USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 760 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 70 GLN : amide:sc= 0.953 K(o=2.1,f=-13!) USER MOD Set 1.2: A 73 LYS NZ :NH3+ -174:sc= 1.19 (180deg=0) USER MOD Set 2.1: A 11 LYS NZ :NH3+ 180:sc= 2.58 (180deg=1.33) USER MOD Set 2.2: A 47 TYR OH : rot 180:sc= 1.01 USER MOD Set 3.1: A 27 GLN : amide:sc= -1.35 K(o=-1.4,f=-3.3!) USER MOD Set 3.2: A 31 ASN : amide:sc= -0.104 K(o=-1.4,f=-4) USER MOD Single : A 1 MET CE :methyl -140:sc= -0.145 (180deg=-0.666) USER MOD Single : A 1 MET N :NH3+ -172:sc= 0 (180deg=-0.0826) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0.0442 USER MOD Single : A 4 LYS NZ :NH3+ 167:sc= -0.0394 (180deg=-0.223) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= 1.08 K(o=1.1,f=-0.038) USER MOD Single : A 21 SER OG : rot -94:sc= 0.824 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.198 K(o=-0.2,f=-0.89) USER MOD Single : A 36 ASN : amide:sc= 0.752 K(o=0.75,f=-6.6!) USER MOD Single : A 39 THR OG1 : rot 180:sc= -1.43 USER MOD Single : A 41 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0179) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot -15:sc= 0.0184 USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 52 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 54 GLN : amide:sc= -0.0072 K(o=-0.0072,f=-0.87) USER MOD Single : A 56 THR OG1 : rot 47:sc= 0.167 USER MOD Single : A 57 THR OG1 : rot 42:sc= 0.0713 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -0.03 X(o=-0.03,f=0) USER MOD Single : A 72 LYS NZ :NH3+ -158:sc= -0.0619 (180deg=-0.39) USER MOD Single : A 75 ASN : amide:sc= 0.825 K(o=0.82,f=-7.8!) USER MOD Single : A 78 GLN : amide:sc= 0.97 K(o=0.97,f=-0.031) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 HIS : no HE2:sc= 0.763 K(o=0.76,f=-3.3!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 CYS SG : rot -22:sc= -0.114 USER MOD Single : A 92 HIS : no HD1:sc= -0.392 X(o=-0.39,f=0) USER MOD Single : A 93 HIS :FLIP no HD1:sc= 0.111 F(o=-1.5,f=0.11) USER MOD Single : A 94 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 95 HIS : no HE2:sc= 0.214! C(o=0.21!,f=-5.1!) USER MOD Single : A 96 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 97 HIS : no HD1:sc=-0.00378 X(o=-0.0038,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.028 20.165 0.157 1.00 0.00 N ATOM 2 CA MET A 1 2.905 18.989 -0.043 1.00 0.00 C ATOM 3 C MET A 1 2.651 18.350 -1.403 1.00 0.00 C ATOM 4 O MET A 1 1.705 17.579 -1.566 1.00 0.00 O ATOM 5 CB MET A 1 2.686 17.953 1.064 1.00 0.00 C ATOM 6 CG MET A 1 3.087 18.436 2.449 1.00 0.00 C ATOM 7 SD MET A 1 2.846 17.178 3.720 1.00 0.00 S ATOM 8 CE MET A 1 1.077 16.917 3.609 1.00 0.00 C ATOM 0 H1 MET A 1 2.309 20.664 1.025 1.00 0.00 H new ATOM 0 H2 MET A 1 2.118 20.807 -0.656 1.00 0.00 H new ATOM 0 H3 MET A 1 1.040 19.851 0.242 1.00 0.00 H new ATOM 0 HA MET A 1 3.938 19.334 -0.003 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.634 17.670 1.080 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.255 17.054 0.825 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.134 18.737 2.435 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.504 19.321 2.704 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.663 16.801 4.611 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.613 17.774 3.121 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.878 16.017 3.027 1.00 0.00 H new ATOM 20 N PRO A 2 3.490 18.668 -2.402 1.00 0.00 N ATOM 21 CA PRO A 2 3.370 18.104 -3.744 1.00 0.00 C ATOM 22 C PRO A 2 4.071 16.756 -3.865 1.00 0.00 C ATOM 23 O PRO A 2 3.912 16.045 -4.859 1.00 0.00 O ATOM 24 CB PRO A 2 4.066 19.151 -4.604 1.00 0.00 C ATOM 25 CG PRO A 2 5.136 19.706 -3.723 1.00 0.00 C ATOM 26 CD PRO A 2 4.618 19.612 -2.307 1.00 0.00 C ATOM 0 HA PRO A 2 2.336 17.908 -4.028 1.00 0.00 H new ATOM 0 HB2 PRO A 2 4.485 18.708 -5.507 1.00 0.00 H new ATOM 0 HB3 PRO A 2 3.372 19.928 -4.923 1.00 0.00 H new ATOM 0 HG2 PRO A 2 6.062 19.142 -3.835 1.00 0.00 H new ATOM 0 HG3 PRO A 2 5.358 20.740 -3.987 1.00 0.00 H new ATOM 0 HD2 PRO A 2 5.386 19.249 -1.624 1.00 0.00 H new ATOM 0 HD3 PRO A 2 4.295 20.584 -1.935 1.00 0.00 H new ATOM 34 N THR A 3 4.839 16.415 -2.844 1.00 0.00 N ATOM 35 CA THR A 3 5.600 15.186 -2.825 1.00 0.00 C ATOM 36 C THR A 3 4.874 14.104 -2.038 1.00 0.00 C ATOM 37 O THR A 3 4.361 14.343 -0.943 1.00 0.00 O ATOM 38 CB THR A 3 6.999 15.424 -2.229 1.00 0.00 C ATOM 39 OG1 THR A 3 6.948 16.499 -1.272 1.00 0.00 O ATOM 40 CG2 THR A 3 8.002 15.758 -3.322 1.00 0.00 C ATOM 0 H THR A 3 4.950 16.986 -2.006 1.00 0.00 H new ATOM 0 HA THR A 3 5.709 14.846 -3.855 1.00 0.00 H new ATOM 0 HB THR A 3 7.320 14.509 -1.731 1.00 0.00 H new ATOM 0 HG1 THR A 3 7.841 16.644 -0.895 1.00 0.00 H new ATOM 0 HG21 THR A 3 8.984 15.922 -2.877 1.00 0.00 H new ATOM 0 HG22 THR A 3 8.058 14.931 -4.030 1.00 0.00 H new ATOM 0 HG23 THR A 3 7.684 16.661 -3.844 1.00 0.00 H new ATOM 48 N LYS A 4 4.822 12.924 -2.621 1.00 0.00 N ATOM 49 CA LYS A 4 4.214 11.776 -1.996 1.00 0.00 C ATOM 50 C LYS A 4 5.108 10.573 -2.197 1.00 0.00 C ATOM 51 O LYS A 4 5.401 10.177 -3.327 1.00 0.00 O ATOM 52 CB LYS A 4 2.832 11.494 -2.580 1.00 0.00 C ATOM 53 CG LYS A 4 2.181 10.246 -2.002 1.00 0.00 C ATOM 54 CD LYS A 4 0.843 9.966 -2.653 1.00 0.00 C ATOM 55 CE LYS A 4 0.191 8.717 -2.082 1.00 0.00 C ATOM 56 NZ LYS A 4 -0.090 8.851 -0.627 1.00 0.00 N ATOM 0 H LYS A 4 5.204 12.737 -3.548 1.00 0.00 H new ATOM 0 HA LYS A 4 4.093 11.982 -0.932 1.00 0.00 H new ATOM 0 HB2 LYS A 4 2.185 12.352 -2.396 1.00 0.00 H new ATOM 0 HB3 LYS A 4 2.917 11.384 -3.661 1.00 0.00 H new ATOM 0 HG2 LYS A 4 2.842 9.391 -2.144 1.00 0.00 H new ATOM 0 HG3 LYS A 4 2.045 10.369 -0.928 1.00 0.00 H new ATOM 0 HD2 LYS A 4 0.182 10.820 -2.508 1.00 0.00 H new ATOM 0 HD3 LYS A 4 0.979 9.847 -3.728 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -0.739 8.518 -2.614 1.00 0.00 H new ATOM 0 HE3 LYS A 4 0.843 7.859 -2.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -0.724 8.084 -0.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 0.802 8.794 -0.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -0.545 9.768 -0.444 1.00 0.00 H new ATOM 70 N THR A 5 5.550 10.011 -1.102 1.00 0.00 N ATOM 71 CA THR A 5 6.427 8.856 -1.138 1.00 0.00 C ATOM 72 C THR A 5 5.724 7.645 -0.541 1.00 0.00 C ATOM 73 O THR A 5 4.824 7.779 0.293 1.00 0.00 O ATOM 74 CB THR A 5 7.725 9.114 -0.356 1.00 0.00 C ATOM 75 OG1 THR A 5 8.118 10.486 -0.499 1.00 0.00 O ATOM 76 CG2 THR A 5 8.849 8.216 -0.856 1.00 0.00 C ATOM 0 H THR A 5 5.318 10.334 -0.163 1.00 0.00 H new ATOM 0 HA THR A 5 6.677 8.666 -2.182 1.00 0.00 H new ATOM 0 HB THR A 5 7.537 8.891 0.694 1.00 0.00 H new ATOM 0 HG1 THR A 5 8.945 10.644 0.003 1.00 0.00 H new ATOM 0 HG21 THR A 5 9.756 8.418 -0.287 1.00 0.00 H new ATOM 0 HG22 THR A 5 8.565 7.172 -0.727 1.00 0.00 H new ATOM 0 HG23 THR A 5 9.031 8.415 -1.912 1.00 0.00 H new ATOM 84 N TYR A 6 6.139 6.466 -0.960 1.00 0.00 N ATOM 85 CA TYR A 6 5.555 5.239 -0.460 1.00 0.00 C ATOM 86 C TYR A 6 6.595 4.476 0.340 1.00 0.00 C ATOM 87 O TYR A 6 7.661 4.127 -0.177 1.00 0.00 O ATOM 88 CB TYR A 6 5.008 4.388 -1.608 1.00 0.00 C ATOM 89 CG TYR A 6 3.541 4.052 -1.447 1.00 0.00 C ATOM 90 CD1 TYR A 6 3.142 2.950 -0.703 1.00 0.00 C ATOM 91 CD2 TYR A 6 2.556 4.841 -2.031 1.00 0.00 C ATOM 92 CE1 TYR A 6 1.804 2.647 -0.538 1.00 0.00 C ATOM 93 CE2 TYR A 6 1.214 4.541 -1.873 1.00 0.00 C ATOM 94 CZ TYR A 6 0.845 3.439 -1.127 1.00 0.00 C ATOM 95 OH TYR A 6 -0.488 3.135 -0.957 1.00 0.00 O ATOM 0 H TYR A 6 6.881 6.332 -1.647 1.00 0.00 H new ATOM 0 HA TYR A 6 4.716 5.482 0.192 1.00 0.00 H new ATOM 0 HB2 TYR A 6 5.152 4.920 -2.548 1.00 0.00 H new ATOM 0 HB3 TYR A 6 5.582 3.464 -1.673 1.00 0.00 H new ATOM 0 HD1 TYR A 6 3.890 2.319 -0.246 1.00 0.00 H new ATOM 0 HD2 TYR A 6 2.843 5.702 -2.617 1.00 0.00 H new ATOM 0 HE1 TYR A 6 1.512 1.791 0.052 1.00 0.00 H new ATOM 0 HE2 TYR A 6 0.460 5.165 -2.330 1.00 0.00 H new ATOM 0 HH TYR A 6 -1.037 3.791 -1.435 1.00 0.00 H new ATOM 105 N SER A 7 6.285 4.246 1.602 1.00 0.00 N ATOM 106 CA SER A 7 7.222 3.652 2.540 1.00 0.00 C ATOM 107 C SER A 7 7.621 2.234 2.136 1.00 0.00 C ATOM 108 O SER A 7 6.902 1.554 1.394 1.00 0.00 O ATOM 109 CB SER A 7 6.608 3.653 3.941 1.00 0.00 C ATOM 110 OG SER A 7 6.197 4.961 4.311 1.00 0.00 O ATOM 0 H SER A 7 5.375 4.466 2.007 1.00 0.00 H new ATOM 0 HA SER A 7 8.131 4.253 2.533 1.00 0.00 H new ATOM 0 HB2 SER A 7 5.753 2.977 3.969 1.00 0.00 H new ATOM 0 HB3 SER A 7 7.335 3.278 4.662 1.00 0.00 H new ATOM 0 HG SER A 7 5.806 4.939 5.209 1.00 0.00 H new ATOM 116 N GLU A 8 8.781 1.807 2.632 1.00 0.00 N ATOM 117 CA GLU A 8 9.294 0.462 2.396 1.00 0.00 C ATOM 118 C GLU A 8 8.270 -0.586 2.802 1.00 0.00 C ATOM 119 O GLU A 8 8.116 -1.608 2.139 1.00 0.00 O ATOM 120 CB GLU A 8 10.575 0.249 3.210 1.00 0.00 C ATOM 121 CG GLU A 8 11.767 1.043 2.714 1.00 0.00 C ATOM 122 CD GLU A 8 12.322 0.496 1.419 1.00 0.00 C ATOM 123 OE1 GLU A 8 12.845 -0.640 1.431 1.00 0.00 O ATOM 124 OE2 GLU A 8 12.224 1.192 0.385 1.00 0.00 O ATOM 0 H GLU A 8 9.391 2.386 3.209 1.00 0.00 H new ATOM 0 HA GLU A 8 9.504 0.358 1.331 1.00 0.00 H new ATOM 0 HB2 GLU A 8 10.381 0.517 4.248 1.00 0.00 H new ATOM 0 HB3 GLU A 8 10.828 -0.811 3.197 1.00 0.00 H new ATOM 0 HG2 GLU A 8 11.474 2.083 2.570 1.00 0.00 H new ATOM 0 HG3 GLU A 8 12.548 1.034 3.474 1.00 0.00 H new ATOM 131 N GLU A 9 7.571 -0.297 3.888 1.00 0.00 N ATOM 132 CA GLU A 9 6.640 -1.224 4.514 1.00 0.00 C ATOM 133 C GLU A 9 5.612 -1.781 3.528 1.00 0.00 C ATOM 134 O GLU A 9 5.495 -2.992 3.391 1.00 0.00 O ATOM 135 CB GLU A 9 5.950 -0.492 5.663 1.00 0.00 C ATOM 136 CG GLU A 9 5.211 -1.387 6.636 1.00 0.00 C ATOM 137 CD GLU A 9 4.848 -0.650 7.906 1.00 0.00 C ATOM 138 OE1 GLU A 9 5.685 -0.615 8.834 1.00 0.00 O ATOM 139 OE2 GLU A 9 3.736 -0.085 7.977 1.00 0.00 O ATOM 0 H GLU A 9 7.635 0.601 4.367 1.00 0.00 H new ATOM 0 HA GLU A 9 7.195 -2.086 4.884 1.00 0.00 H new ATOM 0 HB2 GLU A 9 6.699 0.078 6.213 1.00 0.00 H new ATOM 0 HB3 GLU A 9 5.245 0.227 5.245 1.00 0.00 H new ATOM 0 HG2 GLU A 9 4.305 -1.768 6.164 1.00 0.00 H new ATOM 0 HG3 GLU A 9 5.831 -2.250 6.880 1.00 0.00 H new ATOM 146 N PHE A 10 4.896 -0.910 2.822 1.00 0.00 N ATOM 147 CA PHE A 10 3.873 -1.367 1.879 1.00 0.00 C ATOM 148 C PHE A 10 4.500 -2.136 0.724 1.00 0.00 C ATOM 149 O PHE A 10 4.002 -3.186 0.324 1.00 0.00 O ATOM 150 CB PHE A 10 3.058 -0.195 1.333 1.00 0.00 C ATOM 151 CG PHE A 10 1.925 -0.617 0.431 1.00 0.00 C ATOM 152 CD1 PHE A 10 0.693 -0.963 0.964 1.00 0.00 C ATOM 153 CD2 PHE A 10 2.094 -0.669 -0.944 1.00 0.00 C ATOM 154 CE1 PHE A 10 -0.350 -1.348 0.146 1.00 0.00 C ATOM 155 CE2 PHE A 10 1.055 -1.054 -1.769 1.00 0.00 C ATOM 156 CZ PHE A 10 -0.169 -1.396 -1.223 1.00 0.00 C ATOM 0 H PHE A 10 5.001 0.103 2.881 1.00 0.00 H new ATOM 0 HA PHE A 10 3.204 -2.032 2.426 1.00 0.00 H new ATOM 0 HB2 PHE A 10 2.653 0.376 2.169 1.00 0.00 H new ATOM 0 HB3 PHE A 10 3.721 0.473 0.782 1.00 0.00 H new ATOM 0 HD1 PHE A 10 0.547 -0.931 2.034 1.00 0.00 H new ATOM 0 HD2 PHE A 10 3.049 -0.406 -1.375 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -1.306 -1.611 0.575 1.00 0.00 H new ATOM 0 HE2 PHE A 10 1.198 -1.088 -2.839 1.00 0.00 H new ATOM 0 HZ PHE A 10 -0.982 -1.700 -1.866 1.00 0.00 H new ATOM 166 N LYS A 11 5.595 -1.610 0.194 1.00 0.00 N ATOM 167 CA LYS A 11 6.304 -2.249 -0.906 1.00 0.00 C ATOM 168 C LYS A 11 6.768 -3.649 -0.507 1.00 0.00 C ATOM 169 O LYS A 11 6.737 -4.580 -1.307 1.00 0.00 O ATOM 170 CB LYS A 11 7.496 -1.384 -1.325 1.00 0.00 C ATOM 171 CG LYS A 11 7.098 0.043 -1.679 1.00 0.00 C ATOM 172 CD LYS A 11 8.278 0.856 -2.190 1.00 0.00 C ATOM 173 CE LYS A 11 9.330 1.027 -1.116 1.00 0.00 C ATOM 174 NZ LYS A 11 10.504 1.813 -1.579 1.00 0.00 N ATOM 0 H LYS A 11 6.014 -0.736 0.511 1.00 0.00 H new ATOM 0 HA LYS A 11 5.625 -2.349 -1.753 1.00 0.00 H new ATOM 0 HB2 LYS A 11 8.225 -1.362 -0.515 1.00 0.00 H new ATOM 0 HB3 LYS A 11 7.987 -1.842 -2.183 1.00 0.00 H new ATOM 0 HG2 LYS A 11 6.316 0.023 -2.438 1.00 0.00 H new ATOM 0 HG3 LYS A 11 6.676 0.530 -0.800 1.00 0.00 H new ATOM 0 HD2 LYS A 11 8.716 0.361 -3.057 1.00 0.00 H new ATOM 0 HD3 LYS A 11 7.932 1.834 -2.523 1.00 0.00 H new ATOM 0 HE2 LYS A 11 8.885 1.522 -0.253 1.00 0.00 H new ATOM 0 HE3 LYS A 11 9.665 0.045 -0.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 11.192 1.899 -0.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 10.949 1.330 -2.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 10.193 2.761 -1.872 1.00 0.00 H new ATOM 188 N ARG A 12 7.180 -3.785 0.747 1.00 0.00 N ATOM 189 CA ARG A 12 7.602 -5.070 1.291 1.00 0.00 C ATOM 190 C ARG A 12 6.397 -5.966 1.581 1.00 0.00 C ATOM 191 O ARG A 12 6.447 -7.177 1.360 1.00 0.00 O ATOM 192 CB ARG A 12 8.429 -4.845 2.558 1.00 0.00 C ATOM 193 CG ARG A 12 9.764 -4.176 2.281 1.00 0.00 C ATOM 194 CD ARG A 12 10.547 -3.913 3.555 1.00 0.00 C ATOM 195 NE ARG A 12 11.657 -2.987 3.329 1.00 0.00 N ATOM 196 CZ ARG A 12 12.604 -2.723 4.227 1.00 0.00 C ATOM 197 NH1 ARG A 12 12.638 -3.382 5.380 1.00 0.00 N ATOM 198 NH2 ARG A 12 13.527 -1.809 3.955 1.00 0.00 N ATOM 0 H ARG A 12 7.231 -3.013 1.412 1.00 0.00 H new ATOM 0 HA ARG A 12 8.219 -5.579 0.550 1.00 0.00 H new ATOM 0 HB2 ARG A 12 7.858 -4.231 3.254 1.00 0.00 H new ATOM 0 HB3 ARG A 12 8.603 -5.803 3.047 1.00 0.00 H new ATOM 0 HG2 ARG A 12 10.354 -4.807 1.617 1.00 0.00 H new ATOM 0 HG3 ARG A 12 9.595 -3.234 1.759 1.00 0.00 H new ATOM 0 HD2 ARG A 12 9.880 -3.503 4.313 1.00 0.00 H new ATOM 0 HD3 ARG A 12 10.933 -4.855 3.945 1.00 0.00 H new ATOM 0 HE ARG A 12 11.709 -2.514 2.427 1.00 0.00 H new ATOM 0 HH11 ARG A 12 11.936 -4.094 5.581 1.00 0.00 H new ATOM 0 HH12 ARG A 12 13.366 -3.176 6.064 1.00 0.00 H new ATOM 0 HH21 ARG A 12 13.508 -1.314 3.063 1.00 0.00 H new ATOM 0 HH22 ARG A 12 14.256 -1.601 4.638 1.00 0.00 H new ATOM 212 N ASP A 13 5.322 -5.355 2.067 1.00 0.00 N ATOM 213 CA ASP A 13 4.073 -6.065 2.340 1.00 0.00 C ATOM 214 C ASP A 13 3.488 -6.624 1.046 1.00 0.00 C ATOM 215 O ASP A 13 2.932 -7.721 1.023 1.00 0.00 O ATOM 216 CB ASP A 13 3.077 -5.113 3.013 1.00 0.00 C ATOM 217 CG ASP A 13 1.777 -5.782 3.411 1.00 0.00 C ATOM 218 OD1 ASP A 13 1.762 -6.512 4.427 1.00 0.00 O ATOM 219 OD2 ASP A 13 0.755 -5.544 2.734 1.00 0.00 O ATOM 0 H ASP A 13 5.289 -4.359 2.283 1.00 0.00 H new ATOM 0 HA ASP A 13 4.275 -6.899 3.012 1.00 0.00 H new ATOM 0 HB2 ASP A 13 3.541 -4.682 3.900 1.00 0.00 H new ATOM 0 HB3 ASP A 13 2.859 -4.288 2.334 1.00 0.00 H new ATOM 224 N ALA A 14 3.645 -5.866 -0.037 1.00 0.00 N ATOM 225 CA ALA A 14 3.228 -6.304 -1.364 1.00 0.00 C ATOM 226 C ALA A 14 4.009 -7.543 -1.796 1.00 0.00 C ATOM 227 O ALA A 14 3.461 -8.449 -2.424 1.00 0.00 O ATOM 228 CB ALA A 14 3.404 -5.175 -2.373 1.00 0.00 C ATOM 0 H ALA A 14 4.063 -4.936 -0.018 1.00 0.00 H new ATOM 0 HA ALA A 14 2.172 -6.570 -1.324 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.089 -5.516 -3.359 1.00 0.00 H new ATOM 0 HB2 ALA A 14 2.797 -4.321 -2.073 1.00 0.00 H new ATOM 0 HB3 ALA A 14 4.453 -4.880 -2.409 1.00 0.00 H new ATOM 234 N VAL A 15 5.292 -7.584 -1.447 1.00 0.00 N ATOM 235 CA VAL A 15 6.118 -8.751 -1.732 1.00 0.00 C ATOM 236 C VAL A 15 5.646 -9.936 -0.890 1.00 0.00 C ATOM 237 O VAL A 15 5.671 -11.082 -1.339 1.00 0.00 O ATOM 238 CB VAL A 15 7.618 -8.479 -1.466 1.00 0.00 C ATOM 239 CG1 VAL A 15 8.464 -9.704 -1.795 1.00 0.00 C ATOM 240 CG2 VAL A 15 8.084 -7.272 -2.261 1.00 0.00 C ATOM 0 H VAL A 15 5.779 -6.826 -0.969 1.00 0.00 H new ATOM 0 HA VAL A 15 6.010 -8.983 -2.792 1.00 0.00 H new ATOM 0 HB VAL A 15 7.743 -8.264 -0.405 1.00 0.00 H new ATOM 0 HG11 VAL A 15 9.514 -9.485 -1.599 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.147 -10.543 -1.175 1.00 0.00 H new ATOM 0 HG13 VAL A 15 8.338 -9.962 -2.847 1.00 0.00 H new ATOM 0 HG21 VAL A 15 9.141 -7.093 -2.064 1.00 0.00 H new ATOM 0 HG22 VAL A 15 7.940 -7.459 -3.325 1.00 0.00 H new ATOM 0 HG23 VAL A 15 7.506 -6.396 -1.965 1.00 0.00 H new ATOM 250 N ALA A 16 5.190 -9.648 0.328 1.00 0.00 N ATOM 251 CA ALA A 16 4.621 -10.676 1.196 1.00 0.00 C ATOM 252 C ALA A 16 3.307 -11.197 0.615 1.00 0.00 C ATOM 253 O ALA A 16 3.021 -12.392 0.681 1.00 0.00 O ATOM 254 CB ALA A 16 4.402 -10.143 2.608 1.00 0.00 C ATOM 0 H ALA A 16 5.204 -8.713 0.735 1.00 0.00 H new ATOM 0 HA ALA A 16 5.332 -11.501 1.252 1.00 0.00 H new ATOM 0 HB1 ALA A 16 3.978 -10.930 3.232 1.00 0.00 H new ATOM 0 HB2 ALA A 16 5.355 -9.822 3.027 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.716 -9.296 2.575 1.00 0.00 H new ATOM 260 N LEU A 17 2.517 -10.290 0.043 1.00 0.00 N ATOM 261 CA LEU A 17 1.284 -10.653 -0.655 1.00 0.00 C ATOM 262 C LEU A 17 1.567 -11.642 -1.783 1.00 0.00 C ATOM 263 O LEU A 17 0.777 -12.545 -2.040 1.00 0.00 O ATOM 264 CB LEU A 17 0.608 -9.396 -1.220 1.00 0.00 C ATOM 265 CG LEU A 17 -0.057 -8.485 -0.183 1.00 0.00 C ATOM 266 CD1 LEU A 17 -0.482 -7.174 -0.822 1.00 0.00 C ATOM 267 CD2 LEU A 17 -1.263 -9.178 0.436 1.00 0.00 C ATOM 0 H LEU A 17 2.711 -9.289 0.050 1.00 0.00 H new ATOM 0 HA LEU A 17 0.615 -11.130 0.061 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.354 -8.816 -1.763 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -0.146 -9.704 -1.945 1.00 0.00 H new ATOM 0 HG LEU A 17 0.668 -8.273 0.603 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.953 -6.539 -0.071 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.393 -6.667 -1.229 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -1.192 -7.374 -1.625 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.724 -8.518 1.171 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -1.986 -9.415 -0.344 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -0.943 -10.098 0.925 1.00 0.00 H new ATOM 279 N TYR A 18 2.706 -11.466 -2.443 1.00 0.00 N ATOM 280 CA TYR A 18 3.123 -12.364 -3.517 1.00 0.00 C ATOM 281 C TYR A 18 3.366 -13.778 -2.988 1.00 0.00 C ATOM 282 O TYR A 18 2.983 -14.765 -3.620 1.00 0.00 O ATOM 283 CB TYR A 18 4.385 -11.823 -4.190 1.00 0.00 C ATOM 284 CG TYR A 18 5.003 -12.771 -5.196 1.00 0.00 C ATOM 285 CD1 TYR A 18 4.385 -13.024 -6.416 1.00 0.00 C ATOM 286 CD2 TYR A 18 6.208 -13.411 -4.928 1.00 0.00 C ATOM 287 CE1 TYR A 18 4.949 -13.888 -7.336 1.00 0.00 C ATOM 288 CE2 TYR A 18 6.779 -14.275 -5.843 1.00 0.00 C ATOM 289 CZ TYR A 18 6.146 -14.509 -7.047 1.00 0.00 C ATOM 290 OH TYR A 18 6.710 -15.364 -7.968 1.00 0.00 O ATOM 0 H TYR A 18 3.360 -10.707 -2.253 1.00 0.00 H new ATOM 0 HA TYR A 18 2.321 -12.414 -4.253 1.00 0.00 H new ATOM 0 HB2 TYR A 18 4.143 -10.885 -4.691 1.00 0.00 H new ATOM 0 HB3 TYR A 18 5.123 -11.593 -3.422 1.00 0.00 H new ATOM 0 HD1 TYR A 18 3.449 -12.538 -6.648 1.00 0.00 H new ATOM 0 HD2 TYR A 18 6.707 -13.230 -3.987 1.00 0.00 H new ATOM 0 HE1 TYR A 18 4.454 -14.076 -8.277 1.00 0.00 H new ATOM 0 HE2 TYR A 18 7.715 -14.764 -5.617 1.00 0.00 H new ATOM 0 HH TYR A 18 7.552 -15.718 -7.613 1.00 0.00 H new ATOM 300 N GLU A 19 3.999 -13.876 -1.828 1.00 0.00 N ATOM 301 CA GLU A 19 4.256 -15.172 -1.208 1.00 0.00 C ATOM 302 C GLU A 19 2.966 -15.762 -0.640 1.00 0.00 C ATOM 303 O GLU A 19 2.853 -16.973 -0.453 1.00 0.00 O ATOM 304 CB GLU A 19 5.313 -15.043 -0.107 1.00 0.00 C ATOM 305 CG GLU A 19 6.700 -14.704 -0.633 1.00 0.00 C ATOM 306 CD GLU A 19 7.228 -15.748 -1.599 1.00 0.00 C ATOM 307 OE1 GLU A 19 6.989 -16.950 -1.372 1.00 0.00 O ATOM 308 OE2 GLU A 19 7.878 -15.372 -2.597 1.00 0.00 O ATOM 0 H GLU A 19 4.344 -13.077 -1.296 1.00 0.00 H new ATOM 0 HA GLU A 19 4.636 -15.847 -1.975 1.00 0.00 H new ATOM 0 HB2 GLU A 19 5.001 -14.271 0.596 1.00 0.00 H new ATOM 0 HB3 GLU A 19 5.363 -15.979 0.449 1.00 0.00 H new ATOM 0 HG2 GLU A 19 6.669 -13.735 -1.132 1.00 0.00 H new ATOM 0 HG3 GLU A 19 7.390 -14.609 0.206 1.00 0.00 H new ATOM 315 N ASN A 20 1.994 -14.893 -0.385 1.00 0.00 N ATOM 316 CA ASN A 20 0.688 -15.311 0.120 1.00 0.00 C ATOM 317 C ASN A 20 -0.330 -15.373 -1.015 1.00 0.00 C ATOM 318 O ASN A 20 -1.539 -15.265 -0.790 1.00 0.00 O ATOM 319 CB ASN A 20 0.198 -14.350 1.208 1.00 0.00 C ATOM 320 CG ASN A 20 0.893 -14.566 2.539 1.00 0.00 C ATOM 321 OD1 ASN A 20 0.439 -15.350 3.370 1.00 0.00 O ATOM 322 ND2 ASN A 20 1.997 -13.868 2.754 1.00 0.00 N ATOM 0 H ASN A 20 2.086 -13.886 -0.521 1.00 0.00 H new ATOM 0 HA ASN A 20 0.794 -16.306 0.552 1.00 0.00 H new ATOM 0 HB2 ASN A 20 0.362 -13.323 0.880 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -0.877 -14.475 1.340 1.00 0.00 H new ATOM 0 HD21 ASN A 20 2.502 -13.971 3.634 1.00 0.00 H new ATOM 0 HD22 ASN A 20 2.342 -13.227 2.040 1.00 0.00 H new ATOM 329 N SER A 21 0.168 -15.585 -2.231 1.00 0.00 N ATOM 330 CA SER A 21 -0.672 -15.656 -3.422 1.00 0.00 C ATOM 331 C SER A 21 -1.637 -16.836 -3.361 1.00 0.00 C ATOM 332 O SER A 21 -2.572 -16.934 -4.157 1.00 0.00 O ATOM 333 CB SER A 21 0.197 -15.753 -4.671 1.00 0.00 C ATOM 334 OG SER A 21 1.210 -16.734 -4.516 1.00 0.00 O ATOM 0 H SER A 21 1.163 -15.712 -2.417 1.00 0.00 H new ATOM 0 HA SER A 21 -1.266 -14.743 -3.465 1.00 0.00 H new ATOM 0 HB2 SER A 21 -0.425 -16.001 -5.531 1.00 0.00 H new ATOM 0 HB3 SER A 21 0.653 -14.785 -4.876 1.00 0.00 H new ATOM 0 HG SER A 21 2.034 -16.307 -4.201 1.00 0.00 H new ATOM 340 N ASP A 22 -1.384 -17.739 -2.426 1.00 0.00 N ATOM 341 CA ASP A 22 -2.292 -18.849 -2.152 1.00 0.00 C ATOM 342 C ASP A 22 -3.703 -18.332 -1.871 1.00 0.00 C ATOM 343 O ASP A 22 -4.698 -18.992 -2.176 1.00 0.00 O ATOM 344 CB ASP A 22 -1.777 -19.669 -0.963 1.00 0.00 C ATOM 345 CG ASP A 22 -2.713 -20.793 -0.577 1.00 0.00 C ATOM 346 OD1 ASP A 22 -2.799 -21.787 -1.327 1.00 0.00 O ATOM 347 OD2 ASP A 22 -3.375 -20.687 0.475 1.00 0.00 O ATOM 0 H ASP A 22 -0.551 -17.726 -1.838 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.332 -19.492 -3.032 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -0.800 -20.084 -1.210 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -1.636 -19.010 -0.107 1.00 0.00 H new ATOM 352 N GLY A 23 -3.777 -17.132 -1.310 1.00 0.00 N ATOM 353 CA GLY A 23 -5.059 -16.515 -1.036 1.00 0.00 C ATOM 354 C GLY A 23 -5.593 -15.724 -2.220 1.00 0.00 C ATOM 355 O GLY A 23 -6.806 -15.656 -2.433 1.00 0.00 O ATOM 0 H GLY A 23 -2.968 -16.573 -1.039 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -5.779 -17.287 -0.765 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -4.963 -15.853 -0.175 1.00 0.00 H new ATOM 359 N ALA A 24 -4.691 -15.146 -3.009 1.00 0.00 N ATOM 360 CA ALA A 24 -5.074 -14.310 -4.138 1.00 0.00 C ATOM 361 C ALA A 24 -3.980 -14.324 -5.195 1.00 0.00 C ATOM 362 O ALA A 24 -2.809 -14.116 -4.888 1.00 0.00 O ATOM 363 CB ALA A 24 -5.354 -12.887 -3.675 1.00 0.00 C ATOM 0 H ALA A 24 -3.683 -15.244 -2.884 1.00 0.00 H new ATOM 0 HA ALA A 24 -5.987 -14.712 -4.578 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -5.639 -12.275 -4.531 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -6.166 -12.894 -2.948 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.458 -12.471 -3.214 1.00 0.00 H new ATOM 369 N SER A 25 -4.373 -14.578 -6.434 1.00 0.00 N ATOM 370 CA SER A 25 -3.430 -14.684 -7.541 1.00 0.00 C ATOM 371 C SER A 25 -2.692 -13.362 -7.779 1.00 0.00 C ATOM 372 O SER A 25 -3.157 -12.300 -7.362 1.00 0.00 O ATOM 373 CB SER A 25 -4.177 -15.119 -8.804 1.00 0.00 C ATOM 374 OG SER A 25 -4.949 -16.285 -8.552 1.00 0.00 O ATOM 0 H SER A 25 -5.348 -14.716 -6.701 1.00 0.00 H new ATOM 0 HA SER A 25 -2.679 -15.432 -7.287 1.00 0.00 H new ATOM 0 HB2 SER A 25 -4.827 -14.313 -9.145 1.00 0.00 H new ATOM 0 HB3 SER A 25 -3.464 -15.314 -9.605 1.00 0.00 H new ATOM 0 HG SER A 25 -5.421 -16.548 -9.370 1.00 0.00 H new ATOM 380 N LEU A 26 -1.552 -13.448 -8.466 1.00 0.00 N ATOM 381 CA LEU A 26 -0.671 -12.300 -8.687 1.00 0.00 C ATOM 382 C LEU A 26 -1.434 -11.141 -9.324 1.00 0.00 C ATOM 383 O LEU A 26 -1.374 -10.010 -8.840 1.00 0.00 O ATOM 384 CB LEU A 26 0.521 -12.722 -9.565 1.00 0.00 C ATOM 385 CG LEU A 26 1.726 -11.766 -9.595 1.00 0.00 C ATOM 386 CD1 LEU A 26 2.950 -12.491 -10.128 1.00 0.00 C ATOM 387 CD2 LEU A 26 1.443 -10.543 -10.458 1.00 0.00 C ATOM 0 H LEU A 26 -1.214 -14.314 -8.885 1.00 0.00 H new ATOM 0 HA LEU A 26 -0.294 -11.955 -7.724 1.00 0.00 H new ATOM 0 HB2 LEU A 26 0.868 -13.697 -9.223 1.00 0.00 H new ATOM 0 HB3 LEU A 26 0.163 -12.851 -10.586 1.00 0.00 H new ATOM 0 HG LEU A 26 1.912 -11.430 -8.575 1.00 0.00 H new ATOM 0 HD11 LEU A 26 3.799 -11.807 -10.146 1.00 0.00 H new ATOM 0 HD12 LEU A 26 3.181 -13.339 -9.483 1.00 0.00 H new ATOM 0 HD13 LEU A 26 2.750 -12.848 -11.138 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.314 -9.888 -10.458 1.00 0.00 H new ATOM 0 HD22 LEU A 26 1.227 -10.860 -11.478 1.00 0.00 H new ATOM 0 HD23 LEU A 26 0.585 -10.005 -10.056 1.00 0.00 H new ATOM 399 N GLN A 27 -2.158 -11.425 -10.403 1.00 0.00 N ATOM 400 CA GLN A 27 -2.938 -10.399 -11.086 1.00 0.00 C ATOM 401 C GLN A 27 -4.001 -9.819 -10.157 1.00 0.00 C ATOM 402 O GLN A 27 -4.281 -8.623 -10.194 1.00 0.00 O ATOM 403 CB GLN A 27 -3.599 -10.970 -12.345 1.00 0.00 C ATOM 404 CG GLN A 27 -4.422 -9.951 -13.121 1.00 0.00 C ATOM 405 CD GLN A 27 -3.593 -8.794 -13.649 1.00 0.00 C ATOM 406 OE1 GLN A 27 -2.417 -8.948 -13.971 1.00 0.00 O ATOM 407 NE2 GLN A 27 -4.200 -7.622 -13.722 1.00 0.00 N ATOM 0 H GLN A 27 -2.220 -12.353 -10.821 1.00 0.00 H new ATOM 0 HA GLN A 27 -2.257 -9.600 -11.379 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -2.826 -11.373 -12.999 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -4.242 -11.803 -12.061 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -4.913 -10.450 -13.957 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -5.209 -9.561 -12.476 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -5.178 -7.536 -13.445 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -3.690 -6.804 -14.055 1.00 0.00 H new ATOM 416 N GLN A 28 -4.569 -10.668 -9.309 1.00 0.00 N ATOM 417 CA GLN A 28 -5.617 -10.245 -8.388 1.00 0.00 C ATOM 418 C GLN A 28 -5.052 -9.278 -7.355 1.00 0.00 C ATOM 419 O GLN A 28 -5.716 -8.323 -6.961 1.00 0.00 O ATOM 420 CB GLN A 28 -6.245 -11.452 -7.693 1.00 0.00 C ATOM 421 CG GLN A 28 -7.551 -11.129 -6.983 1.00 0.00 C ATOM 422 CD GLN A 28 -8.617 -10.612 -7.937 1.00 0.00 C ATOM 423 OE1 GLN A 28 -8.639 -10.969 -9.114 1.00 0.00 O ATOM 424 NE2 GLN A 28 -9.497 -9.757 -7.441 1.00 0.00 N ATOM 0 H GLN A 28 -4.321 -11.655 -9.240 1.00 0.00 H new ATOM 0 HA GLN A 28 -6.392 -9.736 -8.961 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -6.425 -12.234 -8.431 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -5.536 -11.854 -6.969 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -7.919 -12.024 -6.481 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -7.366 -10.383 -6.210 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -9.446 -9.485 -6.459 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -10.226 -9.370 -8.040 1.00 0.00 H new ATOM 433 N ILE A 29 -3.818 -9.535 -6.930 1.00 0.00 N ATOM 434 CA ILE A 29 -3.118 -8.636 -6.019 1.00 0.00 C ATOM 435 C ILE A 29 -2.965 -7.262 -6.662 1.00 0.00 C ATOM 436 O ILE A 29 -3.270 -6.237 -6.049 1.00 0.00 O ATOM 437 CB ILE A 29 -1.718 -9.180 -5.644 1.00 0.00 C ATOM 438 CG1 ILE A 29 -1.836 -10.530 -4.928 1.00 0.00 C ATOM 439 CG2 ILE A 29 -0.956 -8.183 -4.775 1.00 0.00 C ATOM 440 CD1 ILE A 29 -2.573 -10.460 -3.606 1.00 0.00 C ATOM 0 H ILE A 29 -3.282 -10.359 -7.202 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.712 -8.561 -5.108 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.157 -9.324 -6.568 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -2.350 -11.234 -5.583 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -0.836 -10.927 -4.755 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.024 -8.591 -4.527 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -0.832 -7.247 -5.319 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -1.515 -7.998 -3.858 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -2.616 -11.454 -3.160 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.049 -9.782 -2.933 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -3.586 -10.094 -3.773 1.00 0.00 H new ATOM 452 N ALA A 30 -2.515 -7.258 -7.914 1.00 0.00 N ATOM 453 CA ALA A 30 -2.349 -6.022 -8.671 1.00 0.00 C ATOM 454 C ALA A 30 -3.686 -5.307 -8.838 1.00 0.00 C ATOM 455 O ALA A 30 -3.763 -4.083 -8.729 1.00 0.00 O ATOM 456 CB ALA A 30 -1.724 -6.308 -10.031 1.00 0.00 C ATOM 0 H ALA A 30 -2.258 -8.101 -8.427 1.00 0.00 H new ATOM 0 HA ALA A 30 -1.679 -5.368 -8.113 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -1.608 -5.374 -10.582 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -0.747 -6.772 -9.892 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -2.369 -6.983 -10.593 1.00 0.00 H new ATOM 462 N ASN A 31 -4.737 -6.084 -9.086 1.00 0.00 N ATOM 463 CA ASN A 31 -6.077 -5.548 -9.257 1.00 0.00 C ATOM 464 C ASN A 31 -6.568 -4.862 -7.986 1.00 0.00 C ATOM 465 O ASN A 31 -7.174 -3.791 -8.047 1.00 0.00 O ATOM 466 CB ASN A 31 -7.051 -6.666 -9.643 1.00 0.00 C ATOM 467 CG ASN A 31 -6.898 -7.144 -11.078 1.00 0.00 C ATOM 468 OD1 ASN A 31 -6.487 -6.394 -11.965 1.00 0.00 O ATOM 469 ND2 ASN A 31 -7.242 -8.403 -11.317 1.00 0.00 N ATOM 0 H ASN A 31 -4.680 -7.099 -9.173 1.00 0.00 H new ATOM 0 HA ASN A 31 -6.036 -4.807 -10.055 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -6.904 -7.511 -8.971 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -8.072 -6.314 -9.494 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -7.170 -8.781 -12.262 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -7.578 -8.993 -10.556 1.00 0.00 H new ATOM 476 N ASP A 32 -6.301 -5.480 -6.841 1.00 0.00 N ATOM 477 CA ASP A 32 -6.759 -4.956 -5.557 1.00 0.00 C ATOM 478 C ASP A 32 -5.959 -3.724 -5.156 1.00 0.00 C ATOM 479 O ASP A 32 -6.516 -2.728 -4.698 1.00 0.00 O ATOM 480 CB ASP A 32 -6.641 -6.024 -4.465 1.00 0.00 C ATOM 481 CG ASP A 32 -7.276 -5.583 -3.158 1.00 0.00 C ATOM 482 OD1 ASP A 32 -6.589 -4.948 -2.339 1.00 0.00 O ATOM 483 OD2 ASP A 32 -8.476 -5.876 -2.943 1.00 0.00 O ATOM 0 H ASP A 32 -5.768 -6.347 -6.775 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.806 -4.674 -5.668 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.117 -6.943 -4.806 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -5.589 -6.253 -4.296 1.00 0.00 H new ATOM 488 N LEU A 33 -4.645 -3.795 -5.339 1.00 0.00 N ATOM 489 CA LEU A 33 -3.762 -2.693 -4.977 1.00 0.00 C ATOM 490 C LEU A 33 -3.933 -1.515 -5.931 1.00 0.00 C ATOM 491 O LEU A 33 -3.797 -0.357 -5.534 1.00 0.00 O ATOM 492 CB LEU A 33 -2.302 -3.157 -4.960 1.00 0.00 C ATOM 493 CG LEU A 33 -1.810 -3.754 -3.635 1.00 0.00 C ATOM 494 CD1 LEU A 33 -2.647 -4.954 -3.221 1.00 0.00 C ATOM 495 CD2 LEU A 33 -0.341 -4.139 -3.741 1.00 0.00 C ATOM 0 H LEU A 33 -4.168 -4.604 -5.736 1.00 0.00 H new ATOM 0 HA LEU A 33 -4.035 -2.360 -3.976 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -2.167 -3.901 -5.745 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -1.667 -2.308 -5.213 1.00 0.00 H new ATOM 0 HG LEU A 33 -1.920 -2.992 -2.864 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -2.271 -5.352 -2.279 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -3.686 -4.648 -3.097 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -2.585 -5.724 -3.990 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -0.006 -4.561 -2.793 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -0.215 -4.878 -4.532 1.00 0.00 H new ATOM 0 HD23 LEU A 33 0.251 -3.254 -3.973 1.00 0.00 H new ATOM 507 N GLY A 34 -4.249 -1.816 -7.182 1.00 0.00 N ATOM 508 CA GLY A 34 -4.455 -0.773 -8.169 1.00 0.00 C ATOM 509 C GLY A 34 -3.182 -0.434 -8.916 1.00 0.00 C ATOM 510 O GLY A 34 -2.967 0.715 -9.312 1.00 0.00 O ATOM 0 H GLY A 34 -4.367 -2.766 -7.533 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -5.217 -1.093 -8.880 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -4.834 0.122 -7.676 1.00 0.00 H new ATOM 514 N ILE A 35 -2.339 -1.438 -9.103 1.00 0.00 N ATOM 515 CA ILE A 35 -1.062 -1.257 -9.770 1.00 0.00 C ATOM 516 C ILE A 35 -0.901 -2.268 -10.898 1.00 0.00 C ATOM 517 O ILE A 35 -1.735 -3.155 -11.071 1.00 0.00 O ATOM 518 CB ILE A 35 0.119 -1.411 -8.788 1.00 0.00 C ATOM 519 CG1 ILE A 35 0.058 -2.769 -8.076 1.00 0.00 C ATOM 520 CG2 ILE A 35 0.132 -0.268 -7.780 1.00 0.00 C ATOM 521 CD1 ILE A 35 1.248 -3.043 -7.184 1.00 0.00 C ATOM 0 H ILE A 35 -2.520 -2.394 -8.798 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.052 -0.245 -10.175 1.00 0.00 H new ATOM 0 HB ILE A 35 1.047 -1.370 -9.358 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -0.852 -2.814 -7.477 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -0.013 -3.558 -8.824 1.00 0.00 H new ATOM 0 HG21 ILE A 35 0.972 -0.395 -7.097 1.00 0.00 H new ATOM 0 HG22 ILE A 35 0.233 0.681 -8.307 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -0.800 -0.271 -7.214 1.00 0.00 H new ATOM 0 HD11 ILE A 35 1.134 -4.020 -6.715 1.00 0.00 H new ATOM 0 HD12 ILE A 35 2.160 -3.031 -7.780 1.00 0.00 H new ATOM 0 HD13 ILE A 35 1.309 -2.275 -6.412 1.00 0.00 H new ATOM 533 N ASN A 36 0.163 -2.124 -11.670 1.00 0.00 N ATOM 534 CA ASN A 36 0.470 -3.063 -12.724 1.00 0.00 C ATOM 535 C ASN A 36 1.192 -4.274 -12.150 1.00 0.00 C ATOM 536 O ASN A 36 1.955 -4.150 -11.192 1.00 0.00 O ATOM 537 CB ASN A 36 1.337 -2.383 -13.777 1.00 0.00 C ATOM 538 CG ASN A 36 1.504 -3.220 -15.017 1.00 0.00 C ATOM 539 OD1 ASN A 36 2.436 -4.015 -15.126 1.00 0.00 O ATOM 540 ND2 ASN A 36 0.592 -3.055 -15.951 1.00 0.00 N ATOM 0 H ASN A 36 0.831 -1.358 -11.581 1.00 0.00 H new ATOM 0 HA ASN A 36 -0.457 -3.399 -13.188 1.00 0.00 H new ATOM 0 HB2 ASN A 36 0.891 -1.426 -14.047 1.00 0.00 H new ATOM 0 HB3 ASN A 36 2.318 -2.169 -13.352 1.00 0.00 H new ATOM 0 HD21 ASN A 36 0.640 -3.600 -16.812 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -0.163 -2.383 -15.814 1.00 0.00 H new ATOM 547 N ARG A 37 0.958 -5.438 -12.742 1.00 0.00 N ATOM 548 CA ARG A 37 1.563 -6.670 -12.276 1.00 0.00 C ATOM 549 C ARG A 37 3.077 -6.638 -12.447 1.00 0.00 C ATOM 550 O ARG A 37 3.814 -7.251 -11.675 1.00 0.00 O ATOM 551 CB ARG A 37 0.963 -7.864 -13.017 1.00 0.00 C ATOM 552 CG ARG A 37 1.098 -7.805 -14.531 1.00 0.00 C ATOM 553 CD ARG A 37 0.562 -9.071 -15.180 1.00 0.00 C ATOM 554 NE ARG A 37 0.488 -8.950 -16.635 1.00 0.00 N ATOM 555 CZ ARG A 37 0.530 -9.985 -17.475 1.00 0.00 C ATOM 556 NH1 ARG A 37 0.675 -11.219 -17.008 1.00 0.00 N ATOM 557 NH2 ARG A 37 0.413 -9.784 -18.783 1.00 0.00 N ATOM 0 H ARG A 37 0.348 -5.550 -13.552 1.00 0.00 H new ATOM 0 HA ARG A 37 1.351 -6.774 -11.212 1.00 0.00 H new ATOM 0 HB2 ARG A 37 1.442 -8.775 -12.658 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -0.094 -7.938 -12.763 1.00 0.00 H new ATOM 0 HG2 ARG A 37 0.557 -6.940 -14.914 1.00 0.00 H new ATOM 0 HG3 ARG A 37 2.146 -7.670 -14.800 1.00 0.00 H new ATOM 0 HD2 ARG A 37 1.203 -9.912 -14.918 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -0.429 -9.290 -14.783 1.00 0.00 H new ATOM 0 HE ARG A 37 0.399 -8.015 -17.033 1.00 0.00 H new ATOM 0 HH11 ARG A 37 0.755 -11.378 -16.004 1.00 0.00 H new ATOM 0 HH12 ARG A 37 0.707 -12.008 -17.653 1.00 0.00 H new ATOM 0 HH21 ARG A 37 0.291 -8.838 -19.145 1.00 0.00 H new ATOM 0 HH22 ARG A 37 0.445 -10.576 -19.426 1.00 0.00 H new ATOM 571 N VAL A 38 3.538 -5.914 -13.455 1.00 0.00 N ATOM 572 CA VAL A 38 4.968 -5.751 -13.681 1.00 0.00 C ATOM 573 C VAL A 38 5.559 -4.792 -12.651 1.00 0.00 C ATOM 574 O VAL A 38 6.688 -4.971 -12.200 1.00 0.00 O ATOM 575 CB VAL A 38 5.269 -5.240 -15.109 1.00 0.00 C ATOM 576 CG1 VAL A 38 6.766 -5.119 -15.347 1.00 0.00 C ATOM 577 CG2 VAL A 38 4.634 -6.154 -16.146 1.00 0.00 C ATOM 0 H VAL A 38 2.945 -5.430 -14.129 1.00 0.00 H new ATOM 0 HA VAL A 38 5.431 -6.732 -13.573 1.00 0.00 H new ATOM 0 HB VAL A 38 4.834 -4.245 -15.209 1.00 0.00 H new ATOM 0 HG11 VAL A 38 6.945 -4.758 -16.360 1.00 0.00 H new ATOM 0 HG12 VAL A 38 7.193 -4.417 -14.630 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.234 -6.095 -15.222 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.856 -5.780 -17.145 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.036 -7.161 -16.038 1.00 0.00 H new ATOM 0 HG23 VAL A 38 3.554 -6.177 -15.998 1.00 0.00 H new ATOM 587 N THR A 39 4.783 -3.785 -12.267 1.00 0.00 N ATOM 588 CA THR A 39 5.200 -2.864 -11.218 1.00 0.00 C ATOM 589 C THR A 39 5.363 -3.615 -9.896 1.00 0.00 C ATOM 590 O THR A 39 6.313 -3.382 -9.146 1.00 0.00 O ATOM 591 CB THR A 39 4.176 -1.724 -11.048 1.00 0.00 C ATOM 592 OG1 THR A 39 3.908 -1.122 -12.322 1.00 0.00 O ATOM 593 CG2 THR A 39 4.686 -0.663 -10.080 1.00 0.00 C ATOM 0 H THR A 39 3.865 -3.586 -12.665 1.00 0.00 H new ATOM 0 HA THR A 39 6.157 -2.429 -11.507 1.00 0.00 H new ATOM 0 HB THR A 39 3.260 -2.149 -10.638 1.00 0.00 H new ATOM 0 HG1 THR A 39 3.256 -0.399 -12.211 1.00 0.00 H new ATOM 0 HG21 THR A 39 3.942 0.127 -9.981 1.00 0.00 H new ATOM 0 HG22 THR A 39 4.866 -1.116 -9.105 1.00 0.00 H new ATOM 0 HG23 THR A 39 5.616 -0.240 -10.460 1.00 0.00 H new ATOM 601 N LEU A 40 4.435 -4.529 -9.628 1.00 0.00 N ATOM 602 CA LEU A 40 4.522 -5.395 -8.459 1.00 0.00 C ATOM 603 C LEU A 40 5.757 -6.283 -8.563 1.00 0.00 C ATOM 604 O LEU A 40 6.503 -6.448 -7.598 1.00 0.00 O ATOM 605 CB LEU A 40 3.260 -6.257 -8.344 1.00 0.00 C ATOM 606 CG LEU A 40 3.219 -7.199 -7.138 1.00 0.00 C ATOM 607 CD1 LEU A 40 3.211 -6.407 -5.840 1.00 0.00 C ATOM 608 CD2 LEU A 40 2.004 -8.112 -7.214 1.00 0.00 C ATOM 0 H LEU A 40 3.611 -4.689 -10.208 1.00 0.00 H new ATOM 0 HA LEU A 40 4.604 -4.776 -7.565 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.393 -5.598 -8.299 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.162 -6.852 -9.252 1.00 0.00 H new ATOM 0 HG LEU A 40 4.116 -7.818 -7.156 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.182 -7.094 -4.995 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.112 -5.797 -5.781 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.333 -5.761 -5.813 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.992 -8.774 -6.348 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.096 -7.509 -7.222 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.053 -8.707 -8.126 1.00 0.00 H new ATOM 620 N LYS A 41 5.969 -6.828 -9.757 1.00 0.00 N ATOM 621 CA LYS A 41 7.126 -7.675 -10.043 1.00 0.00 C ATOM 622 C LYS A 41 8.421 -6.943 -9.700 1.00 0.00 C ATOM 623 O LYS A 41 9.332 -7.516 -9.099 1.00 0.00 O ATOM 624 CB LYS A 41 7.125 -8.055 -11.526 1.00 0.00 C ATOM 625 CG LYS A 41 8.089 -9.171 -11.890 1.00 0.00 C ATOM 626 CD LYS A 41 8.185 -9.340 -13.399 1.00 0.00 C ATOM 627 CE LYS A 41 9.068 -10.519 -13.776 1.00 0.00 C ATOM 628 NZ LYS A 41 8.417 -11.827 -13.493 1.00 0.00 N ATOM 0 H LYS A 41 5.346 -6.696 -10.554 1.00 0.00 H new ATOM 0 HA LYS A 41 7.063 -8.576 -9.433 1.00 0.00 H new ATOM 0 HB2 LYS A 41 6.117 -8.356 -11.811 1.00 0.00 H new ATOM 0 HB3 LYS A 41 7.372 -7.172 -12.115 1.00 0.00 H new ATOM 0 HG2 LYS A 41 9.076 -8.951 -11.482 1.00 0.00 H new ATOM 0 HG3 LYS A 41 7.757 -10.105 -11.437 1.00 0.00 H new ATOM 0 HD2 LYS A 41 7.187 -9.485 -13.813 1.00 0.00 H new ATOM 0 HD3 LYS A 41 8.585 -8.429 -13.843 1.00 0.00 H new ATOM 0 HE2 LYS A 41 9.315 -10.461 -14.836 1.00 0.00 H new ATOM 0 HE3 LYS A 41 10.007 -10.457 -13.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 9.012 -12.597 -13.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 8.297 -11.940 -12.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 7.486 -11.859 -13.956 1.00 0.00 H new ATOM 642 N ASN A 42 8.482 -5.673 -10.086 1.00 0.00 N ATOM 643 CA ASN A 42 9.636 -4.821 -9.802 1.00 0.00 C ATOM 644 C ASN A 42 9.956 -4.787 -8.310 1.00 0.00 C ATOM 645 O ASN A 42 11.104 -5.001 -7.917 1.00 0.00 O ATOM 646 CB ASN A 42 9.399 -3.396 -10.314 1.00 0.00 C ATOM 647 CG ASN A 42 9.788 -3.219 -11.770 1.00 0.00 C ATOM 648 OD1 ASN A 42 9.722 -4.152 -12.570 1.00 0.00 O ATOM 649 ND2 ASN A 42 10.207 -2.012 -12.116 1.00 0.00 N ATOM 0 H ASN A 42 7.737 -5.205 -10.602 1.00 0.00 H new ATOM 0 HA ASN A 42 10.490 -5.251 -10.325 1.00 0.00 H new ATOM 0 HB2 ASN A 42 8.346 -3.142 -10.191 1.00 0.00 H new ATOM 0 HB3 ASN A 42 9.969 -2.696 -9.703 1.00 0.00 H new ATOM 0 HD21 ASN A 42 10.491 -1.827 -13.078 1.00 0.00 H new ATOM 0 HD22 ASN A 42 10.246 -1.267 -11.421 1.00 0.00 H new ATOM 656 N TRP A 43 8.942 -4.529 -7.488 1.00 0.00 N ATOM 657 CA TRP A 43 9.119 -4.496 -6.036 1.00 0.00 C ATOM 658 C TRP A 43 9.572 -5.853 -5.507 1.00 0.00 C ATOM 659 O TRP A 43 10.448 -5.933 -4.645 1.00 0.00 O ATOM 660 CB TRP A 43 7.822 -4.068 -5.333 1.00 0.00 C ATOM 661 CG TRP A 43 7.617 -2.582 -5.293 1.00 0.00 C ATOM 662 CD1 TRP A 43 8.527 -1.619 -5.618 1.00 0.00 C ATOM 663 CD2 TRP A 43 6.428 -1.888 -4.888 1.00 0.00 C ATOM 664 NE1 TRP A 43 7.986 -0.373 -5.428 1.00 0.00 N ATOM 665 CE2 TRP A 43 6.698 -0.511 -4.995 1.00 0.00 C ATOM 666 CE3 TRP A 43 5.163 -2.290 -4.450 1.00 0.00 C ATOM 667 CZ2 TRP A 43 5.756 0.459 -4.678 1.00 0.00 C ATOM 668 CZ3 TRP A 43 4.228 -1.324 -4.138 1.00 0.00 C ATOM 669 CH2 TRP A 43 4.527 0.037 -4.256 1.00 0.00 C ATOM 0 H TRP A 43 7.990 -4.340 -7.801 1.00 0.00 H new ATOM 0 HA TRP A 43 9.894 -3.761 -5.818 1.00 0.00 H new ATOM 0 HB2 TRP A 43 6.975 -4.529 -5.841 1.00 0.00 H new ATOM 0 HB3 TRP A 43 7.829 -4.452 -4.313 1.00 0.00 H new ATOM 0 HD1 TRP A 43 9.529 -1.810 -5.974 1.00 0.00 H new ATOM 0 HE1 TRP A 43 8.467 0.513 -5.585 1.00 0.00 H new ATOM 0 HE3 TRP A 43 4.921 -3.339 -4.357 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 5.987 1.511 -4.762 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 3.248 -1.624 -3.797 1.00 0.00 H new ATOM 0 HH2 TRP A 43 3.772 0.769 -4.009 1.00 0.00 H new ATOM 680 N ILE A 44 8.979 -6.913 -6.044 1.00 0.00 N ATOM 681 CA ILE A 44 9.298 -8.277 -5.625 1.00 0.00 C ATOM 682 C ILE A 44 10.767 -8.603 -5.871 1.00 0.00 C ATOM 683 O ILE A 44 11.463 -9.083 -4.979 1.00 0.00 O ATOM 684 CB ILE A 44 8.417 -9.312 -6.365 1.00 0.00 C ATOM 685 CG1 ILE A 44 6.938 -9.039 -6.090 1.00 0.00 C ATOM 686 CG2 ILE A 44 8.783 -10.731 -5.942 1.00 0.00 C ATOM 687 CD1 ILE A 44 6.004 -9.866 -6.943 1.00 0.00 C ATOM 0 H ILE A 44 8.270 -6.855 -6.775 1.00 0.00 H new ATOM 0 HA ILE A 44 9.095 -8.335 -4.556 1.00 0.00 H new ATOM 0 HB ILE A 44 8.598 -9.217 -7.436 1.00 0.00 H new ATOM 0 HG12 ILE A 44 6.729 -9.238 -5.039 1.00 0.00 H new ATOM 0 HG13 ILE A 44 6.734 -7.982 -6.261 1.00 0.00 H new ATOM 0 HG21 ILE A 44 8.152 -11.443 -6.474 1.00 0.00 H new ATOM 0 HG22 ILE A 44 9.829 -10.924 -6.181 1.00 0.00 H new ATOM 0 HG23 ILE A 44 8.630 -10.842 -4.868 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.971 -9.621 -6.695 1.00 0.00 H new ATOM 0 HD12 ILE A 44 6.185 -9.650 -7.996 1.00 0.00 H new ATOM 0 HD13 ILE A 44 6.181 -10.925 -6.754 1.00 0.00 H new ATOM 699 N ILE A 45 11.234 -8.334 -7.080 1.00 0.00 N ATOM 700 CA ILE A 45 12.605 -8.651 -7.457 1.00 0.00 C ATOM 701 C ILE A 45 13.606 -7.736 -6.747 1.00 0.00 C ATOM 702 O ILE A 45 14.677 -8.170 -6.326 1.00 0.00 O ATOM 703 CB ILE A 45 12.800 -8.533 -8.985 1.00 0.00 C ATOM 704 CG1 ILE A 45 11.805 -9.438 -9.719 1.00 0.00 C ATOM 705 CG2 ILE A 45 14.230 -8.891 -9.375 1.00 0.00 C ATOM 706 CD1 ILE A 45 11.855 -9.300 -11.225 1.00 0.00 C ATOM 0 H ILE A 45 10.684 -7.896 -7.819 1.00 0.00 H new ATOM 0 HA ILE A 45 12.791 -9.680 -7.149 1.00 0.00 H new ATOM 0 HB ILE A 45 12.614 -7.499 -9.276 1.00 0.00 H new ATOM 0 HG12 ILE A 45 12.005 -10.475 -9.451 1.00 0.00 H new ATOM 0 HG13 ILE A 45 10.796 -9.209 -9.375 1.00 0.00 H new ATOM 0 HG21 ILE A 45 14.346 -8.801 -10.455 1.00 0.00 H new ATOM 0 HG22 ILE A 45 14.923 -8.212 -8.878 1.00 0.00 H new ATOM 0 HG23 ILE A 45 14.444 -9.916 -9.071 1.00 0.00 H new ATOM 0 HD11 ILE A 45 11.124 -9.971 -11.676 1.00 0.00 H new ATOM 0 HD12 ILE A 45 11.625 -8.272 -11.504 1.00 0.00 H new ATOM 0 HD13 ILE A 45 12.852 -9.558 -11.581 1.00 0.00 H new ATOM 718 N LYS A 46 13.243 -6.471 -6.604 1.00 0.00 N ATOM 719 CA LYS A 46 14.159 -5.470 -6.077 1.00 0.00 C ATOM 720 C LYS A 46 14.274 -5.553 -4.558 1.00 0.00 C ATOM 721 O LYS A 46 15.380 -5.596 -4.014 1.00 0.00 O ATOM 722 CB LYS A 46 13.700 -4.075 -6.501 1.00 0.00 C ATOM 723 CG LYS A 46 14.668 -2.964 -6.139 1.00 0.00 C ATOM 724 CD LYS A 46 14.274 -1.665 -6.819 1.00 0.00 C ATOM 725 CE LYS A 46 15.277 -0.559 -6.553 1.00 0.00 C ATOM 726 NZ LYS A 46 15.049 0.608 -7.444 1.00 0.00 N ATOM 0 H LYS A 46 12.319 -6.112 -6.846 1.00 0.00 H new ATOM 0 HA LYS A 46 15.148 -5.668 -6.490 1.00 0.00 H new ATOM 0 HB2 LYS A 46 13.544 -4.068 -7.580 1.00 0.00 H new ATOM 0 HB3 LYS A 46 12.735 -3.866 -6.038 1.00 0.00 H new ATOM 0 HG2 LYS A 46 14.681 -2.825 -5.058 1.00 0.00 H new ATOM 0 HG3 LYS A 46 15.678 -3.244 -6.437 1.00 0.00 H new ATOM 0 HD2 LYS A 46 14.191 -1.829 -7.893 1.00 0.00 H new ATOM 0 HD3 LYS A 46 13.290 -1.355 -6.467 1.00 0.00 H new ATOM 0 HE2 LYS A 46 15.205 -0.243 -5.512 1.00 0.00 H new ATOM 0 HE3 LYS A 46 16.288 -0.939 -6.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 15.752 1.346 -7.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 15.142 0.311 -8.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 14.093 0.985 -7.284 1.00 0.00 H new ATOM 740 N TYR A 47 13.139 -5.585 -3.876 1.00 0.00 N ATOM 741 CA TYR A 47 13.133 -5.565 -2.420 1.00 0.00 C ATOM 742 C TYR A 47 13.207 -6.972 -1.849 1.00 0.00 C ATOM 743 O TYR A 47 13.632 -7.166 -0.708 1.00 0.00 O ATOM 744 CB TYR A 47 11.904 -4.816 -1.908 1.00 0.00 C ATOM 745 CG TYR A 47 11.920 -3.361 -2.309 1.00 0.00 C ATOM 746 CD1 TYR A 47 12.673 -2.436 -1.596 1.00 0.00 C ATOM 747 CD2 TYR A 47 11.201 -2.915 -3.408 1.00 0.00 C ATOM 748 CE1 TYR A 47 12.713 -1.110 -1.972 1.00 0.00 C ATOM 749 CE2 TYR A 47 11.234 -1.588 -3.788 1.00 0.00 C ATOM 750 CZ TYR A 47 11.989 -0.690 -3.065 1.00 0.00 C ATOM 751 OH TYR A 47 12.026 0.631 -3.444 1.00 0.00 O ATOM 0 H TYR A 47 12.214 -5.625 -4.304 1.00 0.00 H new ATOM 0 HA TYR A 47 14.022 -5.034 -2.078 1.00 0.00 H new ATOM 0 HB2 TYR A 47 11.003 -5.289 -2.298 1.00 0.00 H new ATOM 0 HB3 TYR A 47 11.860 -4.892 -0.822 1.00 0.00 H new ATOM 0 HD1 TYR A 47 13.236 -2.761 -0.733 1.00 0.00 H new ATOM 0 HD2 TYR A 47 10.606 -3.616 -3.975 1.00 0.00 H new ATOM 0 HE1 TYR A 47 13.309 -0.405 -1.412 1.00 0.00 H new ATOM 0 HE2 TYR A 47 10.671 -1.255 -4.648 1.00 0.00 H new ATOM 0 HH TYR A 47 11.461 0.761 -4.234 1.00 0.00 H new ATOM 761 N GLY A 48 12.808 -7.955 -2.647 1.00 0.00 N ATOM 762 CA GLY A 48 13.018 -9.341 -2.275 1.00 0.00 C ATOM 763 C GLY A 48 14.448 -9.771 -2.547 1.00 0.00 C ATOM 764 O GLY A 48 14.696 -10.700 -3.318 1.00 0.00 O ATOM 0 H GLY A 48 12.343 -7.817 -3.544 1.00 0.00 H new ATOM 0 HA2 GLY A 48 12.790 -9.475 -1.218 1.00 0.00 H new ATOM 0 HA3 GLY A 48 12.331 -9.978 -2.833 1.00 0.00 H new ATOM 768 N SER A 49 15.386 -9.074 -1.914 1.00 0.00 N ATOM 769 CA SER A 49 16.809 -9.318 -2.100 1.00 0.00 C ATOM 770 C SER A 49 17.215 -10.679 -1.543 1.00 0.00 C ATOM 771 O SER A 49 18.233 -11.248 -1.946 1.00 0.00 O ATOM 772 CB SER A 49 17.613 -8.209 -1.419 1.00 0.00 C ATOM 773 OG SER A 49 17.169 -6.925 -1.835 1.00 0.00 O ATOM 0 H SER A 49 15.179 -8.322 -1.256 1.00 0.00 H new ATOM 0 HA SER A 49 17.021 -9.319 -3.169 1.00 0.00 H new ATOM 0 HB2 SER A 49 17.516 -8.298 -0.337 1.00 0.00 H new ATOM 0 HB3 SER A 49 18.671 -8.325 -1.655 1.00 0.00 H new ATOM 0 HG SER A 49 16.612 -7.015 -2.636 1.00 0.00 H new ATOM 779 N ASN A 50 16.431 -11.185 -0.602 1.00 0.00 N ATOM 780 CA ASN A 50 16.689 -12.494 -0.030 1.00 0.00 C ATOM 781 C ASN A 50 16.478 -13.570 -1.075 1.00 0.00 C ATOM 782 O ASN A 50 15.397 -13.701 -1.645 1.00 0.00 O ATOM 783 CB ASN A 50 15.779 -12.772 1.162 1.00 0.00 C ATOM 784 CG ASN A 50 15.983 -11.799 2.304 1.00 0.00 C ATOM 785 OD1 ASN A 50 15.367 -10.731 2.346 1.00 0.00 O ATOM 786 ND2 ASN A 50 16.832 -12.171 3.250 1.00 0.00 N ATOM 0 H ASN A 50 15.614 -10.709 -0.221 1.00 0.00 H new ATOM 0 HA ASN A 50 17.724 -12.504 0.312 1.00 0.00 H new ATOM 0 HB2 ASN A 50 14.740 -12.728 0.836 1.00 0.00 H new ATOM 0 HB3 ASN A 50 15.958 -13.786 1.520 1.00 0.00 H new ATOM 0 HD21 ASN A 50 16.998 -11.565 4.054 1.00 0.00 H new ATOM 0 HD22 ASN A 50 17.320 -13.063 3.175 1.00 0.00 H new ATOM 793 N HIS A 51 17.518 -14.335 -1.314 1.00 0.00 N ATOM 794 CA HIS A 51 17.451 -15.439 -2.260 1.00 0.00 C ATOM 795 C HIS A 51 16.737 -16.606 -1.608 1.00 0.00 C ATOM 796 O HIS A 51 16.021 -17.364 -2.257 1.00 0.00 O ATOM 797 CB HIS A 51 18.849 -15.857 -2.722 1.00 0.00 C ATOM 798 CG HIS A 51 19.556 -14.797 -3.505 1.00 0.00 C ATOM 799 ND1 HIS A 51 19.579 -14.763 -4.882 1.00 0.00 N ATOM 800 CD2 HIS A 51 20.264 -13.719 -3.095 1.00 0.00 C ATOM 801 CE1 HIS A 51 20.269 -13.712 -5.282 1.00 0.00 C ATOM 802 NE2 HIS A 51 20.693 -13.059 -4.217 1.00 0.00 N ATOM 0 H HIS A 51 18.427 -14.217 -0.867 1.00 0.00 H new ATOM 0 HA HIS A 51 16.898 -15.117 -3.142 1.00 0.00 H new ATOM 0 HB2 HIS A 51 19.450 -16.116 -1.850 1.00 0.00 H new ATOM 0 HB3 HIS A 51 18.768 -16.757 -3.332 1.00 0.00 H new ATOM 0 HD2 HIS A 51 20.456 -13.432 -2.072 1.00 0.00 H new ATOM 0 HE1 HIS A 51 20.455 -13.433 -6.309 1.00 0.00 H new ATOM 0 HE2 HIS A 51 21.249 -12.204 -4.227 1.00 0.00 H new ATOM 811 N ASN A 52 16.926 -16.719 -0.303 1.00 0.00 N ATOM 812 CA ASN A 52 16.222 -17.691 0.500 1.00 0.00 C ATOM 813 C ASN A 52 15.248 -16.978 1.418 1.00 0.00 C ATOM 814 O ASN A 52 15.588 -16.623 2.547 1.00 0.00 O ATOM 815 CB ASN A 52 17.196 -18.531 1.324 1.00 0.00 C ATOM 816 CG ASN A 52 17.666 -19.776 0.596 1.00 0.00 C ATOM 817 OD1 ASN A 52 17.786 -19.797 -0.629 1.00 0.00 O ATOM 818 ND2 ASN A 52 17.923 -20.828 1.353 1.00 0.00 N ATOM 0 H ASN A 52 17.575 -16.135 0.225 1.00 0.00 H new ATOM 0 HA ASN A 52 15.677 -18.361 -0.165 1.00 0.00 H new ATOM 0 HB2 ASN A 52 18.061 -17.922 1.586 1.00 0.00 H new ATOM 0 HB3 ASN A 52 16.716 -18.822 2.258 1.00 0.00 H new ATOM 0 HD21 ASN A 52 18.234 -21.700 0.925 1.00 0.00 H new ATOM 0 HD22 ASN A 52 17.811 -20.768 2.365 1.00 0.00 H new ATOM 825 N VAL A 53 14.058 -16.717 0.899 1.00 0.00 N ATOM 826 CA VAL A 53 13.013 -16.056 1.666 1.00 0.00 C ATOM 827 C VAL A 53 12.596 -16.924 2.848 1.00 0.00 C ATOM 828 O VAL A 53 12.638 -16.486 3.998 1.00 0.00 O ATOM 829 CB VAL A 53 11.784 -15.739 0.785 1.00 0.00 C ATOM 830 CG1 VAL A 53 10.715 -15.017 1.587 1.00 0.00 C ATOM 831 CG2 VAL A 53 12.196 -14.910 -0.424 1.00 0.00 C ATOM 0 H VAL A 53 13.791 -16.955 -0.056 1.00 0.00 H new ATOM 0 HA VAL A 53 13.417 -15.114 2.037 1.00 0.00 H new ATOM 0 HB VAL A 53 11.365 -16.682 0.433 1.00 0.00 H new ATOM 0 HG11 VAL A 53 9.860 -14.805 0.945 1.00 0.00 H new ATOM 0 HG12 VAL A 53 10.397 -15.646 2.419 1.00 0.00 H new ATOM 0 HG13 VAL A 53 11.120 -14.082 1.973 1.00 0.00 H new ATOM 0 HG21 VAL A 53 11.319 -14.695 -1.034 1.00 0.00 H new ATOM 0 HG22 VAL A 53 12.642 -13.974 -0.088 1.00 0.00 H new ATOM 0 HG23 VAL A 53 12.922 -15.466 -1.016 1.00 0.00 H new ATOM 841 N GLN A 54 12.242 -18.173 2.554 1.00 0.00 N ATOM 842 CA GLN A 54 11.830 -19.131 3.573 1.00 0.00 C ATOM 843 C GLN A 54 10.587 -18.622 4.301 1.00 0.00 C ATOM 844 O GLN A 54 9.701 -18.034 3.681 1.00 0.00 O ATOM 845 CB GLN A 54 12.979 -19.403 4.557 1.00 0.00 C ATOM 846 CG GLN A 54 14.329 -19.621 3.881 1.00 0.00 C ATOM 847 CD GLN A 54 14.291 -20.689 2.802 1.00 0.00 C ATOM 848 OE1 GLN A 54 14.000 -20.405 1.639 1.00 0.00 O ATOM 849 NE2 GLN A 54 14.614 -21.914 3.169 1.00 0.00 N ATOM 0 H GLN A 54 12.233 -18.547 1.605 1.00 0.00 H new ATOM 0 HA GLN A 54 11.579 -20.074 3.088 1.00 0.00 H new ATOM 0 HB2 GLN A 54 13.060 -18.564 5.247 1.00 0.00 H new ATOM 0 HB3 GLN A 54 12.735 -20.283 5.152 1.00 0.00 H new ATOM 0 HG2 GLN A 54 14.664 -18.681 3.442 1.00 0.00 H new ATOM 0 HG3 GLN A 54 15.065 -19.901 4.635 1.00 0.00 H new ATOM 0 HE21 GLN A 54 14.849 -22.110 4.142 1.00 0.00 H new ATOM 0 HE22 GLN A 54 14.629 -22.666 2.480 1.00 0.00 H new ATOM 858 N GLY A 55 10.513 -18.865 5.601 1.00 0.00 N ATOM 859 CA GLY A 55 9.356 -18.441 6.368 1.00 0.00 C ATOM 860 C GLY A 55 9.308 -16.943 6.604 1.00 0.00 C ATOM 861 O GLY A 55 8.232 -16.350 6.585 1.00 0.00 O ATOM 0 H GLY A 55 11.232 -19.348 6.140 1.00 0.00 H new ATOM 0 HA2 GLY A 55 8.450 -18.749 5.846 1.00 0.00 H new ATOM 0 HA3 GLY A 55 9.359 -18.953 7.330 1.00 0.00 H new ATOM 865 N THR A 56 10.482 -16.344 6.789 1.00 0.00 N ATOM 866 CA THR A 56 10.629 -14.918 7.109 1.00 0.00 C ATOM 867 C THR A 56 9.657 -14.435 8.190 1.00 0.00 C ATOM 868 O THR A 56 8.522 -14.056 7.906 1.00 0.00 O ATOM 869 CB THR A 56 10.492 -14.014 5.863 1.00 0.00 C ATOM 870 OG1 THR A 56 9.561 -14.568 4.925 1.00 0.00 O ATOM 871 CG2 THR A 56 11.843 -13.795 5.193 1.00 0.00 C ATOM 0 H THR A 56 11.372 -16.838 6.721 1.00 0.00 H new ATOM 0 HA THR A 56 11.642 -14.831 7.501 1.00 0.00 H new ATOM 0 HB THR A 56 10.112 -13.049 6.199 1.00 0.00 H new ATOM 0 HG1 THR A 56 8.749 -14.848 5.397 1.00 0.00 H new ATOM 0 HG21 THR A 56 11.716 -13.156 4.319 1.00 0.00 H new ATOM 0 HG22 THR A 56 12.525 -13.317 5.897 1.00 0.00 H new ATOM 0 HG23 THR A 56 12.255 -14.755 4.883 1.00 0.00 H new ATOM 879 N THR A 57 10.116 -14.437 9.432 1.00 0.00 N ATOM 880 CA THR A 57 9.305 -13.955 10.535 1.00 0.00 C ATOM 881 C THR A 57 9.521 -12.457 10.760 1.00 0.00 C ATOM 882 O THR A 57 10.601 -12.023 11.167 1.00 0.00 O ATOM 883 CB THR A 57 9.603 -14.735 11.830 1.00 0.00 C ATOM 884 OG1 THR A 57 11.019 -14.871 12.015 1.00 0.00 O ATOM 885 CG2 THR A 57 8.959 -16.112 11.797 1.00 0.00 C ATOM 0 H THR A 57 11.044 -14.766 9.699 1.00 0.00 H new ATOM 0 HA THR A 57 8.261 -14.119 10.269 1.00 0.00 H new ATOM 0 HB THR A 57 9.182 -14.173 12.664 1.00 0.00 H new ATOM 0 HG1 THR A 57 11.461 -14.027 11.787 1.00 0.00 H new ATOM 0 HG21 THR A 57 9.185 -16.642 12.723 1.00 0.00 H new ATOM 0 HG22 THR A 57 7.879 -16.006 11.694 1.00 0.00 H new ATOM 0 HG23 THR A 57 9.351 -16.677 10.951 1.00 0.00 H new ATOM 893 N PRO A 58 8.499 -11.638 10.466 1.00 0.00 N ATOM 894 CA PRO A 58 8.558 -10.194 10.653 1.00 0.00 C ATOM 895 C PRO A 58 8.260 -9.796 12.096 1.00 0.00 C ATOM 896 O PRO A 58 7.220 -10.161 12.648 1.00 0.00 O ATOM 897 CB PRO A 58 7.465 -9.659 9.710 1.00 0.00 C ATOM 898 CG PRO A 58 6.848 -10.861 9.057 1.00 0.00 C ATOM 899 CD PRO A 58 7.207 -12.043 9.911 1.00 0.00 C ATOM 0 HA PRO A 58 9.549 -9.793 10.439 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.718 -9.091 10.264 1.00 0.00 H new ATOM 0 HB3 PRO A 58 7.889 -8.986 8.965 1.00 0.00 H new ATOM 0 HG2 PRO A 58 5.766 -10.750 8.984 1.00 0.00 H new ATOM 0 HG3 PRO A 58 7.225 -10.987 8.042 1.00 0.00 H new ATOM 0 HD2 PRO A 58 6.467 -12.223 10.691 1.00 0.00 H new ATOM 0 HD3 PRO A 58 7.284 -12.960 9.327 1.00 0.00 H new ATOM 907 N SER A 59 9.171 -9.037 12.692 1.00 0.00 N ATOM 908 CA SER A 59 9.046 -8.614 14.086 1.00 0.00 C ATOM 909 C SER A 59 7.777 -7.786 14.325 1.00 0.00 C ATOM 910 O SER A 59 7.275 -7.717 15.445 1.00 0.00 O ATOM 911 CB SER A 59 10.280 -7.807 14.485 1.00 0.00 C ATOM 912 OG SER A 59 11.466 -8.530 14.194 1.00 0.00 O ATOM 0 H SER A 59 10.014 -8.698 12.228 1.00 0.00 H new ATOM 0 HA SER A 59 8.970 -9.509 14.703 1.00 0.00 H new ATOM 0 HB2 SER A 59 10.287 -6.856 13.952 1.00 0.00 H new ATOM 0 HB3 SER A 59 10.241 -7.575 15.549 1.00 0.00 H new ATOM 0 HG SER A 59 12.246 -7.997 14.455 1.00 0.00 H new ATOM 918 N ALA A 60 7.258 -7.176 13.268 1.00 0.00 N ATOM 919 CA ALA A 60 6.071 -6.332 13.371 1.00 0.00 C ATOM 920 C ALA A 60 4.793 -7.160 13.261 1.00 0.00 C ATOM 921 O ALA A 60 3.726 -6.734 13.694 1.00 0.00 O ATOM 922 CB ALA A 60 6.099 -5.260 12.293 1.00 0.00 C ATOM 0 H ALA A 60 7.641 -7.249 12.325 1.00 0.00 H new ATOM 0 HA ALA A 60 6.078 -5.854 14.351 1.00 0.00 H new ATOM 0 HB1 ALA A 60 5.210 -4.635 12.378 1.00 0.00 H new ATOM 0 HB2 ALA A 60 6.989 -4.643 12.417 1.00 0.00 H new ATOM 0 HB3 ALA A 60 6.118 -5.732 11.311 1.00 0.00 H new ATOM 928 N ALA A 61 4.911 -8.361 12.704 1.00 0.00 N ATOM 929 CA ALA A 61 3.739 -9.175 12.390 1.00 0.00 C ATOM 930 C ALA A 61 3.320 -10.058 13.563 1.00 0.00 C ATOM 931 O ALA A 61 2.478 -10.933 13.407 1.00 0.00 O ATOM 932 CB ALA A 61 3.994 -10.029 11.155 1.00 0.00 C ATOM 0 H ALA A 61 5.803 -8.792 12.461 1.00 0.00 H new ATOM 0 HA ALA A 61 2.918 -8.488 12.187 1.00 0.00 H new ATOM 0 HB1 ALA A 61 3.109 -10.628 10.938 1.00 0.00 H new ATOM 0 HB2 ALA A 61 4.213 -9.383 10.305 1.00 0.00 H new ATOM 0 HB3 ALA A 61 4.843 -10.688 11.337 1.00 0.00 H new ATOM 938 N VAL A 62 3.894 -9.813 14.736 1.00 0.00 N ATOM 939 CA VAL A 62 3.570 -10.597 15.928 1.00 0.00 C ATOM 940 C VAL A 62 2.085 -10.482 16.272 1.00 0.00 C ATOM 941 O VAL A 62 1.400 -11.482 16.497 1.00 0.00 O ATOM 942 CB VAL A 62 4.419 -10.154 17.143 1.00 0.00 C ATOM 943 CG1 VAL A 62 4.067 -10.962 18.381 1.00 0.00 C ATOM 944 CG2 VAL A 62 5.903 -10.284 16.835 1.00 0.00 C ATOM 0 H VAL A 62 4.586 -9.079 14.889 1.00 0.00 H new ATOM 0 HA VAL A 62 3.803 -11.637 15.701 1.00 0.00 H new ATOM 0 HB VAL A 62 4.193 -9.107 17.344 1.00 0.00 H new ATOM 0 HG11 VAL A 62 4.679 -10.629 19.219 1.00 0.00 H new ATOM 0 HG12 VAL A 62 3.014 -10.819 18.622 1.00 0.00 H new ATOM 0 HG13 VAL A 62 4.255 -12.019 18.191 1.00 0.00 H new ATOM 0 HG21 VAL A 62 6.484 -9.968 17.702 1.00 0.00 H new ATOM 0 HG22 VAL A 62 6.136 -11.323 16.601 1.00 0.00 H new ATOM 0 HG23 VAL A 62 6.154 -9.655 15.981 1.00 0.00 H new ATOM 954 N SER A 63 1.600 -9.258 16.295 1.00 0.00 N ATOM 955 CA SER A 63 0.198 -8.997 16.580 1.00 0.00 C ATOM 956 C SER A 63 -0.653 -9.129 15.317 1.00 0.00 C ATOM 957 O SER A 63 -1.828 -9.491 15.378 1.00 0.00 O ATOM 958 CB SER A 63 0.045 -7.600 17.178 1.00 0.00 C ATOM 959 OG SER A 63 0.779 -7.486 18.386 1.00 0.00 O ATOM 0 H SER A 63 2.157 -8.422 16.119 1.00 0.00 H new ATOM 0 HA SER A 63 -0.152 -9.737 17.299 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.393 -6.854 16.464 1.00 0.00 H new ATOM 0 HB3 SER A 63 -1.009 -7.394 17.367 1.00 0.00 H new ATOM 0 HG SER A 63 0.669 -6.583 18.752 1.00 0.00 H new ATOM 965 N GLU A 64 -0.042 -8.857 14.172 1.00 0.00 N ATOM 966 CA GLU A 64 -0.743 -8.902 12.892 1.00 0.00 C ATOM 967 C GLU A 64 -1.082 -10.343 12.514 1.00 0.00 C ATOM 968 O GLU A 64 -2.011 -10.603 11.746 1.00 0.00 O ATOM 969 CB GLU A 64 0.126 -8.272 11.805 1.00 0.00 C ATOM 970 CG GLU A 64 -0.671 -7.614 10.699 1.00 0.00 C ATOM 971 CD GLU A 64 -1.320 -6.320 11.147 1.00 0.00 C ATOM 972 OE1 GLU A 64 -2.220 -6.362 12.015 1.00 0.00 O ATOM 973 OE2 GLU A 64 -0.927 -5.248 10.645 1.00 0.00 O ATOM 0 H GLU A 64 0.943 -8.601 14.102 1.00 0.00 H new ATOM 0 HA GLU A 64 -1.672 -8.340 12.984 1.00 0.00 H new ATOM 0 HB2 GLU A 64 0.782 -7.530 12.260 1.00 0.00 H new ATOM 0 HB3 GLU A 64 0.766 -9.041 11.372 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -0.015 -7.414 9.852 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -1.441 -8.302 10.351 1.00 0.00 H new ATOM 980 N ALA A 65 -0.328 -11.270 13.087 1.00 0.00 N ATOM 981 CA ALA A 65 -0.485 -12.696 12.830 1.00 0.00 C ATOM 982 C ALA A 65 -1.890 -13.195 13.154 1.00 0.00 C ATOM 983 O ALA A 65 -2.315 -14.219 12.632 1.00 0.00 O ATOM 984 CB ALA A 65 0.544 -13.490 13.620 1.00 0.00 C ATOM 0 H ALA A 65 0.417 -11.053 13.749 1.00 0.00 H new ATOM 0 HA ALA A 65 -0.324 -12.848 11.763 1.00 0.00 H new ATOM 0 HB1 ALA A 65 0.416 -14.554 13.419 1.00 0.00 H new ATOM 0 HB2 ALA A 65 1.547 -13.183 13.323 1.00 0.00 H new ATOM 0 HB3 ALA A 65 0.408 -13.303 14.685 1.00 0.00 H new ATOM 990 N GLU A 66 -2.605 -12.484 14.021 1.00 0.00 N ATOM 991 CA GLU A 66 -3.921 -12.933 14.455 1.00 0.00 C ATOM 992 C GLU A 66 -4.896 -13.013 13.279 1.00 0.00 C ATOM 993 O GLU A 66 -5.551 -14.037 13.076 1.00 0.00 O ATOM 994 CB GLU A 66 -4.485 -12.017 15.535 1.00 0.00 C ATOM 995 CG GLU A 66 -5.534 -12.711 16.386 1.00 0.00 C ATOM 996 CD GLU A 66 -6.019 -11.876 17.545 1.00 0.00 C ATOM 997 OE1 GLU A 66 -6.845 -10.971 17.323 1.00 0.00 O ATOM 998 OE2 GLU A 66 -5.589 -12.131 18.687 1.00 0.00 O ATOM 0 H GLU A 66 -2.298 -11.603 14.433 1.00 0.00 H new ATOM 0 HA GLU A 66 -3.800 -13.932 14.873 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -3.673 -11.669 16.174 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -4.924 -11.135 15.068 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.385 -12.974 15.757 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -5.120 -13.644 16.769 1.00 0.00 H new ATOM 1005 N GLN A 67 -4.986 -11.944 12.499 1.00 0.00 N ATOM 1006 CA GLN A 67 -5.858 -11.939 11.331 1.00 0.00 C ATOM 1007 C GLN A 67 -5.277 -12.833 10.244 1.00 0.00 C ATOM 1008 O GLN A 67 -6.004 -13.347 9.398 1.00 0.00 O ATOM 1009 CB GLN A 67 -6.061 -10.519 10.806 1.00 0.00 C ATOM 1010 CG GLN A 67 -4.795 -9.873 10.280 1.00 0.00 C ATOM 1011 CD GLN A 67 -4.950 -8.384 10.091 1.00 0.00 C ATOM 1012 OE1 GLN A 67 -5.334 -7.912 9.020 1.00 0.00 O ATOM 1013 NE2 GLN A 67 -4.671 -7.635 11.140 1.00 0.00 N ATOM 0 H GLN A 67 -4.471 -11.077 12.651 1.00 0.00 H new ATOM 0 HA GLN A 67 -6.832 -12.329 11.626 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -6.805 -10.539 10.010 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -6.467 -9.901 11.606 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -3.976 -10.066 10.973 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -4.523 -10.332 9.329 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -4.356 -8.069 12.007 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -4.770 -6.621 11.084 1.00 0.00 H new ATOM 1022 N ILE A 68 -3.961 -13.021 10.285 1.00 0.00 N ATOM 1023 CA ILE A 68 -3.281 -13.939 9.378 1.00 0.00 C ATOM 1024 C ILE A 68 -3.713 -15.375 9.673 1.00 0.00 C ATOM 1025 O ILE A 68 -3.941 -16.167 8.761 1.00 0.00 O ATOM 1026 CB ILE A 68 -1.743 -13.811 9.498 1.00 0.00 C ATOM 1027 CG1 ILE A 68 -1.292 -12.409 9.078 1.00 0.00 C ATOM 1028 CG2 ILE A 68 -1.034 -14.871 8.666 1.00 0.00 C ATOM 1029 CD1 ILE A 68 -1.662 -12.044 7.655 1.00 0.00 C ATOM 0 H ILE A 68 -3.341 -12.546 10.941 1.00 0.00 H new ATOM 0 HA ILE A 68 -3.561 -13.679 8.357 1.00 0.00 H new ATOM 0 HB ILE A 68 -1.472 -13.970 10.542 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -1.733 -11.678 9.756 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -0.210 -12.337 9.191 1.00 0.00 H new ATOM 0 HG21 ILE A 68 0.045 -14.755 8.771 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -1.328 -15.862 9.012 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -1.311 -14.756 7.618 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -1.308 -11.037 7.434 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -1.199 -12.751 6.966 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -2.745 -12.081 7.540 1.00 0.00 H new ATOM 1041 N ARG A 69 -3.843 -15.686 10.959 1.00 0.00 N ATOM 1042 CA ARG A 69 -4.355 -16.979 11.408 1.00 0.00 C ATOM 1043 C ARG A 69 -5.752 -17.227 10.843 1.00 0.00 C ATOM 1044 O ARG A 69 -6.077 -18.336 10.413 1.00 0.00 O ATOM 1045 CB ARG A 69 -4.387 -17.014 12.943 1.00 0.00 C ATOM 1046 CG ARG A 69 -5.075 -18.234 13.536 1.00 0.00 C ATOM 1047 CD ARG A 69 -5.170 -18.121 15.049 1.00 0.00 C ATOM 1048 NE ARG A 69 -5.934 -19.217 15.647 1.00 0.00 N ATOM 1049 CZ ARG A 69 -6.389 -19.213 16.901 1.00 0.00 C ATOM 1050 NH1 ARG A 69 -6.169 -18.175 17.699 1.00 0.00 N ATOM 1051 NH2 ARG A 69 -7.072 -20.251 17.358 1.00 0.00 N ATOM 0 H ARG A 69 -3.597 -15.051 11.719 1.00 0.00 H new ATOM 0 HA ARG A 69 -3.696 -17.767 11.045 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -3.363 -16.974 13.315 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -4.892 -16.118 13.303 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -6.074 -18.336 13.111 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -4.522 -19.134 13.269 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -4.166 -18.109 15.473 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -5.638 -17.172 15.310 1.00 0.00 H new ATOM 0 HE ARG A 69 -6.131 -20.034 15.069 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -5.647 -17.369 17.355 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -6.522 -18.184 18.656 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -7.249 -21.052 16.752 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -7.421 -20.250 18.317 1.00 0.00 H new ATOM 1065 N GLN A 70 -6.565 -16.180 10.832 1.00 0.00 N ATOM 1066 CA GLN A 70 -7.913 -16.258 10.310 1.00 0.00 C ATOM 1067 C GLN A 70 -7.878 -16.386 8.786 1.00 0.00 C ATOM 1068 O GLN A 70 -8.618 -17.173 8.203 1.00 0.00 O ATOM 1069 CB GLN A 70 -8.676 -15.003 10.728 1.00 0.00 C ATOM 1070 CG GLN A 70 -9.946 -15.262 11.533 1.00 0.00 C ATOM 1071 CD GLN A 70 -11.065 -15.911 10.735 1.00 0.00 C ATOM 1072 OE1 GLN A 70 -10.831 -16.677 9.806 1.00 0.00 O ATOM 1073 NE2 GLN A 70 -12.300 -15.600 11.095 1.00 0.00 N ATOM 0 H GLN A 70 -6.306 -15.258 11.184 1.00 0.00 H new ATOM 0 HA GLN A 70 -8.417 -17.137 10.712 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -8.012 -14.371 11.318 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -8.939 -14.440 9.832 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -9.701 -15.901 12.382 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -10.305 -14.316 11.939 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -12.458 -14.959 11.873 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -13.093 -16.001 10.595 1.00 0.00 H new ATOM 1082 N LEU A 71 -6.990 -15.619 8.156 1.00 0.00 N ATOM 1083 CA LEU A 71 -6.833 -15.638 6.703 1.00 0.00 C ATOM 1084 C LEU A 71 -6.414 -17.024 6.218 1.00 0.00 C ATOM 1085 O LEU A 71 -6.971 -17.552 5.258 1.00 0.00 O ATOM 1086 CB LEU A 71 -5.796 -14.593 6.271 1.00 0.00 C ATOM 1087 CG LEU A 71 -5.553 -14.494 4.763 1.00 0.00 C ATOM 1088 CD1 LEU A 71 -6.809 -14.020 4.046 1.00 0.00 C ATOM 1089 CD2 LEU A 71 -4.388 -13.561 4.478 1.00 0.00 C ATOM 0 H LEU A 71 -6.363 -14.971 8.634 1.00 0.00 H new ATOM 0 HA LEU A 71 -7.795 -15.394 6.252 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -6.116 -13.617 6.635 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -4.849 -14.822 6.760 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.303 -15.486 4.387 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.615 -13.956 2.975 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.619 -14.726 4.226 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.094 -13.037 4.422 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -4.226 -13.500 3.402 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.613 -12.568 4.868 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -3.488 -13.945 4.959 1.00 0.00 H new ATOM 1101 N LYS A 72 -5.430 -17.605 6.896 1.00 0.00 N ATOM 1102 CA LYS A 72 -4.937 -18.935 6.552 1.00 0.00 C ATOM 1103 C LYS A 72 -5.992 -20.004 6.821 1.00 0.00 C ATOM 1104 O LYS A 72 -6.066 -21.003 6.105 1.00 0.00 O ATOM 1105 CB LYS A 72 -3.670 -19.255 7.350 1.00 0.00 C ATOM 1106 CG LYS A 72 -3.258 -20.716 7.271 1.00 0.00 C ATOM 1107 CD LYS A 72 -2.104 -21.032 8.203 1.00 0.00 C ATOM 1108 CE LYS A 72 -1.928 -22.533 8.362 1.00 0.00 C ATOM 1109 NZ LYS A 72 -3.086 -23.151 9.066 1.00 0.00 N ATOM 0 H LYS A 72 -4.956 -17.174 7.690 1.00 0.00 H new ATOM 0 HA LYS A 72 -4.707 -18.937 5.487 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -2.852 -18.635 6.983 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -3.830 -18.987 8.394 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -4.110 -21.347 7.522 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -2.974 -20.958 6.247 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -1.186 -20.594 7.812 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -2.284 -20.578 9.177 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.812 -22.992 7.380 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -1.013 -22.735 8.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -2.794 -24.057 9.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -3.416 -22.513 9.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -3.857 -23.315 8.388 1.00 0.00 H new ATOM 1123 N LYS A 73 -6.793 -19.769 7.860 1.00 0.00 N ATOM 1124 CA LYS A 73 -7.788 -20.726 8.345 1.00 0.00 C ATOM 1125 C LYS A 73 -7.114 -21.869 9.098 1.00 0.00 C ATOM 1126 O LYS A 73 -6.194 -22.519 8.593 1.00 0.00 O ATOM 1127 CB LYS A 73 -8.665 -21.278 7.211 1.00 0.00 C ATOM 1128 CG LYS A 73 -9.504 -20.218 6.514 1.00 0.00 C ATOM 1129 CD LYS A 73 -10.482 -19.556 7.472 1.00 0.00 C ATOM 1130 CE LYS A 73 -11.267 -18.453 6.784 1.00 0.00 C ATOM 1131 NZ LYS A 73 -12.194 -17.770 7.723 1.00 0.00 N ATOM 0 H LYS A 73 -6.769 -18.900 8.394 1.00 0.00 H new ATOM 0 HA LYS A 73 -8.442 -20.186 9.029 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -8.026 -21.765 6.474 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -9.327 -22.044 7.616 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -8.849 -19.461 6.082 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -10.053 -20.673 5.690 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -11.170 -20.303 7.866 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -9.939 -19.143 8.322 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -10.576 -17.724 6.361 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -11.835 -18.874 5.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -12.784 -17.094 7.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -12.803 -18.476 8.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -11.645 -17.262 8.445 1.00 0.00 H new ATOM 1145 N GLU A 74 -7.563 -22.090 10.323 1.00 0.00 N ATOM 1146 CA GLU A 74 -7.030 -23.156 11.159 1.00 0.00 C ATOM 1147 C GLU A 74 -7.926 -24.391 11.093 1.00 0.00 C ATOM 1148 O GLU A 74 -7.530 -25.484 11.497 1.00 0.00 O ATOM 1149 CB GLU A 74 -6.915 -22.668 12.602 1.00 0.00 C ATOM 1150 CG GLU A 74 -8.254 -22.333 13.232 1.00 0.00 C ATOM 1151 CD GLU A 74 -8.110 -21.627 14.559 1.00 0.00 C ATOM 1152 OE1 GLU A 74 -7.172 -21.958 15.316 1.00 0.00 O ATOM 1153 OE2 GLU A 74 -8.918 -20.720 14.839 1.00 0.00 O ATOM 0 H GLU A 74 -8.301 -21.541 10.764 1.00 0.00 H new ATOM 0 HA GLU A 74 -6.041 -23.430 10.790 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -6.422 -23.435 13.199 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -6.277 -21.784 12.629 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -8.825 -21.704 12.550 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -8.825 -23.251 13.373 1.00 0.00 H new ATOM 1160 N ASN A 75 -9.133 -24.207 10.571 1.00 0.00 N ATOM 1161 CA ASN A 75 -10.114 -25.282 10.507 1.00 0.00 C ATOM 1162 C ASN A 75 -9.939 -26.069 9.203 1.00 0.00 C ATOM 1163 O ASN A 75 -9.176 -25.667 8.322 1.00 0.00 O ATOM 1164 CB ASN A 75 -11.532 -24.700 10.620 1.00 0.00 C ATOM 1165 CG ASN A 75 -12.562 -25.689 11.151 1.00 0.00 C ATOM 1166 OD1 ASN A 75 -12.450 -26.898 10.959 1.00 0.00 O ATOM 1167 ND2 ASN A 75 -13.578 -25.177 11.826 1.00 0.00 N ATOM 0 H ASN A 75 -9.456 -23.320 10.185 1.00 0.00 H new ATOM 0 HA ASN A 75 -9.961 -25.968 11.340 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -11.506 -23.830 11.276 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -11.850 -24.350 9.638 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -14.299 -25.791 12.205 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -13.640 -24.169 11.967 1.00 0.00 H new ATOM 1174 N ALA A 76 -10.654 -27.176 9.082 1.00 0.00 N ATOM 1175 CA ALA A 76 -10.479 -28.108 7.977 1.00 0.00 C ATOM 1176 C ALA A 76 -11.019 -27.576 6.647 1.00 0.00 C ATOM 1177 O ALA A 76 -10.725 -28.139 5.590 1.00 0.00 O ATOM 1178 CB ALA A 76 -11.136 -29.435 8.316 1.00 0.00 C ATOM 0 H ALA A 76 -11.374 -27.455 9.748 1.00 0.00 H new ATOM 0 HA ALA A 76 -9.406 -28.243 7.843 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -11.003 -30.129 7.486 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -10.677 -29.849 9.214 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -12.200 -29.280 8.492 1.00 0.00 H new ATOM 1184 N LEU A 77 -11.800 -26.496 6.698 1.00 0.00 N ATOM 1185 CA LEU A 77 -12.479 -25.963 5.515 1.00 0.00 C ATOM 1186 C LEU A 77 -11.499 -25.611 4.391 1.00 0.00 C ATOM 1187 O LEU A 77 -11.867 -25.620 3.218 1.00 0.00 O ATOM 1188 CB LEU A 77 -13.321 -24.732 5.882 1.00 0.00 C ATOM 1189 CG LEU A 77 -12.546 -23.427 6.116 1.00 0.00 C ATOM 1190 CD1 LEU A 77 -13.493 -22.237 6.071 1.00 0.00 C ATOM 1191 CD2 LEU A 77 -11.814 -23.457 7.446 1.00 0.00 C ATOM 0 H LEU A 77 -11.979 -25.969 7.553 1.00 0.00 H new ATOM 0 HA LEU A 77 -13.135 -26.751 5.145 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -14.045 -24.562 5.085 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -13.887 -24.961 6.785 1.00 0.00 H new ATOM 0 HG LEU A 77 -11.807 -23.327 5.321 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -12.931 -21.318 6.238 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -13.977 -22.194 5.095 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -14.251 -22.345 6.847 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -11.274 -22.521 7.585 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -12.534 -23.585 8.255 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -11.108 -24.288 7.454 1.00 0.00 H new ATOM 1203 N GLN A 78 -10.256 -25.310 4.754 1.00 0.00 N ATOM 1204 CA GLN A 78 -9.230 -24.927 3.781 1.00 0.00 C ATOM 1205 C GLN A 78 -9.035 -26.010 2.713 1.00 0.00 C ATOM 1206 O GLN A 78 -8.666 -25.721 1.570 1.00 0.00 O ATOM 1207 CB GLN A 78 -7.904 -24.678 4.503 1.00 0.00 C ATOM 1208 CG GLN A 78 -6.791 -24.190 3.589 1.00 0.00 C ATOM 1209 CD GLN A 78 -5.423 -24.295 4.231 1.00 0.00 C ATOM 1210 OE1 GLN A 78 -4.742 -25.315 4.102 1.00 0.00 O ATOM 1211 NE2 GLN A 78 -5.014 -23.256 4.936 1.00 0.00 N ATOM 0 H GLN A 78 -9.930 -25.323 5.721 1.00 0.00 H new ATOM 0 HA GLN A 78 -9.562 -24.016 3.283 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -8.063 -23.943 5.292 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -7.586 -25.601 4.987 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -6.801 -24.772 2.667 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -6.981 -23.153 3.314 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -5.607 -22.430 5.019 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -4.105 -23.279 5.398 1.00 0.00 H new ATOM 1220 N ARG A 79 -9.310 -27.253 3.088 1.00 0.00 N ATOM 1221 CA ARG A 79 -9.064 -28.399 2.216 1.00 0.00 C ATOM 1222 C ARG A 79 -10.052 -28.463 1.057 1.00 0.00 C ATOM 1223 O ARG A 79 -9.837 -29.190 0.090 1.00 0.00 O ATOM 1224 CB ARG A 79 -9.143 -29.688 3.020 1.00 0.00 C ATOM 1225 CG ARG A 79 -8.134 -29.757 4.153 1.00 0.00 C ATOM 1226 CD ARG A 79 -8.320 -31.016 4.972 1.00 0.00 C ATOM 1227 NE ARG A 79 -9.694 -31.157 5.451 1.00 0.00 N ATOM 1228 CZ ARG A 79 -10.223 -32.312 5.852 1.00 0.00 C ATOM 1229 NH1 ARG A 79 -9.486 -33.419 5.857 1.00 0.00 N ATOM 1230 NH2 ARG A 79 -11.486 -32.361 6.254 1.00 0.00 N ATOM 0 H ARG A 79 -9.706 -27.496 3.996 1.00 0.00 H new ATOM 0 HA ARG A 79 -8.065 -28.278 1.796 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -10.147 -29.789 3.431 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -8.985 -30.534 2.351 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -7.123 -29.730 3.746 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -8.243 -28.883 4.795 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -8.055 -31.884 4.368 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -7.639 -31.000 5.823 1.00 0.00 H new ATOM 0 HE ARG A 79 -10.281 -30.323 5.480 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -8.513 -33.385 5.553 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -9.894 -34.302 6.165 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -12.054 -31.514 6.256 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -11.890 -33.246 6.561 1.00 0.00 H new ATOM 1244 N ALA A 80 -11.129 -27.702 1.160 1.00 0.00 N ATOM 1245 CA ALA A 80 -12.154 -27.667 0.116 1.00 0.00 C ATOM 1246 C ALA A 80 -11.596 -27.125 -1.197 1.00 0.00 C ATOM 1247 O ALA A 80 -12.163 -27.353 -2.262 1.00 0.00 O ATOM 1248 CB ALA A 80 -13.348 -26.837 0.564 1.00 0.00 C ATOM 0 H ALA A 80 -11.322 -27.096 1.957 1.00 0.00 H new ATOM 0 HA ALA A 80 -12.483 -28.692 -0.056 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -14.099 -26.823 -0.226 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -13.778 -27.274 1.465 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -13.024 -25.818 0.774 1.00 0.00 H new ATOM 1254 N ARG A 81 -10.484 -26.406 -1.104 1.00 0.00 N ATOM 1255 CA ARG A 81 -9.854 -25.798 -2.273 1.00 0.00 C ATOM 1256 C ARG A 81 -9.172 -26.848 -3.139 1.00 0.00 C ATOM 1257 O ARG A 81 -8.974 -26.649 -4.337 1.00 0.00 O ATOM 1258 CB ARG A 81 -8.825 -24.767 -1.836 1.00 0.00 C ATOM 1259 CG ARG A 81 -9.389 -23.650 -0.977 1.00 0.00 C ATOM 1260 CD ARG A 81 -8.303 -22.663 -0.594 1.00 0.00 C ATOM 1261 NE ARG A 81 -7.112 -23.335 -0.070 1.00 0.00 N ATOM 1262 CZ ARG A 81 -5.956 -22.721 0.165 1.00 0.00 C ATOM 1263 NH1 ARG A 81 -5.836 -21.420 -0.042 1.00 0.00 N ATOM 1264 NH2 ARG A 81 -4.909 -23.410 0.601 1.00 0.00 N ATOM 0 H ARG A 81 -9.996 -26.228 -0.226 1.00 0.00 H new ATOM 0 HA ARG A 81 -10.636 -25.315 -2.859 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -8.034 -25.272 -1.282 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -8.365 -24.331 -2.723 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -10.181 -23.133 -1.519 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -9.839 -24.069 -0.077 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -8.030 -22.068 -1.466 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -8.689 -21.972 0.155 1.00 0.00 H new ATOM 0 HE ARG A 81 -7.173 -24.334 0.127 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -6.633 -20.882 -0.384 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -4.947 -20.955 0.140 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -4.989 -24.415 0.757 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -4.024 -22.935 0.780 1.00 0.00 H new ATOM 1278 N THR A 82 -8.799 -27.944 -2.509 1.00 0.00 N ATOM 1279 CA THR A 82 -8.180 -29.072 -3.187 1.00 0.00 C ATOM 1280 C THR A 82 -9.105 -29.611 -4.276 1.00 0.00 C ATOM 1281 O THR A 82 -8.905 -29.355 -5.467 1.00 0.00 O ATOM 1282 CB THR A 82 -7.807 -30.188 -2.187 1.00 0.00 C ATOM 1283 OG1 THR A 82 -6.953 -29.653 -1.162 1.00 0.00 O ATOM 1284 CG2 THR A 82 -7.094 -31.335 -2.889 1.00 0.00 C ATOM 0 H THR A 82 -8.917 -28.081 -1.505 1.00 0.00 H new ATOM 0 HA THR A 82 -7.259 -28.722 -3.654 1.00 0.00 H new ATOM 0 HB THR A 82 -8.727 -30.570 -1.744 1.00 0.00 H new ATOM 0 HG1 THR A 82 -6.719 -30.363 -0.528 1.00 0.00 H new ATOM 0 HG21 THR A 82 -6.843 -32.107 -2.162 1.00 0.00 H new ATOM 0 HG22 THR A 82 -7.747 -31.756 -3.654 1.00 0.00 H new ATOM 0 HG23 THR A 82 -6.181 -30.965 -3.355 1.00 0.00 H new ATOM 1292 N ARG A 83 -10.085 -30.390 -3.854 1.00 0.00 N ATOM 1293 CA ARG A 83 -11.112 -30.916 -4.748 1.00 0.00 C ATOM 1294 C ARG A 83 -11.738 -29.796 -5.582 1.00 0.00 C ATOM 1295 O ARG A 83 -12.195 -28.785 -5.048 1.00 0.00 O ATOM 1296 CB ARG A 83 -12.186 -31.626 -3.923 1.00 0.00 C ATOM 1297 CG ARG A 83 -13.430 -32.017 -4.704 1.00 0.00 C ATOM 1298 CD ARG A 83 -14.409 -32.770 -3.818 1.00 0.00 C ATOM 1299 NE ARG A 83 -15.773 -32.730 -4.342 1.00 0.00 N ATOM 1300 CZ ARG A 83 -16.714 -33.621 -4.036 1.00 0.00 C ATOM 1301 NH1 ARG A 83 -16.424 -34.668 -3.269 1.00 0.00 N ATOM 1302 NH2 ARG A 83 -17.952 -33.467 -4.492 1.00 0.00 N ATOM 0 H ARG A 83 -10.195 -30.678 -2.882 1.00 0.00 H new ATOM 0 HA ARG A 83 -10.651 -31.626 -5.434 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -11.753 -32.524 -3.483 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -12.480 -30.977 -3.098 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -13.909 -31.124 -5.105 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -13.150 -32.638 -5.555 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -14.088 -33.807 -3.725 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -14.394 -32.341 -2.816 1.00 0.00 H new ATOM 0 HE ARG A 83 -16.019 -31.974 -4.981 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -15.477 -34.792 -2.912 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -17.149 -35.347 -3.038 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -18.184 -32.665 -5.078 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -18.671 -34.151 -4.256 1.00 0.00 H new ATOM 1316 N HIS A 84 -11.750 -29.991 -6.890 1.00 0.00 N ATOM 1317 CA HIS A 84 -12.260 -28.988 -7.823 1.00 0.00 C ATOM 1318 C HIS A 84 -13.466 -29.523 -8.588 1.00 0.00 C ATOM 1319 O HIS A 84 -13.662 -30.737 -8.675 1.00 0.00 O ATOM 1320 CB HIS A 84 -11.167 -28.574 -8.816 1.00 0.00 C ATOM 1321 CG HIS A 84 -10.301 -27.445 -8.346 1.00 0.00 C ATOM 1322 ND1 HIS A 84 -9.235 -27.612 -7.492 1.00 0.00 N ATOM 1323 CD2 HIS A 84 -10.341 -26.125 -8.638 1.00 0.00 C ATOM 1324 CE1 HIS A 84 -8.657 -26.445 -7.280 1.00 0.00 C ATOM 1325 NE2 HIS A 84 -9.308 -25.527 -7.966 1.00 0.00 N ATOM 0 H HIS A 84 -11.410 -30.842 -7.338 1.00 0.00 H new ATOM 0 HA HIS A 84 -12.567 -28.118 -7.243 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -10.536 -29.438 -9.024 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -11.637 -28.288 -9.757 1.00 0.00 H new ATOM 0 HD1 HIS A 84 -8.938 -28.499 -7.086 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -11.055 -25.633 -9.282 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -7.796 -26.271 -6.651 1.00 0.00 H new ATOM 1334 N PRO A 85 -14.301 -28.622 -9.142 1.00 0.00 N ATOM 1335 CA PRO A 85 -15.439 -29.003 -9.983 1.00 0.00 C ATOM 1336 C PRO A 85 -15.000 -29.442 -11.383 1.00 0.00 C ATOM 1337 O PRO A 85 -13.830 -29.773 -11.606 1.00 0.00 O ATOM 1338 CB PRO A 85 -16.279 -27.717 -10.067 1.00 0.00 C ATOM 1339 CG PRO A 85 -15.669 -26.767 -9.091 1.00 0.00 C ATOM 1340 CD PRO A 85 -14.231 -27.167 -8.968 1.00 0.00 C ATOM 0 HA PRO A 85 -15.982 -29.852 -9.569 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -16.263 -27.305 -11.076 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -17.322 -27.915 -9.820 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -15.759 -25.738 -9.440 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -16.173 -26.822 -8.126 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -13.610 -26.695 -9.729 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -13.813 -26.892 -8.000 1.00 0.00 H new ATOM 1348 N ALA A 86 -15.938 -29.430 -12.323 1.00 0.00 N ATOM 1349 CA ALA A 86 -15.667 -29.851 -13.692 1.00 0.00 C ATOM 1350 C ALA A 86 -14.768 -28.850 -14.418 1.00 0.00 C ATOM 1351 O ALA A 86 -14.489 -27.756 -13.912 1.00 0.00 O ATOM 1352 CB ALA A 86 -16.973 -30.041 -14.447 1.00 0.00 C ATOM 0 H ALA A 86 -16.899 -29.131 -12.160 1.00 0.00 H new ATOM 0 HA ALA A 86 -15.136 -30.802 -13.654 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -16.760 -30.355 -15.469 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -17.573 -30.803 -13.950 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -17.524 -29.100 -14.464 1.00 0.00 H new ATOM 1358 N GLU A 87 -14.341 -29.221 -15.622 1.00 0.00 N ATOM 1359 CA GLU A 87 -13.391 -28.420 -16.387 1.00 0.00 C ATOM 1360 C GLU A 87 -14.043 -27.146 -16.921 1.00 0.00 C ATOM 1361 O GLU A 87 -13.360 -26.149 -17.173 1.00 0.00 O ATOM 1362 CB GLU A 87 -12.783 -29.232 -17.545 1.00 0.00 C ATOM 1363 CG GLU A 87 -13.795 -29.747 -18.565 1.00 0.00 C ATOM 1364 CD GLU A 87 -14.599 -30.931 -18.065 1.00 0.00 C ATOM 1365 OE1 GLU A 87 -14.143 -32.079 -18.226 1.00 0.00 O ATOM 1366 OE2 GLU A 87 -15.695 -30.717 -17.504 1.00 0.00 O ATOM 0 H GLU A 87 -14.640 -30.076 -16.091 1.00 0.00 H new ATOM 0 HA GLU A 87 -12.588 -28.135 -15.708 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -12.052 -28.610 -18.062 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -12.242 -30.082 -17.129 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -14.477 -28.939 -18.830 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -13.269 -30.032 -19.476 1.00 0.00 H new ATOM 1373 N SER A 88 -15.363 -27.174 -17.073 1.00 0.00 N ATOM 1374 CA SER A 88 -16.100 -26.011 -17.545 1.00 0.00 C ATOM 1375 C SER A 88 -16.006 -24.864 -16.541 1.00 0.00 C ATOM 1376 O SER A 88 -16.092 -23.698 -16.915 1.00 0.00 O ATOM 1377 CB SER A 88 -17.562 -26.378 -17.793 1.00 0.00 C ATOM 1378 OG SER A 88 -17.666 -27.485 -18.674 1.00 0.00 O ATOM 0 H SER A 88 -15.943 -27.990 -16.876 1.00 0.00 H new ATOM 0 HA SER A 88 -15.654 -25.681 -18.483 1.00 0.00 H new ATOM 0 HB2 SER A 88 -18.047 -26.616 -16.846 1.00 0.00 H new ATOM 0 HB3 SER A 88 -18.089 -25.522 -18.215 1.00 0.00 H new ATOM 0 HG SER A 88 -18.611 -27.702 -18.816 1.00 0.00 H new ATOM 1384 N CYS A 89 -15.806 -25.195 -15.268 1.00 0.00 N ATOM 1385 CA CYS A 89 -15.697 -24.186 -14.224 1.00 0.00 C ATOM 1386 C CYS A 89 -14.429 -23.359 -14.413 1.00 0.00 C ATOM 1387 O CYS A 89 -14.411 -22.156 -14.160 1.00 0.00 O ATOM 1388 CB CYS A 89 -15.704 -24.850 -12.844 1.00 0.00 C ATOM 1389 SG CYS A 89 -15.605 -23.702 -11.450 1.00 0.00 S ATOM 0 H CYS A 89 -15.716 -26.156 -14.937 1.00 0.00 H new ATOM 0 HA CYS A 89 -16.556 -23.518 -14.293 1.00 0.00 H new ATOM 0 HB2 CYS A 89 -16.614 -25.442 -12.746 1.00 0.00 H new ATOM 0 HB3 CYS A 89 -14.865 -25.544 -12.786 1.00 0.00 H new ATOM 0 HG CYS A 89 -15.096 -22.575 -11.851 1.00 0.00 H new ATOM 1395 N LEU A 90 -13.389 -24.014 -14.906 1.00 0.00 N ATOM 1396 CA LEU A 90 -12.089 -23.375 -15.096 1.00 0.00 C ATOM 1397 C LEU A 90 -12.098 -22.510 -16.350 1.00 0.00 C ATOM 1398 O LEU A 90 -11.287 -21.596 -16.500 1.00 0.00 O ATOM 1399 CB LEU A 90 -10.997 -24.437 -15.219 1.00 0.00 C ATOM 1400 CG LEU A 90 -11.118 -25.600 -14.236 1.00 0.00 C ATOM 1401 CD1 LEU A 90 -10.052 -26.644 -14.520 1.00 0.00 C ATOM 1402 CD2 LEU A 90 -11.015 -25.108 -12.798 1.00 0.00 C ATOM 0 H LEU A 90 -13.418 -24.995 -15.185 1.00 0.00 H new ATOM 0 HA LEU A 90 -11.886 -22.744 -14.231 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -11.010 -24.835 -16.234 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -10.028 -23.959 -15.076 1.00 0.00 H new ATOM 0 HG LEU A 90 -12.098 -26.058 -14.367 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -10.151 -27.467 -13.812 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -10.174 -27.022 -15.535 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -9.065 -26.193 -14.417 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -11.104 -25.954 -12.117 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -10.051 -24.621 -12.648 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -11.816 -24.396 -12.599 1.00 0.00 H new ATOM 1414 N GLU A 91 -13.017 -22.824 -17.251 1.00 0.00 N ATOM 1415 CA GLU A 91 -13.149 -22.105 -18.514 1.00 0.00 C ATOM 1416 C GLU A 91 -13.573 -20.654 -18.292 1.00 0.00 C ATOM 1417 O GLU A 91 -13.160 -19.754 -19.032 1.00 0.00 O ATOM 1418 CB GLU A 91 -14.175 -22.803 -19.409 1.00 0.00 C ATOM 1419 CG GLU A 91 -14.415 -22.087 -20.726 1.00 0.00 C ATOM 1420 CD GLU A 91 -15.614 -22.625 -21.478 1.00 0.00 C ATOM 1421 OE1 GLU A 91 -16.754 -22.226 -21.150 1.00 0.00 O ATOM 1422 OE2 GLU A 91 -15.424 -23.448 -22.398 1.00 0.00 O ATOM 0 H GLU A 91 -13.690 -23.581 -17.130 1.00 0.00 H new ATOM 0 HA GLU A 91 -12.173 -22.106 -18.999 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -13.836 -23.819 -19.613 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -15.120 -22.884 -18.871 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -14.559 -21.024 -20.535 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -13.528 -22.181 -21.352 1.00 0.00 H new ATOM 1429 N HIS A 92 -14.382 -20.431 -17.263 1.00 0.00 N ATOM 1430 CA HIS A 92 -14.983 -19.121 -17.036 1.00 0.00 C ATOM 1431 C HIS A 92 -13.931 -18.070 -16.714 1.00 0.00 C ATOM 1432 O HIS A 92 -13.351 -18.049 -15.625 1.00 0.00 O ATOM 1433 CB HIS A 92 -16.041 -19.181 -15.929 1.00 0.00 C ATOM 1434 CG HIS A 92 -17.251 -19.971 -16.313 1.00 0.00 C ATOM 1435 ND1 HIS A 92 -18.297 -19.446 -17.037 1.00 0.00 N ATOM 1436 CD2 HIS A 92 -17.561 -21.267 -16.099 1.00 0.00 C ATOM 1437 CE1 HIS A 92 -19.194 -20.387 -17.251 1.00 0.00 C ATOM 1438 NE2 HIS A 92 -18.774 -21.510 -16.697 1.00 0.00 N ATOM 0 H HIS A 92 -14.637 -21.138 -16.574 1.00 0.00 H new ATOM 0 HA HIS A 92 -15.475 -18.828 -17.963 1.00 0.00 H new ATOM 0 HB2 HIS A 92 -15.598 -19.619 -15.035 1.00 0.00 H new ATOM 0 HB3 HIS A 92 -16.344 -18.167 -15.670 1.00 0.00 H new ATOM 0 HD2 HIS A 92 -16.963 -21.984 -15.556 1.00 0.00 H new ATOM 0 HE1 HIS A 92 -20.121 -20.261 -17.791 1.00 0.00 H new ATOM 0 HE2 HIS A 92 -19.265 -22.404 -16.711 1.00 0.00 H new ATOM 1447 N HIS A 93 -13.695 -17.201 -17.683 1.00 0.00 N ATOM 1448 CA HIS A 93 -12.725 -16.125 -17.545 1.00 0.00 C ATOM 1449 C HIS A 93 -13.430 -14.781 -17.647 1.00 0.00 C ATOM 1450 O HIS A 93 -14.275 -14.583 -18.523 1.00 0.00 O ATOM 1451 CB HIS A 93 -11.607 -16.243 -18.599 1.00 0.00 C ATOM 1452 CG HIS A 93 -12.069 -16.224 -20.035 1.00 0.00 C ATOM 1453 ND1 HIS A 93 -13.102 -16.852 -20.647 1.00 0.00 N flip ATOM 1454 CD2 HIS A 93 -11.416 -15.523 -21.027 1.00 0.00 C flip ATOM 1455 CE1 HIS A 93 -13.053 -16.525 -21.979 1.00 0.00 C flip ATOM 1456 NE2 HIS A 93 -12.028 -15.720 -22.181 1.00 0.00 N flip ATOM 0 H HIS A 93 -14.169 -17.221 -18.586 1.00 0.00 H new ATOM 0 HA HIS A 93 -12.256 -16.203 -16.564 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -10.903 -15.424 -18.451 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -11.061 -17.170 -18.423 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -10.540 -14.908 -20.883 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -13.741 -16.870 -22.737 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -11.754 -15.317 -23.077 1.00 0.00 H new ATOM 1465 N HIS A 94 -13.101 -13.877 -16.735 1.00 0.00 N ATOM 1466 CA HIS A 94 -13.754 -12.576 -16.678 1.00 0.00 C ATOM 1467 C HIS A 94 -13.434 -11.728 -17.900 1.00 0.00 C ATOM 1468 O HIS A 94 -12.281 -11.617 -18.315 1.00 0.00 O ATOM 1469 CB HIS A 94 -13.363 -11.821 -15.403 1.00 0.00 C ATOM 1470 CG HIS A 94 -14.092 -12.294 -14.182 1.00 0.00 C ATOM 1471 ND1 HIS A 94 -13.458 -12.795 -13.063 1.00 0.00 N ATOM 1472 CD2 HIS A 94 -15.415 -12.321 -13.902 1.00 0.00 C ATOM 1473 CE1 HIS A 94 -14.360 -13.108 -12.154 1.00 0.00 C ATOM 1474 NE2 HIS A 94 -15.555 -12.830 -12.637 1.00 0.00 N ATOM 0 H HIS A 94 -12.385 -14.021 -16.023 1.00 0.00 H new ATOM 0 HA HIS A 94 -14.828 -12.761 -16.666 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -12.291 -11.929 -15.241 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -13.559 -10.758 -15.545 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -16.214 -12.001 -14.555 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -14.155 -13.522 -11.178 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -16.439 -12.971 -12.149 1.00 0.00 H new ATOM 1483 N HIS A 95 -14.471 -11.135 -18.473 1.00 0.00 N ATOM 1484 CA HIS A 95 -14.322 -10.248 -19.618 1.00 0.00 C ATOM 1485 C HIS A 95 -14.153 -8.814 -19.125 1.00 0.00 C ATOM 1486 O HIS A 95 -13.928 -7.895 -19.913 1.00 0.00 O ATOM 1487 CB HIS A 95 -15.560 -10.370 -20.527 1.00 0.00 C ATOM 1488 CG HIS A 95 -15.540 -9.492 -21.745 1.00 0.00 C ATOM 1489 ND1 HIS A 95 -16.341 -8.380 -21.878 1.00 0.00 N ATOM 1490 CD2 HIS A 95 -14.831 -9.580 -22.895 1.00 0.00 C ATOM 1491 CE1 HIS A 95 -16.128 -7.823 -23.053 1.00 0.00 C ATOM 1492 NE2 HIS A 95 -15.215 -8.529 -23.692 1.00 0.00 N ATOM 0 H HIS A 95 -15.434 -11.254 -18.160 1.00 0.00 H new ATOM 0 HA HIS A 95 -13.440 -10.527 -20.194 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -15.657 -11.408 -20.847 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -16.448 -10.133 -19.941 1.00 0.00 H new ATOM 0 HD1 HIS A 95 -16.998 -8.040 -21.176 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -14.100 -10.336 -23.140 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -16.618 -6.937 -23.430 1.00 0.00 H new ATOM 1501 N HIS A 96 -14.230 -8.653 -17.803 1.00 0.00 N ATOM 1502 CA HIS A 96 -14.264 -7.339 -17.174 1.00 0.00 C ATOM 1503 C HIS A 96 -15.477 -6.594 -17.712 1.00 0.00 C ATOM 1504 O HIS A 96 -15.354 -5.662 -18.512 1.00 0.00 O ATOM 1505 CB HIS A 96 -12.964 -6.563 -17.426 1.00 0.00 C ATOM 1506 CG HIS A 96 -12.784 -5.371 -16.538 1.00 0.00 C ATOM 1507 ND1 HIS A 96 -12.728 -4.078 -17.010 1.00 0.00 N ATOM 1508 CD2 HIS A 96 -12.619 -5.285 -15.196 1.00 0.00 C ATOM 1509 CE1 HIS A 96 -12.534 -3.252 -15.999 1.00 0.00 C ATOM 1510 NE2 HIS A 96 -12.464 -3.958 -14.888 1.00 0.00 N ATOM 0 H HIS A 96 -14.270 -9.430 -17.143 1.00 0.00 H new ATOM 0 HA HIS A 96 -14.347 -7.445 -16.092 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -12.118 -7.237 -17.288 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -12.944 -6.235 -18.465 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -12.611 -6.109 -14.498 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -12.447 -2.178 -16.070 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -12.318 -3.579 -13.952 1.00 0.00 H new ATOM 1519 N HIS A 97 -16.648 -7.052 -17.261 1.00 0.00 N ATOM 1520 CA HIS A 97 -17.933 -6.714 -17.869 1.00 0.00 C ATOM 1521 C HIS A 97 -18.024 -7.377 -19.241 1.00 0.00 C ATOM 1522 O HIS A 97 -17.668 -6.740 -20.249 1.00 0.00 O ATOM 1523 CB HIS A 97 -18.159 -5.191 -17.958 1.00 0.00 C ATOM 1524 CG HIS A 97 -19.421 -4.805 -18.682 1.00 0.00 C ATOM 1525 ND1 HIS A 97 -20.675 -4.868 -18.108 1.00 0.00 N ATOM 1526 CD2 HIS A 97 -19.616 -4.366 -19.949 1.00 0.00 C ATOM 1527 CE1 HIS A 97 -21.582 -4.489 -18.993 1.00 0.00 C ATOM 1528 NE2 HIS A 97 -20.963 -4.181 -20.114 1.00 0.00 N ATOM 1529 OXT HIS A 97 -18.407 -8.561 -19.296 1.00 0.00 O ATOM 0 H HIS A 97 -16.729 -7.673 -16.456 1.00 0.00 H new ATOM 0 HA HIS A 97 -18.729 -7.095 -17.230 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -18.189 -4.778 -16.950 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -17.307 -4.736 -18.464 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -18.851 -4.194 -20.691 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -22.648 -4.440 -18.825 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -21.415 -3.856 -20.969 1.00 0.00 H new TER 1538 HIS A 97