USER MOD reduce.3.24.130724 H: found=0, std=0, add=796, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 797 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 95 LYS NZ :NH3+ 178:sc= 0.79 (180deg=0.0567) USER MOD Set 1.2: A 100 ASN : amide:sc= 0.609 K(o=1.4,f=-4.3) USER MOD Single : A 1 MET CE :methyl -165:sc= -0.0115 (180deg=-0.407) USER MOD Single : A 1 MET N :NH3+ 146:sc= 0.109 (180deg=0) USER MOD Single : A 6 SER OG : rot -170:sc= -0.527 USER MOD Single : A 8 SER OG : rot -103:sc= 1.2 USER MOD Single : A 12 LYS NZ :NH3+ 178:sc= 2.43 (180deg=2.42) USER MOD Single : A 14 LYS NZ :NH3+ -175:sc= 1.24 (180deg=1.01) USER MOD Single : A 19 SER OG : rot 87:sc= 0.129 USER MOD Single : A 20 ASN : amide:sc= -0.0169 K(o=-0.017,f=-0.64) USER MOD Single : A 21 LYS NZ :NH3+ -170:sc=-0.00343 (180deg=-0.102) USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=0.0083) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -176:sc= 1.27 (180deg=1.13) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.101 USER MOD Single : A 29 THR OG1 : rot 42:sc= 1.15 USER MOD Single : A 33 SER OG : rot 104:sc= 1.22 USER MOD Single : A 37 LYS NZ :NH3+ -168:sc=-0.00963 (180deg=-0.184) USER MOD Single : A 38 SER OG : rot 82:sc= 0.286 USER MOD Single : A 44 SER OG : rot 120:sc= 1 USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0.00194 USER MOD Single : A 74 MET CE :methyl -117:sc= -0.546 (180deg=-2.48!) USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0.028) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= -4.17! C(o=-4.2!,f=-2.2!) USER MOD Single : A 93 LYS NZ :NH3+ 153:sc= 1.08 (180deg=0.0222) USER MOD Single : A 110 SER OG : rot -42:sc= 0.11 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.885 -10.587 -10.586 1.00 0.00 N ATOM 2 CA MET A 1 0.755 -10.898 -9.164 1.00 0.00 C ATOM 3 C MET A 1 -0.538 -10.298 -8.670 1.00 0.00 C ATOM 4 O MET A 1 -0.956 -9.250 -9.169 1.00 0.00 O ATOM 5 CB MET A 1 1.944 -10.315 -8.366 1.00 0.00 C ATOM 6 CG MET A 1 1.920 -10.672 -6.886 1.00 0.00 C ATOM 7 SD MET A 1 3.314 -10.025 -5.950 1.00 0.00 S ATOM 8 CE MET A 1 3.003 -10.811 -4.358 1.00 0.00 C ATOM 0 H1 MET A 1 1.888 -10.445 -10.820 1.00 0.00 H new ATOM 0 H2 MET A 1 0.506 -11.374 -11.150 1.00 0.00 H new ATOM 0 H3 MET A 1 0.354 -9.719 -10.802 1.00 0.00 H new ATOM 0 HA MET A 1 0.754 -11.979 -9.022 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.875 -10.676 -8.803 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.943 -9.230 -8.469 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.996 -10.295 -6.448 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.901 -11.757 -6.786 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.603 -10.325 -3.589 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.946 -10.719 -4.107 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.272 -11.866 -4.414 1.00 0.00 H new ATOM 20 N PHE A 2 -1.175 -10.929 -7.714 1.00 0.00 N ATOM 21 CA PHE A 2 -2.402 -10.404 -7.180 1.00 0.00 C ATOM 22 C PHE A 2 -2.075 -9.434 -6.055 1.00 0.00 C ATOM 23 O PHE A 2 -1.046 -9.580 -5.370 1.00 0.00 O ATOM 24 CB PHE A 2 -3.304 -11.529 -6.647 1.00 0.00 C ATOM 25 CG PHE A 2 -3.703 -12.566 -7.663 1.00 0.00 C ATOM 26 CD1 PHE A 2 -4.792 -12.363 -8.496 1.00 0.00 C ATOM 27 CD2 PHE A 2 -2.991 -13.752 -7.774 1.00 0.00 C ATOM 28 CE1 PHE A 2 -5.158 -13.321 -9.420 1.00 0.00 C ATOM 29 CE2 PHE A 2 -3.355 -14.709 -8.694 1.00 0.00 C ATOM 30 CZ PHE A 2 -4.438 -14.495 -9.518 1.00 0.00 C ATOM 0 H PHE A 2 -0.863 -11.804 -7.293 1.00 0.00 H new ATOM 0 HA PHE A 2 -2.940 -9.891 -7.978 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -2.789 -12.027 -5.826 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -4.208 -11.083 -6.233 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -5.359 -11.447 -8.421 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -2.141 -13.926 -7.131 1.00 0.00 H new ATOM 0 HE1 PHE A 2 -6.007 -13.152 -10.066 1.00 0.00 H new ATOM 0 HE2 PHE A 2 -2.792 -15.627 -8.770 1.00 0.00 H new ATOM 0 HZ PHE A 2 -4.724 -15.245 -10.240 1.00 0.00 H new ATOM 40 N ALA A 3 -2.905 -8.454 -5.885 1.00 0.00 N ATOM 41 CA ALA A 3 -2.752 -7.482 -4.837 1.00 0.00 C ATOM 42 C ALA A 3 -4.095 -7.239 -4.215 1.00 0.00 C ATOM 43 O ALA A 3 -4.999 -6.743 -4.867 1.00 0.00 O ATOM 44 CB ALA A 3 -2.169 -6.185 -5.382 1.00 0.00 C ATOM 0 H ALA A 3 -3.722 -8.300 -6.476 1.00 0.00 H new ATOM 0 HA ALA A 3 -2.059 -7.860 -4.085 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -2.062 -5.465 -4.571 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -1.192 -6.382 -5.823 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -2.835 -5.778 -6.143 1.00 0.00 H new ATOM 50 N VAL A 4 -4.241 -7.608 -2.988 1.00 0.00 N ATOM 51 CA VAL A 4 -5.506 -7.479 -2.323 1.00 0.00 C ATOM 52 C VAL A 4 -5.488 -6.220 -1.481 1.00 0.00 C ATOM 53 O VAL A 4 -4.516 -5.946 -0.761 1.00 0.00 O ATOM 54 CB VAL A 4 -5.837 -8.722 -1.454 1.00 0.00 C ATOM 55 CG1 VAL A 4 -7.230 -8.610 -0.837 1.00 0.00 C ATOM 56 CG2 VAL A 4 -5.735 -9.993 -2.287 1.00 0.00 C ATOM 0 H VAL A 4 -3.497 -8.006 -2.415 1.00 0.00 H new ATOM 0 HA VAL A 4 -6.291 -7.410 -3.076 1.00 0.00 H new ATOM 0 HB VAL A 4 -5.109 -8.768 -0.644 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -7.433 -9.495 -0.234 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -7.278 -7.722 -0.206 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -7.974 -8.532 -1.630 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -5.970 -10.856 -1.664 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -6.440 -9.942 -3.117 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -4.722 -10.092 -2.677 1.00 0.00 H new ATOM 66 N ILE A 5 -6.520 -5.450 -1.600 1.00 0.00 N ATOM 67 CA ILE A 5 -6.617 -4.199 -0.906 1.00 0.00 C ATOM 68 C ILE A 5 -7.484 -4.357 0.344 1.00 0.00 C ATOM 69 O ILE A 5 -8.560 -4.955 0.288 1.00 0.00 O ATOM 70 CB ILE A 5 -7.246 -3.128 -1.832 1.00 0.00 C ATOM 71 CG1 ILE A 5 -6.474 -3.053 -3.163 1.00 0.00 C ATOM 72 CG2 ILE A 5 -7.239 -1.768 -1.141 1.00 0.00 C ATOM 73 CD1 ILE A 5 -7.108 -2.148 -4.199 1.00 0.00 C ATOM 0 H ILE A 5 -7.327 -5.669 -2.184 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.615 -3.884 -0.613 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.278 -3.410 -2.043 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -5.461 -2.704 -2.963 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -6.389 -4.057 -3.578 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.683 -1.023 -1.801 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.816 -1.826 -0.218 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -6.213 -1.483 -0.910 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.502 -2.152 -5.105 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -8.111 -2.507 -4.431 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -7.168 -1.133 -3.807 1.00 0.00 H new ATOM 85 N SER A 6 -7.001 -3.866 1.461 1.00 0.00 N ATOM 86 CA SER A 6 -7.775 -3.859 2.677 1.00 0.00 C ATOM 87 C SER A 6 -8.514 -2.516 2.782 1.00 0.00 C ATOM 88 O SER A 6 -8.014 -1.506 2.278 1.00 0.00 O ATOM 89 CB SER A 6 -6.845 -4.049 3.866 1.00 0.00 C ATOM 90 OG SER A 6 -6.074 -5.220 3.693 1.00 0.00 O ATOM 0 H SER A 6 -6.068 -3.464 1.551 1.00 0.00 H new ATOM 0 HA SER A 6 -8.503 -4.671 2.670 1.00 0.00 H new ATOM 0 HB2 SER A 6 -6.190 -3.184 3.968 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.426 -4.119 4.786 1.00 0.00 H new ATOM 0 HG SER A 6 -5.596 -5.423 4.524 1.00 0.00 H new ATOM 96 N PRO A 7 -9.717 -2.480 3.399 1.00 0.00 N ATOM 97 CA PRO A 7 -10.510 -1.239 3.575 1.00 0.00 C ATOM 98 C PRO A 7 -9.745 -0.080 4.256 1.00 0.00 C ATOM 99 O PRO A 7 -10.082 1.092 4.065 1.00 0.00 O ATOM 100 CB PRO A 7 -11.708 -1.696 4.403 1.00 0.00 C ATOM 101 CG PRO A 7 -11.858 -3.125 4.021 1.00 0.00 C ATOM 102 CD PRO A 7 -10.452 -3.648 3.931 1.00 0.00 C ATOM 0 HA PRO A 7 -10.782 -0.808 2.612 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -11.526 -1.582 5.472 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -12.603 -1.120 4.168 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -12.438 -3.674 4.763 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -12.380 -3.227 3.070 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -10.071 -3.960 4.903 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -10.380 -4.510 3.268 1.00 0.00 H new ATOM 110 N SER A 8 -8.712 -0.398 5.011 1.00 0.00 N ATOM 111 CA SER A 8 -7.858 0.622 5.590 1.00 0.00 C ATOM 112 C SER A 8 -7.097 1.414 4.503 1.00 0.00 C ATOM 113 O SER A 8 -6.761 2.574 4.693 1.00 0.00 O ATOM 114 CB SER A 8 -6.914 -0.005 6.620 1.00 0.00 C ATOM 115 OG SER A 8 -6.350 -1.222 6.141 1.00 0.00 O ATOM 0 H SER A 8 -8.443 -1.355 5.238 1.00 0.00 H new ATOM 0 HA SER A 8 -8.486 1.346 6.109 1.00 0.00 H new ATOM 0 HB2 SER A 8 -6.116 0.698 6.858 1.00 0.00 H new ATOM 0 HB3 SER A 8 -7.458 -0.195 7.545 1.00 0.00 H new ATOM 0 HG SER A 8 -6.802 -1.981 6.565 1.00 0.00 H new ATOM 121 N ALA A 9 -6.909 0.803 3.340 1.00 0.00 N ATOM 122 CA ALA A 9 -6.195 1.427 2.235 1.00 0.00 C ATOM 123 C ALA A 9 -7.150 2.182 1.306 1.00 0.00 C ATOM 124 O ALA A 9 -6.752 2.676 0.247 1.00 0.00 O ATOM 125 CB ALA A 9 -5.414 0.373 1.460 1.00 0.00 C ATOM 0 H ALA A 9 -7.247 -0.138 3.137 1.00 0.00 H new ATOM 0 HA ALA A 9 -5.497 2.155 2.649 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -4.883 0.847 0.635 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -4.697 -0.110 2.124 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -6.103 -0.374 1.066 1.00 0.00 H new ATOM 131 N PHE A 10 -8.402 2.289 1.717 1.00 0.00 N ATOM 132 CA PHE A 10 -9.420 2.956 0.920 1.00 0.00 C ATOM 133 C PHE A 10 -9.189 4.447 0.770 1.00 0.00 C ATOM 134 O PHE A 10 -8.463 5.068 1.550 1.00 0.00 O ATOM 135 CB PHE A 10 -10.820 2.692 1.447 1.00 0.00 C ATOM 136 CG PHE A 10 -11.393 1.338 1.105 1.00 0.00 C ATOM 137 CD1 PHE A 10 -10.627 0.361 0.488 1.00 0.00 C ATOM 138 CD2 PHE A 10 -12.714 1.055 1.390 1.00 0.00 C ATOM 139 CE1 PHE A 10 -11.168 -0.860 0.172 1.00 0.00 C ATOM 140 CE2 PHE A 10 -13.260 -0.166 1.074 1.00 0.00 C ATOM 141 CZ PHE A 10 -12.490 -1.122 0.464 1.00 0.00 C ATOM 0 H PHE A 10 -8.741 1.920 2.605 1.00 0.00 H new ATOM 0 HA PHE A 10 -9.333 2.517 -0.074 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -10.809 2.800 2.532 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -11.488 3.460 1.057 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -9.592 0.563 0.253 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -13.327 1.804 1.868 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -10.559 -1.614 -0.305 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -14.294 -0.372 1.306 1.00 0.00 H new ATOM 0 HZ PHE A 10 -12.919 -2.081 0.212 1.00 0.00 H new ATOM 151 N GLY A 11 -9.777 4.992 -0.276 1.00 0.00 N ATOM 152 CA GLY A 11 -9.684 6.408 -0.617 1.00 0.00 C ATOM 153 C GLY A 11 -8.384 6.744 -1.316 1.00 0.00 C ATOM 154 O GLY A 11 -8.370 7.473 -2.302 1.00 0.00 O ATOM 0 H GLY A 11 -10.347 4.456 -0.931 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -10.521 6.681 -1.260 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -9.771 7.005 0.291 1.00 0.00 H new ATOM 158 N LYS A 12 -7.331 6.079 -0.904 1.00 0.00 N ATOM 159 CA LYS A 12 -6.011 6.256 -1.464 1.00 0.00 C ATOM 160 C LYS A 12 -5.789 5.232 -2.564 1.00 0.00 C ATOM 161 O LYS A 12 -4.682 5.044 -3.078 1.00 0.00 O ATOM 162 CB LYS A 12 -4.975 6.142 -0.355 1.00 0.00 C ATOM 163 CG LYS A 12 -5.109 7.252 0.684 1.00 0.00 C ATOM 164 CD LYS A 12 -4.152 7.090 1.849 1.00 0.00 C ATOM 165 CE LYS A 12 -2.684 7.176 1.435 1.00 0.00 C ATOM 166 NZ LYS A 12 -1.780 7.057 2.604 1.00 0.00 N ATOM 0 H LYS A 12 -7.368 5.386 -0.156 1.00 0.00 H new ATOM 0 HA LYS A 12 -5.912 7.246 -1.910 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -5.078 5.174 0.136 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -3.976 6.174 -0.790 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -4.930 8.215 0.205 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -6.132 7.269 1.060 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -4.360 7.860 2.592 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -4.332 6.128 2.329 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -2.460 6.385 0.719 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -2.503 8.124 0.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -0.791 7.086 2.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -1.954 7.846 3.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -1.960 6.156 3.091 1.00 0.00 H new ATOM 180 N LEU A 13 -6.897 4.603 -2.938 1.00 0.00 N ATOM 181 CA LEU A 13 -6.974 3.610 -4.001 1.00 0.00 C ATOM 182 C LEU A 13 -6.522 4.222 -5.309 1.00 0.00 C ATOM 183 O LEU A 13 -5.818 3.599 -6.084 1.00 0.00 O ATOM 184 CB LEU A 13 -8.428 3.139 -4.154 1.00 0.00 C ATOM 185 CG LEU A 13 -9.079 2.537 -2.909 1.00 0.00 C ATOM 186 CD1 LEU A 13 -10.535 2.204 -3.176 1.00 0.00 C ATOM 187 CD2 LEU A 13 -8.333 1.302 -2.470 1.00 0.00 C ATOM 0 H LEU A 13 -7.798 4.777 -2.493 1.00 0.00 H new ATOM 0 HA LEU A 13 -6.331 2.767 -3.748 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -9.030 3.988 -4.479 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.465 2.398 -4.952 1.00 0.00 H new ATOM 0 HG LEU A 13 -9.034 3.275 -2.108 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -10.981 1.777 -2.278 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -11.071 3.112 -3.451 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -10.600 1.484 -3.991 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -8.809 0.886 -1.582 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -8.349 0.563 -3.271 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -7.300 1.564 -2.239 1.00 0.00 H new ATOM 199 N LYS A 14 -6.907 5.479 -5.505 1.00 0.00 N ATOM 200 CA LYS A 14 -6.605 6.233 -6.722 1.00 0.00 C ATOM 201 C LYS A 14 -5.097 6.313 -6.931 1.00 0.00 C ATOM 202 O LYS A 14 -4.589 6.197 -8.055 1.00 0.00 O ATOM 203 CB LYS A 14 -7.149 7.663 -6.595 1.00 0.00 C ATOM 204 CG LYS A 14 -8.632 7.770 -6.257 1.00 0.00 C ATOM 205 CD LYS A 14 -9.072 9.229 -6.243 1.00 0.00 C ATOM 206 CE LYS A 14 -10.546 9.390 -5.899 1.00 0.00 C ATOM 207 NZ LYS A 14 -10.831 9.150 -4.464 1.00 0.00 N ATOM 0 H LYS A 14 -7.443 6.010 -4.818 1.00 0.00 H new ATOM 0 HA LYS A 14 -7.070 5.724 -7.566 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -6.580 8.183 -5.825 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -6.969 8.187 -7.534 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -9.219 7.214 -6.988 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -8.823 7.317 -5.284 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -8.471 9.779 -5.519 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -8.880 9.673 -7.220 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -10.869 10.397 -6.165 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -11.133 8.697 -6.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -11.858 9.189 -4.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -10.473 8.212 -4.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -10.362 9.880 -3.890 1.00 0.00 H new ATOM 221 N GLU A 15 -4.406 6.462 -5.829 1.00 0.00 N ATOM 222 CA GLU A 15 -2.989 6.646 -5.800 1.00 0.00 C ATOM 223 C GLU A 15 -2.265 5.329 -6.099 1.00 0.00 C ATOM 224 O GLU A 15 -1.573 5.222 -7.110 1.00 0.00 O ATOM 225 CB GLU A 15 -2.618 7.243 -4.437 1.00 0.00 C ATOM 226 CG GLU A 15 -3.332 8.579 -4.202 1.00 0.00 C ATOM 227 CD GLU A 15 -3.284 9.084 -2.780 1.00 0.00 C ATOM 228 OE1 GLU A 15 -2.294 9.721 -2.383 1.00 0.00 O ATOM 229 OE2 GLU A 15 -4.282 8.936 -2.058 1.00 0.00 O ATOM 0 H GLU A 15 -4.833 6.457 -4.903 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.669 7.338 -6.578 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -2.884 6.542 -3.646 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -1.539 7.390 -4.383 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -2.888 9.331 -4.854 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -4.375 8.474 -4.500 1.00 0.00 H new ATOM 236 N ILE A 16 -2.501 4.308 -5.279 1.00 0.00 N ATOM 237 CA ILE A 16 -1.830 3.002 -5.451 1.00 0.00 C ATOM 238 C ILE A 16 -2.111 2.357 -6.809 1.00 0.00 C ATOM 239 O ILE A 16 -1.199 1.878 -7.483 1.00 0.00 O ATOM 240 CB ILE A 16 -2.170 1.986 -4.319 1.00 0.00 C ATOM 241 CG1 ILE A 16 -3.694 1.814 -4.140 1.00 0.00 C ATOM 242 CG2 ILE A 16 -1.519 2.412 -3.033 1.00 0.00 C ATOM 243 CD1 ILE A 16 -4.098 0.791 -3.093 1.00 0.00 C ATOM 0 H ILE A 16 -3.146 4.349 -4.490 1.00 0.00 H new ATOM 0 HA ILE A 16 -0.767 3.238 -5.395 1.00 0.00 H new ATOM 0 HB ILE A 16 -1.773 1.013 -4.609 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -4.126 2.778 -3.872 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -4.128 1.525 -5.097 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -1.762 1.696 -2.248 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -0.438 2.450 -3.168 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -1.884 3.399 -2.750 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -5.185 0.738 -3.037 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -3.701 -0.186 -3.367 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -3.698 1.086 -2.123 1.00 0.00 H new ATOM 255 N LEU A 17 -3.353 2.402 -7.218 1.00 0.00 N ATOM 256 CA LEU A 17 -3.795 1.758 -8.430 1.00 0.00 C ATOM 257 C LEU A 17 -3.225 2.439 -9.677 1.00 0.00 C ATOM 258 O LEU A 17 -2.716 1.765 -10.587 1.00 0.00 O ATOM 259 CB LEU A 17 -5.330 1.755 -8.432 1.00 0.00 C ATOM 260 CG LEU A 17 -6.068 1.136 -9.610 1.00 0.00 C ATOM 261 CD1 LEU A 17 -5.668 -0.305 -9.816 1.00 0.00 C ATOM 262 CD2 LEU A 17 -7.557 1.231 -9.361 1.00 0.00 C ATOM 0 H LEU A 17 -4.093 2.891 -6.715 1.00 0.00 H new ATOM 0 HA LEU A 17 -3.425 0.733 -8.458 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -5.659 1.238 -7.530 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -5.661 2.790 -8.345 1.00 0.00 H new ATOM 0 HG LEU A 17 -5.804 1.683 -10.515 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -6.214 -0.716 -10.665 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -4.597 -0.361 -10.011 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -5.904 -0.880 -8.920 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -8.095 0.790 -10.200 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -7.808 0.694 -8.446 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -7.842 2.278 -9.257 1.00 0.00 H new ATOM 274 N GLY A 18 -3.249 3.756 -9.689 1.00 0.00 N ATOM 275 CA GLY A 18 -2.840 4.485 -10.865 1.00 0.00 C ATOM 276 C GLY A 18 -1.357 4.753 -10.963 1.00 0.00 C ATOM 277 O GLY A 18 -0.805 4.770 -12.066 1.00 0.00 O ATOM 0 H GLY A 18 -3.545 4.336 -8.904 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -3.153 3.927 -11.748 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -3.369 5.438 -10.886 1.00 0.00 H new ATOM 281 N SER A 19 -0.705 4.946 -9.842 1.00 0.00 N ATOM 282 CA SER A 19 0.699 5.285 -9.856 1.00 0.00 C ATOM 283 C SER A 19 1.571 4.044 -10.033 1.00 0.00 C ATOM 284 O SER A 19 2.619 4.098 -10.699 1.00 0.00 O ATOM 285 CB SER A 19 1.076 6.046 -8.584 1.00 0.00 C ATOM 286 OG SER A 19 0.266 7.215 -8.437 1.00 0.00 O ATOM 0 H SER A 19 -1.120 4.875 -8.913 1.00 0.00 H new ATOM 0 HA SER A 19 0.881 5.934 -10.712 1.00 0.00 H new ATOM 0 HB2 SER A 19 0.950 5.399 -7.716 1.00 0.00 H new ATOM 0 HB3 SER A 19 2.128 6.329 -8.621 1.00 0.00 H new ATOM 0 HG SER A 19 -0.561 6.983 -7.966 1.00 0.00 H new ATOM 292 N ASN A 20 1.140 2.926 -9.474 1.00 0.00 N ATOM 293 CA ASN A 20 1.928 1.715 -9.585 1.00 0.00 C ATOM 294 C ASN A 20 1.598 1.000 -10.865 1.00 0.00 C ATOM 295 O ASN A 20 2.462 0.875 -11.745 1.00 0.00 O ATOM 296 CB ASN A 20 1.667 0.787 -8.407 1.00 0.00 C ATOM 297 CG ASN A 20 2.538 -0.454 -8.432 1.00 0.00 C ATOM 298 OD1 ASN A 20 2.185 -1.467 -9.018 1.00 0.00 O ATOM 299 ND2 ASN A 20 3.668 -0.384 -7.788 1.00 0.00 N ATOM 0 H ASN A 20 0.269 2.833 -8.951 1.00 0.00 H new ATOM 0 HA ASN A 20 2.981 1.996 -9.584 1.00 0.00 H new ATOM 0 HB2 ASN A 20 1.842 1.329 -7.478 1.00 0.00 H new ATOM 0 HB3 ASN A 20 0.618 0.489 -8.410 1.00 0.00 H new ATOM 0 HD21 ASN A 20 4.291 -1.191 -7.762 1.00 0.00 H new ATOM 0 HD22 ASN A 20 3.930 0.478 -7.310 1.00 0.00 H new ATOM 306 N LYS A 21 0.314 0.613 -11.001 1.00 0.00 N ATOM 307 CA LYS A 21 -0.206 -0.125 -12.152 1.00 0.00 C ATOM 308 C LYS A 21 0.513 -1.516 -12.354 1.00 0.00 C ATOM 309 O LYS A 21 1.706 -1.674 -12.134 1.00 0.00 O ATOM 310 CB LYS A 21 -0.183 0.800 -13.419 1.00 0.00 C ATOM 311 CG LYS A 21 -0.934 0.310 -14.678 1.00 0.00 C ATOM 312 CD LYS A 21 -0.189 -0.775 -15.464 1.00 0.00 C ATOM 313 CE LYS A 21 1.111 -0.257 -16.085 1.00 0.00 C ATOM 314 NZ LYS A 21 0.866 0.778 -17.118 1.00 0.00 N ATOM 0 H LYS A 21 -0.397 0.812 -10.297 1.00 0.00 H new ATOM 0 HA LYS A 21 -1.246 -0.393 -11.965 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -0.598 1.767 -13.136 1.00 0.00 H new ATOM 0 HB3 LYS A 21 0.858 0.968 -13.693 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -1.909 -0.076 -14.380 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -1.115 1.161 -15.335 1.00 0.00 H new ATOM 0 HD2 LYS A 21 0.036 -1.610 -14.801 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -0.837 -1.159 -16.252 1.00 0.00 H new ATOM 0 HE2 LYS A 21 1.746 0.157 -15.302 1.00 0.00 H new ATOM 0 HE3 LYS A 21 1.656 -1.090 -16.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 1.751 0.976 -17.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 0.149 0.436 -17.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 0.526 1.649 -16.663 1.00 0.00 H new ATOM 328 N ASN A 22 -0.267 -2.499 -12.741 1.00 0.00 N ATOM 329 CA ASN A 22 0.175 -3.876 -13.048 1.00 0.00 C ATOM 330 C ASN A 22 0.353 -4.763 -11.828 1.00 0.00 C ATOM 331 O ASN A 22 1.467 -5.108 -11.406 1.00 0.00 O ATOM 332 CB ASN A 22 1.347 -4.007 -14.049 1.00 0.00 C ATOM 333 CG ASN A 22 1.520 -5.449 -14.557 1.00 0.00 C ATOM 334 OD1 ASN A 22 2.248 -6.269 -13.977 1.00 0.00 O ATOM 335 ND2 ASN A 22 0.852 -5.766 -15.646 1.00 0.00 N ATOM 0 H ASN A 22 -1.272 -2.375 -12.861 1.00 0.00 H new ATOM 0 HA ASN A 22 -0.685 -4.268 -13.591 1.00 0.00 H new ATOM 0 HB2 ASN A 22 1.175 -3.343 -14.896 1.00 0.00 H new ATOM 0 HB3 ASN A 22 2.270 -3.679 -13.570 1.00 0.00 H new ATOM 0 HD21 ASN A 22 0.926 -6.707 -16.034 1.00 0.00 H new ATOM 0 HD22 ASN A 22 0.261 -5.071 -16.102 1.00 0.00 H new ATOM 342 N TYR A 23 -0.748 -4.959 -11.206 1.00 0.00 N ATOM 343 CA TYR A 23 -1.017 -5.965 -10.227 1.00 0.00 C ATOM 344 C TYR A 23 -2.441 -6.310 -10.454 1.00 0.00 C ATOM 345 O TYR A 23 -3.208 -5.451 -10.928 1.00 0.00 O ATOM 346 CB TYR A 23 -0.893 -5.471 -8.780 1.00 0.00 C ATOM 347 CG TYR A 23 0.485 -5.455 -8.181 1.00 0.00 C ATOM 348 CD1 TYR A 23 0.986 -6.575 -7.530 1.00 0.00 C ATOM 349 CD2 TYR A 23 1.259 -4.326 -8.225 1.00 0.00 C ATOM 350 CE1 TYR A 23 2.231 -6.567 -6.937 1.00 0.00 C ATOM 351 CE2 TYR A 23 2.525 -4.300 -7.634 1.00 0.00 C ATOM 352 CZ TYR A 23 2.998 -5.430 -6.988 1.00 0.00 C ATOM 353 OH TYR A 23 4.251 -5.426 -6.405 1.00 0.00 O ATOM 0 H TYR A 23 -1.563 -4.371 -11.379 1.00 0.00 H new ATOM 0 HA TYR A 23 -0.304 -6.783 -10.335 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -1.295 -4.459 -8.732 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -1.528 -6.097 -8.153 1.00 0.00 H new ATOM 0 HD1 TYR A 23 0.387 -7.473 -7.487 1.00 0.00 H new ATOM 0 HD2 TYR A 23 0.886 -3.444 -8.723 1.00 0.00 H new ATOM 0 HE1 TYR A 23 2.600 -7.450 -6.436 1.00 0.00 H new ATOM 0 HE2 TYR A 23 3.129 -3.406 -7.681 1.00 0.00 H new ATOM 0 HH TYR A 23 4.666 -4.547 -6.529 1.00 0.00 H new ATOM 363 N LYS A 24 -2.823 -7.501 -10.182 1.00 0.00 N ATOM 364 CA LYS A 24 -4.194 -7.822 -10.280 1.00 0.00 C ATOM 365 C LYS A 24 -4.811 -7.494 -8.941 1.00 0.00 C ATOM 366 O LYS A 24 -4.736 -8.282 -7.996 1.00 0.00 O ATOM 367 CB LYS A 24 -4.420 -9.285 -10.683 1.00 0.00 C ATOM 368 CG LYS A 24 -5.885 -9.699 -10.977 1.00 0.00 C ATOM 369 CD LYS A 24 -6.502 -8.989 -12.210 1.00 0.00 C ATOM 370 CE LYS A 24 -7.116 -7.625 -11.888 1.00 0.00 C ATOM 371 NZ LYS A 24 -7.621 -6.929 -13.097 1.00 0.00 N ATOM 0 H LYS A 24 -2.211 -8.264 -9.892 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.668 -7.241 -11.071 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.822 -9.492 -11.570 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -4.038 -9.922 -9.885 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.923 -10.777 -11.134 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -6.497 -9.482 -10.101 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.730 -8.861 -12.969 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -7.270 -9.631 -12.642 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.934 -7.757 -11.180 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -6.369 -7.000 -11.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -7.965 -5.983 -12.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -6.852 -6.838 -13.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -8.400 -7.477 -13.513 1.00 0.00 H new ATOM 385 N PHE A 25 -5.322 -6.292 -8.844 1.00 0.00 N ATOM 386 CA PHE A 25 -5.885 -5.801 -7.619 1.00 0.00 C ATOM 387 C PHE A 25 -7.223 -6.443 -7.370 1.00 0.00 C ATOM 388 O PHE A 25 -8.107 -6.447 -8.242 1.00 0.00 O ATOM 389 CB PHE A 25 -6.015 -4.273 -7.640 1.00 0.00 C ATOM 390 CG PHE A 25 -4.705 -3.515 -7.672 1.00 0.00 C ATOM 391 CD1 PHE A 25 -4.082 -3.221 -8.872 1.00 0.00 C ATOM 392 CD2 PHE A 25 -4.113 -3.078 -6.497 1.00 0.00 C ATOM 393 CE1 PHE A 25 -2.895 -2.508 -8.905 1.00 0.00 C ATOM 394 CE2 PHE A 25 -2.924 -2.367 -6.524 1.00 0.00 C ATOM 395 CZ PHE A 25 -2.316 -2.082 -7.729 1.00 0.00 C ATOM 0 H PHE A 25 -5.358 -5.627 -9.617 1.00 0.00 H new ATOM 0 HA PHE A 25 -5.210 -6.065 -6.805 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -6.604 -3.986 -8.512 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -6.576 -3.960 -6.759 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -4.528 -3.553 -9.798 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -4.584 -3.294 -5.550 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -2.424 -2.286 -9.851 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -2.473 -2.036 -5.600 1.00 0.00 H new ATOM 0 HZ PHE A 25 -1.390 -1.527 -7.751 1.00 0.00 H new ATOM 405 N VAL A 26 -7.343 -7.009 -6.213 1.00 0.00 N ATOM 406 CA VAL A 26 -8.512 -7.709 -5.791 1.00 0.00 C ATOM 407 C VAL A 26 -9.069 -7.036 -4.547 1.00 0.00 C ATOM 408 O VAL A 26 -8.321 -6.698 -3.618 1.00 0.00 O ATOM 409 CB VAL A 26 -8.187 -9.201 -5.462 1.00 0.00 C ATOM 410 CG1 VAL A 26 -9.436 -9.966 -5.051 1.00 0.00 C ATOM 411 CG2 VAL A 26 -7.504 -9.896 -6.634 1.00 0.00 C ATOM 0 H VAL A 26 -6.603 -6.996 -5.511 1.00 0.00 H new ATOM 0 HA VAL A 26 -9.242 -7.685 -6.600 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.496 -9.197 -4.619 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -9.173 -11.000 -4.829 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -9.870 -9.504 -4.164 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -10.161 -9.942 -5.864 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -7.293 -10.932 -6.370 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.159 -9.870 -7.505 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -6.571 -9.383 -6.867 1.00 0.00 H new ATOM 421 N ILE A 27 -10.342 -6.817 -4.549 1.00 0.00 N ATOM 422 CA ILE A 27 -11.017 -6.270 -3.420 1.00 0.00 C ATOM 423 C ILE A 27 -12.021 -7.320 -2.926 1.00 0.00 C ATOM 424 O ILE A 27 -12.407 -8.221 -3.682 1.00 0.00 O ATOM 425 CB ILE A 27 -11.704 -4.900 -3.758 1.00 0.00 C ATOM 426 CG1 ILE A 27 -12.277 -4.228 -2.504 1.00 0.00 C ATOM 427 CG2 ILE A 27 -12.785 -5.067 -4.810 1.00 0.00 C ATOM 428 CD1 ILE A 27 -11.242 -3.959 -1.437 1.00 0.00 C ATOM 0 H ILE A 27 -10.950 -7.015 -5.344 1.00 0.00 H new ATOM 0 HA ILE A 27 -10.303 -6.044 -2.628 1.00 0.00 H new ATOM 0 HB ILE A 27 -10.930 -4.249 -4.164 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -12.747 -3.286 -2.789 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -13.060 -4.862 -2.088 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -13.240 -4.099 -5.021 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -12.345 -5.468 -5.723 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -13.547 -5.754 -4.443 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -11.718 -3.483 -0.580 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -10.789 -4.900 -1.124 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.471 -3.300 -1.836 1.00 0.00 H new ATOM 440 N THR A 28 -12.394 -7.236 -1.694 1.00 0.00 N ATOM 441 CA THR A 28 -13.245 -8.200 -1.083 1.00 0.00 C ATOM 442 C THR A 28 -14.719 -7.796 -1.138 1.00 0.00 C ATOM 443 O THR A 28 -15.058 -6.624 -1.412 1.00 0.00 O ATOM 444 CB THR A 28 -12.807 -8.364 0.365 1.00 0.00 C ATOM 445 OG1 THR A 28 -12.668 -7.057 0.963 1.00 0.00 O ATOM 446 CG2 THR A 28 -11.483 -9.086 0.429 1.00 0.00 C ATOM 0 H THR A 28 -12.110 -6.480 -1.071 1.00 0.00 H new ATOM 0 HA THR A 28 -13.157 -9.138 -1.631 1.00 0.00 H new ATOM 0 HB THR A 28 -13.554 -8.946 0.904 1.00 0.00 H new ATOM 0 HG1 THR A 28 -12.388 -7.153 1.897 1.00 0.00 H new ATOM 0 HG21 THR A 28 -11.179 -9.198 1.470 1.00 0.00 H new ATOM 0 HG22 THR A 28 -11.583 -10.071 -0.027 1.00 0.00 H new ATOM 0 HG23 THR A 28 -10.729 -8.512 -0.109 1.00 0.00 H new ATOM 454 N THR A 29 -15.581 -8.759 -0.873 1.00 0.00 N ATOM 455 CA THR A 29 -17.005 -8.558 -0.809 1.00 0.00 C ATOM 456 C THR A 29 -17.394 -7.596 0.307 1.00 0.00 C ATOM 457 O THR A 29 -18.283 -6.748 0.137 1.00 0.00 O ATOM 458 CB THR A 29 -17.722 -9.901 -0.644 1.00 0.00 C ATOM 459 OG1 THR A 29 -16.876 -10.836 0.095 1.00 0.00 O ATOM 460 CG2 THR A 29 -18.086 -10.470 -1.999 1.00 0.00 C ATOM 0 H THR A 29 -15.298 -9.722 -0.693 1.00 0.00 H new ATOM 0 HA THR A 29 -17.319 -8.103 -1.748 1.00 0.00 H new ATOM 0 HB THR A 29 -18.640 -9.743 -0.078 1.00 0.00 H new ATOM 0 HG1 THR A 29 -16.445 -10.368 0.841 1.00 0.00 H new ATOM 0 HG21 THR A 29 -18.595 -11.425 -1.868 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.745 -9.776 -2.520 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.180 -10.620 -2.586 1.00 0.00 H new ATOM 468 N LEU A 30 -16.729 -7.701 1.438 1.00 0.00 N ATOM 469 CA LEU A 30 -16.974 -6.774 2.511 1.00 0.00 C ATOM 470 C LEU A 30 -16.386 -5.428 2.158 1.00 0.00 C ATOM 471 O LEU A 30 -16.959 -4.402 2.479 1.00 0.00 O ATOM 472 CB LEU A 30 -16.422 -7.287 3.842 1.00 0.00 C ATOM 473 CG LEU A 30 -17.080 -8.555 4.401 1.00 0.00 C ATOM 474 CD1 LEU A 30 -16.397 -8.986 5.681 1.00 0.00 C ATOM 475 CD2 LEU A 30 -18.567 -8.333 4.648 1.00 0.00 C ATOM 0 H LEU A 30 -16.024 -8.412 1.633 1.00 0.00 H new ATOM 0 HA LEU A 30 -18.052 -6.670 2.639 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -15.356 -7.479 3.720 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -16.521 -6.494 4.583 1.00 0.00 H new ATOM 0 HG LEU A 30 -16.970 -9.347 3.660 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -16.877 -9.887 6.064 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -15.345 -9.192 5.481 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -16.476 -8.190 6.422 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -19.010 -9.247 5.044 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -18.700 -7.524 5.366 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -19.056 -8.069 3.710 1.00 0.00 H new ATOM 487 N GLY A 31 -15.273 -5.459 1.428 1.00 0.00 N ATOM 488 CA GLY A 31 -14.608 -4.253 0.987 1.00 0.00 C ATOM 489 C GLY A 31 -15.503 -3.385 0.126 1.00 0.00 C ATOM 490 O GLY A 31 -15.685 -2.204 0.413 1.00 0.00 O ATOM 0 H GLY A 31 -14.815 -6.321 1.131 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -14.280 -3.683 1.856 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -13.713 -4.519 0.424 1.00 0.00 H new ATOM 494 N VAL A 32 -16.089 -3.973 -0.914 1.00 0.00 N ATOM 495 CA VAL A 32 -16.978 -3.221 -1.800 1.00 0.00 C ATOM 496 C VAL A 32 -18.214 -2.706 -1.063 1.00 0.00 C ATOM 497 O VAL A 32 -18.618 -1.563 -1.253 1.00 0.00 O ATOM 498 CB VAL A 32 -17.391 -3.999 -3.093 1.00 0.00 C ATOM 499 CG1 VAL A 32 -16.188 -4.267 -3.967 1.00 0.00 C ATOM 500 CG2 VAL A 32 -18.104 -5.307 -2.775 1.00 0.00 C ATOM 0 H VAL A 32 -15.968 -4.955 -1.163 1.00 0.00 H new ATOM 0 HA VAL A 32 -16.388 -2.366 -2.131 1.00 0.00 H new ATOM 0 HB VAL A 32 -18.091 -3.362 -3.633 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -16.500 -4.809 -4.860 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -15.732 -3.321 -4.258 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -15.463 -4.865 -3.415 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -18.371 -5.811 -3.704 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -17.444 -5.948 -2.191 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -19.008 -5.099 -2.202 1.00 0.00 H new ATOM 510 N SER A 33 -18.765 -3.527 -0.182 1.00 0.00 N ATOM 511 CA SER A 33 -19.947 -3.163 0.577 1.00 0.00 C ATOM 512 C SER A 33 -19.633 -1.993 1.523 1.00 0.00 C ATOM 513 O SER A 33 -20.437 -1.047 1.669 1.00 0.00 O ATOM 514 CB SER A 33 -20.445 -4.384 1.360 1.00 0.00 C ATOM 515 OG SER A 33 -20.639 -5.505 0.489 1.00 0.00 O ATOM 0 H SER A 33 -18.406 -4.459 0.025 1.00 0.00 H new ATOM 0 HA SER A 33 -20.733 -2.839 -0.106 1.00 0.00 H new ATOM 0 HB2 SER A 33 -19.725 -4.642 2.136 1.00 0.00 H new ATOM 0 HB3 SER A 33 -21.382 -4.142 1.862 1.00 0.00 H new ATOM 0 HG SER A 33 -19.898 -6.137 0.599 1.00 0.00 H new ATOM 521 N PHE A 34 -18.450 -2.056 2.125 1.00 0.00 N ATOM 522 CA PHE A 34 -17.952 -1.039 3.028 1.00 0.00 C ATOM 523 C PHE A 34 -17.779 0.269 2.272 1.00 0.00 C ATOM 524 O PHE A 34 -18.281 1.313 2.697 1.00 0.00 O ATOM 525 CB PHE A 34 -16.614 -1.512 3.636 1.00 0.00 C ATOM 526 CG PHE A 34 -16.003 -0.599 4.660 1.00 0.00 C ATOM 527 CD1 PHE A 34 -16.406 -0.654 5.979 1.00 0.00 C ATOM 528 CD2 PHE A 34 -15.011 0.298 4.306 1.00 0.00 C ATOM 529 CE1 PHE A 34 -15.837 0.170 6.927 1.00 0.00 C ATOM 530 CE2 PHE A 34 -14.441 1.123 5.246 1.00 0.00 C ATOM 531 CZ PHE A 34 -14.854 1.060 6.559 1.00 0.00 C ATOM 0 H PHE A 34 -17.802 -2.833 1.993 1.00 0.00 H new ATOM 0 HA PHE A 34 -18.662 -0.874 3.838 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -16.770 -2.489 4.094 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -15.897 -1.650 2.826 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -17.177 -1.351 6.272 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -14.681 0.351 3.279 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -16.162 0.117 7.956 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -13.669 1.821 4.955 1.00 0.00 H new ATOM 0 HZ PHE A 34 -14.407 1.708 7.298 1.00 0.00 H new ATOM 541 N ALA A 35 -17.118 0.188 1.121 1.00 0.00 N ATOM 542 CA ALA A 35 -16.854 1.346 0.277 1.00 0.00 C ATOM 543 C ALA A 35 -18.140 2.070 -0.110 1.00 0.00 C ATOM 544 O ALA A 35 -18.180 3.302 -0.121 1.00 0.00 O ATOM 545 CB ALA A 35 -16.080 0.940 -0.962 1.00 0.00 C ATOM 0 H ALA A 35 -16.750 -0.687 0.747 1.00 0.00 H new ATOM 0 HA ALA A 35 -16.247 2.041 0.858 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -15.893 1.819 -1.579 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -15.130 0.495 -0.668 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -16.660 0.214 -1.532 1.00 0.00 H new ATOM 551 N ILE A 36 -19.190 1.303 -0.392 1.00 0.00 N ATOM 552 CA ILE A 36 -20.494 1.865 -0.747 1.00 0.00 C ATOM 553 C ILE A 36 -21.037 2.746 0.384 1.00 0.00 C ATOM 554 O ILE A 36 -21.262 3.945 0.197 1.00 0.00 O ATOM 555 CB ILE A 36 -21.545 0.752 -1.088 1.00 0.00 C ATOM 556 CG1 ILE A 36 -21.121 -0.068 -2.319 1.00 0.00 C ATOM 557 CG2 ILE A 36 -22.945 1.341 -1.298 1.00 0.00 C ATOM 558 CD1 ILE A 36 -20.957 0.741 -3.592 1.00 0.00 C ATOM 0 H ILE A 36 -19.164 0.283 -0.382 1.00 0.00 H new ATOM 0 HA ILE A 36 -20.338 2.472 -1.639 1.00 0.00 H new ATOM 0 HB ILE A 36 -21.584 0.082 -0.229 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -20.178 -0.569 -2.098 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -21.863 -0.848 -2.493 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -23.646 0.539 -1.532 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -23.266 1.849 -0.389 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -22.920 2.054 -2.122 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -20.657 0.081 -4.406 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -21.903 1.220 -3.843 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -20.193 1.504 -3.443 1.00 0.00 H new ATOM 570 N LYS A 37 -21.173 2.168 1.572 1.00 0.00 N ATOM 571 CA LYS A 37 -21.789 2.874 2.684 1.00 0.00 C ATOM 572 C LYS A 37 -20.910 4.002 3.214 1.00 0.00 C ATOM 573 O LYS A 37 -21.409 4.987 3.756 1.00 0.00 O ATOM 574 CB LYS A 37 -22.277 1.891 3.789 1.00 0.00 C ATOM 575 CG LYS A 37 -21.208 1.042 4.503 1.00 0.00 C ATOM 576 CD LYS A 37 -20.479 1.829 5.590 1.00 0.00 C ATOM 577 CE LYS A 37 -19.462 0.976 6.333 1.00 0.00 C ATOM 578 NZ LYS A 37 -20.088 -0.168 7.037 1.00 0.00 N ATOM 0 H LYS A 37 -20.867 1.219 1.787 1.00 0.00 H new ATOM 0 HA LYS A 37 -22.684 3.366 2.303 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -22.808 2.470 4.545 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -23.002 1.212 3.340 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -21.679 0.165 4.946 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -20.485 0.680 3.772 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -19.974 2.684 5.140 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -21.206 2.225 6.299 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -18.721 0.602 5.627 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -18.930 1.596 7.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -19.398 -0.596 7.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -20.911 0.166 7.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -20.395 -0.878 6.342 1.00 0.00 H new ATOM 592 N SER A 38 -19.613 3.872 3.031 1.00 0.00 N ATOM 593 CA SER A 38 -18.698 4.899 3.446 1.00 0.00 C ATOM 594 C SER A 38 -18.622 6.035 2.412 1.00 0.00 C ATOM 595 O SER A 38 -18.199 7.140 2.740 1.00 0.00 O ATOM 596 CB SER A 38 -17.317 4.307 3.703 1.00 0.00 C ATOM 597 OG SER A 38 -17.365 3.320 4.720 1.00 0.00 O ATOM 0 H SER A 38 -19.174 3.061 2.596 1.00 0.00 H new ATOM 0 HA SER A 38 -19.072 5.327 4.376 1.00 0.00 H new ATOM 0 HB2 SER A 38 -16.930 3.868 2.784 1.00 0.00 H new ATOM 0 HB3 SER A 38 -16.627 5.099 3.993 1.00 0.00 H new ATOM 0 HG SER A 38 -17.661 2.468 4.336 1.00 0.00 H new ATOM 603 N GLY A 39 -19.054 5.766 1.189 1.00 0.00 N ATOM 604 CA GLY A 39 -18.993 6.774 0.145 1.00 0.00 C ATOM 605 C GLY A 39 -17.597 6.876 -0.419 1.00 0.00 C ATOM 606 O GLY A 39 -17.112 7.957 -0.742 1.00 0.00 O ATOM 0 H GLY A 39 -19.446 4.870 0.899 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -19.694 6.523 -0.651 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -19.299 7.740 0.547 1.00 0.00 H new ATOM 610 N ILE A 40 -16.960 5.748 -0.525 1.00 0.00 N ATOM 611 CA ILE A 40 -15.611 5.649 -1.004 1.00 0.00 C ATOM 612 C ILE A 40 -15.636 5.188 -2.451 1.00 0.00 C ATOM 613 O ILE A 40 -16.469 4.358 -2.820 1.00 0.00 O ATOM 614 CB ILE A 40 -14.807 4.659 -0.117 1.00 0.00 C ATOM 615 CG1 ILE A 40 -14.714 5.229 1.315 1.00 0.00 C ATOM 616 CG2 ILE A 40 -13.421 4.371 -0.698 1.00 0.00 C ATOM 617 CD1 ILE A 40 -14.046 4.326 2.326 1.00 0.00 C ATOM 0 H ILE A 40 -17.373 4.849 -0.275 1.00 0.00 H new ATOM 0 HA ILE A 40 -15.121 6.621 -0.951 1.00 0.00 H new ATOM 0 HB ILE A 40 -15.331 3.703 -0.090 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -14.169 6.172 1.278 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -15.721 5.456 1.664 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -12.891 3.675 -0.048 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -13.526 3.932 -1.690 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -12.856 5.301 -0.770 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -14.031 4.817 3.299 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -14.600 3.390 2.401 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -13.024 4.118 2.009 1.00 0.00 H new ATOM 629 N ASP A 41 -14.765 5.766 -3.260 1.00 0.00 N ATOM 630 CA ASP A 41 -14.667 5.468 -4.692 1.00 0.00 C ATOM 631 C ASP A 41 -14.332 4.015 -4.932 1.00 0.00 C ATOM 632 O ASP A 41 -13.172 3.612 -4.830 1.00 0.00 O ATOM 633 CB ASP A 41 -13.581 6.322 -5.359 1.00 0.00 C ATOM 634 CG ASP A 41 -13.803 7.793 -5.221 1.00 0.00 C ATOM 635 OD1 ASP A 41 -13.356 8.378 -4.218 1.00 0.00 O ATOM 636 OD2 ASP A 41 -14.393 8.398 -6.120 1.00 0.00 O ATOM 0 H ASP A 41 -14.094 6.466 -2.944 1.00 0.00 H new ATOM 0 HA ASP A 41 -15.641 5.696 -5.125 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -12.614 6.067 -4.925 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -13.532 6.069 -6.418 1.00 0.00 H new ATOM 641 N ILE A 42 -15.329 3.233 -5.218 1.00 0.00 N ATOM 642 CA ILE A 42 -15.121 1.841 -5.499 1.00 0.00 C ATOM 643 C ILE A 42 -15.366 1.570 -6.982 1.00 0.00 C ATOM 644 O ILE A 42 -14.706 0.723 -7.585 1.00 0.00 O ATOM 645 CB ILE A 42 -15.994 0.911 -4.586 1.00 0.00 C ATOM 646 CG1 ILE A 42 -15.665 -0.574 -4.807 1.00 0.00 C ATOM 647 CG2 ILE A 42 -17.485 1.165 -4.765 1.00 0.00 C ATOM 648 CD1 ILE A 42 -14.244 -0.951 -4.426 1.00 0.00 C ATOM 0 H ILE A 42 -16.302 3.536 -5.263 1.00 0.00 H new ATOM 0 HA ILE A 42 -14.084 1.601 -5.267 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.740 1.163 -3.557 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -16.360 -1.181 -4.226 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -15.827 -0.820 -5.856 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -18.049 0.498 -4.113 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -17.711 2.200 -4.508 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -17.764 0.979 -5.802 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -14.088 -2.014 -4.610 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -13.541 -0.372 -5.025 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -14.082 -0.738 -3.369 1.00 0.00 H new ATOM 660 N ASP A 43 -16.270 2.350 -7.584 1.00 0.00 N ATOM 661 CA ASP A 43 -16.597 2.210 -9.007 1.00 0.00 C ATOM 662 C ASP A 43 -15.385 2.434 -9.845 1.00 0.00 C ATOM 663 O ASP A 43 -15.063 1.623 -10.691 1.00 0.00 O ATOM 664 CB ASP A 43 -17.697 3.177 -9.470 1.00 0.00 C ATOM 665 CG ASP A 43 -19.073 2.823 -8.989 1.00 0.00 C ATOM 666 OD1 ASP A 43 -19.643 1.822 -9.474 1.00 0.00 O ATOM 667 OD2 ASP A 43 -19.627 3.555 -8.132 1.00 0.00 O ATOM 0 H ASP A 43 -16.789 3.087 -7.107 1.00 0.00 H new ATOM 0 HA ASP A 43 -16.969 1.193 -9.131 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -17.451 4.181 -9.124 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -17.702 3.208 -10.560 1.00 0.00 H new ATOM 672 N SER A 44 -14.690 3.523 -9.575 1.00 0.00 N ATOM 673 CA SER A 44 -13.502 3.876 -10.315 1.00 0.00 C ATOM 674 C SER A 44 -12.412 2.812 -10.131 1.00 0.00 C ATOM 675 O SER A 44 -11.692 2.498 -11.061 1.00 0.00 O ATOM 676 CB SER A 44 -13.002 5.269 -9.898 1.00 0.00 C ATOM 677 OG SER A 44 -11.938 5.723 -10.726 1.00 0.00 O ATOM 0 H SER A 44 -14.936 4.184 -8.838 1.00 0.00 H new ATOM 0 HA SER A 44 -13.751 3.914 -11.375 1.00 0.00 H new ATOM 0 HB2 SER A 44 -13.827 5.980 -9.946 1.00 0.00 H new ATOM 0 HB3 SER A 44 -12.667 5.239 -8.861 1.00 0.00 H new ATOM 0 HG SER A 44 -12.201 6.557 -11.169 1.00 0.00 H new ATOM 683 N ALA A 45 -12.347 2.214 -8.950 1.00 0.00 N ATOM 684 CA ALA A 45 -11.360 1.185 -8.676 1.00 0.00 C ATOM 685 C ALA A 45 -11.643 -0.037 -9.546 1.00 0.00 C ATOM 686 O ALA A 45 -10.765 -0.515 -10.285 1.00 0.00 O ATOM 687 CB ALA A 45 -11.367 0.818 -7.194 1.00 0.00 C ATOM 0 H ALA A 45 -12.967 2.425 -8.168 1.00 0.00 H new ATOM 0 HA ALA A 45 -10.367 1.564 -8.918 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.621 0.045 -7.007 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -11.132 1.701 -6.599 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -12.353 0.445 -6.916 1.00 0.00 H new ATOM 693 N LEU A 46 -12.890 -0.485 -9.507 1.00 0.00 N ATOM 694 CA LEU A 46 -13.352 -1.623 -10.297 1.00 0.00 C ATOM 695 C LEU A 46 -13.187 -1.325 -11.787 1.00 0.00 C ATOM 696 O LEU A 46 -12.777 -2.176 -12.574 1.00 0.00 O ATOM 697 CB LEU A 46 -14.830 -1.909 -9.987 1.00 0.00 C ATOM 698 CG LEU A 46 -15.178 -2.254 -8.527 1.00 0.00 C ATOM 699 CD1 LEU A 46 -16.679 -2.391 -8.350 1.00 0.00 C ATOM 700 CD2 LEU A 46 -14.481 -3.533 -8.083 1.00 0.00 C ATOM 0 H LEU A 46 -13.616 -0.068 -8.924 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.755 -2.498 -10.039 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -15.414 -1.036 -10.278 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -15.156 -2.735 -10.619 1.00 0.00 H new ATOM 0 HG LEU A 46 -14.824 -1.435 -7.901 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -16.902 -2.635 -7.311 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -17.164 -1.451 -8.614 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -17.051 -3.185 -8.997 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -14.746 -3.751 -7.048 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -14.796 -4.359 -8.720 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -13.401 -3.405 -8.162 1.00 0.00 H new ATOM 712 N ASP A 47 -13.484 -0.101 -12.152 1.00 0.00 N ATOM 713 CA ASP A 47 -13.386 0.371 -13.531 1.00 0.00 C ATOM 714 C ASP A 47 -11.948 0.380 -14.039 1.00 0.00 C ATOM 715 O ASP A 47 -11.684 0.004 -15.182 1.00 0.00 O ATOM 716 CB ASP A 47 -14.006 1.759 -13.671 1.00 0.00 C ATOM 717 CG ASP A 47 -13.910 2.308 -15.074 1.00 0.00 C ATOM 718 OD1 ASP A 47 -14.625 1.799 -15.979 1.00 0.00 O ATOM 719 OD2 ASP A 47 -13.128 3.252 -15.305 1.00 0.00 O ATOM 0 H ASP A 47 -13.806 0.612 -11.498 1.00 0.00 H new ATOM 0 HA ASP A 47 -13.944 -0.333 -14.148 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -15.054 1.714 -13.375 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -13.509 2.444 -12.984 1.00 0.00 H new ATOM 724 N ARG A 48 -11.014 0.768 -13.191 1.00 0.00 N ATOM 725 CA ARG A 48 -9.611 0.813 -13.590 1.00 0.00 C ATOM 726 C ARG A 48 -8.981 -0.574 -13.560 1.00 0.00 C ATOM 727 O ARG A 48 -7.845 -0.750 -13.984 1.00 0.00 O ATOM 728 CB ARG A 48 -8.802 1.780 -12.740 1.00 0.00 C ATOM 729 CG ARG A 48 -9.323 3.198 -12.743 1.00 0.00 C ATOM 730 CD ARG A 48 -8.477 4.082 -11.867 1.00 0.00 C ATOM 731 NE ARG A 48 -9.213 5.268 -11.429 1.00 0.00 N ATOM 732 CZ ARG A 48 -8.680 6.400 -10.969 1.00 0.00 C ATOM 733 NH1 ARG A 48 -7.368 6.635 -11.076 1.00 0.00 N ATOM 734 NH2 ARG A 48 -9.479 7.314 -10.443 1.00 0.00 N ATOM 0 H ARG A 48 -11.194 1.055 -12.229 1.00 0.00 H new ATOM 0 HA ARG A 48 -9.592 1.180 -14.616 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.783 1.415 -11.713 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -7.772 1.783 -13.096 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -9.328 3.586 -13.762 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -10.355 3.211 -12.392 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -8.142 3.519 -10.996 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -7.584 4.388 -12.412 1.00 0.00 H new ATOM 0 HE ARG A 48 -10.231 5.225 -11.480 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -6.760 5.943 -11.515 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -6.975 7.506 -10.719 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -10.484 7.146 -10.395 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -9.090 8.187 -10.086 1.00 0.00 H new ATOM 748 N GLY A 49 -9.711 -1.558 -13.054 1.00 0.00 N ATOM 749 CA GLY A 49 -9.218 -2.912 -13.119 1.00 0.00 C ATOM 750 C GLY A 49 -9.135 -3.653 -11.799 1.00 0.00 C ATOM 751 O GLY A 49 -8.499 -4.706 -11.733 1.00 0.00 O ATOM 0 H GLY A 49 -10.621 -1.443 -12.607 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -9.861 -3.480 -13.792 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -8.224 -2.895 -13.566 1.00 0.00 H new ATOM 755 N VAL A 50 -9.725 -3.129 -10.753 1.00 0.00 N ATOM 756 CA VAL A 50 -9.780 -3.872 -9.499 1.00 0.00 C ATOM 757 C VAL A 50 -10.953 -4.847 -9.582 1.00 0.00 C ATOM 758 O VAL A 50 -12.034 -4.467 -10.007 1.00 0.00 O ATOM 759 CB VAL A 50 -9.946 -2.934 -8.258 1.00 0.00 C ATOM 760 CG1 VAL A 50 -10.053 -3.730 -6.965 1.00 0.00 C ATOM 761 CG2 VAL A 50 -8.785 -1.961 -8.161 1.00 0.00 C ATOM 0 H VAL A 50 -10.168 -2.211 -10.734 1.00 0.00 H new ATOM 0 HA VAL A 50 -8.838 -4.402 -9.363 1.00 0.00 H new ATOM 0 HB VAL A 50 -10.872 -2.377 -8.397 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -10.167 -3.045 -6.125 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -10.919 -4.391 -7.015 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -9.150 -4.325 -6.828 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -8.921 -1.318 -7.291 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -7.852 -2.516 -8.060 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.747 -1.349 -9.062 1.00 0.00 H new ATOM 771 N ILE A 51 -10.728 -6.091 -9.239 1.00 0.00 N ATOM 772 CA ILE A 51 -11.781 -7.095 -9.293 1.00 0.00 C ATOM 773 C ILE A 51 -12.210 -7.476 -7.897 1.00 0.00 C ATOM 774 O ILE A 51 -11.405 -7.452 -6.971 1.00 0.00 O ATOM 775 CB ILE A 51 -11.357 -8.378 -10.062 1.00 0.00 C ATOM 776 CG1 ILE A 51 -10.080 -8.991 -9.447 1.00 0.00 C ATOM 777 CG2 ILE A 51 -11.176 -8.075 -11.548 1.00 0.00 C ATOM 778 CD1 ILE A 51 -9.659 -10.305 -10.058 1.00 0.00 C ATOM 0 H ILE A 51 -9.825 -6.441 -8.918 1.00 0.00 H new ATOM 0 HA ILE A 51 -12.610 -6.643 -9.837 1.00 0.00 H new ATOM 0 HB ILE A 51 -12.152 -9.118 -9.967 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -9.263 -8.277 -9.552 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -10.240 -9.136 -8.379 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -10.879 -8.984 -12.071 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -12.116 -7.709 -11.962 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -10.404 -7.316 -11.673 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -8.754 -10.662 -9.566 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -10.455 -11.038 -9.929 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -9.463 -10.166 -11.121 1.00 0.00 H new ATOM 790 N VAL A 52 -13.452 -7.814 -7.737 1.00 0.00 N ATOM 791 CA VAL A 52 -13.956 -8.194 -6.439 1.00 0.00 C ATOM 792 C VAL A 52 -14.088 -9.716 -6.318 1.00 0.00 C ATOM 793 O VAL A 52 -14.664 -10.376 -7.194 1.00 0.00 O ATOM 794 CB VAL A 52 -15.306 -7.474 -6.097 1.00 0.00 C ATOM 795 CG1 VAL A 52 -16.370 -7.718 -7.157 1.00 0.00 C ATOM 796 CG2 VAL A 52 -15.818 -7.881 -4.719 1.00 0.00 C ATOM 0 H VAL A 52 -14.143 -7.837 -8.487 1.00 0.00 H new ATOM 0 HA VAL A 52 -13.224 -7.863 -5.702 1.00 0.00 H new ATOM 0 HB VAL A 52 -15.096 -6.404 -6.083 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -17.287 -7.200 -6.878 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -16.019 -7.342 -8.118 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -16.567 -8.787 -7.236 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -16.755 -7.365 -4.512 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -15.984 -8.958 -4.696 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -15.081 -7.612 -3.963 1.00 0.00 H new ATOM 806 N ARG A 53 -13.517 -10.269 -5.273 1.00 0.00 N ATOM 807 CA ARG A 53 -13.636 -11.685 -4.997 1.00 0.00 C ATOM 808 C ARG A 53 -14.322 -11.905 -3.668 1.00 0.00 C ATOM 809 O ARG A 53 -14.265 -11.049 -2.778 1.00 0.00 O ATOM 810 CB ARG A 53 -12.301 -12.427 -5.065 1.00 0.00 C ATOM 811 CG ARG A 53 -11.789 -12.630 -6.484 1.00 0.00 C ATOM 812 CD ARG A 53 -10.530 -13.461 -6.488 1.00 0.00 C ATOM 813 NE ARG A 53 -10.003 -13.707 -7.847 1.00 0.00 N ATOM 814 CZ ARG A 53 -9.324 -14.819 -8.220 1.00 0.00 C ATOM 815 NH1 ARG A 53 -9.188 -15.850 -7.370 1.00 0.00 N ATOM 816 NH2 ARG A 53 -8.806 -14.904 -9.444 1.00 0.00 N ATOM 0 H ARG A 53 -12.959 -9.754 -4.592 1.00 0.00 H new ATOM 0 HA ARG A 53 -14.252 -12.112 -5.788 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -11.556 -11.871 -4.495 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -12.410 -13.399 -4.584 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -12.555 -13.120 -7.085 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -11.592 -11.662 -6.946 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -9.767 -12.957 -5.894 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -10.731 -14.417 -6.004 1.00 0.00 H new ATOM 0 HE ARG A 53 -10.162 -12.989 -8.554 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -9.597 -15.799 -6.437 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -8.676 -16.684 -7.657 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -8.920 -14.132 -10.101 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -8.295 -15.741 -9.725 1.00 0.00 H new ATOM 830 N ALA A 54 -14.949 -13.040 -3.528 1.00 0.00 N ATOM 831 CA ALA A 54 -15.736 -13.328 -2.367 1.00 0.00 C ATOM 832 C ALA A 54 -15.132 -14.434 -1.553 1.00 0.00 C ATOM 833 O ALA A 54 -15.008 -15.570 -2.020 1.00 0.00 O ATOM 834 CB ALA A 54 -17.133 -13.717 -2.784 1.00 0.00 C ATOM 0 H ALA A 54 -14.927 -13.791 -4.218 1.00 0.00 H new ATOM 0 HA ALA A 54 -15.766 -12.429 -1.751 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -17.730 -13.936 -1.898 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -17.590 -12.895 -3.336 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -17.090 -14.601 -3.420 1.00 0.00 H new ATOM 998 N LEU A 65 -9.244 -6.948 15.012 1.00 0.00 N ATOM 999 CA LEU A 65 -9.505 -6.505 13.654 1.00 0.00 C ATOM 1000 C LEU A 65 -10.933 -6.819 13.229 1.00 0.00 C ATOM 1001 O LEU A 65 -11.464 -7.895 13.555 1.00 0.00 O ATOM 1002 CB LEU A 65 -8.527 -7.161 12.670 1.00 0.00 C ATOM 1003 CG LEU A 65 -7.037 -6.956 12.946 1.00 0.00 C ATOM 1004 CD1 LEU A 65 -6.195 -7.668 11.903 1.00 0.00 C ATOM 1005 CD2 LEU A 65 -6.702 -5.483 12.982 1.00 0.00 C ATOM 0 HA LEU A 65 -9.366 -5.424 13.637 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.726 -8.233 12.655 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.744 -6.782 11.671 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.808 -7.386 13.921 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -5.138 -7.509 12.118 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -6.414 -8.736 11.926 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.428 -7.271 10.915 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -5.638 -5.357 13.180 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -6.949 -5.030 12.022 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -7.277 -4.998 13.771 1.00 0.00 H new ATOM 1017 N PRO A 66 -11.595 -5.885 12.526 1.00 0.00 N ATOM 1018 CA PRO A 66 -12.927 -6.121 11.979 1.00 0.00 C ATOM 1019 C PRO A 66 -12.843 -7.109 10.812 1.00 0.00 C ATOM 1020 O PRO A 66 -11.836 -7.127 10.086 1.00 0.00 O ATOM 1021 CB PRO A 66 -13.377 -4.743 11.471 1.00 0.00 C ATOM 1022 CG PRO A 66 -12.366 -3.764 11.973 1.00 0.00 C ATOM 1023 CD PRO A 66 -11.108 -4.531 12.216 1.00 0.00 C ATOM 0 HA PRO A 66 -13.615 -6.543 12.711 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -13.428 -4.727 10.382 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -14.373 -4.498 11.840 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -12.201 -2.971 11.244 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -12.712 -3.287 12.890 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -10.458 -4.527 11.341 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -10.533 -4.111 13.041 1.00 0.00 H new ATOM 1031 N GLN A 67 -13.909 -7.884 10.601 1.00 0.00 N ATOM 1032 CA GLN A 67 -13.919 -8.953 9.594 1.00 0.00 C ATOM 1033 C GLN A 67 -13.592 -8.436 8.188 1.00 0.00 C ATOM 1034 O GLN A 67 -13.039 -9.164 7.385 1.00 0.00 O ATOM 1035 CB GLN A 67 -15.258 -9.706 9.563 1.00 0.00 C ATOM 1036 CG GLN A 67 -15.209 -10.978 8.704 1.00 0.00 C ATOM 1037 CD GLN A 67 -16.561 -11.615 8.476 1.00 0.00 C ATOM 1038 OE1 GLN A 67 -17.469 -11.506 9.297 1.00 0.00 O ATOM 1039 NE2 GLN A 67 -16.711 -12.279 7.355 1.00 0.00 N ATOM 0 H GLN A 67 -14.784 -7.792 11.117 1.00 0.00 H new ATOM 0 HA GLN A 67 -13.134 -9.646 9.897 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -15.543 -9.972 10.581 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -16.033 -9.043 9.178 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -14.765 -10.736 7.739 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -14.552 -11.704 9.184 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -15.936 -12.349 6.696 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -17.603 -12.725 7.142 1.00 0.00 H new ATOM 1048 N TYR A 68 -13.914 -7.182 7.901 1.00 0.00 N ATOM 1049 CA TYR A 68 -13.628 -6.640 6.578 1.00 0.00 C ATOM 1050 C TYR A 68 -12.117 -6.564 6.282 1.00 0.00 C ATOM 1051 O TYR A 68 -11.689 -6.793 5.141 1.00 0.00 O ATOM 1052 CB TYR A 68 -14.387 -5.320 6.282 1.00 0.00 C ATOM 1053 CG TYR A 68 -14.246 -4.195 7.298 1.00 0.00 C ATOM 1054 CD1 TYR A 68 -13.088 -3.450 7.387 1.00 0.00 C ATOM 1055 CD2 TYR A 68 -15.304 -3.853 8.127 1.00 0.00 C ATOM 1056 CE1 TYR A 68 -12.978 -2.401 8.268 1.00 0.00 C ATOM 1057 CE2 TYR A 68 -15.198 -2.804 9.021 1.00 0.00 C ATOM 1058 CZ TYR A 68 -14.028 -2.080 9.081 1.00 0.00 C ATOM 1059 OH TYR A 68 -13.911 -1.021 9.953 1.00 0.00 O ATOM 0 H TYR A 68 -14.363 -6.534 8.548 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.029 -7.359 5.864 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -14.051 -4.946 5.315 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -15.447 -5.554 6.182 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -12.251 -3.696 6.751 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.225 -4.415 8.073 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -12.062 -1.831 8.318 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -16.026 -2.554 9.667 1.00 0.00 H new ATOM 0 HH TYR A 68 -14.744 -0.921 10.460 1.00 0.00 H new ATOM 1069 N GLU A 69 -11.319 -6.315 7.316 1.00 0.00 N ATOM 1070 CA GLU A 69 -9.870 -6.300 7.166 1.00 0.00 C ATOM 1071 C GLU A 69 -9.403 -7.748 7.037 1.00 0.00 C ATOM 1072 O GLU A 69 -8.610 -8.096 6.161 1.00 0.00 O ATOM 1073 CB GLU A 69 -9.198 -5.665 8.394 1.00 0.00 C ATOM 1074 CG GLU A 69 -9.601 -4.224 8.697 1.00 0.00 C ATOM 1075 CD GLU A 69 -9.163 -3.218 7.642 1.00 0.00 C ATOM 1076 OE1 GLU A 69 -7.983 -2.809 7.642 1.00 0.00 O ATOM 1077 OE2 GLU A 69 -9.996 -2.749 6.879 1.00 0.00 O ATOM 0 H GLU A 69 -11.650 -6.122 8.261 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.600 -5.714 6.288 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.424 -6.278 9.267 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.118 -5.699 8.252 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.685 -4.176 8.801 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.176 -3.934 9.658 1.00 0.00 H new ATOM 1084 N SER A 70 -9.954 -8.591 7.897 1.00 0.00 N ATOM 1085 CA SER A 70 -9.642 -10.004 7.945 1.00 0.00 C ATOM 1086 C SER A 70 -9.962 -10.712 6.612 1.00 0.00 C ATOM 1087 O SER A 70 -9.211 -11.589 6.179 1.00 0.00 O ATOM 1088 CB SER A 70 -10.430 -10.632 9.082 1.00 0.00 C ATOM 1089 OG SER A 70 -10.277 -9.863 10.260 1.00 0.00 O ATOM 0 H SER A 70 -10.643 -8.303 8.592 1.00 0.00 H new ATOM 0 HA SER A 70 -8.572 -10.122 8.114 1.00 0.00 H new ATOM 0 HB2 SER A 70 -11.484 -10.695 8.813 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.084 -11.651 9.256 1.00 0.00 H new ATOM 0 HG SER A 70 -10.789 -10.274 10.988 1.00 0.00 H new ATOM 1095 N GLU A 71 -11.067 -10.319 5.964 1.00 0.00 N ATOM 1096 CA GLU A 71 -11.464 -10.898 4.691 1.00 0.00 C ATOM 1097 C GLU A 71 -10.409 -10.581 3.641 1.00 0.00 C ATOM 1098 O GLU A 71 -10.018 -11.451 2.859 1.00 0.00 O ATOM 1099 CB GLU A 71 -12.873 -10.413 4.257 1.00 0.00 C ATOM 1100 CG GLU A 71 -13.398 -11.086 2.984 1.00 0.00 C ATOM 1101 CD GLU A 71 -14.833 -10.714 2.631 1.00 0.00 C ATOM 1102 OE1 GLU A 71 -15.763 -11.335 3.174 1.00 0.00 O ATOM 1103 OE2 GLU A 71 -15.052 -9.816 1.779 1.00 0.00 O ATOM 0 H GLU A 71 -11.700 -9.598 6.310 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.533 -11.980 4.802 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.576 -10.597 5.070 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.843 -9.335 4.100 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.749 -10.819 2.150 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -13.333 -12.167 3.104 1.00 0.00 H new ATOM 1110 N ALA A 72 -9.896 -9.351 3.678 1.00 0.00 N ATOM 1111 CA ALA A 72 -8.839 -8.936 2.767 1.00 0.00 C ATOM 1112 C ALA A 72 -7.575 -9.754 3.016 1.00 0.00 C ATOM 1113 O ALA A 72 -6.964 -10.274 2.071 1.00 0.00 O ATOM 1114 CB ALA A 72 -8.562 -7.450 2.911 1.00 0.00 C ATOM 0 H ALA A 72 -10.198 -8.628 4.331 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.168 -9.118 1.744 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.769 -7.159 2.222 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -9.467 -6.887 2.681 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.251 -7.235 3.933 1.00 0.00 H new ATOM 1120 N ILE A 73 -7.216 -9.902 4.293 1.00 0.00 N ATOM 1121 CA ILE A 73 -6.063 -10.709 4.696 1.00 0.00 C ATOM 1122 C ILE A 73 -6.216 -12.145 4.180 1.00 0.00 C ATOM 1123 O ILE A 73 -5.294 -12.704 3.598 1.00 0.00 O ATOM 1124 CB ILE A 73 -5.875 -10.744 6.251 1.00 0.00 C ATOM 1125 CG1 ILE A 73 -5.669 -9.326 6.810 1.00 0.00 C ATOM 1126 CG2 ILE A 73 -4.690 -11.641 6.637 1.00 0.00 C ATOM 1127 CD1 ILE A 73 -5.526 -9.271 8.324 1.00 0.00 C ATOM 0 H ILE A 73 -7.713 -9.469 5.072 1.00 0.00 H new ATOM 0 HA ILE A 73 -5.181 -10.241 4.258 1.00 0.00 H new ATOM 0 HB ILE A 73 -6.783 -11.160 6.687 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.778 -8.894 6.355 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -6.513 -8.703 6.512 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -4.579 -11.650 7.721 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -4.871 -12.656 6.282 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -3.778 -11.255 6.182 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.384 -8.237 8.639 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -6.427 -9.672 8.789 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -4.665 -9.865 8.630 1.00 0.00 H new ATOM 1139 N MET A 74 -7.399 -12.709 4.361 1.00 0.00 N ATOM 1140 CA MET A 74 -7.679 -14.079 3.938 1.00 0.00 C ATOM 1141 C MET A 74 -7.611 -14.254 2.434 1.00 0.00 C ATOM 1142 O MET A 74 -7.135 -15.276 1.961 1.00 0.00 O ATOM 1143 CB MET A 74 -9.014 -14.568 4.464 1.00 0.00 C ATOM 1144 CG MET A 74 -9.121 -14.748 5.984 1.00 0.00 C ATOM 1145 SD MET A 74 -8.089 -16.079 6.688 1.00 0.00 S ATOM 1146 CE MET A 74 -6.482 -15.291 6.906 1.00 0.00 C ATOM 0 H MET A 74 -8.189 -12.238 4.801 1.00 0.00 H new ATOM 0 HA MET A 74 -6.890 -14.691 4.374 1.00 0.00 H new ATOM 0 HB2 MET A 74 -9.785 -13.865 4.148 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.240 -15.523 3.990 1.00 0.00 H new ATOM 0 HG2 MET A 74 -8.849 -13.808 6.464 1.00 0.00 H new ATOM 0 HG3 MET A 74 -10.163 -14.946 6.237 1.00 0.00 H new ATOM 0 HE1 MET A 74 -5.744 -15.789 6.277 1.00 0.00 H new ATOM 0 HE2 MET A 74 -6.550 -14.241 6.622 1.00 0.00 H new ATOM 0 HE3 MET A 74 -6.179 -15.366 7.950 1.00 0.00 H new ATOM 1156 N VAL A 75 -8.067 -13.271 1.680 1.00 0.00 N ATOM 1157 CA VAL A 75 -7.991 -13.359 0.228 1.00 0.00 C ATOM 1158 C VAL A 75 -6.533 -13.243 -0.235 1.00 0.00 C ATOM 1159 O VAL A 75 -6.100 -13.950 -1.158 1.00 0.00 O ATOM 1160 CB VAL A 75 -8.915 -12.323 -0.487 1.00 0.00 C ATOM 1161 CG1 VAL A 75 -8.756 -12.391 -2.003 1.00 0.00 C ATOM 1162 CG2 VAL A 75 -10.367 -12.589 -0.124 1.00 0.00 C ATOM 0 H VAL A 75 -8.488 -12.414 2.038 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.367 -14.340 -0.063 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.623 -11.328 -0.152 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -9.413 -11.658 -2.471 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.722 -12.175 -2.270 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -9.020 -13.389 -2.352 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -11.006 -11.863 -0.626 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -10.643 -13.595 -0.440 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -10.494 -12.500 0.955 1.00 0.00 H new ATOM 1172 N ALA A 76 -5.762 -12.410 0.450 1.00 0.00 N ATOM 1173 CA ALA A 76 -4.343 -12.269 0.153 1.00 0.00 C ATOM 1174 C ALA A 76 -3.594 -13.542 0.532 1.00 0.00 C ATOM 1175 O ALA A 76 -2.634 -13.927 -0.114 1.00 0.00 O ATOM 1176 CB ALA A 76 -3.758 -11.074 0.873 1.00 0.00 C ATOM 0 H ALA A 76 -6.095 -11.822 1.214 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.232 -12.105 -0.919 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -2.698 -10.989 0.636 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.274 -10.169 0.554 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -3.880 -11.202 1.949 1.00 0.00 H new ATOM 1182 N PHE A 77 -4.063 -14.181 1.574 1.00 0.00 N ATOM 1183 CA PHE A 77 -3.522 -15.440 2.058 1.00 0.00 C ATOM 1184 C PHE A 77 -3.892 -16.570 1.082 1.00 0.00 C ATOM 1185 O PHE A 77 -3.108 -17.489 0.837 1.00 0.00 O ATOM 1186 CB PHE A 77 -4.107 -15.704 3.459 1.00 0.00 C ATOM 1187 CG PHE A 77 -3.605 -16.925 4.170 1.00 0.00 C ATOM 1188 CD1 PHE A 77 -2.432 -16.880 4.905 1.00 0.00 C ATOM 1189 CD2 PHE A 77 -4.322 -18.107 4.135 1.00 0.00 C ATOM 1190 CE1 PHE A 77 -1.983 -17.991 5.589 1.00 0.00 C ATOM 1191 CE2 PHE A 77 -3.879 -19.221 4.808 1.00 0.00 C ATOM 1192 CZ PHE A 77 -2.707 -19.164 5.540 1.00 0.00 C ATOM 0 H PHE A 77 -4.849 -13.838 2.126 1.00 0.00 H new ATOM 0 HA PHE A 77 -2.435 -15.397 2.122 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -3.902 -14.835 4.085 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.190 -15.782 3.368 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.862 -15.964 4.943 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -5.242 -18.156 3.572 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -1.068 -17.942 6.161 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -4.446 -20.139 4.765 1.00 0.00 H new ATOM 0 HZ PHE A 77 -2.359 -20.037 6.073 1.00 0.00 H new ATOM 1202 N GLU A 78 -5.085 -16.462 0.523 1.00 0.00 N ATOM 1203 CA GLU A 78 -5.626 -17.421 -0.415 1.00 0.00 C ATOM 1204 C GLU A 78 -4.839 -17.397 -1.726 1.00 0.00 C ATOM 1205 O GLU A 78 -4.353 -18.425 -2.194 1.00 0.00 O ATOM 1206 CB GLU A 78 -7.097 -17.080 -0.686 1.00 0.00 C ATOM 1207 CG GLU A 78 -7.836 -18.072 -1.565 1.00 0.00 C ATOM 1208 CD GLU A 78 -7.935 -19.430 -0.932 1.00 0.00 C ATOM 1209 OE1 GLU A 78 -8.795 -19.623 -0.064 1.00 0.00 O ATOM 1210 OE2 GLU A 78 -7.150 -20.336 -1.285 1.00 0.00 O ATOM 0 H GLU A 78 -5.717 -15.685 0.716 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.548 -18.421 0.013 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -7.618 -17.005 0.268 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.146 -16.097 -1.154 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -8.838 -17.696 -1.771 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -7.324 -18.157 -2.524 1.00 0.00 H new ATOM 1217 N LEU A 79 -4.693 -16.221 -2.284 1.00 0.00 N ATOM 1218 CA LEU A 79 -4.032 -16.043 -3.574 1.00 0.00 C ATOM 1219 C LEU A 79 -2.526 -16.001 -3.433 1.00 0.00 C ATOM 1220 O LEU A 79 -1.803 -16.157 -4.416 1.00 0.00 O ATOM 1221 CB LEU A 79 -4.498 -14.726 -4.196 1.00 0.00 C ATOM 1222 CG LEU A 79 -5.984 -14.615 -4.509 1.00 0.00 C ATOM 1223 CD1 LEU A 79 -6.327 -13.206 -4.954 1.00 0.00 C ATOM 1224 CD2 LEU A 79 -6.360 -15.602 -5.589 1.00 0.00 C ATOM 0 H LEU A 79 -5.026 -15.353 -1.864 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.295 -16.892 -4.205 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.230 -13.915 -3.520 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.941 -14.568 -5.120 1.00 0.00 H new ATOM 0 HG LEU A 79 -6.548 -14.843 -3.605 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -7.393 -13.143 -5.174 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -6.078 -12.503 -4.159 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -5.757 -12.958 -5.849 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -7.425 -15.515 -5.806 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -5.787 -15.390 -6.492 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -6.140 -16.614 -5.249 1.00 0.00 H new ATOM 1236 N ASN A 80 -2.072 -15.814 -2.199 1.00 0.00 N ATOM 1237 CA ASN A 80 -0.674 -15.542 -1.888 1.00 0.00 C ATOM 1238 C ASN A 80 -0.304 -14.276 -2.635 1.00 0.00 C ATOM 1239 O ASN A 80 0.474 -14.258 -3.599 1.00 0.00 O ATOM 1240 CB ASN A 80 0.273 -16.718 -2.201 1.00 0.00 C ATOM 1241 CG ASN A 80 1.696 -16.459 -1.734 1.00 0.00 C ATOM 1242 OD1 ASN A 80 2.520 -15.913 -2.464 1.00 0.00 O ATOM 1243 ND2 ASN A 80 2.002 -16.864 -0.532 1.00 0.00 N ATOM 0 H ASN A 80 -2.673 -15.848 -1.375 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.555 -15.407 -0.813 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -0.104 -17.622 -1.722 1.00 0.00 H new ATOM 0 HB3 ASN A 80 0.274 -16.903 -3.275 1.00 0.00 H new ATOM 0 HD21 ASN A 80 2.948 -16.731 -0.174 1.00 0.00 H new ATOM 0 HD22 ASN A 80 1.295 -17.314 0.050 1.00 0.00 H new ATOM 1250 N ALA A 81 -0.987 -13.245 -2.246 1.00 0.00 N ATOM 1251 CA ALA A 81 -0.944 -11.985 -2.906 1.00 0.00 C ATOM 1252 C ALA A 81 -0.238 -10.953 -2.071 1.00 0.00 C ATOM 1253 O ALA A 81 0.188 -11.227 -0.946 1.00 0.00 O ATOM 1254 CB ALA A 81 -2.364 -11.537 -3.189 1.00 0.00 C ATOM 0 H ALA A 81 -1.607 -13.261 -1.436 1.00 0.00 H new ATOM 0 HA ALA A 81 -0.388 -12.093 -3.837 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.347 -10.572 -3.695 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.857 -12.272 -3.825 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -2.910 -11.445 -2.250 1.00 0.00 H new ATOM 1260 N LEU A 82 -0.119 -9.788 -2.624 1.00 0.00 N ATOM 1261 CA LEU A 82 0.478 -8.662 -1.971 1.00 0.00 C ATOM 1262 C LEU A 82 -0.669 -7.960 -1.260 1.00 0.00 C ATOM 1263 O LEU A 82 -1.689 -7.683 -1.884 1.00 0.00 O ATOM 1264 CB LEU A 82 1.108 -7.758 -3.069 1.00 0.00 C ATOM 1265 CG LEU A 82 2.122 -6.663 -2.656 1.00 0.00 C ATOM 1266 CD1 LEU A 82 1.508 -5.596 -1.780 1.00 0.00 C ATOM 1267 CD2 LEU A 82 3.339 -7.278 -1.989 1.00 0.00 C ATOM 0 H LEU A 82 -0.443 -9.586 -3.570 1.00 0.00 H new ATOM 0 HA LEU A 82 1.262 -8.924 -1.260 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.605 -8.411 -3.787 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.291 -7.266 -3.598 1.00 0.00 H new ATOM 0 HG LEU A 82 2.439 -6.168 -3.574 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.266 -4.856 -1.522 1.00 0.00 H new ATOM 0 HD12 LEU A 82 0.693 -5.109 -2.316 1.00 0.00 H new ATOM 0 HD13 LEU A 82 1.121 -6.052 -0.868 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.037 -6.490 -1.708 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.029 -7.823 -1.097 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.826 -7.964 -2.682 1.00 0.00 H new ATOM 1279 N LEU A 83 -0.551 -7.727 0.020 1.00 0.00 N ATOM 1280 CA LEU A 83 -1.640 -7.091 0.737 1.00 0.00 C ATOM 1281 C LEU A 83 -1.325 -5.630 0.994 1.00 0.00 C ATOM 1282 O LEU A 83 -0.269 -5.297 1.535 1.00 0.00 O ATOM 1283 CB LEU A 83 -1.949 -7.817 2.054 1.00 0.00 C ATOM 1284 CG LEU A 83 -3.170 -7.296 2.837 1.00 0.00 C ATOM 1285 CD1 LEU A 83 -4.453 -7.521 2.061 1.00 0.00 C ATOM 1286 CD2 LEU A 83 -3.262 -7.944 4.199 1.00 0.00 C ATOM 0 H LEU A 83 0.267 -7.959 0.584 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.530 -7.152 0.110 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -2.105 -8.874 1.837 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -1.072 -7.750 2.698 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.035 -6.223 2.976 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.298 -7.144 2.637 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -4.399 -6.994 1.108 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -4.586 -8.587 1.878 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -4.133 -7.557 4.728 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -3.358 -9.023 4.083 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -2.361 -7.720 4.770 1.00 0.00 H new ATOM 1298 N ILE A 84 -2.216 -4.771 0.582 1.00 0.00 N ATOM 1299 CA ILE A 84 -2.053 -3.351 0.780 1.00 0.00 C ATOM 1300 C ILE A 84 -3.024 -2.898 1.863 1.00 0.00 C ATOM 1301 O ILE A 84 -4.253 -3.045 1.709 1.00 0.00 O ATOM 1302 CB ILE A 84 -2.332 -2.564 -0.531 1.00 0.00 C ATOM 1303 CG1 ILE A 84 -1.458 -3.108 -1.676 1.00 0.00 C ATOM 1304 CG2 ILE A 84 -2.067 -1.069 -0.319 1.00 0.00 C ATOM 1305 CD1 ILE A 84 -1.692 -2.438 -3.015 1.00 0.00 C ATOM 0 H ILE A 84 -3.076 -5.032 0.100 1.00 0.00 H new ATOM 0 HA ILE A 84 -1.024 -3.151 1.079 1.00 0.00 H new ATOM 0 HB ILE A 84 -3.380 -2.696 -0.802 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -0.409 -2.991 -1.403 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -1.643 -4.177 -1.781 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -2.266 -0.529 -1.245 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -2.720 -0.692 0.468 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -1.027 -0.921 -0.030 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -1.036 -2.882 -3.764 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -2.731 -2.577 -3.315 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -1.478 -1.372 -2.931 1.00 0.00 H new ATOM 1317 N ALA A 85 -2.495 -2.371 2.944 1.00 0.00 N ATOM 1318 CA ALA A 85 -3.302 -1.922 4.059 1.00 0.00 C ATOM 1319 C ALA A 85 -2.634 -0.741 4.719 1.00 0.00 C ATOM 1320 O ALA A 85 -1.439 -0.541 4.550 1.00 0.00 O ATOM 1321 CB ALA A 85 -3.480 -3.051 5.067 1.00 0.00 C ATOM 0 H ALA A 85 -1.492 -2.241 3.076 1.00 0.00 H new ATOM 0 HA ALA A 85 -4.285 -1.624 3.693 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -4.089 -2.702 5.901 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -3.975 -3.894 4.585 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -2.504 -3.366 5.437 1.00 0.00 H new ATOM 1327 N GLU A 86 -3.388 0.046 5.453 1.00 0.00 N ATOM 1328 CA GLU A 86 -2.802 1.182 6.156 1.00 0.00 C ATOM 1329 C GLU A 86 -2.636 0.915 7.623 1.00 0.00 C ATOM 1330 O GLU A 86 -1.771 1.509 8.275 1.00 0.00 O ATOM 1331 CB GLU A 86 -3.619 2.452 6.015 1.00 0.00 C ATOM 1332 CG GLU A 86 -3.610 3.081 4.658 1.00 0.00 C ATOM 1333 CD GLU A 86 -3.561 4.577 4.768 1.00 0.00 C ATOM 1334 OE1 GLU A 86 -4.501 5.184 5.329 1.00 0.00 O ATOM 1335 OE2 GLU A 86 -2.561 5.178 4.321 1.00 0.00 O ATOM 0 H GLU A 86 -4.393 -0.070 5.582 1.00 0.00 H new ATOM 0 HA GLU A 86 -1.830 1.322 5.684 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -4.651 2.230 6.286 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.250 3.182 6.736 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -2.749 2.724 4.092 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -4.501 2.781 4.106 1.00 0.00 H new ATOM 1342 N ASP A 87 -3.444 0.042 8.151 1.00 0.00 N ATOM 1343 CA ASP A 87 -3.455 -0.167 9.577 1.00 0.00 C ATOM 1344 C ASP A 87 -2.341 -1.079 9.997 1.00 0.00 C ATOM 1345 O ASP A 87 -2.211 -2.189 9.479 1.00 0.00 O ATOM 1346 CB ASP A 87 -4.781 -0.713 10.050 1.00 0.00 C ATOM 1347 CG ASP A 87 -4.900 -0.673 11.552 1.00 0.00 C ATOM 1348 OD1 ASP A 87 -4.502 -1.639 12.235 1.00 0.00 O ATOM 1349 OD2 ASP A 87 -5.404 0.340 12.080 1.00 0.00 O ATOM 0 H ASP A 87 -4.100 -0.534 7.624 1.00 0.00 H new ATOM 0 HA ASP A 87 -3.304 0.806 10.044 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.591 -0.135 9.606 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -4.895 -1.740 9.704 1.00 0.00 H new ATOM 1354 N LYS A 88 -1.562 -0.605 10.945 1.00 0.00 N ATOM 1355 CA LYS A 88 -0.393 -1.294 11.465 1.00 0.00 C ATOM 1356 C LYS A 88 -0.699 -2.721 11.907 1.00 0.00 C ATOM 1357 O LYS A 88 0.055 -3.642 11.592 1.00 0.00 O ATOM 1358 CB LYS A 88 0.176 -0.496 12.638 1.00 0.00 C ATOM 1359 CG LYS A 88 1.399 -1.106 13.307 1.00 0.00 C ATOM 1360 CD LYS A 88 1.829 -0.252 14.478 1.00 0.00 C ATOM 1361 CE LYS A 88 3.028 -0.829 15.200 1.00 0.00 C ATOM 1362 NZ LYS A 88 3.439 0.032 16.327 1.00 0.00 N ATOM 0 H LYS A 88 -1.727 0.297 11.391 1.00 0.00 H new ATOM 0 HA LYS A 88 0.337 -1.364 10.658 1.00 0.00 H new ATOM 0 HB2 LYS A 88 0.435 0.502 12.285 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -0.606 -0.376 13.388 1.00 0.00 H new ATOM 0 HG2 LYS A 88 1.171 -2.116 13.647 1.00 0.00 H new ATOM 0 HG3 LYS A 88 2.214 -1.188 12.588 1.00 0.00 H new ATOM 0 HD2 LYS A 88 2.068 0.751 14.125 1.00 0.00 H new ATOM 0 HD3 LYS A 88 0.999 -0.154 15.178 1.00 0.00 H new ATOM 0 HE2 LYS A 88 2.788 -1.826 15.570 1.00 0.00 H new ATOM 0 HE3 LYS A 88 3.858 -0.939 14.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 4.263 -0.389 16.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 3.690 0.976 15.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 2.654 0.116 17.004 1.00 0.00 H new ATOM 1376 N ASP A 89 -1.827 -2.919 12.576 1.00 0.00 N ATOM 1377 CA ASP A 89 -2.125 -4.228 13.133 1.00 0.00 C ATOM 1378 C ASP A 89 -2.580 -5.176 12.048 1.00 0.00 C ATOM 1379 O ASP A 89 -2.247 -6.349 12.062 1.00 0.00 O ATOM 1380 CB ASP A 89 -3.148 -4.150 14.258 1.00 0.00 C ATOM 1381 CG ASP A 89 -3.251 -5.453 15.024 1.00 0.00 C ATOM 1382 OD1 ASP A 89 -2.317 -5.761 15.807 1.00 0.00 O ATOM 1383 OD2 ASP A 89 -4.272 -6.144 14.933 1.00 0.00 O ATOM 0 H ASP A 89 -2.536 -2.205 12.743 1.00 0.00 H new ATOM 0 HA ASP A 89 -1.204 -4.617 13.568 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -2.873 -3.348 14.943 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -4.123 -3.895 13.844 1.00 0.00 H new ATOM 1388 N VAL A 90 -3.299 -4.649 11.080 1.00 0.00 N ATOM 1389 CA VAL A 90 -3.729 -5.439 9.927 1.00 0.00 C ATOM 1390 C VAL A 90 -2.492 -5.933 9.180 1.00 0.00 C ATOM 1391 O VAL A 90 -2.369 -7.123 8.856 1.00 0.00 O ATOM 1392 CB VAL A 90 -4.628 -4.605 8.973 1.00 0.00 C ATOM 1393 CG1 VAL A 90 -5.048 -5.417 7.751 1.00 0.00 C ATOM 1394 CG2 VAL A 90 -5.854 -4.119 9.714 1.00 0.00 C ATOM 0 H VAL A 90 -3.603 -3.675 11.061 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.319 -6.285 10.280 1.00 0.00 H new ATOM 0 HB VAL A 90 -4.048 -3.750 8.626 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -5.676 -4.804 7.105 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -4.161 -5.733 7.202 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -5.607 -6.295 8.073 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.480 -3.535 9.039 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.419 -4.975 10.083 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.548 -3.496 10.555 1.00 0.00 H new ATOM 1404 N ILE A 91 -1.555 -5.017 8.979 1.00 0.00 N ATOM 1405 CA ILE A 91 -0.298 -5.310 8.328 1.00 0.00 C ATOM 1406 C ILE A 91 0.492 -6.361 9.115 1.00 0.00 C ATOM 1407 O ILE A 91 0.949 -7.354 8.542 1.00 0.00 O ATOM 1408 CB ILE A 91 0.561 -4.021 8.155 1.00 0.00 C ATOM 1409 CG1 ILE A 91 -0.169 -3.019 7.251 1.00 0.00 C ATOM 1410 CG2 ILE A 91 1.948 -4.346 7.589 1.00 0.00 C ATOM 1411 CD1 ILE A 91 0.502 -1.668 7.162 1.00 0.00 C ATOM 0 H ILE A 91 -1.652 -4.044 9.268 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.526 -5.708 7.339 1.00 0.00 H new ATOM 0 HB ILE A 91 0.703 -3.573 9.139 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -0.248 -3.440 6.249 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -1.185 -2.885 7.622 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.522 -3.425 7.481 1.00 0.00 H new ATOM 0 HG22 ILE A 91 2.469 -5.020 8.268 1.00 0.00 H new ATOM 0 HG23 ILE A 91 1.841 -4.823 6.615 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -0.075 -1.018 6.505 1.00 0.00 H new ATOM 0 HD12 ILE A 91 0.557 -1.223 8.156 1.00 0.00 H new ATOM 0 HD13 ILE A 91 1.509 -1.787 6.762 1.00 0.00 H new ATOM 1423 N ASN A 92 0.618 -6.167 10.423 1.00 0.00 N ATOM 1424 CA ASN A 92 1.403 -7.091 11.233 1.00 0.00 C ATOM 1425 C ASN A 92 0.775 -8.461 11.363 1.00 0.00 C ATOM 1426 O ASN A 92 1.478 -9.456 11.324 1.00 0.00 O ATOM 1427 CB ASN A 92 1.872 -6.500 12.594 1.00 0.00 C ATOM 1428 CG ASN A 92 0.801 -6.121 13.638 1.00 0.00 C ATOM 1429 OD1 ASN A 92 0.917 -5.070 14.271 1.00 0.00 O ATOM 1430 ND2 ASN A 92 -0.143 -6.987 13.929 1.00 0.00 N ATOM 0 H ASN A 92 0.196 -5.394 10.937 1.00 0.00 H new ATOM 0 HA ASN A 92 2.320 -7.243 10.664 1.00 0.00 H new ATOM 0 HB2 ASN A 92 2.544 -7.223 13.056 1.00 0.00 H new ATOM 0 HB3 ASN A 92 2.460 -5.607 12.383 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -0.795 -6.795 14.690 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -0.224 -7.852 13.394 1.00 0.00 H new ATOM 1437 N LYS A 93 -0.545 -8.522 11.471 1.00 0.00 N ATOM 1438 CA LYS A 93 -1.231 -9.814 11.573 1.00 0.00 C ATOM 1439 C LYS A 93 -1.107 -10.599 10.283 1.00 0.00 C ATOM 1440 O LYS A 93 -0.914 -11.816 10.309 1.00 0.00 O ATOM 1441 CB LYS A 93 -2.708 -9.680 11.984 1.00 0.00 C ATOM 1442 CG LYS A 93 -2.935 -9.099 13.383 1.00 0.00 C ATOM 1443 CD LYS A 93 -2.210 -9.889 14.476 1.00 0.00 C ATOM 1444 CE LYS A 93 -2.692 -11.328 14.584 1.00 0.00 C ATOM 1445 NZ LYS A 93 -1.904 -12.094 15.573 1.00 0.00 N ATOM 0 H LYS A 93 -1.160 -7.708 11.491 1.00 0.00 H new ATOM 0 HA LYS A 93 -0.731 -10.363 12.371 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -3.217 -9.048 11.256 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.175 -10.664 11.934 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -2.594 -8.064 13.402 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -4.004 -9.086 13.598 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -1.139 -9.884 14.272 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.354 -9.390 15.434 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -3.744 -11.339 14.869 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -2.621 -11.810 13.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -2.487 -12.864 15.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -1.063 -12.495 15.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -1.607 -11.463 16.344 1.00 0.00 H new ATOM 1459 N ALA A 94 -1.200 -9.908 9.161 1.00 0.00 N ATOM 1460 CA ALA A 94 -1.017 -10.542 7.878 1.00 0.00 C ATOM 1461 C ALA A 94 0.427 -11.003 7.727 1.00 0.00 C ATOM 1462 O ALA A 94 0.691 -12.117 7.260 1.00 0.00 O ATOM 1463 CB ALA A 94 -1.389 -9.593 6.767 1.00 0.00 C ATOM 0 H ALA A 94 -1.401 -8.909 9.117 1.00 0.00 H new ATOM 0 HA ALA A 94 -1.670 -11.413 7.817 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -1.246 -10.085 5.805 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -2.434 -9.300 6.873 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.757 -8.707 6.819 1.00 0.00 H new ATOM 1469 N LYS A 95 1.354 -10.149 8.171 1.00 0.00 N ATOM 1470 CA LYS A 95 2.786 -10.434 8.114 1.00 0.00 C ATOM 1471 C LYS A 95 3.087 -11.704 8.935 1.00 0.00 C ATOM 1472 O LYS A 95 3.839 -12.572 8.488 1.00 0.00 O ATOM 1473 CB LYS A 95 3.585 -9.235 8.670 1.00 0.00 C ATOM 1474 CG LYS A 95 5.103 -9.270 8.426 1.00 0.00 C ATOM 1475 CD LYS A 95 5.500 -8.931 6.969 1.00 0.00 C ATOM 1476 CE LYS A 95 5.095 -7.496 6.587 1.00 0.00 C ATOM 1477 NZ LYS A 95 5.672 -7.044 5.287 1.00 0.00 N ATOM 0 H LYS A 95 1.130 -9.242 8.579 1.00 0.00 H new ATOM 0 HA LYS A 95 3.083 -10.598 7.078 1.00 0.00 H new ATOM 0 HB2 LYS A 95 3.186 -8.321 8.229 1.00 0.00 H new ATOM 0 HB3 LYS A 95 3.410 -9.173 9.744 1.00 0.00 H new ATOM 0 HG2 LYS A 95 5.588 -8.564 9.100 1.00 0.00 H new ATOM 0 HG3 LYS A 95 5.481 -10.261 8.676 1.00 0.00 H new ATOM 0 HD2 LYS A 95 6.577 -9.049 6.848 1.00 0.00 H new ATOM 0 HD3 LYS A 95 5.024 -9.637 6.289 1.00 0.00 H new ATOM 0 HE2 LYS A 95 4.008 -7.435 6.535 1.00 0.00 H new ATOM 0 HE3 LYS A 95 5.415 -6.814 7.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 5.334 -6.084 5.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 6.710 -7.039 5.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 5.374 -7.693 4.531 1.00 0.00 H new ATOM 1491 N GLU A 96 2.457 -11.810 10.115 1.00 0.00 N ATOM 1492 CA GLU A 96 2.577 -12.991 10.991 1.00 0.00 C ATOM 1493 C GLU A 96 2.189 -14.264 10.251 1.00 0.00 C ATOM 1494 O GLU A 96 2.878 -15.278 10.338 1.00 0.00 O ATOM 1495 CB GLU A 96 1.688 -12.854 12.238 1.00 0.00 C ATOM 1496 CG GLU A 96 2.144 -11.828 13.260 1.00 0.00 C ATOM 1497 CD GLU A 96 1.175 -11.704 14.417 1.00 0.00 C ATOM 1498 OE1 GLU A 96 0.719 -12.738 14.961 1.00 0.00 O ATOM 1499 OE2 GLU A 96 0.823 -10.580 14.806 1.00 0.00 O ATOM 0 H GLU A 96 1.850 -11.081 10.491 1.00 0.00 H new ATOM 0 HA GLU A 96 3.621 -13.052 11.298 1.00 0.00 H new ATOM 0 HB2 GLU A 96 0.679 -12.596 11.916 1.00 0.00 H new ATOM 0 HB3 GLU A 96 1.628 -13.826 12.728 1.00 0.00 H new ATOM 0 HG2 GLU A 96 3.127 -12.108 13.640 1.00 0.00 H new ATOM 0 HG3 GLU A 96 2.254 -10.858 12.775 1.00 0.00 H new ATOM 1506 N LEU A 97 1.115 -14.185 9.482 1.00 0.00 N ATOM 1507 CA LEU A 97 0.588 -15.338 8.755 1.00 0.00 C ATOM 1508 C LEU A 97 1.431 -15.673 7.525 1.00 0.00 C ATOM 1509 O LEU A 97 1.230 -16.721 6.883 1.00 0.00 O ATOM 1510 CB LEU A 97 -0.870 -15.103 8.351 1.00 0.00 C ATOM 1511 CG LEU A 97 -1.863 -14.885 9.499 1.00 0.00 C ATOM 1512 CD1 LEU A 97 -3.250 -14.606 8.952 1.00 0.00 C ATOM 1513 CD2 LEU A 97 -1.892 -16.095 10.433 1.00 0.00 C ATOM 0 H LEU A 97 0.583 -13.326 9.342 1.00 0.00 H new ATOM 0 HA LEU A 97 0.635 -16.193 9.430 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.908 -14.233 7.695 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.206 -15.959 7.765 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.533 -14.020 10.074 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -3.943 -14.453 9.779 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -3.223 -13.710 8.331 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -3.582 -15.453 8.352 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -2.604 -15.916 11.239 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -2.194 -16.980 9.873 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -0.899 -16.253 10.854 1.00 0.00 H new ATOM 1525 N GLY A 98 2.363 -14.810 7.207 1.00 0.00 N ATOM 1526 CA GLY A 98 3.218 -15.039 6.074 1.00 0.00 C ATOM 1527 C GLY A 98 2.745 -14.303 4.851 1.00 0.00 C ATOM 1528 O GLY A 98 3.200 -14.566 3.738 1.00 0.00 O ATOM 0 H GLY A 98 2.547 -13.946 7.716 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.233 -14.724 6.317 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.258 -16.107 5.861 1.00 0.00 H new ATOM 1532 N VAL A 99 1.845 -13.387 5.042 1.00 0.00 N ATOM 1533 CA VAL A 99 1.335 -12.594 3.958 1.00 0.00 C ATOM 1534 C VAL A 99 2.107 -11.297 3.931 1.00 0.00 C ATOM 1535 O VAL A 99 2.270 -10.638 4.969 1.00 0.00 O ATOM 1536 CB VAL A 99 -0.179 -12.295 4.124 1.00 0.00 C ATOM 1537 CG1 VAL A 99 -0.718 -11.489 2.950 1.00 0.00 C ATOM 1538 CG2 VAL A 99 -0.967 -13.580 4.291 1.00 0.00 C ATOM 0 H VAL A 99 1.442 -13.166 5.952 1.00 0.00 H new ATOM 0 HA VAL A 99 1.455 -13.146 3.026 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.299 -11.695 5.026 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.781 -11.297 3.098 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.184 -10.541 2.884 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.576 -12.051 2.027 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -2.025 -13.346 4.406 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.828 -14.209 3.412 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.615 -14.110 5.176 1.00 0.00 H new ATOM 1548 N ASN A 100 2.613 -10.935 2.789 1.00 0.00 N ATOM 1549 CA ASN A 100 3.350 -9.711 2.695 1.00 0.00 C ATOM 1550 C ASN A 100 2.413 -8.542 2.568 1.00 0.00 C ATOM 1551 O ASN A 100 1.913 -8.228 1.481 1.00 0.00 O ATOM 1552 CB ASN A 100 4.370 -9.716 1.563 1.00 0.00 C ATOM 1553 CG ASN A 100 5.209 -8.443 1.547 1.00 0.00 C ATOM 1554 OD1 ASN A 100 5.423 -7.803 2.594 1.00 0.00 O ATOM 1555 ND2 ASN A 100 5.715 -8.085 0.391 1.00 0.00 N ATOM 0 H ASN A 100 2.530 -11.463 1.920 1.00 0.00 H new ATOM 0 HA ASN A 100 3.919 -9.613 3.620 1.00 0.00 H new ATOM 0 HB2 ASN A 100 5.025 -10.581 1.668 1.00 0.00 H new ATOM 0 HB3 ASN A 100 3.853 -9.822 0.609 1.00 0.00 H new ATOM 0 HD21 ASN A 100 6.307 -7.257 0.328 1.00 0.00 H new ATOM 0 HD22 ASN A 100 5.517 -8.635 -0.445 1.00 0.00 H new ATOM 1562 N ALA A 101 2.097 -7.981 3.695 1.00 0.00 N ATOM 1563 CA ALA A 101 1.301 -6.803 3.768 1.00 0.00 C ATOM 1564 C ALA A 101 2.210 -5.620 3.921 1.00 0.00 C ATOM 1565 O ALA A 101 3.193 -5.680 4.682 1.00 0.00 O ATOM 1566 CB ALA A 101 0.342 -6.886 4.937 1.00 0.00 C ATOM 0 H ALA A 101 2.392 -8.338 4.604 1.00 0.00 H new ATOM 0 HA ALA A 101 0.712 -6.699 2.857 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -0.259 -5.978 4.979 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -0.312 -7.749 4.811 1.00 0.00 H new ATOM 0 HB3 ALA A 101 0.906 -6.991 5.864 1.00 0.00 H new ATOM 1572 N ILE A 102 1.934 -4.586 3.196 1.00 0.00 N ATOM 1573 CA ILE A 102 2.715 -3.384 3.255 1.00 0.00 C ATOM 1574 C ILE A 102 1.813 -2.159 3.259 1.00 0.00 C ATOM 1575 O ILE A 102 0.667 -2.229 2.777 1.00 0.00 O ATOM 1576 CB ILE A 102 3.803 -3.298 2.101 1.00 0.00 C ATOM 1577 CG1 ILE A 102 3.243 -3.615 0.689 1.00 0.00 C ATOM 1578 CG2 ILE A 102 5.012 -4.169 2.404 1.00 0.00 C ATOM 1579 CD1 ILE A 102 2.367 -2.540 0.074 1.00 0.00 C ATOM 0 H ILE A 102 1.155 -4.547 2.539 1.00 0.00 H new ATOM 0 HA ILE A 102 3.270 -3.410 4.193 1.00 0.00 H new ATOM 0 HB ILE A 102 4.118 -2.255 2.081 1.00 0.00 H new ATOM 0 HG12 ILE A 102 4.082 -3.802 0.019 1.00 0.00 H new ATOM 0 HG13 ILE A 102 2.668 -4.539 0.745 1.00 0.00 H new ATOM 0 HG21 ILE A 102 5.734 -4.084 1.592 1.00 0.00 H new ATOM 0 HG22 ILE A 102 5.473 -3.840 3.336 1.00 0.00 H new ATOM 0 HG23 ILE A 102 4.697 -5.208 2.502 1.00 0.00 H new ATOM 0 HD11 ILE A 102 2.030 -2.864 -0.911 1.00 0.00 H new ATOM 0 HD12 ILE A 102 1.502 -2.365 0.714 1.00 0.00 H new ATOM 0 HD13 ILE A 102 2.938 -1.617 -0.024 1.00 0.00 H new ATOM 1591 N PRO A 103 2.266 -1.048 3.857 1.00 0.00 N ATOM 1592 CA PRO A 103 1.536 0.208 3.802 1.00 0.00 C ATOM 1593 C PRO A 103 1.550 0.780 2.384 1.00 0.00 C ATOM 1594 O PRO A 103 2.434 0.447 1.569 1.00 0.00 O ATOM 1595 CB PRO A 103 2.315 1.146 4.742 1.00 0.00 C ATOM 1596 CG PRO A 103 3.223 0.265 5.524 1.00 0.00 C ATOM 1597 CD PRO A 103 3.486 -0.939 4.671 1.00 0.00 C ATOM 0 HA PRO A 103 0.491 0.085 4.088 1.00 0.00 H new ATOM 0 HB2 PRO A 103 2.879 1.887 4.176 1.00 0.00 H new ATOM 0 HB3 PRO A 103 1.639 1.693 5.399 1.00 0.00 H new ATOM 0 HG2 PRO A 103 4.153 0.781 5.764 1.00 0.00 H new ATOM 0 HG3 PRO A 103 2.765 -0.023 6.470 1.00 0.00 H new ATOM 0 HD2 PRO A 103 4.373 -0.807 4.051 1.00 0.00 H new ATOM 0 HD3 PRO A 103 3.648 -1.832 5.274 1.00 0.00 H new ATOM 1605 N ILE A 104 0.621 1.663 2.116 1.00 0.00 N ATOM 1606 CA ILE A 104 0.463 2.306 0.818 1.00 0.00 C ATOM 1607 C ILE A 104 1.751 2.983 0.363 1.00 0.00 C ATOM 1608 O ILE A 104 2.174 2.833 -0.791 1.00 0.00 O ATOM 1609 CB ILE A 104 -0.708 3.323 0.863 1.00 0.00 C ATOM 1610 CG1 ILE A 104 -2.039 2.570 0.988 1.00 0.00 C ATOM 1611 CG2 ILE A 104 -0.694 4.289 -0.324 1.00 0.00 C ATOM 1612 CD1 ILE A 104 -3.252 3.453 1.042 1.00 0.00 C ATOM 0 H ILE A 104 -0.067 1.968 2.805 1.00 0.00 H new ATOM 0 HA ILE A 104 0.229 1.532 0.087 1.00 0.00 H new ATOM 0 HB ILE A 104 -0.582 3.951 1.745 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -2.138 1.890 0.142 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -2.012 1.957 1.889 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.535 4.978 -0.242 1.00 0.00 H new ATOM 0 HG22 ILE A 104 0.239 4.853 -0.323 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -0.776 3.725 -1.253 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.147 2.837 1.130 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.181 4.116 1.904 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -3.310 4.048 0.131 1.00 0.00 H new ATOM 1624 N GLU A 105 2.396 3.657 1.281 1.00 0.00 N ATOM 1625 CA GLU A 105 3.621 4.380 1.002 1.00 0.00 C ATOM 1626 C GLU A 105 4.756 3.441 0.560 1.00 0.00 C ATOM 1627 O GLU A 105 5.650 3.848 -0.168 1.00 0.00 O ATOM 1628 CB GLU A 105 4.049 5.248 2.196 1.00 0.00 C ATOM 1629 CG GLU A 105 3.110 6.430 2.538 1.00 0.00 C ATOM 1630 CD GLU A 105 1.684 6.023 2.847 1.00 0.00 C ATOM 1631 OE1 GLU A 105 1.475 5.236 3.782 1.00 0.00 O ATOM 1632 OE2 GLU A 105 0.754 6.478 2.147 1.00 0.00 O ATOM 0 H GLU A 105 2.088 3.723 2.251 1.00 0.00 H new ATOM 0 HA GLU A 105 3.411 5.047 0.166 1.00 0.00 H new ATOM 0 HB2 GLU A 105 4.133 4.609 3.075 1.00 0.00 H new ATOM 0 HB3 GLU A 105 5.044 5.645 1.995 1.00 0.00 H new ATOM 0 HG2 GLU A 105 3.517 6.966 3.396 1.00 0.00 H new ATOM 0 HG3 GLU A 105 3.103 7.128 1.701 1.00 0.00 H new ATOM 1639 N GLU A 106 4.690 2.177 0.966 1.00 0.00 N ATOM 1640 CA GLU A 106 5.696 1.201 0.555 1.00 0.00 C ATOM 1641 C GLU A 106 5.431 0.729 -0.849 1.00 0.00 C ATOM 1642 O GLU A 106 6.353 0.480 -1.610 1.00 0.00 O ATOM 1643 CB GLU A 106 5.769 0.015 1.502 1.00 0.00 C ATOM 1644 CG GLU A 106 6.263 0.375 2.875 1.00 0.00 C ATOM 1645 CD GLU A 106 7.578 1.099 2.823 1.00 0.00 C ATOM 1646 OE1 GLU A 106 8.606 0.471 2.487 1.00 0.00 O ATOM 1647 OE2 GLU A 106 7.602 2.306 3.112 1.00 0.00 O ATOM 0 H GLU A 106 3.959 1.806 1.573 1.00 0.00 H new ATOM 0 HA GLU A 106 6.662 1.705 0.589 1.00 0.00 H new ATOM 0 HB2 GLU A 106 4.779 -0.434 1.587 1.00 0.00 H new ATOM 0 HB3 GLU A 106 6.427 -0.742 1.074 1.00 0.00 H new ATOM 0 HG2 GLU A 106 5.523 1.000 3.375 1.00 0.00 H new ATOM 0 HG3 GLU A 106 6.370 -0.531 3.472 1.00 0.00 H new ATOM 1654 N LEU A 107 4.160 0.627 -1.195 1.00 0.00 N ATOM 1655 CA LEU A 107 3.759 0.264 -2.540 1.00 0.00 C ATOM 1656 C LEU A 107 4.217 1.383 -3.472 1.00 0.00 C ATOM 1657 O LEU A 107 4.778 1.134 -4.541 1.00 0.00 O ATOM 1658 CB LEU A 107 2.213 0.039 -2.580 1.00 0.00 C ATOM 1659 CG LEU A 107 1.560 -0.484 -3.891 1.00 0.00 C ATOM 1660 CD1 LEU A 107 1.468 0.589 -4.956 1.00 0.00 C ATOM 1661 CD2 LEU A 107 2.302 -1.706 -4.423 1.00 0.00 C ATOM 0 H LEU A 107 3.383 0.792 -0.556 1.00 0.00 H new ATOM 0 HA LEU A 107 4.218 -0.670 -2.865 1.00 0.00 H new ATOM 0 HB2 LEU A 107 1.962 -0.663 -1.785 1.00 0.00 H new ATOM 0 HB3 LEU A 107 1.736 0.987 -2.330 1.00 0.00 H new ATOM 0 HG LEU A 107 0.541 -0.778 -3.639 1.00 0.00 H new ATOM 0 HD11 LEU A 107 1.005 0.174 -5.851 1.00 0.00 H new ATOM 0 HD12 LEU A 107 0.864 1.418 -4.586 1.00 0.00 H new ATOM 0 HD13 LEU A 107 2.468 0.948 -5.198 1.00 0.00 H new ATOM 0 HD21 LEU A 107 1.824 -2.051 -5.340 1.00 0.00 H new ATOM 0 HD22 LEU A 107 3.338 -1.440 -4.631 1.00 0.00 H new ATOM 0 HD23 LEU A 107 2.274 -2.501 -3.678 1.00 0.00 H new ATOM 1673 N LEU A 108 4.036 2.615 -3.023 1.00 0.00 N ATOM 1674 CA LEU A 108 4.469 3.792 -3.767 1.00 0.00 C ATOM 1675 C LEU A 108 5.989 3.803 -3.900 1.00 0.00 C ATOM 1676 O LEU A 108 6.532 4.069 -4.973 1.00 0.00 O ATOM 1677 CB LEU A 108 4.010 5.055 -3.063 1.00 0.00 C ATOM 1678 CG LEU A 108 2.512 5.200 -2.849 1.00 0.00 C ATOM 1679 CD1 LEU A 108 2.232 6.445 -2.056 1.00 0.00 C ATOM 1680 CD2 LEU A 108 1.765 5.231 -4.178 1.00 0.00 C ATOM 0 H LEU A 108 3.585 2.829 -2.133 1.00 0.00 H new ATOM 0 HA LEU A 108 4.024 3.755 -4.761 1.00 0.00 H new ATOM 0 HB2 LEU A 108 4.501 5.102 -2.091 1.00 0.00 H new ATOM 0 HB3 LEU A 108 4.358 5.913 -3.638 1.00 0.00 H new ATOM 0 HG LEU A 108 2.156 4.333 -2.292 1.00 0.00 H new ATOM 0 HD11 LEU A 108 1.157 6.546 -1.904 1.00 0.00 H new ATOM 0 HD12 LEU A 108 2.730 6.380 -1.089 1.00 0.00 H new ATOM 0 HD13 LEU A 108 2.605 7.314 -2.599 1.00 0.00 H new ATOM 0 HD21 LEU A 108 0.696 5.335 -3.992 1.00 0.00 H new ATOM 0 HD22 LEU A 108 2.114 6.076 -4.772 1.00 0.00 H new ATOM 0 HD23 LEU A 108 1.950 4.304 -4.721 1.00 0.00 H new ATOM 1692 N ALA A 109 6.669 3.453 -2.818 1.00 0.00 N ATOM 1693 CA ALA A 109 8.134 3.387 -2.786 1.00 0.00 C ATOM 1694 C ALA A 109 8.662 2.197 -3.586 1.00 0.00 C ATOM 1695 O ALA A 109 9.869 2.020 -3.728 1.00 0.00 O ATOM 1696 CB ALA A 109 8.632 3.304 -1.355 1.00 0.00 C ATOM 0 H ALA A 109 6.226 3.205 -1.933 1.00 0.00 H new ATOM 0 HA ALA A 109 8.510 4.300 -3.247 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.721 3.256 -1.351 1.00 0.00 H new ATOM 0 HB2 ALA A 109 8.306 4.186 -0.804 1.00 0.00 H new ATOM 0 HB3 ALA A 109 8.227 2.410 -0.880 1.00 0.00 H new ATOM 1702 N SER A 110 7.766 1.377 -4.071 1.00 0.00 N ATOM 1703 CA SER A 110 8.122 0.247 -4.872 1.00 0.00 C ATOM 1704 C SER A 110 7.610 0.453 -6.310 1.00 0.00 C ATOM 1705 O SER A 110 7.793 -0.405 -7.174 1.00 0.00 O ATOM 1706 CB SER A 110 7.526 -1.026 -4.244 1.00 0.00 C ATOM 1707 OG SER A 110 8.030 -2.214 -4.838 1.00 0.00 O ATOM 0 H SER A 110 6.763 1.480 -3.917 1.00 0.00 H new ATOM 0 HA SER A 110 9.206 0.138 -4.911 1.00 0.00 H new ATOM 0 HB2 SER A 110 7.745 -1.037 -3.176 1.00 0.00 H new ATOM 0 HB3 SER A 110 6.441 -1.004 -4.347 1.00 0.00 H new ATOM 0 HG SER A 110 8.079 -2.098 -5.810 1.00 0.00 H new