USER MOD reduce.3.24.130724 H: found=0, std=0, add=822, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 828 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 144 MET CE :methyl 146:sc= -7.16! (180deg=-3.83) USER MOD Set 1.2: B1919 TYR OH : rot 180:sc= -0.847 USER MOD Set 2.1: A 124 MET CE :methyl -138:sc= -4.96 (180deg=-9.72!) USER MOD Set 2.2: B1916 TYR OH : rot 180:sc= 0.388 USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= -0.123 K(o=-0.12,f=-1.2!) USER MOD Single : A 81 SER OG : rot 43:sc= 0.0167 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= -0.015 X(o=-0.015,f=-0.4) USER MOD Single : A 101 SER OG : rot -35:sc= 1.14 USER MOD Single : A 107 HIS :FLIP no HD1:sc= -0.104 F(o=-0.73,f=-0.1) USER MOD Single : A 109 MET CE :methyl -105:sc= -0.0628 (180deg=-2.99!) USER MOD Single : A 110 THR OG1 : rot -61:sc= 1.17 USER MOD Single : A 111 ASN : amide:sc= -0.0473 X(o=-0.047,f=-0.047) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 HIS : no HD1:sc= -0.402 X(o=-0.4,f=-0.07) USER MOD Single : A 137 ASN : amide:sc= -2.08 K(o=-2.1,f=-3.6!) USER MOD Single : A 138 TYR OH : rot 176:sc= -0.116 USER MOD Single : A 145 MET CE :methyl 140:sc= -0.209 (180deg=-0.304) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B1901 LYS NZ :NH3+ 152:sc= -0.0703 (180deg=-0.519) USER MOD Single : B1903 LYS NZ :NH3+ -174:sc= 0.349 (180deg=0.327) USER MOD Single : B1904 GLN : amide:sc= -0.112 X(o=-0.11,f=-0.11) USER MOD Single : B1908 SER OG : rot 98:sc= -4.59! USER MOD Single : B1913 GLN : amide:sc= -0.457 K(o=-0.46,f=-2.8!) USER MOD Single : B1922 LYS NZ :NH3+ 154:sc= -0.0407 (180deg=-0.531) USER MOD Single : B1923 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B1924 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B1926 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B1927 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 76 1.046 19.008 -3.318 1.00 0.00 N ATOM 2 CA MET A 76 2.344 19.288 -3.986 1.00 0.00 C ATOM 3 C MET A 76 3.445 18.373 -3.459 1.00 0.00 C ATOM 4 O MET A 76 4.034 17.596 -4.211 1.00 0.00 O ATOM 5 CB MET A 76 2.713 20.752 -3.742 1.00 0.00 C ATOM 6 CG MET A 76 2.133 21.705 -4.774 1.00 0.00 C ATOM 7 SD MET A 76 3.012 21.644 -6.347 1.00 0.00 S ATOM 8 CE MET A 76 2.556 23.225 -7.053 1.00 0.00 C ATOM 0 HA MET A 76 2.243 19.099 -5.055 1.00 0.00 H new ATOM 0 HB2 MET A 76 2.365 21.046 -2.752 1.00 0.00 H new ATOM 0 HB3 MET A 76 3.799 20.849 -3.740 1.00 0.00 H new ATOM 0 HG2 MET A 76 1.084 21.461 -4.939 1.00 0.00 H new ATOM 0 HG3 MET A 76 2.166 22.722 -4.383 1.00 0.00 H new ATOM 0 HE1 MET A 76 3.024 23.335 -8.031 1.00 0.00 H new ATOM 0 HE2 MET A 76 1.473 23.276 -7.161 1.00 0.00 H new ATOM 0 HE3 MET A 76 2.893 24.027 -6.397 1.00 0.00 H new ATOM 20 N LYS A 77 3.717 18.470 -2.161 1.00 0.00 N ATOM 21 CA LYS A 77 4.746 17.651 -1.533 1.00 0.00 C ATOM 22 C LYS A 77 4.411 17.389 -0.067 1.00 0.00 C ATOM 23 O LYS A 77 5.015 17.973 0.834 1.00 0.00 O ATOM 24 CB LYS A 77 6.111 18.334 -1.648 1.00 0.00 C ATOM 25 CG LYS A 77 6.895 17.923 -2.884 1.00 0.00 C ATOM 26 CD LYS A 77 7.693 19.086 -3.451 1.00 0.00 C ATOM 27 CE LYS A 77 7.791 19.008 -4.966 1.00 0.00 C ATOM 28 NZ LYS A 77 6.764 19.852 -5.634 1.00 0.00 N1+ ATOM 0 H LYS A 77 3.239 19.108 -1.525 1.00 0.00 H new ATOM 0 HA LYS A 77 4.785 16.694 -2.053 1.00 0.00 H new ATOM 0 HB2 LYS A 77 5.967 19.414 -1.662 1.00 0.00 H new ATOM 0 HB3 LYS A 77 6.700 18.102 -0.761 1.00 0.00 H new ATOM 0 HG2 LYS A 77 7.571 17.106 -2.632 1.00 0.00 H new ATOM 0 HG3 LYS A 77 6.209 17.547 -3.643 1.00 0.00 H new ATOM 0 HD2 LYS A 77 7.222 20.026 -3.164 1.00 0.00 H new ATOM 0 HD3 LYS A 77 8.694 19.086 -3.020 1.00 0.00 H new ATOM 0 HE2 LYS A 77 8.784 19.327 -5.282 1.00 0.00 H new ATOM 0 HE3 LYS A 77 7.672 17.972 -5.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 6.865 19.771 -6.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 5.815 19.532 -5.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 6.893 20.844 -5.351 1.00 0.00 H new ATOM 42 N GLU A 78 3.443 16.508 0.165 1.00 0.00 N ATOM 43 CA GLU A 78 3.027 16.170 1.521 1.00 0.00 C ATOM 44 C GLU A 78 3.525 14.782 1.912 1.00 0.00 C ATOM 45 O GLU A 78 4.239 14.130 1.150 1.00 0.00 O ATOM 46 CB GLU A 78 1.503 16.233 1.639 1.00 0.00 C ATOM 47 CG GLU A 78 0.986 17.586 2.102 1.00 0.00 C ATOM 48 CD GLU A 78 0.961 17.715 3.612 1.00 0.00 C ATOM 49 OE1 GLU A 78 0.630 16.717 4.287 1.00 0.00 O ATOM 50 OE2 GLU A 78 1.274 18.812 4.120 1.00 0.00 O1- ATOM 0 H GLU A 78 2.932 16.016 -0.568 1.00 0.00 H new ATOM 0 HA GLU A 78 3.466 16.898 2.203 1.00 0.00 H new ATOM 0 HB2 GLU A 78 1.061 15.996 0.671 1.00 0.00 H new ATOM 0 HB3 GLU A 78 1.169 15.466 2.338 1.00 0.00 H new ATOM 0 HG2 GLU A 78 1.614 18.373 1.684 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.020 17.740 1.711 1.00 0.00 H new ATOM 57 N GLN A 79 3.145 14.336 3.105 1.00 0.00 N ATOM 58 CA GLN A 79 3.552 13.026 3.599 1.00 0.00 C ATOM 59 C GLN A 79 2.348 12.230 4.090 1.00 0.00 C ATOM 60 O GLN A 79 2.457 11.425 5.015 1.00 0.00 O ATOM 61 CB GLN A 79 4.571 13.178 4.729 1.00 0.00 C ATOM 62 CG GLN A 79 5.888 13.792 4.281 1.00 0.00 C ATOM 63 CD GLN A 79 6.654 14.425 5.426 1.00 0.00 C ATOM 64 OE1 GLN A 79 6.062 14.961 6.363 1.00 0.00 O ATOM 65 NE2 GLN A 79 7.978 14.367 5.354 1.00 0.00 N ATOM 0 H GLN A 79 2.555 14.864 3.748 1.00 0.00 H new ATOM 0 HA GLN A 79 4.012 12.482 2.774 1.00 0.00 H new ATOM 0 HB2 GLN A 79 4.140 13.797 5.515 1.00 0.00 H new ATOM 0 HB3 GLN A 79 4.766 12.198 5.166 1.00 0.00 H new ATOM 0 HG2 GLN A 79 6.505 13.022 3.818 1.00 0.00 H new ATOM 0 HG3 GLN A 79 5.693 14.546 3.518 1.00 0.00 H new ATOM 0 HE21 GLN A 79 8.426 13.913 4.558 1.00 0.00 H new ATOM 0 HE22 GLN A 79 8.547 14.777 6.094 1.00 0.00 H new ATOM 74 N ASP A 80 1.199 12.461 3.464 1.00 0.00 N ATOM 75 CA ASP A 80 -0.029 11.765 3.836 1.00 0.00 C ATOM 76 C ASP A 80 0.036 10.297 3.429 1.00 0.00 C ATOM 77 O ASP A 80 -0.328 9.411 4.203 1.00 0.00 O ATOM 78 CB ASP A 80 -1.238 12.435 3.182 1.00 0.00 C ATOM 79 CG ASP A 80 -1.047 12.646 1.692 1.00 0.00 C ATOM 80 OD1 ASP A 80 -1.187 11.665 0.932 1.00 0.00 O1- ATOM 81 OD2 ASP A 80 -0.758 13.791 1.287 1.00 0.00 O ATOM 0 H ASP A 80 1.092 13.124 2.697 1.00 0.00 H new ATOM 0 HA ASP A 80 -0.135 11.820 4.919 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -2.124 11.822 3.349 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -1.421 13.397 3.662 1.00 0.00 H new ATOM 86 N SER A 81 0.502 10.046 2.209 1.00 0.00 N ATOM 87 CA SER A 81 0.616 8.685 1.698 1.00 0.00 C ATOM 88 C SER A 81 1.541 7.850 2.577 1.00 0.00 C ATOM 89 O SER A 81 1.212 6.722 2.946 1.00 0.00 O ATOM 90 CB SER A 81 1.139 8.701 0.261 1.00 0.00 C ATOM 91 OG SER A 81 0.126 9.093 -0.648 1.00 0.00 O ATOM 0 H SER A 81 0.807 10.768 1.556 1.00 0.00 H new ATOM 0 HA SER A 81 -0.376 8.233 1.713 1.00 0.00 H new ATOM 0 HB2 SER A 81 1.984 9.386 0.186 1.00 0.00 H new ATOM 0 HB3 SER A 81 1.507 7.710 -0.006 1.00 0.00 H new ATOM 0 HG SER A 81 -0.375 9.848 -0.274 1.00 0.00 H new ATOM 97 N GLU A 82 2.699 8.411 2.905 1.00 0.00 N ATOM 98 CA GLU A 82 3.677 7.719 3.737 1.00 0.00 C ATOM 99 C GLU A 82 3.089 7.368 5.102 1.00 0.00 C ATOM 100 O GLU A 82 3.069 6.203 5.498 1.00 0.00 O ATOM 101 CB GLU A 82 4.924 8.587 3.916 1.00 0.00 C ATOM 102 CG GLU A 82 6.166 7.800 4.297 1.00 0.00 C ATOM 103 CD GLU A 82 7.420 8.331 3.630 1.00 0.00 C ATOM 104 OE1 GLU A 82 7.341 8.733 2.451 1.00 0.00 O1- ATOM 105 OE2 GLU A 82 8.481 8.345 4.289 1.00 0.00 O ATOM 0 H GLU A 82 2.984 9.344 2.607 1.00 0.00 H new ATOM 0 HA GLU A 82 3.952 6.792 3.234 1.00 0.00 H new ATOM 0 HB2 GLU A 82 5.117 9.126 2.989 1.00 0.00 H new ATOM 0 HB3 GLU A 82 4.728 9.335 4.685 1.00 0.00 H new ATOM 0 HG2 GLU A 82 6.294 7.831 5.379 1.00 0.00 H new ATOM 0 HG3 GLU A 82 6.028 6.754 4.022 1.00 0.00 H new ATOM 112 N GLU A 83 2.617 8.382 5.820 1.00 0.00 N ATOM 113 CA GLU A 83 2.036 8.178 7.144 1.00 0.00 C ATOM 114 C GLU A 83 0.826 7.249 7.084 1.00 0.00 C ATOM 115 O GLU A 83 0.672 6.361 7.922 1.00 0.00 O ATOM 116 CB GLU A 83 1.632 9.520 7.758 1.00 0.00 C ATOM 117 CG GLU A 83 1.458 9.471 9.267 1.00 0.00 C ATOM 118 CD GLU A 83 1.652 10.825 9.921 1.00 0.00 C ATOM 119 OE1 GLU A 83 2.367 11.667 9.339 1.00 0.00 O ATOM 120 OE2 GLU A 83 1.087 11.043 11.013 1.00 0.00 O1- ATOM 0 H GLU A 83 2.625 9.353 5.508 1.00 0.00 H new ATOM 0 HA GLU A 83 2.794 7.708 7.771 1.00 0.00 H new ATOM 0 HB2 GLU A 83 2.389 10.265 7.512 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.698 9.852 7.304 1.00 0.00 H new ATOM 0 HG2 GLU A 83 0.461 9.098 9.502 1.00 0.00 H new ATOM 0 HG3 GLU A 83 2.171 8.763 9.688 1.00 0.00 H new ATOM 127 N GLU A 84 -0.036 7.465 6.095 1.00 0.00 N ATOM 128 CA GLU A 84 -1.236 6.649 5.937 1.00 0.00 C ATOM 129 C GLU A 84 -0.884 5.216 5.544 1.00 0.00 C ATOM 130 O GLU A 84 -1.365 4.259 6.150 1.00 0.00 O ATOM 131 CB GLU A 84 -2.160 7.264 4.886 1.00 0.00 C ATOM 132 CG GLU A 84 -2.777 8.585 5.316 1.00 0.00 C ATOM 133 CD GLU A 84 -4.018 8.398 6.168 1.00 0.00 C ATOM 134 OE1 GLU A 84 -4.202 7.290 6.714 1.00 0.00 O1- ATOM 135 OE2 GLU A 84 -4.804 9.361 6.289 1.00 0.00 O ATOM 0 H GLU A 84 0.073 8.196 5.392 1.00 0.00 H new ATOM 0 HA GLU A 84 -1.750 6.623 6.898 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -1.597 7.418 3.965 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -2.958 6.557 4.658 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -2.040 9.161 5.875 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -3.033 9.168 4.431 1.00 0.00 H new ATOM 142 N LEU A 85 -0.043 5.077 4.523 1.00 0.00 N ATOM 143 CA LEU A 85 0.376 3.769 4.038 1.00 0.00 C ATOM 144 C LEU A 85 0.999 2.935 5.156 1.00 0.00 C ATOM 145 O LEU A 85 0.617 1.784 5.368 1.00 0.00 O ATOM 146 CB LEU A 85 1.364 3.961 2.884 1.00 0.00 C ATOM 147 CG LEU A 85 2.006 2.696 2.308 1.00 0.00 C ATOM 148 CD1 LEU A 85 3.120 2.178 3.206 1.00 0.00 C ATOM 149 CD2 LEU A 85 0.964 1.618 2.066 1.00 0.00 C ATOM 0 H LEU A 85 0.363 5.862 4.013 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.498 3.224 3.683 1.00 0.00 H new ATOM 0 HB2 LEU A 85 0.846 4.478 2.076 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.161 4.621 3.225 1.00 0.00 H new ATOM 0 HG LEU A 85 2.450 2.962 1.349 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.553 1.279 2.767 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.892 2.941 3.306 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.714 1.941 4.190 1.00 0.00 H new ATOM 0 HD21 LEU A 85 1.447 0.731 1.657 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.477 1.365 3.008 1.00 0.00 H new ATOM 0 HD23 LEU A 85 0.219 1.984 1.359 1.00 0.00 H new ATOM 161 N ILE A 86 1.958 3.520 5.869 1.00 0.00 N ATOM 162 CA ILE A 86 2.629 2.825 6.964 1.00 0.00 C ATOM 163 C ILE A 86 1.622 2.372 8.021 1.00 0.00 C ATOM 164 O ILE A 86 1.782 1.313 8.628 1.00 0.00 O ATOM 165 CB ILE A 86 3.707 3.721 7.619 1.00 0.00 C ATOM 166 CG1 ILE A 86 4.709 4.197 6.565 1.00 0.00 C ATOM 167 CG2 ILE A 86 4.434 2.983 8.737 1.00 0.00 C ATOM 168 CD1 ILE A 86 5.339 5.533 6.892 1.00 0.00 C ATOM 0 H ILE A 86 2.287 4.472 5.709 1.00 0.00 H new ATOM 0 HA ILE A 86 3.117 1.947 6.542 1.00 0.00 H new ATOM 0 HB ILE A 86 3.207 4.586 8.054 1.00 0.00 H new ATOM 0 HG12 ILE A 86 5.495 3.450 6.459 1.00 0.00 H new ATOM 0 HG13 ILE A 86 4.205 4.268 5.601 1.00 0.00 H new ATOM 0 HG21 ILE A 86 5.185 3.639 9.177 1.00 0.00 H new ATOM 0 HG22 ILE A 86 3.718 2.686 9.503 1.00 0.00 H new ATOM 0 HG23 ILE A 86 4.920 2.096 8.331 1.00 0.00 H new ATOM 0 HD11 ILE A 86 6.038 5.809 6.103 1.00 0.00 H new ATOM 0 HD12 ILE A 86 4.561 6.293 6.969 1.00 0.00 H new ATOM 0 HD13 ILE A 86 5.872 5.462 7.840 1.00 0.00 H new ATOM 180 N GLU A 87 0.586 3.175 8.230 1.00 0.00 N ATOM 181 CA GLU A 87 -0.446 2.850 9.207 1.00 0.00 C ATOM 182 C GLU A 87 -1.334 1.720 8.694 1.00 0.00 C ATOM 183 O GLU A 87 -1.635 0.769 9.419 1.00 0.00 O ATOM 184 CB GLU A 87 -1.297 4.084 9.514 1.00 0.00 C ATOM 185 CG GLU A 87 -1.847 4.109 10.931 1.00 0.00 C ATOM 186 CD GLU A 87 -2.748 5.301 11.184 1.00 0.00 C ATOM 187 OE1 GLU A 87 -3.913 5.273 10.731 1.00 0.00 O1- ATOM 188 OE2 GLU A 87 -2.291 6.264 11.834 1.00 0.00 O ATOM 0 H GLU A 87 0.438 4.055 7.737 1.00 0.00 H new ATOM 0 HA GLU A 87 0.043 2.521 10.124 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -0.696 4.979 9.351 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -2.128 4.126 8.810 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -2.404 3.191 11.117 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -1.018 4.128 11.639 1.00 0.00 H new ATOM 195 N ALA A 88 -1.748 1.830 7.435 1.00 0.00 N ATOM 196 CA ALA A 88 -2.599 0.821 6.818 1.00 0.00 C ATOM 197 C ALA A 88 -1.912 -0.537 6.798 1.00 0.00 C ATOM 198 O ALA A 88 -2.510 -1.551 7.159 1.00 0.00 O ATOM 199 CB ALA A 88 -2.973 1.241 5.408 1.00 0.00 C ATOM 0 H ALA A 88 -1.507 2.609 6.823 1.00 0.00 H new ATOM 0 HA ALA A 88 -3.507 0.732 7.415 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.609 0.479 4.958 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -3.511 2.189 5.441 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -2.068 1.358 4.811 1.00 0.00 H new ATOM 205 N PHE A 89 -0.653 -0.553 6.375 1.00 0.00 N ATOM 206 CA PHE A 89 0.109 -1.792 6.313 1.00 0.00 C ATOM 207 C PHE A 89 0.395 -2.316 7.711 1.00 0.00 C ATOM 208 O PHE A 89 0.396 -3.523 7.950 1.00 0.00 O ATOM 209 CB PHE A 89 1.419 -1.592 5.541 1.00 0.00 C ATOM 210 CG PHE A 89 1.336 -1.950 4.079 1.00 0.00 C ATOM 211 CD1 PHE A 89 0.612 -3.055 3.648 1.00 0.00 C ATOM 212 CD2 PHE A 89 1.990 -1.177 3.133 1.00 0.00 C ATOM 213 CE1 PHE A 89 0.545 -3.379 2.307 1.00 0.00 C ATOM 214 CE2 PHE A 89 1.926 -1.497 1.791 1.00 0.00 C ATOM 215 CZ PHE A 89 1.203 -2.599 1.377 1.00 0.00 C ATOM 0 H PHE A 89 -0.141 0.275 6.071 1.00 0.00 H new ATOM 0 HA PHE A 89 -0.492 -2.530 5.781 1.00 0.00 H new ATOM 0 HB2 PHE A 89 1.725 -0.550 5.631 1.00 0.00 H new ATOM 0 HB3 PHE A 89 2.198 -2.195 6.007 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.095 -3.668 4.371 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.557 -0.314 3.449 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -0.021 -4.241 1.986 1.00 0.00 H new ATOM 0 HE2 PHE A 89 2.441 -0.886 1.065 1.00 0.00 H new ATOM 0 HZ PHE A 89 1.153 -2.850 0.328 1.00 0.00 H new ATOM 225 N LYS A 90 0.627 -1.392 8.634 1.00 0.00 N ATOM 226 CA LYS A 90 0.905 -1.740 10.028 1.00 0.00 C ATOM 227 C LYS A 90 -0.180 -2.663 10.577 1.00 0.00 C ATOM 228 O LYS A 90 0.096 -3.582 11.348 1.00 0.00 O ATOM 229 CB LYS A 90 0.995 -0.473 10.883 1.00 0.00 C ATOM 230 CG LYS A 90 2.415 0.025 11.085 1.00 0.00 C ATOM 231 CD LYS A 90 2.435 1.400 11.733 1.00 0.00 C ATOM 232 CE LYS A 90 3.851 1.841 12.065 1.00 0.00 C ATOM 233 NZ LYS A 90 3.924 3.299 12.355 1.00 0.00 N1+ ATOM 0 H LYS A 90 0.629 -0.390 8.444 1.00 0.00 H new ATOM 0 HA LYS A 90 1.861 -2.263 10.067 1.00 0.00 H new ATOM 0 HB2 LYS A 90 0.406 0.315 10.413 1.00 0.00 H new ATOM 0 HB3 LYS A 90 0.546 -0.669 11.857 1.00 0.00 H new ATOM 0 HG2 LYS A 90 2.964 -0.681 11.709 1.00 0.00 H new ATOM 0 HG3 LYS A 90 2.927 0.067 10.124 1.00 0.00 H new ATOM 0 HD2 LYS A 90 1.975 2.126 11.062 1.00 0.00 H new ATOM 0 HD3 LYS A 90 1.836 1.383 12.643 1.00 0.00 H new ATOM 0 HE2 LYS A 90 4.213 1.281 12.927 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.511 1.603 11.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 4.906 3.560 12.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 3.603 3.835 11.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.315 3.522 13.168 1.00 0.00 H new ATOM 247 N VAL A 91 -1.413 -2.411 10.157 1.00 0.00 N ATOM 248 CA VAL A 91 -2.549 -3.215 10.584 1.00 0.00 C ATOM 249 C VAL A 91 -2.445 -4.641 10.045 1.00 0.00 C ATOM 250 O VAL A 91 -2.962 -5.582 10.648 1.00 0.00 O ATOM 251 CB VAL A 91 -3.878 -2.597 10.111 1.00 0.00 C ATOM 252 CG1 VAL A 91 -5.062 -3.345 10.706 1.00 0.00 C ATOM 253 CG2 VAL A 91 -3.935 -1.119 10.468 1.00 0.00 C ATOM 0 H VAL A 91 -1.652 -1.652 9.518 1.00 0.00 H new ATOM 0 HA VAL A 91 -2.532 -3.238 11.674 1.00 0.00 H new ATOM 0 HB VAL A 91 -3.933 -2.688 9.026 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -5.990 -2.892 10.359 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -5.028 -4.388 10.392 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -5.017 -3.291 11.794 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -4.881 -0.698 10.126 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -3.855 -1.002 11.549 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -3.110 -0.596 9.985 1.00 0.00 H new ATOM 263 N PHE A 92 -1.773 -4.794 8.904 1.00 0.00 N ATOM 264 CA PHE A 92 -1.605 -6.104 8.286 1.00 0.00 C ATOM 265 C PHE A 92 -0.200 -6.651 8.530 1.00 0.00 C ATOM 266 O PHE A 92 0.326 -7.415 7.720 1.00 0.00 O ATOM 267 CB PHE A 92 -1.875 -6.018 6.783 1.00 0.00 C ATOM 268 CG PHE A 92 -3.324 -5.815 6.444 1.00 0.00 C ATOM 269 CD1 PHE A 92 -4.271 -6.765 6.792 1.00 0.00 C ATOM 270 CD2 PHE A 92 -3.738 -4.672 5.778 1.00 0.00 C ATOM 271 CE1 PHE A 92 -5.605 -6.580 6.481 1.00 0.00 C ATOM 272 CE2 PHE A 92 -5.071 -4.481 5.463 1.00 0.00 C ATOM 273 CZ PHE A 92 -6.005 -5.436 5.815 1.00 0.00 C ATOM 0 H PHE A 92 -1.338 -4.027 8.392 1.00 0.00 H new ATOM 0 HA PHE A 92 -2.323 -6.786 8.742 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -1.294 -5.197 6.364 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -1.523 -6.933 6.306 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -3.963 -7.660 7.312 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -3.011 -3.922 5.502 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -6.334 -7.328 6.758 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -5.381 -3.587 4.943 1.00 0.00 H new ATOM 0 HZ PHE A 92 -7.047 -5.289 5.570 1.00 0.00 H new ATOM 283 N ASP A 93 0.402 -6.257 9.647 1.00 0.00 N ATOM 284 CA ASP A 93 1.743 -6.711 9.993 1.00 0.00 C ATOM 285 C ASP A 93 1.707 -8.132 10.547 1.00 0.00 C ATOM 286 O ASP A 93 1.131 -8.380 11.606 1.00 0.00 O ATOM 287 CB ASP A 93 2.376 -5.768 11.017 1.00 0.00 C ATOM 288 CG ASP A 93 3.889 -5.744 10.927 1.00 0.00 C ATOM 289 OD1 ASP A 93 4.469 -6.727 10.418 1.00 0.00 O1- ATOM 290 OD2 ASP A 93 4.495 -4.744 11.367 1.00 0.00 O ATOM 0 H ASP A 93 -0.018 -5.624 10.328 1.00 0.00 H new ATOM 0 HA ASP A 93 2.347 -6.707 9.086 1.00 0.00 H new ATOM 0 HB2 ASP A 93 1.990 -4.760 10.865 1.00 0.00 H new ATOM 0 HB3 ASP A 93 2.080 -6.075 12.020 1.00 0.00 H new ATOM 295 N ARG A 94 2.322 -9.063 9.824 1.00 0.00 N ATOM 296 CA ARG A 94 2.355 -10.460 10.245 1.00 0.00 C ATOM 297 C ARG A 94 3.758 -10.872 10.677 1.00 0.00 C ATOM 298 O ARG A 94 3.932 -11.535 11.700 1.00 0.00 O ATOM 299 CB ARG A 94 1.874 -11.368 9.111 1.00 0.00 C ATOM 300 CG ARG A 94 0.403 -11.187 8.771 1.00 0.00 C ATOM 301 CD ARG A 94 -0.469 -12.183 9.518 1.00 0.00 C ATOM 302 NE ARG A 94 -1.881 -12.049 9.163 1.00 0.00 N ATOM 303 CZ ARG A 94 -2.880 -12.610 9.847 1.00 0.00 C ATOM 304 NH1 ARG A 94 -2.634 -13.346 10.925 1.00 0.00 N1+ ATOM 305 NH2 ARG A 94 -4.132 -12.431 9.451 1.00 0.00 N ATOM 0 H ARG A 94 2.804 -8.876 8.945 1.00 0.00 H new ATOM 0 HA ARG A 94 1.687 -10.567 11.100 1.00 0.00 H new ATOM 0 HB2 ARG A 94 2.471 -11.171 8.221 1.00 0.00 H new ATOM 0 HB3 ARG A 94 2.049 -12.407 9.389 1.00 0.00 H new ATOM 0 HG2 ARG A 94 0.093 -10.172 9.020 1.00 0.00 H new ATOM 0 HG3 ARG A 94 0.259 -11.309 7.698 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -0.134 -13.196 9.296 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -0.350 -12.036 10.591 1.00 0.00 H new ATOM 0 HE ARG A 94 -2.117 -11.492 8.342 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -1.673 -13.487 11.238 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -3.406 -13.770 11.440 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -4.330 -11.866 8.625 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -4.898 -12.859 9.972 1.00 0.00 H new ATOM 319 N ASP A 95 4.757 -10.478 9.894 1.00 0.00 N ATOM 320 CA ASP A 95 6.142 -10.811 10.201 1.00 0.00 C ATOM 321 C ASP A 95 6.555 -10.249 11.558 1.00 0.00 C ATOM 322 O ASP A 95 7.413 -10.811 12.238 1.00 0.00 O ATOM 323 CB ASP A 95 7.068 -10.276 9.109 1.00 0.00 C ATOM 324 CG ASP A 95 8.273 -11.168 8.882 1.00 0.00 C ATOM 325 OD1 ASP A 95 8.157 -12.132 8.095 1.00 0.00 O1- ATOM 326 OD2 ASP A 95 9.331 -10.904 9.490 1.00 0.00 O ATOM 0 H ASP A 95 4.633 -9.929 9.044 1.00 0.00 H new ATOM 0 HA ASP A 95 6.227 -11.897 10.242 1.00 0.00 H new ATOM 0 HB2 ASP A 95 6.510 -10.181 8.178 1.00 0.00 H new ATOM 0 HB3 ASP A 95 7.406 -9.276 9.381 1.00 0.00 H new ATOM 331 N GLY A 96 5.942 -9.136 11.946 1.00 0.00 N ATOM 332 CA GLY A 96 6.261 -8.518 13.220 1.00 0.00 C ATOM 333 C GLY A 96 7.098 -7.265 13.061 1.00 0.00 C ATOM 334 O GLY A 96 6.724 -6.194 13.541 1.00 0.00 O ATOM 0 H GLY A 96 5.230 -8.650 11.401 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.337 -8.270 13.742 1.00 0.00 H new ATOM 0 HA3 GLY A 96 6.797 -9.233 13.843 1.00 0.00 H new ATOM 338 N ASN A 97 8.234 -7.397 12.385 1.00 0.00 N ATOM 339 CA ASN A 97 9.126 -6.267 12.162 1.00 0.00 C ATOM 340 C ASN A 97 8.470 -5.229 11.259 1.00 0.00 C ATOM 341 O ASN A 97 8.442 -4.041 11.579 1.00 0.00 O ATOM 342 CB ASN A 97 10.442 -6.742 11.541 1.00 0.00 C ATOM 343 CG ASN A 97 11.456 -5.622 11.407 1.00 0.00 C ATOM 344 OD1 ASN A 97 11.371 -4.798 10.496 1.00 0.00 O ATOM 345 ND2 ASN A 97 12.422 -5.586 12.318 1.00 0.00 N ATOM 0 H ASN A 97 8.558 -8.276 11.982 1.00 0.00 H new ATOM 0 HA ASN A 97 9.335 -5.805 13.127 1.00 0.00 H new ATOM 0 HB2 ASN A 97 10.863 -7.538 12.154 1.00 0.00 H new ATOM 0 HB3 ASN A 97 10.244 -7.168 10.558 1.00 0.00 H new ATOM 0 HD21 ASN A 97 13.132 -4.855 12.280 1.00 0.00 H new ATOM 0 HD22 ASN A 97 12.454 -6.290 13.056 1.00 0.00 H new ATOM 352 N GLY A 98 7.939 -5.687 10.129 1.00 0.00 N ATOM 353 CA GLY A 98 7.287 -4.785 9.199 1.00 0.00 C ATOM 354 C GLY A 98 7.258 -5.327 7.782 1.00 0.00 C ATOM 355 O GLY A 98 7.514 -4.594 6.827 1.00 0.00 O ATOM 0 H GLY A 98 7.949 -6.666 9.842 1.00 0.00 H new ATOM 0 HA2 GLY A 98 6.266 -4.600 9.534 1.00 0.00 H new ATOM 0 HA3 GLY A 98 7.804 -3.826 9.206 1.00 0.00 H new ATOM 359 N LEU A 99 6.944 -6.612 7.646 1.00 0.00 N ATOM 360 CA LEU A 99 6.881 -7.249 6.334 1.00 0.00 C ATOM 361 C LEU A 99 5.483 -7.793 6.062 1.00 0.00 C ATOM 362 O LEU A 99 4.778 -8.208 6.980 1.00 0.00 O ATOM 363 CB LEU A 99 7.910 -8.377 6.238 1.00 0.00 C ATOM 364 CG LEU A 99 9.361 -7.956 6.476 1.00 0.00 C ATOM 365 CD1 LEU A 99 10.148 -9.087 7.118 1.00 0.00 C ATOM 366 CD2 LEU A 99 10.010 -7.526 5.169 1.00 0.00 C ATOM 0 H LEU A 99 6.729 -7.232 8.427 1.00 0.00 H new ATOM 0 HA LEU A 99 7.111 -6.496 5.581 1.00 0.00 H new ATOM 0 HB2 LEU A 99 7.649 -9.148 6.962 1.00 0.00 H new ATOM 0 HB3 LEU A 99 7.837 -8.830 5.249 1.00 0.00 H new ATOM 0 HG LEU A 99 9.366 -7.107 7.159 1.00 0.00 H new ATOM 0 HD11 LEU A 99 11.178 -8.768 7.279 1.00 0.00 H new ATOM 0 HD12 LEU A 99 9.695 -9.348 8.074 1.00 0.00 H new ATOM 0 HD13 LEU A 99 10.136 -9.957 6.461 1.00 0.00 H new ATOM 0 HD21 LEU A 99 11.042 -7.229 5.356 1.00 0.00 H new ATOM 0 HD22 LEU A 99 9.993 -8.357 4.464 1.00 0.00 H new ATOM 0 HD23 LEU A 99 9.460 -6.683 4.750 1.00 0.00 H new ATOM 378 N ILE A 100 5.087 -7.787 4.792 1.00 0.00 N ATOM 379 CA ILE A 100 3.772 -8.279 4.400 1.00 0.00 C ATOM 380 C ILE A 100 3.876 -9.227 3.208 1.00 0.00 C ATOM 381 O ILE A 100 4.557 -8.932 2.225 1.00 0.00 O ATOM 382 CB ILE A 100 2.816 -7.114 4.060 1.00 0.00 C ATOM 383 CG1 ILE A 100 1.408 -7.642 3.770 1.00 0.00 C ATOM 384 CG2 ILE A 100 3.342 -6.308 2.880 1.00 0.00 C ATOM 385 CD1 ILE A 100 0.335 -6.579 3.858 1.00 0.00 C ATOM 0 H ILE A 100 5.658 -7.447 4.018 1.00 0.00 H new ATOM 0 HA ILE A 100 3.364 -8.826 5.250 1.00 0.00 H new ATOM 0 HB ILE A 100 2.764 -6.452 4.925 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.392 -8.082 2.773 1.00 0.00 H new ATOM 0 HG13 ILE A 100 1.176 -8.441 4.474 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.652 -5.493 2.659 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.321 -5.897 3.127 1.00 0.00 H new ATOM 0 HG23 ILE A 100 3.430 -6.955 2.007 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -0.636 -7.024 3.641 1.00 0.00 H new ATOM 0 HD12 ILE A 100 0.324 -6.155 4.862 1.00 0.00 H new ATOM 0 HD13 ILE A 100 0.543 -5.791 3.134 1.00 0.00 H new ATOM 397 N SER A 101 3.200 -10.368 3.305 1.00 0.00 N ATOM 398 CA SER A 101 3.218 -11.362 2.238 1.00 0.00 C ATOM 399 C SER A 101 2.371 -10.909 1.054 1.00 0.00 C ATOM 400 O SER A 101 1.240 -10.455 1.224 1.00 0.00 O ATOM 401 CB SER A 101 2.709 -12.708 2.757 1.00 0.00 C ATOM 402 OG SER A 101 3.777 -13.506 3.240 1.00 0.00 O ATOM 0 H SER A 101 2.633 -10.627 4.112 1.00 0.00 H new ATOM 0 HA SER A 101 4.248 -11.475 1.901 1.00 0.00 H new ATOM 0 HB2 SER A 101 1.985 -12.543 3.555 1.00 0.00 H new ATOM 0 HB3 SER A 101 2.189 -13.236 1.958 1.00 0.00 H new ATOM 0 HG SER A 101 4.575 -13.349 2.694 1.00 0.00 H new ATOM 408 N ALA A 102 2.929 -11.037 -0.147 1.00 0.00 N ATOM 409 CA ALA A 102 2.228 -10.641 -1.363 1.00 0.00 C ATOM 410 C ALA A 102 1.085 -11.599 -1.682 1.00 0.00 C ATOM 411 O ALA A 102 0.046 -11.189 -2.200 1.00 0.00 O ATOM 412 CB ALA A 102 3.201 -10.577 -2.530 1.00 0.00 C ATOM 0 H ALA A 102 3.865 -11.412 -0.303 1.00 0.00 H new ATOM 0 HA ALA A 102 1.800 -9.652 -1.198 1.00 0.00 H new ATOM 0 HB1 ALA A 102 2.667 -10.280 -3.433 1.00 0.00 H new ATOM 0 HB2 ALA A 102 3.981 -9.847 -2.314 1.00 0.00 H new ATOM 0 HB3 ALA A 102 3.653 -11.557 -2.681 1.00 0.00 H new ATOM 418 N ALA A 103 1.285 -12.877 -1.374 1.00 0.00 N ATOM 419 CA ALA A 103 0.274 -13.897 -1.633 1.00 0.00 C ATOM 420 C ALA A 103 -1.046 -13.561 -0.945 1.00 0.00 C ATOM 421 O ALA A 103 -2.099 -13.533 -1.582 1.00 0.00 O ATOM 422 CB ALA A 103 0.775 -15.260 -1.179 1.00 0.00 C ATOM 0 H ALA A 103 2.139 -13.231 -0.944 1.00 0.00 H new ATOM 0 HA ALA A 103 0.092 -13.924 -2.707 1.00 0.00 H new ATOM 0 HB1 ALA A 103 0.012 -16.013 -1.377 1.00 0.00 H new ATOM 0 HB2 ALA A 103 1.685 -15.513 -1.723 1.00 0.00 H new ATOM 0 HB3 ALA A 103 0.988 -15.232 -0.110 1.00 0.00 H new ATOM 428 N GLU A 104 -0.983 -13.306 0.357 1.00 0.00 N ATOM 429 CA GLU A 104 -2.175 -12.972 1.130 1.00 0.00 C ATOM 430 C GLU A 104 -2.585 -11.522 0.899 1.00 0.00 C ATOM 431 O GLU A 104 -3.772 -11.206 0.815 1.00 0.00 O ATOM 432 CB GLU A 104 -1.932 -13.211 2.622 1.00 0.00 C ATOM 433 CG GLU A 104 -0.632 -12.616 3.134 1.00 0.00 C ATOM 434 CD GLU A 104 -0.565 -12.577 4.647 1.00 0.00 C ATOM 435 OE1 GLU A 104 -1.068 -11.599 5.240 1.00 0.00 O1- ATOM 436 OE2 GLU A 104 -0.010 -13.526 5.241 1.00 0.00 O ATOM 0 H GLU A 104 -0.120 -13.324 0.900 1.00 0.00 H new ATOM 0 HA GLU A 104 -2.984 -13.620 0.794 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -2.762 -12.788 3.188 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -1.930 -14.284 2.813 1.00 0.00 H new ATOM 0 HG2 GLU A 104 0.206 -13.199 2.752 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -0.521 -11.605 2.743 1.00 0.00 H new ATOM 443 N LEU A 105 -1.591 -10.646 0.801 1.00 0.00 N ATOM 444 CA LEU A 105 -1.831 -9.222 0.583 1.00 0.00 C ATOM 445 C LEU A 105 -2.689 -8.986 -0.660 1.00 0.00 C ATOM 446 O LEU A 105 -3.557 -8.114 -0.671 1.00 0.00 O ATOM 447 CB LEU A 105 -0.493 -8.484 0.444 1.00 0.00 C ATOM 448 CG LEU A 105 -0.589 -7.009 0.044 1.00 0.00 C ATOM 449 CD1 LEU A 105 -1.534 -6.263 0.973 1.00 0.00 C ATOM 450 CD2 LEU A 105 0.789 -6.366 0.054 1.00 0.00 C ATOM 0 H LEU A 105 -0.605 -10.898 0.869 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.374 -8.834 1.445 1.00 0.00 H new ATOM 0 HB2 LEU A 105 0.038 -8.551 1.393 1.00 0.00 H new ATOM 0 HB3 LEU A 105 0.113 -9.004 -0.298 1.00 0.00 H new ATOM 0 HG LEU A 105 -0.989 -6.952 -0.968 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -1.589 -5.217 0.673 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.527 -6.709 0.917 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -1.165 -6.328 1.996 1.00 0.00 H new ATOM 0 HD21 LEU A 105 0.703 -5.318 -0.233 1.00 0.00 H new ATOM 0 HD22 LEU A 105 1.215 -6.435 1.055 1.00 0.00 H new ATOM 0 HD23 LEU A 105 1.437 -6.884 -0.653 1.00 0.00 H new ATOM 462 N ARG A 106 -2.434 -9.763 -1.706 1.00 0.00 N ATOM 463 CA ARG A 106 -3.175 -9.632 -2.955 1.00 0.00 C ATOM 464 C ARG A 106 -4.663 -9.896 -2.747 1.00 0.00 C ATOM 465 O ARG A 106 -5.506 -9.097 -3.156 1.00 0.00 O ATOM 466 CB ARG A 106 -2.617 -10.595 -4.004 1.00 0.00 C ATOM 467 CG ARG A 106 -3.310 -10.495 -5.353 1.00 0.00 C ATOM 468 CD ARG A 106 -2.349 -10.767 -6.501 1.00 0.00 C ATOM 469 NE ARG A 106 -2.556 -12.090 -7.087 1.00 0.00 N ATOM 470 CZ ARG A 106 -2.056 -13.219 -6.583 1.00 0.00 C ATOM 471 NH1 ARG A 106 -1.319 -13.199 -5.478 1.00 0.00 N1+ ATOM 472 NH2 ARG A 106 -2.297 -14.374 -7.187 1.00 0.00 N ATOM 0 H ARG A 106 -1.719 -10.491 -1.714 1.00 0.00 H new ATOM 0 HA ARG A 106 -3.057 -8.607 -3.307 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -1.553 -10.398 -4.136 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -2.708 -11.616 -3.633 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -4.134 -11.207 -5.392 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -3.742 -9.501 -5.468 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -2.478 -10.006 -7.270 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -1.323 -10.686 -6.142 1.00 0.00 H new ATOM 0 HE ARG A 106 -3.119 -12.154 -7.935 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -1.131 -12.314 -5.007 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -0.941 -14.068 -5.101 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -2.863 -14.398 -8.035 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -1.916 -15.239 -6.804 1.00 0.00 H new ATOM 486 N HIS A 107 -4.981 -11.022 -2.119 1.00 0.00 N ATOM 487 CA HIS A 107 -6.370 -11.395 -1.868 1.00 0.00 C ATOM 488 C HIS A 107 -7.064 -10.392 -0.949 1.00 0.00 C ATOM 489 O HIS A 107 -8.214 -10.021 -1.178 1.00 0.00 O ATOM 490 CB HIS A 107 -6.435 -12.795 -1.254 1.00 0.00 C ATOM 491 CG HIS A 107 -7.830 -13.289 -1.035 1.00 0.00 C ATOM 492 ND1 HIS A 107 -8.794 -12.874 -0.178 1.00 0.00 N flip ATOM 493 CD2 HIS A 107 -8.377 -14.341 -1.743 1.00 0.00 C flip ATOM 494 CE1 HIS A 107 -9.892 -13.673 -0.384 1.00 0.00 C flip ATOM 495 NE2 HIS A 107 -9.615 -14.549 -1.333 1.00 0.00 N flip ATOM 0 H HIS A 107 -4.296 -11.694 -1.774 1.00 0.00 H new ATOM 0 HA HIS A 107 -6.893 -11.392 -2.824 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -5.909 -13.493 -1.906 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -5.907 -12.789 -0.301 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -7.871 -14.906 -2.512 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -10.831 -13.597 0.145 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -10.249 -15.264 -1.689 1.00 0.00 H new ATOM 504 N VAL A 108 -6.362 -9.967 0.094 1.00 0.00 N ATOM 505 CA VAL A 108 -6.912 -9.017 1.057 1.00 0.00 C ATOM 506 C VAL A 108 -7.378 -7.727 0.382 1.00 0.00 C ATOM 507 O VAL A 108 -8.562 -7.385 0.416 1.00 0.00 O ATOM 508 CB VAL A 108 -5.873 -8.663 2.143 1.00 0.00 C ATOM 509 CG1 VAL A 108 -6.500 -7.801 3.231 1.00 0.00 C ATOM 510 CG2 VAL A 108 -5.259 -9.927 2.735 1.00 0.00 C ATOM 0 H VAL A 108 -5.408 -10.265 0.296 1.00 0.00 H new ATOM 0 HA VAL A 108 -7.772 -9.505 1.516 1.00 0.00 H new ATOM 0 HB VAL A 108 -5.075 -8.087 1.676 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -5.749 -7.564 3.985 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.877 -6.878 2.791 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -7.323 -8.344 3.696 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -4.530 -9.654 3.498 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -6.043 -10.537 3.184 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -4.764 -10.495 1.947 1.00 0.00 H new ATOM 520 N MET A 109 -6.434 -7.005 -0.208 1.00 0.00 N ATOM 521 CA MET A 109 -6.731 -5.738 -0.866 1.00 0.00 C ATOM 522 C MET A 109 -7.727 -5.905 -2.018 1.00 0.00 C ATOM 523 O MET A 109 -8.696 -5.152 -2.119 1.00 0.00 O ATOM 524 CB MET A 109 -5.432 -5.103 -1.369 1.00 0.00 C ATOM 525 CG MET A 109 -5.079 -3.802 -0.661 1.00 0.00 C ATOM 526 SD MET A 109 -3.701 -3.978 0.491 1.00 0.00 S ATOM 527 CE MET A 109 -4.526 -4.692 1.912 1.00 0.00 C ATOM 0 H MET A 109 -5.451 -7.276 -0.245 1.00 0.00 H new ATOM 0 HA MET A 109 -7.200 -5.082 -0.133 1.00 0.00 H new ATOM 0 HB2 MET A 109 -4.615 -5.813 -1.237 1.00 0.00 H new ATOM 0 HB3 MET A 109 -5.520 -4.913 -2.439 1.00 0.00 H new ATOM 0 HG2 MET A 109 -4.829 -3.046 -1.405 1.00 0.00 H new ATOM 0 HG3 MET A 109 -5.954 -3.440 -0.120 1.00 0.00 H new ATOM 0 HE1 MET A 109 -4.642 -3.932 2.685 1.00 0.00 H new ATOM 0 HE2 MET A 109 -5.508 -5.060 1.615 1.00 0.00 H new ATOM 0 HE3 MET A 109 -3.931 -5.518 2.301 1.00 0.00 H new ATOM 537 N THR A 110 -7.482 -6.879 -2.887 1.00 0.00 N ATOM 538 CA THR A 110 -8.361 -7.117 -4.031 1.00 0.00 C ATOM 539 C THR A 110 -9.761 -7.517 -3.586 1.00 0.00 C ATOM 540 O THR A 110 -10.745 -7.225 -4.265 1.00 0.00 O ATOM 541 CB THR A 110 -7.775 -8.197 -4.938 1.00 0.00 C ATOM 542 OG1 THR A 110 -7.700 -9.438 -4.261 1.00 0.00 O ATOM 543 CG2 THR A 110 -6.389 -7.860 -5.443 1.00 0.00 C ATOM 0 H THR A 110 -6.687 -7.515 -2.824 1.00 0.00 H new ATOM 0 HA THR A 110 -8.437 -6.183 -4.587 1.00 0.00 H new ATOM 0 HB THR A 110 -8.451 -8.258 -5.791 1.00 0.00 H new ATOM 0 HG1 THR A 110 -7.120 -9.348 -3.476 1.00 0.00 H new ATOM 0 HG21 THR A 110 -6.028 -8.666 -6.082 1.00 0.00 H new ATOM 0 HG22 THR A 110 -6.426 -6.933 -6.015 1.00 0.00 H new ATOM 0 HG23 THR A 110 -5.713 -7.738 -4.597 1.00 0.00 H new ATOM 551 N ASN A 111 -9.847 -8.186 -2.444 1.00 0.00 N ATOM 552 CA ASN A 111 -11.132 -8.623 -1.917 1.00 0.00 C ATOM 553 C ASN A 111 -11.889 -7.472 -1.259 1.00 0.00 C ATOM 554 O ASN A 111 -13.102 -7.559 -1.061 1.00 0.00 O ATOM 555 CB ASN A 111 -10.932 -9.758 -0.911 1.00 0.00 C ATOM 556 CG ASN A 111 -12.246 -10.317 -0.396 1.00 0.00 C ATOM 557 OD1 ASN A 111 -12.662 -10.025 0.724 1.00 0.00 O ATOM 558 ND2 ASN A 111 -12.906 -11.127 -1.217 1.00 0.00 N ATOM 0 H ASN A 111 -9.045 -8.437 -1.867 1.00 0.00 H new ATOM 0 HA ASN A 111 -11.729 -8.983 -2.755 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -10.360 -10.558 -1.380 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -10.341 -9.394 -0.070 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -13.795 -11.534 -0.926 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -12.523 -11.342 -2.138 1.00 0.00 H new ATOM 565 N LEU A 112 -11.180 -6.396 -0.905 1.00 0.00 N ATOM 566 CA LEU A 112 -11.819 -5.255 -0.257 1.00 0.00 C ATOM 567 C LEU A 112 -11.676 -3.963 -1.070 1.00 0.00 C ATOM 568 O LEU A 112 -11.114 -3.950 -2.182 1.00 0.00 O ATOM 569 CB LEU A 112 -11.254 -5.066 1.157 1.00 0.00 C ATOM 570 CG LEU A 112 -9.889 -4.367 1.242 1.00 0.00 C ATOM 571 CD1 LEU A 112 -10.060 -2.889 1.582 1.00 0.00 C ATOM 572 CD2 LEU A 112 -8.994 -5.057 2.263 1.00 0.00 C ATOM 0 H LEU A 112 -10.176 -6.294 -1.055 1.00 0.00 H new ATOM 0 HA LEU A 112 -12.885 -5.473 -0.195 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -11.973 -4.491 1.741 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -11.170 -6.045 1.628 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.408 -4.437 0.266 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.081 -2.413 1.637 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -10.656 -2.404 0.809 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.565 -2.793 2.543 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.032 -4.546 2.308 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.468 -5.024 3.244 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.840 -6.095 1.969 1.00 0.00 H new ATOM 584 N GLY A 113 -12.210 -2.882 -0.493 1.00 0.00 N ATOM 585 CA GLY A 113 -12.171 -1.583 -1.133 1.00 0.00 C ATOM 586 C GLY A 113 -13.075 -1.537 -2.339 1.00 0.00 C ATOM 587 O GLY A 113 -14.238 -1.934 -2.268 1.00 0.00 O ATOM 0 H GLY A 113 -12.672 -2.891 0.416 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -12.473 -0.815 -0.420 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -11.149 -1.354 -1.434 1.00 0.00 H new ATOM 591 N GLU A 114 -12.534 -1.087 -3.456 1.00 0.00 N ATOM 592 CA GLU A 114 -13.291 -1.030 -4.695 1.00 0.00 C ATOM 593 C GLU A 114 -12.911 -2.221 -5.562 1.00 0.00 C ATOM 594 O GLU A 114 -12.780 -2.104 -6.780 1.00 0.00 O ATOM 595 CB GLU A 114 -13.013 0.277 -5.438 1.00 0.00 C ATOM 596 CG GLU A 114 -11.541 0.498 -5.744 1.00 0.00 C ATOM 597 CD GLU A 114 -11.289 0.850 -7.198 1.00 0.00 C ATOM 598 OE1 GLU A 114 -12.064 0.391 -8.063 1.00 0.00 O1- ATOM 599 OE2 GLU A 114 -10.317 1.584 -7.471 1.00 0.00 O ATOM 0 H GLU A 114 -11.572 -0.755 -3.532 1.00 0.00 H new ATOM 0 HA GLU A 114 -14.356 -1.067 -4.468 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -13.575 0.282 -6.372 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -13.381 1.111 -4.840 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -11.159 1.298 -5.110 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -10.983 -0.403 -5.491 1.00 0.00 H new ATOM 606 N LYS A 115 -12.706 -3.366 -4.909 1.00 0.00 N ATOM 607 CA LYS A 115 -12.307 -4.581 -5.597 1.00 0.00 C ATOM 608 C LYS A 115 -10.959 -4.361 -6.270 1.00 0.00 C ATOM 609 O LYS A 115 -10.848 -4.413 -7.496 1.00 0.00 O ATOM 610 CB LYS A 115 -13.365 -4.990 -6.626 1.00 0.00 C ATOM 611 CG LYS A 115 -14.673 -5.445 -6.001 1.00 0.00 C ATOM 612 CD LYS A 115 -14.494 -6.722 -5.198 1.00 0.00 C ATOM 613 CE LYS A 115 -15.795 -7.155 -4.544 1.00 0.00 C ATOM 614 NZ LYS A 115 -15.573 -7.734 -3.190 1.00 0.00 N1+ ATOM 0 H LYS A 115 -12.812 -3.471 -3.900 1.00 0.00 H new ATOM 0 HA LYS A 115 -12.216 -5.390 -4.872 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -13.562 -4.147 -7.288 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -12.967 -5.795 -7.244 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -15.061 -4.659 -5.353 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -15.414 -5.607 -6.784 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -14.132 -7.516 -5.851 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -13.734 -6.568 -4.432 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -16.465 -6.298 -4.467 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -16.291 -7.891 -5.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -16.486 -8.016 -2.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -14.955 -8.567 -3.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -15.123 -7.024 -2.578 1.00 0.00 H new ATOM 628 N LEU A 116 -9.931 -4.091 -5.456 1.00 0.00 N ATOM 629 CA LEU A 116 -8.580 -3.835 -5.983 1.00 0.00 C ATOM 630 C LEU A 116 -8.182 -4.844 -7.063 1.00 0.00 C ATOM 631 O LEU A 116 -8.060 -6.040 -6.800 1.00 0.00 O ATOM 632 CB LEU A 116 -7.546 -3.842 -4.857 1.00 0.00 C ATOM 633 CG LEU A 116 -6.452 -2.780 -4.984 1.00 0.00 C ATOM 634 CD1 LEU A 116 -5.533 -2.819 -3.778 1.00 0.00 C ATOM 635 CD2 LEU A 116 -5.659 -2.984 -6.266 1.00 0.00 C ATOM 0 H LEU A 116 -10.005 -4.044 -4.440 1.00 0.00 H new ATOM 0 HA LEU A 116 -8.602 -2.847 -6.442 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -8.062 -3.700 -3.908 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -7.076 -4.825 -4.820 1.00 0.00 H new ATOM 0 HG LEU A 116 -6.925 -1.799 -5.025 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -4.761 -2.057 -3.884 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -6.111 -2.626 -2.874 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -5.066 -3.802 -3.708 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -4.885 -2.220 -6.341 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -5.195 -3.970 -6.254 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -6.328 -2.908 -7.123 1.00 0.00 H new ATOM 647 N THR A 117 -7.992 -4.343 -8.283 1.00 0.00 N ATOM 648 CA THR A 117 -7.619 -5.184 -9.417 1.00 0.00 C ATOM 649 C THR A 117 -6.341 -5.968 -9.136 1.00 0.00 C ATOM 650 O THR A 117 -5.483 -5.527 -8.371 1.00 0.00 O ATOM 651 CB THR A 117 -7.436 -4.327 -10.671 1.00 0.00 C ATOM 652 OG1 THR A 117 -6.522 -3.272 -10.430 1.00 0.00 O ATOM 653 CG2 THR A 117 -8.726 -3.712 -11.171 1.00 0.00 C ATOM 0 H THR A 117 -8.091 -3.354 -8.511 1.00 0.00 H new ATOM 0 HA THR A 117 -8.426 -5.899 -9.579 1.00 0.00 H new ATOM 0 HB THR A 117 -7.059 -5.009 -11.433 1.00 0.00 H new ATOM 0 HG1 THR A 117 -6.418 -2.737 -11.244 1.00 0.00 H new ATOM 0 HG21 THR A 117 -8.524 -3.117 -12.062 1.00 0.00 H new ATOM 0 HG22 THR A 117 -9.435 -4.503 -11.415 1.00 0.00 H new ATOM 0 HG23 THR A 117 -9.148 -3.072 -10.396 1.00 0.00 H new ATOM 661 N ASP A 118 -6.226 -7.133 -9.763 1.00 0.00 N ATOM 662 CA ASP A 118 -5.058 -7.989 -9.589 1.00 0.00 C ATOM 663 C ASP A 118 -3.820 -7.367 -10.229 1.00 0.00 C ATOM 664 O ASP A 118 -2.699 -7.576 -9.765 1.00 0.00 O ATOM 665 CB ASP A 118 -5.320 -9.368 -10.198 1.00 0.00 C ATOM 666 CG ASP A 118 -6.074 -10.282 -9.253 1.00 0.00 C ATOM 667 OD1 ASP A 118 -7.110 -9.848 -8.706 1.00 0.00 O ATOM 668 OD2 ASP A 118 -5.631 -11.435 -9.061 1.00 0.00 O1- ATOM 0 H ASP A 118 -6.930 -7.508 -10.399 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.874 -8.095 -8.520 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -5.890 -9.253 -11.120 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -4.370 -9.830 -10.466 1.00 0.00 H new ATOM 673 N ASP A 119 -4.028 -6.610 -11.303 1.00 0.00 N ATOM 674 CA ASP A 119 -2.927 -5.968 -12.013 1.00 0.00 C ATOM 675 C ASP A 119 -2.232 -4.928 -11.138 1.00 0.00 C ATOM 676 O ASP A 119 -1.005 -4.919 -11.027 1.00 0.00 O ATOM 677 CB ASP A 119 -3.437 -5.309 -13.296 1.00 0.00 C ATOM 678 CG ASP A 119 -2.364 -5.210 -14.361 1.00 0.00 C ATOM 679 OD1 ASP A 119 -1.901 -6.268 -14.836 1.00 0.00 O1- ATOM 680 OD2 ASP A 119 -1.984 -4.076 -14.719 1.00 0.00 O ATOM 0 H ASP A 119 -4.949 -6.426 -11.700 1.00 0.00 H new ATOM 0 HA ASP A 119 -2.200 -6.740 -12.267 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -4.279 -5.881 -13.685 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -3.809 -4.311 -13.065 1.00 0.00 H new ATOM 685 N GLU A 120 -3.017 -4.050 -10.525 1.00 0.00 N ATOM 686 CA GLU A 120 -2.468 -3.005 -9.666 1.00 0.00 C ATOM 687 C GLU A 120 -1.725 -3.607 -8.477 1.00 0.00 C ATOM 688 O GLU A 120 -0.587 -3.236 -8.191 1.00 0.00 O ATOM 689 CB GLU A 120 -3.584 -2.084 -9.170 1.00 0.00 C ATOM 690 CG GLU A 120 -3.080 -0.895 -8.368 1.00 0.00 C ATOM 691 CD GLU A 120 -4.192 0.064 -7.986 1.00 0.00 C ATOM 692 OE1 GLU A 120 -4.565 0.906 -8.829 1.00 0.00 O1- ATOM 693 OE2 GLU A 120 -4.687 -0.027 -6.843 1.00 0.00 O ATOM 0 H GLU A 120 -4.034 -4.040 -10.606 1.00 0.00 H new ATOM 0 HA GLU A 120 -1.760 -2.423 -10.256 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -4.151 -1.720 -10.027 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -4.273 -2.661 -8.554 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -2.588 -1.254 -7.464 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -2.329 -0.361 -8.950 1.00 0.00 H new ATOM 700 N VAL A 121 -2.378 -4.538 -7.791 1.00 0.00 N ATOM 701 CA VAL A 121 -1.787 -5.192 -6.631 1.00 0.00 C ATOM 702 C VAL A 121 -0.558 -6.011 -7.023 1.00 0.00 C ATOM 703 O VAL A 121 0.374 -6.160 -6.237 1.00 0.00 O ATOM 704 CB VAL A 121 -2.810 -6.106 -5.924 1.00 0.00 C ATOM 705 CG1 VAL A 121 -3.265 -7.224 -6.851 1.00 0.00 C ATOM 706 CG2 VAL A 121 -2.228 -6.671 -4.637 1.00 0.00 C ATOM 0 H VAL A 121 -3.319 -4.857 -8.019 1.00 0.00 H new ATOM 0 HA VAL A 121 -1.481 -4.405 -5.942 1.00 0.00 H new ATOM 0 HB VAL A 121 -3.682 -5.506 -5.666 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -3.986 -7.856 -6.332 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -3.731 -6.794 -7.738 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -2.404 -7.823 -7.148 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -2.966 -7.312 -4.155 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -1.335 -7.253 -4.866 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -1.965 -5.853 -3.967 1.00 0.00 H new ATOM 716 N ASP A 122 -0.572 -6.554 -8.235 1.00 0.00 N ATOM 717 CA ASP A 122 0.537 -7.369 -8.721 1.00 0.00 C ATOM 718 C ASP A 122 1.787 -6.526 -8.968 1.00 0.00 C ATOM 719 O ASP A 122 2.907 -7.013 -8.830 1.00 0.00 O ATOM 720 CB ASP A 122 0.134 -8.095 -10.007 1.00 0.00 C ATOM 721 CG ASP A 122 1.221 -9.024 -10.515 1.00 0.00 C ATOM 722 OD1 ASP A 122 1.718 -9.848 -9.719 1.00 0.00 O1- ATOM 723 OD2 ASP A 122 1.576 -8.924 -11.708 1.00 0.00 O ATOM 0 H ASP A 122 -1.338 -6.445 -8.899 1.00 0.00 H new ATOM 0 HA ASP A 122 0.773 -8.102 -7.950 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -0.775 -8.669 -9.827 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -0.100 -7.360 -10.777 1.00 0.00 H new ATOM 728 N GLU A 123 1.592 -5.266 -9.345 1.00 0.00 N ATOM 729 CA GLU A 123 2.712 -4.370 -9.622 1.00 0.00 C ATOM 730 C GLU A 123 3.331 -3.829 -8.340 1.00 0.00 C ATOM 731 O GLU A 123 4.543 -3.909 -8.141 1.00 0.00 O ATOM 732 CB GLU A 123 2.253 -3.210 -10.507 1.00 0.00 C ATOM 733 CG GLU A 123 3.354 -2.649 -11.393 1.00 0.00 C ATOM 734 CD GLU A 123 2.849 -2.237 -12.762 1.00 0.00 C ATOM 735 OE1 GLU A 123 2.030 -2.981 -13.341 1.00 0.00 O ATOM 736 OE2 GLU A 123 3.272 -1.169 -13.254 1.00 0.00 O1- ATOM 0 H GLU A 123 0.672 -4.842 -9.466 1.00 0.00 H new ATOM 0 HA GLU A 123 3.474 -4.948 -10.145 1.00 0.00 H new ATOM 0 HB2 GLU A 123 1.429 -3.547 -11.135 1.00 0.00 H new ATOM 0 HB3 GLU A 123 1.865 -2.412 -9.874 1.00 0.00 H new ATOM 0 HG2 GLU A 123 3.806 -1.787 -10.902 1.00 0.00 H new ATOM 0 HG3 GLU A 123 4.138 -3.397 -11.509 1.00 0.00 H new ATOM 743 N MET A 124 2.494 -3.266 -7.481 1.00 0.00 N ATOM 744 CA MET A 124 2.954 -2.694 -6.218 1.00 0.00 C ATOM 745 C MET A 124 3.729 -3.710 -5.379 1.00 0.00 C ATOM 746 O MET A 124 4.701 -3.360 -4.711 1.00 0.00 O ATOM 747 CB MET A 124 1.767 -2.158 -5.417 1.00 0.00 C ATOM 748 CG MET A 124 0.549 -3.072 -5.434 1.00 0.00 C ATOM 749 SD MET A 124 -0.164 -3.341 -3.801 1.00 0.00 S ATOM 750 CE MET A 124 1.276 -3.875 -2.882 1.00 0.00 C ATOM 0 H MET A 124 1.488 -3.192 -7.634 1.00 0.00 H new ATOM 0 HA MET A 124 3.632 -1.875 -6.459 1.00 0.00 H new ATOM 0 HB2 MET A 124 2.078 -2.003 -4.384 1.00 0.00 H new ATOM 0 HB3 MET A 124 1.483 -1.183 -5.814 1.00 0.00 H new ATOM 0 HG2 MET A 124 -0.210 -2.642 -6.088 1.00 0.00 H new ATOM 0 HG3 MET A 124 0.831 -4.034 -5.862 1.00 0.00 H new ATOM 0 HE1 MET A 124 1.005 -4.708 -2.234 1.00 0.00 H new ATOM 0 HE2 MET A 124 2.053 -4.193 -3.577 1.00 0.00 H new ATOM 0 HE3 MET A 124 1.647 -3.049 -2.275 1.00 0.00 H new ATOM 760 N ILE A 125 3.289 -4.964 -5.405 1.00 0.00 N ATOM 761 CA ILE A 125 3.941 -6.015 -4.632 1.00 0.00 C ATOM 762 C ILE A 125 5.272 -6.437 -5.252 1.00 0.00 C ATOM 763 O ILE A 125 6.267 -6.608 -4.547 1.00 0.00 O ATOM 764 CB ILE A 125 3.030 -7.251 -4.486 1.00 0.00 C ATOM 765 CG1 ILE A 125 2.736 -7.869 -5.862 1.00 0.00 C ATOM 766 CG2 ILE A 125 1.741 -6.863 -3.768 1.00 0.00 C ATOM 767 CD1 ILE A 125 1.717 -8.992 -5.832 1.00 0.00 C ATOM 0 H ILE A 125 2.486 -5.276 -5.951 1.00 0.00 H new ATOM 0 HA ILE A 125 4.136 -5.596 -3.645 1.00 0.00 H new ATOM 0 HB ILE A 125 3.543 -8.004 -3.888 1.00 0.00 H new ATOM 0 HG12 ILE A 125 2.378 -7.086 -6.531 1.00 0.00 H new ATOM 0 HG13 ILE A 125 3.667 -8.248 -6.284 1.00 0.00 H new ATOM 0 HG21 ILE A 125 1.102 -7.740 -3.668 1.00 0.00 H new ATOM 0 HG22 ILE A 125 1.979 -6.473 -2.778 1.00 0.00 H new ATOM 0 HG23 ILE A 125 1.220 -6.098 -4.344 1.00 0.00 H new ATOM 0 HD11 ILE A 125 1.566 -9.374 -6.842 1.00 0.00 H new ATOM 0 HD12 ILE A 125 2.080 -9.795 -5.191 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.772 -8.615 -5.442 1.00 0.00 H new ATOM 779 N ARG A 126 5.283 -6.612 -6.569 1.00 0.00 N ATOM 780 CA ARG A 126 6.492 -7.023 -7.275 1.00 0.00 C ATOM 781 C ARG A 126 7.599 -5.983 -7.125 1.00 0.00 C ATOM 782 O ARG A 126 8.762 -6.327 -6.916 1.00 0.00 O ATOM 783 CB ARG A 126 6.187 -7.258 -8.758 1.00 0.00 C ATOM 784 CG ARG A 126 6.810 -8.529 -9.313 1.00 0.00 C ATOM 785 CD ARG A 126 8.292 -8.345 -9.596 1.00 0.00 C ATOM 786 NE ARG A 126 8.528 -7.714 -10.893 1.00 0.00 N ATOM 787 CZ ARG A 126 9.680 -7.782 -11.561 1.00 0.00 C ATOM 788 NH1 ARG A 126 10.713 -8.453 -11.061 1.00 0.00 N1+ ATOM 789 NH2 ARG A 126 9.801 -7.176 -12.733 1.00 0.00 N ATOM 0 H ARG A 126 4.469 -6.476 -7.169 1.00 0.00 H new ATOM 0 HA ARG A 126 6.840 -7.955 -6.831 1.00 0.00 H new ATOM 0 HB2 ARG A 126 5.107 -7.303 -8.896 1.00 0.00 H new ATOM 0 HB3 ARG A 126 6.547 -6.405 -9.334 1.00 0.00 H new ATOM 0 HG2 ARG A 126 6.673 -9.343 -8.602 1.00 0.00 H new ATOM 0 HG3 ARG A 126 6.296 -8.817 -10.230 1.00 0.00 H new ATOM 0 HD2 ARG A 126 8.738 -7.736 -8.810 1.00 0.00 H new ATOM 0 HD3 ARG A 126 8.789 -9.315 -9.569 1.00 0.00 H new ATOM 0 HE ARG A 126 7.762 -7.188 -11.314 1.00 0.00 H new ATOM 0 HH11 ARG A 126 10.628 -8.922 -10.159 1.00 0.00 H new ATOM 0 HH12 ARG A 126 11.590 -8.499 -11.579 1.00 0.00 H new ATOM 0 HH21 ARG A 126 9.014 -6.658 -13.123 1.00 0.00 H new ATOM 0 HH22 ARG A 126 10.682 -7.227 -13.245 1.00 0.00 H new ATOM 803 N GLU A 127 7.229 -4.713 -7.240 1.00 0.00 N ATOM 804 CA GLU A 127 8.192 -3.623 -7.124 1.00 0.00 C ATOM 805 C GLU A 127 8.556 -3.340 -5.667 1.00 0.00 C ATOM 806 O GLU A 127 9.581 -2.717 -5.391 1.00 0.00 O ATOM 807 CB GLU A 127 7.634 -2.356 -7.773 1.00 0.00 C ATOM 808 CG GLU A 127 8.694 -1.306 -8.065 1.00 0.00 C ATOM 809 CD GLU A 127 9.263 -1.424 -9.466 1.00 0.00 C ATOM 810 OE1 GLU A 127 8.465 -1.511 -10.424 1.00 0.00 O ATOM 811 OE2 GLU A 127 10.504 -1.430 -9.605 1.00 0.00 O1- ATOM 0 H GLU A 127 6.270 -4.412 -7.413 1.00 0.00 H new ATOM 0 HA GLU A 127 9.100 -3.931 -7.643 1.00 0.00 H new ATOM 0 HB2 GLU A 127 7.134 -2.624 -8.704 1.00 0.00 H new ATOM 0 HB3 GLU A 127 6.878 -1.925 -7.117 1.00 0.00 H new ATOM 0 HG2 GLU A 127 8.262 -0.314 -7.935 1.00 0.00 H new ATOM 0 HG3 GLU A 127 9.502 -1.400 -7.340 1.00 0.00 H new ATOM 818 N ALA A 128 7.715 -3.786 -4.735 1.00 0.00 N ATOM 819 CA ALA A 128 7.967 -3.556 -3.317 1.00 0.00 C ATOM 820 C ALA A 128 9.263 -4.222 -2.861 1.00 0.00 C ATOM 821 O ALA A 128 10.121 -3.577 -2.260 1.00 0.00 O ATOM 822 CB ALA A 128 6.796 -4.061 -2.489 1.00 0.00 C ATOM 0 H ALA A 128 6.860 -4.305 -4.936 1.00 0.00 H new ATOM 0 HA ALA A 128 8.076 -2.482 -3.167 1.00 0.00 H new ATOM 0 HB1 ALA A 128 6.995 -3.884 -1.432 1.00 0.00 H new ATOM 0 HB2 ALA A 128 5.889 -3.532 -2.781 1.00 0.00 H new ATOM 0 HB3 ALA A 128 6.664 -5.129 -2.660 1.00 0.00 H new ATOM 828 N ASP A 129 9.403 -5.517 -3.153 1.00 0.00 N ATOM 829 CA ASP A 129 10.601 -6.281 -2.778 1.00 0.00 C ATOM 830 C ASP A 129 10.357 -7.777 -2.952 1.00 0.00 C ATOM 831 O ASP A 129 11.117 -8.464 -3.634 1.00 0.00 O ATOM 832 CB ASP A 129 11.016 -5.990 -1.325 1.00 0.00 C ATOM 833 CG ASP A 129 12.216 -5.066 -1.243 1.00 0.00 C ATOM 834 OD1 ASP A 129 13.310 -5.475 -1.686 1.00 0.00 O ATOM 835 OD2 ASP A 129 12.061 -3.935 -0.738 1.00 0.00 O1- ATOM 0 H ASP A 129 8.699 -6.063 -3.650 1.00 0.00 H new ATOM 0 HA ASP A 129 11.411 -5.969 -3.438 1.00 0.00 H new ATOM 0 HB2 ASP A 129 10.177 -5.541 -0.793 1.00 0.00 H new ATOM 0 HB3 ASP A 129 11.248 -6.928 -0.821 1.00 0.00 H new ATOM 840 N ILE A 130 9.293 -8.272 -2.317 1.00 0.00 N ATOM 841 CA ILE A 130 8.923 -9.689 -2.375 1.00 0.00 C ATOM 842 C ILE A 130 10.131 -10.609 -2.174 1.00 0.00 C ATOM 843 O ILE A 130 10.261 -11.639 -2.838 1.00 0.00 O ATOM 844 CB ILE A 130 8.214 -10.043 -3.702 1.00 0.00 C ATOM 845 CG1 ILE A 130 9.156 -9.868 -4.898 1.00 0.00 C ATOM 846 CG2 ILE A 130 6.968 -9.187 -3.877 1.00 0.00 C ATOM 847 CD1 ILE A 130 8.714 -10.633 -6.128 1.00 0.00 C ATOM 0 H ILE A 130 8.664 -7.704 -1.749 1.00 0.00 H new ATOM 0 HA ILE A 130 8.227 -9.853 -1.553 1.00 0.00 H new ATOM 0 HB ILE A 130 7.919 -11.092 -3.659 1.00 0.00 H new ATOM 0 HG12 ILE A 130 9.226 -8.808 -5.144 1.00 0.00 H new ATOM 0 HG13 ILE A 130 10.156 -10.196 -4.615 1.00 0.00 H new ATOM 0 HG21 ILE A 130 6.478 -9.446 -4.815 1.00 0.00 H new ATOM 0 HG22 ILE A 130 6.283 -9.367 -3.048 1.00 0.00 H new ATOM 0 HG23 ILE A 130 7.249 -8.134 -3.893 1.00 0.00 H new ATOM 0 HD11 ILE A 130 9.425 -10.465 -6.936 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.671 -11.698 -5.898 1.00 0.00 H new ATOM 0 HD13 ILE A 130 7.727 -10.288 -6.436 1.00 0.00 H new ATOM 859 N ASP A 131 11.011 -10.228 -1.253 1.00 0.00 N ATOM 860 CA ASP A 131 12.205 -11.015 -0.964 1.00 0.00 C ATOM 861 C ASP A 131 11.840 -12.311 -0.248 1.00 0.00 C ATOM 862 O ASP A 131 10.932 -12.339 0.584 1.00 0.00 O ATOM 863 CB ASP A 131 13.181 -10.205 -0.109 1.00 0.00 C ATOM 864 CG ASP A 131 14.625 -10.595 -0.354 1.00 0.00 C ATOM 865 OD1 ASP A 131 15.088 -10.465 -1.506 1.00 0.00 O1- ATOM 866 OD2 ASP A 131 15.293 -11.031 0.607 1.00 0.00 O ATOM 0 H ASP A 131 10.920 -9.380 -0.694 1.00 0.00 H new ATOM 0 HA ASP A 131 12.684 -11.265 -1.911 1.00 0.00 H new ATOM 0 HB2 ASP A 131 13.053 -9.144 -0.323 1.00 0.00 H new ATOM 0 HB3 ASP A 131 12.942 -10.349 0.945 1.00 0.00 H new ATOM 871 N GLY A 132 12.552 -13.384 -0.576 1.00 0.00 N ATOM 872 CA GLY A 132 12.287 -14.668 0.045 1.00 0.00 C ATOM 873 C GLY A 132 10.964 -15.263 -0.394 1.00 0.00 C ATOM 874 O GLY A 132 10.507 -15.022 -1.511 1.00 0.00 O ATOM 0 H GLY A 132 13.308 -13.387 -1.261 1.00 0.00 H new ATOM 0 HA2 GLY A 132 13.092 -15.360 -0.201 1.00 0.00 H new ATOM 0 HA3 GLY A 132 12.287 -14.551 1.129 1.00 0.00 H new ATOM 878 N ASP A 133 10.346 -16.045 0.486 1.00 0.00 N ATOM 879 CA ASP A 133 9.067 -16.676 0.182 1.00 0.00 C ATOM 880 C ASP A 133 7.981 -15.628 -0.033 1.00 0.00 C ATOM 881 O ASP A 133 7.389 -15.544 -1.108 1.00 0.00 O ATOM 882 CB ASP A 133 8.661 -17.624 1.312 1.00 0.00 C ATOM 883 CG ASP A 133 7.530 -18.549 0.911 1.00 0.00 C ATOM 884 OD1 ASP A 133 7.608 -19.143 -0.185 1.00 0.00 O1- ATOM 885 OD2 ASP A 133 6.563 -18.680 1.692 1.00 0.00 O ATOM 0 H ASP A 133 10.710 -16.257 1.415 1.00 0.00 H new ATOM 0 HA ASP A 133 9.182 -17.248 -0.739 1.00 0.00 H new ATOM 0 HB2 ASP A 133 9.524 -18.218 1.612 1.00 0.00 H new ATOM 0 HB3 ASP A 133 8.359 -17.040 2.181 1.00 0.00 H new ATOM 890 N GLY A 134 7.725 -14.830 0.999 1.00 0.00 N ATOM 891 CA GLY A 134 6.710 -13.797 0.903 1.00 0.00 C ATOM 892 C GLY A 134 6.887 -12.712 1.947 1.00 0.00 C ATOM 893 O GLY A 134 6.019 -12.512 2.796 1.00 0.00 O ATOM 0 H GLY A 134 8.202 -14.880 1.899 1.00 0.00 H new ATOM 0 HA2 GLY A 134 6.744 -13.350 -0.091 1.00 0.00 H new ATOM 0 HA3 GLY A 134 5.724 -14.249 1.016 1.00 0.00 H new ATOM 897 N HIS A 135 8.015 -12.012 1.886 1.00 0.00 N ATOM 898 CA HIS A 135 8.305 -10.941 2.833 1.00 0.00 C ATOM 899 C HIS A 135 8.478 -9.611 2.107 1.00 0.00 C ATOM 900 O HIS A 135 9.415 -9.437 1.327 1.00 0.00 O ATOM 901 CB HIS A 135 9.567 -11.268 3.632 1.00 0.00 C ATOM 902 CG HIS A 135 9.431 -12.486 4.494 1.00 0.00 C ATOM 903 ND1 HIS A 135 10.411 -13.452 4.590 1.00 0.00 N ATOM 904 CD2 HIS A 135 8.423 -12.893 5.300 1.00 0.00 C ATOM 905 CE1 HIS A 135 10.011 -14.401 5.418 1.00 0.00 C ATOM 906 NE2 HIS A 135 8.809 -14.085 5.863 1.00 0.00 N ATOM 0 H HIS A 135 8.744 -12.167 1.190 1.00 0.00 H new ATOM 0 HA HIS A 135 7.463 -10.855 3.519 1.00 0.00 H new ATOM 0 HB2 HIS A 135 10.397 -11.413 2.941 1.00 0.00 H new ATOM 0 HB3 HIS A 135 9.821 -10.414 4.261 1.00 0.00 H new ATOM 0 HD2 HIS A 135 7.489 -12.377 5.469 1.00 0.00 H new ATOM 0 HE1 HIS A 135 10.572 -15.284 5.685 1.00 0.00 H new ATOM 0 HE2 HIS A 135 8.256 -14.637 6.519 1.00 0.00 H new ATOM 915 N ILE A 136 7.569 -8.676 2.365 1.00 0.00 N ATOM 916 CA ILE A 136 7.622 -7.364 1.729 1.00 0.00 C ATOM 917 C ILE A 136 7.601 -6.243 2.762 1.00 0.00 C ATOM 918 O ILE A 136 6.590 -6.018 3.428 1.00 0.00 O ATOM 919 CB ILE A 136 6.444 -7.163 0.757 1.00 0.00 C ATOM 920 CG1 ILE A 136 6.297 -8.376 -0.164 1.00 0.00 C ATOM 921 CG2 ILE A 136 6.642 -5.894 -0.058 1.00 0.00 C ATOM 922 CD1 ILE A 136 4.978 -8.414 -0.903 1.00 0.00 C ATOM 0 H ILE A 136 6.788 -8.802 3.009 1.00 0.00 H new ATOM 0 HA ILE A 136 8.559 -7.326 1.174 1.00 0.00 H new ATOM 0 HB ILE A 136 5.528 -7.061 1.338 1.00 0.00 H new ATOM 0 HG12 ILE A 136 7.111 -8.373 -0.889 1.00 0.00 H new ATOM 0 HG13 ILE A 136 6.400 -9.286 0.427 1.00 0.00 H new ATOM 0 HG21 ILE A 136 5.802 -5.765 -0.740 1.00 0.00 H new ATOM 0 HG22 ILE A 136 6.700 -5.036 0.612 1.00 0.00 H new ATOM 0 HG23 ILE A 136 7.566 -5.970 -0.631 1.00 0.00 H new ATOM 0 HD11 ILE A 136 4.942 -9.300 -1.537 1.00 0.00 H new ATOM 0 HD12 ILE A 136 4.159 -8.448 -0.184 1.00 0.00 H new ATOM 0 HD13 ILE A 136 4.881 -7.521 -1.521 1.00 0.00 H new ATOM 934 N ASN A 137 8.720 -5.535 2.886 1.00 0.00 N ATOM 935 CA ASN A 137 8.821 -4.431 3.833 1.00 0.00 C ATOM 936 C ASN A 137 8.063 -3.213 3.314 1.00 0.00 C ATOM 937 O ASN A 137 8.268 -2.783 2.179 1.00 0.00 O ATOM 938 CB ASN A 137 10.288 -4.069 4.074 1.00 0.00 C ATOM 939 CG ASN A 137 11.046 -3.836 2.783 1.00 0.00 C ATOM 940 OD1 ASN A 137 10.475 -3.898 1.694 1.00 0.00 O ATOM 941 ND2 ASN A 137 12.342 -3.565 2.896 1.00 0.00 N ATOM 0 H ASN A 137 9.567 -5.706 2.344 1.00 0.00 H new ATOM 0 HA ASN A 137 8.376 -4.746 4.777 1.00 0.00 H new ATOM 0 HB2 ASN A 137 10.341 -3.171 4.690 1.00 0.00 H new ATOM 0 HB3 ASN A 137 10.769 -4.870 4.635 1.00 0.00 H new ATOM 0 HD21 ASN A 137 12.903 -3.399 2.061 1.00 0.00 H new ATOM 0 HD22 ASN A 137 12.776 -3.523 3.818 1.00 0.00 H new ATOM 948 N TYR A 138 7.183 -2.664 4.146 1.00 0.00 N ATOM 949 CA TYR A 138 6.396 -1.498 3.752 1.00 0.00 C ATOM 950 C TYR A 138 7.192 -0.194 3.868 1.00 0.00 C ATOM 951 O TYR A 138 6.663 0.877 3.579 1.00 0.00 O ATOM 952 CB TYR A 138 5.108 -1.401 4.575 1.00 0.00 C ATOM 953 CG TYR A 138 5.295 -1.662 6.050 1.00 0.00 C ATOM 954 CD1 TYR A 138 6.187 -0.910 6.800 1.00 0.00 C ATOM 955 CD2 TYR A 138 4.577 -2.663 6.691 1.00 0.00 C ATOM 956 CE1 TYR A 138 6.361 -1.148 8.147 1.00 0.00 C ATOM 957 CE2 TYR A 138 4.744 -2.906 8.039 1.00 0.00 C ATOM 958 CZ TYR A 138 5.638 -2.147 8.764 1.00 0.00 C ATOM 959 OH TYR A 138 5.809 -2.386 10.108 1.00 0.00 O ATOM 0 H TYR A 138 6.997 -3.003 5.090 1.00 0.00 H new ATOM 0 HA TYR A 138 6.138 -1.636 2.702 1.00 0.00 H new ATOM 0 HB2 TYR A 138 4.681 -0.407 4.445 1.00 0.00 H new ATOM 0 HB3 TYR A 138 4.383 -2.113 4.180 1.00 0.00 H new ATOM 0 HD1 TYR A 138 6.754 -0.126 6.321 1.00 0.00 H new ATOM 0 HD2 TYR A 138 3.877 -3.261 6.126 1.00 0.00 H new ATOM 0 HE1 TYR A 138 7.061 -0.554 8.716 1.00 0.00 H new ATOM 0 HE2 TYR A 138 4.177 -3.687 8.524 1.00 0.00 H new ATOM 0 HH TYR A 138 5.179 -3.078 10.400 1.00 0.00 H new ATOM 969 N GLU A 139 8.459 -0.279 4.279 1.00 0.00 N ATOM 970 CA GLU A 139 9.296 0.909 4.408 1.00 0.00 C ATOM 971 C GLU A 139 9.992 1.212 3.086 1.00 0.00 C ATOM 972 O GLU A 139 10.067 2.363 2.659 1.00 0.00 O ATOM 973 CB GLU A 139 10.334 0.717 5.517 1.00 0.00 C ATOM 974 CG GLU A 139 9.731 0.659 6.913 1.00 0.00 C ATOM 975 CD GLU A 139 10.040 -0.639 7.635 1.00 0.00 C ATOM 976 OE1 GLU A 139 9.303 -1.625 7.426 1.00 0.00 O1- ATOM 977 OE2 GLU A 139 11.019 -0.668 8.409 1.00 0.00 O ATOM 0 H GLU A 139 8.923 -1.153 4.526 1.00 0.00 H new ATOM 0 HA GLU A 139 8.658 1.752 4.671 1.00 0.00 H new ATOM 0 HB2 GLU A 139 10.886 -0.204 5.330 1.00 0.00 H new ATOM 0 HB3 GLU A 139 11.054 1.535 5.475 1.00 0.00 H new ATOM 0 HG2 GLU A 139 10.108 1.495 7.502 1.00 0.00 H new ATOM 0 HG3 GLU A 139 8.650 0.781 6.842 1.00 0.00 H new ATOM 984 N GLU A 140 10.483 0.163 2.434 1.00 0.00 N ATOM 985 CA GLU A 140 11.152 0.306 1.149 1.00 0.00 C ATOM 986 C GLU A 140 10.115 0.525 0.057 1.00 0.00 C ATOM 987 O GLU A 140 10.326 1.298 -0.877 1.00 0.00 O ATOM 988 CB GLU A 140 11.994 -0.934 0.840 1.00 0.00 C ATOM 989 CG GLU A 140 13.308 -0.621 0.142 1.00 0.00 C ATOM 990 CD GLU A 140 14.345 -0.044 1.086 1.00 0.00 C ATOM 991 OE1 GLU A 140 14.872 -0.805 1.924 1.00 0.00 O1- ATOM 992 OE2 GLU A 140 14.629 1.167 0.987 1.00 0.00 O ATOM 0 H GLU A 140 10.429 -0.796 2.776 1.00 0.00 H new ATOM 0 HA GLU A 140 11.818 1.168 1.190 1.00 0.00 H new ATOM 0 HB2 GLU A 140 12.204 -1.461 1.771 1.00 0.00 H new ATOM 0 HB3 GLU A 140 11.412 -1.611 0.214 1.00 0.00 H new ATOM 0 HG2 GLU A 140 13.701 -1.531 -0.311 1.00 0.00 H new ATOM 0 HG3 GLU A 140 13.126 0.085 -0.668 1.00 0.00 H new ATOM 999 N PHE A 141 8.983 -0.158 0.201 1.00 0.00 N ATOM 1000 CA PHE A 141 7.889 -0.042 -0.749 1.00 0.00 C ATOM 1001 C PHE A 141 7.328 1.378 -0.720 1.00 0.00 C ATOM 1002 O PHE A 141 7.139 2.004 -1.761 1.00 0.00 O ATOM 1003 CB PHE A 141 6.796 -1.067 -0.413 1.00 0.00 C ATOM 1004 CG PHE A 141 5.520 -0.900 -1.194 1.00 0.00 C ATOM 1005 CD1 PHE A 141 5.490 -1.111 -2.563 1.00 0.00 C ATOM 1006 CD2 PHE A 141 4.351 -0.528 -0.551 1.00 0.00 C ATOM 1007 CE1 PHE A 141 4.315 -0.954 -3.276 1.00 0.00 C ATOM 1008 CE2 PHE A 141 3.177 -0.370 -1.256 1.00 0.00 C ATOM 1009 CZ PHE A 141 3.157 -0.582 -2.621 1.00 0.00 C ATOM 0 H PHE A 141 8.802 -0.800 0.972 1.00 0.00 H new ATOM 0 HA PHE A 141 8.257 -0.248 -1.754 1.00 0.00 H new ATOM 0 HB2 PHE A 141 7.188 -2.068 -0.592 1.00 0.00 H new ATOM 0 HB3 PHE A 141 6.567 -0.999 0.651 1.00 0.00 H new ATOM 0 HD1 PHE A 141 6.393 -1.401 -3.079 1.00 0.00 H new ATOM 0 HD2 PHE A 141 4.359 -0.360 0.516 1.00 0.00 H new ATOM 0 HE1 PHE A 141 4.303 -1.122 -4.343 1.00 0.00 H new ATOM 0 HE2 PHE A 141 2.273 -0.080 -0.741 1.00 0.00 H new ATOM 0 HZ PHE A 141 2.238 -0.457 -3.175 1.00 0.00 H new ATOM 1019 N VAL A 142 7.071 1.880 0.483 1.00 0.00 N ATOM 1020 CA VAL A 142 6.543 3.227 0.646 1.00 0.00 C ATOM 1021 C VAL A 142 7.586 4.273 0.257 1.00 0.00 C ATOM 1022 O VAL A 142 7.249 5.340 -0.251 1.00 0.00 O ATOM 1023 CB VAL A 142 6.066 3.478 2.095 1.00 0.00 C ATOM 1024 CG1 VAL A 142 7.235 3.501 3.074 1.00 0.00 C ATOM 1025 CG2 VAL A 142 5.267 4.769 2.178 1.00 0.00 C ATOM 0 H VAL A 142 7.220 1.375 1.357 1.00 0.00 H new ATOM 0 HA VAL A 142 5.684 3.318 -0.019 1.00 0.00 H new ATOM 0 HB VAL A 142 5.417 2.650 2.379 1.00 0.00 H new ATOM 0 HG11 VAL A 142 6.862 3.680 4.082 1.00 0.00 H new ATOM 0 HG12 VAL A 142 7.754 2.543 3.044 1.00 0.00 H new ATOM 0 HG13 VAL A 142 7.926 4.297 2.797 1.00 0.00 H new ATOM 0 HG21 VAL A 142 4.940 4.929 3.205 1.00 0.00 H new ATOM 0 HG22 VAL A 142 5.892 5.604 1.862 1.00 0.00 H new ATOM 0 HG23 VAL A 142 4.396 4.700 1.526 1.00 0.00 H new ATOM 1035 N ARG A 143 8.853 3.956 0.514 1.00 0.00 N ATOM 1036 CA ARG A 143 9.949 4.868 0.206 1.00 0.00 C ATOM 1037 C ARG A 143 10.232 4.927 -1.293 1.00 0.00 C ATOM 1038 O ARG A 143 10.518 5.995 -1.833 1.00 0.00 O ATOM 1039 CB ARG A 143 11.212 4.442 0.957 1.00 0.00 C ATOM 1040 CG ARG A 143 12.367 5.420 0.813 1.00 0.00 C ATOM 1041 CD ARG A 143 13.471 5.131 1.817 1.00 0.00 C ATOM 1042 NE ARG A 143 12.945 4.914 3.165 1.00 0.00 N ATOM 1043 CZ ARG A 143 12.433 5.878 3.931 1.00 0.00 C ATOM 1044 NH1 ARG A 143 12.375 7.132 3.495 1.00 0.00 N1+ ATOM 1045 NH2 ARG A 143 11.973 5.586 5.140 1.00 0.00 N ATOM 0 H ARG A 143 9.145 3.074 0.935 1.00 0.00 H new ATOM 0 HA ARG A 143 9.650 5.865 0.529 1.00 0.00 H new ATOM 0 HB2 ARG A 143 10.974 4.327 2.015 1.00 0.00 H new ATOM 0 HB3 ARG A 143 11.528 3.464 0.594 1.00 0.00 H new ATOM 0 HG2 ARG A 143 12.770 5.363 -0.198 1.00 0.00 H new ATOM 0 HG3 ARG A 143 12.003 6.438 0.954 1.00 0.00 H new ATOM 0 HD2 ARG A 143 14.028 4.250 1.499 1.00 0.00 H new ATOM 0 HD3 ARG A 143 14.174 5.964 1.832 1.00 0.00 H new ATOM 0 HE ARG A 143 12.972 3.967 3.542 1.00 0.00 H new ATOM 0 HH11 ARG A 143 12.724 7.365 2.566 1.00 0.00 H new ATOM 0 HH12 ARG A 143 11.981 7.861 4.090 1.00 0.00 H new ATOM 0 HH21 ARG A 143 12.011 4.626 5.482 1.00 0.00 H new ATOM 0 HH22 ARG A 143 11.581 6.322 5.728 1.00 0.00 H new ATOM 1059 N MET A 144 10.169 3.779 -1.961 1.00 0.00 N ATOM 1060 CA MET A 144 10.438 3.720 -3.395 1.00 0.00 C ATOM 1061 C MET A 144 9.319 4.370 -4.209 1.00 0.00 C ATOM 1062 O MET A 144 9.569 4.930 -5.276 1.00 0.00 O ATOM 1063 CB MET A 144 10.648 2.272 -3.845 1.00 0.00 C ATOM 1064 CG MET A 144 9.407 1.399 -3.718 1.00 0.00 C ATOM 1065 SD MET A 144 9.014 0.507 -5.237 1.00 0.00 S ATOM 1066 CE MET A 144 8.041 1.735 -6.104 1.00 0.00 C ATOM 0 H MET A 144 9.936 2.882 -1.536 1.00 0.00 H new ATOM 0 HA MET A 144 11.353 4.284 -3.578 1.00 0.00 H new ATOM 0 HB2 MET A 144 10.977 2.269 -4.884 1.00 0.00 H new ATOM 0 HB3 MET A 144 11.452 1.832 -3.255 1.00 0.00 H new ATOM 0 HG2 MET A 144 9.555 0.682 -2.910 1.00 0.00 H new ATOM 0 HG3 MET A 144 8.558 2.023 -3.439 1.00 0.00 H new ATOM 0 HE1 MET A 144 8.220 1.651 -7.176 1.00 0.00 H new ATOM 0 HE2 MET A 144 6.983 1.572 -5.899 1.00 0.00 H new ATOM 0 HE3 MET A 144 8.327 2.731 -5.766 1.00 0.00 H new ATOM 1076 N MET A 145 8.086 4.294 -3.711 1.00 0.00 N ATOM 1077 CA MET A 145 6.949 4.881 -4.416 1.00 0.00 C ATOM 1078 C MET A 145 6.887 6.390 -4.198 1.00 0.00 C ATOM 1079 O MET A 145 6.447 7.133 -5.076 1.00 0.00 O ATOM 1080 CB MET A 145 5.638 4.230 -3.968 1.00 0.00 C ATOM 1081 CG MET A 145 5.322 4.427 -2.493 1.00 0.00 C ATOM 1082 SD MET A 145 3.618 4.948 -2.202 1.00 0.00 S ATOM 1083 CE MET A 145 2.879 3.405 -1.672 1.00 0.00 C ATOM 0 H MET A 145 7.850 3.836 -2.830 1.00 0.00 H new ATOM 0 HA MET A 145 7.087 4.693 -5.481 1.00 0.00 H new ATOM 0 HB2 MET A 145 4.820 4.638 -4.562 1.00 0.00 H new ATOM 0 HB3 MET A 145 5.684 3.162 -4.180 1.00 0.00 H new ATOM 0 HG2 MET A 145 5.508 3.495 -1.959 1.00 0.00 H new ATOM 0 HG3 MET A 145 6.000 5.172 -2.078 1.00 0.00 H new ATOM 0 HE1 MET A 145 2.186 3.596 -0.853 1.00 0.00 H new ATOM 0 HE2 MET A 145 2.341 2.954 -2.506 1.00 0.00 H new ATOM 0 HE3 MET A 145 3.661 2.724 -1.334 1.00 0.00 H new ATOM 1093 N VAL A 146 7.336 6.839 -3.030 1.00 0.00 N ATOM 1094 CA VAL A 146 7.335 8.261 -2.710 1.00 0.00 C ATOM 1095 C VAL A 146 8.657 8.909 -3.117 1.00 0.00 C ATOM 1096 O VAL A 146 8.705 10.092 -3.452 1.00 0.00 O ATOM 1097 CB VAL A 146 7.083 8.505 -1.206 1.00 0.00 C ATOM 1098 CG1 VAL A 146 5.728 7.946 -0.798 1.00 0.00 C ATOM 1099 CG2 VAL A 146 8.198 7.898 -0.360 1.00 0.00 C ATOM 0 H VAL A 146 7.704 6.240 -2.291 1.00 0.00 H new ATOM 0 HA VAL A 146 6.521 8.716 -3.275 1.00 0.00 H new ATOM 0 HB VAL A 146 7.079 9.581 -1.030 1.00 0.00 H new ATOM 0 HG11 VAL A 146 5.565 8.126 0.265 1.00 0.00 H new ATOM 0 HG12 VAL A 146 4.943 8.437 -1.373 1.00 0.00 H new ATOM 0 HG13 VAL A 146 5.703 6.874 -0.992 1.00 0.00 H new ATOM 0 HG21 VAL A 146 7.997 8.084 0.695 1.00 0.00 H new ATOM 0 HG22 VAL A 146 8.245 6.823 -0.537 1.00 0.00 H new ATOM 0 HG23 VAL A 146 9.150 8.352 -0.633 1.00 0.00 H new ATOM 1109 N SER A 147 9.727 8.120 -3.084 1.00 0.00 N ATOM 1110 CA SER A 147 11.052 8.606 -3.449 1.00 0.00 C ATOM 1111 C SER A 147 11.462 8.082 -4.823 1.00 0.00 C ATOM 1112 O SER A 147 12.646 7.879 -5.092 1.00 0.00 O ATOM 1113 CB SER A 147 12.077 8.175 -2.397 1.00 0.00 C ATOM 1114 OG SER A 147 13.029 9.198 -2.164 1.00 0.00 O ATOM 0 H SER A 147 9.701 7.139 -2.807 1.00 0.00 H new ATOM 0 HA SER A 147 11.019 9.695 -3.492 1.00 0.00 H new ATOM 0 HB2 SER A 147 11.566 7.930 -1.466 1.00 0.00 H new ATOM 0 HB3 SER A 147 12.585 7.270 -2.729 1.00 0.00 H new ATOM 0 HG SER A 147 13.672 8.899 -1.487 1.00 0.00 H new ATOM 1120 N LYS A 148 10.477 7.862 -5.688 1.00 0.00 N ATOM 1121 CA LYS A 148 10.737 7.358 -7.033 1.00 0.00 C ATOM 1122 C LYS A 148 11.202 8.483 -7.955 1.00 0.00 C ATOM 1123 O LYS A 148 11.780 9.465 -7.443 1.00 0.00 O ATOM 1124 CB LYS A 148 9.481 6.696 -7.605 1.00 0.00 C ATOM 1125 CG LYS A 148 9.764 5.408 -8.365 1.00 0.00 C ATOM 1126 CD LYS A 148 9.643 5.601 -9.869 1.00 0.00 C ATOM 1127 CE LYS A 148 10.176 4.398 -10.631 1.00 0.00 C ATOM 1128 NZ LYS A 148 9.341 4.078 -11.823 1.00 0.00 N1+ ATOM 1129 OXT LYS A 148 10.985 8.370 -9.179 1.00 0.00 O1- ATOM 0 H LYS A 148 9.491 8.025 -5.482 1.00 0.00 H new ATOM 0 HA LYS A 148 11.532 6.615 -6.969 1.00 0.00 H new ATOM 0 HB2 LYS A 148 8.789 6.483 -6.790 1.00 0.00 H new ATOM 0 HB3 LYS A 148 8.981 7.399 -8.271 1.00 0.00 H new ATOM 0 HG2 LYS A 148 10.767 5.056 -8.123 1.00 0.00 H new ATOM 0 HG3 LYS A 148 9.068 4.634 -8.041 1.00 0.00 H new ATOM 0 HD2 LYS A 148 8.598 5.766 -10.133 1.00 0.00 H new ATOM 0 HD3 LYS A 148 10.192 6.494 -10.167 1.00 0.00 H new ATOM 0 HE2 LYS A 148 11.200 4.594 -10.948 1.00 0.00 H new ATOM 0 HE3 LYS A 148 10.208 3.534 -9.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 9.739 3.252 -12.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 8.369 3.865 -11.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 9.331 4.893 -12.469 1.00 0.00 H new TER 1143 LYS A 148 ATOM 1144 N LYS B1901 -12.499 -3.926 17.115 1.00 0.00 N ATOM 1145 CA LYS B1901 -11.884 -4.684 15.995 1.00 0.00 C ATOM 1146 C LYS B1901 -12.928 -5.066 14.949 1.00 0.00 C ATOM 1147 O LYS B1901 -12.928 -6.186 14.438 1.00 0.00 O ATOM 1148 CB LYS B1901 -11.219 -5.940 16.563 1.00 0.00 C ATOM 1149 CG LYS B1901 -12.181 -6.850 17.313 1.00 0.00 C ATOM 1150 CD LYS B1901 -12.153 -8.272 16.772 1.00 0.00 C ATOM 1151 CE LYS B1901 -12.258 -9.296 17.891 1.00 0.00 C ATOM 1152 NZ LYS B1901 -13.327 -8.947 18.866 1.00 0.00 N1+ ATOM 0 HA LYS B1901 -11.141 -4.056 15.503 1.00 0.00 H new ATOM 0 HB2 LYS B1901 -10.763 -6.500 15.747 1.00 0.00 H new ATOM 0 HB3 LYS B1901 -10.414 -5.643 17.235 1.00 0.00 H new ATOM 0 HG2 LYS B1901 -11.922 -6.859 18.372 1.00 0.00 H new ATOM 0 HG3 LYS B1901 -13.193 -6.452 17.236 1.00 0.00 H new ATOM 0 HD2 LYS B1901 -12.976 -8.412 16.071 1.00 0.00 H new ATOM 0 HD3 LYS B1901 -11.229 -8.433 16.216 1.00 0.00 H new ATOM 0 HE2 LYS B1901 -12.462 -10.279 17.466 1.00 0.00 H new ATOM 0 HE3 LYS B1901 -11.302 -9.365 18.410 1.00 0.00 H new ATOM 0 HZ1 LYS B1901 -13.695 -9.816 19.304 1.00 0.00 H new ATOM 0 HZ2 LYS B1901 -12.935 -8.327 19.603 1.00 0.00 H new ATOM 0 HZ3 LYS B1901 -14.099 -8.454 18.373 1.00 0.00 H new ATOM 1168 N ARG B1902 -13.815 -4.127 14.635 1.00 0.00 N ATOM 1169 CA ARG B1902 -14.864 -4.366 13.651 1.00 0.00 C ATOM 1170 C ARG B1902 -14.574 -3.618 12.354 1.00 0.00 C ATOM 1171 O ARG B1902 -14.682 -2.393 12.294 1.00 0.00 O ATOM 1172 CB ARG B1902 -16.222 -3.936 14.208 1.00 0.00 C ATOM 1173 CG ARG B1902 -16.206 -2.563 14.858 1.00 0.00 C ATOM 1174 CD ARG B1902 -15.839 -2.648 16.331 1.00 0.00 C ATOM 1175 NE ARG B1902 -17.022 -2.655 17.190 1.00 0.00 N ATOM 1176 CZ ARG B1902 -16.989 -2.464 18.510 1.00 0.00 C ATOM 1177 NH1 ARG B1902 -15.835 -2.247 19.133 1.00 0.00 N1+ ATOM 1178 NH2 ARG B1902 -18.115 -2.487 19.209 1.00 0.00 N ATOM 0 H ARG B1902 -13.828 -3.194 15.048 1.00 0.00 H new ATOM 0 HA ARG B1902 -14.889 -5.434 13.436 1.00 0.00 H new ATOM 0 HB2 ARG B1902 -16.954 -3.938 13.400 1.00 0.00 H new ATOM 0 HB3 ARG B1902 -16.554 -4.672 14.940 1.00 0.00 H new ATOM 0 HG2 ARG B1902 -15.492 -1.923 14.340 1.00 0.00 H new ATOM 0 HG3 ARG B1902 -17.186 -2.098 14.752 1.00 0.00 H new ATOM 0 HD2 ARG B1902 -15.257 -3.552 16.508 1.00 0.00 H new ATOM 0 HD3 ARG B1902 -15.204 -1.803 16.596 1.00 0.00 H new ATOM 0 HE ARG B1902 -17.929 -2.816 16.753 1.00 0.00 H new ATOM 0 HH11 ARG B1902 -14.965 -2.225 18.602 1.00 0.00 H new ATOM 0 HH12 ARG B1902 -15.820 -2.102 20.143 1.00 0.00 H new ATOM 0 HH21 ARG B1902 -19.005 -2.651 18.738 1.00 0.00 H new ATOM 0 HH22 ARG B1902 -18.092 -2.341 20.218 1.00 0.00 H new ATOM 1192 N LYS B1903 -14.206 -4.362 11.315 1.00 0.00 N ATOM 1193 CA LYS B1903 -13.900 -3.769 10.018 1.00 0.00 C ATOM 1194 C LYS B1903 -12.730 -2.798 10.125 1.00 0.00 C ATOM 1195 O LYS B1903 -12.685 -1.784 9.429 1.00 0.00 O ATOM 1196 CB LYS B1903 -15.129 -3.047 9.461 1.00 0.00 C ATOM 1197 CG LYS B1903 -16.309 -3.969 9.195 1.00 0.00 C ATOM 1198 CD LYS B1903 -16.110 -4.772 7.919 1.00 0.00 C ATOM 1199 CE LYS B1903 -17.407 -4.906 7.137 1.00 0.00 C ATOM 1200 NZ LYS B1903 -17.506 -6.220 6.444 1.00 0.00 N1+ ATOM 0 H LYS B1903 -14.113 -5.377 11.346 1.00 0.00 H new ATOM 0 HA LYS B1903 -13.619 -4.572 9.337 1.00 0.00 H new ATOM 0 HB2 LYS B1903 -15.435 -2.273 10.165 1.00 0.00 H new ATOM 0 HB3 LYS B1903 -14.855 -2.544 8.533 1.00 0.00 H new ATOM 0 HG2 LYS B1903 -16.439 -4.648 10.037 1.00 0.00 H new ATOM 0 HG3 LYS B1903 -17.223 -3.380 9.117 1.00 0.00 H new ATOM 0 HD2 LYS B1903 -15.357 -4.288 7.297 1.00 0.00 H new ATOM 0 HD3 LYS B1903 -15.729 -5.763 8.167 1.00 0.00 H new ATOM 0 HE2 LYS B1903 -18.253 -4.789 7.814 1.00 0.00 H new ATOM 0 HE3 LYS B1903 -17.473 -4.103 6.403 1.00 0.00 H new ATOM 0 HZ1 LYS B1903 -18.354 -6.232 5.842 1.00 0.00 H new ATOM 0 HZ2 LYS B1903 -16.661 -6.366 5.855 1.00 0.00 H new ATOM 0 HZ3 LYS B1903 -17.572 -6.981 7.150 1.00 0.00 H new ATOM 1214 N GLN B1904 -11.783 -3.116 11.002 1.00 0.00 N ATOM 1215 CA GLN B1904 -10.609 -2.273 11.202 1.00 0.00 C ATOM 1216 C GLN B1904 -9.559 -2.544 10.129 1.00 0.00 C ATOM 1217 O GLN B1904 -8.917 -1.621 9.625 1.00 0.00 O ATOM 1218 CB GLN B1904 -10.014 -2.517 12.592 1.00 0.00 C ATOM 1219 CG GLN B1904 -9.529 -1.250 13.277 1.00 0.00 C ATOM 1220 CD GLN B1904 -8.472 -0.520 12.472 1.00 0.00 C ATOM 1221 OE1 GLN B1904 -7.323 -0.955 12.395 1.00 0.00 O ATOM 1222 NE2 GLN B1904 -8.856 0.598 11.868 1.00 0.00 N ATOM 0 H GLN B1904 -11.806 -3.952 11.586 1.00 0.00 H new ATOM 0 HA GLN B1904 -10.919 -1.231 11.126 1.00 0.00 H new ATOM 0 HB2 GLN B1904 -10.765 -2.995 13.221 1.00 0.00 H new ATOM 0 HB3 GLN B1904 -9.181 -3.214 12.504 1.00 0.00 H new ATOM 0 HG2 GLN B1904 -10.376 -0.585 13.445 1.00 0.00 H new ATOM 0 HG3 GLN B1904 -9.124 -1.503 14.257 1.00 0.00 H new ATOM 0 HE21 GLN B1904 -9.819 0.922 11.959 1.00 0.00 H new ATOM 0 HE22 GLN B1904 -8.188 1.133 11.313 1.00 0.00 H new ATOM 1231 N GLU B1905 -9.390 -3.816 9.787 1.00 0.00 N ATOM 1232 CA GLU B1905 -8.418 -4.215 8.776 1.00 0.00 C ATOM 1233 C GLU B1905 -8.860 -3.769 7.386 1.00 0.00 C ATOM 1234 O GLU B1905 -8.039 -3.380 6.557 1.00 0.00 O ATOM 1235 CB GLU B1905 -8.227 -5.735 8.797 1.00 0.00 C ATOM 1236 CG GLU B1905 -7.476 -6.239 10.019 1.00 0.00 C ATOM 1237 CD GLU B1905 -8.184 -5.908 11.318 1.00 0.00 C ATOM 1238 OE1 GLU B1905 -9.291 -6.440 11.544 1.00 0.00 O1- ATOM 1239 OE2 GLU B1905 -7.631 -5.115 12.109 1.00 0.00 O ATOM 0 H GLU B1905 -9.914 -4.590 10.196 1.00 0.00 H new ATOM 0 HA GLU B1905 -7.470 -3.730 9.009 1.00 0.00 H new ATOM 0 HB2 GLU B1905 -9.204 -6.216 8.758 1.00 0.00 H new ATOM 0 HB3 GLU B1905 -7.687 -6.037 7.899 1.00 0.00 H new ATOM 0 HG2 GLU B1905 -7.350 -7.319 9.943 1.00 0.00 H new ATOM 0 HG3 GLU B1905 -6.477 -5.802 10.033 1.00 0.00 H new ATOM 1246 N GLU B1906 -10.165 -3.833 7.138 1.00 0.00 N ATOM 1247 CA GLU B1906 -10.719 -3.441 5.847 1.00 0.00 C ATOM 1248 C GLU B1906 -10.451 -1.967 5.557 1.00 0.00 C ATOM 1249 O GLU B1906 -9.851 -1.626 4.539 1.00 0.00 O ATOM 1250 CB GLU B1906 -12.223 -3.714 5.811 1.00 0.00 C ATOM 1251 CG GLU B1906 -12.577 -5.188 5.924 1.00 0.00 C ATOM 1252 CD GLU B1906 -13.715 -5.585 5.005 1.00 0.00 C ATOM 1253 OE1 GLU B1906 -14.887 -5.382 5.390 1.00 0.00 O1- ATOM 1254 OE2 GLU B1906 -13.437 -6.098 3.901 1.00 0.00 O ATOM 0 H GLU B1906 -10.858 -4.153 7.814 1.00 0.00 H new ATOM 0 HA GLU B1906 -10.228 -4.036 5.077 1.00 0.00 H new ATOM 0 HB2 GLU B1906 -12.702 -3.170 6.625 1.00 0.00 H new ATOM 0 HB3 GLU B1906 -12.633 -3.321 4.881 1.00 0.00 H new ATOM 0 HG2 GLU B1906 -11.698 -5.788 5.689 1.00 0.00 H new ATOM 0 HG3 GLU B1906 -12.851 -5.414 6.954 1.00 0.00 H new ATOM 1261 N VAL B1907 -10.901 -1.093 6.457 1.00 0.00 N ATOM 1262 CA VAL B1907 -10.711 0.347 6.294 1.00 0.00 C ATOM 1263 C VAL B1907 -9.238 0.693 6.070 1.00 0.00 C ATOM 1264 O VAL B1907 -8.909 1.549 5.245 1.00 0.00 O ATOM 1265 CB VAL B1907 -11.244 1.126 7.518 1.00 0.00 C ATOM 1266 CG1 VAL B1907 -10.494 0.727 8.781 1.00 0.00 C ATOM 1267 CG2 VAL B1907 -11.153 2.628 7.285 1.00 0.00 C ATOM 0 H VAL B1907 -11.400 -1.358 7.306 1.00 0.00 H new ATOM 0 HA VAL B1907 -11.279 0.644 5.413 1.00 0.00 H new ATOM 0 HB VAL B1907 -12.294 0.868 7.653 1.00 0.00 H new ATOM 0 HG11 VAL B1907 -10.886 1.288 9.629 1.00 0.00 H new ATOM 0 HG12 VAL B1907 -10.625 -0.340 8.960 1.00 0.00 H new ATOM 0 HG13 VAL B1907 -9.433 0.947 8.659 1.00 0.00 H new ATOM 0 HG21 VAL B1907 -11.534 3.156 8.160 1.00 0.00 H new ATOM 0 HG22 VAL B1907 -10.113 2.908 7.117 1.00 0.00 H new ATOM 0 HG23 VAL B1907 -11.747 2.897 6.412 1.00 0.00 H new ATOM 1277 N SER B1908 -8.358 0.016 6.801 1.00 0.00 N ATOM 1278 CA SER B1908 -6.923 0.245 6.676 1.00 0.00 C ATOM 1279 C SER B1908 -6.460 -0.003 5.244 1.00 0.00 C ATOM 1280 O SER B1908 -5.581 0.694 4.733 1.00 0.00 O ATOM 1281 CB SER B1908 -6.155 -0.665 7.638 1.00 0.00 C ATOM 1282 OG SER B1908 -6.030 -0.066 8.917 1.00 0.00 O ATOM 0 H SER B1908 -8.613 -0.695 7.486 1.00 0.00 H new ATOM 0 HA SER B1908 -6.720 1.285 6.932 1.00 0.00 H new ATOM 0 HB2 SER B1908 -6.671 -1.621 7.729 1.00 0.00 H new ATOM 0 HB3 SER B1908 -5.165 -0.875 7.233 1.00 0.00 H new ATOM 0 HG SER B1908 -6.720 -0.423 9.514 1.00 0.00 H new ATOM 1288 N ALA B1909 -7.062 -0.998 4.600 1.00 0.00 N ATOM 1289 CA ALA B1909 -6.717 -1.338 3.226 1.00 0.00 C ATOM 1290 C ALA B1909 -7.279 -0.313 2.243 1.00 0.00 C ATOM 1291 O ALA B1909 -6.728 -0.115 1.161 1.00 0.00 O ATOM 1292 CB ALA B1909 -7.215 -2.736 2.889 1.00 0.00 C ATOM 0 H ALA B1909 -7.791 -1.583 5.009 1.00 0.00 H new ATOM 0 HA ALA B1909 -5.631 -1.322 3.135 1.00 0.00 H new ATOM 0 HB1 ALA B1909 -6.951 -2.978 1.860 1.00 0.00 H new ATOM 0 HB2 ALA B1909 -6.753 -3.459 3.562 1.00 0.00 H new ATOM 0 HB3 ALA B1909 -8.298 -2.774 3.004 1.00 0.00 H new ATOM 1298 N ILE B1910 -8.371 0.346 2.624 1.00 0.00 N ATOM 1299 CA ILE B1910 -8.983 1.354 1.766 1.00 0.00 C ATOM 1300 C ILE B1910 -8.013 2.507 1.533 1.00 0.00 C ATOM 1301 O ILE B1910 -7.698 2.852 0.390 1.00 0.00 O ATOM 1302 CB ILE B1910 -10.293 1.904 2.372 1.00 0.00 C ATOM 1303 CG1 ILE B1910 -11.237 0.754 2.731 1.00 0.00 C ATOM 1304 CG2 ILE B1910 -10.969 2.864 1.403 1.00 0.00 C ATOM 1305 CD1 ILE B1910 -12.544 1.210 3.343 1.00 0.00 C ATOM 0 H ILE B1910 -8.846 0.201 3.515 1.00 0.00 H new ATOM 0 HA ILE B1910 -9.221 0.872 0.818 1.00 0.00 H new ATOM 0 HB ILE B1910 -10.049 2.451 3.283 1.00 0.00 H new ATOM 0 HG12 ILE B1910 -11.449 0.175 1.832 1.00 0.00 H new ATOM 0 HG13 ILE B1910 -10.733 0.086 3.429 1.00 0.00 H new ATOM 0 HG21 ILE B1910 -11.890 3.241 1.847 1.00 0.00 H new ATOM 0 HG22 ILE B1910 -10.300 3.698 1.191 1.00 0.00 H new ATOM 0 HG23 ILE B1910 -11.201 2.341 0.475 1.00 0.00 H new ATOM 0 HD11 ILE B1910 -13.162 0.341 3.571 1.00 0.00 H new ATOM 0 HD12 ILE B1910 -12.343 1.763 4.260 1.00 0.00 H new ATOM 0 HD13 ILE B1910 -13.070 1.854 2.639 1.00 0.00 H new ATOM 1317 N VAL B1911 -7.530 3.095 2.625 1.00 0.00 N ATOM 1318 CA VAL B1911 -6.586 4.201 2.536 1.00 0.00 C ATOM 1319 C VAL B1911 -5.317 3.768 1.805 1.00 0.00 C ATOM 1320 O VAL B1911 -4.753 4.524 1.015 1.00 0.00 O ATOM 1321 CB VAL B1911 -6.210 4.743 3.933 1.00 0.00 C ATOM 1322 CG1 VAL B1911 -5.546 3.662 4.773 1.00 0.00 C ATOM 1323 CG2 VAL B1911 -5.301 5.959 3.808 1.00 0.00 C ATOM 0 H VAL B1911 -7.777 2.824 3.577 1.00 0.00 H new ATOM 0 HA VAL B1911 -7.077 4.997 1.976 1.00 0.00 H new ATOM 0 HB VAL B1911 -7.127 5.048 4.437 1.00 0.00 H new ATOM 0 HG11 VAL B1911 -5.290 4.068 5.752 1.00 0.00 H new ATOM 0 HG12 VAL B1911 -6.232 2.824 4.895 1.00 0.00 H new ATOM 0 HG13 VAL B1911 -4.639 3.319 4.274 1.00 0.00 H new ATOM 0 HG21 VAL B1911 -5.047 6.327 4.802 1.00 0.00 H new ATOM 0 HG22 VAL B1911 -4.389 5.679 3.280 1.00 0.00 H new ATOM 0 HG23 VAL B1911 -5.816 6.742 3.252 1.00 0.00 H new ATOM 1333 N ILE B1912 -4.878 2.542 2.076 1.00 0.00 N ATOM 1334 CA ILE B1912 -3.681 2.007 1.445 1.00 0.00 C ATOM 1335 C ILE B1912 -3.864 1.953 -0.077 1.00 0.00 C ATOM 1336 O ILE B1912 -2.913 2.146 -0.838 1.00 0.00 O ATOM 1337 CB ILE B1912 -3.304 0.616 2.060 1.00 0.00 C ATOM 1338 CG1 ILE B1912 -1.817 0.573 2.399 1.00 0.00 C ATOM 1339 CG2 ILE B1912 -3.663 -0.570 1.168 1.00 0.00 C ATOM 1340 CD1 ILE B1912 -1.412 -0.656 3.184 1.00 0.00 C ATOM 0 H ILE B1912 -5.334 1.903 2.727 1.00 0.00 H new ATOM 0 HA ILE B1912 -2.841 2.672 1.644 1.00 0.00 H new ATOM 0 HB ILE B1912 -3.903 0.517 2.965 1.00 0.00 H new ATOM 0 HG12 ILE B1912 -1.241 0.610 1.475 1.00 0.00 H new ATOM 0 HG13 ILE B1912 -1.557 1.463 2.973 1.00 0.00 H new ATOM 0 HG21 ILE B1912 -3.372 -1.497 1.661 1.00 0.00 H new ATOM 0 HG22 ILE B1912 -4.738 -0.577 0.987 1.00 0.00 H new ATOM 0 HG23 ILE B1912 -3.136 -0.483 0.218 1.00 0.00 H new ATOM 0 HD11 ILE B1912 -0.342 -0.620 3.390 1.00 0.00 H new ATOM 0 HD12 ILE B1912 -1.962 -0.684 4.125 1.00 0.00 H new ATOM 0 HD13 ILE B1912 -1.640 -1.550 2.604 1.00 0.00 H new ATOM 1352 N GLN B1913 -5.102 1.715 -0.508 1.00 0.00 N ATOM 1353 CA GLN B1913 -5.418 1.666 -1.929 1.00 0.00 C ATOM 1354 C GLN B1913 -5.151 3.028 -2.558 1.00 0.00 C ATOM 1355 O GLN B1913 -4.570 3.128 -3.642 1.00 0.00 O ATOM 1356 CB GLN B1913 -6.880 1.251 -2.140 1.00 0.00 C ATOM 1357 CG GLN B1913 -7.036 -0.128 -2.763 1.00 0.00 C ATOM 1358 CD GLN B1913 -8.437 -0.690 -2.602 1.00 0.00 C ATOM 1359 OE1 GLN B1913 -9.420 -0.067 -3.004 1.00 0.00 O ATOM 1360 NE2 GLN B1913 -8.534 -1.876 -2.011 1.00 0.00 N ATOM 0 H GLN B1913 -5.899 1.554 0.108 1.00 0.00 H new ATOM 0 HA GLN B1913 -4.783 0.922 -2.411 1.00 0.00 H new ATOM 0 HB2 GLN B1913 -7.396 1.268 -1.180 1.00 0.00 H new ATOM 0 HB3 GLN B1913 -7.370 1.987 -2.778 1.00 0.00 H new ATOM 0 HG2 GLN B1913 -6.791 -0.072 -3.824 1.00 0.00 H new ATOM 0 HG3 GLN B1913 -6.320 -0.811 -2.306 1.00 0.00 H new ATOM 0 HE21 GLN B1913 -7.693 -2.358 -1.693 1.00 0.00 H new ATOM 0 HE22 GLN B1913 -9.449 -2.305 -1.875 1.00 0.00 H new ATOM 1369 N ARG B1914 -5.562 4.079 -1.853 1.00 0.00 N ATOM 1370 CA ARG B1914 -5.355 5.443 -2.321 1.00 0.00 C ATOM 1371 C ARG B1914 -3.865 5.720 -2.509 1.00 0.00 C ATOM 1372 O ARG B1914 -3.467 6.470 -3.401 1.00 0.00 O ATOM 1373 CB ARG B1914 -5.956 6.444 -1.331 1.00 0.00 C ATOM 1374 CG ARG B1914 -6.695 7.591 -2.003 1.00 0.00 C ATOM 1375 CD ARG B1914 -8.204 7.430 -1.894 1.00 0.00 C ATOM 1376 NE ARG B1914 -8.710 7.855 -0.589 1.00 0.00 N ATOM 1377 CZ ARG B1914 -8.945 9.124 -0.255 1.00 0.00 C ATOM 1378 NH1 ARG B1914 -8.723 10.106 -1.123 1.00 0.00 N1+ ATOM 1379 NH2 ARG B1914 -9.407 9.412 0.955 1.00 0.00 N ATOM 0 H ARG B1914 -6.041 4.010 -0.955 1.00 0.00 H new ATOM 0 HA ARG B1914 -5.857 5.558 -3.282 1.00 0.00 H new ATOM 0 HB2 ARG B1914 -6.643 5.919 -0.667 1.00 0.00 H new ATOM 0 HB3 ARG B1914 -5.159 6.851 -0.708 1.00 0.00 H new ATOM 0 HG2 ARG B1914 -6.396 8.534 -1.546 1.00 0.00 H new ATOM 0 HG3 ARG B1914 -6.410 7.642 -3.054 1.00 0.00 H new ATOM 0 HD2 ARG B1914 -8.688 8.013 -2.677 1.00 0.00 H new ATOM 0 HD3 ARG B1914 -8.470 6.387 -2.063 1.00 0.00 H new ATOM 0 HE ARG B1914 -8.895 7.135 0.109 1.00 0.00 H new ATOM 0 HH11 ARG B1914 -8.369 9.892 -2.055 1.00 0.00 H new ATOM 0 HH12 ARG B1914 -8.906 11.073 -0.857 1.00 0.00 H new ATOM 0 HH21 ARG B1914 -9.581 8.664 1.626 1.00 0.00 H new ATOM 0 HH22 ARG B1914 -9.588 10.382 1.214 1.00 0.00 H new ATOM 1393 N ALA B1915 -3.048 5.094 -1.666 1.00 0.00 N ATOM 1394 CA ALA B1915 -1.602 5.259 -1.740 1.00 0.00 C ATOM 1395 C ALA B1915 -1.075 4.754 -3.077 1.00 0.00 C ATOM 1396 O ALA B1915 -0.254 5.410 -3.720 1.00 0.00 O ATOM 1397 CB ALA B1915 -0.926 4.528 -0.590 1.00 0.00 C ATOM 0 H ALA B1915 -3.364 4.469 -0.925 1.00 0.00 H new ATOM 0 HA ALA B1915 -1.370 6.321 -1.659 1.00 0.00 H new ATOM 0 HB1 ALA B1915 0.154 4.661 -0.659 1.00 0.00 H new ATOM 0 HB2 ALA B1915 -1.281 4.933 0.358 1.00 0.00 H new ATOM 0 HB3 ALA B1915 -1.165 3.466 -0.643 1.00 0.00 H new ATOM 1403 N TYR B1916 -1.559 3.586 -3.499 1.00 0.00 N ATOM 1404 CA TYR B1916 -1.143 2.999 -4.769 1.00 0.00 C ATOM 1405 C TYR B1916 -1.433 3.955 -5.921 1.00 0.00 C ATOM 1406 O TYR B1916 -0.643 4.072 -6.858 1.00 0.00 O ATOM 1407 CB TYR B1916 -1.861 1.670 -5.008 1.00 0.00 C ATOM 1408 CG TYR B1916 -1.677 0.671 -3.889 1.00 0.00 C ATOM 1409 CD1 TYR B1916 -0.432 0.470 -3.308 1.00 0.00 C ATOM 1410 CD2 TYR B1916 -2.751 -0.068 -3.412 1.00 0.00 C ATOM 1411 CE1 TYR B1916 -0.263 -0.440 -2.283 1.00 0.00 C ATOM 1412 CE2 TYR B1916 -2.590 -0.980 -2.386 1.00 0.00 C ATOM 1413 CZ TYR B1916 -1.345 -1.162 -1.825 1.00 0.00 C ATOM 1414 OH TYR B1916 -1.180 -2.069 -0.803 1.00 0.00 O ATOM 0 H TYR B1916 -2.238 3.030 -2.980 1.00 0.00 H new ATOM 0 HA TYR B1916 -0.069 2.817 -4.722 1.00 0.00 H new ATOM 0 HB2 TYR B1916 -2.926 1.861 -5.141 1.00 0.00 H new ATOM 0 HB3 TYR B1916 -1.497 1.232 -5.938 1.00 0.00 H new ATOM 0 HD1 TYR B1916 0.418 1.034 -3.663 1.00 0.00 H new ATOM 0 HD2 TYR B1916 -3.728 0.072 -3.850 1.00 0.00 H new ATOM 0 HE1 TYR B1916 0.712 -0.586 -1.842 1.00 0.00 H new ATOM 0 HE2 TYR B1916 -3.436 -1.547 -2.026 1.00 0.00 H new ATOM 0 HH TYR B1916 -2.040 -2.492 -0.599 1.00 0.00 H new ATOM 1424 N ARG B1917 -2.570 4.644 -5.838 1.00 0.00 N ATOM 1425 CA ARG B1917 -2.962 5.601 -6.870 1.00 0.00 C ATOM 1426 C ARG B1917 -1.894 6.679 -7.035 1.00 0.00 C ATOM 1427 O ARG B1917 -1.489 7.001 -8.152 1.00 0.00 O ATOM 1428 CB ARG B1917 -4.310 6.239 -6.519 1.00 0.00 C ATOM 1429 CG ARG B1917 -5.483 5.620 -7.262 1.00 0.00 C ATOM 1430 CD ARG B1917 -6.748 6.445 -7.096 1.00 0.00 C ATOM 1431 NE ARG B1917 -7.949 5.670 -7.406 1.00 0.00 N ATOM 1432 CZ ARG B1917 -8.391 4.651 -6.669 1.00 0.00 C ATOM 1433 NH1 ARG B1917 -7.739 4.274 -5.574 1.00 0.00 N1+ ATOM 1434 NH2 ARG B1917 -9.492 4.005 -7.029 1.00 0.00 N ATOM 0 H ARG B1917 -3.234 4.557 -5.069 1.00 0.00 H new ATOM 0 HA ARG B1917 -3.063 5.067 -7.815 1.00 0.00 H new ATOM 0 HB2 ARG B1917 -4.479 6.146 -5.446 1.00 0.00 H new ATOM 0 HB3 ARG B1917 -4.269 7.305 -6.744 1.00 0.00 H new ATOM 0 HG2 ARG B1917 -5.240 5.535 -8.321 1.00 0.00 H new ATOM 0 HG3 ARG B1917 -5.656 4.609 -6.893 1.00 0.00 H new ATOM 0 HD2 ARG B1917 -6.809 6.815 -6.072 1.00 0.00 H new ATOM 0 HD3 ARG B1917 -6.701 7.317 -7.748 1.00 0.00 H new ATOM 0 HE ARG B1917 -8.481 5.925 -8.238 1.00 0.00 H new ATOM 0 HH11 ARG B1917 -6.892 4.766 -5.290 1.00 0.00 H new ATOM 0 HH12 ARG B1917 -8.086 3.493 -5.017 1.00 0.00 H new ATOM 0 HH21 ARG B1917 -9.998 4.288 -7.868 1.00 0.00 H new ATOM 0 HH22 ARG B1917 -9.832 3.225 -6.467 1.00 0.00 H new ATOM 1448 N ARG B1918 -1.435 7.224 -5.913 1.00 0.00 N ATOM 1449 CA ARG B1918 -0.405 8.257 -5.930 1.00 0.00 C ATOM 1450 C ARG B1918 0.922 7.676 -6.409 1.00 0.00 C ATOM 1451 O ARG B1918 1.711 8.355 -7.065 1.00 0.00 O ATOM 1452 CB ARG B1918 -0.237 8.862 -4.533 1.00 0.00 C ATOM 1453 CG ARG B1918 0.024 10.359 -4.546 1.00 0.00 C ATOM 1454 CD ARG B1918 -1.217 11.155 -4.163 1.00 0.00 C ATOM 1455 NE ARG B1918 -1.595 10.951 -2.764 1.00 0.00 N ATOM 1456 CZ ARG B1918 -2.548 10.113 -2.343 1.00 0.00 C ATOM 1457 NH1 ARG B1918 -3.228 9.354 -3.199 1.00 0.00 N1+ ATOM 1458 NH2 ARG B1918 -2.816 10.026 -1.048 1.00 0.00 N ATOM 0 H ARG B1918 -1.760 6.968 -4.981 1.00 0.00 H new ATOM 0 HA ARG B1918 -0.714 9.042 -6.620 1.00 0.00 H new ATOM 0 HB2 ARG B1918 -1.136 8.663 -3.950 1.00 0.00 H new ATOM 0 HB3 ARG B1918 0.589 8.362 -4.026 1.00 0.00 H new ATOM 0 HG2 ARG B1918 0.833 10.593 -3.854 1.00 0.00 H new ATOM 0 HG3 ARG B1918 0.357 10.661 -5.539 1.00 0.00 H new ATOM 0 HD2 ARG B1918 -1.034 12.215 -4.337 1.00 0.00 H new ATOM 0 HD3 ARG B1918 -2.046 10.864 -4.808 1.00 0.00 H new ATOM 0 HE ARG B1918 -1.094 11.489 -2.057 1.00 0.00 H new ATOM 0 HH11 ARG B1918 -3.026 9.405 -4.198 1.00 0.00 H new ATOM 0 HH12 ARG B1918 -3.951 8.721 -2.857 1.00 0.00 H new ATOM 0 HH21 ARG B1918 -2.297 10.596 -0.380 1.00 0.00 H new ATOM 0 HH22 ARG B1918 -3.542 9.389 -0.719 1.00 0.00 H new ATOM 1472 N TYR B1919 1.152 6.412 -6.073 1.00 0.00 N ATOM 1473 CA TYR B1919 2.374 5.718 -6.461 1.00 0.00 C ATOM 1474 C TYR B1919 2.489 5.644 -7.985 1.00 0.00 C ATOM 1475 O TYR B1919 3.466 6.112 -8.569 1.00 0.00 O ATOM 1476 CB TYR B1919 2.382 4.308 -5.838 1.00 0.00 C ATOM 1477 CG TYR B1919 3.395 3.348 -6.439 1.00 0.00 C ATOM 1478 CD1 TYR B1919 4.632 3.798 -6.882 1.00 0.00 C ATOM 1479 CD2 TYR B1919 3.106 1.996 -6.565 1.00 0.00 C ATOM 1480 CE1 TYR B1919 5.554 2.928 -7.431 1.00 0.00 C ATOM 1481 CE2 TYR B1919 4.022 1.118 -7.112 1.00 0.00 C ATOM 1482 CZ TYR B1919 5.244 1.589 -7.544 1.00 0.00 C ATOM 1483 OH TYR B1919 6.159 0.719 -8.088 1.00 0.00 O ATOM 0 H TYR B1919 0.503 5.844 -5.529 1.00 0.00 H new ATOM 0 HA TYR B1919 3.236 6.272 -6.090 1.00 0.00 H new ATOM 0 HB2 TYR B1919 2.580 4.400 -4.770 1.00 0.00 H new ATOM 0 HB3 TYR B1919 1.387 3.875 -5.942 1.00 0.00 H new ATOM 0 HD1 TYR B1919 4.877 4.846 -6.796 1.00 0.00 H new ATOM 0 HD2 TYR B1919 2.149 1.624 -6.230 1.00 0.00 H new ATOM 0 HE1 TYR B1919 6.512 3.294 -7.770 1.00 0.00 H new ATOM 0 HE2 TYR B1919 3.782 0.069 -7.201 1.00 0.00 H new ATOM 0 HH TYR B1919 5.785 -0.187 -8.094 1.00 0.00 H new ATOM 1493 N LEU B1920 1.490 5.039 -8.615 1.00 0.00 N ATOM 1494 CA LEU B1920 1.472 4.883 -10.064 1.00 0.00 C ATOM 1495 C LEU B1920 1.603 6.232 -10.775 1.00 0.00 C ATOM 1496 O LEU B1920 2.392 6.377 -11.708 1.00 0.00 O ATOM 1497 CB LEU B1920 0.183 4.173 -10.493 1.00 0.00 C ATOM 1498 CG LEU B1920 0.387 2.898 -11.312 1.00 0.00 C ATOM 1499 CD1 LEU B1920 0.975 1.794 -10.446 1.00 0.00 C ATOM 1500 CD2 LEU B1920 -0.929 2.448 -11.928 1.00 0.00 C ATOM 0 H LEU B1920 0.677 4.646 -8.141 1.00 0.00 H new ATOM 0 HA LEU B1920 2.330 4.276 -10.353 1.00 0.00 H new ATOM 0 HB2 LEU B1920 -0.391 3.925 -9.600 1.00 0.00 H new ATOM 0 HB3 LEU B1920 -0.420 4.869 -11.077 1.00 0.00 H new ATOM 0 HG LEU B1920 1.090 3.114 -12.116 1.00 0.00 H new ATOM 0 HD11 LEU B1920 1.113 0.895 -11.047 1.00 0.00 H new ATOM 0 HD12 LEU B1920 1.938 2.117 -10.049 1.00 0.00 H new ATOM 0 HD13 LEU B1920 0.296 1.579 -9.621 1.00 0.00 H new ATOM 0 HD21 LEU B1920 -0.767 1.539 -12.508 1.00 0.00 H new ATOM 0 HD22 LEU B1920 -1.652 2.250 -11.137 1.00 0.00 H new ATOM 0 HD23 LEU B1920 -1.312 3.232 -12.581 1.00 0.00 H new ATOM 1512 N LEU B1921 0.822 7.211 -10.330 1.00 0.00 N ATOM 1513 CA LEU B1921 0.852 8.542 -10.928 1.00 0.00 C ATOM 1514 C LEU B1921 2.053 9.342 -10.432 1.00 0.00 C ATOM 1515 O LEU B1921 2.803 8.885 -9.568 1.00 0.00 O ATOM 1516 CB LEU B1921 -0.441 9.294 -10.608 1.00 0.00 C ATOM 1517 CG LEU B1921 -0.633 9.649 -9.132 1.00 0.00 C ATOM 1518 CD1 LEU B1921 0.062 10.961 -8.803 1.00 0.00 C ATOM 1519 CD2 LEU B1921 -2.113 9.728 -8.792 1.00 0.00 C ATOM 0 H LEU B1921 0.162 7.109 -9.559 1.00 0.00 H new ATOM 0 HA LEU B1921 0.942 8.423 -12.008 1.00 0.00 H new ATOM 0 HB2 LEU B1921 -0.464 10.213 -11.193 1.00 0.00 H new ATOM 0 HB3 LEU B1921 -1.286 8.688 -10.934 1.00 0.00 H new ATOM 0 HG LEU B1921 -0.182 8.862 -8.527 1.00 0.00 H new ATOM 0 HD11 LEU B1921 -0.086 11.197 -7.749 1.00 0.00 H new ATOM 0 HD12 LEU B1921 1.129 10.869 -9.008 1.00 0.00 H new ATOM 0 HD13 LEU B1921 -0.358 11.759 -9.416 1.00 0.00 H new ATOM 0 HD21 LEU B1921 -2.231 9.981 -7.738 1.00 0.00 H new ATOM 0 HD22 LEU B1921 -2.587 10.495 -9.405 1.00 0.00 H new ATOM 0 HD23 LEU B1921 -2.583 8.765 -8.988 1.00 0.00 H new ATOM 1531 N LYS B1922 2.226 10.540 -10.982 1.00 0.00 N ATOM 1532 CA LYS B1922 3.332 11.408 -10.596 1.00 0.00 C ATOM 1533 C LYS B1922 3.250 12.749 -11.320 1.00 0.00 C ATOM 1534 O LYS B1922 3.515 13.799 -10.734 1.00 0.00 O ATOM 1535 CB LYS B1922 4.672 10.734 -10.895 1.00 0.00 C ATOM 1536 CG LYS B1922 4.760 10.140 -12.291 1.00 0.00 C ATOM 1537 CD LYS B1922 6.018 9.301 -12.464 1.00 0.00 C ATOM 1538 CE LYS B1922 5.737 8.022 -13.234 1.00 0.00 C ATOM 1539 NZ LYS B1922 4.951 8.281 -14.473 1.00 0.00 N1+ ATOM 0 H LYS B1922 1.613 10.932 -11.697 1.00 0.00 H new ATOM 0 HA LYS B1922 3.259 11.589 -9.524 1.00 0.00 H new ATOM 0 HB2 LYS B1922 5.472 11.464 -10.770 1.00 0.00 H new ATOM 0 HB3 LYS B1922 4.843 9.945 -10.163 1.00 0.00 H new ATOM 0 HG2 LYS B1922 3.882 9.523 -12.481 1.00 0.00 H new ATOM 0 HG3 LYS B1922 4.752 10.942 -13.029 1.00 0.00 H new ATOM 0 HD2 LYS B1922 6.775 9.884 -12.989 1.00 0.00 H new ATOM 0 HD3 LYS B1922 6.429 9.054 -11.485 1.00 0.00 H new ATOM 0 HE2 LYS B1922 6.680 7.541 -13.496 1.00 0.00 H new ATOM 0 HE3 LYS B1922 5.191 7.327 -12.596 1.00 0.00 H new ATOM 0 HZ1 LYS B1922 5.144 7.533 -15.169 1.00 0.00 H new ATOM 0 HZ2 LYS B1922 3.936 8.289 -14.245 1.00 0.00 H new ATOM 0 HZ3 LYS B1922 5.223 9.203 -14.871 1.00 0.00 H new ATOM 1553 N GLN B1923 2.881 12.706 -12.597 1.00 0.00 N ATOM 1554 CA GLN B1923 2.764 13.919 -13.401 1.00 0.00 C ATOM 1555 C GLN B1923 1.353 14.064 -13.965 1.00 0.00 C ATOM 1556 O GLN B1923 1.170 14.469 -15.114 1.00 0.00 O ATOM 1557 CB GLN B1923 3.785 13.902 -14.540 1.00 0.00 C ATOM 1558 CG GLN B1923 4.205 15.289 -15.001 1.00 0.00 C ATOM 1559 CD GLN B1923 5.403 15.818 -14.237 1.00 0.00 C ATOM 1560 OE1 GLN B1923 6.528 15.358 -14.429 1.00 0.00 O ATOM 1561 NE2 GLN B1923 5.165 16.790 -13.365 1.00 0.00 N ATOM 0 H GLN B1923 2.658 11.845 -13.097 1.00 0.00 H new ATOM 0 HA GLN B1923 2.966 14.774 -12.756 1.00 0.00 H new ATOM 0 HB2 GLN B1923 4.669 13.353 -14.216 1.00 0.00 H new ATOM 0 HB3 GLN B1923 3.364 13.359 -15.386 1.00 0.00 H new ATOM 0 HG2 GLN B1923 4.441 15.259 -16.065 1.00 0.00 H new ATOM 0 HG3 GLN B1923 3.368 15.977 -14.880 1.00 0.00 H new ATOM 0 HE21 GLN B1923 4.216 17.141 -13.239 1.00 0.00 H new ATOM 0 HE22 GLN B1923 5.932 17.186 -12.821 1.00 0.00 H new ATOM 1570 N LYS B1924 0.358 13.732 -13.149 1.00 0.00 N ATOM 1571 CA LYS B1924 -1.036 13.825 -13.567 1.00 0.00 C ATOM 1572 C LYS B1924 -1.303 12.933 -14.777 1.00 0.00 C ATOM 1573 O LYS B1924 -1.436 13.416 -15.902 1.00 0.00 O ATOM 1574 CB LYS B1924 -1.398 15.276 -13.893 1.00 0.00 C ATOM 1575 CG LYS B1924 -1.919 16.055 -12.695 1.00 0.00 C ATOM 1576 CD LYS B1924 -1.456 17.503 -12.728 1.00 0.00 C ATOM 1577 CE LYS B1924 -2.187 18.297 -13.799 1.00 0.00 C ATOM 1578 NZ LYS B1924 -3.545 18.712 -13.353 1.00 0.00 N1+ ATOM 0 H LYS B1924 0.491 13.396 -12.195 1.00 0.00 H new ATOM 0 HA LYS B1924 -1.661 13.481 -12.743 1.00 0.00 H new ATOM 0 HB2 LYS B1924 -0.518 15.781 -14.290 1.00 0.00 H new ATOM 0 HB3 LYS B1924 -2.153 15.286 -14.679 1.00 0.00 H new ATOM 0 HG2 LYS B1924 -3.008 16.020 -12.683 1.00 0.00 H new ATOM 0 HG3 LYS B1924 -1.575 15.583 -11.775 1.00 0.00 H new ATOM 0 HD2 LYS B1924 -1.625 17.962 -11.754 1.00 0.00 H new ATOM 0 HD3 LYS B1924 -0.383 17.539 -12.916 1.00 0.00 H new ATOM 0 HE2 LYS B1924 -1.604 19.181 -14.057 1.00 0.00 H new ATOM 0 HE3 LYS B1924 -2.270 17.695 -14.704 1.00 0.00 H new ATOM 0 HZ1 LYS B1924 -4.010 19.251 -14.111 1.00 0.00 H new ATOM 0 HZ2 LYS B1924 -4.111 17.868 -13.131 1.00 0.00 H new ATOM 0 HZ3 LYS B1924 -3.465 19.308 -12.504 1.00 0.00 H new ATOM 1592 N VAL B1925 -1.388 11.625 -14.534 1.00 0.00 N ATOM 1593 CA VAL B1925 -1.647 10.652 -15.589 1.00 0.00 C ATOM 1594 C VAL B1925 -0.722 10.859 -16.791 1.00 0.00 C ATOM 1595 O VAL B1925 -0.996 11.685 -17.663 1.00 0.00 O ATOM 1596 CB VAL B1925 -3.117 10.734 -16.036 1.00 0.00 C ATOM 1597 CG1 VAL B1925 -3.424 9.723 -17.135 1.00 0.00 C ATOM 1598 CG2 VAL B1925 -4.042 10.528 -14.847 1.00 0.00 C ATOM 0 H VAL B1925 -1.280 11.215 -13.606 1.00 0.00 H new ATOM 0 HA VAL B1925 -1.446 9.661 -15.181 1.00 0.00 H new ATOM 0 HB VAL B1925 -3.287 11.729 -16.447 1.00 0.00 H new ATOM 0 HG11 VAL B1925 -4.471 9.809 -17.426 1.00 0.00 H new ATOM 0 HG12 VAL B1925 -2.789 9.921 -17.999 1.00 0.00 H new ATOM 0 HG13 VAL B1925 -3.231 8.715 -16.767 1.00 0.00 H new ATOM 0 HG21 VAL B1925 -5.079 10.589 -15.178 1.00 0.00 H new ATOM 0 HG22 VAL B1925 -3.858 9.547 -14.408 1.00 0.00 H new ATOM 0 HG23 VAL B1925 -3.853 11.300 -14.101 1.00 0.00 H new ATOM 1608 N LYS B1926 0.371 10.104 -16.829 1.00 0.00 N ATOM 1609 CA LYS B1926 1.333 10.201 -17.920 1.00 0.00 C ATOM 1610 C LYS B1926 2.089 8.887 -18.095 1.00 0.00 C ATOM 1611 O LYS B1926 1.899 7.944 -17.327 1.00 0.00 O ATOM 1612 CB LYS B1926 2.318 11.345 -17.659 1.00 0.00 C ATOM 1613 CG LYS B1926 1.919 12.653 -18.321 1.00 0.00 C ATOM 1614 CD LYS B1926 2.140 12.607 -19.824 1.00 0.00 C ATOM 1615 CE LYS B1926 1.271 13.624 -20.547 1.00 0.00 C ATOM 1616 NZ LYS B1926 2.024 14.869 -20.867 1.00 0.00 N1+ ATOM 0 H LYS B1926 0.613 9.417 -16.115 1.00 0.00 H new ATOM 0 HA LYS B1926 0.786 10.408 -18.840 1.00 0.00 H new ATOM 0 HB2 LYS B1926 2.403 11.502 -16.584 1.00 0.00 H new ATOM 0 HB3 LYS B1926 3.305 11.052 -18.017 1.00 0.00 H new ATOM 0 HG2 LYS B1926 0.870 12.862 -18.113 1.00 0.00 H new ATOM 0 HG3 LYS B1926 2.498 13.471 -17.892 1.00 0.00 H new ATOM 0 HD2 LYS B1926 3.190 12.802 -20.044 1.00 0.00 H new ATOM 0 HD3 LYS B1926 1.917 11.607 -20.195 1.00 0.00 H new ATOM 0 HE2 LYS B1926 0.887 13.185 -21.468 1.00 0.00 H new ATOM 0 HE3 LYS B1926 0.408 13.870 -19.928 1.00 0.00 H new ATOM 0 HZ1 LYS B1926 1.397 15.537 -21.359 1.00 0.00 H new ATOM 0 HZ2 LYS B1926 2.369 15.302 -19.987 1.00 0.00 H new ATOM 0 HZ3 LYS B1926 2.833 14.638 -21.479 1.00 0.00 H new ATOM 1630 N LYS B1927 2.946 8.833 -19.110 1.00 0.00 N ATOM 1631 CA LYS B1927 3.732 7.634 -19.385 1.00 0.00 C ATOM 1632 C LYS B1927 5.225 7.922 -19.250 1.00 0.00 C ATOM 1633 O LYS B1927 5.701 8.887 -19.885 1.00 0.00 O ATOM 1634 CB LYS B1927 3.414 7.104 -20.789 1.00 0.00 C ATOM 1635 CG LYS B1927 2.711 5.757 -20.783 1.00 0.00 C ATOM 1636 CD LYS B1927 2.449 5.258 -22.195 1.00 0.00 C ATOM 1637 CE LYS B1927 1.509 4.064 -22.199 1.00 0.00 C ATOM 1638 NZ LYS B1927 1.583 3.302 -23.476 1.00 0.00 N1+ ATOM 1639 OXT LYS B1927 5.906 7.179 -18.512 1.00 0.00 O1- ATOM 0 H LYS B1927 3.114 9.605 -19.755 1.00 0.00 H new ATOM 0 HA LYS B1927 3.466 6.872 -18.653 1.00 0.00 H new ATOM 0 HB2 LYS B1927 2.788 7.829 -21.309 1.00 0.00 H new ATOM 0 HB3 LYS B1927 4.341 7.018 -21.355 1.00 0.00 H new ATOM 0 HG2 LYS B1927 3.321 5.030 -20.246 1.00 0.00 H new ATOM 0 HG3 LYS B1927 1.767 5.841 -20.245 1.00 0.00 H new ATOM 0 HD2 LYS B1927 2.020 6.062 -22.792 1.00 0.00 H new ATOM 0 HD3 LYS B1927 3.393 4.981 -22.665 1.00 0.00 H new ATOM 0 HE2 LYS B1927 1.757 3.404 -21.368 1.00 0.00 H new ATOM 0 HE3 LYS B1927 0.487 4.407 -22.040 1.00 0.00 H new ATOM 0 HZ1 LYS B1927 0.927 2.496 -23.438 1.00 0.00 H new ATOM 0 HZ2 LYS B1927 1.321 3.924 -24.267 1.00 0.00 H new ATOM 0 HZ3 LYS B1927 2.553 2.953 -23.616 1.00 0.00 H new TER 1653 LYS B1927