USER MOD reduce.3.24.130724 H: found=0, std=0, add=521, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 521 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 117 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN : amide:sc= -0.0783 K(o=-0.078,f=-2.2!) USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 92 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 93 LYS NZ :NH3+ -161:sc= -0.0496 (180deg=-0.596) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= -0.0827 USER MOD Single : A 101 TYR OH : rot 180:sc= -0.481 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= -0.165 USER MOD Single : A 109 SER OG : rot -31:sc= 0.0715 USER MOD Single : A 110 HIS : no HD1:sc= -0.0757 X(o=-0.076,f=-0.55) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 25:sc= -0.389 USER MOD Single : A 123 LYS NZ :NH3+ -163:sc= -0.0897 (180deg=-0.55) USER MOD Single : A 131 LYS NZ :NH3+ 179:sc= -1.21 (180deg=-1.26) USER MOD Single : A 132 THR OG1 : rot 180:sc= -0.0166 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ -165:sc=-0.00715 (180deg=-0.267) USER MOD Single : A 138 MET CE :methyl -166:sc= -0.911 (180deg=-1.71) USER MOD Single : A 139 SER OG : rot 87:sc= -0.635 USER MOD Single : A 142 LYS NZ :NH3+ -165:sc=-0.00627 (180deg=-0.294) USER MOD Single : A 146 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 147 SER OG : rot -147:sc= 0.0889 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 16 N ALA A 82 35.063 -0.018 -6.859 1.00 0.00 N ATOM 17 CA ALA A 82 34.936 -1.321 -6.231 1.00 0.00 C ATOM 18 C ALA A 82 33.484 -1.578 -5.853 1.00 0.00 C ATOM 19 O ALA A 82 33.019 -1.162 -4.791 1.00 0.00 O ATOM 20 CB ALA A 82 35.808 -1.379 -4.982 1.00 0.00 C ATOM 0 HA ALA A 82 35.262 -2.086 -6.935 1.00 0.00 H new ATOM 0 HB1 ALA A 82 35.709 -2.359 -4.514 1.00 0.00 H new ATOM 0 HB2 ALA A 82 36.849 -1.212 -5.257 1.00 0.00 H new ATOM 0 HB3 ALA A 82 35.490 -0.608 -4.280 1.00 0.00 H new ATOM 26 N TYR A 83 32.782 -2.278 -6.723 1.00 0.00 N ATOM 27 CA TYR A 83 31.379 -2.608 -6.486 1.00 0.00 C ATOM 28 C TYR A 83 31.204 -3.139 -5.070 1.00 0.00 C ATOM 29 O TYR A 83 30.092 -3.210 -4.552 1.00 0.00 O ATOM 30 CB TYR A 83 30.903 -3.663 -7.499 1.00 0.00 C ATOM 31 CG TYR A 83 31.544 -3.401 -8.843 1.00 0.00 C ATOM 32 CD1 TYR A 83 31.509 -2.115 -9.399 1.00 0.00 C ATOM 33 CD2 TYR A 83 32.175 -4.444 -9.535 1.00 0.00 C ATOM 34 CE1 TYR A 83 32.104 -1.874 -10.643 1.00 0.00 C ATOM 35 CE2 TYR A 83 32.769 -4.201 -10.778 1.00 0.00 C ATOM 36 CZ TYR A 83 32.732 -2.917 -11.332 1.00 0.00 C ATOM 37 OH TYR A 83 33.318 -2.677 -12.557 1.00 0.00 O ATOM 0 H TYR A 83 33.156 -2.632 -7.603 1.00 0.00 H new ATOM 0 HA TYR A 83 30.781 -1.705 -6.608 1.00 0.00 H new ATOM 0 HB2 TYR A 83 31.164 -4.662 -7.149 1.00 0.00 H new ATOM 0 HB3 TYR A 83 29.817 -3.631 -7.590 1.00 0.00 H new ATOM 0 HD1 TYR A 83 31.023 -1.310 -8.868 1.00 0.00 H new ATOM 0 HD2 TYR A 83 32.203 -5.436 -9.108 1.00 0.00 H new ATOM 0 HE1 TYR A 83 32.078 -0.883 -11.071 1.00 0.00 H new ATOM 0 HE2 TYR A 83 33.256 -5.005 -11.310 1.00 0.00 H new ATOM 0 HH TYR A 83 33.711 -3.507 -12.900 1.00 0.00 H new ATOM 47 N LYS A 84 32.314 -3.511 -4.450 1.00 0.00 N ATOM 48 CA LYS A 84 32.281 -4.032 -3.088 1.00 0.00 C ATOM 49 C LYS A 84 31.799 -2.952 -2.126 1.00 0.00 C ATOM 50 O LYS A 84 31.031 -3.221 -1.203 1.00 0.00 O ATOM 51 CB LYS A 84 33.671 -4.512 -2.671 1.00 0.00 C ATOM 52 CG LYS A 84 34.067 -5.717 -3.527 1.00 0.00 C ATOM 53 CD LYS A 84 35.468 -6.186 -3.132 1.00 0.00 C ATOM 54 CE LYS A 84 35.859 -7.397 -3.979 1.00 0.00 C ATOM 55 NZ LYS A 84 37.225 -7.851 -3.594 1.00 0.00 N1+ ATOM 0 H LYS A 84 33.245 -3.463 -4.864 1.00 0.00 H new ATOM 0 HA LYS A 84 31.590 -4.875 -3.054 1.00 0.00 H new ATOM 0 HB2 LYS A 84 34.398 -3.709 -2.794 1.00 0.00 H new ATOM 0 HB3 LYS A 84 33.673 -4.785 -1.616 1.00 0.00 H new ATOM 0 HG2 LYS A 84 33.349 -6.526 -3.389 1.00 0.00 H new ATOM 0 HG3 LYS A 84 34.046 -5.449 -4.583 1.00 0.00 H new ATOM 0 HD2 LYS A 84 36.187 -5.380 -3.277 1.00 0.00 H new ATOM 0 HD3 LYS A 84 35.491 -6.447 -2.074 1.00 0.00 H new ATOM 0 HE2 LYS A 84 35.141 -8.204 -3.833 1.00 0.00 H new ATOM 0 HE3 LYS A 84 35.835 -7.137 -5.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 37.492 -8.675 -4.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 37.905 -7.081 -3.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 37.233 -8.115 -2.588 1.00 0.00 H new ATOM 69 N ASN A 85 32.266 -1.729 -2.348 1.00 0.00 N ATOM 70 CA ASN A 85 31.879 -0.612 -1.489 1.00 0.00 C ATOM 71 C ASN A 85 30.386 -0.322 -1.615 1.00 0.00 C ATOM 72 O ASN A 85 29.683 -0.177 -0.617 1.00 0.00 O ATOM 73 CB ASN A 85 32.672 0.642 -1.863 1.00 0.00 C ATOM 74 CG ASN A 85 34.102 0.523 -1.349 1.00 0.00 C ATOM 75 OD1 ASN A 85 34.383 -0.298 -0.475 1.00 0.00 O ATOM 76 ND2 ASN A 85 35.028 1.296 -1.843 1.00 0.00 N ATOM 0 H ASN A 85 32.905 -1.485 -3.105 1.00 0.00 H new ATOM 0 HA ASN A 85 32.099 -0.888 -0.458 1.00 0.00 H new ATOM 0 HB2 ASN A 85 32.675 0.772 -2.945 1.00 0.00 H new ATOM 0 HB3 ASN A 85 32.195 1.525 -1.437 1.00 0.00 H new ATOM 0 HD21 ASN A 85 35.988 1.222 -1.506 1.00 0.00 H new ATOM 0 HD22 ASN A 85 34.793 1.975 -2.567 1.00 0.00 H new ATOM 83 N LEU A 86 29.911 -0.244 -2.847 1.00 0.00 N ATOM 84 CA LEU A 86 28.504 0.036 -3.090 1.00 0.00 C ATOM 85 C LEU A 86 27.622 -1.042 -2.477 1.00 0.00 C ATOM 86 O LEU A 86 26.575 -0.748 -1.903 1.00 0.00 O ATOM 87 CB LEU A 86 28.250 0.108 -4.589 1.00 0.00 C ATOM 88 CG LEU A 86 26.758 0.447 -4.867 1.00 0.00 C ATOM 89 CD1 LEU A 86 26.654 1.461 -6.012 1.00 0.00 C ATOM 90 CD2 LEU A 86 25.995 -0.830 -5.260 1.00 0.00 C ATOM 0 H LEU A 86 30.473 -0.369 -3.689 1.00 0.00 H new ATOM 0 HA LEU A 86 28.257 0.991 -2.626 1.00 0.00 H new ATOM 0 HB2 LEU A 86 28.892 0.866 -5.038 1.00 0.00 H new ATOM 0 HB3 LEU A 86 28.507 -0.844 -5.055 1.00 0.00 H new ATOM 0 HG LEU A 86 26.323 0.872 -3.962 1.00 0.00 H new ATOM 0 HD11 LEU A 86 25.605 1.692 -6.199 1.00 0.00 H new ATOM 0 HD12 LEU A 86 27.184 2.374 -5.739 1.00 0.00 H new ATOM 0 HD13 LEU A 86 27.099 1.039 -6.913 1.00 0.00 H new ATOM 0 HD21 LEU A 86 24.951 -0.585 -5.453 1.00 0.00 H new ATOM 0 HD22 LEU A 86 26.440 -1.258 -6.159 1.00 0.00 H new ATOM 0 HD23 LEU A 86 26.053 -1.554 -4.447 1.00 0.00 H new ATOM 102 N LEU A 87 28.051 -2.291 -2.599 1.00 0.00 N ATOM 103 CA LEU A 87 27.286 -3.406 -2.055 1.00 0.00 C ATOM 104 C LEU A 87 27.054 -3.200 -0.562 1.00 0.00 C ATOM 105 O LEU A 87 25.990 -3.525 -0.039 1.00 0.00 O ATOM 106 CB LEU A 87 28.039 -4.718 -2.290 1.00 0.00 C ATOM 107 CG LEU A 87 27.851 -5.158 -3.750 1.00 0.00 C ATOM 108 CD1 LEU A 87 28.846 -6.275 -4.079 1.00 0.00 C ATOM 109 CD2 LEU A 87 26.405 -5.659 -3.986 1.00 0.00 C ATOM 0 H LEU A 87 28.918 -2.557 -3.066 1.00 0.00 H new ATOM 0 HA LEU A 87 26.321 -3.454 -2.560 1.00 0.00 H new ATOM 0 HB2 LEU A 87 29.099 -4.586 -2.072 1.00 0.00 H new ATOM 0 HB3 LEU A 87 27.668 -5.489 -1.615 1.00 0.00 H new ATOM 0 HG LEU A 87 28.032 -4.302 -4.401 1.00 0.00 H new ATOM 0 HD11 LEU A 87 28.713 -6.587 -5.115 1.00 0.00 H new ATOM 0 HD12 LEU A 87 29.863 -5.909 -3.938 1.00 0.00 H new ATOM 0 HD13 LEU A 87 28.671 -7.124 -3.419 1.00 0.00 H new ATOM 0 HD21 LEU A 87 26.291 -5.966 -5.026 1.00 0.00 H new ATOM 0 HD22 LEU A 87 26.203 -6.508 -3.333 1.00 0.00 H new ATOM 0 HD23 LEU A 87 25.701 -4.856 -3.766 1.00 0.00 H new ATOM 121 N GLN A 88 28.054 -2.664 0.114 1.00 0.00 N ATOM 122 CA GLN A 88 27.940 -2.412 1.544 1.00 0.00 C ATOM 123 C GLN A 88 26.955 -1.276 1.808 1.00 0.00 C ATOM 124 O GLN A 88 26.217 -1.305 2.794 1.00 0.00 O ATOM 125 CB GLN A 88 29.304 -2.039 2.121 1.00 0.00 C ATOM 126 CG GLN A 88 30.245 -3.238 2.021 1.00 0.00 C ATOM 127 CD GLN A 88 31.645 -2.845 2.467 1.00 0.00 C ATOM 128 OE1 GLN A 88 31.872 -1.707 2.877 1.00 0.00 O ATOM 129 NE2 GLN A 88 32.607 -3.726 2.416 1.00 0.00 N ATOM 0 H GLN A 88 28.948 -2.396 -0.297 1.00 0.00 H new ATOM 0 HA GLN A 88 27.577 -3.320 2.024 1.00 0.00 H new ATOM 0 HB2 GLN A 88 29.720 -1.190 1.578 1.00 0.00 H new ATOM 0 HB3 GLN A 88 29.199 -1.732 3.161 1.00 0.00 H new ATOM 0 HG2 GLN A 88 29.873 -4.054 2.641 1.00 0.00 H new ATOM 0 HG3 GLN A 88 30.272 -3.604 0.995 1.00 0.00 H new ATOM 0 HE21 GLN A 88 32.418 -4.669 2.076 1.00 0.00 H new ATOM 0 HE22 GLN A 88 33.548 -3.472 2.716 1.00 0.00 H new ATOM 138 N GLU A 89 26.957 -0.268 0.932 1.00 0.00 N ATOM 139 CA GLU A 89 26.067 0.879 1.109 1.00 0.00 C ATOM 140 C GLU A 89 24.603 0.448 1.069 1.00 0.00 C ATOM 141 O GLU A 89 23.812 0.822 1.938 1.00 0.00 O ATOM 142 CB GLU A 89 26.334 1.910 -0.001 1.00 0.00 C ATOM 143 CG GLU A 89 27.511 2.809 0.390 1.00 0.00 C ATOM 144 CD GLU A 89 28.780 1.980 0.527 1.00 0.00 C ATOM 145 OE1 GLU A 89 28.837 1.163 1.432 1.00 0.00 O ATOM 146 OE2 GLU A 89 29.680 2.171 -0.274 1.00 0.00 O1- ATOM 0 H GLU A 89 27.555 -0.223 0.107 1.00 0.00 H new ATOM 0 HA GLU A 89 26.266 1.324 2.084 1.00 0.00 H new ATOM 0 HB2 GLU A 89 26.552 1.399 -0.939 1.00 0.00 H new ATOM 0 HB3 GLU A 89 25.443 2.516 -0.168 1.00 0.00 H new ATOM 0 HG2 GLU A 89 27.653 3.584 -0.364 1.00 0.00 H new ATOM 0 HG3 GLU A 89 27.295 3.315 1.331 1.00 0.00 H new ATOM 153 N ILE A 90 24.248 -0.331 0.062 1.00 0.00 N ATOM 154 CA ILE A 90 22.876 -0.798 -0.081 1.00 0.00 C ATOM 155 C ILE A 90 22.487 -1.691 1.091 1.00 0.00 C ATOM 156 O ILE A 90 21.369 -1.614 1.599 1.00 0.00 O ATOM 157 CB ILE A 90 22.719 -1.561 -1.400 1.00 0.00 C ATOM 158 CG1 ILE A 90 23.792 -2.646 -1.490 1.00 0.00 C ATOM 159 CG2 ILE A 90 22.875 -0.599 -2.578 1.00 0.00 C ATOM 160 CD1 ILE A 90 23.638 -3.424 -2.797 1.00 0.00 C ATOM 0 H ILE A 90 24.885 -0.653 -0.666 1.00 0.00 H new ATOM 0 HA ILE A 90 22.213 0.068 -0.088 1.00 0.00 H new ATOM 0 HB ILE A 90 21.729 -2.017 -1.435 1.00 0.00 H new ATOM 0 HG12 ILE A 90 24.783 -2.195 -1.440 1.00 0.00 H new ATOM 0 HG13 ILE A 90 23.708 -3.324 -0.641 1.00 0.00 H new ATOM 0 HG21 ILE A 90 22.762 -1.148 -3.513 1.00 0.00 H new ATOM 0 HG22 ILE A 90 22.111 0.177 -2.518 1.00 0.00 H new ATOM 0 HG23 ILE A 90 23.863 -0.139 -2.544 1.00 0.00 H new ATOM 0 HD11 ILE A 90 24.406 -4.195 -2.854 1.00 0.00 H new ATOM 0 HD12 ILE A 90 22.653 -3.890 -2.829 1.00 0.00 H new ATOM 0 HD13 ILE A 90 23.745 -2.742 -3.641 1.00 0.00 H new ATOM 172 N ALA A 91 23.413 -2.543 1.511 1.00 0.00 N ATOM 173 CA ALA A 91 23.153 -3.448 2.619 1.00 0.00 C ATOM 174 C ALA A 91 22.810 -2.667 3.882 1.00 0.00 C ATOM 175 O ALA A 91 21.821 -2.957 4.555 1.00 0.00 O ATOM 176 CB ALA A 91 24.377 -4.326 2.878 1.00 0.00 C ATOM 0 H ALA A 91 24.344 -2.625 1.103 1.00 0.00 H new ATOM 0 HA ALA A 91 22.304 -4.078 2.353 1.00 0.00 H new ATOM 0 HB1 ALA A 91 24.172 -5.000 3.710 1.00 0.00 H new ATOM 0 HB2 ALA A 91 24.602 -4.909 1.985 1.00 0.00 H new ATOM 0 HB3 ALA A 91 25.231 -3.696 3.124 1.00 0.00 H new ATOM 182 N GLN A 92 23.632 -1.672 4.195 1.00 0.00 N ATOM 183 CA GLN A 92 23.403 -0.850 5.377 1.00 0.00 C ATOM 184 C GLN A 92 22.159 0.013 5.201 1.00 0.00 C ATOM 185 O GLN A 92 21.359 0.162 6.126 1.00 0.00 O ATOM 186 CB GLN A 92 24.617 0.046 5.630 1.00 0.00 C ATOM 187 CG GLN A 92 24.396 0.860 6.909 1.00 0.00 C ATOM 188 CD GLN A 92 25.662 1.636 7.257 1.00 0.00 C ATOM 189 OE1 GLN A 92 26.742 1.320 6.761 1.00 0.00 O ATOM 190 NE2 GLN A 92 25.590 2.642 8.086 1.00 0.00 N ATOM 0 H GLN A 92 24.457 -1.416 3.652 1.00 0.00 H new ATOM 0 HA GLN A 92 23.252 -1.510 6.231 1.00 0.00 H new ATOM 0 HB2 GLN A 92 25.517 -0.562 5.724 1.00 0.00 H new ATOM 0 HB3 GLN A 92 24.771 0.715 4.783 1.00 0.00 H new ATOM 0 HG2 GLN A 92 23.563 1.549 6.772 1.00 0.00 H new ATOM 0 HG3 GLN A 92 24.129 0.196 7.731 1.00 0.00 H new ATOM 0 HE21 GLN A 92 24.693 2.902 8.496 1.00 0.00 H new ATOM 0 HE22 GLN A 92 26.431 3.168 8.324 1.00 0.00 H new ATOM 199 N LYS A 93 22.000 0.582 4.009 1.00 0.00 N ATOM 200 CA LYS A 93 20.849 1.433 3.731 1.00 0.00 C ATOM 201 C LYS A 93 19.552 0.645 3.865 1.00 0.00 C ATOM 202 O LYS A 93 18.618 1.075 4.544 1.00 0.00 O ATOM 203 CB LYS A 93 20.960 2.003 2.316 1.00 0.00 C ATOM 204 CG LYS A 93 19.806 2.973 2.064 1.00 0.00 C ATOM 205 CD LYS A 93 19.978 3.627 0.690 1.00 0.00 C ATOM 206 CE LYS A 93 18.838 4.619 0.452 1.00 0.00 C ATOM 207 NZ LYS A 93 17.537 3.891 0.472 1.00 0.00 N1+ ATOM 0 H LYS A 93 22.647 0.471 3.228 1.00 0.00 H new ATOM 0 HA LYS A 93 20.837 2.248 4.455 1.00 0.00 H new ATOM 0 HB2 LYS A 93 21.914 2.516 2.193 1.00 0.00 H new ATOM 0 HB3 LYS A 93 20.936 1.195 1.584 1.00 0.00 H new ATOM 0 HG2 LYS A 93 18.855 2.443 2.109 1.00 0.00 H new ATOM 0 HG3 LYS A 93 19.783 3.737 2.841 1.00 0.00 H new ATOM 0 HD2 LYS A 93 20.938 4.140 0.637 1.00 0.00 H new ATOM 0 HD3 LYS A 93 19.980 2.865 -0.090 1.00 0.00 H new ATOM 0 HE2 LYS A 93 18.847 5.392 1.221 1.00 0.00 H new ATOM 0 HE3 LYS A 93 18.972 5.121 -0.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 16.809 4.468 0.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 17.638 2.987 -0.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 17.256 3.710 1.457 1.00 0.00 H new ATOM 221 N GLU A 94 19.502 -0.516 3.224 1.00 0.00 N ATOM 222 CA GLU A 94 18.317 -1.361 3.285 1.00 0.00 C ATOM 223 C GLU A 94 18.115 -1.893 4.697 1.00 0.00 C ATOM 224 O GLU A 94 17.020 -2.322 5.054 1.00 0.00 O ATOM 225 CB GLU A 94 18.449 -2.532 2.312 1.00 0.00 C ATOM 226 CG GLU A 94 18.408 -2.009 0.876 1.00 0.00 C ATOM 227 CD GLU A 94 18.637 -3.156 -0.103 1.00 0.00 C ATOM 228 OE1 GLU A 94 18.819 -4.271 0.354 1.00 0.00 O ATOM 229 OE2 GLU A 94 18.627 -2.900 -1.297 1.00 0.00 O1- ATOM 0 H GLU A 94 20.264 -0.892 2.659 1.00 0.00 H new ATOM 0 HA GLU A 94 17.453 -0.758 3.005 1.00 0.00 H new ATOM 0 HB2 GLU A 94 19.384 -3.063 2.490 1.00 0.00 H new ATOM 0 HB3 GLU A 94 17.641 -3.246 2.474 1.00 0.00 H new ATOM 0 HG2 GLU A 94 17.445 -1.538 0.679 1.00 0.00 H new ATOM 0 HG3 GLU A 94 19.171 -1.243 0.737 1.00 0.00 H new ATOM 236 N SER A 95 19.182 -1.868 5.492 1.00 0.00 N ATOM 237 CA SER A 95 19.110 -2.359 6.864 1.00 0.00 C ATOM 238 C SER A 95 19.105 -3.884 6.873 1.00 0.00 C ATOM 239 O SER A 95 18.667 -4.510 7.838 1.00 0.00 O ATOM 240 CB SER A 95 17.846 -1.823 7.552 1.00 0.00 C ATOM 241 OG SER A 95 18.090 -1.694 8.946 1.00 0.00 O ATOM 0 H SER A 95 20.098 -1.516 5.213 1.00 0.00 H new ATOM 0 HA SER A 95 19.984 -2.005 7.411 1.00 0.00 H new ATOM 0 HB2 SER A 95 17.569 -0.858 7.129 1.00 0.00 H new ATOM 0 HB3 SER A 95 17.009 -2.499 7.379 1.00 0.00 H new ATOM 0 HG SER A 95 17.286 -1.351 9.388 1.00 0.00 H new ATOM 247 N SER A 96 19.592 -4.472 5.786 1.00 0.00 N ATOM 248 CA SER A 96 19.641 -5.921 5.668 1.00 0.00 C ATOM 249 C SER A 96 20.834 -6.473 6.436 1.00 0.00 C ATOM 250 O SER A 96 20.894 -6.371 7.662 1.00 0.00 O ATOM 251 CB SER A 96 19.747 -6.318 4.199 1.00 0.00 C ATOM 252 OG SER A 96 20.762 -5.544 3.574 1.00 0.00 O ATOM 0 H SER A 96 19.957 -3.968 4.978 1.00 0.00 H new ATOM 0 HA SER A 96 18.726 -6.338 6.089 1.00 0.00 H new ATOM 0 HB2 SER A 96 19.979 -7.380 4.113 1.00 0.00 H new ATOM 0 HB3 SER A 96 18.792 -6.159 3.698 1.00 0.00 H new ATOM 0 HG SER A 96 20.833 -5.798 2.630 1.00 0.00 H new ATOM 258 N LEU A 97 21.784 -7.057 5.709 1.00 0.00 N ATOM 259 CA LEU A 97 22.979 -7.620 6.327 1.00 0.00 C ATOM 260 C LEU A 97 24.202 -7.344 5.465 1.00 0.00 C ATOM 261 O LEU A 97 24.218 -7.652 4.271 1.00 0.00 O ATOM 262 CB LEU A 97 22.809 -9.130 6.510 1.00 0.00 C ATOM 263 CG LEU A 97 24.034 -9.710 7.229 1.00 0.00 C ATOM 264 CD1 LEU A 97 24.179 -9.074 8.627 1.00 0.00 C ATOM 265 CD2 LEU A 97 23.871 -11.226 7.364 1.00 0.00 C ATOM 0 H LEU A 97 21.749 -7.152 4.694 1.00 0.00 H new ATOM 0 HA LEU A 97 23.121 -7.151 7.301 1.00 0.00 H new ATOM 0 HB2 LEU A 97 21.907 -9.336 7.086 1.00 0.00 H new ATOM 0 HB3 LEU A 97 22.684 -9.611 5.540 1.00 0.00 H new ATOM 0 HG LEU A 97 24.930 -9.489 6.648 1.00 0.00 H new ATOM 0 HD11 LEU A 97 25.051 -9.493 9.129 1.00 0.00 H new ATOM 0 HD12 LEU A 97 24.302 -7.996 8.525 1.00 0.00 H new ATOM 0 HD13 LEU A 97 23.286 -9.284 9.216 1.00 0.00 H new ATOM 0 HD21 LEU A 97 24.740 -11.641 7.875 1.00 0.00 H new ATOM 0 HD22 LEU A 97 22.972 -11.445 7.940 1.00 0.00 H new ATOM 0 HD23 LEU A 97 23.785 -11.672 6.373 1.00 0.00 H new ATOM 277 N LEU A 98 25.225 -6.756 6.073 1.00 0.00 N ATOM 278 CA LEU A 98 26.443 -6.434 5.345 1.00 0.00 C ATOM 279 C LEU A 98 26.875 -7.612 4.463 1.00 0.00 C ATOM 280 O LEU A 98 26.718 -8.770 4.848 1.00 0.00 O ATOM 281 CB LEU A 98 27.572 -6.087 6.326 1.00 0.00 C ATOM 282 CG LEU A 98 27.405 -4.644 6.805 1.00 0.00 C ATOM 283 CD1 LEU A 98 26.061 -4.498 7.523 1.00 0.00 C ATOM 284 CD2 LEU A 98 28.542 -4.294 7.766 1.00 0.00 C ATOM 0 H LEU A 98 25.235 -6.495 7.059 1.00 0.00 H new ATOM 0 HA LEU A 98 26.240 -5.573 4.708 1.00 0.00 H new ATOM 0 HB2 LEU A 98 27.552 -6.769 7.176 1.00 0.00 H new ATOM 0 HB3 LEU A 98 28.540 -6.211 5.841 1.00 0.00 H new ATOM 0 HG LEU A 98 27.433 -3.969 5.950 1.00 0.00 H new ATOM 0 HD11 LEU A 98 25.941 -3.470 7.865 1.00 0.00 H new ATOM 0 HD12 LEU A 98 25.253 -4.749 6.836 1.00 0.00 H new ATOM 0 HD13 LEU A 98 26.031 -5.171 8.380 1.00 0.00 H new ATOM 0 HD21 LEU A 98 28.425 -3.266 8.109 1.00 0.00 H new ATOM 0 HD22 LEU A 98 28.515 -4.967 8.623 1.00 0.00 H new ATOM 0 HD23 LEU A 98 29.498 -4.399 7.252 1.00 0.00 H new ATOM 296 N PRO A 99 27.414 -7.340 3.297 1.00 0.00 N ATOM 297 CA PRO A 99 27.870 -8.407 2.354 1.00 0.00 C ATOM 298 C PRO A 99 29.111 -9.129 2.869 1.00 0.00 C ATOM 299 O PRO A 99 30.015 -8.496 3.413 1.00 0.00 O ATOM 300 CB PRO A 99 28.169 -7.636 1.059 1.00 0.00 C ATOM 301 CG PRO A 99 28.491 -6.241 1.498 1.00 0.00 C ATOM 302 CD PRO A 99 27.656 -5.993 2.753 1.00 0.00 C ATOM 0 HA PRO A 99 27.126 -9.192 2.221 1.00 0.00 H new ATOM 0 HB2 PRO A 99 29.005 -8.082 0.519 1.00 0.00 H new ATOM 0 HB3 PRO A 99 27.312 -7.649 0.386 1.00 0.00 H new ATOM 0 HG2 PRO A 99 29.555 -6.134 1.709 1.00 0.00 H new ATOM 0 HG3 PRO A 99 28.247 -5.520 0.718 1.00 0.00 H new ATOM 0 HD2 PRO A 99 28.188 -5.364 3.467 1.00 0.00 H new ATOM 0 HD3 PRO A 99 26.721 -5.485 2.516 1.00 0.00 H new ATOM 310 N PHE A 100 29.154 -10.456 2.701 1.00 0.00 N ATOM 311 CA PHE A 100 30.288 -11.243 3.165 1.00 0.00 C ATOM 312 C PHE A 100 30.795 -12.102 2.026 1.00 0.00 C ATOM 313 O PHE A 100 30.021 -12.801 1.370 1.00 0.00 O ATOM 314 CB PHE A 100 29.864 -12.122 4.339 1.00 0.00 C ATOM 315 CG PHE A 100 31.057 -12.902 4.824 1.00 0.00 C ATOM 316 CD1 PHE A 100 32.053 -12.258 5.570 1.00 0.00 C ATOM 317 CD2 PHE A 100 31.175 -14.265 4.530 1.00 0.00 C ATOM 318 CE1 PHE A 100 33.165 -12.977 6.021 1.00 0.00 C ATOM 319 CE2 PHE A 100 32.288 -14.983 4.980 1.00 0.00 C ATOM 320 CZ PHE A 100 33.282 -14.341 5.727 1.00 0.00 C ATOM 0 H PHE A 100 28.418 -10.999 2.249 1.00 0.00 H new ATOM 0 HA PHE A 100 31.085 -10.578 3.498 1.00 0.00 H new ATOM 0 HB2 PHE A 100 29.464 -11.507 5.145 1.00 0.00 H new ATOM 0 HB3 PHE A 100 29.069 -12.802 4.032 1.00 0.00 H new ATOM 0 HD1 PHE A 100 31.962 -11.206 5.797 1.00 0.00 H new ATOM 0 HD2 PHE A 100 30.407 -14.762 3.956 1.00 0.00 H new ATOM 0 HE1 PHE A 100 33.933 -12.480 6.596 1.00 0.00 H new ATOM 0 HE2 PHE A 100 32.380 -16.034 4.751 1.00 0.00 H new ATOM 0 HZ PHE A 100 34.139 -14.897 6.077 1.00 0.00 H new ATOM 330 N TYR A 101 32.097 -12.036 1.782 1.00 0.00 N ATOM 331 CA TYR A 101 32.696 -12.803 0.699 1.00 0.00 C ATOM 332 C TYR A 101 33.285 -14.110 1.228 1.00 0.00 C ATOM 333 O TYR A 101 33.788 -14.165 2.351 1.00 0.00 O ATOM 334 CB TYR A 101 33.804 -11.983 0.032 1.00 0.00 C ATOM 335 CG TYR A 101 33.223 -10.696 -0.501 1.00 0.00 C ATOM 336 CD1 TYR A 101 33.121 -9.579 0.339 1.00 0.00 C ATOM 337 CD2 TYR A 101 32.783 -10.618 -1.826 1.00 0.00 C ATOM 338 CE1 TYR A 101 32.576 -8.386 -0.148 1.00 0.00 C ATOM 339 CE2 TYR A 101 32.241 -9.423 -2.313 1.00 0.00 C ATOM 340 CZ TYR A 101 32.137 -8.308 -1.473 1.00 0.00 C ATOM 341 OH TYR A 101 31.599 -7.132 -1.950 1.00 0.00 O ATOM 0 H TYR A 101 32.753 -11.465 2.314 1.00 0.00 H new ATOM 0 HA TYR A 101 31.919 -13.033 -0.030 1.00 0.00 H new ATOM 0 HB2 TYR A 101 34.595 -11.768 0.750 1.00 0.00 H new ATOM 0 HB3 TYR A 101 34.256 -12.554 -0.779 1.00 0.00 H new ATOM 0 HD1 TYR A 101 33.463 -9.639 1.362 1.00 0.00 H new ATOM 0 HD2 TYR A 101 32.861 -11.479 -2.473 1.00 0.00 H new ATOM 0 HE1 TYR A 101 32.494 -7.526 0.500 1.00 0.00 H new ATOM 0 HE2 TYR A 101 31.903 -9.361 -3.337 1.00 0.00 H new ATOM 0 HH TYR A 101 31.345 -7.246 -2.890 1.00 0.00 H new ATOM 351 N ALA A 102 33.224 -15.158 0.413 1.00 0.00 N ATOM 352 CA ALA A 102 33.755 -16.464 0.806 1.00 0.00 C ATOM 353 C ALA A 102 34.300 -17.199 -0.411 1.00 0.00 C ATOM 354 O ALA A 102 33.793 -17.040 -1.519 1.00 0.00 O ATOM 355 CB ALA A 102 32.656 -17.297 1.460 1.00 0.00 C ATOM 0 H ALA A 102 32.814 -15.132 -0.521 1.00 0.00 H new ATOM 0 HA ALA A 102 34.565 -16.312 1.520 1.00 0.00 H new ATOM 0 HB1 ALA A 102 33.059 -18.268 1.750 1.00 0.00 H new ATOM 0 HB2 ALA A 102 32.285 -16.779 2.345 1.00 0.00 H new ATOM 0 HB3 ALA A 102 31.838 -17.440 0.753 1.00 0.00 H new ATOM 361 N THR A 103 35.336 -18.008 -0.194 1.00 0.00 N ATOM 362 CA THR A 103 35.947 -18.774 -1.278 1.00 0.00 C ATOM 363 C THR A 103 36.101 -20.233 -0.883 1.00 0.00 C ATOM 364 O THR A 103 36.480 -20.543 0.246 1.00 0.00 O ATOM 365 CB THR A 103 37.314 -18.188 -1.622 1.00 0.00 C ATOM 366 OG1 THR A 103 38.036 -19.110 -2.426 1.00 0.00 O ATOM 367 CG2 THR A 103 38.085 -17.909 -0.335 1.00 0.00 C ATOM 0 H THR A 103 35.768 -18.149 0.719 1.00 0.00 H new ATOM 0 HA THR A 103 35.297 -18.715 -2.151 1.00 0.00 H new ATOM 0 HB THR A 103 37.185 -17.256 -2.173 1.00 0.00 H new ATOM 0 HG1 THR A 103 38.913 -18.733 -2.648 1.00 0.00 H new ATOM 0 HG21 THR A 103 39.061 -17.491 -0.579 1.00 0.00 H new ATOM 0 HG22 THR A 103 37.528 -17.198 0.276 1.00 0.00 H new ATOM 0 HG23 THR A 103 38.217 -18.838 0.219 1.00 0.00 H new ATOM 375 N ALA A 104 35.802 -21.130 -1.822 1.00 0.00 N ATOM 376 CA ALA A 104 35.908 -22.572 -1.568 1.00 0.00 C ATOM 377 C ALA A 104 36.844 -23.220 -2.582 1.00 0.00 C ATOM 378 O ALA A 104 36.961 -22.749 -3.713 1.00 0.00 O ATOM 379 CB ALA A 104 34.527 -23.219 -1.659 1.00 0.00 C ATOM 0 H ALA A 104 35.486 -20.889 -2.761 1.00 0.00 H new ATOM 0 HA ALA A 104 36.312 -22.721 -0.567 1.00 0.00 H new ATOM 0 HB1 ALA A 104 34.613 -24.289 -1.469 1.00 0.00 H new ATOM 0 HB2 ALA A 104 33.866 -22.771 -0.917 1.00 0.00 H new ATOM 0 HB3 ALA A 104 34.115 -23.059 -2.655 1.00 0.00 H new ATOM 385 N THR A 105 37.507 -24.306 -2.176 1.00 0.00 N ATOM 386 CA THR A 105 38.422 -25.015 -3.048 1.00 0.00 C ATOM 387 C THR A 105 37.824 -26.356 -3.458 1.00 0.00 C ATOM 388 O THR A 105 37.251 -27.070 -2.635 1.00 0.00 O ATOM 389 CB THR A 105 39.737 -25.244 -2.317 1.00 0.00 C ATOM 390 OG1 THR A 105 39.552 -26.204 -1.286 1.00 0.00 O ATOM 391 CG2 THR A 105 40.232 -23.927 -1.712 1.00 0.00 C ATOM 0 H THR A 105 37.420 -24.708 -1.243 1.00 0.00 H new ATOM 0 HA THR A 105 38.598 -24.419 -3.944 1.00 0.00 H new ATOM 0 HB THR A 105 40.479 -25.614 -3.025 1.00 0.00 H new ATOM 0 HG1 THR A 105 40.401 -26.350 -0.819 1.00 0.00 H new ATOM 0 HG21 THR A 105 41.174 -24.098 -1.190 1.00 0.00 H new ATOM 0 HG22 THR A 105 40.385 -23.196 -2.506 1.00 0.00 H new ATOM 0 HG23 THR A 105 39.491 -23.548 -1.008 1.00 0.00 H new ATOM 399 N SER A 106 37.954 -26.685 -4.737 1.00 0.00 N ATOM 400 CA SER A 106 37.420 -27.940 -5.250 1.00 0.00 C ATOM 401 C SER A 106 38.028 -28.254 -6.605 1.00 0.00 C ATOM 402 O SER A 106 38.560 -27.368 -7.276 1.00 0.00 O ATOM 403 CB SER A 106 35.902 -27.848 -5.381 1.00 0.00 C ATOM 404 OG SER A 106 35.408 -29.048 -5.963 1.00 0.00 O ATOM 0 H SER A 106 38.421 -26.105 -5.434 1.00 0.00 H new ATOM 0 HA SER A 106 37.674 -28.737 -4.551 1.00 0.00 H new ATOM 0 HB2 SER A 106 35.450 -27.692 -4.402 1.00 0.00 H new ATOM 0 HB3 SER A 106 35.630 -26.992 -5.998 1.00 0.00 H new ATOM 0 HG SER A 106 34.433 -28.994 -6.047 1.00 0.00 H new ATOM 410 N GLY A 107 37.945 -29.522 -7.009 1.00 0.00 N ATOM 411 CA GLY A 107 38.491 -29.950 -8.296 1.00 0.00 C ATOM 412 C GLY A 107 39.571 -31.007 -8.112 1.00 0.00 C ATOM 413 O GLY A 107 39.872 -31.408 -6.986 1.00 0.00 O ATOM 0 H GLY A 107 37.507 -30.267 -6.467 1.00 0.00 H new ATOM 0 HA2 GLY A 107 37.690 -30.349 -8.919 1.00 0.00 H new ATOM 0 HA3 GLY A 107 38.906 -29.090 -8.822 1.00 0.00 H new ATOM 417 N PRO A 108 40.152 -31.460 -9.193 1.00 0.00 N ATOM 418 CA PRO A 108 41.225 -32.499 -9.161 1.00 0.00 C ATOM 419 C PRO A 108 42.451 -32.036 -8.378 1.00 0.00 C ATOM 420 O PRO A 108 42.780 -30.851 -8.360 1.00 0.00 O ATOM 421 CB PRO A 108 41.573 -32.714 -10.649 1.00 0.00 C ATOM 422 CG PRO A 108 41.076 -31.496 -11.340 1.00 0.00 C ATOM 423 CD PRO A 108 39.849 -31.041 -10.573 1.00 0.00 C ATOM 0 HA PRO A 108 40.896 -33.410 -8.660 1.00 0.00 H new ATOM 0 HB2 PRO A 108 42.647 -32.837 -10.789 1.00 0.00 H new ATOM 0 HB3 PRO A 108 41.095 -33.612 -11.040 1.00 0.00 H new ATOM 0 HG2 PRO A 108 41.838 -30.717 -11.351 1.00 0.00 H new ATOM 0 HG3 PRO A 108 40.827 -31.713 -12.379 1.00 0.00 H new ATOM 0 HD2 PRO A 108 39.703 -29.963 -10.646 1.00 0.00 H new ATOM 0 HD3 PRO A 108 38.940 -31.511 -10.948 1.00 0.00 H new ATOM 431 N SER A 109 43.129 -32.989 -7.748 1.00 0.00 N ATOM 432 CA SER A 109 44.326 -32.678 -6.984 1.00 0.00 C ATOM 433 C SER A 109 45.406 -32.132 -7.912 1.00 0.00 C ATOM 434 O SER A 109 46.378 -31.528 -7.457 1.00 0.00 O ATOM 435 CB SER A 109 44.840 -33.935 -6.280 1.00 0.00 C ATOM 436 OG SER A 109 45.954 -33.595 -5.465 1.00 0.00 O ATOM 0 H SER A 109 42.871 -33.976 -7.752 1.00 0.00 H new ATOM 0 HA SER A 109 44.081 -31.925 -6.235 1.00 0.00 H new ATOM 0 HB2 SER A 109 44.050 -34.373 -5.671 1.00 0.00 H new ATOM 0 HB3 SER A 109 45.129 -34.685 -7.016 1.00 0.00 H new ATOM 0 HG SER A 109 46.435 -32.842 -5.867 1.00 0.00 H new ATOM 442 N HIS A 110 45.230 -32.351 -9.217 1.00 0.00 N ATOM 443 CA HIS A 110 46.195 -31.874 -10.204 1.00 0.00 C ATOM 444 C HIS A 110 45.839 -30.470 -10.656 1.00 0.00 C ATOM 445 O HIS A 110 46.707 -29.603 -10.756 1.00 0.00 O ATOM 446 CB HIS A 110 46.220 -32.809 -11.411 1.00 0.00 C ATOM 447 CG HIS A 110 47.361 -32.426 -12.314 1.00 0.00 C ATOM 448 ND1 HIS A 110 47.237 -31.447 -13.285 1.00 0.00 N ATOM 449 CD2 HIS A 110 48.652 -32.884 -12.404 1.00 0.00 C ATOM 450 CE1 HIS A 110 48.423 -31.347 -13.914 1.00 0.00 C ATOM 451 NE2 HIS A 110 49.321 -32.200 -13.417 1.00 0.00 N ATOM 0 H HIS A 110 44.434 -32.852 -9.611 1.00 0.00 H new ATOM 0 HA HIS A 110 47.182 -31.859 -9.741 1.00 0.00 H new ATOM 0 HB2 HIS A 110 46.332 -33.842 -11.083 1.00 0.00 H new ATOM 0 HB3 HIS A 110 45.276 -32.747 -11.953 1.00 0.00 H new ATOM 0 HD2 HIS A 110 49.083 -33.656 -11.784 1.00 0.00 H new ATOM 0 HE1 HIS A 110 48.623 -30.660 -14.723 1.00 0.00 H new ATOM 0 HE2 HIS A 110 50.289 -32.324 -13.715 1.00 0.00 H new ATOM 459 N ALA A 111 44.548 -30.250 -10.915 1.00 0.00 N ATOM 460 CA ALA A 111 44.069 -28.933 -11.341 1.00 0.00 C ATOM 461 C ALA A 111 42.943 -28.453 -10.423 1.00 0.00 C ATOM 462 O ALA A 111 41.768 -28.505 -10.783 1.00 0.00 O ATOM 463 CB ALA A 111 43.585 -28.997 -12.801 1.00 0.00 C ATOM 0 H ALA A 111 43.820 -30.961 -10.838 1.00 0.00 H new ATOM 0 HA ALA A 111 44.891 -28.220 -11.276 1.00 0.00 H new ATOM 0 HB1 ALA A 111 43.230 -28.014 -13.110 1.00 0.00 H new ATOM 0 HB2 ALA A 111 44.409 -29.304 -13.444 1.00 0.00 H new ATOM 0 HB3 ALA A 111 42.772 -29.718 -12.884 1.00 0.00 H new ATOM 469 N PRO A 112 43.283 -27.975 -9.256 1.00 0.00 N ATOM 470 CA PRO A 112 42.283 -27.476 -8.276 1.00 0.00 C ATOM 471 C PRO A 112 41.836 -26.049 -8.582 1.00 0.00 C ATOM 472 O PRO A 112 42.663 -25.158 -8.760 1.00 0.00 O ATOM 473 CB PRO A 112 43.034 -27.549 -6.941 1.00 0.00 C ATOM 474 CG PRO A 112 44.486 -27.380 -7.291 1.00 0.00 C ATOM 475 CD PRO A 112 44.657 -27.861 -8.740 1.00 0.00 C ATOM 0 HA PRO A 112 41.363 -28.060 -8.287 1.00 0.00 H new ATOM 0 HB2 PRO A 112 42.700 -26.767 -6.259 1.00 0.00 H new ATOM 0 HB3 PRO A 112 42.858 -28.502 -6.443 1.00 0.00 H new ATOM 0 HG2 PRO A 112 44.788 -26.337 -7.193 1.00 0.00 H new ATOM 0 HG3 PRO A 112 45.116 -27.959 -6.615 1.00 0.00 H new ATOM 0 HD2 PRO A 112 45.244 -27.154 -9.326 1.00 0.00 H new ATOM 0 HD3 PRO A 112 45.177 -28.818 -8.782 1.00 0.00 H new ATOM 483 N THR A 113 40.525 -25.841 -8.636 1.00 0.00 N ATOM 484 CA THR A 113 39.965 -24.520 -8.914 1.00 0.00 C ATOM 485 C THR A 113 39.332 -23.950 -7.661 1.00 0.00 C ATOM 486 O THR A 113 39.232 -24.628 -6.640 1.00 0.00 O ATOM 487 CB THR A 113 38.920 -24.619 -10.028 1.00 0.00 C ATOM 488 OG1 THR A 113 37.684 -25.059 -9.479 1.00 0.00 O ATOM 489 CG2 THR A 113 39.391 -25.616 -11.091 1.00 0.00 C ATOM 0 H THR A 113 39.827 -26.571 -8.491 1.00 0.00 H new ATOM 0 HA THR A 113 40.768 -23.857 -9.238 1.00 0.00 H new ATOM 0 HB THR A 113 38.787 -23.639 -10.487 1.00 0.00 H new ATOM 0 HG1 THR A 113 37.014 -25.121 -10.191 1.00 0.00 H new ATOM 0 HG21 THR A 113 38.645 -25.684 -11.882 1.00 0.00 H new ATOM 0 HG22 THR A 113 40.337 -25.278 -11.513 1.00 0.00 H new ATOM 0 HG23 THR A 113 39.527 -26.597 -10.635 1.00 0.00 H new ATOM 497 N PHE A 114 38.913 -22.693 -7.745 1.00 0.00 N ATOM 498 CA PHE A 114 38.295 -22.021 -6.603 1.00 0.00 C ATOM 499 C PHE A 114 37.029 -21.290 -7.035 1.00 0.00 C ATOM 500 O PHE A 114 36.941 -20.799 -8.160 1.00 0.00 O ATOM 501 CB PHE A 114 39.292 -21.020 -5.997 1.00 0.00 C ATOM 502 CG PHE A 114 40.700 -21.512 -6.239 1.00 0.00 C ATOM 503 CD1 PHE A 114 41.219 -22.558 -5.472 1.00 0.00 C ATOM 504 CD2 PHE A 114 41.483 -20.919 -7.229 1.00 0.00 C ATOM 505 CE1 PHE A 114 42.525 -23.009 -5.694 1.00 0.00 C ATOM 506 CE2 PHE A 114 42.785 -21.367 -7.451 1.00 0.00 C ATOM 507 CZ PHE A 114 43.310 -22.409 -6.684 1.00 0.00 C ATOM 0 H PHE A 114 38.988 -22.120 -8.585 1.00 0.00 H new ATOM 0 HA PHE A 114 38.027 -22.769 -5.856 1.00 0.00 H new ATOM 0 HB2 PHE A 114 39.156 -20.036 -6.446 1.00 0.00 H new ATOM 0 HB3 PHE A 114 39.111 -20.911 -4.928 1.00 0.00 H new ATOM 0 HD1 PHE A 114 40.612 -23.019 -4.707 1.00 0.00 H new ATOM 0 HD2 PHE A 114 41.081 -20.112 -7.824 1.00 0.00 H new ATOM 0 HE1 PHE A 114 42.926 -23.819 -5.102 1.00 0.00 H new ATOM 0 HE2 PHE A 114 43.389 -20.906 -8.219 1.00 0.00 H new ATOM 0 HZ PHE A 114 44.320 -22.751 -6.855 1.00 0.00 H new ATOM 517 N THR A 115 36.053 -21.222 -6.134 1.00 0.00 N ATOM 518 CA THR A 115 34.793 -20.541 -6.423 1.00 0.00 C ATOM 519 C THR A 115 34.466 -19.553 -5.315 1.00 0.00 C ATOM 520 O THR A 115 34.376 -19.925 -4.144 1.00 0.00 O ATOM 521 CB THR A 115 33.667 -21.564 -6.548 1.00 0.00 C ATOM 522 OG1 THR A 115 33.983 -22.485 -7.582 1.00 0.00 O ATOM 523 CG2 THR A 115 32.363 -20.841 -6.886 1.00 0.00 C ATOM 0 H THR A 115 36.109 -21.629 -5.200 1.00 0.00 H new ATOM 0 HA THR A 115 34.894 -20.000 -7.364 1.00 0.00 H new ATOM 0 HB THR A 115 33.551 -22.101 -5.607 1.00 0.00 H new ATOM 0 HG1 THR A 115 33.263 -23.145 -7.664 1.00 0.00 H new ATOM 0 HG21 THR A 115 31.556 -21.569 -6.976 1.00 0.00 H new ATOM 0 HG22 THR A 115 32.125 -20.131 -6.094 1.00 0.00 H new ATOM 0 HG23 THR A 115 32.477 -20.307 -7.829 1.00 0.00 H new ATOM 531 N SER A 116 34.291 -18.288 -5.688 1.00 0.00 N ATOM 532 CA SER A 116 33.976 -17.250 -4.711 1.00 0.00 C ATOM 533 C SER A 116 32.473 -17.007 -4.666 1.00 0.00 C ATOM 534 O SER A 116 31.848 -16.737 -5.691 1.00 0.00 O ATOM 535 CB SER A 116 34.683 -15.950 -5.085 1.00 0.00 C ATOM 536 OG SER A 116 34.419 -14.970 -4.088 1.00 0.00 O ATOM 0 H SER A 116 34.361 -17.959 -6.651 1.00 0.00 H new ATOM 0 HA SER A 116 34.317 -17.583 -3.731 1.00 0.00 H new ATOM 0 HB2 SER A 116 35.757 -16.118 -5.172 1.00 0.00 H new ATOM 0 HB3 SER A 116 34.336 -15.600 -6.057 1.00 0.00 H new ATOM 0 HG SER A 116 34.208 -15.414 -3.240 1.00 0.00 H new ATOM 542 N THR A 117 31.896 -17.113 -3.471 1.00 0.00 N ATOM 543 CA THR A 117 30.458 -16.910 -3.288 1.00 0.00 C ATOM 544 C THR A 117 30.206 -15.791 -2.287 1.00 0.00 C ATOM 545 O THR A 117 30.829 -15.746 -1.229 1.00 0.00 O ATOM 546 CB THR A 117 29.811 -18.200 -2.781 1.00 0.00 C ATOM 547 OG1 THR A 117 30.003 -19.231 -3.739 1.00 0.00 O ATOM 548 CG2 THR A 117 28.316 -17.966 -2.567 1.00 0.00 C ATOM 0 H THR A 117 32.401 -17.338 -2.614 1.00 0.00 H new ATOM 0 HA THR A 117 30.020 -16.636 -4.248 1.00 0.00 H new ATOM 0 HB THR A 117 30.269 -18.495 -1.837 1.00 0.00 H new ATOM 0 HG1 THR A 117 29.591 -20.059 -3.415 1.00 0.00 H new ATOM 0 HG21 THR A 117 27.852 -18.884 -2.206 1.00 0.00 H new ATOM 0 HG22 THR A 117 28.173 -17.174 -1.832 1.00 0.00 H new ATOM 0 HG23 THR A 117 27.855 -17.673 -3.510 1.00 0.00 H new ATOM 556 N VAL A 118 29.292 -14.885 -2.633 1.00 0.00 N ATOM 557 CA VAL A 118 28.964 -13.756 -1.762 1.00 0.00 C ATOM 558 C VAL A 118 27.498 -13.816 -1.350 1.00 0.00 C ATOM 559 O VAL A 118 26.665 -14.361 -2.073 1.00 0.00 O ATOM 560 CB VAL A 118 29.235 -12.435 -2.488 1.00 0.00 C ATOM 561 CG1 VAL A 118 28.292 -12.300 -3.685 1.00 0.00 C ATOM 562 CG2 VAL A 118 29.002 -11.270 -1.522 1.00 0.00 C ATOM 0 H VAL A 118 28.767 -14.910 -3.507 1.00 0.00 H new ATOM 0 HA VAL A 118 29.589 -13.813 -0.871 1.00 0.00 H new ATOM 0 HB VAL A 118 30.267 -12.420 -2.840 1.00 0.00 H new ATOM 0 HG11 VAL A 118 28.488 -11.359 -4.199 1.00 0.00 H new ATOM 0 HG12 VAL A 118 28.456 -13.130 -4.373 1.00 0.00 H new ATOM 0 HG13 VAL A 118 27.259 -12.315 -3.338 1.00 0.00 H new ATOM 0 HG21 VAL A 118 29.194 -10.328 -2.035 1.00 0.00 H new ATOM 0 HG22 VAL A 118 27.970 -11.289 -1.172 1.00 0.00 H new ATOM 0 HG23 VAL A 118 29.676 -11.363 -0.670 1.00 0.00 H new ATOM 572 N GLU A 119 27.195 -13.256 -0.180 1.00 0.00 N ATOM 573 CA GLU A 119 25.825 -13.250 0.332 1.00 0.00 C ATOM 574 C GLU A 119 25.430 -11.854 0.786 1.00 0.00 C ATOM 575 O GLU A 119 26.223 -11.138 1.395 1.00 0.00 O ATOM 576 CB GLU A 119 25.701 -14.227 1.504 1.00 0.00 C ATOM 577 CG GLU A 119 24.238 -14.316 1.942 1.00 0.00 C ATOM 578 CD GLU A 119 24.094 -15.327 3.075 1.00 0.00 C ATOM 579 OE1 GLU A 119 24.875 -15.257 4.008 1.00 0.00 O ATOM 580 OE2 GLU A 119 23.204 -16.156 2.990 1.00 0.00 O1- ATOM 0 H GLU A 119 27.876 -12.802 0.429 1.00 0.00 H new ATOM 0 HA GLU A 119 25.156 -13.560 -0.470 1.00 0.00 H new ATOM 0 HB2 GLU A 119 26.064 -15.212 1.210 1.00 0.00 H new ATOM 0 HB3 GLU A 119 26.321 -13.894 2.336 1.00 0.00 H new ATOM 0 HG2 GLU A 119 23.888 -13.337 2.270 1.00 0.00 H new ATOM 0 HG3 GLU A 119 23.614 -14.611 1.098 1.00 0.00 H new ATOM 587 N PHE A 120 24.197 -11.474 0.478 1.00 0.00 N ATOM 588 CA PHE A 120 23.706 -10.152 0.864 1.00 0.00 C ATOM 589 C PHE A 120 22.190 -10.069 0.698 1.00 0.00 C ATOM 590 O PHE A 120 21.598 -10.841 -0.055 1.00 0.00 O ATOM 591 CB PHE A 120 24.370 -9.070 0.014 1.00 0.00 C ATOM 592 CG PHE A 120 24.000 -9.270 -1.434 1.00 0.00 C ATOM 593 CD1 PHE A 120 22.828 -8.699 -1.942 1.00 0.00 C ATOM 594 CD2 PHE A 120 24.831 -10.026 -2.270 1.00 0.00 C ATOM 595 CE1 PHE A 120 22.486 -8.883 -3.286 1.00 0.00 C ATOM 596 CE2 PHE A 120 24.489 -10.210 -3.615 1.00 0.00 C ATOM 597 CZ PHE A 120 23.316 -9.638 -4.122 1.00 0.00 C ATOM 0 H PHE A 120 23.525 -12.050 -0.030 1.00 0.00 H new ATOM 0 HA PHE A 120 23.957 -9.992 1.913 1.00 0.00 H new ATOM 0 HB2 PHE A 120 24.051 -8.083 0.349 1.00 0.00 H new ATOM 0 HB3 PHE A 120 25.453 -9.113 0.133 1.00 0.00 H new ATOM 0 HD1 PHE A 120 22.187 -8.116 -1.297 1.00 0.00 H new ATOM 0 HD2 PHE A 120 25.735 -10.467 -1.877 1.00 0.00 H new ATOM 0 HE1 PHE A 120 21.581 -8.442 -3.678 1.00 0.00 H new ATOM 0 HE2 PHE A 120 25.129 -10.793 -4.261 1.00 0.00 H new ATOM 0 HZ PHE A 120 23.052 -9.780 -5.159 1.00 0.00 H new ATOM 607 N ALA A 121 21.566 -9.122 1.392 1.00 0.00 N ATOM 608 CA ALA A 121 20.116 -8.950 1.302 1.00 0.00 C ATOM 609 C ALA A 121 19.404 -10.276 1.549 1.00 0.00 C ATOM 610 O ALA A 121 18.272 -10.478 1.106 1.00 0.00 O ATOM 611 CB ALA A 121 19.738 -8.413 -0.080 1.00 0.00 C ATOM 0 H ALA A 121 22.034 -8.467 2.018 1.00 0.00 H new ATOM 0 HA ALA A 121 19.805 -8.236 2.065 1.00 0.00 H new ATOM 0 HB1 ALA A 121 18.657 -8.288 -0.138 1.00 0.00 H new ATOM 0 HB2 ALA A 121 20.224 -7.451 -0.242 1.00 0.00 H new ATOM 0 HB3 ALA A 121 20.064 -9.117 -0.846 1.00 0.00 H new ATOM 617 N GLY A 122 20.073 -11.176 2.261 1.00 0.00 N ATOM 618 CA GLY A 122 19.493 -12.482 2.566 1.00 0.00 C ATOM 619 C GLY A 122 19.473 -13.373 1.330 1.00 0.00 C ATOM 620 O GLY A 122 18.679 -14.306 1.239 1.00 0.00 O ATOM 0 H GLY A 122 21.010 -11.029 2.636 1.00 0.00 H new ATOM 0 HA2 GLY A 122 20.068 -12.964 3.357 1.00 0.00 H new ATOM 0 HA3 GLY A 122 18.478 -12.354 2.943 1.00 0.00 H new ATOM 624 N LYS A 123 20.350 -13.074 0.376 1.00 0.00 N ATOM 625 CA LYS A 123 20.437 -13.845 -0.863 1.00 0.00 C ATOM 626 C LYS A 123 21.881 -14.218 -1.152 1.00 0.00 C ATOM 627 O LYS A 123 22.807 -13.500 -0.774 1.00 0.00 O ATOM 628 CB LYS A 123 19.863 -13.030 -2.027 1.00 0.00 C ATOM 629 CG LYS A 123 18.337 -13.018 -1.940 1.00 0.00 C ATOM 630 CD LYS A 123 17.769 -12.160 -3.070 1.00 0.00 C ATOM 631 CE LYS A 123 16.251 -12.059 -2.921 1.00 0.00 C ATOM 632 NZ LYS A 123 15.655 -13.424 -2.981 1.00 0.00 N1+ ATOM 0 H LYS A 123 21.013 -12.301 0.436 1.00 0.00 H new ATOM 0 HA LYS A 123 19.856 -14.760 -0.748 1.00 0.00 H new ATOM 0 HB2 LYS A 123 20.247 -12.011 -1.995 1.00 0.00 H new ATOM 0 HB3 LYS A 123 20.180 -13.460 -2.977 1.00 0.00 H new ATOM 0 HG2 LYS A 123 17.950 -14.035 -2.011 1.00 0.00 H new ATOM 0 HG3 LYS A 123 18.020 -12.623 -0.975 1.00 0.00 H new ATOM 0 HD2 LYS A 123 18.214 -11.165 -3.045 1.00 0.00 H new ATOM 0 HD3 LYS A 123 18.022 -12.598 -4.036 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.999 -11.581 -1.974 1.00 0.00 H new ATOM 0 HE3 LYS A 123 15.838 -11.435 -3.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 14.635 -13.349 -3.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 16.109 -13.968 -3.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.805 -13.908 -2.073 1.00 0.00 H new ATOM 646 N VAL A 124 22.067 -15.350 -1.822 1.00 0.00 N ATOM 647 CA VAL A 124 23.405 -15.834 -2.157 1.00 0.00 C ATOM 648 C VAL A 124 23.709 -15.606 -3.633 1.00 0.00 C ATOM 649 O VAL A 124 22.801 -15.414 -4.444 1.00 0.00 O ATOM 650 CB VAL A 124 23.520 -17.326 -1.839 1.00 0.00 C ATOM 651 CG1 VAL A 124 22.548 -18.112 -2.723 1.00 0.00 C ATOM 652 CG2 VAL A 124 24.953 -17.797 -2.110 1.00 0.00 C ATOM 0 H VAL A 124 21.309 -15.951 -2.145 1.00 0.00 H new ATOM 0 HA VAL A 124 24.126 -15.277 -1.559 1.00 0.00 H new ATOM 0 HB VAL A 124 23.275 -17.494 -0.790 1.00 0.00 H new ATOM 0 HG11 VAL A 124 22.629 -19.175 -2.497 1.00 0.00 H new ATOM 0 HG12 VAL A 124 21.529 -17.777 -2.530 1.00 0.00 H new ATOM 0 HG13 VAL A 124 22.793 -17.944 -3.772 1.00 0.00 H new ATOM 0 HG21 VAL A 124 25.036 -18.860 -1.884 1.00 0.00 H new ATOM 0 HG22 VAL A 124 25.199 -17.629 -3.159 1.00 0.00 H new ATOM 0 HG23 VAL A 124 25.645 -17.237 -1.481 1.00 0.00 H new ATOM 662 N PHE A 125 24.992 -15.620 -3.975 1.00 0.00 N ATOM 663 CA PHE A 125 25.415 -15.416 -5.358 1.00 0.00 C ATOM 664 C PHE A 125 26.755 -16.097 -5.610 1.00 0.00 C ATOM 665 O PHE A 125 27.791 -15.650 -5.121 1.00 0.00 O ATOM 666 CB PHE A 125 25.527 -13.919 -5.653 1.00 0.00 C ATOM 667 CG PHE A 125 24.147 -13.307 -5.683 1.00 0.00 C ATOM 668 CD1 PHE A 125 23.559 -12.854 -4.498 1.00 0.00 C ATOM 669 CD2 PHE A 125 23.458 -13.192 -6.895 1.00 0.00 C ATOM 670 CE1 PHE A 125 22.281 -12.287 -4.526 1.00 0.00 C ATOM 671 CE2 PHE A 125 22.180 -12.625 -6.920 1.00 0.00 C ATOM 672 CZ PHE A 125 21.591 -12.173 -5.737 1.00 0.00 C ATOM 0 H PHE A 125 25.757 -15.770 -3.317 1.00 0.00 H new ATOM 0 HA PHE A 125 24.670 -15.857 -6.020 1.00 0.00 H new ATOM 0 HB2 PHE A 125 26.136 -13.432 -4.891 1.00 0.00 H new ATOM 0 HB3 PHE A 125 26.027 -13.762 -6.609 1.00 0.00 H new ATOM 0 HD1 PHE A 125 24.091 -12.942 -3.562 1.00 0.00 H new ATOM 0 HD2 PHE A 125 23.913 -13.541 -7.810 1.00 0.00 H new ATOM 0 HE1 PHE A 125 21.826 -11.937 -3.611 1.00 0.00 H new ATOM 0 HE2 PHE A 125 21.648 -12.536 -7.855 1.00 0.00 H new ATOM 0 HZ PHE A 125 20.604 -11.736 -5.757 1.00 0.00 H new ATOM 682 N SER A 126 26.725 -17.182 -6.378 1.00 0.00 N ATOM 683 CA SER A 126 27.943 -17.921 -6.691 1.00 0.00 C ATOM 684 C SER A 126 28.665 -17.296 -7.878 1.00 0.00 C ATOM 685 O SER A 126 28.033 -16.837 -8.831 1.00 0.00 O ATOM 686 CB SER A 126 27.602 -19.375 -7.010 1.00 0.00 C ATOM 687 OG SER A 126 27.013 -19.980 -5.867 1.00 0.00 O ATOM 0 H SER A 126 25.876 -17.567 -6.793 1.00 0.00 H new ATOM 0 HA SER A 126 28.600 -17.881 -5.822 1.00 0.00 H new ATOM 0 HB2 SER A 126 26.916 -19.423 -7.855 1.00 0.00 H new ATOM 0 HB3 SER A 126 28.502 -19.917 -7.299 1.00 0.00 H new ATOM 0 HG SER A 126 26.791 -20.913 -6.068 1.00 0.00 H new ATOM 693 N GLY A 127 29.994 -17.284 -7.818 1.00 0.00 N ATOM 694 CA GLY A 127 30.797 -16.718 -8.894 1.00 0.00 C ATOM 695 C GLY A 127 31.045 -17.755 -9.976 1.00 0.00 C ATOM 696 O GLY A 127 30.401 -18.806 -9.999 1.00 0.00 O ATOM 0 H GLY A 127 30.534 -17.659 -7.038 1.00 0.00 H new ATOM 0 HA2 GLY A 127 30.287 -15.854 -9.320 1.00 0.00 H new ATOM 0 HA3 GLY A 127 31.748 -16.363 -8.498 1.00 0.00 H new ATOM 700 N GLU A 128 31.974 -17.454 -10.881 1.00 0.00 N ATOM 701 CA GLU A 128 32.293 -18.369 -11.970 1.00 0.00 C ATOM 702 C GLU A 128 33.556 -19.177 -11.653 1.00 0.00 C ATOM 703 O GLU A 128 34.558 -18.627 -11.194 1.00 0.00 O ATOM 704 CB GLU A 128 32.488 -17.582 -13.281 1.00 0.00 C ATOM 705 CG GLU A 128 33.930 -17.080 -13.386 1.00 0.00 C ATOM 706 CD GLU A 128 34.035 -15.971 -14.419 1.00 0.00 C ATOM 707 OE1 GLU A 128 33.125 -15.162 -14.482 1.00 0.00 O ATOM 708 OE2 GLU A 128 35.026 -15.944 -15.128 1.00 0.00 O1- ATOM 0 H GLU A 128 32.515 -16.589 -10.881 1.00 0.00 H new ATOM 0 HA GLU A 128 31.461 -19.064 -12.088 1.00 0.00 H new ATOM 0 HB2 GLU A 128 32.254 -18.219 -14.134 1.00 0.00 H new ATOM 0 HB3 GLU A 128 31.798 -16.739 -13.314 1.00 0.00 H new ATOM 0 HG2 GLU A 128 34.265 -16.714 -12.416 1.00 0.00 H new ATOM 0 HG3 GLU A 128 34.589 -17.904 -13.660 1.00 0.00 H new ATOM 715 N GLU A 129 33.508 -20.476 -11.895 1.00 0.00 N ATOM 716 CA GLU A 129 34.665 -21.320 -11.631 1.00 0.00 C ATOM 717 C GLU A 129 35.912 -20.730 -12.287 1.00 0.00 C ATOM 718 O GLU A 129 35.864 -20.248 -13.420 1.00 0.00 O ATOM 719 CB GLU A 129 34.414 -22.725 -12.177 1.00 0.00 C ATOM 720 CG GLU A 129 33.310 -23.396 -11.360 1.00 0.00 C ATOM 721 CD GLU A 129 33.035 -24.794 -11.905 1.00 0.00 C ATOM 722 OE1 GLU A 129 33.712 -25.186 -12.842 1.00 0.00 O ATOM 723 OE2 GLU A 129 32.152 -25.451 -11.379 1.00 0.00 O1- ATOM 0 H GLU A 129 32.694 -20.965 -12.268 1.00 0.00 H new ATOM 0 HA GLU A 129 34.823 -21.372 -10.554 1.00 0.00 H new ATOM 0 HB2 GLU A 129 34.125 -22.673 -13.227 1.00 0.00 H new ATOM 0 HB3 GLU A 129 35.329 -23.316 -12.127 1.00 0.00 H new ATOM 0 HG2 GLU A 129 33.607 -23.457 -10.313 1.00 0.00 H new ATOM 0 HG3 GLU A 129 32.401 -22.796 -11.399 1.00 0.00 H new ATOM 730 N ALA A 130 37.028 -20.774 -11.567 1.00 0.00 N ATOM 731 CA ALA A 130 38.283 -20.242 -12.084 1.00 0.00 C ATOM 732 C ALA A 130 39.467 -20.820 -11.320 1.00 0.00 C ATOM 733 O ALA A 130 39.334 -21.227 -10.166 1.00 0.00 O ATOM 734 CB ALA A 130 38.292 -18.717 -11.970 1.00 0.00 C ATOM 0 H ALA A 130 37.089 -21.170 -10.629 1.00 0.00 H new ATOM 0 HA ALA A 130 38.370 -20.527 -13.133 1.00 0.00 H new ATOM 0 HB1 ALA A 130 39.233 -18.329 -12.359 1.00 0.00 H new ATOM 0 HB2 ALA A 130 37.464 -18.304 -12.546 1.00 0.00 H new ATOM 0 HB3 ALA A 130 38.185 -18.430 -10.924 1.00 0.00 H new ATOM 740 N LYS A 131 40.627 -20.848 -11.966 1.00 0.00 N ATOM 741 CA LYS A 131 41.838 -21.376 -11.340 1.00 0.00 C ATOM 742 C LYS A 131 42.563 -20.274 -10.576 1.00 0.00 C ATOM 743 O LYS A 131 43.790 -20.270 -10.482 1.00 0.00 O ATOM 744 CB LYS A 131 42.769 -21.968 -12.405 1.00 0.00 C ATOM 745 CG LYS A 131 43.722 -22.976 -11.754 1.00 0.00 C ATOM 746 CD LYS A 131 44.574 -23.643 -12.831 1.00 0.00 C ATOM 747 CE LYS A 131 45.566 -24.601 -12.170 1.00 0.00 C ATOM 748 NZ LYS A 131 44.855 -25.841 -11.752 1.00 0.00 N1+ ATOM 0 H LYS A 131 40.757 -20.513 -12.921 1.00 0.00 H new ATOM 0 HA LYS A 131 41.552 -22.161 -10.641 1.00 0.00 H new ATOM 0 HB2 LYS A 131 42.183 -22.457 -13.183 1.00 0.00 H new ATOM 0 HB3 LYS A 131 43.338 -21.173 -12.887 1.00 0.00 H new ATOM 0 HG2 LYS A 131 44.362 -22.472 -11.030 1.00 0.00 H new ATOM 0 HG3 LYS A 131 43.154 -23.729 -11.207 1.00 0.00 H new ATOM 0 HD2 LYS A 131 43.938 -24.186 -13.530 1.00 0.00 H new ATOM 0 HD3 LYS A 131 45.109 -22.888 -13.407 1.00 0.00 H new ATOM 0 HE2 LYS A 131 46.369 -24.846 -12.865 1.00 0.00 H new ATOM 0 HE3 LYS A 131 46.027 -24.124 -11.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 45.532 -26.500 -11.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 44.115 -25.601 -11.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 44.421 -26.289 -12.584 1.00 0.00 H new ATOM 762 N THR A 132 41.800 -19.338 -10.032 1.00 0.00 N ATOM 763 CA THR A 132 42.382 -18.235 -9.275 1.00 0.00 C ATOM 764 C THR A 132 41.332 -17.591 -8.375 1.00 0.00 C ATOM 765 O THR A 132 40.136 -17.649 -8.658 1.00 0.00 O ATOM 766 CB THR A 132 42.959 -17.191 -10.230 1.00 0.00 C ATOM 767 OG1 THR A 132 43.430 -16.077 -9.485 1.00 0.00 O ATOM 768 CG2 THR A 132 41.875 -16.735 -11.199 1.00 0.00 C ATOM 0 H THR A 132 40.782 -19.318 -10.099 1.00 0.00 H new ATOM 0 HA THR A 132 43.183 -18.629 -8.650 1.00 0.00 H new ATOM 0 HB THR A 132 43.786 -17.628 -10.790 1.00 0.00 H new ATOM 0 HG1 THR A 132 43.802 -15.408 -10.097 1.00 0.00 H new ATOM 0 HG21 THR A 132 42.286 -15.990 -11.880 1.00 0.00 H new ATOM 0 HG22 THR A 132 41.515 -17.590 -11.771 1.00 0.00 H new ATOM 0 HG23 THR A 132 41.048 -16.298 -10.640 1.00 0.00 H new ATOM 776 N LYS A 133 41.789 -16.980 -7.288 1.00 0.00 N ATOM 777 CA LYS A 133 40.886 -16.323 -6.349 1.00 0.00 C ATOM 778 C LYS A 133 40.467 -14.949 -6.863 1.00 0.00 C ATOM 779 O LYS A 133 39.327 -14.524 -6.671 1.00 0.00 O ATOM 780 CB LYS A 133 41.562 -16.175 -4.987 1.00 0.00 C ATOM 781 CG LYS A 133 41.742 -17.555 -4.353 1.00 0.00 C ATOM 782 CD LYS A 133 42.467 -17.412 -3.012 1.00 0.00 C ATOM 783 CE LYS A 133 42.667 -18.795 -2.388 1.00 0.00 C ATOM 784 NZ LYS A 133 43.408 -18.657 -1.103 1.00 0.00 N1+ ATOM 0 H LYS A 133 42.776 -16.926 -7.035 1.00 0.00 H new ATOM 0 HA LYS A 133 39.995 -16.943 -6.248 1.00 0.00 H new ATOM 0 HB2 LYS A 133 42.530 -15.687 -5.101 1.00 0.00 H new ATOM 0 HB3 LYS A 133 40.959 -15.541 -4.337 1.00 0.00 H new ATOM 0 HG2 LYS A 133 40.771 -18.028 -4.205 1.00 0.00 H new ATOM 0 HG3 LYS A 133 42.313 -18.201 -5.020 1.00 0.00 H new ATOM 0 HD2 LYS A 133 43.431 -16.925 -3.158 1.00 0.00 H new ATOM 0 HD3 LYS A 133 41.888 -16.779 -2.340 1.00 0.00 H new ATOM 0 HE2 LYS A 133 41.702 -19.271 -2.214 1.00 0.00 H new ATOM 0 HE3 LYS A 133 43.221 -19.438 -3.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 43.544 -19.596 -0.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 44.335 -18.220 -1.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 42.863 -18.058 -0.451 1.00 0.00 H new ATOM 798 N LYS A 134 41.403 -14.252 -7.501 1.00 0.00 N ATOM 799 CA LYS A 134 41.124 -12.917 -8.016 1.00 0.00 C ATOM 800 C LYS A 134 39.935 -12.937 -8.969 1.00 0.00 C ATOM 801 O LYS A 134 38.974 -12.192 -8.785 1.00 0.00 O ATOM 802 CB LYS A 134 42.358 -12.381 -8.750 1.00 0.00 C ATOM 803 CG LYS A 134 43.498 -12.174 -7.750 1.00 0.00 C ATOM 804 CD LYS A 134 44.750 -11.700 -8.494 1.00 0.00 C ATOM 805 CE LYS A 134 45.914 -11.578 -7.508 1.00 0.00 C ATOM 806 NZ LYS A 134 45.644 -10.468 -6.553 1.00 0.00 N1+ ATOM 0 H LYS A 134 42.352 -14.586 -7.672 1.00 0.00 H new ATOM 0 HA LYS A 134 40.882 -12.268 -7.174 1.00 0.00 H new ATOM 0 HB2 LYS A 134 42.665 -13.081 -9.527 1.00 0.00 H new ATOM 0 HB3 LYS A 134 42.119 -11.440 -9.245 1.00 0.00 H new ATOM 0 HG2 LYS A 134 43.208 -11.439 -6.999 1.00 0.00 H new ATOM 0 HG3 LYS A 134 43.706 -13.104 -7.222 1.00 0.00 H new ATOM 0 HD2 LYS A 134 45.003 -12.404 -9.287 1.00 0.00 H new ATOM 0 HD3 LYS A 134 44.561 -10.738 -8.970 1.00 0.00 H new ATOM 0 HE2 LYS A 134 46.044 -12.514 -6.966 1.00 0.00 H new ATOM 0 HE3 LYS A 134 46.843 -11.390 -8.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 46.522 -10.217 -6.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 45.292 -9.639 -7.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 44.929 -10.771 -5.862 1.00 0.00 H new ATOM 820 N LEU A 135 40.002 -13.787 -9.987 1.00 0.00 N ATOM 821 CA LEU A 135 38.926 -13.883 -10.955 1.00 0.00 C ATOM 822 C LEU A 135 37.647 -14.377 -10.293 1.00 0.00 C ATOM 823 O LEU A 135 36.555 -13.912 -10.614 1.00 0.00 O ATOM 824 CB LEU A 135 39.324 -14.845 -12.084 1.00 0.00 C ATOM 825 CG LEU A 135 38.548 -14.496 -13.366 1.00 0.00 C ATOM 826 CD1 LEU A 135 39.274 -13.358 -14.108 1.00 0.00 C ATOM 827 CD2 LEU A 135 38.464 -15.731 -14.272 1.00 0.00 C ATOM 0 H LEU A 135 40.787 -14.415 -10.160 1.00 0.00 H new ATOM 0 HA LEU A 135 38.745 -12.890 -11.367 1.00 0.00 H new ATOM 0 HB2 LEU A 135 40.396 -14.780 -12.268 1.00 0.00 H new ATOM 0 HB3 LEU A 135 39.113 -15.873 -11.789 1.00 0.00 H new ATOM 0 HG LEU A 135 37.540 -14.175 -13.104 1.00 0.00 H new ATOM 0 HD11 LEU A 135 38.726 -13.109 -15.017 1.00 0.00 H new ATOM 0 HD12 LEU A 135 39.328 -12.480 -13.464 1.00 0.00 H new ATOM 0 HD13 LEU A 135 40.283 -13.679 -14.369 1.00 0.00 H new ATOM 0 HD21 LEU A 135 37.914 -15.480 -15.179 1.00 0.00 H new ATOM 0 HD22 LEU A 135 39.470 -16.057 -14.536 1.00 0.00 H new ATOM 0 HD23 LEU A 135 37.949 -16.534 -13.745 1.00 0.00 H new ATOM 839 N ALA A 136 37.792 -15.325 -9.377 1.00 0.00 N ATOM 840 CA ALA A 136 36.637 -15.879 -8.688 1.00 0.00 C ATOM 841 C ALA A 136 35.880 -14.789 -7.945 1.00 0.00 C ATOM 842 O ALA A 136 34.676 -14.620 -8.143 1.00 0.00 O ATOM 843 CB ALA A 136 37.089 -16.949 -7.694 1.00 0.00 C ATOM 0 H ALA A 136 38.689 -15.722 -9.097 1.00 0.00 H new ATOM 0 HA ALA A 136 35.975 -16.324 -9.431 1.00 0.00 H new ATOM 0 HB1 ALA A 136 36.219 -17.360 -7.181 1.00 0.00 H new ATOM 0 HB2 ALA A 136 37.606 -17.746 -8.228 1.00 0.00 H new ATOM 0 HB3 ALA A 136 37.765 -16.505 -6.963 1.00 0.00 H new ATOM 849 N GLU A 137 36.582 -14.050 -7.092 1.00 0.00 N ATOM 850 CA GLU A 137 35.951 -12.985 -6.321 1.00 0.00 C ATOM 851 C GLU A 137 35.284 -11.975 -7.245 1.00 0.00 C ATOM 852 O GLU A 137 34.151 -11.555 -7.005 1.00 0.00 O ATOM 853 CB GLU A 137 37.005 -12.275 -5.467 1.00 0.00 C ATOM 854 CG GLU A 137 37.510 -13.224 -4.377 1.00 0.00 C ATOM 855 CD GLU A 137 38.641 -12.564 -3.592 1.00 0.00 C ATOM 856 OE1 GLU A 137 39.010 -11.454 -3.943 1.00 0.00 O ATOM 857 OE2 GLU A 137 39.118 -13.176 -2.651 1.00 0.00 O1- ATOM 0 H GLU A 137 37.580 -14.167 -6.918 1.00 0.00 H new ATOM 0 HA GLU A 137 35.190 -13.427 -5.678 1.00 0.00 H new ATOM 0 HB2 GLU A 137 37.836 -11.950 -6.093 1.00 0.00 H new ATOM 0 HB3 GLU A 137 36.578 -11.380 -5.014 1.00 0.00 H new ATOM 0 HG2 GLU A 137 36.693 -13.485 -3.704 1.00 0.00 H new ATOM 0 HG3 GLU A 137 37.862 -14.153 -4.826 1.00 0.00 H new ATOM 864 N MET A 138 35.989 -11.587 -8.299 1.00 0.00 N ATOM 865 CA MET A 138 35.452 -10.621 -9.246 1.00 0.00 C ATOM 866 C MET A 138 34.204 -11.176 -9.927 1.00 0.00 C ATOM 867 O MET A 138 33.232 -10.453 -10.124 1.00 0.00 O ATOM 868 CB MET A 138 36.507 -10.273 -10.302 1.00 0.00 C ATOM 869 CG MET A 138 37.563 -9.338 -9.698 1.00 0.00 C ATOM 870 SD MET A 138 38.612 -8.676 -11.018 1.00 0.00 S ATOM 871 CE MET A 138 39.406 -10.228 -11.494 1.00 0.00 C ATOM 0 H MET A 138 36.927 -11.923 -8.518 1.00 0.00 H new ATOM 0 HA MET A 138 35.182 -9.718 -8.699 1.00 0.00 H new ATOM 0 HB2 MET A 138 36.982 -11.183 -10.668 1.00 0.00 H new ATOM 0 HB3 MET A 138 36.032 -9.794 -11.159 1.00 0.00 H new ATOM 0 HG2 MET A 138 37.078 -8.523 -9.162 1.00 0.00 H new ATOM 0 HG3 MET A 138 38.171 -9.879 -8.973 1.00 0.00 H new ATOM 0 HE1 MET A 138 40.271 -10.016 -12.123 1.00 0.00 H new ATOM 0 HE2 MET A 138 39.729 -10.761 -10.600 1.00 0.00 H new ATOM 0 HE3 MET A 138 38.698 -10.844 -12.047 1.00 0.00 H new ATOM 881 N SER A 139 34.240 -12.454 -10.283 1.00 0.00 N ATOM 882 CA SER A 139 33.100 -13.083 -10.942 1.00 0.00 C ATOM 883 C SER A 139 31.865 -13.017 -10.054 1.00 0.00 C ATOM 884 O SER A 139 30.758 -12.793 -10.539 1.00 0.00 O ATOM 885 CB SER A 139 33.433 -14.542 -11.267 1.00 0.00 C ATOM 886 OG SER A 139 34.638 -14.569 -12.024 1.00 0.00 O ATOM 0 H SER A 139 35.037 -13.071 -10.129 1.00 0.00 H new ATOM 0 HA SER A 139 32.889 -12.545 -11.866 1.00 0.00 H new ATOM 0 HB2 SER A 139 33.549 -15.118 -10.349 1.00 0.00 H new ATOM 0 HB3 SER A 139 32.620 -15.000 -11.831 1.00 0.00 H new ATOM 0 HG SER A 139 35.406 -14.591 -11.416 1.00 0.00 H new ATOM 892 N ALA A 140 32.063 -13.214 -8.753 1.00 0.00 N ATOM 893 CA ALA A 140 30.951 -13.177 -7.807 1.00 0.00 C ATOM 894 C ALA A 140 30.332 -11.782 -7.757 1.00 0.00 C ATOM 895 O ALA A 140 29.111 -11.632 -7.722 1.00 0.00 O ATOM 896 CB ALA A 140 31.442 -13.573 -6.415 1.00 0.00 C ATOM 0 H ALA A 140 32.974 -13.399 -8.333 1.00 0.00 H new ATOM 0 HA ALA A 140 30.190 -13.883 -8.139 1.00 0.00 H new ATOM 0 HB1 ALA A 140 30.608 -13.544 -5.713 1.00 0.00 H new ATOM 0 HB2 ALA A 140 31.854 -14.582 -6.448 1.00 0.00 H new ATOM 0 HB3 ALA A 140 32.215 -12.876 -6.090 1.00 0.00 H new ATOM 902 N ALA A 141 31.184 -10.766 -7.750 1.00 0.00 N ATOM 903 CA ALA A 141 30.709 -9.389 -7.704 1.00 0.00 C ATOM 904 C ALA A 141 30.031 -9.009 -9.016 1.00 0.00 C ATOM 905 O ALA A 141 29.157 -8.143 -9.044 1.00 0.00 O ATOM 906 CB ALA A 141 31.878 -8.439 -7.439 1.00 0.00 C ATOM 0 H ALA A 141 32.199 -10.867 -7.775 1.00 0.00 H new ATOM 0 HA ALA A 141 29.983 -9.305 -6.896 1.00 0.00 H new ATOM 0 HB1 ALA A 141 31.513 -7.413 -7.407 1.00 0.00 H new ATOM 0 HB2 ALA A 141 32.341 -8.690 -6.485 1.00 0.00 H new ATOM 0 HB3 ALA A 141 32.614 -8.537 -8.237 1.00 0.00 H new ATOM 912 N LYS A 142 30.442 -9.656 -10.102 1.00 0.00 N ATOM 913 CA LYS A 142 29.860 -9.376 -11.413 1.00 0.00 C ATOM 914 C LYS A 142 28.436 -9.912 -11.515 1.00 0.00 C ATOM 915 O LYS A 142 27.520 -9.195 -11.919 1.00 0.00 O ATOM 916 CB LYS A 142 30.728 -10.003 -12.510 1.00 0.00 C ATOM 917 CG LYS A 142 31.974 -9.146 -12.738 1.00 0.00 C ATOM 918 CD LYS A 142 32.874 -9.819 -13.775 1.00 0.00 C ATOM 919 CE LYS A 142 34.172 -9.023 -13.917 1.00 0.00 C ATOM 920 NZ LYS A 142 33.871 -7.687 -14.509 1.00 0.00 N1+ ATOM 0 H LYS A 142 31.169 -10.372 -10.103 1.00 0.00 H new ATOM 0 HA LYS A 142 29.825 -8.294 -11.543 1.00 0.00 H new ATOM 0 HB2 LYS A 142 31.018 -11.014 -12.224 1.00 0.00 H new ATOM 0 HB3 LYS A 142 30.158 -10.085 -13.435 1.00 0.00 H new ATOM 0 HG2 LYS A 142 31.687 -8.152 -13.081 1.00 0.00 H new ATOM 0 HG3 LYS A 142 32.515 -9.016 -11.801 1.00 0.00 H new ATOM 0 HD2 LYS A 142 33.094 -10.843 -13.472 1.00 0.00 H new ATOM 0 HD3 LYS A 142 32.362 -9.874 -14.736 1.00 0.00 H new ATOM 0 HE2 LYS A 142 34.646 -8.903 -12.943 1.00 0.00 H new ATOM 0 HE3 LYS A 142 34.876 -9.563 -14.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 34.753 -7.247 -14.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 33.219 -7.802 -15.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 33.431 -7.079 -13.789 1.00 0.00 H new ATOM 934 N VAL A 143 28.260 -11.174 -11.146 1.00 0.00 N ATOM 935 CA VAL A 143 26.946 -11.799 -11.204 1.00 0.00 C ATOM 936 C VAL A 143 26.009 -11.172 -10.183 1.00 0.00 C ATOM 937 O VAL A 143 24.837 -10.934 -10.475 1.00 0.00 O ATOM 938 CB VAL A 143 27.060 -13.302 -10.945 1.00 0.00 C ATOM 939 CG1 VAL A 143 27.746 -13.533 -9.602 1.00 0.00 C ATOM 940 CG2 VAL A 143 25.664 -13.928 -10.921 1.00 0.00 C ATOM 0 H VAL A 143 29.005 -11.781 -10.806 1.00 0.00 H new ATOM 0 HA VAL A 143 26.537 -11.639 -12.202 1.00 0.00 H new ATOM 0 HB VAL A 143 27.647 -13.763 -11.739 1.00 0.00 H new ATOM 0 HG11 VAL A 143 27.828 -14.604 -9.415 1.00 0.00 H new ATOM 0 HG12 VAL A 143 28.742 -13.090 -9.621 1.00 0.00 H new ATOM 0 HG13 VAL A 143 27.158 -13.070 -8.809 1.00 0.00 H new ATOM 0 HG21 VAL A 143 25.749 -14.999 -10.736 1.00 0.00 H new ATOM 0 HG22 VAL A 143 25.073 -13.469 -10.129 1.00 0.00 H new ATOM 0 HG23 VAL A 143 25.175 -13.763 -11.881 1.00 0.00 H new ATOM 950 N ALA A 144 26.527 -10.904 -8.988 1.00 0.00 N ATOM 951 CA ALA A 144 25.720 -10.304 -7.936 1.00 0.00 C ATOM 952 C ALA A 144 25.267 -8.906 -8.343 1.00 0.00 C ATOM 953 O ALA A 144 24.102 -8.549 -8.179 1.00 0.00 O ATOM 954 CB ALA A 144 26.539 -10.229 -6.644 1.00 0.00 C ATOM 0 H ALA A 144 27.495 -11.092 -8.727 1.00 0.00 H new ATOM 0 HA ALA A 144 24.837 -10.921 -7.773 1.00 0.00 H new ATOM 0 HB1 ALA A 144 25.935 -9.780 -5.856 1.00 0.00 H new ATOM 0 HB2 ALA A 144 26.838 -11.233 -6.344 1.00 0.00 H new ATOM 0 HB3 ALA A 144 27.428 -9.621 -6.811 1.00 0.00 H new ATOM 960 N PHE A 145 26.199 -8.119 -8.868 1.00 0.00 N ATOM 961 CA PHE A 145 25.887 -6.761 -9.289 1.00 0.00 C ATOM 962 C PHE A 145 24.827 -6.769 -10.382 1.00 0.00 C ATOM 963 O PHE A 145 23.890 -5.975 -10.352 1.00 0.00 O ATOM 964 CB PHE A 145 27.148 -6.065 -9.803 1.00 0.00 C ATOM 965 CG PHE A 145 26.845 -4.611 -10.084 1.00 0.00 C ATOM 966 CD1 PHE A 145 26.708 -3.705 -9.023 1.00 0.00 C ATOM 967 CD2 PHE A 145 26.699 -4.167 -11.406 1.00 0.00 C ATOM 968 CE1 PHE A 145 26.426 -2.359 -9.286 1.00 0.00 C ATOM 969 CE2 PHE A 145 26.418 -2.821 -11.664 1.00 0.00 C ATOM 970 CZ PHE A 145 26.281 -1.918 -10.605 1.00 0.00 C ATOM 0 H PHE A 145 27.170 -8.396 -9.011 1.00 0.00 H new ATOM 0 HA PHE A 145 25.501 -6.217 -8.427 1.00 0.00 H new ATOM 0 HB2 PHE A 145 27.946 -6.145 -9.065 1.00 0.00 H new ATOM 0 HB3 PHE A 145 27.502 -6.555 -10.710 1.00 0.00 H new ATOM 0 HD1 PHE A 145 26.820 -4.045 -8.004 1.00 0.00 H new ATOM 0 HD2 PHE A 145 26.803 -4.864 -12.225 1.00 0.00 H new ATOM 0 HE1 PHE A 145 26.320 -1.661 -8.469 1.00 0.00 H new ATOM 0 HE2 PHE A 145 26.307 -2.479 -12.682 1.00 0.00 H new ATOM 0 HZ PHE A 145 26.063 -0.879 -10.806 1.00 0.00 H new ATOM 980 N MET A 146 24.984 -7.670 -11.344 1.00 0.00 N ATOM 981 CA MET A 146 24.037 -7.768 -12.448 1.00 0.00 C ATOM 982 C MET A 146 22.640 -8.100 -11.932 1.00 0.00 C ATOM 983 O MET A 146 21.644 -7.584 -12.438 1.00 0.00 O ATOM 984 CB MET A 146 24.490 -8.855 -13.428 1.00 0.00 C ATOM 985 CG MET A 146 23.529 -8.905 -14.620 1.00 0.00 C ATOM 986 SD MET A 146 24.117 -10.127 -15.819 1.00 0.00 S ATOM 987 CE MET A 146 23.292 -11.567 -15.097 1.00 0.00 C ATOM 0 H MET A 146 25.753 -8.339 -11.383 1.00 0.00 H new ATOM 0 HA MET A 146 24.004 -6.805 -12.958 1.00 0.00 H new ATOM 0 HB2 MET A 146 25.503 -8.648 -13.773 1.00 0.00 H new ATOM 0 HB3 MET A 146 24.515 -9.823 -12.927 1.00 0.00 H new ATOM 0 HG2 MET A 146 22.526 -9.165 -14.281 1.00 0.00 H new ATOM 0 HG3 MET A 146 23.462 -7.923 -15.088 1.00 0.00 H new ATOM 0 HE1 MET A 146 23.521 -12.453 -15.689 1.00 0.00 H new ATOM 0 HE2 MET A 146 23.643 -11.713 -14.075 1.00 0.00 H new ATOM 0 HE3 MET A 146 22.214 -11.404 -15.091 1.00 0.00 H new ATOM 997 N SER A 147 22.571 -8.965 -10.927 1.00 0.00 N ATOM 998 CA SER A 147 21.286 -9.354 -10.356 1.00 0.00 C ATOM 999 C SER A 147 20.627 -8.183 -9.631 1.00 0.00 C ATOM 1000 O SER A 147 19.420 -7.971 -9.739 1.00 0.00 O ATOM 1001 CB SER A 147 21.486 -10.505 -9.383 1.00 0.00 C ATOM 1002 OG SER A 147 20.223 -10.908 -8.868 1.00 0.00 O ATOM 0 H SER A 147 23.381 -9.407 -10.493 1.00 0.00 H new ATOM 0 HA SER A 147 20.632 -9.665 -11.171 1.00 0.00 H new ATOM 0 HB2 SER A 147 21.971 -11.342 -9.886 1.00 0.00 H new ATOM 0 HB3 SER A 147 22.143 -10.199 -8.569 1.00 0.00 H new ATOM 0 HG SER A 147 20.330 -11.215 -7.943 1.00 0.00 H new ATOM 1008 N ILE A 148 21.430 -7.436 -8.882 1.00 0.00 N ATOM 1009 CA ILE A 148 20.915 -6.294 -8.128 1.00 0.00 C ATOM 1010 C ILE A 148 20.302 -5.251 -9.061 1.00 0.00 C ATOM 1011 O ILE A 148 19.386 -4.526 -8.675 1.00 0.00 O ATOM 1012 CB ILE A 148 22.046 -5.654 -7.312 1.00 0.00 C ATOM 1013 CG1 ILE A 148 22.481 -6.616 -6.203 1.00 0.00 C ATOM 1014 CG2 ILE A 148 21.558 -4.345 -6.688 1.00 0.00 C ATOM 1015 CD1 ILE A 148 23.781 -6.114 -5.571 1.00 0.00 C ATOM 0 H ILE A 148 22.432 -7.597 -8.779 1.00 0.00 H new ATOM 0 HA ILE A 148 20.137 -6.655 -7.455 1.00 0.00 H new ATOM 0 HB ILE A 148 22.891 -5.446 -7.969 1.00 0.00 H new ATOM 0 HG12 ILE A 148 21.701 -6.690 -5.445 1.00 0.00 H new ATOM 0 HG13 ILE A 148 22.625 -7.616 -6.611 1.00 0.00 H new ATOM 0 HG21 ILE A 148 22.365 -3.895 -6.110 1.00 0.00 H new ATOM 0 HG22 ILE A 148 21.250 -3.659 -7.477 1.00 0.00 H new ATOM 0 HG23 ILE A 148 20.711 -4.548 -6.032 1.00 0.00 H new ATOM 0 HD11 ILE A 148 24.090 -6.799 -4.782 1.00 0.00 H new ATOM 0 HD12 ILE A 148 24.559 -6.062 -6.332 1.00 0.00 H new ATOM 0 HD13 ILE A 148 23.621 -5.122 -5.148 1.00 0.00 H new ATOM 1027 N LYS A 149 20.809 -5.181 -10.282 1.00 0.00 N ATOM 1028 CA LYS A 149 20.297 -4.221 -11.253 1.00 0.00 C ATOM 1029 C LYS A 149 18.834 -4.497 -11.580 1.00 0.00 C ATOM 1030 O LYS A 149 18.026 -3.573 -11.667 1.00 0.00 O ATOM 1031 CB LYS A 149 21.126 -4.287 -12.534 1.00 0.00 C ATOM 1032 CG LYS A 149 22.503 -3.670 -12.288 1.00 0.00 C ATOM 1033 CD LYS A 149 23.380 -3.842 -13.535 1.00 0.00 C ATOM 1034 CE LYS A 149 22.985 -2.815 -14.601 1.00 0.00 C ATOM 1035 NZ LYS A 149 24.020 -2.787 -15.669 1.00 0.00 N1+ ATOM 0 H LYS A 149 21.568 -5.771 -10.624 1.00 0.00 H new ATOM 0 HA LYS A 149 20.371 -3.225 -10.816 1.00 0.00 H new ATOM 0 HB2 LYS A 149 21.233 -5.323 -12.857 1.00 0.00 H new ATOM 0 HB3 LYS A 149 20.616 -3.754 -13.337 1.00 0.00 H new ATOM 0 HG2 LYS A 149 22.400 -2.612 -12.048 1.00 0.00 H new ATOM 0 HG3 LYS A 149 22.977 -4.147 -11.430 1.00 0.00 H new ATOM 0 HD2 LYS A 149 24.430 -3.718 -13.271 1.00 0.00 H new ATOM 0 HD3 LYS A 149 23.268 -4.851 -13.932 1.00 0.00 H new ATOM 0 HE2 LYS A 149 22.015 -3.071 -15.026 1.00 0.00 H new ATOM 0 HE3 LYS A 149 22.885 -1.827 -14.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 23.753 -2.090 -16.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 24.937 -2.523 -15.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 24.094 -3.728 -16.105 1.00 0.00 H new