USER MOD reduce.3.24.130724 H: found=0, std=0, add=935, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 933 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=-0.00504 X(o=-0.019,f=0.41) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc= -0.0139 USER MOD Set 2.1: C 11 SER OG : rot 180:sc= 0.314 USER MOD Set 2.2: C 21 THR OG1 : rot -72:sc= 0.336 USER MOD Set 2.3: C 35 ASN : amide:sc= 0.0124 X(o=0.66,f=0.17) USER MOD Set 3.1: A 13 ASN : amide:sc= -0.0297 X(o=-0.03,f=-0.48) USER MOD Set 3.2: A 19 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 11 SER OG : rot 180:sc= 0.372 USER MOD Set 4.2: A 21 THR OG1 : rot -69:sc= 0.402 USER MOD Single : A 1 MET CE :methyl 179:sc= -1.26 (180deg=-1.27) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0536 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= -0.17 X(o=-0.17,f=0) USER MOD Single : A 35 ASN : amide:sc= -0.0573 X(o=-0.057,f=-0.47) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -0.993 X(o=-0.99,f=-0.69) USER MOD Single : A 48 TYR OH : rot 47:sc= 0.254 USER MOD Single : A 49 GLN : amide:sc= 1.05 K(o=1.1,f=0) USER MOD Single : A 52 GLN : amide:sc= -2.62! K(o=-2.6!,f=-1.4) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl 175:sc= -0.892 (180deg=-1.08) 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+ -161:sc= 1.24 (180deg=0.614) USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 HIS : no HD1:sc= -0.877 X(o=-0.88,f=-0.45) USER MOD Single : C 48 TYR OH : rot 32:sc= 0.251 USER MOD Single : C 49 GLN : amide:sc= 0.939 K(o=0.94,f=0) USER MOD Single : C 52 GLN : amide:sc= -2.97! K(o=-3!,f=-1.2) USER MOD Single : C 56 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.420 -7.340 -10.586 1.00 0.00 N ATOM 2 CA MET A 1 3.692 -6.461 -9.655 1.00 0.00 C ATOM 3 C MET A 1 2.441 -7.165 -9.149 1.00 0.00 C ATOM 4 O MET A 1 1.680 -7.703 -9.949 1.00 0.00 O ATOM 5 CB MET A 1 3.304 -5.144 -10.337 1.00 0.00 C ATOM 6 CG MET A 1 2.946 -4.095 -9.285 1.00 0.00 C ATOM 7 SD MET A 1 2.503 -2.474 -9.945 1.00 0.00 S ATOM 8 CE MET A 1 0.872 -2.879 -10.613 1.00 0.00 C ATOM 0 H1 MET A 1 5.273 -6.853 -10.928 1.00 0.00 H new ATOM 0 H2 MET A 1 4.694 -8.215 -10.095 1.00 0.00 H new ATOM 0 H3 MET A 1 3.808 -7.573 -11.394 1.00 0.00 H new ATOM 0 HA MET A 1 4.348 -6.235 -8.814 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.130 -4.787 -10.952 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.457 -5.306 -11.004 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.113 -4.469 -8.690 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.793 -3.976 -8.609 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.427 -1.986 -11.052 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.973 -3.648 -11.379 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.232 -3.247 -9.811 1.00 0.00 H new ATOM 20 N LEU A 2 2.224 -7.167 -7.834 1.00 0.00 N ATOM 21 CA LEU A 2 1.045 -7.780 -7.235 1.00 0.00 C ATOM 22 C LEU A 2 -0.056 -6.718 -7.162 1.00 0.00 C ATOM 23 O LEU A 2 0.226 -5.584 -6.785 1.00 0.00 O ATOM 24 CB LEU A 2 1.434 -8.279 -5.832 1.00 0.00 C ATOM 25 CG LEU A 2 0.614 -9.459 -5.277 1.00 0.00 C ATOM 26 CD1 LEU A 2 0.629 -9.401 -3.751 1.00 0.00 C ATOM 27 CD2 LEU A 2 -0.831 -9.500 -5.752 1.00 0.00 C ATOM 0 H LEU A 2 2.860 -6.744 -7.158 1.00 0.00 H new ATOM 0 HA LEU A 2 0.679 -8.623 -7.821 1.00 0.00 H new ATOM 0 HB2 LEU A 2 2.484 -8.571 -5.851 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.348 -7.445 -5.136 1.00 0.00 H new ATOM 0 HG LEU A 2 1.088 -10.364 -5.657 1.00 0.00 H new ATOM 0 HD11 LEU A 2 0.051 -10.233 -3.350 1.00 0.00 H new ATOM 0 HD12 LEU A 2 1.657 -9.468 -3.394 1.00 0.00 H new ATOM 0 HD13 LEU A 2 0.190 -8.460 -3.418 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -1.334 -10.362 -5.313 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -1.341 -8.587 -5.445 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -0.855 -9.581 -6.839 1.00 0.00 H new ATOM 39 N ILE A 3 -1.302 -7.062 -7.509 1.00 0.00 N ATOM 40 CA ILE A 3 -2.429 -6.136 -7.444 1.00 0.00 C ATOM 41 C ILE A 3 -3.499 -6.682 -6.505 1.00 0.00 C ATOM 42 O ILE A 3 -3.775 -7.881 -6.504 1.00 0.00 O ATOM 43 CB ILE A 3 -3.032 -5.886 -8.840 1.00 0.00 C ATOM 44 CG1 ILE A 3 -2.122 -5.012 -9.708 1.00 0.00 C ATOM 45 CG2 ILE A 3 -4.360 -5.134 -8.728 1.00 0.00 C ATOM 46 CD1 ILE A 3 -1.053 -5.823 -10.423 1.00 0.00 C ATOM 0 H ILE A 3 -1.553 -7.993 -7.843 1.00 0.00 H new ATOM 0 HA ILE A 3 -2.061 -5.184 -7.061 1.00 0.00 H new ATOM 0 HB ILE A 3 -3.161 -6.870 -9.291 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -2.726 -4.482 -10.445 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.645 -4.256 -9.084 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -4.769 -4.968 -9.725 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -5.064 -5.724 -8.141 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -4.194 -4.174 -8.239 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.434 -5.158 -11.025 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -0.430 -6.332 -9.688 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -1.528 -6.561 -11.069 1.00 0.00 H new ATOM 58 N LEU A 4 -4.092 -5.788 -5.711 1.00 0.00 N ATOM 59 CA LEU A 4 -5.167 -6.098 -4.782 1.00 0.00 C ATOM 60 C LEU A 4 -6.316 -5.125 -5.034 1.00 0.00 C ATOM 61 O LEU A 4 -6.145 -4.076 -5.656 1.00 0.00 O ATOM 62 CB LEU A 4 -4.703 -5.938 -3.328 1.00 0.00 C ATOM 63 CG LEU A 4 -4.027 -7.147 -2.671 1.00 0.00 C ATOM 64 CD1 LEU A 4 -4.963 -8.348 -2.614 1.00 0.00 C ATOM 65 CD2 LEU A 4 -2.752 -7.561 -3.387 1.00 0.00 C ATOM 0 H LEU A 4 -3.826 -4.803 -5.700 1.00 0.00 H new ATOM 0 HA LEU A 4 -5.479 -7.131 -4.937 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -4.009 -5.099 -3.285 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.569 -5.666 -2.725 1.00 0.00 H new ATOM 0 HG LEU A 4 -3.773 -6.828 -1.660 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -4.451 -9.187 -2.142 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -5.849 -8.091 -2.034 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.260 -8.627 -3.625 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -2.314 -8.421 -2.881 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -2.984 -7.826 -4.419 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -2.043 -6.733 -3.375 1.00 0.00 H new ATOM 77 N THR A 5 -7.496 -5.490 -4.535 1.00 0.00 N ATOM 78 CA THR A 5 -8.694 -4.676 -4.629 1.00 0.00 C ATOM 79 C THR A 5 -9.358 -4.665 -3.263 1.00 0.00 C ATOM 80 O THR A 5 -9.680 -5.716 -2.710 1.00 0.00 O ATOM 81 CB THR A 5 -9.626 -5.256 -5.693 1.00 0.00 C ATOM 82 OG1 THR A 5 -8.973 -5.226 -6.942 1.00 0.00 O ATOM 83 CG2 THR A 5 -10.924 -4.458 -5.800 1.00 0.00 C ATOM 0 H THR A 5 -7.643 -6.374 -4.048 1.00 0.00 H new ATOM 0 HA THR A 5 -8.452 -3.655 -4.923 1.00 0.00 H new ATOM 0 HB THR A 5 -9.873 -6.278 -5.405 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.564 -5.598 -7.629 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.561 -4.900 -6.566 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.443 -4.477 -4.842 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.696 -3.427 -6.069 1.00 0.00 H new ATOM 91 N ARG A 6 -9.563 -3.469 -2.711 1.00 0.00 N ATOM 92 CA ARG A 6 -10.132 -3.282 -1.384 1.00 0.00 C ATOM 93 C ARG A 6 -10.985 -2.026 -1.403 1.00 0.00 C ATOM 94 O ARG A 6 -11.001 -1.306 -2.401 1.00 0.00 O ATOM 95 CB ARG A 6 -9.005 -3.162 -0.350 1.00 0.00 C ATOM 96 CG ARG A 6 -8.238 -4.479 -0.167 1.00 0.00 C ATOM 97 CD ARG A 6 -9.119 -5.587 0.421 1.00 0.00 C ATOM 98 NE ARG A 6 -9.181 -5.523 1.879 1.00 0.00 N ATOM 99 CZ ARG A 6 -9.840 -6.409 2.633 1.00 0.00 C ATOM 100 NH1 ARG A 6 -10.520 -7.405 2.075 1.00 0.00 N ATOM 101 NH2 ARG A 6 -9.822 -6.305 3.956 1.00 0.00 N ATOM 0 H ARG A 6 -9.334 -2.594 -3.182 1.00 0.00 H new ATOM 0 HA ARG A 6 -10.751 -4.136 -1.109 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -8.312 -2.381 -0.661 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -9.425 -2.853 0.607 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -7.843 -4.804 -1.130 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -7.383 -4.311 0.488 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -10.126 -5.505 0.012 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -8.730 -6.559 0.117 1.00 0.00 H new ATOM 0 HE ARG A 6 -8.694 -4.759 2.348 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -10.544 -7.501 1.060 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -11.018 -8.074 2.662 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -9.304 -5.547 4.401 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -10.326 -6.983 4.528 1.00 0.00 H new ATOM 115 N LYS A 7 -11.696 -1.758 -0.311 1.00 0.00 N ATOM 116 CA LYS A 7 -12.562 -0.594 -0.228 1.00 0.00 C ATOM 117 C LYS A 7 -12.015 0.378 0.801 1.00 0.00 C ATOM 118 O LYS A 7 -11.211 -0.003 1.650 1.00 0.00 O ATOM 119 CB LYS A 7 -13.986 -1.030 0.120 1.00 0.00 C ATOM 120 CG LYS A 7 -14.433 -2.198 -0.761 1.00 0.00 C ATOM 121 CD LYS A 7 -15.959 -2.298 -0.732 1.00 0.00 C ATOM 122 CE LYS A 7 -16.438 -3.636 -1.284 1.00 0.00 C ATOM 123 NZ LYS A 7 -17.904 -3.747 -1.180 1.00 0.00 N ATOM 0 H LYS A 7 -11.687 -2.336 0.530 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.591 -0.087 -1.193 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -14.035 -1.322 1.169 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.669 -0.190 -0.009 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -14.086 -2.051 -1.784 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -13.989 -3.128 -0.405 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -16.314 -2.177 0.291 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -16.390 -1.486 -1.317 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -16.134 -3.735 -2.326 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -15.967 -4.451 -0.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -18.211 -4.665 -1.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -18.188 -3.674 -0.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -18.350 -2.980 -1.723 1.00 0.00 H new ATOM 137 N VAL A 8 -12.450 1.637 0.726 1.00 0.00 N ATOM 138 CA VAL A 8 -11.959 2.645 1.644 1.00 0.00 C ATOM 139 C VAL A 8 -12.356 2.291 3.074 1.00 0.00 C ATOM 140 O VAL A 8 -13.540 2.264 3.411 1.00 0.00 O ATOM 141 CB VAL A 8 -12.412 4.041 1.218 1.00 0.00 C ATOM 142 CG1 VAL A 8 -11.798 4.333 -0.149 1.00 0.00 C ATOM 143 CG2 VAL A 8 -13.917 4.231 1.075 1.00 0.00 C ATOM 0 H VAL A 8 -13.132 1.972 0.046 1.00 0.00 H new ATOM 0 HA VAL A 8 -10.870 2.662 1.614 1.00 0.00 H new ATOM 0 HB VAL A 8 -12.088 4.711 2.014 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -12.104 5.325 -0.481 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -10.711 4.294 -0.076 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -12.140 3.589 -0.868 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -14.127 5.256 0.769 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -14.301 3.542 0.322 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -14.401 4.031 2.031 1.00 0.00 H new ATOM 153 N GLY A 9 -11.353 2.013 3.906 1.00 0.00 N ATOM 154 CA GLY A 9 -11.553 1.572 5.281 1.00 0.00 C ATOM 155 C GLY A 9 -10.875 0.229 5.547 1.00 0.00 C ATOM 156 O GLY A 9 -10.980 -0.305 6.649 1.00 0.00 O ATOM 0 H GLY A 9 -10.371 2.089 3.640 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -11.156 2.322 5.965 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.620 1.488 5.485 1.00 0.00 H new ATOM 160 N GLU A 10 -10.175 -0.323 4.546 1.00 0.00 N ATOM 161 CA GLU A 10 -9.493 -1.604 4.658 1.00 0.00 C ATOM 162 C GLU A 10 -7.979 -1.414 4.593 1.00 0.00 C ATOM 163 O GLU A 10 -7.494 -0.290 4.448 1.00 0.00 O ATOM 164 CB GLU A 10 -9.985 -2.563 3.566 1.00 0.00 C ATOM 165 CG GLU A 10 -11.489 -2.821 3.718 1.00 0.00 C ATOM 166 CD GLU A 10 -11.993 -3.897 2.760 1.00 0.00 C ATOM 167 OE1 GLU A 10 -11.699 -3.787 1.549 1.00 0.00 O ATOM 168 OE2 GLU A 10 -12.676 -4.826 3.249 1.00 0.00 O ATOM 0 H GLU A 10 -10.070 0.117 3.632 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.728 -2.046 5.626 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -9.780 -2.140 2.583 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.440 -3.505 3.628 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.702 -3.123 4.744 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.034 -1.894 3.539 1.00 0.00 H new ATOM 175 N SER A 11 -7.224 -2.513 4.698 1.00 0.00 N ATOM 176 CA SER A 11 -5.773 -2.466 4.808 1.00 0.00 C ATOM 177 C SER A 11 -5.100 -3.602 4.044 1.00 0.00 C ATOM 178 O SER A 11 -5.751 -4.531 3.567 1.00 0.00 O ATOM 179 CB SER A 11 -5.378 -2.529 6.289 1.00 0.00 C ATOM 180 OG SER A 11 -5.893 -1.409 6.973 1.00 0.00 O ATOM 0 H SER A 11 -7.608 -3.458 4.709 1.00 0.00 H new ATOM 0 HA SER A 11 -5.432 -1.531 4.363 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.760 -3.446 6.737 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.292 -2.556 6.384 1.00 0.00 H new ATOM 0 HG SER A 11 -5.638 -1.457 7.918 1.00 0.00 H new ATOM 186 N ILE A 12 -3.769 -3.503 3.934 1.00 0.00 N ATOM 187 CA ILE A 12 -2.884 -4.446 3.259 1.00 0.00 C ATOM 188 C ILE A 12 -1.665 -4.641 4.165 1.00 0.00 C ATOM 189 O ILE A 12 -1.454 -3.843 5.076 1.00 0.00 O ATOM 190 CB ILE A 12 -2.486 -3.866 1.889 1.00 0.00 C ATOM 191 CG1 ILE A 12 -3.701 -3.691 0.967 1.00 0.00 C ATOM 192 CG2 ILE A 12 -1.442 -4.730 1.178 1.00 0.00 C ATOM 193 CD1 ILE A 12 -4.378 -5.016 0.610 1.00 0.00 C ATOM 0 H ILE A 12 -3.258 -2.718 4.338 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.365 -5.408 3.082 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.051 -2.888 2.097 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -4.427 -3.038 1.452 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.386 -3.192 0.051 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -1.192 -4.282 0.216 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -0.544 -4.795 1.792 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.845 -5.730 1.018 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -5.229 -4.825 -0.043 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.665 -5.662 0.098 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -4.722 -5.506 1.521 1.00 0.00 H new ATOM 205 N ASN A 13 -0.858 -5.683 3.940 1.00 0.00 N ATOM 206 CA ASN A 13 0.272 -5.980 4.811 1.00 0.00 C ATOM 207 C ASN A 13 1.493 -6.416 4.006 1.00 0.00 C ATOM 208 O ASN A 13 1.356 -7.030 2.948 1.00 0.00 O ATOM 209 CB ASN A 13 -0.162 -7.063 5.797 1.00 0.00 C ATOM 210 CG ASN A 13 0.822 -7.221 6.947 1.00 0.00 C ATOM 211 OD1 ASN A 13 1.919 -7.742 6.770 1.00 0.00 O ATOM 212 ND2 ASN A 13 0.436 -6.771 8.134 1.00 0.00 N ATOM 0 H ASN A 13 -0.971 -6.332 3.161 1.00 0.00 H new ATOM 0 HA ASN A 13 0.566 -5.083 5.355 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.146 -6.816 6.195 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.259 -8.013 5.271 1.00 0.00 H new ATOM 0 HD21 ASN A 13 1.059 -6.852 8.938 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.484 -6.344 8.243 1.00 0.00 H new ATOM 219 N ILE A 14 2.689 -6.097 4.514 1.00 0.00 N ATOM 220 CA ILE A 14 3.951 -6.391 3.847 1.00 0.00 C ATOM 221 C ILE A 14 5.010 -6.793 4.877 1.00 0.00 C ATOM 222 O ILE A 14 5.011 -6.307 6.009 1.00 0.00 O ATOM 223 CB ILE A 14 4.414 -5.158 3.050 1.00 0.00 C ATOM 224 CG1 ILE A 14 3.356 -4.775 2.006 1.00 0.00 C ATOM 225 CG2 ILE A 14 5.761 -5.437 2.372 1.00 0.00 C ATOM 226 CD1 ILE A 14 3.767 -3.557 1.176 1.00 0.00 C ATOM 0 H ILE A 14 2.803 -5.622 5.410 1.00 0.00 H new ATOM 0 HA ILE A 14 3.809 -7.223 3.158 1.00 0.00 H new ATOM 0 HB ILE A 14 4.541 -4.323 3.739 1.00 0.00 H new ATOM 0 HG12 ILE A 14 3.182 -5.622 1.342 1.00 0.00 H new ATOM 0 HG13 ILE A 14 2.412 -4.566 2.510 1.00 0.00 H new ATOM 0 HG21 ILE A 14 6.076 -4.556 1.812 1.00 0.00 H new ATOM 0 HG22 ILE A 14 6.508 -5.671 3.130 1.00 0.00 H new ATOM 0 HG23 ILE A 14 5.658 -6.282 1.691 1.00 0.00 H new ATOM 0 HD11 ILE A 14 2.984 -3.328 0.453 1.00 0.00 H new ATOM 0 HD12 ILE A 14 3.914 -2.701 1.834 1.00 0.00 H new ATOM 0 HD13 ILE A 14 4.696 -3.773 0.649 1.00 0.00 H new ATOM 238 N GLY A 15 5.917 -7.689 4.475 1.00 0.00 N ATOM 239 CA GLY A 15 7.005 -8.139 5.327 1.00 0.00 C ATOM 240 C GLY A 15 6.479 -8.717 6.635 1.00 0.00 C ATOM 241 O GLY A 15 5.523 -9.492 6.641 1.00 0.00 O ATOM 0 H GLY A 15 5.911 -8.118 3.550 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.592 -8.893 4.803 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.674 -7.305 5.538 1.00 0.00 H new ATOM 245 N ASP A 16 7.115 -8.334 7.745 1.00 0.00 N ATOM 246 CA ASP A 16 6.736 -8.761 9.082 1.00 0.00 C ATOM 247 C ASP A 16 6.625 -7.556 10.019 1.00 0.00 C ATOM 248 O ASP A 16 6.414 -7.725 11.219 1.00 0.00 O ATOM 249 CB ASP A 16 7.757 -9.772 9.608 1.00 0.00 C ATOM 250 CG ASP A 16 7.813 -11.020 8.731 1.00 0.00 C ATOM 251 OD1 ASP A 16 6.949 -11.904 8.927 1.00 0.00 O ATOM 252 OD2 ASP A 16 8.720 -11.083 7.869 1.00 0.00 O ATOM 0 H ASP A 16 7.920 -7.708 7.733 1.00 0.00 H new ATOM 0 HA ASP A 16 5.758 -9.241 9.040 1.00 0.00 H new ATOM 0 HB2 ASP A 16 8.743 -9.309 9.646 1.00 0.00 H new ATOM 0 HB3 ASP A 16 7.498 -10.055 10.628 1.00 0.00 H new ATOM 257 N ASP A 17 6.769 -6.340 9.477 1.00 0.00 N ATOM 258 CA ASP A 17 6.767 -5.112 10.262 1.00 0.00 C ATOM 259 C ASP A 17 6.104 -3.955 9.514 1.00 0.00 C ATOM 260 O ASP A 17 6.242 -2.805 9.933 1.00 0.00 O ATOM 261 CB ASP A 17 8.209 -4.728 10.612 1.00 0.00 C ATOM 262 CG ASP A 17 8.915 -5.803 11.437 1.00 0.00 C ATOM 263 OD1 ASP A 17 8.688 -5.830 12.668 1.00 0.00 O ATOM 264 OD2 ASP A 17 9.678 -6.588 10.832 1.00 0.00 O ATOM 0 H ASP A 17 6.890 -6.186 8.476 1.00 0.00 H new ATOM 0 HA ASP A 17 6.191 -5.299 11.168 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.769 -4.553 9.693 1.00 0.00 H new ATOM 0 HB3 ASP A 17 8.208 -3.790 11.168 1.00 0.00 H new ATOM 269 N ILE A 18 5.388 -4.227 8.417 1.00 0.00 N ATOM 270 CA ILE A 18 4.776 -3.160 7.628 1.00 0.00 C ATOM 271 C ILE A 18 3.307 -3.473 7.360 1.00 0.00 C ATOM 272 O ILE A 18 2.943 -4.604 7.046 1.00 0.00 O ATOM 273 CB ILE A 18 5.550 -2.985 6.314 1.00 0.00 C ATOM 274 CG1 ILE A 18 7.023 -2.672 6.601 1.00 0.00 C ATOM 275 CG2 ILE A 18 4.918 -1.875 5.465 1.00 0.00 C ATOM 276 CD1 ILE A 18 7.852 -2.639 5.317 1.00 0.00 C ATOM 0 H ILE A 18 5.221 -5.168 8.061 1.00 0.00 H new ATOM 0 HA ILE A 18 4.821 -2.226 8.187 1.00 0.00 H new ATOM 0 HB ILE A 18 5.499 -3.918 5.753 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.099 -1.710 7.109 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.430 -3.423 7.278 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.478 -1.763 4.537 1.00 0.00 H new ATOM 0 HG22 ILE A 18 3.885 -2.136 5.236 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.941 -0.936 6.018 1.00 0.00 H new ATOM 0 HD11 ILE A 18 8.891 -2.414 5.560 1.00 0.00 H new ATOM 0 HD12 ILE A 18 7.797 -3.609 4.823 1.00 0.00 H new ATOM 0 HD13 ILE A 18 7.461 -1.870 4.651 1.00 0.00 H new ATOM 288 N THR A 19 2.460 -2.448 7.486 1.00 0.00 N ATOM 289 CA THR A 19 1.035 -2.548 7.206 1.00 0.00 C ATOM 290 C THR A 19 0.591 -1.228 6.587 1.00 0.00 C ATOM 291 O THR A 19 1.136 -0.181 6.920 1.00 0.00 O ATOM 292 CB THR A 19 0.265 -2.835 8.498 1.00 0.00 C ATOM 293 OG1 THR A 19 0.868 -3.892 9.206 1.00 0.00 O ATOM 294 CG2 THR A 19 -1.182 -3.229 8.212 1.00 0.00 C ATOM 0 H THR A 19 2.752 -1.519 7.788 1.00 0.00 H new ATOM 0 HA THR A 19 0.833 -3.367 6.516 1.00 0.00 H new ATOM 0 HB THR A 19 0.284 -1.918 9.087 1.00 0.00 H new ATOM 0 HG1 THR A 19 0.365 -4.063 10.030 1.00 0.00 H new ATOM 0 HG21 THR A 19 -1.698 -3.425 9.152 1.00 0.00 H new ATOM 0 HG22 THR A 19 -1.683 -2.417 7.686 1.00 0.00 H new ATOM 0 HG23 THR A 19 -1.199 -4.127 7.594 1.00 0.00 H new ATOM 302 N ILE A 20 -0.395 -1.269 5.689 1.00 0.00 N ATOM 303 CA ILE A 20 -0.808 -0.109 4.910 1.00 0.00 C ATOM 304 C ILE A 20 -2.330 -0.006 4.934 1.00 0.00 C ATOM 305 O ILE A 20 -3.016 -1.019 5.051 1.00 0.00 O ATOM 306 CB ILE A 20 -0.303 -0.256 3.466 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.177 -0.650 3.397 1.00 0.00 C ATOM 308 CG2 ILE A 20 -0.522 1.041 2.681 1.00 0.00 C ATOM 309 CD1 ILE A 20 2.130 0.423 3.915 1.00 0.00 C ATOM 0 H ILE A 20 -0.929 -2.113 5.484 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.383 0.799 5.339 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.884 -1.062 3.017 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.327 -1.563 3.973 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.433 -0.880 2.363 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.158 0.915 1.661 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.586 1.278 2.659 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.021 1.854 3.163 1.00 0.00 H new ATOM 0 HD11 ILE A 20 3.157 0.068 3.833 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.011 1.331 3.324 1.00 0.00 H new ATOM 0 HD13 ILE A 20 1.903 0.638 4.959 1.00 0.00 H new ATOM 321 N THR A 21 -2.864 1.211 4.822 1.00 0.00 N ATOM 322 CA THR A 21 -4.297 1.445 4.912 1.00 0.00 C ATOM 323 C THR A 21 -4.744 2.469 3.871 1.00 0.00 C ATOM 324 O THR A 21 -3.971 3.343 3.478 1.00 0.00 O ATOM 325 CB THR A 21 -4.624 1.948 6.324 1.00 0.00 C ATOM 326 OG1 THR A 21 -4.132 1.036 7.281 1.00 0.00 O ATOM 327 CG2 THR A 21 -6.123 2.108 6.547 1.00 0.00 C ATOM 0 H THR A 21 -2.314 2.056 4.667 1.00 0.00 H new ATOM 0 HA THR A 21 -4.829 0.514 4.716 1.00 0.00 H new ATOM 0 HB THR A 21 -4.151 2.924 6.431 1.00 0.00 H new ATOM 0 HG1 THR A 21 -4.646 0.203 7.234 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.304 2.466 7.561 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.523 2.827 5.832 1.00 0.00 H new ATOM 0 HG23 THR A 21 -6.616 1.146 6.409 1.00 0.00 H new ATOM 335 N ILE A 22 -5.995 2.354 3.423 1.00 0.00 N ATOM 336 CA ILE A 22 -6.597 3.279 2.473 1.00 0.00 C ATOM 337 C ILE A 22 -7.650 4.101 3.212 1.00 0.00 C ATOM 338 O ILE A 22 -8.736 3.607 3.509 1.00 0.00 O ATOM 339 CB ILE A 22 -7.149 2.512 1.257 1.00 0.00 C ATOM 340 CG1 ILE A 22 -8.043 3.389 0.373 1.00 0.00 C ATOM 341 CG2 ILE A 22 -7.943 1.262 1.650 1.00 0.00 C ATOM 342 CD1 ILE A 22 -7.287 4.586 -0.196 1.00 0.00 C ATOM 0 H ILE A 22 -6.623 1.605 3.716 1.00 0.00 H new ATOM 0 HA ILE A 22 -5.858 3.971 2.069 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.264 2.209 0.698 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.442 2.790 -0.446 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -8.894 3.741 0.955 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -8.306 0.764 0.751 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.298 0.582 2.206 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -8.790 1.550 2.273 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -7.959 5.180 -0.816 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -6.910 5.200 0.622 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.451 4.234 -0.801 1.00 0.00 H new ATOM 354 N LEU A 23 -7.328 5.364 3.517 1.00 0.00 N ATOM 355 CA LEU A 23 -8.208 6.193 4.324 1.00 0.00 C ATOM 356 C LEU A 23 -9.450 6.598 3.533 1.00 0.00 C ATOM 357 O LEU A 23 -10.539 6.671 4.101 1.00 0.00 O ATOM 358 CB LEU A 23 -7.463 7.436 4.815 1.00 0.00 C ATOM 359 CG LEU A 23 -6.215 7.096 5.644 1.00 0.00 C ATOM 360 CD1 LEU A 23 -5.732 8.359 6.339 1.00 0.00 C ATOM 361 CD2 LEU A 23 -6.501 6.027 6.696 1.00 0.00 C ATOM 0 H LEU A 23 -6.469 5.825 3.216 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.528 5.611 5.188 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.169 8.040 3.957 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -8.138 8.044 5.417 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.455 6.704 4.968 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.846 8.132 6.932 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -5.486 9.114 5.592 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.518 8.738 6.992 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -5.591 5.818 7.259 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.274 6.384 7.376 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.842 5.115 6.205 1.00 0.00 H new ATOM 373 N GLY A 24 -9.295 6.858 2.231 1.00 0.00 N ATOM 374 CA GLY A 24 -10.443 7.041 1.363 1.00 0.00 C ATOM 375 C GLY A 24 -10.161 7.849 0.102 1.00 0.00 C ATOM 376 O GLY A 24 -9.061 8.361 -0.099 1.00 0.00 O ATOM 0 H GLY A 24 -8.391 6.944 1.766 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -10.823 6.061 1.074 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -11.233 7.536 1.927 1.00 0.00 H new ATOM 380 N VAL A 25 -11.189 7.949 -0.742 1.00 0.00 N ATOM 381 CA VAL A 25 -11.121 8.650 -2.014 1.00 0.00 C ATOM 382 C VAL A 25 -11.147 10.166 -1.818 1.00 0.00 C ATOM 383 O VAL A 25 -11.530 10.666 -0.759 1.00 0.00 O ATOM 384 CB VAL A 25 -12.290 8.232 -2.918 1.00 0.00 C ATOM 385 CG1 VAL A 25 -12.344 6.713 -3.087 1.00 0.00 C ATOM 386 CG2 VAL A 25 -13.633 8.701 -2.355 1.00 0.00 C ATOM 0 H VAL A 25 -12.103 7.538 -0.553 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.178 8.379 -2.488 1.00 0.00 H new ATOM 0 HB VAL A 25 -12.116 8.705 -3.884 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -13.182 6.448 -3.732 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -11.415 6.364 -3.537 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -12.474 6.243 -2.112 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -14.436 8.387 -3.021 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -13.787 8.263 -1.369 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -13.634 9.788 -2.273 1.00 0.00 H new ATOM 396 N SER A 26 -10.734 10.886 -2.860 1.00 0.00 N ATOM 397 CA SER A 26 -10.756 12.337 -2.930 1.00 0.00 C ATOM 398 C SER A 26 -10.923 12.724 -4.400 1.00 0.00 C ATOM 399 O SER A 26 -10.194 13.569 -4.915 1.00 0.00 O ATOM 400 CB SER A 26 -9.453 12.916 -2.360 1.00 0.00 C ATOM 401 OG SER A 26 -9.301 12.554 -1.005 1.00 0.00 O ATOM 0 H SER A 26 -10.363 10.455 -3.706 1.00 0.00 H new ATOM 0 HA SER A 26 -11.579 12.739 -2.339 1.00 0.00 H new ATOM 0 HB2 SER A 26 -8.603 12.551 -2.937 1.00 0.00 H new ATOM 0 HB3 SER A 26 -9.459 14.002 -2.454 1.00 0.00 H new ATOM 0 HG SER A 26 -8.465 12.930 -0.658 1.00 0.00 H new ATOM 407 N GLY A 27 -11.888 12.094 -5.076 1.00 0.00 N ATOM 408 CA GLY A 27 -12.054 12.253 -6.509 1.00 0.00 C ATOM 409 C GLY A 27 -11.003 11.397 -7.209 1.00 0.00 C ATOM 410 O GLY A 27 -10.801 10.238 -6.845 1.00 0.00 O ATOM 0 H GLY A 27 -12.566 11.467 -4.643 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -13.056 11.948 -6.812 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -11.941 13.300 -6.791 1.00 0.00 H new ATOM 414 N GLN A 28 -10.332 11.964 -8.209 1.00 0.00 N ATOM 415 CA GLN A 28 -9.207 11.303 -8.856 1.00 0.00 C ATOM 416 C GLN A 28 -8.016 11.236 -7.892 1.00 0.00 C ATOM 417 O GLN A 28 -7.011 10.594 -8.195 1.00 0.00 O ATOM 418 CB GLN A 28 -8.869 12.072 -10.139 1.00 0.00 C ATOM 419 CG GLN A 28 -7.743 11.408 -10.934 1.00 0.00 C ATOM 420 CD GLN A 28 -7.611 12.035 -12.319 1.00 0.00 C ATOM 421 OE1 GLN A 28 -7.794 11.366 -13.331 1.00 0.00 O ATOM 422 NE2 GLN A 28 -7.290 13.322 -12.381 1.00 0.00 N ATOM 0 H GLN A 28 -10.551 12.885 -8.589 1.00 0.00 H new ATOM 0 HA GLN A 28 -9.460 10.277 -9.122 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -9.760 12.142 -10.764 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -8.578 13.091 -9.883 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -6.802 11.509 -10.393 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -7.941 10.341 -11.031 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -7.144 13.853 -11.523 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -7.190 13.779 -13.287 1.00 0.00 H new ATOM 431 N GLN A 29 -8.125 11.891 -6.729 1.00 0.00 N ATOM 432 CA GLN A 29 -7.096 11.832 -5.703 1.00 0.00 C ATOM 433 C GLN A 29 -7.483 10.799 -4.647 1.00 0.00 C ATOM 434 O GLN A 29 -8.624 10.342 -4.593 1.00 0.00 O ATOM 435 CB GLN A 29 -6.880 13.197 -5.053 1.00 0.00 C ATOM 436 CG GLN A 29 -6.589 14.307 -6.060 1.00 0.00 C ATOM 437 CD GLN A 29 -6.234 15.579 -5.304 1.00 0.00 C ATOM 438 OE1 GLN A 29 -7.099 16.387 -4.986 1.00 0.00 O ATOM 439 NE2 GLN A 29 -4.949 15.761 -5.015 1.00 0.00 N ATOM 0 H GLN A 29 -8.927 12.471 -6.481 1.00 0.00 H new ATOM 0 HA GLN A 29 -6.158 11.537 -6.174 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.767 13.462 -4.477 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.051 13.129 -4.348 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.767 14.016 -6.715 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.458 14.477 -6.696 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.259 15.065 -5.297 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -4.653 16.597 -4.511 1.00 0.00 H new ATOM 448 N VAL A 30 -6.519 10.440 -3.804 1.00 0.00 N ATOM 449 CA VAL A 30 -6.638 9.382 -2.816 1.00 0.00 C ATOM 450 C VAL A 30 -5.740 9.705 -1.623 1.00 0.00 C ATOM 451 O VAL A 30 -4.633 10.215 -1.809 1.00 0.00 O ATOM 452 CB VAL A 30 -6.169 8.070 -3.466 1.00 0.00 C ATOM 453 CG1 VAL A 30 -5.923 6.982 -2.427 1.00 0.00 C ATOM 454 CG2 VAL A 30 -7.183 7.537 -4.478 1.00 0.00 C ATOM 0 H VAL A 30 -5.606 10.894 -3.793 1.00 0.00 H new ATOM 0 HA VAL A 30 -7.669 9.290 -2.475 1.00 0.00 H new ATOM 0 HB VAL A 30 -5.237 8.311 -3.977 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.593 6.071 -2.926 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -5.154 7.313 -1.729 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.846 6.784 -1.882 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.810 6.609 -4.912 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -8.132 7.348 -3.977 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -7.331 8.274 -5.268 1.00 0.00 H new ATOM 464 N ARG A 31 -6.205 9.413 -0.404 1.00 0.00 N ATOM 465 CA ARG A 31 -5.368 9.519 0.784 1.00 0.00 C ATOM 466 C ARG A 31 -5.208 8.134 1.392 1.00 0.00 C ATOM 467 O ARG A 31 -6.168 7.378 1.542 1.00 0.00 O ATOM 468 CB ARG A 31 -5.924 10.523 1.802 1.00 0.00 C ATOM 469 CG ARG A 31 -5.059 10.462 3.069 1.00 0.00 C ATOM 470 CD ARG A 31 -5.384 11.530 4.121 1.00 0.00 C ATOM 471 NE ARG A 31 -4.863 12.847 3.734 1.00 0.00 N ATOM 472 CZ ARG A 31 -5.259 14.000 4.273 1.00 0.00 C ATOM 473 NH1 ARG A 31 -6.122 14.033 5.283 1.00 0.00 N ATOM 474 NH2 ARG A 31 -4.784 15.146 3.799 1.00 0.00 N ATOM 0 H ARG A 31 -7.159 9.101 -0.219 1.00 0.00 H new ATOM 0 HA ARG A 31 -4.391 9.905 0.493 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -5.914 11.530 1.385 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -6.961 10.286 2.040 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -5.174 9.478 3.523 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -4.012 10.561 2.782 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -6.464 11.591 4.257 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -4.958 11.237 5.081 1.00 0.00 H new ATOM 0 HE ARG A 31 -4.151 12.882 3.004 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -6.496 13.163 5.663 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.410 14.928 5.679 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.119 15.141 3.026 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.084 16.031 4.208 1.00 0.00 H new ATOM 488 N ILE A 32 -3.962 7.822 1.742 1.00 0.00 N ATOM 489 CA ILE A 32 -3.544 6.528 2.255 1.00 0.00 C ATOM 490 C ILE A 32 -2.651 6.712 3.475 1.00 0.00 C ATOM 491 O ILE A 32 -2.037 7.764 3.650 1.00 0.00 O ATOM 492 CB ILE A 32 -2.788 5.771 1.156 1.00 0.00 C ATOM 493 CG1 ILE A 32 -1.813 6.719 0.438 1.00 0.00 C ATOM 494 CG2 ILE A 32 -3.790 5.165 0.173 1.00 0.00 C ATOM 495 CD1 ILE A 32 -1.006 5.997 -0.633 1.00 0.00 C ATOM 0 H ILE A 32 -3.193 8.488 1.672 1.00 0.00 H new ATOM 0 HA ILE A 32 -4.422 5.954 2.553 1.00 0.00 H new ATOM 0 HB ILE A 32 -2.206 4.964 1.601 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.371 7.537 -0.017 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.135 7.163 1.167 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -3.253 4.627 -0.608 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -4.448 4.475 0.702 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.385 5.960 -0.277 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.330 6.702 -1.116 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -0.427 5.195 -0.174 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -1.683 5.576 -1.377 1.00 0.00 H new ATOM 507 N GLY A 33 -2.587 5.684 4.320 1.00 0.00 N ATOM 508 CA GLY A 33 -1.788 5.713 5.534 1.00 0.00 C ATOM 509 C GLY A 33 -0.858 4.511 5.587 1.00 0.00 C ATOM 510 O GLY A 33 -1.043 3.531 4.864 1.00 0.00 O ATOM 0 H GLY A 33 -3.090 4.808 4.178 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -1.205 6.633 5.571 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -2.441 5.714 6.407 1.00 0.00 H new ATOM 514 N ILE A 34 0.155 4.587 6.450 1.00 0.00 N ATOM 515 CA ILE A 34 1.211 3.593 6.530 1.00 0.00 C ATOM 516 C ILE A 34 1.539 3.329 7.995 1.00 0.00 C ATOM 517 O ILE A 34 1.530 4.243 8.818 1.00 0.00 O ATOM 518 CB ILE A 34 2.445 4.118 5.787 1.00 0.00 C ATOM 519 CG1 ILE A 34 2.111 4.282 4.299 1.00 0.00 C ATOM 520 CG2 ILE A 34 3.640 3.175 5.972 1.00 0.00 C ATOM 521 CD1 ILE A 34 3.257 4.906 3.503 1.00 0.00 C ATOM 0 H ILE A 34 0.261 5.351 7.118 1.00 0.00 H new ATOM 0 HA ILE A 34 0.890 2.659 6.069 1.00 0.00 H new ATOM 0 HB ILE A 34 2.722 5.087 6.203 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.868 3.307 3.876 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.222 4.904 4.197 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.502 3.571 5.435 1.00 0.00 H new ATOM 0 HG22 ILE A 34 3.879 3.094 7.032 1.00 0.00 H new ATOM 0 HG23 ILE A 34 3.390 2.189 5.580 1.00 0.00 H new ATOM 0 HD11 ILE A 34 2.965 4.998 2.457 1.00 0.00 H new ATOM 0 HD12 ILE A 34 3.484 5.893 3.905 1.00 0.00 H new ATOM 0 HD13 ILE A 34 4.140 4.272 3.579 1.00 0.00 H new ATOM 533 N ASN A 35 1.832 2.066 8.305 1.00 0.00 N ATOM 534 CA ASN A 35 2.127 1.611 9.649 1.00 0.00 C ATOM 535 C ASN A 35 3.411 0.789 9.625 1.00 0.00 C ATOM 536 O ASN A 35 3.393 -0.438 9.736 1.00 0.00 O ATOM 537 CB ASN A 35 0.942 0.820 10.202 1.00 0.00 C ATOM 538 CG ASN A 35 -0.267 1.716 10.428 1.00 0.00 C ATOM 539 OD1 ASN A 35 -0.341 2.421 11.428 1.00 0.00 O ATOM 540 ND2 ASN A 35 -1.223 1.694 9.499 1.00 0.00 N ATOM 0 H ASN A 35 1.870 1.321 7.609 1.00 0.00 H new ATOM 0 HA ASN A 35 2.283 2.460 10.314 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.680 0.021 9.508 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.226 0.346 11.141 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -2.053 2.278 9.607 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -1.125 1.094 8.680 1.00 0.00 H new ATOM 547 N ALA A 36 4.528 1.502 9.476 1.00 0.00 N ATOM 548 CA ALA A 36 5.870 0.952 9.529 1.00 0.00 C ATOM 549 C ALA A 36 6.675 1.759 10.545 1.00 0.00 C ATOM 550 O ALA A 36 6.321 2.904 10.833 1.00 0.00 O ATOM 551 CB ALA A 36 6.496 1.065 8.138 1.00 0.00 C ATOM 0 H ALA A 36 4.516 2.508 9.310 1.00 0.00 H new ATOM 0 HA ALA A 36 5.857 -0.096 9.829 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.506 0.656 8.159 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.893 0.507 7.421 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.535 2.113 7.841 1.00 0.00 H new ATOM 557 N PRO A 37 7.747 1.186 11.101 1.00 0.00 N ATOM 558 CA PRO A 37 8.588 1.873 12.056 1.00 0.00 C ATOM 559 C PRO A 37 9.488 2.857 11.321 1.00 0.00 C ATOM 560 O PRO A 37 9.774 2.680 10.140 1.00 0.00 O ATOM 561 CB PRO A 37 9.413 0.762 12.703 1.00 0.00 C ATOM 562 CG PRO A 37 9.560 -0.261 11.575 1.00 0.00 C ATOM 563 CD PRO A 37 8.225 -0.157 10.844 1.00 0.00 C ATOM 0 HA PRO A 37 8.024 2.443 12.794 1.00 0.00 H new ATOM 0 HB2 PRO A 37 10.381 1.126 13.046 1.00 0.00 H new ATOM 0 HB3 PRO A 37 8.907 0.337 13.570 1.00 0.00 H new ATOM 0 HG2 PRO A 37 10.398 -0.023 10.921 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.732 -1.266 11.961 1.00 0.00 H new ATOM 0 HD2 PRO A 37 8.348 -0.332 9.775 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.518 -0.902 11.210 1.00 0.00 H new ATOM 571 N LYS A 38 9.945 3.900 12.015 1.00 0.00 N ATOM 572 CA LYS A 38 10.891 4.842 11.427 1.00 0.00 C ATOM 573 C LYS A 38 12.256 4.186 11.239 1.00 0.00 C ATOM 574 O LYS A 38 13.189 4.811 10.739 1.00 0.00 O ATOM 575 CB LYS A 38 10.962 6.110 12.279 1.00 0.00 C ATOM 576 CG LYS A 38 9.629 6.837 12.087 1.00 0.00 C ATOM 577 CD LYS A 38 9.636 8.229 12.711 1.00 0.00 C ATOM 578 CE LYS A 38 9.691 8.134 14.233 1.00 0.00 C ATOM 579 NZ LYS A 38 9.595 9.469 14.852 1.00 0.00 N ATOM 0 H LYS A 38 9.677 4.111 12.976 1.00 0.00 H new ATOM 0 HA LYS A 38 10.545 5.134 10.436 1.00 0.00 H new ATOM 0 HB2 LYS A 38 11.122 5.864 13.329 1.00 0.00 H new ATOM 0 HB3 LYS A 38 11.796 6.740 11.969 1.00 0.00 H new ATOM 0 HG2 LYS A 38 9.412 6.919 11.022 1.00 0.00 H new ATOM 0 HG3 LYS A 38 8.828 6.246 12.531 1.00 0.00 H new ATOM 0 HD2 LYS A 38 10.494 8.793 12.345 1.00 0.00 H new ATOM 0 HD3 LYS A 38 8.742 8.774 12.407 1.00 0.00 H new ATOM 0 HE2 LYS A 38 8.876 7.504 14.591 1.00 0.00 H new ATOM 0 HE3 LYS A 38 10.622 7.655 14.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 9.635 9.375 15.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 10.387 10.060 14.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 8.696 9.914 14.579 1.00 0.00 H new ATOM 593 N ASP A 39 12.367 2.920 11.640 1.00 0.00 N ATOM 594 CA ASP A 39 13.541 2.109 11.371 1.00 0.00 C ATOM 595 C ASP A 39 13.617 1.773 9.877 1.00 0.00 C ATOM 596 O ASP A 39 14.648 1.292 9.413 1.00 0.00 O ATOM 597 CB ASP A 39 13.491 0.827 12.207 1.00 0.00 C ATOM 598 CG ASP A 39 13.645 1.142 13.694 1.00 0.00 C ATOM 599 OD1 ASP A 39 14.806 1.292 14.134 1.00 0.00 O ATOM 600 OD2 ASP A 39 12.605 1.228 14.377 1.00 0.00 O ATOM 0 H ASP A 39 11.639 2.432 12.162 1.00 0.00 H new ATOM 0 HA ASP A 39 14.434 2.671 11.645 1.00 0.00 H new ATOM 0 HB2 ASP A 39 12.545 0.313 12.036 1.00 0.00 H new ATOM 0 HB3 ASP A 39 14.284 0.150 11.890 1.00 0.00 H new ATOM 605 N VAL A 40 12.539 2.031 9.125 1.00 0.00 N ATOM 606 CA VAL A 40 12.554 1.914 7.676 1.00 0.00 C ATOM 607 C VAL A 40 12.023 3.200 7.050 1.00 0.00 C ATOM 608 O VAL A 40 11.111 3.846 7.574 1.00 0.00 O ATOM 609 CB VAL A 40 11.765 0.686 7.212 1.00 0.00 C ATOM 610 CG1 VAL A 40 12.288 -0.579 7.889 1.00 0.00 C ATOM 611 CG2 VAL A 40 10.269 0.819 7.484 1.00 0.00 C ATOM 0 H VAL A 40 11.641 2.325 9.509 1.00 0.00 H new ATOM 0 HA VAL A 40 13.582 1.771 7.342 1.00 0.00 H new ATOM 0 HB VAL A 40 11.908 0.615 6.134 1.00 0.00 H new ATOM 0 HG11 VAL A 40 11.714 -1.439 7.545 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.339 -0.719 7.636 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.185 -0.482 8.970 1.00 0.00 H new ATOM 0 HG21 VAL A 40 9.755 -0.077 7.137 1.00 0.00 H new ATOM 0 HG22 VAL A 40 10.103 0.941 8.554 1.00 0.00 H new ATOM 0 HG23 VAL A 40 9.879 1.689 6.955 1.00 0.00 H new ATOM 621 N ALA A 41 12.610 3.566 5.912 1.00 0.00 N ATOM 622 CA ALA A 41 12.284 4.794 5.205 1.00 0.00 C ATOM 623 C ALA A 41 10.894 4.707 4.579 1.00 0.00 C ATOM 624 O ALA A 41 10.483 3.645 4.111 1.00 0.00 O ATOM 625 CB ALA A 41 13.337 5.026 4.124 1.00 0.00 C ATOM 0 H ALA A 41 13.332 3.010 5.454 1.00 0.00 H new ATOM 0 HA ALA A 41 12.280 5.627 5.907 1.00 0.00 H new ATOM 0 HB1 ALA A 41 13.107 5.944 3.583 1.00 0.00 H new ATOM 0 HB2 ALA A 41 14.320 5.114 4.587 1.00 0.00 H new ATOM 0 HB3 ALA A 41 13.336 4.186 3.429 1.00 0.00 H new ATOM 631 N VAL A 42 10.177 5.831 4.569 1.00 0.00 N ATOM 632 CA VAL A 42 8.876 5.950 3.925 1.00 0.00 C ATOM 633 C VAL A 42 8.725 7.376 3.415 1.00 0.00 C ATOM 634 O VAL A 42 8.682 8.305 4.221 1.00 0.00 O ATOM 635 CB VAL A 42 7.754 5.644 4.922 1.00 0.00 C ATOM 636 CG1 VAL A 42 6.403 5.768 4.228 1.00 0.00 C ATOM 637 CG2 VAL A 42 7.839 4.233 5.503 1.00 0.00 C ATOM 0 H VAL A 42 10.491 6.693 5.015 1.00 0.00 H new ATOM 0 HA VAL A 42 8.809 5.238 3.102 1.00 0.00 H new ATOM 0 HB VAL A 42 7.864 6.362 5.734 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.607 5.550 4.940 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.281 6.782 3.847 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.353 5.061 3.400 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.017 4.077 6.202 1.00 0.00 H new ATOM 0 HG22 VAL A 42 7.773 3.503 4.696 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.788 4.111 6.026 1.00 0.00 H new ATOM 647 N HIS A 43 8.644 7.543 2.088 1.00 0.00 N ATOM 648 CA HIS A 43 8.535 8.861 1.463 1.00 0.00 C ATOM 649 C HIS A 43 7.752 8.787 0.152 1.00 0.00 C ATOM 650 O HIS A 43 7.524 7.707 -0.392 1.00 0.00 O ATOM 651 CB HIS A 43 9.925 9.426 1.141 1.00 0.00 C ATOM 652 CG HIS A 43 10.941 9.370 2.255 1.00 0.00 C ATOM 653 ND1 HIS A 43 11.316 10.455 3.048 1.00 0.00 N ATOM 654 CD2 HIS A 43 11.647 8.267 2.649 1.00 0.00 C ATOM 655 CE1 HIS A 43 12.238 9.980 3.902 1.00 0.00 C ATOM 656 NE2 HIS A 43 12.454 8.670 3.685 1.00 0.00 N ATOM 0 H HIS A 43 8.652 6.770 1.423 1.00 0.00 H new ATOM 0 HA HIS A 43 8.016 9.505 2.173 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.325 8.884 0.285 1.00 0.00 H new ATOM 0 HB3 HIS A 43 9.810 10.466 0.834 1.00 0.00 H new ATOM 0 HD2 HIS A 43 11.583 7.274 2.228 1.00 0.00 H new ATOM 0 HE1 HIS A 43 12.737 10.568 4.658 1.00 0.00 H new ATOM 0 HE2 HIS A 43 13.105 8.078 4.201 1.00 0.00 H new ATOM 664 N ARG A 44 7.346 9.955 -0.350 1.00 0.00 N ATOM 665 CA ARG A 44 6.735 10.103 -1.669 1.00 0.00 C ATOM 666 C ARG A 44 7.764 9.762 -2.748 1.00 0.00 C ATOM 667 O ARG A 44 8.961 9.949 -2.541 1.00 0.00 O ATOM 668 CB ARG A 44 6.246 11.549 -1.815 1.00 0.00 C ATOM 669 CG ARG A 44 7.452 12.493 -1.775 1.00 0.00 C ATOM 670 CD ARG A 44 7.107 13.903 -1.289 1.00 0.00 C ATOM 671 NE ARG A 44 6.753 14.799 -2.390 1.00 0.00 N ATOM 672 CZ ARG A 44 6.656 16.127 -2.263 1.00 0.00 C ATOM 673 NH1 ARG A 44 6.873 16.716 -1.091 1.00 0.00 N ATOM 674 NH2 ARG A 44 6.341 16.880 -3.311 1.00 0.00 N ATOM 0 H ARG A 44 7.434 10.836 0.157 1.00 0.00 H new ATOM 0 HA ARG A 44 5.889 9.425 -1.781 1.00 0.00 H new ATOM 0 HB2 ARG A 44 5.705 11.670 -2.753 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.550 11.793 -1.012 1.00 0.00 H new ATOM 0 HG2 ARG A 44 8.214 12.068 -1.122 1.00 0.00 H new ATOM 0 HG3 ARG A 44 7.887 12.557 -2.773 1.00 0.00 H new ATOM 0 HD2 ARG A 44 6.276 13.849 -0.586 1.00 0.00 H new ATOM 0 HD3 ARG A 44 7.957 14.316 -0.746 1.00 0.00 H new ATOM 0 HE ARG A 44 6.570 14.388 -3.305 1.00 0.00 H new ATOM 0 HH11 ARG A 44 7.117 16.154 -0.275 1.00 0.00 H new ATOM 0 HH12 ARG A 44 6.796 17.730 -1.008 1.00 0.00 H new ATOM 0 HH21 ARG A 44 6.172 16.446 -4.218 1.00 0.00 H new ATOM 0 HH22 ARG A 44 6.268 17.892 -3.208 1.00 0.00 H new ATOM 688 N GLU A 45 7.323 9.262 -3.905 1.00 0.00 N ATOM 689 CA GLU A 45 8.256 8.921 -4.976 1.00 0.00 C ATOM 690 C GLU A 45 8.912 10.169 -5.567 1.00 0.00 C ATOM 691 O GLU A 45 9.991 10.082 -6.151 1.00 0.00 O ATOM 692 CB GLU A 45 7.539 8.087 -6.043 1.00 0.00 C ATOM 693 CG GLU A 45 6.511 8.882 -6.862 1.00 0.00 C ATOM 694 CD GLU A 45 7.144 9.675 -8.007 1.00 0.00 C ATOM 695 OE1 GLU A 45 7.956 9.076 -8.749 1.00 0.00 O ATOM 696 OE2 GLU A 45 6.817 10.876 -8.130 1.00 0.00 O ATOM 0 H GLU A 45 6.341 9.087 -4.120 1.00 0.00 H new ATOM 0 HA GLU A 45 9.063 8.319 -4.559 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.281 7.664 -6.720 1.00 0.00 H new ATOM 0 HB3 GLU A 45 7.036 7.250 -5.559 1.00 0.00 H new ATOM 0 HG2 GLU A 45 5.770 8.195 -7.270 1.00 0.00 H new ATOM 0 HG3 GLU A 45 5.981 9.568 -6.202 1.00 0.00 H new ATOM 703 N GLU A 46 8.263 11.327 -5.418 1.00 0.00 N ATOM 704 CA GLU A 46 8.743 12.591 -5.960 1.00 0.00 C ATOM 705 C GLU A 46 9.930 13.147 -5.163 1.00 0.00 C ATOM 706 O GLU A 46 10.543 14.131 -5.575 1.00 0.00 O ATOM 707 CB GLU A 46 7.564 13.574 -5.963 1.00 0.00 C ATOM 708 CG GLU A 46 7.875 14.851 -6.740 1.00 0.00 C ATOM 709 CD GLU A 46 6.623 15.709 -6.887 1.00 0.00 C ATOM 710 OE1 GLU A 46 5.945 15.916 -5.855 1.00 0.00 O ATOM 711 OE2 GLU A 46 6.356 16.153 -8.027 1.00 0.00 O ATOM 0 H GLU A 46 7.381 11.409 -4.912 1.00 0.00 H new ATOM 0 HA GLU A 46 9.112 12.437 -6.974 1.00 0.00 H new ATOM 0 HB2 GLU A 46 6.691 13.089 -6.400 1.00 0.00 H new ATOM 0 HB3 GLU A 46 7.305 13.831 -4.936 1.00 0.00 H new ATOM 0 HG2 GLU A 46 8.651 15.417 -6.225 1.00 0.00 H new ATOM 0 HG3 GLU A 46 8.266 14.597 -7.725 1.00 0.00 H new ATOM 718 N ILE A 47 10.267 12.530 -4.026 1.00 0.00 N ATOM 719 CA ILE A 47 11.354 13.002 -3.175 1.00 0.00 C ATOM 720 C ILE A 47 12.263 11.844 -2.785 1.00 0.00 C ATOM 721 O ILE A 47 13.426 12.077 -2.467 1.00 0.00 O ATOM 722 CB ILE A 47 10.769 13.721 -1.945 1.00 0.00 C ATOM 723 CG1 ILE A 47 10.403 15.166 -2.322 1.00 0.00 C ATOM 724 CG2 ILE A 47 11.702 13.713 -0.733 1.00 0.00 C ATOM 725 CD1 ILE A 47 10.184 16.052 -1.090 1.00 0.00 C ATOM 0 H ILE A 47 9.796 11.696 -3.675 1.00 0.00 H new ATOM 0 HA ILE A 47 11.967 13.718 -3.722 1.00 0.00 H new ATOM 0 HB ILE A 47 9.879 13.167 -1.647 1.00 0.00 H new ATOM 0 HG12 ILE A 47 11.197 15.591 -2.936 1.00 0.00 H new ATOM 0 HG13 ILE A 47 9.498 15.162 -2.929 1.00 0.00 H new ATOM 0 HG21 ILE A 47 11.226 14.236 0.096 1.00 0.00 H new ATOM 0 HG22 ILE A 47 11.910 12.684 -0.441 1.00 0.00 H new ATOM 0 HG23 ILE A 47 12.636 14.213 -0.989 1.00 0.00 H new ATOM 0 HD11 ILE A 47 9.928 17.062 -1.409 1.00 0.00 H new ATOM 0 HD12 ILE A 47 9.371 15.645 -0.489 1.00 0.00 H new ATOM 0 HD13 ILE A 47 11.097 16.080 -0.495 1.00 0.00 H new ATOM 737 N TYR A 48 11.782 10.599 -2.797 1.00 0.00 N ATOM 738 CA TYR A 48 12.641 9.501 -2.388 1.00 0.00 C ATOM 739 C TYR A 48 13.838 9.383 -3.321 1.00 0.00 C ATOM 740 O TYR A 48 14.936 9.028 -2.893 1.00 0.00 O ATOM 741 CB TYR A 48 11.862 8.188 -2.389 1.00 0.00 C ATOM 742 CG TYR A 48 12.741 7.042 -1.961 1.00 0.00 C ATOM 743 CD1 TYR A 48 12.867 6.741 -0.598 1.00 0.00 C ATOM 744 CD2 TYR A 48 13.440 6.296 -2.920 1.00 0.00 C ATOM 745 CE1 TYR A 48 13.707 5.698 -0.183 1.00 0.00 C ATOM 746 CE2 TYR A 48 14.283 5.252 -2.515 1.00 0.00 C ATOM 747 CZ TYR A 48 14.407 4.939 -1.143 1.00 0.00 C ATOM 748 OH TYR A 48 15.211 3.913 -0.747 1.00 0.00 O ATOM 0 H TYR A 48 10.836 10.337 -3.076 1.00 0.00 H new ATOM 0 HA TYR A 48 12.997 9.706 -1.378 1.00 0.00 H new ATOM 0 HB2 TYR A 48 11.007 8.267 -1.717 1.00 0.00 H new ATOM 0 HB3 TYR A 48 11.467 7.996 -3.386 1.00 0.00 H new ATOM 0 HD1 TYR A 48 12.316 7.313 0.134 1.00 0.00 H new ATOM 0 HD2 TYR A 48 13.329 6.525 -3.970 1.00 0.00 H new ATOM 0 HE1 TYR A 48 13.817 5.477 0.868 1.00 0.00 H new ATOM 0 HE2 TYR A 48 14.837 4.688 -3.251 1.00 0.00 H new ATOM 0 HH TYR A 48 14.738 3.363 -0.088 1.00 0.00 H new ATOM 758 N GLN A 49 13.621 9.688 -4.601 1.00 0.00 N ATOM 759 CA GLN A 49 14.657 9.589 -5.615 1.00 0.00 C ATOM 760 C GLN A 49 15.685 10.708 -5.464 1.00 0.00 C ATOM 761 O GLN A 49 16.765 10.633 -6.049 1.00 0.00 O ATOM 762 CB GLN A 49 13.994 9.631 -6.990 1.00 0.00 C ATOM 763 CG GLN A 49 12.953 8.510 -7.066 1.00 0.00 C ATOM 764 CD GLN A 49 12.272 8.462 -8.426 1.00 0.00 C ATOM 765 OE1 GLN A 49 12.881 8.095 -9.428 1.00 0.00 O ATOM 766 NE2 GLN A 49 10.997 8.834 -8.472 1.00 0.00 N ATOM 0 H GLN A 49 12.721 10.010 -4.958 1.00 0.00 H new ATOM 0 HA GLN A 49 15.195 8.648 -5.497 1.00 0.00 H new ATOM 0 HB2 GLN A 49 13.520 10.599 -7.152 1.00 0.00 H new ATOM 0 HB3 GLN A 49 14.741 9.507 -7.774 1.00 0.00 H new ATOM 0 HG2 GLN A 49 13.435 7.553 -6.867 1.00 0.00 H new ATOM 0 HG3 GLN A 49 12.203 8.657 -6.289 1.00 0.00 H new ATOM 0 HE21 GLN A 49 10.522 9.133 -7.620 1.00 0.00 H new ATOM 0 HE22 GLN A 49 10.493 8.820 -9.359 1.00 0.00 H new ATOM 775 N ARG A 50 15.357 11.743 -4.681 1.00 0.00 N ATOM 776 CA ARG A 50 16.277 12.835 -4.393 1.00 0.00 C ATOM 777 C ARG A 50 17.030 12.562 -3.093 1.00 0.00 C ATOM 778 O ARG A 50 18.126 13.079 -2.897 1.00 0.00 O ATOM 779 CB ARG A 50 15.503 14.162 -4.375 1.00 0.00 C ATOM 780 CG ARG A 50 15.251 14.702 -2.962 1.00 0.00 C ATOM 781 CD ARG A 50 14.290 15.892 -3.014 1.00 0.00 C ATOM 782 NE ARG A 50 14.852 17.012 -3.779 1.00 0.00 N ATOM 783 CZ ARG A 50 14.386 17.444 -4.953 1.00 0.00 C ATOM 784 NH1 ARG A 50 13.342 16.862 -5.539 1.00 0.00 N ATOM 785 NH2 ARG A 50 14.972 18.474 -5.556 1.00 0.00 N ATOM 0 H ARG A 50 14.446 11.841 -4.233 1.00 0.00 H new ATOM 0 HA ARG A 50 17.032 12.911 -5.175 1.00 0.00 H new ATOM 0 HB2 ARG A 50 16.059 14.906 -4.946 1.00 0.00 H new ATOM 0 HB3 ARG A 50 14.546 14.023 -4.879 1.00 0.00 H new ATOM 0 HG2 ARG A 50 14.834 13.915 -2.333 1.00 0.00 H new ATOM 0 HG3 ARG A 50 16.194 15.006 -2.508 1.00 0.00 H new ATOM 0 HD2 ARG A 50 13.348 15.580 -3.465 1.00 0.00 H new ATOM 0 HD3 ARG A 50 14.064 16.221 -2.000 1.00 0.00 H new ATOM 0 HE ARG A 50 15.658 17.496 -3.384 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.882 16.070 -5.091 1.00 0.00 H new ATOM 0 HH12 ARG A 50 13.002 17.208 -6.436 1.00 0.00 H new ATOM 0 HH21 ARG A 50 15.774 18.930 -5.121 1.00 0.00 H new ATOM 0 HH22 ARG A 50 14.620 18.808 -6.453 1.00 0.00 H new ATOM 799 N ILE A 51 16.451 11.747 -2.202 1.00 0.00 N ATOM 800 CA ILE A 51 17.109 11.331 -0.967 1.00 0.00 C ATOM 801 C ILE A 51 18.214 10.345 -1.312 1.00 0.00 C ATOM 802 O ILE A 51 19.359 10.502 -0.895 1.00 0.00 O ATOM 803 CB ILE A 51 16.092 10.667 -0.032 1.00 0.00 C ATOM 804 CG1 ILE A 51 15.057 11.697 0.415 1.00 0.00 C ATOM 805 CG2 ILE A 51 16.777 10.096 1.214 1.00 0.00 C ATOM 806 CD1 ILE A 51 13.910 11.025 1.153 1.00 0.00 C ATOM 0 H ILE A 51 15.515 11.361 -2.321 1.00 0.00 H new ATOM 0 HA ILE A 51 17.532 12.200 -0.462 1.00 0.00 H new ATOM 0 HB ILE A 51 15.614 9.855 -0.580 1.00 0.00 H new ATOM 0 HG12 ILE A 51 15.529 12.436 1.063 1.00 0.00 H new ATOM 0 HG13 ILE A 51 14.673 12.233 -0.453 1.00 0.00 H new ATOM 0 HG21 ILE A 51 16.031 9.631 1.859 1.00 0.00 H new ATOM 0 HG22 ILE A 51 17.513 9.350 0.915 1.00 0.00 H new ATOM 0 HG23 ILE A 51 17.275 10.900 1.756 1.00 0.00 H new ATOM 0 HD11 ILE A 51 13.185 11.778 1.462 1.00 0.00 H new ATOM 0 HD12 ILE A 51 13.426 10.304 0.494 1.00 0.00 H new ATOM 0 HD13 ILE A 51 14.296 10.510 2.033 1.00 0.00 H new ATOM 818 N GLN A 52 17.862 9.314 -2.086 1.00 0.00 N ATOM 819 CA GLN A 52 18.782 8.250 -2.450 1.00 0.00 C ATOM 820 C GLN A 52 19.799 8.717 -3.488 1.00 0.00 C ATOM 821 O GLN A 52 20.585 7.914 -3.993 1.00 0.00 O ATOM 822 CB GLN A 52 17.981 7.026 -2.909 1.00 0.00 C ATOM 823 CG GLN A 52 17.123 6.513 -1.754 1.00 0.00 C ATOM 824 CD GLN A 52 17.915 6.414 -0.458 1.00 0.00 C ATOM 825 OE1 GLN A 52 18.922 5.716 -0.374 1.00 0.00 O ATOM 826 NE2 GLN A 52 17.462 7.122 0.573 1.00 0.00 N ATOM 0 H GLN A 52 16.926 9.200 -2.475 1.00 0.00 H new ATOM 0 HA GLN A 52 19.368 7.963 -1.577 1.00 0.00 H new ATOM 0 HB2 GLN A 52 17.348 7.290 -3.756 1.00 0.00 H new ATOM 0 HB3 GLN A 52 18.658 6.242 -3.249 1.00 0.00 H new ATOM 0 HG2 GLN A 52 16.273 7.180 -1.610 1.00 0.00 H new ATOM 0 HG3 GLN A 52 16.720 5.533 -2.009 1.00 0.00 H new ATOM 0 HE21 GLN A 52 16.622 7.692 0.471 1.00 0.00 H new ATOM 0 HE22 GLN A 52 17.954 7.095 1.466 1.00 0.00 H new ATOM 835 N ALA A 53 19.785 10.013 -3.815 1.00 0.00 N ATOM 836 CA ALA A 53 20.738 10.582 -4.745 1.00 0.00 C ATOM 837 C ALA A 53 22.136 10.675 -4.119 1.00 0.00 C ATOM 838 O ALA A 53 23.116 10.834 -4.847 1.00 0.00 O ATOM 839 CB ALA A 53 20.257 11.964 -5.173 1.00 0.00 C ATOM 0 H ALA A 53 19.114 10.684 -3.441 1.00 0.00 H new ATOM 0 HA ALA A 53 20.809 9.932 -5.617 1.00 0.00 H new ATOM 0 HB1 ALA A 53 20.971 12.397 -5.873 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.283 11.877 -5.655 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.172 12.607 -4.297 1.00 0.00 H new ATOM 845 N GLY A 54 22.236 10.578 -2.787 1.00 0.00 N ATOM 846 CA GLY A 54 23.520 10.621 -2.099 1.00 0.00 C ATOM 847 C GLY A 54 23.471 11.470 -0.832 1.00 0.00 C ATOM 848 O GLY A 54 24.521 11.829 -0.297 1.00 0.00 O ATOM 0 H GLY A 54 21.434 10.469 -2.166 1.00 0.00 H new ATOM 0 HA2 GLY A 54 23.826 9.607 -1.842 1.00 0.00 H new ATOM 0 HA3 GLY A 54 24.277 11.022 -2.773 1.00 0.00 H new ATOM 852 N LEU A 55 22.270 11.795 -0.343 1.00 0.00 N ATOM 853 CA LEU A 55 22.074 12.687 0.790 1.00 0.00 C ATOM 854 C LEU A 55 20.984 12.160 1.720 1.00 0.00 C ATOM 855 O LEU A 55 20.509 11.038 1.556 1.00 0.00 O ATOM 856 CB LEU A 55 21.758 14.083 0.246 1.00 0.00 C ATOM 857 CG LEU A 55 20.551 14.109 -0.700 1.00 0.00 C ATOM 858 CD1 LEU A 55 19.221 13.973 0.042 1.00 0.00 C ATOM 859 CD2 LEU A 55 20.543 15.433 -1.447 1.00 0.00 C ATOM 0 H LEU A 55 21.398 11.437 -0.733 1.00 0.00 H new ATOM 0 HA LEU A 55 22.979 12.741 1.395 1.00 0.00 H new ATOM 0 HB2 LEU A 55 21.570 14.757 1.082 1.00 0.00 H new ATOM 0 HB3 LEU A 55 22.632 14.466 -0.281 1.00 0.00 H new ATOM 0 HG LEU A 55 20.649 13.261 -1.377 1.00 0.00 H new ATOM 0 HD11 LEU A 55 18.400 13.997 -0.675 1.00 0.00 H new ATOM 0 HD12 LEU A 55 19.202 13.027 0.584 1.00 0.00 H new ATOM 0 HD13 LEU A 55 19.112 14.797 0.747 1.00 0.00 H new ATOM 0 HD21 LEU A 55 19.689 15.464 -2.123 1.00 0.00 H new ATOM 0 HD22 LEU A 55 20.470 16.253 -0.733 1.00 0.00 H new ATOM 0 HD23 LEU A 55 21.464 15.532 -2.021 1.00 0.00 H new ATOM 871 N THR A 56 20.580 12.975 2.701 1.00 0.00 N ATOM 872 CA THR A 56 19.513 12.626 3.629 1.00 0.00 C ATOM 873 C THR A 56 18.614 13.835 3.874 1.00 0.00 C ATOM 874 O THR A 56 18.931 14.944 3.445 1.00 0.00 O ATOM 875 CB THR A 56 20.102 12.086 4.936 1.00 0.00 C ATOM 876 OG1 THR A 56 20.957 13.046 5.522 1.00 0.00 O ATOM 877 CG2 THR A 56 20.895 10.807 4.680 1.00 0.00 C ATOM 0 H THR A 56 20.988 13.895 2.869 1.00 0.00 H new ATOM 0 HA THR A 56 18.900 11.838 3.192 1.00 0.00 H new ATOM 0 HB THR A 56 19.276 11.869 5.613 1.00 0.00 H new ATOM 0 HG1 THR A 56 21.325 12.689 6.357 1.00 0.00 H new ATOM 0 HG21 THR A 56 21.305 10.439 5.620 1.00 0.00 H new ATOM 0 HG22 THR A 56 20.238 10.051 4.250 1.00 0.00 H new ATOM 0 HG23 THR A 56 21.709 11.016 3.986 1.00 0.00 H new ATOM 885 N ALA A 57 17.488 13.621 4.563 1.00 0.00 N ATOM 886 CA ALA A 57 16.495 14.660 4.809 1.00 0.00 C ATOM 887 C ALA A 57 17.109 15.906 5.459 1.00 0.00 C ATOM 888 O ALA A 57 18.073 15.798 6.219 1.00 0.00 O ATOM 889 CB ALA A 57 15.399 14.092 5.705 1.00 0.00 C ATOM 0 H ALA A 57 17.243 12.716 4.966 1.00 0.00 H new ATOM 0 HA ALA A 57 16.082 14.970 3.849 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.650 14.861 5.896 1.00 0.00 H new ATOM 0 HB2 ALA A 57 14.929 13.242 5.210 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.834 13.767 6.650 1.00 0.00 H new ATOM 895 N PRO A 58 16.552 17.086 5.164 1.00 0.00 N ATOM 896 CA PRO A 58 16.999 18.359 5.703 1.00 0.00 C ATOM 897 C PRO A 58 16.544 18.555 7.143 1.00 0.00 C ATOM 898 O PRO A 58 15.637 17.884 7.637 1.00 0.00 O ATOM 899 CB PRO A 58 16.361 19.416 4.806 1.00 0.00 C ATOM 900 CG PRO A 58 15.059 18.754 4.351 1.00 0.00 C ATOM 901 CD PRO A 58 15.429 17.273 4.262 1.00 0.00 C ATOM 0 HA PRO A 58 18.087 18.417 5.717 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.173 20.343 5.348 1.00 0.00 H new ATOM 0 HB3 PRO A 58 17.002 19.666 3.960 1.00 0.00 H new ATOM 0 HG2 PRO A 58 14.251 18.925 5.063 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.724 19.143 3.389 1.00 0.00 H new ATOM 0 HD2 PRO A 58 14.588 16.643 4.550 1.00 0.00 H new ATOM 0 HD3 PRO A 58 15.698 16.999 3.242 1.00 0.00 H new ATOM 909 N ASP A 59 17.203 19.500 7.809 1.00 0.00 N ATOM 910 CA ASP A 59 16.884 19.916 9.159 1.00 0.00 C ATOM 911 C ASP A 59 15.579 20.722 9.153 1.00 0.00 C ATOM 912 O ASP A 59 15.262 21.383 8.164 1.00 0.00 O ATOM 913 CB ASP A 59 18.075 20.747 9.639 1.00 0.00 C ATOM 914 CG ASP A 59 17.973 21.217 11.090 1.00 0.00 C ATOM 915 OD1 ASP A 59 17.043 20.767 11.793 1.00 0.00 O ATOM 916 OD2 ASP A 59 18.836 22.031 11.489 1.00 0.00 O ATOM 0 H ASP A 59 17.993 20.006 7.408 1.00 0.00 H new ATOM 0 HA ASP A 59 16.724 19.073 9.831 1.00 0.00 H new ATOM 0 HB2 ASP A 59 18.984 20.157 9.524 1.00 0.00 H new ATOM 0 HB3 ASP A 59 18.178 21.619 8.994 1.00 0.00 H new ATOM 1635 N MET C 1 1.204 7.109 12.723 1.00 0.00 N ATOM 1636 CA MET C 1 0.846 6.646 11.368 1.00 0.00 C ATOM 1637 C MET C 1 1.231 7.712 10.350 1.00 0.00 C ATOM 1638 O MET C 1 0.835 8.867 10.492 1.00 0.00 O ATOM 1639 CB MET C 1 -0.653 6.351 11.283 1.00 0.00 C ATOM 1640 CG MET C 1 -0.949 5.471 10.070 1.00 0.00 C ATOM 1641 SD MET C 1 -2.693 5.014 9.865 1.00 0.00 S ATOM 1642 CE MET C 1 -3.347 6.604 9.311 1.00 0.00 C ATOM 0 H1 MET C 1 0.942 6.382 13.419 1.00 0.00 H new ATOM 0 H2 MET C 1 2.229 7.281 12.772 1.00 0.00 H new ATOM 0 H3 MET C 1 0.694 7.991 12.935 1.00 0.00 H new ATOM 0 HA MET C 1 1.389 5.726 11.150 1.00 0.00 H new ATOM 0 HB2 MET C 1 -0.985 5.852 12.193 1.00 0.00 H new ATOM 0 HB3 MET C 1 -1.211 7.284 11.209 1.00 0.00 H new ATOM 0 HG2 MET C 1 -0.617 5.992 9.172 1.00 0.00 H new ATOM 0 HG3 MET C 1 -0.356 4.559 10.147 1.00 0.00 H new ATOM 0 HE1 MET C 1 -4.399 6.493 9.048 1.00 0.00 H new ATOM 0 HE2 MET C 1 -3.248 7.337 10.112 1.00 0.00 H new ATOM 0 HE3 MET C 1 -2.789 6.943 8.438 1.00 0.00 H new ATOM 1654 N LEU C 2 1.998 7.338 9.324 1.00 0.00 N ATOM 1655 CA LEU C 2 2.394 8.287 8.292 1.00 0.00 C ATOM 1656 C LEU C 2 1.308 8.302 7.219 1.00 0.00 C ATOM 1657 O LEU C 2 0.825 7.245 6.824 1.00 0.00 O ATOM 1658 CB LEU C 2 3.752 7.840 7.730 1.00 0.00 C ATOM 1659 CG LEU C 2 4.626 8.958 7.130 1.00 0.00 C ATOM 1660 CD1 LEU C 2 5.626 8.329 6.172 1.00 0.00 C ATOM 1661 CD2 LEU C 2 3.863 10.043 6.378 1.00 0.00 C ATOM 0 H LEU C 2 2.353 6.391 9.189 1.00 0.00 H new ATOM 0 HA LEU C 2 2.502 9.299 8.683 1.00 0.00 H new ATOM 0 HB2 LEU C 2 4.313 7.354 8.528 1.00 0.00 H new ATOM 0 HB3 LEU C 2 3.577 7.088 6.960 1.00 0.00 H new ATOM 0 HG LEU C 2 5.100 9.452 7.978 1.00 0.00 H new ATOM 0 HD11 LEU C 2 6.253 9.108 5.738 1.00 0.00 H new ATOM 0 HD12 LEU C 2 6.251 7.619 6.713 1.00 0.00 H new ATOM 0 HD13 LEU C 2 5.091 7.809 5.377 1.00 0.00 H new ATOM 0 HD21 LEU C 2 4.566 10.783 5.994 1.00 0.00 H new ATOM 0 HD22 LEU C 2 3.318 9.595 5.547 1.00 0.00 H new ATOM 0 HD23 LEU C 2 3.159 10.528 7.054 1.00 0.00 H new ATOM 1673 N ILE C 3 0.922 9.488 6.746 1.00 0.00 N ATOM 1674 CA ILE C 3 -0.042 9.639 5.667 1.00 0.00 C ATOM 1675 C ILE C 3 0.612 10.380 4.516 1.00 0.00 C ATOM 1676 O ILE C 3 1.466 11.242 4.720 1.00 0.00 O ATOM 1677 CB ILE C 3 -1.285 10.416 6.127 1.00 0.00 C ATOM 1678 CG1 ILE C 3 -2.207 9.551 6.983 1.00 0.00 C ATOM 1679 CG2 ILE C 3 -2.127 10.881 4.941 1.00 0.00 C ATOM 1680 CD1 ILE C 3 -1.886 9.691 8.465 1.00 0.00 C ATOM 0 H ILE C 3 1.275 10.374 7.107 1.00 0.00 H new ATOM 0 HA ILE C 3 -0.360 8.645 5.352 1.00 0.00 H new ATOM 0 HB ILE C 3 -0.903 11.264 6.696 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -3.244 9.837 6.806 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -2.108 8.507 6.685 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -2.998 11.427 5.305 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -1.530 11.533 4.304 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -2.456 10.015 4.366 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -2.561 9.062 9.045 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -0.857 9.381 8.645 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -2.010 10.731 8.767 1.00 0.00 H new ATOM 1692 N LEU C 4 0.196 10.035 3.303 1.00 0.00 N ATOM 1693 CA LEU C 4 0.570 10.742 2.095 1.00 0.00 C ATOM 1694 C LEU C 4 -0.654 10.765 1.187 1.00 0.00 C ATOM 1695 O LEU C 4 -1.595 9.994 1.381 1.00 0.00 O ATOM 1696 CB LEU C 4 1.770 10.064 1.419 1.00 0.00 C ATOM 1697 CG LEU C 4 3.066 10.205 2.233 1.00 0.00 C ATOM 1698 CD1 LEU C 4 4.197 9.438 1.556 1.00 0.00 C ATOM 1699 CD2 LEU C 4 3.510 11.664 2.348 1.00 0.00 C ATOM 0 H LEU C 4 -0.422 9.241 3.134 1.00 0.00 H new ATOM 0 HA LEU C 4 0.882 11.762 2.321 1.00 0.00 H new ATOM 0 HB2 LEU C 4 1.550 9.006 1.274 1.00 0.00 H new ATOM 0 HB3 LEU C 4 1.918 10.498 0.430 1.00 0.00 H new ATOM 0 HG LEU C 4 2.857 9.808 3.226 1.00 0.00 H new ATOM 0 HD11 LEU C 4 5.110 9.545 2.141 1.00 0.00 H new ATOM 0 HD12 LEU C 4 3.931 8.383 1.487 1.00 0.00 H new ATOM 0 HD13 LEU C 4 4.359 9.837 0.555 1.00 0.00 H new ATOM 0 HD21 LEU C 4 4.429 11.720 2.931 1.00 0.00 H new ATOM 0 HD22 LEU C 4 3.686 12.070 1.352 1.00 0.00 H new ATOM 0 HD23 LEU C 4 2.731 12.243 2.843 1.00 0.00 H new ATOM 1711 N THR C 5 -0.639 11.652 0.194 1.00 0.00 N ATOM 1712 CA THR C 5 -1.766 11.831 -0.703 1.00 0.00 C ATOM 1713 C THR C 5 -1.270 11.678 -2.128 1.00 0.00 C ATOM 1714 O THR C 5 -0.184 12.144 -2.475 1.00 0.00 O ATOM 1715 CB THR C 5 -2.409 13.199 -0.460 1.00 0.00 C ATOM 1716 OG1 THR C 5 -2.912 13.252 0.858 1.00 0.00 O ATOM 1717 CG2 THR C 5 -3.566 13.469 -1.421 1.00 0.00 C ATOM 0 H THR C 5 0.154 12.262 -0.006 1.00 0.00 H new ATOM 0 HA THR C 5 -2.534 11.079 -0.520 1.00 0.00 H new ATOM 0 HB THR C 5 -1.639 13.953 -0.622 1.00 0.00 H new ATOM 0 HG1 THR C 5 -3.323 14.128 1.016 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.991 14.450 -1.212 1.00 0.00 H new ATOM 0 HG22 THR C 5 -3.200 13.444 -2.447 1.00 0.00 H new ATOM 0 HG23 THR C 5 -4.333 12.706 -1.291 1.00 0.00 H new ATOM 1725 N ARG C 6 -2.079 11.014 -2.946 1.00 0.00 N ATOM 1726 CA ARG C 6 -1.731 10.639 -4.305 1.00 0.00 C ATOM 1727 C ARG C 6 -2.953 10.721 -5.214 1.00 0.00 C ATOM 1728 O ARG C 6 -4.054 11.009 -4.753 1.00 0.00 O ATOM 1729 CB ARG C 6 -1.191 9.220 -4.292 1.00 0.00 C ATOM 1730 CG ARG C 6 -2.140 8.272 -3.569 1.00 0.00 C ATOM 1731 CD ARG C 6 -1.952 6.884 -4.154 1.00 0.00 C ATOM 1732 NE ARG C 6 -0.544 6.486 -4.120 1.00 0.00 N ATOM 1733 CZ ARG C 6 -0.129 5.222 -3.979 1.00 0.00 C ATOM 1734 NH1 ARG C 6 -0.999 4.235 -3.793 1.00 0.00 N ATOM 1735 NH2 ARG C 6 1.166 4.937 -4.021 1.00 0.00 N ATOM 0 H ARG C 6 -3.016 10.716 -2.673 1.00 0.00 H new ATOM 0 HA ARG C 6 -0.976 11.325 -4.689 1.00 0.00 H new ATOM 0 HB2 ARG C 6 -1.041 8.877 -5.316 1.00 0.00 H new ATOM 0 HB3 ARG C 6 -0.216 9.204 -3.804 1.00 0.00 H new ATOM 0 HG2 ARG C 6 -1.931 8.266 -2.499 1.00 0.00 H new ATOM 0 HG3 ARG C 6 -3.172 8.600 -3.690 1.00 0.00 H new ATOM 0 HD2 ARG C 6 -2.550 6.165 -3.594 1.00 0.00 H new ATOM 0 HD3 ARG C 6 -2.314 6.867 -5.182 1.00 0.00 H new ATOM 0 HE ARG C 6 0.163 7.216 -4.209 1.00 0.00 H new ATOM 0 HH11 ARG C 6 -1.998 4.436 -3.756 1.00 0.00 H new ATOM 0 HH12 ARG C 6 -0.668 3.276 -3.687 1.00 0.00 H new ATOM 0 HH21 ARG C 6 1.848 5.682 -4.161 1.00 0.00 H new ATOM 0 HH22 ARG C 6 1.480 3.972 -3.913 1.00 0.00 H new ATOM 1749 N LYS C 7 -2.756 10.467 -6.509 1.00 0.00 N ATOM 1750 CA LYS C 7 -3.841 10.348 -7.470 1.00 0.00 C ATOM 1751 C LYS C 7 -3.515 9.222 -8.439 1.00 0.00 C ATOM 1752 O LYS C 7 -2.373 8.775 -8.511 1.00 0.00 O ATOM 1753 CB LYS C 7 -4.125 11.677 -8.198 1.00 0.00 C ATOM 1754 CG LYS C 7 -2.933 12.618 -8.402 1.00 0.00 C ATOM 1755 CD LYS C 7 -2.638 13.414 -7.130 1.00 0.00 C ATOM 1756 CE LYS C 7 -1.696 14.580 -7.411 1.00 0.00 C ATOM 1757 NZ LYS C 7 -0.399 14.103 -7.926 1.00 0.00 N ATOM 0 H LYS C 7 -1.830 10.338 -6.918 1.00 0.00 H new ATOM 0 HA LYS C 7 -4.761 10.107 -6.938 1.00 0.00 H new ATOM 0 HB2 LYS C 7 -4.547 11.446 -9.176 1.00 0.00 H new ATOM 0 HB3 LYS C 7 -4.891 12.214 -7.639 1.00 0.00 H new ATOM 0 HG2 LYS C 7 -2.053 12.040 -8.686 1.00 0.00 H new ATOM 0 HG3 LYS C 7 -3.143 13.303 -9.223 1.00 0.00 H new ATOM 0 HD2 LYS C 7 -3.571 13.790 -6.710 1.00 0.00 H new ATOM 0 HD3 LYS C 7 -2.194 12.757 -6.382 1.00 0.00 H new ATOM 0 HE2 LYS C 7 -2.153 15.254 -8.136 1.00 0.00 H new ATOM 0 HE3 LYS C 7 -1.539 15.153 -6.497 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 0.317 14.848 -7.807 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 -0.107 13.255 -7.400 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 -0.491 13.870 -8.935 1.00 0.00 H new ATOM 1771 N VAL C 8 -4.521 8.758 -9.182 1.00 0.00 N ATOM 1772 CA VAL C 8 -4.396 7.602 -10.064 1.00 0.00 C ATOM 1773 C VAL C 8 -3.127 7.691 -10.915 1.00 0.00 C ATOM 1774 O VAL C 8 -2.899 8.691 -11.589 1.00 0.00 O ATOM 1775 CB VAL C 8 -5.640 7.509 -10.951 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -5.549 6.266 -11.832 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -6.895 7.413 -10.084 1.00 0.00 C ATOM 0 H VAL C 8 -5.450 9.178 -9.187 1.00 0.00 H new ATOM 0 HA VAL C 8 -4.317 6.700 -9.457 1.00 0.00 H new ATOM 0 HB VAL C 8 -5.696 8.402 -11.574 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -6.436 6.201 -12.463 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -4.661 6.330 -12.460 1.00 0.00 H new ATOM 0 HG13 VAL C 8 -5.486 5.378 -11.203 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -7.775 7.347 -10.724 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -6.836 6.524 -9.456 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -6.970 8.299 -9.453 1.00 0.00 H new ATOM 1787 N GLY C 9 -2.304 6.639 -10.875 1.00 0.00 N ATOM 1788 CA GLY C 9 -1.066 6.557 -11.639 1.00 0.00 C ATOM 1789 C GLY C 9 0.166 6.929 -10.810 1.00 0.00 C ATOM 1790 O GLY C 9 1.293 6.718 -11.259 1.00 0.00 O ATOM 0 H GLY C 9 -2.485 5.814 -10.303 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -0.948 5.544 -12.023 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -1.132 7.220 -12.502 1.00 0.00 H new ATOM 1794 N GLU C 10 -0.026 7.479 -9.608 1.00 0.00 N ATOM 1795 CA GLU C 10 1.063 7.900 -8.733 1.00 0.00 C ATOM 1796 C GLU C 10 1.655 6.719 -7.962 1.00 0.00 C ATOM 1797 O GLU C 10 1.104 5.618 -7.978 1.00 0.00 O ATOM 1798 CB GLU C 10 0.511 8.954 -7.767 1.00 0.00 C ATOM 1799 CG GLU C 10 1.624 9.707 -7.037 1.00 0.00 C ATOM 1800 CD GLU C 10 1.121 10.977 -6.360 1.00 0.00 C ATOM 1801 OE1 GLU C 10 0.148 11.571 -6.876 1.00 0.00 O ATOM 1802 OE2 GLU C 10 1.719 11.350 -5.329 1.00 0.00 O ATOM 0 H GLU C 10 -0.952 7.645 -9.214 1.00 0.00 H new ATOM 0 HA GLU C 10 1.871 8.319 -9.333 1.00 0.00 H new ATOM 0 HB2 GLU C 10 -0.104 9.664 -8.320 1.00 0.00 H new ATOM 0 HB3 GLU C 10 -0.138 8.471 -7.037 1.00 0.00 H new ATOM 0 HG2 GLU C 10 2.071 9.053 -6.289 1.00 0.00 H new ATOM 0 HG3 GLU C 10 2.411 9.964 -7.746 1.00 0.00 H new ATOM 1809 N SER C 11 2.784 6.945 -7.280 1.00 0.00 N ATOM 1810 CA SER C 11 3.461 5.913 -6.506 1.00 0.00 C ATOM 1811 C SER C 11 4.052 6.477 -5.218 1.00 0.00 C ATOM 1812 O SER C 11 4.189 7.689 -5.057 1.00 0.00 O ATOM 1813 CB SER C 11 4.568 5.281 -7.350 1.00 0.00 C ATOM 1814 OG SER C 11 4.029 4.675 -8.503 1.00 0.00 O ATOM 0 H SER C 11 3.250 7.852 -7.253 1.00 0.00 H new ATOM 0 HA SER C 11 2.725 5.157 -6.234 1.00 0.00 H new ATOM 0 HB2 SER C 11 5.293 6.043 -7.638 1.00 0.00 H new ATOM 0 HB3 SER C 11 5.104 4.538 -6.759 1.00 0.00 H new ATOM 0 HG SER C 11 4.752 4.277 -9.032 1.00 0.00 H new ATOM 1820 N ILE C 12 4.397 5.574 -4.300 1.00 0.00 N ATOM 1821 CA ILE C 12 5.004 5.863 -3.000 1.00 0.00 C ATOM 1822 C ILE C 12 6.101 4.820 -2.767 1.00 0.00 C ATOM 1823 O ILE C 12 6.135 3.811 -3.471 1.00 0.00 O ATOM 1824 CB ILE C 12 3.914 5.813 -1.909 1.00 0.00 C ATOM 1825 CG1 ILE C 12 2.872 6.928 -2.094 1.00 0.00 C ATOM 1826 CG2 ILE C 12 4.502 5.914 -0.500 1.00 0.00 C ATOM 1827 CD1 ILE C 12 3.448 8.335 -1.940 1.00 0.00 C ATOM 0 H ILE C 12 4.254 4.575 -4.449 1.00 0.00 H new ATOM 0 HA ILE C 12 5.447 6.859 -2.968 1.00 0.00 H new ATOM 0 HB ILE C 12 3.428 4.844 -2.019 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.424 6.834 -3.083 1.00 0.00 H new ATOM 0 HG13 ILE C 12 2.072 6.790 -1.367 1.00 0.00 H new ATOM 0 HG21 ILE C 12 3.697 5.874 0.234 1.00 0.00 H new ATOM 0 HG22 ILE C 12 5.188 5.084 -0.332 1.00 0.00 H new ATOM 0 HG23 ILE C 12 5.041 6.856 -0.397 1.00 0.00 H new ATOM 0 HD11 ILE C 12 2.656 9.070 -2.084 1.00 0.00 H new ATOM 0 HD12 ILE C 12 3.871 8.448 -0.942 1.00 0.00 H new ATOM 0 HD13 ILE C 12 4.228 8.492 -2.685 1.00 0.00 H new ATOM 1839 N ASN C 13 6.993 5.033 -1.796 1.00 0.00 N ATOM 1840 CA ASN C 13 8.145 4.158 -1.614 1.00 0.00 C ATOM 1841 C ASN C 13 8.380 3.848 -0.135 1.00 0.00 C ATOM 1842 O ASN C 13 8.097 4.678 0.729 1.00 0.00 O ATOM 1843 CB ASN C 13 9.356 4.839 -2.250 1.00 0.00 C ATOM 1844 CG ASN C 13 10.546 3.896 -2.348 1.00 0.00 C ATOM 1845 OD1 ASN C 13 11.283 3.701 -1.386 1.00 0.00 O ATOM 1846 ND2 ASN C 13 10.734 3.304 -3.526 1.00 0.00 N ATOM 0 H ASN C 13 6.937 5.802 -1.128 1.00 0.00 H new ATOM 0 HA ASN C 13 7.967 3.198 -2.099 1.00 0.00 H new ATOM 0 HB2 ASN C 13 9.092 5.196 -3.245 1.00 0.00 H new ATOM 0 HB3 ASN C 13 9.632 5.714 -1.661 1.00 0.00 H new ATOM 0 HD21 ASN C 13 11.515 2.660 -3.654 1.00 0.00 H new ATOM 0 HD22 ASN C 13 10.097 3.494 -4.300 1.00 0.00 H new ATOM 1853 N ILE C 14 8.904 2.650 0.136 1.00 0.00 N ATOM 1854 CA ILE C 14 9.178 2.160 1.479 1.00 0.00 C ATOM 1855 C ILE C 14 10.484 1.368 1.485 1.00 0.00 C ATOM 1856 O ILE C 14 10.831 0.712 0.502 1.00 0.00 O ATOM 1857 CB ILE C 14 8.013 1.279 1.957 1.00 0.00 C ATOM 1858 CG1 ILE C 14 6.701 2.082 1.958 1.00 0.00 C ATOM 1859 CG2 ILE C 14 8.306 0.729 3.357 1.00 0.00 C ATOM 1860 CD1 ILE C 14 5.505 1.253 2.433 1.00 0.00 C ATOM 0 H ILE C 14 9.154 1.982 -0.593 1.00 0.00 H new ATOM 0 HA ILE C 14 9.280 3.005 2.159 1.00 0.00 H new ATOM 0 HB ILE C 14 7.903 0.440 1.270 1.00 0.00 H new ATOM 0 HG12 ILE C 14 6.813 2.954 2.603 1.00 0.00 H new ATOM 0 HG13 ILE C 14 6.505 2.453 0.952 1.00 0.00 H new ATOM 0 HG21 ILE C 14 7.474 0.106 3.685 1.00 0.00 H new ATOM 0 HG22 ILE C 14 9.217 0.132 3.330 1.00 0.00 H new ATOM 0 HG23 ILE C 14 8.436 1.557 4.053 1.00 0.00 H new ATOM 0 HD11 ILE C 14 4.605 1.868 2.414 1.00 0.00 H new ATOM 0 HD12 ILE C 14 5.372 0.395 1.774 1.00 0.00 H new ATOM 0 HD13 ILE C 14 5.685 0.904 3.450 1.00 0.00 H new ATOM 1872 N GLY C 15 11.215 1.427 2.604 1.00 0.00 N ATOM 1873 CA GLY C 15 12.470 0.710 2.752 1.00 0.00 C ATOM 1874 C GLY C 15 13.429 1.086 1.632 1.00 0.00 C ATOM 1875 O GLY C 15 13.550 2.256 1.280 1.00 0.00 O ATOM 0 H GLY C 15 10.948 1.972 3.424 1.00 0.00 H new ATOM 0 HA2 GLY C 15 12.918 0.944 3.718 1.00 0.00 H new ATOM 0 HA3 GLY C 15 12.287 -0.364 2.737 1.00 0.00 H new ATOM 1879 N ASP C 16 14.109 0.082 1.082 1.00 0.00 N ATOM 1880 CA ASP C 16 15.023 0.256 -0.041 1.00 0.00 C ATOM 1881 C ASP C 16 14.718 -0.778 -1.133 1.00 0.00 C ATOM 1882 O ASP C 16 15.443 -0.877 -2.119 1.00 0.00 O ATOM 1883 CB ASP C 16 16.466 0.160 0.468 1.00 0.00 C ATOM 1884 CG ASP C 16 17.486 0.494 -0.621 1.00 0.00 C ATOM 1885 OD1 ASP C 16 17.318 1.550 -1.274 1.00 0.00 O ATOM 1886 OD2 ASP C 16 18.431 -0.312 -0.790 1.00 0.00 O ATOM 0 H ASP C 16 14.039 -0.882 1.407 1.00 0.00 H new ATOM 0 HA ASP C 16 14.890 1.240 -0.490 1.00 0.00 H new ATOM 0 HB2 ASP C 16 16.599 0.841 1.309 1.00 0.00 H new ATOM 0 HB3 ASP C 16 16.652 -0.847 0.841 1.00 0.00 H new ATOM 1891 N ASP C 17 13.642 -1.550 -0.949 1.00 0.00 N ATOM 1892 CA ASP C 17 13.264 -2.625 -1.859 1.00 0.00 C ATOM 1893 C ASP C 17 11.745 -2.698 -2.049 1.00 0.00 C ATOM 1894 O ASP C 17 11.249 -3.686 -2.587 1.00 0.00 O ATOM 1895 CB ASP C 17 13.781 -3.961 -1.318 1.00 0.00 C ATOM 1896 CG ASP C 17 15.304 -3.977 -1.177 1.00 0.00 C ATOM 1897 OD1 ASP C 17 15.976 -4.178 -2.215 1.00 0.00 O ATOM 1898 OD2 ASP C 17 15.785 -3.788 -0.036 1.00 0.00 O ATOM 0 H ASP C 17 13.008 -1.442 -0.158 1.00 0.00 H new ATOM 0 HA ASP C 17 13.713 -2.417 -2.830 1.00 0.00 H new ATOM 0 HB2 ASP C 17 13.326 -4.159 -0.347 1.00 0.00 H new ATOM 0 HB3 ASP C 17 13.471 -4.765 -1.985 1.00 0.00 H new ATOM 1903 N ILE C 18 10.999 -1.671 -1.619 1.00 0.00 N ATOM 1904 CA ILE C 18 9.546 -1.696 -1.722 1.00 0.00 C ATOM 1905 C ILE C 18 9.033 -0.384 -2.310 1.00 0.00 C ATOM 1906 O ILE C 18 9.503 0.699 -1.969 1.00 0.00 O ATOM 1907 CB ILE C 18 8.939 -1.940 -0.330 1.00 0.00 C ATOM 1908 CG1 ILE C 18 9.461 -3.250 0.273 1.00 0.00 C ATOM 1909 CG2 ILE C 18 7.411 -1.959 -0.424 1.00 0.00 C ATOM 1910 CD1 ILE C 18 9.020 -3.405 1.729 1.00 0.00 C ATOM 0 H ILE C 18 11.380 -0.822 -1.201 1.00 0.00 H new ATOM 0 HA ILE C 18 9.245 -2.505 -2.388 1.00 0.00 H new ATOM 0 HB ILE C 18 9.241 -1.126 0.329 1.00 0.00 H new ATOM 0 HG12 ILE C 18 9.095 -4.094 -0.312 1.00 0.00 H new ATOM 0 HG13 ILE C 18 10.549 -3.271 0.216 1.00 0.00 H new ATOM 0 HG21 ILE C 18 6.988 -2.132 0.565 1.00 0.00 H new ATOM 0 HG22 ILE C 18 7.058 -1.001 -0.807 1.00 0.00 H new ATOM 0 HG23 ILE C 18 7.098 -2.757 -1.097 1.00 0.00 H new ATOM 0 HD11 ILE C 18 9.406 -4.343 2.128 1.00 0.00 H new ATOM 0 HD12 ILE C 18 9.408 -2.574 2.317 1.00 0.00 H new ATOM 0 HD13 ILE C 18 7.931 -3.409 1.781 1.00 0.00 H new ATOM 1922 N THR C 19 8.051 -0.495 -3.201 1.00 0.00 N ATOM 1923 CA THR C 19 7.397 0.644 -3.828 1.00 0.00 C ATOM 1924 C THR C 19 5.931 0.285 -4.021 1.00 0.00 C ATOM 1925 O THR C 19 5.604 -0.888 -4.180 1.00 0.00 O ATOM 1926 CB THR C 19 8.076 0.969 -5.168 1.00 0.00 C ATOM 1927 OG1 THR C 19 9.478 0.938 -5.036 1.00 0.00 O ATOM 1928 CG2 THR C 19 7.682 2.352 -5.669 1.00 0.00 C ATOM 0 H THR C 19 7.683 -1.395 -3.511 1.00 0.00 H new ATOM 0 HA THR C 19 7.477 1.533 -3.202 1.00 0.00 H new ATOM 0 HB THR C 19 7.746 0.213 -5.881 1.00 0.00 H new ATOM 0 HG1 THR C 19 9.893 1.146 -5.899 1.00 0.00 H new ATOM 0 HG21 THR C 19 8.179 2.550 -6.618 1.00 0.00 H new ATOM 0 HG22 THR C 19 6.602 2.394 -5.810 1.00 0.00 H new ATOM 0 HG23 THR C 19 7.982 3.103 -4.938 1.00 0.00 H new ATOM 1936 N ILE C 20 5.041 1.279 -4.013 1.00 0.00 N ATOM 1937 CA ILE C 20 3.605 1.051 -4.050 1.00 0.00 C ATOM 1938 C ILE C 20 2.989 1.977 -5.094 1.00 0.00 C ATOM 1939 O ILE C 20 3.505 3.069 -5.327 1.00 0.00 O ATOM 1940 CB ILE C 20 3.005 1.332 -2.662 1.00 0.00 C ATOM 1941 CG1 ILE C 20 3.777 0.627 -1.538 1.00 0.00 C ATOM 1942 CG2 ILE C 20 1.540 0.898 -2.622 1.00 0.00 C ATOM 1943 CD1 ILE C 20 3.680 -0.896 -1.590 1.00 0.00 C ATOM 0 H ILE C 20 5.302 2.265 -3.981 1.00 0.00 H new ATOM 0 HA ILE C 20 3.393 0.015 -4.316 1.00 0.00 H new ATOM 0 HB ILE C 20 3.081 2.406 -2.495 1.00 0.00 H new ATOM 0 HG12 ILE C 20 4.826 0.918 -1.592 1.00 0.00 H new ATOM 0 HG13 ILE C 20 3.399 0.974 -0.576 1.00 0.00 H new ATOM 0 HG21 ILE C 20 1.127 1.102 -1.634 1.00 0.00 H new ATOM 0 HG22 ILE C 20 0.976 1.451 -3.373 1.00 0.00 H new ATOM 0 HG23 ILE C 20 1.471 -0.170 -2.831 1.00 0.00 H new ATOM 0 HD11 ILE C 20 4.250 -1.325 -0.766 1.00 0.00 H new ATOM 0 HD12 ILE C 20 2.636 -1.197 -1.505 1.00 0.00 H new ATOM 0 HD13 ILE C 20 4.085 -1.254 -2.536 1.00 0.00 H new ATOM 1955 N THR C 21 1.889 1.555 -5.724 1.00 0.00 N ATOM 1956 CA THR C 21 1.283 2.306 -6.816 1.00 0.00 C ATOM 1957 C THR C 21 -0.238 2.224 -6.758 1.00 0.00 C ATOM 1958 O THR C 21 -0.790 1.234 -6.278 1.00 0.00 O ATOM 1959 CB THR C 21 1.798 1.717 -8.135 1.00 0.00 C ATOM 1960 OG1 THR C 21 3.205 1.745 -8.162 1.00 0.00 O ATOM 1961 CG2 THR C 21 1.282 2.475 -9.357 1.00 0.00 C ATOM 0 H THR C 21 1.401 0.690 -5.491 1.00 0.00 H new ATOM 0 HA THR C 21 1.555 3.359 -6.736 1.00 0.00 H new ATOM 0 HB THR C 21 1.427 0.693 -8.182 1.00 0.00 H new ATOM 0 HG1 THR C 21 3.512 2.669 -8.272 1.00 0.00 H new ATOM 0 HG21 THR C 21 1.677 2.016 -10.263 1.00 0.00 H new ATOM 0 HG22 THR C 21 0.193 2.436 -9.376 1.00 0.00 H new ATOM 0 HG23 THR C 21 1.607 3.514 -9.305 1.00 0.00 H new ATOM 1969 N ILE C 22 -0.913 3.266 -7.246 1.00 0.00 N ATOM 1970 CA ILE C 22 -2.363 3.289 -7.368 1.00 0.00 C ATOM 1971 C ILE C 22 -2.705 3.087 -8.839 1.00 0.00 C ATOM 1972 O ILE C 22 -2.059 3.664 -9.712 1.00 0.00 O ATOM 1973 CB ILE C 22 -2.912 4.614 -6.809 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -4.421 4.808 -7.025 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -2.199 5.804 -7.448 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -5.239 3.794 -6.232 1.00 0.00 C ATOM 0 H ILE C 22 -0.461 4.122 -7.569 1.00 0.00 H new ATOM 0 HA ILE C 22 -2.828 2.492 -6.788 1.00 0.00 H new ATOM 0 HB ILE C 22 -2.728 4.562 -5.736 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -4.705 5.817 -6.727 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -4.652 4.712 -8.086 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -2.601 6.731 -7.040 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -1.132 5.746 -7.234 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -2.355 5.785 -8.527 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -6.301 3.963 -6.411 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -4.974 2.785 -6.549 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -5.027 3.908 -5.169 1.00 0.00 H new ATOM 1988 N LEU C 23 -3.724 2.273 -9.114 1.00 0.00 N ATOM 1989 CA LEU C 23 -4.068 1.932 -10.484 1.00 0.00 C ATOM 1990 C LEU C 23 -5.395 2.568 -10.875 1.00 0.00 C ATOM 1991 O LEU C 23 -5.669 2.756 -12.061 1.00 0.00 O ATOM 1992 CB LEU C 23 -4.159 0.412 -10.622 1.00 0.00 C ATOM 1993 CG LEU C 23 -2.926 -0.298 -10.058 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -3.125 -1.800 -10.195 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -1.651 0.110 -10.788 1.00 0.00 C ATOM 0 H LEU C 23 -4.320 1.842 -8.407 1.00 0.00 H new ATOM 0 HA LEU C 23 -3.293 2.313 -11.149 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -5.049 0.055 -10.104 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -4.276 0.151 -11.674 1.00 0.00 H new ATOM 0 HG LEU C 23 -2.814 -0.013 -9.012 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -2.254 -2.320 -9.797 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -4.013 -2.102 -9.639 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -3.251 -2.056 -11.247 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -0.800 -0.417 -10.356 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -1.739 -0.146 -11.844 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -1.502 1.185 -10.686 1.00 0.00 H new ATOM 2007 N GLY C 24 -6.216 2.905 -9.878 1.00 0.00 N ATOM 2008 CA GLY C 24 -7.435 3.657 -10.113 1.00 0.00 C ATOM 2009 C GLY C 24 -8.447 3.469 -8.996 1.00 0.00 C ATOM 2010 O GLY C 24 -8.138 2.895 -7.952 1.00 0.00 O ATOM 0 H GLY C 24 -6.052 2.665 -8.900 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -7.194 4.716 -10.209 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -7.877 3.344 -11.059 1.00 0.00 H new ATOM 2014 N VAL C 25 -9.665 3.959 -9.227 1.00 0.00 N ATOM 2015 CA VAL C 25 -10.745 3.894 -8.254 1.00 0.00 C ATOM 2016 C VAL C 25 -11.979 3.279 -8.908 1.00 0.00 C ATOM 2017 O VAL C 25 -12.099 3.248 -10.133 1.00 0.00 O ATOM 2018 CB VAL C 25 -11.051 5.292 -7.697 1.00 0.00 C ATOM 2019 CG1 VAL C 25 -9.810 5.900 -7.038 1.00 0.00 C ATOM 2020 CG2 VAL C 25 -11.538 6.241 -8.794 1.00 0.00 C ATOM 0 H VAL C 25 -9.927 4.414 -10.101 1.00 0.00 H new ATOM 0 HA VAL C 25 -10.442 3.265 -7.417 1.00 0.00 H new ATOM 0 HB VAL C 25 -11.841 5.170 -6.956 1.00 0.00 H new ATOM 0 HG11 VAL C 25 -10.052 6.890 -6.651 1.00 0.00 H new ATOM 0 HG12 VAL C 25 -9.483 5.260 -6.219 1.00 0.00 H new ATOM 0 HG13 VAL C 25 -9.011 5.983 -7.775 1.00 0.00 H new ATOM 0 HG21 VAL C 25 -11.745 7.220 -8.363 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -10.769 6.337 -9.560 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -12.448 5.843 -9.242 1.00 0.00 H new ATOM 2030 N SER C 26 -12.899 2.793 -8.073 1.00 0.00 N ATOM 2031 CA SER C 26 -14.109 2.111 -8.512 1.00 0.00 C ATOM 2032 C SER C 26 -15.228 2.415 -7.521 1.00 0.00 C ATOM 2033 O SER C 26 -15.857 1.508 -6.973 1.00 0.00 O ATOM 2034 CB SER C 26 -13.843 0.602 -8.599 1.00 0.00 C ATOM 2035 OG SER C 26 -12.952 0.324 -9.660 1.00 0.00 O ATOM 0 H SER C 26 -12.820 2.865 -7.059 1.00 0.00 H new ATOM 0 HA SER C 26 -14.408 2.460 -9.500 1.00 0.00 H new ATOM 0 HB2 SER C 26 -13.423 0.245 -7.659 1.00 0.00 H new ATOM 0 HB3 SER C 26 -14.781 0.068 -8.753 1.00 0.00 H new ATOM 0 HG SER C 26 -12.788 -0.641 -9.705 1.00 0.00 H new ATOM 2041 N GLY C 27 -15.473 3.706 -7.282 1.00 0.00 N ATOM 2042 CA GLY C 27 -16.463 4.127 -6.309 1.00 0.00 C ATOM 2043 C GLY C 27 -15.920 3.890 -4.906 1.00 0.00 C ATOM 2044 O GLY C 27 -14.816 4.331 -4.584 1.00 0.00 O ATOM 0 H GLY C 27 -14.994 4.473 -7.754 1.00 0.00 H new ATOM 0 HA2 GLY C 27 -16.700 5.182 -6.447 1.00 0.00 H new ATOM 0 HA3 GLY C 27 -17.390 3.571 -6.452 1.00 0.00 H new ATOM 2048 N GLN C 28 -16.691 3.190 -4.072 1.00 0.00 N ATOM 2049 CA GLN C 28 -16.264 2.832 -2.731 1.00 0.00 C ATOM 2050 C GLN C 28 -15.110 1.822 -2.780 1.00 0.00 C ATOM 2051 O GLN C 28 -14.474 1.571 -1.758 1.00 0.00 O ATOM 2052 CB GLN C 28 -17.474 2.276 -1.975 1.00 0.00 C ATOM 2053 CG GLN C 28 -17.151 1.986 -0.508 1.00 0.00 C ATOM 2054 CD GLN C 28 -18.417 1.709 0.296 1.00 0.00 C ATOM 2055 OE1 GLN C 28 -18.739 2.440 1.229 1.00 0.00 O ATOM 2056 NE2 GLN C 28 -19.144 0.652 -0.056 1.00 0.00 N ATOM 0 H GLN C 28 -17.625 2.859 -4.312 1.00 0.00 H new ATOM 0 HA GLN C 28 -15.887 3.711 -2.207 1.00 0.00 H new ATOM 0 HB2 GLN C 28 -18.296 2.990 -2.031 1.00 0.00 H new ATOM 0 HB3 GLN C 28 -17.814 1.360 -2.459 1.00 0.00 H new ATOM 0 HG2 GLN C 28 -16.482 1.128 -0.444 1.00 0.00 H new ATOM 0 HG3 GLN C 28 -16.622 2.835 -0.076 1.00 0.00 H new ATOM 0 HE21 GLN C 28 -18.847 0.066 -0.836 1.00 0.00 H new ATOM 0 HE22 GLN C 28 -19.998 0.428 0.454 1.00 0.00 H new ATOM 2065 N GLN C 29 -14.831 1.242 -3.954 1.00 0.00 N ATOM 2066 CA GLN C 29 -13.735 0.293 -4.111 1.00 0.00 C ATOM 2067 C GLN C 29 -12.503 0.991 -4.686 1.00 0.00 C ATOM 2068 O GLN C 29 -12.598 2.091 -5.233 1.00 0.00 O ATOM 2069 CB GLN C 29 -14.143 -0.852 -5.037 1.00 0.00 C ATOM 2070 CG GLN C 29 -15.399 -1.587 -4.573 1.00 0.00 C ATOM 2071 CD GLN C 29 -15.641 -2.800 -5.457 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -16.344 -2.725 -6.461 1.00 0.00 O ATOM 2073 NE2 GLN C 29 -15.053 -3.933 -5.083 1.00 0.00 N ATOM 0 H GLN C 29 -15.356 1.418 -4.811 1.00 0.00 H new ATOM 0 HA GLN C 29 -13.496 -0.110 -3.127 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -14.311 -0.457 -6.039 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -13.320 -1.563 -5.108 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -15.286 -1.899 -3.535 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -16.259 -0.918 -4.614 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -14.476 -3.955 -4.242 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -15.179 -4.780 -5.637 1.00 0.00 H new ATOM 2082 N VAL C 30 -11.346 0.342 -4.562 1.00 0.00 N ATOM 2083 CA VAL C 30 -10.062 0.881 -4.996 1.00 0.00 C ATOM 2084 C VAL C 30 -9.199 -0.242 -5.571 1.00 0.00 C ATOM 2085 O VAL C 30 -9.331 -1.398 -5.170 1.00 0.00 O ATOM 2086 CB VAL C 30 -9.359 1.544 -3.800 1.00 0.00 C ATOM 2087 CG1 VAL C 30 -7.950 2.007 -4.171 1.00 0.00 C ATOM 2088 CG2 VAL C 30 -10.141 2.765 -3.308 1.00 0.00 C ATOM 0 H VAL C 30 -11.276 -0.588 -4.150 1.00 0.00 H new ATOM 0 HA VAL C 30 -10.219 1.629 -5.773 1.00 0.00 H new ATOM 0 HB VAL C 30 -9.307 0.791 -3.013 1.00 0.00 H new ATOM 0 HG11 VAL C 30 -7.480 2.471 -3.304 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -7.357 1.149 -4.490 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -8.007 2.731 -4.984 1.00 0.00 H new ATOM 0 HG21 VAL C 30 -9.621 3.214 -2.462 1.00 0.00 H new ATOM 0 HG22 VAL C 30 -10.220 3.495 -4.114 1.00 0.00 H new ATOM 0 HG23 VAL C 30 -11.139 2.457 -2.998 1.00 0.00 H new ATOM 2098 N ARG C 31 -8.315 0.103 -6.518 1.00 0.00 N ATOM 2099 CA ARG C 31 -7.419 -0.829 -7.192 1.00 0.00 C ATOM 2100 C ARG C 31 -5.989 -0.315 -7.049 1.00 0.00 C ATOM 2101 O ARG C 31 -5.657 0.759 -7.551 1.00 0.00 O ATOM 2102 CB ARG C 31 -7.827 -0.936 -8.663 1.00 0.00 C ATOM 2103 CG ARG C 31 -8.321 -2.336 -9.035 1.00 0.00 C ATOM 2104 CD ARG C 31 -7.177 -3.352 -9.098 1.00 0.00 C ATOM 2105 NE ARG C 31 -7.644 -4.627 -9.649 1.00 0.00 N ATOM 2106 CZ ARG C 31 -7.605 -4.947 -10.947 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -7.056 -4.127 -11.837 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -8.118 -6.097 -11.360 1.00 0.00 N ATOM 0 H ARG C 31 -8.206 1.065 -6.840 1.00 0.00 H new ATOM 0 HA ARG C 31 -7.480 -1.822 -6.748 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -8.612 -0.210 -8.872 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.976 -0.676 -9.292 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -9.059 -2.666 -8.304 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -8.825 -2.298 -10.001 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -6.369 -2.959 -9.714 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -6.769 -3.510 -8.100 1.00 0.00 H new ATOM 0 HE ARG C 31 -8.024 -5.316 -9.000 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -6.656 -3.239 -11.534 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -7.034 -4.386 -12.823 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -8.542 -6.737 -10.688 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -8.089 -6.342 -12.350 1.00 0.00 H new ATOM 2122 N ILE C 32 -5.152 -1.091 -6.360 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.785 -0.721 -6.007 1.00 0.00 C ATOM 2124 C ILE C 32 -2.839 -1.902 -6.214 1.00 0.00 C ATOM 2125 O ILE C 32 -3.275 -3.047 -6.300 1.00 0.00 O ATOM 2126 CB ILE C 32 -3.715 -0.260 -4.543 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -4.513 -1.204 -3.632 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -4.224 1.178 -4.434 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -4.318 -0.832 -2.162 1.00 0.00 C ATOM 0 H ILE C 32 -5.415 -2.018 -6.024 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.478 0.099 -6.656 1.00 0.00 H new ATOM 0 HB ILE C 32 -2.678 -0.289 -4.210 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -5.572 -1.154 -3.887 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -4.193 -2.233 -3.797 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -4.174 1.504 -3.395 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.605 1.831 -5.049 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -5.257 1.226 -4.780 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -4.892 -1.514 -1.535 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -3.261 -0.906 -1.905 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -4.661 0.189 -1.997 1.00 0.00 H new ATOM 2141 N GLY C 33 -1.535 -1.617 -6.293 1.00 0.00 N ATOM 2142 CA GLY C 33 -0.530 -2.644 -6.503 1.00 0.00 C ATOM 2143 C GLY C 33 0.715 -2.403 -5.652 1.00 0.00 C ATOM 2144 O GLY C 33 0.879 -1.338 -5.059 1.00 0.00 O ATOM 0 H GLY C 33 -1.157 -0.673 -6.213 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -0.952 -3.620 -6.262 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.251 -2.669 -7.556 1.00 0.00 H new ATOM 2148 N ILE C 34 1.584 -3.415 -5.597 1.00 0.00 N ATOM 2149 CA ILE C 34 2.789 -3.400 -4.779 1.00 0.00 C ATOM 2150 C ILE C 34 3.966 -3.877 -5.622 1.00 0.00 C ATOM 2151 O ILE C 34 3.815 -4.758 -6.471 1.00 0.00 O ATOM 2152 CB ILE C 34 2.606 -4.327 -3.561 1.00 0.00 C ATOM 2153 CG1 ILE C 34 1.510 -3.838 -2.611 1.00 0.00 C ATOM 2154 CG2 ILE C 34 3.913 -4.417 -2.770 1.00 0.00 C ATOM 2155 CD1 ILE C 34 0.132 -4.402 -2.970 1.00 0.00 C ATOM 0 H ILE C 34 1.465 -4.277 -6.128 1.00 0.00 H new ATOM 0 HA ILE C 34 2.979 -2.387 -4.424 1.00 0.00 H new ATOM 0 HB ILE C 34 2.316 -5.301 -3.954 1.00 0.00 H new ATOM 0 HG12 ILE C 34 1.763 -4.126 -1.590 1.00 0.00 H new ATOM 0 HG13 ILE C 34 1.471 -2.749 -2.635 1.00 0.00 H new ATOM 0 HG21 ILE C 34 3.774 -5.074 -1.911 1.00 0.00 H new ATOM 0 HG22 ILE C 34 4.699 -4.818 -3.410 1.00 0.00 H new ATOM 0 HG23 ILE C 34 4.198 -3.423 -2.424 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -0.610 -4.025 -2.266 1.00 0.00 H new ATOM 0 HD12 ILE C 34 -0.136 -4.093 -3.980 1.00 0.00 H new ATOM 0 HD13 ILE C 34 0.160 -5.490 -2.919 1.00 0.00 H new ATOM 2167 N ASN C 35 5.138 -3.289 -5.382 1.00 0.00 N ATOM 2168 CA ASN C 35 6.368 -3.569 -6.107 1.00 0.00 C ATOM 2169 C ASN C 35 7.459 -3.946 -5.108 1.00 0.00 C ATOM 2170 O ASN C 35 8.356 -3.158 -4.809 1.00 0.00 O ATOM 2171 CB ASN C 35 6.769 -2.360 -6.954 1.00 0.00 C ATOM 2172 CG ASN C 35 5.789 -2.100 -8.084 1.00 0.00 C ATOM 2173 OD1 ASN C 35 5.878 -2.716 -9.143 1.00 0.00 O ATOM 2174 ND2 ASN C 35 4.846 -1.188 -7.871 1.00 0.00 N ATOM 0 H ASN C 35 5.257 -2.584 -4.655 1.00 0.00 H new ATOM 0 HA ASN C 35 6.218 -4.406 -6.789 1.00 0.00 H new ATOM 0 HB2 ASN C 35 6.830 -1.477 -6.318 1.00 0.00 H new ATOM 0 HB3 ASN C 35 7.764 -2.523 -7.369 1.00 0.00 H new ATOM 0 HD21 ASN C 35 4.164 -0.979 -8.600 1.00 0.00 H new ATOM 0 HD22 ASN C 35 4.804 -0.697 -6.978 1.00 0.00 H new ATOM 2181 N ALA C 36 7.364 -5.174 -4.597 1.00 0.00 N ATOM 2182 CA ALA C 36 8.325 -5.752 -3.671 1.00 0.00 C ATOM 2183 C ALA C 36 8.715 -7.132 -4.194 1.00 0.00 C ATOM 2184 O ALA C 36 7.975 -7.722 -4.983 1.00 0.00 O ATOM 2185 CB ALA C 36 7.679 -5.854 -2.289 1.00 0.00 C ATOM 0 H ALA C 36 6.596 -5.806 -4.824 1.00 0.00 H new ATOM 0 HA ALA C 36 9.219 -5.133 -3.590 1.00 0.00 H new ATOM 0 HB1 ALA C 36 8.391 -6.286 -1.586 1.00 0.00 H new ATOM 0 HB2 ALA C 36 7.390 -4.860 -1.948 1.00 0.00 H new ATOM 0 HB3 ALA C 36 6.795 -6.489 -2.347 1.00 0.00 H new ATOM 2191 N PRO C 37 9.865 -7.666 -3.769 1.00 0.00 N ATOM 2192 CA PRO C 37 10.305 -8.982 -4.169 1.00 0.00 C ATOM 2193 C PRO C 37 9.524 -10.030 -3.388 1.00 0.00 C ATOM 2194 O PRO C 37 9.047 -9.763 -2.287 1.00 0.00 O ATOM 2195 CB PRO C 37 11.786 -9.018 -3.802 1.00 0.00 C ATOM 2196 CG PRO C 37 11.861 -8.110 -2.572 1.00 0.00 C ATOM 2197 CD PRO C 37 10.820 -7.037 -2.873 1.00 0.00 C ATOM 0 HA PRO C 37 10.148 -9.187 -5.228 1.00 0.00 H new ATOM 0 HB2 PRO C 37 12.121 -10.030 -3.577 1.00 0.00 H new ATOM 0 HB3 PRO C 37 12.412 -8.649 -4.614 1.00 0.00 H new ATOM 0 HG2 PRO C 37 11.628 -8.652 -1.655 1.00 0.00 H new ATOM 0 HG3 PRO C 37 12.856 -7.683 -2.446 1.00 0.00 H new ATOM 0 HD2 PRO C 37 10.334 -6.694 -1.960 1.00 0.00 H new ATOM 0 HD3 PRO C 37 11.279 -6.164 -3.338 1.00 0.00 H new ATOM 2205 N LYS C 38 9.388 -11.237 -3.942 1.00 0.00 N ATOM 2206 CA LYS C 38 8.734 -12.331 -3.237 1.00 0.00 C ATOM 2207 C LYS C 38 9.606 -12.823 -2.082 1.00 0.00 C ATOM 2208 O LYS C 38 9.225 -13.736 -1.352 1.00 0.00 O ATOM 2209 CB LYS C 38 8.349 -13.440 -4.216 1.00 0.00 C ATOM 2210 CG LYS C 38 7.193 -12.894 -5.053 1.00 0.00 C ATOM 2211 CD LYS C 38 6.522 -13.959 -5.916 1.00 0.00 C ATOM 2212 CE LYS C 38 7.463 -14.426 -7.024 1.00 0.00 C ATOM 2213 NZ LYS C 38 6.777 -15.369 -7.927 1.00 0.00 N ATOM 0 H LYS C 38 9.723 -11.477 -4.875 1.00 0.00 H new ATOM 0 HA LYS C 38 7.806 -11.973 -2.791 1.00 0.00 H new ATOM 0 HB2 LYS C 38 9.194 -13.709 -4.850 1.00 0.00 H new ATOM 0 HB3 LYS C 38 8.050 -14.342 -3.683 1.00 0.00 H new ATOM 0 HG2 LYS C 38 6.450 -12.451 -4.390 1.00 0.00 H new ATOM 0 HG3 LYS C 38 7.563 -12.095 -5.695 1.00 0.00 H new ATOM 0 HD2 LYS C 38 6.233 -14.807 -5.296 1.00 0.00 H new ATOM 0 HD3 LYS C 38 5.608 -13.557 -6.353 1.00 0.00 H new ATOM 0 HE2 LYS C 38 7.820 -13.566 -7.591 1.00 0.00 H new ATOM 0 HE3 LYS C 38 8.339 -14.905 -6.586 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 7.434 -15.675 -8.673 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 6.458 -16.198 -7.386 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 5.955 -14.900 -8.359 1.00 0.00 H new ATOM 2227 N ASP C 39 10.782 -12.211 -1.922 1.00 0.00 N ATOM 2228 CA ASP C 39 11.634 -12.429 -0.766 1.00 0.00 C ATOM 2229 C ASP C 39 10.987 -11.821 0.480 1.00 0.00 C ATOM 2230 O ASP C 39 11.423 -12.110 1.593 1.00 0.00 O ATOM 2231 CB ASP C 39 13.016 -11.816 -1.010 1.00 0.00 C ATOM 2232 CG ASP C 39 13.752 -12.542 -2.134 1.00 0.00 C ATOM 2233 OD1 ASP C 39 14.262 -13.652 -1.859 1.00 0.00 O ATOM 2234 OD2 ASP C 39 13.798 -11.986 -3.253 1.00 0.00 O ATOM 0 H ASP C 39 11.165 -11.549 -2.597 1.00 0.00 H new ATOM 0 HA ASP C 39 11.755 -13.501 -0.607 1.00 0.00 H new ATOM 0 HB2 ASP C 39 12.909 -10.761 -1.264 1.00 0.00 H new ATOM 0 HB3 ASP C 39 13.605 -11.866 -0.094 1.00 0.00 H new ATOM 2239 N VAL C 40 9.949 -10.991 0.304 1.00 0.00 N ATOM 2240 CA VAL C 40 9.153 -10.488 1.413 1.00 0.00 C ATOM 2241 C VAL C 40 7.670 -10.730 1.146 1.00 0.00 C ATOM 2242 O VAL C 40 7.202 -10.657 0.009 1.00 0.00 O ATOM 2243 CB VAL C 40 9.447 -9.005 1.672 1.00 0.00 C ATOM 2244 CG1 VAL C 40 10.944 -8.779 1.896 1.00 0.00 C ATOM 2245 CG2 VAL C 40 8.967 -8.109 0.532 1.00 0.00 C ATOM 0 H VAL C 40 9.645 -10.656 -0.610 1.00 0.00 H new ATOM 0 HA VAL C 40 9.427 -11.032 2.317 1.00 0.00 H new ATOM 0 HB VAL C 40 8.895 -8.733 2.571 1.00 0.00 H new ATOM 0 HG11 VAL C 40 11.129 -7.720 2.078 1.00 0.00 H new ATOM 0 HG12 VAL C 40 11.274 -9.358 2.758 1.00 0.00 H new ATOM 0 HG13 VAL C 40 11.496 -9.097 1.012 1.00 0.00 H new ATOM 0 HG21 VAL C 40 9.199 -7.069 0.764 1.00 0.00 H new ATOM 0 HG22 VAL C 40 9.469 -8.395 -0.392 1.00 0.00 H new ATOM 0 HG23 VAL C 40 7.890 -8.222 0.409 1.00 0.00 H new ATOM 2255 N ALA C 41 6.931 -11.024 2.215 1.00 0.00 N ATOM 2256 CA ALA C 41 5.518 -11.341 2.131 1.00 0.00 C ATOM 2257 C ALA C 41 4.707 -10.108 1.738 1.00 0.00 C ATOM 2258 O ALA C 41 5.019 -8.997 2.153 1.00 0.00 O ATOM 2259 CB ALA C 41 5.058 -11.861 3.494 1.00 0.00 C ATOM 0 H ALA C 41 7.303 -11.047 3.164 1.00 0.00 H new ATOM 0 HA ALA C 41 5.360 -12.100 1.365 1.00 0.00 H new ATOM 0 HB1 ALA C 41 3.997 -12.105 3.451 1.00 0.00 H new ATOM 0 HB2 ALA C 41 5.626 -12.755 3.753 1.00 0.00 H new ATOM 0 HB3 ALA C 41 5.224 -11.094 4.251 1.00 0.00 H new ATOM 2265 N VAL C 42 3.658 -10.317 0.936 1.00 0.00 N ATOM 2266 CA VAL C 42 2.708 -9.278 0.559 1.00 0.00 C ATOM 2267 C VAL C 42 1.348 -9.938 0.386 1.00 0.00 C ATOM 2268 O VAL C 42 1.178 -10.756 -0.521 1.00 0.00 O ATOM 2269 CB VAL C 42 3.138 -8.608 -0.754 1.00 0.00 C ATOM 2270 CG1 VAL C 42 2.128 -7.537 -1.155 1.00 0.00 C ATOM 2271 CG2 VAL C 42 4.501 -7.932 -0.636 1.00 0.00 C ATOM 0 H VAL C 42 3.446 -11.227 0.527 1.00 0.00 H new ATOM 0 HA VAL C 42 2.667 -8.508 1.329 1.00 0.00 H new ATOM 0 HB VAL C 42 3.193 -9.399 -1.502 1.00 0.00 H new ATOM 0 HG11 VAL C 42 2.444 -7.069 -2.087 1.00 0.00 H new ATOM 0 HG12 VAL C 42 1.148 -7.994 -1.292 1.00 0.00 H new ATOM 0 HG13 VAL C 42 2.069 -6.781 -0.372 1.00 0.00 H new ATOM 0 HG21 VAL C 42 4.763 -7.472 -1.589 1.00 0.00 H new ATOM 0 HG22 VAL C 42 4.461 -7.166 0.138 1.00 0.00 H new ATOM 0 HG23 VAL C 42 5.254 -8.675 -0.373 1.00 0.00 H new ATOM 2281 N HIS C 43 0.386 -9.582 1.251 1.00 0.00 N ATOM 2282 CA HIS C 43 -0.948 -10.171 1.234 1.00 0.00 C ATOM 2283 C HIS C 43 -2.002 -9.167 1.703 1.00 0.00 C ATOM 2284 O HIS C 43 -1.677 -8.120 2.261 1.00 0.00 O ATOM 2285 CB HIS C 43 -1.019 -11.380 2.178 1.00 0.00 C ATOM 2286 CG HIS C 43 0.050 -12.422 1.989 1.00 0.00 C ATOM 2287 ND1 HIS C 43 -0.108 -13.632 1.309 1.00 0.00 N ATOM 2288 CD2 HIS C 43 1.329 -12.337 2.462 1.00 0.00 C ATOM 2289 CE1 HIS C 43 1.084 -14.248 1.393 1.00 0.00 C ATOM 2290 NE2 HIS C 43 1.965 -13.493 2.074 1.00 0.00 N ATOM 0 H HIS C 43 0.517 -8.879 1.978 1.00 0.00 H new ATOM 0 HA HIS C 43 -1.146 -10.472 0.205 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -0.970 -11.018 3.205 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -1.991 -11.857 2.054 1.00 0.00 H new ATOM 0 HD2 HIS C 43 1.756 -11.523 3.029 1.00 0.00 H new ATOM 0 HE1 HIS C 43 1.304 -15.217 0.971 1.00 0.00 H new ATOM 0 HE2 HIS C 43 2.936 -13.736 2.269 1.00 0.00 H new ATOM 2298 N ARG C 44 -3.274 -9.504 1.471 1.00 0.00 N ATOM 2299 CA ARG C 44 -4.427 -8.774 1.990 1.00 0.00 C ATOM 2300 C ARG C 44 -4.459 -8.904 3.514 1.00 0.00 C ATOM 2301 O ARG C 44 -4.052 -9.932 4.052 1.00 0.00 O ATOM 2302 CB ARG C 44 -5.691 -9.368 1.352 1.00 0.00 C ATOM 2303 CG ARG C 44 -5.862 -10.832 1.783 1.00 0.00 C ATOM 2304 CD ARG C 44 -6.576 -11.698 0.743 1.00 0.00 C ATOM 2305 NE ARG C 44 -8.024 -11.779 0.953 1.00 0.00 N ATOM 2306 CZ ARG C 44 -8.819 -12.625 0.287 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -8.316 -13.433 -0.644 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -10.121 -12.673 0.544 1.00 0.00 N ATOM 0 H ARG C 44 -3.533 -10.311 0.904 1.00 0.00 H new ATOM 0 HA ARG C 44 -4.368 -7.714 1.744 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -6.565 -8.789 1.650 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -5.623 -9.306 0.266 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -4.880 -11.259 1.987 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -6.423 -10.864 2.717 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -6.382 -11.295 -0.251 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -6.155 -12.703 0.767 1.00 0.00 H new ATOM 0 HE ARG C 44 -8.448 -11.158 1.643 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -7.318 -13.410 -0.854 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -8.929 -14.075 -1.147 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -10.523 -12.062 1.254 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -10.719 -13.321 0.031 1.00 0.00 H new ATOM 2322 N GLU C 45 -4.942 -7.886 4.226 1.00 0.00 N ATOM 2323 CA GLU C 45 -5.034 -7.963 5.683 1.00 0.00 C ATOM 2324 C GLU C 45 -6.038 -9.038 6.102 1.00 0.00 C ATOM 2325 O GLU C 45 -5.991 -9.532 7.226 1.00 0.00 O ATOM 2326 CB GLU C 45 -5.393 -6.591 6.261 1.00 0.00 C ATOM 2327 CG GLU C 45 -6.845 -6.176 5.987 1.00 0.00 C ATOM 2328 CD GLU C 45 -7.830 -6.755 6.999 1.00 0.00 C ATOM 2329 OE1 GLU C 45 -7.604 -6.551 8.213 1.00 0.00 O ATOM 2330 OE2 GLU C 45 -8.804 -7.401 6.555 1.00 0.00 O ATOM 0 H GLU C 45 -5.272 -7.009 3.824 1.00 0.00 H new ATOM 0 HA GLU C 45 -4.064 -8.251 6.088 1.00 0.00 H new ATOM 0 HB2 GLU C 45 -5.223 -6.603 7.338 1.00 0.00 H new ATOM 0 HB3 GLU C 45 -4.723 -5.841 5.841 1.00 0.00 H new ATOM 0 HG2 GLU C 45 -6.915 -5.088 6.001 1.00 0.00 H new ATOM 0 HG3 GLU C 45 -7.128 -6.501 4.986 1.00 0.00 H new ATOM 2337 N GLU C 46 -6.948 -9.394 5.192 1.00 0.00 N ATOM 2338 CA GLU C 46 -8.008 -10.363 5.418 1.00 0.00 C ATOM 2339 C GLU C 46 -7.476 -11.799 5.461 1.00 0.00 C ATOM 2340 O GLU C 46 -8.221 -12.723 5.791 1.00 0.00 O ATOM 2341 CB GLU C 46 -9.028 -10.174 4.295 1.00 0.00 C ATOM 2342 CG GLU C 46 -10.362 -10.862 4.572 1.00 0.00 C ATOM 2343 CD GLU C 46 -11.350 -10.511 3.463 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -11.924 -9.401 3.532 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -11.522 -11.358 2.558 1.00 0.00 O ATOM 0 H GLU C 46 -6.963 -9.000 4.251 1.00 0.00 H new ATOM 0 HA GLU C 46 -8.470 -10.197 6.391 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -9.200 -9.108 4.145 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -8.612 -10.563 3.366 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -10.224 -11.942 4.623 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -10.754 -10.545 5.538 1.00 0.00 H new ATOM 2352 N ILE C 47 -6.196 -11.998 5.128 1.00 0.00 N ATOM 2353 CA ILE C 47 -5.580 -13.321 5.107 1.00 0.00 C ATOM 2354 C ILE C 47 -4.208 -13.289 5.776 1.00 0.00 C ATOM 2355 O ILE C 47 -3.734 -14.328 6.226 1.00 0.00 O ATOM 2356 CB ILE C 47 -5.501 -13.821 3.650 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -6.837 -14.466 3.254 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -4.342 -14.790 3.397 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -6.720 -15.282 1.960 1.00 0.00 C ATOM 0 H ILE C 47 -5.561 -11.244 4.866 1.00 0.00 H new ATOM 0 HA ILE C 47 -6.192 -14.020 5.677 1.00 0.00 H new ATOM 0 HB ILE C 47 -5.304 -12.949 3.026 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -7.180 -15.113 4.061 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -7.591 -13.689 3.126 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -4.348 -15.100 2.352 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -3.398 -14.295 3.623 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -4.454 -15.666 4.036 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.688 -15.720 1.717 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -6.403 -14.630 1.146 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -5.986 -16.076 2.096 1.00 0.00 H new ATOM 2371 N TYR C 48 -3.548 -12.131 5.867 1.00 0.00 N ATOM 2372 CA TYR C 48 -2.222 -12.105 6.461 1.00 0.00 C ATOM 2373 C TYR C 48 -2.289 -12.542 7.918 1.00 0.00 C ATOM 2374 O TYR C 48 -1.362 -13.164 8.433 1.00 0.00 O ATOM 2375 CB TYR C 48 -1.623 -10.706 6.358 1.00 0.00 C ATOM 2376 CG TYR C 48 -0.250 -10.661 6.987 1.00 0.00 C ATOM 2377 CD1 TYR C 48 0.879 -10.966 6.213 1.00 0.00 C ATOM 2378 CD2 TYR C 48 -0.116 -10.330 8.344 1.00 0.00 C ATOM 2379 CE1 TYR C 48 2.154 -10.953 6.797 1.00 0.00 C ATOM 2380 CE2 TYR C 48 1.152 -10.321 8.936 1.00 0.00 C ATOM 2381 CZ TYR C 48 2.293 -10.619 8.161 1.00 0.00 C ATOM 2382 OH TYR C 48 3.529 -10.592 8.734 1.00 0.00 O ATOM 0 H TYR C 48 -3.901 -11.229 5.546 1.00 0.00 H new ATOM 0 HA TYR C 48 -1.583 -12.799 5.916 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -1.558 -10.410 5.311 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -2.278 -9.988 6.852 1.00 0.00 H new ATOM 0 HD1 TYR C 48 0.767 -11.211 5.167 1.00 0.00 H new ATOM 0 HD2 TYR C 48 -0.989 -10.083 8.930 1.00 0.00 H new ATOM 0 HE1 TYR C 48 3.024 -11.197 6.206 1.00 0.00 H new ATOM 0 HE2 TYR C 48 1.257 -10.086 9.985 1.00 0.00 H new ATOM 0 HH TYR C 48 4.193 -10.319 8.067 1.00 0.00 H new ATOM 2392 N GLN C 49 -3.397 -12.213 8.582 1.00 0.00 N ATOM 2393 CA GLN C 49 -3.599 -12.538 9.983 1.00 0.00 C ATOM 2394 C GLN C 49 -3.867 -14.030 10.173 1.00 0.00 C ATOM 2395 O GLN C 49 -3.812 -14.526 11.296 1.00 0.00 O ATOM 2396 CB GLN C 49 -4.753 -11.693 10.516 1.00 0.00 C ATOM 2397 CG GLN C 49 -4.444 -10.217 10.268 1.00 0.00 C ATOM 2398 CD GLN C 49 -5.530 -9.308 10.830 1.00 0.00 C ATOM 2399 OE1 GLN C 49 -5.663 -9.161 12.042 1.00 0.00 O ATOM 2400 NE2 GLN C 49 -6.314 -8.694 9.948 1.00 0.00 N ATOM 0 H GLN C 49 -4.178 -11.713 8.157 1.00 0.00 H new ATOM 0 HA GLN C 49 -2.693 -12.310 10.545 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -5.683 -11.971 10.021 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -4.892 -11.875 11.582 1.00 0.00 H new ATOM 0 HG2 GLN C 49 -3.487 -9.965 10.724 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -4.342 -10.042 9.197 1.00 0.00 H new ATOM 0 HE21 GLN C 49 -6.171 -8.842 8.949 1.00 0.00 H new ATOM 0 HE22 GLN C 49 -7.058 -8.075 10.271 1.00 0.00 H new ATOM 2409 N ARG C 50 -4.163 -14.746 9.080 1.00 0.00 N ATOM 2410 CA ARG C 50 -4.365 -16.188 9.121 1.00 0.00 C ATOM 2411 C ARG C 50 -3.057 -16.907 8.803 1.00 0.00 C ATOM 2412 O ARG C 50 -2.842 -18.022 9.271 1.00 0.00 O ATOM 2413 CB ARG C 50 -5.512 -16.576 8.177 1.00 0.00 C ATOM 2414 CG ARG C 50 -5.045 -17.201 6.859 1.00 0.00 C ATOM 2415 CD ARG C 50 -6.235 -17.380 5.915 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.183 -18.379 6.428 1.00 0.00 N ATOM 2417 CZ ARG C 50 -8.297 -18.747 5.792 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -8.617 -18.215 4.613 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -9.100 -19.659 6.336 1.00 0.00 N ATOM 0 H ARG C 50 -4.267 -14.338 8.151 1.00 0.00 H new ATOM 0 HA ARG C 50 -4.658 -16.501 10.123 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -6.169 -17.279 8.689 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -6.105 -15.688 7.957 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -4.292 -16.566 6.392 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -4.574 -18.165 7.051 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -6.745 -16.425 5.786 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -5.878 -17.687 4.932 1.00 0.00 H new ATOM 0 HE ARG C 50 -6.977 -18.818 7.325 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -8.007 -17.518 4.186 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -9.471 -18.505 4.138 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -8.863 -20.075 7.237 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -9.952 -19.942 5.852 1.00 0.00 H new ATOM 2433 N ILE C 51 -2.180 -16.277 8.013 1.00 0.00 N ATOM 2434 CA ILE C 51 -0.854 -16.808 7.710 1.00 0.00 C ATOM 2435 C ILE C 51 -0.011 -16.763 8.974 1.00 0.00 C ATOM 2436 O ILE C 51 0.627 -17.746 9.346 1.00 0.00 O ATOM 2437 CB ILE C 51 -0.204 -15.963 6.613 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -1.004 -16.109 5.314 1.00 0.00 C ATOM 2439 CG2 ILE C 51 1.240 -16.398 6.359 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -0.543 -15.096 4.276 1.00 0.00 C ATOM 0 H ILE C 51 -2.375 -15.381 7.566 1.00 0.00 H new ATOM 0 HA ILE C 51 -0.932 -17.837 7.360 1.00 0.00 H new ATOM 0 HB ILE C 51 -0.201 -14.924 6.943 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -0.885 -17.119 4.921 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -2.066 -15.969 5.518 1.00 0.00 H new ATOM 0 HG21 ILE C 51 1.674 -15.778 5.574 1.00 0.00 H new ATOM 0 HG22 ILE C 51 1.821 -16.284 7.274 1.00 0.00 H new ATOM 0 HG23 ILE C 51 1.256 -17.442 6.047 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -1.126 -15.220 3.363 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -0.686 -14.087 4.664 1.00 0.00 H new ATOM 0 HD13 ILE C 51 0.513 -15.255 4.057 1.00 0.00 H new ATOM 2452 N GLN C 52 -0.010 -15.612 9.642 1.00 0.00 N ATOM 2453 CA GLN C 52 0.782 -15.399 10.839 1.00 0.00 C ATOM 2454 C GLN C 52 0.158 -16.078 12.055 1.00 0.00 C ATOM 2455 O GLN C 52 0.649 -15.919 13.171 1.00 0.00 O ATOM 2456 CB GLN C 52 0.991 -13.895 11.043 1.00 0.00 C ATOM 2457 CG GLN C 52 1.786 -13.339 9.863 1.00 0.00 C ATOM 2458 CD GLN C 52 3.046 -14.150 9.600 1.00 0.00 C ATOM 2459 OE1 GLN C 52 3.958 -14.179 10.423 1.00 0.00 O ATOM 2460 NE2 GLN C 52 3.102 -14.810 8.448 1.00 0.00 N ATOM 0 H GLN C 52 -0.562 -14.801 9.363 1.00 0.00 H new ATOM 0 HA GLN C 52 1.759 -15.865 10.714 1.00 0.00 H new ATOM 0 HB2 GLN C 52 0.029 -13.388 11.121 1.00 0.00 H new ATOM 0 HB3 GLN C 52 1.524 -13.712 11.976 1.00 0.00 H new ATOM 0 HG2 GLN C 52 1.160 -13.339 8.970 1.00 0.00 H new ATOM 0 HG3 GLN C 52 2.056 -12.302 10.063 1.00 0.00 H new ATOM 0 HE21 GLN C 52 2.322 -14.759 7.793 1.00 0.00 H new ATOM 0 HE22 GLN C 52 3.925 -15.368 8.219 1.00 0.00 H new ATOM 2469 N ALA C 53 -0.926 -16.838 11.848 1.00 0.00 N ATOM 2470 CA ALA C 53 -1.570 -17.565 12.922 1.00 0.00 C ATOM 2471 C ALA C 53 -0.743 -18.781 13.354 1.00 0.00 C ATOM 2472 O ALA C 53 -0.955 -19.304 14.444 1.00 0.00 O ATOM 2473 CB ALA C 53 -2.960 -18.011 12.465 1.00 0.00 C ATOM 0 H ALA C 53 -1.369 -16.958 10.937 1.00 0.00 H new ATOM 0 HA ALA C 53 -1.656 -16.903 13.784 1.00 0.00 H new ATOM 0 HB1 ALA C 53 -3.449 -18.559 13.270 1.00 0.00 H new ATOM 0 HB2 ALA C 53 -3.556 -17.136 12.207 1.00 0.00 H new ATOM 0 HB3 ALA C 53 -2.866 -18.656 11.592 1.00 0.00 H new ATOM 2479 N GLY C 54 0.195 -19.232 12.508 1.00 0.00 N ATOM 2480 CA GLY C 54 1.043 -20.375 12.818 1.00 0.00 C ATOM 2481 C GLY C 54 1.134 -21.360 11.651 1.00 0.00 C ATOM 2482 O GLY C 54 1.524 -22.510 11.848 1.00 0.00 O ATOM 0 H GLY C 54 0.381 -18.812 11.597 1.00 0.00 H new ATOM 0 HA2 GLY C 54 2.043 -20.025 13.074 1.00 0.00 H new ATOM 0 HA3 GLY C 54 0.651 -20.889 13.695 1.00 0.00 H new ATOM 2486 N LEU C 55 0.778 -20.913 10.443 1.00 0.00 N ATOM 2487 CA LEU C 55 0.698 -21.760 9.260 1.00 0.00 C ATOM 2488 C LEU C 55 1.254 -21.028 8.035 1.00 0.00 C ATOM 2489 O LEU C 55 1.811 -19.940 8.163 1.00 0.00 O ATOM 2490 CB LEU C 55 -0.762 -22.194 9.073 1.00 0.00 C ATOM 2491 CG LEU C 55 -1.736 -21.015 8.963 1.00 0.00 C ATOM 2492 CD1 LEU C 55 -1.719 -20.385 7.573 1.00 0.00 C ATOM 2493 CD2 LEU C 55 -3.142 -21.528 9.235 1.00 0.00 C ATOM 0 H LEU C 55 0.535 -19.939 10.262 1.00 0.00 H new ATOM 0 HA LEU C 55 1.311 -22.652 9.386 1.00 0.00 H new ATOM 0 HB2 LEU C 55 -0.840 -22.805 8.174 1.00 0.00 H new ATOM 0 HB3 LEU C 55 -1.057 -22.823 9.913 1.00 0.00 H new ATOM 0 HG LEU C 55 -1.432 -20.257 9.685 1.00 0.00 H new ATOM 0 HD11 LEU C 55 -2.424 -19.554 7.541 1.00 0.00 H new ATOM 0 HD12 LEU C 55 -0.716 -20.019 7.352 1.00 0.00 H new ATOM 0 HD13 LEU C 55 -2.004 -21.131 6.832 1.00 0.00 H new ATOM 0 HD21 LEU C 55 -3.851 -20.703 9.161 1.00 0.00 H new ATOM 0 HD22 LEU C 55 -3.398 -22.293 8.502 1.00 0.00 H new ATOM 0 HD23 LEU C 55 -3.186 -21.956 10.237 1.00 0.00 H new ATOM 2505 N THR C 56 1.104 -21.623 6.850 1.00 0.00 N ATOM 2506 CA THR C 56 1.592 -21.026 5.611 1.00 0.00 C ATOM 2507 C THR C 56 0.586 -21.230 4.476 1.00 0.00 C ATOM 2508 O THR C 56 -0.405 -21.940 4.633 1.00 0.00 O ATOM 2509 CB THR C 56 2.953 -21.619 5.242 1.00 0.00 C ATOM 2510 OG1 THR C 56 2.856 -23.024 5.119 1.00 0.00 O ATOM 2511 CG2 THR C 56 3.988 -21.275 6.315 1.00 0.00 C ATOM 0 H THR C 56 0.644 -22.525 6.725 1.00 0.00 H new ATOM 0 HA THR C 56 1.710 -19.953 5.765 1.00 0.00 H new ATOM 0 HB THR C 56 3.267 -21.194 4.289 1.00 0.00 H new ATOM 0 HG1 THR C 56 3.732 -23.393 4.881 1.00 0.00 H new ATOM 0 HG21 THR C 56 4.952 -21.703 6.041 1.00 0.00 H new ATOM 0 HG22 THR C 56 4.081 -20.192 6.397 1.00 0.00 H new ATOM 0 HG23 THR C 56 3.669 -21.685 7.273 1.00 0.00 H new ATOM 2519 N ALA C 57 0.854 -20.596 3.330 1.00 0.00 N ATOM 2520 CA ALA C 57 -0.016 -20.635 2.164 1.00 0.00 C ATOM 2521 C ALA C 57 -0.282 -22.068 1.689 1.00 0.00 C ATOM 2522 O ALA C 57 0.514 -22.972 1.950 1.00 0.00 O ATOM 2523 CB ALA C 57 0.645 -19.822 1.051 1.00 0.00 C ATOM 0 H ALA C 57 1.695 -20.035 3.191 1.00 0.00 H new ATOM 0 HA ALA C 57 -0.984 -20.210 2.431 1.00 0.00 H new ATOM 0 HB1 ALA C 57 0.011 -19.836 0.164 1.00 0.00 H new ATOM 0 HB2 ALA C 57 0.781 -18.793 1.384 1.00 0.00 H new ATOM 0 HB3 ALA C 57 1.615 -20.257 0.810 1.00 0.00 H new