USER MOD reduce.3.24.130724 H: found=0, std=0, add=521, rem=0, adj=21 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 Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ -135:sc= 0.833 (180deg=-0.971) USER MOD Single : A 85 ASN : amide:sc= -0.0849 K(o=-0.085,f=-2.3!) USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 92 GLN : amide:sc=-0.00476 K(o=-0.0048,f=-1.6!) USER MOD Single : A 93 LYS NZ :NH3+ -161:sc= -0.0221 (180deg=-0.374) USER MOD Single : A 95 SER OG : rot 52:sc= -0.0824 USER MOD Single : A 96 SER OG : rot 69:sc= 0.699 USER MOD Single : A 101 TYR OH : rot 180:sc= -0.471 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 44:sc= 0.134 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc=0.000579 USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.0017) USER MOD Single : A 113 THR OG1 : rot 15:sc= 0.238 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -8:sc= -1.64! 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 49:sc= 0.12 USER MOD Single : A 131 LYS NZ :NH3+ 162:sc= -0.0319 (180deg=-0.489) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0.0119 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ -163:sc= -0.0174 (180deg=-0.283) USER MOD Single : A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot 91:sc= 0.903 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 MET CE :methyl 147:sc= 0 (180deg=-0.0241) USER MOD Single : A 147 SER OG : rot -130:sc= -0.0179 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 16 N ALA A 82 35.522 -0.623 -6.699 1.00 0.00 N ATOM 17 CA ALA A 82 35.289 -1.935 -6.130 1.00 0.00 C ATOM 18 C ALA A 82 33.823 -2.087 -5.744 1.00 0.00 C ATOM 19 O ALA A 82 33.405 -1.678 -4.667 1.00 0.00 O ATOM 20 CB ALA A 82 36.166 -2.130 -4.897 1.00 0.00 C ATOM 0 HA ALA A 82 35.541 -2.690 -6.875 1.00 0.00 H new ATOM 0 HB1 ALA A 82 35.985 -3.118 -4.475 1.00 0.00 H new ATOM 0 HB2 ALA A 82 37.215 -2.042 -5.179 1.00 0.00 H new ATOM 0 HB3 ALA A 82 35.925 -1.369 -4.155 1.00 0.00 H new ATOM 26 N TYR A 83 33.054 -2.693 -6.626 1.00 0.00 N ATOM 27 CA TYR A 83 31.630 -2.912 -6.378 1.00 0.00 C ATOM 28 C TYR A 83 31.424 -3.467 -4.974 1.00 0.00 C ATOM 29 O TYR A 83 30.318 -3.442 -4.439 1.00 0.00 O ATOM 30 CB TYR A 83 31.057 -3.899 -7.409 1.00 0.00 C ATOM 31 CG TYR A 83 31.709 -3.662 -8.753 1.00 0.00 C ATOM 32 CD1 TYR A 83 31.797 -2.364 -9.272 1.00 0.00 C ATOM 33 CD2 TYR A 83 32.229 -4.741 -9.479 1.00 0.00 C ATOM 34 CE1 TYR A 83 32.403 -2.147 -10.513 1.00 0.00 C ATOM 35 CE2 TYR A 83 32.834 -4.523 -10.721 1.00 0.00 C ATOM 36 CZ TYR A 83 32.922 -3.225 -11.238 1.00 0.00 C ATOM 37 OH TYR A 83 33.518 -3.011 -12.463 1.00 0.00 O ATOM 0 H TYR A 83 33.385 -3.046 -7.524 1.00 0.00 H new ATOM 0 HA TYR A 83 31.110 -1.958 -6.469 1.00 0.00 H new ATOM 0 HB2 TYR A 83 31.233 -4.924 -7.083 1.00 0.00 H new ATOM 0 HB3 TYR A 83 29.977 -3.771 -7.489 1.00 0.00 H new ATOM 0 HD1 TYR A 83 31.397 -1.531 -8.713 1.00 0.00 H new ATOM 0 HD2 TYR A 83 32.163 -5.742 -9.079 1.00 0.00 H new ATOM 0 HE1 TYR A 83 32.471 -1.146 -10.913 1.00 0.00 H new ATOM 0 HE2 TYR A 83 33.233 -5.356 -11.281 1.00 0.00 H new ATOM 0 HH TYR A 83 33.825 -3.866 -12.831 1.00 0.00 H new ATOM 47 N LYS A 84 32.504 -3.954 -4.380 1.00 0.00 N ATOM 48 CA LYS A 84 32.434 -4.507 -3.027 1.00 0.00 C ATOM 49 C LYS A 84 32.076 -3.409 -2.033 1.00 0.00 C ATOM 50 O LYS A 84 31.272 -3.611 -1.121 1.00 0.00 O ATOM 51 CB LYS A 84 33.773 -5.138 -2.647 1.00 0.00 C ATOM 52 CG LYS A 84 34.027 -6.361 -3.532 1.00 0.00 C ATOM 53 CD LYS A 84 35.398 -6.954 -3.203 1.00 0.00 C ATOM 54 CE LYS A 84 35.674 -8.145 -4.121 1.00 0.00 C ATOM 55 NZ LYS A 84 34.639 -9.193 -3.899 1.00 0.00 N1+ ATOM 0 H LYS A 84 33.431 -3.980 -4.804 1.00 0.00 H new ATOM 0 HA LYS A 84 31.662 -5.276 -3.001 1.00 0.00 H new ATOM 0 HB2 LYS A 84 34.577 -4.413 -2.770 1.00 0.00 H new ATOM 0 HB3 LYS A 84 33.765 -5.430 -1.597 1.00 0.00 H new ATOM 0 HG2 LYS A 84 33.249 -7.107 -3.372 1.00 0.00 H new ATOM 0 HG3 LYS A 84 33.985 -6.077 -4.584 1.00 0.00 H new ATOM 0 HD2 LYS A 84 36.173 -6.198 -3.329 1.00 0.00 H new ATOM 0 HD3 LYS A 84 35.428 -7.271 -2.160 1.00 0.00 H new ATOM 0 HE2 LYS A 84 35.665 -7.825 -5.163 1.00 0.00 H new ATOM 0 HE3 LYS A 84 36.666 -8.550 -3.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 35.097 -10.125 -3.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 34.129 -8.995 -3.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 33.968 -9.192 -4.693 1.00 0.00 H new ATOM 69 N ASN A 85 32.693 -2.245 -2.210 1.00 0.00 N ATOM 70 CA ASN A 85 32.433 -1.118 -1.310 1.00 0.00 C ATOM 71 C ASN A 85 30.980 -0.675 -1.417 1.00 0.00 C ATOM 72 O ASN A 85 30.314 -0.449 -0.407 1.00 0.00 O ATOM 73 CB ASN A 85 33.355 0.056 -1.661 1.00 0.00 C ATOM 74 CG ASN A 85 34.762 -0.207 -1.133 1.00 0.00 C ATOM 75 OD1 ASN A 85 34.948 -1.039 -0.245 1.00 0.00 O ATOM 76 ND2 ASN A 85 35.769 0.455 -1.630 1.00 0.00 N ATOM 0 H ASN A 85 33.365 -2.055 -2.953 1.00 0.00 H new ATOM 0 HA ASN A 85 32.630 -1.440 -0.287 1.00 0.00 H new ATOM 0 HB2 ASN A 85 33.384 0.196 -2.742 1.00 0.00 H new ATOM 0 HB3 ASN A 85 32.963 0.978 -1.231 1.00 0.00 H new ATOM 0 HD21 ASN A 85 36.713 0.284 -1.283 1.00 0.00 H new ATOM 0 HD22 ASN A 85 35.613 1.144 -2.366 1.00 0.00 H new ATOM 83 N LEU A 86 30.497 -0.552 -2.644 1.00 0.00 N ATOM 84 CA LEU A 86 29.124 -0.130 -2.868 1.00 0.00 C ATOM 85 C LEU A 86 28.146 -1.129 -2.264 1.00 0.00 C ATOM 86 O LEU A 86 27.143 -0.746 -1.664 1.00 0.00 O ATOM 87 CB LEU A 86 28.863 0.001 -4.364 1.00 0.00 C ATOM 88 CG LEU A 86 27.415 0.496 -4.608 1.00 0.00 C ATOM 89 CD1 LEU A 86 27.402 1.538 -5.732 1.00 0.00 C ATOM 90 CD2 LEU A 86 26.522 -0.687 -5.008 1.00 0.00 C ATOM 0 H LEU A 86 31.031 -0.737 -3.493 1.00 0.00 H new ATOM 0 HA LEU A 86 28.977 0.836 -2.384 1.00 0.00 H new ATOM 0 HB2 LEU A 86 29.574 0.699 -4.806 1.00 0.00 H new ATOM 0 HB3 LEU A 86 29.015 -0.961 -4.854 1.00 0.00 H new ATOM 0 HG LEU A 86 27.037 0.946 -3.690 1.00 0.00 H new ATOM 0 HD11 LEU A 86 26.381 1.881 -5.898 1.00 0.00 H new ATOM 0 HD12 LEU A 86 28.028 2.385 -5.451 1.00 0.00 H new ATOM 0 HD13 LEU A 86 27.788 1.090 -6.648 1.00 0.00 H new ATOM 0 HD21 LEU A 86 25.505 -0.334 -5.178 1.00 0.00 H new ATOM 0 HD22 LEU A 86 26.907 -1.141 -5.922 1.00 0.00 H new ATOM 0 HD23 LEU A 86 26.520 -1.428 -4.208 1.00 0.00 H new ATOM 102 N LEU A 87 28.440 -2.409 -2.431 1.00 0.00 N ATOM 103 CA LEU A 87 27.575 -3.455 -1.905 1.00 0.00 C ATOM 104 C LEU A 87 27.394 -3.279 -0.404 1.00 0.00 C ATOM 105 O LEU A 87 26.315 -3.529 0.134 1.00 0.00 O ATOM 106 CB LEU A 87 28.187 -4.832 -2.195 1.00 0.00 C ATOM 107 CG LEU A 87 27.928 -5.208 -3.657 1.00 0.00 C ATOM 108 CD1 LEU A 87 28.798 -6.412 -4.036 1.00 0.00 C ATOM 109 CD2 LEU A 87 26.441 -5.562 -3.862 1.00 0.00 C ATOM 0 H LEU A 87 29.266 -2.748 -2.924 1.00 0.00 H new ATOM 0 HA LEU A 87 26.602 -3.385 -2.390 1.00 0.00 H new ATOM 0 HB2 LEU A 87 29.259 -4.814 -1.997 1.00 0.00 H new ATOM 0 HB3 LEU A 87 27.753 -5.581 -1.533 1.00 0.00 H new ATOM 0 HG LEU A 87 28.179 -4.358 -4.291 1.00 0.00 H new ATOM 0 HD11 LEU A 87 28.614 -6.680 -5.076 1.00 0.00 H new ATOM 0 HD12 LEU A 87 29.850 -6.156 -3.907 1.00 0.00 H new ATOM 0 HD13 LEU A 87 28.549 -7.257 -3.394 1.00 0.00 H new ATOM 0 HD21 LEU A 87 26.271 -5.827 -4.905 1.00 0.00 H new ATOM 0 HD22 LEU A 87 26.177 -6.406 -3.225 1.00 0.00 H new ATOM 0 HD23 LEU A 87 25.823 -4.703 -3.601 1.00 0.00 H new ATOM 121 N GLN A 88 28.454 -2.860 0.266 1.00 0.00 N ATOM 122 CA GLN A 88 28.398 -2.650 1.706 1.00 0.00 C ATOM 123 C GLN A 88 27.572 -1.410 2.031 1.00 0.00 C ATOM 124 O GLN A 88 26.921 -1.347 3.075 1.00 0.00 O ATOM 125 CB GLN A 88 29.809 -2.485 2.270 1.00 0.00 C ATOM 126 CG GLN A 88 30.571 -3.802 2.124 1.00 0.00 C ATOM 127 CD GLN A 88 31.987 -3.648 2.667 1.00 0.00 C ATOM 128 OE1 GLN A 88 32.761 -2.830 2.167 1.00 0.00 O ATOM 129 NE2 GLN A 88 32.377 -4.393 3.666 1.00 0.00 N ATOM 0 H GLN A 88 29.359 -2.659 -0.159 1.00 0.00 H new ATOM 0 HA GLN A 88 27.927 -3.521 2.162 1.00 0.00 H new ATOM 0 HB2 GLN A 88 30.333 -1.688 1.742 1.00 0.00 H new ATOM 0 HB3 GLN A 88 29.761 -2.194 3.319 1.00 0.00 H new ATOM 0 HG2 GLN A 88 30.051 -4.594 2.662 1.00 0.00 H new ATOM 0 HG3 GLN A 88 30.605 -4.098 1.075 1.00 0.00 H new ATOM 0 HE21 GLN A 88 31.735 -5.070 4.079 1.00 0.00 H new ATOM 0 HE22 GLN A 88 33.324 -4.298 4.034 1.00 0.00 H new ATOM 138 N GLU A 89 27.621 -0.414 1.144 1.00 0.00 N ATOM 139 CA GLU A 89 26.883 0.825 1.371 1.00 0.00 C ATOM 140 C GLU A 89 25.381 0.577 1.364 1.00 0.00 C ATOM 141 O GLU A 89 24.659 1.051 2.239 1.00 0.00 O ATOM 142 CB GLU A 89 27.238 1.838 0.282 1.00 0.00 C ATOM 143 CG GLU A 89 28.685 2.302 0.454 1.00 0.00 C ATOM 144 CD GLU A 89 28.816 3.142 1.719 1.00 0.00 C ATOM 145 OE1 GLU A 89 27.805 3.654 2.172 1.00 0.00 O ATOM 146 OE2 GLU A 89 29.924 3.269 2.213 1.00 0.00 O1- ATOM 0 H GLU A 89 28.156 -0.441 0.276 1.00 0.00 H new ATOM 0 HA GLU A 89 27.162 1.217 2.349 1.00 0.00 H new ATOM 0 HB2 GLU A 89 27.106 1.388 -0.702 1.00 0.00 H new ATOM 0 HB3 GLU A 89 26.564 2.693 0.335 1.00 0.00 H new ATOM 0 HG2 GLU A 89 29.348 1.439 0.510 1.00 0.00 H new ATOM 0 HG3 GLU A 89 28.994 2.885 -0.413 1.00 0.00 H new ATOM 153 N ILE A 90 24.916 -0.168 0.373 1.00 0.00 N ATOM 154 CA ILE A 90 23.493 -0.471 0.258 1.00 0.00 C ATOM 155 C ILE A 90 23.028 -1.327 1.430 1.00 0.00 C ATOM 156 O ILE A 90 21.968 -1.084 2.007 1.00 0.00 O ATOM 157 CB ILE A 90 23.220 -1.197 -1.067 1.00 0.00 C ATOM 158 CG1 ILE A 90 24.184 -2.378 -1.212 1.00 0.00 C ATOM 159 CG2 ILE A 90 23.422 -0.232 -2.234 1.00 0.00 C ATOM 160 CD1 ILE A 90 23.891 -3.127 -2.508 1.00 0.00 C ATOM 0 H ILE A 90 25.497 -0.573 -0.361 1.00 0.00 H new ATOM 0 HA ILE A 90 22.936 0.466 0.275 1.00 0.00 H new ATOM 0 HB ILE A 90 22.193 -1.561 -1.072 1.00 0.00 H new ATOM 0 HG12 ILE A 90 25.214 -2.021 -1.212 1.00 0.00 H new ATOM 0 HG13 ILE A 90 24.080 -3.051 -0.361 1.00 0.00 H new ATOM 0 HG21 ILE A 90 23.227 -0.751 -3.173 1.00 0.00 H new ATOM 0 HG22 ILE A 90 22.735 0.608 -2.134 1.00 0.00 H new ATOM 0 HG23 ILE A 90 24.448 0.136 -2.229 1.00 0.00 H new ATOM 0 HD11 ILE A 90 24.579 -3.966 -2.607 1.00 0.00 H new ATOM 0 HD12 ILE A 90 22.866 -3.498 -2.490 1.00 0.00 H new ATOM 0 HD13 ILE A 90 24.018 -2.452 -3.355 1.00 0.00 H new ATOM 172 N ALA A 91 23.820 -2.338 1.767 1.00 0.00 N ATOM 173 CA ALA A 91 23.474 -3.231 2.862 1.00 0.00 C ATOM 174 C ALA A 91 23.546 -2.496 4.194 1.00 0.00 C ATOM 175 O ALA A 91 22.633 -2.585 5.014 1.00 0.00 O ATOM 176 CB ALA A 91 24.430 -4.426 2.882 1.00 0.00 C ATOM 0 H ALA A 91 24.700 -2.558 1.300 1.00 0.00 H new ATOM 0 HA ALA A 91 22.454 -3.585 2.711 1.00 0.00 H new ATOM 0 HB1 ALA A 91 24.165 -5.090 3.704 1.00 0.00 H new ATOM 0 HB2 ALA A 91 24.355 -4.968 1.939 1.00 0.00 H new ATOM 0 HB3 ALA A 91 25.452 -4.072 3.017 1.00 0.00 H new ATOM 182 N GLN A 92 24.641 -1.773 4.404 1.00 0.00 N ATOM 183 CA GLN A 92 24.825 -1.029 5.643 1.00 0.00 C ATOM 184 C GLN A 92 23.779 0.073 5.770 1.00 0.00 C ATOM 185 O GLN A 92 23.168 0.242 6.824 1.00 0.00 O ATOM 186 CB GLN A 92 26.226 -0.411 5.678 1.00 0.00 C ATOM 187 CG GLN A 92 26.430 0.319 7.008 1.00 0.00 C ATOM 188 CD GLN A 92 27.870 0.809 7.119 1.00 0.00 C ATOM 189 OE1 GLN A 92 28.749 0.320 6.409 1.00 0.00 O ATOM 190 NE2 GLN A 92 28.164 1.753 7.970 1.00 0.00 N ATOM 0 H GLN A 92 25.408 -1.687 3.738 1.00 0.00 H new ATOM 0 HA GLN A 92 24.710 -1.720 6.478 1.00 0.00 H new ATOM 0 HB2 GLN A 92 26.981 -1.188 5.558 1.00 0.00 H new ATOM 0 HB3 GLN A 92 26.349 0.284 4.847 1.00 0.00 H new ATOM 0 HG2 GLN A 92 25.744 1.163 7.078 1.00 0.00 H new ATOM 0 HG3 GLN A 92 26.200 -0.349 7.838 1.00 0.00 H new ATOM 0 HE21 GLN A 92 27.434 2.156 8.557 1.00 0.00 H new ATOM 0 HE22 GLN A 92 29.124 2.088 8.049 1.00 0.00 H new ATOM 199 N LYS A 93 23.579 0.818 4.689 1.00 0.00 N ATOM 200 CA LYS A 93 22.605 1.902 4.693 1.00 0.00 C ATOM 201 C LYS A 93 21.204 1.365 4.953 1.00 0.00 C ATOM 202 O LYS A 93 20.467 1.902 5.777 1.00 0.00 O ATOM 203 CB LYS A 93 22.632 2.634 3.348 1.00 0.00 C ATOM 204 CG LYS A 93 21.692 3.839 3.403 1.00 0.00 C ATOM 205 CD LYS A 93 21.810 4.638 2.102 1.00 0.00 C ATOM 206 CE LYS A 93 20.886 5.855 2.165 1.00 0.00 C ATOM 207 NZ LYS A 93 19.467 5.399 2.176 1.00 0.00 N1+ ATOM 0 H LYS A 93 24.074 0.693 3.806 1.00 0.00 H new ATOM 0 HA LYS A 93 22.868 2.597 5.491 1.00 0.00 H new ATOM 0 HB2 LYS A 93 23.647 2.961 3.120 1.00 0.00 H new ATOM 0 HB3 LYS A 93 22.328 1.959 2.548 1.00 0.00 H new ATOM 0 HG2 LYS A 93 20.664 3.506 3.546 1.00 0.00 H new ATOM 0 HG3 LYS A 93 21.943 4.471 4.255 1.00 0.00 H new ATOM 0 HD2 LYS A 93 22.841 4.958 1.952 1.00 0.00 H new ATOM 0 HD3 LYS A 93 21.544 4.010 1.252 1.00 0.00 H new ATOM 0 HE2 LYS A 93 21.098 6.441 3.059 1.00 0.00 H new ATOM 0 HE3 LYS A 93 21.064 6.505 1.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 18.847 6.186 1.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 19.350 4.613 1.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 19.212 5.079 3.132 1.00 0.00 H new ATOM 221 N GLU A 94 20.840 0.300 4.243 1.00 0.00 N ATOM 222 CA GLU A 94 19.520 -0.303 4.405 1.00 0.00 C ATOM 223 C GLU A 94 19.572 -1.427 5.431 1.00 0.00 C ATOM 224 O GLU A 94 18.603 -2.167 5.600 1.00 0.00 O ATOM 225 CB GLU A 94 19.036 -0.858 3.063 1.00 0.00 C ATOM 226 CG GLU A 94 18.888 0.289 2.061 1.00 0.00 C ATOM 227 CD GLU A 94 17.763 1.223 2.496 1.00 0.00 C ATOM 228 OE1 GLU A 94 16.917 0.784 3.256 1.00 0.00 O ATOM 229 OE2 GLU A 94 17.769 2.365 2.066 1.00 0.00 O1- ATOM 0 H GLU A 94 21.436 -0.160 3.555 1.00 0.00 H new ATOM 0 HA GLU A 94 18.827 0.463 4.754 1.00 0.00 H new ATOM 0 HB2 GLU A 94 19.744 -1.596 2.686 1.00 0.00 H new ATOM 0 HB3 GLU A 94 18.082 -1.369 3.191 1.00 0.00 H new ATOM 0 HG2 GLU A 94 19.824 0.843 1.990 1.00 0.00 H new ATOM 0 HG3 GLU A 94 18.677 -0.110 1.069 1.00 0.00 H new ATOM 236 N SER A 95 20.708 -1.555 6.115 1.00 0.00 N ATOM 237 CA SER A 95 20.875 -2.598 7.123 1.00 0.00 C ATOM 238 C SER A 95 20.267 -3.911 6.639 1.00 0.00 C ATOM 239 O SER A 95 19.588 -4.608 7.393 1.00 0.00 O ATOM 240 CB SER A 95 20.201 -2.173 8.431 1.00 0.00 C ATOM 241 OG SER A 95 18.929 -1.608 8.141 1.00 0.00 O ATOM 0 H SER A 95 21.522 -0.953 5.990 1.00 0.00 H new ATOM 0 HA SER A 95 21.941 -2.745 7.295 1.00 0.00 H new ATOM 0 HB2 SER A 95 20.088 -3.033 9.092 1.00 0.00 H new ATOM 0 HB3 SER A 95 20.823 -1.448 8.955 1.00 0.00 H new ATOM 0 HG SER A 95 18.416 -2.227 7.580 1.00 0.00 H new ATOM 247 N SER A 96 20.504 -4.235 5.372 1.00 0.00 N ATOM 248 CA SER A 96 19.968 -5.459 4.792 1.00 0.00 C ATOM 249 C SER A 96 20.963 -6.592 4.915 1.00 0.00 C ATOM 250 O SER A 96 21.111 -7.377 3.982 1.00 0.00 O ATOM 251 CB SER A 96 19.625 -5.240 3.320 1.00 0.00 C ATOM 252 OG SER A 96 20.808 -5.344 2.540 1.00 0.00 O ATOM 0 H SER A 96 21.061 -3.670 4.731 1.00 0.00 H new ATOM 0 HA SER A 96 19.063 -5.724 5.339 1.00 0.00 H new ATOM 0 HB2 SER A 96 18.894 -5.978 2.992 1.00 0.00 H new ATOM 0 HB3 SER A 96 19.171 -4.259 3.183 1.00 0.00 H new ATOM 0 HG SER A 96 21.119 -6.273 2.540 1.00 0.00 H new ATOM 258 N LEU A 97 21.655 -6.665 6.056 1.00 0.00 N ATOM 259 CA LEU A 97 22.638 -7.715 6.286 1.00 0.00 C ATOM 260 C LEU A 97 23.854 -7.524 5.395 1.00 0.00 C ATOM 261 O LEU A 97 23.831 -7.872 4.218 1.00 0.00 O ATOM 262 CB LEU A 97 22.012 -9.089 6.021 1.00 0.00 C ATOM 263 CG LEU A 97 20.685 -9.203 6.784 1.00 0.00 C ATOM 264 CD1 LEU A 97 20.025 -10.541 6.452 1.00 0.00 C ATOM 265 CD2 LEU A 97 20.950 -9.117 8.293 1.00 0.00 C ATOM 0 H LEU A 97 21.549 -6.009 6.830 1.00 0.00 H new ATOM 0 HA LEU A 97 22.959 -7.659 7.326 1.00 0.00 H new ATOM 0 HB2 LEU A 97 21.842 -9.223 4.953 1.00 0.00 H new ATOM 0 HB3 LEU A 97 22.694 -9.878 6.337 1.00 0.00 H new ATOM 0 HG LEU A 97 20.023 -8.388 6.490 1.00 0.00 H new ATOM 0 HD11 LEU A 97 19.082 -10.626 6.992 1.00 0.00 H new ATOM 0 HD12 LEU A 97 19.835 -10.597 5.380 1.00 0.00 H new ATOM 0 HD13 LEU A 97 20.686 -11.356 6.747 1.00 0.00 H new ATOM 0 HD21 LEU A 97 20.007 -9.198 8.833 1.00 0.00 H new ATOM 0 HD22 LEU A 97 21.611 -9.930 8.593 1.00 0.00 H new ATOM 0 HD23 LEU A 97 21.421 -8.162 8.526 1.00 0.00 H new ATOM 277 N LEU A 98 24.920 -6.971 5.966 1.00 0.00 N ATOM 278 CA LEU A 98 26.140 -6.743 5.212 1.00 0.00 C ATOM 279 C LEU A 98 26.491 -7.969 4.370 1.00 0.00 C ATOM 280 O LEU A 98 26.108 -9.092 4.701 1.00 0.00 O ATOM 281 CB LEU A 98 27.303 -6.424 6.174 1.00 0.00 C ATOM 282 CG LEU A 98 27.373 -4.915 6.416 1.00 0.00 C ATOM 283 CD1 LEU A 98 26.048 -4.433 7.009 1.00 0.00 C ATOM 284 CD2 LEU A 98 28.511 -4.609 7.387 1.00 0.00 C ATOM 0 H LEU A 98 24.960 -6.676 6.941 1.00 0.00 H new ATOM 0 HA LEU A 98 25.978 -5.896 4.546 1.00 0.00 H new ATOM 0 HB2 LEU A 98 27.160 -6.947 7.119 1.00 0.00 H new ATOM 0 HB3 LEU A 98 28.244 -6.779 5.753 1.00 0.00 H new ATOM 0 HG LEU A 98 27.555 -4.401 5.472 1.00 0.00 H new ATOM 0 HD11 LEU A 98 26.096 -3.358 7.182 1.00 0.00 H new ATOM 0 HD12 LEU A 98 25.237 -4.653 6.314 1.00 0.00 H new ATOM 0 HD13 LEU A 98 25.865 -4.945 7.954 1.00 0.00 H new ATOM 0 HD21 LEU A 98 28.562 -3.534 7.560 1.00 0.00 H new ATOM 0 HD22 LEU A 98 28.330 -5.121 8.332 1.00 0.00 H new ATOM 0 HD23 LEU A 98 29.454 -4.953 6.962 1.00 0.00 H new ATOM 296 N PRO A 99 27.219 -7.769 3.305 1.00 0.00 N ATOM 297 CA PRO A 99 27.644 -8.873 2.399 1.00 0.00 C ATOM 298 C PRO A 99 28.579 -9.853 3.097 1.00 0.00 C ATOM 299 O PRO A 99 29.060 -9.591 4.200 1.00 0.00 O ATOM 300 CB PRO A 99 28.348 -8.154 1.234 1.00 0.00 C ATOM 301 CG PRO A 99 28.760 -6.827 1.786 1.00 0.00 C ATOM 302 CD PRO A 99 27.718 -6.461 2.835 1.00 0.00 C ATOM 0 HA PRO A 99 26.801 -9.479 2.067 1.00 0.00 H new ATOM 0 HB2 PRO A 99 29.211 -8.721 0.885 1.00 0.00 H new ATOM 0 HB3 PRO A 99 27.679 -8.036 0.382 1.00 0.00 H new ATOM 0 HG2 PRO A 99 29.755 -6.881 2.228 1.00 0.00 H new ATOM 0 HG3 PRO A 99 28.801 -6.074 0.999 1.00 0.00 H new ATOM 0 HD2 PRO A 99 28.155 -5.883 3.649 1.00 0.00 H new ATOM 0 HD3 PRO A 99 26.917 -5.856 2.410 1.00 0.00 H new ATOM 310 N PHE A 100 28.849 -10.976 2.436 1.00 0.00 N ATOM 311 CA PHE A 100 29.750 -11.981 2.994 1.00 0.00 C ATOM 312 C PHE A 100 30.556 -12.647 1.886 1.00 0.00 C ATOM 313 O PHE A 100 29.997 -13.310 1.013 1.00 0.00 O ATOM 314 CB PHE A 100 28.941 -13.031 3.749 1.00 0.00 C ATOM 315 CG PHE A 100 29.860 -13.849 4.623 1.00 0.00 C ATOM 316 CD1 PHE A 100 30.247 -13.358 5.875 1.00 0.00 C ATOM 317 CD2 PHE A 100 30.324 -15.092 4.182 1.00 0.00 C ATOM 318 CE1 PHE A 100 31.100 -14.113 6.687 1.00 0.00 C ATOM 319 CE2 PHE A 100 31.178 -15.846 4.992 1.00 0.00 C ATOM 320 CZ PHE A 100 31.565 -15.357 6.247 1.00 0.00 C ATOM 0 H PHE A 100 28.461 -11.212 1.522 1.00 0.00 H new ATOM 0 HA PHE A 100 30.441 -11.492 3.681 1.00 0.00 H new ATOM 0 HB2 PHE A 100 28.178 -12.547 4.359 1.00 0.00 H new ATOM 0 HB3 PHE A 100 28.421 -13.680 3.044 1.00 0.00 H new ATOM 0 HD1 PHE A 100 29.888 -12.398 6.214 1.00 0.00 H new ATOM 0 HD2 PHE A 100 30.023 -15.469 3.216 1.00 0.00 H new ATOM 0 HE1 PHE A 100 31.400 -13.736 7.654 1.00 0.00 H new ATOM 0 HE2 PHE A 100 31.539 -16.805 4.651 1.00 0.00 H new ATOM 0 HZ PHE A 100 32.222 -15.941 6.875 1.00 0.00 H new ATOM 330 N TYR A 101 31.875 -12.474 1.927 1.00 0.00 N ATOM 331 CA TYR A 101 32.747 -13.068 0.915 1.00 0.00 C ATOM 332 C TYR A 101 33.363 -14.357 1.440 1.00 0.00 C ATOM 333 O TYR A 101 33.888 -14.400 2.554 1.00 0.00 O ATOM 334 CB TYR A 101 33.859 -12.084 0.546 1.00 0.00 C ATOM 335 CG TYR A 101 33.250 -10.844 -0.062 1.00 0.00 C ATOM 336 CD1 TYR A 101 32.862 -10.842 -1.408 1.00 0.00 C ATOM 337 CD2 TYR A 101 33.072 -9.696 0.718 1.00 0.00 C ATOM 338 CE1 TYR A 101 32.295 -9.693 -1.971 1.00 0.00 C ATOM 339 CE2 TYR A 101 32.505 -8.545 0.155 1.00 0.00 C ATOM 340 CZ TYR A 101 32.119 -8.545 -1.190 1.00 0.00 C ATOM 341 OH TYR A 101 31.560 -7.411 -1.745 1.00 0.00 O ATOM 0 H TYR A 101 32.361 -11.933 2.642 1.00 0.00 H new ATOM 0 HA TYR A 101 32.152 -13.293 0.030 1.00 0.00 H new ATOM 0 HB2 TYR A 101 34.436 -11.822 1.432 1.00 0.00 H new ATOM 0 HB3 TYR A 101 34.550 -12.546 -0.159 1.00 0.00 H new ATOM 0 HD1 TYR A 101 33.000 -11.727 -2.011 1.00 0.00 H new ATOM 0 HD2 TYR A 101 33.372 -9.697 1.755 1.00 0.00 H new ATOM 0 HE1 TYR A 101 31.993 -9.692 -3.008 1.00 0.00 H new ATOM 0 HE2 TYR A 101 32.366 -7.660 0.758 1.00 0.00 H new ATOM 0 HH TYR A 101 31.508 -6.706 -1.066 1.00 0.00 H new ATOM 351 N ALA A 102 33.302 -15.410 0.631 1.00 0.00 N ATOM 352 CA ALA A 102 33.862 -16.703 1.022 1.00 0.00 C ATOM 353 C ALA A 102 34.520 -17.376 -0.170 1.00 0.00 C ATOM 354 O ALA A 102 34.035 -17.279 -1.296 1.00 0.00 O ATOM 355 CB ALA A 102 32.756 -17.604 1.571 1.00 0.00 C ATOM 0 H ALA A 102 32.873 -15.396 -0.295 1.00 0.00 H new ATOM 0 HA ALA A 102 34.613 -16.538 1.795 1.00 0.00 H new ATOM 0 HB1 ALA A 102 33.180 -18.566 1.860 1.00 0.00 H new ATOM 0 HB2 ALA A 102 32.300 -17.132 2.441 1.00 0.00 H new ATOM 0 HB3 ALA A 102 31.998 -17.758 0.803 1.00 0.00 H new ATOM 361 N THR A 103 35.632 -18.063 0.083 1.00 0.00 N ATOM 362 CA THR A 103 36.360 -18.758 -0.980 1.00 0.00 C ATOM 363 C THR A 103 36.497 -20.237 -0.647 1.00 0.00 C ATOM 364 O THR A 103 36.942 -20.600 0.442 1.00 0.00 O ATOM 365 CB THR A 103 37.748 -18.143 -1.153 1.00 0.00 C ATOM 366 OG1 THR A 103 37.612 -16.773 -1.504 1.00 0.00 O ATOM 367 CG2 THR A 103 38.498 -18.882 -2.261 1.00 0.00 C ATOM 0 H THR A 103 36.048 -18.154 1.010 1.00 0.00 H new ATOM 0 HA THR A 103 35.800 -18.653 -1.909 1.00 0.00 H new ATOM 0 HB THR A 103 38.306 -18.228 -0.220 1.00 0.00 H new ATOM 0 HG1 THR A 103 38.500 -16.374 -1.615 1.00 0.00 H new ATOM 0 HG21 THR A 103 39.488 -18.444 -2.385 1.00 0.00 H new ATOM 0 HG22 THR A 103 38.598 -19.934 -1.994 1.00 0.00 H new ATOM 0 HG23 THR A 103 37.944 -18.796 -3.196 1.00 0.00 H new ATOM 375 N ALA A 104 36.118 -21.095 -1.595 1.00 0.00 N ATOM 376 CA ALA A 104 36.209 -22.539 -1.393 1.00 0.00 C ATOM 377 C ALA A 104 37.380 -23.109 -2.181 1.00 0.00 C ATOM 378 O ALA A 104 37.567 -22.773 -3.349 1.00 0.00 O ATOM 379 CB ALA A 104 34.912 -23.209 -1.850 1.00 0.00 C ATOM 0 H ALA A 104 35.748 -20.817 -2.504 1.00 0.00 H new ATOM 0 HA ALA A 104 36.366 -22.735 -0.332 1.00 0.00 H new ATOM 0 HB1 ALA A 104 34.985 -24.286 -1.697 1.00 0.00 H new ATOM 0 HB2 ALA A 104 34.076 -22.816 -1.271 1.00 0.00 H new ATOM 0 HB3 ALA A 104 34.749 -23.003 -2.908 1.00 0.00 H new ATOM 385 N THR A 105 38.171 -23.972 -1.538 1.00 0.00 N ATOM 386 CA THR A 105 39.318 -24.586 -2.185 1.00 0.00 C ATOM 387 C THR A 105 39.119 -26.092 -2.305 1.00 0.00 C ATOM 388 O THR A 105 38.890 -26.781 -1.310 1.00 0.00 O ATOM 389 CB THR A 105 40.574 -24.294 -1.370 1.00 0.00 C ATOM 390 OG1 THR A 105 40.336 -24.571 0.001 1.00 0.00 O ATOM 391 CG2 THR A 105 40.972 -22.826 -1.538 1.00 0.00 C ATOM 0 H THR A 105 38.032 -24.257 -0.569 1.00 0.00 H new ATOM 0 HA THR A 105 39.425 -24.170 -3.187 1.00 0.00 H new ATOM 0 HB THR A 105 41.385 -24.929 -1.727 1.00 0.00 H new ATOM 0 HG1 THR A 105 39.854 -25.420 0.084 1.00 0.00 H new ATOM 0 HG21 THR A 105 41.870 -22.623 -0.954 1.00 0.00 H new ATOM 0 HG22 THR A 105 41.170 -22.621 -2.590 1.00 0.00 H new ATOM 0 HG23 THR A 105 40.160 -22.187 -1.190 1.00 0.00 H new ATOM 399 N SER A 106 39.207 -26.597 -3.532 1.00 0.00 N ATOM 400 CA SER A 106 39.036 -28.023 -3.770 1.00 0.00 C ATOM 401 C SER A 106 39.485 -28.382 -5.179 1.00 0.00 C ATOM 402 O SER A 106 39.421 -27.557 -6.089 1.00 0.00 O ATOM 403 CB SER A 106 37.568 -28.411 -3.588 1.00 0.00 C ATOM 404 OG SER A 106 37.429 -29.816 -3.759 1.00 0.00 O ATOM 0 H SER A 106 39.394 -26.044 -4.369 1.00 0.00 H new ATOM 0 HA SER A 106 39.647 -28.570 -3.052 1.00 0.00 H new ATOM 0 HB2 SER A 106 37.223 -28.118 -2.597 1.00 0.00 H new ATOM 0 HB3 SER A 106 36.948 -27.882 -4.311 1.00 0.00 H new ATOM 0 HG SER A 106 36.489 -30.068 -3.641 1.00 0.00 H new ATOM 410 N GLY A 107 39.931 -29.622 -5.358 1.00 0.00 N ATOM 411 CA GLY A 107 40.384 -30.087 -6.666 1.00 0.00 C ATOM 412 C GLY A 107 41.719 -30.809 -6.554 1.00 0.00 C ATOM 413 O GLY A 107 42.388 -30.750 -5.525 1.00 0.00 O ATOM 0 H GLY A 107 39.989 -30.321 -4.617 1.00 0.00 H new ATOM 0 HA2 GLY A 107 39.639 -30.756 -7.096 1.00 0.00 H new ATOM 0 HA3 GLY A 107 40.480 -29.239 -7.344 1.00 0.00 H new ATOM 417 N PRO A 108 42.120 -31.472 -7.602 1.00 0.00 N ATOM 418 CA PRO A 108 43.413 -32.217 -7.642 1.00 0.00 C ATOM 419 C PRO A 108 44.614 -31.295 -7.447 1.00 0.00 C ATOM 420 O PRO A 108 44.571 -30.118 -7.805 1.00 0.00 O ATOM 421 CB PRO A 108 43.431 -32.849 -9.051 1.00 0.00 C ATOM 422 CG PRO A 108 42.453 -32.056 -9.846 1.00 0.00 C ATOM 423 CD PRO A 108 41.382 -31.592 -8.867 1.00 0.00 C ATOM 0 HA PRO A 108 43.485 -32.951 -6.840 1.00 0.00 H new ATOM 0 HB2 PRO A 108 44.427 -32.802 -9.491 1.00 0.00 H new ATOM 0 HB3 PRO A 108 43.148 -33.901 -9.015 1.00 0.00 H new ATOM 0 HG2 PRO A 108 42.939 -31.205 -10.323 1.00 0.00 H new ATOM 0 HG3 PRO A 108 42.017 -32.661 -10.641 1.00 0.00 H new ATOM 0 HD2 PRO A 108 40.943 -30.641 -9.170 1.00 0.00 H new ATOM 0 HD3 PRO A 108 40.566 -32.310 -8.791 1.00 0.00 H new ATOM 431 N SER A 109 45.688 -31.846 -6.892 1.00 0.00 N ATOM 432 CA SER A 109 46.900 -31.070 -6.667 1.00 0.00 C ATOM 433 C SER A 109 47.506 -30.640 -7.998 1.00 0.00 C ATOM 434 O SER A 109 48.328 -29.723 -8.049 1.00 0.00 O ATOM 435 CB SER A 109 47.918 -31.902 -5.888 1.00 0.00 C ATOM 436 OG SER A 109 47.266 -32.536 -4.796 1.00 0.00 O ATOM 0 H SER A 109 45.744 -32.819 -6.592 1.00 0.00 H new ATOM 0 HA SER A 109 46.642 -30.183 -6.089 1.00 0.00 H new ATOM 0 HB2 SER A 109 48.370 -32.649 -6.540 1.00 0.00 H new ATOM 0 HB3 SER A 109 48.725 -31.265 -5.525 1.00 0.00 H new ATOM 0 HG SER A 109 47.915 -33.072 -4.294 1.00 0.00 H new ATOM 442 N HIS A 110 47.091 -31.303 -9.080 1.00 0.00 N ATOM 443 CA HIS A 110 47.600 -30.975 -10.410 1.00 0.00 C ATOM 444 C HIS A 110 46.718 -29.930 -11.073 1.00 0.00 C ATOM 445 O HIS A 110 47.216 -28.992 -11.696 1.00 0.00 O ATOM 446 CB HIS A 110 47.646 -32.230 -11.278 1.00 0.00 C ATOM 447 CG HIS A 110 48.548 -33.246 -10.635 1.00 0.00 C ATOM 448 ND1 HIS A 110 49.900 -33.015 -10.434 1.00 0.00 N ATOM 449 CD2 HIS A 110 48.307 -34.507 -10.146 1.00 0.00 C ATOM 450 CE1 HIS A 110 50.416 -34.110 -9.846 1.00 0.00 C ATOM 451 NE2 HIS A 110 49.488 -35.050 -9.649 1.00 0.00 N ATOM 0 H HIS A 110 46.411 -32.063 -9.061 1.00 0.00 H new ATOM 0 HA HIS A 110 48.607 -30.573 -10.304 1.00 0.00 H new ATOM 0 HB2 HIS A 110 46.643 -32.641 -11.397 1.00 0.00 H new ATOM 0 HB3 HIS A 110 48.010 -31.983 -12.275 1.00 0.00 H new ATOM 0 HD2 HIS A 110 47.347 -35.002 -10.147 1.00 0.00 H new ATOM 0 HE1 HIS A 110 51.454 -34.216 -9.567 1.00 0.00 H new ATOM 0 HE2 HIS A 110 49.617 -35.969 -9.225 1.00 0.00 H new ATOM 459 N ALA A 111 45.401 -30.092 -10.924 1.00 0.00 N ATOM 460 CA ALA A 111 44.445 -29.148 -11.505 1.00 0.00 C ATOM 461 C ALA A 111 43.517 -28.594 -10.420 1.00 0.00 C ATOM 462 O ALA A 111 42.365 -29.007 -10.302 1.00 0.00 O ATOM 463 CB ALA A 111 43.628 -29.841 -12.609 1.00 0.00 C ATOM 0 H ALA A 111 44.975 -30.863 -10.409 1.00 0.00 H new ATOM 0 HA ALA A 111 44.994 -28.316 -11.945 1.00 0.00 H new ATOM 0 HB1 ALA A 111 42.919 -29.132 -13.036 1.00 0.00 H new ATOM 0 HB2 ALA A 111 44.300 -30.197 -13.390 1.00 0.00 H new ATOM 0 HB3 ALA A 111 43.085 -30.686 -12.184 1.00 0.00 H new ATOM 469 N PRO A 112 43.991 -27.663 -9.640 1.00 0.00 N ATOM 470 CA PRO A 112 43.189 -27.042 -8.550 1.00 0.00 C ATOM 471 C PRO A 112 42.176 -26.035 -9.074 1.00 0.00 C ATOM 472 O PRO A 112 42.305 -25.533 -10.192 1.00 0.00 O ATOM 473 CB PRO A 112 44.245 -26.372 -7.664 1.00 0.00 C ATOM 474 CG PRO A 112 45.386 -26.057 -8.583 1.00 0.00 C ATOM 475 CD PRO A 112 45.347 -27.088 -9.715 1.00 0.00 C ATOM 0 HA PRO A 112 42.585 -27.775 -8.014 1.00 0.00 H new ATOM 0 HB2 PRO A 112 43.853 -25.468 -7.199 1.00 0.00 H new ATOM 0 HB3 PRO A 112 44.560 -27.034 -6.858 1.00 0.00 H new ATOM 0 HG2 PRO A 112 45.294 -25.046 -8.979 1.00 0.00 H new ATOM 0 HG3 PRO A 112 46.335 -26.106 -8.050 1.00 0.00 H new ATOM 0 HD2 PRO A 112 45.528 -26.622 -10.684 1.00 0.00 H new ATOM 0 HD3 PRO A 112 46.111 -27.854 -9.582 1.00 0.00 H new ATOM 483 N THR A 113 41.171 -25.735 -8.254 1.00 0.00 N ATOM 484 CA THR A 113 40.146 -24.775 -8.639 1.00 0.00 C ATOM 485 C THR A 113 39.496 -24.168 -7.410 1.00 0.00 C ATOM 486 O THR A 113 39.410 -24.808 -6.365 1.00 0.00 O ATOM 487 CB THR A 113 39.089 -25.461 -9.506 1.00 0.00 C ATOM 488 OG1 THR A 113 38.658 -26.653 -8.858 1.00 0.00 O ATOM 489 CG2 THR A 113 39.681 -25.809 -10.875 1.00 0.00 C ATOM 0 H THR A 113 41.047 -26.141 -7.326 1.00 0.00 H new ATOM 0 HA THR A 113 40.615 -23.976 -9.212 1.00 0.00 H new ATOM 0 HB THR A 113 38.243 -24.788 -9.646 1.00 0.00 H new ATOM 0 HG1 THR A 113 38.951 -26.641 -7.923 1.00 0.00 H new ATOM 0 HG21 THR A 113 38.922 -26.297 -11.486 1.00 0.00 H new ATOM 0 HG22 THR A 113 40.014 -24.897 -11.370 1.00 0.00 H new ATOM 0 HG23 THR A 113 40.529 -26.481 -10.744 1.00 0.00 H new ATOM 497 N PHE A 114 39.035 -22.925 -7.542 1.00 0.00 N ATOM 498 CA PHE A 114 38.389 -22.240 -6.423 1.00 0.00 C ATOM 499 C PHE A 114 37.089 -21.590 -6.879 1.00 0.00 C ATOM 500 O PHE A 114 36.983 -21.114 -8.007 1.00 0.00 O ATOM 501 CB PHE A 114 39.335 -21.158 -5.868 1.00 0.00 C ATOM 502 CG PHE A 114 40.765 -21.551 -6.156 1.00 0.00 C ATOM 503 CD1 PHE A 114 41.363 -22.595 -5.448 1.00 0.00 C ATOM 504 CD2 PHE A 114 41.491 -20.869 -7.133 1.00 0.00 C ATOM 505 CE1 PHE A 114 42.686 -22.960 -5.713 1.00 0.00 C ATOM 506 CE2 PHE A 114 42.808 -21.227 -7.397 1.00 0.00 C ATOM 507 CZ PHE A 114 43.415 -22.272 -6.686 1.00 0.00 C ATOM 0 H PHE A 114 39.095 -22.378 -8.401 1.00 0.00 H new ATOM 0 HA PHE A 114 38.165 -22.970 -5.645 1.00 0.00 H new ATOM 0 HB2 PHE A 114 39.111 -20.194 -6.325 1.00 0.00 H new ATOM 0 HB3 PHE A 114 39.186 -21.044 -4.794 1.00 0.00 H new ATOM 0 HD1 PHE A 114 40.801 -23.123 -4.692 1.00 0.00 H new ATOM 0 HD2 PHE A 114 41.030 -20.063 -7.684 1.00 0.00 H new ATOM 0 HE1 PHE A 114 43.143 -23.772 -5.167 1.00 0.00 H new ATOM 0 HE2 PHE A 114 43.367 -20.697 -8.154 1.00 0.00 H new ATOM 0 HZ PHE A 114 44.440 -22.543 -6.889 1.00 0.00 H new ATOM 517 N THR A 115 36.103 -21.560 -5.986 1.00 0.00 N ATOM 518 CA THR A 115 34.810 -20.947 -6.297 1.00 0.00 C ATOM 519 C THR A 115 34.462 -19.906 -5.239 1.00 0.00 C ATOM 520 O THR A 115 34.365 -20.220 -4.052 1.00 0.00 O ATOM 521 CB THR A 115 33.726 -22.019 -6.344 1.00 0.00 C ATOM 522 OG1 THR A 115 34.059 -22.977 -7.341 1.00 0.00 O ATOM 523 CG2 THR A 115 32.385 -21.370 -6.686 1.00 0.00 C ATOM 0 H THR A 115 36.171 -21.950 -5.046 1.00 0.00 H new ATOM 0 HA THR A 115 34.872 -20.460 -7.270 1.00 0.00 H new ATOM 0 HB THR A 115 33.653 -22.511 -5.374 1.00 0.00 H new ATOM 0 HG1 THR A 115 33.366 -23.669 -7.374 1.00 0.00 H new ATOM 0 HG21 THR A 115 31.609 -22.135 -6.720 1.00 0.00 H new ATOM 0 HG22 THR A 115 32.134 -20.631 -5.925 1.00 0.00 H new ATOM 0 HG23 THR A 115 32.455 -20.880 -7.657 1.00 0.00 H new ATOM 531 N SER A 116 34.269 -18.667 -5.677 1.00 0.00 N ATOM 532 CA SER A 116 33.929 -17.584 -4.758 1.00 0.00 C ATOM 533 C SER A 116 32.423 -17.374 -4.712 1.00 0.00 C ATOM 534 O SER A 116 31.792 -17.108 -5.734 1.00 0.00 O ATOM 535 CB SER A 116 34.605 -16.290 -5.210 1.00 0.00 C ATOM 536 OG SER A 116 33.807 -15.666 -6.211 1.00 0.00 O ATOM 0 H SER A 116 34.341 -18.387 -6.655 1.00 0.00 H new ATOM 0 HA SER A 116 34.279 -17.855 -3.762 1.00 0.00 H new ATOM 0 HB2 SER A 116 34.735 -15.618 -4.361 1.00 0.00 H new ATOM 0 HB3 SER A 116 35.599 -16.504 -5.602 1.00 0.00 H new ATOM 0 HG SER A 116 33.080 -16.269 -6.473 1.00 0.00 H new ATOM 542 N THR A 117 31.849 -17.496 -3.517 1.00 0.00 N ATOM 543 CA THR A 117 30.407 -17.317 -3.337 1.00 0.00 C ATOM 544 C THR A 117 30.138 -16.111 -2.449 1.00 0.00 C ATOM 545 O THR A 117 30.726 -15.974 -1.377 1.00 0.00 O ATOM 546 CB THR A 117 29.800 -18.570 -2.704 1.00 0.00 C ATOM 547 OG1 THR A 117 29.914 -19.657 -3.612 1.00 0.00 O ATOM 548 CG2 THR A 117 28.324 -18.316 -2.389 1.00 0.00 C ATOM 0 H THR A 117 32.357 -17.717 -2.661 1.00 0.00 H new ATOM 0 HA THR A 117 29.949 -17.151 -4.312 1.00 0.00 H new ATOM 0 HB THR A 117 30.330 -18.810 -1.782 1.00 0.00 H new ATOM 0 HG1 THR A 117 29.527 -20.462 -3.209 1.00 0.00 H new ATOM 0 HG21 THR A 117 27.890 -19.208 -1.938 1.00 0.00 H new ATOM 0 HG22 THR A 117 28.239 -17.480 -1.695 1.00 0.00 H new ATOM 0 HG23 THR A 117 27.791 -18.079 -3.310 1.00 0.00 H new ATOM 556 N VAL A 118 29.242 -15.237 -2.905 1.00 0.00 N ATOM 557 CA VAL A 118 28.892 -14.034 -2.147 1.00 0.00 C ATOM 558 C VAL A 118 27.456 -14.121 -1.658 1.00 0.00 C ATOM 559 O VAL A 118 26.584 -14.647 -2.350 1.00 0.00 O ATOM 560 CB VAL A 118 29.065 -12.796 -3.024 1.00 0.00 C ATOM 561 CG1 VAL A 118 28.018 -12.803 -4.140 1.00 0.00 C ATOM 562 CG2 VAL A 118 28.889 -11.542 -2.164 1.00 0.00 C ATOM 0 H VAL A 118 28.747 -15.337 -3.791 1.00 0.00 H new ATOM 0 HA VAL A 118 29.555 -13.958 -1.285 1.00 0.00 H new ATOM 0 HB VAL A 118 30.061 -12.800 -3.468 1.00 0.00 H new ATOM 0 HG11 VAL A 118 28.145 -11.918 -4.763 1.00 0.00 H new ATOM 0 HG12 VAL A 118 28.143 -13.698 -4.750 1.00 0.00 H new ATOM 0 HG13 VAL A 118 27.020 -12.798 -3.702 1.00 0.00 H new ATOM 0 HG21 VAL A 118 29.012 -10.655 -2.785 1.00 0.00 H new ATOM 0 HG22 VAL A 118 27.893 -11.541 -1.722 1.00 0.00 H new ATOM 0 HG23 VAL A 118 29.637 -11.536 -1.372 1.00 0.00 H new ATOM 572 N GLU A 119 27.212 -13.599 -0.454 1.00 0.00 N ATOM 573 CA GLU A 119 25.872 -13.620 0.129 1.00 0.00 C ATOM 574 C GLU A 119 25.478 -12.235 0.616 1.00 0.00 C ATOM 575 O GLU A 119 26.282 -11.526 1.215 1.00 0.00 O ATOM 576 CB GLU A 119 25.827 -14.613 1.290 1.00 0.00 C ATOM 577 CG GLU A 119 24.385 -14.772 1.772 1.00 0.00 C ATOM 578 CD GLU A 119 24.325 -15.782 2.911 1.00 0.00 C ATOM 579 OE1 GLU A 119 25.378 -16.152 3.405 1.00 0.00 O ATOM 580 OE2 GLU A 119 23.228 -16.167 3.280 1.00 0.00 O1- ATOM 0 H GLU A 119 27.921 -13.159 0.132 1.00 0.00 H new ATOM 0 HA GLU A 119 25.164 -13.931 -0.639 1.00 0.00 H new ATOM 0 HB2 GLU A 119 26.224 -15.577 0.973 1.00 0.00 H new ATOM 0 HB3 GLU A 119 26.458 -14.262 2.107 1.00 0.00 H new ATOM 0 HG2 GLU A 119 23.997 -13.810 2.107 1.00 0.00 H new ATOM 0 HG3 GLU A 119 23.752 -15.102 0.948 1.00 0.00 H new ATOM 587 N PHE A 120 24.229 -11.859 0.359 1.00 0.00 N ATOM 588 CA PHE A 120 23.736 -10.556 0.788 1.00 0.00 C ATOM 589 C PHE A 120 22.224 -10.464 0.591 1.00 0.00 C ATOM 590 O PHE A 120 21.651 -11.211 -0.200 1.00 0.00 O ATOM 591 CB PHE A 120 24.427 -9.446 0.001 1.00 0.00 C ATOM 592 CG PHE A 120 24.022 -9.528 -1.450 1.00 0.00 C ATOM 593 CD1 PHE A 120 22.875 -8.864 -1.892 1.00 0.00 C ATOM 594 CD2 PHE A 120 24.795 -10.267 -2.351 1.00 0.00 C ATOM 595 CE1 PHE A 120 22.495 -8.937 -3.237 1.00 0.00 C ATOM 596 CE2 PHE A 120 24.418 -10.342 -3.697 1.00 0.00 C ATOM 597 CZ PHE A 120 23.268 -9.676 -4.140 1.00 0.00 C ATOM 0 H PHE A 120 23.547 -12.431 -0.139 1.00 0.00 H new ATOM 0 HA PHE A 120 23.960 -10.436 1.848 1.00 0.00 H new ATOM 0 HB2 PHE A 120 24.156 -8.473 0.410 1.00 0.00 H new ATOM 0 HB3 PHE A 120 25.509 -9.540 0.093 1.00 0.00 H new ATOM 0 HD1 PHE A 120 22.280 -8.293 -1.194 1.00 0.00 H new ATOM 0 HD2 PHE A 120 25.682 -10.779 -2.009 1.00 0.00 H new ATOM 0 HE1 PHE A 120 21.607 -8.424 -3.577 1.00 0.00 H new ATOM 0 HE2 PHE A 120 25.014 -10.913 -4.394 1.00 0.00 H new ATOM 0 HZ PHE A 120 22.978 -9.733 -5.179 1.00 0.00 H new ATOM 607 N ALA A 121 21.589 -9.530 1.288 1.00 0.00 N ATOM 608 CA ALA A 121 20.147 -9.346 1.167 1.00 0.00 C ATOM 609 C ALA A 121 19.418 -10.669 1.383 1.00 0.00 C ATOM 610 O ALA A 121 18.260 -10.823 0.995 1.00 0.00 O ATOM 611 CB ALA A 121 19.798 -8.789 -0.215 1.00 0.00 C ATOM 0 H ALA A 121 22.046 -8.891 1.939 1.00 0.00 H new ATOM 0 HA ALA A 121 19.828 -8.637 1.931 1.00 0.00 H new ATOM 0 HB1 ALA A 121 18.719 -8.656 -0.292 1.00 0.00 H new ATOM 0 HB2 ALA A 121 20.293 -7.828 -0.355 1.00 0.00 H new ATOM 0 HB3 ALA A 121 20.134 -9.485 -0.983 1.00 0.00 H new ATOM 617 N GLY A 122 20.105 -11.621 2.009 1.00 0.00 N ATOM 618 CA GLY A 122 19.510 -12.924 2.277 1.00 0.00 C ATOM 619 C GLY A 122 19.536 -13.810 1.040 1.00 0.00 C ATOM 620 O GLY A 122 18.777 -14.769 0.936 1.00 0.00 O ATOM 0 H GLY A 122 21.065 -11.515 2.337 1.00 0.00 H new ATOM 0 HA2 GLY A 122 20.050 -13.413 3.088 1.00 0.00 H new ATOM 0 HA3 GLY A 122 18.481 -12.794 2.612 1.00 0.00 H new ATOM 624 N LYS A 123 20.412 -13.483 0.100 1.00 0.00 N ATOM 625 CA LYS A 123 20.539 -14.251 -1.139 1.00 0.00 C ATOM 626 C LYS A 123 21.996 -14.563 -1.420 1.00 0.00 C ATOM 627 O LYS A 123 22.883 -13.810 -1.032 1.00 0.00 O ATOM 628 CB LYS A 123 19.942 -13.468 -2.306 1.00 0.00 C ATOM 629 CG LYS A 123 18.420 -13.441 -2.178 1.00 0.00 C ATOM 630 CD LYS A 123 17.829 -12.616 -3.321 1.00 0.00 C ATOM 631 CE LYS A 123 16.304 -12.576 -3.185 1.00 0.00 C ATOM 632 NZ LYS A 123 15.726 -11.788 -4.310 1.00 0.00 N1+ ATOM 0 H LYS A 123 21.049 -12.689 0.169 1.00 0.00 H new ATOM 0 HA LYS A 123 19.995 -15.188 -1.023 1.00 0.00 H new ATOM 0 HB2 LYS A 123 20.335 -12.451 -2.314 1.00 0.00 H new ATOM 0 HB3 LYS A 123 20.230 -13.928 -3.251 1.00 0.00 H new ATOM 0 HG2 LYS A 123 18.024 -14.456 -2.205 1.00 0.00 H new ATOM 0 HG3 LYS A 123 18.132 -13.012 -1.218 1.00 0.00 H new ATOM 0 HD2 LYS A 123 18.233 -11.604 -3.300 1.00 0.00 H new ATOM 0 HD3 LYS A 123 18.108 -13.051 -4.280 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.901 -13.589 -3.191 1.00 0.00 H new ATOM 0 HE3 LYS A 123 16.025 -12.128 -2.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 14.690 -11.760 -4.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 16.102 -10.819 -4.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.982 -12.234 -5.214 1.00 0.00 H new ATOM 646 N VAL A 124 22.238 -15.686 -2.098 1.00 0.00 N ATOM 647 CA VAL A 124 23.601 -16.100 -2.429 1.00 0.00 C ATOM 648 C VAL A 124 23.789 -16.198 -3.931 1.00 0.00 C ATOM 649 O VAL A 124 23.027 -16.873 -4.618 1.00 0.00 O ATOM 650 CB VAL A 124 23.896 -17.461 -1.792 1.00 0.00 C ATOM 651 CG1 VAL A 124 22.896 -18.497 -2.312 1.00 0.00 C ATOM 652 CG2 VAL A 124 25.317 -17.895 -2.160 1.00 0.00 C ATOM 0 H VAL A 124 21.511 -16.322 -2.427 1.00 0.00 H new ATOM 0 HA VAL A 124 24.290 -15.350 -2.040 1.00 0.00 H new ATOM 0 HB VAL A 124 23.806 -17.383 -0.708 1.00 0.00 H new ATOM 0 HG11 VAL A 124 23.106 -19.465 -1.858 1.00 0.00 H new ATOM 0 HG12 VAL A 124 21.884 -18.187 -2.053 1.00 0.00 H new ATOM 0 HG13 VAL A 124 22.985 -18.577 -3.395 1.00 0.00 H new ATOM 0 HG21 VAL A 124 25.530 -18.864 -1.708 1.00 0.00 H new ATOM 0 HG22 VAL A 124 25.404 -17.973 -3.244 1.00 0.00 H new ATOM 0 HG23 VAL A 124 26.030 -17.158 -1.791 1.00 0.00 H new ATOM 662 N PHE A 125 24.810 -15.512 -4.443 1.00 0.00 N ATOM 663 CA PHE A 125 25.100 -15.528 -5.878 1.00 0.00 C ATOM 664 C PHE A 125 26.398 -16.282 -6.142 1.00 0.00 C ATOM 665 O PHE A 125 27.465 -15.888 -5.665 1.00 0.00 O ATOM 666 CB PHE A 125 25.220 -14.100 -6.404 1.00 0.00 C ATOM 667 CG PHE A 125 23.906 -13.381 -6.208 1.00 0.00 C ATOM 668 CD1 PHE A 125 23.518 -12.977 -4.926 1.00 0.00 C ATOM 669 CD2 PHE A 125 23.077 -13.113 -7.306 1.00 0.00 C ATOM 670 CE1 PHE A 125 22.304 -12.307 -4.743 1.00 0.00 C ATOM 671 CE2 PHE A 125 21.865 -12.446 -7.119 1.00 0.00 C ATOM 672 CZ PHE A 125 21.474 -12.045 -5.838 1.00 0.00 C ATOM 0 H PHE A 125 25.448 -14.940 -3.889 1.00 0.00 H new ATOM 0 HA PHE A 125 24.283 -16.032 -6.394 1.00 0.00 H new ATOM 0 HB2 PHE A 125 26.017 -13.573 -5.879 1.00 0.00 H new ATOM 0 HB3 PHE A 125 25.487 -14.111 -7.461 1.00 0.00 H new ATOM 0 HD1 PHE A 125 24.155 -13.182 -4.079 1.00 0.00 H new ATOM 0 HD2 PHE A 125 23.376 -13.422 -8.297 1.00 0.00 H new ATOM 0 HE1 PHE A 125 22.007 -11.991 -3.754 1.00 0.00 H new ATOM 0 HE2 PHE A 125 21.228 -12.239 -7.966 1.00 0.00 H new ATOM 0 HZ PHE A 125 20.533 -11.534 -5.694 1.00 0.00 H new ATOM 682 N SER A 126 26.299 -17.373 -6.896 1.00 0.00 N ATOM 683 CA SER A 126 27.475 -18.177 -7.213 1.00 0.00 C ATOM 684 C SER A 126 28.310 -17.498 -8.291 1.00 0.00 C ATOM 685 O SER A 126 27.807 -17.175 -9.368 1.00 0.00 O ATOM 686 CB SER A 126 27.042 -19.562 -7.698 1.00 0.00 C ATOM 687 OG SER A 126 26.006 -19.419 -8.661 1.00 0.00 O ATOM 0 H SER A 126 25.426 -17.718 -7.295 1.00 0.00 H new ATOM 0 HA SER A 126 28.079 -18.279 -6.311 1.00 0.00 H new ATOM 0 HB2 SER A 126 27.890 -20.089 -8.135 1.00 0.00 H new ATOM 0 HB3 SER A 126 26.693 -20.162 -6.857 1.00 0.00 H new ATOM 0 HG SER A 126 26.273 -18.758 -9.333 1.00 0.00 H new ATOM 693 N GLY A 127 29.589 -17.286 -7.998 1.00 0.00 N ATOM 694 CA GLY A 127 30.486 -16.646 -8.951 1.00 0.00 C ATOM 695 C GLY A 127 30.932 -17.632 -10.025 1.00 0.00 C ATOM 696 O GLY A 127 30.429 -18.753 -10.094 1.00 0.00 O ATOM 0 H GLY A 127 30.025 -17.547 -7.113 1.00 0.00 H new ATOM 0 HA2 GLY A 127 29.984 -15.798 -9.416 1.00 0.00 H new ATOM 0 HA3 GLY A 127 31.358 -16.253 -8.428 1.00 0.00 H new ATOM 700 N GLU A 128 31.870 -17.204 -10.863 1.00 0.00 N ATOM 701 CA GLU A 128 32.374 -18.057 -11.929 1.00 0.00 C ATOM 702 C GLU A 128 33.393 -19.049 -11.391 1.00 0.00 C ATOM 703 O GLU A 128 33.834 -18.937 -10.250 1.00 0.00 O ATOM 704 CB GLU A 128 33.026 -17.203 -13.017 1.00 0.00 C ATOM 705 CG GLU A 128 31.941 -16.447 -13.798 1.00 0.00 C ATOM 706 CD GLU A 128 31.431 -17.298 -14.959 1.00 0.00 C ATOM 707 OE1 GLU A 128 32.258 -17.844 -15.671 1.00 0.00 O ATOM 708 OE2 GLU A 128 30.225 -17.397 -15.115 1.00 0.00 O1- ATOM 0 H GLU A 128 32.294 -16.277 -10.824 1.00 0.00 H new ATOM 0 HA GLU A 128 31.533 -18.609 -12.349 1.00 0.00 H new ATOM 0 HB2 GLU A 128 33.725 -16.496 -12.569 1.00 0.00 H new ATOM 0 HB3 GLU A 128 33.602 -17.835 -13.693 1.00 0.00 H new ATOM 0 HG2 GLU A 128 31.115 -16.194 -13.133 1.00 0.00 H new ATOM 0 HG3 GLU A 128 32.344 -15.508 -14.177 1.00 0.00 H new ATOM 715 N GLU A 129 33.771 -20.019 -12.222 1.00 0.00 N ATOM 716 CA GLU A 129 34.754 -21.029 -11.825 1.00 0.00 C ATOM 717 C GLU A 129 36.062 -20.800 -12.580 1.00 0.00 C ATOM 718 O GLU A 129 36.059 -20.496 -13.773 1.00 0.00 O ATOM 719 CB GLU A 129 34.220 -22.429 -12.118 1.00 0.00 C ATOM 720 CG GLU A 129 33.599 -22.463 -13.515 1.00 0.00 C ATOM 721 CD GLU A 129 32.238 -21.777 -13.501 1.00 0.00 C ATOM 722 OE1 GLU A 129 31.541 -21.903 -12.506 1.00 0.00 O ATOM 723 OE2 GLU A 129 31.913 -21.127 -14.482 1.00 0.00 O1- ATOM 0 H GLU A 129 33.414 -20.128 -13.171 1.00 0.00 H new ATOM 0 HA GLU A 129 34.938 -20.943 -10.754 1.00 0.00 H new ATOM 0 HB2 GLU A 129 35.028 -23.158 -12.051 1.00 0.00 H new ATOM 0 HB3 GLU A 129 33.476 -22.708 -11.372 1.00 0.00 H new ATOM 0 HG2 GLU A 129 34.258 -21.966 -14.226 1.00 0.00 H new ATOM 0 HG3 GLU A 129 33.491 -23.495 -13.848 1.00 0.00 H new ATOM 730 N ALA A 130 37.173 -20.956 -11.873 1.00 0.00 N ATOM 731 CA ALA A 130 38.486 -20.766 -12.477 1.00 0.00 C ATOM 732 C ALA A 130 39.591 -21.166 -11.504 1.00 0.00 C ATOM 733 O ALA A 130 39.340 -21.380 -10.321 1.00 0.00 O ATOM 734 CB ALA A 130 38.659 -19.299 -12.880 1.00 0.00 C ATOM 0 H ALA A 130 37.193 -21.212 -10.886 1.00 0.00 H new ATOM 0 HA ALA A 130 38.557 -21.400 -13.361 1.00 0.00 H new ATOM 0 HB1 ALA A 130 39.641 -19.159 -13.331 1.00 0.00 H new ATOM 0 HB2 ALA A 130 37.887 -19.026 -13.599 1.00 0.00 H new ATOM 0 HB3 ALA A 130 38.572 -18.666 -11.997 1.00 0.00 H new ATOM 740 N LYS A 131 40.814 -21.242 -12.008 1.00 0.00 N ATOM 741 CA LYS A 131 41.970 -21.584 -11.184 1.00 0.00 C ATOM 742 C LYS A 131 42.546 -20.331 -10.536 1.00 0.00 C ATOM 743 O LYS A 131 43.759 -20.201 -10.395 1.00 0.00 O ATOM 744 CB LYS A 131 43.043 -22.271 -12.021 1.00 0.00 C ATOM 745 CG LYS A 131 43.413 -21.377 -13.203 1.00 0.00 C ATOM 746 CD LYS A 131 44.489 -22.063 -14.044 1.00 0.00 C ATOM 747 CE LYS A 131 44.815 -21.197 -15.262 1.00 0.00 C ATOM 748 NZ LYS A 131 45.369 -19.890 -14.813 1.00 0.00 N1+ ATOM 0 H LYS A 131 41.035 -21.071 -12.989 1.00 0.00 H new ATOM 0 HA LYS A 131 41.641 -22.271 -10.404 1.00 0.00 H new ATOM 0 HB2 LYS A 131 43.924 -22.470 -11.411 1.00 0.00 H new ATOM 0 HB3 LYS A 131 42.680 -23.234 -12.379 1.00 0.00 H new ATOM 0 HG2 LYS A 131 42.531 -21.179 -13.813 1.00 0.00 H new ATOM 0 HG3 LYS A 131 43.776 -20.414 -12.844 1.00 0.00 H new ATOM 0 HD2 LYS A 131 45.387 -22.221 -13.446 1.00 0.00 H new ATOM 0 HD3 LYS A 131 44.143 -23.045 -14.365 1.00 0.00 H new ATOM 0 HE2 LYS A 131 45.535 -21.708 -15.902 1.00 0.00 H new ATOM 0 HE3 LYS A 131 43.916 -21.037 -15.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 45.865 -19.433 -15.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 44.594 -19.277 -14.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 46.036 -20.046 -14.030 1.00 0.00 H new ATOM 762 N THR A 132 41.672 -19.406 -10.154 1.00 0.00 N ATOM 763 CA THR A 132 42.105 -18.161 -9.524 1.00 0.00 C ATOM 764 C THR A 132 40.998 -17.590 -8.643 1.00 0.00 C ATOM 765 O THR A 132 39.816 -17.742 -8.936 1.00 0.00 O ATOM 766 CB THR A 132 42.490 -17.150 -10.601 1.00 0.00 C ATOM 767 OG1 THR A 132 42.654 -15.867 -10.014 1.00 0.00 O ATOM 768 CG2 THR A 132 41.395 -17.097 -11.663 1.00 0.00 C ATOM 0 H THR A 132 40.662 -19.493 -10.269 1.00 0.00 H new ATOM 0 HA THR A 132 42.971 -18.368 -8.895 1.00 0.00 H new ATOM 0 HB THR A 132 43.428 -17.453 -11.066 1.00 0.00 H new ATOM 0 HG1 THR A 132 42.903 -15.220 -10.707 1.00 0.00 H new ATOM 0 HG21 THR A 132 41.669 -16.375 -12.432 1.00 0.00 H new ATOM 0 HG22 THR A 132 41.278 -18.082 -12.115 1.00 0.00 H new ATOM 0 HG23 THR A 132 40.455 -16.796 -11.201 1.00 0.00 H new ATOM 776 N LYS A 133 41.397 -16.924 -7.564 1.00 0.00 N ATOM 777 CA LYS A 133 40.431 -16.324 -6.649 1.00 0.00 C ATOM 778 C LYS A 133 39.991 -14.949 -7.142 1.00 0.00 C ATOM 779 O LYS A 133 38.912 -14.470 -6.795 1.00 0.00 O ATOM 780 CB LYS A 133 41.052 -16.192 -5.256 1.00 0.00 C ATOM 781 CG LYS A 133 41.362 -17.586 -4.706 1.00 0.00 C ATOM 782 CD LYS A 133 42.021 -17.458 -3.331 1.00 0.00 C ATOM 783 CE LYS A 133 42.340 -18.850 -2.785 1.00 0.00 C ATOM 784 NZ LYS A 133 43.004 -18.723 -1.456 1.00 0.00 N1+ ATOM 0 H LYS A 133 42.373 -16.787 -7.303 1.00 0.00 H new ATOM 0 HA LYS A 133 39.556 -16.972 -6.604 1.00 0.00 H new ATOM 0 HB2 LYS A 133 41.964 -15.597 -5.307 1.00 0.00 H new ATOM 0 HB3 LYS A 133 40.367 -15.669 -4.588 1.00 0.00 H new ATOM 0 HG2 LYS A 133 40.445 -18.170 -4.628 1.00 0.00 H new ATOM 0 HG3 LYS A 133 42.023 -18.119 -5.389 1.00 0.00 H new ATOM 0 HD2 LYS A 133 42.934 -16.868 -3.408 1.00 0.00 H new ATOM 0 HD3 LYS A 133 41.357 -16.931 -2.646 1.00 0.00 H new ATOM 0 HE2 LYS A 133 41.425 -19.434 -2.692 1.00 0.00 H new ATOM 0 HE3 LYS A 133 42.990 -19.384 -3.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 43.221 -19.670 -1.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 43.886 -18.181 -1.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 42.369 -18.230 -0.796 1.00 0.00 H new ATOM 798 N LYS A 134 40.851 -14.303 -7.924 1.00 0.00 N ATOM 799 CA LYS A 134 40.549 -12.969 -8.426 1.00 0.00 C ATOM 800 C LYS A 134 39.372 -12.994 -9.390 1.00 0.00 C ATOM 801 O LYS A 134 38.443 -12.197 -9.267 1.00 0.00 O ATOM 802 CB LYS A 134 41.777 -12.394 -9.141 1.00 0.00 C ATOM 803 CG LYS A 134 42.902 -12.170 -8.131 1.00 0.00 C ATOM 804 CD LYS A 134 44.135 -11.616 -8.851 1.00 0.00 C ATOM 805 CE LYS A 134 45.280 -11.448 -7.851 1.00 0.00 C ATOM 806 NZ LYS A 134 44.939 -10.366 -6.882 1.00 0.00 N1+ ATOM 0 H LYS A 134 41.752 -14.677 -8.220 1.00 0.00 H new ATOM 0 HA LYS A 134 40.284 -12.342 -7.575 1.00 0.00 H new ATOM 0 HB2 LYS A 134 42.108 -13.077 -9.923 1.00 0.00 H new ATOM 0 HB3 LYS A 134 41.519 -11.453 -9.628 1.00 0.00 H new ATOM 0 HG2 LYS A 134 42.577 -11.474 -7.357 1.00 0.00 H new ATOM 0 HG3 LYS A 134 43.150 -13.107 -7.633 1.00 0.00 H new ATOM 0 HD2 LYS A 134 44.435 -12.291 -9.652 1.00 0.00 H new ATOM 0 HD3 LYS A 134 43.899 -10.658 -9.313 1.00 0.00 H new ATOM 0 HE2 LYS A 134 45.454 -12.384 -7.321 1.00 0.00 H new ATOM 0 HE3 LYS A 134 46.203 -11.203 -8.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 45.802 -10.052 -6.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 44.518 -9.563 -7.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 44.259 -10.727 -6.183 1.00 0.00 H new ATOM 820 N LEU A 135 39.422 -13.902 -10.358 1.00 0.00 N ATOM 821 CA LEU A 135 38.362 -14.002 -11.338 1.00 0.00 C ATOM 822 C LEU A 135 37.049 -14.429 -10.700 1.00 0.00 C ATOM 823 O LEU A 135 35.987 -13.901 -11.030 1.00 0.00 O ATOM 824 CB LEU A 135 38.758 -15.023 -12.421 1.00 0.00 C ATOM 825 CG LEU A 135 38.057 -14.681 -13.745 1.00 0.00 C ATOM 826 CD1 LEU A 135 38.873 -13.612 -14.495 1.00 0.00 C ATOM 827 CD2 LEU A 135 37.942 -15.939 -14.610 1.00 0.00 C ATOM 0 H LEU A 135 40.181 -14.572 -10.480 1.00 0.00 H new ATOM 0 HA LEU A 135 38.220 -13.017 -11.781 1.00 0.00 H new ATOM 0 HB2 LEU A 135 39.839 -15.018 -12.560 1.00 0.00 H new ATOM 0 HB3 LEU A 135 38.483 -16.029 -12.103 1.00 0.00 H new ATOM 0 HG LEU A 135 37.058 -14.297 -13.536 1.00 0.00 H new ATOM 0 HD11 LEU A 135 38.377 -13.368 -15.435 1.00 0.00 H new ATOM 0 HD12 LEU A 135 38.948 -12.715 -13.881 1.00 0.00 H new ATOM 0 HD13 LEU A 135 39.872 -13.995 -14.701 1.00 0.00 H new ATOM 0 HD21 LEU A 135 37.444 -15.692 -15.548 1.00 0.00 H new ATOM 0 HD22 LEU A 135 38.938 -16.329 -14.820 1.00 0.00 H new ATOM 0 HD23 LEU A 135 37.362 -16.694 -14.079 1.00 0.00 H new ATOM 839 N ALA A 136 37.128 -15.399 -9.797 1.00 0.00 N ATOM 840 CA ALA A 136 35.929 -15.901 -9.135 1.00 0.00 C ATOM 841 C ALA A 136 35.273 -14.797 -8.317 1.00 0.00 C ATOM 842 O ALA A 136 34.090 -14.508 -8.498 1.00 0.00 O ATOM 843 CB ALA A 136 36.304 -17.065 -8.213 1.00 0.00 C ATOM 0 H ALA A 136 37.997 -15.849 -9.509 1.00 0.00 H new ATOM 0 HA ALA A 136 35.225 -16.243 -9.894 1.00 0.00 H new ATOM 0 HB1 ALA A 136 35.408 -17.440 -7.718 1.00 0.00 H new ATOM 0 HB2 ALA A 136 36.756 -17.864 -8.801 1.00 0.00 H new ATOM 0 HB3 ALA A 136 37.016 -16.720 -7.463 1.00 0.00 H new ATOM 849 N GLU A 137 36.038 -14.183 -7.417 1.00 0.00 N ATOM 850 CA GLU A 137 35.504 -13.113 -6.583 1.00 0.00 C ATOM 851 C GLU A 137 34.948 -11.989 -7.446 1.00 0.00 C ATOM 852 O GLU A 137 33.849 -11.494 -7.202 1.00 0.00 O ATOM 853 CB GLU A 137 36.609 -12.567 -5.674 1.00 0.00 C ATOM 854 CG GLU A 137 36.978 -13.614 -4.621 1.00 0.00 C ATOM 855 CD GLU A 137 38.124 -13.104 -3.756 1.00 0.00 C ATOM 856 OE1 GLU A 137 38.613 -12.021 -4.032 1.00 0.00 O ATOM 857 OE2 GLU A 137 38.492 -13.800 -2.824 1.00 0.00 O1- ATOM 0 H GLU A 137 37.019 -14.406 -7.249 1.00 0.00 H new ATOM 0 HA GLU A 137 34.696 -13.517 -5.973 1.00 0.00 H new ATOM 0 HB2 GLU A 137 37.486 -12.309 -6.267 1.00 0.00 H new ATOM 0 HB3 GLU A 137 36.273 -11.651 -5.188 1.00 0.00 H new ATOM 0 HG2 GLU A 137 36.112 -13.835 -3.997 1.00 0.00 H new ATOM 0 HG3 GLU A 137 37.266 -14.545 -5.108 1.00 0.00 H new ATOM 864 N MET A 138 35.714 -11.591 -8.455 1.00 0.00 N ATOM 865 CA MET A 138 35.287 -10.522 -9.349 1.00 0.00 C ATOM 866 C MET A 138 34.022 -10.933 -10.098 1.00 0.00 C ATOM 867 O MET A 138 33.119 -10.122 -10.305 1.00 0.00 O ATOM 868 CB MET A 138 36.398 -10.199 -10.348 1.00 0.00 C ATOM 869 CG MET A 138 35.966 -9.032 -11.234 1.00 0.00 C ATOM 870 SD MET A 138 37.315 -8.594 -12.361 1.00 0.00 S ATOM 871 CE MET A 138 38.060 -7.303 -11.334 1.00 0.00 C ATOM 0 H MET A 138 36.627 -11.989 -8.673 1.00 0.00 H new ATOM 0 HA MET A 138 35.073 -9.634 -8.754 1.00 0.00 H new ATOM 0 HB2 MET A 138 37.316 -9.946 -9.817 1.00 0.00 H new ATOM 0 HB3 MET A 138 36.615 -11.074 -10.961 1.00 0.00 H new ATOM 0 HG2 MET A 138 35.077 -9.304 -11.803 1.00 0.00 H new ATOM 0 HG3 MET A 138 35.700 -8.173 -10.618 1.00 0.00 H new ATOM 0 HE1 MET A 138 38.927 -6.886 -11.846 1.00 0.00 H new ATOM 0 HE2 MET A 138 37.330 -6.514 -11.155 1.00 0.00 H new ATOM 0 HE3 MET A 138 38.372 -7.731 -10.381 1.00 0.00 H new ATOM 881 N SER A 139 33.965 -12.197 -10.503 1.00 0.00 N ATOM 882 CA SER A 139 32.806 -12.707 -11.224 1.00 0.00 C ATOM 883 C SER A 139 31.556 -12.643 -10.355 1.00 0.00 C ATOM 884 O SER A 139 30.468 -12.329 -10.837 1.00 0.00 O ATOM 885 CB SER A 139 33.051 -14.154 -11.659 1.00 0.00 C ATOM 886 OG SER A 139 33.999 -14.170 -12.718 1.00 0.00 O ATOM 0 H SER A 139 34.703 -12.883 -10.345 1.00 0.00 H new ATOM 0 HA SER A 139 32.654 -12.083 -12.105 1.00 0.00 H new ATOM 0 HB2 SER A 139 33.418 -14.742 -10.818 1.00 0.00 H new ATOM 0 HB3 SER A 139 32.117 -14.612 -11.984 1.00 0.00 H new ATOM 0 HG SER A 139 34.902 -14.254 -12.347 1.00 0.00 H new ATOM 892 N ALA A 140 31.720 -12.944 -9.071 1.00 0.00 N ATOM 893 CA ALA A 140 30.598 -12.920 -8.141 1.00 0.00 C ATOM 894 C ALA A 140 30.018 -11.513 -8.035 1.00 0.00 C ATOM 895 O ALA A 140 28.803 -11.331 -7.969 1.00 0.00 O ATOM 896 CB ALA A 140 31.056 -13.390 -6.759 1.00 0.00 C ATOM 0 H ALA A 140 32.613 -13.206 -8.653 1.00 0.00 H new ATOM 0 HA ALA A 140 29.826 -13.591 -8.516 1.00 0.00 H new ATOM 0 HB1 ALA A 140 30.212 -13.369 -6.069 1.00 0.00 H new ATOM 0 HB2 ALA A 140 31.442 -14.407 -6.830 1.00 0.00 H new ATOM 0 HB3 ALA A 140 31.841 -12.729 -6.392 1.00 0.00 H new ATOM 902 N ALA A 141 30.898 -10.519 -8.004 1.00 0.00 N ATOM 903 CA ALA A 141 30.463 -9.133 -7.900 1.00 0.00 C ATOM 904 C ALA A 141 29.752 -8.689 -9.173 1.00 0.00 C ATOM 905 O ALA A 141 28.892 -7.810 -9.138 1.00 0.00 O ATOM 906 CB ALA A 141 31.669 -8.221 -7.659 1.00 0.00 C ATOM 0 H ALA A 141 31.909 -10.646 -8.049 1.00 0.00 H new ATOM 0 HA ALA A 141 29.770 -9.061 -7.062 1.00 0.00 H new ATOM 0 HB1 ALA A 141 31.334 -7.187 -7.583 1.00 0.00 H new ATOM 0 HB2 ALA A 141 32.165 -8.511 -6.733 1.00 0.00 H new ATOM 0 HB3 ALA A 141 32.368 -8.315 -8.490 1.00 0.00 H new ATOM 912 N LYS A 142 30.102 -9.315 -10.292 1.00 0.00 N ATOM 913 CA LYS A 142 29.474 -8.982 -11.565 1.00 0.00 C ATOM 914 C LYS A 142 28.037 -9.485 -11.636 1.00 0.00 C ATOM 915 O LYS A 142 27.121 -8.735 -11.968 1.00 0.00 O ATOM 916 CB LYS A 142 30.288 -9.588 -12.715 1.00 0.00 C ATOM 917 CG LYS A 142 31.543 -8.749 -12.960 1.00 0.00 C ATOM 918 CD LYS A 142 32.353 -9.364 -14.102 1.00 0.00 C ATOM 919 CE LYS A 142 33.505 -8.426 -14.472 1.00 0.00 C ATOM 920 NZ LYS A 142 34.292 -9.021 -15.588 1.00 0.00 N1+ ATOM 0 H LYS A 142 30.809 -10.048 -10.344 1.00 0.00 H new ATOM 0 HA LYS A 142 29.453 -7.896 -11.652 1.00 0.00 H new ATOM 0 HB2 LYS A 142 30.567 -10.614 -12.474 1.00 0.00 H new ATOM 0 HB3 LYS A 142 29.683 -9.626 -13.621 1.00 0.00 H new ATOM 0 HG2 LYS A 142 31.266 -7.724 -13.207 1.00 0.00 H new ATOM 0 HG3 LYS A 142 32.147 -8.706 -12.054 1.00 0.00 H new ATOM 0 HD2 LYS A 142 32.743 -10.337 -13.803 1.00 0.00 H new ATOM 0 HD3 LYS A 142 31.713 -9.530 -14.968 1.00 0.00 H new ATOM 0 HE2 LYS A 142 33.114 -7.452 -14.767 1.00 0.00 H new ATOM 0 HE3 LYS A 142 34.147 -8.263 -13.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 35.075 -8.384 -15.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 34.676 -9.940 -15.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 33.675 -9.155 -16.415 1.00 0.00 H new ATOM 934 N VAL A 143 27.851 -10.764 -11.330 1.00 0.00 N ATOM 935 CA VAL A 143 26.525 -11.363 -11.369 1.00 0.00 C ATOM 936 C VAL A 143 25.632 -10.764 -10.295 1.00 0.00 C ATOM 937 O VAL A 143 24.455 -10.496 -10.536 1.00 0.00 O ATOM 938 CB VAL A 143 26.624 -12.879 -11.175 1.00 0.00 C ATOM 939 CG1 VAL A 143 27.356 -13.173 -9.868 1.00 0.00 C ATOM 940 CG2 VAL A 143 25.219 -13.481 -11.116 1.00 0.00 C ATOM 0 H VAL A 143 28.598 -11.402 -11.054 1.00 0.00 H new ATOM 0 HA VAL A 143 26.085 -11.154 -12.344 1.00 0.00 H new ATOM 0 HB VAL A 143 27.171 -13.318 -12.009 1.00 0.00 H new ATOM 0 HG11 VAL A 143 27.429 -14.251 -9.726 1.00 0.00 H new ATOM 0 HG12 VAL A 143 28.357 -12.744 -9.907 1.00 0.00 H new ATOM 0 HG13 VAL A 143 26.806 -12.734 -9.036 1.00 0.00 H new ATOM 0 HG21 VAL A 143 25.291 -14.560 -10.978 1.00 0.00 H new ATOM 0 HG22 VAL A 143 24.671 -13.044 -10.281 1.00 0.00 H new ATOM 0 HG23 VAL A 143 24.693 -13.269 -12.047 1.00 0.00 H new ATOM 950 N ALA A 144 26.194 -10.558 -9.107 1.00 0.00 N ATOM 951 CA ALA A 144 25.432 -9.993 -8.003 1.00 0.00 C ATOM 952 C ALA A 144 24.990 -8.571 -8.329 1.00 0.00 C ATOM 953 O ALA A 144 23.835 -8.206 -8.117 1.00 0.00 O ATOM 954 CB ALA A 144 26.288 -9.988 -6.735 1.00 0.00 C ATOM 0 H ALA A 144 27.167 -10.773 -8.887 1.00 0.00 H new ATOM 0 HA ALA A 144 24.545 -10.606 -7.842 1.00 0.00 H new ATOM 0 HB1 ALA A 144 25.715 -9.564 -5.911 1.00 0.00 H new ATOM 0 HB2 ALA A 144 26.578 -11.009 -6.488 1.00 0.00 H new ATOM 0 HB3 ALA A 144 27.182 -9.387 -6.902 1.00 0.00 H new ATOM 960 N PHE A 145 25.920 -7.771 -8.837 1.00 0.00 N ATOM 961 CA PHE A 145 25.620 -6.387 -9.184 1.00 0.00 C ATOM 962 C PHE A 145 24.529 -6.330 -10.243 1.00 0.00 C ATOM 963 O PHE A 145 23.617 -5.510 -10.161 1.00 0.00 O ATOM 964 CB PHE A 145 26.877 -5.690 -9.705 1.00 0.00 C ATOM 965 CG PHE A 145 26.591 -4.219 -9.904 1.00 0.00 C ATOM 966 CD1 PHE A 145 26.541 -3.361 -8.796 1.00 0.00 C ATOM 967 CD2 PHE A 145 26.378 -3.713 -11.191 1.00 0.00 C ATOM 968 CE1 PHE A 145 26.278 -1.999 -8.979 1.00 0.00 C ATOM 969 CE2 PHE A 145 26.116 -2.349 -11.372 1.00 0.00 C ATOM 970 CZ PHE A 145 26.065 -1.493 -10.266 1.00 0.00 C ATOM 0 H PHE A 145 26.883 -8.055 -9.017 1.00 0.00 H new ATOM 0 HA PHE A 145 25.271 -5.875 -8.287 1.00 0.00 H new ATOM 0 HB2 PHE A 145 27.697 -5.820 -8.999 1.00 0.00 H new ATOM 0 HB3 PHE A 145 27.192 -6.141 -10.646 1.00 0.00 H new ATOM 0 HD1 PHE A 145 26.705 -3.751 -7.802 1.00 0.00 H new ATOM 0 HD2 PHE A 145 26.416 -4.374 -12.044 1.00 0.00 H new ATOM 0 HE1 PHE A 145 26.239 -1.338 -8.126 1.00 0.00 H new ATOM 0 HE2 PHE A 145 25.953 -1.958 -12.365 1.00 0.00 H new ATOM 0 HZ PHE A 145 25.861 -0.442 -10.406 1.00 0.00 H new ATOM 980 N MET A 146 24.627 -7.206 -11.236 1.00 0.00 N ATOM 981 CA MET A 146 23.644 -7.242 -12.310 1.00 0.00 C ATOM 982 C MET A 146 22.257 -7.563 -11.764 1.00 0.00 C ATOM 983 O MET A 146 21.258 -7.010 -12.222 1.00 0.00 O ATOM 984 CB MET A 146 24.039 -8.295 -13.349 1.00 0.00 C ATOM 985 CG MET A 146 23.025 -8.296 -14.498 1.00 0.00 C ATOM 986 SD MET A 146 21.596 -9.311 -14.042 1.00 0.00 S ATOM 987 CE MET A 146 22.289 -10.910 -14.523 1.00 0.00 C ATOM 0 H MET A 146 25.373 -7.897 -11.319 1.00 0.00 H new ATOM 0 HA MET A 146 23.618 -6.259 -12.779 1.00 0.00 H new ATOM 0 HB2 MET A 146 25.037 -8.084 -13.733 1.00 0.00 H new ATOM 0 HB3 MET A 146 24.078 -9.281 -12.885 1.00 0.00 H new ATOM 0 HG2 MET A 146 22.706 -7.277 -14.716 1.00 0.00 H new ATOM 0 HG3 MET A 146 23.487 -8.686 -15.405 1.00 0.00 H new ATOM 0 HE1 MET A 146 21.911 -11.686 -13.857 1.00 0.00 H new ATOM 0 HE2 MET A 146 21.999 -11.139 -15.548 1.00 0.00 H new ATOM 0 HE3 MET A 146 23.376 -10.871 -14.454 1.00 0.00 H new ATOM 997 N SER A 147 22.200 -8.463 -10.788 1.00 0.00 N ATOM 998 CA SER A 147 20.927 -8.843 -10.191 1.00 0.00 C ATOM 999 C SER A 147 20.343 -7.695 -9.373 1.00 0.00 C ATOM 1000 O SER A 147 19.148 -7.407 -9.450 1.00 0.00 O ATOM 1001 CB SER A 147 21.120 -10.059 -9.295 1.00 0.00 C ATOM 1002 OG SER A 147 19.857 -10.658 -9.039 1.00 0.00 O ATOM 0 H SER A 147 23.013 -8.939 -10.397 1.00 0.00 H new ATOM 0 HA SER A 147 20.232 -9.085 -10.995 1.00 0.00 H new ATOM 0 HB2 SER A 147 21.785 -10.777 -9.775 1.00 0.00 H new ATOM 0 HB3 SER A 147 21.592 -9.764 -8.358 1.00 0.00 H new ATOM 0 HG SER A 147 19.753 -10.803 -8.075 1.00 0.00 H new ATOM 1008 N ILE A 148 21.193 -7.053 -8.579 1.00 0.00 N ATOM 1009 CA ILE A 148 20.751 -5.945 -7.739 1.00 0.00 C ATOM 1010 C ILE A 148 20.092 -4.859 -8.581 1.00 0.00 C ATOM 1011 O ILE A 148 19.189 -4.164 -8.117 1.00 0.00 O ATOM 1012 CB ILE A 148 21.942 -5.355 -6.976 1.00 0.00 C ATOM 1013 CG1 ILE A 148 22.422 -6.358 -5.924 1.00 0.00 C ATOM 1014 CG2 ILE A 148 21.520 -4.055 -6.281 1.00 0.00 C ATOM 1015 CD1 ILE A 148 23.771 -5.906 -5.368 1.00 0.00 C ATOM 0 H ILE A 148 22.185 -7.278 -8.499 1.00 0.00 H new ATOM 0 HA ILE A 148 20.019 -6.327 -7.027 1.00 0.00 H new ATOM 0 HB ILE A 148 22.749 -5.145 -7.678 1.00 0.00 H new ATOM 0 HG12 ILE A 148 21.692 -6.434 -5.118 1.00 0.00 H new ATOM 0 HG13 ILE A 148 22.513 -7.350 -6.367 1.00 0.00 H new ATOM 0 HG21 ILE A 148 22.370 -3.639 -5.740 1.00 0.00 H new ATOM 0 HG22 ILE A 148 21.179 -3.338 -7.027 1.00 0.00 H new ATOM 0 HG23 ILE A 148 20.711 -4.263 -5.581 1.00 0.00 H new ATOM 0 HD11 ILE A 148 24.113 -6.620 -4.619 1.00 0.00 H new ATOM 0 HD12 ILE A 148 24.499 -5.853 -6.178 1.00 0.00 H new ATOM 0 HD13 ILE A 148 23.665 -4.922 -4.910 1.00 0.00 H new ATOM 1027 N LYS A 149 20.546 -4.719 -9.819 1.00 0.00 N ATOM 1028 CA LYS A 149 19.990 -3.712 -10.711 1.00 0.00 C ATOM 1029 C LYS A 149 18.514 -3.979 -10.970 1.00 0.00 C ATOM 1030 O LYS A 149 17.701 -3.057 -10.980 1.00 0.00 O ATOM 1031 CB LYS A 149 20.748 -3.715 -12.036 1.00 0.00 C ATOM 1032 CG LYS A 149 22.134 -3.093 -11.839 1.00 0.00 C ATOM 1033 CD LYS A 149 22.949 -3.226 -13.132 1.00 0.00 C ATOM 1034 CE LYS A 149 22.490 -2.176 -14.149 1.00 0.00 C ATOM 1035 NZ LYS A 149 23.431 -2.152 -15.296 1.00 0.00 N1+ ATOM 0 H LYS A 149 21.291 -5.285 -10.225 1.00 0.00 H new ATOM 0 HA LYS A 149 20.092 -2.737 -10.234 1.00 0.00 H new ATOM 0 HB2 LYS A 149 20.846 -4.735 -12.408 1.00 0.00 H new ATOM 0 HB3 LYS A 149 20.190 -3.154 -12.786 1.00 0.00 H new ATOM 0 HG2 LYS A 149 22.036 -2.042 -11.566 1.00 0.00 H new ATOM 0 HG3 LYS A 149 22.652 -3.589 -11.018 1.00 0.00 H new ATOM 0 HD2 LYS A 149 24.010 -3.098 -12.918 1.00 0.00 H new ATOM 0 HD3 LYS A 149 22.826 -4.226 -13.548 1.00 0.00 H new ATOM 0 HE2 LYS A 149 21.483 -2.407 -14.496 1.00 0.00 H new ATOM 0 HE3 LYS A 149 22.448 -1.193 -13.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 23.119 -1.439 -15.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 24.385 -1.912 -14.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 23.450 -3.088 -15.749 1.00 0.00 H new