USER MOD reduce.3.24.130724 H: found=0, std=0, add=1077, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1061 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 73 CYS SG : rot 180:sc= -0.0714 USER MOD Set 1.2: A 91 HIS : no HD1:sc= 0.00867 K(o=0.2,f=-8.5!) USER MOD Set 1.3: A 116 THR OG1 : rot 100:sc= 0.259 USER MOD Set 2.1: A 54 SER OG : rot 169:sc= 0.796 USER MOD Set 2.2: A 105 HIS : no HD1:sc= -0.393 K(o=0.39,f=-5.7!) USER MOD Set 2.3: A 131 MET CE :methyl -156:sc= -0.0167 (180deg=-0.356) USER MOD Set 3.1: A 82 HIS : no HE2:sc= -0.458 K(o=0.83,f=-6.2!) USER MOD Set 3.2: A 88 SER OG : rot -153:sc= 1.28 USER MOD Set 4.1: A 55 GLN : amide:sc= -0.0195 K(o=-0.019,f=-0.84) USER MOD Set 4.2: A 100 GLN : amide:sc= 0 K(o=-0.019,f=-1.4) USER MOD Set 5.1: A 46 HIS : no HD1:sc= -0.29 K(o=0.49,f=-1.9) USER MOD Set 5.2: A 58 CYS SG : rot 91:sc= 0.777 USER MOD Set 6.1: A 9 MET CE :methyl 177:sc= -0.866 (180deg=-0.893) USER MOD Set 6.2: A 137 MET CE :methyl -172:sc= 0 (180deg=-0.115) USER MOD Single : A 1 MET CE :methyl 164:sc= -0.0403 (180deg=-0.368) USER MOD Single : A 1 MET N :NH3+ -110:sc= 0.738 (180deg=-0.0549) USER MOD Single : A 3 LYS NZ :NH3+ -176:sc= 1.76 (180deg=1.73) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 TYR OH : rot 165:sc= -0.0326 USER MOD Single : A 11 ASN : amide:sc= 0.776 K(o=0.78,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 ASN : amide:sc= -0.0349 K(o=-0.035,f=-1.5!) USER MOD Single : A 27 THR OG1 : rot 72:sc= 0.861 USER MOD Single : A 30 ASN : amide:sc= -0.0703 K(o=-0.07,f=-1.8!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 ASN : amide:sc= -0.0689 K(o=-0.069,f=-1.6!) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= -0.976 K(o=-0.98,f=-5.4!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= 0.216 K(o=0.22,f=-9.6!) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 TYR OH : rot 164:sc= 0.79 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc=-0.00192 X(o=-0.0019,f=-0.18) USER MOD Single : A 78 ASN : amide:sc= -0.0395 K(o=-0.039,f=-1.5!) USER MOD Single : A 80 HIS : no HD1:sc= 0.33 K(o=0.33,f=-7.4!) USER MOD Single : A 84 THR OG1 : rot -71:sc= -0.175 USER MOD Single : A 87 MET CE :methyl 157:sc= -0.0254 (180deg=-0.319) USER MOD Single : A 89 MET CE :methyl -176:sc= -0.352 (180deg=-0.398) USER MOD Single : A 96 THR OG1 : rot -58:sc= 1.06 USER MOD Single : A 98 SER OG : rot 180:sc= 0.226 USER MOD Single : A 99 CYS SG : rot 97:sc= 0.508 USER MOD Single : A 108 GLN : amide:sc= 0.381 K(o=0.38,f=-5.9!) USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 115 HIS : no HD1:sc= -0.232 K(o=-0.23,f=-3.2!) USER MOD Single : A 120 GLN : amide:sc= -1.68! K(o=-1.7!,f=-0.015) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl 164:sc= -0.106 (180deg=-0.405) USER MOD Single : A 130 THR OG1 : rot -62:sc= 0.427 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN : amide:sc= -0.841 K(o=-0.84,f=-6.5!) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -7.309 3.240 -15.171 1.00 0.00 N ATOM 2 CA MET A 1 -6.379 4.060 -14.403 1.00 0.00 C ATOM 3 C MET A 1 -6.039 3.403 -13.071 1.00 0.00 C ATOM 4 O MET A 1 -6.114 4.038 -12.019 1.00 0.00 O ATOM 5 CB MET A 1 -6.963 5.452 -14.177 1.00 0.00 C ATOM 6 CG MET A 1 -7.038 6.314 -15.431 1.00 0.00 C ATOM 7 SD MET A 1 -7.769 7.933 -15.118 1.00 0.00 S ATOM 8 CE MET A 1 -6.508 8.683 -14.093 1.00 0.00 C ATOM 0 H1 MET A 1 -6.818 2.838 -15.995 1.00 0.00 H new ATOM 0 H2 MET A 1 -7.668 2.469 -14.572 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.104 3.827 -15.494 1.00 0.00 H new ATOM 0 HA MET A 1 -5.457 4.154 -14.976 1.00 0.00 H new ATOM 0 HB2 MET A 1 -7.965 5.349 -13.761 1.00 0.00 H new ATOM 0 HB3 MET A 1 -6.360 5.969 -13.431 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.035 6.445 -15.838 1.00 0.00 H new ATOM 0 HG3 MET A 1 -7.624 5.795 -16.189 1.00 0.00 H new ATOM 0 HE1 MET A 1 -6.667 9.761 -14.051 1.00 0.00 H new ATOM 0 HE2 MET A 1 -6.563 8.268 -13.086 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.525 8.477 -14.517 1.00 0.00 H new ATOM 18 N ALA A 2 -5.663 2.129 -13.123 1.00 0.00 N ATOM 19 CA ALA A 2 -5.258 1.401 -11.927 1.00 0.00 C ATOM 20 C ALA A 2 -3.845 1.781 -11.503 1.00 0.00 C ATOM 21 O ALA A 2 -3.099 2.390 -12.270 1.00 0.00 O ATOM 22 CB ALA A 2 -5.354 -0.100 -12.163 1.00 0.00 C ATOM 0 H ALA A 2 -5.631 1.580 -13.982 1.00 0.00 H new ATOM 0 HA ALA A 2 -5.937 1.675 -11.120 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -5.048 -0.630 -11.261 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -6.382 -0.365 -12.409 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -4.700 -0.381 -12.988 1.00 0.00 H new ATOM 28 N LYS A 3 -3.482 1.418 -10.277 1.00 0.00 N ATOM 29 CA LYS A 3 -2.140 1.670 -9.769 1.00 0.00 C ATOM 30 C LYS A 3 -1.629 0.489 -8.952 1.00 0.00 C ATOM 31 O LYS A 3 -2.407 -0.213 -8.306 1.00 0.00 O ATOM 32 CB LYS A 3 -2.117 2.943 -8.923 1.00 0.00 C ATOM 33 CG LYS A 3 -2.408 4.220 -9.701 1.00 0.00 C ATOM 34 CD LYS A 3 -2.387 5.439 -8.790 1.00 0.00 C ATOM 35 CE LYS A 3 -2.797 6.698 -9.540 1.00 0.00 C ATOM 36 NZ LYS A 3 -1.712 7.194 -10.429 1.00 0.00 N ATOM 0 H LYS A 3 -4.101 0.947 -9.616 1.00 0.00 H new ATOM 0 HA LYS A 3 -1.480 1.803 -10.626 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -2.849 2.845 -8.121 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -1.138 3.034 -8.452 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -1.669 4.342 -10.493 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -3.382 4.141 -10.183 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -3.061 5.279 -7.949 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -1.387 5.569 -8.376 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -3.687 6.493 -10.134 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -3.064 7.476 -8.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -2.006 8.089 -10.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.849 7.350 -9.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -1.521 6.490 -11.170 1.00 0.00 H new ATOM 50 N LYS A 4 -0.318 0.275 -8.986 1.00 0.00 N ATOM 51 CA LYS A 4 0.316 -0.731 -8.141 1.00 0.00 C ATOM 52 C LYS A 4 1.516 -0.152 -7.404 1.00 0.00 C ATOM 53 O LYS A 4 1.937 0.974 -7.669 1.00 0.00 O ATOM 54 CB LYS A 4 0.743 -1.939 -8.977 1.00 0.00 C ATOM 55 CG LYS A 4 -0.406 -2.669 -9.660 1.00 0.00 C ATOM 56 CD LYS A 4 0.082 -3.920 -10.373 1.00 0.00 C ATOM 57 CE LYS A 4 -1.067 -4.659 -11.046 1.00 0.00 C ATOM 58 NZ LYS A 4 -0.632 -5.963 -11.615 1.00 0.00 N ATOM 0 H LYS A 4 0.327 0.785 -9.590 1.00 0.00 H new ATOM 0 HA LYS A 4 -0.415 -1.055 -7.400 1.00 0.00 H new ATOM 0 HB2 LYS A 4 1.450 -1.608 -9.737 1.00 0.00 H new ATOM 0 HB3 LYS A 4 1.273 -2.642 -8.334 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -1.159 -2.940 -8.920 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -0.888 -2.004 -10.376 1.00 0.00 H new ATOM 0 HD2 LYS A 4 0.828 -3.648 -11.119 1.00 0.00 H new ATOM 0 HD3 LYS A 4 0.572 -4.580 -9.658 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -1.864 -4.827 -10.322 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -1.483 -4.038 -11.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -1.443 -6.434 -12.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 0.111 -5.802 -12.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -0.259 -6.566 -10.855 1.00 0.00 H new ATOM 72 N GLY A 5 2.065 -0.930 -6.477 1.00 0.00 N ATOM 73 CA GLY A 5 3.225 -0.501 -5.704 1.00 0.00 C ATOM 74 C GLY A 5 4.084 -1.690 -5.294 1.00 0.00 C ATOM 75 O GLY A 5 3.615 -2.827 -5.268 1.00 0.00 O ATOM 0 H GLY A 5 1.725 -1.862 -6.242 1.00 0.00 H new ATOM 0 HA2 GLY A 5 3.821 0.195 -6.294 1.00 0.00 H new ATOM 0 HA3 GLY A 5 2.894 0.036 -4.815 1.00 0.00 H new ATOM 79 N TYR A 6 5.345 -1.420 -4.974 1.00 0.00 N ATOM 80 CA TYR A 6 6.254 -2.456 -4.500 1.00 0.00 C ATOM 81 C TYR A 6 7.225 -1.905 -3.464 1.00 0.00 C ATOM 82 O TYR A 6 7.876 -0.884 -3.689 1.00 0.00 O ATOM 83 CB TYR A 6 7.021 -3.072 -5.672 1.00 0.00 C ATOM 84 CG TYR A 6 8.091 -4.056 -5.251 1.00 0.00 C ATOM 85 CD1 TYR A 6 7.733 -5.316 -4.795 1.00 0.00 C ATOM 86 CD2 TYR A 6 9.429 -3.698 -5.322 1.00 0.00 C ATOM 87 CE1 TYR A 6 8.710 -6.215 -4.411 1.00 0.00 C ATOM 88 CE2 TYR A 6 10.406 -4.597 -4.938 1.00 0.00 C ATOM 89 CZ TYR A 6 10.050 -5.850 -4.484 1.00 0.00 C ATOM 90 OH TYR A 6 11.023 -6.745 -4.102 1.00 0.00 O ATOM 0 H TYR A 6 5.761 -0.491 -5.035 1.00 0.00 H new ATOM 0 HA TYR A 6 5.657 -3.233 -4.023 1.00 0.00 H new ATOM 0 HB2 TYR A 6 6.315 -3.577 -6.331 1.00 0.00 H new ATOM 0 HB3 TYR A 6 7.483 -2.273 -6.252 1.00 0.00 H new ATOM 0 HD1 TYR A 6 6.691 -5.595 -4.740 1.00 0.00 H new ATOM 0 HD2 TYR A 6 9.707 -2.717 -5.677 1.00 0.00 H new ATOM 0 HE1 TYR A 6 8.434 -7.197 -4.056 1.00 0.00 H new ATOM 0 HE2 TYR A 6 11.448 -4.319 -4.993 1.00 0.00 H new ATOM 0 HH TYR A 6 11.895 -6.441 -4.431 1.00 0.00 H new ATOM 100 N ILE A 7 7.320 -2.586 -2.327 1.00 0.00 N ATOM 101 CA ILE A 7 8.275 -2.216 -1.290 1.00 0.00 C ATOM 102 C ILE A 7 9.351 -3.283 -1.127 1.00 0.00 C ATOM 103 O ILE A 7 9.055 -4.433 -0.805 1.00 0.00 O ATOM 104 CB ILE A 7 7.564 -1.995 0.058 1.00 0.00 C ATOM 105 CG1 ILE A 7 6.620 -0.793 -0.029 1.00 0.00 C ATOM 106 CG2 ILE A 7 8.582 -1.795 1.170 1.00 0.00 C ATOM 107 CD1 ILE A 7 5.632 -0.710 1.112 1.00 0.00 C ATOM 0 H ILE A 7 6.746 -3.398 -2.100 1.00 0.00 H new ATOM 0 HA ILE A 7 8.747 -1.284 -1.601 1.00 0.00 H new ATOM 0 HB ILE A 7 6.974 -2.882 0.289 1.00 0.00 H new ATOM 0 HG12 ILE A 7 7.212 0.122 -0.052 1.00 0.00 H new ATOM 0 HG13 ILE A 7 6.071 -0.841 -0.970 1.00 0.00 H new ATOM 0 HG21 ILE A 7 8.062 -1.640 2.116 1.00 0.00 H new ATOM 0 HG22 ILE A 7 9.217 -2.678 1.245 1.00 0.00 H new ATOM 0 HG23 ILE A 7 9.197 -0.923 0.947 1.00 0.00 H new ATOM 0 HD11 ILE A 7 4.998 0.167 0.981 1.00 0.00 H new ATOM 0 HD12 ILE A 7 5.013 -1.607 1.123 1.00 0.00 H new ATOM 0 HD13 ILE A 7 6.172 -0.630 2.056 1.00 0.00 H new ATOM 119 N LEU A 8 10.602 -2.893 -1.352 1.00 0.00 N ATOM 120 CA LEU A 8 11.740 -3.741 -1.019 1.00 0.00 C ATOM 121 C LEU A 8 12.345 -3.349 0.323 1.00 0.00 C ATOM 122 O LEU A 8 12.630 -2.176 0.567 1.00 0.00 O ATOM 123 CB LEU A 8 12.809 -3.649 -2.116 1.00 0.00 C ATOM 124 CG LEU A 8 14.112 -4.409 -1.840 1.00 0.00 C ATOM 125 CD1 LEU A 8 13.835 -5.906 -1.835 1.00 0.00 C ATOM 126 CD2 LEU A 8 15.144 -4.047 -2.898 1.00 0.00 C ATOM 0 H LEU A 8 10.853 -1.994 -1.764 1.00 0.00 H new ATOM 0 HA LEU A 8 11.382 -4.768 -0.948 1.00 0.00 H new ATOM 0 HB2 LEU A 8 12.382 -4.023 -3.046 1.00 0.00 H new ATOM 0 HB3 LEU A 8 13.050 -2.598 -2.276 1.00 0.00 H new ATOM 0 HG LEU A 8 14.508 -4.129 -0.864 1.00 0.00 H new ATOM 0 HD11 LEU A 8 14.761 -6.447 -1.639 1.00 0.00 H new ATOM 0 HD12 LEU A 8 13.107 -6.139 -1.058 1.00 0.00 H new ATOM 0 HD13 LEU A 8 13.438 -6.206 -2.805 1.00 0.00 H new ATOM 0 HD21 LEU A 8 16.070 -4.587 -2.702 1.00 0.00 H new ATOM 0 HD22 LEU A 8 14.766 -4.320 -3.883 1.00 0.00 H new ATOM 0 HD23 LEU A 8 15.336 -2.974 -2.867 1.00 0.00 H new ATOM 138 N MET A 9 12.539 -4.337 1.190 1.00 0.00 N ATOM 139 CA MET A 9 13.030 -4.087 2.539 1.00 0.00 C ATOM 140 C MET A 9 14.531 -4.330 2.633 1.00 0.00 C ATOM 141 O MET A 9 15.090 -5.125 1.877 1.00 0.00 O ATOM 142 CB MET A 9 12.285 -4.963 3.543 1.00 0.00 C ATOM 143 CG MET A 9 10.790 -4.692 3.627 1.00 0.00 C ATOM 144 SD MET A 9 10.415 -3.062 4.302 1.00 0.00 S ATOM 145 CE MET A 9 8.640 -3.181 4.508 1.00 0.00 C ATOM 0 H MET A 9 12.363 -5.320 0.981 1.00 0.00 H new ATOM 0 HA MET A 9 12.844 -3.040 2.778 1.00 0.00 H new ATOM 0 HB2 MET A 9 12.438 -6.009 3.277 1.00 0.00 H new ATOM 0 HB3 MET A 9 12.724 -4.817 4.530 1.00 0.00 H new ATOM 0 HG2 MET A 9 10.353 -4.778 2.632 1.00 0.00 H new ATOM 0 HG3 MET A 9 10.321 -5.455 4.248 1.00 0.00 H new ATOM 0 HE1 MET A 9 8.265 -2.267 4.968 1.00 0.00 H new ATOM 0 HE2 MET A 9 8.169 -3.317 3.534 1.00 0.00 H new ATOM 0 HE3 MET A 9 8.404 -4.032 5.147 1.00 0.00 H new ATOM 155 N GLU A 10 15.181 -3.639 3.564 1.00 0.00 N ATOM 156 CA GLU A 10 16.605 -3.833 3.808 1.00 0.00 C ATOM 157 C GLU A 10 16.883 -5.220 4.372 1.00 0.00 C ATOM 158 O GLU A 10 18.011 -5.711 4.313 1.00 0.00 O ATOM 159 CB GLU A 10 17.132 -2.766 4.770 1.00 0.00 C ATOM 160 CG GLU A 10 17.222 -1.369 4.172 1.00 0.00 C ATOM 161 CD GLU A 10 17.789 -0.358 5.129 1.00 0.00 C ATOM 162 OE1 GLU A 10 18.075 -0.719 6.244 1.00 0.00 O ATOM 163 OE2 GLU A 10 17.934 0.779 4.743 1.00 0.00 O ATOM 0 H GLU A 10 14.743 -2.939 4.162 1.00 0.00 H new ATOM 0 HA GLU A 10 17.122 -3.741 2.853 1.00 0.00 H new ATOM 0 HB2 GLU A 10 16.484 -2.732 5.646 1.00 0.00 H new ATOM 0 HB3 GLU A 10 18.121 -3.064 5.117 1.00 0.00 H new ATOM 0 HG2 GLU A 10 17.843 -1.402 3.277 1.00 0.00 H new ATOM 0 HG3 GLU A 10 16.228 -1.048 3.859 1.00 0.00 H new ATOM 170 N ASN A 11 15.849 -5.849 4.920 1.00 0.00 N ATOM 171 CA ASN A 11 15.980 -7.182 5.497 1.00 0.00 C ATOM 172 C ASN A 11 15.759 -8.260 4.444 1.00 0.00 C ATOM 173 O ASN A 11 15.801 -9.454 4.746 1.00 0.00 O ATOM 174 CB ASN A 11 15.017 -7.361 6.655 1.00 0.00 C ATOM 175 CG ASN A 11 15.365 -6.496 7.834 1.00 0.00 C ATOM 176 OD1 ASN A 11 16.432 -6.650 8.440 1.00 0.00 O ATOM 177 ND2 ASN A 11 14.486 -5.587 8.173 1.00 0.00 N ATOM 0 H ASN A 11 14.909 -5.456 4.977 1.00 0.00 H new ATOM 0 HA ASN A 11 16.997 -7.285 5.875 1.00 0.00 H new ATOM 0 HB2 ASN A 11 14.006 -7.126 6.322 1.00 0.00 H new ATOM 0 HB3 ASN A 11 15.016 -8.406 6.964 1.00 0.00 H new ATOM 0 HD21 ASN A 11 14.669 -4.971 8.965 1.00 0.00 H new ATOM 0 HD22 ASN A 11 13.618 -5.495 7.645 1.00 0.00 H new ATOM 184 N GLY A 12 15.523 -7.835 3.207 1.00 0.00 N ATOM 185 CA GLY A 12 15.381 -8.763 2.092 1.00 0.00 C ATOM 186 C GLY A 12 13.915 -9.047 1.795 1.00 0.00 C ATOM 187 O GLY A 12 13.592 -9.800 0.876 1.00 0.00 O ATOM 0 H GLY A 12 15.426 -6.852 2.952 1.00 0.00 H new ATOM 0 HA2 GLY A 12 15.860 -8.347 1.206 1.00 0.00 H new ATOM 0 HA3 GLY A 12 15.895 -9.696 2.324 1.00 0.00 H new ATOM 191 N GLY A 13 13.029 -8.440 2.578 1.00 0.00 N ATOM 192 CA GLY A 13 11.594 -8.625 2.399 1.00 0.00 C ATOM 193 C GLY A 13 11.126 -8.049 1.069 1.00 0.00 C ATOM 194 O GLY A 13 11.604 -7.002 0.632 1.00 0.00 O ATOM 0 H GLY A 13 13.280 -7.815 3.344 1.00 0.00 H new ATOM 0 HA2 GLY A 13 11.353 -9.687 2.443 1.00 0.00 H new ATOM 0 HA3 GLY A 13 11.058 -8.142 3.216 1.00 0.00 H new ATOM 198 N LYS A 14 10.189 -8.739 0.428 1.00 0.00 N ATOM 199 CA LYS A 14 9.666 -8.306 -0.863 1.00 0.00 C ATOM 200 C LYS A 14 8.144 -8.246 -0.849 1.00 0.00 C ATOM 201 O LYS A 14 7.473 -9.277 -0.875 1.00 0.00 O ATOM 202 CB LYS A 14 10.145 -9.240 -1.975 1.00 0.00 C ATOM 203 CG LYS A 14 11.654 -9.249 -2.183 1.00 0.00 C ATOM 204 CD LYS A 14 12.042 -10.106 -3.379 1.00 0.00 C ATOM 205 CE LYS A 14 13.549 -10.113 -3.590 1.00 0.00 C ATOM 206 NZ LYS A 14 13.949 -10.996 -4.719 1.00 0.00 N ATOM 0 H LYS A 14 9.775 -9.602 0.782 1.00 0.00 H new ATOM 0 HA LYS A 14 10.044 -7.302 -1.056 1.00 0.00 H new ATOM 0 HB2 LYS A 14 9.816 -10.254 -1.748 1.00 0.00 H new ATOM 0 HB3 LYS A 14 9.663 -8.950 -2.909 1.00 0.00 H new ATOM 0 HG2 LYS A 14 12.009 -8.229 -2.333 1.00 0.00 H new ATOM 0 HG3 LYS A 14 12.145 -9.628 -1.287 1.00 0.00 H new ATOM 0 HD2 LYS A 14 11.689 -11.126 -3.227 1.00 0.00 H new ATOM 0 HD3 LYS A 14 11.549 -9.728 -4.275 1.00 0.00 H new ATOM 0 HE2 LYS A 14 13.893 -9.097 -3.785 1.00 0.00 H new ATOM 0 HE3 LYS A 14 14.042 -10.446 -2.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 14.983 -10.972 -4.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 13.644 -11.971 -4.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 13.500 -10.663 -5.596 1.00 0.00 H new ATOM 220 N ILE A 15 7.606 -7.032 -0.807 1.00 0.00 N ATOM 221 CA ILE A 15 6.167 -6.836 -0.672 1.00 0.00 C ATOM 222 C ILE A 15 5.580 -6.181 -1.916 1.00 0.00 C ATOM 223 O ILE A 15 5.807 -4.999 -2.172 1.00 0.00 O ATOM 224 CB ILE A 15 5.844 -5.974 0.563 1.00 0.00 C ATOM 225 CG1 ILE A 15 6.398 -6.631 1.831 1.00 0.00 C ATOM 226 CG2 ILE A 15 4.343 -5.759 0.683 1.00 0.00 C ATOM 227 CD1 ILE A 15 6.326 -5.748 3.056 1.00 0.00 C ATOM 0 H ILE A 15 8.145 -6.168 -0.865 1.00 0.00 H new ATOM 0 HA ILE A 15 5.716 -7.821 -0.548 1.00 0.00 H new ATOM 0 HB ILE A 15 6.321 -5.001 0.443 1.00 0.00 H new ATOM 0 HG12 ILE A 15 5.845 -7.550 2.024 1.00 0.00 H new ATOM 0 HG13 ILE A 15 7.436 -6.914 1.659 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.132 -5.148 1.561 1.00 0.00 H new ATOM 0 HG22 ILE A 15 3.976 -5.252 -0.209 1.00 0.00 H new ATOM 0 HG23 ILE A 15 3.844 -6.723 0.784 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.736 -6.281 3.914 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.903 -4.839 2.884 1.00 0.00 H new ATOM 0 HD13 ILE A 15 5.287 -5.486 3.255 1.00 0.00 H new ATOM 239 N GLU A 16 4.826 -6.957 -2.687 1.00 0.00 N ATOM 240 CA GLU A 16 4.145 -6.435 -3.865 1.00 0.00 C ATOM 241 C GLU A 16 2.643 -6.332 -3.633 1.00 0.00 C ATOM 242 O GLU A 16 2.013 -7.274 -3.153 1.00 0.00 O ATOM 243 CB GLU A 16 4.422 -7.325 -5.079 1.00 0.00 C ATOM 244 CG GLU A 16 3.881 -6.781 -6.394 1.00 0.00 C ATOM 245 CD GLU A 16 4.207 -7.660 -7.569 1.00 0.00 C ATOM 246 OE1 GLU A 16 5.364 -7.930 -7.782 1.00 0.00 O ATOM 247 OE2 GLU A 16 3.297 -8.062 -8.255 1.00 0.00 O ATOM 0 H GLU A 16 4.671 -7.951 -2.517 1.00 0.00 H new ATOM 0 HA GLU A 16 4.533 -5.434 -4.057 1.00 0.00 H new ATOM 0 HB2 GLU A 16 5.499 -7.465 -5.173 1.00 0.00 H new ATOM 0 HB3 GLU A 16 3.987 -8.308 -4.900 1.00 0.00 H new ATOM 0 HG2 GLU A 16 2.799 -6.671 -6.318 1.00 0.00 H new ATOM 0 HG3 GLU A 16 4.291 -5.786 -6.566 1.00 0.00 H new ATOM 254 N PHE A 17 2.074 -5.181 -3.975 1.00 0.00 N ATOM 255 CA PHE A 17 0.693 -4.873 -3.621 1.00 0.00 C ATOM 256 C PHE A 17 0.028 -4.017 -4.691 1.00 0.00 C ATOM 257 O PHE A 17 0.702 -3.436 -5.541 1.00 0.00 O ATOM 258 CB PHE A 17 0.636 -4.151 -2.273 1.00 0.00 C ATOM 259 CG PHE A 17 1.517 -2.937 -2.198 1.00 0.00 C ATOM 260 CD1 PHE A 17 2.862 -3.057 -1.880 1.00 0.00 C ATOM 261 CD2 PHE A 17 1.004 -1.672 -2.446 1.00 0.00 C ATOM 262 CE1 PHE A 17 3.674 -1.941 -1.809 1.00 0.00 C ATOM 263 CE2 PHE A 17 1.815 -0.555 -2.377 1.00 0.00 C ATOM 264 CZ PHE A 17 3.149 -0.690 -2.059 1.00 0.00 C ATOM 0 H PHE A 17 2.549 -4.445 -4.498 1.00 0.00 H new ATOM 0 HA PHE A 17 0.151 -5.816 -3.547 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -0.394 -3.854 -2.074 1.00 0.00 H new ATOM 0 HB3 PHE A 17 0.925 -4.847 -1.486 1.00 0.00 H new ATOM 0 HD1 PHE A 17 3.279 -4.034 -1.686 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -0.041 -1.559 -2.696 1.00 0.00 H new ATOM 0 HE1 PHE A 17 4.719 -2.048 -1.558 1.00 0.00 H new ATOM 0 HE2 PHE A 17 1.403 0.424 -2.572 1.00 0.00 H new ATOM 0 HZ PHE A 17 3.783 0.183 -2.006 1.00 0.00 H new ATOM 274 N GLU A 18 -1.297 -3.944 -4.643 1.00 0.00 N ATOM 275 CA GLU A 18 -2.056 -3.154 -5.606 1.00 0.00 C ATOM 276 C GLU A 18 -2.796 -2.012 -4.921 1.00 0.00 C ATOM 277 O GLU A 18 -3.227 -2.137 -3.775 1.00 0.00 O ATOM 278 CB GLU A 18 -3.052 -4.043 -6.356 1.00 0.00 C ATOM 279 CG GLU A 18 -2.409 -5.128 -7.207 1.00 0.00 C ATOM 280 CD GLU A 18 -3.412 -5.933 -7.986 1.00 0.00 C ATOM 281 OE1 GLU A 18 -4.585 -5.692 -7.833 1.00 0.00 O ATOM 282 OE2 GLU A 18 -3.004 -6.788 -8.735 1.00 0.00 O ATOM 0 H GLU A 18 -1.869 -4.423 -3.947 1.00 0.00 H new ATOM 0 HA GLU A 18 -1.349 -2.727 -6.317 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -3.718 -4.513 -5.632 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.671 -3.414 -6.997 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -1.703 -4.669 -7.899 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -1.836 -5.796 -6.563 1.00 0.00 H new ATOM 289 N LEU A 19 -2.940 -0.899 -5.631 1.00 0.00 N ATOM 290 CA LEU A 19 -3.617 0.273 -5.089 1.00 0.00 C ATOM 291 C LEU A 19 -5.024 0.409 -5.656 1.00 0.00 C ATOM 292 O LEU A 19 -5.290 0.000 -6.786 1.00 0.00 O ATOM 293 CB LEU A 19 -2.810 1.542 -5.397 1.00 0.00 C ATOM 294 CG LEU A 19 -1.368 1.555 -4.877 1.00 0.00 C ATOM 295 CD1 LEU A 19 -0.661 2.811 -5.370 1.00 0.00 C ATOM 296 CD2 LEU A 19 -1.374 1.493 -3.357 1.00 0.00 C ATOM 0 H LEU A 19 -2.597 -0.784 -6.584 1.00 0.00 H new ATOM 0 HA LEU A 19 -3.693 0.145 -4.009 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.788 1.683 -6.478 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.337 2.397 -4.974 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.829 0.686 -5.254 1.00 0.00 H new ATOM 0 HD11 LEU A 19 0.364 2.820 -5.000 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -0.654 2.820 -6.460 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -1.187 3.692 -5.003 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -0.348 1.502 -2.988 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -1.910 2.355 -2.960 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -1.868 0.577 -3.032 1.00 0.00 H new ATOM 308 N PHE A 20 -5.922 0.985 -4.865 1.00 0.00 N ATOM 309 CA PHE A 20 -7.334 1.047 -5.226 1.00 0.00 C ATOM 310 C PHE A 20 -7.881 2.459 -5.073 1.00 0.00 C ATOM 311 O PHE A 20 -8.479 2.796 -4.051 1.00 0.00 O ATOM 312 CB PHE A 20 -8.149 0.082 -4.362 1.00 0.00 C ATOM 313 CG PHE A 20 -7.700 -1.348 -4.463 1.00 0.00 C ATOM 314 CD1 PHE A 20 -8.050 -2.125 -5.557 1.00 0.00 C ATOM 315 CD2 PHE A 20 -6.927 -1.920 -3.463 1.00 0.00 C ATOM 316 CE1 PHE A 20 -7.639 -3.440 -5.651 1.00 0.00 C ATOM 317 CE2 PHE A 20 -6.514 -3.235 -3.554 1.00 0.00 C ATOM 318 CZ PHE A 20 -6.870 -3.996 -4.649 1.00 0.00 C ATOM 0 H PHE A 20 -5.697 1.416 -3.968 1.00 0.00 H new ATOM 0 HA PHE A 20 -7.421 0.755 -6.273 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -8.087 0.400 -3.321 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -9.198 0.145 -4.653 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -8.651 -1.696 -6.345 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -6.645 -1.330 -2.603 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -7.919 -4.033 -6.509 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -5.912 -3.668 -2.768 1.00 0.00 H new ATOM 0 HZ PHE A 20 -6.548 -5.024 -4.722 1.00 0.00 H new ATOM 328 N PRO A 21 -7.673 3.284 -6.093 1.00 0.00 N ATOM 329 CA PRO A 21 -8.246 4.624 -6.125 1.00 0.00 C ATOM 330 C PRO A 21 -9.752 4.584 -5.901 1.00 0.00 C ATOM 331 O PRO A 21 -10.335 5.526 -5.365 1.00 0.00 O ATOM 332 CB PRO A 21 -7.898 5.114 -7.535 1.00 0.00 C ATOM 333 CG PRO A 21 -6.672 4.347 -7.896 1.00 0.00 C ATOM 334 CD PRO A 21 -6.898 2.980 -7.308 1.00 0.00 C ATOM 0 HA PRO A 21 -7.861 5.277 -5.342 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -8.710 4.920 -8.236 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -7.714 6.188 -7.549 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -6.538 4.297 -8.977 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -5.776 4.813 -7.485 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -7.448 2.330 -7.989 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -5.959 2.477 -7.076 1.00 0.00 H new ATOM 342 N ASN A 22 -10.379 3.487 -6.315 1.00 0.00 N ATOM 343 CA ASN A 22 -11.820 3.327 -6.168 1.00 0.00 C ATOM 344 C ASN A 22 -12.216 3.210 -4.702 1.00 0.00 C ATOM 345 O ASN A 22 -13.326 3.576 -4.317 1.00 0.00 O ATOM 346 CB ASN A 22 -12.306 2.119 -6.950 1.00 0.00 C ATOM 347 CG ASN A 22 -12.289 2.348 -8.435 1.00 0.00 C ATOM 348 OD1 ASN A 22 -12.291 3.494 -8.900 1.00 0.00 O ATOM 349 ND2 ASN A 22 -12.274 1.280 -9.191 1.00 0.00 N ATOM 0 H ASN A 22 -9.910 2.695 -6.755 1.00 0.00 H new ATOM 0 HA ASN A 22 -12.298 4.219 -6.574 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -11.679 1.260 -6.711 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -13.320 1.871 -6.636 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -12.263 1.374 -10.207 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -12.273 0.353 -8.765 1.00 0.00 H new ATOM 356 N GLU A 23 -11.300 2.699 -3.886 1.00 0.00 N ATOM 357 CA GLU A 23 -11.518 2.610 -2.448 1.00 0.00 C ATOM 358 C GLU A 23 -11.181 3.925 -1.757 1.00 0.00 C ATOM 359 O GLU A 23 -11.891 4.361 -0.851 1.00 0.00 O ATOM 360 CB GLU A 23 -10.678 1.479 -1.850 1.00 0.00 C ATOM 361 CG GLU A 23 -11.115 0.083 -2.270 1.00 0.00 C ATOM 362 CD GLU A 23 -10.250 -1.001 -1.688 1.00 0.00 C ATOM 363 OE1 GLU A 23 -9.314 -0.679 -0.995 1.00 0.00 O ATOM 364 OE2 GLU A 23 -10.524 -2.151 -1.937 1.00 0.00 O ATOM 0 H GLU A 23 -10.398 2.340 -4.198 1.00 0.00 H new ATOM 0 HA GLU A 23 -12.574 2.397 -2.284 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -9.637 1.623 -2.140 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -10.719 1.548 -0.763 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -12.148 -0.078 -1.960 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -11.094 0.013 -3.358 1.00 0.00 H new ATOM 371 N ALA A 24 -10.093 4.554 -2.190 1.00 0.00 N ATOM 372 CA ALA A 24 -9.640 5.803 -1.590 1.00 0.00 C ATOM 373 C ALA A 24 -8.863 6.646 -2.593 1.00 0.00 C ATOM 374 O ALA A 24 -7.639 6.548 -2.683 1.00 0.00 O ATOM 375 CB ALA A 24 -8.788 5.522 -0.361 1.00 0.00 C ATOM 0 H ALA A 24 -9.508 4.218 -2.955 1.00 0.00 H new ATOM 0 HA ALA A 24 -10.520 6.369 -1.286 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -8.457 6.464 0.076 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -9.377 4.969 0.371 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -7.919 4.931 -0.648 1.00 0.00 H new ATOM 381 N PRO A 25 -9.581 7.472 -3.345 1.00 0.00 N ATOM 382 CA PRO A 25 -8.974 8.260 -4.412 1.00 0.00 C ATOM 383 C PRO A 25 -7.813 9.096 -3.888 1.00 0.00 C ATOM 384 O PRO A 25 -6.677 8.949 -4.338 1.00 0.00 O ATOM 385 CB PRO A 25 -10.132 9.140 -4.892 1.00 0.00 C ATOM 386 CG PRO A 25 -11.347 8.312 -4.648 1.00 0.00 C ATOM 387 CD PRO A 25 -11.064 7.607 -3.348 1.00 0.00 C ATOM 0 HA PRO A 25 -8.546 7.651 -5.208 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -10.173 10.079 -4.341 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -10.028 9.394 -5.947 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -12.242 8.930 -4.578 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.513 7.601 -5.458 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -11.417 8.184 -2.493 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -11.556 6.635 -3.302 1.00 0.00 H new ATOM 395 N VAL A 26 -8.107 9.972 -2.933 1.00 0.00 N ATOM 396 CA VAL A 26 -7.131 10.950 -2.466 1.00 0.00 C ATOM 397 C VAL A 26 -5.981 10.273 -1.731 1.00 0.00 C ATOM 398 O VAL A 26 -4.822 10.655 -1.888 1.00 0.00 O ATOM 399 CB VAL A 26 -7.805 11.971 -1.529 1.00 0.00 C ATOM 400 CG1 VAL A 26 -6.763 12.881 -0.896 1.00 0.00 C ATOM 401 CG2 VAL A 26 -8.833 12.783 -2.302 1.00 0.00 C ATOM 0 H VAL A 26 -9.013 10.025 -2.467 1.00 0.00 H new ATOM 0 HA VAL A 26 -6.732 11.464 -3.341 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.315 11.435 -0.729 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -7.256 13.596 -0.237 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.059 12.282 -0.319 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.226 13.418 -1.678 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -9.306 13.503 -1.634 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.340 13.314 -3.116 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.591 12.115 -2.711 1.00 0.00 H new ATOM 411 N THR A 27 -6.309 9.267 -0.929 1.00 0.00 N ATOM 412 CA THR A 27 -5.308 8.557 -0.141 1.00 0.00 C ATOM 413 C THR A 27 -4.272 7.892 -1.038 1.00 0.00 C ATOM 414 O THR A 27 -3.070 7.980 -0.785 1.00 0.00 O ATOM 415 CB THR A 27 -5.964 7.497 0.765 1.00 0.00 C ATOM 416 OG1 THR A 27 -6.916 8.129 1.630 1.00 0.00 O ATOM 417 CG2 THR A 27 -4.913 6.789 1.604 1.00 0.00 C ATOM 0 H THR A 27 -7.262 8.924 -0.807 1.00 0.00 H new ATOM 0 HA THR A 27 -4.808 9.295 0.486 1.00 0.00 H new ATOM 0 HB THR A 27 -6.466 6.762 0.136 1.00 0.00 H new ATOM 0 HG1 THR A 27 -7.697 8.409 1.108 1.00 0.00 H new ATOM 0 HG21 THR A 27 -5.394 6.044 2.238 1.00 0.00 H new ATOM 0 HG22 THR A 27 -4.194 6.298 0.948 1.00 0.00 H new ATOM 0 HG23 THR A 27 -4.395 7.517 2.229 1.00 0.00 H new ATOM 425 N VAL A 28 -4.744 7.227 -2.088 1.00 0.00 N ATOM 426 CA VAL A 28 -3.857 6.584 -3.050 1.00 0.00 C ATOM 427 C VAL A 28 -2.994 7.610 -3.773 1.00 0.00 C ATOM 428 O VAL A 28 -1.799 7.397 -3.977 1.00 0.00 O ATOM 429 CB VAL A 28 -4.676 5.787 -4.082 1.00 0.00 C ATOM 430 CG1 VAL A 28 -3.788 5.335 -5.232 1.00 0.00 C ATOM 431 CG2 VAL A 28 -5.336 4.593 -3.408 1.00 0.00 C ATOM 0 H VAL A 28 -5.737 7.120 -2.294 1.00 0.00 H new ATOM 0 HA VAL A 28 -3.205 5.906 -2.499 1.00 0.00 H new ATOM 0 HB VAL A 28 -5.455 6.431 -4.490 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -4.383 4.773 -5.952 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -3.354 6.207 -5.721 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.990 4.700 -4.847 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -5.914 4.033 -4.144 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -4.569 3.947 -2.981 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -5.998 4.942 -2.616 1.00 0.00 H new ATOM 441 N ALA A 29 -3.607 8.724 -4.160 1.00 0.00 N ATOM 442 CA ALA A 29 -2.876 9.828 -4.771 1.00 0.00 C ATOM 443 C ALA A 29 -1.770 10.332 -3.853 1.00 0.00 C ATOM 444 O ALA A 29 -0.652 10.594 -4.297 1.00 0.00 O ATOM 445 CB ALA A 29 -3.828 10.961 -5.126 1.00 0.00 C ATOM 0 H ALA A 29 -4.609 8.886 -4.061 1.00 0.00 H new ATOM 0 HA ALA A 29 -2.411 9.459 -5.685 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -3.268 11.778 -5.581 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -4.578 10.599 -5.829 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -4.321 11.319 -4.222 1.00 0.00 H new ATOM 451 N ASN A 30 -2.089 10.466 -2.570 1.00 0.00 N ATOM 452 CA ASN A 30 -1.116 10.918 -1.582 1.00 0.00 C ATOM 453 C ASN A 30 -0.011 9.888 -1.386 1.00 0.00 C ATOM 454 O ASN A 30 1.153 10.242 -1.201 1.00 0.00 O ATOM 455 CB ASN A 30 -1.800 11.226 -0.262 1.00 0.00 C ATOM 456 CG ASN A 30 -2.587 12.506 -0.304 1.00 0.00 C ATOM 457 OD1 ASN A 30 -2.371 13.354 -1.178 1.00 0.00 O ATOM 458 ND2 ASN A 30 -3.497 12.662 0.623 1.00 0.00 N ATOM 0 H ASN A 30 -3.015 10.268 -2.190 1.00 0.00 H new ATOM 0 HA ASN A 30 -0.658 11.833 -1.957 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -2.465 10.403 -0.001 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -1.049 11.291 0.526 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -4.063 13.510 0.644 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -3.640 11.935 1.324 1.00 0.00 H new ATOM 465 N PHE A 31 -0.383 8.613 -1.427 1.00 0.00 N ATOM 466 CA PHE A 31 0.587 7.529 -1.337 1.00 0.00 C ATOM 467 C PHE A 31 1.663 7.661 -2.407 1.00 0.00 C ATOM 468 O PHE A 31 2.856 7.618 -2.111 1.00 0.00 O ATOM 469 CB PHE A 31 -0.111 6.174 -1.473 1.00 0.00 C ATOM 470 CG PHE A 31 0.829 5.003 -1.452 1.00 0.00 C ATOM 471 CD1 PHE A 31 1.232 4.439 -0.250 1.00 0.00 C ATOM 472 CD2 PHE A 31 1.314 4.463 -2.634 1.00 0.00 C ATOM 473 CE1 PHE A 31 2.097 3.362 -0.229 1.00 0.00 C ATOM 474 CE2 PHE A 31 2.178 3.385 -2.616 1.00 0.00 C ATOM 475 CZ PHE A 31 2.569 2.835 -1.412 1.00 0.00 C ATOM 0 H PHE A 31 -1.351 8.305 -1.522 1.00 0.00 H new ATOM 0 HA PHE A 31 1.063 7.592 -0.359 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -0.832 6.064 -0.663 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.675 6.158 -2.406 1.00 0.00 H new ATOM 0 HD1 PHE A 31 0.865 4.847 0.680 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.013 4.890 -3.579 1.00 0.00 H new ATOM 0 HE1 PHE A 31 2.403 2.933 0.714 1.00 0.00 H new ATOM 0 HE2 PHE A 31 2.547 2.973 -3.544 1.00 0.00 H new ATOM 0 HZ PHE A 31 3.244 1.992 -1.397 1.00 0.00 H new ATOM 485 N GLU A 32 1.232 7.822 -3.655 1.00 0.00 N ATOM 486 CA GLU A 32 2.157 7.995 -4.768 1.00 0.00 C ATOM 487 C GLU A 32 3.042 9.217 -4.563 1.00 0.00 C ATOM 488 O GLU A 32 4.258 9.153 -4.745 1.00 0.00 O ATOM 489 CB GLU A 32 1.388 8.125 -6.085 1.00 0.00 C ATOM 490 CG GLU A 32 2.270 8.285 -7.315 1.00 0.00 C ATOM 491 CD GLU A 32 1.488 8.286 -8.599 1.00 0.00 C ATOM 492 OE1 GLU A 32 0.299 8.086 -8.549 1.00 0.00 O ATOM 493 OE2 GLU A 32 2.082 8.488 -9.633 1.00 0.00 O ATOM 0 H GLU A 32 0.247 7.836 -3.920 1.00 0.00 H new ATOM 0 HA GLU A 32 2.795 7.112 -4.811 1.00 0.00 H new ATOM 0 HB2 GLU A 32 0.762 7.242 -6.214 1.00 0.00 H new ATOM 0 HB3 GLU A 32 0.720 8.983 -6.018 1.00 0.00 H new ATOM 0 HG2 GLU A 32 2.830 9.217 -7.236 1.00 0.00 H new ATOM 0 HG3 GLU A 32 3.000 7.476 -7.340 1.00 0.00 H new ATOM 500 N LYS A 33 2.426 10.331 -4.183 1.00 0.00 N ATOM 501 CA LYS A 33 3.164 11.556 -3.901 1.00 0.00 C ATOM 502 C LYS A 33 4.238 11.323 -2.847 1.00 0.00 C ATOM 503 O LYS A 33 5.384 11.739 -3.011 1.00 0.00 O ATOM 504 CB LYS A 33 2.211 12.663 -3.444 1.00 0.00 C ATOM 505 CG LYS A 33 2.887 13.995 -3.149 1.00 0.00 C ATOM 506 CD LYS A 33 1.868 15.064 -2.787 1.00 0.00 C ATOM 507 CE LYS A 33 2.546 16.382 -2.442 1.00 0.00 C ATOM 508 NZ LYS A 33 1.559 17.450 -2.124 1.00 0.00 N ATOM 0 H LYS A 33 1.416 10.411 -4.063 1.00 0.00 H new ATOM 0 HA LYS A 33 3.654 11.868 -4.823 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.456 12.816 -4.215 1.00 0.00 H new ATOM 0 HB3 LYS A 33 1.689 12.328 -2.548 1.00 0.00 H new ATOM 0 HG2 LYS A 33 3.595 13.872 -2.329 1.00 0.00 H new ATOM 0 HG3 LYS A 33 3.460 14.315 -4.019 1.00 0.00 H new ATOM 0 HD2 LYS A 33 1.183 15.213 -3.621 1.00 0.00 H new ATOM 0 HD3 LYS A 33 1.271 14.728 -1.940 1.00 0.00 H new ATOM 0 HE2 LYS A 33 3.210 16.236 -1.590 1.00 0.00 H new ATOM 0 HE3 LYS A 33 3.167 16.700 -3.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 2.062 18.331 -1.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 0.942 17.608 -2.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 0.983 17.158 -1.309 1.00 0.00 H new ATOM 522 N LEU A 34 3.860 10.653 -1.764 1.00 0.00 N ATOM 523 CA LEU A 34 4.791 10.360 -0.680 1.00 0.00 C ATOM 524 C LEU A 34 5.998 9.580 -1.187 1.00 0.00 C ATOM 525 O LEU A 34 7.141 9.925 -0.889 1.00 0.00 O ATOM 526 CB LEU A 34 4.086 9.562 0.425 1.00 0.00 C ATOM 527 CG LEU A 34 3.120 10.362 1.308 1.00 0.00 C ATOM 528 CD1 LEU A 34 2.300 9.403 2.160 1.00 0.00 C ATOM 529 CD2 LEU A 34 3.910 11.328 2.179 1.00 0.00 C ATOM 0 H LEU A 34 2.914 10.302 -1.613 1.00 0.00 H new ATOM 0 HA LEU A 34 5.140 11.309 -0.274 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.534 8.744 -0.038 1.00 0.00 H new ATOM 0 HB3 LEU A 34 4.846 9.112 1.064 1.00 0.00 H new ATOM 0 HG LEU A 34 2.437 10.940 0.686 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.613 9.971 2.788 1.00 0.00 H new ATOM 0 HD12 LEU A 34 1.732 8.735 1.512 1.00 0.00 H new ATOM 0 HD13 LEU A 34 2.967 8.815 2.791 1.00 0.00 H new ATOM 0 HD21 LEU A 34 3.224 11.897 2.807 1.00 0.00 H new ATOM 0 HD22 LEU A 34 4.600 10.768 2.810 1.00 0.00 H new ATOM 0 HD23 LEU A 34 4.473 12.012 1.545 1.00 0.00 H new ATOM 541 N ALA A 35 5.735 8.527 -1.954 1.00 0.00 N ATOM 542 CA ALA A 35 6.801 7.709 -2.522 1.00 0.00 C ATOM 543 C ALA A 35 7.712 8.537 -3.418 1.00 0.00 C ATOM 544 O ALA A 35 8.932 8.367 -3.405 1.00 0.00 O ATOM 545 CB ALA A 35 6.214 6.541 -3.301 1.00 0.00 C ATOM 0 H ALA A 35 4.793 8.220 -2.197 1.00 0.00 H new ATOM 0 HA ALA A 35 7.400 7.319 -1.699 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.022 5.940 -3.719 1.00 0.00 H new ATOM 0 HB2 ALA A 35 5.611 5.925 -2.634 1.00 0.00 H new ATOM 0 HB3 ALA A 35 5.589 6.920 -4.109 1.00 0.00 H new ATOM 551 N ASN A 36 7.115 9.435 -4.194 1.00 0.00 N ATOM 552 CA ASN A 36 7.875 10.309 -5.078 1.00 0.00 C ATOM 553 C ASN A 36 8.783 11.241 -4.284 1.00 0.00 C ATOM 554 O ASN A 36 9.873 11.593 -4.734 1.00 0.00 O ATOM 555 CB ASN A 36 6.942 11.107 -5.972 1.00 0.00 C ATOM 556 CG ASN A 36 6.330 10.270 -7.061 1.00 0.00 C ATOM 557 OD1 ASN A 36 6.854 9.207 -7.412 1.00 0.00 O ATOM 558 ND2 ASN A 36 5.230 10.729 -7.601 1.00 0.00 N ATOM 0 H ASN A 36 6.105 9.576 -4.228 1.00 0.00 H new ATOM 0 HA ASN A 36 8.506 9.682 -5.708 1.00 0.00 H new ATOM 0 HB2 ASN A 36 6.149 11.544 -5.365 1.00 0.00 H new ATOM 0 HB3 ASN A 36 7.493 11.934 -6.420 1.00 0.00 H new ATOM 0 HD21 ASN A 36 4.769 10.204 -8.344 1.00 0.00 H new ATOM 0 HD22 ASN A 36 4.834 11.612 -7.279 1.00 0.00 H new ATOM 565 N GLU A 37 8.326 11.637 -3.102 1.00 0.00 N ATOM 566 CA GLU A 37 9.103 12.515 -2.235 1.00 0.00 C ATOM 567 C GLU A 37 10.145 11.731 -1.448 1.00 0.00 C ATOM 568 O GLU A 37 10.964 12.310 -0.734 1.00 0.00 O ATOM 569 CB GLU A 37 8.181 13.268 -1.273 1.00 0.00 C ATOM 570 CG GLU A 37 7.276 14.293 -1.941 1.00 0.00 C ATOM 571 CD GLU A 37 6.430 15.054 -0.960 1.00 0.00 C ATOM 572 OE1 GLU A 37 6.547 14.804 0.216 1.00 0.00 O ATOM 573 OE2 GLU A 37 5.666 15.887 -1.386 1.00 0.00 O ATOM 0 H GLU A 37 7.420 11.364 -2.721 1.00 0.00 H new ATOM 0 HA GLU A 37 9.622 13.234 -2.869 1.00 0.00 H new ATOM 0 HB2 GLU A 37 7.561 12.545 -0.743 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.792 13.774 -0.525 1.00 0.00 H new ATOM 0 HG2 GLU A 37 7.887 14.996 -2.507 1.00 0.00 H new ATOM 0 HG3 GLU A 37 6.628 13.786 -2.656 1.00 0.00 H new ATOM 580 N GLY A 38 10.108 10.410 -1.580 1.00 0.00 N ATOM 581 CA GLY A 38 11.075 9.545 -0.914 1.00 0.00 C ATOM 582 C GLY A 38 10.673 9.282 0.531 1.00 0.00 C ATOM 583 O GLY A 38 11.507 8.916 1.360 1.00 0.00 O ATOM 0 H GLY A 38 9.417 9.914 -2.143 1.00 0.00 H new ATOM 0 HA2 GLY A 38 11.152 8.600 -1.451 1.00 0.00 H new ATOM 0 HA3 GLY A 38 12.061 10.008 -0.942 1.00 0.00 H new ATOM 587 N PHE A 39 9.393 9.470 0.828 1.00 0.00 N ATOM 588 CA PHE A 39 8.869 9.212 2.165 1.00 0.00 C ATOM 589 C PHE A 39 8.997 7.737 2.530 1.00 0.00 C ATOM 590 O PHE A 39 9.590 7.391 3.551 1.00 0.00 O ATOM 591 CB PHE A 39 7.403 9.640 2.257 1.00 0.00 C ATOM 592 CG PHE A 39 6.724 9.205 3.524 1.00 0.00 C ATOM 593 CD1 PHE A 39 7.066 9.773 4.742 1.00 0.00 C ATOM 594 CD2 PHE A 39 5.742 8.226 3.501 1.00 0.00 C ATOM 595 CE1 PHE A 39 6.441 9.373 5.909 1.00 0.00 C ATOM 596 CE2 PHE A 39 5.115 7.825 4.664 1.00 0.00 C ATOM 597 CZ PHE A 39 5.465 8.399 5.870 1.00 0.00 C ATOM 0 H PHE A 39 8.697 9.801 0.160 1.00 0.00 H new ATOM 0 HA PHE A 39 9.459 9.797 2.871 1.00 0.00 H new ATOM 0 HB2 PHE A 39 7.345 10.726 2.179 1.00 0.00 H new ATOM 0 HB3 PHE A 39 6.860 9.230 1.405 1.00 0.00 H new ATOM 0 HD1 PHE A 39 7.829 10.536 4.780 1.00 0.00 H new ATOM 0 HD2 PHE A 39 5.464 7.771 2.562 1.00 0.00 H new ATOM 0 HE1 PHE A 39 6.717 9.823 6.851 1.00 0.00 H new ATOM 0 HE2 PHE A 39 4.351 7.062 4.630 1.00 0.00 H new ATOM 0 HZ PHE A 39 4.976 8.086 6.781 1.00 0.00 H new ATOM 607 N TYR A 40 8.436 6.875 1.691 1.00 0.00 N ATOM 608 CA TYR A 40 8.413 5.443 1.965 1.00 0.00 C ATOM 609 C TYR A 40 9.790 4.822 1.762 1.00 0.00 C ATOM 610 O TYR A 40 10.120 3.807 2.374 1.00 0.00 O ATOM 611 CB TYR A 40 7.380 4.744 1.078 1.00 0.00 C ATOM 612 CG TYR A 40 5.949 4.992 1.498 1.00 0.00 C ATOM 613 CD1 TYR A 40 5.439 4.366 2.625 1.00 0.00 C ATOM 614 CD2 TYR A 40 5.147 5.846 0.756 1.00 0.00 C ATOM 615 CE1 TYR A 40 4.131 4.592 3.009 1.00 0.00 C ATOM 616 CE2 TYR A 40 3.839 6.072 1.139 1.00 0.00 C ATOM 617 CZ TYR A 40 3.332 5.442 2.270 1.00 0.00 C ATOM 618 OH TYR A 40 2.030 5.668 2.653 1.00 0.00 O ATOM 0 H TYR A 40 7.990 7.143 0.814 1.00 0.00 H new ATOM 0 HA TYR A 40 8.130 5.306 3.009 1.00 0.00 H new ATOM 0 HB2 TYR A 40 7.511 5.080 0.049 1.00 0.00 H new ATOM 0 HB3 TYR A 40 7.572 3.671 1.089 1.00 0.00 H new ATOM 0 HD1 TYR A 40 6.064 3.702 3.203 1.00 0.00 H new ATOM 0 HD2 TYR A 40 5.545 6.334 -0.121 1.00 0.00 H new ATOM 0 HE1 TYR A 40 3.734 4.104 3.887 1.00 0.00 H new ATOM 0 HE2 TYR A 40 3.212 6.736 0.562 1.00 0.00 H new ATOM 0 HH TYR A 40 1.608 6.291 2.025 1.00 0.00 H new ATOM 628 N ASN A 41 10.590 5.438 0.898 1.00 0.00 N ATOM 629 CA ASN A 41 11.944 4.963 0.635 1.00 0.00 C ATOM 630 C ASN A 41 12.852 5.198 1.834 1.00 0.00 C ATOM 631 O ASN A 41 13.320 6.314 2.062 1.00 0.00 O ATOM 632 CB ASN A 41 12.511 5.631 -0.604 1.00 0.00 C ATOM 633 CG ASN A 41 13.838 5.056 -1.014 1.00 0.00 C ATOM 634 OD1 ASN A 41 14.606 4.573 -0.173 1.00 0.00 O ATOM 635 ND2 ASN A 41 14.124 5.098 -2.290 1.00 0.00 N ATOM 0 H ASN A 41 10.324 6.268 0.368 1.00 0.00 H new ATOM 0 HA ASN A 41 11.895 3.889 0.458 1.00 0.00 H new ATOM 0 HB2 ASN A 41 11.803 5.524 -1.426 1.00 0.00 H new ATOM 0 HB3 ASN A 41 12.624 6.699 -0.417 1.00 0.00 H new ATOM 0 HD21 ASN A 41 15.011 4.723 -2.627 1.00 0.00 H new ATOM 0 HD22 ASN A 41 13.460 5.506 -2.948 1.00 0.00 H new ATOM 642 N GLY A 42 13.099 4.140 2.599 1.00 0.00 N ATOM 643 CA GLY A 42 13.910 4.239 3.806 1.00 0.00 C ATOM 644 C GLY A 42 13.037 4.337 5.049 1.00 0.00 C ATOM 645 O GLY A 42 13.538 4.513 6.160 1.00 0.00 O ATOM 0 H GLY A 42 12.748 3.202 2.404 1.00 0.00 H new ATOM 0 HA2 GLY A 42 14.560 3.368 3.883 1.00 0.00 H new ATOM 0 HA3 GLY A 42 14.556 5.114 3.742 1.00 0.00 H new ATOM 649 N LEU A 43 11.727 4.221 4.858 1.00 0.00 N ATOM 650 CA LEU A 43 10.773 4.407 5.946 1.00 0.00 C ATOM 651 C LEU A 43 10.804 3.230 6.911 1.00 0.00 C ATOM 652 O LEU A 43 11.008 2.086 6.504 1.00 0.00 O ATOM 653 CB LEU A 43 9.357 4.580 5.384 1.00 0.00 C ATOM 654 CG LEU A 43 8.331 5.196 6.344 1.00 0.00 C ATOM 655 CD1 LEU A 43 8.786 6.593 6.744 1.00 0.00 C ATOM 656 CD2 LEU A 43 6.967 5.236 5.672 1.00 0.00 C ATOM 0 H LEU A 43 11.301 3.999 3.958 1.00 0.00 H new ATOM 0 HA LEU A 43 11.058 5.306 6.492 1.00 0.00 H new ATOM 0 HB2 LEU A 43 9.414 5.204 4.492 1.00 0.00 H new ATOM 0 HB3 LEU A 43 8.990 3.604 5.067 1.00 0.00 H new ATOM 0 HG LEU A 43 8.252 4.589 7.246 1.00 0.00 H new ATOM 0 HD11 LEU A 43 8.058 7.032 7.426 1.00 0.00 H new ATOM 0 HD12 LEU A 43 9.755 6.532 7.238 1.00 0.00 H new ATOM 0 HD13 LEU A 43 8.871 7.217 5.854 1.00 0.00 H new ATOM 0 HD21 LEU A 43 6.238 5.674 6.354 1.00 0.00 H new ATOM 0 HD22 LEU A 43 7.025 5.840 4.767 1.00 0.00 H new ATOM 0 HD23 LEU A 43 6.659 4.223 5.413 1.00 0.00 H new ATOM 668 N THR A 44 10.599 3.518 8.192 1.00 0.00 N ATOM 669 CA THR A 44 10.767 2.516 9.238 1.00 0.00 C ATOM 670 C THR A 44 9.466 2.291 10.000 1.00 0.00 C ATOM 671 O THR A 44 8.677 3.218 10.185 1.00 0.00 O ATOM 672 CB THR A 44 11.879 2.922 10.223 1.00 0.00 C ATOM 673 OG1 THR A 44 13.097 3.154 9.502 1.00 0.00 O ATOM 674 CG2 THR A 44 12.106 1.827 11.253 1.00 0.00 C ATOM 0 H THR A 44 10.316 4.438 8.531 1.00 0.00 H new ATOM 0 HA THR A 44 11.053 1.585 8.749 1.00 0.00 H new ATOM 0 HB THR A 44 11.573 3.833 10.738 1.00 0.00 H new ATOM 0 HG1 THR A 44 13.804 3.414 10.129 1.00 0.00 H new ATOM 0 HG21 THR A 44 12.895 2.132 11.940 1.00 0.00 H new ATOM 0 HG22 THR A 44 11.185 1.656 11.811 1.00 0.00 H new ATOM 0 HG23 THR A 44 12.400 0.907 10.747 1.00 0.00 H new ATOM 682 N PHE A 45 9.249 1.057 10.440 1.00 0.00 N ATOM 683 CA PHE A 45 8.125 0.741 11.311 1.00 0.00 C ATOM 684 C PHE A 45 8.510 0.878 12.779 1.00 0.00 C ATOM 685 O PHE A 45 9.681 0.754 13.138 1.00 0.00 O ATOM 686 CB PHE A 45 7.622 -0.678 11.042 1.00 0.00 C ATOM 687 CG PHE A 45 6.978 -0.847 9.695 1.00 0.00 C ATOM 688 CD1 PHE A 45 7.742 -0.812 8.537 1.00 0.00 C ATOM 689 CD2 PHE A 45 5.610 -1.039 9.581 1.00 0.00 C ATOM 690 CE1 PHE A 45 7.151 -0.967 7.297 1.00 0.00 C ATOM 691 CE2 PHE A 45 5.017 -1.196 8.343 1.00 0.00 C ATOM 692 CZ PHE A 45 5.790 -1.159 7.199 1.00 0.00 C ATOM 0 H PHE A 45 9.838 0.258 10.207 1.00 0.00 H new ATOM 0 HA PHE A 45 7.328 1.452 11.094 1.00 0.00 H new ATOM 0 HB2 PHE A 45 8.459 -1.372 11.124 1.00 0.00 H new ATOM 0 HB3 PHE A 45 6.904 -0.952 11.815 1.00 0.00 H new ATOM 0 HD1 PHE A 45 8.809 -0.662 8.605 1.00 0.00 H new ATOM 0 HD2 PHE A 45 5.000 -1.066 10.472 1.00 0.00 H new ATOM 0 HE1 PHE A 45 7.757 -0.938 6.404 1.00 0.00 H new ATOM 0 HE2 PHE A 45 3.950 -1.347 8.270 1.00 0.00 H new ATOM 0 HZ PHE A 45 5.329 -1.280 6.230 1.00 0.00 H new ATOM 702 N HIS A 46 7.516 1.134 13.624 1.00 0.00 N ATOM 703 CA HIS A 46 7.767 1.460 15.023 1.00 0.00 C ATOM 704 C HIS A 46 6.881 0.635 15.948 1.00 0.00 C ATOM 705 O HIS A 46 7.125 0.561 17.153 1.00 0.00 O ATOM 706 CB HIS A 46 7.534 2.953 15.281 1.00 0.00 C ATOM 707 CG HIS A 46 6.136 3.403 14.989 1.00 0.00 C ATOM 708 ND1 HIS A 46 5.676 3.615 13.707 1.00 0.00 N ATOM 709 CD2 HIS A 46 5.099 3.681 15.814 1.00 0.00 C ATOM 710 CE1 HIS A 46 4.413 4.004 13.755 1.00 0.00 C ATOM 711 NE2 HIS A 46 4.040 4.052 15.021 1.00 0.00 N ATOM 0 H HIS A 46 6.530 1.122 13.364 1.00 0.00 H new ATOM 0 HA HIS A 46 8.809 1.220 15.235 1.00 0.00 H new ATOM 0 HB2 HIS A 46 7.767 3.173 16.323 1.00 0.00 H new ATOM 0 HB3 HIS A 46 8.227 3.531 14.670 1.00 0.00 H new ATOM 0 HD2 HIS A 46 5.103 3.622 16.892 1.00 0.00 H new ATOM 0 HE1 HIS A 46 3.792 4.242 12.904 1.00 0.00 H new ATOM 0 HE2 HIS A 46 3.115 4.321 15.356 1.00 0.00 H new ATOM 718 N ARG A 47 5.852 0.017 15.379 1.00 0.00 N ATOM 719 CA ARG A 47 5.013 -0.916 16.120 1.00 0.00 C ATOM 720 C ARG A 47 4.643 -2.121 15.265 1.00 0.00 C ATOM 721 O ARG A 47 3.520 -2.221 14.770 1.00 0.00 O ATOM 722 CB ARG A 47 3.743 -0.229 16.600 1.00 0.00 C ATOM 723 CG ARG A 47 3.957 0.842 17.657 1.00 0.00 C ATOM 724 CD ARG A 47 4.401 0.259 18.949 1.00 0.00 C ATOM 725 NE ARG A 47 4.409 1.245 20.017 1.00 0.00 N ATOM 726 CZ ARG A 47 5.434 2.080 20.279 1.00 0.00 C ATOM 727 NH1 ARG A 47 6.523 2.036 19.544 1.00 0.00 N ATOM 728 NH2 ARG A 47 5.344 2.944 21.275 1.00 0.00 N ATOM 0 H ARG A 47 5.579 0.146 14.405 1.00 0.00 H new ATOM 0 HA ARG A 47 5.586 -1.259 16.981 1.00 0.00 H new ATOM 0 HB2 ARG A 47 3.244 0.222 15.742 1.00 0.00 H new ATOM 0 HB3 ARG A 47 3.067 -0.985 17.000 1.00 0.00 H new ATOM 0 HG2 ARG A 47 4.701 1.556 17.305 1.00 0.00 H new ATOM 0 HG3 ARG A 47 3.030 1.395 17.807 1.00 0.00 H new ATOM 0 HD2 ARG A 47 3.741 -0.565 19.221 1.00 0.00 H new ATOM 0 HD3 ARG A 47 5.401 -0.159 18.834 1.00 0.00 H new ATOM 0 HE ARG A 47 3.581 1.309 20.609 1.00 0.00 H new ATOM 0 HH11 ARG A 47 6.593 1.370 18.775 1.00 0.00 H new ATOM 0 HH12 ARG A 47 7.298 2.668 19.743 1.00 0.00 H new ATOM 0 HH21 ARG A 47 4.499 2.979 21.845 1.00 0.00 H new ATOM 0 HH22 ARG A 47 6.120 3.576 21.474 1.00 0.00 H new ATOM 742 N VAL A 48 5.591 -3.036 15.098 1.00 0.00 N ATOM 743 CA VAL A 48 5.358 -4.251 14.328 1.00 0.00 C ATOM 744 C VAL A 48 4.836 -5.373 15.215 1.00 0.00 C ATOM 745 O VAL A 48 5.460 -5.728 16.216 1.00 0.00 O ATOM 746 CB VAL A 48 6.658 -4.707 13.640 1.00 0.00 C ATOM 747 CG1 VAL A 48 6.438 -6.018 12.900 1.00 0.00 C ATOM 748 CG2 VAL A 48 7.147 -3.626 12.688 1.00 0.00 C ATOM 0 H VAL A 48 6.531 -2.959 15.487 1.00 0.00 H new ATOM 0 HA VAL A 48 4.606 -4.024 13.572 1.00 0.00 H new ATOM 0 HB VAL A 48 7.421 -4.873 14.401 1.00 0.00 H new ATOM 0 HG11 VAL A 48 7.367 -6.325 12.420 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.123 -6.786 13.606 1.00 0.00 H new ATOM 0 HG13 VAL A 48 5.666 -5.883 12.143 1.00 0.00 H new ATOM 0 HG21 VAL A 48 8.067 -3.956 12.205 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.387 -3.437 11.930 1.00 0.00 H new ATOM 0 HG23 VAL A 48 7.338 -2.709 13.246 1.00 0.00 H new ATOM 758 N ILE A 49 3.688 -5.930 14.844 1.00 0.00 N ATOM 759 CA ILE A 49 3.100 -7.041 15.583 1.00 0.00 C ATOM 760 C ILE A 49 2.810 -8.221 14.665 1.00 0.00 C ATOM 761 O ILE A 49 1.745 -8.297 14.052 1.00 0.00 O ATOM 762 CB ILE A 49 1.801 -6.607 16.287 1.00 0.00 C ATOM 763 CG1 ILE A 49 2.035 -5.326 17.094 1.00 0.00 C ATOM 764 CG2 ILE A 49 1.287 -7.720 17.187 1.00 0.00 C ATOM 765 CD1 ILE A 49 0.772 -4.738 17.681 1.00 0.00 C ATOM 0 H ILE A 49 3.145 -5.629 14.034 1.00 0.00 H new ATOM 0 HA ILE A 49 3.826 -7.351 16.334 1.00 0.00 H new ATOM 0 HB ILE A 49 1.046 -6.403 15.528 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.736 -5.539 17.902 1.00 0.00 H new ATOM 0 HG13 ILE A 49 2.506 -4.583 16.451 1.00 0.00 H new ATOM 0 HG21 ILE A 49 0.369 -7.397 17.677 1.00 0.00 H new ATOM 0 HG22 ILE A 49 1.086 -8.608 16.588 1.00 0.00 H new ATOM 0 HG23 ILE A 49 2.038 -7.954 17.942 1.00 0.00 H new ATOM 0 HD11 ILE A 49 1.016 -3.834 18.238 1.00 0.00 H new ATOM 0 HD12 ILE A 49 0.077 -4.493 16.878 1.00 0.00 H new ATOM 0 HD13 ILE A 49 0.310 -5.463 18.351 1.00 0.00 H new ATOM 777 N PRO A 50 3.764 -9.141 14.572 1.00 0.00 N ATOM 778 CA PRO A 50 3.645 -10.281 13.671 1.00 0.00 C ATOM 779 C PRO A 50 2.386 -11.086 13.964 1.00 0.00 C ATOM 780 O PRO A 50 2.093 -11.399 15.118 1.00 0.00 O ATOM 781 CB PRO A 50 4.914 -11.088 13.966 1.00 0.00 C ATOM 782 CG PRO A 50 5.903 -10.065 14.410 1.00 0.00 C ATOM 783 CD PRO A 50 5.093 -9.089 15.221 1.00 0.00 C ATOM 0 HA PRO A 50 3.558 -9.995 12.623 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.740 -11.836 14.740 1.00 0.00 H new ATOM 0 HB3 PRO A 50 5.262 -11.621 13.081 1.00 0.00 H new ATOM 0 HG2 PRO A 50 6.698 -10.513 15.006 1.00 0.00 H new ATOM 0 HG3 PRO A 50 6.379 -9.577 13.560 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.042 -9.380 16.270 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.519 -8.086 15.189 1.00 0.00 H new ATOM 791 N GLY A 51 1.644 -11.419 12.913 1.00 0.00 N ATOM 792 CA GLY A 51 0.453 -12.247 13.048 1.00 0.00 C ATOM 793 C GLY A 51 -0.784 -11.395 13.305 1.00 0.00 C ATOM 794 O GLY A 51 -1.903 -11.907 13.352 1.00 0.00 O ATOM 0 H GLY A 51 1.848 -11.127 11.957 1.00 0.00 H new ATOM 0 HA2 GLY A 51 0.311 -12.835 12.141 1.00 0.00 H new ATOM 0 HA3 GLY A 51 0.588 -12.953 13.868 1.00 0.00 H new ATOM 798 N PHE A 52 -0.576 -10.094 13.471 1.00 0.00 N ATOM 799 CA PHE A 52 -1.674 -9.167 13.722 1.00 0.00 C ATOM 800 C PHE A 52 -1.636 -7.994 12.753 1.00 0.00 C ATOM 801 O PHE A 52 -2.306 -8.006 11.720 1.00 0.00 O ATOM 802 CB PHE A 52 -1.619 -8.651 15.160 1.00 0.00 C ATOM 803 CG PHE A 52 -1.928 -9.697 16.193 1.00 0.00 C ATOM 804 CD1 PHE A 52 -0.919 -10.493 16.717 1.00 0.00 C ATOM 805 CD2 PHE A 52 -3.225 -9.890 16.641 1.00 0.00 C ATOM 806 CE1 PHE A 52 -1.202 -11.457 17.667 1.00 0.00 C ATOM 807 CE2 PHE A 52 -3.511 -10.851 17.591 1.00 0.00 C ATOM 808 CZ PHE A 52 -2.497 -11.636 18.104 1.00 0.00 C ATOM 0 H PHE A 52 0.345 -9.656 13.436 1.00 0.00 H new ATOM 0 HA PHE A 52 -2.607 -9.709 13.571 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -0.626 -8.246 15.353 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.325 -7.828 15.268 1.00 0.00 H new ATOM 0 HD1 PHE A 52 0.098 -10.358 16.379 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -4.023 -9.281 16.242 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -0.408 -12.070 18.067 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -4.526 -10.988 17.932 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.718 -12.389 18.846 1.00 0.00 H new ATOM 818 N VAL A 53 -0.848 -6.979 13.092 1.00 0.00 N ATOM 819 CA VAL A 53 -0.732 -5.787 12.260 1.00 0.00 C ATOM 820 C VAL A 53 0.528 -5.000 12.596 1.00 0.00 C ATOM 821 O VAL A 53 0.896 -4.868 13.763 1.00 0.00 O ATOM 822 CB VAL A 53 -1.965 -4.882 12.448 1.00 0.00 C ATOM 823 CG1 VAL A 53 -2.067 -4.417 13.894 1.00 0.00 C ATOM 824 CG2 VAL A 53 -1.883 -3.692 11.503 1.00 0.00 C ATOM 0 H VAL A 53 -0.279 -6.958 13.939 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.672 -6.113 11.222 1.00 0.00 H new ATOM 0 HB VAL A 53 -2.863 -5.453 12.212 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -2.943 -3.779 14.010 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -2.160 -5.283 14.549 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -1.171 -3.856 14.160 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -2.758 -3.057 11.641 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -0.981 -3.119 11.717 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -1.852 -4.047 10.473 1.00 0.00 H new ATOM 834 N SER A 54 1.186 -4.478 11.566 1.00 0.00 N ATOM 835 CA SER A 54 2.367 -3.646 11.755 1.00 0.00 C ATOM 836 C SER A 54 2.069 -2.186 11.439 1.00 0.00 C ATOM 837 O SER A 54 1.442 -1.876 10.424 1.00 0.00 O ATOM 838 CB SER A 54 3.501 -4.141 10.878 1.00 0.00 C ATOM 839 OG SER A 54 3.077 -4.299 9.552 1.00 0.00 O ATOM 0 H SER A 54 0.920 -4.617 10.591 1.00 0.00 H new ATOM 0 HA SER A 54 2.663 -3.716 12.802 1.00 0.00 H new ATOM 0 HB2 SER A 54 4.331 -3.435 10.917 1.00 0.00 H new ATOM 0 HB3 SER A 54 3.873 -5.091 11.260 1.00 0.00 H new ATOM 0 HG SER A 54 3.855 -4.453 8.976 1.00 0.00 H new ATOM 845 N GLN A 55 2.520 -1.292 12.311 1.00 0.00 N ATOM 846 CA GLN A 55 2.331 0.140 12.109 1.00 0.00 C ATOM 847 C GLN A 55 3.664 0.847 11.898 1.00 0.00 C ATOM 848 O GLN A 55 4.605 0.661 12.668 1.00 0.00 O ATOM 849 CB GLN A 55 1.596 0.756 13.302 1.00 0.00 C ATOM 850 CG GLN A 55 1.243 2.223 13.124 1.00 0.00 C ATOM 851 CD GLN A 55 0.563 2.807 14.348 1.00 0.00 C ATOM 852 OE1 GLN A 55 0.345 2.113 15.344 1.00 0.00 O ATOM 853 NE2 GLN A 55 0.223 4.089 14.280 1.00 0.00 N ATOM 0 H GLN A 55 3.020 -1.534 13.166 1.00 0.00 H new ATOM 0 HA GLN A 55 1.727 0.273 11.211 1.00 0.00 H new ATOM 0 HB2 GLN A 55 0.680 0.192 13.481 1.00 0.00 H new ATOM 0 HB3 GLN A 55 2.216 0.648 14.192 1.00 0.00 H new ATOM 0 HG2 GLN A 55 2.150 2.789 12.911 1.00 0.00 H new ATOM 0 HG3 GLN A 55 0.588 2.334 12.260 1.00 0.00 H new ATOM 0 HE21 GLN A 55 0.423 4.625 13.436 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -0.238 4.537 15.072 1.00 0.00 H new ATOM 862 N GLY A 56 3.736 1.661 10.849 1.00 0.00 N ATOM 863 CA GLY A 56 4.966 2.366 10.511 1.00 0.00 C ATOM 864 C GLY A 56 4.679 3.798 10.080 1.00 0.00 C ATOM 865 O GLY A 56 3.528 4.237 10.076 1.00 0.00 O ATOM 0 H GLY A 56 2.956 1.848 10.219 1.00 0.00 H new ATOM 0 HA2 GLY A 56 5.635 2.370 11.372 1.00 0.00 H new ATOM 0 HA3 GLY A 56 5.482 1.838 9.709 1.00 0.00 H new ATOM 869 N GLY A 57 5.731 4.524 9.717 1.00 0.00 N ATOM 870 CA GLY A 57 5.590 5.901 9.257 1.00 0.00 C ATOM 871 C GLY A 57 6.664 6.796 9.860 1.00 0.00 C ATOM 872 O GLY A 57 6.554 8.022 9.829 1.00 0.00 O ATOM 0 H GLY A 57 6.692 4.181 9.732 1.00 0.00 H new ATOM 0 HA2 GLY A 57 5.655 5.932 8.169 1.00 0.00 H new ATOM 0 HA3 GLY A 57 4.604 6.279 9.528 1.00 0.00 H new ATOM 876 N CYS A 58 7.703 6.177 10.410 1.00 0.00 N ATOM 877 CA CYS A 58 8.750 6.911 11.112 1.00 0.00 C ATOM 878 C CYS A 58 10.073 6.837 10.360 1.00 0.00 C ATOM 879 O CYS A 58 10.336 5.872 9.642 1.00 0.00 O ATOM 880 CB CYS A 58 8.939 6.359 12.525 1.00 0.00 C ATOM 881 SG CYS A 58 7.456 6.444 13.556 1.00 0.00 S ATOM 0 H CYS A 58 7.843 5.167 10.383 1.00 0.00 H new ATOM 0 HA CYS A 58 8.437 7.953 11.170 1.00 0.00 H new ATOM 0 HB2 CYS A 58 9.262 5.320 12.457 1.00 0.00 H new ATOM 0 HB3 CYS A 58 9.741 6.911 13.015 1.00 0.00 H new ATOM 0 HG CYS A 58 6.776 5.343 13.430 1.00 0.00 H new ATOM 887 N PRO A 59 10.902 7.861 10.531 1.00 0.00 N ATOM 888 CA PRO A 59 12.192 7.922 9.855 1.00 0.00 C ATOM 889 C PRO A 59 13.238 7.091 10.587 1.00 0.00 C ATOM 890 O PRO A 59 14.234 6.670 9.998 1.00 0.00 O ATOM 891 CB PRO A 59 12.531 9.416 9.893 1.00 0.00 C ATOM 892 CG PRO A 59 11.937 9.893 11.174 1.00 0.00 C ATOM 893 CD PRO A 59 10.656 9.112 11.307 1.00 0.00 C ATOM 0 HA PRO A 59 12.168 7.517 8.843 1.00 0.00 H new ATOM 0 HB2 PRO A 59 13.608 9.581 9.868 1.00 0.00 H new ATOM 0 HB3 PRO A 59 12.108 9.942 9.037 1.00 0.00 H new ATOM 0 HG2 PRO A 59 12.605 9.707 12.015 1.00 0.00 H new ATOM 0 HG3 PRO A 59 11.747 10.966 11.149 1.00 0.00 H new ATOM 0 HD2 PRO A 59 10.430 8.894 12.351 1.00 0.00 H new ATOM 0 HD3 PRO A 59 9.808 9.668 10.907 1.00 0.00 H new ATOM 901 N ARG A 60 13.006 6.856 11.873 1.00 0.00 N ATOM 902 CA ARG A 60 13.942 6.098 12.696 1.00 0.00 C ATOM 903 C ARG A 60 13.259 4.902 13.346 1.00 0.00 C ATOM 904 O ARG A 60 13.919 3.951 13.766 1.00 0.00 O ATOM 905 CB ARG A 60 14.545 6.984 13.775 1.00 0.00 C ATOM 906 CG ARG A 60 15.349 8.166 13.259 1.00 0.00 C ATOM 907 CD ARG A 60 15.934 8.960 14.368 1.00 0.00 C ATOM 908 NE ARG A 60 16.664 10.119 13.880 1.00 0.00 N ATOM 909 CZ ARG A 60 17.292 11.016 14.667 1.00 0.00 C ATOM 910 NH1 ARG A 60 17.271 10.872 15.973 1.00 0.00 N ATOM 911 NH2 ARG A 60 17.929 12.038 14.124 1.00 0.00 N ATOM 0 H ARG A 60 12.176 7.180 12.370 1.00 0.00 H new ATOM 0 HA ARG A 60 14.735 5.736 12.042 1.00 0.00 H new ATOM 0 HB2 ARG A 60 13.741 7.359 14.408 1.00 0.00 H new ATOM 0 HB3 ARG A 60 15.190 6.373 14.407 1.00 0.00 H new ATOM 0 HG2 ARG A 60 16.147 7.807 12.609 1.00 0.00 H new ATOM 0 HG3 ARG A 60 14.707 8.806 12.653 1.00 0.00 H new ATOM 0 HD2 ARG A 60 15.139 9.288 15.038 1.00 0.00 H new ATOM 0 HD3 ARG A 60 16.604 8.329 14.952 1.00 0.00 H new ATOM 0 HE ARG A 60 16.704 10.264 12.871 1.00 0.00 H new ATOM 0 HH11 ARG A 60 16.780 10.082 16.391 1.00 0.00 H new ATOM 0 HH12 ARG A 60 17.746 11.550 16.569 1.00 0.00 H new ATOM 0 HH21 ARG A 60 17.946 12.148 13.110 1.00 0.00 H new ATOM 0 HH22 ARG A 60 18.404 12.717 14.719 1.00 0.00 H new ATOM 925 N GLY A 61 11.934 4.955 13.428 1.00 0.00 N ATOM 926 CA GLY A 61 11.166 3.924 14.116 1.00 0.00 C ATOM 927 C GLY A 61 11.011 4.246 15.596 1.00 0.00 C ATOM 928 O GLY A 61 10.764 3.359 16.412 1.00 0.00 O ATOM 0 H GLY A 61 11.369 5.703 13.026 1.00 0.00 H new ATOM 0 HA2 GLY A 61 10.182 3.833 13.656 1.00 0.00 H new ATOM 0 HA3 GLY A 61 11.662 2.960 14.001 1.00 0.00 H new ATOM 932 N ASN A 62 11.158 5.522 15.936 1.00 0.00 N ATOM 933 CA ASN A 62 11.136 5.950 17.330 1.00 0.00 C ATOM 934 C ASN A 62 9.741 6.400 17.746 1.00 0.00 C ATOM 935 O ASN A 62 9.540 6.884 18.860 1.00 0.00 O ATOM 936 CB ASN A 62 12.146 7.058 17.564 1.00 0.00 C ATOM 937 CG ASN A 62 11.820 8.310 16.796 1.00 0.00 C ATOM 938 OD1 ASN A 62 10.844 8.351 16.038 1.00 0.00 O ATOM 939 ND2 ASN A 62 12.617 9.331 16.979 1.00 0.00 N ATOM 0 H ASN A 62 11.294 6.278 15.265 1.00 0.00 H new ATOM 0 HA ASN A 62 11.410 5.095 17.948 1.00 0.00 H new ATOM 0 HB2 ASN A 62 12.186 7.289 18.628 1.00 0.00 H new ATOM 0 HB3 ASN A 62 13.137 6.708 17.276 1.00 0.00 H new ATOM 0 HD21 ASN A 62 12.445 10.207 16.486 1.00 0.00 H new ATOM 0 HD22 ASN A 62 13.411 9.251 17.615 1.00 0.00 H new ATOM 946 N GLY A 63 8.779 6.236 16.844 1.00 0.00 N ATOM 947 CA GLY A 63 7.383 6.525 17.152 1.00 0.00 C ATOM 948 C GLY A 63 6.983 7.907 16.653 1.00 0.00 C ATOM 949 O GLY A 63 5.810 8.279 16.700 1.00 0.00 O ATOM 0 H GLY A 63 8.941 5.904 15.893 1.00 0.00 H new ATOM 0 HA2 GLY A 63 6.743 5.771 16.694 1.00 0.00 H new ATOM 0 HA3 GLY A 63 7.226 6.465 18.229 1.00 0.00 H new ATOM 953 N THR A 64 7.963 8.665 16.176 1.00 0.00 N ATOM 954 CA THR A 64 7.710 9.995 15.634 1.00 0.00 C ATOM 955 C THR A 64 7.574 9.955 14.118 1.00 0.00 C ATOM 956 O THR A 64 8.484 9.516 13.415 1.00 0.00 O ATOM 957 CB THR A 64 8.829 10.976 16.028 1.00 0.00 C ATOM 958 OG1 THR A 64 8.892 11.086 17.456 1.00 0.00 O ATOM 959 CG2 THR A 64 8.570 12.351 15.430 1.00 0.00 C ATOM 0 H THR A 64 8.942 8.381 16.153 1.00 0.00 H new ATOM 0 HA THR A 64 6.770 10.344 16.061 1.00 0.00 H new ATOM 0 HB THR A 64 9.775 10.596 15.643 1.00 0.00 H new ATOM 0 HG1 THR A 64 9.606 11.709 17.705 1.00 0.00 H new ATOM 0 HG21 THR A 64 9.372 13.031 15.720 1.00 0.00 H new ATOM 0 HG22 THR A 64 8.534 12.274 14.343 1.00 0.00 H new ATOM 0 HG23 THR A 64 7.618 12.735 15.798 1.00 0.00 H new ATOM 967 N GLY A 65 6.433 10.418 13.619 1.00 0.00 N ATOM 968 CA GLY A 65 6.161 10.405 12.186 1.00 0.00 C ATOM 969 C GLY A 65 7.119 11.321 11.435 1.00 0.00 C ATOM 970 O GLY A 65 7.477 12.393 11.922 1.00 0.00 O ATOM 0 H GLY A 65 5.680 10.808 14.187 1.00 0.00 H new ATOM 0 HA2 GLY A 65 6.253 9.388 11.805 1.00 0.00 H new ATOM 0 HA3 GLY A 65 5.134 10.722 12.005 1.00 0.00 H new ATOM 974 N ASP A 66 7.531 10.892 10.247 1.00 0.00 N ATOM 975 CA ASP A 66 8.464 11.664 9.435 1.00 0.00 C ATOM 976 C ASP A 66 7.768 12.842 8.766 1.00 0.00 C ATOM 977 O ASP A 66 8.004 13.997 9.119 1.00 0.00 O ATOM 978 CB ASP A 66 9.112 10.775 8.372 1.00 0.00 C ATOM 979 CG ASP A 66 10.126 11.520 7.513 1.00 0.00 C ATOM 980 OD1 ASP A 66 10.340 12.684 7.757 1.00 0.00 O ATOM 981 OD2 ASP A 66 10.676 10.918 6.622 1.00 0.00 O ATOM 0 H ASP A 66 7.233 10.013 9.825 1.00 0.00 H new ATOM 0 HA ASP A 66 9.238 12.051 10.098 1.00 0.00 H new ATOM 0 HB2 ASP A 66 9.605 9.934 8.860 1.00 0.00 H new ATOM 0 HB3 ASP A 66 8.335 10.360 7.730 1.00 0.00 H new ATOM 986 N ALA A 67 6.910 12.543 7.796 1.00 0.00 N ATOM 987 CA ALA A 67 6.284 13.576 6.981 1.00 0.00 C ATOM 988 C ALA A 67 5.322 14.422 7.806 1.00 0.00 C ATOM 989 O ALA A 67 5.380 15.651 7.777 1.00 0.00 O ATOM 990 CB ALA A 67 5.557 12.951 5.799 1.00 0.00 C ATOM 0 H ALA A 67 6.632 11.591 7.555 1.00 0.00 H new ATOM 0 HA ALA A 67 7.071 14.230 6.606 1.00 0.00 H new ATOM 0 HB1 ALA A 67 5.095 13.736 5.200 1.00 0.00 H new ATOM 0 HB2 ALA A 67 6.268 12.398 5.186 1.00 0.00 H new ATOM 0 HB3 ALA A 67 4.787 12.271 6.164 1.00 0.00 H new ATOM 996 N GLY A 68 4.440 13.755 8.543 1.00 0.00 N ATOM 997 CA GLY A 68 3.468 14.446 9.385 1.00 0.00 C ATOM 998 C GLY A 68 2.334 15.028 8.551 1.00 0.00 C ATOM 999 O GLY A 68 1.621 15.927 8.998 1.00 0.00 O ATOM 0 H GLY A 68 4.378 12.737 8.575 1.00 0.00 H new ATOM 0 HA2 GLY A 68 3.063 13.752 10.122 1.00 0.00 H new ATOM 0 HA3 GLY A 68 3.964 15.244 9.938 1.00 0.00 H new ATOM 1003 N TYR A 69 2.172 14.511 7.338 1.00 0.00 N ATOM 1004 CA TYR A 69 1.130 14.986 6.436 1.00 0.00 C ATOM 1005 C TYR A 69 -0.255 14.601 6.941 1.00 0.00 C ATOM 1006 O TYR A 69 -0.420 13.578 7.606 1.00 0.00 O ATOM 1007 CB TYR A 69 1.351 14.436 5.024 1.00 0.00 C ATOM 1008 CG TYR A 69 2.575 14.997 4.335 1.00 0.00 C ATOM 1009 CD1 TYR A 69 3.356 15.949 4.976 1.00 0.00 C ATOM 1010 CD2 TYR A 69 2.917 14.560 3.064 1.00 0.00 C ATOM 1011 CE1 TYR A 69 4.474 16.462 4.346 1.00 0.00 C ATOM 1012 CE2 TYR A 69 4.035 15.072 2.436 1.00 0.00 C ATOM 1013 CZ TYR A 69 4.812 16.019 3.071 1.00 0.00 C ATOM 1014 OH TYR A 69 5.925 16.530 2.445 1.00 0.00 O ATOM 0 H TYR A 69 2.750 13.762 6.957 1.00 0.00 H new ATOM 0 HA TYR A 69 1.188 16.074 6.403 1.00 0.00 H new ATOM 0 HB2 TYR A 69 1.441 13.351 5.077 1.00 0.00 H new ATOM 0 HB3 TYR A 69 0.472 14.654 4.417 1.00 0.00 H new ATOM 0 HD1 TYR A 69 3.090 16.288 5.966 1.00 0.00 H new ATOM 0 HD2 TYR A 69 2.309 13.819 2.566 1.00 0.00 H new ATOM 0 HE1 TYR A 69 5.083 17.204 4.841 1.00 0.00 H new ATOM 0 HE2 TYR A 69 4.302 14.731 1.447 1.00 0.00 H new ATOM 0 HH TYR A 69 6.170 15.953 1.692 1.00 0.00 H new ATOM 1024 N THR A 70 -1.246 15.426 6.623 1.00 0.00 N ATOM 1025 CA THR A 70 -2.618 15.175 7.048 1.00 0.00 C ATOM 1026 C THR A 70 -3.376 14.361 6.007 1.00 0.00 C ATOM 1027 O THR A 70 -3.458 14.748 4.841 1.00 0.00 O ATOM 1028 CB THR A 70 -3.365 16.494 7.318 1.00 0.00 C ATOM 1029 OG1 THR A 70 -2.695 17.222 8.356 1.00 0.00 O ATOM 1030 CG2 THR A 70 -4.799 16.218 7.742 1.00 0.00 C ATOM 0 H THR A 70 -1.125 16.275 6.072 1.00 0.00 H new ATOM 0 HA THR A 70 -2.570 14.602 7.974 1.00 0.00 H new ATOM 0 HB THR A 70 -3.375 17.082 6.400 1.00 0.00 H new ATOM 0 HG1 THR A 70 -3.170 18.062 8.526 1.00 0.00 H new ATOM 0 HG21 THR A 70 -5.311 17.162 7.929 1.00 0.00 H new ATOM 0 HG22 THR A 70 -5.315 15.676 6.950 1.00 0.00 H new ATOM 0 HG23 THR A 70 -4.800 15.618 8.652 1.00 0.00 H new ATOM 1038 N ILE A 71 -3.930 13.232 6.435 1.00 0.00 N ATOM 1039 CA ILE A 71 -4.679 12.359 5.540 1.00 0.00 C ATOM 1040 C ILE A 71 -6.169 12.390 5.859 1.00 0.00 C ATOM 1041 O ILE A 71 -6.571 12.209 7.008 1.00 0.00 O ATOM 1042 CB ILE A 71 -4.165 10.910 5.629 1.00 0.00 C ATOM 1043 CG1 ILE A 71 -2.664 10.858 5.337 1.00 0.00 C ATOM 1044 CG2 ILE A 71 -4.929 10.015 4.664 1.00 0.00 C ATOM 1045 CD1 ILE A 71 -2.292 11.343 3.955 1.00 0.00 C ATOM 0 H ILE A 71 -3.874 12.900 7.398 1.00 0.00 H new ATOM 0 HA ILE A 71 -4.529 12.729 4.526 1.00 0.00 H new ATOM 0 HB ILE A 71 -4.332 10.544 6.642 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -2.139 11.462 6.077 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -2.316 9.832 5.457 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -4.553 8.995 4.739 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -5.990 10.031 4.915 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -4.792 10.378 3.645 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -1.212 11.275 3.824 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -2.788 10.724 3.207 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -2.608 12.379 3.836 1.00 0.00 H new ATOM 1057 N PRO A 72 -6.983 12.621 4.834 1.00 0.00 N ATOM 1058 CA PRO A 72 -8.431 12.652 5.000 1.00 0.00 C ATOM 1059 C PRO A 72 -9.010 11.245 5.068 1.00 0.00 C ATOM 1060 O PRO A 72 -8.439 10.302 4.520 1.00 0.00 O ATOM 1061 CB PRO A 72 -8.905 13.396 3.747 1.00 0.00 C ATOM 1062 CG PRO A 72 -7.923 13.004 2.696 1.00 0.00 C ATOM 1063 CD PRO A 72 -6.605 12.942 3.420 1.00 0.00 C ATOM 0 HA PRO A 72 -8.748 13.132 5.926 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -9.919 13.107 3.472 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -8.912 14.475 3.903 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -8.178 12.042 2.253 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -7.897 13.732 1.885 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -5.953 12.177 2.998 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -6.069 13.889 3.355 1.00 0.00 H new ATOM 1071 N CYS A 73 -10.145 11.110 5.745 1.00 0.00 N ATOM 1072 CA CYS A 73 -10.853 9.836 5.806 1.00 0.00 C ATOM 1073 C CYS A 73 -11.771 9.659 4.603 1.00 0.00 C ATOM 1074 O CYS A 73 -12.641 10.490 4.346 1.00 0.00 O ATOM 1075 CB CYS A 73 -11.679 9.741 7.090 1.00 0.00 C ATOM 1076 SG CYS A 73 -12.635 8.213 7.241 1.00 0.00 S ATOM 0 H CYS A 73 -10.595 11.867 6.259 1.00 0.00 H new ATOM 0 HA CYS A 73 -10.104 9.044 5.797 1.00 0.00 H new ATOM 0 HB2 CYS A 73 -11.010 9.825 7.947 1.00 0.00 H new ATOM 0 HB3 CYS A 73 -12.361 10.590 7.134 1.00 0.00 H new ATOM 0 HG CYS A 73 -13.298 8.225 8.359 1.00 0.00 H new ATOM 1082 N GLU A 74 -11.572 8.569 3.870 1.00 0.00 N ATOM 1083 CA GLU A 74 -12.377 8.283 2.689 1.00 0.00 C ATOM 1084 C GLU A 74 -13.149 6.979 2.850 1.00 0.00 C ATOM 1085 O GLU A 74 -12.594 5.969 3.282 1.00 0.00 O ATOM 1086 CB GLU A 74 -11.490 8.211 1.443 1.00 0.00 C ATOM 1087 CG GLU A 74 -10.867 9.539 1.038 1.00 0.00 C ATOM 1088 CD GLU A 74 -10.027 9.436 -0.205 1.00 0.00 C ATOM 1089 OE1 GLU A 74 -9.032 8.753 -0.173 1.00 0.00 O ATOM 1090 OE2 GLU A 74 -10.382 10.042 -1.189 1.00 0.00 O ATOM 0 H GLU A 74 -10.859 7.868 4.074 1.00 0.00 H new ATOM 0 HA GLU A 74 -13.095 9.095 2.572 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -10.693 7.489 1.620 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -12.084 7.833 0.611 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -11.658 10.271 0.876 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.251 9.911 1.857 1.00 0.00 H new ATOM 1097 N THR A 75 -14.430 7.009 2.500 1.00 0.00 N ATOM 1098 CA THR A 75 -15.276 5.826 2.590 1.00 0.00 C ATOM 1099 C THR A 75 -15.854 5.457 1.230 1.00 0.00 C ATOM 1100 O THR A 75 -16.425 4.380 1.058 1.00 0.00 O ATOM 1101 CB THR A 75 -16.420 6.037 3.599 1.00 0.00 C ATOM 1102 OG1 THR A 75 -17.247 7.125 3.167 1.00 0.00 O ATOM 1103 CG2 THR A 75 -15.862 6.346 4.981 1.00 0.00 C ATOM 0 H THR A 75 -14.905 7.841 2.151 1.00 0.00 H new ATOM 0 HA THR A 75 -14.647 5.006 2.937 1.00 0.00 H new ATOM 0 HB THR A 75 -17.010 5.122 3.653 1.00 0.00 H new ATOM 0 HG1 THR A 75 -17.976 7.257 3.809 1.00 0.00 H new ATOM 0 HG21 THR A 75 -16.685 6.492 5.681 1.00 0.00 H new ATOM 0 HG22 THR A 75 -15.242 5.515 5.317 1.00 0.00 H new ATOM 0 HG23 THR A 75 -15.259 7.253 4.935 1.00 0.00 H new ATOM 1111 N ASP A 76 -15.704 6.359 0.266 1.00 0.00 N ATOM 1112 CA ASP A 76 -16.214 6.131 -1.081 1.00 0.00 C ATOM 1113 C ASP A 76 -15.078 5.918 -2.073 1.00 0.00 C ATOM 1114 O ASP A 76 -13.988 6.467 -1.910 1.00 0.00 O ATOM 1115 CB ASP A 76 -17.079 7.311 -1.534 1.00 0.00 C ATOM 1116 CG ASP A 76 -18.362 7.450 -0.727 1.00 0.00 C ATOM 1117 OD1 ASP A 76 -19.050 6.469 -0.568 1.00 0.00 O ATOM 1118 OD2 ASP A 76 -18.643 8.534 -0.277 1.00 0.00 O ATOM 0 H ASP A 76 -15.233 7.255 0.392 1.00 0.00 H new ATOM 0 HA ASP A 76 -16.823 5.228 -1.054 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -16.501 8.232 -1.450 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -17.330 7.187 -2.587 1.00 0.00 H new ATOM 1123 N ASN A 77 -15.337 5.116 -3.099 1.00 0.00 N ATOM 1124 CA ASN A 77 -16.669 4.567 -3.325 1.00 0.00 C ATOM 1125 C ASN A 77 -16.778 3.146 -2.785 1.00 0.00 C ATOM 1126 O ASN A 77 -17.849 2.716 -2.356 1.00 0.00 O ATOM 1127 CB ASN A 77 -17.019 4.605 -4.801 1.00 0.00 C ATOM 1128 CG ASN A 77 -17.246 6.003 -5.305 1.00 0.00 C ATOM 1129 OD1 ASN A 77 -18.234 6.653 -4.945 1.00 0.00 O ATOM 1130 ND2 ASN A 77 -16.350 6.479 -6.131 1.00 0.00 N ATOM 0 H ASN A 77 -14.641 4.831 -3.788 1.00 0.00 H new ATOM 0 HA ASN A 77 -17.383 5.187 -2.783 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -16.215 4.142 -5.373 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -17.916 4.010 -4.973 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -16.451 7.422 -6.505 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -15.550 5.907 -6.401 1.00 0.00 H new ATOM 1137 N ASN A 78 -15.665 2.422 -2.809 1.00 0.00 N ATOM 1138 CA ASN A 78 -15.638 1.042 -2.339 1.00 0.00 C ATOM 1139 C ASN A 78 -15.344 0.975 -0.846 1.00 0.00 C ATOM 1140 O ASN A 78 -14.655 1.837 -0.299 1.00 0.00 O ATOM 1141 CB ASN A 78 -14.620 0.232 -3.121 1.00 0.00 C ATOM 1142 CG ASN A 78 -15.059 -0.040 -4.533 1.00 0.00 C ATOM 1143 OD1 ASN A 78 -16.251 0.041 -4.852 1.00 0.00 O ATOM 1144 ND2 ASN A 78 -14.120 -0.360 -5.385 1.00 0.00 N ATOM 0 H ASN A 78 -14.768 2.768 -3.149 1.00 0.00 H new ATOM 0 HA ASN A 78 -16.625 0.611 -2.506 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -13.670 0.767 -3.136 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -14.445 -0.715 -2.610 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -14.358 -0.555 -6.357 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -13.149 -0.415 -5.077 1.00 0.00 H new ATOM 1151 N PRO A 79 -15.870 -0.054 -0.191 1.00 0.00 N ATOM 1152 CA PRO A 79 -15.686 -0.223 1.246 1.00 0.00 C ATOM 1153 C PRO A 79 -14.277 -0.703 1.568 1.00 0.00 C ATOM 1154 O PRO A 79 -13.504 -1.039 0.670 1.00 0.00 O ATOM 1155 CB PRO A 79 -16.738 -1.277 1.607 1.00 0.00 C ATOM 1156 CG PRO A 79 -16.879 -2.092 0.367 1.00 0.00 C ATOM 1157 CD PRO A 79 -16.767 -1.093 -0.753 1.00 0.00 C ATOM 0 HA PRO A 79 -15.803 0.703 1.808 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -16.417 -1.888 2.451 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -17.684 -0.815 1.890 1.00 0.00 H new ATOM 0 HG2 PRO A 79 -16.101 -2.852 0.301 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -17.836 -2.613 0.341 1.00 0.00 H new ATOM 0 HD2 PRO A 79 -16.348 -1.543 -1.653 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -17.739 -0.682 -1.025 1.00 0.00 H new ATOM 1165 N HIS A 80 -13.947 -0.733 2.854 1.00 0.00 N ATOM 1166 CA HIS A 80 -12.595 -1.058 3.292 1.00 0.00 C ATOM 1167 C HIS A 80 -12.577 -2.332 4.127 1.00 0.00 C ATOM 1168 O HIS A 80 -13.512 -2.606 4.880 1.00 0.00 O ATOM 1169 CB HIS A 80 -11.995 0.097 4.099 1.00 0.00 C ATOM 1170 CG HIS A 80 -11.969 1.398 3.360 1.00 0.00 C ATOM 1171 ND1 HIS A 80 -11.040 1.680 2.381 1.00 0.00 N ATOM 1172 CD2 HIS A 80 -12.759 2.494 3.456 1.00 0.00 C ATOM 1173 CE1 HIS A 80 -11.260 2.894 1.905 1.00 0.00 C ATOM 1174 NE2 HIS A 80 -12.296 3.409 2.541 1.00 0.00 N ATOM 0 H HIS A 80 -14.599 -0.536 3.613 1.00 0.00 H new ATOM 0 HA HIS A 80 -11.991 -1.220 2.399 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -12.568 0.223 5.018 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -10.978 -0.165 4.391 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -13.596 2.624 4.126 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -10.689 3.381 1.128 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -12.689 4.336 2.379 1.00 0.00 H new ATOM 1181 N ARG A 81 -11.507 -3.108 3.990 1.00 0.00 N ATOM 1182 CA ARG A 81 -11.359 -4.347 4.745 1.00 0.00 C ATOM 1183 C ARG A 81 -9.937 -4.503 5.271 1.00 0.00 C ATOM 1184 O ARG A 81 -8.970 -4.377 4.520 1.00 0.00 O ATOM 1185 CB ARG A 81 -11.710 -5.548 3.879 1.00 0.00 C ATOM 1186 CG ARG A 81 -13.163 -5.612 3.437 1.00 0.00 C ATOM 1187 CD ARG A 81 -14.073 -5.900 4.576 1.00 0.00 C ATOM 1188 NE ARG A 81 -15.449 -6.074 4.140 1.00 0.00 N ATOM 1189 CZ ARG A 81 -16.338 -5.073 3.993 1.00 0.00 C ATOM 1190 NH1 ARG A 81 -15.980 -3.834 4.249 1.00 0.00 N ATOM 1191 NH2 ARG A 81 -17.569 -5.335 3.590 1.00 0.00 N ATOM 0 H ARG A 81 -10.729 -2.901 3.363 1.00 0.00 H new ATOM 0 HA ARG A 81 -12.044 -4.299 5.591 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -11.075 -5.537 2.993 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -11.472 -6.458 4.430 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -13.445 -4.665 2.977 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -13.278 -6.383 2.676 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -13.738 -6.801 5.089 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -14.021 -5.084 5.297 1.00 0.00 H new ATOM 0 HE ARG A 81 -15.763 -7.021 3.931 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -15.029 -3.631 4.559 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -16.653 -3.075 4.138 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -17.847 -6.296 3.390 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -18.242 -4.576 3.479 1.00 0.00 H new ATOM 1205 N HIS A 82 -9.817 -4.779 6.565 1.00 0.00 N ATOM 1206 CA HIS A 82 -8.515 -4.985 7.187 1.00 0.00 C ATOM 1207 C HIS A 82 -8.250 -6.465 7.430 1.00 0.00 C ATOM 1208 O HIS A 82 -8.460 -6.971 8.533 1.00 0.00 O ATOM 1209 CB HIS A 82 -8.420 -4.220 8.511 1.00 0.00 C ATOM 1210 CG HIS A 82 -8.236 -2.743 8.340 1.00 0.00 C ATOM 1211 ND1 HIS A 82 -9.232 -1.920 7.861 1.00 0.00 N ATOM 1212 CD2 HIS A 82 -7.170 -1.944 8.582 1.00 0.00 C ATOM 1213 CE1 HIS A 82 -8.788 -0.676 7.818 1.00 0.00 C ATOM 1214 NE2 HIS A 82 -7.540 -0.664 8.249 1.00 0.00 N ATOM 0 H HIS A 82 -10.607 -4.865 7.204 1.00 0.00 H new ATOM 0 HA HIS A 82 -7.759 -4.604 6.500 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -9.326 -4.400 9.090 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -7.587 -4.617 9.091 1.00 0.00 H new ATOM 0 HD1 HIS A 82 -10.165 -2.223 7.583 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -6.209 -2.255 8.965 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -9.350 0.184 7.487 1.00 0.00 H new ATOM 1221 N VAL A 83 -7.786 -7.157 6.395 1.00 0.00 N ATOM 1222 CA VAL A 83 -7.454 -8.572 6.504 1.00 0.00 C ATOM 1223 C VAL A 83 -6.024 -8.839 6.052 1.00 0.00 C ATOM 1224 O VAL A 83 -5.308 -7.922 5.651 1.00 0.00 O ATOM 1225 CB VAL A 83 -8.424 -9.415 5.656 1.00 0.00 C ATOM 1226 CG1 VAL A 83 -9.851 -9.253 6.158 1.00 0.00 C ATOM 1227 CG2 VAL A 83 -8.317 -9.011 4.193 1.00 0.00 C ATOM 0 H VAL A 83 -7.631 -6.759 5.469 1.00 0.00 H new ATOM 0 HA VAL A 83 -7.546 -8.854 7.553 1.00 0.00 H new ATOM 0 HB VAL A 83 -8.152 -10.467 5.748 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -10.522 -9.856 5.547 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -9.911 -9.582 7.195 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -10.143 -8.205 6.092 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -9.006 -9.611 3.598 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -8.571 -7.956 4.087 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -7.298 -9.176 3.844 1.00 0.00 H new ATOM 1237 N THR A 84 -5.614 -10.101 6.120 1.00 0.00 N ATOM 1238 CA THR A 84 -4.279 -10.496 5.688 1.00 0.00 C ATOM 1239 C THR A 84 -3.926 -9.871 4.344 1.00 0.00 C ATOM 1240 O THR A 84 -4.503 -10.221 3.315 1.00 0.00 O ATOM 1241 CB THR A 84 -4.158 -12.028 5.591 1.00 0.00 C ATOM 1242 OG1 THR A 84 -4.444 -12.614 6.868 1.00 0.00 O ATOM 1243 CG2 THR A 84 -2.757 -12.427 5.156 1.00 0.00 C ATOM 0 H THR A 84 -6.188 -10.868 6.470 1.00 0.00 H new ATOM 0 HA THR A 84 -3.578 -10.133 6.439 1.00 0.00 H new ATOM 0 HB THR A 84 -4.872 -12.387 4.850 1.00 0.00 H new ATOM 0 HG1 THR A 84 -3.710 -12.421 7.488 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.691 -13.513 5.093 1.00 0.00 H new ATOM 0 HG22 THR A 84 -2.542 -11.993 4.179 1.00 0.00 H new ATOM 0 HG23 THR A 84 -2.032 -12.061 5.883 1.00 0.00 H new ATOM 1251 N GLY A 85 -2.976 -8.942 4.361 1.00 0.00 N ATOM 1252 CA GLY A 85 -2.530 -8.280 3.140 1.00 0.00 C ATOM 1253 C GLY A 85 -3.396 -7.069 2.822 1.00 0.00 C ATOM 1254 O GLY A 85 -3.980 -6.977 1.742 1.00 0.00 O ATOM 0 H GLY A 85 -2.500 -8.630 5.207 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -1.491 -7.968 3.251 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -2.565 -8.984 2.308 1.00 0.00 H new ATOM 1258 N ALA A 86 -3.477 -6.141 3.769 1.00 0.00 N ATOM 1259 CA ALA A 86 -4.191 -4.887 3.555 1.00 0.00 C ATOM 1260 C ALA A 86 -3.375 -3.697 4.043 1.00 0.00 C ATOM 1261 O ALA A 86 -2.636 -3.799 5.023 1.00 0.00 O ATOM 1262 CB ALA A 86 -5.544 -4.922 4.251 1.00 0.00 C ATOM 0 H ALA A 86 -3.057 -6.233 4.694 1.00 0.00 H new ATOM 0 HA ALA A 86 -4.349 -4.769 2.483 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -6.065 -3.979 4.082 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -6.139 -5.742 3.849 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -5.399 -5.070 5.321 1.00 0.00 H new ATOM 1268 N MET A 87 -3.512 -2.569 3.355 1.00 0.00 N ATOM 1269 CA MET A 87 -2.748 -1.372 3.685 1.00 0.00 C ATOM 1270 C MET A 87 -3.661 -0.161 3.836 1.00 0.00 C ATOM 1271 O MET A 87 -4.390 0.197 2.911 1.00 0.00 O ATOM 1272 CB MET A 87 -1.687 -1.111 2.619 1.00 0.00 C ATOM 1273 CG MET A 87 -0.735 -2.274 2.380 1.00 0.00 C ATOM 1274 SD MET A 87 0.427 -1.957 1.037 1.00 0.00 S ATOM 1275 CE MET A 87 1.424 -0.654 1.754 1.00 0.00 C ATOM 0 H MET A 87 -4.146 -2.459 2.564 1.00 0.00 H new ATOM 0 HA MET A 87 -2.252 -1.539 4.641 1.00 0.00 H new ATOM 0 HB2 MET A 87 -2.185 -0.866 1.681 1.00 0.00 H new ATOM 0 HB3 MET A 87 -1.106 -0.236 2.909 1.00 0.00 H new ATOM 0 HG2 MET A 87 -0.179 -2.477 3.295 1.00 0.00 H new ATOM 0 HG3 MET A 87 -1.312 -3.170 2.152 1.00 0.00 H new ATOM 0 HE1 MET A 87 2.396 -0.627 1.262 1.00 0.00 H new ATOM 0 HE2 MET A 87 0.922 0.304 1.619 1.00 0.00 H new ATOM 0 HE3 MET A 87 1.562 -0.845 2.818 1.00 0.00 H new ATOM 1285 N SER A 88 -3.614 0.466 5.006 1.00 0.00 N ATOM 1286 CA SER A 88 -4.473 1.609 5.297 1.00 0.00 C ATOM 1287 C SER A 88 -3.693 2.723 5.984 1.00 0.00 C ATOM 1288 O SER A 88 -2.654 2.479 6.597 1.00 0.00 O ATOM 1289 CB SER A 88 -5.635 1.180 6.171 1.00 0.00 C ATOM 1290 OG SER A 88 -5.189 0.771 7.435 1.00 0.00 O ATOM 0 H SER A 88 -2.990 0.202 5.769 1.00 0.00 H new ATOM 0 HA SER A 88 -4.855 1.992 4.351 1.00 0.00 H new ATOM 0 HB2 SER A 88 -6.338 2.006 6.279 1.00 0.00 H new ATOM 0 HB3 SER A 88 -6.174 0.364 5.690 1.00 0.00 H new ATOM 0 HG SER A 88 -5.819 0.121 7.810 1.00 0.00 H new ATOM 1296 N MET A 89 -4.200 3.946 5.877 1.00 0.00 N ATOM 1297 CA MET A 89 -3.594 5.089 6.551 1.00 0.00 C ATOM 1298 C MET A 89 -4.266 5.357 7.892 1.00 0.00 C ATOM 1299 O MET A 89 -5.486 5.258 8.016 1.00 0.00 O ATOM 1300 CB MET A 89 -3.668 6.326 5.660 1.00 0.00 C ATOM 1301 CG MET A 89 -2.878 6.218 4.363 1.00 0.00 C ATOM 1302 SD MET A 89 -1.118 5.936 4.644 1.00 0.00 S ATOM 1303 CE MET A 89 -0.640 7.494 5.385 1.00 0.00 C ATOM 0 H MET A 89 -5.030 4.172 5.329 1.00 0.00 H new ATOM 0 HA MET A 89 -2.547 4.854 6.743 1.00 0.00 H new ATOM 0 HB2 MET A 89 -4.713 6.523 5.419 1.00 0.00 H new ATOM 0 HB3 MET A 89 -3.303 7.186 6.222 1.00 0.00 H new ATOM 0 HG2 MET A 89 -3.282 5.402 3.763 1.00 0.00 H new ATOM 0 HG3 MET A 89 -3.008 7.133 3.785 1.00 0.00 H new ATOM 0 HE1 MET A 89 0.437 7.502 5.551 1.00 0.00 H new ATOM 0 HE2 MET A 89 -0.911 8.312 4.718 1.00 0.00 H new ATOM 0 HE3 MET A 89 -1.155 7.617 6.338 1.00 0.00 H new ATOM 1313 N ALA A 90 -3.461 5.698 8.892 1.00 0.00 N ATOM 1314 CA ALA A 90 -3.965 5.896 10.247 1.00 0.00 C ATOM 1315 C ALA A 90 -4.628 7.260 10.393 1.00 0.00 C ATOM 1316 O ALA A 90 -4.077 8.277 9.968 1.00 0.00 O ATOM 1317 CB ALA A 90 -2.838 5.745 11.258 1.00 0.00 C ATOM 0 H ALA A 90 -2.457 5.843 8.790 1.00 0.00 H new ATOM 0 HA ALA A 90 -4.718 5.132 10.442 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -3.229 5.895 12.264 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -2.411 4.745 11.180 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -2.065 6.486 11.055 1.00 0.00 H new ATOM 1323 N HIS A 91 -5.812 7.276 10.995 1.00 0.00 N ATOM 1324 CA HIS A 91 -6.501 8.524 11.298 1.00 0.00 C ATOM 1325 C HIS A 91 -7.480 8.347 12.451 1.00 0.00 C ATOM 1326 O HIS A 91 -7.623 7.252 12.995 1.00 0.00 O ATOM 1327 CB HIS A 91 -7.246 9.043 10.064 1.00 0.00 C ATOM 1328 CG HIS A 91 -8.397 8.181 9.648 1.00 0.00 C ATOM 1329 ND1 HIS A 91 -9.614 8.202 10.297 1.00 0.00 N ATOM 1330 CD2 HIS A 91 -8.517 7.272 8.651 1.00 0.00 C ATOM 1331 CE1 HIS A 91 -10.433 7.343 9.716 1.00 0.00 C ATOM 1332 NE2 HIS A 91 -9.791 6.766 8.716 1.00 0.00 N ATOM 0 H HIS A 91 -6.315 6.437 11.283 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.746 9.253 11.593 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -7.612 10.049 10.268 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -6.544 9.122 9.234 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -7.753 6.997 7.939 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -11.454 7.146 10.009 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -10.180 6.058 8.093 1.00 0.00 H new ATOM 1339 N ARG A 92 -8.153 9.432 12.821 1.00 0.00 N ATOM 1340 CA ARG A 92 -9.152 9.388 13.882 1.00 0.00 C ATOM 1341 C ARG A 92 -10.424 10.119 13.471 1.00 0.00 C ATOM 1342 O ARG A 92 -11.108 10.713 14.305 1.00 0.00 O ATOM 1343 CB ARG A 92 -8.605 10.009 15.159 1.00 0.00 C ATOM 1344 CG ARG A 92 -7.390 9.305 15.743 1.00 0.00 C ATOM 1345 CD ARG A 92 -7.741 7.968 16.287 1.00 0.00 C ATOM 1346 NE ARG A 92 -6.611 7.341 16.955 1.00 0.00 N ATOM 1347 CZ ARG A 92 -5.656 6.625 16.332 1.00 0.00 C ATOM 1348 NH1 ARG A 92 -5.707 6.453 15.029 1.00 0.00 N ATOM 1349 NH2 ARG A 92 -4.667 6.093 17.029 1.00 0.00 N ATOM 0 H ARG A 92 -8.024 10.353 12.401 1.00 0.00 H new ATOM 0 HA ARG A 92 -9.391 8.340 14.063 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -8.343 11.048 14.958 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -9.396 10.019 15.909 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -6.627 9.196 14.972 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -6.959 9.918 16.534 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -8.568 8.068 16.989 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -8.086 7.326 15.477 1.00 0.00 H new ATOM 0 HE ARG A 92 -6.537 7.452 17.966 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -6.470 6.862 14.490 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -4.983 5.911 14.557 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -4.627 6.225 18.040 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -3.944 5.551 16.556 1.00 0.00 H new ATOM 1363 N GLY A 93 -10.736 10.073 12.180 1.00 0.00 N ATOM 1364 CA GLY A 93 -11.869 10.813 11.639 1.00 0.00 C ATOM 1365 C GLY A 93 -11.491 11.536 10.353 1.00 0.00 C ATOM 1366 O GLY A 93 -10.392 11.358 9.829 1.00 0.00 O ATOM 0 H GLY A 93 -10.219 9.530 11.489 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -12.695 10.128 11.445 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -12.220 11.535 12.376 1.00 0.00 H new ATOM 1370 N ARG A 94 -12.410 12.353 9.848 1.00 0.00 N ATOM 1371 CA ARG A 94 -12.192 13.071 8.598 1.00 0.00 C ATOM 1372 C ARG A 94 -11.136 14.158 8.764 1.00 0.00 C ATOM 1373 O ARG A 94 -11.286 15.061 9.588 1.00 0.00 O ATOM 1374 CB ARG A 94 -13.488 13.698 8.107 1.00 0.00 C ATOM 1375 CG ARG A 94 -13.386 14.414 6.769 1.00 0.00 C ATOM 1376 CD ARG A 94 -14.707 14.914 6.313 1.00 0.00 C ATOM 1377 NE ARG A 94 -14.631 15.526 4.995 1.00 0.00 N ATOM 1378 CZ ARG A 94 -14.336 16.821 4.770 1.00 0.00 C ATOM 1379 NH1 ARG A 94 -14.095 17.627 5.780 1.00 0.00 N ATOM 1380 NH2 ARG A 94 -14.290 17.282 3.532 1.00 0.00 N ATOM 0 H ARG A 94 -13.313 12.534 10.286 1.00 0.00 H new ATOM 0 HA ARG A 94 -11.839 12.348 7.863 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -14.245 12.918 8.028 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -13.838 14.408 8.857 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -12.691 15.249 6.855 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -12.977 13.734 6.022 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -15.419 14.089 6.289 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -15.087 15.642 7.030 1.00 0.00 H new ATOM 0 HE ARG A 94 -14.814 14.933 4.185 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -14.131 17.272 6.736 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -13.872 18.607 5.608 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -14.478 16.657 2.748 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -14.067 18.262 3.361 1.00 0.00 H new ATOM 1394 N ASP A 95 -10.070 14.065 7.978 1.00 0.00 N ATOM 1395 CA ASP A 95 -9.046 15.102 7.950 1.00 0.00 C ATOM 1396 C ASP A 95 -8.273 15.149 9.262 1.00 0.00 C ATOM 1397 O ASP A 95 -7.944 16.224 9.762 1.00 0.00 O ATOM 1398 CB ASP A 95 -9.675 16.470 7.673 1.00 0.00 C ATOM 1399 CG ASP A 95 -8.684 17.471 7.094 1.00 0.00 C ATOM 1400 OD1 ASP A 95 -7.664 17.051 6.602 1.00 0.00 O ATOM 1401 OD2 ASP A 95 -8.957 18.646 7.149 1.00 0.00 O ATOM 0 H ASP A 95 -9.892 13.281 7.351 1.00 0.00 H new ATOM 0 HA ASP A 95 -8.350 14.858 7.147 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -10.507 16.348 6.980 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -10.088 16.869 8.600 1.00 0.00 H new ATOM 1406 N THR A 96 -7.987 13.976 9.817 1.00 0.00 N ATOM 1407 CA THR A 96 -7.235 13.879 11.062 1.00 0.00 C ATOM 1408 C THR A 96 -6.080 12.895 10.933 1.00 0.00 C ATOM 1409 O THR A 96 -5.366 12.631 11.901 1.00 0.00 O ATOM 1410 CB THR A 96 -8.147 13.458 12.230 1.00 0.00 C ATOM 1411 OG1 THR A 96 -8.703 12.164 11.961 1.00 0.00 O ATOM 1412 CG2 THR A 96 -9.275 14.461 12.414 1.00 0.00 C ATOM 0 H THR A 96 -8.266 13.077 9.423 1.00 0.00 H new ATOM 0 HA THR A 96 -6.830 14.869 11.272 1.00 0.00 H new ATOM 0 HB THR A 96 -7.552 13.424 13.143 1.00 0.00 H new ATOM 0 HG1 THR A 96 -9.196 12.189 11.114 1.00 0.00 H new ATOM 0 HG21 THR A 96 -9.909 14.147 13.243 1.00 0.00 H new ATOM 0 HG22 THR A 96 -8.856 15.444 12.629 1.00 0.00 H new ATOM 0 HG23 THR A 96 -9.869 14.511 11.502 1.00 0.00 H new ATOM 1420 N GLY A 97 -5.902 12.354 9.733 1.00 0.00 N ATOM 1421 CA GLY A 97 -4.934 11.287 9.511 1.00 0.00 C ATOM 1422 C GLY A 97 -3.506 11.811 9.596 1.00 0.00 C ATOM 1423 O GLY A 97 -3.272 13.017 9.516 1.00 0.00 O ATOM 0 H GLY A 97 -6.416 12.637 8.899 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -5.080 10.500 10.251 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -5.102 10.838 8.532 1.00 0.00 H new ATOM 1427 N SER A 98 -2.554 10.898 9.761 1.00 0.00 N ATOM 1428 CA SER A 98 -1.142 11.259 9.783 1.00 0.00 C ATOM 1429 C SER A 98 -0.371 10.531 8.688 1.00 0.00 C ATOM 1430 O SER A 98 -0.963 9.902 7.812 1.00 0.00 O ATOM 1431 CB SER A 98 -0.541 10.936 11.137 1.00 0.00 C ATOM 1432 OG SER A 98 -0.434 9.551 11.321 1.00 0.00 O ATOM 0 H SER A 98 -2.736 9.902 9.882 1.00 0.00 H new ATOM 0 HA SER A 98 -1.066 12.331 9.601 1.00 0.00 H new ATOM 0 HB2 SER A 98 0.444 11.395 11.220 1.00 0.00 H new ATOM 0 HB3 SER A 98 -1.160 11.365 11.925 1.00 0.00 H new ATOM 0 HG SER A 98 -0.042 9.367 12.200 1.00 0.00 H new ATOM 1438 N CYS A 99 0.953 10.623 8.744 1.00 0.00 N ATOM 1439 CA CYS A 99 1.811 9.895 7.817 1.00 0.00 C ATOM 1440 C CYS A 99 1.960 8.437 8.233 1.00 0.00 C ATOM 1441 O CYS A 99 2.510 7.622 7.492 1.00 0.00 O ATOM 1442 CB CYS A 99 3.194 10.542 7.741 1.00 0.00 C ATOM 1443 SG CYS A 99 4.186 10.342 9.240 1.00 0.00 S ATOM 0 H CYS A 99 1.456 11.195 9.422 1.00 0.00 H new ATOM 0 HA CYS A 99 1.338 9.934 6.836 1.00 0.00 H new ATOM 0 HB2 CYS A 99 3.738 10.114 6.899 1.00 0.00 H new ATOM 0 HB3 CYS A 99 3.075 11.606 7.536 1.00 0.00 H new ATOM 0 HG CYS A 99 4.994 9.334 9.095 1.00 0.00 H new ATOM 1449 N GLN A 100 1.468 8.114 9.425 1.00 0.00 N ATOM 1450 CA GLN A 100 1.518 6.747 9.930 1.00 0.00 C ATOM 1451 C GLN A 100 0.471 5.871 9.252 1.00 0.00 C ATOM 1452 O GLN A 100 -0.589 6.353 8.849 1.00 0.00 O ATOM 1453 CB GLN A 100 1.312 6.727 11.446 1.00 0.00 C ATOM 1454 CG GLN A 100 2.448 7.354 12.236 1.00 0.00 C ATOM 1455 CD GLN A 100 2.192 7.335 13.731 1.00 0.00 C ATOM 1456 OE1 GLN A 100 1.129 6.908 14.188 1.00 0.00 O ATOM 1457 NE2 GLN A 100 3.169 7.799 14.503 1.00 0.00 N ATOM 0 H GLN A 100 1.030 8.781 10.060 1.00 0.00 H new ATOM 0 HA GLN A 100 2.504 6.344 9.700 1.00 0.00 H new ATOM 0 HB2 GLN A 100 0.386 7.252 11.683 1.00 0.00 H new ATOM 0 HB3 GLN A 100 1.185 5.694 11.771 1.00 0.00 H new ATOM 0 HG2 GLN A 100 3.374 6.820 12.022 1.00 0.00 H new ATOM 0 HG3 GLN A 100 2.590 8.384 11.908 1.00 0.00 H new ATOM 0 HE21 GLN A 100 4.032 8.143 14.082 1.00 0.00 H new ATOM 0 HE22 GLN A 100 3.056 7.811 15.517 1.00 0.00 H new ATOM 1466 N PHE A 101 0.775 4.584 9.128 1.00 0.00 N ATOM 1467 CA PHE A 101 -0.069 3.667 8.370 1.00 0.00 C ATOM 1468 C PHE A 101 -0.022 2.263 8.957 1.00 0.00 C ATOM 1469 O PHE A 101 0.908 1.914 9.684 1.00 0.00 O ATOM 1470 CB PHE A 101 0.368 3.627 6.904 1.00 0.00 C ATOM 1471 CG PHE A 101 1.754 3.083 6.699 1.00 0.00 C ATOM 1472 CD1 PHE A 101 2.865 3.898 6.850 1.00 0.00 C ATOM 1473 CD2 PHE A 101 1.947 1.753 6.356 1.00 0.00 C ATOM 1474 CE1 PHE A 101 4.138 3.399 6.661 1.00 0.00 C ATOM 1475 CE2 PHE A 101 3.221 1.250 6.168 1.00 0.00 C ATOM 1476 CZ PHE A 101 4.316 2.073 6.320 1.00 0.00 C ATOM 0 H PHE A 101 1.600 4.151 9.543 1.00 0.00 H new ATOM 0 HA PHE A 101 -1.094 4.033 8.430 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -0.338 3.018 6.340 1.00 0.00 H new ATOM 0 HB3 PHE A 101 0.319 4.635 6.492 1.00 0.00 H new ATOM 0 HD1 PHE A 101 2.733 4.936 7.119 1.00 0.00 H new ATOM 0 HD2 PHE A 101 1.093 1.103 6.234 1.00 0.00 H new ATOM 0 HE1 PHE A 101 4.995 4.046 6.780 1.00 0.00 H new ATOM 0 HE2 PHE A 101 3.358 0.212 5.902 1.00 0.00 H new ATOM 0 HZ PHE A 101 5.312 1.681 6.173 1.00 0.00 H new ATOM 1486 N PHE A 102 -1.032 1.460 8.638 1.00 0.00 N ATOM 1487 CA PHE A 102 -1.071 0.068 9.070 1.00 0.00 C ATOM 1488 C PHE A 102 -0.926 -0.880 7.887 1.00 0.00 C ATOM 1489 O PHE A 102 -1.501 -0.654 6.824 1.00 0.00 O ATOM 1490 CB PHE A 102 -2.376 -0.226 9.810 1.00 0.00 C ATOM 1491 CG PHE A 102 -2.504 0.489 11.125 1.00 0.00 C ATOM 1492 CD1 PHE A 102 -2.001 -0.074 12.288 1.00 0.00 C ATOM 1493 CD2 PHE A 102 -3.125 1.726 11.200 1.00 0.00 C ATOM 1494 CE1 PHE A 102 -2.117 0.581 13.498 1.00 0.00 C ATOM 1495 CE2 PHE A 102 -3.241 2.385 12.410 1.00 0.00 C ATOM 1496 CZ PHE A 102 -2.738 1.813 13.559 1.00 0.00 C ATOM 0 H PHE A 102 -1.836 1.750 8.081 1.00 0.00 H new ATOM 0 HA PHE A 102 -0.231 -0.093 9.746 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -3.215 0.053 9.172 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -2.451 -1.300 9.983 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -1.513 -1.036 12.247 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -3.522 2.180 10.304 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -1.722 0.130 14.396 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -3.726 3.349 12.455 1.00 0.00 H new ATOM 0 HZ PHE A 102 -2.829 2.327 14.504 1.00 0.00 H new ATOM 1506 N ILE A 103 -0.153 -1.945 8.079 1.00 0.00 N ATOM 1507 CA ILE A 103 -0.209 -3.102 7.194 1.00 0.00 C ATOM 1508 C ILE A 103 -0.688 -4.342 7.939 1.00 0.00 C ATOM 1509 O ILE A 103 -0.030 -4.812 8.867 1.00 0.00 O ATOM 1510 CB ILE A 103 1.168 -3.379 6.565 1.00 0.00 C ATOM 1511 CG1 ILE A 103 1.637 -2.169 5.751 1.00 0.00 C ATOM 1512 CG2 ILE A 103 1.113 -4.624 5.692 1.00 0.00 C ATOM 1513 CD1 ILE A 103 2.983 -2.363 5.092 1.00 0.00 C ATOM 0 H ILE A 103 0.520 -2.030 8.841 1.00 0.00 H new ATOM 0 HA ILE A 103 -0.922 -2.872 6.402 1.00 0.00 H new ATOM 0 HB ILE A 103 1.886 -3.553 7.366 1.00 0.00 H new ATOM 0 HG12 ILE A 103 0.895 -1.950 4.983 1.00 0.00 H new ATOM 0 HG13 ILE A 103 1.685 -1.299 6.406 1.00 0.00 H new ATOM 0 HG21 ILE A 103 2.095 -4.806 5.255 1.00 0.00 H new ATOM 0 HG22 ILE A 103 0.822 -5.481 6.299 1.00 0.00 H new ATOM 0 HG23 ILE A 103 0.383 -4.478 4.896 1.00 0.00 H new ATOM 0 HD11 ILE A 103 3.248 -1.465 4.534 1.00 0.00 H new ATOM 0 HD12 ILE A 103 3.738 -2.552 5.855 1.00 0.00 H new ATOM 0 HD13 ILE A 103 2.935 -3.213 4.411 1.00 0.00 H new ATOM 1525 N VAL A 104 -1.836 -4.867 7.525 1.00 0.00 N ATOM 1526 CA VAL A 104 -2.542 -5.876 8.307 1.00 0.00 C ATOM 1527 C VAL A 104 -2.027 -7.275 7.995 1.00 0.00 C ATOM 1528 O VAL A 104 -1.910 -7.659 6.832 1.00 0.00 O ATOM 1529 CB VAL A 104 -4.054 -5.812 8.018 1.00 0.00 C ATOM 1530 CG1 VAL A 104 -4.792 -6.883 8.809 1.00 0.00 C ATOM 1531 CG2 VAL A 104 -4.587 -4.429 8.357 1.00 0.00 C ATOM 0 H VAL A 104 -2.298 -4.611 6.652 1.00 0.00 H new ATOM 0 HA VAL A 104 -2.361 -5.666 9.361 1.00 0.00 H new ATOM 0 HB VAL A 104 -4.221 -6.000 6.957 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -5.859 -6.824 8.594 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -4.418 -7.867 8.526 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -4.628 -6.726 9.875 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -5.657 -4.391 8.150 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.414 -4.221 9.413 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.073 -3.683 7.751 1.00 0.00 H new ATOM 1541 N HIS A 105 -1.721 -8.034 9.042 1.00 0.00 N ATOM 1542 CA HIS A 105 -1.193 -9.383 8.882 1.00 0.00 C ATOM 1543 C HIS A 105 -2.308 -10.420 8.930 1.00 0.00 C ATOM 1544 O HIS A 105 -2.282 -11.409 8.198 1.00 0.00 O ATOM 1545 CB HIS A 105 -0.156 -9.691 9.966 1.00 0.00 C ATOM 1546 CG HIS A 105 0.970 -8.705 10.019 1.00 0.00 C ATOM 1547 ND1 HIS A 105 1.932 -8.726 11.008 1.00 0.00 N ATOM 1548 CD2 HIS A 105 1.285 -7.668 9.208 1.00 0.00 C ATOM 1549 CE1 HIS A 105 2.792 -7.745 10.800 1.00 0.00 C ATOM 1550 NE2 HIS A 105 2.423 -7.088 9.716 1.00 0.00 N ATOM 0 H HIS A 105 -1.830 -7.737 10.012 1.00 0.00 H new ATOM 0 HA HIS A 105 -0.713 -9.433 7.905 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -0.653 -9.714 10.936 1.00 0.00 H new ATOM 0 HB3 HIS A 105 0.252 -10.687 9.793 1.00 0.00 H new ATOM 0 HD2 HIS A 105 0.744 -7.355 8.327 1.00 0.00 H new ATOM 0 HE1 HIS A 105 3.652 -7.519 11.413 1.00 0.00 H new ATOM 0 HE2 HIS A 105 2.904 -6.281 9.320 1.00 0.00 H new ATOM 1557 N GLU A 106 -3.288 -10.187 9.798 1.00 0.00 N ATOM 1558 CA GLU A 106 -4.483 -11.021 9.845 1.00 0.00 C ATOM 1559 C GLU A 106 -5.728 -10.184 10.110 1.00 0.00 C ATOM 1560 O GLU A 106 -5.643 -9.078 10.643 1.00 0.00 O ATOM 1561 CB GLU A 106 -4.342 -12.097 10.923 1.00 0.00 C ATOM 1562 CG GLU A 106 -3.288 -13.154 10.621 1.00 0.00 C ATOM 1563 CD GLU A 106 -3.232 -14.237 11.663 1.00 0.00 C ATOM 1564 OE1 GLU A 106 -3.953 -14.145 12.628 1.00 0.00 O ATOM 1565 OE2 GLU A 106 -2.468 -15.158 11.493 1.00 0.00 O ATOM 0 H GLU A 106 -3.277 -9.427 10.478 1.00 0.00 H new ATOM 0 HA GLU A 106 -4.592 -11.501 8.873 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -4.096 -11.616 11.870 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -5.305 -12.589 11.056 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -3.497 -13.602 9.649 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -2.311 -12.676 10.548 1.00 0.00 H new ATOM 1572 N PRO A 107 -6.886 -10.718 9.733 1.00 0.00 N ATOM 1573 CA PRO A 107 -8.151 -10.022 9.930 1.00 0.00 C ATOM 1574 C PRO A 107 -8.239 -9.423 11.327 1.00 0.00 C ATOM 1575 O PRO A 107 -8.152 -10.137 12.326 1.00 0.00 O ATOM 1576 CB PRO A 107 -9.190 -11.130 9.725 1.00 0.00 C ATOM 1577 CG PRO A 107 -8.580 -12.014 8.691 1.00 0.00 C ATOM 1578 CD PRO A 107 -7.113 -12.029 9.028 1.00 0.00 C ATOM 0 HA PRO A 107 -8.289 -9.179 9.253 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -9.382 -11.673 10.651 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -10.145 -10.724 9.390 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -9.006 -13.017 8.725 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -8.753 -11.628 7.686 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -6.859 -12.875 9.667 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -6.499 -12.111 8.131 1.00 0.00 H new ATOM 1586 N GLN A 108 -8.410 -8.106 11.391 1.00 0.00 N ATOM 1587 CA GLN A 108 -8.458 -7.401 12.667 1.00 0.00 C ATOM 1588 C GLN A 108 -9.675 -6.488 12.746 1.00 0.00 C ATOM 1589 O GLN A 108 -9.652 -5.363 12.245 1.00 0.00 O ATOM 1590 CB GLN A 108 -7.179 -6.587 12.877 1.00 0.00 C ATOM 1591 CG GLN A 108 -7.135 -5.824 14.191 1.00 0.00 C ATOM 1592 CD GLN A 108 -7.469 -6.703 15.381 1.00 0.00 C ATOM 1593 OE1 GLN A 108 -8.601 -6.705 15.871 1.00 0.00 O ATOM 1594 NE2 GLN A 108 -6.482 -7.457 15.853 1.00 0.00 N ATOM 0 H GLN A 108 -8.518 -7.505 10.574 1.00 0.00 H new ATOM 0 HA GLN A 108 -8.538 -8.147 13.457 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -6.322 -7.259 12.831 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -7.073 -5.879 12.055 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -6.142 -5.396 14.326 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -7.838 -4.992 14.149 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -5.561 -7.423 15.416 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -6.645 -8.069 16.652 1.00 0.00 H new ATOM 1603 N PRO A 109 -10.736 -6.978 13.377 1.00 0.00 N ATOM 1604 CA PRO A 109 -11.971 -6.214 13.505 1.00 0.00 C ATOM 1605 C PRO A 109 -11.718 -4.864 14.164 1.00 0.00 C ATOM 1606 O PRO A 109 -12.420 -3.889 13.894 1.00 0.00 O ATOM 1607 CB PRO A 109 -12.845 -7.116 14.383 1.00 0.00 C ATOM 1608 CG PRO A 109 -12.359 -8.495 14.088 1.00 0.00 C ATOM 1609 CD PRO A 109 -10.870 -8.341 13.932 1.00 0.00 C ATOM 0 HA PRO A 109 -12.433 -5.977 12.547 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -12.734 -6.872 15.440 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -13.902 -7.006 14.140 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -12.605 -9.184 14.896 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -12.815 -8.892 13.181 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -10.351 -8.442 14.885 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -10.454 -9.093 13.262 1.00 0.00 H new ATOM 1617 N HIS A 110 -10.712 -4.814 15.030 1.00 0.00 N ATOM 1618 CA HIS A 110 -10.387 -3.592 15.757 1.00 0.00 C ATOM 1619 C HIS A 110 -10.092 -2.444 14.799 1.00 0.00 C ATOM 1620 O HIS A 110 -10.446 -1.296 15.064 1.00 0.00 O ATOM 1621 CB HIS A 110 -9.185 -3.815 16.680 1.00 0.00 C ATOM 1622 CG HIS A 110 -8.798 -2.602 17.468 1.00 0.00 C ATOM 1623 ND1 HIS A 110 -9.578 -2.098 18.488 1.00 0.00 N ATOM 1624 CD2 HIS A 110 -7.717 -1.791 17.385 1.00 0.00 C ATOM 1625 CE1 HIS A 110 -8.991 -1.031 19.000 1.00 0.00 C ATOM 1626 NE2 HIS A 110 -7.862 -0.824 18.348 1.00 0.00 N ATOM 0 H HIS A 110 -10.107 -5.606 15.246 1.00 0.00 H new ATOM 0 HA HIS A 110 -11.256 -3.327 16.360 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -9.413 -4.628 17.370 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -8.333 -4.135 16.081 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -6.895 -1.887 16.691 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -9.370 -0.430 19.813 1.00 0.00 H new ATOM 0 HE2 HIS A 110 -7.203 -0.067 18.531 1.00 0.00 H new ATOM 1633 N LEU A 111 -9.443 -2.762 13.684 1.00 0.00 N ATOM 1634 CA LEU A 111 -9.035 -1.748 12.719 1.00 0.00 C ATOM 1635 C LEU A 111 -9.960 -1.735 11.509 1.00 0.00 C ATOM 1636 O LEU A 111 -10.062 -0.732 10.803 1.00 0.00 O ATOM 1637 CB LEU A 111 -7.592 -1.998 12.265 1.00 0.00 C ATOM 1638 CG LEU A 111 -6.533 -1.982 13.374 1.00 0.00 C ATOM 1639 CD1 LEU A 111 -5.169 -2.309 12.780 1.00 0.00 C ATOM 1640 CD2 LEU A 111 -6.522 -0.617 14.046 1.00 0.00 C ATOM 0 H LEU A 111 -9.188 -3.715 13.426 1.00 0.00 H new ATOM 0 HA LEU A 111 -9.097 -0.776 13.209 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -7.551 -2.965 11.763 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -7.328 -1.243 11.525 1.00 0.00 H new ATOM 0 HG LEU A 111 -6.771 -2.735 14.126 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -4.417 -2.298 13.569 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -5.199 -3.297 12.322 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -4.914 -1.566 12.024 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.769 -0.606 14.834 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.286 0.150 13.308 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -7.503 -0.416 14.478 1.00 0.00 H new ATOM 1652 N ASP A 112 -10.633 -2.857 11.273 1.00 0.00 N ATOM 1653 CA ASP A 112 -11.527 -2.987 10.130 1.00 0.00 C ATOM 1654 C ASP A 112 -12.685 -2.000 10.220 1.00 0.00 C ATOM 1655 O ASP A 112 -13.465 -2.029 11.171 1.00 0.00 O ATOM 1656 CB ASP A 112 -12.073 -4.415 10.036 1.00 0.00 C ATOM 1657 CG ASP A 112 -12.775 -4.695 8.714 1.00 0.00 C ATOM 1658 OD1 ASP A 112 -13.823 -4.135 8.490 1.00 0.00 O ATOM 1659 OD2 ASP A 112 -12.258 -5.465 7.941 1.00 0.00 O ATOM 0 H ASP A 112 -10.575 -3.690 11.859 1.00 0.00 H new ATOM 0 HA ASP A 112 -10.950 -2.763 9.233 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -11.253 -5.121 10.163 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -12.771 -4.587 10.856 1.00 0.00 H new ATOM 1664 N GLY A 113 -12.790 -1.128 9.224 1.00 0.00 N ATOM 1665 CA GLY A 113 -13.877 -0.158 9.166 1.00 0.00 C ATOM 1666 C GLY A 113 -13.539 1.098 9.960 1.00 0.00 C ATOM 1667 O GLY A 113 -14.370 1.993 10.107 1.00 0.00 O ATOM 0 H GLY A 113 -12.135 -1.073 8.444 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -14.076 0.108 8.128 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -14.789 -0.606 9.560 1.00 0.00 H new ATOM 1671 N VAL A 114 -12.313 1.157 10.469 1.00 0.00 N ATOM 1672 CA VAL A 114 -11.869 2.294 11.266 1.00 0.00 C ATOM 1673 C VAL A 114 -10.962 3.214 10.458 1.00 0.00 C ATOM 1674 O VAL A 114 -11.063 4.437 10.549 1.00 0.00 O ATOM 1675 CB VAL A 114 -11.116 1.807 12.518 1.00 0.00 C ATOM 1676 CG1 VAL A 114 -10.539 2.987 13.285 1.00 0.00 C ATOM 1677 CG2 VAL A 114 -12.050 0.994 13.401 1.00 0.00 C ATOM 0 H VAL A 114 -11.609 0.430 10.343 1.00 0.00 H new ATOM 0 HA VAL A 114 -12.755 2.854 11.566 1.00 0.00 H new ATOM 0 HB VAL A 114 -10.288 1.170 12.207 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -10.010 2.624 14.167 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -9.846 3.533 12.645 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -11.347 3.650 13.594 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -11.510 0.653 14.284 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -12.893 1.614 13.707 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -12.417 0.132 12.845 1.00 0.00 H new ATOM 1687 N HIS A 115 -10.077 2.618 9.666 1.00 0.00 N ATOM 1688 CA HIS A 115 -9.118 3.381 8.877 1.00 0.00 C ATOM 1689 C HIS A 115 -9.409 3.260 7.387 1.00 0.00 C ATOM 1690 O HIS A 115 -10.232 2.445 6.970 1.00 0.00 O ATOM 1691 CB HIS A 115 -7.688 2.913 9.163 1.00 0.00 C ATOM 1692 CG HIS A 115 -7.279 3.067 10.596 1.00 0.00 C ATOM 1693 ND1 HIS A 115 -6.976 4.290 11.155 1.00 0.00 N ATOM 1694 CD2 HIS A 115 -7.124 2.153 11.582 1.00 0.00 C ATOM 1695 CE1 HIS A 115 -6.652 4.122 12.425 1.00 0.00 C ATOM 1696 NE2 HIS A 115 -6.733 2.835 12.709 1.00 0.00 N ATOM 0 H HIS A 115 -10.004 1.607 9.554 1.00 0.00 H new ATOM 0 HA HIS A 115 -9.216 4.428 9.165 1.00 0.00 H new ATOM 0 HB2 HIS A 115 -7.594 1.865 8.878 1.00 0.00 H new ATOM 0 HB3 HIS A 115 -6.998 3.477 8.535 1.00 0.00 H new ATOM 0 HD2 HIS A 115 -7.279 1.087 11.499 1.00 0.00 H new ATOM 0 HE1 HIS A 115 -6.369 4.904 13.114 1.00 0.00 H new ATOM 0 HE2 HIS A 115 -6.537 2.415 13.618 1.00 0.00 H new ATOM 1703 N THR A 116 -8.729 4.075 6.589 1.00 0.00 N ATOM 1704 CA THR A 116 -8.965 4.110 5.150 1.00 0.00 C ATOM 1705 C THR A 116 -7.962 3.238 4.406 1.00 0.00 C ATOM 1706 O THR A 116 -6.777 3.565 4.330 1.00 0.00 O ATOM 1707 CB THR A 116 -8.895 5.552 4.612 1.00 0.00 C ATOM 1708 OG1 THR A 116 -9.939 6.336 5.203 1.00 0.00 O ATOM 1709 CG2 THR A 116 -9.052 5.565 3.099 1.00 0.00 C ATOM 0 H THR A 116 -8.009 4.721 6.914 1.00 0.00 H new ATOM 0 HA THR A 116 -9.967 3.717 4.978 1.00 0.00 H new ATOM 0 HB THR A 116 -7.923 5.973 4.870 1.00 0.00 H new ATOM 0 HG1 THR A 116 -9.571 6.869 5.938 1.00 0.00 H new ATOM 0 HG21 THR A 116 -9.000 6.592 2.737 1.00 0.00 H new ATOM 0 HG22 THR A 116 -8.253 4.979 2.645 1.00 0.00 H new ATOM 0 HG23 THR A 116 -10.016 5.134 2.830 1.00 0.00 H new ATOM 1717 N VAL A 117 -8.443 2.127 3.859 1.00 0.00 N ATOM 1718 CA VAL A 117 -7.602 1.236 3.069 1.00 0.00 C ATOM 1719 C VAL A 117 -7.379 1.788 1.667 1.00 0.00 C ATOM 1720 O VAL A 117 -8.321 2.223 1.004 1.00 0.00 O ATOM 1721 CB VAL A 117 -8.247 -0.160 2.972 1.00 0.00 C ATOM 1722 CG1 VAL A 117 -7.441 -1.054 2.040 1.00 0.00 C ATOM 1723 CG2 VAL A 117 -8.351 -0.779 4.357 1.00 0.00 C ATOM 0 H VAL A 117 -9.412 1.822 3.949 1.00 0.00 H new ATOM 0 HA VAL A 117 -6.637 1.159 3.571 1.00 0.00 H new ATOM 0 HB VAL A 117 -9.251 -0.059 2.559 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -7.910 -2.036 1.982 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.409 -0.608 1.046 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.426 -1.158 2.424 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -8.808 -1.766 4.281 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -7.355 -0.873 4.789 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -8.965 -0.143 4.995 1.00 0.00 H new ATOM 1733 N PHE A 118 -6.128 1.768 1.221 1.00 0.00 N ATOM 1734 CA PHE A 118 -5.761 2.364 -0.059 1.00 0.00 C ATOM 1735 C PHE A 118 -5.115 1.337 -0.980 1.00 0.00 C ATOM 1736 O PHE A 118 -4.983 1.565 -2.183 1.00 0.00 O ATOM 1737 CB PHE A 118 -4.805 3.538 0.154 1.00 0.00 C ATOM 1738 CG PHE A 118 -3.491 3.146 0.769 1.00 0.00 C ATOM 1739 CD1 PHE A 118 -2.444 2.701 -0.023 1.00 0.00 C ATOM 1740 CD2 PHE A 118 -3.300 3.222 2.141 1.00 0.00 C ATOM 1741 CE1 PHE A 118 -1.235 2.340 0.542 1.00 0.00 C ATOM 1742 CE2 PHE A 118 -2.093 2.863 2.708 1.00 0.00 C ATOM 1743 CZ PHE A 118 -1.060 2.421 1.907 1.00 0.00 C ATOM 0 H PHE A 118 -5.350 1.345 1.727 1.00 0.00 H new ATOM 0 HA PHE A 118 -6.675 2.725 -0.531 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -4.617 4.020 -0.805 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -5.289 4.277 0.793 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -2.574 2.636 -1.093 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -4.105 3.566 2.773 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -0.427 1.994 -0.086 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -1.958 2.928 3.778 1.00 0.00 H new ATOM 0 HZ PHE A 118 -0.116 2.139 2.349 1.00 0.00 H new ATOM 1753 N GLY A 119 -4.715 0.206 -0.409 1.00 0.00 N ATOM 1754 CA GLY A 119 -4.073 -0.854 -1.176 1.00 0.00 C ATOM 1755 C GLY A 119 -4.132 -2.183 -0.435 1.00 0.00 C ATOM 1756 O GLY A 119 -4.475 -2.232 0.746 1.00 0.00 O ATOM 0 H GLY A 119 -4.825 0.000 0.584 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -4.562 -0.953 -2.145 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -3.034 -0.588 -1.369 1.00 0.00 H new ATOM 1760 N GLN A 120 -3.796 -3.262 -1.136 1.00 0.00 N ATOM 1761 CA GLN A 120 -3.728 -4.583 -0.524 1.00 0.00 C ATOM 1762 C GLN A 120 -2.557 -5.386 -1.075 1.00 0.00 C ATOM 1763 O GLN A 120 -2.240 -5.304 -2.261 1.00 0.00 O ATOM 1764 CB GLN A 120 -5.037 -5.345 -0.750 1.00 0.00 C ATOM 1765 CG GLN A 120 -6.230 -4.765 -0.009 1.00 0.00 C ATOM 1766 CD GLN A 120 -7.488 -5.593 -0.200 1.00 0.00 C ATOM 1767 OE1 GLN A 120 -8.590 -5.162 0.148 1.00 0.00 O ATOM 1768 NE2 GLN A 120 -7.328 -6.789 -0.754 1.00 0.00 N ATOM 0 H GLN A 120 -3.566 -3.246 -2.130 1.00 0.00 H new ATOM 0 HA GLN A 120 -3.575 -4.447 0.547 1.00 0.00 H new ATOM 0 HB2 GLN A 120 -5.257 -5.358 -1.817 1.00 0.00 H new ATOM 0 HB3 GLN A 120 -4.900 -6.381 -0.440 1.00 0.00 H new ATOM 0 HG2 GLN A 120 -5.998 -4.701 1.054 1.00 0.00 H new ATOM 0 HG3 GLN A 120 -6.411 -3.748 -0.357 1.00 0.00 H new ATOM 0 HE21 GLN A 120 -6.397 -7.104 -1.026 1.00 0.00 H new ATOM 0 HE22 GLN A 120 -8.136 -7.392 -0.907 1.00 0.00 H new ATOM 1777 N VAL A 121 -1.917 -6.162 -0.206 1.00 0.00 N ATOM 1778 CA VAL A 121 -0.766 -6.964 -0.599 1.00 0.00 C ATOM 1779 C VAL A 121 -1.197 -8.215 -1.354 1.00 0.00 C ATOM 1780 O VAL A 121 -2.116 -8.918 -0.936 1.00 0.00 O ATOM 1781 CB VAL A 121 0.049 -7.373 0.643 1.00 0.00 C ATOM 1782 CG1 VAL A 121 1.221 -8.258 0.243 1.00 0.00 C ATOM 1783 CG2 VAL A 121 0.536 -6.132 1.374 1.00 0.00 C ATOM 0 H VAL A 121 -2.177 -6.252 0.776 1.00 0.00 H new ATOM 0 HA VAL A 121 -0.148 -6.355 -1.258 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.592 -7.944 1.315 1.00 0.00 H new ATOM 0 HG11 VAL A 121 1.786 -8.538 1.132 1.00 0.00 H new ATOM 0 HG12 VAL A 121 0.847 -9.157 -0.247 1.00 0.00 H new ATOM 0 HG13 VAL A 121 1.870 -7.714 -0.443 1.00 0.00 H new ATOM 0 HG21 VAL A 121 1.111 -6.429 2.251 1.00 0.00 H new ATOM 0 HG22 VAL A 121 1.166 -5.542 0.709 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -0.320 -5.535 1.687 1.00 0.00 H new ATOM 1793 N THR A 122 -0.528 -8.487 -2.469 1.00 0.00 N ATOM 1794 CA THR A 122 -0.908 -9.593 -3.340 1.00 0.00 C ATOM 1795 C THR A 122 0.191 -10.647 -3.401 1.00 0.00 C ATOM 1796 O THR A 122 -0.073 -11.817 -3.682 1.00 0.00 O ATOM 1797 CB THR A 122 -1.227 -9.095 -4.762 1.00 0.00 C ATOM 1798 OG1 THR A 122 -0.055 -8.502 -5.338 1.00 0.00 O ATOM 1799 CG2 THR A 122 -2.346 -8.066 -4.727 1.00 0.00 C ATOM 0 H THR A 122 0.281 -7.956 -2.791 1.00 0.00 H new ATOM 0 HA THR A 122 -1.805 -10.045 -2.916 1.00 0.00 H new ATOM 0 HB THR A 122 -1.547 -9.945 -5.366 1.00 0.00 H new ATOM 0 HG1 THR A 122 -0.259 -8.187 -6.243 1.00 0.00 H new ATOM 0 HG21 THR A 122 -2.558 -7.725 -5.740 1.00 0.00 H new ATOM 0 HG22 THR A 122 -3.242 -8.517 -4.301 1.00 0.00 H new ATOM 0 HG23 THR A 122 -2.041 -7.217 -4.115 1.00 0.00 H new ATOM 1807 N SER A 123 1.423 -10.227 -3.137 1.00 0.00 N ATOM 1808 CA SER A 123 2.556 -11.144 -3.106 1.00 0.00 C ATOM 1809 C SER A 123 3.568 -10.735 -2.044 1.00 0.00 C ATOM 1810 O SER A 123 3.850 -9.551 -1.866 1.00 0.00 O ATOM 1811 CB SER A 123 3.227 -11.192 -4.465 1.00 0.00 C ATOM 1812 OG SER A 123 4.319 -12.068 -4.455 1.00 0.00 O ATOM 0 H SER A 123 1.663 -9.255 -2.941 1.00 0.00 H new ATOM 0 HA SER A 123 2.178 -12.135 -2.854 1.00 0.00 H new ATOM 0 HB2 SER A 123 2.507 -11.511 -5.219 1.00 0.00 H new ATOM 0 HB3 SER A 123 3.560 -10.193 -4.745 1.00 0.00 H new ATOM 0 HG SER A 123 4.734 -12.083 -5.343 1.00 0.00 H new ATOM 1818 N GLY A 124 4.111 -11.722 -1.339 1.00 0.00 N ATOM 1819 CA GLY A 124 4.937 -11.462 -0.166 1.00 0.00 C ATOM 1820 C GLY A 124 4.087 -11.365 1.095 1.00 0.00 C ATOM 1821 O GLY A 124 4.523 -10.815 2.106 1.00 0.00 O ATOM 0 H GLY A 124 3.993 -12.711 -1.560 1.00 0.00 H new ATOM 0 HA2 GLY A 124 5.672 -12.258 -0.052 1.00 0.00 H new ATOM 0 HA3 GLY A 124 5.491 -10.534 -0.307 1.00 0.00 H new ATOM 1825 N MET A 125 2.874 -11.902 1.027 1.00 0.00 N ATOM 1826 CA MET A 125 1.933 -11.811 2.138 1.00 0.00 C ATOM 1827 C MET A 125 2.486 -12.489 3.385 1.00 0.00 C ATOM 1828 O MET A 125 2.248 -12.039 4.505 1.00 0.00 O ATOM 1829 CB MET A 125 0.593 -12.429 1.745 1.00 0.00 C ATOM 1830 CG MET A 125 -0.172 -11.651 0.682 1.00 0.00 C ATOM 1831 SD MET A 125 -1.596 -12.559 0.047 1.00 0.00 S ATOM 1832 CE MET A 125 -2.682 -12.523 1.469 1.00 0.00 C ATOM 0 H MET A 125 2.519 -12.405 0.214 1.00 0.00 H new ATOM 0 HA MET A 125 1.782 -10.757 2.370 1.00 0.00 H new ATOM 0 HB2 MET A 125 0.767 -13.442 1.382 1.00 0.00 H new ATOM 0 HB3 MET A 125 -0.030 -12.512 2.636 1.00 0.00 H new ATOM 0 HG2 MET A 125 -0.508 -10.703 1.102 1.00 0.00 H new ATOM 0 HG3 MET A 125 0.500 -11.413 -0.143 1.00 0.00 H new ATOM 0 HE1 MET A 125 -3.694 -12.783 1.160 1.00 0.00 H new ATOM 0 HE2 MET A 125 -2.333 -13.241 2.211 1.00 0.00 H new ATOM 0 HE3 MET A 125 -2.681 -11.523 1.903 1.00 0.00 H new ATOM 1842 N ASP A 126 3.225 -13.574 3.183 1.00 0.00 N ATOM 1843 CA ASP A 126 3.888 -14.265 4.284 1.00 0.00 C ATOM 1844 C ASP A 126 4.949 -13.383 4.929 1.00 0.00 C ATOM 1845 O ASP A 126 5.043 -13.303 6.154 1.00 0.00 O ATOM 1846 CB ASP A 126 4.527 -15.566 3.793 1.00 0.00 C ATOM 1847 CG ASP A 126 3.504 -16.651 3.487 1.00 0.00 C ATOM 1848 OD1 ASP A 126 2.367 -16.491 3.865 1.00 0.00 O ATOM 1849 OD2 ASP A 126 3.867 -17.628 2.877 1.00 0.00 O ATOM 0 H ASP A 126 3.380 -13.995 2.267 1.00 0.00 H new ATOM 0 HA ASP A 126 3.130 -14.498 5.032 1.00 0.00 H new ATOM 0 HB2 ASP A 126 5.111 -15.362 2.896 1.00 0.00 H new ATOM 0 HB3 ASP A 126 5.221 -15.932 4.549 1.00 0.00 H new ATOM 1854 N VAL A 127 5.747 -12.721 4.097 1.00 0.00 N ATOM 1855 CA VAL A 127 6.754 -11.785 4.584 1.00 0.00 C ATOM 1856 C VAL A 127 6.117 -10.665 5.396 1.00 0.00 C ATOM 1857 O VAL A 127 6.647 -10.255 6.428 1.00 0.00 O ATOM 1858 CB VAL A 127 7.535 -11.179 3.403 1.00 0.00 C ATOM 1859 CG1 VAL A 127 8.438 -10.054 3.884 1.00 0.00 C ATOM 1860 CG2 VAL A 127 8.345 -12.262 2.707 1.00 0.00 C ATOM 0 H VAL A 127 5.716 -12.816 3.082 1.00 0.00 H new ATOM 0 HA VAL A 127 7.437 -12.338 5.229 1.00 0.00 H new ATOM 0 HB VAL A 127 6.827 -10.761 2.688 1.00 0.00 H new ATOM 0 HG11 VAL A 127 8.983 -9.637 3.037 1.00 0.00 H new ATOM 0 HG12 VAL A 127 7.833 -9.274 4.346 1.00 0.00 H new ATOM 0 HG13 VAL A 127 9.147 -10.444 4.615 1.00 0.00 H new ATOM 0 HG21 VAL A 127 8.895 -11.826 1.873 1.00 0.00 H new ATOM 0 HG22 VAL A 127 9.048 -12.702 3.414 1.00 0.00 H new ATOM 0 HG23 VAL A 127 7.674 -13.036 2.334 1.00 0.00 H new ATOM 1870 N VAL A 128 4.976 -10.173 4.924 1.00 0.00 N ATOM 1871 CA VAL A 128 4.217 -9.165 5.652 1.00 0.00 C ATOM 1872 C VAL A 128 3.762 -9.690 7.009 1.00 0.00 C ATOM 1873 O VAL A 128 3.992 -9.055 8.038 1.00 0.00 O ATOM 1874 CB VAL A 128 2.986 -8.728 4.836 1.00 0.00 C ATOM 1875 CG1 VAL A 128 2.061 -7.869 5.684 1.00 0.00 C ATOM 1876 CG2 VAL A 128 3.430 -7.977 3.590 1.00 0.00 C ATOM 0 H VAL A 128 4.557 -10.457 4.039 1.00 0.00 H new ATOM 0 HA VAL A 128 4.873 -8.309 5.811 1.00 0.00 H new ATOM 0 HB VAL A 128 2.433 -9.616 4.529 1.00 0.00 H new ATOM 0 HG11 VAL A 128 1.197 -7.570 5.091 1.00 0.00 H new ATOM 0 HG12 VAL A 128 1.726 -8.440 6.550 1.00 0.00 H new ATOM 0 HG13 VAL A 128 2.596 -6.981 6.020 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.554 -7.671 3.018 1.00 0.00 H new ATOM 0 HG22 VAL A 128 4.000 -7.094 3.881 1.00 0.00 H new ATOM 0 HG23 VAL A 128 4.055 -8.627 2.977 1.00 0.00 H new ATOM 1886 N ARG A 129 3.119 -10.852 7.002 1.00 0.00 N ATOM 1887 CA ARG A 129 2.552 -11.420 8.218 1.00 0.00 C ATOM 1888 C ARG A 129 3.609 -11.564 9.305 1.00 0.00 C ATOM 1889 O ARG A 129 3.346 -11.307 10.479 1.00 0.00 O ATOM 1890 CB ARG A 129 1.931 -12.780 7.935 1.00 0.00 C ATOM 1891 CG ARG A 129 1.288 -13.453 9.137 1.00 0.00 C ATOM 1892 CD ARG A 129 0.577 -14.700 8.755 1.00 0.00 C ATOM 1893 NE ARG A 129 -0.057 -15.336 9.897 1.00 0.00 N ATOM 1894 CZ ARG A 129 0.557 -16.197 10.731 1.00 0.00 C ATOM 1895 NH1 ARG A 129 1.818 -16.515 10.537 1.00 0.00 N ATOM 1896 NH2 ARG A 129 -0.107 -16.724 11.746 1.00 0.00 N ATOM 0 H ARG A 129 2.978 -11.419 6.166 1.00 0.00 H new ATOM 0 HA ARG A 129 1.780 -10.735 8.569 1.00 0.00 H new ATOM 0 HB2 ARG A 129 1.178 -12.664 7.156 1.00 0.00 H new ATOM 0 HB3 ARG A 129 2.702 -13.440 7.537 1.00 0.00 H new ATOM 0 HG2 ARG A 129 2.054 -13.683 9.878 1.00 0.00 H new ATOM 0 HG3 ARG A 129 0.587 -12.764 9.608 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -0.177 -14.471 8.002 1.00 0.00 H new ATOM 0 HD3 ARG A 129 1.282 -15.394 8.299 1.00 0.00 H new ATOM 0 HE ARG A 129 -1.036 -15.115 10.080 1.00 0.00 H new ATOM 0 HH11 ARG A 129 2.332 -16.110 9.755 1.00 0.00 H new ATOM 0 HH12 ARG A 129 2.283 -17.167 11.169 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -1.085 -16.479 11.898 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.359 -17.376 12.377 1.00 0.00 H new ATOM 1910 N THR A 130 4.807 -11.977 8.906 1.00 0.00 N ATOM 1911 CA THR A 130 5.912 -12.141 9.842 1.00 0.00 C ATOM 1912 C THR A 130 6.946 -11.035 9.675 1.00 0.00 C ATOM 1913 O THR A 130 8.150 -11.282 9.740 1.00 0.00 O ATOM 1914 CB THR A 130 6.590 -13.513 9.665 1.00 0.00 C ATOM 1915 OG1 THR A 130 6.982 -13.682 8.297 1.00 0.00 O ATOM 1916 CG2 THR A 130 5.638 -14.633 10.057 1.00 0.00 C ATOM 0 H THR A 130 5.037 -12.205 7.939 1.00 0.00 H new ATOM 0 HA THR A 130 5.494 -12.081 10.847 1.00 0.00 H new ATOM 0 HB THR A 130 7.468 -13.553 10.310 1.00 0.00 H new ATOM 0 HG1 THR A 130 6.187 -13.662 7.724 1.00 0.00 H new ATOM 0 HG21 THR A 130 6.134 -15.595 9.926 1.00 0.00 H new ATOM 0 HG22 THR A 130 5.347 -14.514 11.101 1.00 0.00 H new ATOM 0 HG23 THR A 130 4.750 -14.593 9.426 1.00 0.00 H new ATOM 1924 N MET A 131 6.468 -9.814 9.461 1.00 0.00 N ATOM 1925 CA MET A 131 7.347 -8.654 9.359 1.00 0.00 C ATOM 1926 C MET A 131 8.221 -8.516 10.599 1.00 0.00 C ATOM 1927 O MET A 131 7.763 -8.736 11.721 1.00 0.00 O ATOM 1928 CB MET A 131 6.523 -7.386 9.143 1.00 0.00 C ATOM 1929 CG MET A 131 7.350 -6.138 8.873 1.00 0.00 C ATOM 1930 SD MET A 131 6.331 -4.673 8.606 1.00 0.00 S ATOM 1931 CE MET A 131 5.622 -5.042 7.003 1.00 0.00 C ATOM 0 H MET A 131 5.476 -9.601 9.355 1.00 0.00 H new ATOM 0 HA MET A 131 8.003 -8.799 8.501 1.00 0.00 H new ATOM 0 HB2 MET A 131 5.845 -7.546 8.305 1.00 0.00 H new ATOM 0 HB3 MET A 131 5.905 -7.214 10.024 1.00 0.00 H new ATOM 0 HG2 MET A 131 8.020 -5.962 9.715 1.00 0.00 H new ATOM 0 HG3 MET A 131 7.977 -6.305 7.997 1.00 0.00 H new ATOM 0 HE1 MET A 131 5.332 -4.114 6.511 1.00 0.00 H new ATOM 0 HE2 MET A 131 6.358 -5.562 6.391 1.00 0.00 H new ATOM 0 HE3 MET A 131 4.744 -5.675 7.131 1.00 0.00 H new ATOM 1941 N LYS A 132 9.481 -8.150 10.390 1.00 0.00 N ATOM 1942 CA LYS A 132 10.439 -8.042 11.483 1.00 0.00 C ATOM 1943 C LYS A 132 10.208 -6.776 12.296 1.00 0.00 C ATOM 1944 O LYS A 132 9.744 -5.764 11.770 1.00 0.00 O ATOM 1945 CB LYS A 132 11.870 -8.068 10.945 1.00 0.00 C ATOM 1946 CG LYS A 132 12.297 -9.405 10.353 1.00 0.00 C ATOM 1947 CD LYS A 132 13.752 -9.376 9.911 1.00 0.00 C ATOM 1948 CE LYS A 132 14.189 -10.721 9.351 1.00 0.00 C ATOM 1949 NZ LYS A 132 15.619 -10.716 8.943 1.00 0.00 N ATOM 0 H LYS A 132 9.863 -7.923 9.472 1.00 0.00 H new ATOM 0 HA LYS A 132 10.292 -8.899 12.140 1.00 0.00 H new ATOM 0 HB2 LYS A 132 11.972 -7.297 10.181 1.00 0.00 H new ATOM 0 HB3 LYS A 132 12.554 -7.808 11.753 1.00 0.00 H new ATOM 0 HG2 LYS A 132 12.155 -10.194 11.092 1.00 0.00 H new ATOM 0 HG3 LYS A 132 11.661 -9.648 9.502 1.00 0.00 H new ATOM 0 HD2 LYS A 132 13.889 -8.603 9.154 1.00 0.00 H new ATOM 0 HD3 LYS A 132 14.386 -9.109 10.757 1.00 0.00 H new ATOM 0 HE2 LYS A 132 14.029 -11.495 10.101 1.00 0.00 H new ATOM 0 HE3 LYS A 132 13.568 -10.975 8.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 15.876 -11.651 8.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 15.768 -9.995 8.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 16.214 -10.499 9.767 1.00 0.00 H new ATOM 1963 N ASN A 133 10.533 -6.837 13.583 1.00 0.00 N ATOM 1964 CA ASN A 133 10.320 -5.708 14.482 1.00 0.00 C ATOM 1965 C ASN A 133 11.219 -4.535 14.116 1.00 0.00 C ATOM 1966 O ASN A 133 12.443 -4.627 14.203 1.00 0.00 O ATOM 1967 CB ASN A 133 10.545 -6.125 15.924 1.00 0.00 C ATOM 1968 CG ASN A 133 10.162 -5.050 16.902 1.00 0.00 C ATOM 1969 OD1 ASN A 133 10.180 -3.858 16.572 1.00 0.00 O ATOM 1970 ND2 ASN A 133 9.817 -5.445 18.101 1.00 0.00 N ATOM 0 H ASN A 133 10.945 -7.657 14.028 1.00 0.00 H new ATOM 0 HA ASN A 133 9.285 -5.383 14.373 1.00 0.00 H new ATOM 0 HB2 ASN A 133 9.966 -7.024 16.133 1.00 0.00 H new ATOM 0 HB3 ASN A 133 11.595 -6.382 16.065 1.00 0.00 H new ATOM 0 HD21 ASN A 133 9.549 -4.759 18.806 1.00 0.00 H new ATOM 0 HD22 ASN A 133 9.816 -6.439 18.330 1.00 0.00 H new ATOM 1977 N GLY A 134 10.604 -3.430 13.707 1.00 0.00 N ATOM 1978 CA GLY A 134 11.348 -2.239 13.318 1.00 0.00 C ATOM 1979 C GLY A 134 11.859 -2.351 11.887 1.00 0.00 C ATOM 1980 O GLY A 134 12.829 -1.693 11.511 1.00 0.00 O ATOM 0 H GLY A 134 9.591 -3.335 13.637 1.00 0.00 H new ATOM 0 HA2 GLY A 134 10.709 -1.361 13.411 1.00 0.00 H new ATOM 0 HA3 GLY A 134 12.189 -2.094 13.997 1.00 0.00 H new ATOM 1984 N ASP A 135 11.201 -3.188 11.093 1.00 0.00 N ATOM 1985 CA ASP A 135 11.576 -3.374 9.696 1.00 0.00 C ATOM 1986 C ASP A 135 11.844 -2.037 9.016 1.00 0.00 C ATOM 1987 O ASP A 135 11.061 -1.097 9.143 1.00 0.00 O ATOM 1988 CB ASP A 135 10.477 -4.125 8.940 1.00 0.00 C ATOM 1989 CG ASP A 135 10.936 -4.639 7.583 1.00 0.00 C ATOM 1990 OD1 ASP A 135 12.078 -4.431 7.246 1.00 0.00 O ATOM 1991 OD2 ASP A 135 10.142 -5.235 6.896 1.00 0.00 O ATOM 0 H ASP A 135 10.404 -3.749 11.393 1.00 0.00 H new ATOM 0 HA ASP A 135 12.492 -3.964 9.676 1.00 0.00 H new ATOM 0 HB2 ASP A 135 10.136 -4.965 9.545 1.00 0.00 H new ATOM 0 HB3 ASP A 135 9.621 -3.464 8.802 1.00 0.00 H new ATOM 1996 N VAL A 136 12.958 -1.960 8.294 1.00 0.00 N ATOM 1997 CA VAL A 136 13.314 -0.750 7.563 1.00 0.00 C ATOM 1998 C VAL A 136 13.226 -0.970 6.058 1.00 0.00 C ATOM 1999 O VAL A 136 13.746 -1.953 5.533 1.00 0.00 O ATOM 2000 CB VAL A 136 14.742 -0.306 7.931 1.00 0.00 C ATOM 2001 CG1 VAL A 136 15.123 0.951 7.160 1.00 0.00 C ATOM 2002 CG2 VAL A 136 14.841 -0.069 9.430 1.00 0.00 C ATOM 0 H VAL A 136 13.629 -2.722 8.200 1.00 0.00 H new ATOM 0 HA VAL A 136 12.605 0.028 7.844 1.00 0.00 H new ATOM 0 HB VAL A 136 15.440 -1.097 7.657 1.00 0.00 H new ATOM 0 HG11 VAL A 136 16.135 1.252 7.431 1.00 0.00 H new ATOM 0 HG12 VAL A 136 15.079 0.749 6.090 1.00 0.00 H new ATOM 0 HG13 VAL A 136 14.428 1.754 7.406 1.00 0.00 H new ATOM 0 HG21 VAL A 136 15.854 0.245 9.683 1.00 0.00 H new ATOM 0 HG22 VAL A 136 14.136 0.709 9.723 1.00 0.00 H new ATOM 0 HG23 VAL A 136 14.604 -0.991 9.961 1.00 0.00 H new ATOM 2012 N MET A 137 12.562 -0.046 5.368 1.00 0.00 N ATOM 2013 CA MET A 137 12.440 -0.115 3.918 1.00 0.00 C ATOM 2014 C MET A 137 13.757 0.235 3.236 1.00 0.00 C ATOM 2015 O MET A 137 14.532 1.047 3.742 1.00 0.00 O ATOM 2016 CB MET A 137 11.328 0.814 3.437 1.00 0.00 C ATOM 2017 CG MET A 137 9.933 0.424 3.909 1.00 0.00 C ATOM 2018 SD MET A 137 8.649 1.510 3.258 1.00 0.00 S ATOM 2019 CE MET A 137 7.234 0.972 4.213 1.00 0.00 C ATOM 0 H MET A 137 12.101 0.759 5.792 1.00 0.00 H new ATOM 0 HA MET A 137 12.186 -1.140 3.649 1.00 0.00 H new ATOM 0 HB2 MET A 137 11.544 1.826 3.779 1.00 0.00 H new ATOM 0 HB3 MET A 137 11.336 0.837 2.347 1.00 0.00 H new ATOM 0 HG2 MET A 137 9.724 -0.602 3.605 1.00 0.00 H new ATOM 0 HG3 MET A 137 9.903 0.445 4.998 1.00 0.00 H new ATOM 0 HE1 MET A 137 6.333 1.449 3.828 1.00 0.00 H new ATOM 0 HE2 MET A 137 7.133 -0.111 4.136 1.00 0.00 H new ATOM 0 HE3 MET A 137 7.373 1.250 5.258 1.00 0.00 H new ATOM 2029 N LYS A 138 14.004 -0.381 2.085 1.00 0.00 N ATOM 2030 CA LYS A 138 15.210 -0.107 1.313 1.00 0.00 C ATOM 2031 C LYS A 138 14.898 0.748 0.091 1.00 0.00 C ATOM 2032 O LYS A 138 15.571 1.745 -0.168 1.00 0.00 O ATOM 2033 CB LYS A 138 15.880 -1.413 0.885 1.00 0.00 C ATOM 2034 CG LYS A 138 17.179 -1.229 0.110 1.00 0.00 C ATOM 2035 CD LYS A 138 17.800 -2.569 -0.255 1.00 0.00 C ATOM 2036 CE LYS A 138 19.128 -2.387 -0.973 1.00 0.00 C ATOM 2037 NZ LYS A 138 19.775 -3.691 -1.286 1.00 0.00 N ATOM 0 H LYS A 138 13.384 -1.074 1.666 1.00 0.00 H new ATOM 0 HA LYS A 138 15.896 0.449 1.952 1.00 0.00 H new ATOM 0 HB2 LYS A 138 16.083 -2.011 1.773 1.00 0.00 H new ATOM 0 HB3 LYS A 138 15.182 -1.981 0.270 1.00 0.00 H new ATOM 0 HG2 LYS A 138 16.986 -0.656 -0.797 1.00 0.00 H new ATOM 0 HG3 LYS A 138 17.883 -0.651 0.708 1.00 0.00 H new ATOM 0 HD2 LYS A 138 17.951 -3.160 0.648 1.00 0.00 H new ATOM 0 HD3 LYS A 138 17.114 -3.129 -0.891 1.00 0.00 H new ATOM 0 HE2 LYS A 138 18.968 -1.831 -1.897 1.00 0.00 H new ATOM 0 HE3 LYS A 138 19.797 -1.790 -0.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 20.677 -3.522 -1.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 19.952 -4.212 -0.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 19.149 -4.251 -1.899 1.00 0.00 H new ATOM 2051 N GLU A 139 13.875 0.350 -0.657 1.00 0.00 N ATOM 2052 CA GLU A 139 13.492 1.061 -1.872 1.00 0.00 C ATOM 2053 C GLU A 139 12.036 0.794 -2.230 1.00 0.00 C ATOM 2054 O GLU A 139 11.598 -0.356 -2.277 1.00 0.00 O ATOM 2055 CB GLU A 139 14.396 0.651 -3.036 1.00 0.00 C ATOM 2056 CG GLU A 139 14.179 1.450 -4.313 1.00 0.00 C ATOM 2057 CD GLU A 139 15.143 1.083 -5.406 1.00 0.00 C ATOM 2058 OE1 GLU A 139 15.971 0.234 -5.181 1.00 0.00 O ATOM 2059 OE2 GLU A 139 15.052 1.653 -6.468 1.00 0.00 O ATOM 0 H GLU A 139 13.295 -0.462 -0.443 1.00 0.00 H new ATOM 0 HA GLU A 139 13.610 2.128 -1.685 1.00 0.00 H new ATOM 0 HB2 GLU A 139 15.436 0.758 -2.727 1.00 0.00 H new ATOM 0 HB3 GLU A 139 14.234 -0.405 -3.251 1.00 0.00 H new ATOM 0 HG2 GLU A 139 13.160 1.291 -4.666 1.00 0.00 H new ATOM 0 HG3 GLU A 139 14.277 2.513 -4.091 1.00 0.00 H new ATOM 2066 N VAL A 140 11.289 1.864 -2.481 1.00 0.00 N ATOM 2067 CA VAL A 140 9.858 1.755 -2.740 1.00 0.00 C ATOM 2068 C VAL A 140 9.490 2.389 -4.076 1.00 0.00 C ATOM 2069 O VAL A 140 9.869 3.526 -4.359 1.00 0.00 O ATOM 2070 CB VAL A 140 9.058 2.436 -1.614 1.00 0.00 C ATOM 2071 CG1 VAL A 140 7.564 2.338 -1.889 1.00 0.00 C ATOM 2072 CG2 VAL A 140 9.403 1.801 -0.276 1.00 0.00 C ATOM 0 H VAL A 140 11.651 2.817 -2.511 1.00 0.00 H new ATOM 0 HA VAL A 140 9.608 0.695 -2.776 1.00 0.00 H new ATOM 0 HB VAL A 140 9.327 3.492 -1.577 1.00 0.00 H new ATOM 0 HG11 VAL A 140 7.013 2.824 -1.084 1.00 0.00 H new ATOM 0 HG12 VAL A 140 7.335 2.830 -2.834 1.00 0.00 H new ATOM 0 HG13 VAL A 140 7.273 1.289 -1.946 1.00 0.00 H new ATOM 0 HG21 VAL A 140 8.833 2.288 0.515 1.00 0.00 H new ATOM 0 HG22 VAL A 140 9.154 0.740 -0.302 1.00 0.00 H new ATOM 0 HG23 VAL A 140 10.469 1.919 -0.081 1.00 0.00 H new ATOM 2082 N LYS A 141 8.751 1.648 -4.894 1.00 0.00 N ATOM 2083 CA LYS A 141 8.373 2.117 -6.221 1.00 0.00 C ATOM 2084 C LYS A 141 6.860 2.111 -6.397 1.00 0.00 C ATOM 2085 O LYS A 141 6.161 1.286 -5.811 1.00 0.00 O ATOM 2086 CB LYS A 141 9.031 1.257 -7.301 1.00 0.00 C ATOM 2087 CG LYS A 141 10.551 1.351 -7.341 1.00 0.00 C ATOM 2088 CD LYS A 141 11.127 0.509 -8.470 1.00 0.00 C ATOM 2089 CE LYS A 141 12.645 0.601 -8.511 1.00 0.00 C ATOM 2090 NZ LYS A 141 13.222 -0.198 -9.625 1.00 0.00 N ATOM 0 H LYS A 141 8.402 0.719 -4.661 1.00 0.00 H new ATOM 0 HA LYS A 141 8.724 3.144 -6.324 1.00 0.00 H new ATOM 0 HB2 LYS A 141 8.748 0.217 -7.142 1.00 0.00 H new ATOM 0 HB3 LYS A 141 8.635 1.551 -8.273 1.00 0.00 H new ATOM 0 HG2 LYS A 141 10.850 2.391 -7.471 1.00 0.00 H new ATOM 0 HG3 LYS A 141 10.963 1.018 -6.389 1.00 0.00 H new ATOM 0 HD2 LYS A 141 10.827 -0.531 -8.340 1.00 0.00 H new ATOM 0 HD3 LYS A 141 10.715 0.843 -9.422 1.00 0.00 H new ATOM 0 HE2 LYS A 141 12.942 1.644 -8.621 1.00 0.00 H new ATOM 0 HE3 LYS A 141 13.055 0.251 -7.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 14.258 -0.108 -9.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 12.961 -1.198 -9.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 12.851 0.152 -10.531 1.00 0.00 H new ATOM 2104 N VAL A 142 6.360 3.038 -7.208 1.00 0.00 N ATOM 2105 CA VAL A 142 4.945 3.066 -7.559 1.00 0.00 C ATOM 2106 C VAL A 142 4.751 2.982 -9.068 1.00 0.00 C ATOM 2107 O VAL A 142 5.476 3.618 -9.833 1.00 0.00 O ATOM 2108 CB VAL A 142 4.289 4.354 -7.030 1.00 0.00 C ATOM 2109 CG1 VAL A 142 2.823 4.410 -7.436 1.00 0.00 C ATOM 2110 CG2 VAL A 142 4.433 4.425 -5.518 1.00 0.00 C ATOM 0 H VAL A 142 6.915 3.780 -7.635 1.00 0.00 H new ATOM 0 HA VAL A 142 4.471 2.199 -7.098 1.00 0.00 H new ATOM 0 HB VAL A 142 4.794 5.215 -7.469 1.00 0.00 H new ATOM 0 HG11 VAL A 142 2.374 5.327 -7.054 1.00 0.00 H new ATOM 0 HG12 VAL A 142 2.746 4.394 -8.523 1.00 0.00 H new ATOM 0 HG13 VAL A 142 2.298 3.549 -7.022 1.00 0.00 H new ATOM 0 HG21 VAL A 142 3.967 5.339 -5.151 1.00 0.00 H new ATOM 0 HG22 VAL A 142 3.946 3.562 -5.065 1.00 0.00 H new ATOM 0 HG23 VAL A 142 5.490 4.425 -5.253 1.00 0.00 H new ATOM 2120 N PHE A 143 3.768 2.195 -9.490 1.00 0.00 N ATOM 2121 CA PHE A 143 3.588 1.885 -10.904 1.00 0.00 C ATOM 2122 C PHE A 143 2.180 2.231 -11.369 1.00 0.00 C ATOM 2123 O PHE A 143 1.214 1.559 -11.009 1.00 0.00 O ATOM 2124 CB PHE A 143 3.868 0.403 -11.165 1.00 0.00 C ATOM 2125 CG PHE A 143 5.217 -0.053 -10.688 1.00 0.00 C ATOM 2126 CD1 PHE A 143 6.329 0.046 -11.510 1.00 0.00 C ATOM 2127 CD2 PHE A 143 5.377 -0.580 -9.416 1.00 0.00 C ATOM 2128 CE1 PHE A 143 7.571 -0.373 -11.075 1.00 0.00 C ATOM 2129 CE2 PHE A 143 6.619 -0.999 -8.976 1.00 0.00 C ATOM 2130 CZ PHE A 143 7.716 -0.896 -9.805 1.00 0.00 C ATOM 0 H PHE A 143 3.083 1.759 -8.873 1.00 0.00 H new ATOM 0 HA PHE A 143 4.296 2.490 -11.469 1.00 0.00 H new ATOM 0 HB2 PHE A 143 3.099 -0.194 -10.675 1.00 0.00 H new ATOM 0 HB3 PHE A 143 3.787 0.211 -12.235 1.00 0.00 H new ATOM 0 HD1 PHE A 143 6.223 0.456 -12.503 1.00 0.00 H new ATOM 0 HD2 PHE A 143 4.522 -0.664 -8.761 1.00 0.00 H new ATOM 0 HE1 PHE A 143 8.428 -0.292 -11.727 1.00 0.00 H new ATOM 0 HE2 PHE A 143 6.730 -1.407 -7.982 1.00 0.00 H new ATOM 0 HZ PHE A 143 8.686 -1.224 -9.462 1.00 0.00 H new ATOM 2140 N ASP A 144 2.069 3.283 -12.172 1.00 0.00 N ATOM 2141 CA ASP A 144 0.785 3.694 -12.724 1.00 0.00 C ATOM 2142 C ASP A 144 0.400 2.836 -13.924 1.00 0.00 C ATOM 2143 O ASP A 144 1.195 2.648 -14.845 1.00 0.00 O ATOM 2144 CB ASP A 144 0.825 5.168 -13.136 1.00 0.00 C ATOM 2145 CG ASP A 144 -0.514 5.675 -13.653 1.00 0.00 C ATOM 2146 OD1 ASP A 144 -1.439 5.753 -12.878 1.00 0.00 O ATOM 2147 OD2 ASP A 144 -0.602 5.980 -14.820 1.00 0.00 O ATOM 0 H ASP A 144 2.855 3.868 -12.455 1.00 0.00 H new ATOM 0 HA ASP A 144 0.033 3.559 -11.947 1.00 0.00 H new ATOM 0 HB2 ASP A 144 1.130 5.771 -12.281 1.00 0.00 H new ATOM 0 HB3 ASP A 144 1.582 5.304 -13.908 1.00 0.00 H new ATOM 2152 N GLU A 145 -0.823 2.319 -13.906 1.00 0.00 N ATOM 2153 CA GLU A 145 -1.293 1.429 -14.961 1.00 0.00 C ATOM 2154 C GLU A 145 -2.379 2.094 -15.798 1.00 0.00 C ATOM 2155 O GLU A 145 -3.074 2.995 -15.328 1.00 0.00 O ATOM 2156 CB GLU A 145 -1.824 0.124 -14.363 1.00 0.00 C ATOM 2157 CG GLU A 145 -0.822 -0.623 -13.495 1.00 0.00 C ATOM 2158 CD GLU A 145 0.415 -1.030 -14.248 1.00 0.00 C ATOM 2159 OE1 GLU A 145 0.284 -1.660 -15.269 1.00 0.00 O ATOM 2160 OE2 GLU A 145 1.491 -0.712 -13.800 1.00 0.00 O ATOM 0 H GLU A 145 -1.508 2.501 -13.172 1.00 0.00 H new ATOM 0 HA GLU A 145 -0.446 1.206 -15.610 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -2.709 0.346 -13.766 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -2.142 -0.530 -15.175 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -0.538 0.007 -12.653 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -1.299 -1.512 -13.081 1.00 0.00 H new ATOM 2167 N PRO A 146 -2.521 1.645 -17.040 1.00 0.00 N ATOM 2168 CA PRO A 146 -3.511 2.207 -17.950 1.00 0.00 C ATOM 2169 C PRO A 146 -4.902 1.658 -17.658 1.00 0.00 C ATOM 2170 O PRO A 146 -5.642 2.281 -17.404 1.00 0.00 O ATOM 2171 CB PRO A 146 -3.006 1.761 -19.327 1.00 0.00 C ATOM 2172 CG PRO A 146 -2.342 0.453 -19.066 1.00 0.00 C ATOM 2173 CD PRO A 146 -1.679 0.630 -17.727 1.00 0.00 C ATOM 2174 OXT PRO A 146 -5.109 0.478 -17.732 1.00 0.00 O ATOM 0 HA PRO A 146 -3.611 3.289 -17.864 1.00 0.00 H new ATOM 0 HB2 PRO A 146 -3.826 1.657 -20.037 1.00 0.00 H new ATOM 0 HB3 PRO A 146 -2.309 2.485 -19.749 1.00 0.00 H new ATOM 0 HG2 PRO A 146 -3.065 -0.363 -19.047 1.00 0.00 H new ATOM 0 HG3 PRO A 146 -1.614 0.215 -19.842 1.00 0.00 H new ATOM 0 HD2 PRO A 146 -1.648 -0.306 -17.170 1.00 0.00 H new ATOM 0 HD3 PRO A 146 -0.649 0.971 -17.833 1.00 0.00 H new TER 2182 PRO A 146