129 10.250 2.775 1.00 0.00 H new ATOM 0 HH12 ARG C 6 2.791 11.870 3.015 1.00 0.00 H new ATOM 0 HH21 ARG C 6 4.009 11.220 6.248 1.00 0.00 H new ATOM 0 HH22 ARG C 6 3.842 12.412 4.954 1.00 0.00 H new ATOM 1749 N LYS C 7 3.323 7.309 8.400 1.00 0.00 N ATOM 1750 CA LYS C 7 2.790 7.050 9.729 1.00 0.00 C ATOM 1751 C LYS C 7 1.326 6.641 9.577 1.00 0.00 C ATOM 1752 O LYS C 7 0.660 7.090 8.643 1.00 0.00 O ATOM 1753 CB LYS C 7 2.905 8.315 10.591 1.00 0.00 C ATOM 1754 CG LYS C 7 3.464 8.064 11.996 1.00 0.00 C ATOM 1755 CD LYS C 7 4.937 7.644 11.959 1.00 0.00 C ATOM 1756 CE LYS C 7 5.533 7.561 13.368 1.00 0.00 C ATOM 1757 NZ LYS C 7 5.593 8.887 14.013 1.00 0.00 N ATOM 0 H LYS C 7 3.301 8.291 8.124 1.00 0.00 H new ATOM 0 HA LYS C 7 3.351 6.254 10.218 1.00 0.00 H new ATOM 0 HB2 LYS C 7 3.545 9.034 10.080 1.00 0.00 H new ATOM 0 HB3 LYS C 7 1.920 8.773 10.680 1.00 0.00 H new ATOM 0 HG2 LYS C 7 3.360 8.969 12.595 1.00 0.00 H new ATOM 0 HG3 LYS C 7 2.877 7.287 12.487 1.00 0.00 H new ATOM 0 HD2 LYS C 7 5.028 6.676 11.467 1.00 0.00 H new ATOM 0 HD3 LYS C 7 5.505 8.359 11.364 1.00 0.00 H new ATOM 0 HE2 LYS C 7 4.933 6.886 13.978 1.00 0.00 H new ATOM 0 HE3 LYS C 7 6.535 7.136 13.315 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 6.220 8.842 14.841 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 5.962 9.586 13.337 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 4.639 9.169 14.316 1.00 0.00 H new ATOM 1771 N VAL C 8 0.811 5.796 10.475 1.00 0.00 N ATOM 1772 CA VAL C 8 -0.589 5.399 10.398 1.00 0.00 C ATOM 1773 C VAL C 8 -1.473 6.647 10.446 1.00 0.00 C ATOM 1774 O VAL C 8 -1.320 7.488 11.331 1.00 0.00 O ATOM 1775 CB VAL C 8 -0.951 4.381 11.484 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -0.068 3.144 11.344 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -0.788 4.919 12.907 1.00 0.00 C ATOM 0 H VAL C 8 1.334 5.383 11.247 1.00 0.00 H new ATOM 0 HA VAL C 8 -0.765 4.892 9.449 1.00 0.00 H new ATOM 0 HB VAL C 8 -2.005 4.146 11.336 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -0.328 2.422 12.118 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -0.223 2.696 10.363 1.00 0.00 H new ATOM 0 HG13 VAL C 8 0.978 3.430 11.451 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -1.062 4.144 13.623 1.00 0.00 H new ATOM 0 HG22 VAL C 8 0.249 5.212 13.069 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -1.435 5.785 13.045 1.00 0.00 H new ATOM 1787 N GLY C 9 -2.400 6.764 9.489 1.00 0.00 N ATOM 1788 CA GLY C 9 -3.301 7.907 9.404 1.00 0.00 C ATOM 1789 C GLY C 9 -2.958 8.854 8.253 1.00 0.00 C ATOM 1790 O GLY C 9 -3.639 9.866 8.081 1.00 0.00 O ATOM 0 H GLY C 9 -2.543 6.069 8.756 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -4.323 7.549 9.280 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -3.268 8.459 10.343 1.00 0.00 H new ATOM 1794 N GLU C 10 -1.921 8.551 7.465 1.00 0.00 N ATOM 1795 CA GLU C 10 -1.510 9.399 6.349 1.00 0.00 C ATOM 1796 C GLU C 10 -1.751 8.689 5.012 1.00 0.00 C ATOM 1797 O GLU C 10 -2.318 7.594 4.993 1.00 0.00 O ATOM 1798 CB GLU C 10 -0.039 9.788 6.521 1.00 0.00 C ATOM 1799 CG GLU C 10 0.222 10.498 7.850 1.00 0.00 C ATOM 1800 CD GLU C 10 1.696 10.881 7.995 1.00 0.00 C ATOM 1801 OE1 GLU C 10 2.555 10.002 7.740 1.00 0.00 O ATOM 1802 OE2 GLU C 10 1.955 12.050 8.355 1.00 0.00 O ATOM 0 H GLU C 10 -1.348 7.716 7.584 1.00 0.00 H new ATOM 0 HA GLU C 10 -2.111 10.308 6.344 1.00 0.00 H new ATOM 0 HB2 GLU C 10 0.580 8.893 6.462 1.00 0.00 H new ATOM 0 HB3 GLU C 10 0.261 10.438 5.699 1.00 0.00 H new ATOM 0 HG2 GLU C 10 -0.397 11.393 7.914 1.00 0.00 H new ATOM 0 HG3 GLU C 10 -0.070 9.849 8.675 1.00 0.00 H new ATOM 1809 N SER C 11 -1.329 9.294 3.894 1.00 0.00 N ATOM 1810 CA SER C 11 -1.653 8.774 2.568 1.00 0.00 C ATOM 1811 C SER C 11 -0.494 8.886 1.574 1.00 0.00 C ATOM 1812 O SER C 11 0.523 9.530 1.838 1.00 0.00 O ATOM 1813 CB SER C 11 -2.870 9.522 2.021 1.00 0.00 C ATOM 1814 OG SER C 11 -3.989 9.310 2.861 1.00 0.00 O ATOM 0 H SER C 11 -0.763 10.143 3.886 1.00 0.00 H new ATOM 0 HA SER C 11 -1.865 7.711 2.683 1.00 0.00 H new ATOM 0 HB2 SER C 11 -2.652 10.588 1.955 1.00 0.00 H new ATOM 0 HB3 SER C 11 -3.094 9.179 1.011 1.00 0.00 H new ATOM 0 HG SER C 11 -4.763 9.794 2.504 1.00 0.00 H new ATOM 1820 N ILE C 12 -0.675 8.247 0.414 1.00 0.00 N ATOM 1821 CA ILE C 12 0.278 8.156 -0.689 1.00 0.00 C ATOM 1822 C ILE C 12 -0.519 8.184 -1.996 1.00 0.00 C ATOM 1823 O ILE C 12 -1.733 7.997 -1.974 1.00 0.00 O ATOM 1824 CB ILE C 12 1.118 6.875 -0.521 1.00 0.00 C ATOM 1825 CG1 ILE C 12 1.977 6.984 0.750 1.00 0.00 C ATOM 1826 CG2 ILE C 12 2.012 6.603 -1.734 1.00 0.00 C ATOM 1827 CD1 ILE C 12 2.877 5.763 0.963 1.00 0.00 C ATOM 0 H ILE C 12 -1.543 7.751 0.211 1.00 0.00 H new ATOM 0 HA ILE C 12 0.977 8.992 -0.701 1.00 0.00 H new ATOM 0 HB ILE C 12 0.427 6.037 -0.434 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.595 7.880 0.690 1.00 0.00 H new ATOM 0 HG13 ILE C 12 1.325 7.105 1.615 1.00 0.00 H new ATOM 0 HG21 ILE C 12 2.584 5.690 -1.567 1.00 0.00 H new ATOM 0 HG22 ILE C 12 1.393 6.486 -2.623 1.00 0.00 H new ATOM 0 HG23 ILE C 12 2.697 7.439 -1.876 1.00 0.00 H new ATOM 0 HD11 ILE C 12 3.460 5.895 1.874 1.00 0.00 H new ATOM 0 HD12 ILE C 12 2.261 4.868 1.053 1.00 0.00 H new ATOM 0 HD13 ILE C 12 3.551 5.655 0.113 1.00 0.00 H new ATOM 1839 N ASN C 13 0.137 8.411 -3.140 1.00 0.00 N ATOM 1840 CA ASN C 13 -0.529 8.546 -4.429 1.00 0.00 C ATOM 1841 C ASN C 13 0.239 7.853 -5.552 1.00 0.00 C ATOM 1842 O ASN C 13 1.457 7.690 -5.486 1.00 0.00 O ATOM 1843 CB ASN C 13 -0.686 10.031 -4.751 1.00 0.00 C ATOM 1844 CG ASN C 13 -1.858 10.627 -3.987 1.00 0.00 C ATOM 1845 OD1 ASN C 13 -1.677 11.269 -2.955 1.00 0.00 O ATOM 1846 ND2 ASN C 13 -3.068 10.420 -4.493 1.00 0.00 N ATOM 0 H ASN C 13 1.151 8.506 -3.192 1.00 0.00 H new ATOM 0 HA ASN C 13 -1.503 8.062 -4.359 1.00 0.00 H new ATOM 0 HB2 ASN C 13 0.230 10.563 -4.494 1.00 0.00 H new ATOM 0 HB3 ASN C 13 -0.840 10.161 -5.822 1.00 0.00 H new ATOM 0 HD21 ASN C 13 -3.889 10.800 -4.022 1.00 0.00 H new ATOM 0 HD22 ASN C 13 -3.176 9.881 -5.352 1.00 0.00 H new ATOM 1853 N ILE C 14 -0.505 7.453 -6.588 1.00 0.00 N ATOM 1854 CA ILE C 14 0.039 6.778 -7.760 1.00 0.00 C ATOM 1855 C ILE C 14 -0.724 7.264 -8.990 1.00 0.00 C ATOM 1856 O ILE C 14 -1.935 7.490 -8.926 1.00 0.00 O ATOM 1857 CB ILE C 14 -0.096 5.253 -7.600 1.00 0.00 C ATOM 1858 CG1 ILE C 14 0.624 4.789 -6.325 1.00 0.00 C ATOM 1859 CG2 ILE C 14 0.493 4.544 -8.823 1.00 0.00 C ATOM 1860 CD1 ILE C 14 0.502 3.281 -6.100 1.00 0.00 C ATOM 0 H ILE C 14 -1.514 7.593 -6.632 1.00 0.00 H new ATOM 0 HA ILE C 14 1.098 7.009 -7.873 1.00 0.00 H new ATOM 0 HB ILE C 14 -1.153 5.000 -7.519 1.00 0.00 H new ATOM 0 HG12 ILE C 14 1.678 5.060 -6.388 1.00 0.00 H new ATOM 0 HG13 ILE C 14 0.210 5.316 -5.465 1.00 0.00 H new ATOM 0 HG21 ILE C 14 0.393 3.465 -8.701 1.00 0.00 H new ATOM 0 HG22 ILE C 14 -0.042 4.859 -9.719 1.00 0.00 H new ATOM 0 HG23 ILE C 14 1.547 4.802 -8.920 1.00 0.00 H new ATOM 0 HD11 ILE C 14 1.028 3.006 -5.186 1.00 0.00 H new ATOM 0 HD12 ILE C 14 -0.550 3.011 -6.009 1.00 0.00 H new ATOM 0 HD13 ILE C 14 0.941 2.750 -6.945 1.00 0.00 H new ATOM 1872 N GLY C 15 -0.021 7.428 -10.111 1.00 0.00 N ATOM 1873 CA GLY C 15 -0.615 7.943 -11.332 1.00 0.00 C ATOM 1874 C GLY C 15 -1.298 9.280 -11.061 1.00 0.00 C ATOM 1875 O GLY C 15 -0.790 10.100 -10.298 1.00 0.00 O ATOM 0 H GLY C 15 0.971 7.207 -10.192 1.00 0.00 H new ATOM 0 HA2 GLY C 15 0.153 8.067 -12.095 1.00 0.00 H new ATOM 0 HA3 GLY C 15 -1.340 7.228 -11.722 1.00 0.00 H new ATOM 1879 N ASP C 16 -2.451 9.492 -11.693 1.00 0.00 N ATOM 1880 CA ASP C 16 -3.275 10.676 -11.499 1.00 0.00 C ATOM 1881 C ASP C 16 -4.726 10.275 -11.218 1.00 0.00 C ATOM 1882 O ASP C 16 -5.618 11.123 -11.228 1.00 0.00 O ATOM 1883 CB ASP C 16 -3.140 11.618 -12.696 1.00 0.00 C ATOM 1884 CG ASP C 16 -3.708 11.024 -13.986 1.00 0.00 C ATOM 1885 OD1 ASP C 16 -3.156 10.002 -14.452 1.00 0.00 O ATOM 1886 OD2 ASP C 16 -4.692 11.604 -14.497 1.00 0.00 O ATOM 0 H ASP C 16 -2.843 8.832 -12.365 1.00 0.00 H new ATOM 0 HA ASP C 16 -2.925 11.224 -10.624 1.00 0.00 H new ATOM 0 HB2 ASP C 16 -3.654 12.554 -12.476 1.00 0.00 H new ATOM 0 HB3 ASP C 16 -2.088 11.860 -12.845 1.00 0.00 H new ATOM 1891 N ASP C 17 -4.955 8.980 -10.966 1.00 0.00 N ATOM 1892 CA ASP C 17 -6.278 8.430 -10.699 1.00 0.00 C ATOM 1893 C ASP C 17 -6.259 7.439 -9.533 1.00 0.00 C ATOM 1894 O ASP C 17 -7.273 6.786 -9.286 1.00 0.00 O ATOM 1895 CB ASP C 17 -6.823 7.744 -11.956 1.00 0.00 C ATOM 1896 CG ASP C 17 -7.062 8.735 -13.095 1.00 0.00 C ATOM 1897 OD1 ASP C 17 -7.968 9.584 -12.936 1.00 0.00 O ATOM 1898 OD2 ASP C 17 -6.339 8.634 -14.110 1.00 0.00 O ATOM 0 H ASP C 17 -4.213 8.281 -10.943 1.00 0.00 H new ATOM 0 HA ASP C 17 -6.929 9.258 -10.420 1.00 0.00 H new ATOM 0 HB2 ASP C 17 -6.120 6.978 -12.284 1.00 0.00 H new ATOM 0 HB3 ASP C 17 -7.757 7.237 -11.715 1.00 0.00 H new ATOM 1903 N ILE C 18 -5.137 7.301 -8.809 1.00 0.00 N ATOM 1904 CA ILE C 18 -5.072 6.363 -7.699 1.00 0.00 C ATOM 1905 C ILE C 18 -4.525 7.048 -6.448 1.00 0.00 C ATOM 1906 O ILE C 18 -3.677 7.939 -6.525 1.00 0.00 O ATOM 1907 CB ILE C 18 -4.220 5.135 -8.071 1.00 0.00 C ATOM 1908 CG1 ILE C 18 -4.747 4.407 -9.315 1.00 0.00 C ATOM 1909 CG2 ILE C 18 -4.213 4.133 -6.911 1.00 0.00 C ATOM 1910 CD1 ILE C 18 -4.121 4.946 -10.600 1.00 0.00 C ATOM 0 H ILE C 18 -4.277 7.824 -8.976 1.00 0.00 H new ATOM 0 HA ILE C 18 -6.083 6.018 -7.482 1.00 0.00 H new ATOM 0 HB ILE C 18 -3.217 5.507 -8.282 1.00 0.00 H new ATOM 0 HG12 ILE C 18 -4.536 3.341 -9.228 1.00 0.00 H new ATOM 0 HG13 ILE C 18 -5.830 4.514 -9.366 1.00 0.00 H new ATOM 0 HG21 ILE C 18 -3.608 3.267 -7.182 1.00 0.00 H new ATOM 0 HG22 ILE C 18 -3.792 4.606 -6.024 1.00 0.00 H new ATOM 0 HG23 ILE C 18 -5.233 3.812 -6.702 1.00 0.00 H new ATOM 0 HD11 ILE C 18 -4.522 4.403 -11.456 1.00 0.00 H new ATOM 0 HD12 ILE C 18 -4.354 6.006 -10.701 1.00 0.00 H new ATOM 0 HD13 ILE C 18 -3.040 4.814 -10.561 1.00 0.00 H new ATOM 1922 N THR C 19 -5.021 6.611 -5.289 1.00 0.00 N ATOM 1923 CA THR C 19 -4.595 7.096 -3.984 1.00 0.00 C ATOM 1924 C THR C 19 -4.482 5.896 -3.051 1.00 0.00 C ATOM 1925 O THR C 19 -5.128 4.872 -3.273 1.00 0.00 O ATOM 1926 CB THR C 19 -5.609 8.116 -3.453 1.00 0.00 C ATOM 1927 OG1 THR C 19 -5.786 9.156 -4.390 1.00 0.00 O ATOM 1928 CG2 THR C 19 -5.152 8.732 -2.131 1.00 0.00 C ATOM 0 H THR C 19 -5.745 5.895 -5.235 1.00 0.00 H new ATOM 0 HA THR C 19 -3.629 7.596 -4.052 1.00 0.00 H new ATOM 0 HB THR C 19 -6.546 7.583 -3.290 1.00 0.00 H new ATOM 0 HG1 THR C 19 -6.436 9.802 -4.043 1.00 0.00 H new ATOM 0 HG21 THR C 19 -5.897 9.450 -1.787 1.00 0.00 H new ATOM 0 HG22 THR C 19 -5.034 7.946 -1.385 1.00 0.00 H new ATOM 0 HG23 THR C 19 -4.199 9.240 -2.277 1.00 0.00 H new ATOM 1936 N ILE C 20 -3.660 6.025 -2.012 1.00 0.00 N ATOM 1937 CA ILE C 20 -3.356 4.957 -1.076 1.00 0.00 C ATOM 1938 C ILE C 20 -3.388 5.540 0.334 1.00 0.00 C ATOM 1939 O ILE C 20 -3.078 6.713 0.528 1.00 0.00 O ATOM 1940 CB ILE C 20 -1.956 4.407 -1.388 1.00 0.00 C ATOM 1941 CG1 ILE C 20 -1.805 3.932 -2.837 1.00 0.00 C ATOM 1942 CG2 ILE C 20 -1.594 3.263 -0.434 1.00 0.00 C ATOM 1943 CD1 ILE C 20 -2.649 2.700 -3.155 1.00 0.00 C ATOM 0 H ILE C 20 -3.178 6.898 -1.797 1.00 0.00 H new ATOM 0 HA ILE C 20 -4.082 4.148 -1.157 1.00 0.00 H new ATOM 0 HB ILE C 20 -1.268 5.240 -1.245 1.00 0.00 H new ATOM 0 HG12 ILE C 20 -2.087 4.742 -3.510 1.00 0.00 H new ATOM 0 HG13 ILE C 20 -0.756 3.707 -3.032 1.00 0.00 H new ATOM 0 HG21 ILE C 20 -0.598 2.890 -0.675 1.00 0.00 H new ATOM 0 HG22 ILE C 20 -1.606 3.628 0.593 1.00 0.00 H new ATOM 0 HG23 ILE C 20 -2.319 2.457 -0.541 1.00 0.00 H new ATOM 0 HD11 ILE C 20 -2.498 2.414 -4.196 1.00 0.00 H new ATOM 0 HD12 ILE C 20 -2.351 1.877 -2.505 1.00 0.00 H new ATOM 0 HD13 ILE C 20 -3.702 2.928 -2.991 1.00 0.00 H new ATOM 1955 N THR C 21 -3.761 4.724 1.324 1.00 0.00 N ATOM 1956 CA THR C 21 -3.842 5.169 2.709 1.00 0.00 C ATOM 1957 C THR C 21 -3.350 4.060 3.630 1.00 0.00 C ATOM 1958 O THR C 21 -3.463 2.881 3.300 1.00 0.00 O ATOM 1959 CB THR C 21 -5.295 5.544 3.034 1.00 0.00 C ATOM 1960 OG1 THR C 21 -5.782 6.455 2.071 1.00 0.00 O ATOM 1961 CG2 THR C 21 -5.427 6.192 4.412 1.00 0.00 C ATOM 0 H THR C 21 -4.012 3.745 1.185 1.00 0.00 H new ATOM 0 HA THR C 21 -3.211 6.046 2.858 1.00 0.00 H new ATOM 0 HB THR C 21 -5.872 4.620 3.025 1.00 0.00 H new ATOM 0 HG1 THR C 21 -6.710 6.690 2.282 1.00 0.00 H new ATOM 0 HG21 THR C 21 -6.472 6.440 4.599 1.00 0.00 H new ATOM 0 HG22 THR C 21 -5.077 5.497 5.176 1.00 0.00 H new ATOM 0 HG23 THR C 21 -4.826 7.101 4.446 1.00 0.00 H new ATOM 1969 N ILE C 22 -2.804 4.443 4.786 1.00 0.00 N ATOM 1970 CA ILE C 22 -2.318 3.509 5.788 1.00 0.00 C ATOM 1971 C ILE C 22 -3.237 3.584 7.005 1.00 0.00 C ATOM 1972 O ILE C 22 -3.025 4.373 7.922 1.00 0.00 O ATOM 1973 CB ILE C 22 -0.834 3.766 6.093 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -0.335 2.955 7.294 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -0.544 5.243 6.367 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -0.553 1.460 7.094 1.00 0.00 C ATOM 0 H ILE C 22 -2.688 5.422 5.050 1.00 0.00 H new ATOM 0 HA ILE C 22 -2.353 2.483 5.422 1.00 0.00 H new ATOM 0 HB ILE C 22 -0.304 3.450 5.194 1.00 0.00 H new ATOM 0 HG12 ILE C 22 0.726 3.150 7.450 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -0.855 3.281 8.195 1.00 0.00 H new ATOM 0 HG21 ILE C 22 0.518 5.372 6.577 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -0.816 5.835 5.493 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -1.127 5.575 7.226 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -0.187 0.919 7.966 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -1.617 1.262 6.964 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -0.012 1.129 6.208 1.00 0.00 H new ATOM 1988 N LEU C 23 -4.275 2.745 6.996 1.00 0.00 N ATOM 1989 CA LEU C 23 -5.301 2.764 8.029 1.00 0.00 C ATOM 1990 C LEU C 23 -4.721 2.373 9.384 1.00 0.00 C ATOM 1991 O LEU C 23 -5.197 2.851 10.412 1.00 0.00 O ATOM 1992 CB LEU C 23 -6.431 1.803 7.647 1.00 0.00 C ATOM 1993 CG LEU C 23 -6.925 1.997 6.207 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -8.059 1.019 5.929 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -7.453 3.405 5.970 1.00 0.00 C ATOM 0 H LEU C 23 -4.424 2.039 6.275 1.00 0.00 H new ATOM 0 HA LEU C 23 -5.694 3.778 8.108 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -6.085 0.777 7.771 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -7.266 1.943 8.333 1.00 0.00 H new ATOM 0 HG LEU C 23 -6.076 1.825 5.545 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -8.413 1.153 4.907 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -7.699 -0.002 6.057 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -8.878 1.204 6.624 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -7.792 3.498 4.938 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -8.287 3.599 6.645 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -6.659 4.128 6.157 1.00 0.00 H new ATOM 2007 N GLY C 24 -3.698 1.510 9.395 1.00 0.00 N ATOM 2008 CA GLY C 24 -3.012 1.174 10.639 1.00 0.00 C ATOM 2009 C GLY C 24 -2.289 -0.165 10.569 1.00 0.00 C ATOM 2010 O GLY C 24 -2.146 -0.747 9.494 1.00 0.00 O ATOM 0 H GLY C 24 -3.334 1.040 8.566 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -2.293 1.958 10.876 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -3.736 1.149 11.453 1.00 0.00 H new ATOM 2014 N VAL C 25 -1.830 -0.652 11.727 1.00 0.00 N ATOM 2015 CA VAL C 25 -1.150 -1.938 11.830 1.00 0.00 C ATOM 2016 C VAL C 25 -1.720 -2.742 12.994 1.00 0.00 C ATOM 2017 O VAL C 25 -2.393 -2.191 13.865 1.00 0.00 O ATOM 2018 CB VAL C 25 0.372 -1.762 11.985 1.00 0.00 C ATOM 2019 CG1 VAL C 25 0.913 -0.679 11.045 1.00 0.00 C ATOM 2020 CG2 VAL C 25 0.760 -1.412 13.421 1.00 0.00 C ATOM 0 H VAL C 25 -1.922 -0.162 12.617 1.00 0.00 H new ATOM 0 HA VAL C 25 -1.323 -2.486 10.904 1.00 0.00 H new ATOM 0 HB VAL C 25 0.817 -2.721 11.721 1.00 0.00 H new ATOM 0 HG11 VAL C 25 1.990 -0.583 11.182 1.00 0.00 H new ATOM 0 HG12 VAL C 25 0.702 -0.955 10.012 1.00 0.00 H new ATOM 0 HG13 VAL C 25 0.432 0.273 11.271 1.00 0.00 H new ATOM 0 HG21 VAL C 25 1.842 -1.296 13.488 1.00 0.00 H new ATOM 0 HG22 VAL C 25 0.277 -0.479 13.711 1.00 0.00 H new ATOM 0 HG23 VAL C 25 0.439 -2.211 14.090 1.00 0.00 H new ATOM 2030 N SER C 26 -1.448 -4.048 13.006 1.00 0.00 N ATOM 2031 CA SER C 26 -1.880 -4.939 14.075 1.00 0.00 C ATOM 2032 C SER C 26 -0.907 -6.107 14.147 1.00 0.00 C ATOM 2033 O SER C 26 -0.917 -6.978 13.276 1.00 0.00 O ATOM 2034 CB SER C 26 -3.299 -5.435 13.786 1.00 0.00 C ATOM 2035 OG SER C 26 -3.727 -6.288 14.826 1.00 0.00 O ATOM 0 H SER C 26 -0.919 -4.516 12.270 1.00 0.00 H new ATOM 0 HA SER C 26 -1.890 -4.415 15.031 1.00 0.00 H new ATOM 0 HB2 SER C 26 -3.979 -4.588 13.695 1.00 0.00 H new ATOM 0 HB3 SER C 26 -3.322 -5.966 12.834 1.00 0.00 H new ATOM 0 HG SER C 26 -4.636 -6.602 14.638 1.00 0.00 H new ATOM 2041 N GLY C 27 -0.065 -6.133 15.180 1.00 0.00 N ATOM 2042 CA GLY C 27 1.002 -7.113 15.271 1.00 0.00 C ATOM 2043 C GLY C 27 2.017 -6.865 14.167 1.00 0.00 C ATOM 2044 O GLY C 27 2.901 -6.021 14.318 1.00 0.00 O ATOM 0 H GLY C 27 -0.107 -5.482 15.964 1.00 0.00 H new ATOM 0 HA2 GLY C 27 1.486 -7.049 16.245 1.00 0.00 H new ATOM 0 HA3 GLY C 27 0.593 -8.120 15.184 1.00 0.00 H new ATOM 2048 N GLN C 28 1.886 -7.600 13.063 1.00 0.00 N ATOM 2049 CA GLN C 28 2.687 -7.392 11.865 1.00 0.00 C ATOM 2050 C GLN C 28 1.789 -7.210 10.650 1.00 0.00 C ATOM 2051 O GLN C 28 2.295 -7.021 9.547 1.00 0.00 O ATOM 2052 CB GLN C 28 3.651 -8.562 11.645 1.00 0.00 C ATOM 2053 CG GLN C 28 4.804 -8.592 12.645 1.00 0.00 C ATOM 2054 CD GLN C 28 5.729 -7.382 12.530 1.00 0.00 C ATOM 2055 OE1 GLN C 28 6.786 -7.456 11.909 1.00 0.00 O ATOM 2056 NE2 GLN C 28 5.354 -6.250 13.123 1.00 0.00 N ATOM 0 H GLN C 28 1.214 -8.362 12.978 1.00 0.00 H new ATOM 0 HA GLN C 28 3.276 -6.485 12.002 1.00 0.00 H new ATOM 0 HB2 GLN C 28 3.096 -9.498 11.713 1.00 0.00 H new ATOM 0 HB3 GLN C 28 4.057 -8.504 10.635 1.00 0.00 H new ATOM 0 HG2 GLN C 28 4.399 -8.637 13.656 1.00 0.00 H new ATOM 0 HG3 GLN C 28 5.385 -9.502 12.493 1.00 0.00 H new ATOM 0 HE21 GLN C 28 4.472 -6.210 13.634 1.00 0.00 H new ATOM 0 HE22 GLN C 28 5.949 -5.423 13.066 1.00 0.00 H new ATOM 2065 N GLN C 29 0.466 -7.269 10.833 1.00 0.00 N ATOM 2066 CA GLN C 29 -0.452 -6.932 9.763 1.00 0.00 C ATOM 2067 C GLN C 29 -0.429 -5.431 9.543 1.00 0.00 C ATOM 2068 O GLN C 29 -0.009 -4.665 10.410 1.00 0.00 O ATOM 2069 CB GLN C 29 -1.887 -7.320 10.105 1.00 0.00 C ATOM 2070 CG GLN C 29 -2.135 -8.818 9.980 1.00 0.00 C ATOM 2071 CD GLN C 29 -3.630 -9.084 9.987 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -4.209 -9.411 8.958 1.00 0.00 O ATOM 2073 NE2 GLN C 29 -4.263 -8.948 11.145 1.00 0.00 N ATOM 0 H GLN C 29 0.019 -7.545 11.707 1.00 0.00 H new ATOM 0 HA GLN C 29 -0.134 -7.478 8.875 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -2.113 -7.002 11.123 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -2.571 -6.786 9.445 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -1.692 -9.196 9.059 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -1.656 -9.347 10.804 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -3.745 -8.674 11.980 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -5.267 -9.117 11.200 1.00 0.00 H new ATOM 2082 N VAL C 30 -0.892 -5.014 8.366 1.00 0.00 N ATOM 2083 CA VAL C 30 -1.042 -3.616 8.027 1.00 0.00 C ATOM 2084 C VAL C 30 -2.343 -3.485 7.256 1.00 0.00 C ATOM 2085 O VAL C 30 -2.492 -4.102 6.200 1.00 0.00 O ATOM 2086 CB VAL C 30 0.147 -3.168 7.170 1.00 0.00 C ATOM 2087 CG1 VAL C 30 0.034 -1.677 6.881 1.00 0.00 C ATOM 2088 CG2 VAL C 30 1.476 -3.408 7.890 1.00 0.00 C ATOM 0 H VAL C 30 -1.174 -5.650 7.620 1.00 0.00 H new ATOM 0 HA VAL C 30 -1.066 -2.987 8.917 1.00 0.00 H new ATOM 0 HB VAL C 30 0.127 -3.750 6.248 1.00 0.00 H new ATOM 0 HG11 VAL C 30 0.880 -1.359 6.272 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -0.894 -1.480 6.345 1.00 0.00 H new ATOM 0 HG13 VAL C 30 0.035 -1.123 7.820 1.00 0.00 H new ATOM 0 HG21 VAL C 30 2.299 -3.079 7.255 1.00 0.00 H new ATOM 0 HG22 VAL C 30 1.491 -2.845 8.823 1.00 0.00 H new ATOM 0 HG23 VAL C 30 1.586 -4.471 8.106 1.00 0.00 H new ATOM 2098 N ARG C 31 -3.278 -2.683 7.776 1.00 0.00 N ATOM 2099 CA ARG C 31 -4.478 -2.338 7.032 1.00 0.00 C ATOM 2100 C ARG C 31 -4.104 -1.219 6.076 1.00 0.00 C ATOM 2101 O ARG C 31 -3.726 -0.125 6.507 1.00 0.00 O ATOM 2102 CB ARG C 31 -5.601 -1.846 7.945 1.00 0.00 C ATOM 2103 CG ARG C 31 -6.409 -2.985 8.564 1.00 0.00 C ATOM 2104 CD ARG C 31 -7.822 -2.483 8.886 1.00 0.00 C ATOM 2105 NE ARG C 31 -7.819 -1.376 9.849 1.00 0.00 N ATOM 2106 CZ ARG C 31 -8.914 -0.677 10.161 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -10.086 -0.971 9.605 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -8.843 0.322 11.033 1.00 0.00 N ATOM 0 H ARG C 31 -3.221 -2.266 8.705 1.00 0.00 H new ATOM 0 HA ARG C 31 -4.842 -3.225 6.514 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -5.174 -1.236 8.741 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.270 -1.202 7.374 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -6.458 -3.828 7.875 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -5.921 -3.342 9.471 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -8.307 -2.158 7.966 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -8.414 -3.306 9.285 1.00 0.00 H new ATOM 0 HE ARG C 31 -6.939 -1.128 10.302 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -10.154 -1.736 8.934 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -10.916 -0.431 9.850 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -7.950 0.558 11.467 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -9.681 0.854 11.269 1.00 0.00 H new ATOM 2122 N ILE C 32 -4.212 -1.516 4.782 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.891 -0.580 3.720 1.00 0.00 C ATOM 2124 C ILE C 32 -5.172 -0.326 2.939 1.00 0.00 C ATOM 2125 O ILE C 32 -5.916 -1.260 2.650 1.00 0.00 O ATOM 2126 CB ILE C 32 -2.816 -1.182 2.803 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -1.660 -1.773 3.626 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -2.314 -0.100 1.844 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -0.528 -2.311 2.753 1.00 0.00 C ATOM 0 H ILE C 32 -4.529 -2.425 4.444 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.501 0.353 4.126 1.00 0.00 H new ATOM 0 HB ILE C 32 -3.250 -1.998 2.225 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -1.266 -1.006 4.293 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -2.042 -2.577 4.255 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -1.550 -0.520 1.189 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.145 0.267 1.242 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -1.888 0.724 2.416 1.00 0.00 H new ATOM 0 HD11 ILE C 32 0.260 -2.716 3.388 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -0.912 -3.098 2.104 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -0.124 -1.503 2.143 1.00 0.00 H new ATOM 2141 N GLY C 33 -5.422 0.937 2.601 1.00 0.00 N ATOM 2142 CA GLY C 33 -6.607 1.325 1.853 1.00 0.00 C ATOM 2143 C GLY C 33 -6.182 1.815 0.479 1.00 0.00 C ATOM 2144 O GLY C 33 -5.086 2.355 0.318 1.00 0.00 O ATOM 0 H GLY C 33 -4.808 1.716 2.839 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -7.287 0.478 1.758 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -7.147 2.110 2.383 1.00 0.00 H new ATOM 2148 N ILE C 34 -7.049 1.630 -0.517 1.00 0.00 N ATOM 2149 CA ILE C 34 -6.760 2.047 -1.877 1.00 0.00 C ATOM 2150 C ILE C 34 -8.002 2.711 -2.442 1.00 0.00 C ATOM 2151 O ILE C 34 -9.123 2.308 -2.127 1.00 0.00 O ATOM 2152 CB ILE C 34 -6.340 0.823 -2.708 1.00 0.00 C ATOM 2153 CG1 ILE C 34 -5.124 0.148 -2.060 1.00 0.00 C ATOM 2154 CG2 ILE C 34 -6.026 1.262 -4.144 1.00 0.00 C ATOM 2155 CD1 ILE C 34 -4.708 -1.134 -2.782 1.00 0.00 C ATOM 0 H ILE C 34 -7.962 1.190 -0.399 1.00 0.00 H new ATOM 0 HA ILE C 34 -5.937 2.761 -1.904 1.00 0.00 H new ATOM 0 HB ILE C 34 -7.155 0.100 -2.738 1.00 0.00 H new ATOM 0 HG12 ILE C 34 -4.286 0.845 -2.054 1.00 0.00 H new ATOM 0 HG13 ILE C 34 -5.353 -0.083 -1.020 1.00 0.00 H new ATOM 0 HG21 ILE C 34 -5.728 0.394 -4.733 1.00 0.00 H new ATOM 0 HG22 ILE C 34 -6.912 1.715 -4.588 1.00 0.00 H new ATOM 0 HG23 ILE C 34 -5.214 1.989 -4.133 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -3.843 -1.569 -2.281 1.00 0.00 H new ATOM 0 HD12 ILE C 34 -5.534 -1.845 -2.765 1.00 0.00 H new ATOM 0 HD13 ILE C 34 -4.450 -0.902 -3.815 1.00 0.00 H new ATOM 2167 N ASN C 35 -7.806 3.730 -3.275 1.00 0.00 N ATOM 2168 CA ASN C 35 -8.901 4.477 -3.856 1.00 0.00 C ATOM 2169 C ASN C 35 -8.604 4.711 -5.330 1.00 0.00 C ATOM 2170 O ASN C 35 -7.788 5.558 -5.686 1.00 0.00 O ATOM 2171 CB ASN C 35 -9.082 5.787 -3.086 1.00 0.00 C ATOM 2172 CG ASN C 35 -10.361 6.514 -3.480 1.00 0.00 C ATOM 2173 OD1 ASN C 35 -11.092 6.078 -4.366 1.00 0.00 O ATOM 2174 ND2 ASN C 35 -10.638 7.632 -2.820 1.00 0.00 N ATOM 0 H ASN C 35 -6.883 4.055 -3.561 1.00 0.00 H new ATOM 0 HA ASN C 35 -9.837 3.923 -3.784 1.00 0.00 H new ATOM 0 HB2 ASN C 35 -9.100 5.578 -2.016 1.00 0.00 H new ATOM 0 HB3 ASN C 35 -8.226 6.436 -3.270 1.00 0.00 H new ATOM 0 HD21 ASN C 35 -11.482 8.160 -3.043 1.00 0.00 H new ATOM 0 HD22 ASN C 35 -10.007 7.963 -2.090 1.00 0.00 H new ATOM 2181 N ALA C 36 -9.278 3.936 -6.178 1.00 0.00 N ATOM 2182 CA ALA C 36 -9.102 3.979 -7.619 1.00 0.00 C ATOM 2183 C ALA C 36 -10.450 3.759 -8.305 1.00 0.00 C ATOM 2184 O ALA C 36 -11.347 3.154 -7.708 1.00 0.00 O ATOM 2185 CB ALA C 36 -8.110 2.880 -8.010 1.00 0.00 C ATOM 0 H ALA C 36 -9.971 3.252 -5.873 1.00 0.00 H new ATOM 0 HA ALA C 36 -8.715 4.949 -7.932 1.00 0.00 H new ATOM 0 HB1 ALA C 36 -7.961 2.892 -9.090 1.00 0.00 H new ATOM 0 HB2 ALA C 36 -7.157 3.055 -7.510 1.00 0.00 H new ATOM 0 HB3 ALA C 36 -8.505 1.910 -7.709 1.00 0.00 H new ATOM 2191 N PRO C 37 -10.620 4.233 -9.546 1.00 0.00 N ATOM 2192 CA PRO C 37 -11.826 4.009 -10.323 1.00 0.00 C ATOM 2193 C PRO C 37 -11.907 2.552 -10.757 1.00 0.00 C ATOM 2194 O PRO C 37 -10.886 1.886 -10.918 1.00 0.00 O ATOM 2195 CB PRO C 37 -11.690 4.929 -11.538 1.00 0.00 C ATOM 2196 CG PRO C 37 -10.180 5.086 -11.717 1.00 0.00 C ATOM 2197 CD PRO C 37 -9.659 5.028 -10.285 1.00 0.00 C ATOM 0 HA PRO C 37 -12.732 4.220 -9.754 1.00 0.00 H new ATOM 0 HB2 PRO C 37 -12.153 4.493 -12.423 1.00 0.00 H new ATOM 0 HB3 PRO C 37 -12.174 5.891 -11.366 1.00 0.00 H new ATOM 0 HG2 PRO C 37 -9.761 4.289 -12.332 1.00 0.00 H new ATOM 0 HG3 PRO C 37 -9.927 6.029 -12.201 1.00 0.00 H new ATOM 0 HD2 PRO C 37 -8.667 4.577 -10.248 1.00 0.00 H new ATOM 0 HD3 PRO C 37 -9.570 6.028 -9.861 1.00 0.00 H new ATOM 2205 N LYS C 38 -13.130 2.042 -10.952 1.00 0.00 N ATOM 2206 CA LYS C 38 -13.330 0.693 -11.468 1.00 0.00 C ATOM 2207 C LYS C 38 -12.822 0.582 -12.905 1.00 0.00 C ATOM 2208 O LYS C 38 -12.869 -0.491 -13.504 1.00 0.00 O ATOM 2209 CB LYS C 38 -14.810 0.309 -11.355 1.00 0.00 C ATOM 2210 CG LYS C 38 -15.242 0.126 -9.893 1.00 0.00 C ATOM 2211 CD LYS C 38 -14.573 -1.052 -9.166 1.00 0.00 C ATOM 2212 CE LYS C 38 -15.128 -2.416 -9.585 1.00 0.00 C ATOM 2213 NZ LYS C 38 -14.649 -2.847 -10.913 1.00 0.00 N ATOM 0 H LYS C 38 -13.994 2.549 -10.758 1.00 0.00 H new ATOM 0 HA LYS C 38 -12.751 -0.010 -10.869 1.00 0.00 H new ATOM 0 HB2 LYS C 38 -15.422 1.081 -11.821 1.00 0.00 H new ATOM 0 HB3 LYS C 38 -14.989 -0.615 -11.905 1.00 0.00 H new ATOM 0 HG2 LYS C 38 -15.023 1.043 -9.347 1.00 0.00 H new ATOM 0 HG3 LYS C 38 -16.323 -0.013 -9.863 1.00 0.00 H new ATOM 0 HD2 LYS C 38 -13.501 -1.028 -9.361 1.00 0.00 H new ATOM 0 HD3 LYS C 38 -14.705 -0.929 -8.091 1.00 0.00 H new ATOM 0 HE2 LYS C 38 -14.845 -3.162 -8.842 1.00 0.00 H new ATOM 0 HE3 LYS C 38 -16.217 -2.373 -9.594 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 -14.409 -3.859 -10.884 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 -15.395 -2.688 -11.620 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 -13.805 -2.298 -11.172 1.00 0.00 H new ATOM 2227 N ASP C 39 -12.336 1.696 -13.462 1.00 0.00 N ATOM 2228 CA ASP C 39 -11.677 1.734 -14.755 1.00 0.00 C ATOM 2229 C ASP C 39 -10.331 1.003 -14.701 1.00 0.00 C ATOM 2230 O ASP C 39 -9.723 0.747 -15.742 1.00 0.00 O ATOM 2231 CB ASP C 39 -11.473 3.200 -15.141 1.00 0.00 C ATOM 2232 CG ASP C 39 -11.036 3.353 -16.595 1.00 0.00 C ATOM 2233 OD1 ASP C 39 -11.820 2.940 -17.478 1.00 0.00 O ATOM 2234 OD2 ASP C 39 -9.922 3.878 -16.819 1.00 0.00 O ATOM 0 H ASP C 39 -12.395 2.609 -13.012 1.00 0.00 H new ATOM 0 HA ASP C 39 -12.294 1.231 -15.500 1.00 0.00 H new ATOM 0 HB2 ASP C 39 -12.401 3.749 -14.982 1.00 0.00 H new ATOM 0 HB3 ASP C 39 -10.723 3.646 -14.488 1.00 0.00 H new ATOM 2239 N VAL C 40 -9.869 0.668 -13.490 1.00 0.00 N ATOM 2240 CA VAL C 40 -8.616 -0.038 -13.271 1.00 0.00 C ATOM 2241 C VAL C 40 -8.811 -1.098 -12.186 1.00 0.00 C ATOM 2242 O VAL C 40 -9.762 -1.028 -11.404 1.00 0.00 O ATOM 2243 CB VAL C 40 -7.496 0.942 -12.884 1.00 0.00 C ATOM 2244 CG1 VAL C 40 -7.345 2.039 -13.940 1.00 0.00 C ATOM 2245 CG2 VAL C 40 -7.747 1.612 -11.534 1.00 0.00 C ATOM 0 H VAL C 40 -10.368 0.886 -12.627 1.00 0.00 H new ATOM 0 HA VAL C 40 -8.318 -0.529 -14.198 1.00 0.00 H new ATOM 0 HB VAL C 40 -6.585 0.347 -12.817 1.00 0.00 H new ATOM 0 HG11 VAL C 40 -6.547 2.721 -13.645 1.00 0.00 H new ATOM 0 HG12 VAL C 40 -7.100 1.587 -14.901 1.00 0.00 H new ATOM 0 HG13 VAL C 40 -8.280 2.592 -14.027 1.00 0.00 H new ATOM 0 HG21 VAL C 40 -6.927 2.294 -11.308 1.00 0.00 H new ATOM 0 HG22 VAL C 40 -8.683 2.170 -11.573 1.00 0.00 H new ATOM 0 HG23 VAL C 40 -7.811 0.851 -10.756 1.00 0.00 H new ATOM 2255 N ALA C 41 -7.911 -2.083 -12.134 1.00 0.00 N ATOM 2256 CA ALA C 41 -8.028 -3.190 -11.200 1.00 0.00 C ATOM 2257 C ALA C 41 -7.083 -3.013 -10.017 1.00 0.00 C ATOM 2258 O ALA C 41 -6.085 -2.302 -10.110 1.00 0.00 O ATOM 2259 CB ALA C 41 -7.720 -4.489 -11.943 1.00 0.00 C ATOM 0 H ALA C 41 -7.089 -2.130 -12.736 1.00 0.00 H new ATOM 0 HA ALA C 41 -9.043 -3.221 -10.803 1.00 0.00 H new ATOM 0 HB1 ALA C 41 -7.804 -5.330 -11.255 1.00 0.00 H new ATOM 0 HB2 ALA C 41 -8.429 -4.617 -12.761 1.00 0.00 H new ATOM 0 HB3 ALA C 41 -6.707 -4.447 -12.344 1.00 0.00 H new ATOM 2265 N VAL C 42 -7.405 -3.672 -8.900 1.00 0.00 N ATOM 2266 CA VAL C 42 -6.543 -3.695 -7.722 1.00 0.00 C ATOM 2267 C VAL C 42 -6.794 -4.991 -6.955 1.00 0.00 C ATOM 2268 O VAL C 42 -7.944 -5.377 -6.767 1.00 0.00 O ATOM 2269 CB VAL C 42 -6.814 -2.448 -6.864 1.00 0.00 C ATOM 2270 CG1 VAL C 42 -8.305 -2.230 -6.618 1.00 0.00 C ATOM 2271 CG2 VAL C 42 -6.135 -2.520 -5.506 1.00 0.00 C ATOM 0 H VAL C 42 -8.269 -4.202 -8.790 1.00 0.00 H new ATOM 0 HA VAL C 42 -5.492 -3.670 -8.008 1.00 0.00 H new ATOM 0 HB VAL C 42 -6.404 -1.618 -7.440 1.00 0.00 H new ATOM 0 HG11 VAL C 42 -8.446 -1.338 -6.008 1.00 0.00 H new ATOM 0 HG12 VAL C 42 -8.816 -2.102 -7.572 1.00 0.00 H new ATOM 0 HG13 VAL C 42 -8.718 -3.094 -6.098 1.00 0.00 H new ATOM 0 HG21 VAL C 42 -6.358 -1.616 -4.939 1.00 0.00 H new ATOM 0 HG22 VAL C 42 -6.503 -3.389 -4.961 1.00 0.00 H new ATOM 0 HG23 VAL C 42 -5.057 -2.606 -5.642 1.00 0.00 H new ATOM 2281 N HIS C 43 -5.725 -5.663 -6.507 1.00 0.00 N ATOM 2282 CA HIS C 43 -5.837 -6.958 -5.848 1.00 0.00 C ATOM 2283 C HIS C 43 -4.618 -7.243 -4.980 1.00 0.00 C ATOM 2284 O HIS C 43 -3.624 -6.523 -5.047 1.00 0.00 O ATOM 2285 CB HIS C 43 -5.895 -8.065 -6.907 1.00 0.00 C ATOM 2286 CG HIS C 43 -7.017 -7.927 -7.896 1.00 0.00 C ATOM 2287 ND1 HIS C 43 -8.345 -8.295 -7.669 1.00 0.00 N ATOM 2288 CD2 HIS C 43 -6.898 -7.424 -9.160 1.00 0.00 C ATOM 2289 CE1 HIS C 43 -8.996 -8.004 -8.806 1.00 0.00 C ATOM 2290 NE2 HIS C 43 -8.155 -7.480 -9.717 1.00 0.00 N ATOM 0 H HIS C 43 -4.768 -5.322 -6.593 1.00 0.00 H new ATOM 0 HA HIS C 43 -6.737 -6.936 -5.233 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -4.950 -8.080 -7.450 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -5.989 -9.027 -6.403 1.00 0.00 H new ATOM 0 HD1 HIS C 43 -8.737 -8.699 -6.819 1.00 0.00 H new ATOM 0 HD2 HIS C 43 -5.997 -7.056 -9.629 1.00 0.00 H new ATOM 0 HE1 HIS C 43 -10.051 -8.168 -8.968 1.00 0.00 H new ATOM 2298 N ARG C 44 -4.688 -8.297 -4.160 1.00 0.00 N ATOM 2299 CA ARG C 44 -3.509 -8.768 -3.447 1.00 0.00 C ATOM 2300 C ARG C 44 -2.584 -9.434 -4.458 1.00 0.00 C ATOM 2301 O ARG C 44 -3.036 -9.859 -5.519 1.00 0.00 O ATOM 2302 CB ARG C 44 -3.897 -9.753 -2.340 1.00 0.00 C ATOM 2303 CG ARG C 44 -4.947 -9.157 -1.401 1.00 0.00 C ATOM 2304 CD ARG C 44 -5.093 -9.956 -0.104 1.00 0.00 C ATOM 2305 NE ARG C 44 -5.311 -11.392 -0.327 1.00 0.00 N ATOM 2306 CZ ARG C 44 -6.440 -11.950 -0.772 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -7.504 -11.214 -1.082 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -6.511 -13.269 -0.907 1.00 0.00 N ATOM 0 H ARG C 44 -5.539 -8.830 -3.979 1.00 0.00 H new ATOM 0 HA ARG C 44 -3.003 -7.929 -2.969 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -4.285 -10.669 -2.786 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -3.010 -10.027 -1.769 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -4.675 -8.129 -1.162 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -5.909 -9.121 -1.912 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -4.196 -9.821 0.500 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -5.928 -9.554 0.470 1.00 0.00 H new ATOM 0 HE ARG C 44 -4.531 -12.018 -0.124 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -7.469 -10.200 -0.982 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -8.355 -11.664 -1.420 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -5.706 -13.850 -0.671 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -7.370 -13.701 -1.246 1.00 0.00 H new ATOM 2322 N GLU C 45 -1.290 -9.532 -4.160 1.00 0.00 N ATOM 2323 CA GLU C 45 -0.343 -10.161 -5.074 1.00 0.00 C ATOM 2324 C GLU C 45 -0.659 -11.649 -5.242 1.00 0.00 C ATOM 2325 O GLU C 45 -0.287 -12.249 -6.248 1.00 0.00 O ATOM 2326 CB GLU C 45 1.075 -9.907 -4.551 1.00 0.00 C ATOM 2327 CG GLU C 45 2.162 -10.411 -5.506 1.00 0.00 C ATOM 2328 CD GLU C 45 2.576 -11.866 -5.259 1.00 0.00 C ATOM 2329 OE1 GLU C 45 2.052 -12.484 -4.303 1.00 0.00 O ATOM 2330 OE2 GLU C 45 3.424 -12.351 -6.038 1.00 0.00 O ATOM 0 H GLU C 45 -0.876 -9.185 -3.295 1.00 0.00 H new ATOM 0 HA GLU C 45 -0.424 -9.725 -6.070 1.00 0.00 H new ATOM 0 HB2 GLU C 45 1.210 -8.838 -4.387 1.00 0.00 H new ATOM 0 HB3 GLU C 45 1.193 -10.396 -3.584 1.00 0.00 H new ATOM 0 HG2 GLU C 45 1.805 -10.314 -6.531 1.00 0.00 H new ATOM 0 HG3 GLU C 45 3.040 -9.772 -5.412 1.00 0.00 H new ATOM 2337 N GLU C 46 -1.346 -12.251 -4.265 1.00 0.00 N ATOM 2338 CA GLU C 46 -1.760 -13.650 -4.320 1.00 0.00 C ATOM 2339 C GLU C 46 -3.078 -13.817 -5.085 1.00 0.00 C ATOM 2340 O GLU C 46 -3.532 -14.943 -5.294 1.00 0.00 O ATOM 2341 CB GLU C 46 -1.892 -14.194 -2.895 1.00 0.00 C ATOM 2342 CG GLU C 46 -2.985 -13.449 -2.124 1.00 0.00 C ATOM 2343 CD GLU C 46 -3.017 -13.848 -0.654 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -2.031 -13.535 0.053 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -4.025 -14.461 -0.244 1.00 0.00 O ATOM 0 H GLU C 46 -1.631 -11.774 -3.409 1.00 0.00 H new ATOM 0 HA GLU C 46 -1.000 -14.217 -4.858 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -2.126 -15.258 -2.928 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -0.940 -14.093 -2.373 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -2.818 -12.375 -2.205 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -3.954 -13.656 -2.577 1.00 0.00 H new ATOM 2352 N ILE C 47 -3.691 -12.703 -5.498 1.00 0.00 N ATOM 2353 CA ILE C 47 -4.948 -12.708 -6.231 1.00 0.00 C ATOM 2354 C ILE C 47 -4.741 -12.152 -7.632 1.00 0.00 C ATOM 2355 O ILE C 47 -5.376 -12.611 -8.575 1.00 0.00 O ATOM 2356 CB ILE C 47 -5.977 -11.881 -5.449 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -6.346 -12.562 -4.127 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -7.237 -11.644 -6.275 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -6.917 -13.969 -4.317 1.00 0.00 C ATOM 0 H ILE C 47 -3.321 -11.768 -5.328 1.00 0.00 H new ATOM 0 HA ILE C 47 -5.318 -13.728 -6.335 1.00 0.00 H new ATOM 0 HB ILE C 47 -5.516 -10.918 -5.230 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -5.460 -12.618 -3.494 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -7.076 -11.948 -3.600 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -7.947 -11.055 -5.694 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -6.979 -11.105 -7.186 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -7.687 -12.602 -6.535 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.159 -14.398 -3.345 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -7.820 -13.916 -4.925 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -6.179 -14.597 -4.817 1.00 0.00 H new ATOM 2371 N TYR C 48 -3.855 -11.168 -7.789 1.00 0.00 N ATOM 2372 CA TYR C 48 -3.590 -10.579 -9.088 1.00 0.00 C ATOM 2373 C TYR C 48 -3.157 -11.646 -10.095 1.00 0.00 C ATOM 2374 O TYR C 48 -3.529 -11.581 -11.265 1.00 0.00 O ATOM 2375 CB TYR C 48 -2.497 -9.528 -8.925 1.00 0.00 C ATOM 2376 CG TYR C 48 -1.903 -9.093 -10.239 1.00 0.00 C ATOM 2377 CD1 TYR C 48 -2.715 -8.566 -11.255 1.00 0.00 C ATOM 2378 CD2 TYR C 48 -0.522 -9.230 -10.437 1.00 0.00 C ATOM 2379 CE1 TYR C 48 -2.140 -8.170 -12.472 1.00 0.00 C ATOM 2380 CE2 TYR C 48 0.055 -8.840 -11.647 1.00 0.00 C ATOM 2381 CZ TYR C 48 -0.750 -8.304 -12.676 1.00 0.00 C ATOM 2382 OH TYR C 48 -0.186 -7.922 -13.853 1.00 0.00 O ATOM 0 H TYR C 48 -3.311 -10.766 -7.026 1.00 0.00 H new ATOM 0 HA TYR C 48 -4.500 -10.117 -9.471 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -2.909 -8.659 -8.413 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -1.707 -9.928 -8.289 1.00 0.00 H new ATOM 0 HD1 TYR C 48 -3.779 -8.466 -11.101 1.00 0.00 H new ATOM 0 HD2 TYR C 48 0.097 -9.638 -9.652 1.00 0.00 H new ATOM 0 HE1 TYR C 48 -2.763 -7.762 -13.254 1.00 0.00 H new ATOM 0 HE2 TYR C 48 1.119 -8.948 -11.796 1.00 0.00 H new ATOM 0 HH TYR C 48 -0.872 -7.530 -14.433 1.00 0.00 H new ATOM 2392 N GLN C 49 -2.375 -12.627 -9.643 1.00 0.00 N ATOM 2393 CA GLN C 49 -1.910 -13.703 -10.508 1.00 0.00 C ATOM 2394 C GLN C 49 -3.074 -14.581 -10.958 1.00 0.00 C ATOM 2395 O GLN C 49 -2.962 -15.281 -11.961 1.00 0.00 O ATOM 2396 CB GLN C 49 -0.894 -14.566 -9.751 1.00 0.00 C ATOM 2397 CG GLN C 49 0.315 -13.746 -9.309 1.00 0.00 C ATOM 2398 CD GLN C 49 1.292 -14.612 -8.524 1.00 0.00 C ATOM 2399 OE1 GLN C 49 1.937 -15.499 -9.085 1.00 0.00 O ATOM 2400 NE2 GLN C 49 1.409 -14.366 -7.223 1.00 0.00 N ATOM 0 H GLN C 49 -2.051 -12.695 -8.678 1.00 0.00 H new ATOM 0 HA GLN C 49 -1.445 -13.259 -11.388 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -1.372 -15.012 -8.878 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -0.565 -15.387 -10.388 1.00 0.00 H new ATOM 0 HG2 GLN C 49 0.814 -13.325 -10.182 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -0.012 -12.908 -8.693 1.00 0.00 H new ATOM 0 HE21 GLN C 49 0.858 -13.623 -6.793 1.00 0.00 H new ATOM 0 HE22 GLN C 49 2.049 -14.920 -6.655 1.00 0.00 H new ATOM 2409 N ARG C 50 -4.192 -14.542 -10.224 1.00 0.00 N ATOM 2410 CA ARG C 50 -5.362 -15.331 -10.555 1.00 0.00 C ATOM 2411 C ARG C 50 -6.227 -14.605 -11.576 1.00 0.00 C ATOM 2412 O ARG C 50 -6.818 -15.256 -12.437 1.00 0.00 O ATOM 2413 CB ARG C 50 -6.144 -15.624 -9.273 1.00 0.00 C ATOM 2414 CG ARG C 50 -7.377 -16.463 -9.595 1.00 0.00 C ATOM 2415 CD ARG C 50 -8.102 -16.787 -8.290 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.320 -17.706 -7.457 1.00 0.00 N ATOM 2417 CZ ARG C 50 -7.341 -17.725 -6.124 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -8.110 -16.881 -5.437 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -6.586 -18.596 -5.459 1.00 0.00 N ATOM 0 H ARG C 50 -4.301 -13.963 -9.391 1.00 0.00 H new ATOM 0 HA ARG C 50 -5.053 -16.274 -11.005 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -5.509 -16.153 -8.563 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -6.443 -14.690 -8.798 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -8.038 -15.920 -10.270 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -7.087 -17.382 -10.104 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -8.291 -15.866 -7.739 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -9.072 -17.231 -8.512 1.00 0.00 H new ATOM 0 HE ARG C 50 -6.717 -18.379 -7.931 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -8.695 -16.207 -5.931 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -8.114 -16.909 -4.417 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -5.991 -19.249 -5.969 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -6.602 -18.611 -4.439 1.00 0.00 H new ATOM 2433 N ILE C 51 -6.316 -13.271 -11.506 1.00 0.00 N ATOM 2434 CA ILE C 51 -7.053 -12.525 -12.521 1.00 0.00 C ATOM 2435 C ILE C 51 -6.293 -12.639 -13.845 1.00 0.00 C ATOM 2436 O ILE C 51 -6.874 -12.479 -14.916 1.00 0.00 O ATOM 2437 CB ILE C 51 -7.285 -11.064 -12.096 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -8.311 -10.961 -10.966 1.00 0.00 C ATOM 2439 CG2 ILE C 51 -7.874 -10.249 -13.251 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -7.750 -11.379 -9.614 1.00 0.00 C ATOM 0 H ILE C 51 -5.895 -12.700 -10.773 1.00 0.00 H new ATOM 0 HA ILE C 51 -8.049 -12.951 -12.646 1.00 0.00 H new ATOM 0 HB ILE C 51 -6.311 -10.688 -11.782 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -8.671 -9.934 -10.902 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -9.171 -11.586 -11.205 1.00 0.00 H new ATOM 0 HG21 ILE C 51 -8.030 -9.220 -12.928 1.00 0.00 H new ATOM 0 HG22 ILE C 51 -7.185 -10.264 -14.095 1.00 0.00 H new ATOM 0 HG23 ILE C 51 -8.827 -10.682 -13.553 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -8.525 -11.284 -8.853 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -7.415 -12.415 -9.664 1.00 0.00 H new ATOM 0 HD13 ILE C 51 -6.908 -10.737 -9.356 1.00 0.00 H new