USER MOD reduce.3.24.130724 H: found=0, std=0, add=1016, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1014 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 56 CYS SG : rot 121:sc= 0.367 USER MOD Set 1.2: A 90 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 29 GLN : amide:sc= -1.02 K(o=-0.57,f=-2.9) USER MOD Set 2.2: A 48 LYS NZ :NH3+ -108:sc= 0.447 (180deg=0) USER MOD Single : A 1 MET CE :methyl -148:sc= -0.134 (180deg=-1.07) USER MOD Single : A 1 MET N :NH3+ -111:sc= 0.173 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -109:sc= 0.778 (180deg=-0.00124) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 50:sc= 0.0271 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot -130:sc= -0.0629 USER MOD Single : A 32 GLN : amide:sc= -0.128 X(o=-0.13,f=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0106) USER MOD Single : A 41 GLN : amide:sc= -0.023 X(o=-0.023,f=-0.15) USER MOD Single : A 45 ASN : amide:sc= 1.06 K(o=1.1,f=-0.43) USER MOD Single : A 51 SER OG : rot 180:sc= 0.0218 USER MOD Single : A 53 ASN : amide:sc= -0.0595 K(o=-0.06,f=-1.7!) USER MOD Single : A 58 HIS : no HD1:sc= 0.425 K(o=1.9,f=-9.5!) USER MOD Single : A 61 SER OG : rot 180:sc=4.64e-06 USER MOD Single : A 62 SER OG : rot -44:sc= 1.29 USER MOD Single : A 63 GLN : amide:sc= -0.0533 X(o=-0.053,f=-0.2) USER MOD Single : A 65 HIS : no HD1:sc= -0.0151 X(o=-0.015,f=-0.015) USER MOD Single : A 67 ASN : amide:sc= 1.07 K(o=1.1,f=-1.5) USER MOD Single : A 68 ASN : amide:sc= -0.402 K(o=-0.4,f=-4.9!) USER MOD Single : A 72 GLN : amide:sc= 0.968 K(o=0.97,f=-1) USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 74 LYS NZ :NH3+ 169:sc= 1.23 (180deg=1.15) USER MOD Single : A 80 SER OG : rot 74:sc= 1.22 USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 160:sc= 0.767 (180deg=0.507) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= -0.0968 K(o=-0.097,f=-0.74) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0.509 USER MOD Single : A 107 GLN : amide:sc= -0.262 X(o=-0.26,f=-0.26) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ -173:sc=-0.00329 (180deg=-0.0925) USER MOD Single : A 116 GLN : amide:sc= -0.126 X(o=-0.13,f=-0.58) USER MOD Single : A 120 SER OG : rot 74:sc= 0.0398 USER MOD Single : A 125 ASN : amide:sc= 0.997 K(o=1,f=-0.03) USER MOD Single : A 126 ASN : amide:sc= -0.0168 X(o=-0.017,f=0) USER MOD Single : A 128 GLN : amide:sc= 1.07 K(o=1.1,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -28.188 19.161 -7.952 1.00 0.00 N ATOM 2 CA MET A 1 -27.226 18.880 -6.877 1.00 0.00 C ATOM 3 C MET A 1 -26.296 20.080 -6.714 1.00 0.00 C ATOM 4 O MET A 1 -26.451 21.081 -7.414 1.00 0.00 O ATOM 5 CB MET A 1 -26.482 17.563 -7.161 1.00 0.00 C ATOM 6 CG MET A 1 -25.843 16.950 -5.907 1.00 0.00 C ATOM 7 SD MET A 1 -26.907 16.956 -4.434 1.00 0.00 S ATOM 8 CE MET A 1 -25.737 17.564 -3.192 1.00 0.00 C ATOM 0 H1 MET A 1 -29.139 19.276 -7.546 1.00 0.00 H new ATOM 0 H2 MET A 1 -27.914 20.035 -8.444 1.00 0.00 H new ATOM 0 H3 MET A 1 -28.194 18.371 -8.628 1.00 0.00 H new ATOM 0 HA MET A 1 -27.740 18.737 -5.927 1.00 0.00 H new ATOM 0 HB2 MET A 1 -27.179 16.845 -7.594 1.00 0.00 H new ATOM 0 HB3 MET A 1 -25.706 17.744 -7.905 1.00 0.00 H new ATOM 0 HG2 MET A 1 -25.556 15.922 -6.127 1.00 0.00 H new ATOM 0 HG3 MET A 1 -24.927 17.495 -5.679 1.00 0.00 H new ATOM 0 HE1 MET A 1 -25.973 17.124 -2.223 1.00 0.00 H new ATOM 0 HE2 MET A 1 -24.723 17.285 -3.480 1.00 0.00 H new ATOM 0 HE3 MET A 1 -25.809 18.650 -3.125 1.00 0.00 H new ATOM 18 N LYS A 2 -25.324 20.014 -5.804 1.00 0.00 N ATOM 19 CA LYS A 2 -24.226 20.960 -5.693 1.00 0.00 C ATOM 20 C LYS A 2 -22.982 20.194 -5.262 1.00 0.00 C ATOM 21 O LYS A 2 -23.082 19.076 -4.748 1.00 0.00 O ATOM 22 CB LYS A 2 -24.557 22.043 -4.646 1.00 0.00 C ATOM 23 CG LYS A 2 -24.992 23.401 -5.224 1.00 0.00 C ATOM 24 CD LYS A 2 -23.875 24.130 -5.988 1.00 0.00 C ATOM 25 CE LYS A 2 -22.691 24.499 -5.077 1.00 0.00 C ATOM 26 NZ LYS A 2 -21.471 24.823 -5.843 1.00 0.00 N ATOM 0 H LYS A 2 -25.283 19.274 -5.103 1.00 0.00 H new ATOM 0 HA LYS A 2 -24.060 21.449 -6.653 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -25.351 21.670 -3.999 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -23.680 22.198 -4.017 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -25.838 23.247 -5.893 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -25.340 24.038 -4.411 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -23.521 23.497 -6.802 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -24.278 25.036 -6.441 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -22.965 25.353 -4.457 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -22.483 23.669 -4.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -20.772 24.062 -5.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -21.709 24.917 -6.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -21.071 25.719 -5.497 1.00 0.00 H new ATOM 40 N ALA A 3 -21.819 20.809 -5.459 1.00 0.00 N ATOM 41 CA ALA A 3 -20.545 20.307 -4.994 1.00 0.00 C ATOM 42 C ALA A 3 -19.689 21.500 -4.579 1.00 0.00 C ATOM 43 O ALA A 3 -19.703 22.549 -5.235 1.00 0.00 O ATOM 44 CB ALA A 3 -19.866 19.487 -6.093 1.00 0.00 C ATOM 0 H ALA A 3 -21.743 21.694 -5.961 1.00 0.00 H new ATOM 0 HA ALA A 3 -20.683 19.646 -4.138 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -18.908 19.115 -5.730 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -20.503 18.645 -6.365 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -19.703 20.116 -6.968 1.00 0.00 H new ATOM 50 N LEU A 4 -18.939 21.331 -3.499 1.00 0.00 N ATOM 51 CA LEU A 4 -17.946 22.245 -2.958 1.00 0.00 C ATOM 52 C LEU A 4 -17.119 21.363 -2.039 1.00 0.00 C ATOM 53 O LEU A 4 -17.595 20.979 -0.969 1.00 0.00 O ATOM 54 CB LEU A 4 -18.593 23.423 -2.206 1.00 0.00 C ATOM 55 CG LEU A 4 -17.625 24.516 -1.693 1.00 0.00 C ATOM 56 CD1 LEU A 4 -16.775 24.107 -0.486 1.00 0.00 C ATOM 57 CD2 LEU A 4 -16.706 25.050 -2.801 1.00 0.00 C ATOM 0 H LEU A 4 -19.016 20.484 -2.935 1.00 0.00 H new ATOM 0 HA LEU A 4 -17.346 22.722 -3.733 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -19.322 23.893 -2.866 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -19.144 23.025 -1.354 1.00 0.00 H new ATOM 0 HG LEU A 4 -18.294 25.308 -1.357 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -16.129 24.936 -0.198 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -17.428 23.849 0.348 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -16.163 23.244 -0.748 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -16.046 25.814 -2.390 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -16.108 24.232 -3.203 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -17.311 25.483 -3.598 1.00 0.00 H new ATOM 69 N GLU A 5 -15.932 20.992 -2.505 1.00 0.00 N ATOM 70 CA GLU A 5 -15.001 20.058 -1.891 1.00 0.00 C ATOM 71 C GLU A 5 -15.511 18.621 -2.057 1.00 0.00 C ATOM 72 O GLU A 5 -16.716 18.346 -2.059 1.00 0.00 O ATOM 73 CB GLU A 5 -14.746 20.404 -0.415 1.00 0.00 C ATOM 74 CG GLU A 5 -13.404 19.876 0.097 1.00 0.00 C ATOM 75 CD GLU A 5 -13.370 19.803 1.623 1.00 0.00 C ATOM 76 OE1 GLU A 5 -13.846 20.744 2.301 1.00 0.00 O ATOM 77 OE2 GLU A 5 -12.896 18.764 2.137 1.00 0.00 O ATOM 0 H GLU A 5 -15.571 21.363 -3.384 1.00 0.00 H new ATOM 0 HA GLU A 5 -14.042 20.141 -2.402 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -14.776 21.486 -0.290 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -15.550 19.990 0.194 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -13.220 18.885 -0.319 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -12.600 20.523 -0.254 1.00 0.00 H new ATOM 84 N HIS A 6 -14.578 17.683 -2.162 1.00 0.00 N ATOM 85 CA HIS A 6 -14.810 16.250 -2.220 1.00 0.00 C ATOM 86 C HIS A 6 -13.867 15.570 -1.243 1.00 0.00 C ATOM 87 O HIS A 6 -14.314 14.832 -0.375 1.00 0.00 O ATOM 88 CB HIS A 6 -14.617 15.728 -3.651 1.00 0.00 C ATOM 89 CG HIS A 6 -15.539 16.395 -4.639 1.00 0.00 C ATOM 90 ND1 HIS A 6 -15.263 17.544 -5.357 1.00 0.00 N ATOM 91 CD2 HIS A 6 -16.811 16.000 -4.939 1.00 0.00 C ATOM 92 CE1 HIS A 6 -16.349 17.836 -6.093 1.00 0.00 C ATOM 93 NE2 HIS A 6 -17.299 16.910 -5.855 1.00 0.00 N ATOM 0 H HIS A 6 -13.586 17.917 -2.211 1.00 0.00 H new ATOM 0 HA HIS A 6 -15.838 16.025 -1.938 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -13.583 15.890 -3.957 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -14.789 14.652 -3.668 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -17.333 15.144 -4.538 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -16.445 18.676 -6.765 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -18.225 16.886 -6.281 1.00 0.00 H new ATOM 102 N GLU A 7 -12.565 15.839 -1.345 1.00 0.00 N ATOM 103 CA GLU A 7 -11.539 15.186 -0.525 1.00 0.00 C ATOM 104 C GLU A 7 -10.452 16.214 -0.184 1.00 0.00 C ATOM 105 O GLU A 7 -9.267 15.884 -0.107 1.00 0.00 O ATOM 106 CB GLU A 7 -10.951 13.965 -1.265 1.00 0.00 C ATOM 107 CG GLU A 7 -11.989 13.046 -1.933 1.00 0.00 C ATOM 108 CD GLU A 7 -11.367 11.748 -2.447 1.00 0.00 C ATOM 109 OE1 GLU A 7 -10.779 10.999 -1.632 1.00 0.00 O ATOM 110 OE2 GLU A 7 -11.476 11.468 -3.664 1.00 0.00 O ATOM 0 H GLU A 7 -12.188 16.521 -2.003 1.00 0.00 H new ATOM 0 HA GLU A 7 -11.981 14.818 0.401 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -10.259 14.321 -2.028 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -10.369 13.376 -0.556 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -12.777 12.811 -1.217 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -12.459 13.575 -2.762 1.00 0.00 H new ATOM 117 N LYS A 8 -10.851 17.476 0.018 1.00 0.00 N ATOM 118 CA LYS A 8 -9.990 18.635 0.214 1.00 0.00 C ATOM 119 C LYS A 8 -9.270 18.836 -1.115 1.00 0.00 C ATOM 120 O LYS A 8 -9.809 19.510 -1.993 1.00 0.00 O ATOM 121 CB LYS A 8 -9.124 18.483 1.479 1.00 0.00 C ATOM 122 CG LYS A 8 -8.895 19.825 2.165 1.00 0.00 C ATOM 123 CD LYS A 8 -8.028 20.810 1.381 1.00 0.00 C ATOM 124 CE LYS A 8 -7.740 22.029 2.261 1.00 0.00 C ATOM 125 NZ LYS A 8 -8.901 22.938 2.379 1.00 0.00 N ATOM 0 H LYS A 8 -11.840 17.723 0.050 1.00 0.00 H new ATOM 0 HA LYS A 8 -10.526 19.557 0.438 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -9.609 17.797 2.173 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -8.164 18.041 1.213 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -9.863 20.288 2.356 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -8.430 19.646 3.134 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -7.095 20.334 1.080 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -8.538 21.117 0.468 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -7.445 21.692 3.255 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -6.895 22.579 1.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -8.650 23.745 2.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -9.168 23.284 1.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -9.702 22.425 2.800 1.00 0.00 H new ATOM 139 N THR A 9 -8.120 18.212 -1.303 1.00 0.00 N ATOM 140 CA THR A 9 -7.371 18.171 -2.530 1.00 0.00 C ATOM 141 C THR A 9 -7.243 16.700 -2.945 1.00 0.00 C ATOM 142 O THR A 9 -6.236 16.057 -2.633 1.00 0.00 O ATOM 143 CB THR A 9 -6.023 18.864 -2.325 1.00 0.00 C ATOM 144 OG1 THR A 9 -5.430 18.478 -1.092 1.00 0.00 O ATOM 145 CG2 THR A 9 -6.230 20.368 -2.233 1.00 0.00 C ATOM 0 H THR A 9 -7.664 17.692 -0.553 1.00 0.00 H new ATOM 0 HA THR A 9 -7.870 18.708 -3.336 1.00 0.00 H new ATOM 0 HB THR A 9 -5.388 18.584 -3.165 1.00 0.00 H new ATOM 0 HG1 THR A 9 -5.436 17.501 -1.018 1.00 0.00 H new ATOM 0 HG21 THR A 9 -5.268 20.859 -2.087 1.00 0.00 H new ATOM 0 HG22 THR A 9 -6.686 20.730 -3.155 1.00 0.00 H new ATOM 0 HG23 THR A 9 -6.885 20.594 -1.391 1.00 0.00 H new ATOM 153 N PRO A 10 -8.240 16.104 -3.620 1.00 0.00 N ATOM 154 CA PRO A 10 -8.082 14.758 -4.148 1.00 0.00 C ATOM 155 C PRO A 10 -6.908 14.721 -5.128 1.00 0.00 C ATOM 156 O PRO A 10 -6.263 13.689 -5.277 1.00 0.00 O ATOM 157 CB PRO A 10 -9.404 14.387 -4.821 1.00 0.00 C ATOM 158 CG PRO A 10 -10.121 15.721 -5.007 1.00 0.00 C ATOM 159 CD PRO A 10 -9.569 16.609 -3.893 1.00 0.00 C ATOM 0 HA PRO A 10 -7.857 14.037 -3.362 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -9.238 13.888 -5.776 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -9.987 13.705 -4.203 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -9.920 16.146 -5.990 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -11.202 15.606 -4.924 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -9.536 17.653 -4.203 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -10.198 16.560 -3.004 1.00 0.00 H new ATOM 167 N GLU A 11 -6.551 15.863 -5.718 1.00 0.00 N ATOM 168 CA GLU A 11 -5.429 15.966 -6.634 1.00 0.00 C ATOM 169 C GLU A 11 -4.089 15.895 -5.913 1.00 0.00 C ATOM 170 O GLU A 11 -3.052 15.821 -6.563 1.00 0.00 O ATOM 171 CB GLU A 11 -5.491 17.281 -7.405 1.00 0.00 C ATOM 172 CG GLU A 11 -6.801 17.505 -8.166 1.00 0.00 C ATOM 173 CD GLU A 11 -7.681 18.502 -7.423 1.00 0.00 C ATOM 174 OE1 GLU A 11 -8.156 18.212 -6.300 1.00 0.00 O ATOM 175 OE2 GLU A 11 -7.875 19.626 -7.939 1.00 0.00 O ATOM 0 H GLU A 11 -7.040 16.745 -5.568 1.00 0.00 H new ATOM 0 HA GLU A 11 -5.505 15.119 -7.316 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -5.345 18.105 -6.707 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -4.663 17.313 -8.113 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -6.588 17.875 -9.169 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -7.329 16.558 -8.281 1.00 0.00 H new ATOM 182 N LEU A 12 -4.080 16.046 -4.591 1.00 0.00 N ATOM 183 CA LEU A 12 -2.910 15.865 -3.742 1.00 0.00 C ATOM 184 C LEU A 12 -2.963 14.417 -3.268 1.00 0.00 C ATOM 185 O LEU A 12 -2.008 13.674 -3.435 1.00 0.00 O ATOM 186 CB LEU A 12 -2.913 16.846 -2.552 1.00 0.00 C ATOM 187 CG LEU A 12 -1.590 16.982 -1.761 1.00 0.00 C ATOM 188 CD1 LEU A 12 -0.964 15.669 -1.274 1.00 0.00 C ATOM 189 CD2 LEU A 12 -0.534 17.736 -2.567 1.00 0.00 C ATOM 0 H LEU A 12 -4.915 16.306 -4.066 1.00 0.00 H new ATOM 0 HA LEU A 12 -1.990 16.072 -4.289 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -3.190 17.832 -2.925 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -3.694 16.537 -1.858 1.00 0.00 H new ATOM 0 HG LEU A 12 -1.891 17.537 -0.872 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -0.043 15.884 -0.733 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -1.662 15.156 -0.612 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -0.742 15.032 -2.130 1.00 0.00 H new ATOM 0 HD21 LEU A 12 0.383 17.814 -1.983 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.330 17.198 -3.492 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -0.901 18.735 -2.802 1.00 0.00 H new ATOM 201 N ALA A 13 -4.099 13.981 -2.719 1.00 0.00 N ATOM 202 CA ALA A 13 -4.238 12.667 -2.112 1.00 0.00 C ATOM 203 C ALA A 13 -4.033 11.538 -3.119 1.00 0.00 C ATOM 204 O ALA A 13 -3.444 10.511 -2.770 1.00 0.00 O ATOM 205 CB ALA A 13 -5.614 12.571 -1.445 1.00 0.00 C ATOM 0 H ALA A 13 -4.952 14.539 -2.686 1.00 0.00 H new ATOM 0 HA ALA A 13 -3.456 12.548 -1.361 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -5.728 11.589 -0.987 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -5.702 13.341 -0.679 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -6.392 12.714 -2.194 1.00 0.00 H new ATOM 211 N ALA A 14 -4.478 11.721 -4.363 1.00 0.00 N ATOM 212 CA ALA A 14 -4.216 10.743 -5.404 1.00 0.00 C ATOM 213 C ALA A 14 -2.828 10.961 -6.010 1.00 0.00 C ATOM 214 O ALA A 14 -2.213 9.991 -6.439 1.00 0.00 O ATOM 215 CB ALA A 14 -5.332 10.747 -6.433 1.00 0.00 C ATOM 0 H ALA A 14 -5.017 12.532 -4.666 1.00 0.00 H new ATOM 0 HA ALA A 14 -4.206 9.744 -4.968 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -5.118 10.008 -7.205 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -6.276 10.501 -5.947 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.405 11.735 -6.887 1.00 0.00 H new ATOM 221 N LYS A 15 -2.288 12.190 -6.035 1.00 0.00 N ATOM 222 CA LYS A 15 -0.905 12.390 -6.473 1.00 0.00 C ATOM 223 C LYS A 15 0.034 11.686 -5.514 1.00 0.00 C ATOM 224 O LYS A 15 1.015 11.112 -5.961 1.00 0.00 O ATOM 225 CB LYS A 15 -0.515 13.871 -6.539 1.00 0.00 C ATOM 226 CG LYS A 15 -0.762 14.490 -7.916 1.00 0.00 C ATOM 227 CD LYS A 15 0.143 13.882 -8.994 1.00 0.00 C ATOM 228 CE LYS A 15 0.325 14.879 -10.145 1.00 0.00 C ATOM 229 NZ LYS A 15 1.327 14.439 -11.133 1.00 0.00 N ATOM 0 H LYS A 15 -2.779 13.042 -5.762 1.00 0.00 H new ATOM 0 HA LYS A 15 -0.825 11.977 -7.479 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -1.082 14.425 -5.790 1.00 0.00 H new ATOM 0 HB3 LYS A 15 0.539 13.976 -6.283 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -1.805 14.345 -8.196 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -0.592 15.565 -7.865 1.00 0.00 H new ATOM 0 HD2 LYS A 15 1.112 13.626 -8.566 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -0.294 12.956 -9.369 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -0.632 15.026 -10.646 1.00 0.00 H new ATOM 0 HE3 LYS A 15 0.623 15.845 -9.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 1.407 15.151 -11.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 2.249 14.324 -10.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 1.033 13.531 -11.545 1.00 0.00 H new ATOM 243 N LEU A 16 -0.278 11.680 -4.221 1.00 0.00 N ATOM 244 CA LEU A 16 0.511 10.978 -3.232 1.00 0.00 C ATOM 245 C LEU A 16 0.513 9.485 -3.575 1.00 0.00 C ATOM 246 O LEU A 16 1.549 8.833 -3.473 1.00 0.00 O ATOM 247 CB LEU A 16 -0.065 11.288 -1.843 1.00 0.00 C ATOM 248 CG LEU A 16 0.716 10.617 -0.706 1.00 0.00 C ATOM 249 CD1 LEU A 16 2.142 11.164 -0.634 1.00 0.00 C ATOM 250 CD2 LEU A 16 -0.015 10.863 0.621 1.00 0.00 C ATOM 0 H LEU A 16 -1.088 12.165 -3.836 1.00 0.00 H new ATOM 0 HA LEU A 16 1.551 11.303 -3.229 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.065 12.367 -1.689 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.104 10.960 -1.805 1.00 0.00 H new ATOM 0 HG LEU A 16 0.775 9.546 -0.897 1.00 0.00 H new ATOM 0 HD11 LEU A 16 2.679 10.675 0.179 1.00 0.00 H new ATOM 0 HD12 LEU A 16 2.654 10.969 -1.576 1.00 0.00 H new ATOM 0 HD13 LEU A 16 2.111 12.238 -0.453 1.00 0.00 H new ATOM 0 HD21 LEU A 16 0.536 10.388 1.433 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.082 11.935 0.806 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -1.018 10.441 0.567 1.00 0.00 H new ATOM 262 N ALA A 17 -0.633 8.944 -4.011 1.00 0.00 N ATOM 263 CA ALA A 17 -0.729 7.581 -4.492 1.00 0.00 C ATOM 264 C ALA A 17 0.124 7.393 -5.748 1.00 0.00 C ATOM 265 O ALA A 17 0.816 6.391 -5.845 1.00 0.00 O ATOM 266 CB ALA A 17 -2.185 7.182 -4.758 1.00 0.00 C ATOM 0 H ALA A 17 -1.517 9.452 -4.035 1.00 0.00 H new ATOM 0 HA ALA A 17 -0.345 6.924 -3.712 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -2.221 6.154 -5.118 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -2.759 7.264 -3.835 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.612 7.845 -5.511 1.00 0.00 H new ATOM 272 N ALA A 18 0.087 8.328 -6.701 1.00 0.00 N ATOM 273 CA ALA A 18 0.841 8.262 -7.948 1.00 0.00 C ATOM 274 C ALA A 18 2.352 8.271 -7.693 1.00 0.00 C ATOM 275 O ALA A 18 3.071 7.455 -8.265 1.00 0.00 O ATOM 276 CB ALA A 18 0.436 9.422 -8.861 1.00 0.00 C ATOM 0 H ALA A 18 -0.483 9.170 -6.622 1.00 0.00 H new ATOM 0 HA ALA A 18 0.603 7.320 -8.443 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.002 9.368 -9.791 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -0.630 9.357 -9.081 1.00 0.00 H new ATOM 0 HB3 ALA A 18 0.647 10.368 -8.362 1.00 0.00 H new ATOM 282 N GLU A 19 2.831 9.168 -6.830 1.00 0.00 N ATOM 283 CA GLU A 19 4.225 9.256 -6.402 1.00 0.00 C ATOM 284 C GLU A 19 4.642 7.938 -5.742 1.00 0.00 C ATOM 285 O GLU A 19 5.743 7.447 -5.980 1.00 0.00 O ATOM 286 CB GLU A 19 4.396 10.418 -5.403 1.00 0.00 C ATOM 287 CG GLU A 19 4.233 11.828 -5.989 1.00 0.00 C ATOM 288 CD GLU A 19 5.466 12.302 -6.757 1.00 0.00 C ATOM 289 OE1 GLU A 19 6.360 12.936 -6.155 1.00 0.00 O ATOM 290 OE2 GLU A 19 5.516 12.128 -7.995 1.00 0.00 O ATOM 0 H GLU A 19 2.238 9.876 -6.396 1.00 0.00 H new ATOM 0 HA GLU A 19 4.857 9.441 -7.271 1.00 0.00 H new ATOM 0 HB2 GLU A 19 3.670 10.292 -4.600 1.00 0.00 H new ATOM 0 HB3 GLU A 19 5.386 10.344 -4.953 1.00 0.00 H new ATOM 0 HG2 GLU A 19 3.370 11.841 -6.655 1.00 0.00 H new ATOM 0 HG3 GLU A 19 4.023 12.529 -5.181 1.00 0.00 H new ATOM 297 N ALA A 20 3.759 7.347 -4.931 1.00 0.00 N ATOM 298 CA ALA A 20 4.000 6.064 -4.302 1.00 0.00 C ATOM 299 C ALA A 20 4.071 4.958 -5.334 1.00 0.00 C ATOM 300 O ALA A 20 5.006 4.178 -5.304 1.00 0.00 O ATOM 301 CB ALA A 20 2.929 5.775 -3.246 1.00 0.00 C ATOM 0 H ALA A 20 2.854 7.756 -4.697 1.00 0.00 H new ATOM 0 HA ALA A 20 4.966 6.104 -3.799 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.125 4.808 -2.784 1.00 0.00 H new ATOM 0 HB2 ALA A 20 2.951 6.553 -2.483 1.00 0.00 H new ATOM 0 HB3 ALA A 20 1.947 5.758 -3.719 1.00 0.00 H new ATOM 307 N ILE A 21 3.118 4.894 -6.255 1.00 0.00 N ATOM 308 CA ILE A 21 3.058 3.904 -7.325 1.00 0.00 C ATOM 309 C ILE A 21 4.302 4.009 -8.211 1.00 0.00 C ATOM 310 O ILE A 21 4.775 3.010 -8.751 1.00 0.00 O ATOM 311 CB ILE A 21 1.741 4.159 -8.113 1.00 0.00 C ATOM 312 CG1 ILE A 21 0.547 3.554 -7.344 1.00 0.00 C ATOM 313 CG2 ILE A 21 1.761 3.708 -9.584 1.00 0.00 C ATOM 314 CD1 ILE A 21 -0.811 4.110 -7.787 1.00 0.00 C ATOM 0 H ILE A 21 2.339 5.552 -6.279 1.00 0.00 H new ATOM 0 HA ILE A 21 3.050 2.887 -6.932 1.00 0.00 H new ATOM 0 HB ILE A 21 1.631 5.242 -8.175 1.00 0.00 H new ATOM 0 HG12 ILE A 21 0.549 2.472 -7.478 1.00 0.00 H new ATOM 0 HG13 ILE A 21 0.678 3.743 -6.279 1.00 0.00 H new ATOM 0 HG21 ILE A 21 0.798 3.929 -10.045 1.00 0.00 H new ATOM 0 HG22 ILE A 21 2.549 4.240 -10.117 1.00 0.00 H new ATOM 0 HG23 ILE A 21 1.949 2.636 -9.633 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -1.604 3.641 -7.205 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -0.833 5.188 -7.627 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -0.964 3.897 -8.845 1.00 0.00 H new ATOM 326 N GLU A 22 4.860 5.206 -8.370 1.00 0.00 N ATOM 327 CA GLU A 22 6.038 5.411 -9.190 1.00 0.00 C ATOM 328 C GLU A 22 7.258 4.743 -8.524 1.00 0.00 C ATOM 329 O GLU A 22 8.224 4.417 -9.213 1.00 0.00 O ATOM 330 CB GLU A 22 6.225 6.926 -9.361 1.00 0.00 C ATOM 331 CG GLU A 22 7.409 7.325 -10.246 1.00 0.00 C ATOM 332 CD GLU A 22 7.146 6.960 -11.705 1.00 0.00 C ATOM 333 OE1 GLU A 22 6.101 7.388 -12.252 1.00 0.00 O ATOM 334 OE2 GLU A 22 7.965 6.215 -12.294 1.00 0.00 O ATOM 0 H GLU A 22 4.505 6.056 -7.933 1.00 0.00 H new ATOM 0 HA GLU A 22 5.927 4.954 -10.173 1.00 0.00 H new ATOM 0 HB2 GLU A 22 5.313 7.346 -9.785 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.356 7.376 -8.377 1.00 0.00 H new ATOM 0 HG2 GLU A 22 7.586 8.397 -10.161 1.00 0.00 H new ATOM 0 HG3 GLU A 22 8.313 6.824 -9.899 1.00 0.00 H new ATOM 341 N ARG A 23 7.208 4.484 -7.212 1.00 0.00 N ATOM 342 CA ARG A 23 8.329 3.980 -6.426 1.00 0.00 C ATOM 343 C ARG A 23 8.076 2.566 -5.883 1.00 0.00 C ATOM 344 O ARG A 23 9.031 1.819 -5.679 1.00 0.00 O ATOM 345 CB ARG A 23 8.549 4.983 -5.279 1.00 0.00 C ATOM 346 CG ARG A 23 10.015 5.073 -4.848 1.00 0.00 C ATOM 347 CD ARG A 23 10.125 5.804 -3.507 1.00 0.00 C ATOM 348 NE ARG A 23 11.507 6.138 -3.135 1.00 0.00 N ATOM 349 CZ ARG A 23 12.470 5.310 -2.715 1.00 0.00 C ATOM 350 NH1 ARG A 23 12.286 3.996 -2.652 1.00 0.00 N ATOM 351 NH2 ARG A 23 13.637 5.814 -2.338 1.00 0.00 N ATOM 0 H ARG A 23 6.363 4.624 -6.658 1.00 0.00 H new ATOM 0 HA ARG A 23 9.216 3.895 -7.054 1.00 0.00 H new ATOM 0 HB2 ARG A 23 8.205 5.969 -5.593 1.00 0.00 H new ATOM 0 HB3 ARG A 23 7.940 4.690 -4.424 1.00 0.00 H new ATOM 0 HG2 ARG A 23 10.439 4.073 -4.762 1.00 0.00 H new ATOM 0 HG3 ARG A 23 10.594 5.600 -5.607 1.00 0.00 H new ATOM 0 HD2 ARG A 23 9.537 6.721 -3.552 1.00 0.00 H new ATOM 0 HD3 ARG A 23 9.687 5.183 -2.726 1.00 0.00 H new ATOM 0 HE ARG A 23 11.764 7.123 -3.206 1.00 0.00 H new ATOM 0 HH11 ARG A 23 11.391 3.593 -2.928 1.00 0.00 H new ATOM 0 HH12 ARG A 23 13.040 3.390 -2.327 1.00 0.00 H new ATOM 0 HH21 ARG A 23 13.792 6.822 -2.370 1.00 0.00 H new ATOM 0 HH22 ARG A 23 14.380 5.194 -2.016 1.00 0.00 H new ATOM 365 N ASP A 24 6.825 2.202 -5.609 1.00 0.00 N ATOM 366 CA ASP A 24 6.399 0.950 -4.992 1.00 0.00 C ATOM 367 C ASP A 24 5.883 0.010 -6.076 1.00 0.00 C ATOM 368 O ASP A 24 4.804 0.263 -6.632 1.00 0.00 O ATOM 369 CB ASP A 24 5.257 1.160 -3.985 1.00 0.00 C ATOM 370 CG ASP A 24 4.795 -0.163 -3.350 1.00 0.00 C ATOM 371 OD1 ASP A 24 5.440 -1.219 -3.543 1.00 0.00 O ATOM 372 OD2 ASP A 24 3.704 -0.177 -2.746 1.00 0.00 O ATOM 0 H ASP A 24 6.035 2.810 -5.825 1.00 0.00 H new ATOM 0 HA ASP A 24 7.262 0.537 -4.469 1.00 0.00 H new ATOM 0 HB2 ASP A 24 5.586 1.842 -3.201 1.00 0.00 H new ATOM 0 HB3 ASP A 24 4.414 1.634 -4.487 1.00 0.00 H new ATOM 377 N PRO A 25 6.587 -1.094 -6.375 1.00 0.00 N ATOM 378 CA PRO A 25 6.086 -2.038 -7.345 1.00 0.00 C ATOM 379 C PRO A 25 4.736 -2.625 -6.944 1.00 0.00 C ATOM 380 O PRO A 25 3.904 -2.813 -7.833 1.00 0.00 O ATOM 381 CB PRO A 25 7.161 -3.118 -7.505 1.00 0.00 C ATOM 382 CG PRO A 25 8.048 -2.969 -6.267 1.00 0.00 C ATOM 383 CD PRO A 25 7.882 -1.508 -5.853 1.00 0.00 C ATOM 0 HA PRO A 25 5.898 -1.539 -8.296 1.00 0.00 H new ATOM 0 HB2 PRO A 25 6.718 -4.113 -7.558 1.00 0.00 H new ATOM 0 HB3 PRO A 25 7.733 -2.975 -8.422 1.00 0.00 H new ATOM 0 HG2 PRO A 25 7.736 -3.645 -5.471 1.00 0.00 H new ATOM 0 HG3 PRO A 25 9.088 -3.202 -6.493 1.00 0.00 H new ATOM 0 HD2 PRO A 25 7.919 -1.402 -4.769 1.00 0.00 H new ATOM 0 HD3 PRO A 25 8.683 -0.892 -6.261 1.00 0.00 H new ATOM 391 N TRP A 26 4.487 -2.917 -5.662 1.00 0.00 N ATOM 392 CA TRP A 26 3.225 -3.532 -5.272 1.00 0.00 C ATOM 393 C TRP A 26 2.082 -2.524 -5.387 1.00 0.00 C ATOM 394 O TRP A 26 1.040 -2.898 -5.920 1.00 0.00 O ATOM 395 CB TRP A 26 3.304 -4.154 -3.877 1.00 0.00 C ATOM 396 CG TRP A 26 2.041 -4.816 -3.400 1.00 0.00 C ATOM 397 CD1 TRP A 26 1.398 -4.464 -2.273 1.00 0.00 C ATOM 398 CD2 TRP A 26 1.265 -5.925 -3.957 1.00 0.00 C ATOM 399 NE1 TRP A 26 0.270 -5.241 -2.094 1.00 0.00 N ATOM 400 CE2 TRP A 26 0.152 -6.181 -3.100 1.00 0.00 C ATOM 401 CE3 TRP A 26 1.405 -6.773 -5.076 1.00 0.00 C ATOM 402 CZ2 TRP A 26 -0.764 -7.216 -3.353 1.00 0.00 C ATOM 403 CZ3 TRP A 26 0.566 -7.884 -5.279 1.00 0.00 C ATOM 404 CH2 TRP A 26 -0.539 -8.088 -4.434 1.00 0.00 C ATOM 0 H TRP A 26 5.133 -2.739 -4.893 1.00 0.00 H new ATOM 0 HA TRP A 26 3.019 -4.350 -5.962 1.00 0.00 H new ATOM 0 HB2 TRP A 26 4.107 -4.891 -3.870 1.00 0.00 H new ATOM 0 HB3 TRP A 26 3.579 -3.376 -3.165 1.00 0.00 H new ATOM 0 HD1 TRP A 26 1.719 -3.682 -1.601 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -0.388 -5.135 -1.322 1.00 0.00 H new ATOM 0 HE3 TRP A 26 2.180 -6.563 -5.799 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -1.633 -7.341 -2.724 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 0.770 -8.578 -6.081 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -1.213 -8.912 -4.614 1.00 0.00 H new ATOM 415 N ALA A 27 2.237 -1.259 -4.973 1.00 0.00 N ATOM 416 CA ALA A 27 1.170 -0.277 -5.159 1.00 0.00 C ATOM 417 C ALA A 27 0.822 -0.146 -6.633 1.00 0.00 C ATOM 418 O ALA A 27 -0.371 -0.117 -6.956 1.00 0.00 O ATOM 419 CB ALA A 27 1.521 1.108 -4.614 1.00 0.00 C ATOM 0 H ALA A 27 3.075 -0.900 -4.516 1.00 0.00 H new ATOM 0 HA ALA A 27 0.318 -0.651 -4.592 1.00 0.00 H new ATOM 0 HB1 ALA A 27 0.687 1.788 -4.784 1.00 0.00 H new ATOM 0 HB2 ALA A 27 1.720 1.038 -3.545 1.00 0.00 H new ATOM 0 HB3 ALA A 27 2.407 1.486 -5.124 1.00 0.00 H new ATOM 425 N ALA A 28 1.833 -0.079 -7.508 1.00 0.00 N ATOM 426 CA ALA A 28 1.616 0.018 -8.941 1.00 0.00 C ATOM 427 C ALA A 28 0.832 -1.191 -9.422 1.00 0.00 C ATOM 428 O ALA A 28 -0.152 -1.040 -10.142 1.00 0.00 O ATOM 429 CB ALA A 28 2.965 0.111 -9.661 1.00 0.00 C ATOM 0 H ALA A 28 2.816 -0.091 -7.236 1.00 0.00 H new ATOM 0 HA ALA A 28 1.040 0.916 -9.165 1.00 0.00 H new ATOM 0 HB1 ALA A 28 2.799 0.184 -10.736 1.00 0.00 H new ATOM 0 HB2 ALA A 28 3.501 0.995 -9.316 1.00 0.00 H new ATOM 0 HB3 ALA A 28 3.555 -0.779 -9.444 1.00 0.00 H new ATOM 435 N GLN A 29 1.230 -2.381 -8.977 1.00 0.00 N ATOM 436 CA GLN A 29 0.553 -3.618 -9.307 1.00 0.00 C ATOM 437 C GLN A 29 -0.902 -3.539 -8.845 1.00 0.00 C ATOM 438 O GLN A 29 -1.795 -3.742 -9.654 1.00 0.00 O ATOM 439 CB GLN A 29 1.325 -4.808 -8.716 1.00 0.00 C ATOM 440 CG GLN A 29 2.602 -5.082 -9.528 1.00 0.00 C ATOM 441 CD GLN A 29 3.530 -6.123 -8.899 1.00 0.00 C ATOM 442 OE1 GLN A 29 3.562 -6.320 -7.689 1.00 0.00 O ATOM 443 NE2 GLN A 29 4.292 -6.843 -9.703 1.00 0.00 N ATOM 0 H GLN A 29 2.041 -2.507 -8.371 1.00 0.00 H new ATOM 0 HA GLN A 29 0.532 -3.773 -10.386 1.00 0.00 H new ATOM 0 HB2 GLN A 29 1.585 -4.600 -7.678 1.00 0.00 H new ATOM 0 HB3 GLN A 29 0.691 -5.695 -8.714 1.00 0.00 H new ATOM 0 HG2 GLN A 29 2.320 -5.418 -10.526 1.00 0.00 H new ATOM 0 HG3 GLN A 29 3.150 -4.148 -9.649 1.00 0.00 H new ATOM 0 HE21 GLN A 29 4.267 -6.681 -10.710 1.00 0.00 H new ATOM 0 HE22 GLN A 29 4.905 -7.561 -9.317 1.00 0.00 H new ATOM 452 N VAL A 30 -1.191 -3.193 -7.589 1.00 0.00 N ATOM 453 CA VAL A 30 -2.569 -3.187 -7.088 1.00 0.00 C ATOM 454 C VAL A 30 -3.440 -2.216 -7.885 1.00 0.00 C ATOM 455 O VAL A 30 -4.593 -2.536 -8.191 1.00 0.00 O ATOM 456 CB VAL A 30 -2.595 -2.860 -5.574 1.00 0.00 C ATOM 457 CG1 VAL A 30 -4.016 -2.713 -5.001 1.00 0.00 C ATOM 458 CG2 VAL A 30 -1.904 -3.954 -4.759 1.00 0.00 C ATOM 0 H VAL A 30 -0.492 -2.914 -6.901 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.987 -4.184 -7.223 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.073 -1.906 -5.491 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -3.957 -2.484 -3.937 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.535 -1.905 -5.518 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -4.563 -3.645 -5.142 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.939 -3.696 -3.701 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -2.415 -4.904 -4.918 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -0.865 -4.043 -5.077 1.00 0.00 H new ATOM 468 N SER A 31 -2.912 -1.047 -8.235 1.00 0.00 N ATOM 469 CA SER A 31 -3.615 -0.068 -9.049 1.00 0.00 C ATOM 470 C SER A 31 -3.726 -0.499 -10.518 1.00 0.00 C ATOM 471 O SER A 31 -4.644 -0.049 -11.203 1.00 0.00 O ATOM 472 CB SER A 31 -2.894 1.270 -8.881 1.00 0.00 C ATOM 473 OG SER A 31 -3.266 1.838 -7.635 1.00 0.00 O ATOM 0 H SER A 31 -1.976 -0.753 -7.958 1.00 0.00 H new ATOM 0 HA SER A 31 -4.648 0.024 -8.713 1.00 0.00 H new ATOM 0 HB2 SER A 31 -1.815 1.124 -8.922 1.00 0.00 H new ATOM 0 HB3 SER A 31 -3.156 1.945 -9.696 1.00 0.00 H new ATOM 0 HG SER A 31 -3.543 2.768 -7.769 1.00 0.00 H new ATOM 479 N GLN A 32 -2.864 -1.395 -10.998 1.00 0.00 N ATOM 480 CA GLN A 32 -2.918 -1.971 -12.333 1.00 0.00 C ATOM 481 C GLN A 32 -3.960 -3.091 -12.384 1.00 0.00 C ATOM 482 O GLN A 32 -4.637 -3.251 -13.402 1.00 0.00 O ATOM 483 CB GLN A 32 -1.509 -2.484 -12.672 1.00 0.00 C ATOM 484 CG GLN A 32 -1.326 -3.157 -14.036 1.00 0.00 C ATOM 485 CD GLN A 32 0.041 -3.831 -14.120 1.00 0.00 C ATOM 486 OE1 GLN A 32 0.162 -4.980 -14.547 1.00 0.00 O ATOM 487 NE2 GLN A 32 1.107 -3.147 -13.728 1.00 0.00 N ATOM 0 H GLN A 32 -2.083 -1.749 -10.445 1.00 0.00 H new ATOM 0 HA GLN A 32 -3.221 -1.227 -13.070 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -0.818 -1.643 -12.613 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -1.212 -3.194 -11.901 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -2.112 -3.895 -14.192 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -1.422 -2.416 -14.830 1.00 0.00 H new ATOM 0 HE21 GLN A 32 1.001 -2.196 -13.375 1.00 0.00 H new ATOM 0 HE22 GLN A 32 2.033 -3.572 -13.779 1.00 0.00 H new ATOM 496 N LEU A 33 -4.092 -3.869 -11.305 1.00 0.00 N ATOM 497 CA LEU A 33 -5.031 -4.988 -11.220 1.00 0.00 C ATOM 498 C LEU A 33 -6.446 -4.501 -10.904 1.00 0.00 C ATOM 499 O LEU A 33 -7.396 -5.272 -11.031 1.00 0.00 O ATOM 500 CB LEU A 33 -4.595 -5.997 -10.142 1.00 0.00 C ATOM 501 CG LEU A 33 -3.186 -6.606 -10.246 1.00 0.00 C ATOM 502 CD1 LEU A 33 -3.111 -7.918 -9.461 1.00 0.00 C ATOM 503 CD2 LEU A 33 -2.732 -6.821 -11.696 1.00 0.00 C ATOM 0 H LEU A 33 -3.542 -3.736 -10.456 1.00 0.00 H new ATOM 0 HA LEU A 33 -5.031 -5.479 -12.193 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -4.674 -5.504 -9.173 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.313 -6.817 -10.143 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.499 -5.882 -9.807 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -2.108 -8.335 -9.545 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -3.338 -7.728 -8.412 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -3.834 -8.626 -9.866 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -1.731 -7.253 -11.704 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -3.423 -7.499 -12.197 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.719 -5.865 -12.219 1.00 0.00 H new ATOM 515 N SER A 34 -6.586 -3.236 -10.499 1.00 0.00 N ATOM 516 CA SER A 34 -7.851 -2.552 -10.256 1.00 0.00 C ATOM 517 C SER A 34 -8.808 -3.391 -9.399 1.00 0.00 C ATOM 518 O SER A 34 -9.937 -3.686 -9.800 1.00 0.00 O ATOM 519 CB SER A 34 -8.426 -2.127 -11.605 1.00 0.00 C ATOM 520 OG SER A 34 -7.548 -1.193 -12.209 1.00 0.00 O ATOM 0 H SER A 34 -5.780 -2.636 -10.324 1.00 0.00 H new ATOM 0 HA SER A 34 -7.689 -1.655 -9.658 1.00 0.00 H new ATOM 0 HB2 SER A 34 -8.553 -2.996 -12.251 1.00 0.00 H new ATOM 0 HB3 SER A 34 -9.413 -1.683 -11.470 1.00 0.00 H new ATOM 0 HG SER A 34 -7.910 -0.917 -13.077 1.00 0.00 H new ATOM 526 N LEU A 35 -8.338 -3.799 -8.215 1.00 0.00 N ATOM 527 CA LEU A 35 -9.105 -4.650 -7.307 1.00 0.00 C ATOM 528 C LEU A 35 -10.399 -3.946 -6.874 1.00 0.00 C ATOM 529 O LEU A 35 -10.424 -2.717 -6.767 1.00 0.00 O ATOM 530 CB LEU A 35 -8.270 -5.061 -6.077 1.00 0.00 C ATOM 531 CG LEU A 35 -7.495 -6.379 -6.249 1.00 0.00 C ATOM 532 CD1 LEU A 35 -6.507 -6.339 -7.409 1.00 0.00 C ATOM 533 CD2 LEU A 35 -6.713 -6.691 -4.974 1.00 0.00 C ATOM 0 H LEU A 35 -7.415 -3.547 -7.862 1.00 0.00 H new ATOM 0 HA LEU A 35 -9.368 -5.560 -7.846 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -7.562 -4.264 -5.850 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -8.933 -5.153 -5.217 1.00 0.00 H new ATOM 0 HG LEU A 35 -8.239 -7.148 -6.459 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -5.991 -7.296 -7.480 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -7.044 -6.146 -8.338 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.779 -5.546 -7.240 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -6.166 -7.625 -5.102 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -6.009 -5.884 -4.772 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -7.405 -6.787 -4.137 1.00 0.00 H new ATOM 545 N PRO A 36 -11.463 -4.711 -6.564 1.00 0.00 N ATOM 546 CA PRO A 36 -12.781 -4.174 -6.254 1.00 0.00 C ATOM 547 C PRO A 36 -12.789 -3.374 -4.947 1.00 0.00 C ATOM 548 O PRO A 36 -12.680 -2.146 -4.994 1.00 0.00 O ATOM 549 CB PRO A 36 -13.734 -5.371 -6.271 1.00 0.00 C ATOM 550 CG PRO A 36 -12.828 -6.580 -6.040 1.00 0.00 C ATOM 551 CD PRO A 36 -11.524 -6.159 -6.696 1.00 0.00 C ATOM 0 HA PRO A 36 -13.105 -3.438 -6.990 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -14.491 -5.287 -5.492 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -14.262 -5.446 -7.222 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -12.697 -6.789 -4.978 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -13.236 -7.483 -6.495 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -10.671 -6.632 -6.210 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -11.499 -6.457 -7.744 1.00 0.00 H new ATOM 559 N LYS A 37 -12.941 -4.005 -3.770 1.00 0.00 N ATOM 560 CA LYS A 37 -12.952 -3.249 -2.515 1.00 0.00 C ATOM 561 C LYS A 37 -12.445 -4.069 -1.348 1.00 0.00 C ATOM 562 O LYS A 37 -11.367 -3.778 -0.850 1.00 0.00 O ATOM 563 CB LYS A 37 -14.358 -2.667 -2.249 1.00 0.00 C ATOM 564 CG LYS A 37 -14.289 -1.271 -1.618 1.00 0.00 C ATOM 565 CD LYS A 37 -13.920 -1.271 -0.129 1.00 0.00 C ATOM 566 CE LYS A 37 -14.053 0.133 0.473 1.00 0.00 C ATOM 567 NZ LYS A 37 -13.140 1.119 -0.143 1.00 0.00 N ATOM 0 H LYS A 37 -13.055 -5.013 -3.665 1.00 0.00 H new ATOM 0 HA LYS A 37 -12.257 -2.416 -2.621 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -14.913 -2.615 -3.186 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -14.909 -3.337 -1.589 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -13.557 -0.674 -2.162 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -15.255 -0.781 -1.741 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -14.567 -1.964 0.409 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -12.898 -1.628 -0.005 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -15.081 0.476 0.355 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -13.854 0.083 1.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -13.241 2.035 0.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -12.159 0.787 -0.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -13.377 1.231 -1.149 1.00 0.00 H new ATOM 581 N LEU A 38 -13.182 -5.095 -0.922 1.00 0.00 N ATOM 582 CA LEU A 38 -12.777 -5.960 0.186 1.00 0.00 C ATOM 583 C LEU A 38 -11.408 -6.557 -0.131 1.00 0.00 C ATOM 584 O LEU A 38 -10.488 -6.485 0.679 1.00 0.00 O ATOM 585 CB LEU A 38 -13.883 -7.010 0.416 1.00 0.00 C ATOM 586 CG LEU A 38 -13.599 -8.183 1.376 1.00 0.00 C ATOM 587 CD1 LEU A 38 -12.728 -9.282 0.757 1.00 0.00 C ATOM 588 CD2 LEU A 38 -13.006 -7.731 2.708 1.00 0.00 C ATOM 0 H LEU A 38 -14.078 -5.350 -1.336 1.00 0.00 H new ATOM 0 HA LEU A 38 -12.666 -5.410 1.120 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -14.765 -6.486 0.785 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -14.145 -7.432 -0.554 1.00 0.00 H new ATOM 0 HG LEU A 38 -14.581 -8.615 1.571 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -12.569 -10.075 1.488 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -13.229 -9.692 -0.120 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -11.766 -8.862 0.462 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -12.828 -8.600 3.341 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -12.064 -7.213 2.530 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -13.702 -7.056 3.206 1.00 0.00 H new ATOM 600 N VAL A 39 -11.257 -7.096 -1.342 1.00 0.00 N ATOM 601 CA VAL A 39 -10.018 -7.729 -1.769 1.00 0.00 C ATOM 602 C VAL A 39 -8.921 -6.670 -1.898 1.00 0.00 C ATOM 603 O VAL A 39 -7.769 -6.952 -1.569 1.00 0.00 O ATOM 604 CB VAL A 39 -10.249 -8.500 -3.088 1.00 0.00 C ATOM 605 CG1 VAL A 39 -9.072 -9.426 -3.416 1.00 0.00 C ATOM 606 CG2 VAL A 39 -11.526 -9.352 -3.009 1.00 0.00 C ATOM 0 H VAL A 39 -11.991 -7.104 -2.050 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.690 -8.454 -1.024 1.00 0.00 H new ATOM 0 HB VAL A 39 -10.347 -7.751 -3.873 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -9.271 -9.951 -4.350 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -8.162 -8.835 -3.519 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.945 -10.151 -2.612 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -11.667 -9.885 -3.949 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -11.434 -10.071 -2.195 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -12.384 -8.705 -2.827 1.00 0.00 H new ATOM 616 N GLU A 40 -9.262 -5.446 -2.332 1.00 0.00 N ATOM 617 CA GLU A 40 -8.269 -4.382 -2.396 1.00 0.00 C ATOM 618 C GLU A 40 -7.778 -4.110 -0.970 1.00 0.00 C ATOM 619 O GLU A 40 -6.578 -3.997 -0.762 1.00 0.00 O ATOM 620 CB GLU A 40 -8.797 -3.085 -3.050 1.00 0.00 C ATOM 621 CG GLU A 40 -7.616 -2.097 -3.071 1.00 0.00 C ATOM 622 CD GLU A 40 -7.836 -0.799 -3.829 1.00 0.00 C ATOM 623 OE1 GLU A 40 -8.507 0.108 -3.286 1.00 0.00 O ATOM 624 OE2 GLU A 40 -7.255 -0.624 -4.926 1.00 0.00 O ATOM 0 H GLU A 40 -10.199 -5.180 -2.636 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.452 -4.715 -3.037 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -9.159 -3.279 -4.060 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -9.634 -2.677 -2.484 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.357 -1.852 -2.041 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.754 -2.604 -3.504 1.00 0.00 H new ATOM 631 N GLN A 41 -8.672 -4.036 0.021 1.00 0.00 N ATOM 632 CA GLN A 41 -8.308 -3.713 1.394 1.00 0.00 C ATOM 633 C GLN A 41 -7.312 -4.731 1.961 1.00 0.00 C ATOM 634 O GLN A 41 -6.481 -4.370 2.793 1.00 0.00 O ATOM 635 CB GLN A 41 -9.575 -3.582 2.252 1.00 0.00 C ATOM 636 CG GLN A 41 -9.380 -2.571 3.394 1.00 0.00 C ATOM 637 CD GLN A 41 -10.711 -2.184 4.034 1.00 0.00 C ATOM 638 OE1 GLN A 41 -10.930 -2.399 5.223 1.00 0.00 O ATOM 639 NE2 GLN A 41 -11.619 -1.596 3.275 1.00 0.00 N ATOM 0 H GLN A 41 -9.670 -4.200 -0.112 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.797 -2.750 1.411 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.409 -3.268 1.625 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.837 -4.555 2.667 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.722 -2.998 4.151 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.887 -1.678 3.010 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.425 -1.423 2.289 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -12.514 -1.315 3.675 1.00 0.00 H new ATOM 648 N VAL A 42 -7.367 -5.983 1.503 1.00 0.00 N ATOM 649 CA VAL A 42 -6.402 -7.015 1.853 1.00 0.00 C ATOM 650 C VAL A 42 -5.066 -6.673 1.193 1.00 0.00 C ATOM 651 O VAL A 42 -4.067 -6.533 1.894 1.00 0.00 O ATOM 652 CB VAL A 42 -6.966 -8.396 1.465 1.00 0.00 C ATOM 653 CG1 VAL A 42 -5.943 -9.540 1.506 1.00 0.00 C ATOM 654 CG2 VAL A 42 -8.117 -8.702 2.427 1.00 0.00 C ATOM 0 H VAL A 42 -8.096 -6.309 0.869 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.222 -7.058 2.927 1.00 0.00 H new ATOM 0 HB VAL A 42 -7.288 -8.340 0.425 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -6.428 -10.473 1.219 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -5.130 -9.326 0.813 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -5.544 -9.635 2.516 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -8.545 -9.675 2.185 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -7.742 -8.715 3.450 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.885 -7.934 2.332 1.00 0.00 H new ATOM 664 N ALA A 43 -5.038 -6.479 -0.129 1.00 0.00 N ATOM 665 CA ALA A 43 -3.820 -6.095 -0.834 1.00 0.00 C ATOM 666 C ALA A 43 -3.193 -4.815 -0.255 1.00 0.00 C ATOM 667 O ALA A 43 -1.972 -4.670 -0.276 1.00 0.00 O ATOM 668 CB ALA A 43 -4.132 -5.929 -2.324 1.00 0.00 C ATOM 0 H ALA A 43 -5.854 -6.584 -0.733 1.00 0.00 H new ATOM 0 HA ALA A 43 -3.082 -6.886 -0.702 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -3.225 -5.642 -2.856 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.505 -6.872 -2.725 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.889 -5.155 -2.453 1.00 0.00 H new ATOM 674 N LEU A 44 -4.018 -3.903 0.266 1.00 0.00 N ATOM 675 CA LEU A 44 -3.621 -2.634 0.852 1.00 0.00 C ATOM 676 C LEU A 44 -3.042 -2.785 2.250 1.00 0.00 C ATOM 677 O LEU A 44 -2.168 -1.999 2.599 1.00 0.00 O ATOM 678 CB LEU A 44 -4.804 -1.658 0.928 1.00 0.00 C ATOM 679 CG LEU A 44 -5.209 -1.002 -0.403 1.00 0.00 C ATOM 680 CD1 LEU A 44 -6.485 -0.185 -0.158 1.00 0.00 C ATOM 681 CD2 LEU A 44 -4.137 -0.087 -1.007 1.00 0.00 C ATOM 0 H LEU A 44 -5.028 -4.043 0.288 1.00 0.00 H new ATOM 0 HA LEU A 44 -2.848 -2.241 0.192 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.667 -2.191 1.327 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -4.558 -0.871 1.641 1.00 0.00 H new ATOM 0 HG LEU A 44 -5.359 -1.805 -1.124 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.795 0.292 -1.087 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.278 -0.845 0.193 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -6.289 0.579 0.594 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.504 0.334 -1.943 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.912 0.720 -0.309 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -3.232 -0.664 -1.198 1.00 0.00 H new ATOM 693 N ASN A 45 -3.512 -3.734 3.067 1.00 0.00 N ATOM 694 CA ASN A 45 -3.028 -3.870 4.448 1.00 0.00 C ATOM 695 C ASN A 45 -1.899 -4.901 4.540 1.00 0.00 C ATOM 696 O ASN A 45 -1.496 -5.303 5.641 1.00 0.00 O ATOM 697 CB ASN A 45 -4.191 -4.158 5.410 1.00 0.00 C ATOM 698 CG ASN A 45 -4.965 -2.882 5.706 1.00 0.00 C ATOM 699 OD1 ASN A 45 -4.612 -2.115 6.596 1.00 0.00 O ATOM 700 ND2 ASN A 45 -6.013 -2.601 4.955 1.00 0.00 N ATOM 0 H ASN A 45 -4.222 -4.416 2.800 1.00 0.00 H new ATOM 0 HA ASN A 45 -2.596 -2.920 4.762 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -4.857 -4.901 4.972 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -3.807 -4.581 6.338 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -6.537 -1.740 5.112 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -6.299 -3.245 4.217 1.00 0.00 H new ATOM 707 N ALA A 46 -1.366 -5.340 3.399 1.00 0.00 N ATOM 708 CA ALA A 46 -0.319 -6.326 3.314 1.00 0.00 C ATOM 709 C ALA A 46 0.839 -5.826 2.471 1.00 0.00 C ATOM 710 O ALA A 46 0.673 -4.979 1.599 1.00 0.00 O ATOM 711 CB ALA A 46 -0.886 -7.616 2.718 1.00 0.00 C ATOM 0 H ALA A 46 -1.670 -5.000 2.486 1.00 0.00 H new ATOM 0 HA ALA A 46 0.059 -6.519 4.318 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -0.096 -8.364 2.652 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.688 -7.990 3.355 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.279 -7.414 1.721 1.00 0.00 H new ATOM 717 N TRP A 47 2.017 -6.361 2.766 1.00 0.00 N ATOM 718 CA TRP A 47 3.236 -6.146 2.007 1.00 0.00 C ATOM 719 C TRP A 47 3.445 -7.479 1.295 1.00 0.00 C ATOM 720 O TRP A 47 3.165 -8.548 1.851 1.00 0.00 O ATOM 721 CB TRP A 47 4.400 -5.662 2.871 1.00 0.00 C ATOM 722 CG TRP A 47 4.810 -6.493 4.045 1.00 0.00 C ATOM 723 CD1 TRP A 47 4.365 -6.330 5.310 1.00 0.00 C ATOM 724 CD2 TRP A 47 5.830 -7.533 4.109 1.00 0.00 C ATOM 725 NE1 TRP A 47 5.074 -7.148 6.166 1.00 0.00 N ATOM 726 CE2 TRP A 47 6.009 -7.896 5.477 1.00 0.00 C ATOM 727 CE3 TRP A 47 6.638 -8.189 3.154 1.00 0.00 C ATOM 728 CZ2 TRP A 47 6.968 -8.835 5.875 1.00 0.00 C ATOM 729 CZ3 TRP A 47 7.596 -9.141 3.547 1.00 0.00 C ATOM 730 CH2 TRP A 47 7.768 -9.458 4.904 1.00 0.00 C ATOM 0 H TRP A 47 2.151 -6.977 3.568 1.00 0.00 H new ATOM 0 HA TRP A 47 3.168 -5.330 1.288 1.00 0.00 H new ATOM 0 HB2 TRP A 47 5.270 -5.551 2.224 1.00 0.00 H new ATOM 0 HB3 TRP A 47 4.148 -4.668 3.240 1.00 0.00 H new ATOM 0 HD1 TRP A 47 3.572 -5.659 5.607 1.00 0.00 H new ATOM 0 HE1 TRP A 47 4.927 -7.194 7.174 1.00 0.00 H new ATOM 0 HE3 TRP A 47 6.518 -7.956 2.106 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 7.091 -9.078 6.920 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 8.203 -9.631 2.800 1.00 0.00 H new ATOM 0 HH2 TRP A 47 8.515 -10.180 5.200 1.00 0.00 H new ATOM 741 N LYS A 48 3.888 -7.422 0.043 1.00 0.00 N ATOM 742 CA LYS A 48 3.993 -8.589 -0.810 1.00 0.00 C ATOM 743 C LYS A 48 5.396 -9.179 -0.889 1.00 0.00 C ATOM 744 O LYS A 48 6.263 -8.616 -1.551 1.00 0.00 O ATOM 745 CB LYS A 48 3.458 -8.160 -2.192 1.00 0.00 C ATOM 746 CG LYS A 48 3.361 -9.291 -3.222 1.00 0.00 C ATOM 747 CD LYS A 48 3.985 -8.934 -4.584 1.00 0.00 C ATOM 748 CE LYS A 48 5.505 -8.912 -4.495 1.00 0.00 C ATOM 749 NZ LYS A 48 6.152 -8.512 -5.761 1.00 0.00 N ATOM 0 H LYS A 48 4.185 -6.556 -0.406 1.00 0.00 H new ATOM 0 HA LYS A 48 3.405 -9.405 -0.389 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.469 -7.719 -2.063 1.00 0.00 H new ATOM 0 HB3 LYS A 48 4.106 -7.379 -2.590 1.00 0.00 H new ATOM 0 HG2 LYS A 48 3.856 -10.177 -2.825 1.00 0.00 H new ATOM 0 HG3 LYS A 48 2.312 -9.550 -3.368 1.00 0.00 H new ATOM 0 HD2 LYS A 48 3.671 -9.660 -5.334 1.00 0.00 H new ATOM 0 HD3 LYS A 48 3.622 -7.960 -4.911 1.00 0.00 H new ATOM 0 HE2 LYS A 48 5.807 -8.224 -3.706 1.00 0.00 H new ATOM 0 HE3 LYS A 48 5.861 -9.902 -4.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 6.605 -9.341 -6.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 5.436 -8.127 -6.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 6.871 -7.786 -5.569 1.00 0.00 H new ATOM 763 N GLU A 49 5.623 -10.288 -0.195 1.00 0.00 N ATOM 764 CA GLU A 49 6.865 -11.042 -0.296 1.00 0.00 C ATOM 765 C GLU A 49 6.733 -11.774 -1.634 1.00 0.00 C ATOM 766 O GLU A 49 5.644 -12.252 -1.967 1.00 0.00 O ATOM 767 CB GLU A 49 6.927 -12.071 0.843 1.00 0.00 C ATOM 768 CG GLU A 49 8.065 -13.107 0.771 1.00 0.00 C ATOM 769 CD GLU A 49 7.696 -14.374 1.551 1.00 0.00 C ATOM 770 OE1 GLU A 49 7.331 -14.264 2.743 1.00 0.00 O ATOM 771 OE2 GLU A 49 7.679 -15.486 0.972 1.00 0.00 O ATOM 0 H GLU A 49 4.948 -10.690 0.456 1.00 0.00 H new ATOM 0 HA GLU A 49 7.756 -10.417 -0.233 1.00 0.00 H new ATOM 0 HB2 GLU A 49 7.016 -11.531 1.786 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.978 -12.607 0.871 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.267 -13.361 -0.270 1.00 0.00 H new ATOM 0 HG3 GLU A 49 8.981 -12.677 1.178 1.00 0.00 H new ATOM 778 N GLU A 50 7.813 -11.908 -2.392 1.00 0.00 N ATOM 779 CA GLU A 50 7.839 -12.692 -3.614 1.00 0.00 C ATOM 780 C GLU A 50 9.011 -13.663 -3.532 1.00 0.00 C ATOM 781 O GLU A 50 10.130 -13.288 -3.166 1.00 0.00 O ATOM 782 CB GLU A 50 7.909 -11.763 -4.832 1.00 0.00 C ATOM 783 CG GLU A 50 8.135 -12.531 -6.138 1.00 0.00 C ATOM 784 CD GLU A 50 8.299 -11.625 -7.351 1.00 0.00 C ATOM 785 OE1 GLU A 50 7.666 -10.548 -7.437 1.00 0.00 O ATOM 786 OE2 GLU A 50 9.086 -12.005 -8.250 1.00 0.00 O ATOM 0 H GLU A 50 8.706 -11.468 -2.170 1.00 0.00 H new ATOM 0 HA GLU A 50 6.925 -13.275 -3.730 1.00 0.00 H new ATOM 0 HB2 GLU A 50 6.983 -11.192 -4.904 1.00 0.00 H new ATOM 0 HB3 GLU A 50 8.716 -11.044 -4.692 1.00 0.00 H new ATOM 0 HG2 GLU A 50 9.024 -13.153 -6.036 1.00 0.00 H new ATOM 0 HG3 GLU A 50 7.293 -13.203 -6.306 1.00 0.00 H new ATOM 793 N SER A 51 8.744 -14.904 -3.916 1.00 0.00 N ATOM 794 CA SER A 51 9.675 -15.994 -4.059 1.00 0.00 C ATOM 795 C SER A 51 9.739 -16.311 -5.558 1.00 0.00 C ATOM 796 O SER A 51 9.044 -15.713 -6.391 1.00 0.00 O ATOM 797 CB SER A 51 9.181 -17.163 -3.193 1.00 0.00 C ATOM 798 OG SER A 51 10.089 -18.247 -3.200 1.00 0.00 O ATOM 0 H SER A 51 7.793 -15.187 -4.152 1.00 0.00 H new ATOM 0 HA SER A 51 10.684 -15.764 -3.716 1.00 0.00 H new ATOM 0 HB2 SER A 51 9.034 -16.819 -2.169 1.00 0.00 H new ATOM 0 HB3 SER A 51 8.211 -17.500 -3.558 1.00 0.00 H new ATOM 0 HG SER A 51 9.740 -18.969 -2.637 1.00 0.00 H new ATOM 804 N ASP A 52 10.581 -17.276 -5.902 1.00 0.00 N ATOM 805 CA ASP A 52 10.860 -17.759 -7.250 1.00 0.00 C ATOM 806 C ASP A 52 9.587 -18.001 -8.063 1.00 0.00 C ATOM 807 O ASP A 52 9.552 -17.709 -9.259 1.00 0.00 O ATOM 808 CB ASP A 52 11.613 -19.093 -7.137 1.00 0.00 C ATOM 809 CG ASP A 52 13.093 -18.969 -6.782 1.00 0.00 C ATOM 810 OD1 ASP A 52 13.567 -17.902 -6.328 1.00 0.00 O ATOM 811 OD2 ASP A 52 13.811 -19.979 -6.954 1.00 0.00 O ATOM 0 H ASP A 52 11.125 -17.777 -5.199 1.00 0.00 H new ATOM 0 HA ASP A 52 11.445 -16.995 -7.762 1.00 0.00 H new ATOM 0 HB2 ASP A 52 11.123 -19.707 -6.381 1.00 0.00 H new ATOM 0 HB3 ASP A 52 11.525 -19.624 -8.085 1.00 0.00 H new ATOM 816 N ASN A 53 8.551 -18.538 -7.411 1.00 0.00 N ATOM 817 CA ASN A 53 7.294 -18.974 -7.999 1.00 0.00 C ATOM 818 C ASN A 53 6.115 -18.885 -7.012 1.00 0.00 C ATOM 819 O ASN A 53 5.079 -19.520 -7.239 1.00 0.00 O ATOM 820 CB ASN A 53 7.495 -20.421 -8.484 1.00 0.00 C ATOM 821 CG ASN A 53 8.100 -21.337 -7.425 1.00 0.00 C ATOM 822 OD1 ASN A 53 7.704 -21.339 -6.260 1.00 0.00 O ATOM 823 ND2 ASN A 53 9.113 -22.105 -7.779 1.00 0.00 N ATOM 0 H ASN A 53 8.575 -18.686 -6.402 1.00 0.00 H new ATOM 0 HA ASN A 53 7.034 -18.314 -8.826 1.00 0.00 H new ATOM 0 HB2 ASN A 53 6.534 -20.827 -8.799 1.00 0.00 H new ATOM 0 HB3 ASN A 53 8.142 -20.416 -9.361 1.00 0.00 H new ATOM 0 HD21 ASN A 53 9.568 -22.700 -7.087 1.00 0.00 H new ATOM 0 HD22 ASN A 53 9.441 -22.103 -8.745 1.00 0.00 H new ATOM 830 N ALA A 54 6.237 -18.146 -5.903 1.00 0.00 N ATOM 831 CA ALA A 54 5.161 -17.987 -4.930 1.00 0.00 C ATOM 832 C ALA A 54 5.196 -16.560 -4.407 1.00 0.00 C ATOM 833 O ALA A 54 6.224 -15.892 -4.525 1.00 0.00 O ATOM 834 CB ALA A 54 5.333 -18.995 -3.795 1.00 0.00 C ATOM 0 H ALA A 54 7.089 -17.642 -5.659 1.00 0.00 H new ATOM 0 HA ALA A 54 4.194 -18.175 -5.396 1.00 0.00 H new ATOM 0 HB1 ALA A 54 4.526 -18.871 -3.072 1.00 0.00 H new ATOM 0 HB2 ALA A 54 5.305 -20.007 -4.200 1.00 0.00 H new ATOM 0 HB3 ALA A 54 6.291 -18.828 -3.302 1.00 0.00 H new ATOM 840 N VAL A 55 4.092 -16.086 -3.836 1.00 0.00 N ATOM 841 CA VAL A 55 3.956 -14.701 -3.406 1.00 0.00 C ATOM 842 C VAL A 55 3.168 -14.718 -2.096 1.00 0.00 C ATOM 843 O VAL A 55 2.048 -15.222 -2.053 1.00 0.00 O ATOM 844 CB VAL A 55 3.302 -13.872 -4.539 1.00 0.00 C ATOM 845 CG1 VAL A 55 3.183 -12.395 -4.169 1.00 0.00 C ATOM 846 CG2 VAL A 55 4.119 -13.892 -5.847 1.00 0.00 C ATOM 0 H VAL A 55 3.264 -16.655 -3.659 1.00 0.00 H new ATOM 0 HA VAL A 55 4.914 -14.217 -3.213 1.00 0.00 H new ATOM 0 HB VAL A 55 2.327 -14.339 -4.679 1.00 0.00 H new ATOM 0 HG11 VAL A 55 2.719 -11.850 -4.991 1.00 0.00 H new ATOM 0 HG12 VAL A 55 2.569 -12.292 -3.274 1.00 0.00 H new ATOM 0 HG13 VAL A 55 4.175 -11.987 -3.977 1.00 0.00 H new ATOM 0 HG21 VAL A 55 3.610 -13.294 -6.603 1.00 0.00 H new ATOM 0 HG22 VAL A 55 5.110 -13.478 -5.663 1.00 0.00 H new ATOM 0 HG23 VAL A 55 4.215 -14.919 -6.201 1.00 0.00 H new ATOM 856 N CYS A 56 3.752 -14.220 -1.009 1.00 0.00 N ATOM 857 CA CYS A 56 3.152 -14.257 0.322 1.00 0.00 C ATOM 858 C CYS A 56 2.772 -12.845 0.747 1.00 0.00 C ATOM 859 O CYS A 56 3.634 -12.012 1.019 1.00 0.00 O ATOM 860 CB CYS A 56 4.079 -14.928 1.344 1.00 0.00 C ATOM 861 SG CYS A 56 4.636 -16.543 0.740 1.00 0.00 S ATOM 0 H CYS A 56 4.669 -13.773 -1.028 1.00 0.00 H new ATOM 0 HA CYS A 56 2.248 -14.865 0.282 1.00 0.00 H new ATOM 0 HB2 CYS A 56 4.941 -14.289 1.535 1.00 0.00 H new ATOM 0 HB3 CYS A 56 3.556 -15.050 2.292 1.00 0.00 H new ATOM 0 HG CYS A 56 5.934 -16.556 0.671 1.00 0.00 H new ATOM 867 N LEU A 57 1.478 -12.548 0.798 1.00 0.00 N ATOM 868 CA LEU A 57 0.999 -11.272 1.308 1.00 0.00 C ATOM 869 C LEU A 57 1.022 -11.294 2.830 1.00 0.00 C ATOM 870 O LEU A 57 0.170 -11.920 3.457 1.00 0.00 O ATOM 871 CB LEU A 57 -0.387 -10.937 0.730 1.00 0.00 C ATOM 872 CG LEU A 57 -0.219 -10.241 -0.629 1.00 0.00 C ATOM 873 CD1 LEU A 57 -1.525 -10.166 -1.410 1.00 0.00 C ATOM 874 CD2 LEU A 57 0.256 -8.799 -0.460 1.00 0.00 C ATOM 0 H LEU A 57 0.739 -13.180 0.490 1.00 0.00 H new ATOM 0 HA LEU A 57 1.662 -10.470 0.982 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.975 -11.848 0.614 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.933 -10.290 1.417 1.00 0.00 H new ATOM 0 HG LEU A 57 0.512 -10.844 -1.168 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -1.351 -9.665 -2.362 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.898 -11.174 -1.593 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -2.261 -9.605 -0.834 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.365 -8.335 -1.440 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.474 -8.242 0.126 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.217 -8.790 0.054 1.00 0.00 H new ATOM 886 N HIS A 58 2.022 -10.642 3.420 1.00 0.00 N ATOM 887 CA HIS A 58 2.132 -10.453 4.863 1.00 0.00 C ATOM 888 C HIS A 58 1.147 -9.355 5.257 1.00 0.00 C ATOM 889 O HIS A 58 1.472 -8.175 5.113 1.00 0.00 O ATOM 890 CB HIS A 58 3.563 -10.039 5.238 1.00 0.00 C ATOM 891 CG HIS A 58 4.610 -11.127 5.197 1.00 0.00 C ATOM 892 ND1 HIS A 58 5.394 -11.533 6.266 1.00 0.00 N ATOM 893 CD2 HIS A 58 5.069 -11.762 4.076 1.00 0.00 C ATOM 894 CE1 HIS A 58 6.296 -12.416 5.799 1.00 0.00 C ATOM 895 NE2 HIS A 58 6.112 -12.577 4.476 1.00 0.00 N ATOM 0 H HIS A 58 2.792 -10.223 2.898 1.00 0.00 H new ATOM 0 HA HIS A 58 1.904 -11.381 5.388 1.00 0.00 H new ATOM 0 HB2 HIS A 58 3.875 -9.240 4.566 1.00 0.00 H new ATOM 0 HB3 HIS A 58 3.545 -9.620 6.244 1.00 0.00 H new ATOM 0 HD2 HIS A 58 4.690 -11.649 3.071 1.00 0.00 H new ATOM 0 HE1 HIS A 58 7.048 -12.916 6.392 1.00 0.00 H new ATOM 0 HE2 HIS A 58 6.651 -13.196 3.870 1.00 0.00 H new ATOM 904 N LEU A 59 -0.065 -9.699 5.687 1.00 0.00 N ATOM 905 CA LEU A 59 -1.077 -8.737 6.122 1.00 0.00 C ATOM 906 C LEU A 59 -0.895 -8.453 7.604 1.00 0.00 C ATOM 907 O LEU A 59 -0.761 -9.397 8.380 1.00 0.00 O ATOM 908 CB LEU A 59 -2.484 -9.298 5.868 1.00 0.00 C ATOM 909 CG LEU A 59 -3.564 -8.213 6.091 1.00 0.00 C ATOM 910 CD1 LEU A 59 -4.337 -7.922 4.809 1.00 0.00 C ATOM 911 CD2 LEU A 59 -4.582 -8.657 7.126 1.00 0.00 C ATOM 0 H LEU A 59 -0.377 -10.668 5.744 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.962 -7.813 5.556 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -2.549 -9.677 4.848 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -2.668 -10.141 6.533 1.00 0.00 H new ATOM 0 HG LEU A 59 -3.033 -7.323 6.427 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -5.087 -7.155 5.003 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.648 -7.570 4.041 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.829 -8.832 4.466 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -5.328 -7.874 7.262 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.071 -9.570 6.787 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -4.078 -8.846 8.074 1.00 0.00 H new ATOM 923 N ARG A 60 -0.923 -7.178 8.011 1.00 0.00 N ATOM 924 CA ARG A 60 -0.693 -6.840 9.411 1.00 0.00 C ATOM 925 C ARG A 60 -1.758 -7.476 10.275 1.00 0.00 C ATOM 926 O ARG A 60 -2.948 -7.227 10.070 1.00 0.00 O ATOM 927 CB ARG A 60 -0.639 -5.330 9.683 1.00 0.00 C ATOM 928 CG ARG A 60 0.519 -4.653 8.945 1.00 0.00 C ATOM 929 CD ARG A 60 1.170 -3.529 9.750 1.00 0.00 C ATOM 930 NE ARG A 60 1.747 -2.464 8.903 1.00 0.00 N ATOM 931 CZ ARG A 60 2.811 -2.567 8.092 1.00 0.00 C ATOM 932 NH1 ARG A 60 3.213 -3.729 7.587 1.00 0.00 N ATOM 933 NH2 ARG A 60 3.530 -1.491 7.811 1.00 0.00 N ATOM 0 H ARG A 60 -1.100 -6.381 7.400 1.00 0.00 H new ATOM 0 HA ARG A 60 0.292 -7.234 9.662 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -1.580 -4.873 9.377 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -0.535 -5.159 10.754 1.00 0.00 H new ATOM 0 HG2 ARG A 60 1.273 -5.401 8.702 1.00 0.00 H new ATOM 0 HG3 ARG A 60 0.154 -4.250 8.000 1.00 0.00 H new ATOM 0 HD2 ARG A 60 0.427 -3.091 10.417 1.00 0.00 H new ATOM 0 HD3 ARG A 60 1.955 -3.949 10.379 1.00 0.00 H new ATOM 0 HE ARG A 60 1.288 -1.554 8.939 1.00 0.00 H new ATOM 0 HH11 ARG A 60 2.707 -4.585 7.813 1.00 0.00 H new ATOM 0 HH12 ARG A 60 4.027 -3.764 6.974 1.00 0.00 H new ATOM 0 HH21 ARG A 60 3.274 -0.588 8.211 1.00 0.00 H new ATOM 0 HH22 ARG A 60 4.340 -1.565 7.195 1.00 0.00 H new ATOM 947 N SER A 61 -1.340 -8.205 11.304 1.00 0.00 N ATOM 948 CA SER A 61 -2.248 -8.756 12.289 1.00 0.00 C ATOM 949 C SER A 61 -2.985 -7.634 13.032 1.00 0.00 C ATOM 950 O SER A 61 -4.011 -7.890 13.657 1.00 0.00 O ATOM 951 CB SER A 61 -1.482 -9.641 13.266 1.00 0.00 C ATOM 952 OG SER A 61 -0.605 -10.513 12.582 1.00 0.00 O ATOM 0 H SER A 61 -0.359 -8.428 11.474 1.00 0.00 H new ATOM 0 HA SER A 61 -2.993 -9.366 11.778 1.00 0.00 H new ATOM 0 HB2 SER A 61 -0.915 -9.018 13.958 1.00 0.00 H new ATOM 0 HB3 SER A 61 -2.185 -10.222 13.863 1.00 0.00 H new ATOM 0 HG SER A 61 -0.124 -11.069 13.231 1.00 0.00 H new ATOM 958 N SER A 62 -2.515 -6.389 12.931 1.00 0.00 N ATOM 959 CA SER A 62 -3.185 -5.226 13.484 1.00 0.00 C ATOM 960 C SER A 62 -4.467 -4.883 12.709 1.00 0.00 C ATOM 961 O SER A 62 -5.313 -4.168 13.244 1.00 0.00 O ATOM 962 CB SER A 62 -2.248 -4.010 13.437 1.00 0.00 C ATOM 963 OG SER A 62 -0.865 -4.317 13.529 1.00 0.00 O ATOM 0 H SER A 62 -1.642 -6.164 12.453 1.00 0.00 H new ATOM 0 HA SER A 62 -3.452 -5.466 14.513 1.00 0.00 H new ATOM 0 HB2 SER A 62 -2.424 -3.470 12.507 1.00 0.00 H new ATOM 0 HB3 SER A 62 -2.511 -3.336 14.252 1.00 0.00 H new ATOM 0 HG SER A 62 -0.724 -4.981 14.236 1.00 0.00 H new ATOM 969 N GLN A 63 -4.602 -5.351 11.460 1.00 0.00 N ATOM 970 CA GLN A 63 -5.680 -5.039 10.512 1.00 0.00 C ATOM 971 C GLN A 63 -6.316 -6.317 9.925 1.00 0.00 C ATOM 972 O GLN A 63 -7.067 -6.284 8.946 1.00 0.00 O ATOM 973 CB GLN A 63 -5.136 -4.098 9.416 1.00 0.00 C ATOM 974 CG GLN A 63 -4.546 -2.775 9.954 1.00 0.00 C ATOM 975 CD GLN A 63 -5.526 -1.990 10.826 1.00 0.00 C ATOM 976 OE1 GLN A 63 -6.728 -1.961 10.577 1.00 0.00 O ATOM 977 NE2 GLN A 63 -5.068 -1.364 11.895 1.00 0.00 N ATOM 0 H GLN A 63 -3.920 -5.996 11.061 1.00 0.00 H new ATOM 0 HA GLN A 63 -6.483 -4.526 11.042 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -4.366 -4.623 8.851 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -5.941 -3.867 8.719 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -3.649 -2.994 10.533 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -4.239 -2.153 9.113 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -4.071 -1.383 12.109 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -5.711 -0.861 12.506 1.00 0.00 H new ATOM 986 N ARG A 64 -6.028 -7.477 10.519 1.00 0.00 N ATOM 987 CA ARG A 64 -6.482 -8.793 10.068 1.00 0.00 C ATOM 988 C ARG A 64 -7.985 -9.023 10.124 1.00 0.00 C ATOM 989 O ARG A 64 -8.419 -10.092 9.696 1.00 0.00 O ATOM 990 CB ARG A 64 -5.696 -9.898 10.776 1.00 0.00 C ATOM 991 CG ARG A 64 -5.808 -9.871 12.306 1.00 0.00 C ATOM 992 CD ARG A 64 -6.914 -10.745 12.870 1.00 0.00 C ATOM 993 NE ARG A 64 -6.849 -10.744 14.337 1.00 0.00 N ATOM 994 CZ ARG A 64 -7.330 -11.693 15.139 1.00 0.00 C ATOM 995 NH1 ARG A 64 -7.887 -12.790 14.640 1.00 0.00 N ATOM 996 NH2 ARG A 64 -7.246 -11.524 16.451 1.00 0.00 N ATOM 0 H ARG A 64 -5.451 -7.527 11.358 1.00 0.00 H new ATOM 0 HA ARG A 64 -6.266 -8.827 9.000 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.046 -10.865 10.415 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -4.645 -9.815 10.499 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -4.857 -10.189 12.733 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -5.974 -8.843 12.628 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -7.885 -10.377 12.540 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -6.814 -11.763 12.493 1.00 0.00 H new ATOM 0 HE ARG A 64 -6.395 -9.946 14.782 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -7.951 -12.915 13.630 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -8.251 -13.508 15.267 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -6.819 -10.679 16.830 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -7.609 -12.239 17.082 1.00 0.00 H new ATOM 1010 N HIS A 65 -8.808 -8.080 10.592 1.00 0.00 N ATOM 1011 CA HIS A 65 -10.263 -8.236 10.522 1.00 0.00 C ATOM 1012 C HIS A 65 -10.724 -8.398 9.066 1.00 0.00 C ATOM 1013 O HIS A 65 -11.841 -8.852 8.846 1.00 0.00 O ATOM 1014 CB HIS A 65 -10.969 -7.038 11.175 1.00 0.00 C ATOM 1015 CG HIS A 65 -12.458 -7.222 11.353 1.00 0.00 C ATOM 1016 ND1 HIS A 65 -13.451 -6.441 10.788 1.00 0.00 N ATOM 1017 CD2 HIS A 65 -13.061 -8.203 12.095 1.00 0.00 C ATOM 1018 CE1 HIS A 65 -14.635 -6.957 11.164 1.00 0.00 C ATOM 1019 NE2 HIS A 65 -14.425 -8.022 11.958 1.00 0.00 N ATOM 0 H HIS A 65 -8.495 -7.208 11.020 1.00 0.00 H new ATOM 0 HA HIS A 65 -10.533 -9.138 11.071 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -10.518 -6.851 12.149 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -10.793 -6.151 10.567 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -12.567 -8.969 12.674 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -15.603 -6.576 10.874 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -15.149 -8.599 12.387 1.00 0.00 H new ATOM 1028 N LEU A 66 -9.903 -8.019 8.077 1.00 0.00 N ATOM 1029 CA LEU A 66 -10.205 -8.131 6.649 1.00 0.00 C ATOM 1030 C LEU A 66 -9.633 -9.424 6.047 1.00 0.00 C ATOM 1031 O LEU A 66 -9.895 -9.706 4.880 1.00 0.00 O ATOM 1032 CB LEU A 66 -9.660 -6.892 5.899 1.00 0.00 C ATOM 1033 CG LEU A 66 -10.493 -5.593 5.999 1.00 0.00 C ATOM 1034 CD1 LEU A 66 -11.813 -5.680 5.229 1.00 0.00 C ATOM 1035 CD2 LEU A 66 -10.787 -5.157 7.439 1.00 0.00 C ATOM 0 H LEU A 66 -8.984 -7.614 8.257 1.00 0.00 H new ATOM 0 HA LEU A 66 -11.288 -8.173 6.534 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -8.658 -6.682 6.273 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -9.559 -7.150 4.845 1.00 0.00 H new ATOM 0 HG LEU A 66 -9.856 -4.837 5.540 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -12.357 -4.741 5.333 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -11.608 -5.865 4.175 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -12.415 -6.495 5.630 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -11.375 -4.239 7.428 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -11.347 -5.941 7.949 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -9.848 -4.981 7.965 1.00 0.00 H new ATOM 1047 N ASN A 67 -8.841 -10.206 6.790 1.00 0.00 N ATOM 1048 CA ASN A 67 -8.198 -11.409 6.263 1.00 0.00 C ATOM 1049 C ASN A 67 -9.199 -12.552 6.131 1.00 0.00 C ATOM 1050 O ASN A 67 -9.597 -13.140 7.142 1.00 0.00 O ATOM 1051 CB ASN A 67 -7.037 -11.877 7.163 1.00 0.00 C ATOM 1052 CG ASN A 67 -6.284 -13.057 6.547 1.00 0.00 C ATOM 1053 OD1 ASN A 67 -6.447 -13.381 5.374 1.00 0.00 O ATOM 1054 ND2 ASN A 67 -5.438 -13.722 7.308 1.00 0.00 N ATOM 0 H ASN A 67 -8.630 -10.021 7.771 1.00 0.00 H new ATOM 0 HA ASN A 67 -7.805 -11.145 5.281 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -6.346 -11.050 7.326 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -7.427 -12.164 8.140 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -4.916 -14.509 6.923 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -5.305 -13.450 8.282 1.00 0.00 H new ATOM 1061 N ASN A 68 -9.680 -12.813 4.918 1.00 0.00 N ATOM 1062 CA ASN A 68 -10.529 -13.958 4.630 1.00 0.00 C ATOM 1063 C ASN A 68 -10.025 -14.694 3.396 1.00 0.00 C ATOM 1064 O ASN A 68 -9.566 -14.078 2.431 1.00 0.00 O ATOM 1065 CB ASN A 68 -12.001 -13.555 4.526 1.00 0.00 C ATOM 1066 CG ASN A 68 -12.304 -12.748 3.275 1.00 0.00 C ATOM 1067 OD1 ASN A 68 -11.758 -11.680 3.053 1.00 0.00 O ATOM 1068 ND2 ASN A 68 -13.189 -13.235 2.431 1.00 0.00 N ATOM 0 H ASN A 68 -9.488 -12.229 4.104 1.00 0.00 H new ATOM 0 HA ASN A 68 -10.471 -14.655 5.466 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -12.620 -14.452 4.533 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -12.276 -12.972 5.405 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -13.423 -12.719 1.583 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -13.641 -14.129 2.625 1.00 0.00 H new ATOM 1075 N ARG A 69 -10.198 -16.014 3.357 1.00 0.00 N ATOM 1076 CA ARG A 69 -9.836 -16.836 2.201 1.00 0.00 C ATOM 1077 C ARG A 69 -10.669 -16.487 0.970 1.00 0.00 C ATOM 1078 O ARG A 69 -10.232 -16.732 -0.155 1.00 0.00 O ATOM 1079 CB ARG A 69 -9.942 -18.313 2.590 1.00 0.00 C ATOM 1080 CG ARG A 69 -8.683 -18.723 3.371 1.00 0.00 C ATOM 1081 CD ARG A 69 -8.903 -20.020 4.141 1.00 0.00 C ATOM 1082 NE ARG A 69 -7.636 -20.553 4.654 1.00 0.00 N ATOM 1083 CZ ARG A 69 -7.486 -21.644 5.410 1.00 0.00 C ATOM 1084 NH1 ARG A 69 -8.524 -22.366 5.818 1.00 0.00 N ATOM 1085 NH2 ARG A 69 -6.260 -22.009 5.746 1.00 0.00 N ATOM 0 H ARG A 69 -10.595 -16.547 4.130 1.00 0.00 H new ATOM 0 HA ARG A 69 -8.805 -16.627 1.917 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -10.831 -18.478 3.198 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -10.047 -18.930 1.697 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -7.849 -18.845 2.680 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -8.409 -17.928 4.065 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -9.588 -19.842 4.970 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -9.374 -20.757 3.490 1.00 0.00 H new ATOM 0 HE ARG A 69 -6.788 -20.041 4.410 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -9.471 -22.092 5.555 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -8.374 -23.194 6.395 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -5.460 -21.462 5.429 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -6.115 -22.838 6.323 1.00 0.00 H new ATOM 1099 N GLY A 70 -11.838 -15.875 1.144 1.00 0.00 N ATOM 1100 CA GLY A 70 -12.637 -15.381 0.035 1.00 0.00 C ATOM 1101 C GLY A 70 -11.892 -14.253 -0.682 1.00 0.00 C ATOM 1102 O GLY A 70 -12.010 -14.128 -1.905 1.00 0.00 O ATOM 0 H GLY A 70 -12.255 -15.709 2.060 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -12.846 -16.192 -0.663 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -13.598 -15.019 0.401 1.00 0.00 H new ATOM 1106 N ALA A 71 -11.122 -13.433 0.047 1.00 0.00 N ATOM 1107 CA ALA A 71 -10.270 -12.421 -0.552 1.00 0.00 C ATOM 1108 C ALA A 71 -9.161 -13.132 -1.310 1.00 0.00 C ATOM 1109 O ALA A 71 -8.972 -12.835 -2.485 1.00 0.00 O ATOM 1110 CB ALA A 71 -9.669 -11.467 0.491 1.00 0.00 C ATOM 0 H ALA A 71 -11.079 -13.460 1.066 1.00 0.00 H new ATOM 0 HA ALA A 71 -10.873 -11.807 -1.221 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -9.041 -10.730 -0.009 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -10.472 -10.957 1.023 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -9.067 -12.036 1.200 1.00 0.00 H new ATOM 1116 N GLN A 72 -8.480 -14.088 -0.661 1.00 0.00 N ATOM 1117 CA GLN A 72 -7.336 -14.805 -1.215 1.00 0.00 C ATOM 1118 C GLN A 72 -7.663 -15.328 -2.605 1.00 0.00 C ATOM 1119 O GLN A 72 -6.867 -15.129 -3.507 1.00 0.00 O ATOM 1120 CB GLN A 72 -6.919 -15.971 -0.296 1.00 0.00 C ATOM 1121 CG GLN A 72 -5.667 -16.725 -0.795 1.00 0.00 C ATOM 1122 CD GLN A 72 -5.488 -18.118 -0.178 1.00 0.00 C ATOM 1123 OE1 GLN A 72 -6.411 -18.723 0.369 1.00 0.00 O ATOM 1124 NE2 GLN A 72 -4.292 -18.672 -0.286 1.00 0.00 N ATOM 0 H GLN A 72 -8.720 -14.386 0.285 1.00 0.00 H new ATOM 0 HA GLN A 72 -6.501 -14.108 -1.285 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -6.727 -15.585 0.705 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -7.748 -16.673 -0.213 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -5.724 -16.824 -1.879 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -4.783 -16.126 -0.575 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -3.534 -18.164 -0.741 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -4.128 -19.608 0.085 1.00 0.00 H new ATOM 1133 N GLN A 73 -8.833 -15.941 -2.789 1.00 0.00 N ATOM 1134 CA GLN A 73 -9.196 -16.583 -4.047 1.00 0.00 C ATOM 1135 C GLN A 73 -9.177 -15.574 -5.194 1.00 0.00 C ATOM 1136 O GLN A 73 -8.557 -15.789 -6.236 1.00 0.00 O ATOM 1137 CB GLN A 73 -10.585 -17.219 -3.893 1.00 0.00 C ATOM 1138 CG GLN A 73 -10.769 -18.502 -4.709 1.00 0.00 C ATOM 1139 CD GLN A 73 -10.073 -19.743 -4.148 1.00 0.00 C ATOM 1140 OE1 GLN A 73 -9.355 -19.705 -3.147 1.00 0.00 O ATOM 1141 NE2 GLN A 73 -10.339 -20.888 -4.748 1.00 0.00 N ATOM 0 H GLN A 73 -9.553 -16.005 -2.069 1.00 0.00 H new ATOM 0 HA GLN A 73 -8.469 -17.359 -4.287 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -10.759 -17.441 -2.840 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -11.342 -16.495 -4.195 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -11.836 -18.710 -4.791 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -10.401 -18.325 -5.720 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -10.935 -20.904 -5.576 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -9.949 -21.757 -4.384 1.00 0.00 H new ATOM 1150 N LYS A 74 -9.841 -14.439 -4.977 1.00 0.00 N ATOM 1151 CA LYS A 74 -9.937 -13.394 -5.986 1.00 0.00 C ATOM 1152 C LYS A 74 -8.567 -12.749 -6.181 1.00 0.00 C ATOM 1153 O LYS A 74 -8.185 -12.452 -7.314 1.00 0.00 O ATOM 1154 CB LYS A 74 -11.000 -12.382 -5.532 1.00 0.00 C ATOM 1155 CG LYS A 74 -11.406 -11.341 -6.590 1.00 0.00 C ATOM 1156 CD LYS A 74 -12.590 -11.768 -7.468 1.00 0.00 C ATOM 1157 CE LYS A 74 -12.287 -12.782 -8.576 1.00 0.00 C ATOM 1158 NZ LYS A 74 -11.804 -12.147 -9.817 1.00 0.00 N ATOM 0 H LYS A 74 -10.322 -14.223 -4.104 1.00 0.00 H new ATOM 0 HA LYS A 74 -10.241 -13.801 -6.950 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -11.891 -12.929 -5.223 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -10.627 -11.857 -4.653 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -11.659 -10.407 -6.087 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -10.548 -11.136 -7.230 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -13.360 -12.189 -6.822 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -13.013 -10.875 -7.929 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -11.538 -13.489 -8.220 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -13.188 -13.355 -8.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -11.440 -12.877 -10.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -12.588 -11.640 -10.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -11.043 -11.476 -9.590 1.00 0.00 H new ATOM 1172 N LEU A 75 -7.824 -12.543 -5.091 1.00 0.00 N ATOM 1173 CA LEU A 75 -6.483 -11.983 -5.122 1.00 0.00 C ATOM 1174 C LEU A 75 -5.547 -12.929 -5.889 1.00 0.00 C ATOM 1175 O LEU A 75 -4.654 -12.455 -6.578 1.00 0.00 O ATOM 1176 CB LEU A 75 -5.999 -11.736 -3.678 1.00 0.00 C ATOM 1177 CG LEU A 75 -5.252 -10.416 -3.415 1.00 0.00 C ATOM 1178 CD1 LEU A 75 -4.969 -10.319 -1.909 1.00 0.00 C ATOM 1179 CD2 LEU A 75 -3.964 -10.217 -4.216 1.00 0.00 C ATOM 0 H LEU A 75 -8.148 -12.766 -4.150 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.484 -11.026 -5.643 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -6.865 -11.774 -3.018 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.345 -12.560 -3.393 1.00 0.00 H new ATOM 0 HG LEU A 75 -5.905 -9.614 -3.761 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.439 -9.390 -1.697 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -5.911 -10.333 -1.360 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -4.356 -11.165 -1.599 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -3.518 -9.257 -3.955 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.263 -11.018 -3.983 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -4.192 -10.234 -5.282 1.00 0.00 H new ATOM 1191 N ALA A 76 -5.739 -14.251 -5.808 1.00 0.00 N ATOM 1192 CA ALA A 76 -4.863 -15.257 -6.400 1.00 0.00 C ATOM 1193 C ALA A 76 -5.040 -15.266 -7.907 1.00 0.00 C ATOM 1194 O ALA A 76 -4.055 -15.346 -8.633 1.00 0.00 O ATOM 1195 CB ALA A 76 -5.157 -16.640 -5.808 1.00 0.00 C ATOM 0 H ALA A 76 -6.533 -14.657 -5.313 1.00 0.00 H new ATOM 0 HA ALA A 76 -3.827 -15.007 -6.171 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -4.495 -17.378 -6.261 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.992 -16.617 -4.731 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -6.193 -16.910 -6.011 1.00 0.00 H new ATOM 1201 N GLU A 77 -6.279 -15.142 -8.375 1.00 0.00 N ATOM 1202 CA GLU A 77 -6.601 -15.002 -9.789 1.00 0.00 C ATOM 1203 C GLU A 77 -5.985 -13.701 -10.324 1.00 0.00 C ATOM 1204 O GLU A 77 -5.444 -13.673 -11.428 1.00 0.00 O ATOM 1205 CB GLU A 77 -8.135 -15.012 -9.889 1.00 0.00 C ATOM 1206 CG GLU A 77 -8.677 -15.007 -11.321 1.00 0.00 C ATOM 1207 CD GLU A 77 -10.164 -15.368 -11.313 1.00 0.00 C ATOM 1208 OE1 GLU A 77 -11.016 -14.485 -11.041 1.00 0.00 O ATOM 1209 OE2 GLU A 77 -10.492 -16.560 -11.508 1.00 0.00 O ATOM 0 H GLU A 77 -7.100 -15.136 -7.770 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.193 -15.811 -10.394 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -8.515 -15.894 -9.373 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -8.527 -14.142 -9.362 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.534 -14.024 -11.770 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -8.123 -15.720 -11.932 1.00 0.00 H new ATOM 1216 N ALA A 78 -6.007 -12.632 -9.518 1.00 0.00 N ATOM 1217 CA ALA A 78 -5.380 -11.364 -9.861 1.00 0.00 C ATOM 1218 C ALA A 78 -3.861 -11.545 -9.967 1.00 0.00 C ATOM 1219 O ALA A 78 -3.260 -11.149 -10.960 1.00 0.00 O ATOM 1220 CB ALA A 78 -5.768 -10.280 -8.842 1.00 0.00 C ATOM 0 H ALA A 78 -6.465 -12.630 -8.606 1.00 0.00 H new ATOM 0 HA ALA A 78 -5.741 -11.031 -10.834 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -5.291 -9.338 -9.113 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -6.850 -10.151 -8.842 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -5.438 -10.581 -7.848 1.00 0.00 H new ATOM 1226 N LEU A 79 -3.229 -12.164 -8.968 1.00 0.00 N ATOM 1227 CA LEU A 79 -1.787 -12.377 -8.933 1.00 0.00 C ATOM 1228 C LEU A 79 -1.335 -13.332 -10.037 1.00 0.00 C ATOM 1229 O LEU A 79 -0.237 -13.172 -10.565 1.00 0.00 O ATOM 1230 CB LEU A 79 -1.333 -12.874 -7.546 1.00 0.00 C ATOM 1231 CG LEU A 79 -0.431 -11.831 -6.861 1.00 0.00 C ATOM 1232 CD1 LEU A 79 -0.312 -12.117 -5.371 1.00 0.00 C ATOM 1233 CD2 LEU A 79 0.972 -11.804 -7.484 1.00 0.00 C ATOM 0 H LEU A 79 -3.714 -12.535 -8.151 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.308 -11.415 -9.117 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -2.205 -13.073 -6.923 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.794 -13.816 -7.650 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.898 -10.857 -7.009 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.330 -11.368 -4.907 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.301 -12.081 -4.914 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.120 -13.107 -5.224 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.581 -11.057 -6.976 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.436 -12.784 -7.377 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.896 -11.552 -8.542 1.00 0.00 H new ATOM 1245 N SER A 80 -2.177 -14.289 -10.414 1.00 0.00 N ATOM 1246 CA SER A 80 -1.920 -15.206 -11.515 1.00 0.00 C ATOM 1247 C SER A 80 -1.923 -14.449 -12.848 1.00 0.00 C ATOM 1248 O SER A 80 -1.074 -14.702 -13.710 1.00 0.00 O ATOM 1249 CB SER A 80 -2.953 -16.339 -11.463 1.00 0.00 C ATOM 1250 OG SER A 80 -2.757 -17.082 -10.270 1.00 0.00 O ATOM 0 H SER A 80 -3.073 -14.450 -9.954 1.00 0.00 H new ATOM 0 HA SER A 80 -0.930 -15.653 -11.423 1.00 0.00 H new ATOM 0 HB2 SER A 80 -3.963 -15.930 -11.491 1.00 0.00 H new ATOM 0 HB3 SER A 80 -2.847 -16.987 -12.333 1.00 0.00 H new ATOM 0 HG SER A 80 -3.082 -16.564 -9.505 1.00 0.00 H new ATOM 1256 N MET A 81 -2.833 -13.483 -13.018 1.00 0.00 N ATOM 1257 CA MET A 81 -2.830 -12.620 -14.196 1.00 0.00 C ATOM 1258 C MET A 81 -1.601 -11.707 -14.158 1.00 0.00 C ATOM 1259 O MET A 81 -0.939 -11.499 -15.174 1.00 0.00 O ATOM 1260 CB MET A 81 -4.127 -11.796 -14.256 1.00 0.00 C ATOM 1261 CG MET A 81 -4.187 -10.918 -15.511 1.00 0.00 C ATOM 1262 SD MET A 81 -4.140 -11.849 -17.064 1.00 0.00 S ATOM 1263 CE MET A 81 -3.671 -10.540 -18.225 1.00 0.00 C ATOM 0 H MET A 81 -3.579 -13.282 -12.352 1.00 0.00 H new ATOM 0 HA MET A 81 -2.781 -13.234 -15.095 1.00 0.00 H new ATOM 0 HB2 MET A 81 -4.985 -12.468 -14.241 1.00 0.00 H new ATOM 0 HB3 MET A 81 -4.199 -11.167 -13.369 1.00 0.00 H new ATOM 0 HG2 MET A 81 -5.100 -10.324 -15.483 1.00 0.00 H new ATOM 0 HG3 MET A 81 -3.351 -10.219 -15.493 1.00 0.00 H new ATOM 0 HE1 MET A 81 -3.600 -10.954 -19.231 1.00 0.00 H new ATOM 0 HE2 MET A 81 -4.425 -9.753 -18.209 1.00 0.00 H new ATOM 0 HE3 MET A 81 -2.706 -10.125 -17.934 1.00 0.00 H new ATOM 1273 N LEU A 82 -1.279 -11.165 -12.982 1.00 0.00 N ATOM 1274 CA LEU A 82 -0.203 -10.210 -12.776 1.00 0.00 C ATOM 1275 C LEU A 82 1.128 -10.839 -13.143 1.00 0.00 C ATOM 1276 O LEU A 82 1.868 -10.283 -13.950 1.00 0.00 O ATOM 1277 CB LEU A 82 -0.190 -9.758 -11.310 1.00 0.00 C ATOM 1278 CG LEU A 82 1.042 -8.933 -10.899 1.00 0.00 C ATOM 1279 CD1 LEU A 82 1.268 -7.693 -11.770 1.00 0.00 C ATOM 1280 CD2 LEU A 82 0.891 -8.523 -9.431 1.00 0.00 C ATOM 0 H LEU A 82 -1.780 -11.390 -12.122 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.365 -9.342 -13.415 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.086 -9.167 -11.119 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.248 -10.640 -10.672 1.00 0.00 H new ATOM 0 HG LEU A 82 1.919 -9.564 -11.042 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.153 -7.161 -11.422 1.00 0.00 H new ATOM 0 HD12 LEU A 82 1.412 -7.998 -12.807 1.00 0.00 H new ATOM 0 HD13 LEU A 82 0.400 -7.037 -11.702 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.758 -7.937 -9.126 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -0.012 -7.924 -9.311 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.819 -9.416 -8.809 1.00 0.00 H new ATOM 1292 N LYS A 83 1.450 -11.981 -12.536 1.00 0.00 N ATOM 1293 CA LYS A 83 2.748 -12.613 -12.750 1.00 0.00 C ATOM 1294 C LYS A 83 2.811 -13.269 -14.130 1.00 0.00 C ATOM 1295 O LYS A 83 3.892 -13.659 -14.556 1.00 0.00 O ATOM 1296 CB LYS A 83 3.042 -13.609 -11.611 1.00 0.00 C ATOM 1297 CG LYS A 83 4.542 -13.761 -11.275 1.00 0.00 C ATOM 1298 CD LYS A 83 5.159 -12.431 -10.804 1.00 0.00 C ATOM 1299 CE LYS A 83 6.328 -12.569 -9.818 1.00 0.00 C ATOM 1300 NZ LYS A 83 7.565 -13.122 -10.404 1.00 0.00 N ATOM 0 H LYS A 83 0.834 -12.483 -11.897 1.00 0.00 H new ATOM 0 HA LYS A 83 3.528 -11.852 -12.730 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.511 -13.286 -10.715 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.642 -14.585 -11.885 1.00 0.00 H new ATOM 0 HG2 LYS A 83 4.666 -14.515 -10.498 1.00 0.00 H new ATOM 0 HG3 LYS A 83 5.077 -14.119 -12.154 1.00 0.00 H new ATOM 0 HD2 LYS A 83 5.504 -11.879 -11.678 1.00 0.00 H new ATOM 0 HD3 LYS A 83 4.378 -11.831 -10.336 1.00 0.00 H new ATOM 0 HE2 LYS A 83 6.548 -11.588 -9.397 1.00 0.00 H new ATOM 0 HE3 LYS A 83 6.016 -13.208 -8.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 8.375 -12.875 -9.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 7.485 -14.157 -10.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 7.707 -12.724 -11.354 1.00 0.00 H new ATOM 1314 N GLY A 84 1.684 -13.381 -14.839 1.00 0.00 N ATOM 1315 CA GLY A 84 1.591 -14.053 -16.123 1.00 0.00 C ATOM 1316 C GLY A 84 1.548 -15.571 -15.962 1.00 0.00 C ATOM 1317 O GLY A 84 1.305 -16.274 -16.939 1.00 0.00 O ATOM 0 H GLY A 84 0.794 -12.995 -14.522 1.00 0.00 H new ATOM 0 HA2 GLY A 84 0.696 -13.717 -16.646 1.00 0.00 H new ATOM 0 HA3 GLY A 84 2.445 -13.776 -16.742 1.00 0.00 H new ATOM 1321 N SER A 85 1.677 -16.090 -14.742 1.00 0.00 N ATOM 1322 CA SER A 85 1.779 -17.503 -14.418 1.00 0.00 C ATOM 1323 C SER A 85 0.982 -17.783 -13.148 1.00 0.00 C ATOM 1324 O SER A 85 0.899 -16.900 -12.293 1.00 0.00 O ATOM 1325 CB SER A 85 3.260 -17.809 -14.161 1.00 0.00 C ATOM 1326 OG SER A 85 3.778 -16.923 -13.176 1.00 0.00 O ATOM 0 H SER A 85 1.715 -15.500 -13.911 1.00 0.00 H new ATOM 0 HA SER A 85 1.390 -18.118 -15.229 1.00 0.00 H new ATOM 0 HB2 SER A 85 3.374 -18.841 -13.829 1.00 0.00 H new ATOM 0 HB3 SER A 85 3.826 -17.707 -15.087 1.00 0.00 H new ATOM 0 HG SER A 85 4.723 -17.127 -13.017 1.00 0.00 H new ATOM 1332 N THR A 86 0.490 -19.006 -12.968 1.00 0.00 N ATOM 1333 CA THR A 86 -0.169 -19.426 -11.741 1.00 0.00 C ATOM 1334 C THR A 86 0.836 -19.298 -10.587 1.00 0.00 C ATOM 1335 O THR A 86 1.937 -19.863 -10.637 1.00 0.00 O ATOM 1336 CB THR A 86 -0.676 -20.864 -11.925 1.00 0.00 C ATOM 1337 OG1 THR A 86 -1.532 -20.923 -13.053 1.00 0.00 O ATOM 1338 CG2 THR A 86 -1.446 -21.381 -10.712 1.00 0.00 C ATOM 0 H THR A 86 0.539 -19.737 -13.677 1.00 0.00 H new ATOM 0 HA THR A 86 -1.030 -18.801 -11.506 1.00 0.00 H new ATOM 0 HB THR A 86 0.204 -21.493 -12.059 1.00 0.00 H new ATOM 0 HG1 THR A 86 -1.854 -21.841 -13.172 1.00 0.00 H new ATOM 0 HG21 THR A 86 -1.779 -22.402 -10.900 1.00 0.00 H new ATOM 0 HG22 THR A 86 -0.797 -21.367 -9.836 1.00 0.00 H new ATOM 0 HG23 THR A 86 -2.312 -20.744 -10.532 1.00 0.00 H new ATOM 1346 N VAL A 87 0.466 -18.554 -9.548 1.00 0.00 N ATOM 1347 CA VAL A 87 1.293 -18.240 -8.387 1.00 0.00 C ATOM 1348 C VAL A 87 0.640 -18.856 -7.151 1.00 0.00 C ATOM 1349 O VAL A 87 -0.585 -18.996 -7.094 1.00 0.00 O ATOM 1350 CB VAL A 87 1.418 -16.699 -8.314 1.00 0.00 C ATOM 1351 CG1 VAL A 87 1.666 -16.127 -6.913 1.00 0.00 C ATOM 1352 CG2 VAL A 87 2.558 -16.234 -9.226 1.00 0.00 C ATOM 0 H VAL A 87 -0.462 -18.134 -9.490 1.00 0.00 H new ATOM 0 HA VAL A 87 2.299 -18.655 -8.454 1.00 0.00 H new ATOM 0 HB VAL A 87 0.446 -16.323 -8.634 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.738 -15.041 -6.971 1.00 0.00 H new ATOM 0 HG12 VAL A 87 0.840 -16.401 -6.257 1.00 0.00 H new ATOM 0 HG13 VAL A 87 2.596 -16.532 -6.514 1.00 0.00 H new ATOM 0 HG21 VAL A 87 2.646 -15.149 -9.174 1.00 0.00 H new ATOM 0 HG22 VAL A 87 3.493 -16.690 -8.900 1.00 0.00 H new ATOM 0 HG23 VAL A 87 2.347 -16.532 -10.253 1.00 0.00 H new ATOM 1362 N GLU A 88 1.443 -19.200 -6.139 1.00 0.00 N ATOM 1363 CA GLU A 88 0.922 -19.665 -4.866 1.00 0.00 C ATOM 1364 C GLU A 88 0.826 -18.426 -3.997 1.00 0.00 C ATOM 1365 O GLU A 88 1.769 -18.048 -3.296 1.00 0.00 O ATOM 1366 CB GLU A 88 1.764 -20.805 -4.273 1.00 0.00 C ATOM 1367 CG GLU A 88 1.428 -22.159 -4.925 1.00 0.00 C ATOM 1368 CD GLU A 88 0.083 -22.750 -4.473 1.00 0.00 C ATOM 1369 OE1 GLU A 88 -0.982 -22.093 -4.588 1.00 0.00 O ATOM 1370 OE2 GLU A 88 0.058 -23.915 -4.023 1.00 0.00 O ATOM 0 H GLU A 88 2.461 -19.162 -6.186 1.00 0.00 H new ATOM 0 HA GLU A 88 -0.061 -20.126 -4.962 1.00 0.00 H new ATOM 0 HB2 GLU A 88 2.823 -20.586 -4.413 1.00 0.00 H new ATOM 0 HB3 GLU A 88 1.590 -20.865 -3.199 1.00 0.00 H new ATOM 0 HG2 GLU A 88 1.414 -22.036 -6.008 1.00 0.00 H new ATOM 0 HG3 GLU A 88 2.222 -22.869 -4.694 1.00 0.00 H new ATOM 1377 N LEU A 89 -0.311 -17.740 -4.140 1.00 0.00 N ATOM 1378 CA LEU A 89 -0.636 -16.586 -3.334 1.00 0.00 C ATOM 1379 C LEU A 89 -0.981 -17.081 -1.939 1.00 0.00 C ATOM 1380 O LEU A 89 -2.037 -17.676 -1.718 1.00 0.00 O ATOM 1381 CB LEU A 89 -1.760 -15.756 -3.944 1.00 0.00 C ATOM 1382 CG LEU A 89 -2.308 -14.723 -2.941 1.00 0.00 C ATOM 1383 CD1 LEU A 89 -1.329 -13.756 -2.276 1.00 0.00 C ATOM 1384 CD2 LEU A 89 -3.291 -13.837 -3.661 1.00 0.00 C ATOM 0 H LEU A 89 -1.028 -17.980 -4.825 1.00 0.00 H new ATOM 0 HA LEU A 89 0.221 -15.914 -3.287 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -1.393 -15.243 -4.833 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -2.566 -16.415 -4.266 1.00 0.00 H new ATOM 0 HG LEU A 89 -2.702 -15.354 -2.145 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.872 -13.096 -1.600 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.586 -14.321 -1.713 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.830 -13.161 -3.040 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -3.691 -13.098 -2.967 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -2.788 -13.328 -4.483 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -4.107 -14.443 -4.055 1.00 0.00 H new ATOM 1396 N THR A 90 -0.086 -16.812 -1.007 1.00 0.00 N ATOM 1397 CA THR A 90 -0.255 -17.106 0.398 1.00 0.00 C ATOM 1398 C THR A 90 -0.660 -15.787 1.068 1.00 0.00 C ATOM 1399 O THR A 90 -0.300 -14.711 0.593 1.00 0.00 O ATOM 1400 CB THR A 90 1.089 -17.643 0.907 1.00 0.00 C ATOM 1401 OG1 THR A 90 1.663 -18.549 -0.033 1.00 0.00 O ATOM 1402 CG2 THR A 90 0.998 -18.373 2.240 1.00 0.00 C ATOM 0 H THR A 90 0.808 -16.368 -1.218 1.00 0.00 H new ATOM 0 HA THR A 90 -1.019 -17.854 0.611 1.00 0.00 H new ATOM 0 HB THR A 90 1.708 -16.756 1.041 1.00 0.00 H new ATOM 0 HG1 THR A 90 2.520 -18.878 0.311 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.988 -18.722 2.532 1.00 0.00 H new ATOM 0 HG22 THR A 90 0.614 -17.694 3.001 1.00 0.00 H new ATOM 0 HG23 THR A 90 0.327 -19.226 2.143 1.00 0.00 H new ATOM 1410 N ILE A 91 -1.372 -15.851 2.184 1.00 0.00 N ATOM 1411 CA ILE A 91 -1.719 -14.690 3.005 1.00 0.00 C ATOM 1412 C ILE A 91 -1.180 -15.097 4.369 1.00 0.00 C ATOM 1413 O ILE A 91 -1.679 -16.075 4.939 1.00 0.00 O ATOM 1414 CB ILE A 91 -3.243 -14.394 3.082 1.00 0.00 C ATOM 1415 CG1 ILE A 91 -4.042 -14.524 1.769 1.00 0.00 C ATOM 1416 CG2 ILE A 91 -3.458 -12.998 3.700 1.00 0.00 C ATOM 1417 CD1 ILE A 91 -3.903 -13.360 0.786 1.00 0.00 C ATOM 0 H ILE A 91 -1.735 -16.729 2.556 1.00 0.00 H new ATOM 0 HA ILE A 91 -1.306 -13.767 2.597 1.00 0.00 H new ATOM 0 HB ILE A 91 -3.649 -15.187 3.710 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -3.730 -15.439 1.265 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -5.097 -14.641 2.018 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -4.526 -12.785 3.756 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -3.030 -12.974 4.702 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -2.971 -12.246 3.079 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -4.506 -13.558 -0.100 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -4.245 -12.440 1.260 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -2.858 -13.251 0.496 1.00 0.00 H new ATOM 1429 N VAL A 92 -0.145 -14.432 4.867 1.00 0.00 N ATOM 1430 CA VAL A 92 0.339 -14.687 6.216 1.00 0.00 C ATOM 1431 C VAL A 92 -0.074 -13.505 7.075 1.00 0.00 C ATOM 1432 O VAL A 92 -0.044 -12.356 6.635 1.00 0.00 O ATOM 1433 CB VAL A 92 1.835 -15.038 6.266 1.00 0.00 C ATOM 1434 CG1 VAL A 92 2.140 -16.253 5.373 1.00 0.00 C ATOM 1435 CG2 VAL A 92 2.777 -13.898 5.863 1.00 0.00 C ATOM 0 H VAL A 92 0.373 -13.715 4.359 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.119 -15.588 6.624 1.00 0.00 H new ATOM 0 HB VAL A 92 2.027 -15.257 7.316 1.00 0.00 H new ATOM 0 HG11 VAL A 92 3.204 -16.484 5.424 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.566 -17.112 5.719 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.867 -16.025 4.343 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.810 -14.239 5.929 1.00 0.00 H new ATOM 0 HG22 VAL A 92 2.561 -13.592 4.839 1.00 0.00 H new ATOM 0 HG23 VAL A 92 2.631 -13.051 6.534 1.00 0.00 H new ATOM 1445 N GLU A 93 -0.516 -13.804 8.284 1.00 0.00 N ATOM 1446 CA GLU A 93 -0.976 -12.825 9.248 1.00 0.00 C ATOM 1447 C GLU A 93 0.295 -12.443 10.007 1.00 0.00 C ATOM 1448 O GLU A 93 0.827 -13.245 10.781 1.00 0.00 O ATOM 1449 CB GLU A 93 -2.115 -13.457 10.077 1.00 0.00 C ATOM 1450 CG GLU A 93 -3.147 -12.440 10.579 1.00 0.00 C ATOM 1451 CD GLU A 93 -4.463 -13.121 10.982 1.00 0.00 C ATOM 1452 OE1 GLU A 93 -5.273 -13.459 10.091 1.00 0.00 O ATOM 1453 OE2 GLU A 93 -4.739 -13.271 12.195 1.00 0.00 O ATOM 0 H GLU A 93 -0.565 -14.762 8.630 1.00 0.00 H new ATOM 0 HA GLU A 93 -1.424 -11.916 8.847 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -2.622 -14.207 9.470 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -1.685 -13.978 10.932 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -2.740 -11.900 11.434 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -3.342 -11.704 9.799 1.00 0.00 H new ATOM 1460 N ASP A 94 0.871 -11.290 9.681 1.00 0.00 N ATOM 1461 CA ASP A 94 2.147 -10.814 10.193 1.00 0.00 C ATOM 1462 C ASP A 94 2.071 -9.315 10.462 1.00 0.00 C ATOM 1463 O ASP A 94 2.203 -8.492 9.560 1.00 0.00 O ATOM 1464 CB ASP A 94 3.278 -11.141 9.212 1.00 0.00 C ATOM 1465 CG ASP A 94 4.630 -10.607 9.694 1.00 0.00 C ATOM 1466 OD1 ASP A 94 4.800 -10.331 10.903 1.00 0.00 O ATOM 1467 OD2 ASP A 94 5.566 -10.565 8.863 1.00 0.00 O ATOM 0 H ASP A 94 0.442 -10.637 9.026 1.00 0.00 H new ATOM 0 HA ASP A 94 2.364 -11.323 11.132 1.00 0.00 H new ATOM 0 HB2 ASP A 94 3.342 -12.221 9.079 1.00 0.00 H new ATOM 0 HB3 ASP A 94 3.046 -10.713 8.237 1.00 0.00 H new ATOM 1472 N ASP A 95 1.839 -8.979 11.729 1.00 0.00 N ATOM 1473 CA ASP A 95 1.784 -7.654 12.355 1.00 0.00 C ATOM 1474 C ASP A 95 2.993 -6.767 12.079 1.00 0.00 C ATOM 1475 O ASP A 95 2.898 -5.557 12.290 1.00 0.00 O ATOM 1476 CB ASP A 95 1.718 -7.901 13.874 1.00 0.00 C ATOM 1477 CG ASP A 95 1.122 -6.735 14.653 1.00 0.00 C ATOM 1478 OD1 ASP A 95 -0.117 -6.559 14.598 1.00 0.00 O ATOM 1479 OD2 ASP A 95 1.878 -6.019 15.352 1.00 0.00 O ATOM 0 H ASP A 95 1.665 -9.708 12.421 1.00 0.00 H new ATOM 0 HA ASP A 95 0.924 -7.127 11.942 1.00 0.00 H new ATOM 0 HB2 ASP A 95 1.125 -8.796 14.063 1.00 0.00 H new ATOM 0 HB3 ASP A 95 2.723 -8.100 14.246 1.00 0.00 H new ATOM 1484 N ASN A 96 4.105 -7.347 11.620 1.00 0.00 N ATOM 1485 CA ASN A 96 5.375 -6.668 11.434 1.00 0.00 C ATOM 1486 C ASN A 96 5.275 -5.388 10.598 1.00 0.00 C ATOM 1487 O ASN A 96 5.030 -5.465 9.391 1.00 0.00 O ATOM 1488 CB ASN A 96 6.428 -7.611 10.864 1.00 0.00 C ATOM 1489 CG ASN A 96 7.754 -6.884 10.752 1.00 0.00 C ATOM 1490 OD1 ASN A 96 8.308 -6.775 9.667 1.00 0.00 O ATOM 1491 ND2 ASN A 96 8.246 -6.348 11.858 1.00 0.00 N ATOM 0 H ASN A 96 4.140 -8.333 11.362 1.00 0.00 H new ATOM 0 HA ASN A 96 5.688 -6.353 12.429 1.00 0.00 H new ATOM 0 HB2 ASN A 96 6.534 -8.485 11.507 1.00 0.00 H new ATOM 0 HB3 ASN A 96 6.116 -7.972 9.884 1.00 0.00 H new ATOM 0 HD21 ASN A 96 9.119 -5.821 11.825 1.00 0.00 H new ATOM 0 HD22 ASN A 96 7.753 -6.462 12.743 1.00 0.00 H new ATOM 1498 N PRO A 97 5.458 -4.207 11.217 1.00 0.00 N ATOM 1499 CA PRO A 97 5.270 -2.931 10.555 1.00 0.00 C ATOM 1500 C PRO A 97 6.511 -2.448 9.799 1.00 0.00 C ATOM 1501 O PRO A 97 6.408 -1.474 9.050 1.00 0.00 O ATOM 1502 CB PRO A 97 4.912 -1.963 11.682 1.00 0.00 C ATOM 1503 CG PRO A 97 5.769 -2.481 12.832 1.00 0.00 C ATOM 1504 CD PRO A 97 5.754 -3.991 12.628 1.00 0.00 C ATOM 0 HA PRO A 97 4.498 -3.006 9.789 1.00 0.00 H new ATOM 0 HB2 PRO A 97 5.154 -0.932 11.426 1.00 0.00 H new ATOM 0 HB3 PRO A 97 3.849 -1.991 11.921 1.00 0.00 H new ATOM 0 HG2 PRO A 97 6.782 -2.080 12.791 1.00 0.00 H new ATOM 0 HG3 PRO A 97 5.354 -2.202 13.800 1.00 0.00 H new ATOM 0 HD2 PRO A 97 6.715 -4.430 12.896 1.00 0.00 H new ATOM 0 HD3 PRO A 97 5.001 -4.462 13.260 1.00 0.00 H new ATOM 1512 N ALA A 98 7.665 -3.101 9.972 1.00 0.00 N ATOM 1513 CA ALA A 98 8.933 -2.647 9.412 1.00 0.00 C ATOM 1514 C ALA A 98 8.966 -2.593 7.887 1.00 0.00 C ATOM 1515 O ALA A 98 9.754 -1.830 7.320 1.00 0.00 O ATOM 1516 CB ALA A 98 10.068 -3.502 9.967 1.00 0.00 C ATOM 0 H ALA A 98 7.741 -3.965 10.509 1.00 0.00 H new ATOM 0 HA ALA A 98 9.062 -1.610 9.724 1.00 0.00 H new ATOM 0 HB1 ALA A 98 11.016 -3.164 9.549 1.00 0.00 H new ATOM 0 HB2 ALA A 98 10.096 -3.409 11.053 1.00 0.00 H new ATOM 0 HB3 ALA A 98 9.904 -4.545 9.696 1.00 0.00 H new ATOM 1522 N VAL A 99 8.079 -3.340 7.243 1.00 0.00 N ATOM 1523 CA VAL A 99 7.870 -3.337 5.804 1.00 0.00 C ATOM 1524 C VAL A 99 6.591 -2.545 5.533 1.00 0.00 C ATOM 1525 O VAL A 99 5.576 -2.707 6.227 1.00 0.00 O ATOM 1526 CB VAL A 99 7.780 -4.771 5.249 1.00 0.00 C ATOM 1527 CG1 VAL A 99 7.980 -4.750 3.725 1.00 0.00 C ATOM 1528 CG2 VAL A 99 8.774 -5.748 5.894 1.00 0.00 C ATOM 0 H VAL A 99 7.462 -3.990 7.730 1.00 0.00 H new ATOM 0 HA VAL A 99 8.714 -2.871 5.296 1.00 0.00 H new ATOM 0 HB VAL A 99 6.785 -5.138 5.500 1.00 0.00 H new ATOM 0 HG11 VAL A 99 7.916 -5.766 3.336 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.206 -4.135 3.265 1.00 0.00 H new ATOM 0 HG13 VAL A 99 8.960 -4.334 3.492 1.00 0.00 H new ATOM 0 HG21 VAL A 99 8.651 -6.737 5.452 1.00 0.00 H new ATOM 0 HG22 VAL A 99 9.792 -5.398 5.722 1.00 0.00 H new ATOM 0 HG23 VAL A 99 8.586 -5.804 6.966 1.00 0.00 H new ATOM 1538 N ARG A 100 6.634 -1.649 4.549 1.00 0.00 N ATOM 1539 CA ARG A 100 5.504 -0.798 4.199 1.00 0.00 C ATOM 1540 C ARG A 100 4.557 -1.553 3.272 1.00 0.00 C ATOM 1541 O ARG A 100 4.993 -2.237 2.349 1.00 0.00 O ATOM 1542 CB ARG A 100 5.988 0.477 3.478 1.00 0.00 C ATOM 1543 CG ARG A 100 7.001 1.326 4.263 1.00 0.00 C ATOM 1544 CD ARG A 100 6.435 1.985 5.530 1.00 0.00 C ATOM 1545 NE ARG A 100 7.535 2.447 6.386 1.00 0.00 N ATOM 1546 CZ ARG A 100 7.475 3.202 7.488 1.00 0.00 C ATOM 1547 NH1 ARG A 100 6.370 3.862 7.829 1.00 0.00 N ATOM 1548 NH2 ARG A 100 8.557 3.278 8.250 1.00 0.00 N ATOM 0 H ARG A 100 7.459 -1.494 3.970 1.00 0.00 H new ATOM 0 HA ARG A 100 4.988 -0.520 5.118 1.00 0.00 H new ATOM 0 HB2 ARG A 100 6.438 0.190 2.528 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.121 1.096 3.246 1.00 0.00 H new ATOM 0 HG2 ARG A 100 7.845 0.695 4.543 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.389 2.105 3.606 1.00 0.00 H new ATOM 0 HD2 ARG A 100 5.796 2.825 5.259 1.00 0.00 H new ATOM 0 HD3 ARG A 100 5.813 1.274 6.074 1.00 0.00 H new ATOM 0 HE ARG A 100 8.469 2.153 6.102 1.00 0.00 H new ATOM 0 HH11 ARG A 100 5.537 3.800 7.243 1.00 0.00 H new ATOM 0 HH12 ARG A 100 6.356 4.430 8.676 1.00 0.00 H new ATOM 0 HH21 ARG A 100 9.402 2.769 7.989 1.00 0.00 H new ATOM 0 HH22 ARG A 100 8.545 3.845 9.098 1.00 0.00 H new ATOM 1562 N THR A 101 3.264 -1.469 3.555 1.00 0.00 N ATOM 1563 CA THR A 101 2.207 -1.998 2.702 1.00 0.00 C ATOM 1564 C THR A 101 2.073 -0.968 1.553 1.00 0.00 C ATOM 1565 O THR A 101 2.680 0.099 1.654 1.00 0.00 O ATOM 1566 CB THR A 101 0.943 -2.141 3.572 1.00 0.00 C ATOM 1567 OG1 THR A 101 0.536 -0.885 4.080 1.00 0.00 O ATOM 1568 CG2 THR A 101 1.200 -3.051 4.772 1.00 0.00 C ATOM 0 H THR A 101 2.913 -1.022 4.402 1.00 0.00 H new ATOM 0 HA THR A 101 2.398 -2.982 2.273 1.00 0.00 H new ATOM 0 HB THR A 101 0.170 -2.566 2.932 1.00 0.00 H new ATOM 0 HG1 THR A 101 -0.269 -0.999 4.628 1.00 0.00 H new ATOM 0 HG21 THR A 101 0.291 -3.133 5.368 1.00 0.00 H new ATOM 0 HG22 THR A 101 1.495 -4.040 4.422 1.00 0.00 H new ATOM 0 HG23 THR A 101 1.998 -2.630 5.384 1.00 0.00 H new ATOM 1576 N PRO A 102 1.282 -1.154 0.482 1.00 0.00 N ATOM 1577 CA PRO A 102 1.180 -0.120 -0.550 1.00 0.00 C ATOM 1578 C PRO A 102 0.447 1.116 0.000 1.00 0.00 C ATOM 1579 O PRO A 102 0.696 2.252 -0.414 1.00 0.00 O ATOM 1580 CB PRO A 102 0.442 -0.780 -1.712 1.00 0.00 C ATOM 1581 CG PRO A 102 -0.451 -1.787 -1.007 1.00 0.00 C ATOM 1582 CD PRO A 102 0.349 -2.231 0.219 1.00 0.00 C ATOM 0 HA PRO A 102 2.153 0.246 -0.879 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -0.137 -0.058 -2.287 1.00 0.00 H new ATOM 0 HB3 PRO A 102 1.129 -1.264 -2.406 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -1.401 -1.338 -0.718 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -0.682 -2.632 -1.655 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -0.305 -2.401 1.074 1.00 0.00 H new ATOM 0 HD3 PRO A 102 0.874 -3.167 0.028 1.00 0.00 H new ATOM 1590 N LEU A 103 -0.442 0.895 0.970 1.00 0.00 N ATOM 1591 CA LEU A 103 -1.163 1.907 1.718 1.00 0.00 C ATOM 1592 C LEU A 103 -0.187 2.689 2.593 1.00 0.00 C ATOM 1593 O LEU A 103 -0.216 3.922 2.596 1.00 0.00 O ATOM 1594 CB LEU A 103 -2.230 1.163 2.529 1.00 0.00 C ATOM 1595 CG LEU A 103 -3.177 2.028 3.373 1.00 0.00 C ATOM 1596 CD1 LEU A 103 -4.466 1.235 3.616 1.00 0.00 C ATOM 1597 CD2 LEU A 103 -2.568 2.377 4.730 1.00 0.00 C ATOM 0 H LEU A 103 -0.686 -0.050 1.265 1.00 0.00 H new ATOM 0 HA LEU A 103 -1.646 2.643 1.075 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -2.832 0.572 1.839 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.726 0.461 3.194 1.00 0.00 H new ATOM 0 HG LEU A 103 -3.367 2.955 2.832 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -5.153 1.833 4.215 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -4.932 0.995 2.660 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -4.231 0.312 4.146 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -3.269 2.990 5.297 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.359 1.460 5.282 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.641 2.930 4.581 1.00 0.00 H new ATOM 1609 N GLU A 104 0.676 1.997 3.341 1.00 0.00 N ATOM 1610 CA GLU A 104 1.694 2.658 4.147 1.00 0.00 C ATOM 1611 C GLU A 104 2.757 3.296 3.261 1.00 0.00 C ATOM 1612 O GLU A 104 3.306 4.308 3.678 1.00 0.00 O ATOM 1613 CB GLU A 104 2.332 1.701 5.165 1.00 0.00 C ATOM 1614 CG GLU A 104 1.487 1.557 6.439 1.00 0.00 C ATOM 1615 CD GLU A 104 1.685 2.717 7.428 1.00 0.00 C ATOM 1616 OE1 GLU A 104 1.582 3.906 7.040 1.00 0.00 O ATOM 1617 OE2 GLU A 104 1.987 2.445 8.609 1.00 0.00 O ATOM 0 H GLU A 104 0.687 0.979 3.402 1.00 0.00 H new ATOM 0 HA GLU A 104 1.198 3.447 4.712 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.463 0.721 4.706 1.00 0.00 H new ATOM 0 HB3 GLU A 104 3.325 2.065 5.429 1.00 0.00 H new ATOM 0 HG2 GLU A 104 0.434 1.497 6.164 1.00 0.00 H new ATOM 0 HG3 GLU A 104 1.742 0.619 6.933 1.00 0.00 H new ATOM 1624 N TRP A 105 3.038 2.777 2.064 1.00 0.00 N ATOM 1625 CA TRP A 105 3.945 3.409 1.114 1.00 0.00 C ATOM 1626 C TRP A 105 3.370 4.758 0.715 1.00 0.00 C ATOM 1627 O TRP A 105 4.111 5.730 0.685 1.00 0.00 O ATOM 1628 CB TRP A 105 4.182 2.548 -0.137 1.00 0.00 C ATOM 1629 CG TRP A 105 5.435 1.733 -0.139 1.00 0.00 C ATOM 1630 CD1 TRP A 105 5.505 0.383 -0.150 1.00 0.00 C ATOM 1631 CD2 TRP A 105 6.813 2.201 -0.248 1.00 0.00 C ATOM 1632 NE1 TRP A 105 6.824 -0.013 -0.237 1.00 0.00 N ATOM 1633 CE2 TRP A 105 7.676 1.069 -0.303 1.00 0.00 C ATOM 1634 CE3 TRP A 105 7.418 3.473 -0.340 1.00 0.00 C ATOM 1635 CZ2 TRP A 105 9.067 1.196 -0.423 1.00 0.00 C ATOM 1636 CZ3 TRP A 105 8.812 3.614 -0.485 1.00 0.00 C ATOM 1637 CH2 TRP A 105 9.639 2.476 -0.517 1.00 0.00 C ATOM 0 H TRP A 105 2.638 1.901 1.728 1.00 0.00 H new ATOM 0 HA TRP A 105 4.913 3.530 1.600 1.00 0.00 H new ATOM 0 HB2 TRP A 105 3.333 1.875 -0.258 1.00 0.00 H new ATOM 0 HB3 TRP A 105 4.196 3.203 -1.008 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.657 -0.284 -0.099 1.00 0.00 H new ATOM 0 HE1 TRP A 105 7.131 -0.986 -0.251 1.00 0.00 H new ATOM 0 HE3 TRP A 105 6.799 4.357 -0.298 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 9.694 0.317 -0.443 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 9.247 4.599 -0.572 1.00 0.00 H new ATOM 0 HH2 TRP A 105 10.709 2.586 -0.613 1.00 0.00 H new ATOM 1648 N ARG A 106 2.058 4.859 0.473 1.00 0.00 N ATOM 1649 CA ARG A 106 1.426 6.139 0.164 1.00 0.00 C ATOM 1650 C ARG A 106 1.726 7.152 1.261 1.00 0.00 C ATOM 1651 O ARG A 106 2.131 8.269 0.963 1.00 0.00 O ATOM 1652 CB ARG A 106 -0.075 5.938 -0.077 1.00 0.00 C ATOM 1653 CG ARG A 106 -0.743 7.194 -0.646 1.00 0.00 C ATOM 1654 CD ARG A 106 -2.212 6.900 -0.976 1.00 0.00 C ATOM 1655 NE ARG A 106 -3.073 8.099 -0.928 1.00 0.00 N ATOM 1656 CZ ARG A 106 -3.522 8.654 0.208 1.00 0.00 C ATOM 1657 NH1 ARG A 106 -2.997 8.312 1.383 1.00 0.00 N ATOM 1658 NH2 ARG A 106 -4.494 9.551 0.182 1.00 0.00 N ATOM 0 H ARG A 106 1.416 4.067 0.486 1.00 0.00 H new ATOM 0 HA ARG A 106 1.841 6.546 -0.758 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -0.222 5.106 -0.766 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -0.558 5.665 0.861 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -0.679 8.009 0.075 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -0.218 7.521 -1.544 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -2.272 6.458 -1.970 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -2.594 6.159 -0.274 1.00 0.00 H new ATOM 0 HE ARG A 106 -3.343 8.531 -1.812 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -2.247 7.622 1.425 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -3.345 8.740 2.241 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -4.910 9.827 -0.708 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -4.828 9.967 1.052 1.00 0.00 H new ATOM 1672 N GLN A 107 1.545 6.774 2.526 1.00 0.00 N ATOM 1673 CA GLN A 107 1.821 7.691 3.629 1.00 0.00 C ATOM 1674 C GLN A 107 3.336 7.950 3.721 1.00 0.00 C ATOM 1675 O GLN A 107 3.759 9.095 3.870 1.00 0.00 O ATOM 1676 CB GLN A 107 1.236 7.121 4.934 1.00 0.00 C ATOM 1677 CG GLN A 107 0.777 8.211 5.918 1.00 0.00 C ATOM 1678 CD GLN A 107 1.874 9.192 6.317 1.00 0.00 C ATOM 1679 OE1 GLN A 107 1.859 10.354 5.912 1.00 0.00 O ATOM 1680 NE2 GLN A 107 2.837 8.748 7.097 1.00 0.00 N ATOM 0 H GLN A 107 1.213 5.852 2.809 1.00 0.00 H new ATOM 0 HA GLN A 107 1.340 8.653 3.452 1.00 0.00 H new ATOM 0 HB2 GLN A 107 0.390 6.477 4.695 1.00 0.00 H new ATOM 0 HB3 GLN A 107 1.986 6.496 5.418 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -0.047 8.766 5.470 1.00 0.00 H new ATOM 0 HG3 GLN A 107 0.387 7.733 6.817 1.00 0.00 H new ATOM 0 HE21 GLN A 107 2.827 7.780 7.419 1.00 0.00 H new ATOM 0 HE22 GLN A 107 3.593 9.372 7.379 1.00 0.00 H new ATOM 1689 N ALA A 108 4.163 6.908 3.588 1.00 0.00 N ATOM 1690 CA ALA A 108 5.612 7.001 3.699 1.00 0.00 C ATOM 1691 C ALA A 108 6.180 7.902 2.616 1.00 0.00 C ATOM 1692 O ALA A 108 7.147 8.587 2.880 1.00 0.00 O ATOM 1693 CB ALA A 108 6.270 5.620 3.617 1.00 0.00 C ATOM 0 H ALA A 108 3.833 5.962 3.397 1.00 0.00 H new ATOM 0 HA ALA A 108 5.834 7.432 4.675 1.00 0.00 H new ATOM 0 HB1 ALA A 108 7.351 5.726 3.703 1.00 0.00 H new ATOM 0 HB2 ALA A 108 5.901 4.993 4.428 1.00 0.00 H new ATOM 0 HB3 ALA A 108 6.026 5.157 2.661 1.00 0.00 H new ATOM 1699 N ILE A 109 5.586 7.969 1.428 1.00 0.00 N ATOM 1700 CA ILE A 109 6.017 8.853 0.347 1.00 0.00 C ATOM 1701 C ILE A 109 5.792 10.315 0.745 1.00 0.00 C ATOM 1702 O ILE A 109 6.497 11.204 0.262 1.00 0.00 O ATOM 1703 CB ILE A 109 5.299 8.416 -0.943 1.00 0.00 C ATOM 1704 CG1 ILE A 109 5.881 7.050 -1.388 1.00 0.00 C ATOM 1705 CG2 ILE A 109 5.326 9.461 -2.066 1.00 0.00 C ATOM 1706 CD1 ILE A 109 7.024 7.071 -2.406 1.00 0.00 C ATOM 0 H ILE A 109 4.776 7.400 1.184 1.00 0.00 H new ATOM 0 HA ILE A 109 7.087 8.776 0.156 1.00 0.00 H new ATOM 0 HB ILE A 109 4.237 8.313 -0.719 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.232 6.527 -0.498 1.00 0.00 H new ATOM 0 HG13 ILE A 109 5.068 6.457 -1.807 1.00 0.00 H new ATOM 0 HG21 ILE A 109 4.798 9.073 -2.937 1.00 0.00 H new ATOM 0 HG22 ILE A 109 4.839 10.375 -1.725 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.359 9.679 -2.335 1.00 0.00 H new ATOM 0 HD11 ILE A 109 7.333 6.049 -2.627 1.00 0.00 H new ATOM 0 HD12 ILE A 109 6.686 7.554 -3.323 1.00 0.00 H new ATOM 0 HD13 ILE A 109 7.868 7.625 -1.994 1.00 0.00 H new ATOM 1718 N TYR A 110 4.835 10.597 1.633 1.00 0.00 N ATOM 1719 CA TYR A 110 4.674 11.941 2.150 1.00 0.00 C ATOM 1720 C TYR A 110 5.811 12.161 3.137 1.00 0.00 C ATOM 1721 O TYR A 110 6.561 13.135 3.013 1.00 0.00 O ATOM 1722 CB TYR A 110 3.303 12.159 2.799 1.00 0.00 C ATOM 1723 CG TYR A 110 2.959 13.635 2.898 1.00 0.00 C ATOM 1724 CD1 TYR A 110 3.664 14.484 3.775 1.00 0.00 C ATOM 1725 CD2 TYR A 110 1.960 14.173 2.066 1.00 0.00 C ATOM 1726 CE1 TYR A 110 3.370 15.858 3.822 1.00 0.00 C ATOM 1727 CE2 TYR A 110 1.634 15.538 2.133 1.00 0.00 C ATOM 1728 CZ TYR A 110 2.339 16.382 3.015 1.00 0.00 C ATOM 1729 OH TYR A 110 1.978 17.687 3.132 1.00 0.00 O ATOM 0 H TYR A 110 4.171 9.915 2.000 1.00 0.00 H new ATOM 0 HA TYR A 110 4.715 12.668 1.339 1.00 0.00 H new ATOM 0 HB2 TYR A 110 2.538 11.645 2.217 1.00 0.00 H new ATOM 0 HB3 TYR A 110 3.297 11.716 3.795 1.00 0.00 H new ATOM 0 HD1 TYR A 110 4.434 14.077 4.414 1.00 0.00 H new ATOM 0 HD2 TYR A 110 1.440 13.532 1.370 1.00 0.00 H new ATOM 0 HE1 TYR A 110 3.932 16.510 4.474 1.00 0.00 H new ATOM 0 HE2 TYR A 110 0.847 15.939 1.512 1.00 0.00 H new ATOM 0 HH TYR A 110 1.253 17.884 2.502 1.00 0.00 H new ATOM 1739 N GLU A 111 5.957 11.234 4.089 1.00 0.00 N ATOM 1740 CA GLU A 111 6.950 11.321 5.144 1.00 0.00 C ATOM 1741 C GLU A 111 8.375 11.210 4.591 1.00 0.00 C ATOM 1742 O GLU A 111 9.309 11.623 5.256 1.00 0.00 O ATOM 1743 CB GLU A 111 6.672 10.314 6.271 1.00 0.00 C ATOM 1744 CG GLU A 111 7.189 10.927 7.587 1.00 0.00 C ATOM 1745 CD GLU A 111 7.181 10.005 8.802 1.00 0.00 C ATOM 1746 OE1 GLU A 111 7.463 8.793 8.682 1.00 0.00 O ATOM 1747 OE2 GLU A 111 7.011 10.541 9.928 1.00 0.00 O ATOM 0 H GLU A 111 5.378 10.396 4.142 1.00 0.00 H new ATOM 0 HA GLU A 111 6.869 12.312 5.590 1.00 0.00 H new ATOM 0 HB2 GLU A 111 5.605 10.103 6.341 1.00 0.00 H new ATOM 0 HB3 GLU A 111 7.171 9.366 6.069 1.00 0.00 H new ATOM 0 HG2 GLU A 111 8.209 11.275 7.426 1.00 0.00 H new ATOM 0 HG3 GLU A 111 6.585 11.805 7.818 1.00 0.00 H new ATOM 1754 N GLU A 112 8.577 10.749 3.363 1.00 0.00 N ATOM 1755 CA GLU A 112 9.853 10.710 2.675 1.00 0.00 C ATOM 1756 C GLU A 112 10.350 12.141 2.524 1.00 0.00 C ATOM 1757 O GLU A 112 11.535 12.381 2.699 1.00 0.00 O ATOM 1758 CB GLU A 112 9.677 10.047 1.299 1.00 0.00 C ATOM 1759 CG GLU A 112 9.987 8.541 1.257 1.00 0.00 C ATOM 1760 CD GLU A 112 11.477 8.176 1.277 1.00 0.00 C ATOM 1761 OE1 GLU A 112 12.343 9.048 1.037 1.00 0.00 O ATOM 1762 OE2 GLU A 112 11.787 6.978 1.485 1.00 0.00 O ATOM 0 H GLU A 112 7.816 10.375 2.796 1.00 0.00 H new ATOM 0 HA GLU A 112 10.580 10.127 3.241 1.00 0.00 H new ATOM 0 HB2 GLU A 112 8.650 10.200 0.968 1.00 0.00 H new ATOM 0 HB3 GLU A 112 10.322 10.555 0.583 1.00 0.00 H new ATOM 0 HG2 GLU A 112 9.502 8.063 2.108 1.00 0.00 H new ATOM 0 HG3 GLU A 112 9.539 8.120 0.357 1.00 0.00 H new ATOM 1769 N LYS A 113 9.468 13.121 2.288 1.00 0.00 N ATOM 1770 CA LYS A 113 9.900 14.516 2.201 1.00 0.00 C ATOM 1771 C LYS A 113 10.220 15.080 3.583 1.00 0.00 C ATOM 1772 O LYS A 113 11.067 15.965 3.705 1.00 0.00 O ATOM 1773 CB LYS A 113 8.863 15.353 1.438 1.00 0.00 C ATOM 1774 CG LYS A 113 9.338 16.805 1.254 1.00 0.00 C ATOM 1775 CD LYS A 113 8.667 17.543 0.085 1.00 0.00 C ATOM 1776 CE LYS A 113 9.068 16.986 -1.289 1.00 0.00 C ATOM 1777 NZ LYS A 113 10.509 17.139 -1.575 1.00 0.00 N ATOM 0 H LYS A 113 8.467 12.975 2.156 1.00 0.00 H new ATOM 0 HA LYS A 113 10.828 14.564 1.631 1.00 0.00 H new ATOM 0 HB2 LYS A 113 8.677 14.903 0.463 1.00 0.00 H new ATOM 0 HB3 LYS A 113 7.917 15.344 1.979 1.00 0.00 H new ATOM 0 HG2 LYS A 113 9.148 17.357 2.175 1.00 0.00 H new ATOM 0 HG3 LYS A 113 10.417 16.806 1.098 1.00 0.00 H new ATOM 0 HD2 LYS A 113 7.585 17.477 0.195 1.00 0.00 H new ATOM 0 HD3 LYS A 113 8.929 18.600 0.132 1.00 0.00 H new ATOM 0 HE2 LYS A 113 8.804 15.930 -1.338 1.00 0.00 H new ATOM 0 HE3 LYS A 113 8.493 17.495 -2.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 10.700 16.856 -2.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 10.786 18.132 -1.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 11.057 16.537 -0.928 1.00 0.00 H new ATOM 1791 N LEU A 114 9.566 14.584 4.635 1.00 0.00 N ATOM 1792 CA LEU A 114 9.878 14.968 6.008 1.00 0.00 C ATOM 1793 C LEU A 114 11.246 14.385 6.342 1.00 0.00 C ATOM 1794 O LEU A 114 12.131 15.108 6.788 1.00 0.00 O ATOM 1795 CB LEU A 114 8.817 14.475 7.013 1.00 0.00 C ATOM 1796 CG LEU A 114 7.495 15.265 7.099 1.00 0.00 C ATOM 1797 CD1 LEU A 114 7.719 16.693 7.589 1.00 0.00 C ATOM 1798 CD2 LEU A 114 6.726 15.341 5.778 1.00 0.00 C ATOM 0 H LEU A 114 8.807 13.907 4.557 1.00 0.00 H new ATOM 0 HA LEU A 114 9.883 16.055 6.087 1.00 0.00 H new ATOM 0 HB2 LEU A 114 8.575 13.441 6.767 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.270 14.469 8.004 1.00 0.00 H new ATOM 0 HG LEU A 114 6.896 14.700 7.813 1.00 0.00 H new ATOM 0 HD11 LEU A 114 6.764 17.216 7.636 1.00 0.00 H new ATOM 0 HD12 LEU A 114 8.169 16.671 8.581 1.00 0.00 H new ATOM 0 HD13 LEU A 114 8.384 17.214 6.900 1.00 0.00 H new ATOM 0 HD21 LEU A 114 5.809 15.913 5.923 1.00 0.00 H new ATOM 0 HD22 LEU A 114 7.344 15.831 5.025 1.00 0.00 H new ATOM 0 HD23 LEU A 114 6.477 14.334 5.444 1.00 0.00 H new ATOM 1810 N ALA A 115 11.440 13.092 6.099 1.00 0.00 N ATOM 1811 CA ALA A 115 12.668 12.374 6.386 1.00 0.00 C ATOM 1812 C ALA A 115 13.812 12.952 5.567 1.00 0.00 C ATOM 1813 O ALA A 115 14.911 13.112 6.088 1.00 0.00 O ATOM 1814 CB ALA A 115 12.489 10.890 6.070 1.00 0.00 C ATOM 0 H ALA A 115 10.721 12.500 5.683 1.00 0.00 H new ATOM 0 HA ALA A 115 12.905 12.482 7.444 1.00 0.00 H new ATOM 0 HB1 ALA A 115 13.415 10.357 6.288 1.00 0.00 H new ATOM 0 HB2 ALA A 115 11.684 10.482 6.681 1.00 0.00 H new ATOM 0 HB3 ALA A 115 12.241 10.770 5.015 1.00 0.00 H new ATOM 1820 N GLN A 116 13.559 13.337 4.316 1.00 0.00 N ATOM 1821 CA GLN A 116 14.580 13.890 3.446 1.00 0.00 C ATOM 1822 C GLN A 116 15.111 15.216 3.981 1.00 0.00 C ATOM 1823 O GLN A 116 16.281 15.526 3.770 1.00 0.00 O ATOM 1824 CB GLN A 116 14.083 14.001 2.003 1.00 0.00 C ATOM 1825 CG GLN A 116 14.327 12.709 1.203 1.00 0.00 C ATOM 1826 CD GLN A 116 15.809 12.487 0.885 1.00 0.00 C ATOM 1827 OE1 GLN A 116 16.542 13.431 0.595 1.00 0.00 O ATOM 1828 NE2 GLN A 116 16.299 11.263 0.957 1.00 0.00 N ATOM 0 H GLN A 116 12.638 13.271 3.883 1.00 0.00 H new ATOM 0 HA GLN A 116 15.421 13.197 3.437 1.00 0.00 H new ATOM 0 HB2 GLN A 116 13.017 14.230 2.004 1.00 0.00 H new ATOM 0 HB3 GLN A 116 14.587 14.832 1.510 1.00 0.00 H new ATOM 0 HG2 GLN A 116 13.949 11.858 1.769 1.00 0.00 H new ATOM 0 HG3 GLN A 116 13.761 12.749 0.272 1.00 0.00 H new ATOM 0 HE21 GLN A 116 15.688 10.482 1.198 1.00 0.00 H new ATOM 0 HE22 GLN A 116 17.288 11.098 0.772 1.00 0.00 H new ATOM 1837 N ALA A 117 14.303 15.958 4.744 1.00 0.00 N ATOM 1838 CA ALA A 117 14.772 17.170 5.406 1.00 0.00 C ATOM 1839 C ALA A 117 15.844 16.845 6.459 1.00 0.00 C ATOM 1840 O ALA A 117 16.587 17.736 6.867 1.00 0.00 O ATOM 1841 CB ALA A 117 13.596 17.928 6.029 1.00 0.00 C ATOM 0 H ALA A 117 13.322 15.737 4.916 1.00 0.00 H new ATOM 0 HA ALA A 117 15.233 17.813 4.656 1.00 0.00 H new ATOM 0 HB1 ALA A 117 13.963 18.830 6.519 1.00 0.00 H new ATOM 0 HB2 ALA A 117 12.886 18.202 5.249 1.00 0.00 H new ATOM 0 HB3 ALA A 117 13.101 17.292 6.763 1.00 0.00 H new ATOM 1847 N ARG A 118 15.916 15.598 6.943 1.00 0.00 N ATOM 1848 CA ARG A 118 16.953 15.104 7.835 1.00 0.00 C ATOM 1849 C ARG A 118 18.034 14.408 7.009 1.00 0.00 C ATOM 1850 O ARG A 118 19.205 14.532 7.347 1.00 0.00 O ATOM 1851 CB ARG A 118 16.363 14.151 8.890 1.00 0.00 C ATOM 1852 CG ARG A 118 17.331 13.952 10.068 1.00 0.00 C ATOM 1853 CD ARG A 118 16.895 12.810 10.996 1.00 0.00 C ATOM 1854 NE ARG A 118 15.637 13.089 11.703 1.00 0.00 N ATOM 1855 CZ ARG A 118 15.480 13.798 12.826 1.00 0.00 C ATOM 1856 NH1 ARG A 118 16.502 14.444 13.379 1.00 0.00 N ATOM 1857 NH2 ARG A 118 14.273 13.845 13.375 1.00 0.00 N ATOM 0 H ARG A 118 15.224 14.885 6.711 1.00 0.00 H new ATOM 0 HA ARG A 118 17.397 15.943 8.370 1.00 0.00 H new ATOM 0 HB2 ARG A 118 15.418 14.552 9.257 1.00 0.00 H new ATOM 0 HB3 ARG A 118 16.144 13.187 8.430 1.00 0.00 H new ATOM 0 HG2 ARG A 118 18.329 13.743 9.683 1.00 0.00 H new ATOM 0 HG3 ARG A 118 17.397 14.877 10.641 1.00 0.00 H new ATOM 0 HD2 ARG A 118 16.781 11.898 10.411 1.00 0.00 H new ATOM 0 HD3 ARG A 118 17.682 12.623 11.727 1.00 0.00 H new ATOM 0 HE ARG A 118 14.789 12.698 11.291 1.00 0.00 H new ATOM 0 HH11 ARG A 118 17.425 14.404 12.946 1.00 0.00 H new ATOM 0 HH12 ARG A 118 16.363 14.980 14.236 1.00 0.00 H new ATOM 0 HH21 ARG A 118 13.495 13.348 12.940 1.00 0.00 H new ATOM 0 HH22 ARG A 118 14.123 14.378 14.232 1.00 0.00 H new ATOM 1871 N GLU A 119 17.683 13.728 5.915 1.00 0.00 N ATOM 1872 CA GLU A 119 18.647 13.077 5.033 1.00 0.00 C ATOM 1873 C GLU A 119 19.634 14.101 4.484 1.00 0.00 C ATOM 1874 O GLU A 119 20.816 13.799 4.399 1.00 0.00 O ATOM 1875 CB GLU A 119 17.976 12.352 3.872 1.00 0.00 C ATOM 1876 CG GLU A 119 17.136 11.133 4.293 1.00 0.00 C ATOM 1877 CD GLU A 119 17.944 9.832 4.277 1.00 0.00 C ATOM 1878 OE1 GLU A 119 18.583 9.505 3.248 1.00 0.00 O ATOM 1879 OE2 GLU A 119 17.916 9.083 5.277 1.00 0.00 O ATOM 0 H GLU A 119 16.714 13.614 5.617 1.00 0.00 H new ATOM 0 HA GLU A 119 19.172 12.333 5.633 1.00 0.00 H new ATOM 0 HB2 GLU A 119 17.335 13.055 3.340 1.00 0.00 H new ATOM 0 HB3 GLU A 119 18.743 12.026 3.169 1.00 0.00 H new ATOM 0 HG2 GLU A 119 16.738 11.298 5.294 1.00 0.00 H new ATOM 0 HG3 GLU A 119 16.282 11.035 3.623 1.00 0.00 H new ATOM 1886 N SER A 120 19.188 15.327 4.192 1.00 0.00 N ATOM 1887 CA SER A 120 20.081 16.402 3.776 1.00 0.00 C ATOM 1888 C SER A 120 21.169 16.686 4.822 1.00 0.00 C ATOM 1889 O SER A 120 22.316 16.954 4.460 1.00 0.00 O ATOM 1890 CB SER A 120 19.255 17.662 3.507 1.00 0.00 C ATOM 1891 OG SER A 120 18.444 17.481 2.363 1.00 0.00 O ATOM 0 H SER A 120 18.205 15.596 4.238 1.00 0.00 H new ATOM 0 HA SER A 120 20.592 16.090 2.865 1.00 0.00 H new ATOM 0 HB2 SER A 120 18.631 17.888 4.372 1.00 0.00 H new ATOM 0 HB3 SER A 120 19.917 18.515 3.361 1.00 0.00 H new ATOM 0 HG SER A 120 17.694 16.890 2.584 1.00 0.00 H new ATOM 1897 N ILE A 121 20.821 16.617 6.109 1.00 0.00 N ATOM 1898 CA ILE A 121 21.742 16.806 7.226 1.00 0.00 C ATOM 1899 C ILE A 121 22.667 15.584 7.289 1.00 0.00 C ATOM 1900 O ILE A 121 23.867 15.735 7.494 1.00 0.00 O ATOM 1901 CB ILE A 121 20.962 17.012 8.554 1.00 0.00 C ATOM 1902 CG1 ILE A 121 19.840 18.074 8.420 1.00 0.00 C ATOM 1903 CG2 ILE A 121 21.929 17.404 9.684 1.00 0.00 C ATOM 1904 CD1 ILE A 121 18.898 18.129 9.626 1.00 0.00 C ATOM 0 H ILE A 121 19.865 16.423 6.408 1.00 0.00 H new ATOM 0 HA ILE A 121 22.342 17.704 7.078 1.00 0.00 H new ATOM 0 HB ILE A 121 20.483 16.063 8.797 1.00 0.00 H new ATOM 0 HG12 ILE A 121 20.295 19.055 8.280 1.00 0.00 H new ATOM 0 HG13 ILE A 121 19.257 17.863 7.524 1.00 0.00 H new ATOM 0 HG21 ILE A 121 21.370 17.545 10.609 1.00 0.00 H new ATOM 0 HG22 ILE A 121 22.666 16.613 9.823 1.00 0.00 H new ATOM 0 HG23 ILE A 121 22.438 18.332 9.422 1.00 0.00 H new ATOM 0 HD11 ILE A 121 18.140 18.894 9.461 1.00 0.00 H new ATOM 0 HD12 ILE A 121 18.414 17.161 9.754 1.00 0.00 H new ATOM 0 HD13 ILE A 121 19.469 18.371 10.523 1.00 0.00 H new ATOM 1916 N ILE A 122 22.126 14.379 7.087 1.00 0.00 N ATOM 1917 CA ILE A 122 22.857 13.116 7.049 1.00 0.00 C ATOM 1918 C ILE A 122 23.942 13.166 5.970 1.00 0.00 C ATOM 1919 O ILE A 122 25.117 12.928 6.264 1.00 0.00 O ATOM 1920 CB ILE A 122 21.840 11.942 6.957 1.00 0.00 C ATOM 1921 CG1 ILE A 122 21.669 11.225 8.311 1.00 0.00 C ATOM 1922 CG2 ILE A 122 22.103 10.891 5.867 1.00 0.00 C ATOM 1923 CD1 ILE A 122 21.093 12.146 9.392 1.00 0.00 C ATOM 0 H ILE A 122 21.124 14.255 6.940 1.00 0.00 H new ATOM 0 HA ILE A 122 23.413 12.937 7.969 1.00 0.00 H new ATOM 0 HB ILE A 122 20.921 12.450 6.663 1.00 0.00 H new ATOM 0 HG12 ILE A 122 21.012 10.365 8.183 1.00 0.00 H new ATOM 0 HG13 ILE A 122 22.635 10.842 8.641 1.00 0.00 H new ATOM 0 HG21 ILE A 122 21.327 10.126 5.904 1.00 0.00 H new ATOM 0 HG22 ILE A 122 22.092 11.371 4.889 1.00 0.00 H new ATOM 0 HG23 ILE A 122 23.076 10.429 6.034 1.00 0.00 H new ATOM 0 HD11 ILE A 122 20.992 11.593 10.326 1.00 0.00 H new ATOM 0 HD12 ILE A 122 21.762 12.993 9.543 1.00 0.00 H new ATOM 0 HD13 ILE A 122 20.114 12.508 9.078 1.00 0.00 H new ATOM 1935 N ALA A 123 23.560 13.539 4.748 1.00 0.00 N ATOM 1936 CA ALA A 123 24.428 13.632 3.590 1.00 0.00 C ATOM 1937 C ALA A 123 25.584 14.596 3.848 1.00 0.00 C ATOM 1938 O ALA A 123 26.665 14.406 3.287 1.00 0.00 O ATOM 1939 CB ALA A 123 23.602 14.075 2.378 1.00 0.00 C ATOM 0 H ALA A 123 22.595 13.794 4.537 1.00 0.00 H new ATOM 0 HA ALA A 123 24.863 12.653 3.388 1.00 0.00 H new ATOM 0 HB1 ALA A 123 24.249 14.147 1.504 1.00 0.00 H new ATOM 0 HB2 ALA A 123 22.815 13.346 2.188 1.00 0.00 H new ATOM 0 HB3 ALA A 123 23.154 15.048 2.579 1.00 0.00 H new ATOM 1945 N ASP A 124 25.372 15.612 4.685 1.00 0.00 N ATOM 1946 CA ASP A 124 26.368 16.618 5.015 1.00 0.00 C ATOM 1947 C ASP A 124 27.196 16.181 6.218 1.00 0.00 C ATOM 1948 O ASP A 124 28.362 15.825 6.051 1.00 0.00 O ATOM 1949 CB ASP A 124 25.710 17.990 5.246 1.00 0.00 C ATOM 1950 CG ASP A 124 25.310 18.691 3.944 1.00 0.00 C ATOM 1951 OD1 ASP A 124 25.979 18.489 2.898 1.00 0.00 O ATOM 1952 OD2 ASP A 124 24.342 19.489 3.954 1.00 0.00 O ATOM 0 H ASP A 124 24.481 15.757 5.160 1.00 0.00 H new ATOM 0 HA ASP A 124 27.046 16.722 4.168 1.00 0.00 H new ATOM 0 HB2 ASP A 124 24.825 17.862 5.869 1.00 0.00 H new ATOM 0 HB3 ASP A 124 26.399 18.629 5.799 1.00 0.00 H new ATOM 1957 N ASN A 125 26.616 16.122 7.419 1.00 0.00 N ATOM 1958 CA ASN A 125 27.323 15.854 8.672 1.00 0.00 C ATOM 1959 C ASN A 125 26.594 14.868 9.596 1.00 0.00 C ATOM 1960 O ASN A 125 25.868 15.273 10.509 1.00 0.00 O ATOM 1961 CB ASN A 125 27.655 17.195 9.375 1.00 0.00 C ATOM 1962 CG ASN A 125 26.523 18.230 9.415 1.00 0.00 C ATOM 1963 OD1 ASN A 125 26.660 19.332 8.893 1.00 0.00 O ATOM 1964 ND2 ASN A 125 25.387 17.935 10.017 1.00 0.00 N ATOM 0 H ASN A 125 25.614 16.263 7.550 1.00 0.00 H new ATOM 0 HA ASN A 125 28.254 15.346 8.423 1.00 0.00 H new ATOM 0 HB2 ASN A 125 27.961 16.980 10.399 1.00 0.00 H new ATOM 0 HB3 ASN A 125 28.513 17.643 8.874 1.00 0.00 H new ATOM 0 HD21 ASN A 125 24.632 18.620 10.046 1.00 0.00 H new ATOM 0 HD22 ASN A 125 25.264 17.022 10.454 1.00 0.00 H new ATOM 1971 N ASN A 126 26.794 13.558 9.408 1.00 0.00 N ATOM 1972 CA ASN A 126 26.266 12.530 10.305 1.00 0.00 C ATOM 1973 C ASN A 126 27.108 11.268 10.169 1.00 0.00 C ATOM 1974 O ASN A 126 27.166 10.676 9.090 1.00 0.00 O ATOM 1975 CB ASN A 126 24.799 12.224 10.012 1.00 0.00 C ATOM 1976 CG ASN A 126 24.120 11.560 11.200 1.00 0.00 C ATOM 1977 OD1 ASN A 126 23.377 12.227 11.915 1.00 0.00 O ATOM 1978 ND2 ASN A 126 24.334 10.284 11.451 1.00 0.00 N ATOM 0 H ASN A 126 27.329 13.182 8.625 1.00 0.00 H new ATOM 0 HA ASN A 126 26.320 12.903 11.328 1.00 0.00 H new ATOM 0 HB2 ASN A 126 24.276 13.147 9.762 1.00 0.00 H new ATOM 0 HB3 ASN A 126 24.729 11.573 9.141 1.00 0.00 H new ATOM 0 HD21 ASN A 126 23.880 9.838 12.248 1.00 0.00 H new ATOM 0 HD22 ASN A 126 24.954 9.743 10.848 1.00 0.00 H new ATOM 1985 N ILE A 127 27.770 10.871 11.251 1.00 0.00 N ATOM 1986 CA ILE A 127 28.720 9.757 11.297 1.00 0.00 C ATOM 1987 C ILE A 127 28.363 8.764 12.409 1.00 0.00 C ATOM 1988 O ILE A 127 28.557 7.560 12.230 1.00 0.00 O ATOM 1989 CB ILE A 127 30.161 10.325 11.369 1.00 0.00 C ATOM 1990 CG1 ILE A 127 31.258 9.235 11.321 1.00 0.00 C ATOM 1991 CG2 ILE A 127 30.380 11.332 12.518 1.00 0.00 C ATOM 1992 CD1 ILE A 127 31.708 8.638 12.666 1.00 0.00 C ATOM 0 H ILE A 127 27.658 11.331 12.155 1.00 0.00 H new ATOM 0 HA ILE A 127 28.661 9.166 10.383 1.00 0.00 H new ATOM 0 HB ILE A 127 30.269 10.901 10.450 1.00 0.00 H new ATOM 0 HG12 ILE A 127 30.899 8.420 10.692 1.00 0.00 H new ATOM 0 HG13 ILE A 127 32.134 9.657 10.828 1.00 0.00 H new ATOM 0 HG21 ILE A 127 31.412 11.684 12.502 1.00 0.00 H new ATOM 0 HG22 ILE A 127 29.706 12.179 12.393 1.00 0.00 H new ATOM 0 HG23 ILE A 127 30.178 10.845 13.472 1.00 0.00 H new ATOM 0 HD11 ILE A 127 32.479 7.887 12.491 1.00 0.00 H new ATOM 0 HD12 ILE A 127 32.109 9.429 13.299 1.00 0.00 H new ATOM 0 HD13 ILE A 127 30.855 8.174 13.161 1.00 0.00 H new ATOM 2004 N GLN A 128 27.794 9.234 13.519 1.00 0.00 N ATOM 2005 CA GLN A 128 27.392 8.435 14.667 1.00 0.00 C ATOM 2006 C GLN A 128 25.939 8.743 14.968 1.00 0.00 C ATOM 2007 O GLN A 128 25.223 7.805 15.379 1.00 0.00 O ATOM 2008 CB GLN A 128 28.327 8.729 15.858 1.00 0.00 C ATOM 2009 CG GLN A 128 27.927 8.078 17.197 1.00 0.00 C ATOM 2010 CD GLN A 128 27.927 6.546 17.171 1.00 0.00 C ATOM 2011 OE1 GLN A 128 28.853 5.901 17.645 1.00 0.00 O ATOM 2012 NE2 GLN A 128 26.883 5.934 16.637 1.00 0.00 N ATOM 2013 OXT GLN A 128 25.522 9.913 14.805 1.00 0.00 O ATOM 0 H GLN A 128 27.594 10.226 13.644 1.00 0.00 H new ATOM 0 HA GLN A 128 27.478 7.368 14.461 1.00 0.00 H new ATOM 0 HB2 GLN A 128 29.332 8.396 15.599 1.00 0.00 H new ATOM 0 HB3 GLN A 128 28.376 9.809 16.000 1.00 0.00 H new ATOM 0 HG2 GLN A 128 28.613 8.418 17.973 1.00 0.00 H new ATOM 0 HG3 GLN A 128 26.932 8.426 17.475 1.00 0.00 H new ATOM 0 HE21 GLN A 128 26.117 6.481 16.245 1.00 0.00 H new ATOM 0 HE22 GLN A 128 26.844 4.915 16.617 1.00 0.00 H new TER 2022 GLN A 128