USER MOD reduce.3.24.130724 H: found=0, std=0, add=521, rem=0, adj=23 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 103 THR OG1 : rot 159:sc= 0 USER MOD Set 1.2: A 133 LYS NZ :NH3+ -147:sc= -0.0363 (180deg=-0.346) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 147:sc= 0.0674 (180deg=0) USER MOD Single : A 85 ASN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot -60:sc= 1.06 USER MOD Single : A 96 SER OG : rot 11:sc= 0.0537 USER MOD Single : A 101 TYR OH : rot 180:sc= -0.682 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= -0.0258 USER MOD Single : A 109 SER OG : rot -24:sc= 0.139 USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.08) USER MOD Single : A 113 THR OG1 : rot -43:sc= 0.281 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -80:sc= -1.53 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ -163:sc=-0.00829 (180deg=-0.357) USER MOD Single : A 132 THR OG1 : rot 180:sc=-0.00382 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 MET CE :methyl -104:sc=-0.00112 (180deg=-0.0798) USER MOD Single : A 139 SER OG : rot 85:sc= -2.76! USER MOD Single : A 142 LYS NZ :NH3+ 158:sc= -0.0727 (180deg=-0.638) USER MOD Single : A 146 MET CE :methyl 141:sc= -0.104 (180deg=-1.23) USER MOD Single : A 147 SER OG : rot -139:sc= 0.025 USER MOD Single : A 149 LYS NZ :NH3+ -122:sc= -1.22 (180deg=-3.46!) USER MOD ----------------------------------------------------------------- ATOM 16 N ALA A 82 35.594 -0.404 -6.638 1.00 0.00 N ATOM 17 CA ALA A 82 35.374 -1.729 -6.079 1.00 0.00 C ATOM 18 C ALA A 82 33.897 -1.935 -5.756 1.00 0.00 C ATOM 19 O ALA A 82 33.427 -1.552 -4.684 1.00 0.00 O ATOM 20 CB ALA A 82 36.207 -1.903 -4.806 1.00 0.00 C ATOM 0 HA ALA A 82 35.680 -2.471 -6.817 1.00 0.00 H new ATOM 0 HB1 ALA A 82 36.037 -2.897 -4.393 1.00 0.00 H new ATOM 0 HB2 ALA A 82 37.264 -1.785 -5.044 1.00 0.00 H new ATOM 0 HB3 ALA A 82 35.914 -1.151 -4.074 1.00 0.00 H new ATOM 26 N TYR A 83 33.176 -2.554 -6.683 1.00 0.00 N ATOM 27 CA TYR A 83 31.754 -2.814 -6.486 1.00 0.00 C ATOM 28 C TYR A 83 31.508 -3.384 -5.087 1.00 0.00 C ATOM 29 O TYR A 83 30.376 -3.407 -4.611 1.00 0.00 O ATOM 30 CB TYR A 83 31.254 -3.805 -7.538 1.00 0.00 C ATOM 31 CG TYR A 83 31.963 -3.551 -8.846 1.00 0.00 C ATOM 32 CD1 TYR A 83 32.041 -2.251 -9.359 1.00 0.00 C ATOM 33 CD2 TYR A 83 32.545 -4.615 -9.546 1.00 0.00 C ATOM 34 CE1 TYR A 83 32.699 -2.015 -10.572 1.00 0.00 C ATOM 35 CE2 TYR A 83 33.203 -4.380 -10.758 1.00 0.00 C ATOM 36 CZ TYR A 83 33.281 -3.080 -11.272 1.00 0.00 C ATOM 37 OH TYR A 83 33.929 -2.848 -12.468 1.00 0.00 O ATOM 0 H TYR A 83 33.549 -2.884 -7.573 1.00 0.00 H new ATOM 0 HA TYR A 83 31.211 -1.875 -6.588 1.00 0.00 H new ATOM 0 HB2 TYR A 83 31.436 -4.827 -7.206 1.00 0.00 H new ATOM 0 HB3 TYR A 83 30.177 -3.700 -7.669 1.00 0.00 H new ATOM 0 HD1 TYR A 83 31.593 -1.430 -8.819 1.00 0.00 H new ATOM 0 HD2 TYR A 83 32.486 -5.618 -9.150 1.00 0.00 H new ATOM 0 HE1 TYR A 83 32.758 -1.012 -10.968 1.00 0.00 H new ATOM 0 HE2 TYR A 83 33.651 -5.202 -11.297 1.00 0.00 H new ATOM 0 HH TYR A 83 34.276 -3.694 -12.821 1.00 0.00 H new ATOM 47 N LYS A 84 32.578 -3.846 -4.443 1.00 0.00 N ATOM 48 CA LYS A 84 32.469 -4.397 -3.100 1.00 0.00 C ATOM 49 C LYS A 84 32.036 -3.314 -2.112 1.00 0.00 C ATOM 50 O LYS A 84 31.222 -3.562 -1.223 1.00 0.00 O ATOM 51 CB LYS A 84 33.810 -4.985 -2.667 1.00 0.00 C ATOM 52 CG LYS A 84 34.138 -6.200 -3.536 1.00 0.00 C ATOM 53 CD LYS A 84 35.495 -6.772 -3.123 1.00 0.00 C ATOM 54 CE LYS A 84 35.830 -7.980 -3.999 1.00 0.00 C ATOM 55 NZ LYS A 84 37.172 -8.508 -3.626 1.00 0.00 N1+ ATOM 0 H LYS A 84 33.522 -3.849 -4.829 1.00 0.00 H new ATOM 0 HA LYS A 84 31.717 -5.186 -3.108 1.00 0.00 H new ATOM 0 HB2 LYS A 84 34.595 -4.235 -2.760 1.00 0.00 H new ATOM 0 HB3 LYS A 84 33.770 -5.275 -1.617 1.00 0.00 H new ATOM 0 HG2 LYS A 84 33.363 -6.959 -3.426 1.00 0.00 H new ATOM 0 HG3 LYS A 84 34.157 -5.914 -4.588 1.00 0.00 H new ATOM 0 HD2 LYS A 84 36.268 -6.011 -3.225 1.00 0.00 H new ATOM 0 HD3 LYS A 84 35.473 -7.066 -2.074 1.00 0.00 H new ATOM 0 HE2 LYS A 84 35.074 -8.755 -3.872 1.00 0.00 H new ATOM 0 HE3 LYS A 84 35.820 -7.694 -5.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 37.186 -9.540 -3.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 37.897 -8.075 -4.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 37.371 -8.278 -2.631 1.00 0.00 H new ATOM 69 N ASN A 85 32.595 -2.113 -2.272 1.00 0.00 N ATOM 70 CA ASN A 85 32.259 -1.009 -1.389 1.00 0.00 C ATOM 71 C ASN A 85 30.793 -0.618 -1.551 1.00 0.00 C ATOM 72 O ASN A 85 30.084 -0.411 -0.568 1.00 0.00 O ATOM 73 CB ASN A 85 33.146 0.198 -1.707 1.00 0.00 C ATOM 74 CG ASN A 85 32.781 1.367 -0.799 1.00 0.00 C ATOM 75 OD1 ASN A 85 32.464 1.169 0.373 1.00 0.00 O ATOM 76 ND2 ASN A 85 32.807 2.583 -1.273 1.00 0.00 N ATOM 0 H ASN A 85 33.275 -1.887 -2.998 1.00 0.00 H new ATOM 0 HA ASN A 85 32.427 -1.327 -0.360 1.00 0.00 H new ATOM 0 HB2 ASN A 85 34.195 -0.065 -1.571 1.00 0.00 H new ATOM 0 HB3 ASN A 85 33.022 0.485 -2.751 1.00 0.00 H new ATOM 0 HD21 ASN A 85 32.564 3.370 -0.671 1.00 0.00 H new ATOM 0 HD22 ASN A 85 33.070 2.746 -2.245 1.00 0.00 H new ATOM 83 N LEU A 86 30.344 -0.529 -2.799 1.00 0.00 N ATOM 84 CA LEU A 86 28.966 -0.149 -3.077 1.00 0.00 C ATOM 85 C LEU A 86 27.998 -1.142 -2.444 1.00 0.00 C ATOM 86 O LEU A 86 26.997 -0.751 -1.844 1.00 0.00 O ATOM 87 CB LEU A 86 28.732 -0.102 -4.590 1.00 0.00 C ATOM 88 CG LEU A 86 27.287 0.315 -4.872 1.00 0.00 C ATOM 89 CD1 LEU A 86 27.260 1.337 -6.012 1.00 0.00 C ATOM 90 CD2 LEU A 86 26.468 -0.915 -5.276 1.00 0.00 C ATOM 0 H LEU A 86 30.910 -0.713 -3.627 1.00 0.00 H new ATOM 0 HA LEU A 86 28.789 0.838 -2.650 1.00 0.00 H new ATOM 0 HB2 LEU A 86 29.422 0.603 -5.053 1.00 0.00 H new ATOM 0 HB3 LEU A 86 28.932 -1.079 -5.030 1.00 0.00 H new ATOM 0 HG LEU A 86 26.859 0.760 -3.974 1.00 0.00 H new ATOM 0 HD11 LEU A 86 26.230 1.633 -6.211 1.00 0.00 H new ATOM 0 HD12 LEU A 86 27.841 2.214 -5.728 1.00 0.00 H new ATOM 0 HD13 LEU A 86 27.690 0.892 -6.910 1.00 0.00 H new ATOM 0 HD21 LEU A 86 25.439 -0.617 -5.477 1.00 0.00 H new ATOM 0 HD22 LEU A 86 26.898 -1.360 -6.173 1.00 0.00 H new ATOM 0 HD23 LEU A 86 26.483 -1.644 -4.466 1.00 0.00 H new ATOM 102 N LEU A 87 28.310 -2.427 -2.573 1.00 0.00 N ATOM 103 CA LEU A 87 27.459 -3.469 -2.008 1.00 0.00 C ATOM 104 C LEU A 87 27.268 -3.246 -0.511 1.00 0.00 C ATOM 105 O LEU A 87 26.183 -3.478 0.026 1.00 0.00 O ATOM 106 CB LEU A 87 28.090 -4.842 -2.246 1.00 0.00 C ATOM 107 CG LEU A 87 27.956 -5.217 -3.724 1.00 0.00 C ATOM 108 CD1 LEU A 87 28.800 -6.461 -4.012 1.00 0.00 C ATOM 109 CD2 LEU A 87 26.486 -5.513 -4.042 1.00 0.00 C ATOM 0 H LEU A 87 29.138 -2.771 -3.059 1.00 0.00 H new ATOM 0 HA LEU A 87 26.486 -3.427 -2.498 1.00 0.00 H new ATOM 0 HB2 LEU A 87 29.141 -4.826 -1.958 1.00 0.00 H new ATOM 0 HB3 LEU A 87 27.601 -5.592 -1.624 1.00 0.00 H new ATOM 0 HG LEU A 87 28.304 -4.390 -4.343 1.00 0.00 H new ATOM 0 HD11 LEU A 87 28.705 -6.729 -5.064 1.00 0.00 H new ATOM 0 HD12 LEU A 87 29.845 -6.253 -3.783 1.00 0.00 H new ATOM 0 HD13 LEU A 87 28.451 -7.288 -3.394 1.00 0.00 H new ATOM 0 HD21 LEU A 87 26.388 -5.780 -5.094 1.00 0.00 H new ATOM 0 HD22 LEU A 87 26.140 -6.341 -3.423 1.00 0.00 H new ATOM 0 HD23 LEU A 87 25.884 -4.628 -3.835 1.00 0.00 H new ATOM 121 N GLN A 88 28.323 -2.800 0.154 1.00 0.00 N ATOM 122 CA GLN A 88 28.256 -2.543 1.588 1.00 0.00 C ATOM 123 C GLN A 88 27.399 -1.313 1.873 1.00 0.00 C ATOM 124 O GLN A 88 26.691 -1.256 2.877 1.00 0.00 O ATOM 125 CB GLN A 88 29.665 -2.324 2.147 1.00 0.00 C ATOM 126 CG GLN A 88 30.464 -3.622 2.039 1.00 0.00 C ATOM 127 CD GLN A 88 31.894 -3.398 2.518 1.00 0.00 C ATOM 128 OE1 GLN A 88 32.247 -2.289 2.919 1.00 0.00 O ATOM 129 NE2 GLN A 88 32.741 -4.390 2.503 1.00 0.00 N ATOM 0 H GLN A 88 29.230 -2.609 -0.271 1.00 0.00 H new ATOM 0 HA GLN A 88 27.803 -3.409 2.071 1.00 0.00 H new ATOM 0 HB2 GLN A 88 30.167 -1.529 1.596 1.00 0.00 H new ATOM 0 HB3 GLN A 88 29.609 -2.004 3.188 1.00 0.00 H new ATOM 0 HG2 GLN A 88 29.990 -4.401 2.636 1.00 0.00 H new ATOM 0 HG3 GLN A 88 30.468 -3.971 1.006 1.00 0.00 H new ATOM 0 HE21 GLN A 88 32.446 -5.308 2.170 1.00 0.00 H new ATOM 0 HE22 GLN A 88 33.699 -4.248 2.824 1.00 0.00 H new ATOM 138 N GLU A 89 27.472 -0.332 0.983 1.00 0.00 N ATOM 139 CA GLU A 89 26.710 0.902 1.160 1.00 0.00 C ATOM 140 C GLU A 89 25.214 0.619 1.157 1.00 0.00 C ATOM 141 O GLU A 89 24.484 1.079 2.033 1.00 0.00 O ATOM 142 CB GLU A 89 27.046 1.888 0.035 1.00 0.00 C ATOM 143 CG GLU A 89 28.490 2.370 0.188 1.00 0.00 C ATOM 144 CD GLU A 89 28.618 3.247 1.428 1.00 0.00 C ATOM 145 OE1 GLU A 89 27.608 3.772 1.866 1.00 0.00 O ATOM 146 OE2 GLU A 89 29.725 3.382 1.923 1.00 0.00 O1- ATOM 0 H GLU A 89 28.044 -0.363 0.139 1.00 0.00 H new ATOM 0 HA GLU A 89 26.982 1.337 2.122 1.00 0.00 H new ATOM 0 HB2 GLU A 89 26.913 1.408 -0.935 1.00 0.00 H new ATOM 0 HB3 GLU A 89 26.363 2.737 0.066 1.00 0.00 H new ATOM 0 HG2 GLU A 89 29.161 1.515 0.266 1.00 0.00 H new ATOM 0 HG3 GLU A 89 28.791 2.931 -0.697 1.00 0.00 H new ATOM 153 N ILE A 90 24.765 -0.146 0.168 1.00 0.00 N ATOM 154 CA ILE A 90 23.348 -0.477 0.055 1.00 0.00 C ATOM 155 C ILE A 90 22.900 -1.329 1.234 1.00 0.00 C ATOM 156 O ILE A 90 21.812 -1.131 1.775 1.00 0.00 O ATOM 157 CB ILE A 90 23.094 -1.227 -1.254 1.00 0.00 C ATOM 158 CG1 ILE A 90 24.067 -2.402 -1.363 1.00 0.00 C ATOM 159 CG2 ILE A 90 23.300 -0.282 -2.439 1.00 0.00 C ATOM 160 CD1 ILE A 90 23.789 -3.181 -2.651 1.00 0.00 C ATOM 0 H ILE A 90 25.355 -0.546 -0.561 1.00 0.00 H new ATOM 0 HA ILE A 90 22.774 0.449 0.059 1.00 0.00 H new ATOM 0 HB ILE A 90 22.069 -1.599 -1.265 1.00 0.00 H new ATOM 0 HG12 ILE A 90 25.094 -2.038 -1.361 1.00 0.00 H new ATOM 0 HG13 ILE A 90 23.959 -3.058 -0.499 1.00 0.00 H new ATOM 0 HG21 ILE A 90 23.118 -0.820 -3.369 1.00 0.00 H new ATOM 0 HG22 ILE A 90 22.606 0.555 -2.362 1.00 0.00 H new ATOM 0 HG23 ILE A 90 24.323 0.094 -2.431 1.00 0.00 H new ATOM 0 HD11 ILE A 90 24.483 -4.018 -2.727 1.00 0.00 H new ATOM 0 HD12 ILE A 90 22.766 -3.558 -2.635 1.00 0.00 H new ATOM 0 HD13 ILE A 90 23.919 -2.522 -3.510 1.00 0.00 H new ATOM 172 N ALA A 91 23.740 -2.283 1.625 1.00 0.00 N ATOM 173 CA ALA A 91 23.412 -3.165 2.733 1.00 0.00 C ATOM 174 C ALA A 91 23.412 -2.402 4.052 1.00 0.00 C ATOM 175 O ALA A 91 22.464 -2.487 4.830 1.00 0.00 O ATOM 176 CB ALA A 91 24.426 -4.311 2.806 1.00 0.00 C ATOM 0 H ALA A 91 24.646 -2.462 1.192 1.00 0.00 H new ATOM 0 HA ALA A 91 22.414 -3.569 2.563 1.00 0.00 H new ATOM 0 HB1 ALA A 91 24.174 -4.968 3.639 1.00 0.00 H new ATOM 0 HB2 ALA A 91 24.401 -4.879 1.876 1.00 0.00 H new ATOM 0 HB3 ALA A 91 25.426 -3.903 2.956 1.00 0.00 H new ATOM 182 N GLN A 92 24.484 -1.654 4.295 1.00 0.00 N ATOM 183 CA GLN A 92 24.602 -0.885 5.528 1.00 0.00 C ATOM 184 C GLN A 92 23.539 0.201 5.593 1.00 0.00 C ATOM 185 O GLN A 92 22.884 0.382 6.621 1.00 0.00 O ATOM 186 CB GLN A 92 25.992 -0.249 5.615 1.00 0.00 C ATOM 187 CG GLN A 92 27.041 -1.336 5.856 1.00 0.00 C ATOM 188 CD GLN A 92 28.435 -0.719 5.884 1.00 0.00 C ATOM 189 OE1 GLN A 92 28.900 -0.187 4.877 1.00 0.00 O ATOM 190 NE2 GLN A 92 29.133 -0.757 6.986 1.00 0.00 N ATOM 0 H GLN A 92 25.277 -1.564 3.660 1.00 0.00 H new ATOM 0 HA GLN A 92 24.458 -1.563 6.369 1.00 0.00 H new ATOM 0 HB2 GLN A 92 26.215 0.288 4.693 1.00 0.00 H new ATOM 0 HB3 GLN A 92 26.019 0.481 6.424 1.00 0.00 H new ATOM 0 HG2 GLN A 92 26.840 -1.844 6.799 1.00 0.00 H new ATOM 0 HG3 GLN A 92 26.983 -2.089 5.070 1.00 0.00 H new ATOM 0 HE21 GLN A 92 28.746 -1.199 7.820 1.00 0.00 H new ATOM 0 HE22 GLN A 92 30.066 -0.345 7.013 1.00 0.00 H new ATOM 199 N LYS A 93 23.366 0.919 4.488 1.00 0.00 N ATOM 200 CA LYS A 93 22.379 1.991 4.433 1.00 0.00 C ATOM 201 C LYS A 93 20.982 1.446 4.699 1.00 0.00 C ATOM 202 O LYS A 93 20.227 2.004 5.496 1.00 0.00 O ATOM 203 CB LYS A 93 22.413 2.661 3.058 1.00 0.00 C ATOM 204 CG LYS A 93 21.454 3.853 3.045 1.00 0.00 C ATOM 205 CD LYS A 93 21.556 4.577 1.702 1.00 0.00 C ATOM 206 CE LYS A 93 20.608 5.778 1.696 1.00 0.00 C ATOM 207 NZ LYS A 93 20.745 6.512 0.406 1.00 0.00 N1+ ATOM 0 H LYS A 93 23.892 0.780 3.625 1.00 0.00 H new ATOM 0 HA LYS A 93 22.623 2.724 5.201 1.00 0.00 H new ATOM 0 HB2 LYS A 93 23.426 2.993 2.829 1.00 0.00 H new ATOM 0 HB3 LYS A 93 22.130 1.945 2.286 1.00 0.00 H new ATOM 0 HG2 LYS A 93 20.432 3.512 3.209 1.00 0.00 H new ATOM 0 HG3 LYS A 93 21.697 4.537 3.858 1.00 0.00 H new ATOM 0 HD2 LYS A 93 22.581 4.908 1.532 1.00 0.00 H new ATOM 0 HD3 LYS A 93 21.302 3.896 0.890 1.00 0.00 H new ATOM 0 HE2 LYS A 93 19.579 5.444 1.829 1.00 0.00 H new ATOM 0 HE3 LYS A 93 20.838 6.441 2.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 20.101 7.329 0.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 21.725 6.843 0.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 20.505 5.877 -0.382 1.00 0.00 H new ATOM 221 N GLU A 94 20.639 0.349 4.029 1.00 0.00 N ATOM 222 CA GLU A 94 19.327 -0.262 4.201 1.00 0.00 C ATOM 223 C GLU A 94 19.394 -1.395 5.217 1.00 0.00 C ATOM 224 O GLU A 94 18.444 -2.162 5.371 1.00 0.00 O ATOM 225 CB GLU A 94 18.824 -0.806 2.861 1.00 0.00 C ATOM 226 CG GLU A 94 18.527 0.360 1.915 1.00 0.00 C ATOM 227 CD GLU A 94 18.134 -0.171 0.541 1.00 0.00 C ATOM 228 OE1 GLU A 94 18.051 -1.379 0.395 1.00 0.00 O ATOM 229 OE2 GLU A 94 17.924 0.640 -0.347 1.00 0.00 O1- ATOM 0 H GLU A 94 21.248 -0.131 3.366 1.00 0.00 H new ATOM 0 HA GLU A 94 18.638 0.499 4.566 1.00 0.00 H new ATOM 0 HB2 GLU A 94 19.572 -1.464 2.420 1.00 0.00 H new ATOM 0 HB3 GLU A 94 17.925 -1.403 3.013 1.00 0.00 H new ATOM 0 HG2 GLU A 94 17.722 0.973 2.321 1.00 0.00 H new ATOM 0 HG3 GLU A 94 19.404 1.002 1.829 1.00 0.00 H new ATOM 236 N SER A 95 20.524 -1.496 5.907 1.00 0.00 N ATOM 237 CA SER A 95 20.710 -2.546 6.907 1.00 0.00 C ATOM 238 C SER A 95 20.101 -3.859 6.422 1.00 0.00 C ATOM 239 O SER A 95 19.468 -4.582 7.190 1.00 0.00 O ATOM 240 CB SER A 95 20.056 -2.134 8.225 1.00 0.00 C ATOM 241 OG SER A 95 19.990 -3.262 9.088 1.00 0.00 O ATOM 0 H SER A 95 21.321 -0.870 5.795 1.00 0.00 H new ATOM 0 HA SER A 95 21.779 -2.689 7.063 1.00 0.00 H new ATOM 0 HB2 SER A 95 20.629 -1.335 8.695 1.00 0.00 H new ATOM 0 HB3 SER A 95 19.055 -1.743 8.041 1.00 0.00 H new ATOM 0 HG SER A 95 19.460 -3.968 8.663 1.00 0.00 H new ATOM 247 N SER A 96 20.291 -4.153 5.140 1.00 0.00 N ATOM 248 CA SER A 96 19.746 -5.375 4.558 1.00 0.00 C ATOM 249 C SER A 96 20.717 -6.534 4.736 1.00 0.00 C ATOM 250 O SER A 96 20.804 -7.420 3.885 1.00 0.00 O ATOM 251 CB SER A 96 19.463 -5.165 3.072 1.00 0.00 C ATOM 252 OG SER A 96 18.566 -4.073 2.913 1.00 0.00 O ATOM 0 H SER A 96 20.814 -3.568 4.489 1.00 0.00 H new ATOM 0 HA SER A 96 18.816 -5.616 5.073 1.00 0.00 H new ATOM 0 HB2 SER A 96 20.392 -4.968 2.538 1.00 0.00 H new ATOM 0 HB3 SER A 96 19.033 -6.069 2.641 1.00 0.00 H new ATOM 0 HG SER A 96 18.469 -3.602 3.767 1.00 0.00 H new ATOM 258 N LEU A 97 21.444 -6.521 5.840 1.00 0.00 N ATOM 259 CA LEU A 97 22.410 -7.580 6.125 1.00 0.00 C ATOM 260 C LEU A 97 23.676 -7.397 5.297 1.00 0.00 C ATOM 261 O LEU A 97 23.714 -7.744 4.117 1.00 0.00 O ATOM 262 CB LEU A 97 21.790 -8.947 5.815 1.00 0.00 C ATOM 263 CG LEU A 97 22.453 -10.023 6.679 1.00 0.00 C ATOM 264 CD1 LEU A 97 21.716 -10.131 8.016 1.00 0.00 C ATOM 265 CD2 LEU A 97 22.395 -11.368 5.953 1.00 0.00 C ATOM 0 H LEU A 97 21.388 -5.794 6.554 1.00 0.00 H new ATOM 0 HA LEU A 97 22.674 -7.527 7.181 1.00 0.00 H new ATOM 0 HB2 LEU A 97 20.717 -8.923 6.007 1.00 0.00 H new ATOM 0 HB3 LEU A 97 21.919 -9.184 4.759 1.00 0.00 H new ATOM 0 HG LEU A 97 23.493 -9.753 6.860 1.00 0.00 H new ATOM 0 HD11 LEU A 97 22.188 -10.897 8.631 1.00 0.00 H new ATOM 0 HD12 LEU A 97 21.759 -9.173 8.534 1.00 0.00 H new ATOM 0 HD13 LEU A 97 20.675 -10.400 7.837 1.00 0.00 H new ATOM 0 HD21 LEU A 97 22.867 -12.134 6.568 1.00 0.00 H new ATOM 0 HD22 LEU A 97 21.355 -11.639 5.771 1.00 0.00 H new ATOM 0 HD23 LEU A 97 22.922 -11.291 5.002 1.00 0.00 H new ATOM 277 N LEU A 98 24.710 -6.854 5.923 1.00 0.00 N ATOM 278 CA LEU A 98 25.978 -6.633 5.233 1.00 0.00 C ATOM 279 C LEU A 98 26.352 -7.857 4.400 1.00 0.00 C ATOM 280 O LEU A 98 25.975 -8.981 4.724 1.00 0.00 O ATOM 281 CB LEU A 98 27.087 -6.354 6.255 1.00 0.00 C ATOM 282 CG LEU A 98 27.041 -4.882 6.670 1.00 0.00 C ATOM 283 CD1 LEU A 98 25.691 -4.578 7.321 1.00 0.00 C ATOM 284 CD2 LEU A 98 28.164 -4.599 7.668 1.00 0.00 C ATOM 0 H LEU A 98 24.700 -6.560 6.900 1.00 0.00 H new ATOM 0 HA LEU A 98 25.867 -5.774 4.572 1.00 0.00 H new ATOM 0 HB2 LEU A 98 26.960 -6.993 7.129 1.00 0.00 H new ATOM 0 HB3 LEU A 98 28.060 -6.591 5.825 1.00 0.00 H new ATOM 0 HG LEU A 98 27.170 -4.252 5.790 1.00 0.00 H new ATOM 0 HD11 LEU A 98 25.658 -3.529 7.617 1.00 0.00 H new ATOM 0 HD12 LEU A 98 24.890 -4.780 6.610 1.00 0.00 H new ATOM 0 HD13 LEU A 98 25.562 -5.208 8.201 1.00 0.00 H new ATOM 0 HD21 LEU A 98 28.132 -3.550 7.964 1.00 0.00 H new ATOM 0 HD22 LEU A 98 28.036 -5.229 8.548 1.00 0.00 H new ATOM 0 HD23 LEU A 98 29.126 -4.816 7.204 1.00 0.00 H new ATOM 296 N PRO A 99 27.086 -7.649 3.342 1.00 0.00 N ATOM 297 CA PRO A 99 27.536 -8.747 2.438 1.00 0.00 C ATOM 298 C PRO A 99 28.501 -9.702 3.135 1.00 0.00 C ATOM 299 O PRO A 99 28.949 -9.443 4.251 1.00 0.00 O ATOM 300 CB PRO A 99 28.225 -8.016 1.286 1.00 0.00 C ATOM 301 CG PRO A 99 28.616 -6.684 1.837 1.00 0.00 C ATOM 302 CD PRO A 99 27.569 -6.336 2.884 1.00 0.00 C ATOM 0 HA PRO A 99 26.706 -9.372 2.110 1.00 0.00 H new ATOM 0 HB2 PRO A 99 29.098 -8.568 0.937 1.00 0.00 H new ATOM 0 HB3 PRO A 99 27.555 -7.907 0.433 1.00 0.00 H new ATOM 0 HG2 PRO A 99 29.611 -6.722 2.279 1.00 0.00 H new ATOM 0 HG3 PRO A 99 28.646 -5.930 1.050 1.00 0.00 H new ATOM 0 HD2 PRO A 99 27.998 -5.759 3.703 1.00 0.00 H new ATOM 0 HD3 PRO A 99 26.762 -5.738 2.461 1.00 0.00 H new ATOM 310 N PHE A 100 28.813 -10.810 2.470 1.00 0.00 N ATOM 311 CA PHE A 100 29.733 -11.794 3.032 1.00 0.00 C ATOM 312 C PHE A 100 30.583 -12.424 1.936 1.00 0.00 C ATOM 313 O PHE A 100 30.063 -13.090 1.037 1.00 0.00 O ATOM 314 CB PHE A 100 28.940 -12.881 3.758 1.00 0.00 C ATOM 315 CG PHE A 100 29.865 -13.660 4.662 1.00 0.00 C ATOM 316 CD1 PHE A 100 30.292 -13.104 5.874 1.00 0.00 C ATOM 317 CD2 PHE A 100 30.299 -14.937 4.289 1.00 0.00 C ATOM 318 CE1 PHE A 100 31.149 -13.824 6.713 1.00 0.00 C ATOM 319 CE2 PHE A 100 31.157 -15.658 5.127 1.00 0.00 C ATOM 320 CZ PHE A 100 31.582 -15.103 6.340 1.00 0.00 C ATOM 0 H PHE A 100 28.446 -11.048 1.549 1.00 0.00 H new ATOM 0 HA PHE A 100 30.394 -11.290 3.737 1.00 0.00 H new ATOM 0 HB2 PHE A 100 28.137 -12.431 4.342 1.00 0.00 H new ATOM 0 HB3 PHE A 100 28.473 -13.549 3.035 1.00 0.00 H new ATOM 0 HD1 PHE A 100 29.959 -12.118 6.162 1.00 0.00 H new ATOM 0 HD2 PHE A 100 29.972 -15.366 3.354 1.00 0.00 H new ATOM 0 HE1 PHE A 100 31.477 -13.394 7.648 1.00 0.00 H new ATOM 0 HE2 PHE A 100 31.492 -16.643 4.838 1.00 0.00 H new ATOM 0 HZ PHE A 100 32.243 -15.660 6.987 1.00 0.00 H new ATOM 330 N TYR A 101 31.894 -12.218 2.015 1.00 0.00 N ATOM 331 CA TYR A 101 32.806 -12.771 1.021 1.00 0.00 C ATOM 332 C TYR A 101 33.411 -14.077 1.520 1.00 0.00 C ATOM 333 O TYR A 101 33.939 -14.146 2.631 1.00 0.00 O ATOM 334 CB TYR A 101 33.925 -11.768 0.725 1.00 0.00 C ATOM 335 CG TYR A 101 33.341 -10.538 0.074 1.00 0.00 C ATOM 336 CD1 TYR A 101 33.012 -10.555 -1.287 1.00 0.00 C ATOM 337 CD2 TYR A 101 33.127 -9.380 0.831 1.00 0.00 C ATOM 338 CE1 TYR A 101 32.470 -9.416 -1.891 1.00 0.00 C ATOM 339 CE2 TYR A 101 32.586 -8.240 0.227 1.00 0.00 C ATOM 340 CZ TYR A 101 32.257 -8.257 -1.134 1.00 0.00 C ATOM 341 OH TYR A 101 31.723 -7.132 -1.729 1.00 0.00 O ATOM 0 H TYR A 101 32.346 -11.676 2.752 1.00 0.00 H new ATOM 0 HA TYR A 101 32.244 -12.969 0.108 1.00 0.00 H new ATOM 0 HB2 TYR A 101 34.437 -11.495 1.648 1.00 0.00 H new ATOM 0 HB3 TYR A 101 34.669 -12.220 0.070 1.00 0.00 H new ATOM 0 HD1 TYR A 101 33.177 -11.449 -1.871 1.00 0.00 H new ATOM 0 HD2 TYR A 101 33.379 -9.367 1.881 1.00 0.00 H new ATOM 0 HE1 TYR A 101 32.216 -9.430 -2.941 1.00 0.00 H new ATOM 0 HE2 TYR A 101 32.422 -7.346 0.811 1.00 0.00 H new ATOM 0 HH TYR A 101 31.640 -6.418 -1.063 1.00 0.00 H new ATOM 351 N ALA A 102 33.333 -15.114 0.692 1.00 0.00 N ATOM 352 CA ALA A 102 33.873 -16.419 1.061 1.00 0.00 C ATOM 353 C ALA A 102 34.390 -17.150 -0.172 1.00 0.00 C ATOM 354 O ALA A 102 33.864 -16.984 -1.273 1.00 0.00 O ATOM 355 CB ALA A 102 32.795 -17.259 1.741 1.00 0.00 C ATOM 0 H ALA A 102 32.904 -15.078 -0.233 1.00 0.00 H new ATOM 0 HA ALA A 102 34.701 -16.266 1.754 1.00 0.00 H new ATOM 0 HB1 ALA A 102 33.208 -18.231 2.012 1.00 0.00 H new ATOM 0 HB2 ALA A 102 32.449 -16.748 2.639 1.00 0.00 H new ATOM 0 HB3 ALA A 102 31.958 -17.399 1.057 1.00 0.00 H new ATOM 361 N THR A 103 35.429 -17.959 0.017 1.00 0.00 N ATOM 362 CA THR A 103 36.012 -18.711 -1.090 1.00 0.00 C ATOM 363 C THR A 103 36.279 -20.151 -0.678 1.00 0.00 C ATOM 364 O THR A 103 36.632 -20.426 0.469 1.00 0.00 O ATOM 365 CB THR A 103 37.322 -18.051 -1.530 1.00 0.00 C ATOM 366 OG1 THR A 103 38.022 -18.929 -2.402 1.00 0.00 O ATOM 367 CG2 THR A 103 38.184 -17.752 -0.303 1.00 0.00 C ATOM 0 H THR A 103 35.881 -18.110 0.919 1.00 0.00 H new ATOM 0 HA THR A 103 35.305 -18.711 -1.920 1.00 0.00 H new ATOM 0 HB THR A 103 37.103 -17.119 -2.051 1.00 0.00 H new ATOM 0 HG1 THR A 103 38.660 -18.415 -2.941 1.00 0.00 H new ATOM 0 HG21 THR A 103 39.116 -17.282 -0.619 1.00 0.00 H new ATOM 0 HG22 THR A 103 37.646 -17.079 0.364 1.00 0.00 H new ATOM 0 HG23 THR A 103 38.406 -18.682 0.221 1.00 0.00 H new ATOM 375 N ALA A 104 36.112 -21.073 -1.622 1.00 0.00 N ATOM 376 CA ALA A 104 36.337 -22.489 -1.345 1.00 0.00 C ATOM 377 C ALA A 104 37.258 -23.098 -2.393 1.00 0.00 C ATOM 378 O ALA A 104 37.330 -22.621 -3.527 1.00 0.00 O ATOM 379 CB ALA A 104 35.003 -23.238 -1.335 1.00 0.00 C ATOM 0 H ALA A 104 35.824 -20.868 -2.579 1.00 0.00 H new ATOM 0 HA ALA A 104 36.809 -22.579 -0.367 1.00 0.00 H new ATOM 0 HB1 ALA A 104 35.180 -24.293 -1.128 1.00 0.00 H new ATOM 0 HB2 ALA A 104 34.357 -22.820 -0.563 1.00 0.00 H new ATOM 0 HB3 ALA A 104 34.521 -23.135 -2.307 1.00 0.00 H new ATOM 385 N THR A 105 37.964 -24.159 -2.011 1.00 0.00 N ATOM 386 CA THR A 105 38.874 -24.832 -2.931 1.00 0.00 C ATOM 387 C THR A 105 38.333 -26.208 -3.310 1.00 0.00 C ATOM 388 O THR A 105 37.814 -26.938 -2.466 1.00 0.00 O ATOM 389 CB THR A 105 40.251 -24.988 -2.280 1.00 0.00 C ATOM 390 OG1 THR A 105 40.202 -26.028 -1.313 1.00 0.00 O ATOM 391 CG2 THR A 105 40.648 -23.675 -1.602 1.00 0.00 C ATOM 0 H THR A 105 37.924 -24.568 -1.078 1.00 0.00 H new ATOM 0 HA THR A 105 38.962 -24.227 -3.833 1.00 0.00 H new ATOM 0 HB THR A 105 40.988 -25.237 -3.043 1.00 0.00 H new ATOM 0 HG1 THR A 105 41.083 -26.130 -0.897 1.00 0.00 H new ATOM 0 HG21 THR A 105 41.628 -23.787 -1.139 1.00 0.00 H new ATOM 0 HG22 THR A 105 40.686 -22.879 -2.345 1.00 0.00 H new ATOM 0 HG23 THR A 105 39.912 -23.423 -0.838 1.00 0.00 H new ATOM 399 N SER A 106 38.456 -26.552 -4.588 1.00 0.00 N ATOM 400 CA SER A 106 37.981 -27.843 -5.071 1.00 0.00 C ATOM 401 C SER A 106 38.585 -28.163 -6.432 1.00 0.00 C ATOM 402 O SER A 106 38.943 -27.262 -7.192 1.00 0.00 O ATOM 403 CB SER A 106 36.456 -27.830 -5.179 1.00 0.00 C ATOM 404 OG SER A 106 36.013 -29.067 -5.722 1.00 0.00 O ATOM 0 H SER A 106 38.878 -25.959 -5.303 1.00 0.00 H new ATOM 0 HA SER A 106 38.290 -28.610 -4.361 1.00 0.00 H new ATOM 0 HB2 SER A 106 36.012 -27.671 -4.196 1.00 0.00 H new ATOM 0 HB3 SER A 106 36.132 -27.005 -5.813 1.00 0.00 H new ATOM 0 HG SER A 106 35.035 -29.063 -5.791 1.00 0.00 H new ATOM 410 N GLY A 107 38.696 -29.452 -6.740 1.00 0.00 N ATOM 411 CA GLY A 107 39.252 -29.878 -8.018 1.00 0.00 C ATOM 412 C GLY A 107 40.407 -30.851 -7.815 1.00 0.00 C ATOM 413 O GLY A 107 40.716 -31.241 -6.688 1.00 0.00 O ATOM 0 H GLY A 107 38.410 -30.214 -6.126 1.00 0.00 H new ATOM 0 HA2 GLY A 107 38.474 -30.352 -8.617 1.00 0.00 H new ATOM 0 HA3 GLY A 107 39.599 -29.008 -8.576 1.00 0.00 H new ATOM 417 N PRO A 108 41.044 -31.244 -8.882 1.00 0.00 N ATOM 418 CA PRO A 108 42.191 -32.195 -8.833 1.00 0.00 C ATOM 419 C PRO A 108 43.373 -31.636 -8.045 1.00 0.00 C ATOM 420 O PRO A 108 43.580 -30.424 -7.998 1.00 0.00 O ATOM 421 CB PRO A 108 42.564 -32.393 -10.308 1.00 0.00 C ATOM 422 CG PRO A 108 41.989 -31.218 -11.026 1.00 0.00 C ATOM 423 CD PRO A 108 40.738 -30.821 -10.256 1.00 0.00 C ATOM 0 HA PRO A 108 41.928 -33.123 -8.326 1.00 0.00 H new ATOM 0 HB2 PRO A 108 43.645 -32.441 -10.436 1.00 0.00 H new ATOM 0 HB3 PRO A 108 42.156 -33.327 -10.694 1.00 0.00 H new ATOM 0 HG2 PRO A 108 42.703 -30.395 -11.060 1.00 0.00 H new ATOM 0 HG3 PRO A 108 41.747 -31.473 -12.058 1.00 0.00 H new ATOM 0 HD2 PRO A 108 40.551 -29.749 -10.316 1.00 0.00 H new ATOM 0 HD3 PRO A 108 39.850 -31.321 -10.644 1.00 0.00 H new ATOM 431 N SER A 109 44.144 -32.527 -7.432 1.00 0.00 N ATOM 432 CA SER A 109 45.315 -32.113 -6.666 1.00 0.00 C ATOM 433 C SER A 109 46.357 -31.485 -7.587 1.00 0.00 C ATOM 434 O SER A 109 47.282 -30.814 -7.128 1.00 0.00 O ATOM 435 CB SER A 109 45.923 -33.317 -5.949 1.00 0.00 C ATOM 436 OG SER A 109 47.031 -32.886 -5.168 1.00 0.00 O ATOM 0 H SER A 109 43.982 -33.534 -7.450 1.00 0.00 H new ATOM 0 HA SER A 109 45.003 -31.374 -5.928 1.00 0.00 H new ATOM 0 HB2 SER A 109 45.176 -33.791 -5.312 1.00 0.00 H new ATOM 0 HB3 SER A 109 46.243 -34.064 -6.675 1.00 0.00 H new ATOM 0 HG SER A 109 47.392 -32.056 -5.543 1.00 0.00 H new ATOM 442 N HIS A 110 46.206 -31.711 -8.889 1.00 0.00 N ATOM 443 CA HIS A 110 47.137 -31.155 -9.866 1.00 0.00 C ATOM 444 C HIS A 110 46.658 -29.788 -10.341 1.00 0.00 C ATOM 445 O HIS A 110 47.446 -28.848 -10.460 1.00 0.00 O ATOM 446 CB HIS A 110 47.263 -32.097 -11.062 1.00 0.00 C ATOM 447 CG HIS A 110 48.409 -31.654 -11.929 1.00 0.00 C ATOM 448 ND1 HIS A 110 48.227 -30.837 -13.033 1.00 0.00 N ATOM 449 CD2 HIS A 110 49.757 -31.906 -11.867 1.00 0.00 C ATOM 450 CE1 HIS A 110 49.436 -30.627 -13.586 1.00 0.00 C ATOM 451 NE2 HIS A 110 50.404 -31.256 -12.915 1.00 0.00 N ATOM 0 H HIS A 110 45.454 -32.271 -9.290 1.00 0.00 H new ATOM 0 HA HIS A 110 48.111 -31.042 -9.390 1.00 0.00 H new ATOM 0 HB2 HIS A 110 47.426 -33.119 -10.719 1.00 0.00 H new ATOM 0 HB3 HIS A 110 46.337 -32.098 -11.637 1.00 0.00 H new ATOM 0 HD2 HIS A 110 50.242 -32.516 -11.119 1.00 0.00 H new ATOM 0 HE1 HIS A 110 49.603 -30.023 -14.466 1.00 0.00 H new ATOM 0 HE2 HIS A 110 51.402 -31.260 -13.125 1.00 0.00 H new ATOM 459 N ALA A 111 45.358 -29.681 -10.612 1.00 0.00 N ATOM 460 CA ALA A 111 44.785 -28.414 -11.058 1.00 0.00 C ATOM 461 C ALA A 111 43.607 -28.023 -10.164 1.00 0.00 C ATOM 462 O ALA A 111 42.448 -28.168 -10.552 1.00 0.00 O ATOM 463 CB ALA A 111 44.313 -28.537 -12.506 1.00 0.00 C ATOM 0 H ALA A 111 44.689 -30.447 -10.532 1.00 0.00 H new ATOM 0 HA ALA A 111 45.551 -27.641 -10.993 1.00 0.00 H new ATOM 0 HB1 ALA A 111 43.887 -27.588 -12.832 1.00 0.00 H new ATOM 0 HB2 ALA A 111 45.159 -28.793 -13.144 1.00 0.00 H new ATOM 0 HB3 ALA A 111 43.556 -29.318 -12.577 1.00 0.00 H new ATOM 469 N PRO A 112 43.891 -27.525 -8.994 1.00 0.00 N ATOM 470 CA PRO A 112 42.841 -27.111 -8.021 1.00 0.00 C ATOM 471 C PRO A 112 42.271 -25.734 -8.338 1.00 0.00 C ATOM 472 O PRO A 112 43.013 -24.760 -8.474 1.00 0.00 O ATOM 473 CB PRO A 112 43.578 -27.102 -6.679 1.00 0.00 C ATOM 474 CG PRO A 112 45.012 -26.834 -7.016 1.00 0.00 C ATOM 475 CD PRO A 112 45.245 -27.301 -8.466 1.00 0.00 C ATOM 0 HA PRO A 112 41.981 -27.780 -8.037 1.00 0.00 H new ATOM 0 HB2 PRO A 112 43.180 -26.333 -6.017 1.00 0.00 H new ATOM 0 HB3 PRO A 112 43.467 -28.056 -6.163 1.00 0.00 H new ATOM 0 HG2 PRO A 112 45.237 -25.772 -6.915 1.00 0.00 H new ATOM 0 HG3 PRO A 112 45.672 -27.367 -6.331 1.00 0.00 H new ATOM 0 HD2 PRO A 112 45.779 -26.548 -9.046 1.00 0.00 H new ATOM 0 HD3 PRO A 112 45.842 -28.213 -8.500 1.00 0.00 H new ATOM 483 N THR A 113 40.948 -25.657 -8.451 1.00 0.00 N ATOM 484 CA THR A 113 40.285 -24.391 -8.744 1.00 0.00 C ATOM 485 C THR A 113 39.637 -23.828 -7.485 1.00 0.00 C ATOM 486 O THR A 113 39.566 -24.499 -6.454 1.00 0.00 O ATOM 487 CB THR A 113 39.225 -24.590 -9.824 1.00 0.00 C ATOM 488 OG1 THR A 113 38.048 -25.129 -9.236 1.00 0.00 O ATOM 489 CG2 THR A 113 39.754 -25.553 -10.888 1.00 0.00 C ATOM 0 H THR A 113 40.317 -26.452 -8.345 1.00 0.00 H new ATOM 0 HA THR A 113 41.033 -23.684 -9.103 1.00 0.00 H new ATOM 0 HB THR A 113 38.993 -23.632 -10.288 1.00 0.00 H new ATOM 0 HG1 THR A 113 38.293 -25.836 -8.603 1.00 0.00 H new ATOM 0 HG21 THR A 113 38.997 -25.695 -11.659 1.00 0.00 H new ATOM 0 HG22 THR A 113 40.656 -25.139 -11.337 1.00 0.00 H new ATOM 0 HG23 THR A 113 39.986 -26.513 -10.427 1.00 0.00 H new ATOM 497 N PHE A 114 39.161 -22.588 -7.573 1.00 0.00 N ATOM 498 CA PHE A 114 38.526 -21.942 -6.430 1.00 0.00 C ATOM 499 C PHE A 114 37.224 -21.274 -6.848 1.00 0.00 C ATOM 500 O PHE A 114 37.101 -20.774 -7.968 1.00 0.00 O ATOM 501 CB PHE A 114 39.473 -20.894 -5.836 1.00 0.00 C ATOM 502 CG PHE A 114 40.905 -21.297 -6.102 1.00 0.00 C ATOM 503 CD1 PHE A 114 41.494 -22.322 -5.352 1.00 0.00 C ATOM 504 CD2 PHE A 114 41.641 -20.649 -7.101 1.00 0.00 C ATOM 505 CE1 PHE A 114 42.820 -22.696 -5.600 1.00 0.00 C ATOM 506 CE2 PHE A 114 42.966 -21.023 -7.348 1.00 0.00 C ATOM 507 CZ PHE A 114 43.557 -22.047 -6.598 1.00 0.00 C ATOM 0 H PHE A 114 39.203 -22.016 -8.416 1.00 0.00 H new ATOM 0 HA PHE A 114 38.305 -22.702 -5.680 1.00 0.00 H new ATOM 0 HB2 PHE A 114 39.272 -19.917 -6.275 1.00 0.00 H new ATOM 0 HB3 PHE A 114 39.304 -20.802 -4.763 1.00 0.00 H new ATOM 0 HD1 PHE A 114 40.926 -22.824 -4.583 1.00 0.00 H new ATOM 0 HD2 PHE A 114 41.186 -19.860 -7.681 1.00 0.00 H new ATOM 0 HE1 PHE A 114 43.275 -23.486 -5.021 1.00 0.00 H new ATOM 0 HE2 PHE A 114 43.534 -20.521 -8.118 1.00 0.00 H new ATOM 0 HZ PHE A 114 44.580 -22.336 -6.789 1.00 0.00 H new ATOM 517 N THR A 115 36.252 -21.261 -5.941 1.00 0.00 N ATOM 518 CA THR A 115 34.960 -20.644 -6.224 1.00 0.00 C ATOM 519 C THR A 115 34.594 -19.650 -5.129 1.00 0.00 C ATOM 520 O THR A 115 34.516 -20.007 -3.952 1.00 0.00 O ATOM 521 CB THR A 115 33.878 -21.718 -6.327 1.00 0.00 C ATOM 522 OG1 THR A 115 34.227 -22.643 -7.348 1.00 0.00 O ATOM 523 CG2 THR A 115 32.537 -21.065 -6.664 1.00 0.00 C ATOM 0 H THR A 115 36.333 -21.668 -5.009 1.00 0.00 H new ATOM 0 HA THR A 115 35.031 -20.113 -7.173 1.00 0.00 H new ATOM 0 HB THR A 115 33.794 -22.242 -5.375 1.00 0.00 H new ATOM 0 HG1 THR A 115 33.535 -23.334 -7.414 1.00 0.00 H new ATOM 0 HG21 THR A 115 31.767 -21.833 -6.737 1.00 0.00 H new ATOM 0 HG22 THR A 115 32.270 -20.356 -5.880 1.00 0.00 H new ATOM 0 HG23 THR A 115 32.617 -20.540 -7.616 1.00 0.00 H new ATOM 531 N SER A 116 34.368 -18.399 -5.520 1.00 0.00 N ATOM 532 CA SER A 116 34.015 -17.359 -4.559 1.00 0.00 C ATOM 533 C SER A 116 32.506 -17.181 -4.495 1.00 0.00 C ATOM 534 O SER A 116 31.857 -16.901 -5.503 1.00 0.00 O ATOM 535 CB SER A 116 34.670 -16.037 -4.961 1.00 0.00 C ATOM 536 OG SER A 116 36.074 -16.225 -5.085 1.00 0.00 O ATOM 0 H SER A 116 34.422 -18.082 -6.488 1.00 0.00 H new ATOM 0 HA SER A 116 34.375 -17.660 -3.575 1.00 0.00 H new ATOM 0 HB2 SER A 116 34.254 -15.685 -5.905 1.00 0.00 H new ATOM 0 HB3 SER A 116 34.459 -15.272 -4.214 1.00 0.00 H new ATOM 0 HG SER A 116 36.486 -16.207 -4.196 1.00 0.00 H new ATOM 542 N THR A 117 31.946 -17.343 -3.299 1.00 0.00 N ATOM 543 CA THR A 117 30.506 -17.200 -3.112 1.00 0.00 C ATOM 544 C THR A 117 30.197 -15.971 -2.268 1.00 0.00 C ATOM 545 O THR A 117 30.750 -15.794 -1.182 1.00 0.00 O ATOM 546 CB THR A 117 29.941 -18.446 -2.426 1.00 0.00 C ATOM 547 OG1 THR A 117 30.113 -19.572 -3.277 1.00 0.00 O ATOM 548 CG2 THR A 117 28.451 -18.243 -2.141 1.00 0.00 C ATOM 0 H THR A 117 32.464 -17.572 -2.450 1.00 0.00 H new ATOM 0 HA THR A 117 30.042 -17.082 -4.091 1.00 0.00 H new ATOM 0 HB THR A 117 30.468 -18.615 -1.487 1.00 0.00 H new ATOM 0 HG1 THR A 117 29.753 -20.371 -2.839 1.00 0.00 H new ATOM 0 HG21 THR A 117 28.050 -19.131 -1.653 1.00 0.00 H new ATOM 0 HG22 THR A 117 28.320 -17.379 -1.489 1.00 0.00 H new ATOM 0 HG23 THR A 117 27.921 -18.074 -3.078 1.00 0.00 H new ATOM 556 N VAL A 118 29.308 -15.120 -2.773 1.00 0.00 N ATOM 557 CA VAL A 118 28.929 -13.907 -2.056 1.00 0.00 C ATOM 558 C VAL A 118 27.494 -14.010 -1.554 1.00 0.00 C ATOM 559 O VAL A 118 26.619 -14.530 -2.248 1.00 0.00 O ATOM 560 CB VAL A 118 29.068 -12.691 -2.972 1.00 0.00 C ATOM 561 CG1 VAL A 118 28.007 -12.758 -4.073 1.00 0.00 C ATOM 562 CG2 VAL A 118 28.875 -11.413 -2.155 1.00 0.00 C ATOM 0 H VAL A 118 28.839 -15.247 -3.670 1.00 0.00 H new ATOM 0 HA VAL A 118 29.594 -13.791 -1.200 1.00 0.00 H new ATOM 0 HB VAL A 118 30.060 -12.687 -3.423 1.00 0.00 H new ATOM 0 HG11 VAL A 118 28.106 -11.891 -4.726 1.00 0.00 H new ATOM 0 HG12 VAL A 118 28.144 -13.669 -4.655 1.00 0.00 H new ATOM 0 HG13 VAL A 118 27.015 -12.762 -3.622 1.00 0.00 H new ATOM 0 HG21 VAL A 118 28.974 -10.546 -2.808 1.00 0.00 H new ATOM 0 HG22 VAL A 118 27.883 -11.416 -1.704 1.00 0.00 H new ATOM 0 HG23 VAL A 118 29.630 -11.365 -1.371 1.00 0.00 H new ATOM 572 N GLU A 119 27.255 -13.509 -0.344 1.00 0.00 N ATOM 573 CA GLU A 119 25.919 -13.551 0.240 1.00 0.00 C ATOM 574 C GLU A 119 25.491 -12.161 0.699 1.00 0.00 C ATOM 575 O GLU A 119 26.275 -11.426 1.297 1.00 0.00 O ATOM 576 CB GLU A 119 25.901 -14.512 1.430 1.00 0.00 C ATOM 577 CG GLU A 119 24.460 -14.715 1.900 1.00 0.00 C ATOM 578 CD GLU A 119 24.426 -15.696 3.068 1.00 0.00 C ATOM 579 OE1 GLU A 119 24.539 -15.246 4.196 1.00 0.00 O1- ATOM 580 OE2 GLU A 119 24.286 -16.881 2.816 1.00 0.00 O ATOM 0 H GLU A 119 27.964 -13.073 0.246 1.00 0.00 H new ATOM 0 HA GLU A 119 25.220 -13.901 -0.520 1.00 0.00 H new ATOM 0 HB2 GLU A 119 26.340 -15.468 1.145 1.00 0.00 H new ATOM 0 HB3 GLU A 119 26.507 -14.112 2.243 1.00 0.00 H new ATOM 0 HG2 GLU A 119 24.030 -13.761 2.203 1.00 0.00 H new ATOM 0 HG3 GLU A 119 23.851 -15.093 1.079 1.00 0.00 H new ATOM 587 N PHE A 120 24.241 -11.809 0.413 1.00 0.00 N ATOM 588 CA PHE A 120 23.718 -10.504 0.805 1.00 0.00 C ATOM 589 C PHE A 120 22.210 -10.446 0.579 1.00 0.00 C ATOM 590 O PHE A 120 21.657 -11.231 -0.190 1.00 0.00 O ATOM 591 CB PHE A 120 24.402 -9.402 0.000 1.00 0.00 C ATOM 592 CG PHE A 120 24.022 -9.532 -1.457 1.00 0.00 C ATOM 593 CD1 PHE A 120 22.879 -8.884 -1.941 1.00 0.00 C ATOM 594 CD2 PHE A 120 24.810 -10.301 -2.321 1.00 0.00 C ATOM 595 CE1 PHE A 120 22.525 -9.004 -3.289 1.00 0.00 C ATOM 596 CE2 PHE A 120 24.455 -10.422 -3.669 1.00 0.00 C ATOM 597 CZ PHE A 120 23.313 -9.772 -4.154 1.00 0.00 C ATOM 0 H PHE A 120 23.577 -12.403 -0.084 1.00 0.00 H new ATOM 0 HA PHE A 120 23.922 -10.353 1.865 1.00 0.00 H new ATOM 0 HB2 PHE A 120 24.106 -8.424 0.378 1.00 0.00 H new ATOM 0 HB3 PHE A 120 25.484 -9.473 0.112 1.00 0.00 H new ATOM 0 HD1 PHE A 120 22.271 -8.292 -1.274 1.00 0.00 H new ATOM 0 HD2 PHE A 120 25.692 -10.801 -1.947 1.00 0.00 H new ATOM 0 HE1 PHE A 120 21.644 -8.504 -3.662 1.00 0.00 H new ATOM 0 HE2 PHE A 120 25.062 -11.017 -4.336 1.00 0.00 H new ATOM 0 HZ PHE A 120 23.041 -9.863 -5.195 1.00 0.00 H new ATOM 607 N ALA A 121 21.553 -9.507 1.250 1.00 0.00 N ATOM 608 CA ALA A 121 20.109 -9.354 1.115 1.00 0.00 C ATOM 609 C ALA A 121 19.407 -10.689 1.339 1.00 0.00 C ATOM 610 O ALA A 121 18.272 -10.886 0.904 1.00 0.00 O ATOM 611 CB ALA A 121 19.765 -8.821 -0.277 1.00 0.00 C ATOM 0 H ALA A 121 21.993 -8.844 1.889 1.00 0.00 H new ATOM 0 HA ALA A 121 19.767 -8.644 1.868 1.00 0.00 H new ATOM 0 HB1 ALA A 121 18.684 -8.710 -0.367 1.00 0.00 H new ATOM 0 HB2 ALA A 121 20.242 -7.852 -0.424 1.00 0.00 H new ATOM 0 HB3 ALA A 121 20.123 -9.520 -1.033 1.00 0.00 H new ATOM 617 N GLY A 122 20.090 -11.603 2.021 1.00 0.00 N ATOM 618 CA GLY A 122 19.519 -12.915 2.302 1.00 0.00 C ATOM 619 C GLY A 122 19.571 -13.810 1.072 1.00 0.00 C ATOM 620 O GLY A 122 18.820 -14.783 0.966 1.00 0.00 O ATOM 0 H GLY A 122 21.032 -11.461 2.387 1.00 0.00 H new ATOM 0 HA2 GLY A 122 20.064 -13.385 3.121 1.00 0.00 H new ATOM 0 HA3 GLY A 122 18.486 -12.803 2.630 1.00 0.00 H new ATOM 624 N LYS A 123 20.460 -13.481 0.141 1.00 0.00 N ATOM 625 CA LYS A 123 20.604 -14.265 -1.082 1.00 0.00 C ATOM 626 C LYS A 123 22.070 -14.574 -1.351 1.00 0.00 C ATOM 627 O LYS A 123 22.956 -13.813 -0.962 1.00 0.00 O ATOM 628 CB LYS A 123 20.011 -13.506 -2.265 1.00 0.00 C ATOM 629 CG LYS A 123 18.487 -13.462 -2.136 1.00 0.00 C ATOM 630 CD LYS A 123 17.895 -12.700 -3.323 1.00 0.00 C ATOM 631 CE LYS A 123 16.369 -12.684 -3.210 1.00 0.00 C ATOM 632 NZ LYS A 123 15.794 -11.930 -4.360 1.00 0.00 N1+ ATOM 0 H LYS A 123 21.089 -12.681 0.208 1.00 0.00 H new ATOM 0 HA LYS A 123 20.067 -15.204 -0.953 1.00 0.00 H new ATOM 0 HB2 LYS A 123 20.412 -12.493 -2.298 1.00 0.00 H new ATOM 0 HB3 LYS A 123 20.293 -13.991 -3.199 1.00 0.00 H new ATOM 0 HG2 LYS A 123 18.085 -14.475 -2.104 1.00 0.00 H new ATOM 0 HG3 LYS A 123 18.205 -12.977 -1.202 1.00 0.00 H new ATOM 0 HD2 LYS A 123 18.279 -11.680 -3.342 1.00 0.00 H new ATOM 0 HD3 LYS A 123 18.196 -13.172 -4.258 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.984 -13.704 -3.201 1.00 0.00 H new ATOM 0 HE3 LYS A 123 16.068 -12.221 -2.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 14.757 -11.919 -4.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 16.153 -10.954 -4.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 16.071 -12.391 -5.250 1.00 0.00 H new ATOM 646 N VAL A 124 22.324 -15.694 -2.023 1.00 0.00 N ATOM 647 CA VAL A 124 23.691 -16.093 -2.330 1.00 0.00 C ATOM 648 C VAL A 124 23.890 -16.232 -3.832 1.00 0.00 C ATOM 649 O VAL A 124 23.128 -16.921 -4.511 1.00 0.00 O ATOM 650 CB VAL A 124 24.005 -17.432 -1.653 1.00 0.00 C ATOM 651 CG1 VAL A 124 23.039 -18.502 -2.160 1.00 0.00 C ATOM 652 CG2 VAL A 124 25.442 -17.844 -1.981 1.00 0.00 C ATOM 0 H VAL A 124 21.607 -16.335 -2.362 1.00 0.00 H new ATOM 0 HA VAL A 124 24.364 -15.321 -1.956 1.00 0.00 H new ATOM 0 HB VAL A 124 23.894 -17.327 -0.574 1.00 0.00 H new ATOM 0 HG11 VAL A 124 23.264 -19.453 -1.678 1.00 0.00 H new ATOM 0 HG12 VAL A 124 22.016 -18.209 -1.925 1.00 0.00 H new ATOM 0 HG13 VAL A 124 23.147 -18.608 -3.239 1.00 0.00 H new ATOM 0 HG21 VAL A 124 25.666 -18.796 -1.500 1.00 0.00 H new ATOM 0 HG22 VAL A 124 25.553 -17.948 -3.060 1.00 0.00 H new ATOM 0 HG23 VAL A 124 26.131 -17.082 -1.617 1.00 0.00 H new ATOM 662 N PHE A 125 24.919 -15.568 -4.351 1.00 0.00 N ATOM 663 CA PHE A 125 25.218 -15.631 -5.780 1.00 0.00 C ATOM 664 C PHE A 125 26.536 -16.363 -6.015 1.00 0.00 C ATOM 665 O PHE A 125 27.586 -15.944 -5.523 1.00 0.00 O ATOM 666 CB PHE A 125 25.301 -14.222 -6.361 1.00 0.00 C ATOM 667 CG PHE A 125 23.980 -13.517 -6.164 1.00 0.00 C ATOM 668 CD1 PHE A 125 23.604 -13.083 -4.887 1.00 0.00 C ATOM 669 CD2 PHE A 125 23.134 -13.298 -7.257 1.00 0.00 C ATOM 670 CE1 PHE A 125 22.380 -12.429 -4.704 1.00 0.00 C ATOM 671 CE2 PHE A 125 21.910 -12.643 -7.073 1.00 0.00 C ATOM 672 CZ PHE A 125 21.533 -12.210 -5.797 1.00 0.00 C ATOM 0 H PHE A 125 25.556 -14.984 -3.809 1.00 0.00 H new ATOM 0 HA PHE A 125 24.417 -16.177 -6.278 1.00 0.00 H new ATOM 0 HB2 PHE A 125 26.100 -13.663 -5.874 1.00 0.00 H new ATOM 0 HB3 PHE A 125 25.546 -14.269 -7.422 1.00 0.00 H new ATOM 0 HD1 PHE A 125 24.258 -13.253 -4.044 1.00 0.00 H new ATOM 0 HD2 PHE A 125 23.425 -13.634 -8.241 1.00 0.00 H new ATOM 0 HE1 PHE A 125 22.089 -12.093 -3.720 1.00 0.00 H new ATOM 0 HE2 PHE A 125 21.257 -12.472 -7.916 1.00 0.00 H new ATOM 0 HZ PHE A 125 20.588 -11.707 -5.655 1.00 0.00 H new ATOM 682 N SER A 126 26.476 -17.456 -6.768 1.00 0.00 N ATOM 683 CA SER A 126 27.672 -18.238 -7.060 1.00 0.00 C ATOM 684 C SER A 126 28.477 -17.593 -8.182 1.00 0.00 C ATOM 685 O SER A 126 27.928 -17.225 -9.221 1.00 0.00 O ATOM 686 CB SER A 126 27.279 -19.660 -7.463 1.00 0.00 C ATOM 687 OG SER A 126 28.450 -20.397 -7.786 1.00 0.00 O ATOM 0 H SER A 126 25.619 -17.819 -7.185 1.00 0.00 H new ATOM 0 HA SER A 126 28.289 -18.271 -6.162 1.00 0.00 H new ATOM 0 HB2 SER A 126 26.743 -20.146 -6.648 1.00 0.00 H new ATOM 0 HB3 SER A 126 26.604 -19.634 -8.318 1.00 0.00 H new ATOM 0 HG SER A 126 28.202 -21.309 -8.043 1.00 0.00 H new ATOM 693 N GLY A 127 29.781 -17.461 -7.967 1.00 0.00 N ATOM 694 CA GLY A 127 30.655 -16.862 -8.970 1.00 0.00 C ATOM 695 C GLY A 127 31.011 -17.876 -10.052 1.00 0.00 C ATOM 696 O GLY A 127 30.469 -18.981 -10.087 1.00 0.00 O ATOM 0 H GLY A 127 30.254 -17.758 -7.114 1.00 0.00 H new ATOM 0 HA2 GLY A 127 30.162 -16.000 -9.421 1.00 0.00 H new ATOM 0 HA3 GLY A 127 31.565 -16.496 -8.494 1.00 0.00 H new ATOM 700 N GLU A 128 31.927 -17.494 -10.937 1.00 0.00 N ATOM 701 CA GLU A 128 32.345 -18.378 -12.019 1.00 0.00 C ATOM 702 C GLU A 128 33.624 -19.121 -11.638 1.00 0.00 C ATOM 703 O GLU A 128 34.593 -18.510 -11.183 1.00 0.00 O ATOM 704 CB GLU A 128 32.579 -17.565 -13.296 1.00 0.00 C ATOM 705 CG GLU A 128 34.012 -17.022 -13.306 1.00 0.00 C ATOM 706 CD GLU A 128 34.147 -15.921 -14.347 1.00 0.00 C ATOM 707 OE1 GLU A 128 33.200 -15.713 -15.087 1.00 0.00 O ATOM 708 OE2 GLU A 128 35.196 -15.300 -14.389 1.00 0.00 O1- ATOM 0 H GLU A 128 32.391 -16.586 -10.927 1.00 0.00 H new ATOM 0 HA GLU A 128 31.555 -19.108 -12.196 1.00 0.00 H new ATOM 0 HB2 GLU A 128 32.410 -18.190 -14.173 1.00 0.00 H new ATOM 0 HB3 GLU A 128 31.867 -16.741 -13.350 1.00 0.00 H new ATOM 0 HG2 GLU A 128 34.269 -16.634 -12.320 1.00 0.00 H new ATOM 0 HG3 GLU A 128 34.713 -17.828 -13.525 1.00 0.00 H new ATOM 715 N GLU A 129 33.625 -20.428 -11.842 1.00 0.00 N ATOM 716 CA GLU A 129 34.795 -21.240 -11.525 1.00 0.00 C ATOM 717 C GLU A 129 36.034 -20.681 -12.220 1.00 0.00 C ATOM 718 O GLU A 129 35.964 -20.216 -13.357 1.00 0.00 O ATOM 719 CB GLU A 129 34.565 -22.685 -11.975 1.00 0.00 C ATOM 720 CG GLU A 129 33.457 -23.311 -11.127 1.00 0.00 C ATOM 721 CD GLU A 129 33.201 -24.746 -11.580 1.00 0.00 C ATOM 722 OE1 GLU A 129 33.881 -25.187 -12.493 1.00 0.00 O ATOM 723 OE2 GLU A 129 32.333 -25.381 -11.006 1.00 0.00 O1- ATOM 0 H GLU A 129 32.836 -20.950 -12.223 1.00 0.00 H new ATOM 0 HA GLU A 129 34.952 -21.216 -10.447 1.00 0.00 H new ATOM 0 HB2 GLU A 129 34.289 -22.710 -13.029 1.00 0.00 H new ATOM 0 HB3 GLU A 129 35.485 -23.260 -11.873 1.00 0.00 H new ATOM 0 HG2 GLU A 129 33.742 -23.298 -10.075 1.00 0.00 H new ATOM 0 HG3 GLU A 129 32.543 -22.724 -11.217 1.00 0.00 H new ATOM 730 N ALA A 130 37.170 -20.730 -11.525 1.00 0.00 N ATOM 731 CA ALA A 130 38.416 -20.227 -12.084 1.00 0.00 C ATOM 732 C ALA A 130 39.605 -20.714 -11.265 1.00 0.00 C ATOM 733 O ALA A 130 39.461 -21.074 -10.097 1.00 0.00 O ATOM 734 CB ALA A 130 38.399 -18.698 -12.104 1.00 0.00 C ATOM 0 H ALA A 130 37.250 -21.110 -10.582 1.00 0.00 H new ATOM 0 HA ALA A 130 38.513 -20.602 -13.103 1.00 0.00 H new ATOM 0 HB1 ALA A 130 39.335 -18.329 -12.524 1.00 0.00 H new ATOM 0 HB2 ALA A 130 37.566 -18.351 -12.715 1.00 0.00 H new ATOM 0 HB3 ALA A 130 38.284 -18.322 -11.087 1.00 0.00 H new ATOM 740 N LYS A 131 40.780 -20.726 -11.884 1.00 0.00 N ATOM 741 CA LYS A 131 41.992 -21.165 -11.203 1.00 0.00 C ATOM 742 C LYS A 131 42.636 -20.003 -10.450 1.00 0.00 C ATOM 743 O LYS A 131 43.862 -19.919 -10.351 1.00 0.00 O ATOM 744 CB LYS A 131 42.987 -21.737 -12.212 1.00 0.00 C ATOM 745 CG LYS A 131 43.969 -22.665 -11.495 1.00 0.00 C ATOM 746 CD LYS A 131 44.895 -23.320 -12.520 1.00 0.00 C ATOM 747 CE LYS A 131 45.848 -24.282 -11.808 1.00 0.00 C ATOM 748 NZ LYS A 131 46.768 -23.508 -10.925 1.00 0.00 N1+ ATOM 0 H LYS A 131 40.919 -20.438 -12.853 1.00 0.00 H new ATOM 0 HA LYS A 131 41.720 -21.941 -10.487 1.00 0.00 H new ATOM 0 HB2 LYS A 131 42.456 -22.285 -12.991 1.00 0.00 H new ATOM 0 HB3 LYS A 131 43.528 -20.928 -12.703 1.00 0.00 H new ATOM 0 HG2 LYS A 131 44.554 -22.101 -10.769 1.00 0.00 H new ATOM 0 HG3 LYS A 131 43.424 -23.429 -10.941 1.00 0.00 H new ATOM 0 HD2 LYS A 131 44.308 -23.858 -13.264 1.00 0.00 H new ATOM 0 HD3 LYS A 131 45.463 -22.557 -13.052 1.00 0.00 H new ATOM 0 HE2 LYS A 131 45.281 -25.002 -11.218 1.00 0.00 H new ATOM 0 HE3 LYS A 131 46.422 -24.850 -12.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 47.584 -24.100 -10.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 47.100 -22.660 -11.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 46.263 -23.223 -10.062 1.00 0.00 H new ATOM 762 N THR A 132 41.806 -19.102 -9.937 1.00 0.00 N ATOM 763 CA THR A 132 42.309 -17.945 -9.202 1.00 0.00 C ATOM 764 C THR A 132 41.217 -17.361 -8.313 1.00 0.00 C ATOM 765 O THR A 132 40.028 -17.486 -8.610 1.00 0.00 O ATOM 766 CB THR A 132 42.800 -16.880 -10.181 1.00 0.00 C ATOM 767 OG1 THR A 132 43.188 -15.720 -9.459 1.00 0.00 O ATOM 768 CG2 THR A 132 41.677 -16.525 -11.157 1.00 0.00 C ATOM 0 H THR A 132 40.790 -19.148 -10.015 1.00 0.00 H new ATOM 0 HA THR A 132 43.138 -18.268 -8.573 1.00 0.00 H new ATOM 0 HB THR A 132 43.654 -17.264 -10.739 1.00 0.00 H new ATOM 0 HG1 THR A 132 43.505 -15.036 -10.085 1.00 0.00 H new ATOM 0 HG21 THR A 132 42.028 -15.765 -11.855 1.00 0.00 H new ATOM 0 HG22 THR A 132 41.380 -17.416 -11.710 1.00 0.00 H new ATOM 0 HG23 THR A 132 40.821 -16.140 -10.602 1.00 0.00 H new ATOM 776 N LYS A 133 41.624 -16.728 -7.218 1.00 0.00 N ATOM 777 CA LYS A 133 40.672 -16.128 -6.295 1.00 0.00 C ATOM 778 C LYS A 133 40.225 -14.758 -6.787 1.00 0.00 C ATOM 779 O LYS A 133 39.085 -14.349 -6.573 1.00 0.00 O ATOM 780 CB LYS A 133 41.302 -15.997 -4.905 1.00 0.00 C ATOM 781 CG LYS A 133 41.483 -17.386 -4.292 1.00 0.00 C ATOM 782 CD LYS A 133 42.147 -17.255 -2.919 1.00 0.00 C ATOM 783 CE LYS A 133 42.376 -18.647 -2.327 1.00 0.00 C ATOM 784 NZ LYS A 133 41.061 -19.286 -2.039 1.00 0.00 N1+ ATOM 0 H LYS A 133 42.602 -16.618 -6.950 1.00 0.00 H new ATOM 0 HA LYS A 133 39.798 -16.777 -6.239 1.00 0.00 H new ATOM 0 HB2 LYS A 133 42.265 -15.492 -4.977 1.00 0.00 H new ATOM 0 HB3 LYS A 133 40.668 -15.385 -4.263 1.00 0.00 H new ATOM 0 HG2 LYS A 133 40.517 -17.881 -4.195 1.00 0.00 H new ATOM 0 HG3 LYS A 133 42.095 -18.007 -4.946 1.00 0.00 H new ATOM 0 HD2 LYS A 133 43.096 -16.727 -3.011 1.00 0.00 H new ATOM 0 HD3 LYS A 133 41.517 -16.665 -2.254 1.00 0.00 H new ATOM 0 HE2 LYS A 133 42.946 -19.261 -3.024 1.00 0.00 H new ATOM 0 HE3 LYS A 133 42.965 -18.573 -1.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 41.147 -19.894 -1.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 40.349 -18.549 -1.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 40.769 -19.861 -2.855 1.00 0.00 H new ATOM 798 N LYS A 134 41.140 -14.049 -7.445 1.00 0.00 N ATOM 799 CA LYS A 134 40.835 -12.715 -7.944 1.00 0.00 C ATOM 800 C LYS A 134 39.648 -12.750 -8.897 1.00 0.00 C ATOM 801 O LYS A 134 38.664 -12.036 -8.703 1.00 0.00 O ATOM 802 CB LYS A 134 42.057 -12.144 -8.675 1.00 0.00 C ATOM 803 CG LYS A 134 43.187 -11.903 -7.672 1.00 0.00 C ATOM 804 CD LYS A 134 44.401 -11.320 -8.400 1.00 0.00 C ATOM 805 CE LYS A 134 45.533 -11.086 -7.399 1.00 0.00 C ATOM 806 NZ LYS A 134 46.721 -10.538 -8.111 1.00 0.00 N1+ ATOM 0 H LYS A 134 42.087 -14.373 -7.642 1.00 0.00 H new ATOM 0 HA LYS A 134 40.582 -12.081 -7.094 1.00 0.00 H new ATOM 0 HB2 LYS A 134 42.386 -12.836 -9.450 1.00 0.00 H new ATOM 0 HB3 LYS A 134 41.793 -11.211 -9.172 1.00 0.00 H new ATOM 0 HG2 LYS A 134 42.855 -11.219 -6.891 1.00 0.00 H new ATOM 0 HG3 LYS A 134 43.458 -12.838 -7.182 1.00 0.00 H new ATOM 0 HD2 LYS A 134 44.730 -12.002 -9.184 1.00 0.00 H new ATOM 0 HD3 LYS A 134 44.131 -10.382 -8.886 1.00 0.00 H new ATOM 0 HE2 LYS A 134 45.209 -10.392 -6.623 1.00 0.00 H new ATOM 0 HE3 LYS A 134 45.793 -12.021 -6.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 47.491 -10.379 -7.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 47.034 -11.215 -8.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 46.469 -9.637 -8.565 1.00 0.00 H new ATOM 820 N LEU A 135 39.741 -13.592 -9.918 1.00 0.00 N ATOM 821 CA LEU A 135 38.667 -13.714 -10.895 1.00 0.00 C ATOM 822 C LEU A 135 37.406 -14.273 -10.242 1.00 0.00 C ATOM 823 O LEU A 135 36.293 -13.857 -10.556 1.00 0.00 O ATOM 824 CB LEU A 135 39.102 -14.632 -12.041 1.00 0.00 C ATOM 825 CG LEU A 135 38.344 -14.255 -13.319 1.00 0.00 C ATOM 826 CD1 LEU A 135 39.066 -13.098 -14.018 1.00 0.00 C ATOM 827 CD2 LEU A 135 38.287 -15.462 -14.255 1.00 0.00 C ATOM 0 H LEU A 135 40.544 -14.197 -10.091 1.00 0.00 H new ATOM 0 HA LEU A 135 38.448 -12.722 -11.289 1.00 0.00 H new ATOM 0 HB2 LEU A 135 40.176 -14.543 -12.204 1.00 0.00 H new ATOM 0 HB3 LEU A 135 38.904 -15.672 -11.782 1.00 0.00 H new ATOM 0 HG LEU A 135 37.330 -13.948 -13.062 1.00 0.00 H new ATOM 0 HD11 LEU A 135 38.528 -12.829 -14.927 1.00 0.00 H new ATOM 0 HD12 LEU A 135 39.104 -12.237 -13.351 1.00 0.00 H new ATOM 0 HD13 LEU A 135 40.080 -13.404 -14.274 1.00 0.00 H new ATOM 0 HD21 LEU A 135 37.748 -15.193 -15.163 1.00 0.00 H new ATOM 0 HD22 LEU A 135 39.300 -15.771 -14.512 1.00 0.00 H new ATOM 0 HD23 LEU A 135 37.772 -16.284 -13.758 1.00 0.00 H new ATOM 839 N ALA A 136 37.595 -15.228 -9.334 1.00 0.00 N ATOM 840 CA ALA A 136 36.464 -15.848 -8.653 1.00 0.00 C ATOM 841 C ALA A 136 35.629 -14.802 -7.928 1.00 0.00 C ATOM 842 O ALA A 136 34.424 -14.690 -8.154 1.00 0.00 O ATOM 843 CB ALA A 136 36.971 -16.885 -7.644 1.00 0.00 C ATOM 0 H ALA A 136 38.509 -15.585 -9.056 1.00 0.00 H new ATOM 0 HA ALA A 136 35.839 -16.336 -9.401 1.00 0.00 H new ATOM 0 HB1 ALA A 136 36.122 -17.345 -7.138 1.00 0.00 H new ATOM 0 HB2 ALA A 136 37.542 -17.653 -8.167 1.00 0.00 H new ATOM 0 HB3 ALA A 136 37.610 -16.395 -6.909 1.00 0.00 H new ATOM 849 N GLU A 137 36.277 -14.029 -7.067 1.00 0.00 N ATOM 850 CA GLU A 137 35.580 -12.994 -6.309 1.00 0.00 C ATOM 851 C GLU A 137 34.958 -11.972 -7.252 1.00 0.00 C ATOM 852 O GLU A 137 33.827 -11.531 -7.045 1.00 0.00 O ATOM 853 CB GLU A 137 36.560 -12.288 -5.365 1.00 0.00 C ATOM 854 CG GLU A 137 37.007 -13.261 -4.272 1.00 0.00 C ATOM 855 CD GLU A 137 38.081 -12.612 -3.405 1.00 0.00 C ATOM 856 OE1 GLU A 137 38.384 -11.455 -3.639 1.00 0.00 O ATOM 857 OE2 GLU A 137 38.584 -13.284 -2.519 1.00 0.00 O1- ATOM 0 H GLU A 137 37.277 -14.096 -6.875 1.00 0.00 H new ATOM 0 HA GLU A 137 34.789 -13.466 -5.726 1.00 0.00 H new ATOM 0 HB2 GLU A 137 37.425 -11.929 -5.923 1.00 0.00 H new ATOM 0 HB3 GLU A 137 36.085 -11.415 -4.917 1.00 0.00 H new ATOM 0 HG2 GLU A 137 36.154 -13.546 -3.656 1.00 0.00 H new ATOM 0 HG3 GLU A 137 37.395 -14.175 -4.723 1.00 0.00 H new ATOM 864 N MET A 138 35.701 -11.601 -8.289 1.00 0.00 N ATOM 865 CA MET A 138 35.214 -10.620 -9.252 1.00 0.00 C ATOM 866 C MET A 138 33.970 -11.140 -9.963 1.00 0.00 C ATOM 867 O MET A 138 33.014 -10.395 -10.183 1.00 0.00 O ATOM 868 CB MET A 138 36.306 -10.320 -10.284 1.00 0.00 C ATOM 869 CG MET A 138 37.382 -9.436 -9.646 1.00 0.00 C ATOM 870 SD MET A 138 36.691 -7.802 -9.287 1.00 0.00 S ATOM 871 CE MET A 138 36.910 -7.095 -10.938 1.00 0.00 C ATOM 0 H MET A 138 36.635 -11.961 -8.484 1.00 0.00 H new ATOM 0 HA MET A 138 34.957 -9.706 -8.716 1.00 0.00 H new ATOM 0 HB2 MET A 138 36.749 -11.250 -10.641 1.00 0.00 H new ATOM 0 HB3 MET A 138 35.875 -9.819 -11.150 1.00 0.00 H new ATOM 0 HG2 MET A 138 37.748 -9.897 -8.729 1.00 0.00 H new ATOM 0 HG3 MET A 138 38.235 -9.342 -10.318 1.00 0.00 H new ATOM 0 HE1 MET A 138 37.760 -6.413 -10.932 1.00 0.00 H new ATOM 0 HE2 MET A 138 37.092 -7.895 -11.655 1.00 0.00 H new ATOM 0 HE3 MET A 138 36.010 -6.550 -11.223 1.00 0.00 H new ATOM 881 N SER A 139 33.991 -12.416 -10.319 1.00 0.00 N ATOM 882 CA SER A 139 32.857 -13.028 -11.008 1.00 0.00 C ATOM 883 C SER A 139 31.626 -13.040 -10.110 1.00 0.00 C ATOM 884 O SER A 139 30.504 -12.830 -10.572 1.00 0.00 O ATOM 885 CB SER A 139 33.203 -14.456 -11.423 1.00 0.00 C ATOM 886 OG SER A 139 34.403 -14.442 -12.189 1.00 0.00 O ATOM 0 H SER A 139 34.774 -13.047 -10.145 1.00 0.00 H new ATOM 0 HA SER A 139 32.637 -12.437 -11.897 1.00 0.00 H new ATOM 0 HB2 SER A 139 33.328 -15.084 -10.541 1.00 0.00 H new ATOM 0 HB3 SER A 139 32.389 -14.885 -12.007 1.00 0.00 H new ATOM 0 HG SER A 139 35.176 -14.461 -11.587 1.00 0.00 H new ATOM 892 N ALA A 140 31.842 -13.294 -8.823 1.00 0.00 N ATOM 893 CA ALA A 140 30.742 -13.332 -7.864 1.00 0.00 C ATOM 894 C ALA A 140 30.095 -11.957 -7.735 1.00 0.00 C ATOM 895 O ALA A 140 28.871 -11.835 -7.710 1.00 0.00 O ATOM 896 CB ALA A 140 31.255 -13.789 -6.498 1.00 0.00 C ATOM 0 H ALA A 140 32.762 -13.476 -8.422 1.00 0.00 H new ATOM 0 HA ALA A 140 29.995 -14.039 -8.225 1.00 0.00 H new ATOM 0 HB1 ALA A 140 30.428 -13.814 -5.789 1.00 0.00 H new ATOM 0 HB2 ALA A 140 31.688 -14.785 -6.587 1.00 0.00 H new ATOM 0 HB3 ALA A 140 32.016 -13.093 -6.144 1.00 0.00 H new ATOM 902 N ALA A 141 30.926 -10.923 -7.654 1.00 0.00 N ATOM 903 CA ALA A 141 30.424 -9.560 -7.535 1.00 0.00 C ATOM 904 C ALA A 141 29.820 -9.097 -8.857 1.00 0.00 C ATOM 905 O ALA A 141 28.969 -8.208 -8.885 1.00 0.00 O ATOM 906 CB ALA A 141 31.560 -8.617 -7.132 1.00 0.00 C ATOM 0 H ALA A 141 31.943 -11.002 -7.668 1.00 0.00 H new ATOM 0 HA ALA A 141 29.650 -9.543 -6.768 1.00 0.00 H new ATOM 0 HB1 ALA A 141 31.176 -7.601 -7.045 1.00 0.00 H new ATOM 0 HB2 ALA A 141 31.972 -8.932 -6.173 1.00 0.00 H new ATOM 0 HB3 ALA A 141 32.343 -8.646 -7.890 1.00 0.00 H new ATOM 912 N LYS A 142 30.275 -9.698 -9.951 1.00 0.00 N ATOM 913 CA LYS A 142 29.774 -9.339 -11.272 1.00 0.00 C ATOM 914 C LYS A 142 28.336 -9.808 -11.458 1.00 0.00 C ATOM 915 O LYS A 142 27.481 -9.055 -11.921 1.00 0.00 O ATOM 916 CB LYS A 142 30.660 -9.960 -12.355 1.00 0.00 C ATOM 917 CG LYS A 142 30.217 -9.460 -13.730 1.00 0.00 C ATOM 918 CD LYS A 142 31.125 -10.057 -14.808 1.00 0.00 C ATOM 919 CE LYS A 142 30.685 -9.552 -16.184 1.00 0.00 C ATOM 920 NZ LYS A 142 30.797 -8.066 -16.227 1.00 0.00 N1+ ATOM 0 H LYS A 142 30.985 -10.431 -9.950 1.00 0.00 H new ATOM 0 HA LYS A 142 29.798 -8.253 -11.359 1.00 0.00 H new ATOM 0 HB2 LYS A 142 31.703 -9.697 -12.180 1.00 0.00 H new ATOM 0 HB3 LYS A 142 30.594 -11.047 -12.314 1.00 0.00 H new ATOM 0 HG2 LYS A 142 29.181 -9.743 -13.915 1.00 0.00 H new ATOM 0 HG3 LYS A 142 30.261 -8.371 -13.764 1.00 0.00 H new ATOM 0 HD2 LYS A 142 32.162 -9.777 -14.621 1.00 0.00 H new ATOM 0 HD3 LYS A 142 31.078 -11.146 -14.776 1.00 0.00 H new ATOM 0 HE2 LYS A 142 31.305 -9.997 -16.962 1.00 0.00 H new ATOM 0 HE3 LYS A 142 29.657 -9.856 -16.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 30.867 -7.752 -17.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 29.955 -7.642 -15.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 31.647 -7.767 -15.708 1.00 0.00 H new ATOM 934 N VAL A 143 28.077 -11.063 -11.096 1.00 0.00 N ATOM 935 CA VAL A 143 26.742 -11.627 -11.236 1.00 0.00 C ATOM 936 C VAL A 143 25.784 -11.006 -10.230 1.00 0.00 C ATOM 937 O VAL A 143 24.614 -10.774 -10.530 1.00 0.00 O ATOM 938 CB VAL A 143 26.794 -13.142 -11.035 1.00 0.00 C ATOM 939 CG1 VAL A 143 27.408 -13.454 -9.670 1.00 0.00 C ATOM 940 CG2 VAL A 143 25.374 -13.712 -11.096 1.00 0.00 C ATOM 0 H VAL A 143 28.770 -11.702 -10.707 1.00 0.00 H new ATOM 0 HA VAL A 143 26.379 -11.406 -12.240 1.00 0.00 H new ATOM 0 HB VAL A 143 27.402 -13.592 -11.819 1.00 0.00 H new ATOM 0 HG11 VAL A 143 27.445 -14.534 -9.526 1.00 0.00 H new ATOM 0 HG12 VAL A 143 28.418 -13.047 -9.624 1.00 0.00 H new ATOM 0 HG13 VAL A 143 26.799 -13.004 -8.886 1.00 0.00 H new ATOM 0 HG21 VAL A 143 25.409 -14.792 -10.953 1.00 0.00 H new ATOM 0 HG22 VAL A 143 24.767 -13.261 -10.311 1.00 0.00 H new ATOM 0 HG23 VAL A 143 24.934 -13.489 -12.068 1.00 0.00 H new ATOM 950 N ALA A 144 26.288 -10.745 -9.033 1.00 0.00 N ATOM 951 CA ALA A 144 25.465 -10.151 -7.981 1.00 0.00 C ATOM 952 C ALA A 144 25.011 -8.752 -8.379 1.00 0.00 C ATOM 953 O ALA A 144 23.838 -8.407 -8.239 1.00 0.00 O ATOM 954 CB ALA A 144 26.260 -10.077 -6.673 1.00 0.00 C ATOM 0 H ALA A 144 27.254 -10.932 -8.764 1.00 0.00 H new ATOM 0 HA ALA A 144 24.586 -10.779 -7.838 1.00 0.00 H new ATOM 0 HB1 ALA A 144 25.639 -9.633 -5.895 1.00 0.00 H new ATOM 0 HB2 ALA A 144 26.558 -11.081 -6.371 1.00 0.00 H new ATOM 0 HB3 ALA A 144 27.149 -9.464 -6.822 1.00 0.00 H new ATOM 960 N PHE A 145 25.945 -7.953 -8.882 1.00 0.00 N ATOM 961 CA PHE A 145 25.629 -6.589 -9.293 1.00 0.00 C ATOM 962 C PHE A 145 24.538 -6.590 -10.357 1.00 0.00 C ATOM 963 O PHE A 145 23.610 -5.785 -10.307 1.00 0.00 O ATOM 964 CB PHE A 145 26.884 -5.908 -9.846 1.00 0.00 C ATOM 965 CG PHE A 145 26.598 -4.444 -10.084 1.00 0.00 C ATOM 966 CD1 PHE A 145 26.569 -3.554 -9.003 1.00 0.00 C ATOM 967 CD2 PHE A 145 26.363 -3.976 -11.383 1.00 0.00 C ATOM 968 CE1 PHE A 145 26.306 -2.196 -9.222 1.00 0.00 C ATOM 969 CE2 PHE A 145 26.099 -2.621 -11.601 1.00 0.00 C ATOM 970 CZ PHE A 145 26.070 -1.729 -10.521 1.00 0.00 C ATOM 0 H PHE A 145 26.920 -8.222 -9.015 1.00 0.00 H new ATOM 0 HA PHE A 145 25.270 -6.040 -8.422 1.00 0.00 H new ATOM 0 HB2 PHE A 145 27.710 -6.019 -9.144 1.00 0.00 H new ATOM 0 HB3 PHE A 145 27.190 -6.386 -10.777 1.00 0.00 H new ATOM 0 HD1 PHE A 145 26.749 -3.915 -8.001 1.00 0.00 H new ATOM 0 HD2 PHE A 145 26.386 -4.662 -12.216 1.00 0.00 H new ATOM 0 HE1 PHE A 145 26.285 -1.509 -8.389 1.00 0.00 H new ATOM 0 HE2 PHE A 145 25.917 -2.261 -12.603 1.00 0.00 H new ATOM 0 HZ PHE A 145 25.866 -0.682 -10.690 1.00 0.00 H new ATOM 980 N MET A 146 24.656 -7.498 -11.319 1.00 0.00 N ATOM 981 CA MET A 146 23.678 -7.588 -12.397 1.00 0.00 C ATOM 982 C MET A 146 22.294 -7.900 -11.840 1.00 0.00 C ATOM 983 O MET A 146 21.286 -7.399 -12.338 1.00 0.00 O ATOM 984 CB MET A 146 24.092 -8.676 -13.390 1.00 0.00 C ATOM 985 CG MET A 146 23.112 -8.695 -14.564 1.00 0.00 C ATOM 986 SD MET A 146 23.716 -9.836 -15.834 1.00 0.00 S ATOM 987 CE MET A 146 23.585 -11.353 -14.858 1.00 0.00 C ATOM 0 H MET A 146 25.414 -8.178 -11.375 1.00 0.00 H new ATOM 0 HA MET A 146 23.641 -6.627 -12.910 1.00 0.00 H new ATOM 0 HB2 MET A 146 25.104 -8.489 -13.750 1.00 0.00 H new ATOM 0 HB3 MET A 146 24.104 -9.648 -12.897 1.00 0.00 H new ATOM 0 HG2 MET A 146 22.124 -9.004 -14.222 1.00 0.00 H new ATOM 0 HG3 MET A 146 23.007 -7.693 -14.980 1.00 0.00 H new ATOM 0 HE1 MET A 146 23.229 -12.165 -15.493 1.00 0.00 H new ATOM 0 HE2 MET A 146 24.564 -11.611 -14.453 1.00 0.00 H new ATOM 0 HE3 MET A 146 22.883 -11.199 -14.039 1.00 0.00 H new ATOM 997 N SER A 147 22.252 -8.740 -10.810 1.00 0.00 N ATOM 998 CA SER A 147 20.984 -9.114 -10.197 1.00 0.00 C ATOM 999 C SER A 147 20.384 -7.943 -9.428 1.00 0.00 C ATOM 1000 O SER A 147 19.193 -7.654 -9.544 1.00 0.00 O ATOM 1001 CB SER A 147 21.194 -10.294 -9.248 1.00 0.00 C ATOM 1002 OG SER A 147 19.941 -10.688 -8.701 1.00 0.00 O ATOM 0 H SER A 147 23.074 -9.171 -10.386 1.00 0.00 H new ATOM 0 HA SER A 147 20.293 -9.399 -10.990 1.00 0.00 H new ATOM 0 HB2 SER A 147 21.649 -11.128 -9.782 1.00 0.00 H new ATOM 0 HB3 SER A 147 21.881 -10.015 -8.449 1.00 0.00 H new ATOM 0 HG SER A 147 20.051 -10.897 -7.750 1.00 0.00 H new ATOM 1008 N ILE A 148 21.219 -7.269 -8.646 1.00 0.00 N ATOM 1009 CA ILE A 148 20.759 -6.135 -7.851 1.00 0.00 C ATOM 1010 C ILE A 148 20.081 -5.099 -8.737 1.00 0.00 C ATOM 1011 O ILE A 148 19.162 -4.401 -8.303 1.00 0.00 O ATOM 1012 CB ILE A 148 21.940 -5.493 -7.119 1.00 0.00 C ATOM 1013 CG1 ILE A 148 22.464 -6.457 -6.050 1.00 0.00 C ATOM 1014 CG2 ILE A 148 21.486 -4.193 -6.455 1.00 0.00 C ATOM 1015 CD1 ILE A 148 23.796 -5.941 -5.506 1.00 0.00 C ATOM 0 H ILE A 148 22.211 -7.485 -8.545 1.00 0.00 H new ATOM 0 HA ILE A 148 20.036 -6.499 -7.120 1.00 0.00 H new ATOM 0 HB ILE A 148 22.734 -5.276 -7.834 1.00 0.00 H new ATOM 0 HG12 ILE A 148 21.739 -6.548 -5.241 1.00 0.00 H new ATOM 0 HG13 ILE A 148 22.594 -7.452 -6.475 1.00 0.00 H new ATOM 0 HG21 ILE A 148 22.328 -3.737 -5.934 1.00 0.00 H new ATOM 0 HG22 ILE A 148 21.115 -3.506 -7.216 1.00 0.00 H new ATOM 0 HG23 ILE A 148 20.691 -4.408 -5.741 1.00 0.00 H new ATOM 0 HD11 ILE A 148 24.169 -6.627 -4.745 1.00 0.00 H new ATOM 0 HD12 ILE A 148 24.519 -5.873 -6.319 1.00 0.00 H new ATOM 0 HD13 ILE A 148 23.651 -4.955 -5.065 1.00 0.00 H new ATOM 1027 N LYS A 149 20.539 -5.000 -9.978 1.00 0.00 N ATOM 1028 CA LYS A 149 19.965 -4.047 -10.921 1.00 0.00 C ATOM 1029 C LYS A 149 18.492 -4.354 -11.167 1.00 0.00 C ATOM 1030 O LYS A 149 17.660 -3.449 -11.234 1.00 0.00 O ATOM 1031 CB LYS A 149 20.727 -4.097 -12.247 1.00 0.00 C ATOM 1032 CG LYS A 149 22.094 -3.432 -12.076 1.00 0.00 C ATOM 1033 CD LYS A 149 22.879 -3.535 -13.385 1.00 0.00 C ATOM 1034 CE LYS A 149 22.184 -2.702 -14.465 1.00 0.00 C ATOM 1035 NZ LYS A 149 21.183 -3.547 -15.175 1.00 0.00 N1+ ATOM 0 H LYS A 149 21.301 -5.564 -10.354 1.00 0.00 H new ATOM 0 HA LYS A 149 20.049 -3.048 -10.492 1.00 0.00 H new ATOM 0 HB2 LYS A 149 20.852 -5.131 -12.568 1.00 0.00 H new ATOM 0 HB3 LYS A 149 20.158 -3.588 -13.025 1.00 0.00 H new ATOM 0 HG2 LYS A 149 21.969 -2.386 -11.796 1.00 0.00 H new ATOM 0 HG3 LYS A 149 22.646 -3.914 -11.269 1.00 0.00 H new ATOM 0 HD2 LYS A 149 23.899 -3.181 -13.238 1.00 0.00 H new ATOM 0 HD3 LYS A 149 22.945 -4.576 -13.701 1.00 0.00 H new ATOM 0 HE2 LYS A 149 21.694 -1.839 -14.015 1.00 0.00 H new ATOM 0 HE3 LYS A 149 22.919 -2.318 -15.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 21.404 -3.567 -16.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 21.213 -4.514 -14.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 20.232 -3.150 -15.036 1.00 0.00 H new