USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 874 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 38 ASN : amide:sc= -0.51 K(o=-0.87,f=-3.1) USER MOD Set 1.2: A 39 SER OG : rot -10:sc= -0.358 USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 3 GLN :FLIP amide:sc= -1.88! C(o=-3.7!,f=-1.9!) USER MOD Single : A 5 SER OG : rot -51:sc= 0.408 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A -1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 79:sc= -0.42 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -2.7 X(o=-2.7,f=-2.8!) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 ASN : amide:sc= -0.498 X(o=-0.5,f=-0.25) USER MOD Single : A 22 SER OG : rot 50:sc= 0.888 USER MOD Single : A 31 THR OG1 : rot 70:sc= 1.29 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.0633 USER MOD Single : A 47 HIS : no HD1:sc= -4.18 K(o=-4.2,f=-5.4!) USER MOD Single : A 48 SER OG : rot 180:sc= -0.0829 USER MOD Single : A 49 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.00817) USER MOD Single : A 51 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 54 THR OG1 : rot -67:sc= 0.467 USER MOD Single : A 55 ASN : amide:sc= 0 X(o=0,f=-0.094) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -4.82! C(o=-4.8!,f=-4.9!) USER MOD Single : A 74 GLN : amide:sc= -2.21 X(o=-2.2,f=-1.7) USER MOD Single : A 79 HIS : no HD1:sc=-0.00454 X(o=-0.0045,f=0) USER MOD Single : A 85 LYS NZ :NH3+ -165:sc= -0.0286 (180deg=-0.356) USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 ASN : amide:sc= -1.44 X(o=-1.4,f=-1.4) USER MOD Single : A 90 GLN :FLIP amide:sc= -0.987 F(o=-1.6,f=-0.99) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc=-0.00794 X(o=-0.0079,f=0) USER MOD Single : A 95 HIS : no HD1:sc= -0.639 X(o=-0.64,f=-0.97) USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 2.263 1.723 -2.465 1.00 0.00 N ATOM 2 CA GLY A -1 2.905 0.463 -2.140 1.00 0.00 C ATOM 3 C GLY A -1 2.148 -0.731 -2.685 1.00 0.00 C ATOM 4 O GLY A -1 1.190 -1.201 -2.070 1.00 0.00 O ATOM 0 H1 GLY A -1 2.819 2.508 -2.070 1.00 0.00 H new ATOM 0 H2 GLY A -1 2.204 1.826 -3.498 1.00 0.00 H new ATOM 0 H3 GLY A -1 1.305 1.739 -2.060 1.00 0.00 H new ATOM 0 HA2 GLY A -1 3.918 0.461 -2.542 1.00 0.00 H new ATOM 0 HA3 GLY A -1 2.991 0.371 -1.057 1.00 0.00 H new ATOM 8 N SER A 0 2.576 -1.223 -3.843 1.00 0.00 N ATOM 9 CA SER A 0 1.927 -2.367 -4.474 1.00 0.00 C ATOM 10 C SER A 0 2.908 -3.524 -4.638 1.00 0.00 C ATOM 11 O SER A 0 3.522 -3.687 -5.692 1.00 0.00 O ATOM 12 CB SER A 0 1.357 -1.969 -5.837 1.00 0.00 C ATOM 13 OG SER A 0 1.979 -0.793 -6.326 1.00 0.00 O ATOM 0 H SER A 0 3.369 -0.848 -4.363 1.00 0.00 H new ATOM 0 HA SER A 0 1.111 -2.693 -3.829 1.00 0.00 H new ATOM 0 HB2 SER A 0 1.502 -2.783 -6.547 1.00 0.00 H new ATOM 0 HB3 SER A 0 0.282 -1.808 -5.752 1.00 0.00 H new ATOM 0 HG SER A 0 1.599 -0.560 -7.199 1.00 0.00 H new ATOM 19 N ALA A 1 3.048 -4.326 -3.588 1.00 0.00 N ATOM 20 CA ALA A 1 3.951 -5.470 -3.615 1.00 0.00 C ATOM 21 C ALA A 1 3.210 -6.745 -4.003 1.00 0.00 C ATOM 22 O ALA A 1 3.368 -7.253 -5.113 1.00 0.00 O ATOM 23 CB ALA A 1 4.628 -5.641 -2.263 1.00 0.00 C ATOM 0 H ALA A 1 2.547 -4.205 -2.708 1.00 0.00 H new ATOM 0 HA ALA A 1 4.715 -5.281 -4.369 1.00 0.00 H new ATOM 0 HB1 ALA A 1 5.299 -6.499 -2.298 1.00 0.00 H new ATOM 0 HB2 ALA A 1 5.199 -4.743 -2.026 1.00 0.00 H new ATOM 0 HB3 ALA A 1 3.872 -5.803 -1.495 1.00 0.00 H new ATOM 29 N ARG A 2 2.402 -7.258 -3.081 1.00 0.00 N ATOM 30 CA ARG A 2 1.638 -8.476 -3.326 1.00 0.00 C ATOM 31 C ARG A 2 0.754 -8.323 -4.560 1.00 0.00 C ATOM 32 O ARG A 2 0.743 -9.187 -5.437 1.00 0.00 O ATOM 33 CB ARG A 2 0.778 -8.817 -2.108 1.00 0.00 C ATOM 34 CG ARG A 2 -0.187 -9.968 -2.347 1.00 0.00 C ATOM 35 CD ARG A 2 0.552 -11.280 -2.559 1.00 0.00 C ATOM 36 NE ARG A 2 -0.308 -12.436 -2.323 1.00 0.00 N ATOM 37 CZ ARG A 2 -1.239 -12.845 -3.177 1.00 0.00 C ATOM 38 NH1 ARG A 2 -1.430 -12.195 -4.317 1.00 0.00 N ATOM 39 NH2 ARG A 2 -1.982 -13.907 -2.892 1.00 0.00 N ATOM 0 H ARG A 2 2.259 -6.849 -2.157 1.00 0.00 H new ATOM 0 HA ARG A 2 2.343 -9.288 -3.503 1.00 0.00 H new ATOM 0 HB2 ARG A 2 1.431 -9.069 -1.272 1.00 0.00 H new ATOM 0 HB3 ARG A 2 0.211 -7.933 -1.815 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -0.861 -10.062 -1.495 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -0.804 -9.752 -3.219 1.00 0.00 H new ATOM 0 HD2 ARG A 2 0.939 -11.318 -3.577 1.00 0.00 H new ATOM 0 HD3 ARG A 2 1.411 -11.325 -1.890 1.00 0.00 H new ATOM 0 HE ARG A 2 -0.187 -12.958 -1.455 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -0.861 -11.378 -4.540 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -2.146 -12.512 -4.971 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -1.838 -14.410 -2.016 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -2.697 -14.220 -3.549 1.00 0.00 H new ATOM 53 N GLN A 3 0.015 -7.220 -4.620 1.00 0.00 N ATOM 54 CA GLN A 3 -0.873 -6.956 -5.746 1.00 0.00 C ATOM 55 C GLN A 3 -0.123 -7.070 -7.069 1.00 0.00 C ATOM 56 O GLN A 3 -0.680 -7.514 -8.074 1.00 0.00 O ATOM 57 CB GLN A 3 -1.495 -5.565 -5.617 1.00 0.00 C ATOM 58 CG GLN A 3 -0.540 -4.521 -5.062 1.00 0.00 C ATOM 59 CD GLN A 3 -0.797 -4.213 -3.600 1.00 0.00 C ATOM 60 OE1 GLN A 3 0.128 -4.618 -2.738 1.00 0.00 O flip ATOM 61 NE2 GLN A 3 -1.817 -3.619 -3.249 1.00 0.00 N flip ATOM 0 H GLN A 3 0.014 -6.495 -3.902 1.00 0.00 H new ATOM 0 HA GLN A 3 -1.666 -7.703 -5.734 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -1.845 -5.240 -6.597 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -2.370 -5.626 -4.970 1.00 0.00 H new ATOM 0 HG2 GLN A 3 0.485 -4.872 -5.181 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -0.632 -3.604 -5.644 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -2.502 -3.326 -3.946 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -1.977 -3.420 -2.261 1.00 0.00 H new ATOM 70 N LEU A 4 1.143 -6.667 -7.062 1.00 0.00 N ATOM 71 CA LEU A 4 1.970 -6.724 -8.262 1.00 0.00 C ATOM 72 C LEU A 4 2.750 -8.034 -8.325 1.00 0.00 C ATOM 73 O LEU A 4 3.345 -8.364 -9.351 1.00 0.00 O ATOM 74 CB LEU A 4 2.938 -5.539 -8.295 1.00 0.00 C ATOM 75 CG LEU A 4 2.469 -4.311 -9.076 1.00 0.00 C ATOM 76 CD1 LEU A 4 1.015 -4.000 -8.758 1.00 0.00 C ATOM 77 CD2 LEU A 4 3.353 -3.112 -8.764 1.00 0.00 C ATOM 0 H LEU A 4 1.619 -6.297 -6.239 1.00 0.00 H new ATOM 0 HA LEU A 4 1.312 -6.672 -9.129 1.00 0.00 H new ATOM 0 HB2 LEU A 4 3.144 -5.235 -7.269 1.00 0.00 H new ATOM 0 HB3 LEU A 4 3.882 -5.878 -8.723 1.00 0.00 H new ATOM 0 HG LEU A 4 2.548 -4.529 -10.141 1.00 0.00 H new ATOM 0 HD11 LEU A 4 0.699 -3.123 -9.323 1.00 0.00 H new ATOM 0 HD12 LEU A 4 0.392 -4.852 -9.032 1.00 0.00 H new ATOM 0 HD13 LEU A 4 0.910 -3.802 -7.691 1.00 0.00 H new ATOM 0 HD21 LEU A 4 3.005 -2.247 -9.328 1.00 0.00 H new ATOM 0 HD22 LEU A 4 3.305 -2.893 -7.697 1.00 0.00 H new ATOM 0 HD23 LEU A 4 4.383 -3.337 -9.043 1.00 0.00 H new ATOM 89 N SER A 5 2.739 -8.776 -7.223 1.00 0.00 N ATOM 90 CA SER A 5 3.446 -10.049 -7.152 1.00 0.00 C ATOM 91 C SER A 5 2.819 -11.072 -8.094 1.00 0.00 C ATOM 92 O SER A 5 3.400 -12.123 -8.365 1.00 0.00 O ATOM 93 CB SER A 5 3.434 -10.584 -5.719 1.00 0.00 C ATOM 94 OG SER A 5 2.233 -11.285 -5.446 1.00 0.00 O ATOM 0 H SER A 5 2.248 -8.518 -6.367 1.00 0.00 H new ATOM 0 HA SER A 5 4.478 -9.881 -7.461 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.287 -11.245 -5.567 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.543 -9.757 -5.018 1.00 0.00 H new ATOM 0 HG SER A 5 1.466 -10.732 -5.704 1.00 0.00 H new ATOM 100 N LYS A 6 1.627 -10.757 -8.591 1.00 0.00 N ATOM 101 CA LYS A 6 0.919 -11.646 -9.504 1.00 0.00 C ATOM 102 C LYS A 6 1.836 -12.114 -10.629 1.00 0.00 C ATOM 103 O LYS A 6 1.693 -13.226 -11.139 1.00 0.00 O ATOM 104 CB LYS A 6 -0.305 -10.938 -10.091 1.00 0.00 C ATOM 105 CG LYS A 6 -1.220 -11.859 -10.880 1.00 0.00 C ATOM 106 CD LYS A 6 -2.051 -11.086 -11.891 1.00 0.00 C ATOM 107 CE LYS A 6 -2.839 -12.021 -12.795 1.00 0.00 C ATOM 108 NZ LYS A 6 -3.000 -11.463 -14.166 1.00 0.00 N ATOM 0 H LYS A 6 1.131 -9.892 -8.376 1.00 0.00 H new ATOM 0 HA LYS A 6 0.591 -12.519 -8.940 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -0.874 -10.482 -9.281 1.00 0.00 H new ATOM 0 HB3 LYS A 6 0.030 -10.129 -10.740 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -0.624 -12.611 -11.397 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -1.880 -12.391 -10.195 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -2.737 -10.421 -11.367 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -1.398 -10.458 -12.496 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -2.331 -12.984 -12.852 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -3.821 -12.204 -12.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -3.542 -12.130 -14.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -3.507 -10.556 -14.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -2.063 -11.312 -14.592 1.00 0.00 H new ATOM 122 N LEU A 7 2.780 -11.260 -11.011 1.00 0.00 N ATOM 123 CA LEU A 7 3.722 -11.587 -12.075 1.00 0.00 C ATOM 124 C LEU A 7 5.008 -12.174 -11.502 1.00 0.00 C ATOM 125 O LEU A 7 5.684 -12.971 -12.153 1.00 0.00 O ATOM 126 CB LEU A 7 4.042 -10.340 -12.902 1.00 0.00 C ATOM 127 CG LEU A 7 5.169 -10.484 -13.925 1.00 0.00 C ATOM 128 CD1 LEU A 7 4.918 -9.584 -15.125 1.00 0.00 C ATOM 129 CD2 LEU A 7 6.513 -10.162 -13.286 1.00 0.00 C ATOM 0 H LEU A 7 2.913 -10.336 -10.599 1.00 0.00 H new ATOM 0 HA LEU A 7 3.258 -12.334 -12.720 1.00 0.00 H new ATOM 0 HB2 LEU A 7 3.137 -10.036 -13.428 1.00 0.00 H new ATOM 0 HB3 LEU A 7 4.300 -9.531 -12.218 1.00 0.00 H new ATOM 0 HG LEU A 7 5.191 -11.518 -14.270 1.00 0.00 H new ATOM 0 HD11 LEU A 7 5.730 -9.700 -15.843 1.00 0.00 H new ATOM 0 HD12 LEU A 7 3.975 -9.861 -15.596 1.00 0.00 H new ATOM 0 HD13 LEU A 7 4.869 -8.546 -14.797 1.00 0.00 H new ATOM 0 HD21 LEU A 7 7.304 -10.270 -14.028 1.00 0.00 H new ATOM 0 HD22 LEU A 7 6.502 -9.138 -12.913 1.00 0.00 H new ATOM 0 HD23 LEU A 7 6.696 -10.848 -12.459 1.00 0.00 H new ATOM 141 N LYS A 8 5.340 -11.777 -10.278 1.00 0.00 N ATOM 142 CA LYS A 8 6.542 -12.266 -9.614 1.00 0.00 C ATOM 143 C LYS A 8 6.659 -13.781 -9.746 1.00 0.00 C ATOM 144 O LYS A 8 7.597 -14.289 -10.361 1.00 0.00 O ATOM 145 CB LYS A 8 6.530 -11.871 -8.136 1.00 0.00 C ATOM 146 CG LYS A 8 7.317 -12.818 -7.247 1.00 0.00 C ATOM 147 CD LYS A 8 7.627 -12.189 -5.899 1.00 0.00 C ATOM 148 CE LYS A 8 8.772 -12.905 -5.200 1.00 0.00 C ATOM 149 NZ LYS A 8 8.281 -13.907 -4.214 1.00 0.00 N ATOM 0 H LYS A 8 4.793 -11.117 -9.726 1.00 0.00 H new ATOM 0 HA LYS A 8 7.405 -11.810 -10.098 1.00 0.00 H new ATOM 0 HB2 LYS A 8 6.939 -10.866 -8.034 1.00 0.00 H new ATOM 0 HB3 LYS A 8 5.498 -11.832 -7.787 1.00 0.00 H new ATOM 0 HG2 LYS A 8 6.749 -13.736 -7.099 1.00 0.00 H new ATOM 0 HG3 LYS A 8 8.247 -13.095 -7.743 1.00 0.00 H new ATOM 0 HD2 LYS A 8 7.883 -11.139 -6.037 1.00 0.00 H new ATOM 0 HD3 LYS A 8 6.738 -12.220 -5.269 1.00 0.00 H new ATOM 0 HE2 LYS A 8 9.396 -13.402 -5.942 1.00 0.00 H new ATOM 0 HE3 LYS A 8 9.401 -12.174 -4.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 9.092 -14.373 -3.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 7.706 -13.430 -3.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 7.702 -14.619 -4.702 1.00 0.00 H new ATOM 163 N ARG A 9 5.701 -14.496 -9.166 1.00 0.00 N ATOM 164 CA ARG A 9 5.697 -15.953 -9.219 1.00 0.00 C ATOM 165 C ARG A 9 5.919 -16.446 -10.646 1.00 0.00 C ATOM 166 O ARG A 9 6.853 -17.202 -10.915 1.00 0.00 O ATOM 167 CB ARG A 9 4.375 -16.501 -8.679 1.00 0.00 C ATOM 168 CG ARG A 9 3.990 -15.935 -7.322 1.00 0.00 C ATOM 169 CD ARG A 9 2.770 -16.640 -6.750 1.00 0.00 C ATOM 170 NE ARG A 9 3.081 -17.994 -6.301 1.00 0.00 N ATOM 171 CZ ARG A 9 2.191 -18.804 -5.738 1.00 0.00 C ATOM 172 NH1 ARG A 9 0.942 -18.399 -5.557 1.00 0.00 N ATOM 173 NH2 ARG A 9 2.550 -20.023 -5.355 1.00 0.00 N ATOM 0 H ARG A 9 4.918 -14.090 -8.654 1.00 0.00 H new ATOM 0 HA ARG A 9 6.514 -16.316 -8.596 1.00 0.00 H new ATOM 0 HB2 ARG A 9 3.582 -16.281 -9.393 1.00 0.00 H new ATOM 0 HB3 ARG A 9 4.445 -17.586 -8.604 1.00 0.00 H new ATOM 0 HG2 ARG A 9 4.828 -16.038 -6.632 1.00 0.00 H new ATOM 0 HG3 ARG A 9 3.784 -14.869 -7.416 1.00 0.00 H new ATOM 0 HD2 ARG A 9 2.376 -16.062 -5.914 1.00 0.00 H new ATOM 0 HD3 ARG A 9 1.986 -16.680 -7.507 1.00 0.00 H new ATOM 0 HE ARG A 9 4.033 -18.337 -6.426 1.00 0.00 H new ATOM 0 HH11 ARG A 9 0.662 -17.463 -5.850 1.00 0.00 H new ATOM 0 HH12 ARG A 9 0.261 -19.023 -5.124 1.00 0.00 H new ATOM 0 HH21 ARG A 9 3.510 -20.339 -5.493 1.00 0.00 H new ATOM 0 HH22 ARG A 9 1.866 -20.644 -4.923 1.00 0.00 H new ATOM 187 N PHE A 10 5.054 -16.012 -11.557 1.00 0.00 N ATOM 188 CA PHE A 10 5.155 -16.410 -12.957 1.00 0.00 C ATOM 189 C PHE A 10 6.573 -16.203 -13.481 1.00 0.00 C ATOM 190 O PHE A 10 7.146 -17.086 -14.121 1.00 0.00 O ATOM 191 CB PHE A 10 4.163 -15.614 -13.808 1.00 0.00 C ATOM 192 CG PHE A 10 4.262 -15.909 -15.277 1.00 0.00 C ATOM 193 CD1 PHE A 10 5.224 -15.289 -16.058 1.00 0.00 C ATOM 194 CD2 PHE A 10 3.394 -16.806 -15.878 1.00 0.00 C ATOM 195 CE1 PHE A 10 5.319 -15.558 -17.411 1.00 0.00 C ATOM 196 CE2 PHE A 10 3.483 -17.079 -17.229 1.00 0.00 C ATOM 197 CZ PHE A 10 4.446 -16.454 -17.997 1.00 0.00 C ATOM 0 H PHE A 10 4.276 -15.385 -11.351 1.00 0.00 H new ATOM 0 HA PHE A 10 4.913 -17.471 -13.026 1.00 0.00 H new ATOM 0 HB2 PHE A 10 3.150 -15.831 -13.469 1.00 0.00 H new ATOM 0 HB3 PHE A 10 4.331 -14.549 -13.647 1.00 0.00 H new ATOM 0 HD1 PHE A 10 5.908 -14.587 -15.604 1.00 0.00 H new ATOM 0 HD2 PHE A 10 2.639 -17.298 -15.283 1.00 0.00 H new ATOM 0 HE1 PHE A 10 6.074 -15.069 -18.008 1.00 0.00 H new ATOM 0 HE2 PHE A 10 2.800 -17.781 -17.685 1.00 0.00 H new ATOM 0 HZ PHE A 10 4.516 -16.665 -19.054 1.00 0.00 H new ATOM 207 N LEU A 11 7.133 -15.030 -13.205 1.00 0.00 N ATOM 208 CA LEU A 11 8.484 -14.705 -13.648 1.00 0.00 C ATOM 209 C LEU A 11 9.498 -15.688 -13.071 1.00 0.00 C ATOM 210 O LEU A 11 10.301 -16.270 -13.802 1.00 0.00 O ATOM 211 CB LEU A 11 8.848 -13.278 -13.235 1.00 0.00 C ATOM 212 CG LEU A 11 9.656 -12.470 -14.252 1.00 0.00 C ATOM 213 CD1 LEU A 11 11.027 -13.094 -14.462 1.00 0.00 C ATOM 214 CD2 LEU A 11 8.905 -12.372 -15.572 1.00 0.00 C ATOM 0 H LEU A 11 6.672 -14.289 -12.677 1.00 0.00 H new ATOM 0 HA LEU A 11 8.511 -14.780 -14.735 1.00 0.00 H new ATOM 0 HB2 LEU A 11 7.926 -12.737 -13.021 1.00 0.00 H new ATOM 0 HB3 LEU A 11 9.414 -13.324 -12.305 1.00 0.00 H new ATOM 0 HG LEU A 11 9.795 -11.463 -13.859 1.00 0.00 H new ATOM 0 HD11 LEU A 11 11.587 -12.506 -15.189 1.00 0.00 H new ATOM 0 HD12 LEU A 11 11.567 -13.112 -13.516 1.00 0.00 H new ATOM 0 HD13 LEU A 11 10.910 -14.112 -14.833 1.00 0.00 H new ATOM 0 HD21 LEU A 11 9.494 -11.794 -16.284 1.00 0.00 H new ATOM 0 HD22 LEU A 11 8.736 -13.373 -15.969 1.00 0.00 H new ATOM 0 HD23 LEU A 11 7.947 -11.879 -15.410 1.00 0.00 H new ATOM 226 N THR A 12 9.455 -15.870 -11.755 1.00 0.00 N ATOM 227 CA THR A 12 10.369 -16.783 -11.080 1.00 0.00 C ATOM 228 C THR A 12 10.396 -18.143 -11.768 1.00 0.00 C ATOM 229 O THR A 12 11.445 -18.600 -12.223 1.00 0.00 O ATOM 230 CB THR A 12 9.979 -16.976 -9.602 1.00 0.00 C ATOM 231 OG1 THR A 12 8.711 -16.363 -9.345 1.00 0.00 O ATOM 232 CG2 THR A 12 11.033 -16.378 -8.682 1.00 0.00 C ATOM 0 H THR A 12 8.797 -15.397 -11.135 1.00 0.00 H new ATOM 0 HA THR A 12 11.361 -16.333 -11.132 1.00 0.00 H new ATOM 0 HB THR A 12 9.911 -18.046 -9.404 1.00 0.00 H new ATOM 0 HG1 THR A 12 7.994 -16.948 -9.667 1.00 0.00 H new ATOM 0 HG21 THR A 12 10.736 -16.526 -7.644 1.00 0.00 H new ATOM 0 HG22 THR A 12 11.991 -16.868 -8.859 1.00 0.00 H new ATOM 0 HG23 THR A 12 11.128 -15.311 -8.883 1.00 0.00 H new ATOM 240 N THR A 13 9.235 -18.787 -11.843 1.00 0.00 N ATOM 241 CA THR A 13 9.125 -20.095 -12.475 1.00 0.00 C ATOM 242 C THR A 13 9.454 -20.016 -13.962 1.00 0.00 C ATOM 243 O THR A 13 10.011 -20.953 -14.535 1.00 0.00 O ATOM 244 CB THR A 13 7.713 -20.686 -12.304 1.00 0.00 C ATOM 245 OG1 THR A 13 7.635 -21.963 -12.947 1.00 0.00 O ATOM 246 CG2 THR A 13 6.662 -19.753 -12.887 1.00 0.00 C ATOM 0 H THR A 13 8.357 -18.423 -11.473 1.00 0.00 H new ATOM 0 HA THR A 13 9.845 -20.746 -11.980 1.00 0.00 H new ATOM 0 HB THR A 13 7.519 -20.805 -11.238 1.00 0.00 H new ATOM 0 HG1 THR A 13 6.735 -22.333 -12.832 1.00 0.00 H new ATOM 0 HG21 THR A 13 5.673 -20.191 -12.755 1.00 0.00 H new ATOM 0 HG22 THR A 13 6.704 -18.792 -12.375 1.00 0.00 H new ATOM 0 HG23 THR A 13 6.855 -19.607 -13.950 1.00 0.00 H new ATOM 254 N LEU A 14 9.108 -18.893 -14.580 1.00 0.00 N ATOM 255 CA LEU A 14 9.367 -18.691 -16.002 1.00 0.00 C ATOM 256 C LEU A 14 10.863 -18.749 -16.296 1.00 0.00 C ATOM 257 O LEU A 14 11.289 -19.364 -17.273 1.00 0.00 O ATOM 258 CB LEU A 14 8.797 -17.347 -16.459 1.00 0.00 C ATOM 259 CG LEU A 14 9.487 -16.699 -17.660 1.00 0.00 C ATOM 260 CD1 LEU A 14 8.468 -16.006 -18.550 1.00 0.00 C ATOM 261 CD2 LEU A 14 10.551 -15.715 -17.196 1.00 0.00 C ATOM 0 H LEU A 14 8.647 -18.108 -14.120 1.00 0.00 H new ATOM 0 HA LEU A 14 8.876 -19.493 -16.553 1.00 0.00 H new ATOM 0 HB2 LEU A 14 7.743 -17.485 -16.702 1.00 0.00 H new ATOM 0 HB3 LEU A 14 8.842 -16.652 -15.621 1.00 0.00 H new ATOM 0 HG LEU A 14 9.974 -17.482 -18.242 1.00 0.00 H new ATOM 0 HD11 LEU A 14 8.977 -15.551 -19.399 1.00 0.00 H new ATOM 0 HD12 LEU A 14 7.743 -16.736 -18.910 1.00 0.00 H new ATOM 0 HD13 LEU A 14 7.952 -15.234 -17.979 1.00 0.00 H new ATOM 0 HD21 LEU A 14 11.032 -15.263 -18.064 1.00 0.00 H new ATOM 0 HD22 LEU A 14 10.087 -14.936 -16.591 1.00 0.00 H new ATOM 0 HD23 LEU A 14 11.297 -16.240 -16.600 1.00 0.00 H new ATOM 273 N GLN A 15 11.654 -18.106 -15.443 1.00 0.00 N ATOM 274 CA GLN A 15 13.102 -18.086 -15.611 1.00 0.00 C ATOM 275 C GLN A 15 13.730 -19.369 -15.078 1.00 0.00 C ATOM 276 O GLN A 15 14.776 -19.805 -15.558 1.00 0.00 O ATOM 277 CB GLN A 15 13.703 -16.875 -14.895 1.00 0.00 C ATOM 278 CG GLN A 15 14.128 -17.163 -13.464 1.00 0.00 C ATOM 279 CD GLN A 15 14.233 -15.907 -12.622 1.00 0.00 C ATOM 280 OE1 GLN A 15 15.280 -15.623 -12.038 1.00 0.00 O ATOM 281 NE2 GLN A 15 13.147 -15.146 -12.555 1.00 0.00 N ATOM 0 H GLN A 15 11.317 -17.592 -14.629 1.00 0.00 H new ATOM 0 HA GLN A 15 13.317 -18.013 -16.677 1.00 0.00 H new ATOM 0 HB2 GLN A 15 14.567 -16.523 -15.458 1.00 0.00 H new ATOM 0 HB3 GLN A 15 12.973 -16.066 -14.892 1.00 0.00 H new ATOM 0 HG2 GLN A 15 13.410 -17.844 -13.006 1.00 0.00 H new ATOM 0 HG3 GLN A 15 15.091 -17.673 -13.471 1.00 0.00 H new ATOM 0 HE21 GLN A 15 12.301 -15.419 -13.055 1.00 0.00 H new ATOM 0 HE22 GLN A 15 13.159 -14.288 -12.004 1.00 0.00 H new ATOM 290 N GLN A 16 13.084 -19.970 -14.083 1.00 0.00 N ATOM 291 CA GLN A 16 13.581 -21.203 -13.485 1.00 0.00 C ATOM 292 C GLN A 16 13.440 -22.373 -14.454 1.00 0.00 C ATOM 293 O GLN A 16 14.360 -23.175 -14.612 1.00 0.00 O ATOM 294 CB GLN A 16 12.827 -21.505 -12.189 1.00 0.00 C ATOM 295 CG GLN A 16 13.158 -20.548 -11.055 1.00 0.00 C ATOM 296 CD GLN A 16 14.132 -21.141 -10.056 1.00 0.00 C ATOM 297 OE1 GLN A 16 13.799 -22.074 -9.325 1.00 0.00 O ATOM 298 NE2 GLN A 16 15.345 -20.602 -10.020 1.00 0.00 N ATOM 0 H GLN A 16 12.216 -19.623 -13.675 1.00 0.00 H new ATOM 0 HA GLN A 16 14.639 -21.068 -13.259 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.755 -21.467 -12.385 1.00 0.00 H new ATOM 0 HB3 GLN A 16 13.057 -22.523 -11.873 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.581 -19.633 -11.469 1.00 0.00 H new ATOM 0 HG3 GLN A 16 12.239 -20.270 -10.539 1.00 0.00 H new ATOM 0 HE21 GLN A 16 15.579 -19.830 -10.644 1.00 0.00 H new ATOM 0 HE22 GLN A 16 16.043 -20.960 -9.368 1.00 0.00 H new ATOM 307 N PHE A 17 12.282 -22.464 -15.099 1.00 0.00 N ATOM 308 CA PHE A 17 12.020 -23.537 -16.052 1.00 0.00 C ATOM 309 C PHE A 17 12.384 -23.106 -17.470 1.00 0.00 C ATOM 310 O PHE A 17 12.404 -23.920 -18.392 1.00 0.00 O ATOM 311 CB PHE A 17 10.549 -23.951 -15.994 1.00 0.00 C ATOM 312 CG PHE A 17 10.336 -25.431 -16.139 1.00 0.00 C ATOM 313 CD1 PHE A 17 10.525 -26.280 -15.060 1.00 0.00 C ATOM 314 CD2 PHE A 17 9.948 -25.973 -17.354 1.00 0.00 C ATOM 315 CE1 PHE A 17 10.330 -27.642 -15.190 1.00 0.00 C ATOM 316 CE2 PHE A 17 9.752 -27.334 -17.489 1.00 0.00 C ATOM 317 CZ PHE A 17 9.944 -28.170 -16.407 1.00 0.00 C ATOM 0 H PHE A 17 11.510 -21.808 -14.979 1.00 0.00 H new ATOM 0 HA PHE A 17 12.641 -24.390 -15.780 1.00 0.00 H new ATOM 0 HB2 PHE A 17 10.125 -23.622 -15.045 1.00 0.00 H new ATOM 0 HB3 PHE A 17 10.003 -23.434 -16.784 1.00 0.00 H new ATOM 0 HD1 PHE A 17 10.828 -25.873 -14.107 1.00 0.00 H new ATOM 0 HD2 PHE A 17 9.797 -25.325 -18.204 1.00 0.00 H new ATOM 0 HE1 PHE A 17 10.479 -28.293 -14.341 1.00 0.00 H new ATOM 0 HE2 PHE A 17 9.449 -27.744 -18.441 1.00 0.00 H new ATOM 0 HZ PHE A 17 9.793 -29.234 -16.512 1.00 0.00 H new ATOM 327 N GLY A 18 12.670 -21.818 -17.636 1.00 0.00 N ATOM 328 CA GLY A 18 13.028 -21.300 -18.943 1.00 0.00 C ATOM 329 C GLY A 18 14.216 -22.022 -19.547 1.00 0.00 C ATOM 330 O GLY A 18 14.414 -21.997 -20.761 1.00 0.00 O ATOM 0 H GLY A 18 12.660 -21.124 -16.888 1.00 0.00 H new ATOM 0 HA2 GLY A 18 12.173 -21.390 -19.613 1.00 0.00 H new ATOM 0 HA3 GLY A 18 13.257 -20.238 -18.859 1.00 0.00 H new ATOM 334 N ASN A 19 15.010 -22.666 -18.698 1.00 0.00 N ATOM 335 CA ASN A 19 16.187 -23.396 -19.155 1.00 0.00 C ATOM 336 C ASN A 19 15.810 -24.801 -19.615 1.00 0.00 C ATOM 337 O ASN A 19 16.567 -25.453 -20.335 1.00 0.00 O ATOM 338 CB ASN A 19 17.229 -23.475 -18.037 1.00 0.00 C ATOM 339 CG ASN A 19 18.223 -24.600 -18.253 1.00 0.00 C ATOM 340 OD1 ASN A 19 19.249 -24.418 -18.909 1.00 0.00 O ATOM 341 ND2 ASN A 19 17.923 -25.769 -17.701 1.00 0.00 N ATOM 0 H ASN A 19 14.860 -22.697 -17.690 1.00 0.00 H new ATOM 0 HA ASN A 19 16.613 -22.858 -20.002 1.00 0.00 H new ATOM 0 HB2 ASN A 19 17.764 -22.528 -17.975 1.00 0.00 H new ATOM 0 HB3 ASN A 19 16.723 -23.619 -17.082 1.00 0.00 H new ATOM 0 HD21 ASN A 19 18.554 -26.562 -17.812 1.00 0.00 H new ATOM 0 HD22 ASN A 19 17.061 -25.874 -17.165 1.00 0.00 H new ATOM 348 N ASP A 20 14.636 -25.260 -19.196 1.00 0.00 N ATOM 349 CA ASP A 20 14.158 -26.587 -19.566 1.00 0.00 C ATOM 350 C ASP A 20 13.554 -26.575 -20.967 1.00 0.00 C ATOM 351 O ASP A 20 13.873 -27.427 -21.798 1.00 0.00 O ATOM 352 CB ASP A 20 13.122 -27.080 -18.555 1.00 0.00 C ATOM 353 CG ASP A 20 12.995 -28.590 -18.545 1.00 0.00 C ATOM 354 OD1 ASP A 20 12.593 -29.158 -19.582 1.00 0.00 O ATOM 355 OD2 ASP A 20 13.298 -29.205 -17.501 1.00 0.00 O ATOM 0 H ASP A 20 13.998 -24.733 -18.600 1.00 0.00 H new ATOM 0 HA ASP A 20 15.010 -27.267 -19.562 1.00 0.00 H new ATOM 0 HB2 ASP A 20 13.398 -26.735 -17.559 1.00 0.00 H new ATOM 0 HB3 ASP A 20 12.153 -26.638 -18.788 1.00 0.00 H new ATOM 360 N ILE A 21 12.681 -25.607 -21.221 1.00 0.00 N ATOM 361 CA ILE A 21 12.033 -25.485 -22.521 1.00 0.00 C ATOM 362 C ILE A 21 13.055 -25.526 -23.652 1.00 0.00 C ATOM 363 O ILE A 21 12.839 -26.173 -24.676 1.00 0.00 O ATOM 364 CB ILE A 21 11.220 -24.181 -22.625 1.00 0.00 C ATOM 365 CG1 ILE A 21 10.679 -24.004 -24.045 1.00 0.00 C ATOM 366 CG2 ILE A 21 12.078 -22.990 -22.227 1.00 0.00 C ATOM 367 CD1 ILE A 21 9.871 -22.738 -24.231 1.00 0.00 C ATOM 0 H ILE A 21 12.406 -24.895 -20.544 1.00 0.00 H new ATOM 0 HA ILE A 21 11.356 -26.334 -22.616 1.00 0.00 H new ATOM 0 HB ILE A 21 10.375 -24.241 -21.939 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.514 -23.998 -24.745 1.00 0.00 H new ATOM 0 HG13 ILE A 21 10.057 -24.863 -24.298 1.00 0.00 H new ATOM 0 HG21 ILE A 21 11.490 -22.076 -22.305 1.00 0.00 H new ATOM 0 HG22 ILE A 21 12.419 -23.115 -21.199 1.00 0.00 H new ATOM 0 HG23 ILE A 21 12.940 -22.925 -22.891 1.00 0.00 H new ATOM 0 HD11 ILE A 21 9.520 -22.679 -25.261 1.00 0.00 H new ATOM 0 HD12 ILE A 21 9.015 -22.750 -23.556 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.495 -21.872 -24.010 1.00 0.00 H new ATOM 379 N SER A 22 14.171 -24.830 -23.457 1.00 0.00 N ATOM 380 CA SER A 22 15.228 -24.785 -24.461 1.00 0.00 C ATOM 381 C SER A 22 16.456 -24.056 -23.925 1.00 0.00 C ATOM 382 O SER A 22 16.375 -23.249 -22.999 1.00 0.00 O ATOM 383 CB SER A 22 14.725 -24.094 -25.730 1.00 0.00 C ATOM 384 OG SER A 22 14.302 -25.043 -26.694 1.00 0.00 O ATOM 0 H SER A 22 14.366 -24.290 -22.614 1.00 0.00 H new ATOM 0 HA SER A 22 15.511 -25.810 -24.701 1.00 0.00 H new ATOM 0 HB2 SER A 22 13.898 -23.429 -25.482 1.00 0.00 H new ATOM 0 HB3 SER A 22 15.518 -23.474 -26.149 1.00 0.00 H new ATOM 0 HG SER A 22 13.693 -25.686 -26.275 1.00 0.00 H new ATOM 390 N PRO A 23 17.623 -24.347 -24.519 1.00 0.00 N ATOM 391 CA PRO A 23 18.891 -23.731 -24.119 1.00 0.00 C ATOM 392 C PRO A 23 18.959 -22.253 -24.488 1.00 0.00 C ATOM 393 O PRO A 23 19.259 -21.407 -23.646 1.00 0.00 O ATOM 394 CB PRO A 23 19.936 -24.527 -24.904 1.00 0.00 C ATOM 395 CG PRO A 23 19.202 -25.048 -26.091 1.00 0.00 C ATOM 396 CD PRO A 23 17.793 -25.300 -25.629 1.00 0.00 C ATOM 0 HA PRO A 23 19.036 -23.761 -23.039 1.00 0.00 H new ATOM 0 HB2 PRO A 23 20.773 -23.895 -25.202 1.00 0.00 H new ATOM 0 HB3 PRO A 23 20.347 -25.339 -24.305 1.00 0.00 H new ATOM 0 HG2 PRO A 23 19.222 -24.328 -26.909 1.00 0.00 H new ATOM 0 HG3 PRO A 23 19.661 -25.964 -26.462 1.00 0.00 H new ATOM 0 HD2 PRO A 23 17.071 -25.122 -26.426 1.00 0.00 H new ATOM 0 HD3 PRO A 23 17.656 -26.330 -25.299 1.00 0.00 H new ATOM 404 N GLU A 24 18.679 -21.949 -25.751 1.00 0.00 N ATOM 405 CA GLU A 24 18.710 -20.573 -26.231 1.00 0.00 C ATOM 406 C GLU A 24 17.775 -19.690 -25.409 1.00 0.00 C ATOM 407 O GLU A 24 18.207 -18.716 -24.792 1.00 0.00 O ATOM 408 CB GLU A 24 18.316 -20.514 -27.708 1.00 0.00 C ATOM 409 CG GLU A 24 17.106 -21.367 -28.050 1.00 0.00 C ATOM 410 CD GLU A 24 17.320 -22.213 -29.290 1.00 0.00 C ATOM 411 OE1 GLU A 24 18.072 -21.773 -30.185 1.00 0.00 O ATOM 412 OE2 GLU A 24 16.735 -23.314 -29.367 1.00 0.00 O ATOM 0 H GLU A 24 18.428 -22.637 -26.461 1.00 0.00 H new ATOM 0 HA GLU A 24 19.728 -20.200 -26.119 1.00 0.00 H new ATOM 0 HB2 GLU A 24 18.108 -19.479 -27.979 1.00 0.00 H new ATOM 0 HB3 GLU A 24 19.162 -20.839 -28.314 1.00 0.00 H new ATOM 0 HG2 GLU A 24 16.875 -22.017 -27.207 1.00 0.00 H new ATOM 0 HG3 GLU A 24 16.241 -20.721 -28.201 1.00 0.00 H new ATOM 419 N ILE A 25 16.492 -20.038 -25.407 1.00 0.00 N ATOM 420 CA ILE A 25 15.497 -19.278 -24.661 1.00 0.00 C ATOM 421 C ILE A 25 15.851 -19.213 -23.180 1.00 0.00 C ATOM 422 O ILE A 25 15.606 -18.207 -22.515 1.00 0.00 O ATOM 423 CB ILE A 25 14.091 -19.889 -24.815 1.00 0.00 C ATOM 424 CG1 ILE A 25 13.115 -18.846 -25.365 1.00 0.00 C ATOM 425 CG2 ILE A 25 13.600 -20.431 -23.481 1.00 0.00 C ATOM 426 CD1 ILE A 25 13.095 -17.559 -24.570 1.00 0.00 C ATOM 0 H ILE A 25 16.118 -20.841 -25.913 1.00 0.00 H new ATOM 0 HA ILE A 25 15.494 -18.270 -25.075 1.00 0.00 H new ATOM 0 HB ILE A 25 14.146 -20.716 -25.523 1.00 0.00 H new ATOM 0 HG12 ILE A 25 13.380 -18.621 -26.398 1.00 0.00 H new ATOM 0 HG13 ILE A 25 12.111 -19.271 -25.379 1.00 0.00 H new ATOM 0 HG21 ILE A 25 12.606 -20.859 -23.606 1.00 0.00 H new ATOM 0 HG22 ILE A 25 14.285 -21.201 -23.127 1.00 0.00 H new ATOM 0 HG23 ILE A 25 13.557 -19.621 -22.753 1.00 0.00 H new ATOM 0 HD11 ILE A 25 12.382 -16.866 -25.017 1.00 0.00 H new ATOM 0 HD12 ILE A 25 12.800 -17.771 -23.542 1.00 0.00 H new ATOM 0 HD13 ILE A 25 14.089 -17.111 -24.578 1.00 0.00 H new ATOM 438 N GLY A 26 16.431 -20.294 -22.667 1.00 0.00 N ATOM 439 CA GLY A 26 16.812 -20.339 -21.268 1.00 0.00 C ATOM 440 C GLY A 26 17.809 -19.257 -20.903 1.00 0.00 C ATOM 441 O GLY A 26 17.524 -18.396 -20.071 1.00 0.00 O ATOM 0 H GLY A 26 16.644 -21.140 -23.196 1.00 0.00 H new ATOM 0 HA2 GLY A 26 15.921 -20.232 -20.649 1.00 0.00 H new ATOM 0 HA3 GLY A 26 17.241 -21.315 -21.043 1.00 0.00 H new ATOM 445 N GLU A 27 18.983 -19.302 -21.526 1.00 0.00 N ATOM 446 CA GLU A 27 20.027 -18.319 -21.260 1.00 0.00 C ATOM 447 C GLU A 27 19.491 -16.899 -21.424 1.00 0.00 C ATOM 448 O GLU A 27 19.831 -16.003 -20.652 1.00 0.00 O ATOM 449 CB GLU A 27 21.216 -18.539 -22.196 1.00 0.00 C ATOM 450 CG GLU A 27 20.845 -18.514 -23.669 1.00 0.00 C ATOM 451 CD GLU A 27 22.050 -18.654 -24.578 1.00 0.00 C ATOM 452 OE1 GLU A 27 22.734 -17.638 -24.818 1.00 0.00 O ATOM 453 OE2 GLU A 27 22.310 -19.782 -25.048 1.00 0.00 O ATOM 0 H GLU A 27 19.235 -20.008 -22.218 1.00 0.00 H new ATOM 0 HA GLU A 27 20.358 -18.447 -20.229 1.00 0.00 H new ATOM 0 HB2 GLU A 27 21.964 -17.770 -22.006 1.00 0.00 H new ATOM 0 HB3 GLU A 27 21.678 -19.498 -21.963 1.00 0.00 H new ATOM 0 HG2 GLU A 27 20.143 -19.321 -23.876 1.00 0.00 H new ATOM 0 HG3 GLU A 27 20.332 -17.579 -23.894 1.00 0.00 H new ATOM 460 N ARG A 28 18.653 -16.703 -22.437 1.00 0.00 N ATOM 461 CA ARG A 28 18.072 -15.393 -22.705 1.00 0.00 C ATOM 462 C ARG A 28 17.159 -14.959 -21.562 1.00 0.00 C ATOM 463 O ARG A 28 17.381 -13.922 -20.936 1.00 0.00 O ATOM 464 CB ARG A 28 17.287 -15.418 -24.018 1.00 0.00 C ATOM 465 CG ARG A 28 17.403 -14.134 -24.821 1.00 0.00 C ATOM 466 CD ARG A 28 18.236 -14.335 -26.077 1.00 0.00 C ATOM 467 NE ARG A 28 17.566 -15.199 -27.046 1.00 0.00 N ATOM 468 CZ ARG A 28 17.878 -15.236 -28.337 1.00 0.00 C ATOM 469 NH1 ARG A 28 18.845 -14.463 -28.811 1.00 0.00 N ATOM 470 NH2 ARG A 28 17.222 -16.049 -29.156 1.00 0.00 N ATOM 0 H ARG A 28 18.361 -17.435 -23.085 1.00 0.00 H new ATOM 0 HA ARG A 28 18.886 -14.673 -22.790 1.00 0.00 H new ATOM 0 HB2 ARG A 28 17.640 -16.250 -24.627 1.00 0.00 H new ATOM 0 HB3 ARG A 28 16.236 -15.606 -23.800 1.00 0.00 H new ATOM 0 HG2 ARG A 28 16.408 -13.784 -25.095 1.00 0.00 H new ATOM 0 HG3 ARG A 28 17.855 -13.357 -24.204 1.00 0.00 H new ATOM 0 HD2 ARG A 28 18.441 -13.367 -26.535 1.00 0.00 H new ATOM 0 HD3 ARG A 28 19.198 -14.770 -25.808 1.00 0.00 H new ATOM 0 HE ARG A 28 16.818 -15.807 -26.713 1.00 0.00 H new ATOM 0 HH11 ARG A 28 19.352 -13.838 -28.184 1.00 0.00 H new ATOM 0 HH12 ARG A 28 19.082 -14.493 -29.803 1.00 0.00 H new ATOM 0 HH21 ARG A 28 16.478 -16.646 -28.794 1.00 0.00 H new ATOM 0 HH22 ARG A 28 17.462 -16.077 -30.147 1.00 0.00 H new ATOM 484 N VAL A 29 16.132 -15.759 -21.296 1.00 0.00 N ATOM 485 CA VAL A 29 15.185 -15.458 -20.228 1.00 0.00 C ATOM 486 C VAL A 29 15.909 -15.034 -18.956 1.00 0.00 C ATOM 487 O VAL A 29 15.688 -13.938 -18.440 1.00 0.00 O ATOM 488 CB VAL A 29 14.288 -16.671 -19.916 1.00 0.00 C ATOM 489 CG1 VAL A 29 13.439 -16.403 -18.682 1.00 0.00 C ATOM 490 CG2 VAL A 29 13.412 -17.008 -21.113 1.00 0.00 C ATOM 0 H VAL A 29 15.934 -16.621 -21.805 1.00 0.00 H new ATOM 0 HA VAL A 29 14.562 -14.635 -20.579 1.00 0.00 H new ATOM 0 HB VAL A 29 14.927 -17.530 -19.709 1.00 0.00 H new ATOM 0 HG11 VAL A 29 12.812 -17.270 -18.477 1.00 0.00 H new ATOM 0 HG12 VAL A 29 14.089 -16.214 -17.827 1.00 0.00 H new ATOM 0 HG13 VAL A 29 12.808 -15.532 -18.857 1.00 0.00 H new ATOM 0 HG21 VAL A 29 12.785 -17.867 -20.875 1.00 0.00 H new ATOM 0 HG22 VAL A 29 12.780 -16.153 -21.353 1.00 0.00 H new ATOM 0 HG23 VAL A 29 14.042 -17.245 -21.970 1.00 0.00 H new ATOM 500 N ARG A 30 16.775 -15.908 -18.454 1.00 0.00 N ATOM 501 CA ARG A 30 17.531 -15.625 -17.241 1.00 0.00 C ATOM 502 C ARG A 30 18.391 -14.376 -17.415 1.00 0.00 C ATOM 503 O ARG A 30 18.438 -13.513 -16.538 1.00 0.00 O ATOM 504 CB ARG A 30 18.415 -16.818 -16.874 1.00 0.00 C ATOM 505 CG ARG A 30 19.431 -17.176 -17.947 1.00 0.00 C ATOM 506 CD ARG A 30 19.975 -18.583 -17.752 1.00 0.00 C ATOM 507 NE ARG A 30 20.296 -18.856 -16.354 1.00 0.00 N ATOM 508 CZ ARG A 30 21.397 -18.418 -15.753 1.00 0.00 C ATOM 509 NH1 ARG A 30 22.278 -17.689 -16.426 1.00 0.00 N ATOM 510 NH2 ARG A 30 21.619 -18.708 -14.478 1.00 0.00 N ATOM 0 H ARG A 30 16.970 -16.819 -18.869 1.00 0.00 H new ATOM 0 HA ARG A 30 16.820 -15.447 -16.434 1.00 0.00 H new ATOM 0 HB2 ARG A 30 18.942 -16.597 -15.946 1.00 0.00 H new ATOM 0 HB3 ARG A 30 17.781 -17.684 -16.682 1.00 0.00 H new ATOM 0 HG2 ARG A 30 18.967 -17.097 -18.930 1.00 0.00 H new ATOM 0 HG3 ARG A 30 20.253 -16.461 -17.924 1.00 0.00 H new ATOM 0 HD2 ARG A 30 19.241 -19.308 -18.104 1.00 0.00 H new ATOM 0 HD3 ARG A 30 20.869 -18.714 -18.362 1.00 0.00 H new ATOM 0 HE ARG A 30 19.639 -19.414 -15.809 1.00 0.00 H new ATOM 0 HH11 ARG A 30 22.111 -17.464 -17.407 1.00 0.00 H new ATOM 0 HH12 ARG A 30 23.123 -17.354 -15.963 1.00 0.00 H new ATOM 0 HH21 ARG A 30 20.944 -19.268 -13.957 1.00 0.00 H new ATOM 0 HH22 ARG A 30 22.465 -18.371 -14.018 1.00 0.00 H new ATOM 524 N THR A 31 19.071 -14.287 -18.554 1.00 0.00 N ATOM 525 CA THR A 31 19.931 -13.146 -18.844 1.00 0.00 C ATOM 526 C THR A 31 19.173 -11.833 -18.685 1.00 0.00 C ATOM 527 O THR A 31 19.570 -10.965 -17.906 1.00 0.00 O ATOM 528 CB THR A 31 20.507 -13.224 -20.270 1.00 0.00 C ATOM 529 OG1 THR A 31 21.563 -14.190 -20.320 1.00 0.00 O ATOM 530 CG2 THR A 31 21.032 -11.868 -20.717 1.00 0.00 C ATOM 0 H THR A 31 19.043 -14.992 -19.291 1.00 0.00 H new ATOM 0 HA THR A 31 20.752 -13.178 -18.127 1.00 0.00 H new ATOM 0 HB THR A 31 19.706 -13.526 -20.945 1.00 0.00 H new ATOM 0 HG1 THR A 31 21.187 -15.090 -20.227 1.00 0.00 H new ATOM 0 HG21 THR A 31 21.434 -11.948 -21.727 1.00 0.00 H new ATOM 0 HG22 THR A 31 20.219 -11.142 -20.706 1.00 0.00 H new ATOM 0 HG23 THR A 31 21.820 -11.541 -20.038 1.00 0.00 H new ATOM 538 N LEU A 32 18.080 -11.692 -19.427 1.00 0.00 N ATOM 539 CA LEU A 32 17.266 -10.484 -19.368 1.00 0.00 C ATOM 540 C LEU A 32 16.711 -10.269 -17.963 1.00 0.00 C ATOM 541 O LEU A 32 16.929 -9.223 -17.352 1.00 0.00 O ATOM 542 CB LEU A 32 16.117 -10.570 -20.374 1.00 0.00 C ATOM 543 CG LEU A 32 16.476 -11.112 -21.758 1.00 0.00 C ATOM 544 CD1 LEU A 32 15.391 -10.766 -22.766 1.00 0.00 C ATOM 545 CD2 LEU A 32 17.822 -10.566 -22.212 1.00 0.00 C ATOM 0 H LEU A 32 17.737 -12.400 -20.077 1.00 0.00 H new ATOM 0 HA LEU A 32 17.901 -9.635 -19.622 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.336 -11.201 -19.950 1.00 0.00 H new ATOM 0 HB3 LEU A 32 15.691 -9.574 -20.495 1.00 0.00 H new ATOM 0 HG LEU A 32 16.550 -12.198 -21.693 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.665 -11.160 -23.745 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.446 -11.206 -22.449 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.284 -9.683 -22.828 1.00 0.00 H new ATOM 0 HD21 LEU A 32 18.061 -10.962 -23.199 1.00 0.00 H new ATOM 0 HD22 LEU A 32 17.776 -9.478 -22.259 1.00 0.00 H new ATOM 0 HD23 LEU A 32 18.594 -10.866 -21.504 1.00 0.00 H new ATOM 557 N VAL A 33 15.995 -11.267 -17.456 1.00 0.00 N ATOM 558 CA VAL A 33 15.412 -11.189 -16.122 1.00 0.00 C ATOM 559 C VAL A 33 16.451 -10.761 -15.092 1.00 0.00 C ATOM 560 O VAL A 33 16.410 -9.641 -14.581 1.00 0.00 O ATOM 561 CB VAL A 33 14.806 -12.539 -15.694 1.00 0.00 C ATOM 562 CG1 VAL A 33 14.329 -12.477 -14.251 1.00 0.00 C ATOM 563 CG2 VAL A 33 13.668 -12.931 -16.625 1.00 0.00 C ATOM 0 H VAL A 33 15.805 -12.139 -17.949 1.00 0.00 H new ATOM 0 HA VAL A 33 14.620 -10.442 -16.166 1.00 0.00 H new ATOM 0 HB VAL A 33 15.580 -13.303 -15.762 1.00 0.00 H new ATOM 0 HG11 VAL A 33 13.904 -13.440 -13.967 1.00 0.00 H new ATOM 0 HG12 VAL A 33 15.171 -12.245 -13.599 1.00 0.00 H new ATOM 0 HG13 VAL A 33 13.569 -11.702 -14.152 1.00 0.00 H new ATOM 0 HG21 VAL A 33 13.252 -13.887 -16.308 1.00 0.00 H new ATOM 0 HG22 VAL A 33 12.891 -12.168 -16.591 1.00 0.00 H new ATOM 0 HG23 VAL A 33 14.045 -13.020 -17.644 1.00 0.00 H new ATOM 573 N LEU A 34 17.383 -11.660 -14.792 1.00 0.00 N ATOM 574 CA LEU A 34 18.435 -11.376 -13.823 1.00 0.00 C ATOM 575 C LEU A 34 19.162 -10.081 -14.172 1.00 0.00 C ATOM 576 O LEU A 34 19.582 -9.335 -13.288 1.00 0.00 O ATOM 577 CB LEU A 34 19.432 -12.535 -13.769 1.00 0.00 C ATOM 578 CG LEU A 34 18.997 -13.757 -12.960 1.00 0.00 C ATOM 579 CD1 LEU A 34 19.072 -13.465 -11.469 1.00 0.00 C ATOM 580 CD2 LEU A 34 17.590 -14.183 -13.352 1.00 0.00 C ATOM 0 H LEU A 34 17.431 -12.591 -15.206 1.00 0.00 H new ATOM 0 HA LEU A 34 17.971 -11.258 -12.844 1.00 0.00 H new ATOM 0 HB2 LEU A 34 19.642 -12.856 -14.790 1.00 0.00 H new ATOM 0 HB3 LEU A 34 20.368 -12.163 -13.353 1.00 0.00 H new ATOM 0 HG LEU A 34 19.679 -14.578 -13.183 1.00 0.00 H new ATOM 0 HD11 LEU A 34 18.759 -14.346 -10.909 1.00 0.00 H new ATOM 0 HD12 LEU A 34 20.097 -13.209 -11.199 1.00 0.00 H new ATOM 0 HD13 LEU A 34 18.414 -12.630 -11.228 1.00 0.00 H new ATOM 0 HD21 LEU A 34 17.297 -15.054 -12.766 1.00 0.00 H new ATOM 0 HD22 LEU A 34 16.895 -13.366 -13.159 1.00 0.00 H new ATOM 0 HD23 LEU A 34 17.568 -14.435 -14.412 1.00 0.00 H new ATOM 592 N GLY A 35 19.305 -9.819 -15.467 1.00 0.00 N ATOM 593 CA GLY A 35 19.979 -8.612 -15.910 1.00 0.00 C ATOM 594 C GLY A 35 19.321 -7.353 -15.381 1.00 0.00 C ATOM 595 O GLY A 35 19.890 -6.652 -14.543 1.00 0.00 O ATOM 0 H GLY A 35 18.966 -10.421 -16.218 1.00 0.00 H new ATOM 0 HA2 GLY A 35 21.019 -8.640 -15.584 1.00 0.00 H new ATOM 0 HA3 GLY A 35 19.988 -8.583 -17.000 1.00 0.00 H new ATOM 599 N LEU A 36 18.122 -7.063 -15.872 1.00 0.00 N ATOM 600 CA LEU A 36 17.386 -5.878 -15.445 1.00 0.00 C ATOM 601 C LEU A 36 17.196 -5.872 -13.931 1.00 0.00 C ATOM 602 O LEU A 36 16.979 -4.822 -13.327 1.00 0.00 O ATOM 603 CB LEU A 36 16.025 -5.820 -16.141 1.00 0.00 C ATOM 604 CG LEU A 36 15.131 -7.048 -15.972 1.00 0.00 C ATOM 605 CD1 LEU A 36 14.308 -6.937 -14.698 1.00 0.00 C ATOM 606 CD2 LEU A 36 14.224 -7.219 -17.181 1.00 0.00 C ATOM 0 H LEU A 36 17.638 -7.632 -16.566 1.00 0.00 H new ATOM 0 HA LEU A 36 17.967 -4.999 -15.724 1.00 0.00 H new ATOM 0 HB2 LEU A 36 15.486 -4.949 -15.768 1.00 0.00 H new ATOM 0 HB3 LEU A 36 16.191 -5.660 -17.206 1.00 0.00 H new ATOM 0 HG LEU A 36 15.768 -7.929 -15.894 1.00 0.00 H new ATOM 0 HD11 LEU A 36 13.677 -7.820 -14.594 1.00 0.00 H new ATOM 0 HD12 LEU A 36 14.975 -6.864 -13.839 1.00 0.00 H new ATOM 0 HD13 LEU A 36 13.681 -6.047 -14.746 1.00 0.00 H new ATOM 0 HD21 LEU A 36 13.595 -8.098 -17.042 1.00 0.00 H new ATOM 0 HD22 LEU A 36 13.594 -6.336 -17.291 1.00 0.00 H new ATOM 0 HD23 LEU A 36 14.832 -7.345 -18.077 1.00 0.00 H new ATOM 618 N VAL A 37 17.281 -7.051 -13.324 1.00 0.00 N ATOM 619 CA VAL A 37 17.122 -7.182 -11.881 1.00 0.00 C ATOM 620 C VAL A 37 18.298 -6.557 -11.140 1.00 0.00 C ATOM 621 O VAL A 37 18.124 -5.640 -10.338 1.00 0.00 O ATOM 622 CB VAL A 37 16.991 -8.658 -11.462 1.00 0.00 C ATOM 623 CG1 VAL A 37 17.243 -8.814 -9.970 1.00 0.00 C ATOM 624 CG2 VAL A 37 15.619 -9.198 -11.838 1.00 0.00 C ATOM 0 H VAL A 37 17.459 -7.930 -13.810 1.00 0.00 H new ATOM 0 HA VAL A 37 16.206 -6.654 -11.614 1.00 0.00 H new ATOM 0 HB VAL A 37 17.744 -9.238 -11.996 1.00 0.00 H new ATOM 0 HG11 VAL A 37 17.146 -9.864 -9.692 1.00 0.00 H new ATOM 0 HG12 VAL A 37 18.249 -8.467 -9.733 1.00 0.00 H new ATOM 0 HG13 VAL A 37 16.515 -8.223 -9.414 1.00 0.00 H new ATOM 0 HG21 VAL A 37 15.543 -10.242 -11.535 1.00 0.00 H new ATOM 0 HG22 VAL A 37 14.848 -8.617 -11.332 1.00 0.00 H new ATOM 0 HG23 VAL A 37 15.481 -9.123 -12.917 1.00 0.00 H new ATOM 634 N ASN A 38 19.498 -7.060 -11.413 1.00 0.00 N ATOM 635 CA ASN A 38 20.704 -6.551 -10.772 1.00 0.00 C ATOM 636 C ASN A 38 21.622 -5.882 -11.791 1.00 0.00 C ATOM 637 O ASN A 38 22.103 -4.771 -11.573 1.00 0.00 O ATOM 638 CB ASN A 38 21.449 -7.686 -10.066 1.00 0.00 C ATOM 639 CG ASN A 38 21.676 -8.880 -10.973 1.00 0.00 C ATOM 640 OD1 ASN A 38 22.640 -8.919 -11.737 1.00 0.00 O ATOM 641 ND2 ASN A 38 20.786 -9.862 -10.891 1.00 0.00 N ATOM 0 H ASN A 38 19.660 -7.820 -12.074 1.00 0.00 H new ATOM 0 HA ASN A 38 20.406 -5.806 -10.034 1.00 0.00 H new ATOM 0 HB2 ASN A 38 22.410 -7.318 -9.707 1.00 0.00 H new ATOM 0 HB3 ASN A 38 20.881 -8.001 -9.191 1.00 0.00 H new ATOM 0 HD21 ASN A 38 20.886 -10.691 -11.476 1.00 0.00 H new ATOM 0 HD22 ASN A 38 20.002 -9.787 -10.243 1.00 0.00 H new ATOM 648 N SER A 39 21.858 -6.568 -12.905 1.00 0.00 N ATOM 649 CA SER A 39 22.720 -6.042 -13.958 1.00 0.00 C ATOM 650 C SER A 39 22.104 -4.800 -14.595 1.00 0.00 C ATOM 651 O SER A 39 20.927 -4.502 -14.391 1.00 0.00 O ATOM 652 CB SER A 39 22.964 -7.109 -15.026 1.00 0.00 C ATOM 653 OG SER A 39 22.980 -8.407 -14.457 1.00 0.00 O ATOM 0 H SER A 39 21.465 -7.488 -13.102 1.00 0.00 H new ATOM 0 HA SER A 39 23.673 -5.763 -13.508 1.00 0.00 H new ATOM 0 HB2 SER A 39 22.185 -7.052 -15.786 1.00 0.00 H new ATOM 0 HB3 SER A 39 23.913 -6.916 -15.527 1.00 0.00 H new ATOM 0 HG SER A 39 22.987 -8.336 -13.480 1.00 0.00 H new ATOM 659 N THR A 40 22.909 -4.078 -15.368 1.00 0.00 N ATOM 660 CA THR A 40 22.445 -2.867 -16.034 1.00 0.00 C ATOM 661 C THR A 40 21.611 -3.203 -17.265 1.00 0.00 C ATOM 662 O THR A 40 22.142 -3.355 -18.366 1.00 0.00 O ATOM 663 CB THR A 40 23.625 -1.972 -16.456 1.00 0.00 C ATOM 664 OG1 THR A 40 24.315 -1.492 -15.297 1.00 0.00 O ATOM 665 CG2 THR A 40 23.140 -0.793 -17.287 1.00 0.00 C ATOM 0 H THR A 40 23.886 -4.311 -15.548 1.00 0.00 H new ATOM 0 HA THR A 40 21.827 -2.327 -15.316 1.00 0.00 H new ATOM 0 HB THR A 40 24.306 -2.569 -17.063 1.00 0.00 H new ATOM 0 HG1 THR A 40 25.065 -0.925 -15.574 1.00 0.00 H new ATOM 0 HG21 THR A 40 23.991 -0.175 -17.573 1.00 0.00 H new ATOM 0 HG22 THR A 40 22.641 -1.161 -18.183 1.00 0.00 H new ATOM 0 HG23 THR A 40 22.441 -0.198 -16.700 1.00 0.00 H new ATOM 673 N LEU A 41 20.301 -3.316 -17.073 1.00 0.00 N ATOM 674 CA LEU A 41 19.392 -3.633 -18.169 1.00 0.00 C ATOM 675 C LEU A 41 18.076 -2.876 -18.021 1.00 0.00 C ATOM 676 O LEU A 41 17.541 -2.748 -16.919 1.00 0.00 O ATOM 677 CB LEU A 41 19.125 -5.138 -18.217 1.00 0.00 C ATOM 678 CG LEU A 41 19.910 -5.926 -19.267 1.00 0.00 C ATOM 679 CD1 LEU A 41 21.071 -6.665 -18.622 1.00 0.00 C ATOM 680 CD2 LEU A 41 18.995 -6.899 -19.997 1.00 0.00 C ATOM 0 H LEU A 41 19.845 -3.193 -16.169 1.00 0.00 H new ATOM 0 HA LEU A 41 19.865 -3.324 -19.101 1.00 0.00 H new ATOM 0 HB2 LEU A 41 19.347 -5.558 -17.236 1.00 0.00 H new ATOM 0 HB3 LEU A 41 18.061 -5.292 -18.396 1.00 0.00 H new ATOM 0 HG LEU A 41 20.314 -5.222 -19.995 1.00 0.00 H new ATOM 0 HD11 LEU A 41 21.618 -7.220 -19.384 1.00 0.00 H new ATOM 0 HD12 LEU A 41 21.739 -5.948 -18.146 1.00 0.00 H new ATOM 0 HD13 LEU A 41 20.690 -7.358 -17.872 1.00 0.00 H new ATOM 0 HD21 LEU A 41 19.570 -7.451 -20.740 1.00 0.00 H new ATOM 0 HD22 LEU A 41 18.562 -7.598 -19.281 1.00 0.00 H new ATOM 0 HD23 LEU A 41 18.197 -6.346 -20.493 1.00 0.00 H new ATOM 692 N THR A 42 17.557 -2.377 -19.138 1.00 0.00 N ATOM 693 CA THR A 42 16.303 -1.634 -19.133 1.00 0.00 C ATOM 694 C THR A 42 15.159 -2.483 -19.674 1.00 0.00 C ATOM 695 O THR A 42 15.379 -3.425 -20.437 1.00 0.00 O ATOM 696 CB THR A 42 16.411 -0.345 -19.970 1.00 0.00 C ATOM 697 OG1 THR A 42 15.150 0.333 -19.989 1.00 0.00 O ATOM 698 CG2 THR A 42 16.845 -0.659 -21.394 1.00 0.00 C ATOM 0 H THR A 42 17.986 -2.474 -20.058 1.00 0.00 H new ATOM 0 HA THR A 42 16.096 -1.369 -18.096 1.00 0.00 H new ATOM 0 HB THR A 42 17.162 0.298 -19.512 1.00 0.00 H new ATOM 0 HG1 THR A 42 15.227 1.152 -20.521 1.00 0.00 H new ATOM 0 HG21 THR A 42 16.914 0.266 -21.966 1.00 0.00 H new ATOM 0 HG22 THR A 42 17.818 -1.149 -21.378 1.00 0.00 H new ATOM 0 HG23 THR A 42 16.114 -1.319 -21.860 1.00 0.00 H new ATOM 706 N ILE A 43 13.937 -2.145 -19.275 1.00 0.00 N ATOM 707 CA ILE A 43 12.758 -2.876 -19.722 1.00 0.00 C ATOM 708 C ILE A 43 12.768 -3.063 -21.236 1.00 0.00 C ATOM 709 O ILE A 43 12.603 -4.176 -21.734 1.00 0.00 O ATOM 710 CB ILE A 43 11.460 -2.155 -19.314 1.00 0.00 C ATOM 711 CG1 ILE A 43 11.420 -1.951 -17.798 1.00 0.00 C ATOM 712 CG2 ILE A 43 10.246 -2.945 -19.780 1.00 0.00 C ATOM 713 CD1 ILE A 43 10.735 -3.076 -17.054 1.00 0.00 C ATOM 0 H ILE A 43 13.738 -1.370 -18.643 1.00 0.00 H new ATOM 0 HA ILE A 43 12.790 -3.852 -19.237 1.00 0.00 H new ATOM 0 HB ILE A 43 11.438 -1.177 -19.794 1.00 0.00 H new ATOM 0 HG12 ILE A 43 12.440 -1.849 -17.426 1.00 0.00 H new ATOM 0 HG13 ILE A 43 10.905 -1.015 -17.579 1.00 0.00 H new ATOM 0 HG21 ILE A 43 9.336 -2.422 -19.484 1.00 0.00 H new ATOM 0 HG22 ILE A 43 10.271 -3.044 -20.865 1.00 0.00 H new ATOM 0 HG23 ILE A 43 10.260 -3.935 -19.325 1.00 0.00 H new ATOM 0 HD11 ILE A 43 10.744 -2.864 -15.985 1.00 0.00 H new ATOM 0 HD12 ILE A 43 9.704 -3.165 -17.398 1.00 0.00 H new ATOM 0 HD13 ILE A 43 11.262 -4.011 -17.243 1.00 0.00 H new ATOM 725 N GLU A 44 12.964 -1.966 -21.961 1.00 0.00 N ATOM 726 CA GLU A 44 12.996 -2.010 -23.418 1.00 0.00 C ATOM 727 C GLU A 44 13.967 -3.080 -23.908 1.00 0.00 C ATOM 728 O GLU A 44 13.614 -3.918 -24.737 1.00 0.00 O ATOM 729 CB GLU A 44 13.396 -0.645 -23.983 1.00 0.00 C ATOM 730 CG GLU A 44 13.390 -0.589 -25.501 1.00 0.00 C ATOM 731 CD GLU A 44 13.892 0.737 -26.038 1.00 0.00 C ATOM 732 OE1 GLU A 44 14.533 1.485 -25.270 1.00 0.00 O ATOM 733 OE2 GLU A 44 13.644 1.027 -27.227 1.00 0.00 O ATOM 0 H GLU A 44 13.103 -1.037 -21.563 1.00 0.00 H new ATOM 0 HA GLU A 44 11.996 -2.262 -23.771 1.00 0.00 H new ATOM 0 HB2 GLU A 44 12.714 0.112 -23.597 1.00 0.00 H new ATOM 0 HB3 GLU A 44 14.392 -0.390 -23.622 1.00 0.00 H new ATOM 0 HG2 GLU A 44 14.012 -1.394 -25.893 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.377 -0.763 -25.863 1.00 0.00 H new ATOM 740 N GLU A 45 15.191 -3.043 -23.390 1.00 0.00 N ATOM 741 CA GLU A 45 16.213 -4.008 -23.777 1.00 0.00 C ATOM 742 C GLU A 45 15.788 -5.427 -23.407 1.00 0.00 C ATOM 743 O GLU A 45 16.058 -6.379 -24.140 1.00 0.00 O ATOM 744 CB GLU A 45 17.545 -3.671 -23.104 1.00 0.00 C ATOM 745 CG GLU A 45 18.641 -4.686 -23.382 1.00 0.00 C ATOM 746 CD GLU A 45 19.594 -4.233 -24.470 1.00 0.00 C ATOM 747 OE1 GLU A 45 19.113 -3.834 -25.551 1.00 0.00 O ATOM 748 OE2 GLU A 45 20.821 -4.277 -24.241 1.00 0.00 O ATOM 0 H GLU A 45 15.498 -2.356 -22.702 1.00 0.00 H new ATOM 0 HA GLU A 45 16.337 -3.954 -24.859 1.00 0.00 H new ATOM 0 HB2 GLU A 45 17.876 -2.689 -23.443 1.00 0.00 H new ATOM 0 HB3 GLU A 45 17.391 -3.601 -22.027 1.00 0.00 H new ATOM 0 HG2 GLU A 45 19.202 -4.869 -22.466 1.00 0.00 H new ATOM 0 HG3 GLU A 45 18.188 -5.634 -23.673 1.00 0.00 H new ATOM 755 N PHE A 46 15.123 -5.560 -22.264 1.00 0.00 N ATOM 756 CA PHE A 46 14.663 -6.862 -21.795 1.00 0.00 C ATOM 757 C PHE A 46 13.509 -7.372 -22.654 1.00 0.00 C ATOM 758 O PHE A 46 13.270 -8.577 -22.739 1.00 0.00 O ATOM 759 CB PHE A 46 14.224 -6.774 -20.332 1.00 0.00 C ATOM 760 CG PHE A 46 12.972 -7.548 -20.034 1.00 0.00 C ATOM 761 CD1 PHE A 46 11.727 -6.951 -20.159 1.00 0.00 C ATOM 762 CD2 PHE A 46 13.038 -8.871 -19.630 1.00 0.00 C ATOM 763 CE1 PHE A 46 10.573 -7.660 -19.885 1.00 0.00 C ATOM 764 CE2 PHE A 46 11.887 -9.586 -19.355 1.00 0.00 C ATOM 765 CZ PHE A 46 10.653 -8.979 -19.483 1.00 0.00 C ATOM 0 H PHE A 46 14.891 -4.783 -21.646 1.00 0.00 H new ATOM 0 HA PHE A 46 15.492 -7.564 -21.877 1.00 0.00 H new ATOM 0 HB2 PHE A 46 15.029 -7.143 -19.697 1.00 0.00 H new ATOM 0 HB3 PHE A 46 14.066 -5.728 -20.071 1.00 0.00 H new ATOM 0 HD1 PHE A 46 11.658 -5.920 -20.474 1.00 0.00 H new ATOM 0 HD2 PHE A 46 14.001 -9.350 -19.528 1.00 0.00 H new ATOM 0 HE1 PHE A 46 9.609 -7.183 -19.985 1.00 0.00 H new ATOM 0 HE2 PHE A 46 11.953 -10.617 -19.041 1.00 0.00 H new ATOM 0 HZ PHE A 46 9.752 -9.535 -19.269 1.00 0.00 H new ATOM 775 N HIS A 47 12.797 -6.447 -23.288 1.00 0.00 N ATOM 776 CA HIS A 47 11.668 -6.802 -24.141 1.00 0.00 C ATOM 777 C HIS A 47 12.129 -7.067 -25.571 1.00 0.00 C ATOM 778 O HIS A 47 11.390 -7.630 -26.378 1.00 0.00 O ATOM 779 CB HIS A 47 10.621 -5.688 -24.128 1.00 0.00 C ATOM 780 CG HIS A 47 9.529 -5.881 -25.134 1.00 0.00 C ATOM 781 ND1 HIS A 47 8.866 -7.078 -25.305 1.00 0.00 N ATOM 782 CD2 HIS A 47 8.982 -5.019 -26.023 1.00 0.00 C ATOM 783 CE1 HIS A 47 7.961 -6.945 -26.257 1.00 0.00 C ATOM 784 NE2 HIS A 47 8.010 -5.705 -26.709 1.00 0.00 N ATOM 0 H HIS A 47 12.981 -5.446 -23.228 1.00 0.00 H new ATOM 0 HA HIS A 47 11.221 -7.715 -23.748 1.00 0.00 H new ATOM 0 HB2 HIS A 47 10.180 -5.626 -23.133 1.00 0.00 H new ATOM 0 HB3 HIS A 47 11.114 -4.735 -24.318 1.00 0.00 H new ATOM 0 HD2 HIS A 47 9.258 -3.985 -26.166 1.00 0.00 H new ATOM 0 HE1 HIS A 47 7.294 -7.719 -26.607 1.00 0.00 H new ATOM 0 HE2 HIS A 47 7.422 -5.319 -27.448 1.00 0.00 H new ATOM 792 N SER A 48 13.356 -6.656 -25.877 1.00 0.00 N ATOM 793 CA SER A 48 13.914 -6.845 -27.211 1.00 0.00 C ATOM 794 C SER A 48 14.382 -8.284 -27.406 1.00 0.00 C ATOM 795 O SER A 48 13.808 -9.036 -28.194 1.00 0.00 O ATOM 796 CB SER A 48 15.080 -5.882 -27.440 1.00 0.00 C ATOM 797 OG SER A 48 16.071 -6.468 -28.267 1.00 0.00 O ATOM 0 H SER A 48 13.982 -6.190 -25.220 1.00 0.00 H new ATOM 0 HA SER A 48 13.130 -6.635 -27.939 1.00 0.00 H new ATOM 0 HB2 SER A 48 14.713 -4.965 -27.901 1.00 0.00 H new ATOM 0 HB3 SER A 48 15.519 -5.604 -26.482 1.00 0.00 H new ATOM 0 HG SER A 48 16.805 -5.832 -28.400 1.00 0.00 H new ATOM 803 N LYS A 49 15.430 -8.661 -26.681 1.00 0.00 N ATOM 804 CA LYS A 49 15.978 -10.010 -26.771 1.00 0.00 C ATOM 805 C LYS A 49 14.885 -11.055 -26.567 1.00 0.00 C ATOM 806 O LYS A 49 14.780 -12.015 -27.331 1.00 0.00 O ATOM 807 CB LYS A 49 17.084 -10.203 -25.732 1.00 0.00 C ATOM 808 CG LYS A 49 18.485 -10.118 -26.312 1.00 0.00 C ATOM 809 CD LYS A 49 19.065 -8.722 -26.165 1.00 0.00 C ATOM 810 CE LYS A 49 19.638 -8.500 -24.773 1.00 0.00 C ATOM 811 NZ LYS A 49 20.969 -9.148 -24.611 1.00 0.00 N ATOM 0 H LYS A 49 15.917 -8.051 -26.024 1.00 0.00 H new ATOM 0 HA LYS A 49 16.399 -10.140 -27.768 1.00 0.00 H new ATOM 0 HB2 LYS A 49 16.976 -9.448 -24.954 1.00 0.00 H new ATOM 0 HB3 LYS A 49 16.956 -11.174 -25.254 1.00 0.00 H new ATOM 0 HG2 LYS A 49 19.132 -10.837 -25.809 1.00 0.00 H new ATOM 0 HG3 LYS A 49 18.461 -10.394 -27.366 1.00 0.00 H new ATOM 0 HD2 LYS A 49 19.847 -8.571 -26.910 1.00 0.00 H new ATOM 0 HD3 LYS A 49 18.290 -7.982 -26.363 1.00 0.00 H new ATOM 0 HE2 LYS A 49 19.730 -7.430 -24.584 1.00 0.00 H new ATOM 0 HE3 LYS A 49 18.948 -8.897 -24.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 21.363 -8.903 -23.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 20.864 -10.180 -24.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 21.611 -8.814 -25.358 1.00 0.00 H new ATOM 825 N LEU A 50 14.073 -10.861 -25.534 1.00 0.00 N ATOM 826 CA LEU A 50 12.987 -11.787 -25.230 1.00 0.00 C ATOM 827 C LEU A 50 12.024 -11.900 -26.407 1.00 0.00 C ATOM 828 O LEU A 50 11.593 -12.996 -26.765 1.00 0.00 O ATOM 829 CB LEU A 50 12.233 -11.327 -23.981 1.00 0.00 C ATOM 830 CG LEU A 50 11.839 -12.425 -22.993 1.00 0.00 C ATOM 831 CD1 LEU A 50 11.537 -11.831 -21.627 1.00 0.00 C ATOM 832 CD2 LEU A 50 10.640 -13.206 -23.514 1.00 0.00 C ATOM 0 H LEU A 50 14.146 -10.071 -24.893 1.00 0.00 H new ATOM 0 HA LEU A 50 13.421 -12.769 -25.043 1.00 0.00 H new ATOM 0 HB2 LEU A 50 12.850 -10.598 -23.456 1.00 0.00 H new ATOM 0 HB3 LEU A 50 11.328 -10.809 -24.298 1.00 0.00 H new ATOM 0 HG LEU A 50 12.679 -13.112 -22.890 1.00 0.00 H new ATOM 0 HD11 LEU A 50 11.258 -12.628 -20.937 1.00 0.00 H new ATOM 0 HD12 LEU A 50 12.421 -11.317 -21.250 1.00 0.00 H new ATOM 0 HD13 LEU A 50 10.714 -11.121 -21.713 1.00 0.00 H new ATOM 0 HD21 LEU A 50 10.373 -13.983 -22.798 1.00 0.00 H new ATOM 0 HD22 LEU A 50 9.795 -12.530 -23.647 1.00 0.00 H new ATOM 0 HD23 LEU A 50 10.892 -13.664 -24.470 1.00 0.00 H new ATOM 844 N GLN A 51 11.692 -10.761 -27.006 1.00 0.00 N ATOM 845 CA GLN A 51 10.780 -10.734 -28.143 1.00 0.00 C ATOM 846 C GLN A 51 11.281 -11.640 -29.264 1.00 0.00 C ATOM 847 O GLN A 51 10.498 -12.343 -29.902 1.00 0.00 O ATOM 848 CB GLN A 51 10.621 -9.303 -28.662 1.00 0.00 C ATOM 849 CG GLN A 51 9.875 -9.215 -29.983 1.00 0.00 C ATOM 850 CD GLN A 51 9.507 -7.791 -30.351 1.00 0.00 C ATOM 851 OE1 GLN A 51 9.682 -6.867 -29.557 1.00 0.00 O ATOM 852 NE2 GLN A 51 8.993 -7.606 -31.562 1.00 0.00 N ATOM 0 H GLN A 51 12.041 -9.845 -26.723 1.00 0.00 H new ATOM 0 HA GLN A 51 9.810 -11.102 -27.808 1.00 0.00 H new ATOM 0 HB2 GLN A 51 10.092 -8.711 -27.915 1.00 0.00 H new ATOM 0 HB3 GLN A 51 11.608 -8.857 -28.781 1.00 0.00 H new ATOM 0 HG2 GLN A 51 10.492 -9.643 -30.773 1.00 0.00 H new ATOM 0 HG3 GLN A 51 8.968 -9.817 -29.925 1.00 0.00 H new ATOM 0 HE21 GLN A 51 8.865 -8.401 -32.189 1.00 0.00 H new ATOM 0 HE22 GLN A 51 8.726 -6.669 -31.865 1.00 0.00 H new ATOM 861 N GLU A 52 12.589 -11.617 -29.497 1.00 0.00 N ATOM 862 CA GLU A 52 13.193 -12.437 -30.541 1.00 0.00 C ATOM 863 C GLU A 52 13.662 -13.776 -29.979 1.00 0.00 C ATOM 864 O GLU A 52 14.148 -14.634 -30.715 1.00 0.00 O ATOM 865 CB GLU A 52 14.370 -11.699 -31.182 1.00 0.00 C ATOM 866 CG GLU A 52 15.544 -11.491 -30.240 1.00 0.00 C ATOM 867 CD GLU A 52 16.778 -10.972 -30.952 1.00 0.00 C ATOM 868 OE1 GLU A 52 16.846 -9.751 -31.207 1.00 0.00 O ATOM 869 OE2 GLU A 52 17.676 -11.786 -31.252 1.00 0.00 O ATOM 0 H GLU A 52 13.251 -11.040 -28.978 1.00 0.00 H new ATOM 0 HA GLU A 52 12.436 -12.628 -31.301 1.00 0.00 H new ATOM 0 HB2 GLU A 52 14.709 -12.260 -32.053 1.00 0.00 H new ATOM 0 HB3 GLU A 52 14.027 -10.729 -31.542 1.00 0.00 H new ATOM 0 HG2 GLU A 52 15.257 -10.788 -29.458 1.00 0.00 H new ATOM 0 HG3 GLU A 52 15.782 -12.434 -29.749 1.00 0.00 H new ATOM 876 N ALA A 53 13.513 -13.946 -28.669 1.00 0.00 N ATOM 877 CA ALA A 53 13.920 -15.180 -28.008 1.00 0.00 C ATOM 878 C ALA A 53 12.757 -16.162 -27.917 1.00 0.00 C ATOM 879 O ALA A 53 12.905 -17.346 -28.222 1.00 0.00 O ATOM 880 CB ALA A 53 14.470 -14.879 -26.622 1.00 0.00 C ATOM 0 H ALA A 53 13.114 -13.245 -28.045 1.00 0.00 H new ATOM 0 HA ALA A 53 14.706 -15.642 -28.606 1.00 0.00 H new ATOM 0 HB1 ALA A 53 14.770 -15.809 -26.140 1.00 0.00 H new ATOM 0 HB2 ALA A 53 15.334 -14.220 -26.709 1.00 0.00 H new ATOM 0 HB3 ALA A 53 13.701 -14.392 -26.023 1.00 0.00 H new ATOM 886 N THR A 54 11.600 -15.664 -27.494 1.00 0.00 N ATOM 887 CA THR A 54 10.412 -16.499 -27.360 1.00 0.00 C ATOM 888 C THR A 54 9.856 -16.887 -28.725 1.00 0.00 C ATOM 889 O THR A 54 9.771 -16.057 -29.630 1.00 0.00 O ATOM 890 CB THR A 54 9.311 -15.784 -26.554 1.00 0.00 C ATOM 891 OG1 THR A 54 9.174 -14.432 -27.005 1.00 0.00 O ATOM 892 CG2 THR A 54 9.633 -15.798 -25.068 1.00 0.00 C ATOM 0 H THR A 54 11.460 -14.687 -27.238 1.00 0.00 H new ATOM 0 HA THR A 54 10.717 -17.399 -26.826 1.00 0.00 H new ATOM 0 HB THR A 54 8.373 -16.316 -26.711 1.00 0.00 H new ATOM 0 HG1 THR A 54 9.982 -13.927 -26.775 1.00 0.00 H new ATOM 0 HG21 THR A 54 8.842 -15.287 -24.519 1.00 0.00 H new ATOM 0 HG22 THR A 54 9.708 -16.829 -24.722 1.00 0.00 H new ATOM 0 HG23 THR A 54 10.581 -15.288 -24.896 1.00 0.00 H new ATOM 900 N ASN A 55 9.478 -18.153 -28.867 1.00 0.00 N ATOM 901 CA ASN A 55 8.929 -18.651 -30.123 1.00 0.00 C ATOM 902 C ASN A 55 7.777 -17.772 -30.600 1.00 0.00 C ATOM 903 O ASN A 55 7.712 -17.395 -31.770 1.00 0.00 O ATOM 904 CB ASN A 55 8.451 -20.095 -29.958 1.00 0.00 C ATOM 905 CG ASN A 55 8.450 -20.857 -31.269 1.00 0.00 C ATOM 906 OD1 ASN A 55 9.471 -20.939 -31.953 1.00 0.00 O ATOM 907 ND2 ASN A 55 7.301 -21.419 -31.626 1.00 0.00 N ATOM 0 H ASN A 55 9.542 -18.853 -28.128 1.00 0.00 H new ATOM 0 HA ASN A 55 9.719 -18.621 -30.873 1.00 0.00 H new ATOM 0 HB2 ASN A 55 9.094 -20.608 -29.243 1.00 0.00 H new ATOM 0 HB3 ASN A 55 7.445 -20.096 -29.539 1.00 0.00 H new ATOM 0 HD21 ASN A 55 7.240 -21.944 -32.498 1.00 0.00 H new ATOM 0 HD22 ASN A 55 6.480 -21.325 -31.028 1.00 0.00 H new ATOM 914 N PHE A 56 6.869 -17.450 -29.684 1.00 0.00 N ATOM 915 CA PHE A 56 5.718 -16.616 -30.010 1.00 0.00 C ATOM 916 C PHE A 56 6.163 -15.275 -30.586 1.00 0.00 C ATOM 917 O PHE A 56 7.306 -14.848 -30.420 1.00 0.00 O ATOM 918 CB PHE A 56 4.857 -16.388 -28.766 1.00 0.00 C ATOM 919 CG PHE A 56 3.760 -17.401 -28.603 1.00 0.00 C ATOM 920 CD1 PHE A 56 4.058 -18.743 -28.427 1.00 0.00 C ATOM 921 CD2 PHE A 56 2.430 -17.011 -28.625 1.00 0.00 C ATOM 922 CE1 PHE A 56 3.050 -19.677 -28.277 1.00 0.00 C ATOM 923 CE2 PHE A 56 1.418 -17.941 -28.475 1.00 0.00 C ATOM 924 CZ PHE A 56 1.729 -19.275 -28.300 1.00 0.00 C ATOM 0 H PHE A 56 6.908 -17.754 -28.711 1.00 0.00 H new ATOM 0 HA PHE A 56 5.126 -17.137 -30.763 1.00 0.00 H new ATOM 0 HB2 PHE A 56 5.495 -16.410 -27.883 1.00 0.00 H new ATOM 0 HB3 PHE A 56 4.417 -15.392 -28.816 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.089 -19.063 -28.407 1.00 0.00 H new ATOM 0 HD2 PHE A 56 2.181 -15.969 -28.761 1.00 0.00 H new ATOM 0 HE1 PHE A 56 3.295 -20.720 -28.142 1.00 0.00 H new ATOM 0 HE2 PHE A 56 0.386 -17.625 -28.495 1.00 0.00 H new ATOM 0 HZ PHE A 56 0.940 -20.003 -28.181 1.00 0.00 H new ATOM 934 N PRO A 57 5.240 -14.593 -31.280 1.00 0.00 N ATOM 935 CA PRO A 57 5.513 -13.291 -31.895 1.00 0.00 C ATOM 936 C PRO A 57 5.691 -12.187 -30.859 1.00 0.00 C ATOM 937 O PRO A 57 6.650 -11.416 -30.916 1.00 0.00 O ATOM 938 CB PRO A 57 4.267 -13.031 -32.745 1.00 0.00 C ATOM 939 CG PRO A 57 3.189 -13.821 -32.088 1.00 0.00 C ATOM 940 CD PRO A 57 3.858 -15.042 -31.518 1.00 0.00 C ATOM 0 HA PRO A 57 6.441 -13.297 -32.466 1.00 0.00 H new ATOM 0 HB2 PRO A 57 4.020 -11.970 -32.771 1.00 0.00 H new ATOM 0 HB3 PRO A 57 4.418 -13.349 -33.777 1.00 0.00 H new ATOM 0 HG2 PRO A 57 2.703 -13.241 -31.304 1.00 0.00 H new ATOM 0 HG3 PRO A 57 2.416 -14.098 -32.805 1.00 0.00 H new ATOM 0 HD2 PRO A 57 3.378 -15.370 -30.596 1.00 0.00 H new ATOM 0 HD3 PRO A 57 3.822 -15.881 -32.213 1.00 0.00 H new ATOM 948 N LEU A 58 4.762 -12.115 -29.912 1.00 0.00 N ATOM 949 CA LEU A 58 4.816 -11.105 -28.862 1.00 0.00 C ATOM 950 C LEU A 58 3.632 -11.244 -27.910 1.00 0.00 C ATOM 951 O LEU A 58 2.478 -11.264 -28.339 1.00 0.00 O ATOM 952 CB LEU A 58 4.829 -9.703 -29.475 1.00 0.00 C ATOM 953 CG LEU A 58 4.510 -8.551 -28.523 1.00 0.00 C ATOM 954 CD1 LEU A 58 5.543 -7.443 -28.659 1.00 0.00 C ATOM 955 CD2 LEU A 58 3.111 -8.013 -28.787 1.00 0.00 C ATOM 0 H LEU A 58 3.962 -12.745 -29.850 1.00 0.00 H new ATOM 0 HA LEU A 58 5.735 -11.256 -28.295 1.00 0.00 H new ATOM 0 HB2 LEU A 58 5.813 -9.527 -29.909 1.00 0.00 H new ATOM 0 HB3 LEU A 58 4.111 -9.680 -30.295 1.00 0.00 H new ATOM 0 HG LEU A 58 4.546 -8.929 -27.501 1.00 0.00 H new ATOM 0 HD11 LEU A 58 5.299 -6.632 -27.973 1.00 0.00 H new ATOM 0 HD12 LEU A 58 6.531 -7.836 -28.419 1.00 0.00 H new ATOM 0 HD13 LEU A 58 5.540 -7.067 -29.682 1.00 0.00 H new ATOM 0 HD21 LEU A 58 2.901 -7.193 -28.100 1.00 0.00 H new ATOM 0 HD22 LEU A 58 3.048 -7.652 -29.813 1.00 0.00 H new ATOM 0 HD23 LEU A 58 2.381 -8.808 -28.637 1.00 0.00 H new ATOM 967 N ARG A 59 3.926 -11.338 -26.618 1.00 0.00 N ATOM 968 CA ARG A 59 2.885 -11.475 -25.605 1.00 0.00 C ATOM 969 C ARG A 59 2.234 -10.127 -25.310 1.00 0.00 C ATOM 970 O ARG A 59 2.821 -9.066 -25.525 1.00 0.00 O ATOM 971 CB ARG A 59 3.469 -12.064 -24.320 1.00 0.00 C ATOM 972 CG ARG A 59 4.723 -11.353 -23.838 1.00 0.00 C ATOM 973 CD ARG A 59 4.584 -10.897 -22.394 1.00 0.00 C ATOM 974 NE ARG A 59 5.757 -11.243 -21.596 1.00 0.00 N ATOM 975 CZ ARG A 59 6.085 -12.490 -21.275 1.00 0.00 C ATOM 976 NH1 ARG A 59 5.334 -13.503 -21.682 1.00 0.00 N ATOM 977 NH2 ARG A 59 7.168 -12.725 -20.545 1.00 0.00 N ATOM 0 H ARG A 59 4.876 -11.322 -26.247 1.00 0.00 H new ATOM 0 HA ARG A 59 2.122 -12.151 -25.992 1.00 0.00 H new ATOM 0 HB2 ARG A 59 2.714 -12.022 -23.535 1.00 0.00 H new ATOM 0 HB3 ARG A 59 3.699 -13.117 -24.485 1.00 0.00 H new ATOM 0 HG2 ARG A 59 5.579 -12.021 -23.929 1.00 0.00 H new ATOM 0 HG3 ARG A 59 4.922 -10.491 -24.475 1.00 0.00 H new ATOM 0 HD2 ARG A 59 4.433 -9.818 -22.368 1.00 0.00 H new ATOM 0 HD3 ARG A 59 3.698 -11.354 -21.953 1.00 0.00 H new ATOM 0 HE ARG A 59 6.357 -10.487 -21.267 1.00 0.00 H new ATOM 0 HH11 ARG A 59 4.501 -13.327 -22.244 1.00 0.00 H new ATOM 0 HH12 ARG A 59 5.589 -14.459 -21.434 1.00 0.00 H new ATOM 0 HH21 ARG A 59 7.749 -11.948 -20.230 1.00 0.00 H new ATOM 0 HH22 ARG A 59 7.419 -13.682 -20.299 1.00 0.00 H new ATOM 991 N PRO A 60 0.993 -10.167 -24.805 1.00 0.00 N ATOM 992 CA PRO A 60 0.235 -8.958 -24.468 1.00 0.00 C ATOM 993 C PRO A 60 0.809 -8.232 -23.257 1.00 0.00 C ATOM 994 O PRO A 60 1.000 -8.828 -22.196 1.00 0.00 O ATOM 995 CB PRO A 60 -1.166 -9.492 -24.158 1.00 0.00 C ATOM 996 CG PRO A 60 -0.947 -10.902 -23.732 1.00 0.00 C ATOM 997 CD PRO A 60 0.232 -11.396 -24.523 1.00 0.00 C ATOM 0 HA PRO A 60 0.258 -8.225 -25.275 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -1.646 -8.911 -23.371 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -1.813 -9.439 -25.034 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -0.750 -10.960 -22.661 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -1.830 -11.510 -23.927 1.00 0.00 H new ATOM 0 HD2 PRO A 60 0.824 -12.114 -23.956 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -0.080 -11.895 -25.441 1.00 0.00 H new ATOM 1005 N PHE A 61 1.083 -6.942 -23.420 1.00 0.00 N ATOM 1006 CA PHE A 61 1.636 -6.135 -22.339 1.00 0.00 C ATOM 1007 C PHE A 61 2.943 -6.733 -21.827 1.00 0.00 C ATOM 1008 O PHE A 61 2.967 -7.417 -20.803 1.00 0.00 O ATOM 1009 CB PHE A 61 0.630 -6.022 -21.192 1.00 0.00 C ATOM 1010 CG PHE A 61 -0.703 -5.475 -21.616 1.00 0.00 C ATOM 1011 CD1 PHE A 61 -0.864 -4.122 -21.866 1.00 0.00 C ATOM 1012 CD2 PHE A 61 -1.796 -6.314 -21.764 1.00 0.00 C ATOM 1013 CE1 PHE A 61 -2.090 -3.615 -22.256 1.00 0.00 C ATOM 1014 CE2 PHE A 61 -3.024 -5.814 -22.154 1.00 0.00 C ATOM 1015 CZ PHE A 61 -3.171 -4.462 -22.400 1.00 0.00 C ATOM 0 H PHE A 61 0.931 -6.433 -24.291 1.00 0.00 H new ATOM 0 HA PHE A 61 1.842 -5.139 -22.732 1.00 0.00 H new ATOM 0 HB2 PHE A 61 0.485 -7.007 -20.748 1.00 0.00 H new ATOM 0 HB3 PHE A 61 1.047 -5.380 -20.416 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -0.022 -3.455 -21.755 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -1.687 -7.371 -21.572 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -2.202 -2.558 -22.448 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -3.868 -6.479 -22.266 1.00 0.00 H new ATOM 0 HZ PHE A 61 -4.130 -4.069 -22.704 1.00 0.00 H new ATOM 1025 N VAL A 62 4.029 -6.473 -22.548 1.00 0.00 N ATOM 1026 CA VAL A 62 5.340 -6.985 -22.167 1.00 0.00 C ATOM 1027 C VAL A 62 6.120 -5.954 -21.360 1.00 0.00 C ATOM 1028 O VAL A 62 6.531 -6.218 -20.229 1.00 0.00 O ATOM 1029 CB VAL A 62 6.167 -7.384 -23.404 1.00 0.00 C ATOM 1030 CG1 VAL A 62 7.246 -8.386 -23.024 1.00 0.00 C ATOM 1031 CG2 VAL A 62 5.262 -7.948 -24.490 1.00 0.00 C ATOM 0 H VAL A 62 4.027 -5.911 -23.399 1.00 0.00 H new ATOM 0 HA VAL A 62 5.168 -7.869 -21.552 1.00 0.00 H new ATOM 0 HB VAL A 62 6.655 -6.492 -23.797 1.00 0.00 H new ATOM 0 HG11 VAL A 62 7.820 -8.656 -23.910 1.00 0.00 H new ATOM 0 HG12 VAL A 62 7.910 -7.942 -22.283 1.00 0.00 H new ATOM 0 HG13 VAL A 62 6.782 -9.279 -22.606 1.00 0.00 H new ATOM 0 HG21 VAL A 62 5.862 -8.225 -25.357 1.00 0.00 H new ATOM 0 HG22 VAL A 62 4.744 -8.829 -24.111 1.00 0.00 H new ATOM 0 HG23 VAL A 62 4.530 -7.195 -24.781 1.00 0.00 H new ATOM 1041 N ILE A 63 6.319 -4.778 -21.946 1.00 0.00 N ATOM 1042 CA ILE A 63 7.048 -3.706 -21.280 1.00 0.00 C ATOM 1043 C ILE A 63 6.384 -3.328 -19.961 1.00 0.00 C ATOM 1044 O ILE A 63 7.023 -3.273 -18.909 1.00 0.00 O ATOM 1045 CB ILE A 63 7.146 -2.454 -22.171 1.00 0.00 C ATOM 1046 CG1 ILE A 63 8.124 -2.695 -23.323 1.00 0.00 C ATOM 1047 CG2 ILE A 63 7.577 -1.250 -21.347 1.00 0.00 C ATOM 1048 CD1 ILE A 63 7.530 -2.420 -24.687 1.00 0.00 C ATOM 0 H ILE A 63 5.985 -4.544 -22.881 1.00 0.00 H new ATOM 0 HA ILE A 63 8.053 -4.081 -21.084 1.00 0.00 H new ATOM 0 HB ILE A 63 6.162 -2.249 -22.592 1.00 0.00 H new ATOM 0 HG12 ILE A 63 9.001 -2.063 -23.183 1.00 0.00 H new ATOM 0 HG13 ILE A 63 8.468 -3.729 -23.287 1.00 0.00 H new ATOM 0 HG21 ILE A 63 7.642 -0.373 -21.991 1.00 0.00 H new ATOM 0 HG22 ILE A 63 6.847 -1.068 -20.559 1.00 0.00 H new ATOM 0 HG23 ILE A 63 8.552 -1.445 -20.900 1.00 0.00 H new ATOM 0 HD11 ILE A 63 8.279 -2.612 -25.455 1.00 0.00 H new ATOM 0 HD12 ILE A 63 6.671 -3.071 -24.848 1.00 0.00 H new ATOM 0 HD13 ILE A 63 7.212 -1.379 -24.742 1.00 0.00 H new ATOM 1060 N PRO A 64 5.071 -3.061 -20.014 1.00 0.00 N ATOM 1061 CA PRO A 64 4.291 -2.686 -18.831 1.00 0.00 C ATOM 1062 C PRO A 64 4.116 -3.848 -17.859 1.00 0.00 C ATOM 1063 O PRO A 64 3.613 -3.671 -16.749 1.00 0.00 O ATOM 1064 CB PRO A 64 2.939 -2.269 -19.416 1.00 0.00 C ATOM 1065 CG PRO A 64 2.841 -3.006 -20.707 1.00 0.00 C ATOM 1066 CD PRO A 64 4.246 -3.107 -21.233 1.00 0.00 C ATOM 0 HA PRO A 64 4.780 -1.903 -18.251 1.00 0.00 H new ATOM 0 HB2 PRO A 64 2.120 -2.532 -18.747 1.00 0.00 H new ATOM 0 HB3 PRO A 64 2.890 -1.191 -19.571 1.00 0.00 H new ATOM 0 HG2 PRO A 64 2.407 -3.995 -20.560 1.00 0.00 H new ATOM 0 HG3 PRO A 64 2.198 -2.477 -21.411 1.00 0.00 H new ATOM 0 HD2 PRO A 64 4.401 -4.032 -21.789 1.00 0.00 H new ATOM 0 HD3 PRO A 64 4.482 -2.285 -21.909 1.00 0.00 H new ATOM 1074 N PHE A 65 4.534 -5.036 -18.283 1.00 0.00 N ATOM 1075 CA PHE A 65 4.423 -6.227 -17.450 1.00 0.00 C ATOM 1076 C PHE A 65 5.458 -6.205 -16.328 1.00 0.00 C ATOM 1077 O PHE A 65 5.113 -6.290 -15.149 1.00 0.00 O ATOM 1078 CB PHE A 65 4.601 -7.488 -18.299 1.00 0.00 C ATOM 1079 CG PHE A 65 3.473 -8.469 -18.159 1.00 0.00 C ATOM 1080 CD1 PHE A 65 2.157 -8.033 -18.135 1.00 0.00 C ATOM 1081 CD2 PHE A 65 3.727 -9.827 -18.052 1.00 0.00 C ATOM 1082 CE1 PHE A 65 1.117 -8.934 -18.006 1.00 0.00 C ATOM 1083 CE2 PHE A 65 2.690 -10.732 -17.924 1.00 0.00 C ATOM 1084 CZ PHE A 65 1.384 -10.285 -17.902 1.00 0.00 C ATOM 0 H PHE A 65 4.953 -5.199 -19.199 1.00 0.00 H new ATOM 0 HA PHE A 65 3.429 -6.236 -17.003 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.694 -7.201 -19.346 1.00 0.00 H new ATOM 0 HB3 PHE A 65 5.534 -7.977 -18.018 1.00 0.00 H new ATOM 0 HD1 PHE A 65 1.942 -6.978 -18.218 1.00 0.00 H new ATOM 0 HD2 PHE A 65 4.747 -10.182 -18.069 1.00 0.00 H new ATOM 0 HE1 PHE A 65 0.096 -8.582 -17.987 1.00 0.00 H new ATOM 0 HE2 PHE A 65 2.901 -11.788 -17.841 1.00 0.00 H new ATOM 0 HZ PHE A 65 0.572 -10.991 -17.804 1.00 0.00 H new ATOM 1094 N LEU A 66 6.726 -6.092 -16.705 1.00 0.00 N ATOM 1095 CA LEU A 66 7.813 -6.059 -15.732 1.00 0.00 C ATOM 1096 C LEU A 66 8.080 -4.633 -15.262 1.00 0.00 C ATOM 1097 O LEU A 66 8.699 -4.416 -14.220 1.00 0.00 O ATOM 1098 CB LEU A 66 9.085 -6.655 -16.338 1.00 0.00 C ATOM 1099 CG LEU A 66 9.394 -8.104 -15.960 1.00 0.00 C ATOM 1100 CD1 LEU A 66 8.730 -9.063 -16.935 1.00 0.00 C ATOM 1101 CD2 LEU A 66 10.897 -8.335 -15.921 1.00 0.00 C ATOM 0 H LEU A 66 7.028 -6.022 -17.677 1.00 0.00 H new ATOM 0 HA LEU A 66 7.514 -6.656 -14.870 1.00 0.00 H new ATOM 0 HB2 LEU A 66 9.010 -6.592 -17.424 1.00 0.00 H new ATOM 0 HB3 LEU A 66 9.930 -6.035 -16.040 1.00 0.00 H new ATOM 0 HG LEU A 66 8.991 -8.294 -14.965 1.00 0.00 H new ATOM 0 HD11 LEU A 66 8.961 -10.089 -16.650 1.00 0.00 H new ATOM 0 HD12 LEU A 66 7.650 -8.915 -16.913 1.00 0.00 H new ATOM 0 HD13 LEU A 66 9.102 -8.874 -17.942 1.00 0.00 H new ATOM 0 HD21 LEU A 66 11.099 -9.371 -15.650 1.00 0.00 H new ATOM 0 HD22 LEU A 66 11.323 -8.127 -16.903 1.00 0.00 H new ATOM 0 HD23 LEU A 66 11.348 -7.673 -15.182 1.00 0.00 H new ATOM 1113 N LYS A 67 7.608 -3.662 -16.036 1.00 0.00 N ATOM 1114 CA LYS A 67 7.792 -2.255 -15.698 1.00 0.00 C ATOM 1115 C LYS A 67 7.262 -1.958 -14.299 1.00 0.00 C ATOM 1116 O LYS A 67 7.764 -1.069 -13.611 1.00 0.00 O ATOM 1117 CB LYS A 67 7.082 -1.367 -16.723 1.00 0.00 C ATOM 1118 CG LYS A 67 8.006 -0.822 -17.798 1.00 0.00 C ATOM 1119 CD LYS A 67 8.270 0.662 -17.608 1.00 0.00 C ATOM 1120 CE LYS A 67 7.030 1.491 -17.904 1.00 0.00 C ATOM 1121 NZ LYS A 67 7.310 2.952 -17.838 1.00 0.00 N ATOM 0 H LYS A 67 7.095 -3.823 -16.903 1.00 0.00 H new ATOM 0 HA LYS A 67 8.860 -2.039 -15.716 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.285 -1.939 -17.197 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.610 -0.533 -16.204 1.00 0.00 H new ATOM 0 HG2 LYS A 67 8.950 -1.366 -17.777 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.563 -0.991 -18.779 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.596 0.846 -16.585 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.083 0.975 -18.263 1.00 0.00 H new ATOM 0 HE2 LYS A 67 6.652 1.238 -18.895 1.00 0.00 H new ATOM 0 HE3 LYS A 67 6.246 1.239 -17.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 6.440 3.482 -18.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 7.646 3.198 -16.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.040 3.198 -18.537 1.00 0.00 H new ATOM 1135 N ALA A 68 6.247 -2.708 -13.883 1.00 0.00 N ATOM 1136 CA ALA A 68 5.653 -2.527 -12.565 1.00 0.00 C ATOM 1137 C ALA A 68 6.036 -3.667 -11.628 1.00 0.00 C ATOM 1138 O ALA A 68 5.595 -3.715 -10.481 1.00 0.00 O ATOM 1139 CB ALA A 68 4.139 -2.420 -12.678 1.00 0.00 C ATOM 0 H ALA A 68 5.819 -3.447 -14.440 1.00 0.00 H new ATOM 0 HA ALA A 68 6.041 -1.600 -12.144 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.709 -2.285 -11.686 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.880 -1.567 -13.305 1.00 0.00 H new ATOM 0 HB3 ALA A 68 3.742 -3.332 -13.125 1.00 0.00 H new ATOM 1145 N ASN A 69 6.858 -4.585 -12.126 1.00 0.00 N ATOM 1146 CA ASN A 69 7.300 -5.727 -11.333 1.00 0.00 C ATOM 1147 C ASN A 69 8.805 -5.671 -11.091 1.00 0.00 C ATOM 1148 O ASN A 69 9.360 -6.504 -10.373 1.00 0.00 O ATOM 1149 CB ASN A 69 6.933 -7.035 -12.037 1.00 0.00 C ATOM 1150 CG ASN A 69 5.723 -7.706 -11.415 1.00 0.00 C ATOM 1151 OD1 ASN A 69 5.852 -8.683 -10.678 1.00 0.00 O ATOM 1152 ND2 ASN A 69 4.539 -7.183 -11.712 1.00 0.00 N ATOM 0 H ASN A 69 7.232 -4.561 -13.075 1.00 0.00 H new ATOM 0 HA ASN A 69 6.794 -5.687 -10.369 1.00 0.00 H new ATOM 0 HB2 ASN A 69 6.733 -6.834 -13.090 1.00 0.00 H new ATOM 0 HB3 ASN A 69 7.783 -7.716 -11.998 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.689 -7.592 -11.324 1.00 0.00 H new ATOM 0 HD22 ASN A 69 4.480 -6.372 -12.328 1.00 0.00 H new ATOM 1159 N LEU A 70 9.460 -4.686 -11.695 1.00 0.00 N ATOM 1160 CA LEU A 70 10.901 -4.520 -11.544 1.00 0.00 C ATOM 1161 C LEU A 70 11.309 -4.599 -10.076 1.00 0.00 C ATOM 1162 O LEU A 70 12.179 -5.379 -9.689 1.00 0.00 O ATOM 1163 CB LEU A 70 11.346 -3.182 -12.137 1.00 0.00 C ATOM 1164 CG LEU A 70 12.635 -3.206 -12.958 1.00 0.00 C ATOM 1165 CD1 LEU A 70 13.827 -3.530 -12.071 1.00 0.00 C ATOM 1166 CD2 LEU A 70 12.525 -4.213 -14.095 1.00 0.00 C ATOM 0 H LEU A 70 9.016 -3.990 -12.294 1.00 0.00 H new ATOM 0 HA LEU A 70 11.392 -5.331 -12.082 1.00 0.00 H new ATOM 0 HB2 LEU A 70 10.543 -2.803 -12.770 1.00 0.00 H new ATOM 0 HB3 LEU A 70 11.472 -2.470 -11.321 1.00 0.00 H new ATOM 0 HG LEU A 70 12.787 -2.216 -13.389 1.00 0.00 H new ATOM 0 HD11 LEU A 70 14.736 -3.543 -12.673 1.00 0.00 H new ATOM 0 HD12 LEU A 70 13.918 -2.772 -11.293 1.00 0.00 H new ATOM 0 HD13 LEU A 70 13.683 -4.508 -11.611 1.00 0.00 H new ATOM 0 HD21 LEU A 70 13.452 -4.217 -14.669 1.00 0.00 H new ATOM 0 HD22 LEU A 70 12.349 -5.207 -13.685 1.00 0.00 H new ATOM 0 HD23 LEU A 70 11.696 -3.937 -14.747 1.00 0.00 H new ATOM 1178 N PRO A 71 10.663 -3.775 -9.238 1.00 0.00 N ATOM 1179 CA PRO A 71 10.939 -3.735 -7.799 1.00 0.00 C ATOM 1180 C PRO A 71 10.465 -4.994 -7.082 1.00 0.00 C ATOM 1181 O PRO A 71 10.848 -5.253 -5.940 1.00 0.00 O ATOM 1182 CB PRO A 71 10.147 -2.516 -7.320 1.00 0.00 C ATOM 1183 CG PRO A 71 9.048 -2.364 -8.314 1.00 0.00 C ATOM 1184 CD PRO A 71 9.614 -2.819 -9.630 1.00 0.00 C ATOM 0 HA PRO A 71 12.007 -3.675 -7.591 1.00 0.00 H new ATOM 0 HB2 PRO A 71 9.754 -2.669 -6.315 1.00 0.00 H new ATOM 0 HB3 PRO A 71 10.774 -1.625 -7.284 1.00 0.00 H new ATOM 0 HG2 PRO A 71 8.182 -2.964 -8.033 1.00 0.00 H new ATOM 0 HG3 PRO A 71 8.713 -1.328 -8.370 1.00 0.00 H new ATOM 0 HD2 PRO A 71 8.854 -3.290 -10.253 1.00 0.00 H new ATOM 0 HD3 PRO A 71 10.023 -1.986 -10.201 1.00 0.00 H new ATOM 1192 N LEU A 72 9.630 -5.775 -7.759 1.00 0.00 N ATOM 1193 CA LEU A 72 9.103 -7.009 -7.186 1.00 0.00 C ATOM 1194 C LEU A 72 9.967 -8.203 -7.579 1.00 0.00 C ATOM 1195 O LEU A 72 9.962 -9.235 -6.905 1.00 0.00 O ATOM 1196 CB LEU A 72 7.662 -7.234 -7.648 1.00 0.00 C ATOM 1197 CG LEU A 72 6.579 -6.521 -6.838 1.00 0.00 C ATOM 1198 CD1 LEU A 72 6.720 -6.841 -5.358 1.00 0.00 C ATOM 1199 CD2 LEU A 72 6.643 -5.018 -7.068 1.00 0.00 C ATOM 0 H LEU A 72 9.304 -5.576 -8.705 1.00 0.00 H new ATOM 0 HA LEU A 72 9.119 -6.913 -6.100 1.00 0.00 H new ATOM 0 HB2 LEU A 72 7.580 -6.914 -8.687 1.00 0.00 H new ATOM 0 HB3 LEU A 72 7.458 -8.304 -7.627 1.00 0.00 H new ATOM 0 HG LEU A 72 5.606 -6.880 -7.175 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.940 -6.324 -4.798 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.623 -7.916 -5.207 1.00 0.00 H new ATOM 0 HD13 LEU A 72 7.698 -6.512 -5.006 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.865 -4.527 -6.484 1.00 0.00 H new ATOM 0 HD22 LEU A 72 7.619 -4.644 -6.759 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.491 -4.805 -8.126 1.00 0.00 H new ATOM 1211 N LEU A 73 10.710 -8.057 -8.670 1.00 0.00 N ATOM 1212 CA LEU A 73 11.582 -9.122 -9.151 1.00 0.00 C ATOM 1213 C LEU A 73 12.992 -8.967 -8.591 1.00 0.00 C ATOM 1214 O LEU A 73 13.702 -9.952 -8.391 1.00 0.00 O ATOM 1215 CB LEU A 73 11.625 -9.121 -10.680 1.00 0.00 C ATOM 1216 CG LEU A 73 10.320 -9.487 -11.389 1.00 0.00 C ATOM 1217 CD1 LEU A 73 10.419 -9.189 -12.877 1.00 0.00 C ATOM 1218 CD2 LEU A 73 9.980 -10.952 -11.158 1.00 0.00 C ATOM 0 H LEU A 73 10.726 -7.210 -9.239 1.00 0.00 H new ATOM 0 HA LEU A 73 11.177 -10.073 -8.805 1.00 0.00 H new ATOM 0 HB2 LEU A 73 11.931 -8.130 -11.014 1.00 0.00 H new ATOM 0 HB3 LEU A 73 12.398 -9.819 -11.002 1.00 0.00 H new ATOM 0 HG LEU A 73 9.519 -8.878 -10.970 1.00 0.00 H new ATOM 0 HD11 LEU A 73 9.481 -9.456 -13.365 1.00 0.00 H new ATOM 0 HD12 LEU A 73 10.615 -8.127 -13.023 1.00 0.00 H new ATOM 0 HD13 LEU A 73 11.232 -9.771 -13.311 1.00 0.00 H new ATOM 0 HD21 LEU A 73 9.049 -11.194 -11.670 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.782 -11.578 -11.549 1.00 0.00 H new ATOM 0 HD23 LEU A 73 9.865 -11.135 -10.090 1.00 0.00 H new ATOM 1230 N GLN A 74 13.389 -7.724 -8.339 1.00 0.00 N ATOM 1231 CA GLN A 74 14.714 -7.440 -7.800 1.00 0.00 C ATOM 1232 C GLN A 74 14.771 -7.746 -6.307 1.00 0.00 C ATOM 1233 O GLN A 74 15.850 -7.803 -5.716 1.00 0.00 O ATOM 1234 CB GLN A 74 15.086 -5.978 -8.048 1.00 0.00 C ATOM 1235 CG GLN A 74 14.127 -4.988 -7.406 1.00 0.00 C ATOM 1236 CD GLN A 74 14.427 -4.753 -5.939 1.00 0.00 C ATOM 1237 OE1 GLN A 74 13.547 -4.876 -5.086 1.00 0.00 O ATOM 1238 NE2 GLN A 74 15.675 -4.413 -5.636 1.00 0.00 N ATOM 0 H GLN A 74 12.813 -6.898 -8.499 1.00 0.00 H new ATOM 0 HA GLN A 74 15.432 -8.081 -8.311 1.00 0.00 H new ATOM 0 HB2 GLN A 74 16.091 -5.798 -7.666 1.00 0.00 H new ATOM 0 HB3 GLN A 74 15.116 -5.797 -9.122 1.00 0.00 H new ATOM 0 HG2 GLN A 74 14.179 -4.039 -7.940 1.00 0.00 H new ATOM 0 HG3 GLN A 74 13.107 -5.357 -7.510 1.00 0.00 H new ATOM 0 HE21 GLN A 74 16.373 -4.322 -6.375 1.00 0.00 H new ATOM 0 HE22 GLN A 74 15.936 -4.243 -4.665 1.00 0.00 H new ATOM 1247 N ARG A 75 13.604 -7.941 -5.703 1.00 0.00 N ATOM 1248 CA ARG A 75 13.521 -8.239 -4.278 1.00 0.00 C ATOM 1249 C ARG A 75 13.443 -9.744 -4.041 1.00 0.00 C ATOM 1250 O ARG A 75 13.705 -10.222 -2.938 1.00 0.00 O ATOM 1251 CB ARG A 75 12.302 -7.550 -3.661 1.00 0.00 C ATOM 1252 CG ARG A 75 10.976 -8.089 -4.170 1.00 0.00 C ATOM 1253 CD ARG A 75 9.805 -7.271 -3.649 1.00 0.00 C ATOM 1254 NE ARG A 75 9.546 -7.525 -2.234 1.00 0.00 N ATOM 1255 CZ ARG A 75 8.936 -8.615 -1.782 1.00 0.00 C ATOM 1256 NH1 ARG A 75 8.524 -9.547 -2.630 1.00 0.00 N ATOM 1257 NH2 ARG A 75 8.737 -8.774 -0.480 1.00 0.00 N ATOM 0 H ARG A 75 12.702 -7.898 -6.178 1.00 0.00 H new ATOM 0 HA ARG A 75 14.424 -7.860 -3.800 1.00 0.00 H new ATOM 0 HB2 ARG A 75 12.340 -7.665 -2.578 1.00 0.00 H new ATOM 0 HB3 ARG A 75 12.355 -6.482 -3.870 1.00 0.00 H new ATOM 0 HG2 ARG A 75 10.972 -8.079 -5.260 1.00 0.00 H new ATOM 0 HG3 ARG A 75 10.862 -9.128 -3.861 1.00 0.00 H new ATOM 0 HD2 ARG A 75 10.010 -6.211 -3.795 1.00 0.00 H new ATOM 0 HD3 ARG A 75 8.912 -7.506 -4.229 1.00 0.00 H new ATOM 0 HE ARG A 75 9.850 -6.827 -1.556 1.00 0.00 H new ATOM 0 HH11 ARG A 75 8.675 -9.428 -3.632 1.00 0.00 H new ATOM 0 HH12 ARG A 75 8.056 -10.383 -2.281 1.00 0.00 H new ATOM 0 HH21 ARG A 75 9.053 -8.059 0.175 1.00 0.00 H new ATOM 0 HH22 ARG A 75 8.268 -9.611 -0.134 1.00 0.00 H new ATOM 1271 N GLU A 76 13.079 -10.484 -5.084 1.00 0.00 N ATOM 1272 CA GLU A 76 12.965 -11.934 -4.988 1.00 0.00 C ATOM 1273 C GLU A 76 14.287 -12.609 -5.344 1.00 0.00 C ATOM 1274 O GLU A 76 14.482 -13.796 -5.080 1.00 0.00 O ATOM 1275 CB GLU A 76 11.855 -12.443 -5.910 1.00 0.00 C ATOM 1276 CG GLU A 76 12.323 -12.720 -7.329 1.00 0.00 C ATOM 1277 CD GLU A 76 11.189 -12.676 -8.336 1.00 0.00 C ATOM 1278 OE1 GLU A 76 10.186 -11.981 -8.069 1.00 0.00 O ATOM 1279 OE2 GLU A 76 11.305 -13.336 -9.389 1.00 0.00 O ATOM 0 H GLU A 76 12.858 -10.103 -6.004 1.00 0.00 H new ATOM 0 HA GLU A 76 12.715 -12.185 -3.957 1.00 0.00 H new ATOM 0 HB2 GLU A 76 11.435 -13.357 -5.490 1.00 0.00 H new ATOM 0 HB3 GLU A 76 11.051 -11.707 -5.938 1.00 0.00 H new ATOM 0 HG2 GLU A 76 13.080 -11.987 -7.608 1.00 0.00 H new ATOM 0 HG3 GLU A 76 12.799 -13.700 -7.366 1.00 0.00 H new ATOM 1286 N LEU A 77 15.191 -11.844 -5.945 1.00 0.00 N ATOM 1287 CA LEU A 77 16.495 -12.367 -6.339 1.00 0.00 C ATOM 1288 C LEU A 77 17.244 -12.926 -5.134 1.00 0.00 C ATOM 1289 O LEU A 77 18.123 -13.777 -5.276 1.00 0.00 O ATOM 1290 CB LEU A 77 17.326 -11.270 -7.007 1.00 0.00 C ATOM 1291 CG LEU A 77 18.034 -11.660 -8.305 1.00 0.00 C ATOM 1292 CD1 LEU A 77 19.109 -12.700 -8.034 1.00 0.00 C ATOM 1293 CD2 LEU A 77 17.031 -12.180 -9.324 1.00 0.00 C ATOM 0 H LEU A 77 15.046 -10.860 -6.170 1.00 0.00 H new ATOM 0 HA LEU A 77 16.334 -13.177 -7.051 1.00 0.00 H new ATOM 0 HB2 LEU A 77 16.673 -10.422 -7.214 1.00 0.00 H new ATOM 0 HB3 LEU A 77 18.077 -10.927 -6.296 1.00 0.00 H new ATOM 0 HG LEU A 77 18.512 -10.771 -8.717 1.00 0.00 H new ATOM 0 HD11 LEU A 77 19.602 -12.966 -8.969 1.00 0.00 H new ATOM 0 HD12 LEU A 77 19.843 -12.292 -7.340 1.00 0.00 H new ATOM 0 HD13 LEU A 77 18.653 -13.589 -7.599 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.553 -12.453 -10.241 1.00 0.00 H new ATOM 0 HD22 LEU A 77 16.524 -13.056 -8.921 1.00 0.00 H new ATOM 0 HD23 LEU A 77 16.297 -11.404 -9.541 1.00 0.00 H new ATOM 1305 N LEU A 78 16.890 -12.443 -3.948 1.00 0.00 N ATOM 1306 CA LEU A 78 17.527 -12.896 -2.716 1.00 0.00 C ATOM 1307 C LEU A 78 17.056 -14.298 -2.343 1.00 0.00 C ATOM 1308 O LEU A 78 17.606 -14.929 -1.440 1.00 0.00 O ATOM 1309 CB LEU A 78 17.225 -11.923 -1.575 1.00 0.00 C ATOM 1310 CG LEU A 78 18.207 -10.764 -1.403 1.00 0.00 C ATOM 1311 CD1 LEU A 78 19.519 -11.259 -0.815 1.00 0.00 C ATOM 1312 CD2 LEU A 78 18.446 -10.066 -2.734 1.00 0.00 C ATOM 0 H LEU A 78 16.165 -11.738 -3.813 1.00 0.00 H new ATOM 0 HA LEU A 78 18.604 -12.927 -2.883 1.00 0.00 H new ATOM 0 HB2 LEU A 78 16.229 -11.509 -1.732 1.00 0.00 H new ATOM 0 HB3 LEU A 78 17.193 -12.487 -0.643 1.00 0.00 H new ATOM 0 HG LEU A 78 17.772 -10.043 -0.711 1.00 0.00 H new ATOM 0 HD11 LEU A 78 20.206 -10.420 -0.700 1.00 0.00 H new ATOM 0 HD12 LEU A 78 19.333 -11.712 0.159 1.00 0.00 H new ATOM 0 HD13 LEU A 78 19.960 -12.000 -1.482 1.00 0.00 H new ATOM 0 HD21 LEU A 78 19.147 -9.244 -2.593 1.00 0.00 H new ATOM 0 HD22 LEU A 78 18.860 -10.777 -3.449 1.00 0.00 H new ATOM 0 HD23 LEU A 78 17.502 -9.676 -3.115 1.00 0.00 H new ATOM 1324 N HIS A 79 16.036 -14.781 -3.045 1.00 0.00 N ATOM 1325 CA HIS A 79 15.493 -16.110 -2.790 1.00 0.00 C ATOM 1326 C HIS A 79 16.164 -17.152 -3.680 1.00 0.00 C ATOM 1327 O HIS A 79 16.553 -18.222 -3.214 1.00 0.00 O ATOM 1328 CB HIS A 79 13.982 -16.120 -3.023 1.00 0.00 C ATOM 1329 CG HIS A 79 13.289 -17.297 -2.410 1.00 0.00 C ATOM 1330 ND1 HIS A 79 12.517 -17.207 -1.270 1.00 0.00 N ATOM 1331 CD2 HIS A 79 13.253 -18.597 -2.784 1.00 0.00 C ATOM 1332 CE1 HIS A 79 12.038 -18.400 -0.970 1.00 0.00 C ATOM 1333 NE2 HIS A 79 12.469 -19.262 -1.873 1.00 0.00 N ATOM 0 H HIS A 79 15.569 -14.272 -3.795 1.00 0.00 H new ATOM 0 HA HIS A 79 15.694 -16.364 -1.749 1.00 0.00 H new ATOM 0 HB2 HIS A 79 13.554 -15.204 -2.616 1.00 0.00 H new ATOM 0 HB3 HIS A 79 13.788 -16.113 -4.096 1.00 0.00 H new ATOM 0 HD2 HIS A 79 13.749 -19.031 -3.640 1.00 0.00 H new ATOM 0 HE1 HIS A 79 11.402 -18.632 -0.129 1.00 0.00 H new ATOM 0 HE2 HIS A 79 12.255 -20.259 -1.891 1.00 0.00 H new ATOM 1341 N ALA A 80 16.296 -16.830 -4.962 1.00 0.00 N ATOM 1342 CA ALA A 80 16.921 -17.738 -5.917 1.00 0.00 C ATOM 1343 C ALA A 80 18.266 -18.236 -5.400 1.00 0.00 C ATOM 1344 O ALA A 80 18.585 -19.419 -5.513 1.00 0.00 O ATOM 1345 CB ALA A 80 17.092 -17.051 -7.264 1.00 0.00 C ATOM 0 H ALA A 80 15.979 -15.948 -5.364 1.00 0.00 H new ATOM 0 HA ALA A 80 16.267 -18.601 -6.043 1.00 0.00 H new ATOM 0 HB1 ALA A 80 17.560 -17.740 -7.967 1.00 0.00 H new ATOM 0 HB2 ALA A 80 16.116 -16.750 -7.645 1.00 0.00 H new ATOM 0 HB3 ALA A 80 17.723 -16.170 -7.146 1.00 0.00 H new ATOM 1351 N ALA A 81 19.051 -17.326 -4.834 1.00 0.00 N ATOM 1352 CA ALA A 81 20.362 -17.674 -4.299 1.00 0.00 C ATOM 1353 C ALA A 81 20.248 -18.745 -3.220 1.00 0.00 C ATOM 1354 O ALA A 81 21.086 -19.642 -3.132 1.00 0.00 O ATOM 1355 CB ALA A 81 21.051 -16.436 -3.745 1.00 0.00 C ATOM 0 H ALA A 81 18.802 -16.342 -4.734 1.00 0.00 H new ATOM 0 HA ALA A 81 20.964 -18.078 -5.113 1.00 0.00 H new ATOM 0 HB1 ALA A 81 22.029 -16.710 -3.349 1.00 0.00 H new ATOM 0 HB2 ALA A 81 21.175 -15.702 -4.541 1.00 0.00 H new ATOM 0 HB3 ALA A 81 20.444 -16.008 -2.948 1.00 0.00 H new ATOM 1361 N ARG A 82 19.205 -18.645 -2.402 1.00 0.00 N ATOM 1362 CA ARG A 82 18.983 -19.606 -1.327 1.00 0.00 C ATOM 1363 C ARG A 82 19.023 -21.035 -1.859 1.00 0.00 C ATOM 1364 O ARG A 82 19.960 -21.786 -1.584 1.00 0.00 O ATOM 1365 CB ARG A 82 17.639 -19.340 -0.648 1.00 0.00 C ATOM 1366 CG ARG A 82 17.483 -17.915 -0.141 1.00 0.00 C ATOM 1367 CD ARG A 82 18.587 -17.549 0.839 1.00 0.00 C ATOM 1368 NE ARG A 82 18.660 -18.487 1.956 1.00 0.00 N ATOM 1369 CZ ARG A 82 19.527 -18.372 2.956 1.00 0.00 C ATOM 1370 NH1 ARG A 82 20.390 -17.366 2.978 1.00 0.00 N ATOM 1371 NH2 ARG A 82 19.532 -19.266 3.937 1.00 0.00 N ATOM 0 H ARG A 82 18.501 -17.909 -2.463 1.00 0.00 H new ATOM 0 HA ARG A 82 19.782 -19.487 -0.595 1.00 0.00 H new ATOM 0 HB2 ARG A 82 16.836 -19.555 -1.353 1.00 0.00 H new ATOM 0 HB3 ARG A 82 17.522 -20.029 0.188 1.00 0.00 H new ATOM 0 HG2 ARG A 82 17.499 -17.224 -0.984 1.00 0.00 H new ATOM 0 HG3 ARG A 82 16.513 -17.804 0.344 1.00 0.00 H new ATOM 0 HD2 ARG A 82 19.544 -17.531 0.317 1.00 0.00 H new ATOM 0 HD3 ARG A 82 18.414 -16.543 1.221 1.00 0.00 H new ATOM 0 HE ARG A 82 18.010 -19.273 1.969 1.00 0.00 H new ATOM 0 HH11 ARG A 82 20.390 -16.677 2.226 1.00 0.00 H new ATOM 0 HH12 ARG A 82 21.054 -17.281 3.747 1.00 0.00 H new ATOM 0 HH21 ARG A 82 18.870 -20.042 3.923 1.00 0.00 H new ATOM 0 HH22 ARG A 82 20.198 -19.177 4.705 1.00 0.00 H new ATOM 1385 N LEU A 83 17.999 -21.406 -2.621 1.00 0.00 N ATOM 1386 CA LEU A 83 17.916 -22.746 -3.191 1.00 0.00 C ATOM 1387 C LEU A 83 19.080 -23.006 -4.143 1.00 0.00 C ATOM 1388 O LEU A 83 19.394 -24.154 -4.455 1.00 0.00 O ATOM 1389 CB LEU A 83 16.589 -22.926 -3.930 1.00 0.00 C ATOM 1390 CG LEU A 83 15.381 -23.282 -3.062 1.00 0.00 C ATOM 1391 CD1 LEU A 83 14.091 -22.849 -3.740 1.00 0.00 C ATOM 1392 CD2 LEU A 83 15.356 -24.775 -2.768 1.00 0.00 C ATOM 0 H LEU A 83 17.215 -20.798 -2.858 1.00 0.00 H new ATOM 0 HA LEU A 83 17.971 -23.465 -2.374 1.00 0.00 H new ATOM 0 HB2 LEU A 83 16.367 -22.004 -4.466 1.00 0.00 H new ATOM 0 HB3 LEU A 83 16.716 -23.708 -4.679 1.00 0.00 H new ATOM 0 HG LEU A 83 15.468 -22.748 -2.116 1.00 0.00 H new ATOM 0 HD11 LEU A 83 13.242 -23.110 -3.108 1.00 0.00 H new ATOM 0 HD12 LEU A 83 14.107 -21.771 -3.898 1.00 0.00 H new ATOM 0 HD13 LEU A 83 13.997 -23.355 -4.701 1.00 0.00 H new ATOM 0 HD21 LEU A 83 14.490 -25.010 -2.149 1.00 0.00 H new ATOM 0 HD22 LEU A 83 15.294 -25.329 -3.705 1.00 0.00 H new ATOM 0 HD23 LEU A 83 16.266 -25.057 -2.239 1.00 0.00 H new ATOM 1404 N ALA A 84 19.717 -21.932 -4.598 1.00 0.00 N ATOM 1405 CA ALA A 84 20.848 -22.044 -5.510 1.00 0.00 C ATOM 1406 C ALA A 84 22.131 -22.375 -4.755 1.00 0.00 C ATOM 1407 O ALA A 84 23.153 -22.703 -5.360 1.00 0.00 O ATOM 1408 CB ALA A 84 21.017 -20.756 -6.302 1.00 0.00 C ATOM 0 H ALA A 84 19.469 -20.974 -4.350 1.00 0.00 H new ATOM 0 HA ALA A 84 20.644 -22.860 -6.203 1.00 0.00 H new ATOM 0 HB1 ALA A 84 21.865 -20.854 -6.979 1.00 0.00 H new ATOM 0 HB2 ALA A 84 20.113 -20.562 -6.879 1.00 0.00 H new ATOM 0 HB3 ALA A 84 21.194 -19.928 -5.616 1.00 0.00 H new ATOM 1414 N LYS A 85 22.072 -22.288 -3.431 1.00 0.00 N ATOM 1415 CA LYS A 85 23.229 -22.579 -2.592 1.00 0.00 C ATOM 1416 C LYS A 85 24.354 -21.582 -2.851 1.00 0.00 C ATOM 1417 O LYS A 85 25.517 -21.856 -2.558 1.00 0.00 O ATOM 1418 CB LYS A 85 23.726 -24.003 -2.850 1.00 0.00 C ATOM 1419 CG LYS A 85 22.613 -25.035 -2.905 1.00 0.00 C ATOM 1420 CD LYS A 85 21.863 -25.118 -1.586 1.00 0.00 C ATOM 1421 CE LYS A 85 22.754 -25.637 -0.469 1.00 0.00 C ATOM 1422 NZ LYS A 85 23.295 -26.990 -0.775 1.00 0.00 N ATOM 0 H LYS A 85 21.235 -22.018 -2.915 1.00 0.00 H new ATOM 0 HA LYS A 85 22.922 -22.491 -1.550 1.00 0.00 H new ATOM 0 HB2 LYS A 85 24.275 -24.022 -3.792 1.00 0.00 H new ATOM 0 HB3 LYS A 85 24.430 -24.281 -2.065 1.00 0.00 H new ATOM 0 HG2 LYS A 85 21.918 -24.779 -3.704 1.00 0.00 H new ATOM 0 HG3 LYS A 85 23.033 -26.011 -3.148 1.00 0.00 H new ATOM 0 HD2 LYS A 85 21.482 -24.132 -1.320 1.00 0.00 H new ATOM 0 HD3 LYS A 85 20.999 -25.774 -1.698 1.00 0.00 H new ATOM 0 HE2 LYS A 85 23.579 -24.943 -0.311 1.00 0.00 H new ATOM 0 HE3 LYS A 85 22.186 -25.675 0.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 23.679 -27.415 0.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 22.533 -27.592 -1.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 24.051 -26.909 -1.485 1.00 0.00 H new ATOM 1436 N GLN A 86 23.998 -20.425 -3.401 1.00 0.00 N ATOM 1437 CA GLN A 86 24.979 -19.388 -3.698 1.00 0.00 C ATOM 1438 C GLN A 86 24.475 -18.019 -3.253 1.00 0.00 C ATOM 1439 O GLN A 86 23.352 -17.888 -2.768 1.00 0.00 O ATOM 1440 CB GLN A 86 25.292 -19.367 -5.195 1.00 0.00 C ATOM 1441 CG GLN A 86 25.226 -20.738 -5.849 1.00 0.00 C ATOM 1442 CD GLN A 86 26.237 -20.900 -6.967 1.00 0.00 C ATOM 1443 OE1 GLN A 86 27.395 -21.244 -6.728 1.00 0.00 O ATOM 1444 NE2 GLN A 86 25.804 -20.652 -8.198 1.00 0.00 N ATOM 0 H GLN A 86 23.039 -20.183 -3.650 1.00 0.00 H new ATOM 0 HA GLN A 86 25.891 -19.616 -3.146 1.00 0.00 H new ATOM 0 HB2 GLN A 86 24.589 -18.701 -5.695 1.00 0.00 H new ATOM 0 HB3 GLN A 86 26.288 -18.950 -5.344 1.00 0.00 H new ATOM 0 HG2 GLN A 86 25.399 -21.505 -5.094 1.00 0.00 H new ATOM 0 HG3 GLN A 86 24.223 -20.900 -6.245 1.00 0.00 H new ATOM 0 HE21 GLN A 86 24.836 -20.369 -8.351 1.00 0.00 H new ATOM 0 HE22 GLN A 86 26.440 -20.744 -8.990 1.00 0.00 H new ATOM 1453 N ASN A 87 25.314 -17.002 -3.421 1.00 0.00 N ATOM 1454 CA ASN A 87 24.953 -15.642 -3.036 1.00 0.00 C ATOM 1455 C ASN A 87 24.011 -15.018 -4.061 1.00 0.00 C ATOM 1456 O ASN A 87 23.957 -15.427 -5.221 1.00 0.00 O ATOM 1457 CB ASN A 87 26.210 -14.781 -2.890 1.00 0.00 C ATOM 1458 CG ASN A 87 26.458 -14.359 -1.455 1.00 0.00 C ATOM 1459 OD1 ASN A 87 26.395 -15.176 -0.536 1.00 0.00 O ATOM 1460 ND2 ASN A 87 26.741 -13.077 -1.256 1.00 0.00 N ATOM 0 H ASN A 87 26.248 -17.094 -3.821 1.00 0.00 H new ATOM 0 HA ASN A 87 24.438 -15.687 -2.076 1.00 0.00 H new ATOM 0 HB2 ASN A 87 27.073 -15.337 -3.257 1.00 0.00 H new ATOM 0 HB3 ASN A 87 26.114 -13.893 -3.515 1.00 0.00 H new ATOM 0 HD21 ASN A 87 26.917 -12.734 -0.312 1.00 0.00 H new ATOM 0 HD22 ASN A 87 26.783 -12.435 -2.048 1.00 0.00 H new ATOM 1467 N PRO A 88 23.251 -14.003 -3.625 1.00 0.00 N ATOM 1468 CA PRO A 88 22.298 -13.299 -4.489 1.00 0.00 C ATOM 1469 C PRO A 88 22.993 -12.452 -5.549 1.00 0.00 C ATOM 1470 O PRO A 88 22.391 -12.089 -6.559 1.00 0.00 O ATOM 1471 CB PRO A 88 21.527 -12.407 -3.513 1.00 0.00 C ATOM 1472 CG PRO A 88 22.461 -12.197 -2.372 1.00 0.00 C ATOM 1473 CD PRO A 88 23.264 -13.463 -2.255 1.00 0.00 C ATOM 0 HA PRO A 88 21.666 -13.990 -5.047 1.00 0.00 H new ATOM 0 HB2 PRO A 88 21.250 -11.460 -3.977 1.00 0.00 H new ATOM 0 HB3 PRO A 88 20.603 -12.884 -3.186 1.00 0.00 H new ATOM 0 HG2 PRO A 88 23.109 -11.339 -2.551 1.00 0.00 H new ATOM 0 HG3 PRO A 88 21.913 -11.996 -1.451 1.00 0.00 H new ATOM 0 HD2 PRO A 88 24.279 -13.265 -1.911 1.00 0.00 H new ATOM 0 HD3 PRO A 88 22.817 -14.158 -1.545 1.00 0.00 H new ATOM 1481 N ALA A 89 24.263 -12.141 -5.312 1.00 0.00 N ATOM 1482 CA ALA A 89 25.041 -11.339 -6.249 1.00 0.00 C ATOM 1483 C ALA A 89 25.818 -12.224 -7.217 1.00 0.00 C ATOM 1484 O ALA A 89 25.796 -12.003 -8.427 1.00 0.00 O ATOM 1485 CB ALA A 89 25.989 -10.418 -5.495 1.00 0.00 C ATOM 0 H ALA A 89 24.775 -12.432 -4.479 1.00 0.00 H new ATOM 0 HA ALA A 89 24.348 -10.731 -6.831 1.00 0.00 H new ATOM 0 HB1 ALA A 89 26.563 -9.825 -6.207 1.00 0.00 H new ATOM 0 HB2 ALA A 89 25.414 -9.753 -4.850 1.00 0.00 H new ATOM 0 HB3 ALA A 89 26.669 -11.015 -4.887 1.00 0.00 H new ATOM 1491 N GLN A 90 26.505 -13.225 -6.675 1.00 0.00 N ATOM 1492 CA GLN A 90 27.290 -14.142 -7.491 1.00 0.00 C ATOM 1493 C GLN A 90 26.390 -15.154 -8.193 1.00 0.00 C ATOM 1494 O GLN A 90 26.834 -15.888 -9.076 1.00 0.00 O ATOM 1495 CB GLN A 90 28.322 -14.871 -6.629 1.00 0.00 C ATOM 1496 CG GLN A 90 27.729 -15.987 -5.784 1.00 0.00 C ATOM 1497 CD GLN A 90 28.721 -16.558 -4.790 1.00 0.00 C ATOM 1498 OE1 GLN A 90 29.364 -15.683 -4.026 1.00 0.00 O flip ATOM 1499 NE2 GLN A 90 28.909 -17.772 -4.711 1.00 0.00 N flip ATOM 0 H GLN A 90 26.533 -13.421 -5.674 1.00 0.00 H new ATOM 0 HA GLN A 90 27.810 -13.558 -8.250 1.00 0.00 H new ATOM 0 HB2 GLN A 90 29.094 -15.287 -7.276 1.00 0.00 H new ATOM 0 HB3 GLN A 90 28.810 -14.150 -5.973 1.00 0.00 H new ATOM 0 HG2 GLN A 90 26.860 -15.608 -5.247 1.00 0.00 H new ATOM 0 HG3 GLN A 90 27.376 -16.784 -6.438 1.00 0.00 H new ATOM 0 HE21 GLN A 90 28.393 -18.409 -5.318 1.00 0.00 H new ATOM 0 HE22 GLN A 90 29.581 -18.141 -4.038 1.00 0.00 H new ATOM 1508 N TYR A 91 25.124 -15.189 -7.793 1.00 0.00 N ATOM 1509 CA TYR A 91 24.162 -16.113 -8.381 1.00 0.00 C ATOM 1510 C TYR A 91 24.276 -16.123 -9.902 1.00 0.00 C ATOM 1511 O TYR A 91 24.544 -17.160 -10.510 1.00 0.00 O ATOM 1512 CB TYR A 91 22.739 -15.732 -7.968 1.00 0.00 C ATOM 1513 CG TYR A 91 21.667 -16.438 -8.767 1.00 0.00 C ATOM 1514 CD1 TYR A 91 21.768 -17.793 -9.057 1.00 0.00 C ATOM 1515 CD2 TYR A 91 20.554 -15.749 -9.233 1.00 0.00 C ATOM 1516 CE1 TYR A 91 20.791 -18.442 -9.788 1.00 0.00 C ATOM 1517 CE2 TYR A 91 19.572 -16.390 -9.963 1.00 0.00 C ATOM 1518 CZ TYR A 91 19.695 -17.736 -10.238 1.00 0.00 C ATOM 1519 OH TYR A 91 18.720 -18.378 -10.967 1.00 0.00 O ATOM 0 H TYR A 91 24.740 -14.588 -7.064 1.00 0.00 H new ATOM 0 HA TYR A 91 24.385 -17.114 -8.011 1.00 0.00 H new ATOM 0 HB2 TYR A 91 22.603 -15.961 -6.911 1.00 0.00 H new ATOM 0 HB3 TYR A 91 22.613 -14.655 -8.079 1.00 0.00 H new ATOM 0 HD1 TYR A 91 22.625 -18.349 -8.705 1.00 0.00 H new ATOM 0 HD2 TYR A 91 20.455 -14.695 -9.021 1.00 0.00 H new ATOM 0 HE1 TYR A 91 20.885 -19.496 -10.006 1.00 0.00 H new ATOM 0 HE2 TYR A 91 18.712 -15.840 -10.317 1.00 0.00 H new ATOM 0 HH TYR A 91 18.017 -17.739 -11.206 1.00 0.00 H new ATOM 1529 N LEU A 92 24.071 -14.961 -10.512 1.00 0.00 N ATOM 1530 CA LEU A 92 24.151 -14.833 -11.963 1.00 0.00 C ATOM 1531 C LEU A 92 25.560 -14.444 -12.399 1.00 0.00 C ATOM 1532 O LEU A 92 26.104 -15.006 -13.349 1.00 0.00 O ATOM 1533 CB LEU A 92 23.146 -13.793 -12.460 1.00 0.00 C ATOM 1534 CG LEU A 92 22.663 -13.961 -13.901 1.00 0.00 C ATOM 1535 CD1 LEU A 92 23.822 -13.810 -14.874 1.00 0.00 C ATOM 1536 CD2 LEU A 92 21.984 -15.311 -14.082 1.00 0.00 C ATOM 0 H LEU A 92 23.848 -14.093 -10.024 1.00 0.00 H new ATOM 0 HA LEU A 92 23.909 -15.801 -12.402 1.00 0.00 H new ATOM 0 HB2 LEU A 92 22.277 -13.813 -11.802 1.00 0.00 H new ATOM 0 HB3 LEU A 92 23.597 -12.806 -12.362 1.00 0.00 H new ATOM 0 HG LEU A 92 21.934 -13.179 -14.113 1.00 0.00 H new ATOM 0 HD11 LEU A 92 23.459 -13.933 -15.894 1.00 0.00 H new ATOM 0 HD12 LEU A 92 24.264 -12.820 -14.763 1.00 0.00 H new ATOM 0 HD13 LEU A 92 24.575 -14.569 -14.663 1.00 0.00 H new ATOM 0 HD21 LEU A 92 21.647 -15.413 -15.113 1.00 0.00 H new ATOM 0 HD22 LEU A 92 22.691 -16.108 -13.851 1.00 0.00 H new ATOM 0 HD23 LEU A 92 21.127 -15.380 -13.412 1.00 0.00 H new ATOM 1548 N ALA A 93 26.146 -13.481 -11.696 1.00 0.00 N ATOM 1549 CA ALA A 93 27.494 -13.019 -12.007 1.00 0.00 C ATOM 1550 C ALA A 93 28.468 -14.189 -12.093 1.00 0.00 C ATOM 1551 O ALA A 93 29.038 -14.457 -13.151 1.00 0.00 O ATOM 1552 CB ALA A 93 27.962 -12.016 -10.963 1.00 0.00 C ATOM 0 H ALA A 93 25.709 -13.005 -10.907 1.00 0.00 H new ATOM 0 HA ALA A 93 27.468 -12.529 -12.980 1.00 0.00 H new ATOM 0 HB1 ALA A 93 28.970 -11.680 -11.208 1.00 0.00 H new ATOM 0 HB2 ALA A 93 27.287 -11.161 -10.952 1.00 0.00 H new ATOM 0 HB3 ALA A 93 27.966 -12.488 -9.981 1.00 0.00 H new ATOM 1558 N GLN A 94 28.654 -14.882 -10.974 1.00 0.00 N ATOM 1559 CA GLN A 94 29.561 -16.022 -10.925 1.00 0.00 C ATOM 1560 C GLN A 94 30.940 -15.645 -11.455 1.00 0.00 C ATOM 1561 O GLN A 94 31.661 -16.485 -11.995 1.00 0.00 O ATOM 1562 CB GLN A 94 28.992 -17.189 -11.734 1.00 0.00 C ATOM 1563 CG GLN A 94 27.622 -17.647 -11.261 1.00 0.00 C ATOM 1564 CD GLN A 94 27.189 -18.951 -11.901 1.00 0.00 C ATOM 1565 OE1 GLN A 94 26.190 -19.002 -12.618 1.00 0.00 O ATOM 1566 NE2 GLN A 94 27.942 -20.015 -11.644 1.00 0.00 N ATOM 0 H GLN A 94 28.189 -14.674 -10.090 1.00 0.00 H new ATOM 0 HA GLN A 94 29.664 -16.327 -9.884 1.00 0.00 H new ATOM 0 HB2 GLN A 94 28.926 -16.896 -12.782 1.00 0.00 H new ATOM 0 HB3 GLN A 94 29.685 -18.029 -11.681 1.00 0.00 H new ATOM 0 HG2 GLN A 94 27.637 -17.766 -10.178 1.00 0.00 H new ATOM 0 HG3 GLN A 94 26.887 -16.874 -11.487 1.00 0.00 H new ATOM 0 HE21 GLN A 94 28.762 -19.927 -11.044 1.00 0.00 H new ATOM 0 HE22 GLN A 94 27.700 -20.920 -12.047 1.00 0.00 H new ATOM 1575 N HIS A 95 31.302 -14.375 -11.300 1.00 0.00 N ATOM 1576 CA HIS A 95 32.595 -13.886 -11.763 1.00 0.00 C ATOM 1577 C HIS A 95 32.965 -12.582 -11.063 1.00 0.00 C ATOM 1578 O HIS A 95 32.103 -11.890 -10.523 1.00 0.00 O ATOM 1579 CB HIS A 95 32.572 -13.677 -13.278 1.00 0.00 C ATOM 1580 CG HIS A 95 32.940 -14.902 -14.057 1.00 0.00 C ATOM 1581 ND1 HIS A 95 33.987 -15.729 -13.709 1.00 0.00 N ATOM 1582 CD2 HIS A 95 32.392 -15.439 -15.172 1.00 0.00 C ATOM 1583 CE1 HIS A 95 34.068 -16.721 -14.578 1.00 0.00 C ATOM 1584 NE2 HIS A 95 33.111 -16.569 -15.475 1.00 0.00 N ATOM 0 H HIS A 95 30.717 -13.666 -10.857 1.00 0.00 H new ATOM 0 HA HIS A 95 33.348 -14.635 -11.519 1.00 0.00 H new ATOM 0 HB2 HIS A 95 31.575 -13.352 -13.577 1.00 0.00 H new ATOM 0 HB3 HIS A 95 33.260 -12.872 -13.536 1.00 0.00 H new ATOM 0 HD2 HIS A 95 31.547 -15.051 -15.721 1.00 0.00 H new ATOM 0 HE1 HIS A 95 34.794 -17.521 -14.558 1.00 0.00 H new ATOM 0 HE2 HIS A 95 32.934 -17.190 -16.265 1.00 0.00 H new ATOM 1592 N GLU A 96 34.253 -12.253 -11.078 1.00 0.00 N ATOM 1593 CA GLU A 96 34.737 -11.032 -10.442 1.00 0.00 C ATOM 1594 C GLU A 96 34.728 -9.866 -11.427 1.00 0.00 C ATOM 1595 O GLU A 96 34.665 -8.704 -11.027 1.00 0.00 O ATOM 1596 CB GLU A 96 36.150 -11.241 -9.895 1.00 0.00 C ATOM 1597 CG GLU A 96 37.221 -11.275 -10.972 1.00 0.00 C ATOM 1598 CD GLU A 96 38.450 -12.056 -10.549 1.00 0.00 C ATOM 1599 OE1 GLU A 96 38.311 -12.974 -9.714 1.00 0.00 O ATOM 1600 OE2 GLU A 96 39.551 -11.748 -11.053 1.00 0.00 O ATOM 0 H GLU A 96 34.980 -12.814 -11.523 1.00 0.00 H new ATOM 0 HA GLU A 96 34.068 -10.793 -9.616 1.00 0.00 H new ATOM 0 HB2 GLU A 96 36.380 -10.441 -9.191 1.00 0.00 H new ATOM 0 HB3 GLU A 96 36.179 -12.176 -9.336 1.00 0.00 H new ATOM 0 HG2 GLU A 96 36.807 -11.719 -11.877 1.00 0.00 H new ATOM 0 HG3 GLU A 96 37.512 -10.255 -11.222 1.00 0.00 H new ATOM 1607 N GLN A 97 34.791 -10.187 -12.715 1.00 0.00 N ATOM 1608 CA GLN A 97 34.792 -9.167 -13.757 1.00 0.00 C ATOM 1609 C GLN A 97 33.627 -8.200 -13.573 1.00 0.00 C ATOM 1610 O GLN A 97 33.826 -7.000 -13.379 1.00 0.00 O ATOM 1611 CB GLN A 97 34.716 -9.818 -15.139 1.00 0.00 C ATOM 1612 CG GLN A 97 36.077 -10.124 -15.743 1.00 0.00 C ATOM 1613 CD GLN A 97 35.985 -10.577 -17.187 1.00 0.00 C ATOM 1614 OE1 GLN A 97 34.915 -10.542 -17.794 1.00 0.00 O ATOM 1615 NE2 GLN A 97 37.111 -11.007 -17.745 1.00 0.00 N ATOM 0 H GLN A 97 34.842 -11.145 -13.062 1.00 0.00 H new ATOM 0 HA GLN A 97 35.723 -8.605 -13.679 1.00 0.00 H new ATOM 0 HB2 GLN A 97 34.144 -10.743 -15.065 1.00 0.00 H new ATOM 0 HB3 GLN A 97 34.169 -9.158 -15.813 1.00 0.00 H new ATOM 0 HG2 GLN A 97 36.705 -9.235 -15.684 1.00 0.00 H new ATOM 0 HG3 GLN A 97 36.566 -10.899 -15.153 1.00 0.00 H new ATOM 0 HE21 GLN A 97 37.976 -11.019 -17.204 1.00 0.00 H new ATOM 0 HE22 GLN A 97 37.111 -11.325 -18.714 1.00 0.00 H new ATOM 1624 N LEU A 98 32.410 -8.729 -13.634 1.00 0.00 N ATOM 1625 CA LEU A 98 31.211 -7.913 -13.474 1.00 0.00 C ATOM 1626 C LEU A 98 31.263 -7.119 -12.173 1.00 0.00 C ATOM 1627 O LEU A 98 30.669 -6.045 -12.065 1.00 0.00 O ATOM 1628 CB LEU A 98 29.962 -8.796 -13.497 1.00 0.00 C ATOM 1629 CG LEU A 98 29.291 -8.975 -14.859 1.00 0.00 C ATOM 1630 CD1 LEU A 98 30.299 -9.458 -15.891 1.00 0.00 C ATOM 1631 CD2 LEU A 98 28.124 -9.946 -14.755 1.00 0.00 C ATOM 0 H LEU A 98 32.227 -9.720 -13.793 1.00 0.00 H new ATOM 0 HA LEU A 98 31.166 -7.210 -14.306 1.00 0.00 H new ATOM 0 HB2 LEU A 98 30.231 -9.781 -13.115 1.00 0.00 H new ATOM 0 HB3 LEU A 98 29.231 -8.375 -12.807 1.00 0.00 H new ATOM 0 HG LEU A 98 28.905 -8.008 -15.183 1.00 0.00 H new ATOM 0 HD11 LEU A 98 29.804 -9.580 -16.854 1.00 0.00 H new ATOM 0 HD12 LEU A 98 31.102 -8.727 -15.986 1.00 0.00 H new ATOM 0 HD13 LEU A 98 30.715 -10.414 -15.573 1.00 0.00 H new ATOM 0 HD21 LEU A 98 27.658 -10.061 -15.734 1.00 0.00 H new ATOM 0 HD22 LEU A 98 28.486 -10.914 -14.409 1.00 0.00 H new ATOM 0 HD23 LEU A 98 27.391 -9.559 -14.048 1.00 0.00 H new ATOM 1643 N LEU A 99 31.978 -7.652 -11.189 1.00 0.00 N ATOM 1644 CA LEU A 99 32.111 -6.991 -9.895 1.00 0.00 C ATOM 1645 C LEU A 99 32.849 -5.664 -10.034 1.00 0.00 C ATOM 1646 O LEU A 99 32.300 -4.602 -9.738 1.00 0.00 O ATOM 1647 CB LEU A 99 32.850 -7.899 -8.910 1.00 0.00 C ATOM 1648 CG LEU A 99 32.547 -7.670 -7.429 1.00 0.00 C ATOM 1649 CD1 LEU A 99 32.988 -6.279 -7.002 1.00 0.00 C ATOM 1650 CD2 LEU A 99 31.064 -7.870 -7.151 1.00 0.00 C ATOM 0 H LEU A 99 32.475 -8.540 -11.262 1.00 0.00 H new ATOM 0 HA LEU A 99 31.110 -6.790 -9.513 1.00 0.00 H new ATOM 0 HB2 LEU A 99 32.612 -8.935 -9.153 1.00 0.00 H new ATOM 0 HB3 LEU A 99 33.922 -7.773 -9.065 1.00 0.00 H new ATOM 0 HG LEU A 99 33.108 -8.401 -6.846 1.00 0.00 H new ATOM 0 HD11 LEU A 99 32.764 -6.135 -5.945 1.00 0.00 H new ATOM 0 HD12 LEU A 99 34.061 -6.172 -7.164 1.00 0.00 H new ATOM 0 HD13 LEU A 99 32.456 -5.532 -7.591 1.00 0.00 H new ATOM 0 HD21 LEU A 99 30.867 -7.703 -6.092 1.00 0.00 H new ATOM 0 HD22 LEU A 99 30.484 -7.163 -7.744 1.00 0.00 H new ATOM 0 HD23 LEU A 99 30.778 -8.887 -7.417 1.00 0.00 H new ATOM 1662 N LEU A 100 34.096 -5.732 -10.488 1.00 0.00 N ATOM 1663 CA LEU A 100 34.910 -4.535 -10.669 1.00 0.00 C ATOM 1664 C LEU A 100 34.169 -3.493 -11.501 1.00 0.00 C ATOM 1665 O LEU A 100 33.742 -2.460 -10.984 1.00 0.00 O ATOM 1666 CB LEU A 100 36.236 -4.893 -11.342 1.00 0.00 C ATOM 1667 CG LEU A 100 37.158 -5.825 -10.555 1.00 0.00 C ATOM 1668 CD1 LEU A 100 38.476 -6.015 -11.289 1.00 0.00 C ATOM 1669 CD2 LEU A 100 37.399 -5.279 -9.155 1.00 0.00 C ATOM 0 H LEU A 100 34.565 -6.603 -10.737 1.00 0.00 H new ATOM 0 HA LEU A 100 35.112 -4.111 -9.685 1.00 0.00 H new ATOM 0 HB2 LEU A 100 36.019 -5.357 -12.304 1.00 0.00 H new ATOM 0 HB3 LEU A 100 36.777 -3.969 -11.549 1.00 0.00 H new ATOM 0 HG LEU A 100 36.672 -6.796 -10.466 1.00 0.00 H new ATOM 0 HD11 LEU A 100 39.120 -6.681 -10.714 1.00 0.00 H new ATOM 0 HD12 LEU A 100 38.287 -6.450 -12.270 1.00 0.00 H new ATOM 0 HD13 LEU A 100 38.968 -5.050 -11.409 1.00 0.00 H new ATOM 0 HD21 LEU A 100 38.057 -5.955 -8.609 1.00 0.00 H new ATOM 0 HD22 LEU A 100 37.864 -4.296 -9.223 1.00 0.00 H new ATOM 0 HD23 LEU A 100 36.448 -5.195 -8.629 1.00 0.00 H new ATOM 1681 N ASP A 101 34.019 -3.772 -12.791 1.00 0.00 N ATOM 1682 CA ASP A 101 33.326 -2.860 -13.694 1.00 0.00 C ATOM 1683 C ASP A 101 33.900 -1.451 -13.589 1.00 0.00 C ATOM 1684 O ASP A 101 33.159 -0.478 -13.447 1.00 0.00 O ATOM 1685 CB ASP A 101 31.829 -2.840 -13.384 1.00 0.00 C ATOM 1686 CG ASP A 101 31.020 -2.169 -14.477 1.00 0.00 C ATOM 1687 OD1 ASP A 101 30.882 -2.768 -15.564 1.00 0.00 O ATOM 1688 OD2 ASP A 101 30.524 -1.047 -14.244 1.00 0.00 O ATOM 0 H ASP A 101 34.368 -4.622 -13.235 1.00 0.00 H new ATOM 0 HA ASP A 101 33.472 -3.217 -14.714 1.00 0.00 H new ATOM 0 HB2 ASP A 101 31.475 -3.862 -13.250 1.00 0.00 H new ATOM 0 HB3 ASP A 101 31.663 -2.319 -12.441 1.00 0.00 H new ATOM 1693 N ALA A 102 35.223 -1.349 -13.658 1.00 0.00 N ATOM 1694 CA ALA A 102 35.896 -0.059 -13.571 1.00 0.00 C ATOM 1695 C ALA A 102 36.652 0.254 -14.857 1.00 0.00 C ATOM 1696 O ALA A 102 36.676 -0.553 -15.786 1.00 0.00 O ATOM 1697 CB ALA A 102 36.843 -0.036 -12.380 1.00 0.00 C ATOM 0 H ALA A 102 35.850 -2.145 -13.774 1.00 0.00 H new ATOM 0 HA ALA A 102 35.136 0.710 -13.431 1.00 0.00 H new ATOM 0 HB1 ALA A 102 37.338 0.933 -12.328 1.00 0.00 H new ATOM 0 HB2 ALA A 102 36.278 -0.205 -11.463 1.00 0.00 H new ATOM 0 HB3 ALA A 102 37.591 -0.820 -12.495 1.00 0.00 H new ATOM 1703 N SER A 103 37.270 1.430 -14.904 1.00 0.00 N ATOM 1704 CA SER A 103 38.024 1.851 -16.079 1.00 0.00 C ATOM 1705 C SER A 103 39.108 2.854 -15.698 1.00 0.00 C ATOM 1706 O SER A 103 38.876 3.760 -14.899 1.00 0.00 O ATOM 1707 CB SER A 103 37.086 2.467 -17.120 1.00 0.00 C ATOM 1708 OG SER A 103 37.798 2.853 -18.282 1.00 0.00 O ATOM 0 H SER A 103 37.263 2.108 -14.142 1.00 0.00 H new ATOM 0 HA SER A 103 38.502 0.970 -16.508 1.00 0.00 H new ATOM 0 HB2 SER A 103 36.311 1.748 -17.386 1.00 0.00 H new ATOM 0 HB3 SER A 103 36.583 3.335 -16.693 1.00 0.00 H new ATOM 0 HG SER A 103 37.177 3.242 -18.932 1.00 0.00 H new TER 1714 SER A 103