USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1166 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 15 HIS : +bothHN:sc= 0.724 K(o=1.1,f=-8!) USER MOD Set 1.2: A 18 GLN : amide:sc= 0.421 K(o=1.1,f=-1.2) USER MOD Set 2.1: A 9 MET CE :methyl -141:sc= -0.325 (180deg=-2.13) USER MOD Set 2.2: A 118 CYS SG : rot 34:sc= 0.00368 USER MOD Set 3.1: A 7 LYS NZ :NH3+ -132:sc= 1.15 (180deg=1.02) USER MOD Set 3.2: A 8 GLN : amide:sc= -4.26! C(o=-3.1!,f=-7.2!) USER MOD Single : A 1 MET CE :methyl 180:sc= -0.184 (180deg=-0.184) USER MOD Single : A 1 MET N :NH3+ -178:sc= 1.53 (180deg=1.49) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.0195 USER MOD Single : A 5 THR OG1 : rot 180:sc= -2.67! USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 MET CE :methyl -174:sc= -1.67 (180deg=-1.73) USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 25 CYS SG : rot 180:sc= -0.884 USER MOD Single : A 43 TYR OH : rot 15:sc= -0.576 USER MOD Single : A 46 ASN : amide:sc= -0.278 X(o=-0.28,f=-0.043) USER MOD Single : A 47 ASN : amide:sc= 1.42 K(o=1.4,f=-9.6!) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 SER OG : rot 113:sc= 0.0567 USER MOD Single : A 54 HIS : no HD1:sc= 0.743 K(o=0.74,f=-5.3!) USER MOD Single : A 56 SER OG : rot 99:sc= 1.3 USER MOD Single : A 57 MET CE :methyl -111:sc= -1.74 (180deg=-1.91) USER MOD Single : A 62 GLN : amide:sc= -0.0285 K(o=-0.028,f=-1.3) USER MOD Single : A 64 THR OG1 : rot 70:sc= 1.34 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl -161:sc= -1.86 (180deg=-2.66!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= -0.0109 X(o=-0.011,f=0) USER MOD Single : A 76 MET CE :methyl 162:sc= -0.0977 (180deg=-0.572) USER MOD Single : A 79 ASN : amide:sc= -0.597 K(o=-0.6,f=-3.7!) USER MOD Single : A 81 HIS : no HD1:sc= 0.924 K(o=0.92,f=-5.2!) USER MOD Single : A 82 SER OG : rot 160:sc= -0.17 USER MOD Single : A 83 HIS : +bothHN:sc= 0.0982 K(o=0.098,f=-3.3!) USER MOD Single : A 86 THR OG1 : rot 180:sc= -1.52! USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 140:sc= 0.0977 (180deg=0) USER MOD Single : A 102 SER OG : rot -32:sc= 0.449 USER MOD Single : A 104 SER OG : rot 81:sc= 1.52 USER MOD Single : A 105 TYR OH : rot -1:sc= 1.18 USER MOD Single : A 109 SER OG : rot 69:sc= 0.0445 USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 168:sc= -0.0332 (180deg=-0.224) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc=-0.00598 (180deg=-0.00598) USER MOD Single : A 120 SER OG : rot 24:sc= 0.237 USER MOD Single : A 124 LYS NZ :NH3+ 150:sc= 1.28 (180deg=1.24) USER MOD Single : A 125 LYS NZ :NH3+ 165:sc= -0.0211 (180deg=-0.211) USER MOD Single : A 136 LYS NZ :NH3+ -175:sc= 1.23 (180deg=1.16) USER MOD Single : A 141 HIS : no HE2:sc= -0.638! C(o=-0.64!,f=-6.2!) USER MOD Single : A 142 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 143 HIS : no HD1:sc= -0.146 X(o=-0.15,f=-0.37) USER MOD Single : A 144 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 145 HIS : no HE2:sc= 0.189 K(o=0.19,f=-1.8!) USER MOD Single : A 146 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.527 -2.457 5.462 1.00 0.00 N ATOM 2 CA MET A 1 -13.058 -2.797 4.095 1.00 0.00 C ATOM 3 C MET A 1 -12.108 -1.720 3.584 1.00 0.00 C ATOM 4 O MET A 1 -11.927 -0.690 4.236 1.00 0.00 O ATOM 5 CB MET A 1 -14.247 -2.941 3.138 1.00 0.00 C ATOM 6 CG MET A 1 -14.966 -1.633 2.848 1.00 0.00 C ATOM 7 SD MET A 1 -16.433 -1.856 1.822 1.00 0.00 S ATOM 8 CE MET A 1 -16.883 -0.146 1.520 1.00 0.00 C ATOM 0 H1 MET A 1 -14.147 -3.214 5.815 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.708 -2.357 6.095 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.055 -1.561 5.435 1.00 0.00 H new ATOM 0 HA MET A 1 -12.529 -3.749 4.139 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.895 -3.367 2.198 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.959 -3.649 3.562 1.00 0.00 H new ATOM 0 HG2 MET A 1 -15.254 -1.165 3.789 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.280 -0.949 2.349 1.00 0.00 H new ATOM 0 HE1 MET A 1 -17.776 -0.110 0.896 1.00 0.00 H new ATOM 0 HE2 MET A 1 -17.083 0.351 2.469 1.00 0.00 H new ATOM 0 HE3 MET A 1 -16.064 0.361 1.010 1.00 0.00 H new ATOM 20 N ILE A 2 -11.493 -1.951 2.430 1.00 0.00 N ATOM 21 CA ILE A 2 -10.577 -0.975 1.856 1.00 0.00 C ATOM 22 C ILE A 2 -11.077 -0.503 0.492 1.00 0.00 C ATOM 23 O ILE A 2 -11.517 -1.304 -0.330 1.00 0.00 O ATOM 24 CB ILE A 2 -9.137 -1.535 1.732 1.00 0.00 C ATOM 25 CG1 ILE A 2 -8.193 -0.473 1.162 1.00 0.00 C ATOM 26 CG2 ILE A 2 -9.112 -2.790 0.870 1.00 0.00 C ATOM 27 CD1 ILE A 2 -6.753 -0.932 1.055 1.00 0.00 C ATOM 0 H ILE A 2 -11.611 -2.800 1.877 1.00 0.00 H new ATOM 0 HA ILE A 2 -10.545 -0.125 2.537 1.00 0.00 H new ATOM 0 HB ILE A 2 -8.793 -1.804 2.731 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -8.546 -0.179 0.173 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -8.236 0.415 1.793 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -8.090 -3.162 0.799 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -9.746 -3.554 1.321 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -9.482 -2.554 -0.128 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -6.144 -0.127 0.643 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -6.382 -1.198 2.045 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -6.696 -1.801 0.400 1.00 0.00 H new ATOM 39 N THR A 3 -11.031 0.799 0.272 1.00 0.00 N ATOM 40 CA THR A 3 -11.484 1.379 -0.979 1.00 0.00 C ATOM 41 C THR A 3 -10.385 2.236 -1.604 1.00 0.00 C ATOM 42 O THR A 3 -9.835 3.123 -0.949 1.00 0.00 O ATOM 43 CB THR A 3 -12.742 2.240 -0.753 1.00 0.00 C ATOM 44 OG1 THR A 3 -13.722 1.487 -0.025 1.00 0.00 O ATOM 45 CG2 THR A 3 -13.335 2.700 -2.078 1.00 0.00 C ATOM 0 H THR A 3 -10.682 1.478 0.948 1.00 0.00 H new ATOM 0 HA THR A 3 -11.728 0.562 -1.659 1.00 0.00 H new ATOM 0 HB THR A 3 -12.453 3.121 -0.179 1.00 0.00 H new ATOM 0 HG1 THR A 3 -14.519 2.039 0.118 1.00 0.00 H new ATOM 0 HG21 THR A 3 -14.221 3.306 -1.889 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.599 3.294 -2.620 1.00 0.00 H new ATOM 0 HG23 THR A 3 -13.610 1.830 -2.675 1.00 0.00 H new ATOM 53 N LEU A 4 -10.054 1.959 -2.857 1.00 0.00 N ATOM 54 CA LEU A 4 -9.079 2.757 -3.581 1.00 0.00 C ATOM 55 C LEU A 4 -9.540 2.971 -5.014 1.00 0.00 C ATOM 56 O LEU A 4 -10.457 2.301 -5.487 1.00 0.00 O ATOM 57 CB LEU A 4 -7.683 2.120 -3.523 1.00 0.00 C ATOM 58 CG LEU A 4 -7.599 0.627 -3.856 1.00 0.00 C ATOM 59 CD1 LEU A 4 -7.477 0.407 -5.356 1.00 0.00 C ATOM 60 CD2 LEU A 4 -6.425 -0.009 -3.130 1.00 0.00 C ATOM 0 H LEU A 4 -10.448 1.186 -3.393 1.00 0.00 H new ATOM 0 HA LEU A 4 -9.002 3.732 -3.100 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.033 2.660 -4.211 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -7.281 2.269 -2.521 1.00 0.00 H new ATOM 0 HG LEU A 4 -8.521 0.152 -3.520 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -7.419 -0.662 -5.564 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -8.349 0.827 -5.857 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -6.576 0.897 -5.724 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -6.377 -1.070 -3.375 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.500 0.477 -3.439 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -6.555 0.109 -2.054 1.00 0.00 H new ATOM 72 N THR A 5 -8.925 3.916 -5.693 1.00 0.00 N ATOM 73 CA THR A 5 -9.363 4.288 -7.025 1.00 0.00 C ATOM 74 C THR A 5 -8.491 3.638 -8.094 1.00 0.00 C ATOM 75 O THR A 5 -7.471 3.013 -7.785 1.00 0.00 O ATOM 76 CB THR A 5 -9.333 5.816 -7.199 1.00 0.00 C ATOM 77 OG1 THR A 5 -7.987 6.298 -7.098 1.00 0.00 O ATOM 78 CG2 THR A 5 -10.195 6.488 -6.144 1.00 0.00 C ATOM 0 H THR A 5 -8.122 4.441 -5.347 1.00 0.00 H new ATOM 0 HA THR A 5 -10.386 3.932 -7.144 1.00 0.00 H new ATOM 0 HB THR A 5 -9.729 6.057 -8.186 1.00 0.00 H new ATOM 0 HG1 THR A 5 -7.979 7.271 -7.212 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.162 7.569 -6.282 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.224 6.141 -6.240 1.00 0.00 H new ATOM 0 HG23 THR A 5 -9.818 6.237 -5.152 1.00 0.00 H new ATOM 86 N LYS A 6 -8.899 3.794 -9.349 1.00 0.00 N ATOM 87 CA LYS A 6 -8.136 3.283 -10.480 1.00 0.00 C ATOM 88 C LYS A 6 -6.737 3.880 -10.494 1.00 0.00 C ATOM 89 O LYS A 6 -5.751 3.185 -10.730 1.00 0.00 O ATOM 90 CB LYS A 6 -8.841 3.635 -11.786 1.00 0.00 C ATOM 91 CG LYS A 6 -10.231 3.034 -11.923 1.00 0.00 C ATOM 92 CD LYS A 6 -10.860 3.411 -13.251 1.00 0.00 C ATOM 93 CE LYS A 6 -12.283 2.890 -13.369 1.00 0.00 C ATOM 94 NZ LYS A 6 -12.874 3.213 -14.694 1.00 0.00 N ATOM 0 H LYS A 6 -9.761 4.274 -9.609 1.00 0.00 H new ATOM 0 HA LYS A 6 -8.062 2.200 -10.381 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -8.916 4.720 -11.865 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.227 3.297 -12.621 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -10.171 1.949 -11.840 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -10.863 3.382 -11.106 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -10.860 4.496 -13.358 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -10.257 3.010 -14.066 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -12.290 1.810 -13.220 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -12.897 3.324 -12.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -13.845 2.843 -14.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -12.890 4.245 -14.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -12.301 2.778 -15.445 1.00 0.00 H new ATOM 108 N LYS A 7 -6.670 5.178 -10.227 1.00 0.00 N ATOM 109 CA LYS A 7 -5.416 5.911 -10.207 1.00 0.00 C ATOM 110 C LYS A 7 -4.458 5.333 -9.165 1.00 0.00 C ATOM 111 O LYS A 7 -3.255 5.258 -9.405 1.00 0.00 O ATOM 112 CB LYS A 7 -5.712 7.387 -9.925 1.00 0.00 C ATOM 113 CG LYS A 7 -4.606 8.345 -10.340 1.00 0.00 C ATOM 114 CD LYS A 7 -3.655 8.660 -9.197 1.00 0.00 C ATOM 115 CE LYS A 7 -4.351 9.425 -8.081 1.00 0.00 C ATOM 116 NZ LYS A 7 -3.446 9.668 -6.927 1.00 0.00 N ATOM 0 H LYS A 7 -7.487 5.751 -10.018 1.00 0.00 H new ATOM 0 HA LYS A 7 -4.927 5.819 -11.177 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -6.629 7.666 -10.443 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -5.899 7.509 -8.858 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -4.045 7.911 -11.167 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -5.049 9.271 -10.706 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -3.243 7.732 -8.800 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -2.816 9.247 -9.572 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -4.713 10.379 -8.466 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -5.224 8.864 -7.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -3.931 9.408 -6.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -2.586 9.092 -7.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -3.187 10.675 -6.895 1.00 0.00 H new ATOM 130 N GLN A 8 -4.997 4.913 -8.018 1.00 0.00 N ATOM 131 CA GLN A 8 -4.184 4.296 -6.972 1.00 0.00 C ATOM 132 C GLN A 8 -3.617 2.971 -7.458 1.00 0.00 C ATOM 133 O GLN A 8 -2.445 2.664 -7.234 1.00 0.00 O ATOM 134 CB GLN A 8 -5.015 4.055 -5.709 1.00 0.00 C ATOM 135 CG GLN A 8 -5.799 5.263 -5.230 1.00 0.00 C ATOM 136 CD GLN A 8 -4.960 6.517 -5.127 1.00 0.00 C ATOM 137 OE1 GLN A 8 -4.903 7.315 -6.059 1.00 0.00 O ATOM 138 NE2 GLN A 8 -4.293 6.692 -4.004 1.00 0.00 N ATOM 0 H GLN A 8 -5.989 4.989 -7.792 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.367 4.978 -6.736 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.711 3.238 -5.898 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -4.350 3.729 -4.909 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -6.628 5.444 -5.914 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -6.233 5.043 -4.254 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -4.368 6.005 -3.254 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -3.702 7.515 -3.885 1.00 0.00 H new ATOM 147 N MET A 9 -4.458 2.184 -8.124 1.00 0.00 N ATOM 148 CA MET A 9 -4.025 0.919 -8.704 1.00 0.00 C ATOM 149 C MET A 9 -2.898 1.165 -9.702 1.00 0.00 C ATOM 150 O MET A 9 -1.871 0.491 -9.671 1.00 0.00 O ATOM 151 CB MET A 9 -5.207 0.224 -9.387 1.00 0.00 C ATOM 152 CG MET A 9 -4.880 -1.145 -9.960 1.00 0.00 C ATOM 153 SD MET A 9 -6.323 -1.942 -10.693 1.00 0.00 S ATOM 154 CE MET A 9 -7.415 -2.042 -9.272 1.00 0.00 C ATOM 0 H MET A 9 -5.443 2.401 -8.275 1.00 0.00 H new ATOM 0 HA MET A 9 -3.653 0.270 -7.912 1.00 0.00 H new ATOM 0 HB2 MET A 9 -6.018 0.119 -8.666 1.00 0.00 H new ATOM 0 HB3 MET A 9 -5.575 0.863 -10.190 1.00 0.00 H new ATOM 0 HG2 MET A 9 -4.101 -1.044 -10.715 1.00 0.00 H new ATOM 0 HG3 MET A 9 -4.478 -1.780 -9.171 1.00 0.00 H new ATOM 0 HE1 MET A 9 -7.948 -2.993 -9.289 1.00 0.00 H new ATOM 0 HE2 MET A 9 -6.828 -1.971 -8.356 1.00 0.00 H new ATOM 0 HE3 MET A 9 -8.133 -1.223 -9.307 1.00 0.00 H new ATOM 164 N GLU A 10 -3.092 2.162 -10.556 1.00 0.00 N ATOM 165 CA GLU A 10 -2.103 2.557 -11.538 1.00 0.00 C ATOM 166 C GLU A 10 -0.818 3.053 -10.871 1.00 0.00 C ATOM 167 O GLU A 10 0.278 2.852 -11.395 1.00 0.00 O ATOM 168 CB GLU A 10 -2.708 3.646 -12.418 1.00 0.00 C ATOM 169 CG GLU A 10 -3.669 3.123 -13.473 1.00 0.00 C ATOM 170 CD GLU A 10 -2.997 2.192 -14.465 1.00 0.00 C ATOM 171 OE1 GLU A 10 -1.924 2.558 -14.996 1.00 0.00 O ATOM 172 OE2 GLU A 10 -3.550 1.106 -14.738 1.00 0.00 O ATOM 0 H GLU A 10 -3.946 2.719 -10.583 1.00 0.00 H new ATOM 0 HA GLU A 10 -1.832 1.693 -12.144 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.233 4.361 -11.785 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -1.902 4.189 -12.912 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.488 2.596 -12.984 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -4.107 3.965 -14.010 1.00 0.00 H new ATOM 179 N GLU A 11 -0.959 3.707 -9.724 1.00 0.00 N ATOM 180 CA GLU A 11 0.184 4.180 -8.957 1.00 0.00 C ATOM 181 C GLU A 11 0.993 3.016 -8.402 1.00 0.00 C ATOM 182 O GLU A 11 2.223 2.995 -8.497 1.00 0.00 O ATOM 183 CB GLU A 11 -0.294 5.086 -7.825 1.00 0.00 C ATOM 184 CG GLU A 11 -0.496 6.532 -8.246 1.00 0.00 C ATOM 185 CD GLU A 11 -0.721 7.458 -7.072 1.00 0.00 C ATOM 186 OE1 GLU A 11 -1.879 7.601 -6.630 1.00 0.00 O ATOM 187 OE2 GLU A 11 0.254 8.061 -6.593 1.00 0.00 O ATOM 0 H GLU A 11 -1.863 3.923 -9.303 1.00 0.00 H new ATOM 0 HA GLU A 11 0.834 4.749 -9.621 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -1.233 4.697 -7.431 1.00 0.00 H new ATOM 0 HB3 GLU A 11 0.431 5.051 -7.012 1.00 0.00 H new ATOM 0 HG2 GLU A 11 0.377 6.868 -8.806 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -1.350 6.593 -8.920 1.00 0.00 H new ATOM 194 N MET A 12 0.298 2.043 -7.831 1.00 0.00 N ATOM 195 CA MET A 12 0.948 0.853 -7.299 1.00 0.00 C ATOM 196 C MET A 12 1.593 0.056 -8.427 1.00 0.00 C ATOM 197 O MET A 12 2.717 -0.431 -8.294 1.00 0.00 O ATOM 198 CB MET A 12 -0.061 -0.017 -6.539 1.00 0.00 C ATOM 199 CG MET A 12 -0.625 0.651 -5.294 1.00 0.00 C ATOM 200 SD MET A 12 -1.753 -0.418 -4.376 1.00 0.00 S ATOM 201 CE MET A 12 -3.034 -0.708 -5.595 1.00 0.00 C ATOM 0 H MET A 12 -0.716 2.054 -7.724 1.00 0.00 H new ATOM 0 HA MET A 12 1.726 1.165 -6.602 1.00 0.00 H new ATOM 0 HB2 MET A 12 -0.883 -0.274 -7.207 1.00 0.00 H new ATOM 0 HB3 MET A 12 0.421 -0.952 -6.253 1.00 0.00 H new ATOM 0 HG2 MET A 12 0.197 0.948 -4.643 1.00 0.00 H new ATOM 0 HG3 MET A 12 -1.149 1.562 -5.582 1.00 0.00 H new ATOM 0 HE1 MET A 12 -3.852 -1.264 -5.138 1.00 0.00 H new ATOM 0 HE2 MET A 12 -3.407 0.247 -5.965 1.00 0.00 H new ATOM 0 HE3 MET A 12 -2.623 -1.283 -6.425 1.00 0.00 H new ATOM 211 N LEU A 13 0.878 -0.053 -9.541 1.00 0.00 N ATOM 212 CA LEU A 13 1.379 -0.747 -10.721 1.00 0.00 C ATOM 213 C LEU A 13 2.642 -0.083 -11.258 1.00 0.00 C ATOM 214 O LEU A 13 3.602 -0.762 -11.626 1.00 0.00 O ATOM 215 CB LEU A 13 0.302 -0.786 -11.810 1.00 0.00 C ATOM 216 CG LEU A 13 -0.874 -1.726 -11.530 1.00 0.00 C ATOM 217 CD1 LEU A 13 -1.884 -1.667 -12.666 1.00 0.00 C ATOM 218 CD2 LEU A 13 -0.378 -3.149 -11.325 1.00 0.00 C ATOM 0 H LEU A 13 -0.059 0.334 -9.651 1.00 0.00 H new ATOM 0 HA LEU A 13 1.630 -1.767 -10.429 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.086 0.223 -11.952 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.768 -1.083 -12.749 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.369 -1.400 -10.615 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.713 -2.341 -12.451 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.260 -0.649 -12.766 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.403 -1.969 -13.596 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -1.226 -3.805 -11.127 1.00 0.00 H new ATOM 0 HD22 LEU A 13 0.140 -3.487 -12.223 1.00 0.00 H new ATOM 0 HD23 LEU A 13 0.308 -3.177 -10.478 1.00 0.00 H new ATOM 230 N ALA A 14 2.640 1.242 -11.293 1.00 0.00 N ATOM 231 CA ALA A 14 3.784 1.995 -11.788 1.00 0.00 C ATOM 232 C ALA A 14 5.016 1.762 -10.921 1.00 0.00 C ATOM 233 O ALA A 14 6.125 1.611 -11.432 1.00 0.00 O ATOM 234 CB ALA A 14 3.455 3.478 -11.858 1.00 0.00 C ATOM 0 H ALA A 14 1.858 1.819 -10.984 1.00 0.00 H new ATOM 0 HA ALA A 14 4.010 1.639 -12.793 1.00 0.00 H new ATOM 0 HB1 ALA A 14 4.321 4.026 -12.230 1.00 0.00 H new ATOM 0 HB2 ALA A 14 2.612 3.632 -12.531 1.00 0.00 H new ATOM 0 HB3 ALA A 14 3.196 3.841 -10.863 1.00 0.00 H new ATOM 240 N HIS A 15 4.819 1.716 -9.612 1.00 0.00 N ATOM 241 CA HIS A 15 5.927 1.489 -8.693 1.00 0.00 C ATOM 242 C HIS A 15 6.434 0.054 -8.799 1.00 0.00 C ATOM 243 O HIS A 15 7.638 -0.191 -8.742 1.00 0.00 O ATOM 244 CB HIS A 15 5.508 1.785 -7.254 1.00 0.00 C ATOM 245 CG HIS A 15 6.655 1.756 -6.287 1.00 0.00 C ATOM 246 ND1 HIS A 15 7.864 2.370 -6.535 1.00 0.00 N ATOM 247 CD2 HIS A 15 6.776 1.175 -5.072 1.00 0.00 C ATOM 248 CE1 HIS A 15 8.675 2.169 -5.518 1.00 0.00 C ATOM 249 NE2 HIS A 15 8.042 1.448 -4.612 1.00 0.00 N ATOM 0 H HIS A 15 3.910 1.832 -9.164 1.00 0.00 H new ATOM 0 HA HIS A 15 6.733 2.168 -8.971 1.00 0.00 H new ATOM 0 HB2 HIS A 15 5.033 2.765 -7.215 1.00 0.00 H new ATOM 0 HB3 HIS A 15 4.760 1.056 -6.943 1.00 0.00 H new ATOM 0 HD1 HIS A 15 8.094 2.898 -7.376 1.00 0.00 H new ATOM 0 HD2 HIS A 15 6.018 0.602 -4.558 1.00 0.00 H new ATOM 0 HE1 HIS A 15 9.689 2.533 -5.438 1.00 0.00 H new ATOM 0 HE2 HIS A 15 8.428 1.144 -3.718 1.00 0.00 H new ATOM 258 N ALA A 16 5.508 -0.882 -8.949 1.00 0.00 N ATOM 259 CA ALA A 16 5.851 -2.295 -9.066 1.00 0.00 C ATOM 260 C ALA A 16 6.726 -2.552 -10.291 1.00 0.00 C ATOM 261 O ALA A 16 7.798 -3.148 -10.182 1.00 0.00 O ATOM 262 CB ALA A 16 4.587 -3.139 -9.128 1.00 0.00 C ATOM 0 H ALA A 16 4.508 -0.688 -8.993 1.00 0.00 H new ATOM 0 HA ALA A 16 6.422 -2.579 -8.182 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.856 -4.192 -9.215 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.004 -2.988 -8.220 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.994 -2.843 -9.994 1.00 0.00 H new ATOM 268 N ARG A 17 6.272 -2.079 -11.452 1.00 0.00 N ATOM 269 CA ARG A 17 7.006 -2.262 -12.705 1.00 0.00 C ATOM 270 C ARG A 17 8.341 -1.519 -12.671 1.00 0.00 C ATOM 271 O ARG A 17 9.319 -1.948 -13.281 1.00 0.00 O ATOM 272 CB ARG A 17 6.157 -1.810 -13.898 1.00 0.00 C ATOM 273 CG ARG A 17 5.828 -0.336 -13.879 1.00 0.00 C ATOM 274 CD ARG A 17 4.790 0.033 -14.927 1.00 0.00 C ATOM 275 NE ARG A 17 5.260 -0.199 -16.291 1.00 0.00 N ATOM 276 CZ ARG A 17 4.474 -0.168 -17.368 1.00 0.00 C ATOM 277 NH1 ARG A 17 3.173 0.074 -17.246 1.00 0.00 N ATOM 278 NH2 ARG A 17 4.999 -0.373 -18.567 1.00 0.00 N ATOM 0 H ARG A 17 5.397 -1.565 -11.551 1.00 0.00 H new ATOM 0 HA ARG A 17 7.219 -3.324 -12.822 1.00 0.00 H new ATOM 0 HB2 ARG A 17 6.688 -2.044 -14.821 1.00 0.00 H new ATOM 0 HB3 ARG A 17 5.229 -2.381 -13.911 1.00 0.00 H new ATOM 0 HG2 ARG A 17 5.459 -0.060 -12.891 1.00 0.00 H new ATOM 0 HG3 ARG A 17 6.737 0.240 -14.052 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.884 -0.548 -14.755 1.00 0.00 H new ATOM 0 HD3 ARG A 17 4.522 1.083 -14.813 1.00 0.00 H new ATOM 0 HE ARG A 17 6.251 -0.397 -16.428 1.00 0.00 H new ATOM 0 HH11 ARG A 17 2.769 0.238 -16.324 1.00 0.00 H new ATOM 0 HH12 ARG A 17 2.578 0.096 -18.075 1.00 0.00 H new ATOM 0 HH21 ARG A 17 5.998 -0.553 -18.662 1.00 0.00 H new ATOM 0 HH22 ARG A 17 4.404 -0.351 -19.395 1.00 0.00 H new ATOM 292 N GLN A 18 8.358 -0.398 -11.960 1.00 0.00 N ATOM 293 CA GLN A 18 9.555 0.416 -11.789 1.00 0.00 C ATOM 294 C GLN A 18 10.710 -0.372 -11.169 1.00 0.00 C ATOM 295 O GLN A 18 11.847 -0.308 -11.641 1.00 0.00 O ATOM 296 CB GLN A 18 9.209 1.612 -10.903 1.00 0.00 C ATOM 297 CG GLN A 18 10.406 2.394 -10.396 1.00 0.00 C ATOM 298 CD GLN A 18 10.000 3.569 -9.532 1.00 0.00 C ATOM 299 OE1 GLN A 18 9.797 3.427 -8.325 1.00 0.00 O ATOM 300 NE2 GLN A 18 9.898 4.741 -10.135 1.00 0.00 N ATOM 0 H GLN A 18 7.537 -0.026 -11.483 1.00 0.00 H new ATOM 0 HA GLN A 18 9.887 0.746 -12.773 1.00 0.00 H new ATOM 0 HB2 GLN A 18 8.563 2.287 -11.464 1.00 0.00 H new ATOM 0 HB3 GLN A 18 8.634 1.258 -10.047 1.00 0.00 H new ATOM 0 HG2 GLN A 18 11.054 1.731 -9.823 1.00 0.00 H new ATOM 0 HG3 GLN A 18 10.988 2.754 -11.244 1.00 0.00 H new ATOM 0 HE21 GLN A 18 10.074 4.816 -11.137 1.00 0.00 H new ATOM 0 HE22 GLN A 18 9.643 5.570 -9.598 1.00 0.00 H new ATOM 309 N ALA A 19 10.407 -1.114 -10.117 1.00 0.00 N ATOM 310 CA ALA A 19 11.440 -1.784 -9.328 1.00 0.00 C ATOM 311 C ALA A 19 11.821 -3.155 -9.888 1.00 0.00 C ATOM 312 O ALA A 19 12.763 -3.778 -9.404 1.00 0.00 O ATOM 313 CB ALA A 19 10.991 -1.917 -7.883 1.00 0.00 C ATOM 0 H ALA A 19 9.455 -1.271 -9.785 1.00 0.00 H new ATOM 0 HA ALA A 19 12.332 -1.161 -9.382 1.00 0.00 H new ATOM 0 HB1 ALA A 19 11.768 -2.417 -7.305 1.00 0.00 H new ATOM 0 HB2 ALA A 19 10.809 -0.927 -7.466 1.00 0.00 H new ATOM 0 HB3 ALA A 19 10.073 -2.503 -7.840 1.00 0.00 H new ATOM 319 N LEU A 20 11.101 -3.614 -10.906 1.00 0.00 N ATOM 320 CA LEU A 20 11.347 -4.931 -11.491 1.00 0.00 C ATOM 321 C LEU A 20 12.792 -5.073 -11.971 1.00 0.00 C ATOM 322 O LEU A 20 13.380 -4.127 -12.501 1.00 0.00 O ATOM 323 CB LEU A 20 10.384 -5.185 -12.652 1.00 0.00 C ATOM 324 CG LEU A 20 8.912 -5.335 -12.258 1.00 0.00 C ATOM 325 CD1 LEU A 20 8.056 -5.598 -13.486 1.00 0.00 C ATOM 326 CD2 LEU A 20 8.742 -6.455 -11.241 1.00 0.00 C ATOM 0 H LEU A 20 10.341 -3.094 -11.345 1.00 0.00 H new ATOM 0 HA LEU A 20 11.177 -5.674 -10.712 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.471 -4.363 -13.362 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.698 -6.090 -13.172 1.00 0.00 H new ATOM 0 HG LEU A 20 8.582 -4.402 -11.801 1.00 0.00 H new ATOM 0 HD11 LEU A 20 7.013 -5.702 -13.187 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.153 -4.765 -14.182 1.00 0.00 H new ATOM 0 HD13 LEU A 20 8.388 -6.516 -13.971 1.00 0.00 H new ATOM 0 HD21 LEU A 20 7.689 -6.547 -10.973 1.00 0.00 H new ATOM 0 HD22 LEU A 20 9.090 -7.394 -11.672 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.325 -6.228 -10.349 1.00 0.00 H new ATOM 338 N PRO A 21 13.386 -6.269 -11.804 1.00 0.00 N ATOM 339 CA PRO A 21 12.719 -7.433 -11.229 1.00 0.00 C ATOM 340 C PRO A 21 12.970 -7.595 -9.728 1.00 0.00 C ATOM 341 O PRO A 21 12.878 -8.700 -9.193 1.00 0.00 O ATOM 342 CB PRO A 21 13.366 -8.577 -12.004 1.00 0.00 C ATOM 343 CG PRO A 21 14.761 -8.111 -12.293 1.00 0.00 C ATOM 344 CD PRO A 21 14.763 -6.599 -12.193 1.00 0.00 C ATOM 0 HA PRO A 21 11.634 -7.373 -11.311 1.00 0.00 H new ATOM 0 HB2 PRO A 21 13.371 -9.497 -11.419 1.00 0.00 H new ATOM 0 HB3 PRO A 21 12.822 -8.787 -12.925 1.00 0.00 H new ATOM 0 HG2 PRO A 21 15.465 -8.544 -11.582 1.00 0.00 H new ATOM 0 HG3 PRO A 21 15.074 -8.430 -13.287 1.00 0.00 H new ATOM 0 HD2 PRO A 21 15.482 -6.249 -11.453 1.00 0.00 H new ATOM 0 HD3 PRO A 21 15.032 -6.136 -13.143 1.00 0.00 H new ATOM 352 N ASN A 22 13.280 -6.497 -9.055 1.00 0.00 N ATOM 353 CA ASN A 22 13.492 -6.525 -7.611 1.00 0.00 C ATOM 354 C ASN A 22 12.156 -6.332 -6.905 1.00 0.00 C ATOM 355 O ASN A 22 11.108 -6.271 -7.554 1.00 0.00 O ATOM 356 CB ASN A 22 14.467 -5.423 -7.168 1.00 0.00 C ATOM 357 CG ASN A 22 15.804 -5.455 -7.893 1.00 0.00 C ATOM 358 OD1 ASN A 22 16.258 -6.497 -8.369 1.00 0.00 O ATOM 359 ND2 ASN A 22 16.456 -4.302 -7.969 1.00 0.00 N ATOM 0 H ASN A 22 13.391 -5.577 -9.482 1.00 0.00 H new ATOM 0 HA ASN A 22 13.925 -7.489 -7.346 1.00 0.00 H new ATOM 0 HB2 ASN A 22 14.000 -4.452 -7.330 1.00 0.00 H new ATOM 0 HB3 ASN A 22 14.643 -5.517 -6.096 1.00 0.00 H new ATOM 0 HD21 ASN A 22 17.363 -4.259 -8.433 1.00 0.00 H new ATOM 0 HD22 ASN A 22 16.050 -3.459 -7.564 1.00 0.00 H new ATOM 366 N GLU A 23 12.183 -6.224 -5.587 1.00 0.00 N ATOM 367 CA GLU A 23 10.961 -5.994 -4.836 1.00 0.00 C ATOM 368 C GLU A 23 10.724 -4.494 -4.665 1.00 0.00 C ATOM 369 O GLU A 23 11.668 -3.701 -4.612 1.00 0.00 O ATOM 370 CB GLU A 23 10.999 -6.697 -3.471 1.00 0.00 C ATOM 371 CG GLU A 23 12.052 -6.163 -2.513 1.00 0.00 C ATOM 372 CD GLU A 23 13.462 -6.588 -2.866 1.00 0.00 C ATOM 373 OE1 GLU A 23 13.836 -7.734 -2.536 1.00 0.00 O ATOM 374 OE2 GLU A 23 14.201 -5.776 -3.468 1.00 0.00 O ATOM 0 H GLU A 23 13.028 -6.291 -5.020 1.00 0.00 H new ATOM 0 HA GLU A 23 10.132 -6.420 -5.400 1.00 0.00 H new ATOM 0 HB2 GLU A 23 10.019 -6.604 -3.002 1.00 0.00 H new ATOM 0 HB3 GLU A 23 11.177 -7.761 -3.630 1.00 0.00 H new ATOM 0 HG2 GLU A 23 12.002 -5.074 -2.501 1.00 0.00 H new ATOM 0 HG3 GLU A 23 11.820 -6.504 -1.504 1.00 0.00 H new ATOM 381 N ALA A 24 9.459 -4.104 -4.598 1.00 0.00 N ATOM 382 CA ALA A 24 9.099 -2.702 -4.472 1.00 0.00 C ATOM 383 C ALA A 24 8.358 -2.445 -3.171 1.00 0.00 C ATOM 384 O ALA A 24 7.384 -3.126 -2.861 1.00 0.00 O ATOM 385 CB ALA A 24 8.247 -2.268 -5.654 1.00 0.00 C ATOM 0 H ALA A 24 8.664 -4.742 -4.629 1.00 0.00 H new ATOM 0 HA ALA A 24 10.018 -2.116 -4.463 1.00 0.00 H new ATOM 0 HB1 ALA A 24 7.985 -1.216 -5.546 1.00 0.00 H new ATOM 0 HB2 ALA A 24 8.808 -2.410 -6.578 1.00 0.00 H new ATOM 0 HB3 ALA A 24 7.337 -2.867 -5.686 1.00 0.00 H new ATOM 391 N CYS A 25 8.832 -1.469 -2.410 1.00 0.00 N ATOM 392 CA CYS A 25 8.188 -1.087 -1.164 1.00 0.00 C ATOM 393 C CYS A 25 7.687 0.353 -1.237 1.00 0.00 C ATOM 394 O CYS A 25 8.233 1.175 -1.979 1.00 0.00 O ATOM 395 CB CYS A 25 9.166 -1.248 0.000 1.00 0.00 C ATOM 396 SG CYS A 25 10.769 -0.453 -0.269 1.00 0.00 S ATOM 0 H CYS A 25 9.665 -0.925 -2.636 1.00 0.00 H new ATOM 0 HA CYS A 25 7.331 -1.740 -1.001 1.00 0.00 H new ATOM 0 HB2 CYS A 25 8.713 -0.834 0.901 1.00 0.00 H new ATOM 0 HB3 CYS A 25 9.325 -2.311 0.183 1.00 0.00 H new ATOM 0 HG CYS A 25 11.527 -0.642 0.770 1.00 0.00 H new ATOM 402 N GLY A 26 6.637 0.647 -0.488 1.00 0.00 N ATOM 403 CA GLY A 26 6.100 1.992 -0.443 1.00 0.00 C ATOM 404 C GLY A 26 5.069 2.141 0.655 1.00 0.00 C ATOM 405 O GLY A 26 4.868 1.216 1.436 1.00 0.00 O ATOM 0 H GLY A 26 6.142 -0.028 0.095 1.00 0.00 H new ATOM 0 HA2 GLY A 26 6.910 2.703 -0.282 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.648 2.237 -1.404 1.00 0.00 H new ATOM 409 N LEU A 27 4.402 3.286 0.703 1.00 0.00 N ATOM 410 CA LEU A 27 3.396 3.541 1.731 1.00 0.00 C ATOM 411 C LEU A 27 2.058 3.903 1.102 1.00 0.00 C ATOM 412 O LEU A 27 1.999 4.342 -0.048 1.00 0.00 O ATOM 413 CB LEU A 27 3.841 4.672 2.664 1.00 0.00 C ATOM 414 CG LEU A 27 5.010 4.342 3.594 1.00 0.00 C ATOM 415 CD1 LEU A 27 5.355 5.541 4.460 1.00 0.00 C ATOM 416 CD2 LEU A 27 4.677 3.140 4.464 1.00 0.00 C ATOM 0 H LEU A 27 4.537 4.053 0.045 1.00 0.00 H new ATOM 0 HA LEU A 27 3.282 2.625 2.311 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.116 5.533 2.055 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.989 4.972 3.274 1.00 0.00 H new ATOM 0 HG LEU A 27 5.877 4.096 2.981 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.189 5.289 5.115 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.635 6.381 3.824 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.489 5.815 5.063 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.520 2.920 5.119 1.00 0.00 H new ATOM 0 HD22 LEU A 27 3.797 3.360 5.068 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.475 2.277 3.830 1.00 0.00 H new ATOM 428 N LEU A 28 0.991 3.716 1.866 1.00 0.00 N ATOM 429 CA LEU A 28 -0.353 4.042 1.410 1.00 0.00 C ATOM 430 C LEU A 28 -0.998 5.054 2.343 1.00 0.00 C ATOM 431 O LEU A 28 -0.963 4.893 3.567 1.00 0.00 O ATOM 432 CB LEU A 28 -1.212 2.780 1.336 1.00 0.00 C ATOM 433 CG LEU A 28 -0.778 1.764 0.284 1.00 0.00 C ATOM 434 CD1 LEU A 28 -1.577 0.484 0.428 1.00 0.00 C ATOM 435 CD2 LEU A 28 -0.948 2.339 -1.113 1.00 0.00 C ATOM 0 H LEU A 28 1.031 3.337 2.812 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.281 4.477 0.413 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.204 2.295 2.312 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.243 3.072 1.134 1.00 0.00 H new ATOM 0 HG LEU A 28 0.277 1.536 0.437 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.257 -0.232 -0.329 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.412 0.062 1.419 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -2.637 0.700 0.297 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.634 1.601 -1.851 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -1.995 2.593 -1.277 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.337 3.236 -1.214 1.00 0.00 H new ATOM 447 N GLY A 29 -1.586 6.087 1.764 1.00 0.00 N ATOM 448 CA GLY A 29 -2.183 7.135 2.556 1.00 0.00 C ATOM 449 C GLY A 29 -3.636 7.374 2.219 1.00 0.00 C ATOM 450 O GLY A 29 -4.087 7.094 1.107 1.00 0.00 O ATOM 0 H GLY A 29 -1.660 6.217 0.755 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.098 6.878 3.612 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.624 8.059 2.407 1.00 0.00 H new ATOM 454 N GLY A 30 -4.364 7.903 3.183 1.00 0.00 N ATOM 455 CA GLY A 30 -5.771 8.178 3.005 1.00 0.00 C ATOM 456 C GLY A 30 -6.445 8.409 4.333 1.00 0.00 C ATOM 457 O GLY A 30 -5.808 8.881 5.273 1.00 0.00 O ATOM 0 H GLY A 30 -3.999 8.151 4.102 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -5.897 9.056 2.371 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.247 7.343 2.491 1.00 0.00 H new ATOM 461 N ARG A 31 -7.718 8.081 4.431 1.00 0.00 N ATOM 462 CA ARG A 31 -8.423 8.206 5.693 1.00 0.00 C ATOM 463 C ARG A 31 -9.098 6.903 6.079 1.00 0.00 C ATOM 464 O ARG A 31 -9.592 6.167 5.228 1.00 0.00 O ATOM 465 CB ARG A 31 -9.460 9.330 5.655 1.00 0.00 C ATOM 466 CG ARG A 31 -8.874 10.715 5.878 1.00 0.00 C ATOM 467 CD ARG A 31 -9.867 11.616 6.596 1.00 0.00 C ATOM 468 NE ARG A 31 -10.214 11.088 7.923 1.00 0.00 N ATOM 469 CZ ARG A 31 -11.462 10.994 8.388 1.00 0.00 C ATOM 470 NH1 ARG A 31 -12.483 11.432 7.664 1.00 0.00 N ATOM 471 NH2 ARG A 31 -11.690 10.475 9.591 1.00 0.00 N ATOM 0 H ARG A 31 -8.283 7.728 3.658 1.00 0.00 H new ATOM 0 HA ARG A 31 -7.674 8.453 6.446 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -9.967 9.311 4.690 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -10.217 9.139 6.416 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -7.958 10.637 6.464 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -8.602 11.158 4.920 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -9.444 12.615 6.700 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -10.771 11.714 5.995 1.00 0.00 H new ATOM 0 HE ARG A 31 -9.454 10.774 8.526 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -12.317 11.844 6.746 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -13.434 11.357 8.025 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -10.910 10.147 10.161 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -12.645 10.405 9.943 1.00 0.00 H new ATOM 485 N ARG A 32 -9.099 6.621 7.370 1.00 0.00 N ATOM 486 CA ARG A 32 -9.784 5.458 7.898 1.00 0.00 C ATOM 487 C ARG A 32 -10.865 5.905 8.870 1.00 0.00 C ATOM 488 O ARG A 32 -10.617 6.728 9.754 1.00 0.00 O ATOM 489 CB ARG A 32 -8.800 4.509 8.594 1.00 0.00 C ATOM 490 CG ARG A 32 -8.042 5.148 9.747 1.00 0.00 C ATOM 491 CD ARG A 32 -7.134 4.152 10.447 1.00 0.00 C ATOM 492 NE ARG A 32 -7.880 3.053 11.062 1.00 0.00 N ATOM 493 CZ ARG A 32 -7.943 2.842 12.377 1.00 0.00 C ATOM 494 NH1 ARG A 32 -7.420 3.723 13.219 1.00 0.00 N ATOM 495 NH2 ARG A 32 -8.555 1.764 12.854 1.00 0.00 N ATOM 0 H ARG A 32 -8.629 7.188 8.076 1.00 0.00 H new ATOM 0 HA ARG A 32 -10.242 4.916 7.071 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -9.347 3.643 8.967 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -8.083 4.141 7.860 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -7.447 5.981 9.373 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -8.752 5.559 10.465 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -6.422 3.747 9.728 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -6.555 4.668 11.213 1.00 0.00 H new ATOM 0 HE ARG A 32 -8.381 2.411 10.448 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -6.968 4.565 12.861 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -7.470 3.559 14.225 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -8.979 1.093 12.213 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -8.601 1.607 13.861 1.00 0.00 H new ATOM 509 N ASP A 33 -12.061 5.374 8.701 1.00 0.00 N ATOM 510 CA ASP A 33 -13.179 5.733 9.566 1.00 0.00 C ATOM 511 C ASP A 33 -13.403 4.623 10.580 1.00 0.00 C ATOM 512 O ASP A 33 -14.506 4.425 11.091 1.00 0.00 O ATOM 513 CB ASP A 33 -14.450 5.958 8.745 1.00 0.00 C ATOM 514 CG ASP A 33 -15.269 7.121 9.260 1.00 0.00 C ATOM 515 OD1 ASP A 33 -16.004 6.950 10.256 1.00 0.00 O ATOM 516 OD2 ASP A 33 -15.182 8.215 8.668 1.00 0.00 O ATOM 0 H ASP A 33 -12.288 4.694 7.976 1.00 0.00 H new ATOM 0 HA ASP A 33 -12.942 6.662 10.084 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -14.180 6.139 7.705 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -15.057 5.053 8.764 1.00 0.00 H new ATOM 521 N GLY A 34 -12.331 3.910 10.865 1.00 0.00 N ATOM 522 CA GLY A 34 -12.403 2.747 11.712 1.00 0.00 C ATOM 523 C GLY A 34 -11.786 1.556 11.025 1.00 0.00 C ATOM 524 O GLY A 34 -10.567 1.497 10.850 1.00 0.00 O ATOM 0 H GLY A 34 -11.396 4.122 10.517 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -11.885 2.941 12.651 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -13.443 2.533 11.959 1.00 0.00 H new ATOM 528 N ASP A 35 -12.622 0.631 10.588 1.00 0.00 N ATOM 529 CA ASP A 35 -12.144 -0.548 9.884 1.00 0.00 C ATOM 530 C ASP A 35 -12.263 -0.347 8.381 1.00 0.00 C ATOM 531 O ASP A 35 -11.887 -1.215 7.589 1.00 0.00 O ATOM 532 CB ASP A 35 -12.919 -1.793 10.318 1.00 0.00 C ATOM 533 CG ASP A 35 -12.765 -2.077 11.794 1.00 0.00 C ATOM 534 OD1 ASP A 35 -11.738 -2.670 12.187 1.00 0.00 O ATOM 535 OD2 ASP A 35 -13.668 -1.699 12.574 1.00 0.00 O ATOM 0 H ASP A 35 -13.634 0.672 10.707 1.00 0.00 H new ATOM 0 HA ASP A 35 -11.094 -0.696 10.137 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -13.975 -1.661 10.084 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.571 -2.653 9.746 1.00 0.00 H new ATOM 540 N ASP A 36 -12.800 0.800 7.985 1.00 0.00 N ATOM 541 CA ASP A 36 -12.861 1.149 6.576 1.00 0.00 C ATOM 542 C ASP A 36 -11.838 2.211 6.261 1.00 0.00 C ATOM 543 O ASP A 36 -11.655 3.177 7.002 1.00 0.00 O ATOM 544 CB ASP A 36 -14.235 1.635 6.149 1.00 0.00 C ATOM 545 CG ASP A 36 -15.321 0.615 6.411 1.00 0.00 C ATOM 546 OD1 ASP A 36 -15.293 -0.462 5.777 1.00 0.00 O ATOM 547 OD2 ASP A 36 -16.206 0.882 7.248 1.00 0.00 O ATOM 0 H ASP A 36 -13.196 1.498 8.615 1.00 0.00 H new ATOM 0 HA ASP A 36 -12.647 0.237 6.018 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -14.472 2.557 6.681 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -14.217 1.876 5.086 1.00 0.00 H new ATOM 552 N ARG A 37 -11.185 2.001 5.156 1.00 0.00 N ATOM 553 CA ARG A 37 -10.031 2.787 4.751 1.00 0.00 C ATOM 554 C ARG A 37 -10.151 3.237 3.298 1.00 0.00 C ATOM 555 O ARG A 37 -10.358 2.414 2.405 1.00 0.00 O ATOM 556 CB ARG A 37 -8.761 1.958 4.964 1.00 0.00 C ATOM 557 CG ARG A 37 -8.954 0.488 4.631 1.00 0.00 C ATOM 558 CD ARG A 37 -7.878 -0.387 5.246 1.00 0.00 C ATOM 559 NE ARG A 37 -8.328 -1.776 5.360 1.00 0.00 N ATOM 560 CZ ARG A 37 -7.714 -2.704 6.091 1.00 0.00 C ATOM 561 NH1 ARG A 37 -6.561 -2.431 6.690 1.00 0.00 N ATOM 562 NH2 ARG A 37 -8.246 -3.916 6.207 1.00 0.00 N ATOM 0 H ARG A 37 -11.435 1.269 4.492 1.00 0.00 H new ATOM 0 HA ARG A 37 -9.982 3.688 5.363 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -7.960 2.364 4.346 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -8.441 2.052 6.002 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -9.931 0.162 4.987 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -8.950 0.359 3.549 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -6.976 -0.343 4.635 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -7.614 -0.005 6.232 1.00 0.00 H new ATOM 0 HE ARG A 37 -9.166 -2.050 4.846 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -6.141 -1.507 6.591 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -6.095 -3.146 7.249 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -9.124 -4.135 5.736 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -7.776 -4.628 6.767 1.00 0.00 H new ATOM 576 N TRP A 38 -10.030 4.532 3.064 1.00 0.00 N ATOM 577 CA TRP A 38 -10.038 5.061 1.709 1.00 0.00 C ATOM 578 C TRP A 38 -8.640 5.526 1.329 1.00 0.00 C ATOM 579 O TRP A 38 -8.065 6.393 1.990 1.00 0.00 O ATOM 580 CB TRP A 38 -11.026 6.222 1.577 1.00 0.00 C ATOM 581 CG TRP A 38 -12.436 5.851 1.915 1.00 0.00 C ATOM 582 CD1 TRP A 38 -13.362 5.278 1.088 1.00 0.00 C ATOM 583 CD2 TRP A 38 -13.082 6.027 3.178 1.00 0.00 C ATOM 584 NE1 TRP A 38 -14.539 5.084 1.766 1.00 0.00 N ATOM 585 CE2 TRP A 38 -14.394 5.538 3.049 1.00 0.00 C ATOM 586 CE3 TRP A 38 -12.675 6.547 4.408 1.00 0.00 C ATOM 587 CZ2 TRP A 38 -15.303 5.560 4.101 1.00 0.00 C ATOM 588 CZ3 TRP A 38 -13.576 6.568 5.450 1.00 0.00 C ATOM 589 CH2 TRP A 38 -14.877 6.074 5.293 1.00 0.00 C ATOM 0 H TRP A 38 -9.925 5.237 3.793 1.00 0.00 H new ATOM 0 HA TRP A 38 -10.354 4.266 1.033 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -10.707 7.035 2.229 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -10.994 6.601 0.556 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -13.192 5.017 0.054 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -15.385 4.669 1.377 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -11.672 6.926 4.540 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -16.308 5.185 3.980 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -13.274 6.973 6.405 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -15.557 6.100 6.131 1.00 0.00 H new ATOM 600 N VAL A 39 -8.093 4.936 0.279 1.00 0.00 N ATOM 601 CA VAL A 39 -6.747 5.264 -0.166 1.00 0.00 C ATOM 602 C VAL A 39 -6.788 6.365 -1.219 1.00 0.00 C ATOM 603 O VAL A 39 -7.156 6.123 -2.368 1.00 0.00 O ATOM 604 CB VAL A 39 -6.032 4.030 -0.757 1.00 0.00 C ATOM 605 CG1 VAL A 39 -4.571 4.336 -1.055 1.00 0.00 C ATOM 606 CG2 VAL A 39 -6.151 2.837 0.179 1.00 0.00 C ATOM 0 H VAL A 39 -8.561 4.225 -0.283 1.00 0.00 H new ATOM 0 HA VAL A 39 -6.192 5.608 0.707 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.522 3.777 -1.697 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -4.091 3.450 -1.470 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -4.510 5.153 -1.774 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.065 4.625 -0.134 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.640 1.979 -0.258 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.695 3.081 1.139 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.203 2.595 0.328 1.00 0.00 H new ATOM 616 N GLU A 40 -6.426 7.573 -0.818 1.00 0.00 N ATOM 617 CA GLU A 40 -6.426 8.708 -1.735 1.00 0.00 C ATOM 618 C GLU A 40 -5.009 9.076 -2.160 1.00 0.00 C ATOM 619 O GLU A 40 -4.815 9.799 -3.136 1.00 0.00 O ATOM 620 CB GLU A 40 -7.103 9.925 -1.102 1.00 0.00 C ATOM 621 CG GLU A 40 -8.581 9.725 -0.807 1.00 0.00 C ATOM 622 CD GLU A 40 -9.247 10.992 -0.307 1.00 0.00 C ATOM 623 OE1 GLU A 40 -9.041 11.353 0.868 1.00 0.00 O ATOM 624 OE2 GLU A 40 -9.969 11.647 -1.092 1.00 0.00 O ATOM 0 H GLU A 40 -6.129 7.795 0.132 1.00 0.00 H new ATOM 0 HA GLU A 40 -6.990 8.408 -2.619 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.588 10.173 -0.174 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -6.988 10.780 -1.769 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -9.086 9.384 -1.711 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.697 8.938 -0.061 1.00 0.00 H new ATOM 631 N ARG A 41 -4.016 8.568 -1.442 1.00 0.00 N ATOM 632 CA ARG A 41 -2.632 8.907 -1.735 1.00 0.00 C ATOM 633 C ARG A 41 -1.754 7.657 -1.736 1.00 0.00 C ATOM 634 O ARG A 41 -1.874 6.803 -0.858 1.00 0.00 O ATOM 635 CB ARG A 41 -2.106 9.908 -0.706 1.00 0.00 C ATOM 636 CG ARG A 41 -0.935 10.737 -1.205 1.00 0.00 C ATOM 637 CD ARG A 41 -1.388 11.758 -2.238 1.00 0.00 C ATOM 638 NE ARG A 41 -0.295 12.615 -2.699 1.00 0.00 N ATOM 639 CZ ARG A 41 0.226 13.615 -1.979 1.00 0.00 C ATOM 640 NH1 ARG A 41 -0.168 13.810 -0.726 1.00 0.00 N ATOM 641 NH2 ARG A 41 1.147 14.411 -2.512 1.00 0.00 N ATOM 0 H ARG A 41 -4.142 7.926 -0.660 1.00 0.00 H new ATOM 0 HA ARG A 41 -2.595 9.357 -2.727 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -2.916 10.577 -0.416 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -1.802 9.368 0.191 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -0.464 11.249 -0.366 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -0.182 10.082 -1.643 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -1.822 11.238 -3.092 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -2.175 12.378 -1.809 1.00 0.00 H new ATOM 0 HE ARG A 41 0.093 12.439 -3.626 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -0.869 13.197 -0.311 1.00 0.00 H new ATOM 0 HH12 ARG A 41 0.231 14.573 -0.179 1.00 0.00 H new ATOM 0 HH21 ARG A 41 1.458 14.260 -3.472 1.00 0.00 H new ATOM 0 HH22 ARG A 41 1.543 15.173 -1.961 1.00 0.00 H new ATOM 655 N VAL A 42 -0.888 7.549 -2.728 1.00 0.00 N ATOM 656 CA VAL A 42 0.078 6.463 -2.792 1.00 0.00 C ATOM 657 C VAL A 42 1.488 7.036 -2.713 1.00 0.00 C ATOM 658 O VAL A 42 1.777 8.063 -3.324 1.00 0.00 O ATOM 659 CB VAL A 42 -0.076 5.630 -4.087 1.00 0.00 C ATOM 660 CG1 VAL A 42 0.993 4.545 -4.176 1.00 0.00 C ATOM 661 CG2 VAL A 42 -1.460 5.011 -4.163 1.00 0.00 C ATOM 0 H VAL A 42 -0.833 8.205 -3.507 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.106 5.798 -1.948 1.00 0.00 H new ATOM 0 HB VAL A 42 0.054 6.305 -4.933 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.859 3.977 -5.096 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.981 5.006 -4.175 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.904 3.876 -3.320 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -1.549 4.429 -5.081 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -1.615 4.359 -3.304 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.212 5.800 -4.160 1.00 0.00 H new ATOM 671 N TYR A 43 2.351 6.396 -1.938 1.00 0.00 N ATOM 672 CA TYR A 43 3.716 6.866 -1.777 1.00 0.00 C ATOM 673 C TYR A 43 4.728 5.837 -2.260 1.00 0.00 C ATOM 674 O TYR A 43 5.163 4.972 -1.494 1.00 0.00 O ATOM 675 CB TYR A 43 4.000 7.234 -0.323 1.00 0.00 C ATOM 676 CG TYR A 43 3.320 8.506 0.112 1.00 0.00 C ATOM 677 CD1 TYR A 43 3.777 9.740 -0.331 1.00 0.00 C ATOM 678 CD2 TYR A 43 2.219 8.477 0.954 1.00 0.00 C ATOM 679 CE1 TYR A 43 3.161 10.911 0.061 1.00 0.00 C ATOM 680 CE2 TYR A 43 1.599 9.643 1.349 1.00 0.00 C ATOM 681 CZ TYR A 43 2.071 10.856 0.900 1.00 0.00 C ATOM 682 OH TYR A 43 1.454 12.018 1.293 1.00 0.00 O ATOM 0 H TYR A 43 2.129 5.551 -1.412 1.00 0.00 H new ATOM 0 HA TYR A 43 3.820 7.759 -2.394 1.00 0.00 H new ATOM 0 HB2 TYR A 43 3.675 6.417 0.322 1.00 0.00 H new ATOM 0 HB3 TYR A 43 5.076 7.340 -0.185 1.00 0.00 H new ATOM 0 HD1 TYR A 43 4.629 9.784 -0.993 1.00 0.00 H new ATOM 0 HD2 TYR A 43 1.842 7.528 1.305 1.00 0.00 H new ATOM 0 HE1 TYR A 43 3.531 11.864 -0.288 1.00 0.00 H new ATOM 0 HE2 TYR A 43 0.745 9.605 2.009 1.00 0.00 H new ATOM 0 HH TYR A 43 1.747 12.755 0.717 1.00 0.00 H new ATOM 692 N PRO A 44 5.075 5.878 -3.555 1.00 0.00 N ATOM 693 CA PRO A 44 6.124 5.034 -4.114 1.00 0.00 C ATOM 694 C PRO A 44 7.496 5.455 -3.601 1.00 0.00 C ATOM 695 O PRO A 44 8.206 6.227 -4.247 1.00 0.00 O ATOM 696 CB PRO A 44 6.023 5.258 -5.631 1.00 0.00 C ATOM 697 CG PRO A 44 4.738 5.989 -5.844 1.00 0.00 C ATOM 698 CD PRO A 44 4.478 6.748 -4.576 1.00 0.00 C ATOM 0 HA PRO A 44 6.004 3.987 -3.835 1.00 0.00 H new ATOM 0 HB2 PRO A 44 6.870 5.838 -5.999 1.00 0.00 H new ATOM 0 HB3 PRO A 44 6.028 4.310 -6.169 1.00 0.00 H new ATOM 0 HG2 PRO A 44 4.811 6.665 -6.696 1.00 0.00 H new ATOM 0 HG3 PRO A 44 3.925 5.295 -6.057 1.00 0.00 H new ATOM 0 HD2 PRO A 44 4.943 7.734 -4.591 1.00 0.00 H new ATOM 0 HD3 PRO A 44 3.412 6.901 -4.406 1.00 0.00 H new ATOM 706 N LEU A 45 7.845 4.970 -2.420 1.00 0.00 N ATOM 707 CA LEU A 45 9.107 5.320 -1.791 1.00 0.00 C ATOM 708 C LEU A 45 10.249 4.497 -2.372 1.00 0.00 C ATOM 709 O LEU A 45 10.049 3.704 -3.298 1.00 0.00 O ATOM 710 CB LEU A 45 9.020 5.125 -0.274 1.00 0.00 C ATOM 711 CG LEU A 45 7.989 6.006 0.437 1.00 0.00 C ATOM 712 CD1 LEU A 45 7.978 5.714 1.926 1.00 0.00 C ATOM 713 CD2 LEU A 45 8.280 7.480 0.189 1.00 0.00 C ATOM 0 H LEU A 45 7.268 4.329 -1.876 1.00 0.00 H new ATOM 0 HA LEU A 45 9.310 6.371 -1.994 1.00 0.00 H new ATOM 0 HB2 LEU A 45 8.784 4.080 -0.071 1.00 0.00 H new ATOM 0 HB3 LEU A 45 10.001 5.320 0.158 1.00 0.00 H new ATOM 0 HG LEU A 45 7.004 5.776 0.030 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.240 6.349 2.416 1.00 0.00 H new ATOM 0 HD12 LEU A 45 7.722 4.667 2.090 1.00 0.00 H new ATOM 0 HD13 LEU A 45 8.964 5.916 2.344 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.536 8.089 0.703 1.00 0.00 H new ATOM 0 HD22 LEU A 45 9.273 7.724 0.568 1.00 0.00 H new ATOM 0 HD23 LEU A 45 8.240 7.684 -0.881 1.00 0.00 H new ATOM 725 N ASN A 46 11.439 4.685 -1.830 1.00 0.00 N ATOM 726 CA ASN A 46 12.628 4.033 -2.353 1.00 0.00 C ATOM 727 C ASN A 46 12.946 2.773 -1.558 1.00 0.00 C ATOM 728 O ASN A 46 12.702 2.707 -0.355 1.00 0.00 O ATOM 729 CB ASN A 46 13.818 5.002 -2.312 1.00 0.00 C ATOM 730 CG ASN A 46 15.117 4.375 -2.790 1.00 0.00 C ATOM 731 OD1 ASN A 46 15.415 4.366 -3.983 1.00 0.00 O ATOM 732 ND2 ASN A 46 15.909 3.864 -1.858 1.00 0.00 N ATOM 0 H ASN A 46 11.609 5.287 -1.024 1.00 0.00 H new ATOM 0 HA ASN A 46 12.439 3.745 -3.387 1.00 0.00 H new ATOM 0 HB2 ASN A 46 13.592 5.871 -2.930 1.00 0.00 H new ATOM 0 HB3 ASN A 46 13.950 5.362 -1.292 1.00 0.00 H new ATOM 0 HD21 ASN A 46 16.801 3.444 -2.121 1.00 0.00 H new ATOM 0 HD22 ASN A 46 15.627 3.890 -0.878 1.00 0.00 H new ATOM 739 N ASN A 47 13.468 1.771 -2.242 1.00 0.00 N ATOM 740 CA ASN A 47 13.920 0.558 -1.584 1.00 0.00 C ATOM 741 C ASN A 47 15.432 0.602 -1.434 1.00 0.00 C ATOM 742 O ASN A 47 16.158 0.661 -2.424 1.00 0.00 O ATOM 743 CB ASN A 47 13.492 -0.692 -2.363 1.00 0.00 C ATOM 744 CG ASN A 47 13.975 -1.981 -1.717 1.00 0.00 C ATOM 745 OD1 ASN A 47 14.255 -2.024 -0.517 1.00 0.00 O ATOM 746 ND2 ASN A 47 14.053 -3.041 -2.502 1.00 0.00 N ATOM 0 H ASN A 47 13.590 1.773 -3.255 1.00 0.00 H new ATOM 0 HA ASN A 47 13.458 0.502 -0.598 1.00 0.00 H new ATOM 0 HB2 ASN A 47 12.405 -0.713 -2.438 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.881 -0.632 -3.380 1.00 0.00 H new ATOM 0 HD21 ASN A 47 14.354 -3.938 -2.120 1.00 0.00 H new ATOM 0 HD22 ASN A 47 13.812 -2.963 -3.490 1.00 0.00 H new ATOM 753 N LEU A 48 15.893 0.610 -0.193 1.00 0.00 N ATOM 754 CA LEU A 48 17.315 0.675 0.106 1.00 0.00 C ATOM 755 C LEU A 48 18.017 -0.619 -0.290 1.00 0.00 C ATOM 756 O LEU A 48 19.243 -0.666 -0.383 1.00 0.00 O ATOM 757 CB LEU A 48 17.530 0.952 1.598 1.00 0.00 C ATOM 758 CG LEU A 48 17.271 2.393 2.062 1.00 0.00 C ATOM 759 CD1 LEU A 48 18.217 3.359 1.370 1.00 0.00 C ATOM 760 CD2 LEU A 48 15.825 2.810 1.829 1.00 0.00 C ATOM 0 H LEU A 48 15.295 0.572 0.632 1.00 0.00 H new ATOM 0 HA LEU A 48 17.746 1.490 -0.475 1.00 0.00 H new ATOM 0 HB2 LEU A 48 16.881 0.286 2.167 1.00 0.00 H new ATOM 0 HB3 LEU A 48 18.557 0.689 1.851 1.00 0.00 H new ATOM 0 HG LEU A 48 17.457 2.426 3.135 1.00 0.00 H new ATOM 0 HD11 LEU A 48 18.016 4.374 1.713 1.00 0.00 H new ATOM 0 HD12 LEU A 48 19.247 3.093 1.608 1.00 0.00 H new ATOM 0 HD13 LEU A 48 18.068 3.305 0.292 1.00 0.00 H new ATOM 0 HD21 LEU A 48 15.682 3.835 2.170 1.00 0.00 H new ATOM 0 HD22 LEU A 48 15.595 2.746 0.765 1.00 0.00 H new ATOM 0 HD23 LEU A 48 15.161 2.147 2.384 1.00 0.00 H new ATOM 772 N ASP A 49 17.239 -1.663 -0.528 1.00 0.00 N ATOM 773 CA ASP A 49 17.796 -2.951 -0.908 1.00 0.00 C ATOM 774 C ASP A 49 17.722 -3.163 -2.410 1.00 0.00 C ATOM 775 O ASP A 49 17.011 -2.454 -3.119 1.00 0.00 O ATOM 776 CB ASP A 49 17.068 -4.097 -0.201 1.00 0.00 C ATOM 777 CG ASP A 49 17.892 -4.706 0.914 1.00 0.00 C ATOM 778 OD1 ASP A 49 18.714 -5.602 0.629 1.00 0.00 O ATOM 779 OD2 ASP A 49 17.731 -4.292 2.082 1.00 0.00 O ATOM 0 H ASP A 49 16.221 -1.644 -0.465 1.00 0.00 H new ATOM 0 HA ASP A 49 18.842 -2.948 -0.602 1.00 0.00 H new ATOM 0 HB2 ASP A 49 16.127 -3.729 0.207 1.00 0.00 H new ATOM 0 HB3 ASP A 49 16.820 -4.870 -0.929 1.00 0.00 H new ATOM 784 N GLN A 50 18.489 -4.131 -2.878 1.00 0.00 N ATOM 785 CA GLN A 50 18.435 -4.583 -4.256 1.00 0.00 C ATOM 786 C GLN A 50 18.399 -6.101 -4.255 1.00 0.00 C ATOM 787 O GLN A 50 19.402 -6.766 -4.529 1.00 0.00 O ATOM 788 CB GLN A 50 19.646 -4.075 -5.043 1.00 0.00 C ATOM 789 CG GLN A 50 19.665 -2.567 -5.219 1.00 0.00 C ATOM 790 CD GLN A 50 20.918 -2.077 -5.912 1.00 0.00 C ATOM 791 OE1 GLN A 50 20.968 -1.995 -7.139 1.00 0.00 O ATOM 792 NE2 GLN A 50 21.932 -1.739 -5.131 1.00 0.00 N ATOM 0 H GLN A 50 19.172 -4.629 -2.308 1.00 0.00 H new ATOM 0 HA GLN A 50 17.542 -4.187 -4.740 1.00 0.00 H new ATOM 0 HB2 GLN A 50 20.557 -4.385 -4.532 1.00 0.00 H new ATOM 0 HB3 GLN A 50 19.655 -4.548 -6.025 1.00 0.00 H new ATOM 0 HG2 GLN A 50 18.792 -2.261 -5.796 1.00 0.00 H new ATOM 0 HG3 GLN A 50 19.584 -2.090 -4.242 1.00 0.00 H new ATOM 0 HE21 GLN A 50 21.846 -1.823 -4.118 1.00 0.00 H new ATOM 0 HE22 GLN A 50 22.799 -1.394 -5.542 1.00 0.00 H new ATOM 801 N SER A 51 17.248 -6.639 -3.898 1.00 0.00 N ATOM 802 CA SER A 51 17.109 -8.054 -3.627 1.00 0.00 C ATOM 803 C SER A 51 15.946 -8.645 -4.423 1.00 0.00 C ATOM 804 O SER A 51 15.185 -7.916 -5.056 1.00 0.00 O ATOM 805 CB SER A 51 16.896 -8.263 -2.123 1.00 0.00 C ATOM 806 OG SER A 51 17.967 -7.711 -1.367 1.00 0.00 O ATOM 0 H SER A 51 16.385 -6.107 -3.788 1.00 0.00 H new ATOM 0 HA SER A 51 18.019 -8.569 -3.936 1.00 0.00 H new ATOM 0 HB2 SER A 51 15.957 -7.800 -1.819 1.00 0.00 H new ATOM 0 HB3 SER A 51 16.810 -9.329 -1.911 1.00 0.00 H new ATOM 0 HG SER A 51 17.641 -6.946 -0.848 1.00 0.00 H new ATOM 812 N PRO A 52 15.846 -9.980 -4.476 1.00 0.00 N ATOM 813 CA PRO A 52 14.680 -10.658 -5.019 1.00 0.00 C ATOM 814 C PRO A 52 13.667 -11.040 -3.935 1.00 0.00 C ATOM 815 O PRO A 52 12.672 -11.709 -4.215 1.00 0.00 O ATOM 816 CB PRO A 52 15.304 -11.904 -5.637 1.00 0.00 C ATOM 817 CG PRO A 52 16.461 -12.233 -4.747 1.00 0.00 C ATOM 818 CD PRO A 52 16.883 -10.945 -4.070 1.00 0.00 C ATOM 0 HA PRO A 52 14.113 -10.039 -5.715 1.00 0.00 H new ATOM 0 HB2 PRO A 52 14.589 -12.726 -5.677 1.00 0.00 H new ATOM 0 HB3 PRO A 52 15.632 -11.717 -6.659 1.00 0.00 H new ATOM 0 HG2 PRO A 52 16.177 -12.982 -4.007 1.00 0.00 H new ATOM 0 HG3 PRO A 52 17.285 -12.652 -5.325 1.00 0.00 H new ATOM 0 HD2 PRO A 52 16.923 -11.057 -2.987 1.00 0.00 H new ATOM 0 HD3 PRO A 52 17.874 -10.628 -4.395 1.00 0.00 H new ATOM 826 N GLU A 53 13.918 -10.605 -2.697 1.00 0.00 N ATOM 827 CA GLU A 53 13.132 -11.066 -1.551 1.00 0.00 C ATOM 828 C GLU A 53 12.926 -9.975 -0.496 1.00 0.00 C ATOM 829 O GLU A 53 11.810 -9.767 -0.021 1.00 0.00 O ATOM 830 CB GLU A 53 13.805 -12.271 -0.878 1.00 0.00 C ATOM 831 CG GLU A 53 13.884 -13.520 -1.743 1.00 0.00 C ATOM 832 CD GLU A 53 14.488 -14.695 -1.005 1.00 0.00 C ATOM 833 OE1 GLU A 53 15.722 -14.732 -0.848 1.00 0.00 O ATOM 834 OE2 GLU A 53 13.730 -15.590 -0.578 1.00 0.00 O ATOM 0 H GLU A 53 14.654 -9.939 -2.464 1.00 0.00 H new ATOM 0 HA GLU A 53 12.157 -11.347 -1.950 1.00 0.00 H new ATOM 0 HB2 GLU A 53 14.814 -11.987 -0.581 1.00 0.00 H new ATOM 0 HB3 GLU A 53 13.260 -12.512 0.035 1.00 0.00 H new ATOM 0 HG2 GLU A 53 12.884 -13.785 -2.086 1.00 0.00 H new ATOM 0 HG3 GLU A 53 14.479 -13.307 -2.631 1.00 0.00 H new ATOM 841 N HIS A 54 14.004 -9.297 -0.106 1.00 0.00 N ATOM 842 CA HIS A 54 13.952 -8.390 1.042 1.00 0.00 C ATOM 843 C HIS A 54 14.034 -6.935 0.623 1.00 0.00 C ATOM 844 O HIS A 54 14.904 -6.539 -0.149 1.00 0.00 O ATOM 845 CB HIS A 54 15.089 -8.667 2.024 1.00 0.00 C ATOM 846 CG HIS A 54 15.046 -10.017 2.674 1.00 0.00 C ATOM 847 ND1 HIS A 54 15.870 -10.367 3.720 1.00 0.00 N ATOM 848 CD2 HIS A 54 14.279 -11.103 2.429 1.00 0.00 C ATOM 849 CE1 HIS A 54 15.615 -11.604 4.085 1.00 0.00 C ATOM 850 NE2 HIS A 54 14.651 -12.076 3.320 1.00 0.00 N ATOM 0 H HIS A 54 14.915 -9.356 -0.561 1.00 0.00 H new ATOM 0 HA HIS A 54 12.991 -8.573 1.523 1.00 0.00 H new ATOM 0 HB2 HIS A 54 16.038 -8.563 1.498 1.00 0.00 H new ATOM 0 HB3 HIS A 54 15.071 -7.904 2.802 1.00 0.00 H new ATOM 0 HD2 HIS A 54 13.514 -11.188 1.671 1.00 0.00 H new ATOM 0 HE1 HIS A 54 16.112 -12.143 4.878 1.00 0.00 H new ATOM 0 HE2 HIS A 54 14.248 -13.011 3.381 1.00 0.00 H new ATOM 859 N PHE A 55 13.158 -6.141 1.204 1.00 0.00 N ATOM 860 CA PHE A 55 13.114 -4.713 0.944 1.00 0.00 C ATOM 861 C PHE A 55 13.363 -3.944 2.233 1.00 0.00 C ATOM 862 O PHE A 55 13.017 -4.411 3.320 1.00 0.00 O ATOM 863 CB PHE A 55 11.767 -4.309 0.328 1.00 0.00 C ATOM 864 CG PHE A 55 10.564 -4.757 1.114 1.00 0.00 C ATOM 865 CD1 PHE A 55 10.030 -3.958 2.114 1.00 0.00 C ATOM 866 CD2 PHE A 55 9.961 -5.976 0.846 1.00 0.00 C ATOM 867 CE1 PHE A 55 8.921 -4.367 2.830 1.00 0.00 C ATOM 868 CE2 PHE A 55 8.853 -6.390 1.559 1.00 0.00 C ATOM 869 CZ PHE A 55 8.333 -5.586 2.552 1.00 0.00 C ATOM 0 H PHE A 55 12.456 -6.465 1.869 1.00 0.00 H new ATOM 0 HA PHE A 55 13.898 -4.467 0.227 1.00 0.00 H new ATOM 0 HB2 PHE A 55 11.738 -3.224 0.229 1.00 0.00 H new ATOM 0 HB3 PHE A 55 11.703 -4.723 -0.678 1.00 0.00 H new ATOM 0 HD1 PHE A 55 10.486 -3.005 2.336 1.00 0.00 H new ATOM 0 HD2 PHE A 55 10.363 -6.610 0.070 1.00 0.00 H new ATOM 0 HE1 PHE A 55 8.515 -3.735 3.606 1.00 0.00 H new ATOM 0 HE2 PHE A 55 8.394 -7.343 1.339 1.00 0.00 H new ATOM 0 HZ PHE A 55 7.467 -5.909 3.111 1.00 0.00 H new ATOM 879 N SER A 56 13.968 -2.777 2.110 1.00 0.00 N ATOM 880 CA SER A 56 14.263 -1.945 3.263 1.00 0.00 C ATOM 881 C SER A 56 13.868 -0.503 2.989 1.00 0.00 C ATOM 882 O SER A 56 14.091 0.018 1.895 1.00 0.00 O ATOM 883 CB SER A 56 15.750 -2.025 3.613 1.00 0.00 C ATOM 884 OG SER A 56 16.134 -3.360 3.903 1.00 0.00 O ATOM 0 H SER A 56 14.266 -2.382 1.218 1.00 0.00 H new ATOM 0 HA SER A 56 13.684 -2.313 4.110 1.00 0.00 H new ATOM 0 HB2 SER A 56 16.344 -1.645 2.782 1.00 0.00 H new ATOM 0 HB3 SER A 56 15.960 -1.388 4.472 1.00 0.00 H new ATOM 0 HG SER A 56 16.557 -3.757 3.114 1.00 0.00 H new ATOM 890 N MET A 57 13.278 0.131 3.987 1.00 0.00 N ATOM 891 CA MET A 57 12.826 1.509 3.868 1.00 0.00 C ATOM 892 C MET A 57 13.532 2.365 4.904 1.00 0.00 C ATOM 893 O MET A 57 13.962 1.854 5.943 1.00 0.00 O ATOM 894 CB MET A 57 11.311 1.582 4.069 1.00 0.00 C ATOM 895 CG MET A 57 10.525 0.726 3.089 1.00 0.00 C ATOM 896 SD MET A 57 8.760 0.677 3.464 1.00 0.00 S ATOM 897 CE MET A 57 8.335 2.410 3.330 1.00 0.00 C ATOM 0 H MET A 57 13.099 -0.291 4.898 1.00 0.00 H new ATOM 0 HA MET A 57 13.065 1.882 2.872 1.00 0.00 H new ATOM 0 HB2 MET A 57 11.072 1.268 5.085 1.00 0.00 H new ATOM 0 HB3 MET A 57 10.990 2.619 3.972 1.00 0.00 H new ATOM 0 HG2 MET A 57 10.667 1.113 2.080 1.00 0.00 H new ATOM 0 HG3 MET A 57 10.923 -0.289 3.100 1.00 0.00 H new ATOM 0 HE1 MET A 57 8.093 2.803 4.318 1.00 0.00 H new ATOM 0 HE2 MET A 57 9.180 2.961 2.917 1.00 0.00 H new ATOM 0 HE3 MET A 57 7.472 2.523 2.674 1.00 0.00 H new ATOM 907 N ASP A 58 13.679 3.650 4.625 1.00 0.00 N ATOM 908 CA ASP A 58 14.310 4.551 5.576 1.00 0.00 C ATOM 909 C ASP A 58 13.238 5.277 6.385 1.00 0.00 C ATOM 910 O ASP A 58 12.192 5.648 5.846 1.00 0.00 O ATOM 911 CB ASP A 58 15.197 5.566 4.845 1.00 0.00 C ATOM 912 CG ASP A 58 16.180 6.252 5.776 1.00 0.00 C ATOM 913 OD1 ASP A 58 15.813 7.278 6.382 1.00 0.00 O ATOM 914 OD2 ASP A 58 17.322 5.763 5.912 1.00 0.00 O ATOM 0 H ASP A 58 13.373 4.090 3.757 1.00 0.00 H new ATOM 0 HA ASP A 58 14.937 3.969 6.251 1.00 0.00 H new ATOM 0 HB2 ASP A 58 15.746 5.059 4.051 1.00 0.00 H new ATOM 0 HB3 ASP A 58 14.568 6.317 4.368 1.00 0.00 H new ATOM 919 N PRO A 59 13.478 5.499 7.684 1.00 0.00 N ATOM 920 CA PRO A 59 12.526 6.190 8.558 1.00 0.00 C ATOM 921 C PRO A 59 12.202 7.607 8.086 1.00 0.00 C ATOM 922 O PRO A 59 11.103 8.112 8.333 1.00 0.00 O ATOM 923 CB PRO A 59 13.235 6.235 9.918 1.00 0.00 C ATOM 924 CG PRO A 59 14.669 5.960 9.622 1.00 0.00 C ATOM 925 CD PRO A 59 14.676 5.066 8.420 1.00 0.00 C ATOM 0 HA PRO A 59 11.567 5.673 8.578 1.00 0.00 H new ATOM 0 HB2 PRO A 59 13.111 7.208 10.394 1.00 0.00 H new ATOM 0 HB3 PRO A 59 12.824 5.491 10.601 1.00 0.00 H new ATOM 0 HG2 PRO A 59 15.211 6.885 9.424 1.00 0.00 H new ATOM 0 HG3 PRO A 59 15.157 5.479 10.469 1.00 0.00 H new ATOM 0 HD2 PRO A 59 15.582 5.192 7.828 1.00 0.00 H new ATOM 0 HD3 PRO A 59 14.621 4.014 8.698 1.00 0.00 H new ATOM 933 N ARG A 60 13.146 8.241 7.394 1.00 0.00 N ATOM 934 CA ARG A 60 12.964 9.622 6.972 1.00 0.00 C ATOM 935 C ARG A 60 11.915 9.722 5.869 1.00 0.00 C ATOM 936 O ARG A 60 11.052 10.595 5.916 1.00 0.00 O ATOM 937 CB ARG A 60 14.291 10.247 6.517 1.00 0.00 C ATOM 938 CG ARG A 60 14.773 9.785 5.152 1.00 0.00 C ATOM 939 CD ARG A 60 16.193 10.240 4.885 1.00 0.00 C ATOM 940 NE ARG A 60 17.132 9.644 5.828 1.00 0.00 N ATOM 941 CZ ARG A 60 18.174 10.287 6.349 1.00 0.00 C ATOM 942 NH1 ARG A 60 18.432 11.543 6.000 1.00 0.00 N ATOM 943 NH2 ARG A 60 18.968 9.665 7.208 1.00 0.00 N ATOM 0 H ARG A 60 14.035 7.823 7.117 1.00 0.00 H new ATOM 0 HA ARG A 60 12.608 10.185 7.834 1.00 0.00 H new ATOM 0 HB2 ARG A 60 14.180 11.331 6.501 1.00 0.00 H new ATOM 0 HB3 ARG A 60 15.058 10.016 7.256 1.00 0.00 H new ATOM 0 HG2 ARG A 60 14.721 8.698 5.095 1.00 0.00 H new ATOM 0 HG3 ARG A 60 14.112 10.177 4.379 1.00 0.00 H new ATOM 0 HD2 ARG A 60 16.477 9.971 3.868 1.00 0.00 H new ATOM 0 HD3 ARG A 60 16.247 11.326 4.954 1.00 0.00 H new ATOM 0 HE ARG A 60 16.981 8.674 6.105 1.00 0.00 H new ATOM 0 HH11 ARG A 60 17.830 12.020 5.329 1.00 0.00 H new ATOM 0 HH12 ARG A 60 19.232 12.030 6.403 1.00 0.00 H new ATOM 0 HH21 ARG A 60 18.780 8.697 7.468 1.00 0.00 H new ATOM 0 HH22 ARG A 60 19.768 10.154 7.610 1.00 0.00 H new ATOM 957 N GLU A 61 11.965 8.817 4.893 1.00 0.00 N ATOM 958 CA GLU A 61 11.022 8.862 3.785 1.00 0.00 C ATOM 959 C GLU A 61 9.631 8.456 4.262 1.00 0.00 C ATOM 960 O GLU A 61 8.623 8.980 3.787 1.00 0.00 O ATOM 961 CB GLU A 61 11.497 7.993 2.613 1.00 0.00 C ATOM 962 CG GLU A 61 11.611 6.513 2.929 1.00 0.00 C ATOM 963 CD GLU A 61 12.321 5.747 1.835 1.00 0.00 C ATOM 964 OE1 GLU A 61 12.106 6.063 0.641 1.00 0.00 O ATOM 965 OE2 GLU A 61 13.126 4.854 2.163 1.00 0.00 O ATOM 0 H GLU A 61 12.641 8.054 4.849 1.00 0.00 H new ATOM 0 HA GLU A 61 10.968 9.887 3.417 1.00 0.00 H new ATOM 0 HB2 GLU A 61 10.806 8.121 1.780 1.00 0.00 H new ATOM 0 HB3 GLU A 61 12.469 8.356 2.280 1.00 0.00 H new ATOM 0 HG2 GLU A 61 12.149 6.384 3.868 1.00 0.00 H new ATOM 0 HG3 GLU A 61 10.614 6.096 3.073 1.00 0.00 H new ATOM 972 N GLN A 62 9.588 7.537 5.223 1.00 0.00 N ATOM 973 CA GLN A 62 8.330 7.151 5.852 1.00 0.00 C ATOM 974 C GLN A 62 7.690 8.361 6.520 1.00 0.00 C ATOM 975 O GLN A 62 6.510 8.653 6.314 1.00 0.00 O ATOM 976 CB GLN A 62 8.558 6.056 6.896 1.00 0.00 C ATOM 977 CG GLN A 62 9.081 4.747 6.328 1.00 0.00 C ATOM 978 CD GLN A 62 9.249 3.689 7.401 1.00 0.00 C ATOM 979 OE1 GLN A 62 10.311 3.562 8.012 1.00 0.00 O ATOM 980 NE2 GLN A 62 8.196 2.926 7.647 1.00 0.00 N ATOM 0 H GLN A 62 10.408 7.047 5.582 1.00 0.00 H new ATOM 0 HA GLN A 62 7.666 6.766 5.078 1.00 0.00 H new ATOM 0 HB2 GLN A 62 9.264 6.423 7.641 1.00 0.00 H new ATOM 0 HB3 GLN A 62 7.619 5.864 7.414 1.00 0.00 H new ATOM 0 HG2 GLN A 62 8.394 4.383 5.564 1.00 0.00 H new ATOM 0 HG3 GLN A 62 10.039 4.921 5.838 1.00 0.00 H new ATOM 0 HE21 GLN A 62 7.334 3.062 7.120 1.00 0.00 H new ATOM 0 HE22 GLN A 62 8.247 2.202 8.364 1.00 0.00 H new ATOM 989 N LEU A 63 8.492 9.075 7.304 1.00 0.00 N ATOM 990 CA LEU A 63 8.027 10.255 8.018 1.00 0.00 C ATOM 991 C LEU A 63 7.613 11.353 7.040 1.00 0.00 C ATOM 992 O LEU A 63 6.605 12.025 7.246 1.00 0.00 O ATOM 993 CB LEU A 63 9.127 10.767 8.952 1.00 0.00 C ATOM 994 CG LEU A 63 8.766 12.005 9.774 1.00 0.00 C ATOM 995 CD1 LEU A 63 7.607 11.709 10.718 1.00 0.00 C ATOM 996 CD2 LEU A 63 9.981 12.498 10.550 1.00 0.00 C ATOM 0 H LEU A 63 9.475 8.853 7.460 1.00 0.00 H new ATOM 0 HA LEU A 63 7.155 9.979 8.610 1.00 0.00 H new ATOM 0 HB2 LEU A 63 9.401 9.964 9.637 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.011 10.993 8.355 1.00 0.00 H new ATOM 0 HG LEU A 63 8.450 12.792 9.090 1.00 0.00 H new ATOM 0 HD11 LEU A 63 7.368 12.604 11.292 1.00 0.00 H new ATOM 0 HD12 LEU A 63 6.735 11.405 10.139 1.00 0.00 H new ATOM 0 HD13 LEU A 63 7.888 10.906 11.399 1.00 0.00 H new ATOM 0 HD21 LEU A 63 9.709 13.380 11.130 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.326 11.713 11.223 1.00 0.00 H new ATOM 0 HD23 LEU A 63 10.778 12.755 9.853 1.00 0.00 H new ATOM 1008 N THR A 64 8.390 11.512 5.971 1.00 0.00 N ATOM 1009 CA THR A 64 8.109 12.522 4.953 1.00 0.00 C ATOM 1010 C THR A 64 6.723 12.304 4.330 1.00 0.00 C ATOM 1011 O THR A 64 5.997 13.261 4.045 1.00 0.00 O ATOM 1012 CB THR A 64 9.194 12.517 3.847 1.00 0.00 C ATOM 1013 OG1 THR A 64 10.497 12.671 4.438 1.00 0.00 O ATOM 1014 CG2 THR A 64 8.958 13.647 2.851 1.00 0.00 C ATOM 0 H THR A 64 9.222 10.952 5.787 1.00 0.00 H new ATOM 0 HA THR A 64 8.121 13.495 5.445 1.00 0.00 H new ATOM 0 HB THR A 64 9.138 11.565 3.320 1.00 0.00 H new ATOM 0 HG1 THR A 64 10.732 11.856 4.928 1.00 0.00 H new ATOM 0 HG21 THR A 64 9.732 13.623 2.084 1.00 0.00 H new ATOM 0 HG22 THR A 64 7.981 13.523 2.384 1.00 0.00 H new ATOM 0 HG23 THR A 64 8.992 14.604 3.372 1.00 0.00 H new ATOM 1022 N ALA A 65 6.352 11.041 4.156 1.00 0.00 N ATOM 1023 CA ALA A 65 5.051 10.694 3.604 1.00 0.00 C ATOM 1024 C ALA A 65 3.933 11.065 4.573 1.00 0.00 C ATOM 1025 O ALA A 65 2.925 11.657 4.180 1.00 0.00 O ATOM 1026 CB ALA A 65 5.011 9.211 3.270 1.00 0.00 C ATOM 0 H ALA A 65 6.937 10.239 4.391 1.00 0.00 H new ATOM 0 HA ALA A 65 4.896 11.263 2.687 1.00 0.00 H new ATOM 0 HB1 ALA A 65 4.035 8.957 2.857 1.00 0.00 H new ATOM 0 HB2 ALA A 65 5.785 8.982 2.538 1.00 0.00 H new ATOM 0 HB3 ALA A 65 5.184 8.629 4.175 1.00 0.00 H new ATOM 1032 N VAL A 66 4.128 10.733 5.845 1.00 0.00 N ATOM 1033 CA VAL A 66 3.152 11.049 6.882 1.00 0.00 C ATOM 1034 C VAL A 66 3.051 12.561 7.069 1.00 0.00 C ATOM 1035 O VAL A 66 1.974 13.102 7.317 1.00 0.00 O ATOM 1036 CB VAL A 66 3.519 10.382 8.227 1.00 0.00 C ATOM 1037 CG1 VAL A 66 2.460 10.665 9.282 1.00 0.00 C ATOM 1038 CG2 VAL A 66 3.708 8.883 8.047 1.00 0.00 C ATOM 0 H VAL A 66 4.956 10.243 6.183 1.00 0.00 H new ATOM 0 HA VAL A 66 2.188 10.657 6.559 1.00 0.00 H new ATOM 0 HB VAL A 66 4.461 10.810 8.570 1.00 0.00 H new ATOM 0 HG11 VAL A 66 2.742 10.185 10.219 1.00 0.00 H new ATOM 0 HG12 VAL A 66 2.378 11.741 9.436 1.00 0.00 H new ATOM 0 HG13 VAL A 66 1.500 10.273 8.948 1.00 0.00 H new ATOM 0 HG21 VAL A 66 3.966 8.431 9.005 1.00 0.00 H new ATOM 0 HG22 VAL A 66 2.783 8.442 7.675 1.00 0.00 H new ATOM 0 HG23 VAL A 66 4.510 8.701 7.332 1.00 0.00 H new ATOM 1048 N LYS A 67 4.186 13.224 6.910 1.00 0.00 N ATOM 1049 CA LYS A 67 4.294 14.670 7.046 1.00 0.00 C ATOM 1050 C LYS A 67 3.359 15.381 6.070 1.00 0.00 C ATOM 1051 O LYS A 67 2.632 16.302 6.450 1.00 0.00 O ATOM 1052 CB LYS A 67 5.748 15.068 6.779 1.00 0.00 C ATOM 1053 CG LYS A 67 6.073 16.534 6.982 1.00 0.00 C ATOM 1054 CD LYS A 67 7.514 16.799 6.582 1.00 0.00 C ATOM 1055 CE LYS A 67 7.923 18.241 6.803 1.00 0.00 C ATOM 1056 NZ LYS A 67 9.272 18.505 6.242 1.00 0.00 N ATOM 0 H LYS A 67 5.069 12.768 6.680 1.00 0.00 H new ATOM 0 HA LYS A 67 4.002 14.967 8.053 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.393 14.478 7.430 1.00 0.00 H new ATOM 0 HB3 LYS A 67 5.997 14.798 5.753 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.401 17.151 6.386 1.00 0.00 H new ATOM 0 HG3 LYS A 67 5.918 16.810 8.025 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.172 16.146 7.155 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.648 16.544 5.531 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.195 18.905 6.336 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.919 18.464 7.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.528 19.499 6.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.968 17.887 6.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.266 18.314 5.220 1.00 0.00 H new ATOM 1070 N ASP A 68 3.366 14.931 4.820 1.00 0.00 N ATOM 1071 CA ASP A 68 2.502 15.507 3.791 1.00 0.00 C ATOM 1072 C ASP A 68 1.044 15.186 4.090 1.00 0.00 C ATOM 1073 O ASP A 68 0.163 16.044 3.983 1.00 0.00 O ATOM 1074 CB ASP A 68 2.872 14.957 2.410 1.00 0.00 C ATOM 1075 CG ASP A 68 2.190 15.709 1.277 1.00 0.00 C ATOM 1076 OD1 ASP A 68 1.008 15.434 0.994 1.00 0.00 O ATOM 1077 OD2 ASP A 68 2.841 16.577 0.653 1.00 0.00 O ATOM 0 H ASP A 68 3.960 14.169 4.493 1.00 0.00 H new ATOM 0 HA ASP A 68 2.642 16.588 3.792 1.00 0.00 H new ATOM 0 HB2 ASP A 68 3.953 15.013 2.279 1.00 0.00 H new ATOM 0 HB3 ASP A 68 2.598 13.903 2.358 1.00 0.00 H new ATOM 1082 N MET A 69 0.805 13.944 4.491 1.00 0.00 N ATOM 1083 CA MET A 69 -0.548 13.468 4.750 1.00 0.00 C ATOM 1084 C MET A 69 -1.194 14.186 5.926 1.00 0.00 C ATOM 1085 O MET A 69 -2.315 14.679 5.807 1.00 0.00 O ATOM 1086 CB MET A 69 -0.554 11.964 5.013 1.00 0.00 C ATOM 1087 CG MET A 69 -0.310 11.129 3.773 1.00 0.00 C ATOM 1088 SD MET A 69 -0.510 9.364 4.068 1.00 0.00 S ATOM 1089 CE MET A 69 0.839 9.032 5.199 1.00 0.00 C ATOM 0 H MET A 69 1.533 13.246 4.644 1.00 0.00 H new ATOM 0 HA MET A 69 -1.131 13.686 3.855 1.00 0.00 H new ATOM 0 HB2 MET A 69 0.211 11.730 5.754 1.00 0.00 H new ATOM 0 HB3 MET A 69 -1.514 11.683 5.446 1.00 0.00 H new ATOM 0 HG2 MET A 69 -0.999 11.442 2.989 1.00 0.00 H new ATOM 0 HG3 MET A 69 0.698 11.319 3.405 1.00 0.00 H new ATOM 0 HE1 MET A 69 1.053 7.963 5.206 1.00 0.00 H new ATOM 0 HE2 MET A 69 1.726 9.578 4.878 1.00 0.00 H new ATOM 0 HE3 MET A 69 0.560 9.352 6.203 1.00 0.00 H new ATOM 1099 N ARG A 70 -0.484 14.280 7.045 1.00 0.00 N ATOM 1100 CA ARG A 70 -1.058 14.862 8.256 1.00 0.00 C ATOM 1101 C ARG A 70 -1.333 16.348 8.061 1.00 0.00 C ATOM 1102 O ARG A 70 -2.185 16.932 8.731 1.00 0.00 O ATOM 1103 CB ARG A 70 -0.140 14.641 9.461 1.00 0.00 C ATOM 1104 CG ARG A 70 1.162 15.419 9.411 1.00 0.00 C ATOM 1105 CD ARG A 70 2.046 15.073 10.594 1.00 0.00 C ATOM 1106 NE ARG A 70 3.167 15.999 10.740 1.00 0.00 N ATOM 1107 CZ ARG A 70 4.077 15.916 11.711 1.00 0.00 C ATOM 1108 NH1 ARG A 70 4.050 14.898 12.566 1.00 0.00 N ATOM 1109 NH2 ARG A 70 5.028 16.835 11.817 1.00 0.00 N ATOM 0 H ARG A 70 0.481 13.964 7.140 1.00 0.00 H new ATOM 0 HA ARG A 70 -2.004 14.358 8.454 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -0.679 14.917 10.368 1.00 0.00 H new ATOM 0 HB3 ARG A 70 0.089 13.578 9.537 1.00 0.00 H new ATOM 0 HG2 ARG A 70 1.687 15.197 8.482 1.00 0.00 H new ATOM 0 HG3 ARG A 70 0.951 16.488 9.410 1.00 0.00 H new ATOM 0 HD2 ARG A 70 1.449 15.083 11.506 1.00 0.00 H new ATOM 0 HD3 ARG A 70 2.429 14.059 10.474 1.00 0.00 H new ATOM 0 HE ARG A 70 3.259 16.753 10.059 1.00 0.00 H new ATOM 0 HH11 ARG A 70 3.332 14.179 12.480 1.00 0.00 H new ATOM 0 HH12 ARG A 70 4.747 14.837 13.308 1.00 0.00 H new ATOM 0 HH21 ARG A 70 5.065 17.609 11.154 1.00 0.00 H new ATOM 0 HH22 ARG A 70 5.722 16.767 12.561 1.00 0.00 H new ATOM 1123 N LYS A 71 -0.600 16.945 7.134 1.00 0.00 N ATOM 1124 CA LYS A 71 -0.787 18.340 6.773 1.00 0.00 C ATOM 1125 C LYS A 71 -2.136 18.538 6.081 1.00 0.00 C ATOM 1126 O LYS A 71 -2.827 19.529 6.311 1.00 0.00 O ATOM 1127 CB LYS A 71 0.352 18.774 5.854 1.00 0.00 C ATOM 1128 CG LYS A 71 0.304 20.234 5.443 1.00 0.00 C ATOM 1129 CD LYS A 71 1.537 20.612 4.639 1.00 0.00 C ATOM 1130 CE LYS A 71 1.437 22.022 4.085 1.00 0.00 C ATOM 1131 NZ LYS A 71 2.681 22.427 3.383 1.00 0.00 N ATOM 0 H LYS A 71 0.140 16.476 6.612 1.00 0.00 H new ATOM 0 HA LYS A 71 -0.779 18.951 7.675 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.301 18.581 6.355 1.00 0.00 H new ATOM 0 HB3 LYS A 71 0.334 18.156 4.957 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -0.592 20.420 4.851 1.00 0.00 H new ATOM 0 HG3 LYS A 71 0.236 20.864 6.330 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.422 20.531 5.270 1.00 0.00 H new ATOM 0 HD3 LYS A 71 1.666 19.907 3.818 1.00 0.00 H new ATOM 0 HE2 LYS A 71 0.594 22.083 3.396 1.00 0.00 H new ATOM 0 HE3 LYS A 71 1.235 22.719 4.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 2.575 23.395 3.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 3.481 22.393 4.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.860 21.777 2.591 1.00 0.00 H new ATOM 1145 N ASN A 72 -2.508 17.578 5.241 1.00 0.00 N ATOM 1146 CA ASN A 72 -3.762 17.662 4.490 1.00 0.00 C ATOM 1147 C ASN A 72 -4.920 17.032 5.270 1.00 0.00 C ATOM 1148 O ASN A 72 -6.087 17.337 5.026 1.00 0.00 O ATOM 1149 CB ASN A 72 -3.609 16.974 3.127 1.00 0.00 C ATOM 1150 CG ASN A 72 -4.848 17.110 2.251 1.00 0.00 C ATOM 1151 OD1 ASN A 72 -5.002 18.088 1.521 1.00 0.00 O ATOM 1152 ND2 ASN A 72 -5.732 16.125 2.306 1.00 0.00 N ATOM 0 H ASN A 72 -1.964 16.734 5.061 1.00 0.00 H new ATOM 0 HA ASN A 72 -3.992 18.716 4.336 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -2.753 17.400 2.605 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -3.394 15.917 3.282 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -6.574 16.162 1.731 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -5.571 15.329 2.923 1.00 0.00 H new ATOM 1159 N GLY A 73 -4.596 16.169 6.223 1.00 0.00 N ATOM 1160 CA GLY A 73 -5.630 15.538 7.028 1.00 0.00 C ATOM 1161 C GLY A 73 -5.710 14.037 6.818 1.00 0.00 C ATOM 1162 O GLY A 73 -6.642 13.386 7.292 1.00 0.00 O ATOM 0 H GLY A 73 -3.642 15.894 6.455 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -5.438 15.742 8.081 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -6.594 15.985 6.787 1.00 0.00 H new ATOM 1166 N TRP A 74 -4.736 13.488 6.107 1.00 0.00 N ATOM 1167 CA TRP A 74 -4.679 12.055 5.861 1.00 0.00 C ATOM 1168 C TRP A 74 -3.886 11.351 6.953 1.00 0.00 C ATOM 1169 O TRP A 74 -3.148 11.984 7.714 1.00 0.00 O ATOM 1170 CB TRP A 74 -4.046 11.749 4.499 1.00 0.00 C ATOM 1171 CG TRP A 74 -4.928 12.050 3.328 1.00 0.00 C ATOM 1172 CD1 TRP A 74 -6.232 11.678 3.172 1.00 0.00 C ATOM 1173 CD2 TRP A 74 -4.565 12.751 2.132 1.00 0.00 C ATOM 1174 NE1 TRP A 74 -6.705 12.109 1.958 1.00 0.00 N ATOM 1175 CE2 TRP A 74 -5.701 12.774 1.300 1.00 0.00 C ATOM 1176 CE3 TRP A 74 -3.391 13.367 1.688 1.00 0.00 C ATOM 1177 CZ2 TRP A 74 -5.694 13.387 0.047 1.00 0.00 C ATOM 1178 CZ3 TRP A 74 -3.386 13.974 0.446 1.00 0.00 C ATOM 1179 CH2 TRP A 74 -4.530 13.982 -0.362 1.00 0.00 C ATOM 0 H TRP A 74 -3.971 14.017 5.688 1.00 0.00 H new ATOM 0 HA TRP A 74 -5.704 11.685 5.863 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -3.125 12.324 4.402 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -3.769 10.695 4.469 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -6.808 11.125 3.899 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -7.649 11.959 1.603 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -2.504 13.369 2.304 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -6.575 13.392 -0.578 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -2.484 14.451 0.092 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -4.494 14.467 -1.326 1.00 0.00 H new ATOM 1190 N VAL A 75 -4.044 10.041 7.018 1.00 0.00 N ATOM 1191 CA VAL A 75 -3.320 9.218 7.970 1.00 0.00 C ATOM 1192 C VAL A 75 -2.611 8.086 7.241 1.00 0.00 C ATOM 1193 O VAL A 75 -2.992 7.724 6.124 1.00 0.00 O ATOM 1194 CB VAL A 75 -4.257 8.620 9.045 1.00 0.00 C ATOM 1195 CG1 VAL A 75 -4.911 9.721 9.870 1.00 0.00 C ATOM 1196 CG2 VAL A 75 -5.315 7.723 8.410 1.00 0.00 C ATOM 0 H VAL A 75 -4.677 9.518 6.413 1.00 0.00 H new ATOM 0 HA VAL A 75 -2.594 9.859 8.470 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.651 8.008 9.713 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.565 9.275 10.619 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.140 10.310 10.366 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.496 10.367 9.216 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -5.961 7.315 9.188 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -5.914 8.306 7.710 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -4.828 6.906 7.878 1.00 0.00 H new ATOM 1206 N MET A 76 -1.578 7.534 7.862 1.00 0.00 N ATOM 1207 CA MET A 76 -0.862 6.412 7.278 1.00 0.00 C ATOM 1208 C MET A 76 -1.666 5.131 7.455 1.00 0.00 C ATOM 1209 O MET A 76 -1.747 4.584 8.557 1.00 0.00 O ATOM 1210 CB MET A 76 0.524 6.258 7.909 1.00 0.00 C ATOM 1211 CG MET A 76 1.341 5.112 7.318 1.00 0.00 C ATOM 1212 SD MET A 76 2.980 4.951 8.056 1.00 0.00 S ATOM 1213 CE MET A 76 2.559 4.597 9.762 1.00 0.00 C ATOM 0 H MET A 76 -1.220 7.844 8.765 1.00 0.00 H new ATOM 0 HA MET A 76 -0.730 6.606 6.214 1.00 0.00 H new ATOM 0 HB2 MET A 76 1.076 7.189 7.784 1.00 0.00 H new ATOM 0 HB3 MET A 76 0.410 6.097 8.981 1.00 0.00 H new ATOM 0 HG2 MET A 76 0.796 4.178 7.454 1.00 0.00 H new ATOM 0 HG3 MET A 76 1.447 5.266 6.244 1.00 0.00 H new ATOM 0 HE1 MET A 76 3.422 4.164 10.267 1.00 0.00 H new ATOM 0 HE2 MET A 76 2.270 5.520 10.265 1.00 0.00 H new ATOM 0 HE3 MET A 76 1.728 3.892 9.793 1.00 0.00 H new ATOM 1223 N LEU A 77 -2.271 4.671 6.369 1.00 0.00 N ATOM 1224 CA LEU A 77 -3.093 3.469 6.402 1.00 0.00 C ATOM 1225 C LEU A 77 -2.219 2.232 6.540 1.00 0.00 C ATOM 1226 O LEU A 77 -2.569 1.281 7.240 1.00 0.00 O ATOM 1227 CB LEU A 77 -3.947 3.368 5.131 1.00 0.00 C ATOM 1228 CG LEU A 77 -4.914 4.530 4.902 1.00 0.00 C ATOM 1229 CD1 LEU A 77 -5.664 4.343 3.593 1.00 0.00 C ATOM 1230 CD2 LEU A 77 -5.889 4.650 6.063 1.00 0.00 C ATOM 0 H LEU A 77 -2.208 5.113 5.452 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.755 3.530 7.266 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -3.282 3.295 4.271 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -4.520 2.442 5.170 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.338 5.453 4.842 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.349 5.178 3.443 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.952 4.305 2.768 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.229 3.412 3.627 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.569 5.482 5.882 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.461 3.727 6.154 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.336 4.827 6.986 1.00 0.00 H new ATOM 1242 N GLY A 78 -1.077 2.259 5.872 1.00 0.00 N ATOM 1243 CA GLY A 78 -0.162 1.143 5.912 1.00 0.00 C ATOM 1244 C GLY A 78 0.852 1.223 4.796 1.00 0.00 C ATOM 1245 O GLY A 78 1.299 2.316 4.440 1.00 0.00 O ATOM 0 H GLY A 78 -0.767 3.043 5.298 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.352 1.126 6.873 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -0.720 0.210 5.833 1.00 0.00 H new ATOM 1249 N ASN A 79 1.194 0.083 4.223 1.00 0.00 N ATOM 1250 CA ASN A 79 2.174 0.040 3.151 1.00 0.00 C ATOM 1251 C ASN A 79 1.759 -0.962 2.087 1.00 0.00 C ATOM 1252 O ASN A 79 0.766 -1.677 2.238 1.00 0.00 O ATOM 1253 CB ASN A 79 3.578 -0.294 3.689 1.00 0.00 C ATOM 1254 CG ASN A 79 3.700 -1.664 4.345 1.00 0.00 C ATOM 1255 OD1 ASN A 79 3.022 -2.622 3.979 1.00 0.00 O ATOM 1256 ND2 ASN A 79 4.587 -1.762 5.323 1.00 0.00 N ATOM 0 H ASN A 79 0.808 -0.825 4.481 1.00 0.00 H new ATOM 0 HA ASN A 79 2.216 1.031 2.699 1.00 0.00 H new ATOM 0 HB2 ASN A 79 4.291 -0.236 2.866 1.00 0.00 H new ATOM 0 HB3 ASN A 79 3.865 0.468 4.414 1.00 0.00 H new ATOM 0 HD21 ASN A 79 4.725 -2.654 5.799 1.00 0.00 H new ATOM 0 HD22 ASN A 79 5.132 -0.946 5.601 1.00 0.00 H new ATOM 1263 N PHE A 80 2.519 -1.007 1.013 1.00 0.00 N ATOM 1264 CA PHE A 80 2.265 -1.949 -0.058 1.00 0.00 C ATOM 1265 C PHE A 80 3.582 -2.447 -0.619 1.00 0.00 C ATOM 1266 O PHE A 80 4.596 -1.747 -0.559 1.00 0.00 O ATOM 1267 CB PHE A 80 1.421 -1.308 -1.171 1.00 0.00 C ATOM 1268 CG PHE A 80 2.146 -0.273 -1.991 1.00 0.00 C ATOM 1269 CD1 PHE A 80 2.334 1.013 -1.510 1.00 0.00 C ATOM 1270 CD2 PHE A 80 2.632 -0.589 -3.250 1.00 0.00 C ATOM 1271 CE1 PHE A 80 2.994 1.961 -2.265 1.00 0.00 C ATOM 1272 CE2 PHE A 80 3.293 0.358 -4.009 1.00 0.00 C ATOM 1273 CZ PHE A 80 3.475 1.634 -3.516 1.00 0.00 C ATOM 0 H PHE A 80 3.323 -0.398 0.858 1.00 0.00 H new ATOM 0 HA PHE A 80 1.701 -2.790 0.346 1.00 0.00 H new ATOM 0 HB2 PHE A 80 1.063 -2.094 -1.836 1.00 0.00 H new ATOM 0 HB3 PHE A 80 0.542 -0.846 -0.722 1.00 0.00 H new ATOM 0 HD1 PHE A 80 1.959 1.277 -0.532 1.00 0.00 H new ATOM 0 HD2 PHE A 80 2.493 -1.586 -3.642 1.00 0.00 H new ATOM 0 HE1 PHE A 80 3.134 2.959 -1.877 1.00 0.00 H new ATOM 0 HE2 PHE A 80 3.667 0.099 -4.988 1.00 0.00 H new ATOM 0 HZ PHE A 80 3.992 2.375 -4.108 1.00 0.00 H new ATOM 1283 N HIS A 81 3.575 -3.661 -1.133 1.00 0.00 N ATOM 1284 CA HIS A 81 4.754 -4.214 -1.768 1.00 0.00 C ATOM 1285 C HIS A 81 4.357 -5.300 -2.753 1.00 0.00 C ATOM 1286 O HIS A 81 3.348 -5.985 -2.569 1.00 0.00 O ATOM 1287 CB HIS A 81 5.762 -4.737 -0.728 1.00 0.00 C ATOM 1288 CG HIS A 81 5.273 -5.864 0.133 1.00 0.00 C ATOM 1289 ND1 HIS A 81 4.706 -5.677 1.377 1.00 0.00 N ATOM 1290 CD2 HIS A 81 5.313 -7.202 -0.061 1.00 0.00 C ATOM 1291 CE1 HIS A 81 4.423 -6.852 1.909 1.00 0.00 C ATOM 1292 NE2 HIS A 81 4.782 -7.793 1.056 1.00 0.00 N ATOM 0 H HIS A 81 2.766 -4.283 -1.123 1.00 0.00 H new ATOM 0 HA HIS A 81 5.252 -3.417 -2.319 1.00 0.00 H new ATOM 0 HB2 HIS A 81 6.660 -5.065 -1.251 1.00 0.00 H new ATOM 0 HB3 HIS A 81 6.054 -3.909 -0.082 1.00 0.00 H new ATOM 0 HD2 HIS A 81 5.693 -7.711 -0.935 1.00 0.00 H new ATOM 0 HE1 HIS A 81 3.974 -7.015 2.878 1.00 0.00 H new ATOM 0 HE2 HIS A 81 4.681 -8.797 1.204 1.00 0.00 H new ATOM 1301 N SER A 82 5.154 -5.456 -3.789 1.00 0.00 N ATOM 1302 CA SER A 82 4.837 -6.372 -4.866 1.00 0.00 C ATOM 1303 C SER A 82 5.823 -7.526 -4.897 1.00 0.00 C ATOM 1304 O SER A 82 6.946 -7.407 -4.405 1.00 0.00 O ATOM 1305 CB SER A 82 4.876 -5.614 -6.195 1.00 0.00 C ATOM 1306 OG SER A 82 6.064 -4.844 -6.302 1.00 0.00 O ATOM 0 H SER A 82 6.035 -4.955 -3.909 1.00 0.00 H new ATOM 0 HA SER A 82 3.840 -6.782 -4.704 1.00 0.00 H new ATOM 0 HB2 SER A 82 4.819 -6.320 -7.023 1.00 0.00 H new ATOM 0 HB3 SER A 82 4.006 -4.962 -6.272 1.00 0.00 H new ATOM 0 HG SER A 82 6.233 -4.632 -7.244 1.00 0.00 H new ATOM 1312 N HIS A 83 5.396 -8.652 -5.447 1.00 0.00 N ATOM 1313 CA HIS A 83 6.301 -9.764 -5.663 1.00 0.00 C ATOM 1314 C HIS A 83 6.698 -9.800 -7.136 1.00 0.00 C ATOM 1315 O HIS A 83 5.859 -9.560 -8.006 1.00 0.00 O ATOM 1316 CB HIS A 83 5.643 -11.094 -5.264 1.00 0.00 C ATOM 1317 CG HIS A 83 5.385 -11.257 -3.789 1.00 0.00 C ATOM 1318 ND1 HIS A 83 4.292 -11.937 -3.289 1.00 0.00 N ATOM 1319 CD2 HIS A 83 6.096 -10.850 -2.702 1.00 0.00 C ATOM 1320 CE1 HIS A 83 4.342 -11.942 -1.967 1.00 0.00 C ATOM 1321 NE2 HIS A 83 5.424 -11.291 -1.587 1.00 0.00 N ATOM 0 H HIS A 83 4.436 -8.817 -5.749 1.00 0.00 H new ATOM 0 HA HIS A 83 7.186 -9.628 -5.041 1.00 0.00 H new ATOM 0 HB2 HIS A 83 4.696 -11.188 -5.796 1.00 0.00 H new ATOM 0 HB3 HIS A 83 6.280 -11.913 -5.599 1.00 0.00 H new ATOM 0 HD1 HIS A 83 3.559 -12.369 -3.852 1.00 0.00 H new ATOM 0 HD2 HIS A 83 7.017 -10.286 -2.713 1.00 0.00 H new ATOM 0 HE1 HIS A 83 3.619 -12.402 -1.310 1.00 0.00 H new ATOM 0 HE2 HIS A 83 5.715 -11.139 -0.621 1.00 0.00 H new ATOM 1330 N PRO A 84 7.972 -10.098 -7.434 1.00 0.00 N ATOM 1331 CA PRO A 84 8.467 -10.167 -8.817 1.00 0.00 C ATOM 1332 C PRO A 84 7.845 -11.312 -9.613 1.00 0.00 C ATOM 1333 O PRO A 84 7.274 -11.101 -10.684 1.00 0.00 O ATOM 1334 CB PRO A 84 9.979 -10.383 -8.656 1.00 0.00 C ATOM 1335 CG PRO A 84 10.283 -9.994 -7.247 1.00 0.00 C ATOM 1336 CD PRO A 84 9.050 -10.324 -6.458 1.00 0.00 C ATOM 0 HA PRO A 84 8.210 -9.267 -9.376 1.00 0.00 H new ATOM 0 HB2 PRO A 84 10.251 -11.422 -8.845 1.00 0.00 H new ATOM 0 HB3 PRO A 84 10.541 -9.773 -9.363 1.00 0.00 H new ATOM 0 HG2 PRO A 84 11.147 -10.539 -6.868 1.00 0.00 H new ATOM 0 HG3 PRO A 84 10.520 -8.932 -7.177 1.00 0.00 H new ATOM 0 HD2 PRO A 84 9.062 -11.353 -6.099 1.00 0.00 H new ATOM 0 HD3 PRO A 84 8.945 -9.682 -5.583 1.00 0.00 H new ATOM 1344 N ALA A 85 7.959 -12.523 -9.090 1.00 0.00 N ATOM 1345 CA ALA A 85 7.417 -13.697 -9.758 1.00 0.00 C ATOM 1346 C ALA A 85 6.766 -14.629 -8.745 1.00 0.00 C ATOM 1347 O ALA A 85 7.222 -15.750 -8.525 1.00 0.00 O ATOM 1348 CB ALA A 85 8.512 -14.420 -10.531 1.00 0.00 C ATOM 0 H ALA A 85 8.423 -12.719 -8.203 1.00 0.00 H new ATOM 0 HA ALA A 85 6.654 -13.375 -10.467 1.00 0.00 H new ATOM 0 HB1 ALA A 85 8.091 -15.296 -11.025 1.00 0.00 H new ATOM 0 HB2 ALA A 85 8.933 -13.749 -11.279 1.00 0.00 H new ATOM 0 HB3 ALA A 85 9.297 -14.734 -9.843 1.00 0.00 H new ATOM 1354 N THR A 86 5.719 -14.133 -8.103 1.00 0.00 N ATOM 1355 CA THR A 86 4.998 -14.888 -7.089 1.00 0.00 C ATOM 1356 C THR A 86 3.586 -14.322 -6.925 1.00 0.00 C ATOM 1357 O THR A 86 3.358 -13.143 -7.209 1.00 0.00 O ATOM 1358 CB THR A 86 5.740 -14.847 -5.734 1.00 0.00 C ATOM 1359 OG1 THR A 86 6.873 -13.972 -5.825 1.00 0.00 O ATOM 1360 CG2 THR A 86 6.209 -16.234 -5.317 1.00 0.00 C ATOM 0 H THR A 86 5.346 -13.198 -8.269 1.00 0.00 H new ATOM 0 HA THR A 86 4.938 -15.926 -7.415 1.00 0.00 H new ATOM 0 HB THR A 86 5.043 -14.477 -4.982 1.00 0.00 H new ATOM 0 HG1 THR A 86 7.338 -13.949 -4.963 1.00 0.00 H new ATOM 0 HG21 THR A 86 6.727 -16.170 -4.360 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.348 -16.895 -5.220 1.00 0.00 H new ATOM 0 HG23 THR A 86 6.888 -16.631 -6.072 1.00 0.00 H new ATOM 1368 N PRO A 87 2.624 -15.144 -6.472 1.00 0.00 N ATOM 1369 CA PRO A 87 1.221 -14.730 -6.333 1.00 0.00 C ATOM 1370 C PRO A 87 1.014 -13.659 -5.263 1.00 0.00 C ATOM 1371 O PRO A 87 1.920 -13.350 -4.476 1.00 0.00 O ATOM 1372 CB PRO A 87 0.494 -16.022 -5.931 1.00 0.00 C ATOM 1373 CG PRO A 87 1.440 -17.125 -6.262 1.00 0.00 C ATOM 1374 CD PRO A 87 2.811 -16.549 -6.078 1.00 0.00 C ATOM 0 HA PRO A 87 0.853 -14.281 -7.256 1.00 0.00 H new ATOM 0 HB2 PRO A 87 0.248 -16.021 -4.869 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -0.444 -16.131 -6.476 1.00 0.00 H new ATOM 0 HG2 PRO A 87 1.285 -17.984 -5.609 1.00 0.00 H new ATOM 0 HG3 PRO A 87 1.295 -17.472 -7.285 1.00 0.00 H new ATOM 0 HD2 PRO A 87 3.153 -16.639 -5.047 1.00 0.00 H new ATOM 0 HD3 PRO A 87 3.549 -17.051 -6.704 1.00 0.00 H new ATOM 1382 N ALA A 88 -0.189 -13.102 -5.237 1.00 0.00 N ATOM 1383 CA ALA A 88 -0.539 -12.067 -4.276 1.00 0.00 C ATOM 1384 C ALA A 88 -0.982 -12.681 -2.950 1.00 0.00 C ATOM 1385 O ALA A 88 -2.177 -12.848 -2.696 1.00 0.00 O ATOM 1386 CB ALA A 88 -1.629 -11.153 -4.835 1.00 0.00 C ATOM 0 H ALA A 88 -0.944 -13.353 -5.876 1.00 0.00 H new ATOM 0 HA ALA A 88 0.351 -11.466 -4.092 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -1.874 -10.387 -4.099 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -1.272 -10.677 -5.748 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -2.519 -11.742 -5.057 1.00 0.00 H new ATOM 1392 N ARG A 89 -0.009 -13.053 -2.133 1.00 0.00 N ATOM 1393 CA ARG A 89 -0.271 -13.578 -0.804 1.00 0.00 C ATOM 1394 C ARG A 89 1.010 -13.471 0.018 1.00 0.00 C ATOM 1395 O ARG A 89 2.102 -13.631 -0.525 1.00 0.00 O ATOM 1396 CB ARG A 89 -0.743 -15.038 -0.899 1.00 0.00 C ATOM 1397 CG ARG A 89 -1.680 -15.461 0.221 1.00 0.00 C ATOM 1398 CD ARG A 89 -2.228 -16.857 -0.009 1.00 0.00 C ATOM 1399 NE ARG A 89 -3.283 -17.186 0.949 1.00 0.00 N ATOM 1400 CZ ARG A 89 -3.977 -18.325 0.945 1.00 0.00 C ATOM 1401 NH1 ARG A 89 -3.746 -19.248 0.023 1.00 0.00 N ATOM 1402 NH2 ARG A 89 -4.919 -18.529 1.859 1.00 0.00 N ATOM 0 H ARG A 89 0.981 -12.999 -2.372 1.00 0.00 H new ATOM 0 HA ARG A 89 -1.061 -13.004 -0.319 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -1.247 -15.184 -1.854 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.129 -15.692 -0.895 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -1.149 -15.430 1.172 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -2.505 -14.753 0.293 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -2.620 -16.932 -1.023 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -1.420 -17.584 0.075 1.00 0.00 H new ATOM 0 HE ARG A 89 -3.503 -16.498 1.669 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -3.034 -19.090 -0.690 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -4.280 -20.117 0.026 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -5.110 -17.815 2.562 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -5.451 -19.399 1.858 1.00 0.00 H new ATOM 1416 N PRO A 90 0.905 -13.168 1.319 1.00 0.00 N ATOM 1417 CA PRO A 90 2.074 -13.008 2.188 1.00 0.00 C ATOM 1418 C PRO A 90 2.733 -14.338 2.545 1.00 0.00 C ATOM 1419 O PRO A 90 2.070 -15.262 3.020 1.00 0.00 O ATOM 1420 CB PRO A 90 1.507 -12.349 3.455 1.00 0.00 C ATOM 1421 CG PRO A 90 0.094 -11.988 3.134 1.00 0.00 C ATOM 1422 CD PRO A 90 -0.342 -12.930 2.053 1.00 0.00 C ATOM 0 HA PRO A 90 2.852 -12.424 1.696 1.00 0.00 H new ATOM 0 HB2 PRO A 90 1.552 -13.032 4.303 1.00 0.00 H new ATOM 0 HB3 PRO A 90 2.084 -11.465 3.726 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -0.542 -12.084 4.014 1.00 0.00 H new ATOM 0 HG3 PRO A 90 0.023 -10.953 2.801 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -0.755 -13.852 2.461 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -1.110 -12.490 1.417 1.00 0.00 H new ATOM 1430 N SER A 91 4.034 -14.429 2.316 1.00 0.00 N ATOM 1431 CA SER A 91 4.802 -15.601 2.701 1.00 0.00 C ATOM 1432 C SER A 91 5.419 -15.390 4.084 1.00 0.00 C ATOM 1433 O SER A 91 5.146 -14.384 4.741 1.00 0.00 O ATOM 1434 CB SER A 91 5.898 -15.867 1.666 1.00 0.00 C ATOM 1435 OG SER A 91 5.343 -16.100 0.381 1.00 0.00 O ATOM 0 H SER A 91 4.583 -13.699 1.862 1.00 0.00 H new ATOM 0 HA SER A 91 4.139 -16.465 2.742 1.00 0.00 H new ATOM 0 HB2 SER A 91 6.576 -15.015 1.623 1.00 0.00 H new ATOM 0 HB3 SER A 91 6.489 -16.730 1.972 1.00 0.00 H new ATOM 0 HG SER A 91 6.064 -16.265 -0.262 1.00 0.00 H new ATOM 1441 N ALA A 92 6.237 -16.341 4.524 1.00 0.00 N ATOM 1442 CA ALA A 92 6.931 -16.233 5.805 1.00 0.00 C ATOM 1443 C ALA A 92 7.733 -14.938 5.898 1.00 0.00 C ATOM 1444 O ALA A 92 7.762 -14.292 6.948 1.00 0.00 O ATOM 1445 CB ALA A 92 7.840 -17.432 6.009 1.00 0.00 C ATOM 0 H ALA A 92 6.437 -17.199 4.010 1.00 0.00 H new ATOM 0 HA ALA A 92 6.179 -16.216 6.594 1.00 0.00 H new ATOM 0 HB1 ALA A 92 8.352 -17.341 6.967 1.00 0.00 H new ATOM 0 HB2 ALA A 92 7.245 -18.345 6.001 1.00 0.00 H new ATOM 0 HB3 ALA A 92 8.576 -17.471 5.206 1.00 0.00 H new ATOM 1451 N GLU A 93 8.367 -14.554 4.794 1.00 0.00 N ATOM 1452 CA GLU A 93 9.145 -13.324 4.749 1.00 0.00 C ATOM 1453 C GLU A 93 8.244 -12.111 4.944 1.00 0.00 C ATOM 1454 O GLU A 93 8.544 -11.233 5.749 1.00 0.00 O ATOM 1455 CB GLU A 93 9.900 -13.211 3.422 1.00 0.00 C ATOM 1456 CG GLU A 93 10.906 -14.329 3.200 1.00 0.00 C ATOM 1457 CD GLU A 93 11.956 -14.398 4.291 1.00 0.00 C ATOM 1458 OE1 GLU A 93 11.637 -14.855 5.404 1.00 0.00 O ATOM 1459 OE2 GLU A 93 13.110 -13.995 4.045 1.00 0.00 O ATOM 0 H GLU A 93 8.356 -15.078 3.919 1.00 0.00 H new ATOM 0 HA GLU A 93 9.871 -13.353 5.562 1.00 0.00 H new ATOM 0 HB2 GLU A 93 9.181 -13.212 2.603 1.00 0.00 H new ATOM 0 HB3 GLU A 93 10.420 -12.253 3.389 1.00 0.00 H new ATOM 0 HG2 GLU A 93 10.379 -15.282 3.149 1.00 0.00 H new ATOM 0 HG3 GLU A 93 11.397 -14.184 2.238 1.00 0.00 H new ATOM 1466 N ASP A 94 7.131 -12.087 4.218 1.00 0.00 N ATOM 1467 CA ASP A 94 6.168 -10.994 4.320 1.00 0.00 C ATOM 1468 C ASP A 94 5.593 -10.924 5.730 1.00 0.00 C ATOM 1469 O ASP A 94 5.329 -9.844 6.255 1.00 0.00 O ATOM 1470 CB ASP A 94 5.016 -11.180 3.322 1.00 0.00 C ATOM 1471 CG ASP A 94 5.468 -11.289 1.880 1.00 0.00 C ATOM 1472 OD1 ASP A 94 5.813 -12.405 1.448 1.00 0.00 O ATOM 1473 OD2 ASP A 94 5.448 -10.267 1.163 1.00 0.00 O ATOM 0 H ASP A 94 6.872 -12.814 3.551 1.00 0.00 H new ATOM 0 HA ASP A 94 6.694 -10.068 4.089 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.459 -12.079 3.587 1.00 0.00 H new ATOM 0 HB3 ASP A 94 4.328 -10.340 3.415 1.00 0.00 H new ATOM 1478 N LYS A 95 5.412 -12.095 6.331 1.00 0.00 N ATOM 1479 CA LYS A 95 4.798 -12.211 7.646 1.00 0.00 C ATOM 1480 C LYS A 95 5.668 -11.573 8.727 1.00 0.00 C ATOM 1481 O LYS A 95 5.181 -10.783 9.536 1.00 0.00 O ATOM 1482 CB LYS A 95 4.561 -13.690 7.973 1.00 0.00 C ATOM 1483 CG LYS A 95 3.159 -14.007 8.478 1.00 0.00 C ATOM 1484 CD LYS A 95 2.866 -13.363 9.826 1.00 0.00 C ATOM 1485 CE LYS A 95 3.759 -13.911 10.927 1.00 0.00 C ATOM 1486 NZ LYS A 95 3.422 -13.326 12.252 1.00 0.00 N ATOM 0 H LYS A 95 5.686 -12.988 5.920 1.00 0.00 H new ATOM 0 HA LYS A 95 3.846 -11.680 7.626 1.00 0.00 H new ATOM 0 HB2 LYS A 95 4.754 -14.283 7.079 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.284 -14.003 8.726 1.00 0.00 H new ATOM 0 HG2 LYS A 95 2.427 -13.663 7.748 1.00 0.00 H new ATOM 0 HG3 LYS A 95 3.042 -15.087 8.562 1.00 0.00 H new ATOM 0 HD2 LYS A 95 3.005 -12.285 9.750 1.00 0.00 H new ATOM 0 HD3 LYS A 95 1.822 -13.532 10.089 1.00 0.00 H new ATOM 0 HE2 LYS A 95 3.657 -14.995 10.972 1.00 0.00 H new ATOM 0 HE3 LYS A 95 4.801 -13.698 10.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 3.475 -14.065 12.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 4.096 -12.567 12.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 2.458 -12.936 12.224 1.00 0.00 H new ATOM 1500 N ARG A 96 6.954 -11.908 8.739 1.00 0.00 N ATOM 1501 CA ARG A 96 7.849 -11.406 9.778 1.00 0.00 C ATOM 1502 C ARG A 96 8.242 -9.951 9.538 1.00 0.00 C ATOM 1503 O ARG A 96 8.703 -9.274 10.454 1.00 0.00 O ATOM 1504 CB ARG A 96 9.093 -12.288 9.941 1.00 0.00 C ATOM 1505 CG ARG A 96 9.949 -12.442 8.698 1.00 0.00 C ATOM 1506 CD ARG A 96 11.209 -13.230 9.024 1.00 0.00 C ATOM 1507 NE ARG A 96 12.018 -13.532 7.846 1.00 0.00 N ATOM 1508 CZ ARG A 96 13.343 -13.667 7.874 1.00 0.00 C ATOM 1509 NH1 ARG A 96 14.013 -13.471 9.007 1.00 0.00 N ATOM 1510 NH2 ARG A 96 13.992 -14.003 6.769 1.00 0.00 N ATOM 0 H ARG A 96 7.397 -12.517 8.051 1.00 0.00 H new ATOM 0 HA ARG A 96 7.290 -11.448 10.713 1.00 0.00 H new ATOM 0 HB2 ARG A 96 9.710 -11.872 10.737 1.00 0.00 H new ATOM 0 HB3 ARG A 96 8.775 -13.278 10.268 1.00 0.00 H new ATOM 0 HG2 ARG A 96 9.383 -12.952 7.919 1.00 0.00 H new ATOM 0 HG3 ARG A 96 10.216 -11.460 8.307 1.00 0.00 H new ATOM 0 HD2 ARG A 96 11.811 -12.664 9.735 1.00 0.00 H new ATOM 0 HD3 ARG A 96 10.930 -14.163 9.514 1.00 0.00 H new ATOM 0 HE ARG A 96 11.542 -13.646 6.951 1.00 0.00 H new ATOM 0 HH11 ARG A 96 13.512 -13.216 9.858 1.00 0.00 H new ATOM 0 HH12 ARG A 96 15.027 -13.575 9.024 1.00 0.00 H new ATOM 0 HH21 ARG A 96 13.477 -14.157 5.902 1.00 0.00 H new ATOM 0 HH22 ARG A 96 15.006 -14.108 6.785 1.00 0.00 H new ATOM 1524 N LEU A 97 8.060 -9.470 8.313 1.00 0.00 N ATOM 1525 CA LEU A 97 8.341 -8.077 7.997 1.00 0.00 C ATOM 1526 C LEU A 97 7.183 -7.174 8.422 1.00 0.00 C ATOM 1527 O LEU A 97 7.201 -5.963 8.185 1.00 0.00 O ATOM 1528 CB LEU A 97 8.621 -7.912 6.500 1.00 0.00 C ATOM 1529 CG LEU A 97 9.911 -8.569 6.000 1.00 0.00 C ATOM 1530 CD1 LEU A 97 10.094 -8.318 4.511 1.00 0.00 C ATOM 1531 CD2 LEU A 97 11.114 -8.055 6.780 1.00 0.00 C ATOM 0 H LEU A 97 7.720 -10.023 7.526 1.00 0.00 H new ATOM 0 HA LEU A 97 9.229 -7.778 8.554 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.781 -8.327 5.942 1.00 0.00 H new ATOM 0 HB3 LEU A 97 8.662 -6.847 6.270 1.00 0.00 H new ATOM 0 HG LEU A 97 9.833 -9.644 6.162 1.00 0.00 H new ATOM 0 HD11 LEU A 97 11.015 -8.792 4.173 1.00 0.00 H new ATOM 0 HD12 LEU A 97 9.249 -8.737 3.965 1.00 0.00 H new ATOM 0 HD13 LEU A 97 10.149 -7.245 4.327 1.00 0.00 H new ATOM 0 HD21 LEU A 97 12.020 -8.534 6.409 1.00 0.00 H new ATOM 0 HD22 LEU A 97 11.196 -6.976 6.652 1.00 0.00 H new ATOM 0 HD23 LEU A 97 10.988 -8.287 7.838 1.00 0.00 H new ATOM 1543 N ALA A 98 6.182 -7.766 9.056 1.00 0.00 N ATOM 1544 CA ALA A 98 5.041 -7.018 9.551 1.00 0.00 C ATOM 1545 C ALA A 98 5.033 -7.008 11.074 1.00 0.00 C ATOM 1546 O ALA A 98 4.636 -7.984 11.715 1.00 0.00 O ATOM 1547 CB ALA A 98 3.749 -7.605 9.012 1.00 0.00 C ATOM 0 H ALA A 98 6.139 -8.768 9.240 1.00 0.00 H new ATOM 0 HA ALA A 98 5.122 -5.989 9.202 1.00 0.00 H new ATOM 0 HB1 ALA A 98 2.903 -7.033 9.392 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.756 -7.562 7.923 1.00 0.00 H new ATOM 0 HB3 ALA A 98 3.659 -8.643 9.333 1.00 0.00 H new ATOM 1553 N PHE A 99 5.482 -5.903 11.647 1.00 0.00 N ATOM 1554 CA PHE A 99 5.589 -5.778 13.097 1.00 0.00 C ATOM 1555 C PHE A 99 4.399 -5.012 13.660 1.00 0.00 C ATOM 1556 O PHE A 99 4.254 -4.870 14.876 1.00 0.00 O ATOM 1557 CB PHE A 99 6.891 -5.066 13.483 1.00 0.00 C ATOM 1558 CG PHE A 99 8.134 -5.788 13.043 1.00 0.00 C ATOM 1559 CD1 PHE A 99 8.664 -6.813 13.810 1.00 0.00 C ATOM 1560 CD2 PHE A 99 8.776 -5.435 11.867 1.00 0.00 C ATOM 1561 CE1 PHE A 99 9.806 -7.478 13.409 1.00 0.00 C ATOM 1562 CE2 PHE A 99 9.919 -6.096 11.461 1.00 0.00 C ATOM 1563 CZ PHE A 99 10.437 -7.116 12.234 1.00 0.00 C ATOM 0 H PHE A 99 5.780 -5.075 11.131 1.00 0.00 H new ATOM 0 HA PHE A 99 5.595 -6.782 13.521 1.00 0.00 H new ATOM 0 HB2 PHE A 99 6.890 -4.067 13.048 1.00 0.00 H new ATOM 0 HB3 PHE A 99 6.919 -4.942 14.566 1.00 0.00 H new ATOM 0 HD1 PHE A 99 8.178 -7.095 14.732 1.00 0.00 H new ATOM 0 HD2 PHE A 99 8.378 -4.634 11.261 1.00 0.00 H new ATOM 0 HE1 PHE A 99 10.205 -8.280 14.013 1.00 0.00 H new ATOM 0 HE2 PHE A 99 10.407 -5.815 10.539 1.00 0.00 H new ATOM 0 HZ PHE A 99 11.334 -7.630 11.921 1.00 0.00 H new ATOM 1573 N ASP A 100 3.553 -4.513 12.769 1.00 0.00 N ATOM 1574 CA ASP A 100 2.365 -3.771 13.173 1.00 0.00 C ATOM 1575 C ASP A 100 1.127 -4.352 12.501 1.00 0.00 C ATOM 1576 O ASP A 100 0.756 -3.944 11.400 1.00 0.00 O ATOM 1577 CB ASP A 100 2.501 -2.287 12.829 1.00 0.00 C ATOM 1578 CG ASP A 100 1.479 -1.425 13.553 1.00 0.00 C ATOM 1579 OD1 ASP A 100 0.298 -1.413 13.149 1.00 0.00 O ATOM 1580 OD2 ASP A 100 1.863 -0.742 14.530 1.00 0.00 O ATOM 0 H ASP A 100 3.667 -4.608 11.760 1.00 0.00 H new ATOM 0 HA ASP A 100 2.260 -3.863 14.254 1.00 0.00 H new ATOM 0 HB2 ASP A 100 3.505 -1.948 13.086 1.00 0.00 H new ATOM 0 HB3 ASP A 100 2.386 -2.155 11.753 1.00 0.00 H new ATOM 1585 N PRO A 101 0.504 -5.358 13.130 1.00 0.00 N ATOM 1586 CA PRO A 101 -0.672 -6.049 12.578 1.00 0.00 C ATOM 1587 C PRO A 101 -1.892 -5.138 12.433 1.00 0.00 C ATOM 1588 O PRO A 101 -2.925 -5.550 11.901 1.00 0.00 O ATOM 1589 CB PRO A 101 -0.960 -7.154 13.605 1.00 0.00 C ATOM 1590 CG PRO A 101 0.295 -7.287 14.396 1.00 0.00 C ATOM 1591 CD PRO A 101 0.900 -5.917 14.428 1.00 0.00 C ATOM 0 HA PRO A 101 -0.475 -6.416 11.571 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -1.802 -6.888 14.244 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -1.217 -8.092 13.113 1.00 0.00 H new ATOM 0 HG2 PRO A 101 0.087 -7.647 15.404 1.00 0.00 H new ATOM 0 HG3 PRO A 101 0.974 -8.004 13.935 1.00 0.00 H new ATOM 0 HD2 PRO A 101 0.516 -5.324 15.258 1.00 0.00 H new ATOM 0 HD3 PRO A 101 1.984 -5.956 14.538 1.00 0.00 H new ATOM 1599 N SER A 102 -1.771 -3.905 12.906 1.00 0.00 N ATOM 1600 CA SER A 102 -2.876 -2.964 12.869 1.00 0.00 C ATOM 1601 C SER A 102 -2.804 -2.089 11.617 1.00 0.00 C ATOM 1602 O SER A 102 -3.700 -1.282 11.363 1.00 0.00 O ATOM 1603 CB SER A 102 -2.869 -2.098 14.135 1.00 0.00 C ATOM 1604 OG SER A 102 -3.962 -1.193 14.154 1.00 0.00 O ATOM 0 H SER A 102 -0.916 -3.535 13.320 1.00 0.00 H new ATOM 0 HA SER A 102 -3.810 -3.525 12.832 1.00 0.00 H new ATOM 0 HB2 SER A 102 -2.911 -2.739 15.015 1.00 0.00 H new ATOM 0 HB3 SER A 102 -1.934 -1.541 14.191 1.00 0.00 H new ATOM 0 HG SER A 102 -4.181 -0.925 13.237 1.00 0.00 H new ATOM 1610 N LEU A 103 -1.736 -2.241 10.844 1.00 0.00 N ATOM 1611 CA LEU A 103 -1.576 -1.484 9.607 1.00 0.00 C ATOM 1612 C LEU A 103 -2.257 -2.189 8.436 1.00 0.00 C ATOM 1613 O LEU A 103 -2.709 -3.329 8.555 1.00 0.00 O ATOM 1614 CB LEU A 103 -0.092 -1.270 9.288 1.00 0.00 C ATOM 1615 CG LEU A 103 0.623 -0.219 10.140 1.00 0.00 C ATOM 1616 CD1 LEU A 103 2.107 -0.179 9.805 1.00 0.00 C ATOM 1617 CD2 LEU A 103 -0.003 1.152 9.929 1.00 0.00 C ATOM 0 H LEU A 103 -0.968 -2.880 11.051 1.00 0.00 H new ATOM 0 HA LEU A 103 -2.052 -0.514 9.754 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.427 -2.221 9.405 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.002 -0.985 8.240 1.00 0.00 H new ATOM 0 HG LEU A 103 0.512 -0.494 11.189 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.599 0.574 10.421 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.551 -1.155 10.002 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.236 0.072 8.752 1.00 0.00 H new ATOM 0 HD21 LEU A 103 0.517 1.888 10.542 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.079 1.432 8.879 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.054 1.120 10.215 1.00 0.00 H new ATOM 1629 N SER A 104 -2.334 -1.496 7.310 1.00 0.00 N ATOM 1630 CA SER A 104 -2.905 -2.059 6.099 1.00 0.00 C ATOM 1631 C SER A 104 -1.791 -2.512 5.159 1.00 0.00 C ATOM 1632 O SER A 104 -0.938 -1.715 4.772 1.00 0.00 O ATOM 1633 CB SER A 104 -3.789 -1.016 5.413 1.00 0.00 C ATOM 1634 OG SER A 104 -4.688 -0.430 6.345 1.00 0.00 O ATOM 0 H SER A 104 -2.005 -0.536 7.211 1.00 0.00 H new ATOM 0 HA SER A 104 -3.515 -2.924 6.357 1.00 0.00 H new ATOM 0 HB2 SER A 104 -3.166 -0.242 4.965 1.00 0.00 H new ATOM 0 HB3 SER A 104 -4.350 -1.483 4.603 1.00 0.00 H new ATOM 0 HG SER A 104 -4.221 0.261 6.859 1.00 0.00 H new ATOM 1640 N TYR A 105 -1.787 -3.791 4.814 1.00 0.00 N ATOM 1641 CA TYR A 105 -0.768 -4.340 3.931 1.00 0.00 C ATOM 1642 C TYR A 105 -1.394 -4.800 2.622 1.00 0.00 C ATOM 1643 O TYR A 105 -2.320 -5.613 2.619 1.00 0.00 O ATOM 1644 CB TYR A 105 -0.047 -5.516 4.603 1.00 0.00 C ATOM 1645 CG TYR A 105 0.673 -5.146 5.883 1.00 0.00 C ATOM 1646 CD1 TYR A 105 -0.015 -5.042 7.085 1.00 0.00 C ATOM 1647 CD2 TYR A 105 2.040 -4.892 5.888 1.00 0.00 C ATOM 1648 CE1 TYR A 105 0.635 -4.694 8.251 1.00 0.00 C ATOM 1649 CE2 TYR A 105 2.698 -4.546 7.054 1.00 0.00 C ATOM 1650 CZ TYR A 105 1.990 -4.445 8.232 1.00 0.00 C ATOM 1651 OH TYR A 105 2.635 -4.097 9.396 1.00 0.00 O ATOM 0 H TYR A 105 -2.479 -4.469 5.132 1.00 0.00 H new ATOM 0 HA TYR A 105 -0.041 -3.556 3.722 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -0.774 -6.298 4.820 1.00 0.00 H new ATOM 0 HB3 TYR A 105 0.673 -5.936 3.901 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -1.077 -5.237 7.107 1.00 0.00 H new ATOM 0 HD2 TYR A 105 2.597 -4.966 4.966 1.00 0.00 H new ATOM 0 HE1 TYR A 105 0.083 -4.617 9.176 1.00 0.00 H new ATOM 0 HE2 TYR A 105 3.761 -4.356 7.042 1.00 0.00 H new ATOM 0 HH TYR A 105 1.987 -4.057 10.130 1.00 0.00 H new ATOM 1661 N LEU A 106 -0.912 -4.257 1.516 1.00 0.00 N ATOM 1662 CA LEU A 106 -1.384 -4.667 0.200 1.00 0.00 C ATOM 1663 C LEU A 106 -0.311 -5.450 -0.540 1.00 0.00 C ATOM 1664 O LEU A 106 0.872 -5.093 -0.514 1.00 0.00 O ATOM 1665 CB LEU A 106 -1.827 -3.461 -0.637 1.00 0.00 C ATOM 1666 CG LEU A 106 -3.254 -2.965 -0.378 1.00 0.00 C ATOM 1667 CD1 LEU A 106 -3.394 -2.390 1.022 1.00 0.00 C ATOM 1668 CD2 LEU A 106 -3.656 -1.933 -1.420 1.00 0.00 C ATOM 0 H LEU A 106 -0.195 -3.532 1.501 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.249 -5.313 0.351 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -1.136 -2.639 -0.451 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -1.737 -3.721 -1.692 1.00 0.00 H new ATOM 0 HG LEU A 106 -3.924 -3.821 -0.456 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -4.417 -2.047 1.174 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.156 -3.159 1.757 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.709 -1.551 1.141 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.672 -1.592 -1.221 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.973 -1.085 -1.375 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.612 -2.382 -2.412 1.00 0.00 H new ATOM 1680 N ILE A 107 -0.731 -6.521 -1.193 1.00 0.00 N ATOM 1681 CA ILE A 107 0.178 -7.368 -1.946 1.00 0.00 C ATOM 1682 C ILE A 107 -0.137 -7.268 -3.434 1.00 0.00 C ATOM 1683 O ILE A 107 -1.261 -7.554 -3.860 1.00 0.00 O ATOM 1684 CB ILE A 107 0.083 -8.851 -1.510 1.00 0.00 C ATOM 1685 CG1 ILE A 107 0.222 -8.986 0.012 1.00 0.00 C ATOM 1686 CG2 ILE A 107 1.149 -9.686 -2.217 1.00 0.00 C ATOM 1687 CD1 ILE A 107 1.556 -8.523 0.552 1.00 0.00 C ATOM 0 H ILE A 107 -1.704 -6.826 -1.216 1.00 0.00 H new ATOM 0 HA ILE A 107 1.191 -7.018 -1.746 1.00 0.00 H new ATOM 0 HB ILE A 107 -0.900 -9.225 -1.796 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -0.571 -8.412 0.491 1.00 0.00 H new ATOM 0 HG13 ILE A 107 0.072 -10.030 0.289 1.00 0.00 H new ATOM 0 HG21 ILE A 107 1.067 -10.725 -1.899 1.00 0.00 H new ATOM 0 HG22 ILE A 107 1.003 -9.624 -3.295 1.00 0.00 H new ATOM 0 HG23 ILE A 107 2.138 -9.305 -1.962 1.00 0.00 H new ATOM 0 HD11 ILE A 107 1.575 -8.651 1.634 1.00 0.00 H new ATOM 0 HD12 ILE A 107 2.355 -9.113 0.103 1.00 0.00 H new ATOM 0 HD13 ILE A 107 1.702 -7.471 0.308 1.00 0.00 H new ATOM 1699 N ILE A 108 0.846 -6.854 -4.216 1.00 0.00 N ATOM 1700 CA ILE A 108 0.666 -6.713 -5.653 1.00 0.00 C ATOM 1701 C ILE A 108 1.351 -7.867 -6.382 1.00 0.00 C ATOM 1702 O ILE A 108 2.514 -8.185 -6.110 1.00 0.00 O ATOM 1703 CB ILE A 108 1.242 -5.374 -6.170 1.00 0.00 C ATOM 1704 CG1 ILE A 108 0.689 -4.189 -5.362 1.00 0.00 C ATOM 1705 CG2 ILE A 108 0.937 -5.193 -7.656 1.00 0.00 C ATOM 1706 CD1 ILE A 108 -0.811 -4.023 -5.466 1.00 0.00 C ATOM 0 H ILE A 108 1.778 -6.609 -3.881 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.405 -6.728 -5.853 1.00 0.00 H new ATOM 0 HB ILE A 108 2.324 -5.401 -6.039 1.00 0.00 H new ATOM 0 HG12 ILE A 108 0.958 -4.319 -4.314 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.171 -3.273 -5.703 1.00 0.00 H new ATOM 0 HG21 ILE A 108 1.351 -4.245 -8.000 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.384 -6.010 -8.221 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.142 -5.194 -7.809 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -1.125 -3.167 -4.869 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -1.088 -3.860 -6.508 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -1.303 -4.923 -5.096 1.00 0.00 H new ATOM 1718 N SER A 109 0.629 -8.497 -7.295 1.00 0.00 N ATOM 1719 CA SER A 109 1.162 -9.623 -8.044 1.00 0.00 C ATOM 1720 C SER A 109 1.381 -9.250 -9.507 1.00 0.00 C ATOM 1721 O SER A 109 0.447 -8.853 -10.207 1.00 0.00 O ATOM 1722 CB SER A 109 0.208 -10.815 -7.944 1.00 0.00 C ATOM 1723 OG SER A 109 0.694 -11.938 -8.660 1.00 0.00 O ATOM 0 H SER A 109 -0.330 -8.247 -7.535 1.00 0.00 H new ATOM 0 HA SER A 109 2.125 -9.896 -7.613 1.00 0.00 H new ATOM 0 HB2 SER A 109 0.070 -11.083 -6.897 1.00 0.00 H new ATOM 0 HB3 SER A 109 -0.770 -10.532 -8.332 1.00 0.00 H new ATOM 0 HG SER A 109 1.484 -12.298 -8.206 1.00 0.00 H new ATOM 1729 N LEU A 110 2.622 -9.367 -9.962 1.00 0.00 N ATOM 1730 CA LEU A 110 2.951 -9.140 -11.364 1.00 0.00 C ATOM 1731 C LEU A 110 3.130 -10.469 -12.087 1.00 0.00 C ATOM 1732 O LEU A 110 3.610 -10.512 -13.221 1.00 0.00 O ATOM 1733 CB LEU A 110 4.222 -8.294 -11.500 1.00 0.00 C ATOM 1734 CG LEU A 110 4.002 -6.779 -11.554 1.00 0.00 C ATOM 1735 CD1 LEU A 110 3.163 -6.405 -12.765 1.00 0.00 C ATOM 1736 CD2 LEU A 110 3.348 -6.277 -10.277 1.00 0.00 C ATOM 0 H LEU A 110 3.420 -9.619 -9.379 1.00 0.00 H new ATOM 0 HA LEU A 110 2.125 -8.595 -11.820 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.879 -8.519 -10.660 1.00 0.00 H new ATOM 0 HB3 LEU A 110 4.746 -8.600 -12.405 1.00 0.00 H new ATOM 0 HG LEU A 110 4.977 -6.299 -11.645 1.00 0.00 H new ATOM 0 HD11 LEU A 110 3.017 -5.325 -12.787 1.00 0.00 H new ATOM 0 HD12 LEU A 110 3.675 -6.720 -13.674 1.00 0.00 H new ATOM 0 HD13 LEU A 110 2.194 -6.901 -12.704 1.00 0.00 H new ATOM 0 HD21 LEU A 110 3.203 -5.199 -10.342 1.00 0.00 H new ATOM 0 HD22 LEU A 110 2.382 -6.765 -10.146 1.00 0.00 H new ATOM 0 HD23 LEU A 110 3.989 -6.506 -9.426 1.00 0.00 H new ATOM 1748 N ALA A 111 2.729 -11.551 -11.422 1.00 0.00 N ATOM 1749 CA ALA A 111 2.828 -12.886 -11.996 1.00 0.00 C ATOM 1750 C ALA A 111 1.934 -13.011 -13.227 1.00 0.00 C ATOM 1751 O ALA A 111 2.293 -13.672 -14.204 1.00 0.00 O ATOM 1752 CB ALA A 111 2.455 -13.939 -10.961 1.00 0.00 C ATOM 0 H ALA A 111 2.332 -11.526 -10.483 1.00 0.00 H new ATOM 0 HA ALA A 111 3.861 -13.051 -12.303 1.00 0.00 H new ATOM 0 HB1 ALA A 111 2.534 -14.931 -11.406 1.00 0.00 H new ATOM 0 HB2 ALA A 111 3.132 -13.868 -10.110 1.00 0.00 H new ATOM 0 HB3 ALA A 111 1.431 -13.773 -10.625 1.00 0.00 H new ATOM 1758 N GLU A 112 0.778 -12.363 -13.173 1.00 0.00 N ATOM 1759 CA GLU A 112 -0.169 -12.361 -14.281 1.00 0.00 C ATOM 1760 C GLU A 112 -0.524 -10.916 -14.645 1.00 0.00 C ATOM 1761 O GLU A 112 -1.498 -10.358 -14.144 1.00 0.00 O ATOM 1762 CB GLU A 112 -1.417 -13.166 -13.900 1.00 0.00 C ATOM 1763 CG GLU A 112 -2.415 -13.350 -15.030 1.00 0.00 C ATOM 1764 CD GLU A 112 -3.537 -14.293 -14.649 1.00 0.00 C ATOM 1765 OE1 GLU A 112 -4.527 -13.837 -14.040 1.00 0.00 O ATOM 1766 OE2 GLU A 112 -3.431 -15.500 -14.943 1.00 0.00 O ATOM 0 H GLU A 112 0.471 -11.825 -12.363 1.00 0.00 H new ATOM 0 HA GLU A 112 0.280 -12.833 -15.155 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -1.106 -14.148 -13.543 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -1.916 -12.668 -13.069 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -2.833 -12.382 -15.305 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -1.900 -13.736 -15.909 1.00 0.00 H new ATOM 1773 N PRO A 113 0.302 -10.280 -15.494 1.00 0.00 N ATOM 1774 CA PRO A 113 0.181 -8.851 -15.797 1.00 0.00 C ATOM 1775 C PRO A 113 -0.985 -8.489 -16.712 1.00 0.00 C ATOM 1776 O PRO A 113 -1.338 -7.312 -16.823 1.00 0.00 O ATOM 1777 CB PRO A 113 1.512 -8.523 -16.471 1.00 0.00 C ATOM 1778 CG PRO A 113 1.936 -9.800 -17.105 1.00 0.00 C ATOM 1779 CD PRO A 113 1.438 -10.900 -16.205 1.00 0.00 C ATOM 0 HA PRO A 113 -0.025 -8.283 -14.890 1.00 0.00 H new ATOM 0 HB2 PRO A 113 1.397 -7.732 -17.212 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.249 -8.176 -15.746 1.00 0.00 H new ATOM 0 HG2 PRO A 113 1.516 -9.896 -18.106 1.00 0.00 H new ATOM 0 HG3 PRO A 113 3.020 -9.842 -17.209 1.00 0.00 H new ATOM 0 HD2 PRO A 113 1.125 -11.774 -16.776 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.211 -11.232 -15.512 1.00 0.00 H new ATOM 1787 N GLN A 114 -1.581 -9.477 -17.363 1.00 0.00 N ATOM 1788 CA GLN A 114 -2.728 -9.213 -18.230 1.00 0.00 C ATOM 1789 C GLN A 114 -3.911 -8.745 -17.394 1.00 0.00 C ATOM 1790 O GLN A 114 -4.713 -7.919 -17.826 1.00 0.00 O ATOM 1791 CB GLN A 114 -3.104 -10.448 -19.052 1.00 0.00 C ATOM 1792 CG GLN A 114 -3.545 -11.642 -18.220 1.00 0.00 C ATOM 1793 CD GLN A 114 -3.947 -12.822 -19.080 1.00 0.00 C ATOM 1794 OE1 GLN A 114 -5.115 -12.974 -19.444 1.00 0.00 O ATOM 1795 NE2 GLN A 114 -2.983 -13.658 -19.424 1.00 0.00 N ATOM 0 H GLN A 114 -1.298 -10.456 -17.312 1.00 0.00 H new ATOM 0 HA GLN A 114 -2.452 -8.425 -18.931 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -3.907 -10.182 -19.739 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -2.248 -10.740 -19.660 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -2.734 -11.939 -17.555 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -4.385 -11.352 -17.588 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -2.029 -13.497 -19.102 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -3.193 -14.465 -20.012 1.00 0.00 H new ATOM 1804 N LYS A 115 -3.991 -9.275 -16.183 1.00 0.00 N ATOM 1805 CA LYS A 115 -4.983 -8.865 -15.209 1.00 0.00 C ATOM 1806 C LYS A 115 -4.332 -8.852 -13.834 1.00 0.00 C ATOM 1807 O LYS A 115 -4.450 -9.814 -13.074 1.00 0.00 O ATOM 1808 CB LYS A 115 -6.193 -9.808 -15.217 1.00 0.00 C ATOM 1809 CG LYS A 115 -7.120 -9.630 -16.412 1.00 0.00 C ATOM 1810 CD LYS A 115 -7.790 -8.261 -16.402 1.00 0.00 C ATOM 1811 CE LYS A 115 -8.768 -8.093 -17.559 1.00 0.00 C ATOM 1812 NZ LYS A 115 -9.867 -9.094 -17.516 1.00 0.00 N ATOM 0 H LYS A 115 -3.364 -10.007 -15.849 1.00 0.00 H new ATOM 0 HA LYS A 115 -5.346 -7.869 -15.463 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -5.836 -10.838 -15.199 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -6.765 -9.653 -14.302 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -6.553 -9.752 -17.335 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -7.882 -10.409 -16.401 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -8.318 -8.123 -15.459 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -7.027 -7.484 -16.457 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -9.192 -7.089 -17.531 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -8.231 -8.186 -18.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -10.611 -8.822 -18.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -9.494 -10.031 -17.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -10.266 -9.130 -16.556 1.00 0.00 H new ATOM 1826 N PRO A 116 -3.602 -7.772 -13.518 1.00 0.00 N ATOM 1827 CA PRO A 116 -2.819 -7.674 -12.282 1.00 0.00 C ATOM 1828 C PRO A 116 -3.685 -7.819 -11.038 1.00 0.00 C ATOM 1829 O PRO A 116 -4.702 -7.134 -10.894 1.00 0.00 O ATOM 1830 CB PRO A 116 -2.202 -6.269 -12.345 1.00 0.00 C ATOM 1831 CG PRO A 116 -3.020 -5.525 -13.344 1.00 0.00 C ATOM 1832 CD PRO A 116 -3.498 -6.550 -14.331 1.00 0.00 C ATOM 0 HA PRO A 116 -2.078 -8.470 -12.211 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -2.233 -5.782 -11.370 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -1.156 -6.312 -12.647 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -3.860 -5.023 -12.864 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -2.428 -4.754 -13.837 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -4.458 -6.273 -14.767 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -2.797 -6.673 -15.156 1.00 0.00 H new ATOM 1840 N VAL A 117 -3.286 -8.713 -10.145 1.00 0.00 N ATOM 1841 CA VAL A 117 -4.055 -8.950 -8.938 1.00 0.00 C ATOM 1842 C VAL A 117 -3.546 -8.071 -7.804 1.00 0.00 C ATOM 1843 O VAL A 117 -2.373 -8.139 -7.425 1.00 0.00 O ATOM 1844 CB VAL A 117 -3.984 -10.430 -8.502 1.00 0.00 C ATOM 1845 CG1 VAL A 117 -4.818 -10.670 -7.251 1.00 0.00 C ATOM 1846 CG2 VAL A 117 -4.433 -11.345 -9.627 1.00 0.00 C ATOM 0 H VAL A 117 -2.443 -9.280 -10.234 1.00 0.00 H new ATOM 0 HA VAL A 117 -5.093 -8.702 -9.160 1.00 0.00 H new ATOM 0 HB VAL A 117 -2.945 -10.661 -8.266 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -4.751 -11.720 -6.965 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -4.443 -10.048 -6.439 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.858 -10.415 -7.453 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -4.375 -12.382 -9.297 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -5.461 -11.108 -9.900 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -3.786 -11.202 -10.492 1.00 0.00 H new ATOM 1856 N CYS A 118 -4.434 -7.241 -7.285 1.00 0.00 N ATOM 1857 CA CYS A 118 -4.156 -6.441 -6.111 1.00 0.00 C ATOM 1858 C CYS A 118 -5.096 -6.843 -4.982 1.00 0.00 C ATOM 1859 O CYS A 118 -6.319 -6.776 -5.137 1.00 0.00 O ATOM 1860 CB CYS A 118 -4.310 -4.951 -6.436 1.00 0.00 C ATOM 1861 SG CYS A 118 -5.908 -4.504 -7.159 1.00 0.00 S ATOM 0 H CYS A 118 -5.369 -7.105 -7.669 1.00 0.00 H new ATOM 0 HA CYS A 118 -3.128 -6.617 -5.793 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -4.165 -4.375 -5.522 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -3.518 -4.658 -7.126 1.00 0.00 H new ATOM 0 HG CYS A 118 -6.840 -5.254 -6.649 1.00 0.00 H new ATOM 1867 N LYS A 119 -4.547 -7.287 -3.863 1.00 0.00 N ATOM 1868 CA LYS A 119 -5.368 -7.624 -2.709 1.00 0.00 C ATOM 1869 C LYS A 119 -4.725 -7.103 -1.437 1.00 0.00 C ATOM 1870 O LYS A 119 -3.532 -6.798 -1.412 1.00 0.00 O ATOM 1871 CB LYS A 119 -5.594 -9.135 -2.592 1.00 0.00 C ATOM 1872 CG LYS A 119 -6.298 -9.751 -3.794 1.00 0.00 C ATOM 1873 CD LYS A 119 -6.787 -11.161 -3.498 1.00 0.00 C ATOM 1874 CE LYS A 119 -5.639 -12.115 -3.203 1.00 0.00 C ATOM 1875 NZ LYS A 119 -6.132 -13.443 -2.753 1.00 0.00 N ATOM 0 H LYS A 119 -3.545 -7.422 -3.728 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.339 -7.149 -2.850 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -4.631 -9.627 -2.457 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -6.183 -9.336 -1.697 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -7.143 -9.125 -4.081 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -5.615 -9.773 -4.643 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -7.466 -11.137 -2.646 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -7.357 -11.533 -4.349 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -5.028 -12.237 -4.097 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -4.997 -11.685 -2.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -5.322 -14.067 -2.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -6.694 -13.329 -1.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -6.725 -13.864 -3.497 1.00 0.00 H new ATOM 1889 N SER A 120 -5.517 -7.010 -0.387 1.00 0.00 N ATOM 1890 CA SER A 120 -5.031 -6.527 0.889 1.00 0.00 C ATOM 1891 C SER A 120 -5.102 -7.645 1.916 1.00 0.00 C ATOM 1892 O SER A 120 -6.091 -8.380 1.985 1.00 0.00 O ATOM 1893 CB SER A 120 -5.850 -5.318 1.355 1.00 0.00 C ATOM 1894 OG SER A 120 -5.306 -4.749 2.538 1.00 0.00 O ATOM 0 H SER A 120 -6.505 -7.264 -0.394 1.00 0.00 H new ATOM 0 HA SER A 120 -3.994 -6.210 0.777 1.00 0.00 H new ATOM 0 HB2 SER A 120 -5.874 -4.567 0.566 1.00 0.00 H new ATOM 0 HB3 SER A 120 -6.881 -5.623 1.536 1.00 0.00 H new ATOM 0 HG SER A 120 -4.356 -4.980 2.605 1.00 0.00 H new ATOM 1900 N PHE A 121 -4.050 -7.784 2.696 1.00 0.00 N ATOM 1901 CA PHE A 121 -3.992 -8.816 3.710 1.00 0.00 C ATOM 1902 C PHE A 121 -3.595 -8.224 5.046 1.00 0.00 C ATOM 1903 O PHE A 121 -2.639 -7.457 5.143 1.00 0.00 O ATOM 1904 CB PHE A 121 -3.000 -9.912 3.317 1.00 0.00 C ATOM 1905 CG PHE A 121 -3.405 -10.690 2.100 1.00 0.00 C ATOM 1906 CD1 PHE A 121 -4.271 -11.766 2.210 1.00 0.00 C ATOM 1907 CD2 PHE A 121 -2.920 -10.347 0.851 1.00 0.00 C ATOM 1908 CE1 PHE A 121 -4.641 -12.487 1.094 1.00 0.00 C ATOM 1909 CE2 PHE A 121 -3.288 -11.066 -0.268 1.00 0.00 C ATOM 1910 CZ PHE A 121 -4.152 -12.136 -0.146 1.00 0.00 C ATOM 0 H PHE A 121 -3.220 -7.193 2.647 1.00 0.00 H new ATOM 0 HA PHE A 121 -4.985 -9.258 3.795 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -2.025 -9.459 3.139 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -2.883 -10.600 4.154 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -4.660 -12.043 3.179 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -2.247 -9.508 0.750 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -5.314 -13.326 1.192 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -2.901 -10.792 -1.238 1.00 0.00 H new ATOM 0 HZ PHE A 121 -4.444 -12.697 -1.021 1.00 0.00 H new ATOM 1920 N LEU A 122 -4.347 -8.570 6.068 1.00 0.00 N ATOM 1921 CA LEU A 122 -4.032 -8.156 7.415 1.00 0.00 C ATOM 1922 C LEU A 122 -3.113 -9.183 8.046 1.00 0.00 C ATOM 1923 O LEU A 122 -3.540 -10.290 8.383 1.00 0.00 O ATOM 1924 CB LEU A 122 -5.313 -8.016 8.240 1.00 0.00 C ATOM 1925 CG LEU A 122 -6.322 -7.000 7.703 1.00 0.00 C ATOM 1926 CD1 LEU A 122 -7.605 -7.042 8.518 1.00 0.00 C ATOM 1927 CD2 LEU A 122 -5.724 -5.602 7.718 1.00 0.00 C ATOM 0 H LEU A 122 -5.188 -9.142 5.989 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.533 -7.187 7.390 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -5.798 -8.991 8.298 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -5.043 -7.733 9.257 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.562 -7.261 6.672 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -8.312 -6.313 8.122 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -8.041 -8.039 8.459 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -7.383 -6.804 9.558 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.454 -4.890 7.333 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -5.457 -5.331 8.740 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.832 -5.581 7.092 1.00 0.00 H new ATOM 1939 N ILE A 123 -1.855 -8.822 8.193 1.00 0.00 N ATOM 1940 CA ILE A 123 -0.873 -9.723 8.757 1.00 0.00 C ATOM 1941 C ILE A 123 -0.878 -9.601 10.272 1.00 0.00 C ATOM 1942 O ILE A 123 -0.452 -8.589 10.824 1.00 0.00 O ATOM 1943 CB ILE A 123 0.538 -9.430 8.210 1.00 0.00 C ATOM 1944 CG1 ILE A 123 0.533 -9.477 6.675 1.00 0.00 C ATOM 1945 CG2 ILE A 123 1.538 -10.430 8.771 1.00 0.00 C ATOM 1946 CD1 ILE A 123 1.868 -9.132 6.049 1.00 0.00 C ATOM 0 H ILE A 123 -1.488 -7.908 7.929 1.00 0.00 H new ATOM 0 HA ILE A 123 -1.139 -10.740 8.470 1.00 0.00 H new ATOM 0 HB ILE A 123 0.836 -8.430 8.524 1.00 0.00 H new ATOM 0 HG12 ILE A 123 0.238 -10.475 6.352 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.222 -8.785 6.302 1.00 0.00 H new ATOM 0 HG21 ILE A 123 2.531 -10.212 8.377 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.555 -10.356 9.858 1.00 0.00 H new ATOM 0 HG23 ILE A 123 1.246 -11.439 8.480 1.00 0.00 H new ATOM 0 HD11 ILE A 123 1.786 -9.187 4.963 1.00 0.00 H new ATOM 0 HD12 ILE A 123 2.157 -8.122 6.341 1.00 0.00 H new ATOM 0 HD13 ILE A 123 2.624 -9.839 6.392 1.00 0.00 H new ATOM 1958 N LYS A 124 -1.386 -10.626 10.934 1.00 0.00 N ATOM 1959 CA LYS A 124 -1.525 -10.606 12.377 1.00 0.00 C ATOM 1960 C LYS A 124 -0.440 -11.458 13.020 1.00 0.00 C ATOM 1961 O LYS A 124 0.448 -11.972 12.339 1.00 0.00 O ATOM 1962 CB LYS A 124 -2.908 -11.130 12.786 1.00 0.00 C ATOM 1963 CG LYS A 124 -4.068 -10.430 12.090 1.00 0.00 C ATOM 1964 CD LYS A 124 -4.126 -8.951 12.436 1.00 0.00 C ATOM 1965 CE LYS A 124 -5.265 -8.254 11.710 1.00 0.00 C ATOM 1966 NZ LYS A 124 -5.330 -6.808 12.043 1.00 0.00 N ATOM 0 H LYS A 124 -1.710 -11.486 10.491 1.00 0.00 H new ATOM 0 HA LYS A 124 -1.421 -9.577 12.721 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -2.959 -12.197 12.570 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -3.023 -11.017 13.864 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -3.968 -10.547 11.011 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -5.005 -10.907 12.377 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -4.252 -8.833 13.512 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -3.181 -8.477 12.172 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -5.137 -8.374 10.634 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -6.209 -8.730 11.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -5.716 -6.282 11.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -5.945 -6.670 12.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -4.375 -6.458 12.259 1.00 0.00 H new ATOM 1980 N LYS A 125 -0.518 -11.609 14.331 1.00 0.00 N ATOM 1981 CA LYS A 125 0.434 -12.425 15.064 1.00 0.00 C ATOM 1982 C LYS A 125 0.252 -13.886 14.690 1.00 0.00 C ATOM 1983 O LYS A 125 1.191 -14.568 14.278 1.00 0.00 O ATOM 1984 CB LYS A 125 0.220 -12.258 16.566 1.00 0.00 C ATOM 1985 CG LYS A 125 1.310 -12.893 17.414 1.00 0.00 C ATOM 1986 CD LYS A 125 0.940 -12.888 18.886 1.00 0.00 C ATOM 1987 CE LYS A 125 2.079 -13.400 19.754 1.00 0.00 C ATOM 1988 NZ LYS A 125 3.247 -12.483 19.729 1.00 0.00 N ATOM 0 H LYS A 125 -1.235 -11.175 14.912 1.00 0.00 H new ATOM 0 HA LYS A 125 1.444 -12.105 14.807 1.00 0.00 H new ATOM 0 HB2 LYS A 125 0.163 -11.195 16.800 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -0.741 -12.696 16.838 1.00 0.00 H new ATOM 0 HG2 LYS A 125 1.480 -13.918 17.083 1.00 0.00 H new ATOM 0 HG3 LYS A 125 2.246 -12.353 17.271 1.00 0.00 H new ATOM 0 HD2 LYS A 125 0.676 -11.875 19.192 1.00 0.00 H new ATOM 0 HD3 LYS A 125 0.057 -13.508 19.041 1.00 0.00 H new ATOM 0 HE2 LYS A 125 1.730 -13.516 20.780 1.00 0.00 H new ATOM 0 HE3 LYS A 125 2.385 -14.387 19.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 3.891 -12.720 20.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 3.749 -12.585 18.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 2.920 -11.501 19.835 1.00 0.00 H new ATOM 2002 N ASP A 126 -0.978 -14.341 14.843 1.00 0.00 N ATOM 2003 CA ASP A 126 -1.334 -15.738 14.618 1.00 0.00 C ATOM 2004 C ASP A 126 -1.301 -16.097 13.137 1.00 0.00 C ATOM 2005 O ASP A 126 -0.643 -17.061 12.736 1.00 0.00 O ATOM 2006 CB ASP A 126 -2.729 -16.020 15.175 1.00 0.00 C ATOM 2007 CG ASP A 126 -2.857 -15.632 16.630 1.00 0.00 C ATOM 2008 OD1 ASP A 126 -2.453 -16.426 17.500 1.00 0.00 O ATOM 2009 OD2 ASP A 126 -3.369 -14.530 16.912 1.00 0.00 O ATOM 0 H ASP A 126 -1.763 -13.755 15.127 1.00 0.00 H new ATOM 0 HA ASP A 126 -0.596 -16.351 15.135 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -3.468 -15.474 14.590 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -2.954 -17.081 15.063 1.00 0.00 H new ATOM 2014 N GLY A 127 -2.011 -15.326 12.324 1.00 0.00 N ATOM 2015 CA GLY A 127 -2.109 -15.636 10.911 1.00 0.00 C ATOM 2016 C GLY A 127 -2.428 -14.419 10.069 1.00 0.00 C ATOM 2017 O GLY A 127 -2.182 -13.288 10.486 1.00 0.00 O ATOM 0 H GLY A 127 -2.520 -14.492 12.617 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -1.169 -16.071 10.572 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -2.882 -16.390 10.761 1.00 0.00 H new ATOM 2021 N VAL A 128 -2.981 -14.649 8.889 1.00 0.00 N ATOM 2022 CA VAL A 128 -3.284 -13.568 7.963 1.00 0.00 C ATOM 2023 C VAL A 128 -4.778 -13.525 7.661 1.00 0.00 C ATOM 2024 O VAL A 128 -5.404 -14.563 7.447 1.00 0.00 O ATOM 2025 CB VAL A 128 -2.498 -13.728 6.642 1.00 0.00 C ATOM 2026 CG1 VAL A 128 -2.790 -12.576 5.690 1.00 0.00 C ATOM 2027 CG2 VAL A 128 -1.003 -13.830 6.911 1.00 0.00 C ATOM 0 H VAL A 128 -3.230 -15.578 8.548 1.00 0.00 H new ATOM 0 HA VAL A 128 -2.984 -12.634 8.438 1.00 0.00 H new ATOM 0 HB VAL A 128 -2.826 -14.653 6.168 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -2.224 -12.713 4.768 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -3.856 -12.554 5.462 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -2.499 -11.635 6.157 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -0.470 -13.942 5.967 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -0.662 -12.926 7.415 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -0.805 -14.695 7.544 1.00 0.00 H new ATOM 2037 N ASP A 129 -5.347 -12.328 7.664 1.00 0.00 N ATOM 2038 CA ASP A 129 -6.758 -12.152 7.344 1.00 0.00 C ATOM 2039 C ASP A 129 -6.886 -11.400 6.027 1.00 0.00 C ATOM 2040 O ASP A 129 -6.196 -10.406 5.810 1.00 0.00 O ATOM 2041 CB ASP A 129 -7.468 -11.382 8.457 1.00 0.00 C ATOM 2042 CG ASP A 129 -8.948 -11.697 8.532 1.00 0.00 C ATOM 2043 OD1 ASP A 129 -9.579 -11.865 7.474 1.00 0.00 O ATOM 2044 OD2 ASP A 129 -9.475 -11.814 9.660 1.00 0.00 O ATOM 0 H ASP A 129 -4.853 -11.463 7.885 1.00 0.00 H new ATOM 0 HA ASP A 129 -7.227 -13.132 7.252 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -7.001 -11.620 9.413 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -7.336 -10.312 8.295 1.00 0.00 H new ATOM 2049 N GLU A 130 -7.758 -11.866 5.150 1.00 0.00 N ATOM 2050 CA GLU A 130 -7.853 -11.315 3.811 1.00 0.00 C ATOM 2051 C GLU A 130 -8.952 -10.255 3.701 1.00 0.00 C ATOM 2052 O GLU A 130 -10.103 -10.472 4.095 1.00 0.00 O ATOM 2053 CB GLU A 130 -8.063 -12.446 2.807 1.00 0.00 C ATOM 2054 CG GLU A 130 -9.211 -13.384 3.141 1.00 0.00 C ATOM 2055 CD GLU A 130 -9.136 -14.674 2.356 1.00 0.00 C ATOM 2056 OE1 GLU A 130 -9.174 -14.623 1.108 1.00 0.00 O ATOM 2057 OE2 GLU A 130 -8.999 -15.747 2.980 1.00 0.00 O ATOM 0 H GLU A 130 -8.411 -12.626 5.342 1.00 0.00 H new ATOM 0 HA GLU A 130 -6.916 -10.807 3.582 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.240 -12.012 1.823 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.144 -13.028 2.738 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -9.198 -13.608 4.208 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -10.158 -12.887 2.931 1.00 0.00 H new ATOM 2064 N GLU A 131 -8.570 -9.105 3.158 1.00 0.00 N ATOM 2065 CA GLU A 131 -9.463 -7.964 3.017 1.00 0.00 C ATOM 2066 C GLU A 131 -9.985 -7.862 1.582 1.00 0.00 C ATOM 2067 O GLU A 131 -9.321 -8.296 0.636 1.00 0.00 O ATOM 2068 CB GLU A 131 -8.708 -6.684 3.403 1.00 0.00 C ATOM 2069 CG GLU A 131 -9.483 -5.394 3.183 1.00 0.00 C ATOM 2070 CD GLU A 131 -10.670 -5.241 4.108 1.00 0.00 C ATOM 2071 OE1 GLU A 131 -11.724 -5.845 3.836 1.00 0.00 O ATOM 2072 OE2 GLU A 131 -10.552 -4.498 5.106 1.00 0.00 O ATOM 0 H GLU A 131 -7.629 -8.938 2.802 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.320 -8.095 3.678 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -8.428 -6.748 4.454 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -7.783 -6.638 2.829 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -8.811 -4.547 3.323 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -9.830 -5.359 2.150 1.00 0.00 H new ATOM 2079 N GLU A 132 -11.175 -7.298 1.426 1.00 0.00 N ATOM 2080 CA GLU A 132 -11.771 -7.110 0.117 1.00 0.00 C ATOM 2081 C GLU A 132 -11.585 -5.663 -0.333 1.00 0.00 C ATOM 2082 O GLU A 132 -11.711 -4.734 0.470 1.00 0.00 O ATOM 2083 CB GLU A 132 -13.254 -7.472 0.170 1.00 0.00 C ATOM 2084 CG GLU A 132 -13.906 -7.565 -1.195 1.00 0.00 C ATOM 2085 CD GLU A 132 -13.219 -8.569 -2.099 1.00 0.00 C ATOM 2086 OE1 GLU A 132 -13.431 -9.784 -1.915 1.00 0.00 O ATOM 2087 OE2 GLU A 132 -12.463 -8.146 -2.997 1.00 0.00 O ATOM 0 H GLU A 132 -11.748 -6.961 2.199 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.279 -7.763 -0.604 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -13.368 -8.427 0.683 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.780 -6.725 0.765 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -14.953 -7.845 -1.076 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.890 -6.584 -1.669 1.00 0.00 H new ATOM 2094 N ILE A 133 -11.288 -5.471 -1.611 1.00 0.00 N ATOM 2095 CA ILE A 133 -10.982 -4.142 -2.124 1.00 0.00 C ATOM 2096 C ILE A 133 -12.128 -3.581 -2.957 1.00 0.00 C ATOM 2097 O ILE A 133 -12.625 -4.232 -3.880 1.00 0.00 O ATOM 2098 CB ILE A 133 -9.686 -4.134 -2.968 1.00 0.00 C ATOM 2099 CG1 ILE A 133 -8.494 -4.598 -2.122 1.00 0.00 C ATOM 2100 CG2 ILE A 133 -9.424 -2.743 -3.541 1.00 0.00 C ATOM 2101 CD1 ILE A 133 -7.170 -4.555 -2.855 1.00 0.00 C ATOM 0 H ILE A 133 -11.252 -6.214 -2.309 1.00 0.00 H new ATOM 0 HA ILE A 133 -10.836 -3.506 -1.251 1.00 0.00 H new ATOM 0 HB ILE A 133 -9.814 -4.828 -3.799 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -8.426 -3.972 -1.232 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -8.677 -5.617 -1.781 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -8.508 -2.759 -4.131 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -10.259 -2.448 -4.176 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -9.317 -2.028 -2.725 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -6.376 -4.897 -2.192 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -7.217 -5.204 -3.730 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -6.963 -3.533 -3.172 1.00 0.00 H new ATOM 2113 N ILE A 134 -12.540 -2.371 -2.616 1.00 0.00 N ATOM 2114 CA ILE A 134 -13.561 -1.660 -3.365 1.00 0.00 C ATOM 2115 C ILE A 134 -12.902 -0.631 -4.281 1.00 0.00 C ATOM 2116 O ILE A 134 -11.938 0.029 -3.888 1.00 0.00 O ATOM 2117 CB ILE A 134 -14.550 -0.932 -2.425 1.00 0.00 C ATOM 2118 CG1 ILE A 134 -15.015 -1.860 -1.298 1.00 0.00 C ATOM 2119 CG2 ILE A 134 -15.747 -0.412 -3.210 1.00 0.00 C ATOM 2120 CD1 ILE A 134 -15.771 -3.086 -1.767 1.00 0.00 C ATOM 0 H ILE A 134 -12.177 -1.856 -1.814 1.00 0.00 H new ATOM 0 HA ILE A 134 -14.115 -2.393 -3.951 1.00 0.00 H new ATOM 0 HB ILE A 134 -14.031 -0.084 -1.978 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -14.144 -2.182 -0.727 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -15.651 -1.294 -0.618 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -16.433 0.097 -2.533 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -15.406 0.287 -3.974 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -16.261 -1.247 -3.686 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -16.062 -3.686 -0.905 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -16.663 -2.777 -2.312 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -15.133 -3.678 -2.422 1.00 0.00 H new ATOM 2132 N LEU A 135 -13.405 -0.504 -5.500 1.00 0.00 N ATOM 2133 CA LEU A 135 -12.844 0.446 -6.449 1.00 0.00 C ATOM 2134 C LEU A 135 -13.757 1.647 -6.653 1.00 0.00 C ATOM 2135 O LEU A 135 -14.977 1.508 -6.748 1.00 0.00 O ATOM 2136 CB LEU A 135 -12.572 -0.223 -7.798 1.00 0.00 C ATOM 2137 CG LEU A 135 -11.373 -1.169 -7.828 1.00 0.00 C ATOM 2138 CD1 LEU A 135 -11.142 -1.696 -9.233 1.00 0.00 C ATOM 2139 CD2 LEU A 135 -10.128 -0.459 -7.326 1.00 0.00 C ATOM 0 H LEU A 135 -14.195 -1.043 -5.854 1.00 0.00 H new ATOM 0 HA LEU A 135 -11.903 0.797 -6.025 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -13.461 -0.780 -8.094 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -12.419 0.555 -8.546 1.00 0.00 H new ATOM 0 HG LEU A 135 -11.586 -2.013 -7.172 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -10.284 -2.368 -9.233 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -12.027 -2.237 -9.569 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -10.950 -0.862 -9.908 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -9.282 -1.146 -7.353 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -9.918 0.401 -7.962 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -10.289 -0.122 -6.302 1.00 0.00 H new ATOM 2151 N LYS A 136 -13.151 2.824 -6.711 1.00 0.00 N ATOM 2152 CA LYS A 136 -13.865 4.043 -7.058 1.00 0.00 C ATOM 2153 C LYS A 136 -13.246 4.687 -8.291 1.00 0.00 C ATOM 2154 O LYS A 136 -12.043 4.566 -8.527 1.00 0.00 O ATOM 2155 CB LYS A 136 -13.865 5.042 -5.898 1.00 0.00 C ATOM 2156 CG LYS A 136 -14.951 4.784 -4.865 1.00 0.00 C ATOM 2157 CD LYS A 136 -15.166 5.995 -3.966 1.00 0.00 C ATOM 2158 CE LYS A 136 -16.379 5.814 -3.065 1.00 0.00 C ATOM 2159 NZ LYS A 136 -16.772 7.081 -2.389 1.00 0.00 N ATOM 0 H LYS A 136 -12.158 2.960 -6.520 1.00 0.00 H new ATOM 0 HA LYS A 136 -14.898 3.770 -7.273 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -12.893 5.012 -5.405 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -13.989 6.049 -6.298 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -15.884 4.535 -5.371 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -14.678 3.922 -4.257 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -14.278 6.157 -3.354 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -15.297 6.886 -4.580 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -17.217 5.445 -3.656 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -16.161 5.056 -2.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -17.548 6.893 -1.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -15.956 7.466 -1.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -17.087 7.771 -3.101 1.00 0.00 H new ATOM 2173 N GLU A 137 -14.074 5.353 -9.085 1.00 0.00 N ATOM 2174 CA GLU A 137 -13.610 6.023 -10.286 1.00 0.00 C ATOM 2175 C GLU A 137 -12.843 7.296 -9.958 1.00 0.00 C ATOM 2176 O GLU A 137 -11.965 7.726 -10.709 1.00 0.00 O ATOM 2177 CB GLU A 137 -14.796 6.374 -11.176 1.00 0.00 C ATOM 2178 CG GLU A 137 -15.562 5.169 -11.701 1.00 0.00 C ATOM 2179 CD GLU A 137 -16.772 4.816 -10.853 1.00 0.00 C ATOM 2180 OE1 GLU A 137 -16.683 4.869 -9.608 1.00 0.00 O ATOM 2181 OE2 GLU A 137 -17.832 4.497 -11.432 1.00 0.00 O ATOM 0 H GLU A 137 -15.076 5.442 -8.915 1.00 0.00 H new ATOM 0 HA GLU A 137 -12.938 5.339 -10.805 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -15.481 7.009 -10.615 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -14.439 6.960 -12.023 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -15.887 5.369 -12.722 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -14.892 4.310 -11.743 1.00 0.00 H new ATOM 2188 N GLU A 138 -13.176 7.876 -8.830 1.00 0.00 N ATOM 2189 CA GLU A 138 -12.579 9.134 -8.397 1.00 0.00 C ATOM 2190 C GLU A 138 -12.380 9.129 -6.879 1.00 0.00 C ATOM 2191 O GLU A 138 -12.910 8.257 -6.188 1.00 0.00 O ATOM 2192 CB GLU A 138 -13.476 10.298 -8.837 1.00 0.00 C ATOM 2193 CG GLU A 138 -12.784 11.649 -8.858 1.00 0.00 C ATOM 2194 CD GLU A 138 -13.603 12.698 -9.578 1.00 0.00 C ATOM 2195 OE1 GLU A 138 -13.441 12.845 -10.810 1.00 0.00 O ATOM 2196 OE2 GLU A 138 -14.417 13.382 -8.923 1.00 0.00 O ATOM 0 H GLU A 138 -13.866 7.497 -8.182 1.00 0.00 H new ATOM 0 HA GLU A 138 -11.599 9.255 -8.859 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -13.863 10.086 -9.834 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -14.334 10.353 -8.167 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -12.596 11.975 -7.835 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -11.813 11.551 -9.344 1.00 0.00 H new ATOM 2203 N LEU A 139 -11.608 10.087 -6.368 1.00 0.00 N ATOM 2204 CA LEU A 139 -11.263 10.128 -4.946 1.00 0.00 C ATOM 2205 C LEU A 139 -12.447 10.581 -4.089 1.00 0.00 C ATOM 2206 O LEU A 139 -13.551 10.792 -4.593 1.00 0.00 O ATOM 2207 CB LEU A 139 -10.061 11.049 -4.711 1.00 0.00 C ATOM 2208 CG LEU A 139 -8.752 10.604 -5.370 1.00 0.00 C ATOM 2209 CD1 LEU A 139 -7.654 11.621 -5.105 1.00 0.00 C ATOM 2210 CD2 LEU A 139 -8.331 9.235 -4.860 1.00 0.00 C ATOM 0 H LEU A 139 -11.208 10.847 -6.918 1.00 0.00 H new ATOM 0 HA LEU A 139 -11.000 9.114 -4.645 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -10.311 12.045 -5.076 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -9.896 11.136 -3.637 1.00 0.00 H new ATOM 0 HG LEU A 139 -8.917 10.536 -6.445 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -6.730 11.291 -5.580 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -7.947 12.588 -5.515 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -7.497 11.715 -4.031 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -7.399 8.938 -5.341 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -8.185 9.278 -3.781 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -9.107 8.506 -5.092 1.00 0.00 H new ATOM 2222 N GLU A 140 -12.204 10.742 -2.789 1.00 0.00 N ATOM 2223 CA GLU A 140 -13.269 11.048 -1.843 1.00 0.00 C ATOM 2224 C GLU A 140 -13.302 12.542 -1.528 1.00 0.00 C ATOM 2225 O GLU A 140 -14.166 13.023 -0.793 1.00 0.00 O ATOM 2226 CB GLU A 140 -13.074 10.229 -0.558 1.00 0.00 C ATOM 2227 CG GLU A 140 -14.312 10.137 0.320 1.00 0.00 C ATOM 2228 CD GLU A 140 -15.455 9.422 -0.367 1.00 0.00 C ATOM 2229 OE1 GLU A 140 -15.407 8.180 -0.468 1.00 0.00 O ATOM 2230 OE2 GLU A 140 -16.410 10.102 -0.800 1.00 0.00 O ATOM 0 H GLU A 140 -11.277 10.665 -2.369 1.00 0.00 H new ATOM 0 HA GLU A 140 -14.225 10.779 -2.293 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -12.759 9.221 -0.828 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -12.264 10.672 0.022 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -14.062 9.613 1.243 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -14.631 11.141 0.600 1.00 0.00 H new ATOM 2237 N HIS A 141 -12.360 13.271 -2.093 1.00 0.00 N ATOM 2238 CA HIS A 141 -12.296 14.717 -1.917 1.00 0.00 C ATOM 2239 C HIS A 141 -12.519 15.419 -3.248 1.00 0.00 C ATOM 2240 O HIS A 141 -12.454 14.791 -4.301 1.00 0.00 O ATOM 2241 CB HIS A 141 -10.957 15.134 -1.305 1.00 0.00 C ATOM 2242 CG HIS A 141 -10.880 14.895 0.174 1.00 0.00 C ATOM 2243 ND1 HIS A 141 -10.469 13.706 0.733 1.00 0.00 N ATOM 2244 CD2 HIS A 141 -11.175 15.710 1.216 1.00 0.00 C ATOM 2245 CE1 HIS A 141 -10.514 13.798 2.049 1.00 0.00 C ATOM 2246 NE2 HIS A 141 -10.937 15.004 2.367 1.00 0.00 N ATOM 0 H HIS A 141 -11.622 12.887 -2.683 1.00 0.00 H new ATOM 0 HA HIS A 141 -13.087 15.015 -1.229 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -10.154 14.585 -1.797 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -10.788 16.192 -1.504 1.00 0.00 H new ATOM 0 HD1 HIS A 141 -10.175 12.881 0.211 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -11.532 16.727 1.152 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -10.249 13.017 2.746 1.00 0.00 H new ATOM 2255 N HIS A 142 -12.779 16.718 -3.205 1.00 0.00 N ATOM 2256 CA HIS A 142 -13.127 17.456 -4.411 1.00 0.00 C ATOM 2257 C HIS A 142 -11.906 17.992 -5.149 1.00 0.00 C ATOM 2258 O HIS A 142 -11.397 19.076 -4.845 1.00 0.00 O ATOM 2259 CB HIS A 142 -14.079 18.611 -4.097 1.00 0.00 C ATOM 2260 CG HIS A 142 -15.493 18.186 -3.864 1.00 0.00 C ATOM 2261 ND1 HIS A 142 -16.391 17.979 -4.890 1.00 0.00 N ATOM 2262 CD2 HIS A 142 -16.169 17.940 -2.717 1.00 0.00 C ATOM 2263 CE1 HIS A 142 -17.557 17.628 -4.384 1.00 0.00 C ATOM 2264 NE2 HIS A 142 -17.450 17.597 -3.071 1.00 0.00 N ATOM 0 H HIS A 142 -12.756 17.280 -2.354 1.00 0.00 H new ATOM 0 HA HIS A 142 -13.625 16.741 -5.066 1.00 0.00 H new ATOM 0 HB2 HIS A 142 -13.718 19.136 -3.213 1.00 0.00 H new ATOM 0 HB3 HIS A 142 -14.055 19.323 -4.922 1.00 0.00 H new ATOM 0 HD2 HIS A 142 -15.775 18.002 -1.713 1.00 0.00 H new ATOM 0 HE1 HIS A 142 -18.449 17.404 -4.950 1.00 0.00 H new ATOM 0 HE2 HIS A 142 -18.199 17.357 -2.422 1.00 0.00 H new ATOM 2273 N HIS A 143 -11.437 17.224 -6.117 1.00 0.00 N ATOM 2274 CA HIS A 143 -10.466 17.717 -7.080 1.00 0.00 C ATOM 2275 C HIS A 143 -11.225 18.156 -8.319 1.00 0.00 C ATOM 2276 O HIS A 143 -12.385 17.781 -8.486 1.00 0.00 O ATOM 2277 CB HIS A 143 -9.428 16.644 -7.435 1.00 0.00 C ATOM 2278 CG HIS A 143 -8.482 16.327 -6.317 1.00 0.00 C ATOM 2279 ND1 HIS A 143 -8.577 15.187 -5.549 1.00 0.00 N ATOM 2280 CD2 HIS A 143 -7.412 17.009 -5.840 1.00 0.00 C ATOM 2281 CE1 HIS A 143 -7.610 15.183 -4.649 1.00 0.00 C ATOM 2282 NE2 HIS A 143 -6.892 16.277 -4.802 1.00 0.00 N ATOM 0 H HIS A 143 -11.714 16.252 -6.258 1.00 0.00 H new ATOM 0 HA HIS A 143 -9.917 18.554 -6.650 1.00 0.00 H new ATOM 0 HB2 HIS A 143 -9.947 15.732 -7.729 1.00 0.00 H new ATOM 0 HB3 HIS A 143 -8.855 16.978 -8.300 1.00 0.00 H new ATOM 0 HD2 HIS A 143 -7.038 17.953 -6.208 1.00 0.00 H new ATOM 0 HE1 HIS A 143 -7.437 14.413 -3.912 1.00 0.00 H new ATOM 0 HE2 HIS A 143 -6.081 16.538 -4.240 1.00 0.00 H new ATOM 2291 N HIS A 144 -10.592 18.956 -9.171 1.00 0.00 N ATOM 2292 CA HIS A 144 -11.264 19.498 -10.351 1.00 0.00 C ATOM 2293 C HIS A 144 -12.433 20.385 -9.945 1.00 0.00 C ATOM 2294 O HIS A 144 -13.480 20.373 -10.594 1.00 0.00 O ATOM 2295 CB HIS A 144 -11.778 18.384 -11.274 1.00 0.00 C ATOM 2296 CG HIS A 144 -10.771 17.876 -12.252 1.00 0.00 C ATOM 2297 ND1 HIS A 144 -10.397 18.586 -13.368 1.00 0.00 N ATOM 2298 CD2 HIS A 144 -10.074 16.718 -12.296 1.00 0.00 C ATOM 2299 CE1 HIS A 144 -9.522 17.889 -14.059 1.00 0.00 C ATOM 2300 NE2 HIS A 144 -9.304 16.751 -13.432 1.00 0.00 N ATOM 0 H HIS A 144 -9.619 19.244 -9.069 1.00 0.00 H new ATOM 0 HA HIS A 144 -10.525 20.088 -10.894 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -12.122 17.551 -10.661 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -12.644 18.755 -11.823 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -10.115 15.917 -11.573 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -9.060 18.198 -14.985 1.00 0.00 H new ATOM 0 HE2 HIS A 144 -8.668 16.016 -13.740 1.00 0.00 H new ATOM 2309 N HIS A 145 -12.260 21.157 -8.878 1.00 0.00 N ATOM 2310 CA HIS A 145 -13.311 22.068 -8.440 1.00 0.00 C ATOM 2311 C HIS A 145 -13.356 23.291 -9.351 1.00 0.00 C ATOM 2312 O HIS A 145 -12.833 24.358 -9.030 1.00 0.00 O ATOM 2313 CB HIS A 145 -13.168 22.464 -6.957 1.00 0.00 C ATOM 2314 CG HIS A 145 -11.770 22.763 -6.493 1.00 0.00 C ATOM 2315 ND1 HIS A 145 -11.076 21.935 -5.631 1.00 0.00 N ATOM 2316 CD2 HIS A 145 -10.948 23.812 -6.743 1.00 0.00 C ATOM 2317 CE1 HIS A 145 -9.895 22.463 -5.373 1.00 0.00 C ATOM 2318 NE2 HIS A 145 -9.791 23.600 -6.033 1.00 0.00 N ATOM 0 H HIS A 145 -11.415 21.171 -8.307 1.00 0.00 H new ATOM 0 HA HIS A 145 -14.262 21.542 -8.518 1.00 0.00 H new ATOM 0 HB2 HIS A 145 -13.787 23.342 -6.773 1.00 0.00 H new ATOM 0 HB3 HIS A 145 -13.569 21.657 -6.344 1.00 0.00 H new ATOM 0 HD1 HIS A 145 -11.423 21.053 -5.253 1.00 0.00 H new ATOM 0 HD2 HIS A 145 -11.163 24.656 -7.381 1.00 0.00 H new ATOM 0 HE1 HIS A 145 -9.140 22.036 -4.729 1.00 0.00 H new ATOM 2327 N HIS A 146 -13.964 23.091 -10.509 1.00 0.00 N ATOM 2328 CA HIS A 146 -14.045 24.098 -11.550 1.00 0.00 C ATOM 2329 C HIS A 146 -15.116 23.686 -12.553 1.00 0.00 C ATOM 2330 O HIS A 146 -14.841 22.798 -13.386 1.00 0.00 O ATOM 2331 CB HIS A 146 -12.685 24.249 -12.247 1.00 0.00 C ATOM 2332 CG HIS A 146 -12.691 25.194 -13.412 1.00 0.00 C ATOM 2333 ND1 HIS A 146 -12.497 24.783 -14.711 1.00 0.00 N ATOM 2334 CD2 HIS A 146 -12.851 26.536 -13.468 1.00 0.00 C ATOM 2335 CE1 HIS A 146 -12.537 25.827 -15.514 1.00 0.00 C ATOM 2336 NE2 HIS A 146 -12.752 26.905 -14.785 1.00 0.00 N ATOM 2337 OXT HIS A 146 -16.235 24.230 -12.486 1.00 0.00 O ATOM 0 H HIS A 146 -14.421 22.212 -10.754 1.00 0.00 H new ATOM 0 HA HIS A 146 -14.310 25.060 -11.112 1.00 0.00 H new ATOM 0 HB2 HIS A 146 -11.952 24.594 -11.518 1.00 0.00 H new ATOM 0 HB3 HIS A 146 -12.355 23.269 -12.591 1.00 0.00 H new ATOM 0 HD2 HIS A 146 -13.025 27.195 -12.630 1.00 0.00 H new ATOM 0 HE1 HIS A 146 -12.415 25.804 -16.587 1.00 0.00 H new ATOM 0 HE2 HIS A 146 -12.832 27.857 -15.142 1.00 0.00 H new TER 2346 HIS A 146