USER MOD reduce.3.24.130724 H: found=0, std=0, add=822, rem=0, adj=20 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 -108:sc= -4.06 (180deg=-3.61) USER MOD Set 1.2: B1919 TYR OH : rot 180:sc= -0.0707 USER MOD Set 2.1: B1904 GLN :FLIP amide:sc= -0.62 F(o=-2.6,f=-1.5) USER MOD Set 2.2: B1908 SER OG : rot 60:sc= -0.863 USER MOD Set 3.1: A 124 MET CE :methyl -168:sc= -4.97! (180deg=-6.05!) USER MOD Set 3.2: B1916 TYR OH : rot 175:sc= -0.144 USER MOD Single : A 76 MET CE :methyl 164:sc= -0.0626 (180deg=-0.411) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 SER OG : rot -120:sc= 0.974 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= -0.267 X(o=-0.27,f=0) USER MOD Single : A 101 SER OG : rot 180:sc= -0.517 USER MOD Single : A 107 HIS :FLIP no HD1:sc= -0.232 F(o=-0.98,f=-0.23) USER MOD Single : A 109 MET CE :methyl -155:sc= -0.685 (180deg=-1.86) USER MOD Single : A 110 THR OG1 : rot -59:sc= 1.18 USER MOD Single : A 111 ASN : amide:sc= -0.103 K(o=-0.1,f=-1.5) USER MOD Single : A 115 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.112) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.0409 USER MOD Single : A 135 HIS :FLIP no HD1:sc= -0.485 F(o=-1.4,f=-0.48) USER MOD Single : A 137 ASN :FLIP amide:sc= 0 F(o=-0.6,f=0) USER MOD Single : A 138 TYR OH : rot -15:sc= -1.19 USER MOD Single : A 145 MET CE :methyl 176:sc= -1.15 (180deg=-1.21) USER MOD Single : A 147 SER OG : rot -59:sc=0.000192 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B1901 LYS NZ :NH3+ -140:sc= -0.0259 (180deg=-0.712) USER MOD Single : B1903 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B1913 GLN : amide:sc= -1.48 K(o=-1.5,f=-6.8!) USER MOD Single : B1922 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B1923 GLN : amide:sc= -0.501 K(o=-0.5,f=-3.8!) 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 4.647 18.677 8.023 1.00 0.00 N ATOM 2 CA MET A 76 5.684 19.665 7.619 1.00 0.00 C ATOM 3 C MET A 76 5.871 19.683 6.105 1.00 0.00 C ATOM 4 O MET A 76 6.086 20.739 5.510 1.00 0.00 O ATOM 5 CB MET A 76 7.000 19.306 8.316 1.00 0.00 C ATOM 6 CG MET A 76 7.602 17.986 7.856 1.00 0.00 C ATOM 7 SD MET A 76 9.240 17.693 8.549 1.00 0.00 S ATOM 8 CE MET A 76 8.858 17.613 10.297 1.00 0.00 C ATOM 0 HA MET A 76 5.363 20.663 7.918 1.00 0.00 H new ATOM 0 HB2 MET A 76 7.722 20.104 8.141 1.00 0.00 H new ATOM 0 HB3 MET A 76 6.829 19.261 9.392 1.00 0.00 H new ATOM 0 HG2 MET A 76 6.939 17.169 8.142 1.00 0.00 H new ATOM 0 HG3 MET A 76 7.665 17.979 6.768 1.00 0.00 H new ATOM 0 HE1 MET A 76 9.694 17.162 10.832 1.00 0.00 H new ATOM 0 HE2 MET A 76 8.684 18.619 10.678 1.00 0.00 H new ATOM 0 HE3 MET A 76 7.963 17.009 10.447 1.00 0.00 H new ATOM 20 N LYS A 77 5.785 18.510 5.486 1.00 0.00 N ATOM 21 CA LYS A 77 5.944 18.393 4.041 1.00 0.00 C ATOM 22 C LYS A 77 4.970 17.367 3.471 1.00 0.00 C ATOM 23 O LYS A 77 4.030 17.718 2.756 1.00 0.00 O ATOM 24 CB LYS A 77 7.380 18.000 3.694 1.00 0.00 C ATOM 25 CG LYS A 77 8.395 19.100 3.972 1.00 0.00 C ATOM 26 CD LYS A 77 9.633 18.560 4.673 1.00 0.00 C ATOM 27 CE LYS A 77 10.875 19.353 4.298 1.00 0.00 C ATOM 28 NZ LYS A 77 12.125 18.610 4.620 1.00 0.00 N1+ ATOM 0 H LYS A 77 5.606 17.626 5.963 1.00 0.00 H new ATOM 0 HA LYS A 77 5.725 19.363 3.595 1.00 0.00 H new ATOM 0 HB2 LYS A 77 7.653 17.112 4.264 1.00 0.00 H new ATOM 0 HB3 LYS A 77 7.429 17.729 2.639 1.00 0.00 H new ATOM 0 HG2 LYS A 77 8.685 19.573 3.034 1.00 0.00 H new ATOM 0 HG3 LYS A 77 7.935 19.872 4.589 1.00 0.00 H new ATOM 0 HD2 LYS A 77 9.487 18.599 5.753 1.00 0.00 H new ATOM 0 HD3 LYS A 77 9.775 17.512 4.408 1.00 0.00 H new ATOM 0 HE2 LYS A 77 10.852 19.581 3.232 1.00 0.00 H new ATOM 0 HE3 LYS A 77 10.872 20.305 4.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 12.949 19.184 4.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 12.159 18.414 5.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 12.141 17.713 4.095 1.00 0.00 H new ATOM 42 N GLU A 78 5.197 16.098 3.795 1.00 0.00 N ATOM 43 CA GLU A 78 4.338 15.020 3.319 1.00 0.00 C ATOM 44 C GLU A 78 3.956 14.089 4.464 1.00 0.00 C ATOM 45 O GLU A 78 4.560 14.128 5.535 1.00 0.00 O ATOM 46 CB GLU A 78 5.039 14.232 2.208 1.00 0.00 C ATOM 47 CG GLU A 78 4.522 14.555 0.816 1.00 0.00 C ATOM 48 CD GLU A 78 4.878 15.962 0.374 1.00 0.00 C ATOM 49 OE1 GLU A 78 6.040 16.184 -0.022 1.00 0.00 O1- ATOM 50 OE2 GLU A 78 3.992 16.842 0.425 1.00 0.00 O ATOM 0 H GLU A 78 5.970 15.791 4.386 1.00 0.00 H new ATOM 0 HA GLU A 78 3.427 15.462 2.916 1.00 0.00 H new ATOM 0 HB2 GLU A 78 6.109 14.438 2.247 1.00 0.00 H new ATOM 0 HB3 GLU A 78 4.913 13.166 2.395 1.00 0.00 H new ATOM 0 HG2 GLU A 78 4.934 13.839 0.104 1.00 0.00 H new ATOM 0 HG3 GLU A 78 3.439 14.435 0.798 1.00 0.00 H new ATOM 57 N GLN A 79 2.949 13.247 4.226 1.00 0.00 N ATOM 58 CA GLN A 79 2.479 12.294 5.236 1.00 0.00 C ATOM 59 C GLN A 79 1.238 11.547 4.761 1.00 0.00 C ATOM 60 O GLN A 79 1.035 10.381 5.094 1.00 0.00 O ATOM 61 CB GLN A 79 2.171 13.007 6.556 1.00 0.00 C ATOM 62 CG GLN A 79 1.283 14.229 6.392 1.00 0.00 C ATOM 63 CD GLN A 79 0.974 14.907 7.712 1.00 0.00 C ATOM 64 OE1 GLN A 79 1.296 16.079 7.911 1.00 0.00 O ATOM 65 NE2 GLN A 79 0.348 14.173 8.624 1.00 0.00 N ATOM 0 H GLN A 79 2.442 13.205 3.342 1.00 0.00 H new ATOM 0 HA GLN A 79 3.280 11.572 5.396 1.00 0.00 H new ATOM 0 HB2 GLN A 79 1.687 12.305 7.235 1.00 0.00 H new ATOM 0 HB3 GLN A 79 3.108 13.309 7.024 1.00 0.00 H new ATOM 0 HG2 GLN A 79 1.771 14.942 5.727 1.00 0.00 H new ATOM 0 HG3 GLN A 79 0.350 13.934 5.912 1.00 0.00 H new ATOM 0 HE21 GLN A 79 0.100 13.206 8.417 1.00 0.00 H new ATOM 0 HE22 GLN A 79 0.115 14.576 9.531 1.00 0.00 H new ATOM 74 N ASP A 80 0.411 12.235 3.987 1.00 0.00 N ATOM 75 CA ASP A 80 -0.829 11.661 3.458 1.00 0.00 C ATOM 76 C ASP A 80 -0.597 10.295 2.807 1.00 0.00 C ATOM 77 O ASP A 80 -1.506 9.468 2.745 1.00 0.00 O ATOM 78 CB ASP A 80 -1.455 12.615 2.440 1.00 0.00 C ATOM 79 CG ASP A 80 -1.607 14.023 2.982 1.00 0.00 C ATOM 80 OD1 ASP A 80 -0.576 14.705 3.161 1.00 0.00 O1- ATOM 81 OD2 ASP A 80 -2.757 14.443 3.229 1.00 0.00 O ATOM 0 H ASP A 80 0.574 13.202 3.706 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.507 11.519 4.299 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -0.838 12.639 1.542 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -2.433 12.235 2.144 1.00 0.00 H new ATOM 86 N SER A 81 0.619 10.067 2.321 1.00 0.00 N ATOM 87 CA SER A 81 0.954 8.802 1.674 1.00 0.00 C ATOM 88 C SER A 81 1.830 7.933 2.573 1.00 0.00 C ATOM 89 O SER A 81 1.479 6.797 2.886 1.00 0.00 O ATOM 90 CB SER A 81 1.668 9.058 0.346 1.00 0.00 C ATOM 91 OG SER A 81 0.740 9.205 -0.714 1.00 0.00 O ATOM 0 H SER A 81 1.386 10.738 2.362 1.00 0.00 H new ATOM 0 HA SER A 81 0.022 8.268 1.486 1.00 0.00 H new ATOM 0 HB2 SER A 81 2.279 9.957 0.426 1.00 0.00 H new ATOM 0 HB3 SER A 81 2.345 8.232 0.129 1.00 0.00 H new ATOM 0 HG SER A 81 0.905 8.517 -1.391 1.00 0.00 H new ATOM 97 N GLU A 82 2.977 8.473 2.972 1.00 0.00 N ATOM 98 CA GLU A 82 3.911 7.743 3.823 1.00 0.00 C ATOM 99 C GLU A 82 3.280 7.370 5.162 1.00 0.00 C ATOM 100 O GLU A 82 3.231 6.197 5.528 1.00 0.00 O ATOM 101 CB GLU A 82 5.172 8.577 4.058 1.00 0.00 C ATOM 102 CG GLU A 82 5.978 8.831 2.794 1.00 0.00 C ATOM 103 CD GLU A 82 6.502 10.251 2.713 1.00 0.00 C ATOM 104 OE1 GLU A 82 5.776 11.177 3.132 1.00 0.00 O ATOM 105 OE2 GLU A 82 7.639 10.438 2.229 1.00 0.00 O1- ATOM 0 H GLU A 82 3.282 9.413 2.720 1.00 0.00 H new ATOM 0 HA GLU A 82 4.175 6.820 3.307 1.00 0.00 H new ATOM 0 HB2 GLU A 82 4.888 9.534 4.496 1.00 0.00 H new ATOM 0 HB3 GLU A 82 5.804 8.068 4.786 1.00 0.00 H new ATOM 0 HG2 GLU A 82 6.816 8.135 2.756 1.00 0.00 H new ATOM 0 HG3 GLU A 82 5.355 8.627 1.923 1.00 0.00 H new ATOM 112 N GLU A 83 2.811 8.372 5.896 1.00 0.00 N ATOM 113 CA GLU A 83 2.200 8.140 7.202 1.00 0.00 C ATOM 114 C GLU A 83 0.955 7.263 7.094 1.00 0.00 C ATOM 115 O GLU A 83 0.680 6.455 7.981 1.00 0.00 O ATOM 116 CB GLU A 83 1.840 9.472 7.863 1.00 0.00 C ATOM 117 CG GLU A 83 1.767 9.395 9.380 1.00 0.00 C ATOM 118 CD GLU A 83 0.886 10.475 9.976 1.00 0.00 C ATOM 119 OE1 GLU A 83 1.298 11.655 9.956 1.00 0.00 O1- ATOM 120 OE2 GLU A 83 -0.215 10.142 10.463 1.00 0.00 O ATOM 0 H GLU A 83 2.841 9.351 5.611 1.00 0.00 H new ATOM 0 HA GLU A 83 2.930 7.615 7.817 1.00 0.00 H new ATOM 0 HB2 GLU A 83 2.580 10.221 7.580 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.879 9.812 7.477 1.00 0.00 H new ATOM 0 HG2 GLU A 83 1.385 8.417 9.673 1.00 0.00 H new ATOM 0 HG3 GLU A 83 2.772 9.482 9.793 1.00 0.00 H new ATOM 127 N GLU A 84 0.201 7.430 6.015 1.00 0.00 N ATOM 128 CA GLU A 84 -1.019 6.655 5.810 1.00 0.00 C ATOM 129 C GLU A 84 -0.703 5.222 5.384 1.00 0.00 C ATOM 130 O GLU A 84 -1.239 4.266 5.944 1.00 0.00 O ATOM 131 CB GLU A 84 -1.901 7.325 4.756 1.00 0.00 C ATOM 132 CG GLU A 84 -2.536 8.621 5.231 1.00 0.00 C ATOM 133 CD GLU A 84 -3.868 8.895 4.561 1.00 0.00 C ATOM 134 OE1 GLU A 84 -3.894 9.005 3.317 1.00 0.00 O1- ATOM 135 OE2 GLU A 84 -4.884 8.999 5.279 1.00 0.00 O ATOM 0 H GLU A 84 0.411 8.093 5.269 1.00 0.00 H new ATOM 0 HA GLU A 84 -1.553 6.619 6.759 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -1.302 7.527 3.868 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -2.688 6.632 4.459 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -2.678 8.578 6.311 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -1.856 9.449 5.032 1.00 0.00 H new ATOM 142 N LEU A 85 0.161 5.084 4.386 1.00 0.00 N ATOM 143 CA LEU A 85 0.543 3.773 3.876 1.00 0.00 C ATOM 144 C LEU A 85 1.196 2.922 4.967 1.00 0.00 C ATOM 145 O LEU A 85 0.924 1.726 5.075 1.00 0.00 O ATOM 146 CB LEU A 85 1.483 3.941 2.674 1.00 0.00 C ATOM 147 CG LEU A 85 2.215 2.678 2.207 1.00 0.00 C ATOM 148 CD1 LEU A 85 1.223 1.585 1.851 1.00 0.00 C ATOM 149 CD2 LEU A 85 3.109 2.991 1.017 1.00 0.00 C ATOM 0 H LEU A 85 0.612 5.867 3.912 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.356 3.249 3.552 1.00 0.00 H new ATOM 0 HB2 LEU A 85 0.903 4.330 1.837 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.228 4.696 2.924 1.00 0.00 H new ATOM 0 HG LEU A 85 2.840 2.321 3.026 1.00 0.00 H new ATOM 0 HD11 LEU A 85 1.763 0.697 1.522 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.621 1.340 2.726 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.572 1.932 1.049 1.00 0.00 H new ATOM 0 HD21 LEU A 85 3.621 2.083 0.698 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.502 3.372 0.196 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.846 3.742 1.303 1.00 0.00 H new ATOM 161 N ILE A 86 2.057 3.537 5.772 1.00 0.00 N ATOM 162 CA ILE A 86 2.740 2.822 6.845 1.00 0.00 C ATOM 163 C ILE A 86 1.751 2.380 7.925 1.00 0.00 C ATOM 164 O ILE A 86 1.886 1.295 8.493 1.00 0.00 O ATOM 165 CB ILE A 86 3.855 3.686 7.479 1.00 0.00 C ATOM 166 CG1 ILE A 86 4.855 4.126 6.410 1.00 0.00 C ATOM 167 CG2 ILE A 86 4.575 2.924 8.588 1.00 0.00 C ATOM 168 CD1 ILE A 86 5.563 5.420 6.740 1.00 0.00 C ATOM 0 H ILE A 86 2.298 4.526 5.702 1.00 0.00 H new ATOM 0 HA ILE A 86 3.198 1.938 6.402 1.00 0.00 H new ATOM 0 HB ILE A 86 3.391 4.569 7.918 1.00 0.00 H new ATOM 0 HG12 ILE A 86 5.598 3.340 6.273 1.00 0.00 H new ATOM 0 HG13 ILE A 86 4.332 4.239 5.460 1.00 0.00 H new ATOM 0 HG21 ILE A 86 5.354 3.555 9.016 1.00 0.00 H new ATOM 0 HG22 ILE A 86 3.861 2.651 9.365 1.00 0.00 H new ATOM 0 HG23 ILE A 86 5.025 2.021 8.176 1.00 0.00 H new ATOM 0 HD11 ILE A 86 6.257 5.670 5.937 1.00 0.00 H new ATOM 0 HD12 ILE A 86 4.829 6.219 6.848 1.00 0.00 H new ATOM 0 HD13 ILE A 86 6.114 5.305 7.673 1.00 0.00 H new ATOM 180 N GLU A 87 0.760 3.220 8.204 1.00 0.00 N ATOM 181 CA GLU A 87 -0.244 2.904 9.215 1.00 0.00 C ATOM 182 C GLU A 87 -1.139 1.759 8.747 1.00 0.00 C ATOM 183 O GLU A 87 -1.411 0.817 9.497 1.00 0.00 O ATOM 184 CB GLU A 87 -1.086 4.144 9.535 1.00 0.00 C ATOM 185 CG GLU A 87 -1.185 4.442 11.022 1.00 0.00 C ATOM 186 CD GLU A 87 -2.531 4.061 11.605 1.00 0.00 C ATOM 187 OE1 GLU A 87 -3.068 3.002 11.219 1.00 0.00 O ATOM 188 OE2 GLU A 87 -3.049 4.823 12.450 1.00 0.00 O1- ATOM 0 H GLU A 87 0.630 4.122 7.746 1.00 0.00 H new ATOM 0 HA GLU A 87 0.270 2.588 10.123 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -0.655 5.007 9.027 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -2.090 4.006 9.133 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -0.399 3.902 11.550 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -1.009 5.505 11.188 1.00 0.00 H new ATOM 195 N ALA A 88 -1.591 1.842 7.500 1.00 0.00 N ATOM 196 CA ALA A 88 -2.451 0.811 6.933 1.00 0.00 C ATOM 197 C ALA A 88 -1.746 -0.537 6.931 1.00 0.00 C ATOM 198 O ALA A 88 -2.271 -1.525 7.444 1.00 0.00 O ATOM 199 CB ALA A 88 -2.875 1.190 5.524 1.00 0.00 C ATOM 0 H ALA A 88 -1.377 2.611 6.865 1.00 0.00 H new ATOM 0 HA ALA A 88 -3.343 0.730 7.554 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.517 0.410 5.115 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -3.421 2.133 5.550 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -1.991 1.300 4.895 1.00 0.00 H new ATOM 205 N PHE A 89 -0.545 -0.571 6.360 1.00 0.00 N ATOM 206 CA PHE A 89 0.231 -1.801 6.309 1.00 0.00 C ATOM 207 C PHE A 89 0.570 -2.266 7.716 1.00 0.00 C ATOM 208 O PHE A 89 0.604 -3.463 7.998 1.00 0.00 O ATOM 209 CB PHE A 89 1.509 -1.615 5.486 1.00 0.00 C ATOM 210 CG PHE A 89 1.372 -1.999 4.034 1.00 0.00 C ATOM 211 CD1 PHE A 89 0.622 -3.105 3.646 1.00 0.00 C ATOM 212 CD2 PHE A 89 2.003 -1.252 3.054 1.00 0.00 C ATOM 213 CE1 PHE A 89 0.509 -3.450 2.313 1.00 0.00 C ATOM 214 CE2 PHE A 89 1.892 -1.594 1.722 1.00 0.00 C ATOM 215 CZ PHE A 89 1.145 -2.694 1.350 1.00 0.00 C ATOM 0 H PHE A 89 -0.092 0.235 5.929 1.00 0.00 H new ATOM 0 HA PHE A 89 -0.375 -2.564 5.820 1.00 0.00 H new ATOM 0 HB2 PHE A 89 1.818 -0.571 5.546 1.00 0.00 H new ATOM 0 HB3 PHE A 89 2.305 -2.209 5.934 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.122 -3.701 4.396 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.590 -0.390 3.336 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -0.077 -4.311 2.025 1.00 0.00 H new ATOM 0 HE2 PHE A 89 2.390 -1.001 0.969 1.00 0.00 H new ATOM 0 HZ PHE A 89 1.059 -2.962 0.307 1.00 0.00 H new ATOM 225 N LYS A 90 0.805 -1.302 8.598 1.00 0.00 N ATOM 226 CA LYS A 90 1.128 -1.588 9.997 1.00 0.00 C ATOM 227 C LYS A 90 0.114 -2.565 10.593 1.00 0.00 C ATOM 228 O LYS A 90 0.465 -3.456 11.367 1.00 0.00 O ATOM 229 CB LYS A 90 1.151 -0.289 10.810 1.00 0.00 C ATOM 230 CG LYS A 90 2.552 0.176 11.165 1.00 0.00 C ATOM 231 CD LYS A 90 2.919 -0.190 12.595 1.00 0.00 C ATOM 232 CE LYS A 90 3.654 -1.518 12.659 1.00 0.00 C ATOM 233 NZ LYS A 90 4.459 -1.648 13.906 1.00 0.00 N1+ ATOM 0 H LYS A 90 0.778 -0.308 8.370 1.00 0.00 H new ATOM 0 HA LYS A 90 2.116 -2.047 10.037 1.00 0.00 H new ATOM 0 HB2 LYS A 90 0.649 0.495 10.243 1.00 0.00 H new ATOM 0 HB3 LYS A 90 0.581 -0.433 11.728 1.00 0.00 H new ATOM 0 HG2 LYS A 90 3.270 -0.273 10.478 1.00 0.00 H new ATOM 0 HG3 LYS A 90 2.621 1.256 11.036 1.00 0.00 H new ATOM 0 HD2 LYS A 90 3.544 0.594 13.023 1.00 0.00 H new ATOM 0 HD3 LYS A 90 2.015 -0.244 13.201 1.00 0.00 H new ATOM 0 HE2 LYS A 90 2.934 -2.334 12.605 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.309 -1.613 11.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 4.945 -2.568 13.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 5.163 -0.884 13.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.831 -1.583 14.733 1.00 0.00 H new ATOM 247 N VAL A 91 -1.143 -2.386 10.206 1.00 0.00 N ATOM 248 CA VAL A 91 -2.227 -3.244 10.673 1.00 0.00 C ATOM 249 C VAL A 91 -2.142 -4.646 10.060 1.00 0.00 C ATOM 250 O VAL A 91 -2.701 -5.600 10.601 1.00 0.00 O ATOM 251 CB VAL A 91 -3.602 -2.638 10.329 1.00 0.00 C ATOM 252 CG1 VAL A 91 -4.722 -3.437 10.977 1.00 0.00 C ATOM 253 CG2 VAL A 91 -3.663 -1.178 10.750 1.00 0.00 C ATOM 0 H VAL A 91 -1.439 -1.649 9.566 1.00 0.00 H new ATOM 0 HA VAL A 91 -2.120 -3.320 11.755 1.00 0.00 H new ATOM 0 HB VAL A 91 -3.737 -2.686 9.248 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -5.683 -2.991 10.720 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -4.691 -4.465 10.616 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -4.596 -3.429 12.060 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -4.641 -0.768 10.499 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -3.503 -1.102 11.826 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -2.889 -0.616 10.228 1.00 0.00 H new ATOM 263 N PHE A 92 -1.456 -4.764 8.923 1.00 0.00 N ATOM 264 CA PHE A 92 -1.321 -6.047 8.237 1.00 0.00 C ATOM 265 C PHE A 92 0.113 -6.568 8.300 1.00 0.00 C ATOM 266 O PHE A 92 0.562 -7.270 7.393 1.00 0.00 O ATOM 267 CB PHE A 92 -1.752 -5.911 6.777 1.00 0.00 C ATOM 268 CG PHE A 92 -3.219 -5.639 6.603 1.00 0.00 C ATOM 269 CD1 PHE A 92 -4.162 -6.575 6.996 1.00 0.00 C ATOM 270 CD2 PHE A 92 -3.652 -4.449 6.042 1.00 0.00 C ATOM 271 CE1 PHE A 92 -5.512 -6.328 6.834 1.00 0.00 C ATOM 272 CE2 PHE A 92 -5.001 -4.196 5.878 1.00 0.00 C ATOM 273 CZ PHE A 92 -5.932 -5.137 6.274 1.00 0.00 C ATOM 0 H PHE A 92 -0.986 -3.987 8.459 1.00 0.00 H new ATOM 0 HA PHE A 92 -1.967 -6.763 8.745 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -1.184 -5.104 6.314 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -1.496 -6.827 6.245 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -3.838 -7.508 7.434 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -2.928 -3.711 5.729 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -6.238 -7.065 7.145 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -5.327 -3.264 5.441 1.00 0.00 H new ATOM 0 HZ PHE A 92 -6.986 -4.942 6.146 1.00 0.00 H new ATOM 283 N ASP A 93 0.831 -6.223 9.365 1.00 0.00 N ATOM 284 CA ASP A 93 2.217 -6.662 9.529 1.00 0.00 C ATOM 285 C ASP A 93 2.347 -8.180 9.390 1.00 0.00 C ATOM 286 O ASP A 93 2.702 -8.680 8.325 1.00 0.00 O ATOM 287 CB ASP A 93 2.770 -6.198 10.882 1.00 0.00 C ATOM 288 CG ASP A 93 3.188 -4.740 10.872 1.00 0.00 C ATOM 289 OD1 ASP A 93 2.959 -4.063 9.851 1.00 0.00 O1- ATOM 290 OD2 ASP A 93 3.746 -4.277 11.890 1.00 0.00 O ATOM 0 H ASP A 93 0.479 -5.643 10.126 1.00 0.00 H new ATOM 0 HA ASP A 93 2.805 -6.205 8.733 1.00 0.00 H new ATOM 0 HB2 ASP A 93 2.013 -6.350 11.651 1.00 0.00 H new ATOM 0 HB3 ASP A 93 3.627 -6.816 11.152 1.00 0.00 H new ATOM 295 N ARG A 94 2.060 -8.894 10.475 1.00 0.00 N ATOM 296 CA ARG A 94 2.129 -10.359 10.534 1.00 0.00 C ATOM 297 C ARG A 94 3.561 -10.855 10.728 1.00 0.00 C ATOM 298 O ARG A 94 3.815 -11.703 11.583 1.00 0.00 O ATOM 299 CB ARG A 94 1.507 -11.006 9.292 1.00 0.00 C ATOM 300 CG ARG A 94 0.082 -10.553 9.019 1.00 0.00 C ATOM 301 CD ARG A 94 -0.896 -11.181 10.000 1.00 0.00 C ATOM 302 NE ARG A 94 -2.277 -10.787 9.729 1.00 0.00 N ATOM 303 CZ ARG A 94 -3.048 -11.353 8.800 1.00 0.00 C ATOM 304 NH1 ARG A 94 -2.579 -12.336 8.038 1.00 0.00 N1+ ATOM 305 NH2 ARG A 94 -4.293 -10.932 8.631 1.00 0.00 N ATOM 0 H ARG A 94 1.768 -8.468 11.355 1.00 0.00 H new ATOM 0 HA ARG A 94 1.547 -10.661 11.404 1.00 0.00 H new ATOM 0 HB2 ARG A 94 2.125 -10.775 8.424 1.00 0.00 H new ATOM 0 HB3 ARG A 94 1.518 -12.089 9.413 1.00 0.00 H new ATOM 0 HG2 ARG A 94 0.024 -9.467 9.089 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -0.198 -10.822 8.001 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -0.813 -12.267 9.949 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -0.629 -10.888 11.015 1.00 0.00 H new ATOM 0 HE ARG A 94 -2.676 -10.031 10.286 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -1.621 -12.664 8.161 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -3.177 -12.762 7.330 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -4.659 -10.177 9.211 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -4.885 -11.363 7.921 1.00 0.00 H new ATOM 319 N ASP A 95 4.495 -10.332 9.939 1.00 0.00 N ATOM 320 CA ASP A 95 5.889 -10.739 10.045 1.00 0.00 C ATOM 321 C ASP A 95 6.460 -10.389 11.416 1.00 0.00 C ATOM 322 O ASP A 95 7.353 -11.070 11.919 1.00 0.00 O ATOM 323 CB ASP A 95 6.722 -10.074 8.950 1.00 0.00 C ATOM 324 CG ASP A 95 8.064 -10.749 8.754 1.00 0.00 C ATOM 325 OD1 ASP A 95 8.983 -10.489 9.559 1.00 0.00 O ATOM 326 OD2 ASP A 95 8.198 -11.539 7.796 1.00 0.00 O1- ATOM 0 H ASP A 95 4.311 -9.629 9.223 1.00 0.00 H new ATOM 0 HA ASP A 95 5.933 -11.821 9.920 1.00 0.00 H new ATOM 0 HB2 ASP A 95 6.167 -10.095 8.012 1.00 0.00 H new ATOM 0 HB3 ASP A 95 6.879 -9.026 9.203 1.00 0.00 H new ATOM 331 N GLY A 96 5.941 -9.321 12.015 1.00 0.00 N ATOM 332 CA GLY A 96 6.413 -8.899 13.321 1.00 0.00 C ATOM 333 C GLY A 96 7.195 -7.602 13.259 1.00 0.00 C ATOM 334 O GLY A 96 6.874 -6.641 13.959 1.00 0.00 O ATOM 0 H GLY A 96 5.202 -8.740 11.619 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.561 -8.776 13.990 1.00 0.00 H new ATOM 0 HA3 GLY A 96 7.043 -9.680 13.747 1.00 0.00 H new ATOM 338 N ASN A 97 8.222 -7.573 12.418 1.00 0.00 N ATOM 339 CA ASN A 97 9.051 -6.383 12.264 1.00 0.00 C ATOM 340 C ASN A 97 8.342 -5.336 11.412 1.00 0.00 C ATOM 341 O ASN A 97 8.385 -4.143 11.713 1.00 0.00 O ATOM 342 CB ASN A 97 10.395 -6.750 11.631 1.00 0.00 C ATOM 343 CG ASN A 97 11.405 -5.624 11.729 1.00 0.00 C ATOM 344 OD1 ASN A 97 11.987 -5.208 10.727 1.00 0.00 O ATOM 345 ND2 ASN A 97 11.621 -5.125 12.941 1.00 0.00 N ATOM 0 H ASN A 97 8.501 -8.360 11.832 1.00 0.00 H new ATOM 0 HA ASN A 97 9.228 -5.962 13.254 1.00 0.00 H new ATOM 0 HB2 ASN A 97 10.795 -7.637 12.122 1.00 0.00 H new ATOM 0 HB3 ASN A 97 10.242 -7.007 10.583 1.00 0.00 H new ATOM 0 HD21 ASN A 97 12.291 -4.367 13.068 1.00 0.00 H new ATOM 0 HD22 ASN A 97 11.116 -5.500 13.744 1.00 0.00 H new ATOM 352 N GLY A 98 7.685 -5.790 10.349 1.00 0.00 N ATOM 353 CA GLY A 98 6.973 -4.880 9.472 1.00 0.00 C ATOM 354 C GLY A 98 7.014 -5.315 8.020 1.00 0.00 C ATOM 355 O GLY A 98 7.265 -4.503 7.129 1.00 0.00 O ATOM 0 H GLY A 98 7.633 -6.772 10.080 1.00 0.00 H new ATOM 0 HA2 GLY A 98 5.935 -4.807 9.796 1.00 0.00 H new ATOM 0 HA3 GLY A 98 7.405 -3.883 9.561 1.00 0.00 H new ATOM 359 N LEU A 99 6.762 -6.599 7.780 1.00 0.00 N ATOM 360 CA LEU A 99 6.768 -7.139 6.425 1.00 0.00 C ATOM 361 C LEU A 99 5.426 -7.778 6.089 1.00 0.00 C ATOM 362 O LEU A 99 4.757 -8.332 6.961 1.00 0.00 O ATOM 363 CB LEU A 99 7.894 -8.161 6.260 1.00 0.00 C ATOM 364 CG LEU A 99 9.302 -7.613 6.503 1.00 0.00 C ATOM 365 CD1 LEU A 99 9.678 -7.738 7.970 1.00 0.00 C ATOM 366 CD2 LEU A 99 10.313 -8.336 5.627 1.00 0.00 C ATOM 0 H LEU A 99 6.551 -7.284 8.506 1.00 0.00 H new ATOM 0 HA LEU A 99 6.939 -6.314 5.734 1.00 0.00 H new ATOM 0 HB2 LEU A 99 7.718 -8.988 6.948 1.00 0.00 H new ATOM 0 HB3 LEU A 99 7.848 -8.570 5.251 1.00 0.00 H new ATOM 0 HG LEU A 99 9.311 -6.556 6.237 1.00 0.00 H new ATOM 0 HD11 LEU A 99 10.682 -7.343 8.123 1.00 0.00 H new ATOM 0 HD12 LEU A 99 8.970 -7.173 8.576 1.00 0.00 H new ATOM 0 HD13 LEU A 99 9.652 -8.787 8.264 1.00 0.00 H new ATOM 0 HD21 LEU A 99 11.309 -7.934 5.813 1.00 0.00 H new ATOM 0 HD22 LEU A 99 10.302 -9.400 5.861 1.00 0.00 H new ATOM 0 HD23 LEU A 99 10.054 -8.193 4.578 1.00 0.00 H new ATOM 378 N ILE A 100 5.034 -7.692 4.821 1.00 0.00 N ATOM 379 CA ILE A 100 3.765 -8.257 4.376 1.00 0.00 C ATOM 380 C ILE A 100 3.968 -9.237 3.221 1.00 0.00 C ATOM 381 O ILE A 100 4.901 -9.096 2.431 1.00 0.00 O ATOM 382 CB ILE A 100 2.780 -7.146 3.949 1.00 0.00 C ATOM 383 CG1 ILE A 100 1.405 -7.743 3.649 1.00 0.00 C ATOM 384 CG2 ILE A 100 3.310 -6.379 2.742 1.00 0.00 C ATOM 385 CD1 ILE A 100 0.270 -6.758 3.825 1.00 0.00 C ATOM 0 H ILE A 100 5.576 -7.238 4.086 1.00 0.00 H new ATOM 0 HA ILE A 100 3.340 -8.798 5.222 1.00 0.00 H new ATOM 0 HB ILE A 100 2.681 -6.442 4.775 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.395 -8.118 2.625 1.00 0.00 H new ATOM 0 HG13 ILE A 100 1.238 -8.599 4.303 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.597 -5.603 2.462 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.266 -5.920 2.994 1.00 0.00 H new ATOM 0 HG23 ILE A 100 3.446 -7.065 1.906 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -0.676 -7.248 3.596 1.00 0.00 H new ATOM 0 HD12 ILE A 100 0.254 -6.402 4.855 1.00 0.00 H new ATOM 0 HD13 ILE A 100 0.414 -5.913 3.151 1.00 0.00 H new ATOM 397 N SER A 101 3.091 -10.231 3.133 1.00 0.00 N ATOM 398 CA SER A 101 3.175 -11.236 2.077 1.00 0.00 C ATOM 399 C SER A 101 2.410 -10.790 0.837 1.00 0.00 C ATOM 400 O SER A 101 1.279 -10.313 0.931 1.00 0.00 O ATOM 401 CB SER A 101 2.630 -12.576 2.575 1.00 0.00 C ATOM 402 OG SER A 101 2.899 -13.613 1.647 1.00 0.00 O ATOM 0 H SER A 101 2.313 -10.363 3.780 1.00 0.00 H new ATOM 0 HA SER A 101 4.224 -11.356 1.808 1.00 0.00 H new ATOM 0 HB2 SER A 101 3.079 -12.820 3.538 1.00 0.00 H new ATOM 0 HB3 SER A 101 1.555 -12.498 2.736 1.00 0.00 H new ATOM 0 HG SER A 101 2.542 -14.459 1.989 1.00 0.00 H new ATOM 408 N ALA A 102 3.035 -10.948 -0.325 1.00 0.00 N ATOM 409 CA ALA A 102 2.416 -10.561 -1.588 1.00 0.00 C ATOM 410 C ALA A 102 1.239 -11.469 -1.929 1.00 0.00 C ATOM 411 O ALA A 102 0.210 -11.008 -2.426 1.00 0.00 O ATOM 412 CB ALA A 102 3.445 -10.590 -2.707 1.00 0.00 C ATOM 0 H ALA A 102 3.971 -11.342 -0.418 1.00 0.00 H new ATOM 0 HA ALA A 102 2.036 -9.545 -1.480 1.00 0.00 H new ATOM 0 HB1 ALA A 102 2.971 -10.299 -3.645 1.00 0.00 H new ATOM 0 HB2 ALA A 102 4.252 -9.894 -2.477 1.00 0.00 H new ATOM 0 HB3 ALA A 102 3.851 -11.597 -2.802 1.00 0.00 H new ATOM 418 N ALA A 103 1.398 -12.762 -1.666 1.00 0.00 N ATOM 419 CA ALA A 103 0.350 -13.737 -1.950 1.00 0.00 C ATOM 420 C ALA A 103 -0.942 -13.394 -1.217 1.00 0.00 C ATOM 421 O ALA A 103 -2.016 -13.350 -1.817 1.00 0.00 O ATOM 422 CB ALA A 103 0.816 -15.135 -1.574 1.00 0.00 C ATOM 0 H ALA A 103 2.243 -13.160 -1.256 1.00 0.00 H new ATOM 0 HA ALA A 103 0.145 -13.707 -3.020 1.00 0.00 H new ATOM 0 HB1 ALA A 103 0.025 -15.853 -1.791 1.00 0.00 H new ATOM 0 HB2 ALA A 103 1.705 -15.390 -2.151 1.00 0.00 H new ATOM 0 HB3 ALA A 103 1.052 -15.166 -0.510 1.00 0.00 H new ATOM 428 N GLU A 104 -0.834 -13.157 0.087 1.00 0.00 N ATOM 429 CA GLU A 104 -1.996 -12.823 0.902 1.00 0.00 C ATOM 430 C GLU A 104 -2.425 -11.378 0.677 1.00 0.00 C ATOM 431 O GLU A 104 -3.618 -11.072 0.647 1.00 0.00 O ATOM 432 CB GLU A 104 -1.685 -13.051 2.382 1.00 0.00 C ATOM 433 CG GLU A 104 -1.356 -14.496 2.718 1.00 0.00 C ATOM 434 CD GLU A 104 -1.170 -14.721 4.206 1.00 0.00 C ATOM 435 OE1 GLU A 104 -1.996 -14.209 4.991 1.00 0.00 O1- ATOM 436 OE2 GLU A 104 -0.199 -15.409 4.585 1.00 0.00 O ATOM 0 H GLU A 104 0.046 -13.190 0.601 1.00 0.00 H new ATOM 0 HA GLU A 104 -2.817 -13.474 0.604 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -0.845 -12.419 2.670 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -2.541 -12.734 2.978 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -2.156 -15.141 2.354 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -0.447 -14.789 2.194 1.00 0.00 H new ATOM 443 N LEU A 105 -1.447 -10.493 0.520 1.00 0.00 N ATOM 444 CA LEU A 105 -1.724 -9.077 0.297 1.00 0.00 C ATOM 445 C LEU A 105 -2.557 -8.873 -0.964 1.00 0.00 C ATOM 446 O LEU A 105 -3.322 -7.914 -1.064 1.00 0.00 O ATOM 447 CB LEU A 105 -0.412 -8.293 0.189 1.00 0.00 C ATOM 448 CG LEU A 105 -0.564 -6.806 -0.138 1.00 0.00 C ATOM 449 CD1 LEU A 105 -1.508 -6.135 0.847 1.00 0.00 C ATOM 450 CD2 LEU A 105 0.793 -6.118 -0.130 1.00 0.00 C ATOM 0 H LEU A 105 -0.455 -10.730 0.543 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.295 -8.706 1.148 1.00 0.00 H new ATOM 0 HB2 LEU A 105 0.127 -8.388 1.132 1.00 0.00 H new ATOM 0 HB3 LEU A 105 0.206 -8.756 -0.580 1.00 0.00 H new ATOM 0 HG LEU A 105 -0.991 -6.716 -1.137 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -1.603 -5.078 0.598 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.488 -6.610 0.793 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -1.111 -6.235 1.857 1.00 0.00 H new ATOM 0 HD21 LEU A 105 0.666 -5.061 -0.365 1.00 0.00 H new ATOM 0 HD22 LEU A 105 1.246 -6.219 0.856 1.00 0.00 H new ATOM 0 HD23 LEU A 105 1.440 -6.580 -0.876 1.00 0.00 H new ATOM 462 N ARG A 106 -2.399 -9.774 -1.928 1.00 0.00 N ATOM 463 CA ARG A 106 -3.135 -9.681 -3.182 1.00 0.00 C ATOM 464 C ARG A 106 -4.625 -9.924 -2.968 1.00 0.00 C ATOM 465 O ARG A 106 -5.457 -9.131 -3.399 1.00 0.00 O ATOM 466 CB ARG A 106 -2.585 -10.683 -4.198 1.00 0.00 C ATOM 467 CG ARG A 106 -3.273 -10.614 -5.552 1.00 0.00 C ATOM 468 CD ARG A 106 -2.314 -10.951 -6.682 1.00 0.00 C ATOM 469 NE ARG A 106 -3.010 -11.498 -7.847 1.00 0.00 N ATOM 470 CZ ARG A 106 -3.604 -12.691 -7.869 1.00 0.00 C ATOM 471 NH1 ARG A 106 -3.595 -13.473 -6.795 1.00 0.00 N1+ ATOM 472 NH2 ARG A 106 -4.213 -13.105 -8.972 1.00 0.00 N ATOM 0 H ARG A 106 -1.770 -10.574 -1.865 1.00 0.00 H new ATOM 0 HA ARG A 106 -3.006 -8.670 -3.569 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -1.518 -10.504 -4.332 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -2.691 -11.691 -3.796 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -4.115 -11.306 -5.569 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -3.679 -9.614 -5.704 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -1.768 -10.054 -6.974 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -1.577 -11.672 -6.329 1.00 0.00 H new ATOM 0 HE ARG A 106 -3.043 -10.931 -8.695 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -3.130 -13.162 -5.942 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -4.053 -14.384 -6.824 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -4.226 -12.511 -9.801 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -4.668 -14.018 -8.991 1.00 0.00 H new ATOM 486 N HIS A 107 -4.953 -11.026 -2.306 1.00 0.00 N ATOM 487 CA HIS A 107 -6.346 -11.374 -2.045 1.00 0.00 C ATOM 488 C HIS A 107 -7.018 -10.346 -1.139 1.00 0.00 C ATOM 489 O HIS A 107 -8.140 -9.915 -1.403 1.00 0.00 O ATOM 490 CB HIS A 107 -6.431 -12.763 -1.406 1.00 0.00 C ATOM 491 CG HIS A 107 -7.835 -13.228 -1.171 1.00 0.00 C ATOM 492 ND1 HIS A 107 -8.822 -12.713 -0.401 1.00 0.00 N flip ATOM 493 CD2 HIS A 107 -8.364 -14.354 -1.765 1.00 0.00 C flip ATOM 494 CE1 HIS A 107 -9.917 -13.528 -0.542 1.00 0.00 C flip ATOM 495 NE2 HIS A 107 -9.616 -14.510 -1.371 1.00 0.00 N flip ATOM 0 H HIS A 107 -4.275 -11.694 -1.940 1.00 0.00 H new ATOM 0 HA HIS A 107 -6.872 -11.380 -3.000 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -5.922 -13.481 -2.048 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -5.897 -12.750 -0.456 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -7.838 -15.007 -2.446 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -10.870 -13.389 -0.054 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -10.243 -15.261 -1.659 1.00 0.00 H new ATOM 504 N VAL A 108 -6.331 -9.964 -0.071 1.00 0.00 N ATOM 505 CA VAL A 108 -6.863 -8.995 0.882 1.00 0.00 C ATOM 506 C VAL A 108 -7.257 -7.682 0.207 1.00 0.00 C ATOM 507 O VAL A 108 -8.417 -7.274 0.251 1.00 0.00 O ATOM 508 CB VAL A 108 -5.843 -8.695 2.000 1.00 0.00 C ATOM 509 CG1 VAL A 108 -6.474 -7.833 3.086 1.00 0.00 C ATOM 510 CG2 VAL A 108 -5.289 -9.990 2.587 1.00 0.00 C ATOM 0 H VAL A 108 -5.400 -10.311 0.159 1.00 0.00 H new ATOM 0 HA VAL A 108 -7.756 -9.448 1.312 1.00 0.00 H new ATOM 0 HB VAL A 108 -5.013 -8.139 1.565 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -5.738 -7.633 3.865 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.810 -6.891 2.653 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -7.326 -8.358 3.518 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -4.572 -9.755 3.373 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -6.106 -10.579 3.005 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -4.793 -10.562 1.803 1.00 0.00 H new ATOM 520 N MET A 109 -6.280 -7.018 -0.398 1.00 0.00 N ATOM 521 CA MET A 109 -6.516 -5.739 -1.058 1.00 0.00 C ATOM 522 C MET A 109 -7.515 -5.858 -2.210 1.00 0.00 C ATOM 523 O MET A 109 -8.447 -5.062 -2.312 1.00 0.00 O ATOM 524 CB MET A 109 -5.196 -5.161 -1.566 1.00 0.00 C ATOM 525 CG MET A 109 -4.111 -5.095 -0.502 1.00 0.00 C ATOM 526 SD MET A 109 -4.022 -3.483 0.300 1.00 0.00 S ATOM 527 CE MET A 109 -4.022 -3.957 2.027 1.00 0.00 C ATOM 0 H MET A 109 -5.315 -7.344 -0.446 1.00 0.00 H new ATOM 0 HA MET A 109 -6.951 -5.066 -0.319 1.00 0.00 H new ATOM 0 HB2 MET A 109 -4.840 -5.767 -2.399 1.00 0.00 H new ATOM 0 HB3 MET A 109 -5.374 -4.158 -1.955 1.00 0.00 H new ATOM 0 HG2 MET A 109 -4.298 -5.861 0.250 1.00 0.00 H new ATOM 0 HG3 MET A 109 -3.147 -5.324 -0.957 1.00 0.00 H new ATOM 0 HE1 MET A 109 -4.409 -3.135 2.630 1.00 0.00 H new ATOM 0 HE2 MET A 109 -4.653 -4.835 2.163 1.00 0.00 H new ATOM 0 HE3 MET A 109 -3.004 -4.189 2.341 1.00 0.00 H new ATOM 537 N THR A 110 -7.316 -6.843 -3.083 1.00 0.00 N ATOM 538 CA THR A 110 -8.207 -7.033 -4.226 1.00 0.00 C ATOM 539 C THR A 110 -9.619 -7.388 -3.776 1.00 0.00 C ATOM 540 O THR A 110 -10.598 -7.001 -4.414 1.00 0.00 O ATOM 541 CB THR A 110 -7.670 -8.118 -5.160 1.00 0.00 C ATOM 542 OG1 THR A 110 -7.648 -9.377 -4.511 1.00 0.00 O ATOM 543 CG2 THR A 110 -6.273 -7.832 -5.668 1.00 0.00 C ATOM 0 H THR A 110 -6.553 -7.517 -3.023 1.00 0.00 H new ATOM 0 HA THR A 110 -8.247 -6.088 -4.768 1.00 0.00 H new ATOM 0 HB THR A 110 -8.351 -8.129 -6.011 1.00 0.00 H new ATOM 0 HG1 THR A 110 -7.083 -9.323 -3.712 1.00 0.00 H new ATOM 0 HG21 THR A 110 -5.952 -8.640 -6.325 1.00 0.00 H new ATOM 0 HG22 THR A 110 -6.272 -6.893 -6.221 1.00 0.00 H new ATOM 0 HG23 THR A 110 -5.587 -7.757 -4.824 1.00 0.00 H new ATOM 551 N ASN A 111 -9.721 -8.127 -2.678 1.00 0.00 N ATOM 552 CA ASN A 111 -11.019 -8.530 -2.152 1.00 0.00 C ATOM 553 C ASN A 111 -11.721 -7.374 -1.438 1.00 0.00 C ATOM 554 O ASN A 111 -12.927 -7.434 -1.198 1.00 0.00 O ATOM 555 CB ASN A 111 -10.860 -9.711 -1.193 1.00 0.00 C ATOM 556 CG ASN A 111 -12.194 -10.290 -0.765 1.00 0.00 C ATOM 557 OD1 ASN A 111 -13.205 -10.120 -1.446 1.00 0.00 O ATOM 558 ND2 ASN A 111 -12.203 -10.980 0.370 1.00 0.00 N ATOM 0 H ASN A 111 -8.923 -8.458 -2.136 1.00 0.00 H new ATOM 0 HA ASN A 111 -11.637 -8.830 -2.998 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -10.267 -10.489 -1.674 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -10.307 -9.388 -0.311 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -13.072 -11.394 0.708 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -11.341 -11.096 0.903 1.00 0.00 H new ATOM 565 N LEU A 112 -10.971 -6.328 -1.089 1.00 0.00 N ATOM 566 CA LEU A 112 -11.549 -5.183 -0.393 1.00 0.00 C ATOM 567 C LEU A 112 -11.474 -3.906 -1.232 1.00 0.00 C ATOM 568 O LEU A 112 -11.035 -3.923 -2.395 1.00 0.00 O ATOM 569 CB LEU A 112 -10.848 -4.974 0.949 1.00 0.00 C ATOM 570 CG LEU A 112 -9.361 -4.645 0.860 1.00 0.00 C ATOM 571 CD1 LEU A 112 -9.156 -3.145 0.728 1.00 0.00 C ATOM 572 CD2 LEU A 112 -8.627 -5.186 2.077 1.00 0.00 C ATOM 0 H LEU A 112 -9.971 -6.252 -1.276 1.00 0.00 H new ATOM 0 HA LEU A 112 -12.603 -5.401 -0.221 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -11.351 -4.167 1.482 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -10.969 -5.876 1.549 1.00 0.00 H new ATOM 0 HG LEU A 112 -8.950 -5.124 -0.029 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -8.090 -2.928 0.666 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.652 -2.788 -0.174 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.579 -2.642 1.598 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.567 -4.944 2.000 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.038 -4.734 2.980 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.749 -6.268 2.125 1.00 0.00 H new ATOM 584 N GLY A 113 -11.924 -2.803 -0.629 1.00 0.00 N ATOM 585 CA GLY A 113 -11.931 -1.523 -1.309 1.00 0.00 C ATOM 586 C GLY A 113 -12.881 -1.531 -2.482 1.00 0.00 C ATOM 587 O GLY A 113 -14.011 -2.008 -2.372 1.00 0.00 O ATOM 0 H GLY A 113 -12.285 -2.779 0.325 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -12.220 -0.739 -0.609 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -10.925 -1.287 -1.655 1.00 0.00 H new ATOM 591 N GLU A 114 -12.418 -1.033 -3.618 1.00 0.00 N ATOM 592 CA GLU A 114 -13.229 -1.022 -4.824 1.00 0.00 C ATOM 593 C GLU A 114 -12.823 -2.194 -5.706 1.00 0.00 C ATOM 594 O GLU A 114 -12.690 -2.060 -6.922 1.00 0.00 O ATOM 595 CB GLU A 114 -13.056 0.299 -5.578 1.00 0.00 C ATOM 596 CG GLU A 114 -11.611 0.754 -5.687 1.00 0.00 C ATOM 597 CD GLU A 114 -11.365 1.627 -6.901 1.00 0.00 C ATOM 598 OE1 GLU A 114 -12.112 2.611 -7.086 1.00 0.00 O1- ATOM 599 OE2 GLU A 114 -10.426 1.328 -7.668 1.00 0.00 O ATOM 0 H GLU A 114 -11.487 -0.632 -3.729 1.00 0.00 H new ATOM 0 HA GLU A 114 -14.280 -1.118 -4.552 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -13.471 0.192 -6.580 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -13.635 1.073 -5.074 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -11.339 1.305 -4.787 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -10.961 -0.120 -5.735 1.00 0.00 H new ATOM 606 N LYS A 115 -12.600 -3.345 -5.068 1.00 0.00 N ATOM 607 CA LYS A 115 -12.179 -4.544 -5.773 1.00 0.00 C ATOM 608 C LYS A 115 -10.830 -4.299 -6.439 1.00 0.00 C ATOM 609 O LYS A 115 -10.720 -4.308 -7.666 1.00 0.00 O ATOM 610 CB LYS A 115 -13.227 -4.953 -6.811 1.00 0.00 C ATOM 611 CG LYS A 115 -14.540 -5.417 -6.201 1.00 0.00 C ATOM 612 CD LYS A 115 -14.328 -6.566 -5.230 1.00 0.00 C ATOM 613 CE LYS A 115 -15.578 -7.421 -5.097 1.00 0.00 C ATOM 614 NZ LYS A 115 -16.771 -6.609 -4.728 1.00 0.00 N1+ ATOM 0 H LYS A 115 -12.706 -3.466 -4.061 1.00 0.00 H new ATOM 0 HA LYS A 115 -12.078 -5.360 -5.058 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -13.421 -4.108 -7.471 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -12.821 -5.753 -7.429 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -15.016 -4.584 -5.683 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -15.220 -5.730 -6.993 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -13.498 -7.184 -5.572 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -14.050 -6.171 -4.253 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -15.767 -7.936 -6.039 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -15.414 -8.189 -4.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -17.564 -7.242 -4.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -16.548 -6.020 -3.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -17.036 -5.998 -5.527 1.00 0.00 H new ATOM 628 N LEU A 116 -9.801 -4.054 -5.621 1.00 0.00 N ATOM 629 CA LEU A 116 -8.454 -3.780 -6.147 1.00 0.00 C ATOM 630 C LEU A 116 -8.049 -4.779 -7.234 1.00 0.00 C ATOM 631 O LEU A 116 -7.931 -5.978 -6.982 1.00 0.00 O ATOM 632 CB LEU A 116 -7.410 -3.781 -5.023 1.00 0.00 C ATOM 633 CG LEU A 116 -6.415 -2.618 -5.075 1.00 0.00 C ATOM 634 CD1 LEU A 116 -5.378 -2.746 -3.972 1.00 0.00 C ATOM 635 CD2 LEU A 116 -5.740 -2.558 -6.437 1.00 0.00 C ATOM 0 H LEU A 116 -9.870 -4.039 -4.603 1.00 0.00 H new ATOM 0 HA LEU A 116 -8.489 -2.788 -6.596 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -7.928 -3.756 -4.064 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -6.855 -4.718 -5.061 1.00 0.00 H new ATOM 0 HG LEU A 116 -6.965 -1.690 -4.919 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -4.682 -1.909 -4.028 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -5.876 -2.739 -3.002 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -4.832 -3.681 -4.093 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -5.036 -1.726 -6.458 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -5.206 -3.490 -6.620 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -6.494 -2.414 -7.211 1.00 0.00 H new ATOM 647 N THR A 117 -7.841 -4.267 -8.444 1.00 0.00 N ATOM 648 CA THR A 117 -7.452 -5.100 -9.575 1.00 0.00 C ATOM 649 C THR A 117 -6.139 -5.823 -9.296 1.00 0.00 C ATOM 650 O THR A 117 -5.199 -5.241 -8.757 1.00 0.00 O ATOM 651 CB THR A 117 -7.318 -4.248 -10.837 1.00 0.00 C ATOM 652 OG1 THR A 117 -6.743 -2.989 -10.533 1.00 0.00 O ATOM 653 CG2 THR A 117 -8.639 -3.993 -11.531 1.00 0.00 C ATOM 0 H THR A 117 -7.936 -3.276 -8.665 1.00 0.00 H new ATOM 0 HA THR A 117 -8.231 -5.847 -9.727 1.00 0.00 H new ATOM 0 HB THR A 117 -6.679 -4.823 -11.507 1.00 0.00 H new ATOM 0 HG1 THR A 117 -6.664 -2.459 -11.353 1.00 0.00 H new ATOM 0 HG21 THR A 117 -8.472 -3.383 -12.418 1.00 0.00 H new ATOM 0 HG22 THR A 117 -9.086 -4.943 -11.823 1.00 0.00 H new ATOM 0 HG23 THR A 117 -9.312 -3.469 -10.852 1.00 0.00 H new ATOM 661 N ASP A 118 -6.084 -7.098 -9.671 1.00 0.00 N ATOM 662 CA ASP A 118 -4.888 -7.907 -9.464 1.00 0.00 C ATOM 663 C ASP A 118 -3.671 -7.286 -10.149 1.00 0.00 C ATOM 664 O ASP A 118 -2.538 -7.494 -9.723 1.00 0.00 O ATOM 665 CB ASP A 118 -5.113 -9.325 -9.992 1.00 0.00 C ATOM 666 CG ASP A 118 -6.110 -10.102 -9.155 1.00 0.00 C ATOM 667 OD1 ASP A 118 -6.892 -9.464 -8.419 1.00 0.00 O1- ATOM 668 OD2 ASP A 118 -6.110 -11.348 -9.235 1.00 0.00 O ATOM 0 H ASP A 118 -6.855 -7.593 -10.120 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.692 -7.946 -8.392 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -5.468 -9.274 -11.021 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -4.163 -9.859 -10.009 1.00 0.00 H new ATOM 673 N ASP A 119 -3.913 -6.527 -11.214 1.00 0.00 N ATOM 674 CA ASP A 119 -2.832 -5.884 -11.954 1.00 0.00 C ATOM 675 C ASP A 119 -2.150 -4.809 -11.110 1.00 0.00 C ATOM 676 O ASP A 119 -0.923 -4.758 -11.027 1.00 0.00 O ATOM 677 CB ASP A 119 -3.367 -5.270 -13.248 1.00 0.00 C ATOM 678 CG ASP A 119 -2.258 -4.892 -14.211 1.00 0.00 C ATOM 679 OD1 ASP A 119 -1.850 -5.756 -15.016 1.00 0.00 O ATOM 680 OD2 ASP A 119 -1.796 -3.733 -14.159 1.00 0.00 O1- ATOM 0 H ASP A 119 -4.846 -6.343 -11.583 1.00 0.00 H new ATOM 0 HA ASP A 119 -2.093 -6.647 -12.199 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -4.039 -5.978 -13.732 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -3.956 -4.384 -13.010 1.00 0.00 H new ATOM 685 N GLU A 120 -2.953 -3.951 -10.490 1.00 0.00 N ATOM 686 CA GLU A 120 -2.425 -2.875 -9.658 1.00 0.00 C ATOM 687 C GLU A 120 -1.773 -3.424 -8.392 1.00 0.00 C ATOM 688 O GLU A 120 -0.789 -2.871 -7.899 1.00 0.00 O ATOM 689 CB GLU A 120 -3.540 -1.895 -9.286 1.00 0.00 C ATOM 690 CG GLU A 120 -3.717 -0.767 -10.289 1.00 0.00 C ATOM 691 CD GLU A 120 -4.752 0.248 -9.848 1.00 0.00 C ATOM 692 OE1 GLU A 120 -4.504 0.953 -8.847 1.00 0.00 O ATOM 693 OE2 GLU A 120 -5.811 0.341 -10.504 1.00 0.00 O1- ATOM 0 H GLU A 120 -3.971 -3.979 -10.548 1.00 0.00 H new ATOM 0 HA GLU A 120 -1.663 -2.350 -10.235 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -4.479 -2.442 -9.197 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -3.326 -1.469 -8.306 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -2.761 -0.265 -10.438 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -4.011 -1.185 -11.252 1.00 0.00 H new ATOM 700 N VAL A 121 -2.327 -4.511 -7.869 1.00 0.00 N ATOM 701 CA VAL A 121 -1.799 -5.131 -6.662 1.00 0.00 C ATOM 702 C VAL A 121 -0.573 -5.982 -6.976 1.00 0.00 C ATOM 703 O VAL A 121 0.338 -6.101 -6.159 1.00 0.00 O ATOM 704 CB VAL A 121 -2.865 -6.002 -5.968 1.00 0.00 C ATOM 705 CG1 VAL A 121 -2.338 -6.552 -4.652 1.00 0.00 C ATOM 706 CG2 VAL A 121 -4.140 -5.207 -5.747 1.00 0.00 C ATOM 0 H VAL A 121 -3.142 -4.981 -8.263 1.00 0.00 H new ATOM 0 HA VAL A 121 -1.510 -4.326 -5.987 1.00 0.00 H new ATOM 0 HB VAL A 121 -3.095 -6.845 -6.619 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -3.107 -7.164 -4.179 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -1.454 -7.162 -4.840 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -2.075 -5.726 -3.992 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -4.881 -5.837 -5.256 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -3.925 -4.343 -5.119 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -4.529 -4.870 -6.707 1.00 0.00 H new ATOM 716 N ASP A 122 -0.562 -6.573 -8.164 1.00 0.00 N ATOM 717 CA ASP A 122 0.549 -7.416 -8.591 1.00 0.00 C ATOM 718 C ASP A 122 1.787 -6.579 -8.902 1.00 0.00 C ATOM 719 O ASP A 122 2.917 -7.040 -8.737 1.00 0.00 O ATOM 720 CB ASP A 122 0.149 -8.233 -9.822 1.00 0.00 C ATOM 721 CG ASP A 122 1.241 -9.189 -10.265 1.00 0.00 C ATOM 722 OD1 ASP A 122 1.662 -10.030 -9.443 1.00 0.00 O ATOM 723 OD2 ASP A 122 1.673 -9.096 -11.433 1.00 0.00 O1- ATOM 0 H ASP A 122 -1.311 -6.484 -8.851 1.00 0.00 H new ATOM 0 HA ASP A 122 0.792 -8.094 -7.773 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -0.756 -8.798 -9.600 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -0.091 -7.555 -10.642 1.00 0.00 H new ATOM 728 N GLU A 123 1.568 -5.351 -9.360 1.00 0.00 N ATOM 729 CA GLU A 123 2.665 -4.455 -9.704 1.00 0.00 C ATOM 730 C GLU A 123 3.288 -3.829 -8.458 1.00 0.00 C ATOM 731 O GLU A 123 4.507 -3.682 -8.372 1.00 0.00 O ATOM 732 CB GLU A 123 2.172 -3.355 -10.646 1.00 0.00 C ATOM 733 CG GLU A 123 2.316 -3.706 -12.118 1.00 0.00 C ATOM 734 CD GLU A 123 3.763 -3.853 -12.542 1.00 0.00 C ATOM 735 OE1 GLU A 123 4.645 -3.306 -11.848 1.00 0.00 O ATOM 736 OE2 GLU A 123 4.016 -4.518 -13.570 1.00 0.00 O1- ATOM 0 H GLU A 123 0.639 -4.953 -9.502 1.00 0.00 H new ATOM 0 HA GLU A 123 3.432 -5.046 -10.205 1.00 0.00 H new ATOM 0 HB2 GLU A 123 1.124 -3.147 -10.431 1.00 0.00 H new ATOM 0 HB3 GLU A 123 2.727 -2.439 -10.443 1.00 0.00 H new ATOM 0 HG2 GLU A 123 1.786 -4.637 -12.320 1.00 0.00 H new ATOM 0 HG3 GLU A 123 1.841 -2.932 -12.721 1.00 0.00 H new ATOM 743 N MET A 124 2.447 -3.447 -7.503 1.00 0.00 N ATOM 744 CA MET A 124 2.924 -2.822 -6.275 1.00 0.00 C ATOM 745 C MET A 124 3.651 -3.824 -5.376 1.00 0.00 C ATOM 746 O MET A 124 4.602 -3.465 -4.680 1.00 0.00 O ATOM 747 CB MET A 124 1.761 -2.170 -5.521 1.00 0.00 C ATOM 748 CG MET A 124 0.797 -3.164 -4.896 1.00 0.00 C ATOM 749 SD MET A 124 1.005 -3.314 -3.109 1.00 0.00 S ATOM 750 CE MET A 124 -0.427 -4.299 -2.679 1.00 0.00 C ATOM 0 H MET A 124 1.434 -3.559 -7.555 1.00 0.00 H new ATOM 0 HA MET A 124 3.641 -2.050 -6.554 1.00 0.00 H new ATOM 0 HB2 MET A 124 2.164 -1.528 -4.738 1.00 0.00 H new ATOM 0 HB3 MET A 124 1.210 -1.528 -6.208 1.00 0.00 H new ATOM 0 HG2 MET A 124 -0.226 -2.856 -5.113 1.00 0.00 H new ATOM 0 HG3 MET A 124 0.941 -4.141 -5.357 1.00 0.00 H new ATOM 0 HE1 MET A 124 -0.558 -4.298 -1.597 1.00 0.00 H new ATOM 0 HE2 MET A 124 -1.314 -3.877 -3.152 1.00 0.00 H new ATOM 0 HE3 MET A 124 -0.282 -5.322 -3.026 1.00 0.00 H new ATOM 760 N ILE A 125 3.200 -5.074 -5.389 1.00 0.00 N ATOM 761 CA ILE A 125 3.814 -6.113 -4.569 1.00 0.00 C ATOM 762 C ILE A 125 5.158 -6.552 -5.143 1.00 0.00 C ATOM 763 O ILE A 125 6.100 -6.834 -4.402 1.00 0.00 O ATOM 764 CB ILE A 125 2.889 -7.341 -4.427 1.00 0.00 C ATOM 765 CG1 ILE A 125 2.635 -7.987 -5.796 1.00 0.00 C ATOM 766 CG2 ILE A 125 1.577 -6.939 -3.762 1.00 0.00 C ATOM 767 CD1 ILE A 125 1.687 -9.166 -5.748 1.00 0.00 C ATOM 0 H ILE A 125 2.414 -5.392 -5.956 1.00 0.00 H new ATOM 0 HA ILE A 125 3.976 -5.680 -3.582 1.00 0.00 H new ATOM 0 HB ILE A 125 3.382 -8.079 -3.794 1.00 0.00 H new ATOM 0 HG12 ILE A 125 2.230 -7.235 -6.473 1.00 0.00 H new ATOM 0 HG13 ILE A 125 3.586 -8.314 -6.215 1.00 0.00 H new ATOM 0 HG21 ILE A 125 0.934 -7.814 -3.668 1.00 0.00 H new ATOM 0 HG22 ILE A 125 1.781 -6.530 -2.772 1.00 0.00 H new ATOM 0 HG23 ILE A 125 1.077 -6.185 -4.370 1.00 0.00 H new ATOM 0 HD11 ILE A 125 1.557 -9.569 -6.752 1.00 0.00 H new ATOM 0 HD12 ILE A 125 2.099 -9.938 -5.098 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.722 -8.841 -5.360 1.00 0.00 H new ATOM 779 N ARG A 126 5.238 -6.608 -6.468 1.00 0.00 N ATOM 780 CA ARG A 126 6.464 -7.015 -7.146 1.00 0.00 C ATOM 781 C ARG A 126 7.551 -5.951 -6.998 1.00 0.00 C ATOM 782 O ARG A 126 8.742 -6.263 -7.014 1.00 0.00 O ATOM 783 CB ARG A 126 6.186 -7.279 -8.629 1.00 0.00 C ATOM 784 CG ARG A 126 6.922 -8.491 -9.181 1.00 0.00 C ATOM 785 CD ARG A 126 6.024 -9.337 -10.072 1.00 0.00 C ATOM 786 NE ARG A 126 6.733 -9.843 -11.246 1.00 0.00 N ATOM 787 CZ ARG A 126 6.141 -10.466 -12.266 1.00 0.00 C ATOM 788 NH1 ARG A 126 4.828 -10.667 -12.267 1.00 0.00 N1+ ATOM 789 NH2 ARG A 126 6.867 -10.891 -13.291 1.00 0.00 N ATOM 0 H ARG A 126 4.467 -6.376 -7.095 1.00 0.00 H new ATOM 0 HA ARG A 126 6.820 -7.934 -6.680 1.00 0.00 H new ATOM 0 HB2 ARG A 126 5.114 -7.420 -8.770 1.00 0.00 H new ATOM 0 HB3 ARG A 126 6.470 -6.399 -9.206 1.00 0.00 H new ATOM 0 HG2 ARG A 126 7.792 -8.161 -9.749 1.00 0.00 H new ATOM 0 HG3 ARG A 126 7.292 -9.099 -8.356 1.00 0.00 H new ATOM 0 HD2 ARG A 126 5.630 -10.176 -9.497 1.00 0.00 H new ATOM 0 HD3 ARG A 126 5.169 -8.742 -10.394 1.00 0.00 H new ATOM 0 HE ARG A 126 7.744 -9.711 -11.288 1.00 0.00 H new ATOM 0 HH11 ARG A 126 4.262 -10.344 -11.482 1.00 0.00 H new ATOM 0 HH12 ARG A 126 4.386 -11.145 -13.052 1.00 0.00 H new ATOM 0 HH21 ARG A 126 7.876 -10.741 -13.298 1.00 0.00 H new ATOM 0 HH22 ARG A 126 6.417 -11.368 -14.072 1.00 0.00 H new ATOM 803 N GLU A 127 7.133 -4.697 -6.857 1.00 0.00 N ATOM 804 CA GLU A 127 8.072 -3.590 -6.709 1.00 0.00 C ATOM 805 C GLU A 127 8.387 -3.309 -5.239 1.00 0.00 C ATOM 806 O GLU A 127 9.414 -2.707 -4.925 1.00 0.00 O ATOM 807 CB GLU A 127 7.504 -2.330 -7.366 1.00 0.00 C ATOM 808 CG GLU A 127 8.564 -1.310 -7.747 1.00 0.00 C ATOM 809 CD GLU A 127 9.148 -1.562 -9.123 1.00 0.00 C ATOM 810 OE1 GLU A 127 8.485 -2.242 -9.934 1.00 0.00 O1- ATOM 811 OE2 GLU A 127 10.269 -1.080 -9.389 1.00 0.00 O ATOM 0 H GLU A 127 6.151 -4.422 -6.842 1.00 0.00 H new ATOM 0 HA GLU A 127 9.001 -3.875 -7.203 1.00 0.00 H new ATOM 0 HB2 GLU A 127 6.949 -2.615 -8.260 1.00 0.00 H new ATOM 0 HB3 GLU A 127 6.793 -1.864 -6.684 1.00 0.00 H new ATOM 0 HG2 GLU A 127 8.129 -0.311 -7.719 1.00 0.00 H new ATOM 0 HG3 GLU A 127 9.364 -1.330 -7.007 1.00 0.00 H new ATOM 818 N ALA A 128 7.501 -3.736 -4.341 1.00 0.00 N ATOM 819 CA ALA A 128 7.697 -3.512 -2.913 1.00 0.00 C ATOM 820 C ALA A 128 9.010 -4.116 -2.423 1.00 0.00 C ATOM 821 O ALA A 128 9.807 -3.439 -1.773 1.00 0.00 O ATOM 822 CB ALA A 128 6.528 -4.081 -2.125 1.00 0.00 C ATOM 0 H ALA A 128 6.644 -4.237 -4.577 1.00 0.00 H new ATOM 0 HA ALA A 128 7.747 -2.435 -2.750 1.00 0.00 H new ATOM 0 HB1 ALA A 128 6.687 -3.907 -1.061 1.00 0.00 H new ATOM 0 HB2 ALA A 128 5.606 -3.592 -2.439 1.00 0.00 H new ATOM 0 HB3 ALA A 128 6.452 -5.152 -2.310 1.00 0.00 H new ATOM 828 N ASP A 129 9.233 -5.391 -2.736 1.00 0.00 N ATOM 829 CA ASP A 129 10.455 -6.079 -2.324 1.00 0.00 C ATOM 830 C ASP A 129 10.438 -7.534 -2.778 1.00 0.00 C ATOM 831 O ASP A 129 11.215 -7.937 -3.644 1.00 0.00 O ATOM 832 CB ASP A 129 10.626 -6.012 -0.802 1.00 0.00 C ATOM 833 CG ASP A 129 12.064 -5.769 -0.391 1.00 0.00 C ATOM 834 OD1 ASP A 129 12.973 -6.161 -1.153 1.00 0.00 O1- ATOM 835 OD2 ASP A 129 12.283 -5.187 0.692 1.00 0.00 O ATOM 0 H ASP A 129 8.585 -5.968 -3.272 1.00 0.00 H new ATOM 0 HA ASP A 129 11.298 -5.575 -2.797 1.00 0.00 H new ATOM 0 HB2 ASP A 129 9.998 -5.215 -0.404 1.00 0.00 H new ATOM 0 HB3 ASP A 129 10.277 -6.945 -0.359 1.00 0.00 H new ATOM 840 N ILE A 130 9.548 -8.321 -2.180 1.00 0.00 N ATOM 841 CA ILE A 130 9.428 -9.734 -2.513 1.00 0.00 C ATOM 842 C ILE A 130 10.684 -10.499 -2.095 1.00 0.00 C ATOM 843 O ILE A 130 11.425 -11.014 -2.933 1.00 0.00 O ATOM 844 CB ILE A 130 9.176 -9.943 -4.023 1.00 0.00 C ATOM 845 CG1 ILE A 130 8.005 -9.078 -4.491 1.00 0.00 C ATOM 846 CG2 ILE A 130 8.908 -11.412 -4.320 1.00 0.00 C ATOM 847 CD1 ILE A 130 6.683 -9.460 -3.860 1.00 0.00 C ATOM 0 H ILE A 130 8.899 -8.002 -1.461 1.00 0.00 H new ATOM 0 HA ILE A 130 8.570 -10.121 -1.963 1.00 0.00 H new ATOM 0 HB ILE A 130 10.069 -9.640 -4.569 1.00 0.00 H new ATOM 0 HG12 ILE A 130 8.220 -8.034 -4.262 1.00 0.00 H new ATOM 0 HG13 ILE A 130 7.917 -9.155 -5.575 1.00 0.00 H new ATOM 0 HG21 ILE A 130 8.733 -11.541 -5.388 1.00 0.00 H new ATOM 0 HG22 ILE A 130 9.770 -12.007 -4.019 1.00 0.00 H new ATOM 0 HG23 ILE A 130 8.029 -11.741 -3.766 1.00 0.00 H new ATOM 0 HD11 ILE A 130 5.897 -8.806 -4.237 1.00 0.00 H new ATOM 0 HD12 ILE A 130 6.446 -10.494 -4.111 1.00 0.00 H new ATOM 0 HD13 ILE A 130 6.753 -9.356 -2.777 1.00 0.00 H new ATOM 859 N ASP A 131 10.918 -10.566 -0.787 1.00 0.00 N ATOM 860 CA ASP A 131 12.083 -11.262 -0.252 1.00 0.00 C ATOM 861 C ASP A 131 11.665 -12.488 0.553 1.00 0.00 C ATOM 862 O ASP A 131 10.796 -12.407 1.422 1.00 0.00 O ATOM 863 CB ASP A 131 12.908 -10.317 0.624 1.00 0.00 C ATOM 864 CG ASP A 131 14.400 -10.517 0.444 1.00 0.00 C ATOM 865 OD1 ASP A 131 14.855 -10.575 -0.717 1.00 0.00 O1- ATOM 866 OD2 ASP A 131 15.113 -10.616 1.464 1.00 0.00 O ATOM 0 H ASP A 131 10.316 -10.147 -0.079 1.00 0.00 H new ATOM 0 HA ASP A 131 12.693 -11.595 -1.091 1.00 0.00 H new ATOM 0 HB2 ASP A 131 12.651 -9.285 0.383 1.00 0.00 H new ATOM 0 HB3 ASP A 131 12.647 -10.475 1.670 1.00 0.00 H new ATOM 871 N GLY A 132 12.289 -13.623 0.258 1.00 0.00 N ATOM 872 CA GLY A 132 11.973 -14.853 0.962 1.00 0.00 C ATOM 873 C GLY A 132 10.610 -15.422 0.597 1.00 0.00 C ATOM 874 O GLY A 132 10.157 -16.388 1.212 1.00 0.00 O ATOM 0 H GLY A 132 13.010 -13.714 -0.458 1.00 0.00 H new ATOM 0 HA2 GLY A 132 12.740 -15.596 0.743 1.00 0.00 H new ATOM 0 HA3 GLY A 132 12.006 -14.668 2.036 1.00 0.00 H new ATOM 878 N ASP A 133 9.948 -14.833 -0.401 1.00 0.00 N ATOM 879 CA ASP A 133 8.634 -15.303 -0.829 1.00 0.00 C ATOM 880 C ASP A 133 7.642 -15.299 0.332 1.00 0.00 C ATOM 881 O ASP A 133 7.335 -16.347 0.902 1.00 0.00 O ATOM 882 CB ASP A 133 8.742 -16.711 -1.420 1.00 0.00 C ATOM 883 CG ASP A 133 9.069 -16.694 -2.901 1.00 0.00 C ATOM 884 OD1 ASP A 133 9.591 -15.666 -3.382 1.00 0.00 O1- ATOM 885 OD2 ASP A 133 8.803 -17.708 -3.579 1.00 0.00 O ATOM 0 H ASP A 133 10.301 -14.032 -0.925 1.00 0.00 H new ATOM 0 HA ASP A 133 8.266 -14.620 -1.595 1.00 0.00 H new ATOM 0 HB2 ASP A 133 9.513 -17.267 -0.887 1.00 0.00 H new ATOM 0 HB3 ASP A 133 7.802 -17.240 -1.265 1.00 0.00 H new ATOM 890 N GLY A 134 7.143 -14.116 0.677 1.00 0.00 N ATOM 891 CA GLY A 134 6.193 -14.004 1.769 1.00 0.00 C ATOM 892 C GLY A 134 6.444 -12.793 2.650 1.00 0.00 C ATOM 893 O GLY A 134 5.539 -12.326 3.340 1.00 0.00 O ATOM 0 H GLY A 134 7.379 -13.235 0.221 1.00 0.00 H new ATOM 0 HA2 GLY A 134 5.184 -13.947 1.361 1.00 0.00 H new ATOM 0 HA3 GLY A 134 6.240 -14.906 2.379 1.00 0.00 H new ATOM 897 N HIS A 135 7.674 -12.285 2.633 1.00 0.00 N ATOM 898 CA HIS A 135 8.030 -11.125 3.443 1.00 0.00 C ATOM 899 C HIS A 135 8.320 -9.911 2.567 1.00 0.00 C ATOM 900 O HIS A 135 9.210 -9.944 1.717 1.00 0.00 O ATOM 901 CB HIS A 135 9.244 -11.440 4.317 1.00 0.00 C ATOM 902 CG HIS A 135 9.092 -12.691 5.123 1.00 0.00 C ATOM 903 ND1 HIS A 135 7.993 -13.263 5.671 1.00 0.00 N flip ATOM 904 CD2 HIS A 135 10.151 -13.511 5.450 1.00 0.00 C flip ATOM 905 CE1 HIS A 135 8.405 -14.406 6.311 1.00 0.00 C flip ATOM 906 NE2 HIS A 135 9.710 -14.533 6.161 1.00 0.00 N flip ATOM 0 H HIS A 135 8.438 -12.657 2.069 1.00 0.00 H new ATOM 0 HA HIS A 135 7.180 -10.890 4.084 1.00 0.00 H new ATOM 0 HB2 HIS A 135 10.125 -11.532 3.682 1.00 0.00 H new ATOM 0 HB3 HIS A 135 9.423 -10.603 4.991 1.00 0.00 H new ATOM 0 HD2 HIS A 135 11.180 -13.344 5.169 1.00 0.00 H new ATOM 0 HE1 HIS A 135 7.765 -15.090 6.849 1.00 0.00 H new ATOM 0 HE2 HIS A 135 10.282 -15.292 6.532 1.00 0.00 H new ATOM 915 N ILE A 136 7.564 -8.840 2.782 1.00 0.00 N ATOM 916 CA ILE A 136 7.739 -7.612 2.014 1.00 0.00 C ATOM 917 C ILE A 136 7.670 -6.385 2.917 1.00 0.00 C ATOM 918 O ILE A 136 6.587 -5.963 3.324 1.00 0.00 O ATOM 919 CB ILE A 136 6.670 -7.480 0.911 1.00 0.00 C ATOM 920 CG1 ILE A 136 6.581 -8.774 0.099 1.00 0.00 C ATOM 921 CG2 ILE A 136 6.985 -6.299 0.004 1.00 0.00 C ATOM 922 CD1 ILE A 136 5.319 -8.884 -0.726 1.00 0.00 C ATOM 0 H ILE A 136 6.824 -8.797 3.482 1.00 0.00 H new ATOM 0 HA ILE A 136 8.724 -7.668 1.551 1.00 0.00 H new ATOM 0 HB ILE A 136 5.704 -7.302 1.383 1.00 0.00 H new ATOM 0 HG12 ILE A 136 7.445 -8.838 -0.563 1.00 0.00 H new ATOM 0 HG13 ILE A 136 6.636 -9.624 0.779 1.00 0.00 H new ATOM 0 HG21 ILE A 136 6.221 -6.220 -0.769 1.00 0.00 H new ATOM 0 HG22 ILE A 136 7.001 -5.382 0.593 1.00 0.00 H new ATOM 0 HG23 ILE A 136 7.959 -6.448 -0.462 1.00 0.00 H new ATOM 0 HD11 ILE A 136 5.324 -9.826 -1.275 1.00 0.00 H new ATOM 0 HD12 ILE A 136 4.450 -8.852 -0.068 1.00 0.00 H new ATOM 0 HD13 ILE A 136 5.271 -8.054 -1.431 1.00 0.00 H new ATOM 934 N ASN A 137 8.830 -5.814 3.225 1.00 0.00 N ATOM 935 CA ASN A 137 8.896 -4.633 4.076 1.00 0.00 C ATOM 936 C ASN A 137 8.137 -3.471 3.442 1.00 0.00 C ATOM 937 O ASN A 137 8.357 -3.136 2.279 1.00 0.00 O ATOM 938 CB ASN A 137 10.355 -4.237 4.324 1.00 0.00 C ATOM 939 CG ASN A 137 10.613 -3.854 5.769 1.00 0.00 C ATOM 940 OD1 ASN A 137 9.722 -3.051 6.338 1.00 0.00 O flip ATOM 941 ND2 ASN A 137 11.604 -4.276 6.368 1.00 0.00 N flip ATOM 0 H ASN A 137 9.736 -6.150 2.898 1.00 0.00 H new ATOM 0 HA ASN A 137 8.429 -4.872 5.031 1.00 0.00 H new ATOM 0 HB2 ASN A 137 11.006 -5.067 4.049 1.00 0.00 H new ATOM 0 HB3 ASN A 137 10.616 -3.400 3.677 1.00 0.00 H new ATOM 0 HD21 ASN A 137 12.264 -4.891 5.892 1.00 0.00 H new ATOM 0 HD22 ASN A 137 11.764 -4.010 7.340 1.00 0.00 H new ATOM 948 N TYR A 138 7.241 -2.861 4.212 1.00 0.00 N ATOM 949 CA TYR A 138 6.450 -1.737 3.713 1.00 0.00 C ATOM 950 C TYR A 138 7.190 -0.402 3.854 1.00 0.00 C ATOM 951 O TYR A 138 6.610 0.652 3.602 1.00 0.00 O ATOM 952 CB TYR A 138 5.101 -1.662 4.430 1.00 0.00 C ATOM 953 CG TYR A 138 5.194 -1.843 5.925 1.00 0.00 C ATOM 954 CD1 TYR A 138 5.679 -0.828 6.737 1.00 0.00 C ATOM 955 CD2 TYR A 138 4.801 -3.032 6.522 1.00 0.00 C ATOM 956 CE1 TYR A 138 5.770 -0.992 8.104 1.00 0.00 C ATOM 957 CE2 TYR A 138 4.888 -3.205 7.887 1.00 0.00 C ATOM 958 CZ TYR A 138 5.374 -2.183 8.675 1.00 0.00 C ATOM 959 OH TYR A 138 5.463 -2.351 10.038 1.00 0.00 O ATOM 0 H TYR A 138 7.044 -3.123 5.178 1.00 0.00 H new ATOM 0 HA TYR A 138 6.283 -1.915 2.651 1.00 0.00 H new ATOM 0 HB2 TYR A 138 4.641 -0.697 4.218 1.00 0.00 H new ATOM 0 HB3 TYR A 138 4.440 -2.426 4.021 1.00 0.00 H new ATOM 0 HD1 TYR A 138 5.990 0.106 6.292 1.00 0.00 H new ATOM 0 HD2 TYR A 138 4.421 -3.835 5.908 1.00 0.00 H new ATOM 0 HE1 TYR A 138 6.149 -0.192 8.723 1.00 0.00 H new ATOM 0 HE2 TYR A 138 4.577 -4.136 8.337 1.00 0.00 H new ATOM 0 HH TYR A 138 6.035 -1.652 10.417 1.00 0.00 H new ATOM 969 N GLU A 139 8.467 -0.445 4.241 1.00 0.00 N ATOM 970 CA GLU A 139 9.260 0.771 4.392 1.00 0.00 C ATOM 971 C GLU A 139 9.945 1.118 3.076 1.00 0.00 C ATOM 972 O GLU A 139 10.026 2.285 2.691 1.00 0.00 O ATOM 973 CB GLU A 139 10.301 0.596 5.499 1.00 0.00 C ATOM 974 CG GLU A 139 9.728 0.746 6.900 1.00 0.00 C ATOM 975 CD GLU A 139 10.694 0.288 7.976 1.00 0.00 C ATOM 976 OE1 GLU A 139 11.914 0.273 7.711 1.00 0.00 O ATOM 977 OE2 GLU A 139 10.229 -0.054 9.083 1.00 0.00 O1- ATOM 0 H GLU A 139 8.970 -1.306 4.454 1.00 0.00 H new ATOM 0 HA GLU A 139 8.594 1.588 4.668 1.00 0.00 H new ATOM 0 HB2 GLU A 139 10.757 -0.389 5.405 1.00 0.00 H new ATOM 0 HB3 GLU A 139 11.095 1.330 5.359 1.00 0.00 H new ATOM 0 HG2 GLU A 139 9.466 1.790 7.072 1.00 0.00 H new ATOM 0 HG3 GLU A 139 8.806 0.170 6.975 1.00 0.00 H new ATOM 984 N GLU A 140 10.420 0.090 2.383 1.00 0.00 N ATOM 985 CA GLU A 140 11.077 0.272 1.098 1.00 0.00 C ATOM 986 C GLU A 140 10.030 0.535 0.026 1.00 0.00 C ATOM 987 O GLU A 140 10.230 1.353 -0.871 1.00 0.00 O ATOM 988 CB GLU A 140 11.906 -0.962 0.738 1.00 0.00 C ATOM 989 CG GLU A 140 13.297 -0.960 1.351 1.00 0.00 C ATOM 990 CD GLU A 140 14.221 -1.976 0.708 1.00 0.00 C ATOM 991 OE1 GLU A 140 14.001 -3.189 0.909 1.00 0.00 O1- ATOM 992 OE2 GLU A 140 15.163 -1.559 0.004 1.00 0.00 O ATOM 0 H GLU A 140 10.361 -0.880 2.692 1.00 0.00 H new ATOM 0 HA GLU A 140 11.750 1.127 1.162 1.00 0.00 H new ATOM 0 HB2 GLU A 140 11.374 -1.855 1.067 1.00 0.00 H new ATOM 0 HB3 GLU A 140 11.996 -1.025 -0.346 1.00 0.00 H new ATOM 0 HG2 GLU A 140 13.732 0.035 1.252 1.00 0.00 H new ATOM 0 HG3 GLU A 140 13.220 -1.169 2.418 1.00 0.00 H new ATOM 999 N PHE A 141 8.899 -0.156 0.147 1.00 0.00 N ATOM 1000 CA PHE A 141 7.799 0.006 -0.791 1.00 0.00 C ATOM 1001 C PHE A 141 7.226 1.416 -0.676 1.00 0.00 C ATOM 1002 O PHE A 141 7.029 2.100 -1.679 1.00 0.00 O ATOM 1003 CB PHE A 141 6.712 -1.047 -0.523 1.00 0.00 C ATOM 1004 CG PHE A 141 5.438 -0.832 -1.298 1.00 0.00 C ATOM 1005 CD1 PHE A 141 5.430 -0.885 -2.682 1.00 0.00 C ATOM 1006 CD2 PHE A 141 4.253 -0.570 -0.634 1.00 0.00 C ATOM 1007 CE1 PHE A 141 4.261 -0.681 -3.389 1.00 0.00 C ATOM 1008 CE2 PHE A 141 3.082 -0.362 -1.335 1.00 0.00 C ATOM 1009 CZ PHE A 141 3.085 -0.417 -2.713 1.00 0.00 C ATOM 0 H PHE A 141 8.723 -0.834 0.888 1.00 0.00 H new ATOM 0 HA PHE A 141 8.169 -0.138 -1.806 1.00 0.00 H new ATOM 0 HB2 PHE A 141 7.109 -2.033 -0.765 1.00 0.00 H new ATOM 0 HB3 PHE A 141 6.480 -1.050 0.542 1.00 0.00 H new ATOM 0 HD1 PHE A 141 6.348 -1.088 -3.214 1.00 0.00 H new ATOM 0 HD2 PHE A 141 4.244 -0.528 0.445 1.00 0.00 H new ATOM 0 HE1 PHE A 141 4.266 -0.728 -4.468 1.00 0.00 H new ATOM 0 HE2 PHE A 141 2.164 -0.156 -0.805 1.00 0.00 H new ATOM 0 HZ PHE A 141 2.170 -0.254 -3.263 1.00 0.00 H new ATOM 1019 N VAL A 142 6.968 1.848 0.555 1.00 0.00 N ATOM 1020 CA VAL A 142 6.427 3.179 0.790 1.00 0.00 C ATOM 1021 C VAL A 142 7.439 4.246 0.391 1.00 0.00 C ATOM 1022 O VAL A 142 7.069 5.320 -0.083 1.00 0.00 O ATOM 1023 CB VAL A 142 6.023 3.385 2.269 1.00 0.00 C ATOM 1024 CG1 VAL A 142 7.233 3.278 3.188 1.00 0.00 C ATOM 1025 CG2 VAL A 142 5.325 4.726 2.452 1.00 0.00 C ATOM 0 H VAL A 142 7.124 1.298 1.400 1.00 0.00 H new ATOM 0 HA VAL A 142 5.532 3.272 0.175 1.00 0.00 H new ATOM 0 HB VAL A 142 5.325 2.593 2.541 1.00 0.00 H new ATOM 0 HG11 VAL A 142 6.919 3.427 4.221 1.00 0.00 H new ATOM 0 HG12 VAL A 142 7.683 2.291 3.084 1.00 0.00 H new ATOM 0 HG13 VAL A 142 7.964 4.040 2.917 1.00 0.00 H new ATOM 0 HG21 VAL A 142 5.049 4.852 3.499 1.00 0.00 H new ATOM 0 HG22 VAL A 142 5.998 5.530 2.155 1.00 0.00 H new ATOM 0 HG23 VAL A 142 4.428 4.757 1.834 1.00 0.00 H new ATOM 1035 N ARG A 143 8.719 3.945 0.593 1.00 0.00 N ATOM 1036 CA ARG A 143 9.784 4.885 0.264 1.00 0.00 C ATOM 1037 C ARG A 143 9.992 5.000 -1.244 1.00 0.00 C ATOM 1038 O ARG A 143 10.143 6.099 -1.772 1.00 0.00 O ATOM 1039 CB ARG A 143 11.090 4.459 0.940 1.00 0.00 C ATOM 1040 CG ARG A 143 11.291 5.079 2.314 1.00 0.00 C ATOM 1041 CD ARG A 143 12.407 4.389 3.089 1.00 0.00 C ATOM 1042 NE ARG A 143 13.547 5.277 3.316 1.00 0.00 N ATOM 1043 CZ ARG A 143 13.495 6.385 4.057 1.00 0.00 C ATOM 1044 NH1 ARG A 143 12.363 6.754 4.646 1.00 0.00 N1+ ATOM 1045 NH2 ARG A 143 14.582 7.128 4.209 1.00 0.00 N ATOM 0 H ARG A 143 9.042 3.059 0.982 1.00 0.00 H new ATOM 0 HA ARG A 143 9.485 5.865 0.635 1.00 0.00 H new ATOM 0 HB2 ARG A 143 11.104 3.373 1.034 1.00 0.00 H new ATOM 0 HB3 ARG A 143 11.928 4.734 0.300 1.00 0.00 H new ATOM 0 HG2 ARG A 143 11.526 6.138 2.204 1.00 0.00 H new ATOM 0 HG3 ARG A 143 10.362 5.016 2.881 1.00 0.00 H new ATOM 0 HD2 ARG A 143 12.022 4.042 4.048 1.00 0.00 H new ATOM 0 HD3 ARG A 143 12.738 3.507 2.540 1.00 0.00 H new ATOM 0 HE ARG A 143 14.437 5.034 2.881 1.00 0.00 H new ATOM 0 HH11 ARG A 143 11.522 6.188 4.534 1.00 0.00 H new ATOM 0 HH12 ARG A 143 12.335 7.603 5.210 1.00 0.00 H new ATOM 0 HH21 ARG A 143 15.455 6.852 3.760 1.00 0.00 H new ATOM 0 HH22 ARG A 143 14.545 7.976 4.775 1.00 0.00 H new ATOM 1059 N MET A 144 10.013 3.865 -1.935 1.00 0.00 N ATOM 1060 CA MET A 144 10.225 3.856 -3.381 1.00 0.00 C ATOM 1061 C MET A 144 9.048 4.472 -4.137 1.00 0.00 C ATOM 1062 O MET A 144 9.233 5.062 -5.202 1.00 0.00 O ATOM 1063 CB MET A 144 10.482 2.430 -3.877 1.00 0.00 C ATOM 1064 CG MET A 144 9.296 1.494 -3.700 1.00 0.00 C ATOM 1065 SD MET A 144 8.888 0.579 -5.200 1.00 0.00 S ATOM 1066 CE MET A 144 7.661 1.661 -5.930 1.00 0.00 C ATOM 0 H MET A 144 9.886 2.942 -1.520 1.00 0.00 H new ATOM 0 HA MET A 144 11.103 4.469 -3.582 1.00 0.00 H new ATOM 0 HB2 MET A 144 10.750 2.466 -4.933 1.00 0.00 H new ATOM 0 HB3 MET A 144 11.340 2.019 -3.344 1.00 0.00 H new ATOM 0 HG2 MET A 144 9.514 0.788 -2.899 1.00 0.00 H new ATOM 0 HG3 MET A 144 8.427 2.073 -3.387 1.00 0.00 H new ATOM 0 HE1 MET A 144 6.675 1.205 -5.841 1.00 0.00 H new ATOM 0 HE2 MET A 144 7.666 2.619 -5.411 1.00 0.00 H new ATOM 0 HE3 MET A 144 7.894 1.817 -6.983 1.00 0.00 H new ATOM 1076 N MET A 145 7.839 4.329 -3.600 1.00 0.00 N ATOM 1077 CA MET A 145 6.653 4.874 -4.257 1.00 0.00 C ATOM 1078 C MET A 145 6.525 6.378 -4.019 1.00 0.00 C ATOM 1079 O MET A 145 5.958 7.096 -4.842 1.00 0.00 O ATOM 1080 CB MET A 145 5.389 4.154 -3.779 1.00 0.00 C ATOM 1081 CG MET A 145 5.050 4.404 -2.318 1.00 0.00 C ATOM 1082 SD MET A 145 3.304 4.778 -2.054 1.00 0.00 S ATOM 1083 CE MET A 145 2.566 3.175 -2.366 1.00 0.00 C ATOM 0 H MET A 145 7.655 3.846 -2.721 1.00 0.00 H new ATOM 0 HA MET A 145 6.767 4.709 -5.328 1.00 0.00 H new ATOM 0 HB2 MET A 145 4.548 4.470 -4.396 1.00 0.00 H new ATOM 0 HB3 MET A 145 5.513 3.082 -3.934 1.00 0.00 H new ATOM 0 HG2 MET A 145 5.320 3.525 -1.732 1.00 0.00 H new ATOM 0 HG3 MET A 145 5.654 5.232 -1.947 1.00 0.00 H new ATOM 0 HE1 MET A 145 1.494 3.224 -2.173 1.00 0.00 H new ATOM 0 HE2 MET A 145 2.735 2.893 -3.405 1.00 0.00 H new ATOM 0 HE3 MET A 145 3.019 2.432 -1.710 1.00 0.00 H new ATOM 1093 N VAL A 146 7.053 6.852 -2.895 1.00 0.00 N ATOM 1094 CA VAL A 146 6.992 8.273 -2.568 1.00 0.00 C ATOM 1095 C VAL A 146 8.288 8.991 -2.944 1.00 0.00 C ATOM 1096 O VAL A 146 8.294 10.202 -3.162 1.00 0.00 O ATOM 1097 CB VAL A 146 6.700 8.503 -1.068 1.00 0.00 C ATOM 1098 CG1 VAL A 146 5.362 7.886 -0.683 1.00 0.00 C ATOM 1099 CG2 VAL A 146 7.823 7.945 -0.201 1.00 0.00 C ATOM 0 H VAL A 146 7.526 6.277 -2.198 1.00 0.00 H new ATOM 0 HA VAL A 146 6.172 8.689 -3.154 1.00 0.00 H new ATOM 0 HB VAL A 146 6.645 9.578 -0.894 1.00 0.00 H new ATOM 0 HG11 VAL A 146 5.174 8.058 0.377 1.00 0.00 H new ATOM 0 HG12 VAL A 146 4.567 8.344 -1.272 1.00 0.00 H new ATOM 0 HG13 VAL A 146 5.386 6.814 -0.878 1.00 0.00 H new ATOM 0 HG21 VAL A 146 7.593 8.120 0.850 1.00 0.00 H new ATOM 0 HG22 VAL A 146 7.921 6.874 -0.378 1.00 0.00 H new ATOM 0 HG23 VAL A 146 8.760 8.442 -0.455 1.00 0.00 H new ATOM 1109 N SER A 147 9.385 8.239 -3.017 1.00 0.00 N ATOM 1110 CA SER A 147 10.681 8.810 -3.363 1.00 0.00 C ATOM 1111 C SER A 147 10.970 8.652 -4.855 1.00 0.00 C ATOM 1112 O SER A 147 12.105 8.384 -5.253 1.00 0.00 O ATOM 1113 CB SER A 147 11.786 8.142 -2.541 1.00 0.00 C ATOM 1114 OG SER A 147 12.924 8.983 -2.437 1.00 0.00 O ATOM 0 H SER A 147 9.400 7.234 -2.841 1.00 0.00 H new ATOM 0 HA SER A 147 10.656 9.875 -3.132 1.00 0.00 H new ATOM 0 HB2 SER A 147 11.411 7.907 -1.545 1.00 0.00 H new ATOM 0 HB3 SER A 147 12.069 7.198 -3.006 1.00 0.00 H new ATOM 0 HG SER A 147 13.260 9.191 -3.334 1.00 0.00 H new ATOM 1120 N LYS A 148 9.937 8.821 -5.676 1.00 0.00 N ATOM 1121 CA LYS A 148 10.083 8.700 -7.123 1.00 0.00 C ATOM 1122 C LYS A 148 8.773 9.032 -7.829 1.00 0.00 C ATOM 1123 O LYS A 148 7.907 9.673 -7.196 1.00 0.00 O ATOM 1124 CB LYS A 148 10.533 7.287 -7.496 1.00 0.00 C ATOM 1125 CG LYS A 148 11.355 7.228 -8.774 1.00 0.00 C ATOM 1126 CD LYS A 148 12.123 5.919 -8.884 1.00 0.00 C ATOM 1127 CE LYS A 148 13.526 6.140 -9.428 1.00 0.00 C ATOM 1128 NZ LYS A 148 14.483 5.112 -8.932 1.00 0.00 N1+ ATOM 1129 OXT LYS A 148 8.623 8.649 -9.008 1.00 0.00 O1- ATOM 0 H LYS A 148 8.991 9.042 -5.364 1.00 0.00 H new ATOM 0 HA LYS A 148 10.842 9.412 -7.448 1.00 0.00 H new ATOM 0 HB2 LYS A 148 11.121 6.874 -6.676 1.00 0.00 H new ATOM 0 HB3 LYS A 148 9.654 6.653 -7.610 1.00 0.00 H new ATOM 0 HG2 LYS A 148 10.697 7.339 -9.636 1.00 0.00 H new ATOM 0 HG3 LYS A 148 12.054 8.064 -8.797 1.00 0.00 H new ATOM 0 HD2 LYS A 148 12.182 5.447 -7.903 1.00 0.00 H new ATOM 0 HD3 LYS A 148 11.583 5.233 -9.536 1.00 0.00 H new ATOM 0 HE2 LYS A 148 13.501 6.117 -10.517 1.00 0.00 H new ATOM 0 HE3 LYS A 148 13.876 7.131 -9.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 15.427 5.298 -9.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 14.527 5.151 -7.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 14.164 4.168 -9.230 1.00 0.00 H new TER 1143 LYS A 148 ATOM 1144 N LYS B1901 -13.635 -8.235 18.469 1.00 0.00 N ATOM 1145 CA LYS B1901 -14.863 -7.403 18.370 1.00 0.00 C ATOM 1146 C LYS B1901 -14.707 -6.314 17.314 1.00 0.00 C ATOM 1147 O LYS B1901 -15.633 -6.038 16.552 1.00 0.00 O ATOM 1148 CB LYS B1901 -15.139 -6.777 19.739 1.00 0.00 C ATOM 1149 CG LYS B1901 -15.182 -7.788 20.872 1.00 0.00 C ATOM 1150 CD LYS B1901 -16.322 -8.778 20.692 1.00 0.00 C ATOM 1151 CE LYS B1901 -17.668 -8.134 20.978 1.00 0.00 C ATOM 1152 NZ LYS B1901 -18.342 -7.679 19.730 1.00 0.00 N1+ ATOM 0 HA LYS B1901 -15.700 -8.033 18.069 1.00 0.00 H new ATOM 0 HB2 LYS B1901 -14.368 -6.037 19.953 1.00 0.00 H new ATOM 0 HB3 LYS B1901 -16.090 -6.245 19.701 1.00 0.00 H new ATOM 0 HG2 LYS B1901 -14.235 -8.326 20.917 1.00 0.00 H new ATOM 0 HG3 LYS B1901 -15.298 -7.267 21.822 1.00 0.00 H new ATOM 0 HD2 LYS B1901 -16.312 -9.165 19.673 1.00 0.00 H new ATOM 0 HD3 LYS B1901 -16.175 -9.629 21.358 1.00 0.00 H new ATOM 0 HE2 LYS B1901 -18.309 -8.847 21.497 1.00 0.00 H new ATOM 0 HE3 LYS B1901 -17.529 -7.284 21.646 1.00 0.00 H new ATOM 0 HZ1 LYS B1901 -18.799 -6.760 19.898 1.00 0.00 H new ATOM 0 HZ2 LYS B1901 -17.638 -7.582 18.971 1.00 0.00 H new ATOM 0 HZ3 LYS B1901 -19.060 -8.377 19.449 1.00 0.00 H new ATOM 1168 N ARG B1902 -13.530 -5.698 17.275 1.00 0.00 N ATOM 1169 CA ARG B1902 -13.251 -4.639 16.313 1.00 0.00 C ATOM 1170 C ARG B1902 -12.402 -5.163 15.160 1.00 0.00 C ATOM 1171 O ARG B1902 -11.294 -5.658 15.368 1.00 0.00 O ATOM 1172 CB ARG B1902 -12.538 -3.473 17.001 1.00 0.00 C ATOM 1173 CG ARG B1902 -12.980 -2.107 16.498 1.00 0.00 C ATOM 1174 CD ARG B1902 -12.436 -0.987 17.372 1.00 0.00 C ATOM 1175 NE ARG B1902 -13.438 0.048 17.622 1.00 0.00 N ATOM 1176 CZ ARG B1902 -13.370 0.929 18.621 1.00 0.00 C ATOM 1177 NH1 ARG B1902 -12.348 0.911 19.471 1.00 0.00 N1+ ATOM 1178 NH2 ARG B1902 -14.328 1.833 18.771 1.00 0.00 N ATOM 0 H ARG B1902 -12.753 -5.915 17.900 1.00 0.00 H new ATOM 0 HA ARG B1902 -14.200 -4.287 15.909 1.00 0.00 H new ATOM 0 HB2 ARG B1902 -12.717 -3.531 18.075 1.00 0.00 H new ATOM 0 HB3 ARG B1902 -11.463 -3.576 16.851 1.00 0.00 H new ATOM 0 HG2 ARG B1902 -12.638 -1.968 15.472 1.00 0.00 H new ATOM 0 HG3 ARG B1902 -14.069 -2.060 16.480 1.00 0.00 H new ATOM 0 HD2 ARG B1902 -12.097 -1.400 18.322 1.00 0.00 H new ATOM 0 HD3 ARG B1902 -11.566 -0.541 16.890 1.00 0.00 H new ATOM 0 HE ARG B1902 -14.239 0.100 16.993 1.00 0.00 H new ATOM 0 HH11 ARG B1902 -11.606 0.219 19.362 1.00 0.00 H new ATOM 0 HH12 ARG B1902 -12.305 1.589 20.232 1.00 0.00 H new ATOM 0 HH21 ARG B1902 -15.115 1.854 18.123 1.00 0.00 H new ATOM 0 HH22 ARG B1902 -14.278 2.508 19.534 1.00 0.00 H new ATOM 1192 N LYS B1903 -12.930 -5.055 13.945 1.00 0.00 N ATOM 1193 CA LYS B1903 -12.219 -5.520 12.759 1.00 0.00 C ATOM 1194 C LYS B1903 -12.123 -4.413 11.710 1.00 0.00 C ATOM 1195 O LYS B1903 -12.736 -4.493 10.644 1.00 0.00 O ATOM 1196 CB LYS B1903 -12.920 -6.747 12.169 1.00 0.00 C ATOM 1197 CG LYS B1903 -11.968 -7.734 11.512 1.00 0.00 C ATOM 1198 CD LYS B1903 -11.641 -8.897 12.436 1.00 0.00 C ATOM 1199 CE LYS B1903 -10.276 -8.727 13.085 1.00 0.00 C ATOM 1200 NZ LYS B1903 -9.614 -10.037 13.337 1.00 0.00 N1+ ATOM 0 H LYS B1903 -13.847 -4.650 13.756 1.00 0.00 H new ATOM 0 HA LYS B1903 -11.207 -5.797 13.056 1.00 0.00 H new ATOM 0 HB2 LYS B1903 -13.470 -7.257 12.960 1.00 0.00 H new ATOM 0 HB3 LYS B1903 -13.653 -6.417 11.433 1.00 0.00 H new ATOM 0 HG2 LYS B1903 -12.414 -8.113 10.593 1.00 0.00 H new ATOM 0 HG3 LYS B1903 -11.048 -7.221 11.232 1.00 0.00 H new ATOM 0 HD2 LYS B1903 -12.405 -8.975 13.209 1.00 0.00 H new ATOM 0 HD3 LYS B1903 -11.663 -9.829 11.871 1.00 0.00 H new ATOM 0 HE2 LYS B1903 -9.642 -8.117 12.442 1.00 0.00 H new ATOM 0 HE3 LYS B1903 -10.386 -8.189 14.026 1.00 0.00 H new ATOM 0 HZ1 LYS B1903 -8.687 -9.878 13.780 1.00 0.00 H new ATOM 0 HZ2 LYS B1903 -10.207 -10.609 13.971 1.00 0.00 H new ATOM 0 HZ3 LYS B1903 -9.485 -10.540 12.436 1.00 0.00 H new ATOM 1214 N GLN B1904 -11.349 -3.376 12.023 1.00 0.00 N ATOM 1215 CA GLN B1904 -11.166 -2.249 11.111 1.00 0.00 C ATOM 1216 C GLN B1904 -10.034 -2.495 10.106 1.00 0.00 C ATOM 1217 O GLN B1904 -9.557 -1.555 9.466 1.00 0.00 O ATOM 1218 CB GLN B1904 -10.886 -0.971 11.905 1.00 0.00 C ATOM 1219 CG GLN B1904 -9.570 -1.000 12.662 1.00 0.00 C ATOM 1220 CD GLN B1904 -8.455 -0.288 11.921 1.00 0.00 C ATOM 1221 OE1 GLN B1904 -7.638 -1.051 11.205 1.00 0.00 O flip ATOM 1222 NE2 GLN B1904 -8.331 0.935 11.989 1.00 0.00 N flip ATOM 0 H GLN B1904 -10.838 -3.293 12.902 1.00 0.00 H new ATOM 0 HA GLN B1904 -12.090 -2.137 10.545 1.00 0.00 H new ATOM 0 HB2 GLN B1904 -10.883 -0.122 11.221 1.00 0.00 H new ATOM 0 HB3 GLN B1904 -11.699 -0.808 12.613 1.00 0.00 H new ATOM 0 HG2 GLN B1904 -9.707 -0.536 13.639 1.00 0.00 H new ATOM 0 HG3 GLN B1904 -9.280 -2.036 12.839 1.00 0.00 H new ATOM 0 HE21 GLN B1904 -8.982 1.483 12.551 1.00 0.00 H new ATOM 0 HE22 GLN B1904 -7.577 1.400 11.483 1.00 0.00 H new ATOM 1231 N GLU B1905 -9.599 -3.749 9.966 1.00 0.00 N ATOM 1232 CA GLU B1905 -8.522 -4.089 9.037 1.00 0.00 C ATOM 1233 C GLU B1905 -8.836 -3.606 7.623 1.00 0.00 C ATOM 1234 O GLU B1905 -7.965 -3.084 6.929 1.00 0.00 O ATOM 1235 CB GLU B1905 -8.289 -5.601 9.028 1.00 0.00 C ATOM 1236 CG GLU B1905 -7.463 -6.097 10.204 1.00 0.00 C ATOM 1237 CD GLU B1905 -6.819 -7.443 9.935 1.00 0.00 C ATOM 1238 OE1 GLU B1905 -7.319 -8.176 9.056 1.00 0.00 O ATOM 1239 OE2 GLU B1905 -5.814 -7.764 10.603 1.00 0.00 O1- ATOM 0 H GLU B1905 -9.976 -4.543 10.483 1.00 0.00 H new ATOM 0 HA GLU B1905 -7.617 -3.585 9.377 1.00 0.00 H new ATOM 0 HB2 GLU B1905 -9.254 -6.109 9.032 1.00 0.00 H new ATOM 0 HB3 GLU B1905 -7.788 -5.877 8.100 1.00 0.00 H new ATOM 0 HG2 GLU B1905 -6.687 -5.366 10.433 1.00 0.00 H new ATOM 0 HG3 GLU B1905 -8.100 -6.172 11.085 1.00 0.00 H new ATOM 1246 N GLU B1906 -10.086 -3.782 7.204 1.00 0.00 N ATOM 1247 CA GLU B1906 -10.508 -3.361 5.873 1.00 0.00 C ATOM 1248 C GLU B1906 -10.290 -1.864 5.679 1.00 0.00 C ATOM 1249 O GLU B1906 -9.746 -1.437 4.662 1.00 0.00 O ATOM 1250 CB GLU B1906 -11.978 -3.713 5.639 1.00 0.00 C ATOM 1251 CG GLU B1906 -12.927 -3.063 6.632 1.00 0.00 C ATOM 1252 CD GLU B1906 -14.210 -3.852 6.815 1.00 0.00 C ATOM 1253 OE1 GLU B1906 -14.172 -5.090 6.657 1.00 0.00 O1- ATOM 1254 OE2 GLU B1906 -15.251 -3.231 7.114 1.00 0.00 O ATOM 0 H GLU B1906 -10.821 -4.212 7.765 1.00 0.00 H new ATOM 0 HA GLU B1906 -9.898 -3.895 5.144 1.00 0.00 H new ATOM 0 HB2 GLU B1906 -12.259 -3.411 4.630 1.00 0.00 H new ATOM 0 HB3 GLU B1906 -12.096 -4.795 5.692 1.00 0.00 H new ATOM 0 HG2 GLU B1906 -12.426 -2.962 7.595 1.00 0.00 H new ATOM 0 HG3 GLU B1906 -13.169 -2.056 6.292 1.00 0.00 H new ATOM 1261 N VAL B1907 -10.711 -1.069 6.667 1.00 0.00 N ATOM 1262 CA VAL B1907 -10.557 0.387 6.609 1.00 0.00 C ATOM 1263 C VAL B1907 -9.118 0.779 6.276 1.00 0.00 C ATOM 1264 O VAL B1907 -8.871 1.555 5.347 1.00 0.00 O ATOM 1265 CB VAL B1907 -10.960 1.046 7.942 1.00 0.00 C ATOM 1266 CG1 VAL B1907 -10.981 2.560 7.805 1.00 0.00 C ATOM 1267 CG2 VAL B1907 -12.312 0.526 8.408 1.00 0.00 C ATOM 0 H VAL B1907 -11.161 -1.410 7.517 1.00 0.00 H new ATOM 0 HA VAL B1907 -11.218 0.743 5.819 1.00 0.00 H new ATOM 0 HB VAL B1907 -10.217 0.783 8.695 1.00 0.00 H new ATOM 0 HG11 VAL B1907 -11.268 3.007 8.757 1.00 0.00 H new ATOM 0 HG12 VAL B1907 -9.990 2.914 7.522 1.00 0.00 H new ATOM 0 HG13 VAL B1907 -11.701 2.846 7.038 1.00 0.00 H new ATOM 0 HG21 VAL B1907 -12.580 1.003 9.351 1.00 0.00 H new ATOM 0 HG22 VAL B1907 -13.068 0.756 7.658 1.00 0.00 H new ATOM 0 HG23 VAL B1907 -12.257 -0.553 8.550 1.00 0.00 H new ATOM 1277 N SER B1908 -8.171 0.223 7.028 1.00 0.00 N ATOM 1278 CA SER B1908 -6.757 0.500 6.799 1.00 0.00 C ATOM 1279 C SER B1908 -6.365 0.112 5.376 1.00 0.00 C ATOM 1280 O SER B1908 -5.471 0.710 4.779 1.00 0.00 O ATOM 1281 CB SER B1908 -5.893 -0.262 7.808 1.00 0.00 C ATOM 1282 OG SER B1908 -5.574 0.553 8.924 1.00 0.00 O ATOM 0 H SER B1908 -8.357 -0.419 7.798 1.00 0.00 H new ATOM 0 HA SER B1908 -6.589 1.569 6.931 1.00 0.00 H new ATOM 0 HB2 SER B1908 -6.422 -1.154 8.144 1.00 0.00 H new ATOM 0 HB3 SER B1908 -4.976 -0.598 7.325 1.00 0.00 H new ATOM 0 HG SER B1908 -6.400 0.837 9.368 1.00 0.00 H new ATOM 1288 N ALA B1909 -7.055 -0.890 4.833 1.00 0.00 N ATOM 1289 CA ALA B1909 -6.794 -1.350 3.478 1.00 0.00 C ATOM 1290 C ALA B1909 -7.336 -0.358 2.448 1.00 0.00 C ATOM 1291 O ALA B1909 -6.855 -0.306 1.317 1.00 0.00 O ATOM 1292 CB ALA B1909 -7.400 -2.730 3.267 1.00 0.00 C ATOM 0 H ALA B1909 -7.798 -1.396 5.314 1.00 0.00 H new ATOM 0 HA ALA B1909 -5.715 -1.417 3.340 1.00 0.00 H new ATOM 0 HB1 ALA B1909 -7.198 -3.064 2.249 1.00 0.00 H new ATOM 0 HB2 ALA B1909 -6.959 -3.433 3.974 1.00 0.00 H new ATOM 0 HB3 ALA B1909 -8.477 -2.683 3.427 1.00 0.00 H new ATOM 1298 N ILE B1910 -8.332 0.436 2.847 1.00 0.00 N ATOM 1299 CA ILE B1910 -8.915 1.428 1.950 1.00 0.00 C ATOM 1300 C ILE B1910 -7.932 2.567 1.700 1.00 0.00 C ATOM 1301 O ILE B1910 -7.650 2.913 0.552 1.00 0.00 O ATOM 1302 CB ILE B1910 -10.230 2.012 2.512 1.00 0.00 C ATOM 1303 CG1 ILE B1910 -11.191 0.886 2.900 1.00 0.00 C ATOM 1304 CG2 ILE B1910 -10.880 2.939 1.494 1.00 0.00 C ATOM 1305 CD1 ILE B1910 -12.512 1.378 3.454 1.00 0.00 C ATOM 0 H ILE B1910 -8.747 0.410 3.778 1.00 0.00 H new ATOM 0 HA ILE B1910 -9.137 0.916 1.013 1.00 0.00 H new ATOM 0 HB ILE B1910 -9.996 2.591 3.405 1.00 0.00 H new ATOM 0 HG12 ILE B1910 -11.383 0.266 2.024 1.00 0.00 H new ATOM 0 HG13 ILE B1910 -10.710 0.249 3.643 1.00 0.00 H new ATOM 0 HG21 ILE B1910 -11.805 3.341 1.907 1.00 0.00 H new ATOM 0 HG22 ILE B1910 -10.200 3.758 1.262 1.00 0.00 H new ATOM 0 HG23 ILE B1910 -11.101 2.382 0.584 1.00 0.00 H new ATOM 0 HD11 ILE B1910 -13.141 0.524 3.707 1.00 0.00 H new ATOM 0 HD12 ILE B1910 -12.332 1.974 4.349 1.00 0.00 H new ATOM 0 HD13 ILE B1910 -13.015 1.990 2.706 1.00 0.00 H new ATOM 1317 N VAL B1911 -7.409 3.145 2.779 1.00 0.00 N ATOM 1318 CA VAL B1911 -6.454 4.242 2.659 1.00 0.00 C ATOM 1319 C VAL B1911 -5.218 3.802 1.878 1.00 0.00 C ATOM 1320 O VAL B1911 -4.713 4.539 1.030 1.00 0.00 O ATOM 1321 CB VAL B1911 -6.020 4.786 4.039 1.00 0.00 C ATOM 1322 CG1 VAL B1911 -5.332 3.704 4.858 1.00 0.00 C ATOM 1323 CG2 VAL B1911 -5.112 5.999 3.877 1.00 0.00 C ATOM 0 H VAL B1911 -7.628 2.875 3.738 1.00 0.00 H new ATOM 0 HA VAL B1911 -6.961 5.042 2.120 1.00 0.00 H new ATOM 0 HB VAL B1911 -6.915 5.098 4.577 1.00 0.00 H new ATOM 0 HG11 VAL B1911 -5.036 4.112 5.825 1.00 0.00 H new ATOM 0 HG12 VAL B1911 -6.019 2.871 5.010 1.00 0.00 H new ATOM 0 HG13 VAL B1911 -4.448 3.353 4.327 1.00 0.00 H new ATOM 0 HG21 VAL B1911 -4.818 6.367 4.860 1.00 0.00 H new ATOM 0 HG22 VAL B1911 -4.223 5.715 3.314 1.00 0.00 H new ATOM 0 HG23 VAL B1911 -5.645 6.784 3.341 1.00 0.00 H new ATOM 1333 N ILE B1912 -4.739 2.595 2.162 1.00 0.00 N ATOM 1334 CA ILE B1912 -3.569 2.067 1.476 1.00 0.00 C ATOM 1335 C ILE B1912 -3.842 1.961 -0.028 1.00 0.00 C ATOM 1336 O ILE B1912 -2.944 2.140 -0.850 1.00 0.00 O ATOM 1337 CB ILE B1912 -3.118 0.705 2.092 1.00 0.00 C ATOM 1338 CG1 ILE B1912 -1.595 0.630 2.133 1.00 0.00 C ATOM 1339 CG2 ILE B1912 -3.686 -0.508 1.358 1.00 0.00 C ATOM 1340 CD1 ILE B1912 -1.069 -0.455 3.047 1.00 0.00 C ATOM 0 H ILE B1912 -5.142 1.968 2.859 1.00 0.00 H new ATOM 0 HA ILE B1912 -2.739 2.760 1.615 1.00 0.00 H new ATOM 0 HB ILE B1912 -3.521 0.670 3.104 1.00 0.00 H new ATOM 0 HG12 ILE B1912 -1.220 0.458 1.124 1.00 0.00 H new ATOM 0 HG13 ILE B1912 -1.200 1.592 2.459 1.00 0.00 H new ATOM 0 HG21 ILE B1912 -3.333 -1.421 1.837 1.00 0.00 H new ATOM 0 HG22 ILE B1912 -4.775 -0.477 1.393 1.00 0.00 H new ATOM 0 HG23 ILE B1912 -3.355 -0.492 0.319 1.00 0.00 H new ATOM 0 HD11 ILE B1912 0.021 -0.451 3.027 1.00 0.00 H new ATOM 0 HD12 ILE B1912 -1.414 -0.272 4.065 1.00 0.00 H new ATOM 0 HD13 ILE B1912 -1.434 -1.425 2.709 1.00 0.00 H new ATOM 1352 N GLN B1913 -5.100 1.690 -0.370 1.00 0.00 N ATOM 1353 CA GLN B1913 -5.507 1.588 -1.763 1.00 0.00 C ATOM 1354 C GLN B1913 -5.303 2.929 -2.454 1.00 0.00 C ATOM 1355 O GLN B1913 -4.885 2.995 -3.612 1.00 0.00 O ATOM 1356 CB GLN B1913 -6.974 1.157 -1.859 1.00 0.00 C ATOM 1357 CG GLN B1913 -7.239 0.141 -2.956 1.00 0.00 C ATOM 1358 CD GLN B1913 -8.551 -0.595 -2.765 1.00 0.00 C ATOM 1359 OE1 GLN B1913 -9.625 -0.050 -3.018 1.00 0.00 O ATOM 1360 NE2 GLN B1913 -8.471 -1.842 -2.314 1.00 0.00 N ATOM 0 H GLN B1913 -5.853 1.538 0.301 1.00 0.00 H new ATOM 0 HA GLN B1913 -4.895 0.835 -2.259 1.00 0.00 H new ATOM 0 HB2 GLN B1913 -7.283 0.735 -0.903 1.00 0.00 H new ATOM 0 HB3 GLN B1913 -7.592 2.038 -2.034 1.00 0.00 H new ATOM 0 HG2 GLN B1913 -7.248 0.648 -3.921 1.00 0.00 H new ATOM 0 HG3 GLN B1913 -6.422 -0.581 -2.983 1.00 0.00 H new ATOM 0 HE21 GLN B1913 -7.560 -2.256 -2.117 1.00 0.00 H new ATOM 0 HE22 GLN B1913 -9.321 -2.386 -2.165 1.00 0.00 H new ATOM 1369 N ARG B1914 -5.584 4.001 -1.719 1.00 0.00 N ATOM 1370 CA ARG B1914 -5.419 5.349 -2.239 1.00 0.00 C ATOM 1371 C ARG B1914 -3.951 5.607 -2.561 1.00 0.00 C ATOM 1372 O ARG B1914 -3.625 6.294 -3.528 1.00 0.00 O ATOM 1373 CB ARG B1914 -5.929 6.377 -1.226 1.00 0.00 C ATOM 1374 CG ARG B1914 -6.729 7.507 -1.856 1.00 0.00 C ATOM 1375 CD ARG B1914 -7.550 8.255 -0.817 1.00 0.00 C ATOM 1376 NE ARG B1914 -8.615 7.424 -0.257 1.00 0.00 N ATOM 1377 CZ ARG B1914 -9.432 7.815 0.722 1.00 0.00 C ATOM 1378 NH1 ARG B1914 -9.314 9.024 1.260 1.00 0.00 N1+ ATOM 1379 NH2 ARG B1914 -10.372 6.991 1.166 1.00 0.00 N ATOM 0 H ARG B1914 -5.928 3.959 -0.760 1.00 0.00 H new ATOM 0 HA ARG B1914 -6.003 5.447 -3.154 1.00 0.00 H new ATOM 0 HB2 ARG B1914 -6.551 5.870 -0.488 1.00 0.00 H new ATOM 0 HB3 ARG B1914 -5.079 6.799 -0.690 1.00 0.00 H new ATOM 0 HG2 ARG B1914 -6.051 8.200 -2.354 1.00 0.00 H new ATOM 0 HG3 ARG B1914 -7.391 7.103 -2.622 1.00 0.00 H new ATOM 0 HD2 ARG B1914 -6.896 8.595 -0.014 1.00 0.00 H new ATOM 0 HD3 ARG B1914 -7.986 9.145 -1.271 1.00 0.00 H new ATOM 0 HE ARG B1914 -8.741 6.487 -0.639 1.00 0.00 H new ATOM 0 HH11 ARG B1914 -8.593 9.663 0.925 1.00 0.00 H new ATOM 0 HH12 ARG B1914 -9.944 9.313 2.008 1.00 0.00 H new ATOM 0 HH21 ARG B1914 -10.469 6.061 0.759 1.00 0.00 H new ATOM 0 HH22 ARG B1914 -10.998 7.288 1.915 1.00 0.00 H new ATOM 1393 N ALA B1915 -3.069 5.036 -1.743 1.00 0.00 N ATOM 1394 CA ALA B1915 -1.634 5.189 -1.940 1.00 0.00 C ATOM 1395 C ALA B1915 -1.216 4.618 -3.289 1.00 0.00 C ATOM 1396 O ALA B1915 -0.412 5.215 -4.006 1.00 0.00 O ATOM 1397 CB ALA B1915 -0.870 4.510 -0.814 1.00 0.00 C ATOM 0 H ALA B1915 -3.325 4.464 -0.938 1.00 0.00 H new ATOM 0 HA ALA B1915 -1.395 6.252 -1.929 1.00 0.00 H new ATOM 0 HB1 ALA B1915 0.201 4.633 -0.975 1.00 0.00 H new ATOM 0 HB2 ALA B1915 -1.148 4.962 0.138 1.00 0.00 H new ATOM 0 HB3 ALA B1915 -1.115 3.448 -0.797 1.00 0.00 H new ATOM 1403 N TYR B1916 -1.777 3.461 -3.635 1.00 0.00 N ATOM 1404 CA TYR B1916 -1.473 2.811 -4.904 1.00 0.00 C ATOM 1405 C TYR B1916 -1.846 3.721 -6.069 1.00 0.00 C ATOM 1406 O TYR B1916 -1.114 3.819 -7.054 1.00 0.00 O ATOM 1407 CB TYR B1916 -2.220 1.479 -5.018 1.00 0.00 C ATOM 1408 CG TYR B1916 -1.917 0.510 -3.897 1.00 0.00 C ATOM 1409 CD1 TYR B1916 -0.624 0.358 -3.410 1.00 0.00 C ATOM 1410 CD2 TYR B1916 -2.927 -0.254 -3.324 1.00 0.00 C ATOM 1411 CE1 TYR B1916 -0.347 -0.527 -2.386 1.00 0.00 C ATOM 1412 CE2 TYR B1916 -2.657 -1.140 -2.298 1.00 0.00 C ATOM 1413 CZ TYR B1916 -1.366 -1.274 -1.833 1.00 0.00 C ATOM 1414 OH TYR B1916 -1.095 -2.155 -0.811 1.00 0.00 O ATOM 0 H TYR B1916 -2.445 2.956 -3.053 1.00 0.00 H new ATOM 0 HA TYR B1916 -0.402 2.614 -4.940 1.00 0.00 H new ATOM 0 HB2 TYR B1916 -3.292 1.675 -5.036 1.00 0.00 H new ATOM 0 HB3 TYR B1916 -1.965 1.011 -5.969 1.00 0.00 H new ATOM 0 HD1 TYR B1916 0.177 0.941 -3.839 1.00 0.00 H new ATOM 0 HD2 TYR B1916 -3.939 -0.154 -3.686 1.00 0.00 H new ATOM 0 HE1 TYR B1916 0.663 -0.633 -2.020 1.00 0.00 H new ATOM 0 HE2 TYR B1916 -3.454 -1.725 -1.863 1.00 0.00 H new ATOM 0 HH TYR B1916 -1.933 -2.541 -0.481 1.00 0.00 H new ATOM 1424 N ARG B1917 -2.988 4.396 -5.945 1.00 0.00 N ATOM 1425 CA ARG B1917 -3.451 5.309 -6.983 1.00 0.00 C ATOM 1426 C ARG B1917 -2.434 6.428 -7.191 1.00 0.00 C ATOM 1427 O ARG B1917 -2.112 6.787 -8.324 1.00 0.00 O ATOM 1428 CB ARG B1917 -4.812 5.901 -6.610 1.00 0.00 C ATOM 1429 CG ARG B1917 -5.899 4.854 -6.420 1.00 0.00 C ATOM 1430 CD ARG B1917 -7.229 5.486 -6.031 1.00 0.00 C ATOM 1431 NE ARG B1917 -7.862 4.784 -4.916 1.00 0.00 N ATOM 1432 CZ ARG B1917 -9.153 4.894 -4.601 1.00 0.00 C ATOM 1433 NH1 ARG B1917 -9.962 5.670 -5.315 1.00 0.00 N1+ ATOM 1434 NH2 ARG B1917 -9.638 4.220 -3.566 1.00 0.00 N ATOM 0 H ARG B1917 -3.607 4.327 -5.137 1.00 0.00 H new ATOM 0 HA ARG B1917 -3.558 4.749 -7.912 1.00 0.00 H new ATOM 0 HB2 ARG B1917 -4.709 6.477 -5.690 1.00 0.00 H new ATOM 0 HB3 ARG B1917 -5.122 6.597 -7.389 1.00 0.00 H new ATOM 0 HG2 ARG B1917 -6.022 4.286 -7.342 1.00 0.00 H new ATOM 0 HG3 ARG B1917 -5.593 4.147 -5.649 1.00 0.00 H new ATOM 0 HD2 ARG B1917 -7.069 6.529 -5.759 1.00 0.00 H new ATOM 0 HD3 ARG B1917 -7.899 5.480 -6.891 1.00 0.00 H new ATOM 0 HE ARG B1917 -7.280 4.172 -4.344 1.00 0.00 H new ATOM 0 HH11 ARG B1917 -9.597 6.189 -6.113 1.00 0.00 H new ATOM 0 HH12 ARG B1917 -10.948 5.746 -5.064 1.00 0.00 H new ATOM 0 HH21 ARG B1917 -9.024 3.621 -3.015 1.00 0.00 H new ATOM 0 HH22 ARG B1917 -10.625 4.301 -3.322 1.00 0.00 H new ATOM 1448 N ARG B1918 -1.923 6.961 -6.087 1.00 0.00 N ATOM 1449 CA ARG B1918 -0.930 8.026 -6.141 1.00 0.00 C ATOM 1450 C ARG B1918 0.395 7.486 -6.668 1.00 0.00 C ATOM 1451 O ARG B1918 1.141 8.192 -7.348 1.00 0.00 O ATOM 1452 CB ARG B1918 -0.734 8.637 -4.751 1.00 0.00 C ATOM 1453 CG ARG B1918 -0.536 10.145 -4.767 1.00 0.00 C ATOM 1454 CD ARG B1918 -0.638 10.733 -3.370 1.00 0.00 C ATOM 1455 NE ARG B1918 0.678 10.943 -2.767 1.00 0.00 N ATOM 1456 CZ ARG B1918 1.457 11.994 -3.021 1.00 0.00 C ATOM 1457 NH1 ARG B1918 1.064 12.942 -3.866 1.00 0.00 N1+ ATOM 1458 NH2 ARG B1918 2.638 12.099 -2.427 1.00 0.00 N ATOM 0 H ARG B1918 -2.181 6.672 -5.143 1.00 0.00 H new ATOM 0 HA ARG B1918 -1.287 8.802 -6.819 1.00 0.00 H new ATOM 0 HB2 ARG B1918 -1.601 8.400 -4.134 1.00 0.00 H new ATOM 0 HB3 ARG B1918 0.130 8.171 -4.278 1.00 0.00 H new ATOM 0 HG2 ARG B1918 0.440 10.381 -5.192 1.00 0.00 H new ATOM 0 HG3 ARG B1918 -1.284 10.605 -5.412 1.00 0.00 H new ATOM 0 HD2 ARG B1918 -1.172 11.682 -3.414 1.00 0.00 H new ATOM 0 HD3 ARG B1918 -1.224 10.066 -2.738 1.00 0.00 H new ATOM 0 HE ARG B1918 1.021 10.241 -2.111 1.00 0.00 H new ATOM 0 HH11 ARG B1918 0.157 12.870 -4.328 1.00 0.00 H new ATOM 0 HH12 ARG B1918 1.669 13.742 -4.052 1.00 0.00 H new ATOM 0 HH21 ARG B1918 2.948 11.376 -1.777 1.00 0.00 H new ATOM 0 HH22 ARG B1918 3.236 12.902 -2.620 1.00 0.00 H new ATOM 1472 N TYR B1919 0.674 6.225 -6.354 1.00 0.00 N ATOM 1473 CA TYR B1919 1.899 5.572 -6.797 1.00 0.00 C ATOM 1474 C TYR B1919 1.965 5.541 -8.325 1.00 0.00 C ATOM 1475 O TYR B1919 2.883 6.098 -8.928 1.00 0.00 O ATOM 1476 CB TYR B1919 1.964 4.147 -6.217 1.00 0.00 C ATOM 1477 CG TYR B1919 3.057 3.274 -6.801 1.00 0.00 C ATOM 1478 CD1 TYR B1919 4.352 3.753 -6.955 1.00 0.00 C ATOM 1479 CD2 TYR B1919 2.787 1.971 -7.203 1.00 0.00 C ATOM 1480 CE1 TYR B1919 5.348 2.956 -7.490 1.00 0.00 C ATOM 1481 CE2 TYR B1919 3.777 1.170 -7.739 1.00 0.00 C ATOM 1482 CZ TYR B1919 5.054 1.667 -7.881 1.00 0.00 C ATOM 1483 OH TYR B1919 6.041 0.871 -8.417 1.00 0.00 O ATOM 0 H TYR B1919 0.064 5.633 -5.791 1.00 0.00 H new ATOM 0 HA TYR B1919 2.758 6.138 -6.435 1.00 0.00 H new ATOM 0 HB2 TYR B1919 2.109 4.215 -5.139 1.00 0.00 H new ATOM 0 HB3 TYR B1919 1.003 3.659 -6.379 1.00 0.00 H new ATOM 0 HD1 TYR B1919 4.585 4.763 -6.652 1.00 0.00 H new ATOM 0 HD2 TYR B1919 1.787 1.578 -7.095 1.00 0.00 H new ATOM 0 HE1 TYR B1919 6.351 3.341 -7.601 1.00 0.00 H new ATOM 0 HE2 TYR B1919 3.551 0.159 -8.045 1.00 0.00 H new ATOM 0 HH TYR B1919 5.668 -0.008 -8.639 1.00 0.00 H new ATOM 1493 N LEU B1920 0.987 4.886 -8.941 1.00 0.00 N ATOM 1494 CA LEU B1920 0.934 4.782 -10.395 1.00 0.00 C ATOM 1495 C LEU B1920 0.804 6.163 -11.035 1.00 0.00 C ATOM 1496 O LEU B1920 1.307 6.396 -12.134 1.00 0.00 O ATOM 1497 CB LEU B1920 -0.237 3.885 -10.817 1.00 0.00 C ATOM 1498 CG LEU B1920 0.150 2.459 -11.209 1.00 0.00 C ATOM 1499 CD1 LEU B1920 0.896 1.773 -10.073 1.00 0.00 C ATOM 1500 CD2 LEU B1920 -1.086 1.659 -11.594 1.00 0.00 C ATOM 0 H LEU B1920 0.220 4.419 -8.457 1.00 0.00 H new ATOM 0 HA LEU B1920 1.865 4.334 -10.742 1.00 0.00 H new ATOM 0 HB2 LEU B1920 -0.953 3.839 -9.997 1.00 0.00 H new ATOM 0 HB3 LEU B1920 -0.747 4.352 -11.660 1.00 0.00 H new ATOM 0 HG LEU B1920 0.813 2.509 -12.073 1.00 0.00 H new ATOM 0 HD11 LEU B1920 1.162 0.759 -10.372 1.00 0.00 H new ATOM 0 HD12 LEU B1920 1.802 2.333 -9.842 1.00 0.00 H new ATOM 0 HD13 LEU B1920 0.258 1.735 -9.190 1.00 0.00 H new ATOM 0 HD21 LEU B1920 -0.792 0.646 -11.870 1.00 0.00 H new ATOM 0 HD22 LEU B1920 -1.772 1.620 -10.748 1.00 0.00 H new ATOM 0 HD23 LEU B1920 -1.580 2.137 -12.440 1.00 0.00 H new ATOM 1512 N LEU B1921 0.125 7.073 -10.344 1.00 0.00 N ATOM 1513 CA LEU B1921 -0.070 8.427 -10.849 1.00 0.00 C ATOM 1514 C LEU B1921 1.250 9.196 -10.869 1.00 0.00 C ATOM 1515 O LEU B1921 2.310 8.637 -10.592 1.00 0.00 O ATOM 1516 CB LEU B1921 -1.104 9.168 -9.995 1.00 0.00 C ATOM 1517 CG LEU B1921 -2.526 9.175 -10.561 1.00 0.00 C ATOM 1518 CD1 LEU B1921 -2.575 9.945 -11.872 1.00 0.00 C ATOM 1519 CD2 LEU B1921 -3.028 7.752 -10.756 1.00 0.00 C ATOM 0 H LEU B1921 -0.299 6.897 -9.433 1.00 0.00 H new ATOM 0 HA LEU B1921 -0.441 8.360 -11.872 1.00 0.00 H new ATOM 0 HB2 LEU B1921 -1.126 8.715 -9.004 1.00 0.00 H new ATOM 0 HB3 LEU B1921 -0.775 10.199 -9.867 1.00 0.00 H new ATOM 0 HG LEU B1921 -3.180 9.675 -9.846 1.00 0.00 H new ATOM 0 HD11 LEU B1921 -3.594 9.939 -12.259 1.00 0.00 H new ATOM 0 HD12 LEU B1921 -2.257 10.974 -11.702 1.00 0.00 H new ATOM 0 HD13 LEU B1921 -1.909 9.475 -12.595 1.00 0.00 H new ATOM 0 HD21 LEU B1921 -4.040 7.775 -11.159 1.00 0.00 H new ATOM 0 HD22 LEU B1921 -2.373 7.227 -11.451 1.00 0.00 H new ATOM 0 HD23 LEU B1921 -3.031 7.233 -9.798 1.00 0.00 H new ATOM 1531 N LYS B1922 1.174 10.481 -11.199 1.00 0.00 N ATOM 1532 CA LYS B1922 2.362 11.328 -11.255 1.00 0.00 C ATOM 1533 C LYS B1922 1.984 12.778 -11.546 1.00 0.00 C ATOM 1534 O LYS B1922 2.555 13.705 -10.972 1.00 0.00 O ATOM 1535 CB LYS B1922 3.331 10.816 -12.324 1.00 0.00 C ATOM 1536 CG LYS B1922 2.651 10.425 -13.630 1.00 0.00 C ATOM 1537 CD LYS B1922 2.899 8.967 -13.985 1.00 0.00 C ATOM 1538 CE LYS B1922 3.132 8.787 -15.476 1.00 0.00 C ATOM 1539 NZ LYS B1922 4.163 7.750 -15.757 1.00 0.00 N1+ ATOM 0 H LYS B1922 0.304 10.959 -11.432 1.00 0.00 H new ATOM 0 HA LYS B1922 2.852 11.288 -10.282 1.00 0.00 H new ATOM 0 HB2 LYS B1922 4.074 11.587 -12.528 1.00 0.00 H new ATOM 0 HB3 LYS B1922 3.868 9.952 -11.931 1.00 0.00 H new ATOM 0 HG2 LYS B1922 1.578 10.601 -13.548 1.00 0.00 H new ATOM 0 HG3 LYS B1922 3.018 11.062 -14.435 1.00 0.00 H new ATOM 0 HD2 LYS B1922 3.765 8.600 -13.434 1.00 0.00 H new ATOM 0 HD3 LYS B1922 2.045 8.366 -13.674 1.00 0.00 H new ATOM 0 HE2 LYS B1922 2.195 8.507 -15.958 1.00 0.00 H new ATOM 0 HE3 LYS B1922 3.444 9.736 -15.912 1.00 0.00 H new ATOM 0 HZ1 LYS B1922 4.292 7.658 -16.785 1.00 0.00 H new ATOM 0 HZ2 LYS B1922 5.064 8.029 -15.319 1.00 0.00 H new ATOM 0 HZ3 LYS B1922 3.854 6.838 -15.364 1.00 0.00 H new ATOM 1553 N GLN B1923 1.018 12.968 -12.441 1.00 0.00 N ATOM 1554 CA GLN B1923 0.563 14.305 -12.807 1.00 0.00 C ATOM 1555 C GLN B1923 1.690 15.107 -13.450 1.00 0.00 C ATOM 1556 O GLN B1923 2.852 14.701 -13.417 1.00 0.00 O ATOM 1557 CB GLN B1923 0.031 15.045 -11.577 1.00 0.00 C ATOM 1558 CG GLN B1923 -1.141 14.345 -10.907 1.00 0.00 C ATOM 1559 CD GLN B1923 -0.750 13.658 -9.612 1.00 0.00 C ATOM 1560 OE1 GLN B1923 -0.370 12.487 -9.608 1.00 0.00 O ATOM 1561 NE2 GLN B1923 -0.841 14.386 -8.506 1.00 0.00 N ATOM 0 H GLN B1923 0.535 12.212 -12.926 1.00 0.00 H new ATOM 0 HA GLN B1923 -0.243 14.199 -13.533 1.00 0.00 H new ATOM 0 HB2 GLN B1923 0.838 15.158 -10.853 1.00 0.00 H new ATOM 0 HB3 GLN B1923 -0.276 16.049 -11.871 1.00 0.00 H new ATOM 0 HG2 GLN B1923 -1.926 15.073 -10.704 1.00 0.00 H new ATOM 0 HG3 GLN B1923 -1.559 13.608 -11.593 1.00 0.00 H new ATOM 0 HE21 GLN B1923 -1.161 15.353 -8.557 1.00 0.00 H new ATOM 0 HE22 GLN B1923 -0.591 13.978 -7.605 1.00 0.00 H new ATOM 1570 N LYS B1924 1.338 16.249 -14.033 1.00 0.00 N ATOM 1571 CA LYS B1924 2.320 17.108 -14.686 1.00 0.00 C ATOM 1572 C LYS B1924 2.737 18.253 -13.767 1.00 0.00 C ATOM 1573 O LYS B1924 2.966 19.374 -14.222 1.00 0.00 O ATOM 1574 CB LYS B1924 1.750 17.667 -15.991 1.00 0.00 C ATOM 1575 CG LYS B1924 0.363 18.269 -15.841 1.00 0.00 C ATOM 1576 CD LYS B1924 -0.037 19.064 -17.073 1.00 0.00 C ATOM 1577 CE LYS B1924 -1.473 19.551 -16.981 1.00 0.00 C ATOM 1578 NZ LYS B1924 -1.621 20.667 -16.006 1.00 0.00 N1+ ATOM 0 H LYS B1924 0.381 16.601 -14.067 1.00 0.00 H new ATOM 0 HA LYS B1924 3.201 16.507 -14.910 1.00 0.00 H new ATOM 0 HB2 LYS B1924 2.428 18.429 -16.377 1.00 0.00 H new ATOM 0 HB3 LYS B1924 1.712 16.869 -16.732 1.00 0.00 H new ATOM 0 HG2 LYS B1924 -0.363 17.474 -15.668 1.00 0.00 H new ATOM 0 HG3 LYS B1924 0.340 18.917 -14.965 1.00 0.00 H new ATOM 0 HD2 LYS B1924 0.631 19.918 -17.189 1.00 0.00 H new ATOM 0 HD3 LYS B1924 0.081 18.444 -17.961 1.00 0.00 H new ATOM 0 HE2 LYS B1924 -1.808 19.882 -17.964 1.00 0.00 H new ATOM 0 HE3 LYS B1924 -2.118 18.724 -16.686 1.00 0.00 H new ATOM 0 HZ1 LYS B1924 -2.615 20.970 -15.973 1.00 0.00 H new ATOM 0 HZ2 LYS B1924 -1.326 20.345 -15.062 1.00 0.00 H new ATOM 0 HZ3 LYS B1924 -1.025 21.467 -16.301 1.00 0.00 H new ATOM 1592 N VAL B1925 2.836 17.963 -12.475 1.00 0.00 N ATOM 1593 CA VAL B1925 3.227 18.968 -11.495 1.00 0.00 C ATOM 1594 C VAL B1925 4.713 19.304 -11.617 1.00 0.00 C ATOM 1595 O VAL B1925 5.573 18.484 -11.293 1.00 0.00 O ATOM 1596 CB VAL B1925 2.921 18.498 -10.055 1.00 0.00 C ATOM 1597 CG1 VAL B1925 3.701 17.234 -9.721 1.00 0.00 C ATOM 1598 CG2 VAL B1925 3.223 19.601 -9.051 1.00 0.00 C ATOM 0 H VAL B1925 2.651 17.040 -12.082 1.00 0.00 H new ATOM 0 HA VAL B1925 2.642 19.864 -11.703 1.00 0.00 H new ATOM 0 HB VAL B1925 1.858 18.266 -9.993 1.00 0.00 H new ATOM 0 HG11 VAL B1925 3.470 16.922 -8.703 1.00 0.00 H new ATOM 0 HG12 VAL B1925 3.423 16.441 -10.415 1.00 0.00 H new ATOM 0 HG13 VAL B1925 4.769 17.433 -9.806 1.00 0.00 H new ATOM 0 HG21 VAL B1925 3.000 19.248 -8.044 1.00 0.00 H new ATOM 0 HG22 VAL B1925 4.277 19.873 -9.115 1.00 0.00 H new ATOM 0 HG23 VAL B1925 2.609 20.474 -9.273 1.00 0.00 H new ATOM 1608 N LYS B1926 5.006 20.512 -12.087 1.00 0.00 N ATOM 1609 CA LYS B1926 6.385 20.954 -12.252 1.00 0.00 C ATOM 1610 C LYS B1926 7.056 21.163 -10.899 1.00 0.00 C ATOM 1611 O LYS B1926 6.466 21.741 -9.986 1.00 0.00 O ATOM 1612 CB LYS B1926 6.434 22.249 -13.065 1.00 0.00 C ATOM 1613 CG LYS B1926 7.845 22.728 -13.361 1.00 0.00 C ATOM 1614 CD LYS B1926 8.544 21.816 -14.356 1.00 0.00 C ATOM 1615 CE LYS B1926 10.050 21.817 -14.149 1.00 0.00 C ATOM 1616 NZ LYS B1926 10.784 21.469 -15.397 1.00 0.00 N1+ ATOM 0 H LYS B1926 4.306 21.202 -12.360 1.00 0.00 H new ATOM 0 HA LYS B1926 6.927 20.176 -12.789 1.00 0.00 H new ATOM 0 HB2 LYS B1926 5.906 22.097 -14.006 1.00 0.00 H new ATOM 0 HB3 LYS B1926 5.901 23.029 -12.522 1.00 0.00 H new ATOM 0 HG2 LYS B1926 7.811 23.743 -13.757 1.00 0.00 H new ATOM 0 HG3 LYS B1926 8.419 22.767 -12.435 1.00 0.00 H new ATOM 0 HD2 LYS B1926 8.162 20.801 -14.251 1.00 0.00 H new ATOM 0 HD3 LYS B1926 8.315 22.140 -15.371 1.00 0.00 H new ATOM 0 HE2 LYS B1926 10.368 22.801 -13.804 1.00 0.00 H new ATOM 0 HE3 LYS B1926 10.309 21.105 -13.365 1.00 0.00 H new ATOM 0 HZ1 LYS B1926 11.807 21.481 -15.213 1.00 0.00 H new ATOM 0 HZ2 LYS B1926 10.500 20.520 -15.713 1.00 0.00 H new ATOM 0 HZ3 LYS B1926 10.558 22.163 -16.138 1.00 0.00 H new ATOM 1630 N LYS B1927 8.293 20.691 -10.777 1.00 0.00 N ATOM 1631 CA LYS B1927 9.045 20.826 -9.534 1.00 0.00 C ATOM 1632 C LYS B1927 10.287 21.687 -9.741 1.00 0.00 C ATOM 1633 O LYS B1927 10.503 22.617 -8.936 1.00 0.00 O ATOM 1634 CB LYS B1927 9.449 19.449 -9.006 1.00 0.00 C ATOM 1635 CG LYS B1927 8.285 18.645 -8.450 1.00 0.00 C ATOM 1636 CD LYS B1927 7.725 17.686 -9.486 1.00 0.00 C ATOM 1637 CE LYS B1927 8.261 16.277 -9.288 1.00 0.00 C ATOM 1638 NZ LYS B1927 7.327 15.433 -8.492 1.00 0.00 N1+ ATOM 1639 OXT LYS B1927 11.034 21.425 -10.708 1.00 0.00 O1- ATOM 0 H LYS B1927 8.796 20.212 -11.524 1.00 0.00 H new ATOM 0 HA LYS B1927 8.403 21.315 -8.801 1.00 0.00 H new ATOM 0 HB2 LYS B1927 9.918 18.884 -9.811 1.00 0.00 H new ATOM 0 HB3 LYS B1927 10.199 19.574 -8.225 1.00 0.00 H new ATOM 0 HG2 LYS B1927 8.614 18.085 -7.575 1.00 0.00 H new ATOM 0 HG3 LYS B1927 7.499 19.323 -8.118 1.00 0.00 H new ATOM 0 HD2 LYS B1927 6.637 17.675 -9.422 1.00 0.00 H new ATOM 0 HD3 LYS B1927 7.982 18.037 -10.485 1.00 0.00 H new ATOM 0 HE2 LYS B1927 8.430 15.813 -10.260 1.00 0.00 H new ATOM 0 HE3 LYS B1927 9.227 16.324 -8.784 1.00 0.00 H new ATOM 0 HZ1 LYS B1927 7.730 14.481 -8.380 1.00 0.00 H new ATOM 0 HZ2 LYS B1927 7.185 15.861 -7.555 1.00 0.00 H new ATOM 0 HZ3 LYS B1927 6.413 15.367 -8.985 1.00 0.00 H new TER 1653 LYS B1927