USER MOD reduce.3.24.130724 H: found=0, std=0, add=640, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 635 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 49 ASN : amide:sc= 0.644 K(o=1.9,f=-6.2) USER MOD Set 1.2: A 52 LYS NZ :NH3+ 133:sc= 1.25 (180deg=0) USER MOD Set 2.1: A 19 SER OG : rot 72:sc= -1.3 USER MOD Set 2.2: A 41 GLN : amide:sc= -1.76 X(o=-3.1,f=-3!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 171:sc= 0 (180deg=-0.102) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot -105:sc= 0.761 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 160:sc= -0.0544 (180deg=-0.342) USER MOD Single : A 24 THR OG1 : rot 64:sc= 1.23 USER MOD Single : A 30 GLN : amide:sc= 0.439 K(o=0.44,f=-0.085) USER MOD Single : A 32 HIS : no HD1:sc= -0.456 X(o=-0.46,f=-0.044) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 46 SER OG : rot 180:sc= -0.0703 USER MOD Single : A 50 GLN : amide:sc= -2.76 K(o=-2.8,f=-9!) USER MOD Single : A 51 HIS : no HD1:sc= -4.51! C(o=-4.5!,f=-4.2!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= -1.97 K(o=-2,f=-1.4) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 ASN : amide:sc= -2.16 K(o=-2.2,f=-2.8!) USER MOD Single : A 64 LYS NZ :NH3+ 149:sc= -0.102 (180deg=-0.696) USER MOD Single : A 65 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0112) USER MOD Single : A 67 HIS : no HD1:sc= -0.175 X(o=-0.18,f=-0.03) USER MOD Single : A 68 SER OG : rot 45:sc= 0.00861 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.101) USER MOD Single : A 73 THR OG1 : rot 17:sc= 0.442! USER MOD Single : A 75 SER OG : rot 29:sc= 0.0609 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.219 -0.659 -3.081 1.00 0.00 N ATOM 2 CA MET A 1 1.599 -0.434 -2.670 1.00 0.00 C ATOM 3 C MET A 1 2.352 -1.756 -2.548 1.00 0.00 C ATOM 4 O MET A 1 3.137 -1.950 -1.621 1.00 0.00 O ATOM 5 CB MET A 1 1.641 0.314 -1.336 1.00 0.00 C ATOM 6 CG MET A 1 2.921 1.106 -1.124 1.00 0.00 C ATOM 7 SD MET A 1 3.346 1.285 0.619 1.00 0.00 S ATOM 8 CE MET A 1 4.088 2.915 0.622 1.00 0.00 C ATOM 0 H1 MET A 1 -0.314 0.231 -3.011 1.00 0.00 H new ATOM 0 H2 MET A 1 0.200 -0.997 -4.064 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.216 -1.372 -2.462 1.00 0.00 H new ATOM 0 HA MET A 1 2.085 0.173 -3.434 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.790 0.993 -1.283 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.528 -0.403 -0.523 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.741 0.611 -1.645 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.810 2.094 -1.570 1.00 0.00 H new ATOM 0 HE1 MET A 1 4.403 3.169 1.634 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.954 2.922 -0.040 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.359 3.647 0.274 1.00 0.00 H new ATOM 18 N ALA A 2 2.107 -2.660 -3.491 1.00 0.00 N ATOM 19 CA ALA A 2 2.764 -3.961 -3.490 1.00 0.00 C ATOM 20 C ALA A 2 2.504 -4.706 -2.185 1.00 0.00 C ATOM 21 O ALA A 2 3.439 -5.131 -1.505 1.00 0.00 O ATOM 22 CB ALA A 2 4.259 -3.799 -3.719 1.00 0.00 C ATOM 0 H ALA A 2 1.459 -2.515 -4.265 1.00 0.00 H new ATOM 0 HA ALA A 2 2.346 -4.552 -4.305 1.00 0.00 H new ATOM 0 HB1 ALA A 2 4.736 -4.779 -3.716 1.00 0.00 H new ATOM 0 HB2 ALA A 2 4.429 -3.316 -4.681 1.00 0.00 H new ATOM 0 HB3 ALA A 2 4.684 -3.186 -2.925 1.00 0.00 H new ATOM 28 N ILE A 3 1.230 -4.859 -1.839 1.00 0.00 N ATOM 29 CA ILE A 3 0.849 -5.553 -0.615 1.00 0.00 C ATOM 30 C ILE A 3 0.283 -6.935 -0.920 1.00 0.00 C ATOM 31 O ILE A 3 -0.288 -7.162 -1.987 1.00 0.00 O ATOM 32 CB ILE A 3 -0.192 -4.749 0.186 1.00 0.00 C ATOM 33 CG1 ILE A 3 -0.389 -5.367 1.572 1.00 0.00 C ATOM 34 CG2 ILE A 3 -1.512 -4.693 -0.567 1.00 0.00 C ATOM 35 CD1 ILE A 3 -0.684 -4.349 2.651 1.00 0.00 C ATOM 0 H ILE A 3 0.444 -4.512 -2.389 1.00 0.00 H new ATOM 0 HA ILE A 3 1.754 -5.658 -0.017 1.00 0.00 H new ATOM 0 HB ILE A 3 0.175 -3.731 0.312 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.208 -6.085 1.528 1.00 0.00 H new ATOM 0 HG13 ILE A 3 0.508 -5.923 1.844 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -2.237 -4.121 0.012 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -1.360 -4.212 -1.533 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.887 -5.705 -0.720 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.812 -4.858 3.606 1.00 0.00 H new ATOM 0 HD12 ILE A 3 0.145 -3.645 2.723 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -1.598 -3.809 2.402 1.00 0.00 H new ATOM 47 N SER A 4 0.443 -7.856 0.025 1.00 0.00 N ATOM 48 CA SER A 4 -0.050 -9.218 -0.143 1.00 0.00 C ATOM 49 C SER A 4 -1.523 -9.216 -0.543 1.00 0.00 C ATOM 50 O SER A 4 -2.312 -8.414 -0.044 1.00 0.00 O ATOM 51 CB SER A 4 0.139 -10.015 1.149 1.00 0.00 C ATOM 52 OG SER A 4 1.502 -10.343 1.351 1.00 0.00 O ATOM 0 H SER A 4 0.910 -7.684 0.915 1.00 0.00 H new ATOM 0 HA SER A 4 0.525 -9.691 -0.939 1.00 0.00 H new ATOM 0 HB2 SER A 4 -0.228 -9.434 1.995 1.00 0.00 H new ATOM 0 HB3 SER A 4 -0.456 -10.928 1.107 1.00 0.00 H new ATOM 0 HG SER A 4 1.596 -10.851 2.184 1.00 0.00 H new ATOM 58 N ALA A 5 -1.886 -10.122 -1.446 1.00 0.00 N ATOM 59 CA ALA A 5 -3.263 -10.227 -1.911 1.00 0.00 C ATOM 60 C ALA A 5 -4.212 -10.521 -0.755 1.00 0.00 C ATOM 61 O ALA A 5 -5.402 -10.214 -0.824 1.00 0.00 O ATOM 62 CB ALA A 5 -3.378 -11.305 -2.978 1.00 0.00 C ATOM 0 H ALA A 5 -1.245 -10.793 -1.869 1.00 0.00 H new ATOM 0 HA ALA A 5 -3.548 -9.269 -2.345 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -4.412 -11.373 -3.317 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -2.736 -11.052 -3.822 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -3.069 -12.264 -2.561 1.00 0.00 H new ATOM 68 N GLU A 6 -3.678 -11.117 0.307 1.00 0.00 N ATOM 69 CA GLU A 6 -4.480 -11.453 1.477 1.00 0.00 C ATOM 70 C GLU A 6 -4.973 -10.191 2.180 1.00 0.00 C ATOM 71 O GLU A 6 -5.984 -10.214 2.882 1.00 0.00 O ATOM 72 CB GLU A 6 -3.667 -12.307 2.452 1.00 0.00 C ATOM 73 CG GLU A 6 -2.531 -11.552 3.122 1.00 0.00 C ATOM 74 CD GLU A 6 -1.518 -12.476 3.770 1.00 0.00 C ATOM 75 OE1 GLU A 6 -1.867 -13.121 4.781 1.00 0.00 O ATOM 76 OE2 GLU A 6 -0.378 -12.554 3.267 1.00 0.00 O ATOM 0 H GLU A 6 -2.694 -11.377 0.381 1.00 0.00 H new ATOM 0 HA GLU A 6 -5.346 -12.023 1.140 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -4.333 -12.700 3.220 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -3.257 -13.163 1.917 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -2.028 -10.929 2.382 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -2.941 -10.882 3.877 1.00 0.00 H new ATOM 83 N GLU A 7 -4.252 -9.092 1.984 1.00 0.00 N ATOM 84 CA GLU A 7 -4.616 -7.821 2.600 1.00 0.00 C ATOM 85 C GLU A 7 -5.611 -7.060 1.729 1.00 0.00 C ATOM 86 O GLU A 7 -6.408 -6.263 2.228 1.00 0.00 O ATOM 87 CB GLU A 7 -3.368 -6.966 2.833 1.00 0.00 C ATOM 88 CG GLU A 7 -3.524 -5.956 3.957 1.00 0.00 C ATOM 89 CD GLU A 7 -3.060 -6.496 5.296 1.00 0.00 C ATOM 90 OE1 GLU A 7 -3.041 -7.734 5.461 1.00 0.00 O ATOM 91 OE2 GLU A 7 -2.716 -5.682 6.178 1.00 0.00 O ATOM 0 H GLU A 7 -3.413 -9.056 1.404 1.00 0.00 H new ATOM 0 HA GLU A 7 -5.087 -8.033 3.560 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -2.526 -7.621 3.058 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -3.123 -6.437 1.912 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -2.955 -5.058 3.715 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -4.570 -5.660 4.032 1.00 0.00 H new ATOM 98 N LEU A 8 -5.560 -7.310 0.426 1.00 0.00 N ATOM 99 CA LEU A 8 -6.457 -6.649 -0.516 1.00 0.00 C ATOM 100 C LEU A 8 -7.910 -6.794 -0.077 1.00 0.00 C ATOM 101 O LEU A 8 -8.739 -5.925 -0.347 1.00 0.00 O ATOM 102 CB LEU A 8 -6.275 -7.231 -1.919 1.00 0.00 C ATOM 103 CG LEU A 8 -7.382 -6.917 -2.925 1.00 0.00 C ATOM 104 CD1 LEU A 8 -7.511 -5.415 -3.125 1.00 0.00 C ATOM 105 CD2 LEU A 8 -7.112 -7.612 -4.251 1.00 0.00 C ATOM 0 H LEU A 8 -4.907 -7.966 -0.003 1.00 0.00 H new ATOM 0 HA LEU A 8 -6.207 -5.588 -0.535 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -5.331 -6.865 -2.322 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.187 -8.314 -1.833 1.00 0.00 H new ATOM 0 HG LEU A 8 -8.325 -7.292 -2.527 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -8.304 -5.211 -3.844 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -7.753 -4.941 -2.174 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -6.569 -5.016 -3.500 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -7.911 -7.377 -4.954 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.160 -7.268 -4.655 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -7.072 -8.690 -4.095 1.00 0.00 H new ATOM 117 N GLU A 9 -8.211 -7.896 0.602 1.00 0.00 N ATOM 118 CA GLU A 9 -9.565 -8.153 1.079 1.00 0.00 C ATOM 119 C GLU A 9 -9.852 -7.364 2.353 1.00 0.00 C ATOM 120 O GLU A 9 -10.981 -6.933 2.589 1.00 0.00 O ATOM 121 CB GLU A 9 -9.763 -9.648 1.337 1.00 0.00 C ATOM 122 CG GLU A 9 -9.025 -10.158 2.563 1.00 0.00 C ATOM 123 CD GLU A 9 -8.521 -11.578 2.393 1.00 0.00 C ATOM 124 OE1 GLU A 9 -7.975 -11.889 1.315 1.00 0.00 O ATOM 125 OE2 GLU A 9 -8.673 -12.378 3.340 1.00 0.00 O ATOM 0 H GLU A 9 -7.536 -8.625 0.834 1.00 0.00 H new ATOM 0 HA GLU A 9 -10.262 -7.829 0.307 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.828 -9.850 1.454 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -9.427 -10.206 0.463 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -8.182 -9.500 2.774 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.689 -10.113 3.427 1.00 0.00 H new ATOM 132 N LYS A 10 -8.822 -7.178 3.171 1.00 0.00 N ATOM 133 CA LYS A 10 -8.961 -6.440 4.421 1.00 0.00 C ATOM 134 C LYS A 10 -9.579 -5.067 4.177 1.00 0.00 C ATOM 135 O LYS A 10 -10.245 -4.512 5.050 1.00 0.00 O ATOM 136 CB LYS A 10 -7.598 -6.284 5.099 1.00 0.00 C ATOM 137 CG LYS A 10 -6.896 -7.605 5.364 1.00 0.00 C ATOM 138 CD LYS A 10 -7.304 -8.195 6.704 1.00 0.00 C ATOM 139 CE LYS A 10 -6.549 -7.544 7.853 1.00 0.00 C ATOM 140 NZ LYS A 10 -5.231 -8.195 8.090 1.00 0.00 N ATOM 0 H LYS A 10 -7.881 -7.528 2.991 1.00 0.00 H new ATOM 0 HA LYS A 10 -9.624 -7.006 5.076 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -6.959 -5.662 4.472 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -7.730 -5.756 6.044 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -7.133 -8.310 4.568 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -5.817 -7.455 5.345 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -8.376 -8.062 6.850 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -7.113 -9.268 6.703 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -6.398 -6.487 7.635 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -7.150 -7.600 8.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -4.748 -7.723 8.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -5.376 -9.198 8.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -4.647 -8.119 7.233 1.00 0.00 H new ATOM 154 N ILE A 11 -9.354 -4.526 2.984 1.00 0.00 N ATOM 155 CA ILE A 11 -9.891 -3.220 2.625 1.00 0.00 C ATOM 156 C ILE A 11 -11.340 -3.329 2.162 1.00 0.00 C ATOM 157 O ILE A 11 -12.149 -2.431 2.399 1.00 0.00 O ATOM 158 CB ILE A 11 -9.057 -2.554 1.514 1.00 0.00 C ATOM 159 CG1 ILE A 11 -7.603 -2.395 1.963 1.00 0.00 C ATOM 160 CG2 ILE A 11 -9.653 -1.205 1.141 1.00 0.00 C ATOM 161 CD1 ILE A 11 -6.690 -3.486 1.451 1.00 0.00 C ATOM 0 H ILE A 11 -8.804 -4.972 2.250 1.00 0.00 H new ATOM 0 HA ILE A 11 -9.845 -2.603 3.522 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.077 -3.194 0.632 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.229 -1.430 1.622 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.567 -2.384 3.052 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -9.053 -0.747 0.355 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.673 -1.344 0.784 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -9.661 -0.556 2.017 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -5.676 -3.309 1.808 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -7.039 -4.453 1.814 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -6.696 -3.484 0.361 1.00 0.00 H new ATOM 173 N LEU A 12 -11.661 -4.436 1.501 1.00 0.00 N ATOM 174 CA LEU A 12 -13.014 -4.665 1.005 1.00 0.00 C ATOM 175 C LEU A 12 -13.919 -5.190 2.115 1.00 0.00 C ATOM 176 O LEU A 12 -15.142 -5.206 1.979 1.00 0.00 O ATOM 177 CB LEU A 12 -12.990 -5.655 -0.160 1.00 0.00 C ATOM 178 CG LEU A 12 -12.599 -5.080 -1.522 1.00 0.00 C ATOM 179 CD1 LEU A 12 -12.459 -6.191 -2.551 1.00 0.00 C ATOM 180 CD2 LEU A 12 -13.623 -4.052 -1.981 1.00 0.00 C ATOM 0 H LEU A 12 -11.004 -5.188 1.296 1.00 0.00 H new ATOM 0 HA LEU A 12 -13.413 -3.713 0.656 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -12.295 -6.458 0.086 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -13.979 -6.105 -0.248 1.00 0.00 H new ATOM 0 HG LEU A 12 -11.634 -4.583 -1.421 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -12.180 -5.762 -3.514 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -11.688 -6.891 -2.228 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -13.408 -6.718 -2.649 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -13.328 -3.653 -2.952 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -14.601 -4.525 -2.065 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -13.674 -3.240 -1.256 1.00 0.00 H new ATOM 192 N LYS A 13 -13.309 -5.618 3.216 1.00 0.00 N ATOM 193 CA LYS A 13 -14.059 -6.140 4.352 1.00 0.00 C ATOM 194 C LYS A 13 -14.717 -5.010 5.137 1.00 0.00 C ATOM 195 O LYS A 13 -15.708 -5.220 5.835 1.00 0.00 O ATOM 196 CB LYS A 13 -13.136 -6.944 5.272 1.00 0.00 C ATOM 197 CG LYS A 13 -12.776 -8.314 4.725 1.00 0.00 C ATOM 198 CD LYS A 13 -12.766 -9.367 5.821 1.00 0.00 C ATOM 199 CE LYS A 13 -14.165 -9.623 6.361 1.00 0.00 C ATOM 200 NZ LYS A 13 -14.212 -10.833 7.227 1.00 0.00 N ATOM 0 H LYS A 13 -12.297 -5.613 3.345 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.841 -6.795 3.968 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -12.220 -6.377 5.440 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -13.619 -7.065 6.242 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -13.491 -8.598 3.953 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -11.795 -8.271 4.251 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -12.350 -10.296 5.431 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -12.115 -9.042 6.633 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -14.499 -8.756 6.930 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -14.859 -9.745 5.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -15.182 -10.973 7.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -13.918 -11.665 6.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -13.569 -10.707 8.035 1.00 0.00 H new ATOM 214 N LYS A 14 -14.159 -3.809 5.016 1.00 0.00 N ATOM 215 CA LYS A 14 -14.693 -2.644 5.711 1.00 0.00 C ATOM 216 C LYS A 14 -16.188 -2.491 5.449 1.00 0.00 C ATOM 217 O LYS A 14 -16.988 -2.426 6.382 1.00 0.00 O ATOM 218 CB LYS A 14 -13.954 -1.379 5.269 1.00 0.00 C ATOM 219 CG LYS A 14 -12.586 -1.218 5.909 1.00 0.00 C ATOM 220 CD LYS A 14 -12.687 -1.111 7.421 1.00 0.00 C ATOM 221 CE LYS A 14 -11.434 -0.492 8.021 1.00 0.00 C ATOM 222 NZ LYS A 14 -11.679 0.041 9.389 1.00 0.00 N ATOM 0 H LYS A 14 -13.337 -3.618 4.443 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.544 -2.790 6.781 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -13.839 -1.396 4.185 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -14.564 -0.509 5.511 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -11.957 -2.068 5.645 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -12.100 -0.327 5.512 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -13.555 -0.508 7.687 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -12.845 -2.102 7.847 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -10.642 -1.240 8.059 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -11.082 0.313 7.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -10.801 0.454 9.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -12.417 0.773 9.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -11.991 -0.731 10.012 1.00 0.00 H new ATOM 236 N SER A 15 -16.557 -2.436 4.173 1.00 0.00 N ATOM 237 CA SER A 15 -17.956 -2.288 3.788 1.00 0.00 C ATOM 238 C SER A 15 -18.531 -3.618 3.309 1.00 0.00 C ATOM 239 O SER A 15 -19.725 -3.879 3.452 1.00 0.00 O ATOM 240 CB SER A 15 -18.096 -1.233 2.690 1.00 0.00 C ATOM 241 OG SER A 15 -19.446 -1.099 2.280 1.00 0.00 O ATOM 0 H SER A 15 -15.907 -2.492 3.389 1.00 0.00 H new ATOM 0 HA SER A 15 -18.517 -1.965 4.665 1.00 0.00 H new ATOM 0 HB2 SER A 15 -17.726 -0.274 3.053 1.00 0.00 H new ATOM 0 HB3 SER A 15 -17.479 -1.509 1.835 1.00 0.00 H new ATOM 0 HG SER A 15 -19.568 -1.533 1.410 1.00 0.00 H new ATOM 247 N PHE A 16 -17.671 -4.455 2.738 1.00 0.00 N ATOM 248 CA PHE A 16 -18.092 -5.758 2.236 1.00 0.00 C ATOM 249 C PHE A 16 -17.410 -6.884 3.006 1.00 0.00 C ATOM 250 O PHE A 16 -16.541 -7.588 2.489 1.00 0.00 O ATOM 251 CB PHE A 16 -17.773 -5.880 0.744 1.00 0.00 C ATOM 252 CG PHE A 16 -17.999 -4.608 -0.023 1.00 0.00 C ATOM 253 CD1 PHE A 16 -19.160 -3.874 0.153 1.00 0.00 C ATOM 254 CD2 PHE A 16 -17.049 -4.147 -0.920 1.00 0.00 C ATOM 255 CE1 PHE A 16 -19.370 -2.704 -0.552 1.00 0.00 C ATOM 256 CE2 PHE A 16 -17.253 -2.977 -1.627 1.00 0.00 C ATOM 257 CZ PHE A 16 -18.415 -2.254 -1.442 1.00 0.00 C ATOM 0 H PHE A 16 -16.679 -4.254 2.611 1.00 0.00 H new ATOM 0 HA PHE A 16 -19.169 -5.844 2.379 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -16.733 -6.186 0.627 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -18.388 -6.669 0.312 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -19.910 -4.220 0.849 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -16.138 -4.708 -1.069 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -20.281 -2.142 -0.407 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -16.505 -2.629 -2.323 1.00 0.00 H new ATOM 0 HZ PHE A 16 -18.576 -1.339 -1.992 1.00 0.00 H new ATOM 267 N PRO A 17 -17.811 -7.060 4.274 1.00 0.00 N ATOM 268 CA PRO A 17 -17.252 -8.099 5.144 1.00 0.00 C ATOM 269 C PRO A 17 -17.669 -9.502 4.714 1.00 0.00 C ATOM 270 O PRO A 17 -16.832 -10.392 4.569 1.00 0.00 O ATOM 271 CB PRO A 17 -17.838 -7.765 6.518 1.00 0.00 C ATOM 272 CG PRO A 17 -19.098 -7.027 6.223 1.00 0.00 C ATOM 273 CD PRO A 17 -18.841 -6.259 4.956 1.00 0.00 C ATOM 0 HA PRO A 17 -16.162 -8.107 5.121 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -18.034 -8.669 7.095 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -17.150 -7.156 7.104 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -19.934 -7.716 6.099 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -19.357 -6.355 7.041 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -19.744 -6.167 4.352 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -18.492 -5.248 5.163 1.00 0.00 H new ATOM 281 N SER A 18 -18.969 -9.691 4.511 1.00 0.00 N ATOM 282 CA SER A 18 -19.498 -10.987 4.101 1.00 0.00 C ATOM 283 C SER A 18 -19.056 -11.329 2.681 1.00 0.00 C ATOM 284 O SER A 18 -18.974 -12.500 2.310 1.00 0.00 O ATOM 285 CB SER A 18 -21.025 -10.988 4.186 1.00 0.00 C ATOM 286 OG SER A 18 -21.470 -10.361 5.376 1.00 0.00 O ATOM 0 H SER A 18 -19.675 -8.964 4.624 1.00 0.00 H new ATOM 0 HA SER A 18 -19.103 -11.744 4.778 1.00 0.00 H new ATOM 0 HB2 SER A 18 -21.441 -10.471 3.321 1.00 0.00 H new ATOM 0 HB3 SER A 18 -21.394 -12.013 4.152 1.00 0.00 H new ATOM 0 HG SER A 18 -22.449 -10.373 5.406 1.00 0.00 H new ATOM 292 N SER A 19 -18.773 -10.298 1.892 1.00 0.00 N ATOM 293 CA SER A 19 -18.343 -10.488 0.511 1.00 0.00 C ATOM 294 C SER A 19 -17.171 -11.462 0.436 1.00 0.00 C ATOM 295 O SER A 19 -16.382 -11.576 1.374 1.00 0.00 O ATOM 296 CB SER A 19 -17.946 -9.147 -0.111 1.00 0.00 C ATOM 297 OG SER A 19 -19.037 -8.563 -0.802 1.00 0.00 O ATOM 0 H SER A 19 -18.834 -9.323 2.185 1.00 0.00 H new ATOM 0 HA SER A 19 -19.179 -10.908 -0.049 1.00 0.00 H new ATOM 0 HB2 SER A 19 -17.600 -8.469 0.669 1.00 0.00 H new ATOM 0 HB3 SER A 19 -17.113 -9.294 -0.798 1.00 0.00 H new ATOM 0 HG SER A 19 -19.695 -8.233 -0.155 1.00 0.00 H new ATOM 303 N VAL A 20 -17.065 -12.165 -0.687 1.00 0.00 N ATOM 304 CA VAL A 20 -15.990 -13.130 -0.887 1.00 0.00 C ATOM 305 C VAL A 20 -14.884 -12.547 -1.760 1.00 0.00 C ATOM 306 O VAL A 20 -14.960 -12.593 -2.988 1.00 0.00 O ATOM 307 CB VAL A 20 -16.513 -14.425 -1.536 1.00 0.00 C ATOM 308 CG1 VAL A 20 -15.372 -15.404 -1.768 1.00 0.00 C ATOM 309 CG2 VAL A 20 -17.597 -15.053 -0.673 1.00 0.00 C ATOM 0 H VAL A 20 -17.711 -12.084 -1.473 1.00 0.00 H new ATOM 0 HA VAL A 20 -15.586 -13.364 0.098 1.00 0.00 H new ATOM 0 HB VAL A 20 -16.949 -14.176 -2.503 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -15.760 -16.313 -2.227 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -14.633 -14.951 -2.429 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -14.904 -15.650 -0.815 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -17.955 -15.967 -1.147 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -17.188 -15.289 0.309 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -18.425 -14.353 -0.563 1.00 0.00 H new ATOM 319 N ILE A 21 -13.858 -12.000 -1.118 1.00 0.00 N ATOM 320 CA ILE A 21 -12.735 -11.410 -1.836 1.00 0.00 C ATOM 321 C ILE A 21 -11.720 -12.475 -2.240 1.00 0.00 C ATOM 322 O ILE A 21 -11.054 -13.067 -1.391 1.00 0.00 O ATOM 323 CB ILE A 21 -12.027 -10.336 -0.990 1.00 0.00 C ATOM 324 CG1 ILE A 21 -13.050 -9.359 -0.407 1.00 0.00 C ATOM 325 CG2 ILE A 21 -10.996 -9.595 -1.828 1.00 0.00 C ATOM 326 CD1 ILE A 21 -13.481 -9.705 1.001 1.00 0.00 C ATOM 0 H ILE A 21 -13.781 -11.953 -0.102 1.00 0.00 H new ATOM 0 HA ILE A 21 -13.144 -10.943 -2.732 1.00 0.00 H new ATOM 0 HB ILE A 21 -11.510 -10.827 -0.165 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -12.626 -8.355 -0.412 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -13.928 -9.337 -1.052 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -10.504 -8.839 -1.215 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -10.253 -10.301 -2.199 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -11.491 -9.113 -2.671 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -14.206 -8.970 1.350 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -13.935 -10.696 1.009 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -12.612 -9.699 1.659 1.00 0.00 H new ATOM 338 N LYS A 22 -11.606 -12.712 -3.542 1.00 0.00 N ATOM 339 CA LYS A 22 -10.670 -13.703 -4.061 1.00 0.00 C ATOM 340 C LYS A 22 -9.884 -13.143 -5.242 1.00 0.00 C ATOM 341 O LYS A 22 -10.447 -12.486 -6.118 1.00 0.00 O ATOM 342 CB LYS A 22 -11.419 -14.968 -4.486 1.00 0.00 C ATOM 343 CG LYS A 22 -10.554 -16.217 -4.480 1.00 0.00 C ATOM 344 CD LYS A 22 -10.471 -16.831 -3.093 1.00 0.00 C ATOM 345 CE LYS A 22 -11.721 -17.631 -2.762 1.00 0.00 C ATOM 346 NZ LYS A 22 -11.840 -18.850 -3.609 1.00 0.00 N ATOM 0 H LYS A 22 -12.150 -12.231 -4.258 1.00 0.00 H new ATOM 0 HA LYS A 22 -9.967 -13.954 -3.266 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -12.267 -15.120 -3.818 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -11.824 -14.821 -5.487 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -10.963 -16.947 -5.178 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -9.552 -15.968 -4.829 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -9.597 -17.479 -3.033 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -10.336 -16.043 -2.352 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -11.700 -17.920 -1.711 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -12.601 -17.004 -2.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -12.482 -19.529 -3.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -12.219 -18.589 -4.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -10.902 -19.285 -3.726 1.00 0.00 H new ATOM 360 N ILE A 23 -8.582 -13.408 -5.260 1.00 0.00 N ATOM 361 CA ILE A 23 -7.721 -12.932 -6.335 1.00 0.00 C ATOM 362 C ILE A 23 -7.559 -13.993 -7.419 1.00 0.00 C ATOM 363 O ILE A 23 -7.480 -15.187 -7.129 1.00 0.00 O ATOM 364 CB ILE A 23 -6.329 -12.536 -5.808 1.00 0.00 C ATOM 365 CG1 ILE A 23 -6.455 -11.448 -4.740 1.00 0.00 C ATOM 366 CG2 ILE A 23 -5.445 -12.063 -6.952 1.00 0.00 C ATOM 367 CD1 ILE A 23 -6.605 -11.992 -3.337 1.00 0.00 C ATOM 0 H ILE A 23 -8.101 -13.950 -4.542 1.00 0.00 H new ATOM 0 HA ILE A 23 -8.203 -12.052 -6.760 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.865 -13.412 -5.354 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -5.574 -10.807 -4.780 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.316 -10.821 -4.972 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -4.465 -11.787 -6.564 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -5.334 -12.865 -7.681 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -5.903 -11.198 -7.432 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -6.689 -11.164 -2.633 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.502 -12.609 -3.280 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.733 -12.595 -3.085 1.00 0.00 H new ATOM 379 N THR A 24 -7.508 -13.549 -8.671 1.00 0.00 N ATOM 380 CA THR A 24 -7.354 -14.458 -9.799 1.00 0.00 C ATOM 381 C THR A 24 -6.315 -13.940 -10.786 1.00 0.00 C ATOM 382 O THR A 24 -6.196 -12.733 -11.000 1.00 0.00 O ATOM 383 CB THR A 24 -8.689 -14.667 -10.539 1.00 0.00 C ATOM 384 OG1 THR A 24 -9.659 -15.233 -9.650 1.00 0.00 O ATOM 385 CG2 THR A 24 -8.504 -15.578 -11.743 1.00 0.00 C ATOM 0 H THR A 24 -7.571 -12.564 -8.929 1.00 0.00 H new ATOM 0 HA THR A 24 -7.019 -15.412 -9.392 1.00 0.00 H new ATOM 0 HB THR A 24 -9.041 -13.696 -10.889 1.00 0.00 H new ATOM 0 HG1 THR A 24 -9.853 -14.597 -8.930 1.00 0.00 H new ATOM 0 HG21 THR A 24 -9.460 -15.711 -12.249 1.00 0.00 H new ATOM 0 HG22 THR A 24 -7.788 -15.130 -12.432 1.00 0.00 H new ATOM 0 HG23 THR A 24 -8.131 -16.547 -11.412 1.00 0.00 H new ATOM 393 N ASP A 25 -5.565 -14.858 -11.386 1.00 0.00 N ATOM 394 CA ASP A 25 -4.536 -14.493 -12.353 1.00 0.00 C ATOM 395 C ASP A 25 -5.089 -14.530 -13.774 1.00 0.00 C ATOM 396 O ASP A 25 -5.328 -15.602 -14.331 1.00 0.00 O ATOM 397 CB ASP A 25 -3.337 -15.434 -12.234 1.00 0.00 C ATOM 398 CG ASP A 25 -2.058 -14.812 -12.757 1.00 0.00 C ATOM 399 OD1 ASP A 25 -2.025 -13.574 -12.924 1.00 0.00 O ATOM 400 OD2 ASP A 25 -1.089 -15.562 -12.999 1.00 0.00 O ATOM 0 H ASP A 25 -5.650 -15.861 -11.220 1.00 0.00 H new ATOM 0 HA ASP A 25 -4.212 -13.476 -12.135 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -3.201 -15.713 -11.189 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -3.543 -16.352 -12.785 1.00 0.00 H new ATOM 405 N LEU A 26 -5.291 -13.352 -14.356 1.00 0.00 N ATOM 406 CA LEU A 26 -5.817 -13.249 -15.713 1.00 0.00 C ATOM 407 C LEU A 26 -4.707 -12.909 -16.702 1.00 0.00 C ATOM 408 O LEU A 26 -4.941 -12.822 -17.908 1.00 0.00 O ATOM 409 CB LEU A 26 -6.915 -12.187 -15.776 1.00 0.00 C ATOM 410 CG LEU A 26 -6.680 -10.928 -14.940 1.00 0.00 C ATOM 411 CD1 LEU A 26 -5.447 -10.185 -15.430 1.00 0.00 C ATOM 412 CD2 LEU A 26 -7.903 -10.023 -14.984 1.00 0.00 C ATOM 0 H LEU A 26 -5.098 -12.455 -13.909 1.00 0.00 H new ATOM 0 HA LEU A 26 -6.239 -14.216 -15.987 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -7.045 -11.889 -16.816 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.852 -12.642 -15.455 1.00 0.00 H new ATOM 0 HG LEU A 26 -6.511 -11.228 -13.906 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -5.295 -9.292 -14.824 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -4.575 -10.833 -15.346 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -5.586 -9.897 -16.472 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -7.718 -9.132 -14.384 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -8.103 -9.731 -16.015 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -8.765 -10.557 -14.585 1.00 0.00 H new ATOM 424 N VAL A 27 -3.497 -12.720 -16.185 1.00 0.00 N ATOM 425 CA VAL A 27 -2.350 -12.393 -17.023 1.00 0.00 C ATOM 426 C VAL A 27 -1.116 -13.182 -16.598 1.00 0.00 C ATOM 427 O VAL A 27 -1.066 -13.730 -15.498 1.00 0.00 O ATOM 428 CB VAL A 27 -2.026 -10.888 -16.970 1.00 0.00 C ATOM 429 CG1 VAL A 27 -3.136 -10.080 -17.626 1.00 0.00 C ATOM 430 CG2 VAL A 27 -1.809 -10.441 -15.532 1.00 0.00 C ATOM 0 H VAL A 27 -3.286 -12.788 -15.189 1.00 0.00 H new ATOM 0 HA VAL A 27 -2.618 -12.664 -18.044 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.104 -10.712 -17.525 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.890 -9.019 -17.579 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.240 -10.383 -18.668 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -4.075 -10.258 -17.101 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.581 -9.375 -15.513 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.713 -10.629 -14.952 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.978 -10.998 -15.099 1.00 0.00 H new ATOM 440 N GLY A 28 -0.122 -13.235 -17.479 1.00 0.00 N ATOM 441 CA GLY A 28 1.099 -13.959 -17.177 1.00 0.00 C ATOM 442 C GLY A 28 2.104 -13.112 -16.422 1.00 0.00 C ATOM 443 O GLY A 28 3.192 -12.831 -16.926 1.00 0.00 O ATOM 0 H GLY A 28 -0.140 -12.790 -18.396 1.00 0.00 H new ATOM 0 HA2 GLY A 28 0.857 -14.843 -16.587 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.549 -14.310 -18.106 1.00 0.00 H new ATOM 447 N ASP A 29 1.739 -12.702 -15.213 1.00 0.00 N ATOM 448 CA ASP A 29 2.617 -11.881 -14.387 1.00 0.00 C ATOM 449 C ASP A 29 2.866 -10.525 -15.039 1.00 0.00 C ATOM 450 O ASP A 29 3.993 -10.204 -15.413 1.00 0.00 O ATOM 451 CB ASP A 29 3.947 -12.598 -14.149 1.00 0.00 C ATOM 452 CG ASP A 29 4.701 -12.039 -12.958 1.00 0.00 C ATOM 453 OD1 ASP A 29 4.404 -10.897 -12.551 1.00 0.00 O ATOM 454 OD2 ASP A 29 5.590 -12.744 -12.435 1.00 0.00 O ATOM 0 H ASP A 29 0.841 -12.924 -14.783 1.00 0.00 H new ATOM 0 HA ASP A 29 2.124 -11.718 -13.428 1.00 0.00 H new ATOM 0 HB2 ASP A 29 3.761 -13.660 -13.991 1.00 0.00 H new ATOM 0 HB3 ASP A 29 4.567 -12.512 -15.041 1.00 0.00 H new ATOM 459 N GLN A 30 1.805 -9.735 -15.174 1.00 0.00 N ATOM 460 CA GLN A 30 1.909 -8.414 -15.783 1.00 0.00 C ATOM 461 C GLN A 30 1.748 -7.317 -14.736 1.00 0.00 C ATOM 462 O GLN A 30 1.302 -6.212 -15.045 1.00 0.00 O ATOM 463 CB GLN A 30 0.854 -8.250 -16.878 1.00 0.00 C ATOM 464 CG GLN A 30 1.111 -7.069 -17.799 1.00 0.00 C ATOM 465 CD GLN A 30 -0.111 -6.189 -17.975 1.00 0.00 C ATOM 466 OE1 GLN A 30 -0.506 -5.872 -19.098 1.00 0.00 O ATOM 467 NE2 GLN A 30 -0.719 -5.790 -16.864 1.00 0.00 N ATOM 0 H GLN A 30 0.864 -9.987 -14.870 1.00 0.00 H new ATOM 0 HA GLN A 30 2.900 -8.323 -16.227 1.00 0.00 H new ATOM 0 HB2 GLN A 30 0.815 -9.162 -17.473 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -0.125 -8.131 -16.413 1.00 0.00 H new ATOM 0 HG2 GLN A 30 1.929 -6.471 -17.397 1.00 0.00 H new ATOM 0 HG3 GLN A 30 1.433 -7.436 -18.773 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -0.358 -6.076 -15.954 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -1.547 -5.197 -16.921 1.00 0.00 H new ATOM 476 N ASP A 31 2.113 -7.630 -13.498 1.00 0.00 N ATOM 477 CA ASP A 31 2.009 -6.670 -12.405 1.00 0.00 C ATOM 478 C ASP A 31 0.561 -6.240 -12.195 1.00 0.00 C ATOM 479 O ASP A 31 0.293 -5.161 -11.665 1.00 0.00 O ATOM 480 CB ASP A 31 2.882 -5.447 -12.688 1.00 0.00 C ATOM 481 CG ASP A 31 4.218 -5.818 -13.301 1.00 0.00 C ATOM 482 OD1 ASP A 31 4.897 -6.709 -12.749 1.00 0.00 O ATOM 483 OD2 ASP A 31 4.584 -5.218 -14.333 1.00 0.00 O ATOM 0 H ASP A 31 2.483 -8.541 -13.226 1.00 0.00 H new ATOM 0 HA ASP A 31 2.360 -7.154 -11.494 1.00 0.00 H new ATOM 0 HB2 ASP A 31 2.351 -4.774 -13.361 1.00 0.00 H new ATOM 0 HB3 ASP A 31 3.051 -4.902 -11.759 1.00 0.00 H new ATOM 488 N HIS A 32 -0.371 -7.090 -12.616 1.00 0.00 N ATOM 489 CA HIS A 32 -1.793 -6.797 -12.475 1.00 0.00 C ATOM 490 C HIS A 32 -2.464 -7.800 -11.542 1.00 0.00 C ATOM 491 O HIS A 32 -1.846 -8.775 -11.114 1.00 0.00 O ATOM 492 CB HIS A 32 -2.477 -6.816 -13.842 1.00 0.00 C ATOM 493 CG HIS A 32 -3.452 -5.696 -14.040 1.00 0.00 C ATOM 494 ND1 HIS A 32 -4.817 -5.885 -14.077 1.00 0.00 N ATOM 495 CD2 HIS A 32 -3.252 -4.369 -14.210 1.00 0.00 C ATOM 496 CE1 HIS A 32 -5.415 -4.722 -14.263 1.00 0.00 C ATOM 497 NE2 HIS A 32 -4.488 -3.785 -14.347 1.00 0.00 N ATOM 0 H HIS A 32 -0.167 -7.987 -13.057 1.00 0.00 H new ATOM 0 HA HIS A 32 -1.893 -5.802 -12.042 1.00 0.00 H new ATOM 0 HB2 HIS A 32 -1.716 -6.766 -14.621 1.00 0.00 H new ATOM 0 HB3 HIS A 32 -2.997 -7.766 -13.966 1.00 0.00 H new ATOM 0 HD2 HIS A 32 -2.298 -3.863 -14.234 1.00 0.00 H new ATOM 0 HE1 HIS A 32 -6.481 -4.564 -14.334 1.00 0.00 H new ATOM 0 HE2 HIS A 32 -4.661 -2.790 -14.490 1.00 0.00 H new ATOM 505 N TYR A 33 -3.732 -7.555 -11.231 1.00 0.00 N ATOM 506 CA TYR A 33 -4.486 -8.435 -10.346 1.00 0.00 C ATOM 507 C TYR A 33 -5.978 -8.370 -10.657 1.00 0.00 C ATOM 508 O TYR A 33 -6.512 -7.309 -10.977 1.00 0.00 O ATOM 509 CB TYR A 33 -4.241 -8.056 -8.885 1.00 0.00 C ATOM 510 CG TYR A 33 -2.817 -8.286 -8.430 1.00 0.00 C ATOM 511 CD1 TYR A 33 -2.354 -9.566 -8.152 1.00 0.00 C ATOM 512 CD2 TYR A 33 -1.935 -7.223 -8.281 1.00 0.00 C ATOM 513 CE1 TYR A 33 -1.054 -9.780 -7.735 1.00 0.00 C ATOM 514 CE2 TYR A 33 -0.633 -7.428 -7.866 1.00 0.00 C ATOM 515 CZ TYR A 33 -0.198 -8.708 -7.594 1.00 0.00 C ATOM 516 OH TYR A 33 1.098 -8.918 -7.181 1.00 0.00 O ATOM 0 H TYR A 33 -4.259 -6.754 -11.579 1.00 0.00 H new ATOM 0 HA TYR A 33 -4.142 -9.456 -10.511 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -4.493 -7.005 -8.744 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -4.914 -8.633 -8.251 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -3.021 -10.408 -8.264 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -2.273 -6.219 -8.493 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -0.710 -10.781 -7.521 1.00 0.00 H new ATOM 0 HE2 TYR A 33 0.040 -6.591 -7.755 1.00 0.00 H new ATOM 0 HH TYR A 33 1.569 -8.060 -7.134 1.00 0.00 H new ATOM 526 N ALA A 34 -6.646 -9.515 -10.558 1.00 0.00 N ATOM 527 CA ALA A 34 -8.077 -9.590 -10.825 1.00 0.00 C ATOM 528 C ALA A 34 -8.870 -9.735 -9.531 1.00 0.00 C ATOM 529 O ALA A 34 -8.663 -10.678 -8.766 1.00 0.00 O ATOM 530 CB ALA A 34 -8.379 -10.748 -11.764 1.00 0.00 C ATOM 0 H ALA A 34 -6.219 -10.403 -10.295 1.00 0.00 H new ATOM 0 HA ALA A 34 -8.381 -8.659 -11.304 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -9.451 -10.792 -11.954 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -7.849 -10.601 -12.705 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -8.053 -11.682 -11.306 1.00 0.00 H new ATOM 536 N LEU A 35 -9.778 -8.796 -9.290 1.00 0.00 N ATOM 537 CA LEU A 35 -10.603 -8.819 -8.087 1.00 0.00 C ATOM 538 C LEU A 35 -11.933 -9.517 -8.351 1.00 0.00 C ATOM 539 O LEU A 35 -12.568 -9.293 -9.381 1.00 0.00 O ATOM 540 CB LEU A 35 -10.851 -7.394 -7.588 1.00 0.00 C ATOM 541 CG LEU A 35 -10.777 -7.191 -6.074 1.00 0.00 C ATOM 542 CD1 LEU A 35 -11.264 -5.800 -5.698 1.00 0.00 C ATOM 543 CD2 LEU A 35 -11.589 -8.256 -5.352 1.00 0.00 C ATOM 0 H LEU A 35 -9.962 -8.009 -9.912 1.00 0.00 H new ATOM 0 HA LEU A 35 -10.068 -9.378 -7.320 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -10.123 -6.734 -8.059 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -11.837 -7.077 -7.929 1.00 0.00 H new ATOM 0 HG LEU A 35 -9.736 -7.285 -5.765 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -11.204 -5.673 -4.617 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -10.640 -5.052 -6.186 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -12.298 -5.677 -6.021 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -11.524 -8.095 -4.276 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -12.631 -8.194 -5.666 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -11.194 -9.242 -5.596 1.00 0.00 H new ATOM 555 N GLU A 36 -12.349 -10.361 -7.413 1.00 0.00 N ATOM 556 CA GLU A 36 -13.605 -11.090 -7.545 1.00 0.00 C ATOM 557 C GLU A 36 -14.413 -11.021 -6.252 1.00 0.00 C ATOM 558 O GLU A 36 -14.118 -11.723 -5.285 1.00 0.00 O ATOM 559 CB GLU A 36 -13.337 -12.551 -7.914 1.00 0.00 C ATOM 560 CG GLU A 36 -12.771 -12.731 -9.312 1.00 0.00 C ATOM 561 CD GLU A 36 -11.303 -12.362 -9.400 1.00 0.00 C ATOM 562 OE1 GLU A 36 -10.494 -12.972 -8.670 1.00 0.00 O ATOM 563 OE2 GLU A 36 -10.963 -11.464 -10.198 1.00 0.00 O ATOM 0 H GLU A 36 -11.835 -10.557 -6.554 1.00 0.00 H new ATOM 0 HA GLU A 36 -14.184 -10.622 -8.341 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -12.641 -12.978 -7.192 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -14.267 -13.114 -7.832 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -12.900 -13.768 -9.621 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -13.338 -12.117 -10.011 1.00 0.00 H new ATOM 570 N ILE A 37 -15.433 -10.169 -6.244 1.00 0.00 N ATOM 571 CA ILE A 37 -16.284 -10.008 -5.072 1.00 0.00 C ATOM 572 C ILE A 37 -17.641 -10.671 -5.282 1.00 0.00 C ATOM 573 O ILE A 37 -18.275 -10.494 -6.322 1.00 0.00 O ATOM 574 CB ILE A 37 -16.499 -8.521 -4.732 1.00 0.00 C ATOM 575 CG1 ILE A 37 -17.250 -8.382 -3.406 1.00 0.00 C ATOM 576 CG2 ILE A 37 -17.258 -7.826 -5.853 1.00 0.00 C ATOM 577 CD1 ILE A 37 -16.638 -7.364 -2.469 1.00 0.00 C ATOM 0 H ILE A 37 -15.690 -9.580 -7.036 1.00 0.00 H new ATOM 0 HA ILE A 37 -15.771 -10.492 -4.241 1.00 0.00 H new ATOM 0 HB ILE A 37 -15.525 -8.042 -4.628 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -18.283 -8.101 -3.611 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -17.276 -9.352 -2.909 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -17.402 -6.776 -5.598 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -16.688 -7.900 -6.779 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -18.229 -8.304 -5.986 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -17.222 -7.318 -1.550 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -15.614 -7.655 -2.235 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -16.637 -6.384 -2.947 1.00 0.00 H new ATOM 589 N SER A 38 -18.081 -11.434 -4.286 1.00 0.00 N ATOM 590 CA SER A 38 -19.362 -12.126 -4.362 1.00 0.00 C ATOM 591 C SER A 38 -20.149 -11.956 -3.066 1.00 0.00 C ATOM 592 O SER A 38 -19.618 -12.157 -1.974 1.00 0.00 O ATOM 593 CB SER A 38 -19.147 -13.613 -4.651 1.00 0.00 C ATOM 594 OG SER A 38 -20.228 -14.389 -4.163 1.00 0.00 O ATOM 0 H SER A 38 -17.569 -11.588 -3.417 1.00 0.00 H new ATOM 0 HA SER A 38 -19.937 -11.685 -5.176 1.00 0.00 H new ATOM 0 HB2 SER A 38 -19.041 -13.766 -5.725 1.00 0.00 H new ATOM 0 HB3 SER A 38 -18.218 -13.946 -4.188 1.00 0.00 H new ATOM 0 HG SER A 38 -20.067 -15.335 -4.361 1.00 0.00 H new ATOM 600 N ASP A 39 -21.418 -11.585 -3.196 1.00 0.00 N ATOM 601 CA ASP A 39 -22.280 -11.389 -2.037 1.00 0.00 C ATOM 602 C ASP A 39 -23.708 -11.070 -2.469 1.00 0.00 C ATOM 603 O ASP A 39 -23.976 -10.857 -3.650 1.00 0.00 O ATOM 604 CB ASP A 39 -21.737 -10.263 -1.155 1.00 0.00 C ATOM 605 CG ASP A 39 -22.130 -10.427 0.300 1.00 0.00 C ATOM 606 OD1 ASP A 39 -23.248 -10.006 0.664 1.00 0.00 O ATOM 607 OD2 ASP A 39 -21.319 -10.976 1.074 1.00 0.00 O ATOM 0 H ASP A 39 -21.872 -11.414 -4.093 1.00 0.00 H new ATOM 0 HA ASP A 39 -22.292 -12.316 -1.463 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -20.650 -10.235 -1.234 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -22.108 -9.306 -1.523 1.00 0.00 H new ATOM 612 N ALA A 40 -24.620 -11.040 -1.503 1.00 0.00 N ATOM 613 CA ALA A 40 -26.020 -10.747 -1.783 1.00 0.00 C ATOM 614 C ALA A 40 -26.316 -9.262 -1.604 1.00 0.00 C ATOM 615 O ALA A 40 -27.368 -8.888 -1.085 1.00 0.00 O ATOM 616 CB ALA A 40 -26.924 -11.579 -0.885 1.00 0.00 C ATOM 0 H ALA A 40 -24.414 -11.215 -0.519 1.00 0.00 H new ATOM 0 HA ALA A 40 -26.219 -11.008 -2.822 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -27.967 -11.350 -1.105 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -26.740 -12.638 -1.064 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -26.714 -11.346 0.159 1.00 0.00 H new ATOM 622 N GLN A 41 -25.382 -8.420 -2.034 1.00 0.00 N ATOM 623 CA GLN A 41 -25.544 -6.976 -1.920 1.00 0.00 C ATOM 624 C GLN A 41 -25.574 -6.320 -3.296 1.00 0.00 C ATOM 625 O GLN A 41 -26.178 -5.263 -3.479 1.00 0.00 O ATOM 626 CB GLN A 41 -24.411 -6.380 -1.082 1.00 0.00 C ATOM 627 CG GLN A 41 -23.027 -6.650 -1.651 1.00 0.00 C ATOM 628 CD GLN A 41 -21.953 -6.683 -0.582 1.00 0.00 C ATOM 629 OE1 GLN A 41 -20.936 -5.997 -0.685 1.00 0.00 O ATOM 630 NE2 GLN A 41 -22.173 -7.484 0.455 1.00 0.00 N ATOM 0 H GLN A 41 -24.505 -8.713 -2.465 1.00 0.00 H new ATOM 0 HA GLN A 41 -26.495 -6.781 -1.425 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -24.558 -5.303 -1.001 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -24.465 -6.786 -0.072 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -23.036 -7.602 -2.181 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -22.783 -5.880 -2.383 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -23.030 -8.035 0.501 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -21.485 -7.547 1.205 1.00 0.00 H new ATOM 639 N PHE A 42 -24.918 -6.954 -4.263 1.00 0.00 N ATOM 640 CA PHE A 42 -24.869 -6.432 -5.623 1.00 0.00 C ATOM 641 C PHE A 42 -25.979 -7.035 -6.478 1.00 0.00 C ATOM 642 O PHE A 42 -25.762 -7.394 -7.634 1.00 0.00 O ATOM 643 CB PHE A 42 -23.507 -6.725 -6.256 1.00 0.00 C ATOM 644 CG PHE A 42 -22.347 -6.401 -5.358 1.00 0.00 C ATOM 645 CD1 PHE A 42 -21.862 -5.106 -5.272 1.00 0.00 C ATOM 646 CD2 PHE A 42 -21.741 -7.391 -4.601 1.00 0.00 C ATOM 647 CE1 PHE A 42 -20.794 -4.805 -4.447 1.00 0.00 C ATOM 648 CE2 PHE A 42 -20.673 -7.096 -3.775 1.00 0.00 C ATOM 649 CZ PHE A 42 -20.200 -5.801 -3.697 1.00 0.00 C ATOM 0 H PHE A 42 -24.413 -7.830 -4.129 1.00 0.00 H new ATOM 0 HA PHE A 42 -25.016 -5.353 -5.576 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -23.461 -7.779 -6.529 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -23.413 -6.152 -7.179 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -22.323 -4.323 -5.856 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -22.108 -8.405 -4.657 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -20.425 -3.792 -4.389 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -20.209 -7.877 -3.191 1.00 0.00 H new ATOM 0 HZ PHE A 42 -19.367 -5.567 -3.051 1.00 0.00 H new ATOM 659 N ASN A 43 -27.171 -7.142 -5.899 1.00 0.00 N ATOM 660 CA ASN A 43 -28.317 -7.702 -6.607 1.00 0.00 C ATOM 661 C ASN A 43 -29.102 -6.608 -7.323 1.00 0.00 C ATOM 662 O ASN A 43 -29.783 -6.865 -8.315 1.00 0.00 O ATOM 663 CB ASN A 43 -29.231 -8.447 -5.632 1.00 0.00 C ATOM 664 CG ASN A 43 -28.779 -9.875 -5.392 1.00 0.00 C ATOM 665 OD1 ASN A 43 -28.653 -10.663 -6.329 1.00 0.00 O ATOM 666 ND2 ASN A 43 -28.534 -10.213 -4.131 1.00 0.00 N ATOM 0 H ASN A 43 -27.368 -6.849 -4.942 1.00 0.00 H new ATOM 0 HA ASN A 43 -27.944 -8.404 -7.353 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -29.257 -7.913 -4.682 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -30.248 -8.452 -6.023 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -28.228 -11.160 -3.907 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -28.652 -9.526 -3.387 1.00 0.00 H new ATOM 673 N GLY A 44 -29.001 -5.384 -6.812 1.00 0.00 N ATOM 674 CA GLY A 44 -29.707 -4.268 -7.416 1.00 0.00 C ATOM 675 C GLY A 44 -28.776 -3.320 -8.144 1.00 0.00 C ATOM 676 O GLY A 44 -29.208 -2.556 -9.009 1.00 0.00 O ATOM 0 H GLY A 44 -28.444 -5.146 -5.992 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -30.452 -4.649 -8.115 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -30.246 -3.721 -6.642 1.00 0.00 H new ATOM 680 N LEU A 45 -27.495 -3.366 -7.795 1.00 0.00 N ATOM 681 CA LEU A 45 -26.500 -2.502 -8.421 1.00 0.00 C ATOM 682 C LEU A 45 -26.144 -3.004 -9.817 1.00 0.00 C ATOM 683 O LEU A 45 -26.456 -4.139 -10.177 1.00 0.00 O ATOM 684 CB LEU A 45 -25.240 -2.431 -7.556 1.00 0.00 C ATOM 685 CG LEU A 45 -25.412 -1.804 -6.172 1.00 0.00 C ATOM 686 CD1 LEU A 45 -24.494 -2.478 -5.163 1.00 0.00 C ATOM 687 CD2 LEU A 45 -25.140 -0.308 -6.227 1.00 0.00 C ATOM 0 H LEU A 45 -27.121 -3.992 -7.082 1.00 0.00 H new ATOM 0 HA LEU A 45 -26.928 -1.504 -8.512 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -24.853 -3.442 -7.430 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -24.483 -1.865 -8.098 1.00 0.00 H new ATOM 0 HG LEU A 45 -26.443 -1.954 -5.852 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -24.630 -2.019 -4.184 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -24.736 -3.539 -5.103 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -23.457 -2.360 -5.478 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -25.267 0.122 -5.233 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -24.119 -0.136 -6.569 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -25.838 0.164 -6.918 1.00 0.00 H new ATOM 699 N SER A 46 -25.487 -2.152 -10.597 1.00 0.00 N ATOM 700 CA SER A 46 -25.090 -2.508 -11.954 1.00 0.00 C ATOM 701 C SER A 46 -23.572 -2.613 -12.066 1.00 0.00 C ATOM 702 O SER A 46 -22.848 -2.368 -11.100 1.00 0.00 O ATOM 703 CB SER A 46 -25.615 -1.473 -12.951 1.00 0.00 C ATOM 704 OG SER A 46 -25.437 -1.914 -14.286 1.00 0.00 O ATOM 0 H SER A 46 -25.218 -1.210 -10.312 1.00 0.00 H new ATOM 0 HA SER A 46 -25.523 -3.480 -12.189 1.00 0.00 H new ATOM 0 HB2 SER A 46 -26.673 -1.287 -12.764 1.00 0.00 H new ATOM 0 HB3 SER A 46 -25.095 -0.526 -12.805 1.00 0.00 H new ATOM 0 HG SER A 46 -25.782 -1.236 -14.903 1.00 0.00 H new ATOM 710 N LEU A 47 -23.096 -2.980 -13.251 1.00 0.00 N ATOM 711 CA LEU A 47 -21.664 -3.118 -13.491 1.00 0.00 C ATOM 712 C LEU A 47 -20.926 -1.830 -13.139 1.00 0.00 C ATOM 713 O LEU A 47 -19.741 -1.853 -12.806 1.00 0.00 O ATOM 714 CB LEU A 47 -21.405 -3.484 -14.954 1.00 0.00 C ATOM 715 CG LEU A 47 -21.559 -4.962 -15.313 1.00 0.00 C ATOM 716 CD1 LEU A 47 -20.602 -5.813 -14.493 1.00 0.00 C ATOM 717 CD2 LEU A 47 -22.996 -5.416 -15.100 1.00 0.00 C ATOM 0 H LEU A 47 -23.681 -3.187 -14.060 1.00 0.00 H new ATOM 0 HA LEU A 47 -21.289 -3.917 -12.851 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -22.086 -2.906 -15.578 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -20.393 -3.171 -15.212 1.00 0.00 H new ATOM 0 HG LEU A 47 -21.312 -5.088 -16.367 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -20.726 -6.862 -14.762 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -19.576 -5.505 -14.696 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -20.817 -5.683 -13.432 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -23.087 -6.470 -15.361 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -23.271 -5.276 -14.055 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -23.661 -4.827 -15.732 1.00 0.00 H new ATOM 729 N ILE A 48 -21.635 -0.709 -13.213 1.00 0.00 N ATOM 730 CA ILE A 48 -21.049 0.588 -12.899 1.00 0.00 C ATOM 731 C ILE A 48 -21.046 0.840 -11.395 1.00 0.00 C ATOM 732 O ILE A 48 -19.995 1.054 -10.793 1.00 0.00 O ATOM 733 CB ILE A 48 -21.805 1.733 -13.599 1.00 0.00 C ATOM 734 CG1 ILE A 48 -21.774 1.540 -15.117 1.00 0.00 C ATOM 735 CG2 ILE A 48 -21.202 3.077 -13.218 1.00 0.00 C ATOM 736 CD1 ILE A 48 -20.376 1.462 -15.688 1.00 0.00 C ATOM 0 H ILE A 48 -22.617 -0.673 -13.488 1.00 0.00 H new ATOM 0 HA ILE A 48 -20.022 0.566 -13.264 1.00 0.00 H new ATOM 0 HB ILE A 48 -22.844 1.717 -13.270 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -22.312 0.627 -15.370 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -22.306 2.365 -15.591 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -21.747 3.876 -13.721 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -21.271 3.214 -12.139 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -20.155 3.105 -13.521 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -20.431 1.325 -16.768 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -19.840 2.385 -15.466 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -19.847 0.620 -15.242 1.00 0.00 H new ATOM 748 N ASN A 49 -22.231 0.812 -10.794 1.00 0.00 N ATOM 749 CA ASN A 49 -22.366 1.037 -9.359 1.00 0.00 C ATOM 750 C ASN A 49 -21.529 0.034 -8.571 1.00 0.00 C ATOM 751 O ASN A 49 -21.152 0.289 -7.427 1.00 0.00 O ATOM 752 CB ASN A 49 -23.834 0.933 -8.942 1.00 0.00 C ATOM 753 CG ASN A 49 -24.749 1.745 -9.838 1.00 0.00 C ATOM 754 OD1 ASN A 49 -24.296 2.617 -10.579 1.00 0.00 O ATOM 755 ND2 ASN A 49 -26.045 1.461 -9.773 1.00 0.00 N ATOM 0 H ASN A 49 -23.111 0.636 -11.278 1.00 0.00 H new ATOM 0 HA ASN A 49 -22.003 2.040 -9.137 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -24.142 -0.112 -8.965 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -23.941 1.275 -7.913 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -26.709 1.974 -10.352 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -26.376 0.729 -9.144 1.00 0.00 H new ATOM 762 N GLN A 50 -21.242 -1.106 -9.191 1.00 0.00 N ATOM 763 CA GLN A 50 -20.449 -2.147 -8.547 1.00 0.00 C ATOM 764 C GLN A 50 -18.961 -1.825 -8.626 1.00 0.00 C ATOM 765 O GLN A 50 -18.189 -2.188 -7.738 1.00 0.00 O ATOM 766 CB GLN A 50 -20.725 -3.503 -9.198 1.00 0.00 C ATOM 767 CG GLN A 50 -22.037 -4.133 -8.759 1.00 0.00 C ATOM 768 CD GLN A 50 -22.726 -4.887 -9.880 1.00 0.00 C ATOM 769 OE1 GLN A 50 -22.165 -5.063 -10.961 1.00 0.00 O ATOM 770 NE2 GLN A 50 -23.949 -5.337 -9.626 1.00 0.00 N ATOM 0 H GLN A 50 -21.546 -1.332 -10.138 1.00 0.00 H new ATOM 0 HA GLN A 50 -20.737 -2.191 -7.497 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -20.734 -3.381 -10.281 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -19.907 -4.184 -8.961 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -21.849 -4.815 -7.930 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -22.703 -3.355 -8.387 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -24.376 -5.168 -8.715 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -24.462 -5.852 -10.342 1.00 0.00 H new ATOM 779 N HIS A 51 -18.564 -1.141 -9.694 1.00 0.00 N ATOM 780 CA HIS A 51 -17.167 -0.770 -9.889 1.00 0.00 C ATOM 781 C HIS A 51 -16.813 0.465 -9.066 1.00 0.00 C ATOM 782 O HIS A 51 -15.668 0.640 -8.651 1.00 0.00 O ATOM 783 CB HIS A 51 -16.888 -0.508 -11.369 1.00 0.00 C ATOM 784 CG HIS A 51 -15.470 -0.778 -11.769 1.00 0.00 C ATOM 785 ND1 HIS A 51 -14.457 0.146 -11.619 1.00 0.00 N ATOM 786 CD2 HIS A 51 -14.898 -1.877 -12.314 1.00 0.00 C ATOM 787 CE1 HIS A 51 -13.324 -0.373 -12.056 1.00 0.00 C ATOM 788 NE2 HIS A 51 -13.563 -1.599 -12.483 1.00 0.00 N ATOM 0 H HIS A 51 -19.190 -0.832 -10.438 1.00 0.00 H new ATOM 0 HA HIS A 51 -16.546 -1.600 -9.552 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -17.551 -1.130 -11.971 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -17.130 0.530 -11.597 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -15.398 -2.800 -12.569 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -12.364 0.122 -12.063 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -12.870 -2.236 -12.875 1.00 0.00 H new ATOM 796 N LYS A 52 -17.804 1.320 -8.836 1.00 0.00 N ATOM 797 CA LYS A 52 -17.599 2.539 -8.063 1.00 0.00 C ATOM 798 C LYS A 52 -17.615 2.244 -6.566 1.00 0.00 C ATOM 799 O LYS A 52 -16.911 2.889 -5.788 1.00 0.00 O ATOM 800 CB LYS A 52 -18.678 3.570 -8.401 1.00 0.00 C ATOM 801 CG LYS A 52 -20.007 3.307 -7.714 1.00 0.00 C ATOM 802 CD LYS A 52 -21.027 4.385 -8.042 1.00 0.00 C ATOM 803 CE LYS A 52 -21.272 4.484 -9.540 1.00 0.00 C ATOM 804 NZ LYS A 52 -22.694 4.795 -9.850 1.00 0.00 N ATOM 0 H LYS A 52 -18.758 1.191 -9.174 1.00 0.00 H new ATOM 0 HA LYS A 52 -16.622 2.945 -8.325 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -18.323 4.561 -8.119 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -18.832 3.582 -9.480 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -20.391 2.335 -8.023 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -19.857 3.262 -6.635 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -21.965 4.166 -7.533 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -20.676 5.346 -7.665 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -20.631 5.258 -9.962 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -20.994 3.544 -10.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -22.737 5.559 -10.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -23.160 3.947 -10.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -23.181 5.096 -8.982 1.00 0.00 H new ATOM 818 N LEU A 53 -18.421 1.265 -6.170 1.00 0.00 N ATOM 819 CA LEU A 53 -18.527 0.882 -4.766 1.00 0.00 C ATOM 820 C LEU A 53 -17.170 0.459 -4.213 1.00 0.00 C ATOM 821 O LEU A 53 -16.705 0.992 -3.205 1.00 0.00 O ATOM 822 CB LEU A 53 -19.535 -0.256 -4.602 1.00 0.00 C ATOM 823 CG LEU A 53 -20.934 0.148 -4.135 1.00 0.00 C ATOM 824 CD1 LEU A 53 -21.839 -1.071 -4.045 1.00 0.00 C ATOM 825 CD2 LEU A 53 -20.863 0.861 -2.793 1.00 0.00 C ATOM 0 H LEU A 53 -19.011 0.722 -6.801 1.00 0.00 H new ATOM 0 HA LEU A 53 -18.873 1.749 -4.204 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -19.628 -0.773 -5.557 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -19.129 -0.974 -3.889 1.00 0.00 H new ATOM 0 HG LEU A 53 -21.356 0.836 -4.868 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -22.830 -0.764 -3.711 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -21.916 -1.541 -5.026 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -21.421 -1.783 -3.334 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -21.868 1.141 -2.476 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -20.421 0.196 -2.051 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -20.250 1.757 -2.889 1.00 0.00 H new ATOM 837 N VAL A 54 -16.538 -0.501 -4.880 1.00 0.00 N ATOM 838 CA VAL A 54 -15.233 -0.994 -4.457 1.00 0.00 C ATOM 839 C VAL A 54 -14.247 0.154 -4.268 1.00 0.00 C ATOM 840 O VAL A 54 -13.373 0.101 -3.402 1.00 0.00 O ATOM 841 CB VAL A 54 -14.652 -1.992 -5.476 1.00 0.00 C ATOM 842 CG1 VAL A 54 -15.471 -3.274 -5.494 1.00 0.00 C ATOM 843 CG2 VAL A 54 -14.596 -1.367 -6.862 1.00 0.00 C ATOM 0 H VAL A 54 -16.909 -0.953 -5.716 1.00 0.00 H new ATOM 0 HA VAL A 54 -15.381 -1.503 -3.505 1.00 0.00 H new ATOM 0 HB VAL A 54 -13.635 -2.242 -5.174 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -15.046 -3.967 -6.220 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -15.455 -3.730 -4.504 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -16.500 -3.045 -5.771 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -14.183 -2.086 -7.569 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -15.602 -1.086 -7.176 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -13.963 -0.480 -6.836 1.00 0.00 H new ATOM 853 N LYS A 55 -14.393 1.192 -5.085 1.00 0.00 N ATOM 854 CA LYS A 55 -13.517 2.355 -5.008 1.00 0.00 C ATOM 855 C LYS A 55 -13.924 3.268 -3.856 1.00 0.00 C ATOM 856 O LYS A 55 -13.086 3.947 -3.265 1.00 0.00 O ATOM 857 CB LYS A 55 -13.551 3.133 -6.326 1.00 0.00 C ATOM 858 CG LYS A 55 -13.021 2.345 -7.511 1.00 0.00 C ATOM 859 CD LYS A 55 -11.502 2.344 -7.546 1.00 0.00 C ATOM 860 CE LYS A 55 -10.931 1.065 -6.953 1.00 0.00 C ATOM 861 NZ LYS A 55 -9.860 0.487 -7.810 1.00 0.00 N ATOM 0 H LYS A 55 -15.110 1.251 -5.808 1.00 0.00 H new ATOM 0 HA LYS A 55 -12.502 2.002 -4.827 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -14.577 3.437 -6.532 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -12.964 4.045 -6.215 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -13.385 1.319 -7.459 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -13.407 2.774 -8.436 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -11.161 2.453 -8.575 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -11.124 3.203 -6.992 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -10.530 1.272 -5.961 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -11.730 0.334 -6.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -9.497 -0.383 -7.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -10.248 0.266 -8.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -9.086 1.174 -7.909 1.00 0.00 H new ATOM 875 N ASN A 56 -15.215 3.276 -3.542 1.00 0.00 N ATOM 876 CA ASN A 56 -15.733 4.105 -2.459 1.00 0.00 C ATOM 877 C ASN A 56 -15.362 3.519 -1.100 1.00 0.00 C ATOM 878 O ASN A 56 -14.960 4.242 -0.189 1.00 0.00 O ATOM 879 CB ASN A 56 -17.253 4.237 -2.572 1.00 0.00 C ATOM 880 CG ASN A 56 -17.686 4.806 -3.909 1.00 0.00 C ATOM 881 OD1 ASN A 56 -17.020 5.675 -4.471 1.00 0.00 O ATOM 882 ND2 ASN A 56 -18.807 4.316 -4.425 1.00 0.00 N ATOM 0 H ASN A 56 -15.922 2.718 -4.022 1.00 0.00 H new ATOM 0 HA ASN A 56 -15.282 5.094 -2.544 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -17.711 3.258 -2.431 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -17.620 4.879 -1.771 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -19.148 4.660 -5.323 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -19.327 3.596 -3.924 1.00 0.00 H new ATOM 889 N ALA A 57 -15.499 2.203 -0.972 1.00 0.00 N ATOM 890 CA ALA A 57 -15.175 1.519 0.274 1.00 0.00 C ATOM 891 C ALA A 57 -13.715 1.735 0.656 1.00 0.00 C ATOM 892 O ALA A 57 -13.335 1.573 1.816 1.00 0.00 O ATOM 893 CB ALA A 57 -15.478 0.033 0.154 1.00 0.00 C ATOM 0 H ALA A 57 -15.832 1.590 -1.716 1.00 0.00 H new ATOM 0 HA ALA A 57 -15.795 1.942 1.064 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -15.231 -0.465 1.091 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -16.537 -0.106 -0.063 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -14.883 -0.396 -0.652 1.00 0.00 H new ATOM 899 N LEU A 58 -12.899 2.100 -0.327 1.00 0.00 N ATOM 900 CA LEU A 58 -11.479 2.337 -0.095 1.00 0.00 C ATOM 901 C LEU A 58 -11.156 3.826 -0.171 1.00 0.00 C ATOM 902 O LEU A 58 -10.085 4.262 0.252 1.00 0.00 O ATOM 903 CB LEU A 58 -10.639 1.568 -1.116 1.00 0.00 C ATOM 904 CG LEU A 58 -10.946 1.851 -2.587 1.00 0.00 C ATOM 905 CD1 LEU A 58 -10.247 3.122 -3.043 1.00 0.00 C ATOM 906 CD2 LEU A 58 -10.532 0.671 -3.455 1.00 0.00 C ATOM 0 H LEU A 58 -13.197 2.238 -1.293 1.00 0.00 H new ATOM 0 HA LEU A 58 -11.236 1.982 0.906 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -9.588 1.793 -0.935 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -10.772 0.501 -0.936 1.00 0.00 H new ATOM 0 HG LEU A 58 -12.021 1.994 -2.693 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -10.477 3.307 -4.092 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -10.592 3.963 -2.442 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -9.170 3.008 -2.922 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -10.758 0.890 -4.499 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -9.462 0.496 -3.344 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -11.079 -0.219 -3.144 1.00 0.00 H new ATOM 918 N SER A 59 -12.089 4.602 -0.713 1.00 0.00 N ATOM 919 CA SER A 59 -11.903 6.042 -0.846 1.00 0.00 C ATOM 920 C SER A 59 -12.419 6.773 0.390 1.00 0.00 C ATOM 921 O SER A 59 -11.898 7.823 0.764 1.00 0.00 O ATOM 922 CB SER A 59 -12.623 6.557 -2.094 1.00 0.00 C ATOM 923 OG SER A 59 -12.499 7.963 -2.211 1.00 0.00 O ATOM 0 H SER A 59 -12.981 4.258 -1.067 1.00 0.00 H new ATOM 0 HA SER A 59 -10.835 6.238 -0.944 1.00 0.00 H new ATOM 0 HB2 SER A 59 -12.208 6.077 -2.981 1.00 0.00 H new ATOM 0 HB3 SER A 59 -13.677 6.284 -2.048 1.00 0.00 H new ATOM 0 HG SER A 59 -12.966 8.267 -3.017 1.00 0.00 H new ATOM 929 N GLU A 60 -13.446 6.209 1.018 1.00 0.00 N ATOM 930 CA GLU A 60 -14.033 6.808 2.211 1.00 0.00 C ATOM 931 C GLU A 60 -13.351 6.286 3.473 1.00 0.00 C ATOM 932 O GLU A 60 -13.194 7.015 4.452 1.00 0.00 O ATOM 933 CB GLU A 60 -15.534 6.515 2.270 1.00 0.00 C ATOM 934 CG GLU A 60 -15.859 5.053 2.531 1.00 0.00 C ATOM 935 CD GLU A 60 -17.190 4.637 1.937 1.00 0.00 C ATOM 936 OE1 GLU A 60 -18.227 5.187 2.364 1.00 0.00 O ATOM 937 OE2 GLU A 60 -17.196 3.762 1.046 1.00 0.00 O ATOM 0 H GLU A 60 -13.888 5.339 0.721 1.00 0.00 H new ATOM 0 HA GLU A 60 -13.883 7.886 2.157 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -15.984 7.124 3.054 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -15.992 6.818 1.328 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -15.068 4.429 2.114 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -15.873 4.874 3.606 1.00 0.00 H new ATOM 944 N ILE A 61 -12.951 5.020 3.441 1.00 0.00 N ATOM 945 CA ILE A 61 -12.286 4.400 4.581 1.00 0.00 C ATOM 946 C ILE A 61 -10.802 4.749 4.607 1.00 0.00 C ATOM 947 O ILE A 61 -10.146 4.643 5.645 1.00 0.00 O ATOM 948 CB ILE A 61 -12.442 2.868 4.560 1.00 0.00 C ATOM 949 CG1 ILE A 61 -13.923 2.486 4.502 1.00 0.00 C ATOM 950 CG2 ILE A 61 -11.777 2.251 5.781 1.00 0.00 C ATOM 951 CD1 ILE A 61 -14.727 3.006 5.673 1.00 0.00 C ATOM 0 H ILE A 61 -13.076 4.403 2.638 1.00 0.00 H new ATOM 0 HA ILE A 61 -12.765 4.793 5.478 1.00 0.00 H new ATOM 0 HB ILE A 61 -11.950 2.479 3.668 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -14.353 2.870 3.577 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -14.009 1.400 4.466 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -11.896 1.168 5.752 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -10.716 2.500 5.782 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -12.242 2.643 6.686 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -15.767 2.698 5.566 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -14.322 2.601 6.601 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -14.672 4.094 5.697 1.00 0.00 H new ATOM 963 N LEU A 62 -10.277 5.165 3.460 1.00 0.00 N ATOM 964 CA LEU A 62 -8.869 5.531 3.351 1.00 0.00 C ATOM 965 C LEU A 62 -7.971 4.367 3.757 1.00 0.00 C ATOM 966 O LEU A 62 -7.113 4.506 4.627 1.00 0.00 O ATOM 967 CB LEU A 62 -8.569 6.750 4.226 1.00 0.00 C ATOM 968 CG LEU A 62 -8.946 8.109 3.636 1.00 0.00 C ATOM 969 CD1 LEU A 62 -8.221 8.339 2.319 1.00 0.00 C ATOM 970 CD2 LEU A 62 -10.453 8.207 3.441 1.00 0.00 C ATOM 0 H LEU A 62 -10.805 5.257 2.592 1.00 0.00 H new ATOM 0 HA LEU A 62 -8.663 5.779 2.310 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.094 6.630 5.174 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -7.502 6.757 4.451 1.00 0.00 H new ATOM 0 HG LEU A 62 -8.639 8.885 4.337 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -8.502 9.311 1.914 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.144 8.313 2.487 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -8.497 7.558 1.611 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -10.703 9.181 3.020 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -10.784 7.422 2.761 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -10.953 8.088 4.402 1.00 0.00 H new ATOM 982 N ASN A 63 -8.173 3.220 3.117 1.00 0.00 N ATOM 983 CA ASN A 63 -7.380 2.031 3.410 1.00 0.00 C ATOM 984 C ASN A 63 -6.287 1.836 2.364 1.00 0.00 C ATOM 985 O ASN A 63 -5.253 1.225 2.636 1.00 0.00 O ATOM 986 CB ASN A 63 -8.278 0.794 3.463 1.00 0.00 C ATOM 987 CG ASN A 63 -8.743 0.477 4.871 1.00 0.00 C ATOM 988 OD1 ASN A 63 -8.212 1.008 5.846 1.00 0.00 O ATOM 989 ND2 ASN A 63 -9.740 -0.393 4.983 1.00 0.00 N ATOM 0 H ASN A 63 -8.879 3.088 2.392 1.00 0.00 H new ATOM 0 HA ASN A 63 -6.907 2.170 4.382 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -9.146 0.951 2.823 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -7.737 -0.062 3.061 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -10.095 -0.645 5.905 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -10.150 -0.809 4.147 1.00 0.00 H new ATOM 996 N LYS A 64 -6.522 2.359 1.165 1.00 0.00 N ATOM 997 CA LYS A 64 -5.558 2.244 0.077 1.00 0.00 C ATOM 998 C LYS A 64 -5.194 3.619 -0.475 1.00 0.00 C ATOM 999 O LYS A 64 -5.977 4.565 -0.380 1.00 0.00 O ATOM 1000 CB LYS A 64 -6.122 1.367 -1.042 1.00 0.00 C ATOM 1001 CG LYS A 64 -5.127 1.082 -2.153 1.00 0.00 C ATOM 1002 CD LYS A 64 -3.891 0.373 -1.626 1.00 0.00 C ATOM 1003 CE LYS A 64 -4.242 -0.968 -1.001 1.00 0.00 C ATOM 1004 NZ LYS A 64 -3.033 -1.679 -0.499 1.00 0.00 N ATOM 0 H LYS A 64 -7.373 2.867 0.922 1.00 0.00 H new ATOM 0 HA LYS A 64 -4.655 1.780 0.473 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -6.459 0.422 -0.616 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -6.999 1.855 -1.468 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -5.601 0.468 -2.919 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -4.835 2.018 -2.630 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -3.182 0.222 -2.440 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -3.397 1.002 -0.886 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -4.940 -0.814 -0.178 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -4.750 -1.590 -1.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -3.289 -2.259 0.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -2.654 -2.292 -1.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -2.311 -0.983 -0.223 1.00 0.00 H new ATOM 1018 N LYS A 65 -4.003 3.724 -1.053 1.00 0.00 N ATOM 1019 CA LYS A 65 -3.536 4.982 -1.624 1.00 0.00 C ATOM 1020 C LYS A 65 -3.965 5.110 -3.082 1.00 0.00 C ATOM 1021 O LYS A 65 -4.877 5.871 -3.407 1.00 0.00 O ATOM 1022 CB LYS A 65 -2.012 5.079 -1.518 1.00 0.00 C ATOM 1023 CG LYS A 65 -1.514 5.305 -0.102 1.00 0.00 C ATOM 1024 CD LYS A 65 -1.945 6.661 0.432 1.00 0.00 C ATOM 1025 CE LYS A 65 -1.253 6.989 1.746 1.00 0.00 C ATOM 1026 NZ LYS A 65 0.160 7.410 1.539 1.00 0.00 N ATOM 0 H LYS A 65 -3.342 2.952 -1.139 1.00 0.00 H new ATOM 0 HA LYS A 65 -3.986 5.798 -1.059 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.570 4.162 -1.907 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -1.663 5.895 -2.151 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.896 4.519 0.549 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.426 5.234 -0.082 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -1.716 7.432 -0.303 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -3.025 6.669 0.577 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -1.798 7.784 2.255 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -1.280 6.116 2.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 0.581 7.673 2.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 0.699 6.624 1.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 0.188 8.227 0.896 1.00 0.00 H new ATOM 1040 N LEU A 66 -3.303 4.360 -3.956 1.00 0.00 N ATOM 1041 CA LEU A 66 -3.617 4.389 -5.381 1.00 0.00 C ATOM 1042 C LEU A 66 -3.196 3.088 -6.057 1.00 0.00 C ATOM 1043 O LEU A 66 -2.065 2.628 -5.894 1.00 0.00 O ATOM 1044 CB LEU A 66 -2.922 5.574 -6.052 1.00 0.00 C ATOM 1045 CG LEU A 66 -3.568 6.943 -5.834 1.00 0.00 C ATOM 1046 CD1 LEU A 66 -2.925 7.654 -4.653 1.00 0.00 C ATOM 1047 CD2 LEU A 66 -3.459 7.791 -7.093 1.00 0.00 C ATOM 0 H LEU A 66 -2.546 3.725 -3.704 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.696 4.500 -5.489 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -1.894 5.618 -5.692 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -2.876 5.383 -7.124 1.00 0.00 H new ATOM 0 HG LEU A 66 -4.624 6.794 -5.611 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -3.397 8.626 -4.513 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -3.055 7.054 -3.752 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.861 7.792 -4.847 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.924 8.761 -6.919 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.408 7.932 -7.347 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -3.967 7.288 -7.916 1.00 0.00 H new ATOM 1059 N HIS A 67 -4.113 2.500 -6.820 1.00 0.00 N ATOM 1060 CA HIS A 67 -3.836 1.253 -7.524 1.00 0.00 C ATOM 1061 C HIS A 67 -4.923 0.957 -8.553 1.00 0.00 C ATOM 1062 O HIS A 67 -6.111 1.129 -8.281 1.00 0.00 O ATOM 1063 CB HIS A 67 -3.728 0.095 -6.531 1.00 0.00 C ATOM 1064 CG HIS A 67 -2.854 -1.023 -7.008 1.00 0.00 C ATOM 1065 ND1 HIS A 67 -3.090 -2.347 -6.700 1.00 0.00 N ATOM 1066 CD2 HIS A 67 -1.740 -1.010 -7.777 1.00 0.00 C ATOM 1067 CE1 HIS A 67 -2.158 -3.099 -7.257 1.00 0.00 C ATOM 1068 NE2 HIS A 67 -1.327 -2.312 -7.917 1.00 0.00 N ATOM 0 H HIS A 67 -5.053 2.867 -6.966 1.00 0.00 H new ATOM 0 HA HIS A 67 -2.886 1.363 -8.047 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -3.337 0.473 -5.586 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -4.726 -0.295 -6.330 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -1.265 -0.138 -8.201 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -2.087 -4.174 -7.185 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -0.511 -2.621 -8.445 1.00 0.00 H new ATOM 1076 N SER A 68 -4.508 0.512 -9.734 1.00 0.00 N ATOM 1077 CA SER A 68 -5.446 0.197 -10.805 1.00 0.00 C ATOM 1078 C SER A 68 -5.461 -1.302 -11.091 1.00 0.00 C ATOM 1079 O SER A 68 -4.437 -1.887 -11.445 1.00 0.00 O ATOM 1080 CB SER A 68 -5.079 0.966 -12.076 1.00 0.00 C ATOM 1081 OG SER A 68 -3.677 0.964 -12.287 1.00 0.00 O ATOM 0 H SER A 68 -3.528 0.361 -9.974 1.00 0.00 H new ATOM 0 HA SER A 68 -6.442 0.498 -10.482 1.00 0.00 H new ATOM 0 HB2 SER A 68 -5.580 0.517 -12.934 1.00 0.00 H new ATOM 0 HB3 SER A 68 -5.437 1.993 -12.000 1.00 0.00 H new ATOM 0 HG SER A 68 -3.326 0.061 -12.141 1.00 0.00 H new ATOM 1087 N ILE A 69 -6.628 -1.916 -10.933 1.00 0.00 N ATOM 1088 CA ILE A 69 -6.778 -3.345 -11.175 1.00 0.00 C ATOM 1089 C ILE A 69 -8.177 -3.674 -11.684 1.00 0.00 C ATOM 1090 O ILE A 69 -9.070 -2.826 -11.666 1.00 0.00 O ATOM 1091 CB ILE A 69 -6.503 -4.164 -9.899 1.00 0.00 C ATOM 1092 CG1 ILE A 69 -7.372 -3.658 -8.746 1.00 0.00 C ATOM 1093 CG2 ILE A 69 -5.029 -4.090 -9.530 1.00 0.00 C ATOM 1094 CD1 ILE A 69 -7.171 -4.424 -7.457 1.00 0.00 C ATOM 0 H ILE A 69 -7.484 -1.446 -10.638 1.00 0.00 H new ATOM 0 HA ILE A 69 -6.045 -3.614 -11.936 1.00 0.00 H new ATOM 0 HB ILE A 69 -6.758 -5.206 -10.091 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -7.153 -2.605 -8.571 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -8.421 -3.721 -9.037 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -4.850 -4.673 -8.627 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -4.429 -4.492 -10.346 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -4.750 -3.051 -9.352 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.819 -4.011 -6.684 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -7.418 -5.474 -7.615 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -6.131 -4.340 -7.142 1.00 0.00 H new ATOM 1106 N SER A 70 -8.361 -4.910 -12.137 1.00 0.00 N ATOM 1107 CA SER A 70 -9.652 -5.350 -12.654 1.00 0.00 C ATOM 1108 C SER A 70 -10.600 -5.707 -11.513 1.00 0.00 C ATOM 1109 O SER A 70 -10.200 -6.332 -10.531 1.00 0.00 O ATOM 1110 CB SER A 70 -9.470 -6.556 -13.577 1.00 0.00 C ATOM 1111 OG SER A 70 -10.708 -7.200 -13.824 1.00 0.00 O ATOM 0 H SER A 70 -7.633 -5.624 -12.157 1.00 0.00 H new ATOM 0 HA SER A 70 -10.088 -4.529 -13.222 1.00 0.00 H new ATOM 0 HB2 SER A 70 -9.030 -6.233 -14.520 1.00 0.00 H new ATOM 0 HB3 SER A 70 -8.773 -7.262 -13.125 1.00 0.00 H new ATOM 0 HG SER A 70 -10.565 -7.966 -14.418 1.00 0.00 H new ATOM 1117 N ILE A 71 -11.859 -5.304 -11.651 1.00 0.00 N ATOM 1118 CA ILE A 71 -12.865 -5.582 -10.634 1.00 0.00 C ATOM 1119 C ILE A 71 -14.036 -6.365 -11.217 1.00 0.00 C ATOM 1120 O ILE A 71 -14.731 -5.888 -12.114 1.00 0.00 O ATOM 1121 CB ILE A 71 -13.396 -4.283 -9.999 1.00 0.00 C ATOM 1122 CG1 ILE A 71 -12.252 -3.502 -9.350 1.00 0.00 C ATOM 1123 CG2 ILE A 71 -14.478 -4.598 -8.975 1.00 0.00 C ATOM 1124 CD1 ILE A 71 -12.404 -2.001 -9.465 1.00 0.00 C ATOM 0 H ILE A 71 -12.206 -4.784 -12.457 1.00 0.00 H new ATOM 0 HA ILE A 71 -12.378 -6.181 -9.865 1.00 0.00 H new ATOM 0 HB ILE A 71 -13.834 -3.665 -10.783 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -12.190 -3.773 -8.296 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -11.311 -3.800 -9.812 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -14.844 -3.670 -8.535 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -15.302 -5.117 -9.464 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -14.064 -5.233 -8.192 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -11.558 -1.512 -8.983 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -12.436 -1.718 -10.517 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -13.328 -1.690 -8.978 1.00 0.00 H new ATOM 1136 N LYS A 72 -14.250 -7.571 -10.702 1.00 0.00 N ATOM 1137 CA LYS A 72 -15.339 -8.421 -11.168 1.00 0.00 C ATOM 1138 C LYS A 72 -16.523 -8.363 -10.209 1.00 0.00 C ATOM 1139 O LYS A 72 -16.348 -8.262 -8.994 1.00 0.00 O ATOM 1140 CB LYS A 72 -14.858 -9.866 -11.316 1.00 0.00 C ATOM 1141 CG LYS A 72 -15.905 -10.800 -11.897 1.00 0.00 C ATOM 1142 CD LYS A 72 -15.432 -12.244 -11.887 1.00 0.00 C ATOM 1143 CE LYS A 72 -16.534 -13.194 -12.332 1.00 0.00 C ATOM 1144 NZ LYS A 72 -16.979 -12.913 -13.725 1.00 0.00 N ATOM 0 H LYS A 72 -13.683 -7.982 -9.961 1.00 0.00 H new ATOM 0 HA LYS A 72 -15.664 -8.052 -12.141 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -13.975 -9.882 -11.954 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -14.552 -10.240 -10.339 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -16.828 -10.715 -11.324 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -16.135 -10.499 -12.919 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -14.570 -12.350 -12.546 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -15.101 -12.513 -10.884 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -16.177 -14.222 -12.265 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -17.384 -13.107 -11.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -17.643 -13.652 -14.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -17.451 -11.987 -13.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -16.154 -12.904 -14.358 1.00 0.00 H new ATOM 1158 N THR A 73 -17.731 -8.431 -10.762 1.00 0.00 N ATOM 1159 CA THR A 73 -18.944 -8.387 -9.955 1.00 0.00 C ATOM 1160 C THR A 73 -19.659 -9.733 -9.964 1.00 0.00 C ATOM 1161 O THR A 73 -19.958 -10.280 -11.026 1.00 0.00 O ATOM 1162 CB THR A 73 -19.913 -7.300 -10.457 1.00 0.00 C ATOM 1163 OG1 THR A 73 -20.523 -7.716 -11.684 1.00 0.00 O ATOM 1164 CG2 THR A 73 -19.185 -5.981 -10.669 1.00 0.00 C ATOM 0 H THR A 73 -17.895 -8.517 -11.765 1.00 0.00 H new ATOM 0 HA THR A 73 -18.638 -8.148 -8.936 1.00 0.00 H new ATOM 0 HB THR A 73 -20.683 -7.154 -9.700 1.00 0.00 H new ATOM 0 HG1 THR A 73 -20.406 -8.683 -11.796 1.00 0.00 H new ATOM 0 HG21 THR A 73 -19.890 -5.229 -11.024 1.00 0.00 H new ATOM 0 HG22 THR A 73 -18.747 -5.652 -9.727 1.00 0.00 H new ATOM 0 HG23 THR A 73 -18.396 -6.116 -11.409 1.00 0.00 H new ATOM 1172 N ILE A 74 -19.931 -10.261 -8.776 1.00 0.00 N ATOM 1173 CA ILE A 74 -20.613 -11.543 -8.648 1.00 0.00 C ATOM 1174 C ILE A 74 -21.783 -11.449 -7.674 1.00 0.00 C ATOM 1175 O ILE A 74 -21.629 -10.974 -6.548 1.00 0.00 O ATOM 1176 CB ILE A 74 -19.651 -12.648 -8.173 1.00 0.00 C ATOM 1177 CG1 ILE A 74 -18.480 -12.788 -9.147 1.00 0.00 C ATOM 1178 CG2 ILE A 74 -20.391 -13.970 -8.032 1.00 0.00 C ATOM 1179 CD1 ILE A 74 -17.255 -12.002 -8.736 1.00 0.00 C ATOM 0 H ILE A 74 -19.690 -9.821 -7.888 1.00 0.00 H new ATOM 0 HA ILE A 74 -20.988 -11.801 -9.638 1.00 0.00 H new ATOM 0 HB ILE A 74 -19.255 -12.370 -7.196 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -18.214 -13.841 -9.233 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -18.799 -12.458 -10.136 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -19.698 -14.741 -7.696 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -21.194 -13.861 -7.303 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -20.812 -14.256 -8.996 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -16.465 -12.148 -9.472 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -17.505 -10.943 -8.678 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -16.911 -12.348 -7.761 1.00 0.00 H new ATOM 1191 N SER A 75 -22.951 -11.905 -8.114 1.00 0.00 N ATOM 1192 CA SER A 75 -24.147 -11.871 -7.281 1.00 0.00 C ATOM 1193 C SER A 75 -24.744 -13.267 -7.129 1.00 0.00 C ATOM 1194 O SER A 75 -24.973 -13.967 -8.117 1.00 0.00 O ATOM 1195 CB SER A 75 -25.186 -10.923 -7.884 1.00 0.00 C ATOM 1196 OG SER A 75 -25.538 -11.321 -9.197 1.00 0.00 O ATOM 0 H SER A 75 -23.095 -12.302 -9.042 1.00 0.00 H new ATOM 0 HA SER A 75 -23.862 -11.508 -6.294 1.00 0.00 H new ATOM 0 HB2 SER A 75 -26.076 -10.906 -7.255 1.00 0.00 H new ATOM 0 HB3 SER A 75 -24.789 -9.908 -7.902 1.00 0.00 H new ATOM 0 HG SER A 75 -25.438 -12.292 -9.282 1.00 0.00 H new ATOM 1202 N ILE A 76 -24.992 -13.666 -5.886 1.00 0.00 N ATOM 1203 CA ILE A 76 -25.562 -14.977 -5.605 1.00 0.00 C ATOM 1204 C ILE A 76 -26.775 -14.863 -4.688 1.00 0.00 C ATOM 1205 O ILE A 76 -26.688 -15.057 -3.475 1.00 0.00 O ATOM 1206 CB ILE A 76 -24.527 -15.913 -4.954 1.00 0.00 C ATOM 1207 CG1 ILE A 76 -25.172 -17.255 -4.600 1.00 0.00 C ATOM 1208 CG2 ILE A 76 -23.930 -15.263 -3.715 1.00 0.00 C ATOM 1209 CD1 ILE A 76 -25.883 -17.909 -5.764 1.00 0.00 C ATOM 0 H ILE A 76 -24.807 -13.100 -5.058 1.00 0.00 H new ATOM 0 HA ILE A 76 -25.870 -15.399 -6.562 1.00 0.00 H new ATOM 0 HB ILE A 76 -23.724 -16.094 -5.668 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -24.403 -17.932 -4.228 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -25.884 -17.104 -3.788 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -23.200 -15.937 -3.266 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -23.439 -14.331 -3.994 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -24.722 -15.055 -2.996 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -26.316 -18.856 -5.441 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -26.675 -17.251 -6.123 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -25.171 -18.092 -6.569 1.00 0.00 H new ATOM 1221 N PRO A 77 -27.936 -14.544 -5.279 1.00 0.00 N ATOM 1222 CA PRO A 77 -29.191 -14.400 -4.534 1.00 0.00 C ATOM 1223 C PRO A 77 -29.711 -15.734 -4.012 1.00 0.00 C ATOM 1224 O PRO A 77 -29.799 -15.947 -2.802 1.00 0.00 O ATOM 1225 CB PRO A 77 -30.154 -13.818 -5.571 1.00 0.00 C ATOM 1226 CG PRO A 77 -29.608 -14.260 -6.885 1.00 0.00 C ATOM 1227 CD PRO A 77 -28.114 -14.299 -6.720 1.00 0.00 C ATOM 0 HA PRO A 77 -29.070 -13.777 -3.648 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -31.169 -14.186 -5.420 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -30.197 -12.731 -5.505 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -29.996 -15.241 -7.159 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -29.895 -13.571 -7.679 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -27.664 -15.089 -7.321 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -27.651 -13.362 -7.028 1.00 0.00 H new TER 1235 PRO A 77