USER MOD reduce.3.24.130724 H: found=0, std=0, add=869, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 871 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 68 TYR OH : rot 15:sc= 0.892 USER MOD Set 1.2: A 101 LYS NZ :NH3+ -158:sc= 1.04 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot -160:sc= -0.13 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= -0.0913 X(o=-0.091,f=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -0.487 X(o=-0.49,f=-0.69) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 146:sc= 0.742 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 120:sc= -0.218 USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 ASN : amide:sc= -0.971 K(o=-0.97,f=-2.7) USER MOD Single : A 76 SER OG : rot 31:sc= 0.132 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -170:sc= -0.839 USER MOD Single : A 98 SER OG : rot 180:sc= 0.046 USER MOD Single : A 100 GLN : amide:sc= -0.106 X(o=-0.11,f=-0.0017) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 90:sc= 1.05 USER MOD ----------------------------------------------------------------- ATOM 18 N LEU A 2 3.959 0.308 -1.669 1.00 0.00 N ATOM 19 CA LEU A 2 5.401 0.104 -1.575 1.00 0.00 C ATOM 20 C LEU A 2 6.110 1.395 -1.179 1.00 0.00 C ATOM 21 O LEU A 2 5.468 2.417 -0.932 1.00 0.00 O ATOM 22 CB LEU A 2 5.951 -0.406 -2.908 1.00 0.00 C ATOM 23 CG LEU A 2 6.484 -1.839 -2.911 1.00 0.00 C ATOM 24 CD1 LEU A 2 6.754 -2.305 -4.333 1.00 0.00 C ATOM 25 CD2 LEU A 2 7.745 -1.941 -2.066 1.00 0.00 C ATOM 0 HA LEU A 2 5.588 -0.642 -0.802 1.00 0.00 H new ATOM 0 HB2 LEU A 2 5.161 -0.332 -3.656 1.00 0.00 H new ATOM 0 HB3 LEU A 2 6.754 0.259 -3.225 1.00 0.00 H new ATOM 0 HG LEU A 2 5.725 -2.489 -2.475 1.00 0.00 H new ATOM 0 HD11 LEU A 2 7.133 -3.327 -4.315 1.00 0.00 H new ATOM 0 HD12 LEU A 2 5.829 -2.271 -4.909 1.00 0.00 H new ATOM 0 HD13 LEU A 2 7.494 -1.652 -4.796 1.00 0.00 H new ATOM 0 HD21 LEU A 2 8.110 -2.968 -2.080 1.00 0.00 H new ATOM 0 HD22 LEU A 2 8.510 -1.279 -2.472 1.00 0.00 H new ATOM 0 HD23 LEU A 2 7.520 -1.650 -1.040 1.00 0.00 H new ATOM 37 N LEU A 3 7.436 1.342 -1.122 1.00 0.00 N ATOM 38 CA LEU A 3 8.233 2.508 -0.758 1.00 0.00 C ATOM 39 C LEU A 3 9.545 2.535 -1.535 1.00 0.00 C ATOM 40 O LEU A 3 10.622 2.660 -0.951 1.00 0.00 O ATOM 41 CB LEU A 3 8.517 2.508 0.745 1.00 0.00 C ATOM 42 CG LEU A 3 7.300 2.660 1.658 1.00 0.00 C ATOM 43 CD1 LEU A 3 6.799 1.297 2.110 1.00 0.00 C ATOM 44 CD2 LEU A 3 7.639 3.530 2.859 1.00 0.00 C ATOM 0 H LEU A 3 7.982 0.504 -1.323 1.00 0.00 H new ATOM 0 HA LEU A 3 7.662 3.401 -1.013 1.00 0.00 H new ATOM 0 HB2 LEU A 3 9.023 1.576 0.999 1.00 0.00 H new ATOM 0 HB3 LEU A 3 9.213 3.318 0.963 1.00 0.00 H new ATOM 0 HG LEU A 3 6.505 3.148 1.094 1.00 0.00 H new ATOM 0 HD11 LEU A 3 5.933 1.425 2.759 1.00 0.00 H new ATOM 0 HD12 LEU A 3 6.516 0.706 1.239 1.00 0.00 H new ATOM 0 HD13 LEU A 3 7.589 0.782 2.657 1.00 0.00 H new ATOM 0 HD21 LEU A 3 6.761 3.627 3.497 1.00 0.00 H new ATOM 0 HD22 LEU A 3 8.450 3.070 3.424 1.00 0.00 H new ATOM 0 HD23 LEU A 3 7.950 4.517 2.517 1.00 0.00 H new ATOM 56 N ILE A 4 9.447 2.418 -2.855 1.00 0.00 N ATOM 57 CA ILE A 4 10.626 2.432 -3.712 1.00 0.00 C ATOM 58 C ILE A 4 10.332 3.119 -5.041 1.00 0.00 C ATOM 59 O ILE A 4 9.182 3.432 -5.351 1.00 0.00 O ATOM 60 CB ILE A 4 11.139 1.006 -3.987 1.00 0.00 C ATOM 61 CG1 ILE A 4 10.057 0.176 -4.682 1.00 0.00 C ATOM 62 CG2 ILE A 4 11.573 0.339 -2.691 1.00 0.00 C ATOM 63 CD1 ILE A 4 10.583 -1.090 -5.320 1.00 0.00 C ATOM 0 H ILE A 4 8.564 2.313 -3.354 1.00 0.00 H new ATOM 0 HA ILE A 4 11.396 2.990 -3.180 1.00 0.00 H new ATOM 0 HB ILE A 4 12.004 1.069 -4.648 1.00 0.00 H new ATOM 0 HG12 ILE A 4 9.288 -0.086 -3.955 1.00 0.00 H new ATOM 0 HG13 ILE A 4 9.578 0.787 -5.447 1.00 0.00 H new ATOM 0 HG21 ILE A 4 11.933 -0.668 -2.903 1.00 0.00 H new ATOM 0 HG22 ILE A 4 12.372 0.921 -2.232 1.00 0.00 H new ATOM 0 HG23 ILE A 4 10.725 0.285 -2.008 1.00 0.00 H new ATOM 0 HD11 ILE A 4 9.761 -1.627 -5.793 1.00 0.00 H new ATOM 0 HD12 ILE A 4 11.331 -0.835 -6.071 1.00 0.00 H new ATOM 0 HD13 ILE A 4 11.037 -1.721 -4.556 1.00 0.00 H new ATOM 75 N THR A 5 11.380 3.352 -5.826 1.00 0.00 N ATOM 76 CA THR A 5 11.235 4.001 -7.122 1.00 0.00 C ATOM 77 C THR A 5 11.649 3.068 -8.254 1.00 0.00 C ATOM 78 O THR A 5 12.374 2.094 -8.054 1.00 0.00 O ATOM 79 CB THR A 5 12.074 5.290 -7.202 1.00 0.00 C ATOM 80 OG1 THR A 5 13.263 5.150 -6.417 1.00 0.00 O ATOM 81 CG2 THR A 5 11.275 6.488 -6.711 1.00 0.00 C ATOM 0 H THR A 5 12.339 3.100 -5.586 1.00 0.00 H new ATOM 0 HA THR A 5 10.181 4.255 -7.231 1.00 0.00 H new ATOM 0 HB THR A 5 12.344 5.456 -8.245 1.00 0.00 H new ATOM 0 HG1 THR A 5 13.792 5.973 -6.475 1.00 0.00 H new ATOM 0 HG21 THR A 5 11.889 7.386 -6.777 1.00 0.00 H new ATOM 0 HG22 THR A 5 10.385 6.610 -7.329 1.00 0.00 H new ATOM 0 HG23 THR A 5 10.978 6.327 -5.675 1.00 0.00 H new ATOM 89 N PRO A 6 11.179 3.371 -9.474 1.00 0.00 N ATOM 90 CA PRO A 6 11.489 2.571 -10.663 1.00 0.00 C ATOM 91 C PRO A 6 12.948 2.703 -11.085 1.00 0.00 C ATOM 92 O PRO A 6 13.566 1.734 -11.527 1.00 0.00 O ATOM 93 CB PRO A 6 10.567 3.158 -11.735 1.00 0.00 C ATOM 94 CG PRO A 6 10.308 4.555 -11.289 1.00 0.00 C ATOM 95 CD PRO A 6 10.309 4.517 -9.786 1.00 0.00 C ATOM 0 HA PRO A 6 11.339 1.506 -10.489 1.00 0.00 H new ATOM 0 HB2 PRO A 6 11.039 3.137 -12.717 1.00 0.00 H new ATOM 0 HB3 PRO A 6 9.640 2.590 -11.814 1.00 0.00 H new ATOM 0 HG2 PRO A 6 11.076 5.233 -11.663 1.00 0.00 H new ATOM 0 HG3 PRO A 6 9.352 4.915 -11.670 1.00 0.00 H new ATOM 0 HD2 PRO A 6 10.696 5.443 -9.361 1.00 0.00 H new ATOM 0 HD3 PRO A 6 9.304 4.379 -9.387 1.00 0.00 H new ATOM 103 N ASP A 7 13.493 3.906 -10.946 1.00 0.00 N ATOM 104 CA ASP A 7 14.881 4.164 -11.312 1.00 0.00 C ATOM 105 C ASP A 7 15.828 3.270 -10.517 1.00 0.00 C ATOM 106 O ASP A 7 16.896 2.897 -11.000 1.00 0.00 O ATOM 107 CB ASP A 7 15.229 5.635 -11.075 1.00 0.00 C ATOM 108 CG ASP A 7 15.062 6.477 -12.324 1.00 0.00 C ATOM 109 OD1 ASP A 7 16.088 6.849 -12.931 1.00 0.00 O ATOM 110 OD2 ASP A 7 13.905 6.765 -12.696 1.00 0.00 O ATOM 0 H ASP A 7 12.995 4.718 -10.582 1.00 0.00 H new ATOM 0 HA ASP A 7 14.999 3.937 -12.372 1.00 0.00 H new ATOM 0 HB2 ASP A 7 14.593 6.033 -10.284 1.00 0.00 H new ATOM 0 HB3 ASP A 7 16.258 5.710 -10.725 1.00 0.00 H new ATOM 115 N GLU A 8 15.428 2.932 -9.295 1.00 0.00 N ATOM 116 CA GLU A 8 16.242 2.084 -8.433 1.00 0.00 C ATOM 117 C GLU A 8 16.248 0.643 -8.936 1.00 0.00 C ATOM 118 O GLU A 8 17.282 -0.026 -8.928 1.00 0.00 O ATOM 119 CB GLU A 8 15.722 2.132 -6.995 1.00 0.00 C ATOM 120 CG GLU A 8 16.786 2.503 -5.975 1.00 0.00 C ATOM 121 CD GLU A 8 17.891 1.468 -5.881 1.00 0.00 C ATOM 122 OE1 GLU A 8 17.572 0.261 -5.871 1.00 0.00 O ATOM 123 OE2 GLU A 8 19.073 1.866 -5.817 1.00 0.00 O ATOM 0 H GLU A 8 14.546 3.232 -8.880 1.00 0.00 H new ATOM 0 HA GLU A 8 17.264 2.462 -8.455 1.00 0.00 H new ATOM 0 HB2 GLU A 8 14.907 2.853 -6.936 1.00 0.00 H new ATOM 0 HB3 GLU A 8 15.306 1.159 -6.735 1.00 0.00 H new ATOM 0 HG2 GLU A 8 17.218 3.467 -6.241 1.00 0.00 H new ATOM 0 HG3 GLU A 8 16.320 2.622 -4.997 1.00 0.00 H new ATOM 130 N LEU A 9 15.085 0.170 -9.372 1.00 0.00 N ATOM 131 CA LEU A 9 14.954 -1.191 -9.878 1.00 0.00 C ATOM 132 C LEU A 9 15.985 -1.468 -10.969 1.00 0.00 C ATOM 133 O LEU A 9 16.676 -2.487 -10.941 1.00 0.00 O ATOM 134 CB LEU A 9 13.544 -1.420 -10.424 1.00 0.00 C ATOM 135 CG LEU A 9 13.380 -2.595 -11.389 1.00 0.00 C ATOM 136 CD1 LEU A 9 13.953 -3.867 -10.784 1.00 0.00 C ATOM 137 CD2 LEU A 9 11.914 -2.787 -11.751 1.00 0.00 C ATOM 0 H LEU A 9 14.220 0.710 -9.385 1.00 0.00 H new ATOM 0 HA LEU A 9 15.133 -1.878 -9.051 1.00 0.00 H new ATOM 0 HB2 LEU A 9 12.870 -1.571 -9.581 1.00 0.00 H new ATOM 0 HB3 LEU A 9 13.221 -0.511 -10.932 1.00 0.00 H new ATOM 0 HG LEU A 9 13.933 -2.371 -12.301 1.00 0.00 H new ATOM 0 HD11 LEU A 9 13.827 -4.692 -11.485 1.00 0.00 H new ATOM 0 HD12 LEU A 9 15.014 -3.726 -10.577 1.00 0.00 H new ATOM 0 HD13 LEU A 9 13.429 -4.096 -9.856 1.00 0.00 H new ATOM 0 HD21 LEU A 9 11.816 -3.627 -12.438 1.00 0.00 H new ATOM 0 HD22 LEU A 9 11.339 -2.989 -10.847 1.00 0.00 H new ATOM 0 HD23 LEU A 9 11.535 -1.883 -12.227 1.00 0.00 H new ATOM 149 N LYS A 10 16.084 -0.554 -11.927 1.00 0.00 N ATOM 150 CA LYS A 10 17.032 -0.696 -13.026 1.00 0.00 C ATOM 151 C LYS A 10 18.464 -0.497 -12.538 1.00 0.00 C ATOM 152 O LYS A 10 19.405 -1.059 -13.099 1.00 0.00 O ATOM 153 CB LYS A 10 16.715 0.310 -14.134 1.00 0.00 C ATOM 154 CG LYS A 10 16.596 1.741 -13.641 1.00 0.00 C ATOM 155 CD LYS A 10 16.476 2.721 -14.796 1.00 0.00 C ATOM 156 CE LYS A 10 15.056 3.246 -14.937 1.00 0.00 C ATOM 157 NZ LYS A 10 14.673 3.434 -16.364 1.00 0.00 N ATOM 0 H LYS A 10 15.519 0.294 -11.965 1.00 0.00 H new ATOM 0 HA LYS A 10 16.939 -1.706 -13.424 1.00 0.00 H new ATOM 0 HB2 LYS A 10 17.496 0.260 -14.893 1.00 0.00 H new ATOM 0 HB3 LYS A 10 15.782 0.023 -14.618 1.00 0.00 H new ATOM 0 HG2 LYS A 10 15.724 1.832 -12.993 1.00 0.00 H new ATOM 0 HG3 LYS A 10 17.469 1.993 -13.038 1.00 0.00 H new ATOM 0 HD2 LYS A 10 17.159 3.555 -14.639 1.00 0.00 H new ATOM 0 HD3 LYS A 10 16.778 2.232 -15.722 1.00 0.00 H new ATOM 0 HE2 LYS A 10 14.363 2.550 -14.464 1.00 0.00 H new ATOM 0 HE3 LYS A 10 14.966 4.195 -14.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 13.698 3.793 -16.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 15.318 4.117 -16.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 14.734 2.523 -16.863 1.00 0.00 H new ATOM 171 N SER A 11 18.621 0.305 -11.490 1.00 0.00 N ATOM 172 CA SER A 11 19.938 0.580 -10.929 1.00 0.00 C ATOM 173 C SER A 11 20.528 -0.673 -10.288 1.00 0.00 C ATOM 174 O SER A 11 21.734 -0.910 -10.356 1.00 0.00 O ATOM 175 CB SER A 11 19.851 1.703 -9.894 1.00 0.00 C ATOM 176 OG SER A 11 21.052 2.455 -9.854 1.00 0.00 O ATOM 0 H SER A 11 17.852 0.776 -11.012 1.00 0.00 H new ATOM 0 HA SER A 11 20.593 0.895 -11.742 1.00 0.00 H new ATOM 0 HB2 SER A 11 19.015 2.360 -10.135 1.00 0.00 H new ATOM 0 HB3 SER A 11 19.650 1.280 -8.910 1.00 0.00 H new ATOM 0 HG SER A 11 20.970 3.167 -9.186 1.00 0.00 H new ATOM 182 N TYR A 12 19.668 -1.471 -9.665 1.00 0.00 N ATOM 183 CA TYR A 12 20.103 -2.699 -9.010 1.00 0.00 C ATOM 184 C TYR A 12 20.054 -3.879 -9.975 1.00 0.00 C ATOM 185 O TYR A 12 21.015 -4.638 -10.096 1.00 0.00 O ATOM 186 CB TYR A 12 19.227 -2.988 -7.789 1.00 0.00 C ATOM 187 CG TYR A 12 19.505 -4.328 -7.148 1.00 0.00 C ATOM 188 CD1 TYR A 12 20.685 -4.554 -6.449 1.00 0.00 C ATOM 189 CD2 TYR A 12 18.589 -5.369 -7.240 1.00 0.00 C ATOM 190 CE1 TYR A 12 20.944 -5.778 -5.862 1.00 0.00 C ATOM 191 CE2 TYR A 12 18.839 -6.595 -6.655 1.00 0.00 C ATOM 192 CZ TYR A 12 20.018 -6.794 -5.967 1.00 0.00 C ATOM 193 OH TYR A 12 20.271 -8.015 -5.384 1.00 0.00 O ATOM 0 H TYR A 12 18.666 -1.290 -9.600 1.00 0.00 H new ATOM 0 HA TYR A 12 21.134 -2.561 -8.686 1.00 0.00 H new ATOM 0 HB2 TYR A 12 19.379 -2.202 -7.049 1.00 0.00 H new ATOM 0 HB3 TYR A 12 18.179 -2.947 -8.086 1.00 0.00 H new ATOM 0 HD1 TYR A 12 21.412 -3.760 -6.363 1.00 0.00 H new ATOM 0 HD2 TYR A 12 17.665 -5.217 -7.778 1.00 0.00 H new ATOM 0 HE1 TYR A 12 21.867 -5.938 -5.324 1.00 0.00 H new ATOM 0 HE2 TYR A 12 18.116 -7.393 -6.736 1.00 0.00 H new ATOM 0 HH TYR A 12 19.518 -8.619 -5.550 1.00 0.00 H new ATOM 203 N SER A 13 18.925 -4.027 -10.662 1.00 0.00 N ATOM 204 CA SER A 13 18.748 -5.115 -11.616 1.00 0.00 C ATOM 205 C SER A 13 19.823 -5.072 -12.697 1.00 0.00 C ATOM 206 O SER A 13 20.478 -4.048 -12.897 1.00 0.00 O ATOM 207 CB SER A 13 17.361 -5.039 -12.257 1.00 0.00 C ATOM 208 OG SER A 13 17.212 -6.019 -13.270 1.00 0.00 O ATOM 0 H SER A 13 18.120 -3.407 -10.575 1.00 0.00 H new ATOM 0 HA SER A 13 18.840 -6.057 -11.075 1.00 0.00 H new ATOM 0 HB2 SER A 13 16.596 -5.182 -11.494 1.00 0.00 H new ATOM 0 HB3 SER A 13 17.207 -4.047 -12.681 1.00 0.00 H new ATOM 0 HG SER A 13 16.478 -5.763 -13.867 1.00 0.00 H new ATOM 214 N VAL A 14 20.001 -6.191 -13.392 1.00 0.00 N ATOM 215 CA VAL A 14 20.996 -6.282 -14.454 1.00 0.00 C ATOM 216 C VAL A 14 20.333 -6.484 -15.812 1.00 0.00 C ATOM 217 O VAL A 14 20.902 -6.143 -16.849 1.00 0.00 O ATOM 218 CB VAL A 14 21.984 -7.436 -14.200 1.00 0.00 C ATOM 219 CG1 VAL A 14 22.648 -7.281 -12.841 1.00 0.00 C ATOM 220 CG2 VAL A 14 21.274 -8.777 -14.306 1.00 0.00 C ATOM 0 H VAL A 14 19.469 -7.048 -13.239 1.00 0.00 H new ATOM 0 HA VAL A 14 21.543 -5.339 -14.457 1.00 0.00 H new ATOM 0 HB VAL A 14 22.761 -7.401 -14.963 1.00 0.00 H new ATOM 0 HG11 VAL A 14 23.343 -8.105 -12.679 1.00 0.00 H new ATOM 0 HG12 VAL A 14 23.191 -6.337 -12.807 1.00 0.00 H new ATOM 0 HG13 VAL A 14 21.887 -7.290 -12.061 1.00 0.00 H new ATOM 0 HG21 VAL A 14 21.987 -9.581 -14.124 1.00 0.00 H new ATOM 0 HG22 VAL A 14 20.475 -8.825 -13.566 1.00 0.00 H new ATOM 0 HG23 VAL A 14 20.851 -8.887 -15.304 1.00 0.00 H new ATOM 230 N PHE A 15 19.126 -7.040 -15.798 1.00 0.00 N ATOM 231 CA PHE A 15 18.385 -7.289 -17.029 1.00 0.00 C ATOM 232 C PHE A 15 18.169 -5.993 -17.805 1.00 0.00 C ATOM 233 O PHE A 15 17.487 -5.083 -17.336 1.00 0.00 O ATOM 234 CB PHE A 15 17.036 -7.939 -16.715 1.00 0.00 C ATOM 235 CG PHE A 15 16.979 -9.400 -17.060 1.00 0.00 C ATOM 236 CD1 PHE A 15 16.918 -10.359 -16.062 1.00 0.00 C ATOM 237 CD2 PHE A 15 16.988 -9.814 -18.382 1.00 0.00 C ATOM 238 CE1 PHE A 15 16.866 -11.704 -16.376 1.00 0.00 C ATOM 239 CE2 PHE A 15 16.935 -11.157 -18.703 1.00 0.00 C ATOM 240 CZ PHE A 15 16.875 -12.104 -17.698 1.00 0.00 C ATOM 0 H PHE A 15 18.640 -7.327 -14.948 1.00 0.00 H new ATOM 0 HA PHE A 15 18.973 -7.968 -17.646 1.00 0.00 H new ATOM 0 HB2 PHE A 15 16.821 -7.816 -15.654 1.00 0.00 H new ATOM 0 HB3 PHE A 15 16.253 -7.414 -17.262 1.00 0.00 H new ATOM 0 HD1 PHE A 15 16.911 -10.052 -15.027 1.00 0.00 H new ATOM 0 HD2 PHE A 15 17.037 -9.078 -19.171 1.00 0.00 H new ATOM 0 HE1 PHE A 15 16.818 -12.441 -15.588 1.00 0.00 H new ATOM 0 HE2 PHE A 15 16.940 -11.466 -19.738 1.00 0.00 H new ATOM 0 HZ PHE A 15 16.835 -13.154 -17.946 1.00 0.00 H new ATOM 250 N GLU A 16 18.756 -5.919 -18.996 1.00 0.00 N ATOM 251 CA GLU A 16 18.630 -4.734 -19.836 1.00 0.00 C ATOM 252 C GLU A 16 17.166 -4.453 -20.163 1.00 0.00 C ATOM 253 O GLU A 16 16.800 -3.329 -20.507 1.00 0.00 O ATOM 254 CB GLU A 16 19.427 -4.912 -21.130 1.00 0.00 C ATOM 255 CG GLU A 16 19.375 -3.702 -22.048 1.00 0.00 C ATOM 256 CD GLU A 16 20.047 -3.954 -23.384 1.00 0.00 C ATOM 257 OE1 GLU A 16 21.257 -4.265 -23.389 1.00 0.00 O ATOM 258 OE2 GLU A 16 19.365 -3.840 -24.423 1.00 0.00 O ATOM 0 H GLU A 16 19.323 -6.665 -19.400 1.00 0.00 H new ATOM 0 HA GLU A 16 19.032 -3.884 -19.284 1.00 0.00 H new ATOM 0 HB2 GLU A 16 20.467 -5.124 -20.880 1.00 0.00 H new ATOM 0 HB3 GLU A 16 19.045 -5.781 -21.666 1.00 0.00 H new ATOM 0 HG2 GLU A 16 18.335 -3.422 -22.216 1.00 0.00 H new ATOM 0 HG3 GLU A 16 19.857 -2.857 -21.557 1.00 0.00 H new ATOM 265 N SER A 17 16.333 -5.483 -20.054 1.00 0.00 N ATOM 266 CA SER A 17 14.910 -5.349 -20.342 1.00 0.00 C ATOM 267 C SER A 17 14.216 -4.511 -19.273 1.00 0.00 C ATOM 268 O SER A 17 13.289 -3.755 -19.565 1.00 0.00 O ATOM 269 CB SER A 17 14.253 -6.728 -20.430 1.00 0.00 C ATOM 270 OG SER A 17 14.795 -7.484 -21.500 1.00 0.00 O ATOM 0 H SER A 17 16.619 -6.419 -19.768 1.00 0.00 H new ATOM 0 HA SER A 17 14.805 -4.843 -21.302 1.00 0.00 H new ATOM 0 HB2 SER A 17 14.398 -7.264 -19.492 1.00 0.00 H new ATOM 0 HB3 SER A 17 13.178 -6.614 -20.569 1.00 0.00 H new ATOM 0 HG SER A 17 14.360 -8.361 -21.534 1.00 0.00 H new ATOM 276 N VAL A 18 14.672 -4.650 -18.032 1.00 0.00 N ATOM 277 CA VAL A 18 14.096 -3.905 -16.918 1.00 0.00 C ATOM 278 C VAL A 18 14.542 -2.447 -16.944 1.00 0.00 C ATOM 279 O VAL A 18 13.796 -1.552 -16.546 1.00 0.00 O ATOM 280 CB VAL A 18 14.489 -4.527 -15.565 1.00 0.00 C ATOM 281 CG1 VAL A 18 13.729 -3.859 -14.429 1.00 0.00 C ATOM 282 CG2 VAL A 18 14.238 -6.028 -15.576 1.00 0.00 C ATOM 0 H VAL A 18 15.438 -5.271 -17.773 1.00 0.00 H new ATOM 0 HA VAL A 18 13.013 -3.953 -17.030 1.00 0.00 H new ATOM 0 HB VAL A 18 15.554 -4.361 -15.404 1.00 0.00 H new ATOM 0 HG11 VAL A 18 14.020 -4.312 -13.481 1.00 0.00 H new ATOM 0 HG12 VAL A 18 13.964 -2.795 -14.410 1.00 0.00 H new ATOM 0 HG13 VAL A 18 12.658 -3.991 -14.581 1.00 0.00 H new ATOM 0 HG21 VAL A 18 14.521 -6.451 -14.612 1.00 0.00 H new ATOM 0 HG22 VAL A 18 13.181 -6.219 -15.760 1.00 0.00 H new ATOM 0 HG23 VAL A 18 14.832 -6.490 -16.364 1.00 0.00 H new ATOM 292 N LYS A 19 15.762 -2.215 -17.414 1.00 0.00 N ATOM 293 CA LYS A 19 16.309 -0.866 -17.494 1.00 0.00 C ATOM 294 C LYS A 19 15.799 -0.145 -18.738 1.00 0.00 C ATOM 295 O LYS A 19 15.347 0.998 -18.665 1.00 0.00 O ATOM 296 CB LYS A 19 17.838 -0.913 -17.509 1.00 0.00 C ATOM 297 CG LYS A 19 18.435 -1.679 -16.342 1.00 0.00 C ATOM 298 CD LYS A 19 19.526 -2.633 -16.801 1.00 0.00 C ATOM 299 CE LYS A 19 20.788 -2.479 -15.966 1.00 0.00 C ATOM 300 NZ LYS A 19 22.019 -2.625 -16.790 1.00 0.00 N ATOM 0 H LYS A 19 16.392 -2.945 -17.746 1.00 0.00 H new ATOM 0 HA LYS A 19 15.978 -0.314 -16.614 1.00 0.00 H new ATOM 0 HB2 LYS A 19 18.170 -1.371 -18.441 1.00 0.00 H new ATOM 0 HB3 LYS A 19 18.224 0.106 -17.499 1.00 0.00 H new ATOM 0 HG2 LYS A 19 18.846 -0.977 -15.617 1.00 0.00 H new ATOM 0 HG3 LYS A 19 17.650 -2.239 -15.834 1.00 0.00 H new ATOM 0 HD2 LYS A 19 19.166 -3.659 -16.732 1.00 0.00 H new ATOM 0 HD3 LYS A 19 19.757 -2.446 -17.850 1.00 0.00 H new ATOM 0 HE2 LYS A 19 20.787 -1.501 -15.484 1.00 0.00 H new ATOM 0 HE3 LYS A 19 20.792 -3.226 -15.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 22.857 -2.514 -16.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 22.033 -3.567 -17.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 22.029 -1.896 -17.532 1.00 0.00 H new ATOM 314 N THR A 20 15.873 -0.821 -19.880 1.00 0.00 N ATOM 315 CA THR A 20 15.419 -0.246 -21.140 1.00 0.00 C ATOM 316 C THR A 20 13.962 0.194 -21.050 1.00 0.00 C ATOM 317 O THR A 20 13.549 1.146 -21.712 1.00 0.00 O ATOM 318 CB THR A 20 15.571 -1.246 -22.301 1.00 0.00 C ATOM 319 OG1 THR A 20 15.340 -0.584 -23.550 1.00 0.00 O ATOM 320 CG2 THR A 20 14.598 -2.405 -22.148 1.00 0.00 C ATOM 0 H THR A 20 16.243 -1.768 -19.958 1.00 0.00 H new ATOM 0 HA THR A 20 16.047 0.623 -21.335 1.00 0.00 H new ATOM 0 HB THR A 20 16.587 -1.641 -22.281 1.00 0.00 H new ATOM 0 HG1 THR A 20 15.440 -1.226 -24.284 1.00 0.00 H new ATOM 0 HG21 THR A 20 14.724 -3.098 -22.980 1.00 0.00 H new ATOM 0 HG22 THR A 20 14.795 -2.924 -21.210 1.00 0.00 H new ATOM 0 HG23 THR A 20 13.577 -2.025 -22.144 1.00 0.00 H new ATOM 328 N ARG A 21 13.187 -0.506 -20.226 1.00 0.00 N ATOM 329 CA ARG A 21 11.776 -0.187 -20.051 1.00 0.00 C ATOM 330 C ARG A 21 11.599 1.245 -19.557 1.00 0.00 C ATOM 331 O ARG A 21 12.509 1.849 -18.989 1.00 0.00 O ATOM 332 CB ARG A 21 11.130 -1.162 -19.064 1.00 0.00 C ATOM 333 CG ARG A 21 10.270 -2.223 -19.730 1.00 0.00 C ATOM 334 CD ARG A 21 10.117 -3.452 -18.847 1.00 0.00 C ATOM 335 NE ARG A 21 8.761 -3.583 -18.322 1.00 0.00 N ATOM 336 CZ ARG A 21 7.705 -3.866 -19.076 1.00 0.00 C ATOM 337 NH1 ARG A 21 7.848 -4.048 -20.381 1.00 0.00 N ATOM 338 NH2 ARG A 21 6.502 -3.969 -18.524 1.00 0.00 N ATOM 0 H ARG A 21 13.513 -1.297 -19.670 1.00 0.00 H new ATOM 0 HA ARG A 21 11.285 -0.282 -21.020 1.00 0.00 H new ATOM 0 HB2 ARG A 21 11.913 -1.652 -18.485 1.00 0.00 H new ATOM 0 HB3 ARG A 21 10.517 -0.600 -18.359 1.00 0.00 H new ATOM 0 HG2 ARG A 21 9.287 -1.809 -19.952 1.00 0.00 H new ATOM 0 HG3 ARG A 21 10.717 -2.511 -20.681 1.00 0.00 H new ATOM 0 HD2 ARG A 21 10.372 -4.344 -19.420 1.00 0.00 H new ATOM 0 HD3 ARG A 21 10.823 -3.393 -18.018 1.00 0.00 H new ATOM 0 HE ARG A 21 8.617 -3.450 -17.321 1.00 0.00 H new ATOM 0 HH11 ARG A 21 8.771 -3.971 -20.809 1.00 0.00 H new ATOM 0 HH12 ARG A 21 7.035 -4.265 -20.958 1.00 0.00 H new ATOM 0 HH21 ARG A 21 6.388 -3.831 -17.520 1.00 0.00 H new ATOM 0 HH22 ARG A 21 5.692 -4.186 -19.104 1.00 0.00 H new ATOM 352 N PRO A 22 10.399 1.804 -19.777 1.00 0.00 N ATOM 353 CA PRO A 22 10.075 3.172 -19.362 1.00 0.00 C ATOM 354 C PRO A 22 9.969 3.308 -17.847 1.00 0.00 C ATOM 355 O PRO A 22 10.321 2.391 -17.106 1.00 0.00 O ATOM 356 CB PRO A 22 8.716 3.428 -20.019 1.00 0.00 C ATOM 357 CG PRO A 22 8.117 2.075 -20.191 1.00 0.00 C ATOM 358 CD PRO A 22 9.268 1.143 -20.448 1.00 0.00 C ATOM 0 HA PRO A 22 10.847 3.882 -19.657 1.00 0.00 H new ATOM 0 HB2 PRO A 22 8.088 4.063 -19.394 1.00 0.00 H new ATOM 0 HB3 PRO A 22 8.829 3.936 -20.977 1.00 0.00 H new ATOM 0 HG2 PRO A 22 7.565 1.777 -19.300 1.00 0.00 H new ATOM 0 HG3 PRO A 22 7.412 2.063 -21.022 1.00 0.00 H new ATOM 0 HD2 PRO A 22 9.081 0.151 -20.037 1.00 0.00 H new ATOM 0 HD3 PRO A 22 9.452 1.017 -21.515 1.00 0.00 H new ATOM 366 N ASP A 23 9.481 4.458 -17.394 1.00 0.00 N ATOM 367 CA ASP A 23 9.327 4.714 -15.967 1.00 0.00 C ATOM 368 C ASP A 23 7.898 4.431 -15.515 1.00 0.00 C ATOM 369 O ASP A 23 7.655 4.122 -14.349 1.00 0.00 O ATOM 370 CB ASP A 23 9.701 6.161 -15.643 1.00 0.00 C ATOM 371 CG ASP A 23 11.075 6.534 -16.163 1.00 0.00 C ATOM 372 OD1 ASP A 23 12.065 5.909 -15.727 1.00 0.00 O ATOM 373 OD2 ASP A 23 11.161 7.450 -17.007 1.00 0.00 O ATOM 0 H ASP A 23 9.185 5.228 -17.995 1.00 0.00 H new ATOM 0 HA ASP A 23 9.998 4.045 -15.429 1.00 0.00 H new ATOM 0 HB2 ASP A 23 8.958 6.831 -16.076 1.00 0.00 H new ATOM 0 HB3 ASP A 23 9.672 6.308 -14.563 1.00 0.00 H new ATOM 378 N GLU A 24 6.955 4.542 -16.446 1.00 0.00 N ATOM 379 CA GLU A 24 5.550 4.300 -16.142 1.00 0.00 C ATOM 380 C GLU A 24 5.283 2.809 -15.952 1.00 0.00 C ATOM 381 O GLU A 24 4.567 2.408 -15.034 1.00 0.00 O ATOM 382 CB GLU A 24 4.661 4.849 -17.260 1.00 0.00 C ATOM 383 CG GLU A 24 4.990 4.285 -18.632 1.00 0.00 C ATOM 384 CD GLU A 24 4.838 5.311 -19.737 1.00 0.00 C ATOM 385 OE1 GLU A 24 4.092 6.293 -19.536 1.00 0.00 O ATOM 386 OE2 GLU A 24 5.464 5.134 -20.803 1.00 0.00 O ATOM 0 H GLU A 24 7.139 4.798 -17.416 1.00 0.00 H new ATOM 0 HA GLU A 24 5.313 4.816 -15.212 1.00 0.00 H new ATOM 0 HB2 GLU A 24 3.620 4.628 -17.026 1.00 0.00 H new ATOM 0 HB3 GLU A 24 4.758 5.934 -17.290 1.00 0.00 H new ATOM 0 HG2 GLU A 24 6.013 3.908 -18.630 1.00 0.00 H new ATOM 0 HG3 GLU A 24 4.338 3.436 -18.837 1.00 0.00 H new ATOM 393 N LEU A 25 5.863 1.994 -16.826 1.00 0.00 N ATOM 394 CA LEU A 25 5.689 0.548 -16.755 1.00 0.00 C ATOM 395 C LEU A 25 6.339 -0.019 -15.497 1.00 0.00 C ATOM 396 O LEU A 25 5.737 -0.820 -14.781 1.00 0.00 O ATOM 397 CB LEU A 25 6.286 -0.119 -17.996 1.00 0.00 C ATOM 398 CG LEU A 25 5.571 0.161 -19.318 1.00 0.00 C ATOM 399 CD1 LEU A 25 6.219 -0.620 -20.451 1.00 0.00 C ATOM 400 CD2 LEU A 25 4.093 -0.182 -19.208 1.00 0.00 C ATOM 0 H LEU A 25 6.458 2.310 -17.592 1.00 0.00 H new ATOM 0 HA LEU A 25 4.620 0.338 -16.715 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.323 0.201 -18.092 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.299 -1.197 -17.834 1.00 0.00 H new ATOM 0 HG LEU A 25 5.661 1.224 -19.540 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.697 -0.408 -21.384 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.264 -0.325 -20.545 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.161 -1.687 -20.237 1.00 0.00 H new ATOM 0 HD21 LEU A 25 3.600 0.024 -20.158 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.982 -1.238 -18.963 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.637 0.422 -18.424 1.00 0.00 H new ATOM 412 N LEU A 26 7.570 0.404 -15.232 1.00 0.00 N ATOM 413 CA LEU A 26 8.302 -0.059 -14.058 1.00 0.00 C ATOM 414 C LEU A 26 7.465 0.107 -12.794 1.00 0.00 C ATOM 415 O LEU A 26 7.376 -0.804 -11.970 1.00 0.00 O ATOM 416 CB LEU A 26 9.617 0.709 -13.917 1.00 0.00 C ATOM 417 CG LEU A 26 10.763 0.249 -14.819 1.00 0.00 C ATOM 418 CD1 LEU A 26 11.996 1.111 -14.596 1.00 0.00 C ATOM 419 CD2 LEU A 26 11.082 -1.218 -14.569 1.00 0.00 C ATOM 0 H LEU A 26 8.082 1.067 -15.814 1.00 0.00 H new ATOM 0 HA LEU A 26 8.520 -1.119 -14.191 1.00 0.00 H new ATOM 0 HB2 LEU A 26 9.423 1.762 -14.119 1.00 0.00 H new ATOM 0 HB3 LEU A 26 9.946 0.639 -12.880 1.00 0.00 H new ATOM 0 HG LEU A 26 10.451 0.360 -15.857 1.00 0.00 H new ATOM 0 HD11 LEU A 26 12.801 0.769 -15.246 1.00 0.00 H new ATOM 0 HD12 LEU A 26 11.760 2.150 -14.826 1.00 0.00 H new ATOM 0 HD13 LEU A 26 12.312 1.032 -13.556 1.00 0.00 H new ATOM 0 HD21 LEU A 26 11.900 -1.528 -15.219 1.00 0.00 H new ATOM 0 HD22 LEU A 26 11.374 -1.354 -13.528 1.00 0.00 H new ATOM 0 HD23 LEU A 26 10.200 -1.823 -14.780 1.00 0.00 H new ATOM 431 N LYS A 27 6.850 1.276 -12.647 1.00 0.00 N ATOM 432 CA LYS A 27 6.016 1.562 -11.485 1.00 0.00 C ATOM 433 C LYS A 27 4.905 0.526 -11.345 1.00 0.00 C ATOM 434 O LYS A 27 4.680 -0.011 -10.261 1.00 0.00 O ATOM 435 CB LYS A 27 5.411 2.963 -11.599 1.00 0.00 C ATOM 436 CG LYS A 27 6.282 4.053 -11.000 1.00 0.00 C ATOM 437 CD LYS A 27 6.335 5.280 -11.895 1.00 0.00 C ATOM 438 CE LYS A 27 5.355 6.348 -11.435 1.00 0.00 C ATOM 439 NZ LYS A 27 6.035 7.644 -11.162 1.00 0.00 N ATOM 0 H LYS A 27 6.914 2.041 -13.319 1.00 0.00 H new ATOM 0 HA LYS A 27 6.645 1.516 -10.596 1.00 0.00 H new ATOM 0 HB2 LYS A 27 5.234 3.188 -12.651 1.00 0.00 H new ATOM 0 HB3 LYS A 27 4.440 2.972 -11.103 1.00 0.00 H new ATOM 0 HG2 LYS A 27 5.894 4.333 -10.020 1.00 0.00 H new ATOM 0 HG3 LYS A 27 7.291 3.670 -10.846 1.00 0.00 H new ATOM 0 HD2 LYS A 27 7.346 5.688 -11.895 1.00 0.00 H new ATOM 0 HD3 LYS A 27 6.107 4.993 -12.921 1.00 0.00 H new ATOM 0 HE2 LYS A 27 4.591 6.493 -12.199 1.00 0.00 H new ATOM 0 HE3 LYS A 27 4.845 6.009 -10.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 5.333 8.346 -10.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 6.747 7.512 -10.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 6.501 7.981 -12.029 1.00 0.00 H new ATOM 453 N GLN A 28 4.217 0.250 -12.447 1.00 0.00 N ATOM 454 CA GLN A 28 3.130 -0.722 -12.446 1.00 0.00 C ATOM 455 C GLN A 28 3.621 -2.086 -11.973 1.00 0.00 C ATOM 456 O GLN A 28 2.980 -2.736 -11.147 1.00 0.00 O ATOM 457 CB GLN A 28 2.523 -0.842 -13.844 1.00 0.00 C ATOM 458 CG GLN A 28 1.802 0.415 -14.305 1.00 0.00 C ATOM 459 CD GLN A 28 1.532 0.419 -15.797 1.00 0.00 C ATOM 460 OE1 GLN A 28 1.750 1.423 -16.476 1.00 0.00 O ATOM 461 NE2 GLN A 28 1.054 -0.706 -16.315 1.00 0.00 N ATOM 0 H GLN A 28 4.393 0.686 -13.352 1.00 0.00 H new ATOM 0 HA GLN A 28 2.364 -0.372 -11.754 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.314 -1.078 -14.555 1.00 0.00 H new ATOM 0 HB3 GLN A 28 1.823 -1.677 -13.857 1.00 0.00 H new ATOM 0 HG2 GLN A 28 0.857 0.505 -13.768 1.00 0.00 H new ATOM 0 HG3 GLN A 28 2.400 1.288 -14.046 1.00 0.00 H new ATOM 0 HE21 GLN A 28 0.888 -1.514 -15.715 1.00 0.00 H new ATOM 0 HE22 GLN A 28 0.852 -0.762 -17.313 1.00 0.00 H new ATOM 470 N ASP A 29 4.762 -2.515 -12.503 1.00 0.00 N ATOM 471 CA ASP A 29 5.339 -3.802 -12.134 1.00 0.00 C ATOM 472 C ASP A 29 5.731 -3.821 -10.660 1.00 0.00 C ATOM 473 O ASP A 29 5.459 -4.787 -9.948 1.00 0.00 O ATOM 474 CB ASP A 29 6.562 -4.104 -13.003 1.00 0.00 C ATOM 475 CG ASP A 29 7.133 -5.484 -12.740 1.00 0.00 C ATOM 476 OD1 ASP A 29 6.464 -6.281 -12.049 1.00 0.00 O ATOM 477 OD2 ASP A 29 8.247 -5.766 -13.226 1.00 0.00 O ATOM 0 H ASP A 29 5.305 -1.990 -13.189 1.00 0.00 H new ATOM 0 HA ASP A 29 4.585 -4.571 -12.300 1.00 0.00 H new ATOM 0 HB2 ASP A 29 6.286 -4.023 -14.054 1.00 0.00 H new ATOM 0 HB3 ASP A 29 7.331 -3.354 -12.816 1.00 0.00 H new ATOM 482 N ILE A 30 6.371 -2.747 -10.210 1.00 0.00 N ATOM 483 CA ILE A 30 6.799 -2.640 -8.821 1.00 0.00 C ATOM 484 C ILE A 30 5.611 -2.735 -7.870 1.00 0.00 C ATOM 485 O ILE A 30 5.694 -3.364 -6.815 1.00 0.00 O ATOM 486 CB ILE A 30 7.545 -1.318 -8.562 1.00 0.00 C ATOM 487 CG1 ILE A 30 8.789 -1.227 -9.447 1.00 0.00 C ATOM 488 CG2 ILE A 30 7.924 -1.203 -7.093 1.00 0.00 C ATOM 489 CD1 ILE A 30 9.122 0.184 -9.880 1.00 0.00 C ATOM 0 H ILE A 30 6.604 -1.939 -10.787 1.00 0.00 H new ATOM 0 HA ILE A 30 7.477 -3.473 -8.635 1.00 0.00 H new ATOM 0 HB ILE A 30 6.883 -0.489 -8.813 1.00 0.00 H new ATOM 0 HG12 ILE A 30 9.640 -1.643 -8.907 1.00 0.00 H new ATOM 0 HG13 ILE A 30 8.641 -1.845 -10.333 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.451 -0.263 -6.926 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.022 -1.227 -6.482 1.00 0.00 H new ATOM 0 HG23 ILE A 30 8.571 -2.036 -6.818 1.00 0.00 H new ATOM 0 HD11 ILE A 30 10.015 0.172 -10.504 1.00 0.00 H new ATOM 0 HD12 ILE A 30 8.288 0.597 -10.448 1.00 0.00 H new ATOM 0 HD13 ILE A 30 9.303 0.801 -9.000 1.00 0.00 H new ATOM 501 N LEU A 31 4.504 -2.107 -8.251 1.00 0.00 N ATOM 502 CA LEU A 31 3.296 -2.121 -7.433 1.00 0.00 C ATOM 503 C LEU A 31 2.597 -3.474 -7.519 1.00 0.00 C ATOM 504 O LEU A 31 1.913 -3.890 -6.585 1.00 0.00 O ATOM 505 CB LEU A 31 2.341 -1.012 -7.879 1.00 0.00 C ATOM 506 CG LEU A 31 2.823 0.421 -7.649 1.00 0.00 C ATOM 507 CD1 LEU A 31 1.728 1.415 -8.001 1.00 0.00 C ATOM 508 CD2 LEU A 31 3.272 0.607 -6.206 1.00 0.00 C ATOM 0 H LEU A 31 4.418 -1.582 -9.121 1.00 0.00 H new ATOM 0 HA LEU A 31 3.586 -1.947 -6.397 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.139 -1.140 -8.942 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.394 -1.144 -7.356 1.00 0.00 H new ATOM 0 HG LEU A 31 3.677 0.607 -8.301 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.089 2.429 -7.831 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.454 1.298 -9.050 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.855 1.231 -7.375 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.612 1.632 -6.060 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.437 0.403 -5.536 1.00 0.00 H new ATOM 0 HD23 LEU A 31 4.089 -0.081 -5.988 1.00 0.00 H new ATOM 520 N GLU A 32 2.775 -4.157 -8.646 1.00 0.00 N ATOM 521 CA GLU A 32 2.162 -5.463 -8.853 1.00 0.00 C ATOM 522 C GLU A 32 2.957 -6.555 -8.143 1.00 0.00 C ATOM 523 O GLU A 32 2.419 -7.609 -7.805 1.00 0.00 O ATOM 524 CB GLU A 32 2.066 -5.776 -10.347 1.00 0.00 C ATOM 525 CG GLU A 32 0.846 -6.601 -10.720 1.00 0.00 C ATOM 526 CD GLU A 32 1.205 -8.004 -11.170 1.00 0.00 C ATOM 527 OE1 GLU A 32 2.085 -8.623 -10.536 1.00 0.00 O ATOM 528 OE2 GLU A 32 0.606 -8.483 -12.156 1.00 0.00 O ATOM 0 H GLU A 32 3.339 -3.827 -9.429 1.00 0.00 H new ATOM 0 HA GLU A 32 1.158 -5.435 -8.431 1.00 0.00 H new ATOM 0 HB2 GLU A 32 2.045 -4.840 -10.905 1.00 0.00 H new ATOM 0 HB3 GLU A 32 2.964 -6.311 -10.656 1.00 0.00 H new ATOM 0 HG2 GLU A 32 0.175 -6.659 -9.863 1.00 0.00 H new ATOM 0 HG3 GLU A 32 0.301 -6.096 -11.517 1.00 0.00 H new ATOM 535 N ALA A 33 4.242 -6.295 -7.922 1.00 0.00 N ATOM 536 CA ALA A 33 5.111 -7.254 -7.251 1.00 0.00 C ATOM 537 C ALA A 33 4.815 -7.313 -5.757 1.00 0.00 C ATOM 538 O ALA A 33 4.767 -8.391 -5.164 1.00 0.00 O ATOM 539 CB ALA A 33 6.571 -6.898 -7.488 1.00 0.00 C ATOM 0 H ALA A 33 4.704 -5.428 -8.198 1.00 0.00 H new ATOM 0 HA ALA A 33 4.915 -8.240 -7.672 1.00 0.00 H new ATOM 0 HB1 ALA A 33 7.209 -7.622 -6.981 1.00 0.00 H new ATOM 0 HB2 ALA A 33 6.781 -6.915 -8.557 1.00 0.00 H new ATOM 0 HB3 ALA A 33 6.771 -5.901 -7.095 1.00 0.00 H new ATOM 545 N THR A 34 4.617 -6.146 -5.151 1.00 0.00 N ATOM 546 CA THR A 34 4.327 -6.065 -3.725 1.00 0.00 C ATOM 547 C THR A 34 3.097 -6.891 -3.366 1.00 0.00 C ATOM 548 O THR A 34 2.921 -7.293 -2.216 1.00 0.00 O ATOM 549 CB THR A 34 4.100 -4.608 -3.280 1.00 0.00 C ATOM 550 OG1 THR A 34 4.100 -4.526 -1.850 1.00 0.00 O ATOM 551 CG2 THR A 34 2.783 -4.075 -3.823 1.00 0.00 C ATOM 0 H THR A 34 4.652 -5.244 -5.626 1.00 0.00 H new ATOM 0 HA THR A 34 5.196 -6.466 -3.203 1.00 0.00 H new ATOM 0 HB THR A 34 4.912 -4.000 -3.678 1.00 0.00 H new ATOM 0 HG1 THR A 34 3.957 -3.596 -1.576 1.00 0.00 H new ATOM 0 HG21 THR A 34 2.645 -3.045 -3.495 1.00 0.00 H new ATOM 0 HG22 THR A 34 2.797 -4.111 -4.912 1.00 0.00 H new ATOM 0 HG23 THR A 34 1.962 -4.687 -3.451 1.00 0.00 H new ATOM 559 N ALA A 35 2.248 -7.141 -4.357 1.00 0.00 N ATOM 560 CA ALA A 35 1.035 -7.922 -4.146 1.00 0.00 C ATOM 561 C ALA A 35 1.369 -9.363 -3.774 1.00 0.00 C ATOM 562 O ALA A 35 0.605 -10.025 -3.070 1.00 0.00 O ATOM 563 CB ALA A 35 0.160 -7.886 -5.390 1.00 0.00 C ATOM 0 H ALA A 35 2.378 -6.814 -5.314 1.00 0.00 H new ATOM 0 HA ALA A 35 0.486 -7.477 -3.316 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -0.742 -8.473 -5.218 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -0.115 -6.855 -5.611 1.00 0.00 H new ATOM 0 HB3 ALA A 35 0.709 -8.304 -6.234 1.00 0.00 H new ATOM 569 N ASP A 36 2.512 -9.843 -4.250 1.00 0.00 N ATOM 570 CA ASP A 36 2.946 -11.206 -3.967 1.00 0.00 C ATOM 571 C ASP A 36 3.432 -11.333 -2.526 1.00 0.00 C ATOM 572 O ASP A 36 2.934 -12.163 -1.765 1.00 0.00 O ATOM 573 CB ASP A 36 4.058 -11.621 -4.932 1.00 0.00 C ATOM 574 CG ASP A 36 4.250 -13.124 -4.982 1.00 0.00 C ATOM 575 OD1 ASP A 36 3.490 -13.843 -4.299 1.00 0.00 O ATOM 576 OD2 ASP A 36 5.160 -13.581 -5.705 1.00 0.00 O ATOM 0 H ASP A 36 3.155 -9.308 -4.834 1.00 0.00 H new ATOM 0 HA ASP A 36 2.092 -11.869 -4.103 1.00 0.00 H new ATOM 0 HB2 ASP A 36 3.824 -11.254 -5.931 1.00 0.00 H new ATOM 0 HB3 ASP A 36 4.992 -11.148 -4.630 1.00 0.00 H new ATOM 581 N ILE A 37 4.406 -10.507 -2.161 1.00 0.00 N ATOM 582 CA ILE A 37 4.958 -10.527 -0.812 1.00 0.00 C ATOM 583 C ILE A 37 3.868 -10.305 0.232 1.00 0.00 C ATOM 584 O ILE A 37 3.720 -11.092 1.166 1.00 0.00 O ATOM 585 CB ILE A 37 6.049 -9.455 -0.634 1.00 0.00 C ATOM 586 CG1 ILE A 37 7.126 -9.609 -1.711 1.00 0.00 C ATOM 587 CG2 ILE A 37 6.664 -9.550 0.754 1.00 0.00 C ATOM 588 CD1 ILE A 37 8.244 -8.596 -1.597 1.00 0.00 C ATOM 0 H ILE A 37 4.829 -9.816 -2.780 1.00 0.00 H new ATOM 0 HA ILE A 37 5.401 -11.512 -0.667 1.00 0.00 H new ATOM 0 HB ILE A 37 5.592 -8.471 -0.741 1.00 0.00 H new ATOM 0 HG12 ILE A 37 7.548 -10.612 -1.650 1.00 0.00 H new ATOM 0 HG13 ILE A 37 6.662 -9.517 -2.693 1.00 0.00 H new ATOM 0 HG21 ILE A 37 7.433 -8.786 0.864 1.00 0.00 H new ATOM 0 HG22 ILE A 37 5.890 -9.397 1.506 1.00 0.00 H new ATOM 0 HG23 ILE A 37 7.110 -10.536 0.888 1.00 0.00 H new ATOM 0 HD11 ILE A 37 8.971 -8.765 -2.392 1.00 0.00 H new ATOM 0 HD12 ILE A 37 7.834 -7.590 -1.688 1.00 0.00 H new ATOM 0 HD13 ILE A 37 8.734 -8.702 -0.629 1.00 0.00 H new ATOM 600 N ILE A 38 3.107 -9.228 0.064 1.00 0.00 N ATOM 601 CA ILE A 38 2.029 -8.904 0.990 1.00 0.00 C ATOM 602 C ILE A 38 1.056 -10.070 1.130 1.00 0.00 C ATOM 603 O ILE A 38 0.500 -10.304 2.204 1.00 0.00 O ATOM 604 CB ILE A 38 1.253 -7.654 0.535 1.00 0.00 C ATOM 605 CG1 ILE A 38 2.167 -6.427 0.549 1.00 0.00 C ATOM 606 CG2 ILE A 38 0.042 -7.429 1.428 1.00 0.00 C ATOM 607 CD1 ILE A 38 1.527 -5.190 -0.041 1.00 0.00 C ATOM 0 H ILE A 38 3.217 -8.566 -0.704 1.00 0.00 H new ATOM 0 HA ILE A 38 2.492 -8.702 1.956 1.00 0.00 H new ATOM 0 HB ILE A 38 0.904 -7.812 -0.485 1.00 0.00 H new ATOM 0 HG12 ILE A 38 2.465 -6.217 1.576 1.00 0.00 H new ATOM 0 HG13 ILE A 38 3.077 -6.655 -0.006 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -0.496 -6.542 1.094 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -0.617 -8.296 1.373 1.00 0.00 H new ATOM 0 HG23 ILE A 38 0.370 -7.288 2.458 1.00 0.00 H new ATOM 0 HD11 ILE A 38 2.232 -4.360 0.002 1.00 0.00 H new ATOM 0 HD12 ILE A 38 1.254 -5.381 -1.079 1.00 0.00 H new ATOM 0 HD13 ILE A 38 0.633 -4.936 0.528 1.00 0.00 H new ATOM 619 N LEU A 39 0.855 -10.799 0.038 1.00 0.00 N ATOM 620 CA LEU A 39 -0.051 -11.943 0.039 1.00 0.00 C ATOM 621 C LEU A 39 0.494 -13.069 0.912 1.00 0.00 C ATOM 622 O LEU A 39 -0.257 -13.922 1.385 1.00 0.00 O ATOM 623 CB LEU A 39 -0.266 -12.449 -1.389 1.00 0.00 C ATOM 624 CG LEU A 39 -1.594 -12.066 -2.043 1.00 0.00 C ATOM 625 CD1 LEU A 39 -1.465 -12.076 -3.559 1.00 0.00 C ATOM 626 CD2 LEU A 39 -2.701 -13.008 -1.594 1.00 0.00 C ATOM 0 H LEU A 39 1.306 -10.619 -0.859 1.00 0.00 H new ATOM 0 HA LEU A 39 -1.006 -11.618 0.451 1.00 0.00 H new ATOM 0 HB2 LEU A 39 0.545 -12.073 -2.013 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -0.186 -13.536 -1.384 1.00 0.00 H new ATOM 0 HG LEU A 39 -1.854 -11.056 -1.728 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -2.420 -11.801 -4.007 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -0.701 -11.360 -3.864 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -1.181 -13.074 -3.893 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -3.639 -12.720 -2.069 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -2.448 -14.029 -1.879 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -2.811 -12.951 -0.511 1.00 0.00 H new ATOM 638 N LYS A 40 1.806 -13.064 1.124 1.00 0.00 N ATOM 639 CA LYS A 40 2.453 -14.082 1.943 1.00 0.00 C ATOM 640 C LYS A 40 2.369 -13.724 3.423 1.00 0.00 C ATOM 641 O LYS A 40 2.015 -14.559 4.256 1.00 0.00 O ATOM 642 CB LYS A 40 3.917 -14.244 1.529 1.00 0.00 C ATOM 643 CG LYS A 40 4.152 -15.393 0.563 1.00 0.00 C ATOM 644 CD LYS A 40 5.288 -15.088 -0.399 1.00 0.00 C ATOM 645 CE LYS A 40 5.779 -16.346 -1.099 1.00 0.00 C ATOM 646 NZ LYS A 40 5.113 -16.545 -2.416 1.00 0.00 N ATOM 0 H LYS A 40 2.442 -12.366 0.740 1.00 0.00 H new ATOM 0 HA LYS A 40 1.931 -15.026 1.785 1.00 0.00 H new ATOM 0 HB2 LYS A 40 4.261 -13.317 1.069 1.00 0.00 H new ATOM 0 HB3 LYS A 40 4.523 -14.401 2.421 1.00 0.00 H new ATOM 0 HG2 LYS A 40 4.382 -16.299 1.123 1.00 0.00 H new ATOM 0 HG3 LYS A 40 3.240 -15.589 -0.000 1.00 0.00 H new ATOM 0 HD2 LYS A 40 4.953 -14.364 -1.142 1.00 0.00 H new ATOM 0 HD3 LYS A 40 6.113 -14.627 0.145 1.00 0.00 H new ATOM 0 HE2 LYS A 40 6.858 -16.283 -1.243 1.00 0.00 H new ATOM 0 HE3 LYS A 40 5.592 -17.212 -0.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 5.475 -17.413 -2.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 4.086 -16.630 -2.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 5.312 -15.731 -3.032 1.00 0.00 H new ATOM 660 N VAL A 41 2.695 -12.476 3.745 1.00 0.00 N ATOM 661 CA VAL A 41 2.654 -12.006 5.125 1.00 0.00 C ATOM 662 C VAL A 41 1.219 -11.771 5.582 1.00 0.00 C ATOM 663 O VAL A 41 0.928 -11.781 6.778 1.00 0.00 O ATOM 664 CB VAL A 41 3.456 -10.703 5.298 1.00 0.00 C ATOM 665 CG1 VAL A 41 4.943 -10.962 5.110 1.00 0.00 C ATOM 666 CG2 VAL A 41 2.965 -9.641 4.326 1.00 0.00 C ATOM 0 H VAL A 41 2.991 -11.772 3.069 1.00 0.00 H new ATOM 0 HA VAL A 41 3.105 -12.786 5.739 1.00 0.00 H new ATOM 0 HB VAL A 41 3.301 -10.334 6.312 1.00 0.00 H new ATOM 0 HG11 VAL A 41 5.493 -10.030 5.236 1.00 0.00 H new ATOM 0 HG12 VAL A 41 5.283 -11.687 5.850 1.00 0.00 H new ATOM 0 HG13 VAL A 41 5.120 -11.356 4.109 1.00 0.00 H new ATOM 0 HG21 VAL A 41 3.543 -8.727 4.463 1.00 0.00 H new ATOM 0 HG22 VAL A 41 3.088 -9.999 3.304 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.911 -9.435 4.514 1.00 0.00 H new ATOM 676 N GLY A 42 0.324 -11.559 4.622 1.00 0.00 N ATOM 677 CA GLY A 42 -1.071 -11.324 4.946 1.00 0.00 C ATOM 678 C GLY A 42 -1.316 -9.925 5.474 1.00 0.00 C ATOM 679 O GLY A 42 -2.327 -9.669 6.129 1.00 0.00 O ATOM 0 H GLY A 42 0.540 -11.546 3.625 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.679 -11.485 4.056 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -1.396 -12.052 5.690 1.00 0.00 H new ATOM 683 N HIS A 43 -0.388 -9.016 5.191 1.00 0.00 N ATOM 684 CA HIS A 43 -0.508 -7.635 5.643 1.00 0.00 C ATOM 685 C HIS A 43 0.152 -6.680 4.653 1.00 0.00 C ATOM 686 O HIS A 43 1.221 -6.970 4.115 1.00 0.00 O ATOM 687 CB HIS A 43 0.125 -7.472 7.026 1.00 0.00 C ATOM 688 CG HIS A 43 -0.540 -8.291 8.089 1.00 0.00 C ATOM 689 ND1 HIS A 43 -1.816 -8.038 8.547 1.00 0.00 N ATOM 690 CD2 HIS A 43 -0.099 -9.366 8.784 1.00 0.00 C ATOM 691 CE1 HIS A 43 -2.130 -8.920 9.478 1.00 0.00 C ATOM 692 NE2 HIS A 43 -1.106 -9.737 9.641 1.00 0.00 N ATOM 0 H HIS A 43 0.455 -9.211 4.651 1.00 0.00 H new ATOM 0 HA HIS A 43 -1.568 -7.390 5.706 1.00 0.00 H new ATOM 0 HB2 HIS A 43 1.177 -7.750 6.970 1.00 0.00 H new ATOM 0 HB3 HIS A 43 0.088 -6.421 7.312 1.00 0.00 H new ATOM 0 HD2 HIS A 43 0.865 -9.843 8.683 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -3.066 -8.965 10.015 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -1.069 -10.517 10.297 1.00 0.00 H new ATOM 700 N ASP A 44 -0.491 -5.542 4.418 1.00 0.00 N ATOM 701 CA ASP A 44 0.034 -4.544 3.493 1.00 0.00 C ATOM 702 C ASP A 44 0.543 -3.319 4.246 1.00 0.00 C ATOM 703 O ASP A 44 0.611 -2.221 3.692 1.00 0.00 O ATOM 704 CB ASP A 44 -1.045 -4.130 2.490 1.00 0.00 C ATOM 705 CG ASP A 44 -2.014 -3.117 3.067 1.00 0.00 C ATOM 706 OD1 ASP A 44 -2.201 -2.052 2.442 1.00 0.00 O ATOM 707 OD2 ASP A 44 -2.585 -3.390 4.143 1.00 0.00 O ATOM 0 H ASP A 44 -1.377 -5.287 4.855 1.00 0.00 H new ATOM 0 HA ASP A 44 0.870 -4.989 2.953 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -0.571 -3.710 1.603 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -1.596 -5.014 2.169 1.00 0.00 H new ATOM 712 N PHE A 45 0.897 -3.514 5.512 1.00 0.00 N ATOM 713 CA PHE A 45 1.398 -2.425 6.342 1.00 0.00 C ATOM 714 C PHE A 45 0.451 -1.229 6.299 1.00 0.00 C ATOM 715 O PHE A 45 0.859 -0.112 5.981 1.00 0.00 O ATOM 716 CB PHE A 45 2.793 -2.002 5.878 1.00 0.00 C ATOM 717 CG PHE A 45 3.711 -3.159 5.606 1.00 0.00 C ATOM 718 CD1 PHE A 45 4.182 -3.946 6.644 1.00 0.00 C ATOM 719 CD2 PHE A 45 4.104 -3.459 4.311 1.00 0.00 C ATOM 720 CE1 PHE A 45 5.026 -5.012 6.397 1.00 0.00 C ATOM 721 CE2 PHE A 45 4.947 -4.524 4.058 1.00 0.00 C ATOM 722 CZ PHE A 45 5.410 -5.301 5.102 1.00 0.00 C ATOM 0 H PHE A 45 0.846 -4.416 5.985 1.00 0.00 H new ATOM 0 HA PHE A 45 1.458 -2.783 7.370 1.00 0.00 H new ATOM 0 HB2 PHE A 45 2.700 -1.402 4.973 1.00 0.00 H new ATOM 0 HB3 PHE A 45 3.242 -1.363 6.639 1.00 0.00 H new ATOM 0 HD1 PHE A 45 3.886 -3.724 7.659 1.00 0.00 H new ATOM 0 HD2 PHE A 45 3.747 -2.854 3.491 1.00 0.00 H new ATOM 0 HE1 PHE A 45 5.385 -5.618 7.215 1.00 0.00 H new ATOM 0 HE2 PHE A 45 5.244 -4.749 3.044 1.00 0.00 H new ATOM 0 HZ PHE A 45 6.071 -6.133 4.906 1.00 0.00 H new ATOM 732 N SER A 46 -0.815 -1.472 6.621 1.00 0.00 N ATOM 733 CA SER A 46 -1.822 -0.417 6.616 1.00 0.00 C ATOM 734 C SER A 46 -1.569 0.581 7.742 1.00 0.00 C ATOM 735 O SER A 46 -1.404 1.777 7.500 1.00 0.00 O ATOM 736 CB SER A 46 -3.222 -1.018 6.756 1.00 0.00 C ATOM 737 OG SER A 46 -4.142 -0.373 5.893 1.00 0.00 O ATOM 0 H SER A 46 -1.168 -2.391 6.889 1.00 0.00 H new ATOM 0 HA SER A 46 -1.755 0.111 5.665 1.00 0.00 H new ATOM 0 HB2 SER A 46 -3.189 -2.083 6.527 1.00 0.00 H new ATOM 0 HB3 SER A 46 -3.560 -0.925 7.788 1.00 0.00 H new ATOM 0 HG SER A 46 -5.029 -0.776 6.000 1.00 0.00 H new ATOM 743 N ASP A 47 -1.540 0.080 8.972 1.00 0.00 N ATOM 744 CA ASP A 47 -1.306 0.927 10.136 1.00 0.00 C ATOM 745 C ASP A 47 -0.054 1.777 9.948 1.00 0.00 C ATOM 746 O ASP A 47 1.061 1.258 9.915 1.00 0.00 O ATOM 747 CB ASP A 47 -1.172 0.070 11.397 1.00 0.00 C ATOM 748 CG ASP A 47 -2.502 -0.161 12.085 1.00 0.00 C ATOM 749 OD1 ASP A 47 -3.549 -0.019 11.417 1.00 0.00 O ATOM 750 OD2 ASP A 47 -2.498 -0.484 13.291 1.00 0.00 O ATOM 0 H ASP A 47 -1.675 -0.907 9.189 1.00 0.00 H new ATOM 0 HA ASP A 47 -2.161 1.594 10.247 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -0.731 -0.891 11.134 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -0.487 0.556 12.092 1.00 0.00 H new ATOM 755 N ALA A 48 -0.247 3.086 9.823 1.00 0.00 N ATOM 756 CA ALA A 48 0.866 4.008 9.639 1.00 0.00 C ATOM 757 C ALA A 48 1.878 3.880 10.772 1.00 0.00 C ATOM 758 O ALA A 48 3.052 4.214 10.608 1.00 0.00 O ATOM 759 CB ALA A 48 0.356 5.439 9.543 1.00 0.00 C ATOM 0 H ALA A 48 -1.164 3.531 9.846 1.00 0.00 H new ATOM 0 HA ALA A 48 1.369 3.750 8.707 1.00 0.00 H new ATOM 0 HB1 ALA A 48 1.198 6.117 9.406 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -0.323 5.527 8.695 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -0.173 5.699 10.460 1.00 0.00 H new ATOM 765 N GLU A 49 1.416 3.396 11.920 1.00 0.00 N ATOM 766 CA GLU A 49 2.283 3.226 13.081 1.00 0.00 C ATOM 767 C GLU A 49 2.833 1.805 13.146 1.00 0.00 C ATOM 768 O GLU A 49 3.236 1.331 14.209 1.00 0.00 O ATOM 769 CB GLU A 49 1.519 3.549 14.367 1.00 0.00 C ATOM 770 CG GLU A 49 0.369 2.596 14.647 1.00 0.00 C ATOM 771 CD GLU A 49 -0.120 2.676 16.080 1.00 0.00 C ATOM 772 OE1 GLU A 49 0.568 3.313 16.905 1.00 0.00 O ATOM 773 OE2 GLU A 49 -1.188 2.101 16.376 1.00 0.00 O ATOM 0 H GLU A 49 0.447 3.115 12.072 1.00 0.00 H new ATOM 0 HA GLU A 49 3.121 3.916 12.981 1.00 0.00 H new ATOM 0 HB2 GLU A 49 2.213 3.525 15.208 1.00 0.00 H new ATOM 0 HB3 GLU A 49 1.130 4.565 14.303 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -0.457 2.821 13.972 1.00 0.00 H new ATOM 0 HG3 GLU A 49 0.687 1.576 14.432 1.00 0.00 H new ATOM 780 N TYR A 50 2.845 1.129 12.002 1.00 0.00 N ATOM 781 CA TYR A 50 3.343 -0.240 11.929 1.00 0.00 C ATOM 782 C TYR A 50 3.712 -0.609 10.495 1.00 0.00 C ATOM 783 O TYR A 50 3.230 -1.605 9.955 1.00 0.00 O ATOM 784 CB TYR A 50 2.293 -1.216 12.464 1.00 0.00 C ATOM 785 CG TYR A 50 2.803 -2.631 12.614 1.00 0.00 C ATOM 786 CD1 TYR A 50 4.055 -2.885 13.163 1.00 0.00 C ATOM 787 CD2 TYR A 50 2.035 -3.714 12.206 1.00 0.00 C ATOM 788 CE1 TYR A 50 4.525 -4.177 13.301 1.00 0.00 C ATOM 789 CE2 TYR A 50 2.497 -5.009 12.341 1.00 0.00 C ATOM 790 CZ TYR A 50 3.742 -5.235 12.889 1.00 0.00 C ATOM 791 OH TYR A 50 4.207 -6.524 13.025 1.00 0.00 O ATOM 0 H TYR A 50 2.516 1.506 11.113 1.00 0.00 H new ATOM 0 HA TYR A 50 4.240 -0.307 12.545 1.00 0.00 H new ATOM 0 HB2 TYR A 50 1.940 -0.862 13.432 1.00 0.00 H new ATOM 0 HB3 TYR A 50 1.435 -1.217 11.792 1.00 0.00 H new ATOM 0 HD1 TYR A 50 4.670 -2.059 13.487 1.00 0.00 H new ATOM 0 HD2 TYR A 50 1.060 -3.541 11.776 1.00 0.00 H new ATOM 0 HE1 TYR A 50 5.500 -4.357 13.729 1.00 0.00 H new ATOM 0 HE2 TYR A 50 1.886 -5.840 12.019 1.00 0.00 H new ATOM 0 HH TYR A 50 3.534 -7.152 12.688 1.00 0.00 H new ATOM 801 N ILE A 51 4.571 0.201 9.886 1.00 0.00 N ATOM 802 CA ILE A 51 5.007 -0.040 8.516 1.00 0.00 C ATOM 803 C ILE A 51 6.505 -0.321 8.457 1.00 0.00 C ATOM 804 O ILE A 51 7.294 0.482 7.959 1.00 0.00 O ATOM 805 CB ILE A 51 4.685 1.158 7.603 1.00 0.00 C ATOM 806 CG1 ILE A 51 3.200 1.514 7.697 1.00 0.00 C ATOM 807 CG2 ILE A 51 5.071 0.846 6.165 1.00 0.00 C ATOM 808 CD1 ILE A 51 2.805 2.691 6.834 1.00 0.00 C ATOM 0 H ILE A 51 4.979 1.030 10.319 1.00 0.00 H new ATOM 0 HA ILE A 51 4.461 -0.914 8.161 1.00 0.00 H new ATOM 0 HB ILE A 51 5.267 2.017 7.936 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.608 0.646 7.407 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.953 1.736 8.735 1.00 0.00 H new ATOM 0 HG21 ILE A 51 4.838 1.702 5.532 1.00 0.00 H new ATOM 0 HG22 ILE A 51 6.139 0.636 6.112 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.513 -0.024 5.819 1.00 0.00 H new ATOM 0 HD11 ILE A 51 1.739 2.886 6.951 1.00 0.00 H new ATOM 0 HD12 ILE A 51 3.371 3.572 7.138 1.00 0.00 H new ATOM 0 HD13 ILE A 51 3.020 2.465 5.790 1.00 0.00 H new ATOM 820 N PRO A 52 6.908 -1.490 8.977 1.00 0.00 N ATOM 821 CA PRO A 52 8.314 -1.906 8.994 1.00 0.00 C ATOM 822 C PRO A 52 8.838 -2.233 7.600 1.00 0.00 C ATOM 823 O PRO A 52 8.167 -2.903 6.814 1.00 0.00 O ATOM 824 CB PRO A 52 8.301 -3.162 9.869 1.00 0.00 C ATOM 825 CG PRO A 52 6.916 -3.696 9.746 1.00 0.00 C ATOM 826 CD PRO A 52 6.023 -2.496 9.588 1.00 0.00 C ATOM 0 HA PRO A 52 8.968 -1.118 9.366 1.00 0.00 H new ATOM 0 HB2 PRO A 52 9.037 -3.890 9.528 1.00 0.00 H new ATOM 0 HB3 PRO A 52 8.543 -2.925 10.905 1.00 0.00 H new ATOM 0 HG2 PRO A 52 6.829 -4.363 8.888 1.00 0.00 H new ATOM 0 HG3 PRO A 52 6.641 -4.274 10.628 1.00 0.00 H new ATOM 0 HD2 PRO A 52 5.165 -2.715 8.953 1.00 0.00 H new ATOM 0 HD3 PRO A 52 5.632 -2.157 10.547 1.00 0.00 H new ATOM 834 N LEU A 53 10.041 -1.757 7.299 1.00 0.00 N ATOM 835 CA LEU A 53 10.657 -1.999 5.999 1.00 0.00 C ATOM 836 C LEU A 53 12.124 -2.387 6.155 1.00 0.00 C ATOM 837 O LEU A 53 13.030 -1.574 5.971 1.00 0.00 O ATOM 838 CB LEU A 53 10.538 -0.755 5.117 1.00 0.00 C ATOM 839 CG LEU A 53 10.450 -1.006 3.611 1.00 0.00 C ATOM 840 CD1 LEU A 53 9.247 -1.877 3.284 1.00 0.00 C ATOM 841 CD2 LEU A 53 10.379 0.311 2.854 1.00 0.00 C ATOM 0 H LEU A 53 10.610 -1.201 7.938 1.00 0.00 H new ATOM 0 HA LEU A 53 10.130 -2.826 5.523 1.00 0.00 H new ATOM 0 HB2 LEU A 53 9.652 -0.199 5.425 1.00 0.00 H new ATOM 0 HB3 LEU A 53 11.399 -0.114 5.309 1.00 0.00 H new ATOM 0 HG LEU A 53 11.350 -1.534 3.297 1.00 0.00 H new ATOM 0 HD11 LEU A 53 9.201 -2.045 2.208 1.00 0.00 H new ATOM 0 HD12 LEU A 53 9.341 -2.834 3.797 1.00 0.00 H new ATOM 0 HD13 LEU A 53 8.336 -1.377 3.613 1.00 0.00 H new ATOM 0 HD21 LEU A 53 10.317 0.113 1.784 1.00 0.00 H new ATOM 0 HD22 LEU A 53 9.497 0.866 3.172 1.00 0.00 H new ATOM 0 HD23 LEU A 53 11.273 0.899 3.063 1.00 0.00 H new ATOM 853 N PRO A 54 12.366 -3.660 6.501 1.00 0.00 N ATOM 854 CA PRO A 54 13.722 -4.186 6.686 1.00 0.00 C ATOM 855 C PRO A 54 14.486 -4.295 5.371 1.00 0.00 C ATOM 856 O PRO A 54 13.987 -3.900 4.318 1.00 0.00 O ATOM 857 CB PRO A 54 13.485 -5.575 7.284 1.00 0.00 C ATOM 858 CG PRO A 54 12.125 -5.962 6.815 1.00 0.00 C ATOM 859 CD PRO A 54 11.335 -4.685 6.737 1.00 0.00 C ATOM 0 HA PRO A 54 14.330 -3.535 7.314 1.00 0.00 H new ATOM 0 HB2 PRO A 54 14.238 -6.286 6.944 1.00 0.00 H new ATOM 0 HB3 PRO A 54 13.537 -5.552 8.373 1.00 0.00 H new ATOM 0 HG2 PRO A 54 12.172 -6.452 5.842 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.660 -6.667 7.504 1.00 0.00 H new ATOM 0 HD2 PRO A 54 10.604 -4.713 5.929 1.00 0.00 H new ATOM 0 HD3 PRO A 54 10.784 -4.496 7.658 1.00 0.00 H new ATOM 867 N GLU A 55 15.700 -4.833 5.440 1.00 0.00 N ATOM 868 CA GLU A 55 16.533 -4.993 4.254 1.00 0.00 C ATOM 869 C GLU A 55 16.094 -6.207 3.441 1.00 0.00 C ATOM 870 O GLU A 55 16.313 -6.271 2.231 1.00 0.00 O ATOM 871 CB GLU A 55 18.003 -5.136 4.651 1.00 0.00 C ATOM 872 CG GLU A 55 18.925 -5.423 3.478 1.00 0.00 C ATOM 873 CD GLU A 55 20.385 -5.183 3.812 1.00 0.00 C ATOM 874 OE1 GLU A 55 20.888 -4.080 3.510 1.00 0.00 O ATOM 875 OE2 GLU A 55 21.024 -6.097 4.373 1.00 0.00 O ATOM 0 H GLU A 55 16.128 -5.165 6.304 1.00 0.00 H new ATOM 0 HA GLU A 55 16.416 -4.102 3.637 1.00 0.00 H new ATOM 0 HB2 GLU A 55 18.329 -4.219 5.142 1.00 0.00 H new ATOM 0 HB3 GLU A 55 18.097 -5.940 5.381 1.00 0.00 H new ATOM 0 HG2 GLU A 55 18.794 -6.458 3.162 1.00 0.00 H new ATOM 0 HG3 GLU A 55 18.641 -4.794 2.635 1.00 0.00 H new ATOM 882 N THR A 56 15.473 -7.170 4.115 1.00 0.00 N ATOM 883 CA THR A 56 15.005 -8.384 3.457 1.00 0.00 C ATOM 884 C THR A 56 13.834 -8.088 2.527 1.00 0.00 C ATOM 885 O THR A 56 13.804 -8.547 1.385 1.00 0.00 O ATOM 886 CB THR A 56 14.574 -9.448 4.483 1.00 0.00 C ATOM 887 OG1 THR A 56 13.323 -9.080 5.076 1.00 0.00 O ATOM 888 CG2 THR A 56 15.626 -9.611 5.569 1.00 0.00 C ATOM 0 H THR A 56 15.282 -7.133 5.116 1.00 0.00 H new ATOM 0 HA THR A 56 15.841 -8.770 2.873 1.00 0.00 H new ATOM 0 HB THR A 56 14.463 -10.398 3.961 1.00 0.00 H new ATOM 0 HG1 THR A 56 12.802 -9.887 5.268 1.00 0.00 H new ATOM 0 HG21 THR A 56 15.299 -10.368 6.282 1.00 0.00 H new ATOM 0 HG22 THR A 56 16.569 -9.920 5.118 1.00 0.00 H new ATOM 0 HG23 THR A 56 15.765 -8.662 6.086 1.00 0.00 H new ATOM 896 N VAL A 57 12.870 -7.318 3.022 1.00 0.00 N ATOM 897 CA VAL A 57 11.697 -6.959 2.234 1.00 0.00 C ATOM 898 C VAL A 57 12.088 -6.138 1.010 1.00 0.00 C ATOM 899 O VAL A 57 11.636 -6.410 -0.103 1.00 0.00 O ATOM 900 CB VAL A 57 10.681 -6.160 3.071 1.00 0.00 C ATOM 901 CG1 VAL A 57 9.504 -5.727 2.211 1.00 0.00 C ATOM 902 CG2 VAL A 57 10.209 -6.981 4.261 1.00 0.00 C ATOM 0 H VAL A 57 12.878 -6.931 3.966 1.00 0.00 H new ATOM 0 HA VAL A 57 11.236 -7.892 1.910 1.00 0.00 H new ATOM 0 HB VAL A 57 11.173 -5.264 3.449 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.797 -5.164 2.820 1.00 0.00 H new ATOM 0 HG12 VAL A 57 9.861 -5.099 1.395 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.009 -6.608 1.801 1.00 0.00 H new ATOM 0 HG21 VAL A 57 9.492 -6.401 4.842 1.00 0.00 H new ATOM 0 HG22 VAL A 57 9.734 -7.896 3.906 1.00 0.00 H new ATOM 0 HG23 VAL A 57 11.063 -7.235 4.889 1.00 0.00 H new ATOM 912 N ARG A 58 12.931 -5.133 1.223 1.00 0.00 N ATOM 913 CA ARG A 58 13.382 -4.271 0.137 1.00 0.00 C ATOM 914 C ARG A 58 14.039 -5.090 -0.970 1.00 0.00 C ATOM 915 O ARG A 58 13.880 -4.793 -2.155 1.00 0.00 O ATOM 916 CB ARG A 58 14.366 -3.224 0.664 1.00 0.00 C ATOM 917 CG ARG A 58 13.991 -1.797 0.296 1.00 0.00 C ATOM 918 CD ARG A 58 15.109 -0.823 0.633 1.00 0.00 C ATOM 919 NE ARG A 58 16.296 -1.047 -0.189 1.00 0.00 N ATOM 920 CZ ARG A 58 17.252 -0.140 -0.361 1.00 0.00 C ATOM 921 NH1 ARG A 58 17.161 1.044 0.229 1.00 0.00 N ATOM 922 NH2 ARG A 58 18.301 -0.418 -1.124 1.00 0.00 N ATOM 0 H ARG A 58 13.315 -4.896 2.137 1.00 0.00 H new ATOM 0 HA ARG A 58 12.510 -3.765 -0.278 1.00 0.00 H new ATOM 0 HB2 ARG A 58 14.425 -3.307 1.749 1.00 0.00 H new ATOM 0 HB3 ARG A 58 15.360 -3.442 0.273 1.00 0.00 H new ATOM 0 HG2 ARG A 58 13.767 -1.742 -0.769 1.00 0.00 H new ATOM 0 HG3 ARG A 58 13.084 -1.509 0.827 1.00 0.00 H new ATOM 0 HD2 ARG A 58 14.756 0.198 0.489 1.00 0.00 H new ATOM 0 HD3 ARG A 58 15.373 -0.924 1.686 1.00 0.00 H new ATOM 0 HE ARG A 58 16.396 -1.948 -0.656 1.00 0.00 H new ATOM 0 HH11 ARG A 58 16.356 1.260 0.817 1.00 0.00 H new ATOM 0 HH12 ARG A 58 17.896 1.738 0.095 1.00 0.00 H new ATOM 0 HH21 ARG A 58 18.374 -1.328 -1.579 1.00 0.00 H new ATOM 0 HH22 ARG A 58 19.035 0.278 -1.256 1.00 0.00 H new ATOM 936 N LEU A 59 14.778 -6.121 -0.576 1.00 0.00 N ATOM 937 CA LEU A 59 15.460 -6.984 -1.535 1.00 0.00 C ATOM 938 C LEU A 59 14.466 -7.886 -2.259 1.00 0.00 C ATOM 939 O LEU A 59 14.508 -8.016 -3.482 1.00 0.00 O ATOM 940 CB LEU A 59 16.515 -7.835 -0.825 1.00 0.00 C ATOM 941 CG LEU A 59 17.376 -8.723 -1.723 1.00 0.00 C ATOM 942 CD1 LEU A 59 17.993 -7.907 -2.849 1.00 0.00 C ATOM 943 CD2 LEU A 59 18.459 -9.415 -0.908 1.00 0.00 C ATOM 0 H LEU A 59 14.920 -6.380 0.400 1.00 0.00 H new ATOM 0 HA LEU A 59 15.950 -6.349 -2.273 1.00 0.00 H new ATOM 0 HB2 LEU A 59 17.174 -7.170 -0.267 1.00 0.00 H new ATOM 0 HB3 LEU A 59 16.011 -8.470 -0.096 1.00 0.00 H new ATOM 0 HG LEU A 59 16.737 -9.488 -2.165 1.00 0.00 H new ATOM 0 HD11 LEU A 59 18.602 -8.557 -3.477 1.00 0.00 H new ATOM 0 HD12 LEU A 59 17.201 -7.459 -3.450 1.00 0.00 H new ATOM 0 HD13 LEU A 59 18.618 -7.120 -2.428 1.00 0.00 H new ATOM 0 HD21 LEU A 59 19.062 -10.043 -1.564 1.00 0.00 H new ATOM 0 HD22 LEU A 59 19.095 -8.665 -0.437 1.00 0.00 H new ATOM 0 HD23 LEU A 59 17.996 -10.033 -0.139 1.00 0.00 H new ATOM 955 N ALA A 60 13.572 -8.505 -1.496 1.00 0.00 N ATOM 956 CA ALA A 60 12.564 -9.392 -2.065 1.00 0.00 C ATOM 957 C ALA A 60 11.812 -8.709 -3.203 1.00 0.00 C ATOM 958 O ALA A 60 11.592 -9.303 -4.259 1.00 0.00 O ATOM 959 CB ALA A 60 11.593 -9.848 -0.987 1.00 0.00 C ATOM 0 H ALA A 60 13.525 -8.409 -0.482 1.00 0.00 H new ATOM 0 HA ALA A 60 13.073 -10.266 -2.473 1.00 0.00 H new ATOM 0 HB1 ALA A 60 10.846 -10.509 -1.426 1.00 0.00 H new ATOM 0 HB2 ALA A 60 12.138 -10.382 -0.209 1.00 0.00 H new ATOM 0 HB3 ALA A 60 11.098 -8.980 -0.552 1.00 0.00 H new ATOM 965 N LEU A 61 11.420 -7.460 -2.980 1.00 0.00 N ATOM 966 CA LEU A 61 10.691 -6.696 -3.987 1.00 0.00 C ATOM 967 C LEU A 61 11.584 -6.381 -5.183 1.00 0.00 C ATOM 968 O LEU A 61 11.160 -6.491 -6.334 1.00 0.00 O ATOM 969 CB LEU A 61 10.154 -5.398 -3.381 1.00 0.00 C ATOM 970 CG LEU A 61 8.810 -4.910 -3.923 1.00 0.00 C ATOM 971 CD1 LEU A 61 8.867 -4.760 -5.435 1.00 0.00 C ATOM 972 CD2 LEU A 61 7.695 -5.864 -3.521 1.00 0.00 C ATOM 0 H LEU A 61 11.594 -6.954 -2.111 1.00 0.00 H new ATOM 0 HA LEU A 61 9.853 -7.302 -4.332 1.00 0.00 H new ATOM 0 HB2 LEU A 61 10.061 -5.535 -2.304 1.00 0.00 H new ATOM 0 HB3 LEU A 61 10.894 -4.613 -3.540 1.00 0.00 H new ATOM 0 HG LEU A 61 8.598 -3.933 -3.490 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.902 -4.412 -5.803 1.00 0.00 H new ATOM 0 HD12 LEU A 61 9.638 -4.037 -5.700 1.00 0.00 H new ATOM 0 HD13 LEU A 61 9.102 -5.723 -5.888 1.00 0.00 H new ATOM 0 HD21 LEU A 61 6.746 -5.501 -3.915 1.00 0.00 H new ATOM 0 HD22 LEU A 61 7.901 -6.855 -3.925 1.00 0.00 H new ATOM 0 HD23 LEU A 61 7.639 -5.920 -2.434 1.00 0.00 H new ATOM 984 N LEU A 62 12.823 -5.990 -4.903 1.00 0.00 N ATOM 985 CA LEU A 62 13.777 -5.661 -5.956 1.00 0.00 C ATOM 986 C LEU A 62 13.960 -6.835 -6.912 1.00 0.00 C ATOM 987 O LEU A 62 14.069 -6.652 -8.125 1.00 0.00 O ATOM 988 CB LEU A 62 15.125 -5.270 -5.347 1.00 0.00 C ATOM 989 CG LEU A 62 15.203 -3.873 -4.731 1.00 0.00 C ATOM 990 CD1 LEU A 62 16.322 -3.804 -3.704 1.00 0.00 C ATOM 991 CD2 LEU A 62 15.406 -2.824 -5.815 1.00 0.00 C ATOM 0 H LEU A 62 13.190 -5.893 -3.956 1.00 0.00 H new ATOM 0 HA LEU A 62 13.381 -4.816 -6.519 1.00 0.00 H new ATOM 0 HB2 LEU A 62 15.379 -5.999 -4.578 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.887 -5.346 -6.122 1.00 0.00 H new ATOM 0 HG LEU A 62 14.260 -3.667 -4.224 1.00 0.00 H new ATOM 0 HD11 LEU A 62 16.362 -2.802 -3.276 1.00 0.00 H new ATOM 0 HD12 LEU A 62 16.134 -4.529 -2.912 1.00 0.00 H new ATOM 0 HD13 LEU A 62 17.273 -4.031 -4.186 1.00 0.00 H new ATOM 0 HD21 LEU A 62 15.459 -1.835 -5.359 1.00 0.00 H new ATOM 0 HD22 LEU A 62 16.334 -3.028 -6.349 1.00 0.00 H new ATOM 0 HD23 LEU A 62 14.570 -2.857 -6.514 1.00 0.00 H new ATOM 1003 N LYS A 63 13.990 -8.043 -6.358 1.00 0.00 N ATOM 1004 CA LYS A 63 14.156 -9.249 -7.161 1.00 0.00 C ATOM 1005 C LYS A 63 12.882 -9.564 -7.939 1.00 0.00 C ATOM 1006 O LYS A 63 12.929 -9.847 -9.137 1.00 0.00 O ATOM 1007 CB LYS A 63 14.525 -10.434 -6.266 1.00 0.00 C ATOM 1008 CG LYS A 63 15.970 -10.417 -5.799 1.00 0.00 C ATOM 1009 CD LYS A 63 16.616 -11.785 -5.933 1.00 0.00 C ATOM 1010 CE LYS A 63 17.846 -11.910 -5.047 1.00 0.00 C ATOM 1011 NZ LYS A 63 18.877 -12.800 -5.650 1.00 0.00 N ATOM 0 H LYS A 63 13.901 -8.213 -5.356 1.00 0.00 H new ATOM 0 HA LYS A 63 14.962 -9.074 -7.873 1.00 0.00 H new ATOM 0 HB2 LYS A 63 13.870 -10.438 -5.394 1.00 0.00 H new ATOM 0 HB3 LYS A 63 14.338 -11.361 -6.809 1.00 0.00 H new ATOM 0 HG2 LYS A 63 16.533 -9.689 -6.383 1.00 0.00 H new ATOM 0 HG3 LYS A 63 16.013 -10.094 -4.759 1.00 0.00 H new ATOM 0 HD2 LYS A 63 15.894 -12.557 -5.666 1.00 0.00 H new ATOM 0 HD3 LYS A 63 16.896 -11.956 -6.972 1.00 0.00 H new ATOM 0 HE2 LYS A 63 18.274 -10.922 -4.878 1.00 0.00 H new ATOM 0 HE3 LYS A 63 17.553 -12.302 -4.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 19.699 -12.859 -5.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 18.478 -13.750 -5.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 19.175 -12.413 -6.568 1.00 0.00 H new ATOM 1025 N LEU A 64 11.746 -9.511 -7.253 1.00 0.00 N ATOM 1026 CA LEU A 64 10.459 -9.789 -7.881 1.00 0.00 C ATOM 1027 C LEU A 64 10.181 -8.804 -9.012 1.00 0.00 C ATOM 1028 O LEU A 64 9.642 -9.176 -10.054 1.00 0.00 O ATOM 1029 CB LEU A 64 9.338 -9.721 -6.843 1.00 0.00 C ATOM 1030 CG LEU A 64 8.815 -11.063 -6.330 1.00 0.00 C ATOM 1031 CD1 LEU A 64 8.387 -10.949 -4.876 1.00 0.00 C ATOM 1032 CD2 LEU A 64 7.659 -11.549 -7.192 1.00 0.00 C ATOM 0 H LEU A 64 11.690 -9.278 -6.262 1.00 0.00 H new ATOM 0 HA LEU A 64 10.497 -10.794 -8.301 1.00 0.00 H new ATOM 0 HB2 LEU A 64 9.694 -9.143 -5.990 1.00 0.00 H new ATOM 0 HB3 LEU A 64 8.503 -9.170 -7.275 1.00 0.00 H new ATOM 0 HG LEU A 64 9.621 -11.794 -6.393 1.00 0.00 H new ATOM 0 HD11 LEU A 64 8.018 -11.914 -4.529 1.00 0.00 H new ATOM 0 HD12 LEU A 64 9.240 -10.647 -4.268 1.00 0.00 H new ATOM 0 HD13 LEU A 64 7.596 -10.204 -4.787 1.00 0.00 H new ATOM 0 HD21 LEU A 64 7.299 -12.505 -6.813 1.00 0.00 H new ATOM 0 HD22 LEU A 64 6.850 -10.819 -7.161 1.00 0.00 H new ATOM 0 HD23 LEU A 64 7.998 -11.671 -8.221 1.00 0.00 H new ATOM 1044 N SER A 65 10.555 -7.546 -8.800 1.00 0.00 N ATOM 1045 CA SER A 65 10.345 -6.507 -9.801 1.00 0.00 C ATOM 1046 C SER A 65 11.011 -6.882 -11.121 1.00 0.00 C ATOM 1047 O SER A 65 10.484 -6.598 -12.196 1.00 0.00 O ATOM 1048 CB SER A 65 10.893 -5.169 -9.301 1.00 0.00 C ATOM 1049 OG SER A 65 9.891 -4.167 -9.323 1.00 0.00 O ATOM 0 H SER A 65 11.005 -7.222 -7.944 1.00 0.00 H new ATOM 0 HA SER A 65 9.272 -6.411 -9.970 1.00 0.00 H new ATOM 0 HB2 SER A 65 11.274 -5.285 -8.286 1.00 0.00 H new ATOM 0 HB3 SER A 65 11.733 -4.861 -9.923 1.00 0.00 H new ATOM 0 HG SER A 65 9.752 -3.823 -8.416 1.00 0.00 H new ATOM 1055 N GLN A 66 12.173 -7.520 -11.030 1.00 0.00 N ATOM 1056 CA GLN A 66 12.913 -7.933 -12.217 1.00 0.00 C ATOM 1057 C GLN A 66 12.274 -9.161 -12.856 1.00 0.00 C ATOM 1058 O GLN A 66 12.207 -9.272 -14.081 1.00 0.00 O ATOM 1059 CB GLN A 66 14.370 -8.230 -11.858 1.00 0.00 C ATOM 1060 CG GLN A 66 15.153 -8.883 -12.985 1.00 0.00 C ATOM 1061 CD GLN A 66 15.558 -10.309 -12.665 1.00 0.00 C ATOM 1062 OE1 GLN A 66 15.104 -11.255 -13.310 1.00 0.00 O ATOM 1063 NE2 GLN A 66 16.417 -10.470 -11.665 1.00 0.00 N ATOM 0 H GLN A 66 12.623 -7.762 -10.147 1.00 0.00 H new ATOM 0 HA GLN A 66 12.883 -7.114 -12.936 1.00 0.00 H new ATOM 0 HB2 GLN A 66 14.863 -7.300 -11.576 1.00 0.00 H new ATOM 0 HB3 GLN A 66 14.395 -8.882 -10.984 1.00 0.00 H new ATOM 0 HG2 GLN A 66 14.550 -8.876 -13.893 1.00 0.00 H new ATOM 0 HG3 GLN A 66 16.046 -8.293 -13.191 1.00 0.00 H new ATOM 0 HE21 GLN A 66 16.767 -9.657 -11.158 1.00 0.00 H new ATOM 0 HE22 GLN A 66 16.726 -11.406 -11.404 1.00 0.00 H new ATOM 1072 N PHE A 67 11.805 -10.082 -12.020 1.00 0.00 N ATOM 1073 CA PHE A 67 11.172 -11.303 -12.504 1.00 0.00 C ATOM 1074 C PHE A 67 10.042 -10.981 -13.478 1.00 0.00 C ATOM 1075 O PHE A 67 10.024 -11.469 -14.608 1.00 0.00 O ATOM 1076 CB PHE A 67 10.631 -12.122 -11.330 1.00 0.00 C ATOM 1077 CG PHE A 67 9.784 -13.288 -11.753 1.00 0.00 C ATOM 1078 CD1 PHE A 67 10.357 -14.526 -11.995 1.00 0.00 C ATOM 1079 CD2 PHE A 67 8.415 -13.146 -11.909 1.00 0.00 C ATOM 1080 CE1 PHE A 67 9.580 -15.601 -12.384 1.00 0.00 C ATOM 1081 CE2 PHE A 67 7.633 -14.217 -12.297 1.00 0.00 C ATOM 1082 CZ PHE A 67 8.216 -15.446 -12.536 1.00 0.00 C ATOM 0 H PHE A 67 11.852 -10.006 -11.004 1.00 0.00 H new ATOM 0 HA PHE A 67 11.925 -11.889 -13.030 1.00 0.00 H new ATOM 0 HB2 PHE A 67 11.468 -12.488 -10.736 1.00 0.00 H new ATOM 0 HB3 PHE A 67 10.042 -11.471 -10.684 1.00 0.00 H new ATOM 0 HD1 PHE A 67 11.423 -14.653 -11.878 1.00 0.00 H new ATOM 0 HD2 PHE A 67 7.953 -12.187 -11.725 1.00 0.00 H new ATOM 0 HE1 PHE A 67 10.039 -16.561 -12.569 1.00 0.00 H new ATOM 0 HE2 PHE A 67 6.566 -14.093 -12.413 1.00 0.00 H new ATOM 0 HZ PHE A 67 7.607 -16.284 -12.841 1.00 0.00 H new ATOM 1092 N TYR A 68 9.101 -10.157 -13.031 1.00 0.00 N ATOM 1093 CA TYR A 68 7.966 -9.771 -13.860 1.00 0.00 C ATOM 1094 C TYR A 68 8.417 -8.908 -15.034 1.00 0.00 C ATOM 1095 O TYR A 68 8.080 -9.181 -16.186 1.00 0.00 O ATOM 1096 CB TYR A 68 6.931 -9.016 -13.025 1.00 0.00 C ATOM 1097 CG TYR A 68 5.743 -9.862 -12.624 1.00 0.00 C ATOM 1098 CD1 TYR A 68 4.945 -10.473 -13.583 1.00 0.00 C ATOM 1099 CD2 TYR A 68 5.419 -10.048 -11.286 1.00 0.00 C ATOM 1100 CE1 TYR A 68 3.858 -11.246 -13.221 1.00 0.00 C ATOM 1101 CE2 TYR A 68 4.335 -10.821 -10.915 1.00 0.00 C ATOM 1102 CZ TYR A 68 3.558 -11.417 -11.885 1.00 0.00 C ATOM 1103 OH TYR A 68 2.477 -12.186 -11.520 1.00 0.00 O ATOM 0 H TYR A 68 9.102 -9.743 -12.099 1.00 0.00 H new ATOM 0 HA TYR A 68 7.511 -10.680 -14.255 1.00 0.00 H new ATOM 0 HB2 TYR A 68 7.412 -8.631 -12.126 1.00 0.00 H new ATOM 0 HB3 TYR A 68 6.578 -8.154 -13.591 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.178 -10.342 -14.629 1.00 0.00 H new ATOM 0 HD2 TYR A 68 6.024 -9.581 -10.523 1.00 0.00 H new ATOM 0 HE1 TYR A 68 3.247 -11.713 -13.979 1.00 0.00 H new ATOM 0 HE2 TYR A 68 4.098 -10.957 -9.870 1.00 0.00 H new ATOM 0 HH TYR A 68 2.182 -12.720 -12.287 1.00 0.00 H new ATOM 1113 N ALA A 69 9.183 -7.864 -14.732 1.00 0.00 N ATOM 1114 CA ALA A 69 9.683 -6.961 -15.761 1.00 0.00 C ATOM 1115 C ALA A 69 10.402 -7.730 -16.864 1.00 0.00 C ATOM 1116 O ALA A 69 10.439 -7.295 -18.016 1.00 0.00 O ATOM 1117 CB ALA A 69 10.612 -5.924 -15.147 1.00 0.00 C ATOM 0 H ALA A 69 9.470 -7.623 -13.783 1.00 0.00 H new ATOM 0 HA ALA A 69 8.830 -6.450 -16.207 1.00 0.00 H new ATOM 0 HB1 ALA A 69 10.978 -5.256 -15.927 1.00 0.00 H new ATOM 0 HB2 ALA A 69 10.069 -5.346 -14.400 1.00 0.00 H new ATOM 0 HB3 ALA A 69 11.456 -6.426 -14.674 1.00 0.00 H new ATOM 1123 N LEU A 70 10.974 -8.874 -16.505 1.00 0.00 N ATOM 1124 CA LEU A 70 11.694 -9.704 -17.465 1.00 0.00 C ATOM 1125 C LEU A 70 10.731 -10.351 -18.455 1.00 0.00 C ATOM 1126 O LEU A 70 10.956 -10.320 -19.666 1.00 0.00 O ATOM 1127 CB LEU A 70 12.495 -10.784 -16.736 1.00 0.00 C ATOM 1128 CG LEU A 70 12.996 -11.945 -17.596 1.00 0.00 C ATOM 1129 CD1 LEU A 70 13.754 -11.423 -18.807 1.00 0.00 C ATOM 1130 CD2 LEU A 70 13.874 -12.877 -16.775 1.00 0.00 C ATOM 0 H LEU A 70 10.953 -9.248 -15.556 1.00 0.00 H new ATOM 0 HA LEU A 70 12.380 -9.063 -18.019 1.00 0.00 H new ATOM 0 HB2 LEU A 70 13.355 -10.312 -16.262 1.00 0.00 H new ATOM 0 HB3 LEU A 70 11.875 -11.191 -15.938 1.00 0.00 H new ATOM 0 HG LEU A 70 12.133 -12.510 -17.949 1.00 0.00 H new ATOM 0 HD11 LEU A 70 14.103 -12.263 -19.408 1.00 0.00 H new ATOM 0 HD12 LEU A 70 13.094 -10.797 -19.408 1.00 0.00 H new ATOM 0 HD13 LEU A 70 14.609 -10.834 -18.475 1.00 0.00 H new ATOM 0 HD21 LEU A 70 14.221 -13.697 -17.403 1.00 0.00 H new ATOM 0 HD22 LEU A 70 14.732 -12.325 -16.392 1.00 0.00 H new ATOM 0 HD23 LEU A 70 13.299 -13.278 -15.941 1.00 0.00 H new ATOM 1142 N ILE A 71 9.657 -10.934 -17.933 1.00 0.00 N ATOM 1143 CA ILE A 71 8.658 -11.585 -18.772 1.00 0.00 C ATOM 1144 C ILE A 71 7.507 -10.637 -19.092 1.00 0.00 C ATOM 1145 O ILE A 71 6.402 -11.073 -19.412 1.00 0.00 O ATOM 1146 CB ILE A 71 8.095 -12.850 -18.098 1.00 0.00 C ATOM 1147 CG1 ILE A 71 7.432 -12.492 -16.766 1.00 0.00 C ATOM 1148 CG2 ILE A 71 9.199 -13.875 -17.888 1.00 0.00 C ATOM 1149 CD1 ILE A 71 6.838 -13.683 -16.047 1.00 0.00 C ATOM 0 H ILE A 71 9.456 -10.969 -16.934 1.00 0.00 H new ATOM 0 HA ILE A 71 9.159 -11.869 -19.697 1.00 0.00 H new ATOM 0 HB ILE A 71 7.341 -13.287 -18.752 1.00 0.00 H new ATOM 0 HG12 ILE A 71 8.169 -12.018 -16.118 1.00 0.00 H new ATOM 0 HG13 ILE A 71 6.647 -11.758 -16.946 1.00 0.00 H new ATOM 0 HG21 ILE A 71 8.785 -14.763 -17.411 1.00 0.00 H new ATOM 0 HG22 ILE A 71 9.630 -14.148 -18.851 1.00 0.00 H new ATOM 0 HG23 ILE A 71 9.975 -13.449 -17.251 1.00 0.00 H new ATOM 0 HD11 ILE A 71 6.385 -13.355 -15.111 1.00 0.00 H new ATOM 0 HD12 ILE A 71 6.077 -14.145 -16.676 1.00 0.00 H new ATOM 0 HD13 ILE A 71 7.623 -14.409 -15.835 1.00 0.00 H new ATOM 1161 N ASN A 72 7.775 -9.339 -19.005 1.00 0.00 N ATOM 1162 CA ASN A 72 6.762 -8.328 -19.287 1.00 0.00 C ATOM 1163 C ASN A 72 7.118 -7.535 -20.540 1.00 0.00 C ATOM 1164 O ASN A 72 6.243 -6.994 -21.215 1.00 0.00 O ATOM 1165 CB ASN A 72 6.612 -7.380 -18.095 1.00 0.00 C ATOM 1166 CG ASN A 72 5.704 -7.943 -17.019 1.00 0.00 C ATOM 1167 OD1 ASN A 72 5.278 -9.096 -17.091 1.00 0.00 O ATOM 1168 ND2 ASN A 72 5.404 -7.129 -16.014 1.00 0.00 N ATOM 0 H ASN A 72 8.685 -8.962 -18.741 1.00 0.00 H new ATOM 0 HA ASN A 72 5.814 -8.838 -19.459 1.00 0.00 H new ATOM 0 HB2 ASN A 72 7.595 -7.179 -17.669 1.00 0.00 H new ATOM 0 HB3 ASN A 72 6.213 -6.426 -18.441 1.00 0.00 H new ATOM 0 HD21 ASN A 72 4.797 -7.452 -15.260 1.00 0.00 H new ATOM 0 HD22 ASN A 72 5.780 -6.181 -15.996 1.00 0.00 H new ATOM 1175 N GLY A 73 8.410 -7.471 -20.847 1.00 0.00 N ATOM 1176 CA GLY A 73 8.860 -6.743 -22.019 1.00 0.00 C ATOM 1177 C GLY A 73 9.976 -7.458 -22.753 1.00 0.00 C ATOM 1178 O GLY A 73 10.813 -6.823 -23.396 1.00 0.00 O ATOM 0 H GLY A 73 9.154 -7.911 -20.305 1.00 0.00 H new ATOM 0 HA2 GLY A 73 8.019 -6.597 -22.697 1.00 0.00 H new ATOM 0 HA3 GLY A 73 9.203 -5.753 -21.718 1.00 0.00 H new ATOM 1182 N ASP A 74 9.992 -8.783 -22.656 1.00 0.00 N ATOM 1183 CA ASP A 74 11.015 -9.586 -23.316 1.00 0.00 C ATOM 1184 C ASP A 74 10.816 -9.583 -24.829 1.00 0.00 C ATOM 1185 O ASP A 74 10.011 -8.816 -25.356 1.00 0.00 O ATOM 1186 CB ASP A 74 10.987 -11.021 -22.789 1.00 0.00 C ATOM 1187 CG ASP A 74 12.373 -11.623 -22.672 1.00 0.00 C ATOM 1188 OD1 ASP A 74 12.537 -12.810 -23.022 1.00 0.00 O ATOM 1189 OD2 ASP A 74 13.295 -10.905 -22.231 1.00 0.00 O ATOM 0 H ASP A 74 9.308 -9.324 -22.127 1.00 0.00 H new ATOM 0 HA ASP A 74 11.987 -9.145 -23.094 1.00 0.00 H new ATOM 0 HB2 ASP A 74 10.504 -11.037 -21.812 1.00 0.00 H new ATOM 0 HB3 ASP A 74 10.382 -11.637 -23.454 1.00 0.00 H new ATOM 1194 N GLU A 75 11.557 -10.444 -25.520 1.00 0.00 N ATOM 1195 CA GLU A 75 11.463 -10.538 -26.972 1.00 0.00 C ATOM 1196 C GLU A 75 10.012 -10.715 -27.413 1.00 0.00 C ATOM 1197 O GLU A 75 9.390 -9.786 -27.926 1.00 0.00 O ATOM 1198 CB GLU A 75 12.310 -11.704 -27.486 1.00 0.00 C ATOM 1199 CG GLU A 75 13.605 -11.269 -28.150 1.00 0.00 C ATOM 1200 CD GLU A 75 14.650 -12.368 -28.167 1.00 0.00 C ATOM 1201 OE1 GLU A 75 15.253 -12.596 -29.236 1.00 0.00 O ATOM 1202 OE2 GLU A 75 14.864 -13.001 -27.111 1.00 0.00 O ATOM 0 H GLU A 75 12.228 -11.086 -25.098 1.00 0.00 H new ATOM 0 HA GLU A 75 11.843 -9.608 -27.396 1.00 0.00 H new ATOM 0 HB2 GLU A 75 12.544 -12.367 -26.653 1.00 0.00 H new ATOM 0 HB3 GLU A 75 11.722 -12.282 -28.199 1.00 0.00 H new ATOM 0 HG2 GLU A 75 13.397 -10.955 -29.173 1.00 0.00 H new ATOM 0 HG3 GLU A 75 14.004 -10.401 -27.625 1.00 0.00 H new ATOM 1209 N SER A 76 9.481 -11.917 -27.209 1.00 0.00 N ATOM 1210 CA SER A 76 8.106 -12.219 -27.589 1.00 0.00 C ATOM 1211 C SER A 76 7.516 -13.296 -26.683 1.00 0.00 C ATOM 1212 O SER A 76 7.350 -14.444 -27.095 1.00 0.00 O ATOM 1213 CB SER A 76 8.046 -12.674 -29.048 1.00 0.00 C ATOM 1214 OG SER A 76 7.846 -11.573 -29.918 1.00 0.00 O ATOM 0 H SER A 76 9.982 -12.697 -26.783 1.00 0.00 H new ATOM 0 HA SER A 76 7.515 -11.310 -27.475 1.00 0.00 H new ATOM 0 HB2 SER A 76 8.972 -13.186 -29.311 1.00 0.00 H new ATOM 0 HB3 SER A 76 7.237 -13.393 -29.175 1.00 0.00 H new ATOM 0 HG SER A 76 8.258 -10.772 -29.532 1.00 0.00 H new ATOM 1220 N ILE A 77 7.203 -12.916 -25.449 1.00 0.00 N ATOM 1221 CA ILE A 77 6.632 -13.848 -24.486 1.00 0.00 C ATOM 1222 C ILE A 77 5.130 -13.632 -24.336 1.00 0.00 C ATOM 1223 O ILE A 77 4.687 -12.578 -23.878 1.00 0.00 O ATOM 1224 CB ILE A 77 7.299 -13.711 -23.105 1.00 0.00 C ATOM 1225 CG1 ILE A 77 8.805 -13.956 -23.215 1.00 0.00 C ATOM 1226 CG2 ILE A 77 6.671 -14.679 -22.114 1.00 0.00 C ATOM 1227 CD1 ILE A 77 9.538 -13.821 -21.899 1.00 0.00 C ATOM 0 H ILE A 77 7.335 -11.969 -25.093 1.00 0.00 H new ATOM 0 HA ILE A 77 6.816 -14.851 -24.871 1.00 0.00 H new ATOM 0 HB ILE A 77 7.140 -12.696 -22.741 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.974 -14.956 -23.614 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.228 -13.251 -23.931 1.00 0.00 H new ATOM 0 HG21 ILE A 77 7.154 -14.570 -21.143 1.00 0.00 H new ATOM 0 HG22 ILE A 77 5.607 -14.461 -22.017 1.00 0.00 H new ATOM 0 HG23 ILE A 77 6.801 -15.701 -22.471 1.00 0.00 H new ATOM 0 HD11 ILE A 77 10.601 -14.008 -22.054 1.00 0.00 H new ATOM 0 HD12 ILE A 77 9.400 -12.813 -21.508 1.00 0.00 H new ATOM 0 HD13 ILE A 77 9.142 -14.544 -21.186 1.00 0.00 H new ATOM 1443 N TYR A 91 2.680 -16.778 -17.794 1.00 0.00 N ATOM 1444 CA TYR A 91 3.789 -16.283 -18.600 1.00 0.00 C ATOM 1445 C TYR A 91 4.660 -17.434 -19.093 1.00 0.00 C ATOM 1446 O TYR A 91 5.520 -17.933 -18.367 1.00 0.00 O ATOM 1447 CB TYR A 91 4.635 -15.298 -17.791 1.00 0.00 C ATOM 1448 CG TYR A 91 3.916 -14.009 -17.464 1.00 0.00 C ATOM 1449 CD1 TYR A 91 4.215 -12.832 -18.140 1.00 0.00 C ATOM 1450 CD2 TYR A 91 2.938 -13.967 -16.477 1.00 0.00 C ATOM 1451 CE1 TYR A 91 3.561 -11.652 -17.843 1.00 0.00 C ATOM 1452 CE2 TYR A 91 2.279 -12.791 -16.175 1.00 0.00 C ATOM 1453 CZ TYR A 91 2.594 -11.637 -16.861 1.00 0.00 C ATOM 1454 OH TYR A 91 1.939 -10.463 -16.562 1.00 0.00 O ATOM 0 HA TYR A 91 3.374 -15.768 -19.467 1.00 0.00 H new ATOM 0 HB2 TYR A 91 4.946 -15.776 -16.862 1.00 0.00 H new ATOM 0 HB3 TYR A 91 5.542 -15.067 -18.350 1.00 0.00 H new ATOM 0 HD1 TYR A 91 4.972 -12.840 -18.911 1.00 0.00 H new ATOM 0 HD2 TYR A 91 2.689 -14.869 -15.937 1.00 0.00 H new ATOM 0 HE1 TYR A 91 3.806 -10.746 -18.377 1.00 0.00 H new ATOM 0 HE2 TYR A 91 1.521 -12.776 -15.406 1.00 0.00 H new ATOM 0 HH TYR A 91 1.287 -10.625 -15.848 1.00 0.00 H new ATOM 1464 N THR A 92 4.432 -17.850 -20.335 1.00 0.00 N ATOM 1465 CA THR A 92 5.194 -18.942 -20.927 1.00 0.00 C ATOM 1466 C THR A 92 6.348 -18.413 -21.770 1.00 0.00 C ATOM 1467 O THR A 92 6.158 -17.555 -22.633 1.00 0.00 O ATOM 1468 CB THR A 92 4.301 -19.840 -21.804 1.00 0.00 C ATOM 1469 OG1 THR A 92 2.957 -19.825 -21.311 1.00 0.00 O ATOM 1470 CG2 THR A 92 4.823 -21.269 -21.823 1.00 0.00 C ATOM 0 H THR A 92 3.725 -17.447 -20.950 1.00 0.00 H new ATOM 0 HA THR A 92 5.592 -19.533 -20.102 1.00 0.00 H new ATOM 0 HB THR A 92 4.319 -19.450 -22.822 1.00 0.00 H new ATOM 0 HG1 THR A 92 2.395 -20.397 -21.875 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.176 -21.884 -22.449 1.00 0.00 H new ATOM 0 HG22 THR A 92 5.836 -21.281 -22.226 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.831 -21.667 -20.808 1.00 0.00 H new ATOM 1478 N LEU A 93 7.546 -18.930 -21.517 1.00 0.00 N ATOM 1479 CA LEU A 93 8.732 -18.510 -22.255 1.00 0.00 C ATOM 1480 C LEU A 93 8.793 -19.188 -23.620 1.00 0.00 C ATOM 1481 O LEU A 93 8.062 -20.141 -23.885 1.00 0.00 O ATOM 1482 CB LEU A 93 9.995 -18.833 -21.455 1.00 0.00 C ATOM 1483 CG LEU A 93 9.926 -18.560 -19.952 1.00 0.00 C ATOM 1484 CD1 LEU A 93 11.272 -18.832 -19.298 1.00 0.00 C ATOM 1485 CD2 LEU A 93 9.484 -17.128 -19.690 1.00 0.00 C ATOM 0 H LEU A 93 7.721 -19.641 -20.806 1.00 0.00 H new ATOM 0 HA LEU A 93 8.672 -17.432 -22.408 1.00 0.00 H new ATOM 0 HB2 LEU A 93 10.235 -19.886 -21.602 1.00 0.00 H new ATOM 0 HB3 LEU A 93 10.822 -18.257 -21.871 1.00 0.00 H new ATOM 0 HG LEU A 93 9.189 -19.233 -19.513 1.00 0.00 H new ATOM 0 HD11 LEU A 93 11.204 -18.632 -18.229 1.00 0.00 H new ATOM 0 HD12 LEU A 93 11.549 -19.874 -19.456 1.00 0.00 H new ATOM 0 HD13 LEU A 93 12.029 -18.184 -19.740 1.00 0.00 H new ATOM 0 HD21 LEU A 93 9.440 -16.952 -18.615 1.00 0.00 H new ATOM 0 HD22 LEU A 93 10.197 -16.439 -20.142 1.00 0.00 H new ATOM 0 HD23 LEU A 93 8.497 -16.966 -20.124 1.00 0.00 H new ATOM 1497 N GLY A 94 9.673 -18.690 -24.484 1.00 0.00 N ATOM 1498 CA GLY A 94 9.815 -19.261 -25.810 1.00 0.00 C ATOM 1499 C GLY A 94 10.134 -20.742 -25.773 1.00 0.00 C ATOM 1500 O GLY A 94 9.851 -21.469 -26.725 1.00 0.00 O ATOM 0 H GLY A 94 10.290 -17.901 -24.289 1.00 0.00 H new ATOM 0 HA2 GLY A 94 8.893 -19.105 -26.370 1.00 0.00 H new ATOM 0 HA3 GLY A 94 10.606 -18.736 -26.346 1.00 0.00 H new ATOM 1504 N ASP A 95 10.726 -21.191 -24.671 1.00 0.00 N ATOM 1505 CA ASP A 95 11.084 -22.595 -24.513 1.00 0.00 C ATOM 1506 C ASP A 95 10.027 -23.338 -23.703 1.00 0.00 C ATOM 1507 O ASP A 95 10.318 -24.344 -23.058 1.00 0.00 O ATOM 1508 CB ASP A 95 12.448 -22.722 -23.833 1.00 0.00 C ATOM 1509 CG ASP A 95 13.595 -22.396 -24.770 1.00 0.00 C ATOM 1510 OD1 ASP A 95 13.539 -22.815 -25.945 1.00 0.00 O ATOM 1511 OD2 ASP A 95 14.548 -21.721 -24.328 1.00 0.00 O ATOM 0 H ASP A 95 10.968 -20.602 -23.874 1.00 0.00 H new ATOM 0 HA ASP A 95 11.138 -23.044 -25.505 1.00 0.00 H new ATOM 0 HB2 ASP A 95 12.485 -22.054 -22.972 1.00 0.00 H new ATOM 0 HB3 ASP A 95 12.569 -23.737 -23.455 1.00 0.00 H new ATOM 1516 N GLY A 96 8.797 -22.834 -23.740 1.00 0.00 N ATOM 1517 CA GLY A 96 7.715 -23.462 -23.005 1.00 0.00 C ATOM 1518 C GLY A 96 8.058 -23.682 -21.545 1.00 0.00 C ATOM 1519 O GLY A 96 7.550 -24.609 -20.914 1.00 0.00 O ATOM 0 H GLY A 96 8.531 -22.002 -24.266 1.00 0.00 H new ATOM 0 HA2 GLY A 96 6.823 -22.840 -23.076 1.00 0.00 H new ATOM 0 HA3 GLY A 96 7.474 -24.419 -23.467 1.00 0.00 H new ATOM 1523 N SER A 97 8.923 -22.828 -21.006 1.00 0.00 N ATOM 1524 CA SER A 97 9.338 -22.937 -19.613 1.00 0.00 C ATOM 1525 C SER A 97 8.394 -22.159 -18.702 1.00 0.00 C ATOM 1526 O SER A 97 7.917 -21.082 -19.059 1.00 0.00 O ATOM 1527 CB SER A 97 10.769 -22.422 -19.443 1.00 0.00 C ATOM 1528 OG SER A 97 11.240 -21.822 -20.637 1.00 0.00 O ATOM 0 H SER A 97 9.350 -22.053 -21.514 1.00 0.00 H new ATOM 0 HA SER A 97 9.302 -23.989 -19.331 1.00 0.00 H new ATOM 0 HB2 SER A 97 10.804 -21.697 -18.630 1.00 0.00 H new ATOM 0 HB3 SER A 97 11.425 -23.247 -19.163 1.00 0.00 H new ATOM 0 HG SER A 97 12.200 -21.644 -20.557 1.00 0.00 H new ATOM 1534 N SER A 98 8.128 -22.713 -17.524 1.00 0.00 N ATOM 1535 CA SER A 98 7.237 -22.074 -16.562 1.00 0.00 C ATOM 1536 C SER A 98 8.029 -21.242 -15.558 1.00 0.00 C ATOM 1537 O SER A 98 8.276 -21.676 -14.432 1.00 0.00 O ATOM 1538 CB SER A 98 6.406 -23.127 -15.826 1.00 0.00 C ATOM 1539 OG SER A 98 7.073 -24.377 -15.801 1.00 0.00 O ATOM 0 H SER A 98 8.517 -23.603 -17.212 1.00 0.00 H new ATOM 0 HA SER A 98 6.567 -21.411 -17.109 1.00 0.00 H new ATOM 0 HB2 SER A 98 6.212 -22.794 -14.806 1.00 0.00 H new ATOM 0 HB3 SER A 98 5.438 -23.238 -16.315 1.00 0.00 H new ATOM 0 HG SER A 98 6.522 -25.032 -15.324 1.00 0.00 H new ATOM 1545 N LEU A 99 8.424 -20.043 -15.974 1.00 0.00 N ATOM 1546 CA LEU A 99 9.188 -19.148 -15.112 1.00 0.00 C ATOM 1547 C LEU A 99 8.493 -18.961 -13.767 1.00 0.00 C ATOM 1548 O LEU A 99 7.394 -18.411 -13.698 1.00 0.00 O ATOM 1549 CB LEU A 99 9.379 -17.792 -15.793 1.00 0.00 C ATOM 1550 CG LEU A 99 10.679 -17.055 -15.469 1.00 0.00 C ATOM 1551 CD1 LEU A 99 11.764 -17.421 -16.469 1.00 0.00 C ATOM 1552 CD2 LEU A 99 10.449 -15.550 -15.455 1.00 0.00 C ATOM 0 H LEU A 99 8.228 -19.669 -16.902 1.00 0.00 H new ATOM 0 HA LEU A 99 10.164 -19.600 -14.935 1.00 0.00 H new ATOM 0 HB2 LEU A 99 9.328 -17.939 -16.872 1.00 0.00 H new ATOM 0 HB3 LEU A 99 8.542 -17.149 -15.519 1.00 0.00 H new ATOM 0 HG LEU A 99 11.011 -17.361 -14.477 1.00 0.00 H new ATOM 0 HD11 LEU A 99 12.681 -16.887 -16.222 1.00 0.00 H new ATOM 0 HD12 LEU A 99 11.948 -18.495 -16.430 1.00 0.00 H new ATOM 0 HD13 LEU A 99 11.442 -17.144 -17.473 1.00 0.00 H new ATOM 0 HD21 LEU A 99 11.385 -15.041 -15.223 1.00 0.00 H new ATOM 0 HD22 LEU A 99 10.093 -15.227 -16.434 1.00 0.00 H new ATOM 0 HD23 LEU A 99 9.704 -15.303 -14.699 1.00 0.00 H new ATOM 1564 N GLN A 100 9.141 -19.421 -12.702 1.00 0.00 N ATOM 1565 CA GLN A 100 8.585 -19.303 -11.360 1.00 0.00 C ATOM 1566 C GLN A 100 9.207 -18.127 -10.614 1.00 0.00 C ATOM 1567 O GLN A 100 10.412 -17.888 -10.704 1.00 0.00 O ATOM 1568 CB GLN A 100 8.811 -20.596 -10.575 1.00 0.00 C ATOM 1569 CG GLN A 100 10.256 -21.067 -10.582 1.00 0.00 C ATOM 1570 CD GLN A 100 10.607 -21.891 -9.359 1.00 0.00 C ATOM 1571 OE1 GLN A 100 11.015 -23.048 -9.471 1.00 0.00 O ATOM 1572 NE2 GLN A 100 10.450 -21.299 -8.181 1.00 0.00 N ATOM 0 H GLN A 100 10.052 -19.879 -12.743 1.00 0.00 H new ATOM 0 HA GLN A 100 7.514 -19.125 -11.453 1.00 0.00 H new ATOM 0 HB2 GLN A 100 8.492 -20.446 -9.544 1.00 0.00 H new ATOM 0 HB3 GLN A 100 8.180 -21.380 -10.993 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.437 -21.660 -11.479 1.00 0.00 H new ATOM 0 HG3 GLN A 100 10.916 -20.201 -10.634 1.00 0.00 H new ATOM 0 HE21 GLN A 100 10.109 -20.339 -8.134 1.00 0.00 H new ATOM 0 HE22 GLN A 100 10.670 -21.804 -7.323 1.00 0.00 H new ATOM 1581 N LYS A 101 8.379 -17.394 -9.878 1.00 0.00 N ATOM 1582 CA LYS A 101 8.847 -16.243 -9.116 1.00 0.00 C ATOM 1583 C LYS A 101 10.038 -16.618 -8.239 1.00 0.00 C ATOM 1584 O LYS A 101 10.275 -17.789 -7.941 1.00 0.00 O ATOM 1585 CB LYS A 101 7.716 -15.686 -8.247 1.00 0.00 C ATOM 1586 CG LYS A 101 6.936 -14.564 -8.909 1.00 0.00 C ATOM 1587 CD LYS A 101 5.735 -15.095 -9.673 1.00 0.00 C ATOM 1588 CE LYS A 101 4.699 -14.006 -9.910 1.00 0.00 C ATOM 1589 NZ LYS A 101 3.384 -14.571 -10.319 1.00 0.00 N ATOM 0 H LYS A 101 7.379 -17.577 -9.793 1.00 0.00 H new ATOM 0 HA LYS A 101 9.165 -15.477 -9.823 1.00 0.00 H new ATOM 0 HB2 LYS A 101 7.030 -16.495 -7.996 1.00 0.00 H new ATOM 0 HB3 LYS A 101 8.136 -15.321 -7.309 1.00 0.00 H new ATOM 0 HG2 LYS A 101 6.602 -13.855 -8.151 1.00 0.00 H new ATOM 0 HG3 LYS A 101 7.589 -14.018 -9.590 1.00 0.00 H new ATOM 0 HD2 LYS A 101 6.062 -15.502 -10.630 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.282 -15.915 -9.116 1.00 0.00 H new ATOM 0 HE2 LYS A 101 4.575 -13.419 -9.000 1.00 0.00 H new ATOM 0 HE3 LYS A 101 5.058 -13.325 -10.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 2.834 -13.844 -10.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 3.536 -15.384 -10.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 2.861 -14.880 -9.475 1.00 0.00 H new ATOM 1603 N PRO A 102 10.804 -15.602 -7.815 1.00 0.00 N ATOM 1604 CA PRO A 102 11.982 -15.801 -6.965 1.00 0.00 C ATOM 1605 C PRO A 102 11.610 -16.240 -5.552 1.00 0.00 C ATOM 1606 O PRO A 102 10.635 -15.756 -4.978 1.00 0.00 O ATOM 1607 CB PRO A 102 12.639 -14.419 -6.940 1.00 0.00 C ATOM 1608 CG PRO A 102 11.526 -13.466 -7.207 1.00 0.00 C ATOM 1609 CD PRO A 102 10.580 -14.182 -8.131 1.00 0.00 C ATOM 0 HA PRO A 102 12.631 -16.590 -7.346 1.00 0.00 H new ATOM 0 HB2 PRO A 102 13.107 -14.221 -5.976 1.00 0.00 H new ATOM 0 HB3 PRO A 102 13.420 -14.338 -7.696 1.00 0.00 H new ATOM 0 HG2 PRO A 102 11.026 -13.181 -6.281 1.00 0.00 H new ATOM 0 HG3 PRO A 102 11.899 -12.549 -7.664 1.00 0.00 H new ATOM 0 HD2 PRO A 102 9.545 -13.889 -7.953 1.00 0.00 H new ATOM 0 HD3 PRO A 102 10.797 -13.964 -9.177 1.00 0.00 H new ATOM 1617 N ASP A 103 12.393 -17.159 -4.998 1.00 0.00 N ATOM 1618 CA ASP A 103 12.147 -17.662 -3.651 1.00 0.00 C ATOM 1619 C ASP A 103 12.539 -16.625 -2.604 1.00 0.00 C ATOM 1620 O ASP A 103 13.575 -16.748 -1.950 1.00 0.00 O ATOM 1621 CB ASP A 103 12.923 -18.959 -3.419 1.00 0.00 C ATOM 1622 CG ASP A 103 12.392 -20.109 -4.252 1.00 0.00 C ATOM 1623 OD1 ASP A 103 11.352 -19.928 -4.919 1.00 0.00 O ATOM 1624 OD2 ASP A 103 13.018 -21.189 -4.237 1.00 0.00 O ATOM 0 H ASP A 103 13.203 -17.571 -5.461 1.00 0.00 H new ATOM 0 HA ASP A 103 11.080 -17.864 -3.554 1.00 0.00 H new ATOM 0 HB2 ASP A 103 13.974 -18.797 -3.657 1.00 0.00 H new ATOM 0 HB3 ASP A 103 12.872 -19.225 -2.363 1.00 0.00 H new ATOM 1629 N VAL A 104 11.704 -15.602 -2.449 1.00 0.00 N ATOM 1630 CA VAL A 104 11.963 -14.543 -1.481 1.00 0.00 C ATOM 1631 C VAL A 104 11.135 -14.740 -0.216 1.00 0.00 C ATOM 1632 O VAL A 104 10.895 -13.794 0.535 1.00 0.00 O ATOM 1633 CB VAL A 104 11.654 -13.154 -2.072 1.00 0.00 C ATOM 1634 CG1 VAL A 104 12.428 -12.940 -3.365 1.00 0.00 C ATOM 1635 CG2 VAL A 104 10.159 -12.994 -2.303 1.00 0.00 C ATOM 0 H VAL A 104 10.842 -15.484 -2.982 1.00 0.00 H new ATOM 0 HA VAL A 104 13.023 -14.596 -1.230 1.00 0.00 H new ATOM 0 HB VAL A 104 11.971 -12.395 -1.357 1.00 0.00 H new ATOM 0 HG11 VAL A 104 12.197 -11.954 -3.768 1.00 0.00 H new ATOM 0 HG12 VAL A 104 13.497 -13.009 -3.165 1.00 0.00 H new ATOM 0 HG13 VAL A 104 12.144 -13.704 -4.089 1.00 0.00 H new ATOM 0 HG21 VAL A 104 9.959 -12.007 -2.721 1.00 0.00 H new ATOM 0 HG22 VAL A 104 9.814 -13.759 -2.999 1.00 0.00 H new ATOM 0 HG23 VAL A 104 9.631 -13.101 -1.355 1.00 0.00 H new ATOM 1645 N TYR A 105 10.701 -15.974 0.013 1.00 0.00 N ATOM 1646 CA TYR A 105 9.897 -16.296 1.187 1.00 0.00 C ATOM 1647 C TYR A 105 10.738 -16.228 2.458 1.00 0.00 C ATOM 1648 O TYR A 105 10.294 -15.710 3.482 1.00 0.00 O ATOM 1649 CB TYR A 105 9.282 -17.688 1.043 1.00 0.00 C ATOM 1650 CG TYR A 105 8.387 -18.077 2.198 1.00 0.00 C ATOM 1651 CD1 TYR A 105 7.013 -17.877 2.136 1.00 0.00 C ATOM 1652 CD2 TYR A 105 8.915 -18.643 3.352 1.00 0.00 C ATOM 1653 CE1 TYR A 105 6.192 -18.230 3.190 1.00 0.00 C ATOM 1654 CE2 TYR A 105 8.101 -19.001 4.409 1.00 0.00 C ATOM 1655 CZ TYR A 105 6.740 -18.792 4.324 1.00 0.00 C ATOM 1656 OH TYR A 105 5.926 -19.145 5.375 1.00 0.00 O ATOM 0 H TYR A 105 10.892 -16.768 -0.598 1.00 0.00 H new ATOM 0 HA TYR A 105 9.097 -15.559 1.262 1.00 0.00 H new ATOM 0 HB2 TYR A 105 8.706 -17.728 0.119 1.00 0.00 H new ATOM 0 HB3 TYR A 105 10.083 -18.422 0.951 1.00 0.00 H new ATOM 0 HD1 TYR A 105 6.580 -17.438 1.249 1.00 0.00 H new ATOM 0 HD2 TYR A 105 9.980 -18.806 3.424 1.00 0.00 H new ATOM 0 HE1 TYR A 105 5.126 -18.067 3.126 1.00 0.00 H new ATOM 0 HE2 TYR A 105 8.528 -19.442 5.298 1.00 0.00 H new ATOM 0 HH TYR A 105 6.469 -19.528 6.095 1.00 0.00 H new ATOM 1666 N ALA A 106 11.956 -16.755 2.383 1.00 0.00 N ATOM 1667 CA ALA A 106 12.861 -16.752 3.525 1.00 0.00 C ATOM 1668 C ALA A 106 13.269 -15.331 3.900 1.00 0.00 C ATOM 1669 O ALA A 106 13.628 -15.059 5.046 1.00 0.00 O ATOM 1670 CB ALA A 106 14.092 -17.595 3.225 1.00 0.00 C ATOM 0 H ALA A 106 12.338 -17.189 1.543 1.00 0.00 H new ATOM 0 HA ALA A 106 12.335 -17.186 4.375 1.00 0.00 H new ATOM 0 HB1 ALA A 106 14.759 -17.584 4.087 1.00 0.00 H new ATOM 0 HB2 ALA A 106 13.788 -18.620 3.014 1.00 0.00 H new ATOM 0 HB3 ALA A 106 14.611 -17.185 2.359 1.00 0.00 H new ATOM 1676 N LEU A 107 13.213 -14.429 2.926 1.00 0.00 N ATOM 1677 CA LEU A 107 13.577 -13.035 3.154 1.00 0.00 C ATOM 1678 C LEU A 107 12.533 -12.332 4.015 1.00 0.00 C ATOM 1679 O LEU A 107 12.860 -11.732 5.039 1.00 0.00 O ATOM 1680 CB LEU A 107 13.731 -12.303 1.819 1.00 0.00 C ATOM 1681 CG LEU A 107 14.912 -12.734 0.949 1.00 0.00 C ATOM 1682 CD1 LEU A 107 14.859 -12.042 -0.404 1.00 0.00 C ATOM 1683 CD2 LEU A 107 16.228 -12.437 1.652 1.00 0.00 C ATOM 0 H LEU A 107 12.919 -14.638 1.972 1.00 0.00 H new ATOM 0 HA LEU A 107 14.529 -13.016 3.684 1.00 0.00 H new ATOM 0 HB2 LEU A 107 12.814 -12.439 1.245 1.00 0.00 H new ATOM 0 HB3 LEU A 107 13.825 -11.236 2.021 1.00 0.00 H new ATOM 0 HG LEU A 107 14.845 -13.810 0.786 1.00 0.00 H new ATOM 0 HD11 LEU A 107 15.707 -12.361 -1.009 1.00 0.00 H new ATOM 0 HD12 LEU A 107 13.931 -12.306 -0.912 1.00 0.00 H new ATOM 0 HD13 LEU A 107 14.900 -10.962 -0.262 1.00 0.00 H new ATOM 0 HD21 LEU A 107 17.058 -12.750 1.018 1.00 0.00 H new ATOM 0 HD22 LEU A 107 16.303 -11.367 1.846 1.00 0.00 H new ATOM 0 HD23 LEU A 107 16.267 -12.981 2.596 1.00 0.00 H new ATOM 1695 N ILE A 108 11.275 -12.413 3.594 1.00 0.00 N ATOM 1696 CA ILE A 108 10.182 -11.788 4.329 1.00 0.00 C ATOM 1697 C ILE A 108 9.736 -12.660 5.498 1.00 0.00 C ATOM 1698 O ILE A 108 8.952 -12.230 6.344 1.00 0.00 O ATOM 1699 CB ILE A 108 8.973 -11.515 3.415 1.00 0.00 C ATOM 1700 CG1 ILE A 108 8.541 -12.801 2.707 1.00 0.00 C ATOM 1701 CG2 ILE A 108 9.309 -10.432 2.401 1.00 0.00 C ATOM 1702 CD1 ILE A 108 7.145 -12.732 2.128 1.00 0.00 C ATOM 0 H ILE A 108 10.988 -12.905 2.748 1.00 0.00 H new ATOM 0 HA ILE A 108 10.560 -10.839 4.711 1.00 0.00 H new ATOM 0 HB ILE A 108 8.143 -11.165 4.029 1.00 0.00 H new ATOM 0 HG12 ILE A 108 9.247 -13.020 1.906 1.00 0.00 H new ATOM 0 HG13 ILE A 108 8.592 -13.630 3.413 1.00 0.00 H new ATOM 0 HG21 ILE A 108 8.444 -10.251 1.762 1.00 0.00 H new ATOM 0 HG22 ILE A 108 9.573 -9.513 2.924 1.00 0.00 H new ATOM 0 HG23 ILE A 108 10.151 -10.755 1.789 1.00 0.00 H new ATOM 0 HD11 ILE A 108 6.906 -13.678 1.641 1.00 0.00 H new ATOM 0 HD12 ILE A 108 6.428 -12.544 2.927 1.00 0.00 H new ATOM 0 HD13 ILE A 108 7.094 -11.925 1.397 1.00 0.00 H new ATOM 1714 N LYS A 109 10.242 -13.888 5.539 1.00 0.00 N ATOM 1715 CA LYS A 109 9.899 -14.821 6.606 1.00 0.00 C ATOM 1716 C LYS A 109 10.164 -14.204 7.975 1.00 0.00 C ATOM 1717 O LYS A 109 9.538 -14.578 8.967 1.00 0.00 O ATOM 1718 CB LYS A 109 10.700 -16.116 6.455 1.00 0.00 C ATOM 1719 CG LYS A 109 10.581 -17.048 7.649 1.00 0.00 C ATOM 1720 CD LYS A 109 10.517 -18.503 7.217 1.00 0.00 C ATOM 1721 CE LYS A 109 11.523 -19.355 7.975 1.00 0.00 C ATOM 1722 NZ LYS A 109 11.076 -19.633 9.368 1.00 0.00 N ATOM 0 H LYS A 109 10.891 -14.260 4.846 1.00 0.00 H new ATOM 0 HA LYS A 109 8.835 -15.047 6.529 1.00 0.00 H new ATOM 0 HB2 LYS A 109 10.362 -16.640 5.561 1.00 0.00 H new ATOM 0 HB3 LYS A 109 11.750 -15.868 6.302 1.00 0.00 H new ATOM 0 HG2 LYS A 109 11.434 -16.902 8.312 1.00 0.00 H new ATOM 0 HG3 LYS A 109 9.687 -16.797 8.220 1.00 0.00 H new ATOM 0 HD2 LYS A 109 9.512 -18.889 7.385 1.00 0.00 H new ATOM 0 HD3 LYS A 109 10.711 -18.575 6.147 1.00 0.00 H new ATOM 0 HE2 LYS A 109 11.672 -20.297 7.447 1.00 0.00 H new ATOM 0 HE3 LYS A 109 12.486 -18.846 7.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 11.789 -20.216 9.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 10.958 -18.736 9.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 10.169 -20.142 9.347 1.00 0.00 H new ATOM 1736 N ASP A 110 11.093 -13.256 8.022 1.00 0.00 N ATOM 1737 CA ASP A 110 11.439 -12.585 9.270 1.00 0.00 C ATOM 1738 C ASP A 110 10.251 -11.792 9.807 1.00 0.00 C ATOM 1739 O ASP A 110 10.164 -11.520 11.005 1.00 0.00 O ATOM 1740 CB ASP A 110 12.635 -11.655 9.060 1.00 0.00 C ATOM 1741 CG ASP A 110 13.946 -12.298 9.470 1.00 0.00 C ATOM 1742 OD1 ASP A 110 14.513 -13.060 8.660 1.00 0.00 O ATOM 1743 OD2 ASP A 110 14.406 -12.036 10.601 1.00 0.00 O ATOM 0 H ASP A 110 11.620 -12.934 7.210 1.00 0.00 H new ATOM 0 HA ASP A 110 11.706 -13.347 10.002 1.00 0.00 H new ATOM 0 HB2 ASP A 110 12.688 -11.367 8.010 1.00 0.00 H new ATOM 0 HB3 ASP A 110 12.486 -10.741 9.635 1.00 0.00 H new ATOM 1748 N TYR A 111 9.340 -11.423 8.914 1.00 0.00 N ATOM 1749 CA TYR A 111 8.160 -10.658 9.297 1.00 0.00 C ATOM 1750 C TYR A 111 6.890 -11.306 8.754 1.00 0.00 C ATOM 1751 O TYR A 111 5.994 -10.623 8.257 1.00 0.00 O ATOM 1752 CB TYR A 111 8.270 -9.220 8.787 1.00 0.00 C ATOM 1753 CG TYR A 111 9.385 -8.431 9.436 1.00 0.00 C ATOM 1754 CD1 TYR A 111 10.717 -8.724 9.167 1.00 0.00 C ATOM 1755 CD2 TYR A 111 9.107 -7.394 10.317 1.00 0.00 C ATOM 1756 CE1 TYR A 111 11.739 -8.006 9.758 1.00 0.00 C ATOM 1757 CE2 TYR A 111 10.123 -6.670 10.912 1.00 0.00 C ATOM 1758 CZ TYR A 111 11.437 -6.980 10.629 1.00 0.00 C ATOM 1759 OH TYR A 111 12.452 -6.263 11.220 1.00 0.00 O ATOM 0 H TYR A 111 9.396 -11.641 7.919 1.00 0.00 H new ATOM 0 HA TYR A 111 8.104 -10.647 10.385 1.00 0.00 H new ATOM 0 HB2 TYR A 111 8.428 -9.237 7.709 1.00 0.00 H new ATOM 0 HB3 TYR A 111 7.324 -8.708 8.962 1.00 0.00 H new ATOM 0 HD1 TYR A 111 10.957 -9.526 8.485 1.00 0.00 H new ATOM 0 HD2 TYR A 111 8.079 -7.149 10.541 1.00 0.00 H new ATOM 0 HE1 TYR A 111 12.769 -8.247 9.539 1.00 0.00 H new ATOM 0 HE2 TYR A 111 9.889 -5.866 11.595 1.00 0.00 H new ATOM 0 HH TYR A 111 12.070 -5.576 11.805 1.00 0.00 H new ATOM 1769 N VAL A 112 6.821 -12.630 8.852 1.00 0.00 N ATOM 1770 CA VAL A 112 5.661 -13.372 8.373 1.00 0.00 C ATOM 1771 C VAL A 112 4.980 -14.123 9.512 1.00 0.00 C ATOM 1772 O VAL A 112 5.643 -14.682 10.386 1.00 0.00 O ATOM 1773 CB VAL A 112 6.053 -14.376 7.273 1.00 0.00 C ATOM 1774 CG1 VAL A 112 4.904 -15.332 6.987 1.00 0.00 C ATOM 1775 CG2 VAL A 112 6.474 -13.643 6.008 1.00 0.00 C ATOM 0 H VAL A 112 7.555 -13.210 9.259 1.00 0.00 H new ATOM 0 HA VAL A 112 4.967 -12.641 7.958 1.00 0.00 H new ATOM 0 HB VAL A 112 6.902 -14.961 7.626 1.00 0.00 H new ATOM 0 HG11 VAL A 112 5.200 -16.034 6.207 1.00 0.00 H new ATOM 0 HG12 VAL A 112 4.654 -15.882 7.894 1.00 0.00 H new ATOM 0 HG13 VAL A 112 4.034 -14.766 6.654 1.00 0.00 H new ATOM 0 HG21 VAL A 112 6.748 -14.368 5.241 1.00 0.00 H new ATOM 0 HG22 VAL A 112 5.646 -13.031 5.650 1.00 0.00 H new ATOM 0 HG23 VAL A 112 7.330 -13.004 6.225 1.00 0.00 H new ATOM 1910 N ILE A 122 12.456 -21.202 17.770 1.00 0.00 N ATOM 1911 CA ILE A 122 12.234 -21.267 19.209 1.00 0.00 C ATOM 1912 C ILE A 122 13.549 -21.454 19.959 1.00 0.00 C ATOM 1913 O ILE A 122 14.452 -22.144 19.486 1.00 0.00 O ATOM 1914 CB ILE A 122 11.277 -22.415 19.580 1.00 0.00 C ATOM 1915 CG1 ILE A 122 9.890 -22.164 18.984 1.00 0.00 C ATOM 1916 CG2 ILE A 122 11.191 -22.565 21.092 1.00 0.00 C ATOM 1917 CD1 ILE A 122 9.336 -23.349 18.224 1.00 0.00 C ATOM 0 HA ILE A 122 11.782 -20.319 19.502 1.00 0.00 H new ATOM 0 HB ILE A 122 11.668 -23.344 19.164 1.00 0.00 H new ATOM 0 HG12 ILE A 122 9.200 -21.903 19.787 1.00 0.00 H new ATOM 0 HG13 ILE A 122 9.941 -21.305 18.315 1.00 0.00 H new ATOM 0 HG21 ILE A 122 10.511 -23.380 21.339 1.00 0.00 H new ATOM 0 HG22 ILE A 122 12.181 -22.784 21.493 1.00 0.00 H new ATOM 0 HG23 ILE A 122 10.820 -21.638 21.529 1.00 0.00 H new ATOM 0 HD11 ILE A 122 8.351 -23.100 17.829 1.00 0.00 H new ATOM 0 HD12 ILE A 122 10.005 -23.598 17.400 1.00 0.00 H new ATOM 0 HD13 ILE A 122 9.253 -24.204 18.894 1.00 0.00 H new ATOM 1929 N GLU A 123 13.647 -20.836 21.132 1.00 0.00 N ATOM 1930 CA GLU A 123 14.852 -20.936 21.948 1.00 0.00 C ATOM 1931 C GLU A 123 16.048 -20.315 21.231 1.00 0.00 C ATOM 1932 O GLU A 123 17.197 -20.550 21.602 1.00 0.00 O ATOM 1933 CB GLU A 123 15.147 -22.399 22.285 1.00 0.00 C ATOM 1934 CG GLU A 123 14.882 -22.755 23.738 1.00 0.00 C ATOM 1935 CD GLU A 123 15.855 -23.787 24.273 1.00 0.00 C ATOM 1936 OE1 GLU A 123 15.398 -24.758 24.911 1.00 0.00 O ATOM 1937 OE2 GLU A 123 17.074 -23.625 24.053 1.00 0.00 O ATOM 0 H GLU A 123 12.908 -20.262 21.538 1.00 0.00 H new ATOM 0 HA GLU A 123 14.680 -20.386 22.873 1.00 0.00 H new ATOM 0 HB2 GLU A 123 14.539 -23.040 21.646 1.00 0.00 H new ATOM 0 HB3 GLU A 123 16.190 -22.614 22.052 1.00 0.00 H new ATOM 0 HG2 GLU A 123 14.944 -21.853 24.346 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.865 -23.135 23.835 1.00 0.00 H new ATOM 1944 N ALA A 124 15.767 -19.523 20.202 1.00 0.00 N ATOM 1945 CA ALA A 124 16.818 -18.868 19.434 1.00 0.00 C ATOM 1946 C ALA A 124 17.033 -17.435 19.908 1.00 0.00 C ATOM 1947 O ALA A 124 18.168 -16.996 20.099 1.00 0.00 O ATOM 1948 CB ALA A 124 16.479 -18.889 17.951 1.00 0.00 C ATOM 0 H ALA A 124 14.820 -19.319 19.881 1.00 0.00 H new ATOM 0 HA ALA A 124 17.745 -19.418 19.592 1.00 0.00 H new ATOM 0 HB1 ALA A 124 17.273 -18.396 17.389 1.00 0.00 H new ATOM 0 HB2 ALA A 124 16.383 -19.921 17.614 1.00 0.00 H new ATOM 0 HB3 ALA A 124 15.538 -18.364 17.785 1.00 0.00 H new ATOM 1954 N LYS A 125 15.937 -16.708 20.097 1.00 0.00 N ATOM 1955 CA LYS A 125 16.005 -15.324 20.550 1.00 0.00 C ATOM 1956 C LYS A 125 16.167 -15.254 22.065 1.00 0.00 C ATOM 1957 O LYS A 125 16.712 -14.288 22.597 1.00 0.00 O ATOM 1958 CB LYS A 125 14.745 -14.565 20.125 1.00 0.00 C ATOM 1959 CG LYS A 125 14.956 -13.067 19.986 1.00 0.00 C ATOM 1960 CD LYS A 125 14.296 -12.526 18.728 1.00 0.00 C ATOM 1961 CE LYS A 125 13.411 -11.328 19.035 1.00 0.00 C ATOM 1962 NZ LYS A 125 13.458 -10.311 17.948 1.00 0.00 N ATOM 0 H LYS A 125 14.990 -17.055 19.943 1.00 0.00 H new ATOM 0 HA LYS A 125 16.876 -14.859 20.088 1.00 0.00 H new ATOM 0 HB2 LYS A 125 14.394 -14.964 19.173 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.957 -14.746 20.856 1.00 0.00 H new ATOM 0 HG2 LYS A 125 14.548 -12.558 20.860 1.00 0.00 H new ATOM 0 HG3 LYS A 125 16.024 -12.850 19.960 1.00 0.00 H new ATOM 0 HD2 LYS A 125 15.063 -12.239 18.008 1.00 0.00 H new ATOM 0 HD3 LYS A 125 13.700 -13.311 18.262 1.00 0.00 H new ATOM 0 HE2 LYS A 125 12.383 -11.662 19.175 1.00 0.00 H new ATOM 0 HE3 LYS A 125 13.729 -10.872 19.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 12.842 -9.510 18.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 14.435 -9.973 17.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 13.130 -10.738 17.058 1.00 0.00 H new ATOM 1976 N VAL A 126 15.690 -16.286 22.754 1.00 0.00 N ATOM 1977 CA VAL A 126 15.785 -16.343 24.208 1.00 0.00 C ATOM 1978 C VAL A 126 17.239 -16.394 24.663 1.00 0.00 C ATOM 1979 O VAL A 126 17.575 -15.936 25.755 1.00 0.00 O ATOM 1980 CB VAL A 126 15.040 -17.568 24.771 1.00 0.00 C ATOM 1981 CG1 VAL A 126 15.123 -17.592 26.290 1.00 0.00 C ATOM 1982 CG2 VAL A 126 13.591 -17.569 24.308 1.00 0.00 C ATOM 0 H VAL A 126 15.234 -17.093 22.329 1.00 0.00 H new ATOM 0 HA VAL A 126 15.319 -15.435 24.591 1.00 0.00 H new ATOM 0 HB VAL A 126 15.520 -18.470 24.391 1.00 0.00 H new ATOM 0 HG11 VAL A 126 14.591 -18.464 26.670 1.00 0.00 H new ATOM 0 HG12 VAL A 126 16.168 -17.642 26.597 1.00 0.00 H new ATOM 0 HG13 VAL A 126 14.670 -16.687 26.694 1.00 0.00 H new ATOM 0 HG21 VAL A 126 13.080 -18.441 24.715 1.00 0.00 H new ATOM 0 HG22 VAL A 126 13.097 -16.663 24.658 1.00 0.00 H new ATOM 0 HG23 VAL A 126 13.557 -17.604 23.219 1.00 0.00 H new ATOM 1992 N ARG A 127 18.099 -16.952 23.817 1.00 0.00 N ATOM 1993 CA ARG A 127 19.518 -17.063 24.132 1.00 0.00 C ATOM 1994 C ARG A 127 20.217 -15.716 23.971 1.00 0.00 C ATOM 1995 O ARG A 127 21.248 -15.463 24.593 1.00 0.00 O ATOM 1996 CB ARG A 127 20.182 -18.105 23.231 1.00 0.00 C ATOM 1997 CG ARG A 127 19.949 -19.538 23.682 1.00 0.00 C ATOM 1998 CD ARG A 127 21.096 -20.045 24.543 1.00 0.00 C ATOM 1999 NE ARG A 127 20.947 -21.459 24.874 1.00 0.00 N ATOM 2000 CZ ARG A 127 21.116 -22.442 23.996 1.00 0.00 C ATOM 2001 NH1 ARG A 127 21.437 -22.165 22.740 1.00 0.00 N ATOM 2002 NH2 ARG A 127 20.963 -23.704 24.374 1.00 0.00 N ATOM 0 H ARG A 127 17.838 -17.334 22.908 1.00 0.00 H new ATOM 0 HA ARG A 127 19.611 -17.379 25.171 1.00 0.00 H new ATOM 0 HB2 ARG A 127 19.805 -17.987 22.215 1.00 0.00 H new ATOM 0 HB3 ARG A 127 21.255 -17.913 23.198 1.00 0.00 H new ATOM 0 HG2 ARG A 127 19.017 -19.597 24.244 1.00 0.00 H new ATOM 0 HG3 ARG A 127 19.836 -20.181 22.809 1.00 0.00 H new ATOM 0 HD2 ARG A 127 22.039 -19.893 24.017 1.00 0.00 H new ATOM 0 HD3 ARG A 127 21.146 -19.461 25.462 1.00 0.00 H new ATOM 0 HE ARG A 127 20.699 -21.706 25.832 1.00 0.00 H new ATOM 0 HH11 ARG A 127 21.555 -21.196 22.446 1.00 0.00 H new ATOM 0 HH12 ARG A 127 21.566 -22.921 22.068 1.00 0.00 H new ATOM 0 HH21 ARG A 127 20.715 -23.921 25.339 1.00 0.00 H new ATOM 0 HH22 ARG A 127 21.093 -24.458 23.699 1.00 0.00 H new ATOM 2016 N MET A 128 19.649 -14.857 23.131 1.00 0.00 N ATOM 2017 CA MET A 128 20.218 -13.536 22.889 1.00 0.00 C ATOM 2018 C MET A 128 19.572 -12.491 23.794 1.00 0.00 C ATOM 2019 O MET A 128 20.183 -11.473 24.117 1.00 0.00 O ATOM 2020 CB MET A 128 20.037 -13.140 21.423 1.00 0.00 C ATOM 2021 CG MET A 128 21.168 -13.609 20.522 1.00 0.00 C ATOM 2022 SD MET A 128 20.654 -14.903 19.377 1.00 0.00 S ATOM 2023 CE MET A 128 22.100 -15.960 19.389 1.00 0.00 C ATOM 0 H MET A 128 18.796 -15.052 22.607 1.00 0.00 H new ATOM 0 HA MET A 128 21.283 -13.580 23.117 1.00 0.00 H new ATOM 0 HB2 MET A 128 19.097 -13.553 21.057 1.00 0.00 H new ATOM 0 HB3 MET A 128 19.956 -12.055 21.356 1.00 0.00 H new ATOM 0 HG2 MET A 128 21.552 -12.760 19.956 1.00 0.00 H new ATOM 0 HG3 MET A 128 21.988 -13.979 21.138 1.00 0.00 H new ATOM 0 HE1 MET A 128 21.936 -16.809 18.725 1.00 0.00 H new ATOM 0 HE2 MET A 128 22.967 -15.395 19.047 1.00 0.00 H new ATOM 0 HE3 MET A 128 22.279 -16.321 20.402 1.00 0.00 H new ATOM 2033 N ARG A 129 18.333 -12.751 24.199 1.00 0.00 N ATOM 2034 CA ARG A 129 17.604 -11.832 25.064 1.00 0.00 C ATOM 2035 C ARG A 129 17.923 -12.099 26.532 1.00 0.00 C ATOM 2036 O ARG A 129 17.823 -11.205 27.372 1.00 0.00 O ATOM 2037 CB ARG A 129 16.098 -11.961 24.828 1.00 0.00 C ATOM 2038 CG ARG A 129 15.421 -10.646 24.478 1.00 0.00 C ATOM 2039 CD ARG A 129 14.048 -10.538 25.122 1.00 0.00 C ATOM 2040 NE ARG A 129 14.123 -10.034 26.491 1.00 0.00 N ATOM 2041 CZ ARG A 129 14.358 -8.762 26.794 1.00 0.00 C ATOM 2042 NH1 ARG A 129 14.540 -7.870 25.830 1.00 0.00 N ATOM 2043 NH2 ARG A 129 14.411 -8.381 28.064 1.00 0.00 N ATOM 0 H ARG A 129 17.814 -13.590 23.942 1.00 0.00 H new ATOM 0 HA ARG A 129 17.918 -10.817 24.820 1.00 0.00 H new ATOM 0 HB2 ARG A 129 15.925 -12.675 24.022 1.00 0.00 H new ATOM 0 HB3 ARG A 129 15.632 -12.372 25.724 1.00 0.00 H new ATOM 0 HG2 ARG A 129 16.045 -9.815 24.807 1.00 0.00 H new ATOM 0 HG3 ARG A 129 15.324 -10.562 23.396 1.00 0.00 H new ATOM 0 HD2 ARG A 129 13.419 -9.876 24.526 1.00 0.00 H new ATOM 0 HD3 ARG A 129 13.570 -11.517 25.122 1.00 0.00 H new ATOM 0 HE ARG A 129 13.988 -10.695 27.256 1.00 0.00 H new ATOM 0 HH11 ARG A 129 14.500 -8.160 24.853 1.00 0.00 H new ATOM 0 HH12 ARG A 129 14.720 -6.894 26.066 1.00 0.00 H new ATOM 0 HH21 ARG A 129 14.271 -9.065 28.808 1.00 0.00 H new ATOM 0 HH22 ARG A 129 14.591 -7.404 28.296 1.00 0.00 H new ATOM 2057 N SER A 130 18.308 -13.335 26.834 1.00 0.00 N ATOM 2058 CA SER A 130 18.638 -13.721 28.201 1.00 0.00 C ATOM 2059 C SER A 130 20.142 -13.640 28.440 1.00 0.00 C ATOM 2060 O SER A 130 20.694 -14.384 29.252 1.00 0.00 O ATOM 2061 CB SER A 130 18.140 -15.139 28.487 1.00 0.00 C ATOM 2062 OG SER A 130 16.757 -15.261 28.205 1.00 0.00 O ATOM 0 H SER A 130 18.399 -14.086 26.150 1.00 0.00 H new ATOM 0 HA SER A 130 18.142 -13.026 28.879 1.00 0.00 H new ATOM 0 HB2 SER A 130 18.701 -15.853 27.885 1.00 0.00 H new ATOM 0 HB3 SER A 130 18.325 -15.389 29.532 1.00 0.00 H new ATOM 0 HG SER A 130 16.636 -15.530 27.270 1.00 0.00 H new