USER MOD reduce.3.24.130724 H: found=0, std=0, add=615, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 616 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 607 LYS NZ :NH3+ -151:sc= 0.726 (180deg=-1.63!) USER MOD Set 1.2: A 610 GLN : amide:sc= -0.138 K(o=0.59,f=-10!) USER MOD Single : A 552 THR OG1 : rot 180:sc= 0.216 USER MOD Single : A 555 THR OG1 : rot 174:sc= 0.199 USER MOD Single : A 556 THR OG1 : rot 180:sc= 0.0027 USER MOD Single : A 559 GLN : amide:sc= -0.753 K(o=-0.75,f=-1.5) USER MOD Single : A 560 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 564 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 567 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 568 THR OG1 : rot 67:sc= 1.3 USER MOD Single : A 569 TYR OH : rot 180:sc= 0 USER MOD Single : A 572 ASN : amide:sc= -0.0217 K(o=-0.022,f=-2.9!) USER MOD Single : A 573 THR OG1 : rot -150:sc= -0.194 USER MOD Single : A 578 LYS NZ :NH3+ 173:sc= -0.0129 (180deg=-0.13) USER MOD Single : A 579 LYS NZ :NH3+ -137:sc= -0.0443 (180deg=-0.375) USER MOD Single : A 588 THR OG1 : rot -59:sc= 0.176 USER MOD Single : A 589 LYS NZ :NH3+ -152:sc= 0.0903 (180deg=-0.744) USER MOD Single : A 590 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 592 CYS SG : rot 70:sc= 0.689 USER MOD Single : A 593 MET CE :methyl -127:sc= 0 (180deg=-0.668) USER MOD Single : A 594 LYS NZ :NH3+ 175:sc= 0.724 (180deg=0.712) USER MOD Single : A 596 TYR OH : rot 180:sc= 0 USER MOD Single : A 597 LYS NZ :NH3+ -114:sc= 0.698 (180deg=-0.0295) USER MOD Single : A 602 MET CE :methyl -171:sc= -0.0968 (180deg=-0.213) USER MOD Single : A 604 LYS NZ :NH3+ 166:sc= -0.0378 (180deg=-0.252) USER MOD Single : A 606 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 612 GLN : amide:sc= -0.0178 X(o=-0.018,f=-0.21) USER MOD Single : A 615 ASN : amide:sc= -0.0026 X(o=-0.0026,f=0) USER MOD Single : A 617 SER OG : rot -80:sc= 0.832 USER MOD Single : A 620 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 621 LYS NZ :NH3+ -133:sc= -1.26 (180deg=-3.73!) USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 551 0.108 -5.620 0.140 1.00 0.00 N ATOM 2 CA PHE A 551 -0.600 -6.457 1.133 1.00 0.00 C ATOM 3 C PHE A 551 -2.117 -6.212 1.022 1.00 0.00 C ATOM 4 O PHE A 551 -2.561 -5.065 0.925 1.00 0.00 O ATOM 5 CB PHE A 551 -0.094 -6.145 2.574 1.00 0.00 C ATOM 6 CG PHE A 551 -0.707 -7.004 3.696 1.00 0.00 C ATOM 7 CD1 PHE A 551 -0.444 -8.374 3.781 1.00 0.00 C ATOM 8 CD2 PHE A 551 -1.546 -6.445 4.669 1.00 0.00 C ATOM 9 CE1 PHE A 551 -0.987 -9.147 4.796 1.00 0.00 C ATOM 10 CE2 PHE A 551 -2.086 -7.221 5.684 1.00 0.00 C ATOM 11 CZ PHE A 551 -1.810 -8.574 5.744 1.00 0.00 C ATOM 0 HA PHE A 551 -0.394 -7.507 0.927 1.00 0.00 H new ATOM 0 HB2 PHE A 551 0.988 -6.271 2.595 1.00 0.00 H new ATOM 0 HB3 PHE A 551 -0.297 -5.096 2.792 1.00 0.00 H new ATOM 0 HD1 PHE A 551 0.193 -8.839 3.043 1.00 0.00 H new ATOM 0 HD2 PHE A 551 -1.776 -5.391 4.628 1.00 0.00 H new ATOM 0 HE1 PHE A 551 -0.765 -10.203 4.845 1.00 0.00 H new ATOM 0 HE2 PHE A 551 -2.723 -6.767 6.429 1.00 0.00 H new ATOM 0 HZ PHE A 551 -2.237 -9.180 6.529 1.00 0.00 H new ATOM 21 N THR A 552 -2.892 -7.298 1.025 1.00 0.00 N ATOM 22 CA THR A 552 -4.368 -7.262 0.972 1.00 0.00 C ATOM 23 C THR A 552 -4.947 -7.530 2.386 1.00 0.00 C ATOM 24 O THR A 552 -4.193 -7.908 3.287 1.00 0.00 O ATOM 25 CB THR A 552 -4.875 -8.330 -0.066 1.00 0.00 C ATOM 26 OG1 THR A 552 -4.318 -9.619 0.235 1.00 0.00 O ATOM 27 CG2 THR A 552 -4.514 -7.939 -1.512 1.00 0.00 C ATOM 0 H THR A 552 -2.514 -8.244 1.065 1.00 0.00 H new ATOM 0 HA THR A 552 -4.709 -6.278 0.649 1.00 0.00 H new ATOM 0 HB THR A 552 -5.961 -8.370 0.013 1.00 0.00 H new ATOM 0 HG1 THR A 552 -4.642 -10.276 -0.416 1.00 0.00 H new ATOM 0 HG21 THR A 552 -4.882 -8.702 -2.198 1.00 0.00 H new ATOM 0 HG22 THR A 552 -4.973 -6.981 -1.755 1.00 0.00 H new ATOM 0 HG23 THR A 552 -3.431 -7.857 -1.607 1.00 0.00 H new ATOM 35 N PRO A 553 -6.289 -7.316 2.632 1.00 0.00 N ATOM 36 CA PRO A 553 -6.945 -7.759 3.906 1.00 0.00 C ATOM 37 C PRO A 553 -7.050 -9.303 3.977 1.00 0.00 C ATOM 38 O PRO A 553 -6.493 -9.996 3.118 1.00 0.00 O ATOM 39 CB PRO A 553 -8.344 -7.085 3.824 1.00 0.00 C ATOM 40 CG PRO A 553 -8.604 -6.956 2.354 1.00 0.00 C ATOM 41 CD PRO A 553 -7.263 -6.612 1.741 1.00 0.00 C ATOM 0 HA PRO A 553 -6.391 -7.479 4.802 1.00 0.00 H new ATOM 0 HB2 PRO A 553 -9.107 -7.691 4.312 1.00 0.00 H new ATOM 0 HB3 PRO A 553 -8.347 -6.112 4.316 1.00 0.00 H new ATOM 0 HG2 PRO A 553 -8.999 -7.884 1.941 1.00 0.00 H new ATOM 0 HG3 PRO A 553 -9.340 -6.178 2.151 1.00 0.00 H new ATOM 0 HD2 PRO A 553 -7.190 -6.960 0.711 1.00 0.00 H new ATOM 0 HD3 PRO A 553 -7.091 -5.536 1.727 1.00 0.00 H new ATOM 49 N TRP A 554 -7.745 -9.837 5.003 1.00 0.00 N ATOM 50 CA TRP A 554 -7.996 -11.288 5.117 1.00 0.00 C ATOM 51 C TRP A 554 -8.860 -11.770 3.936 1.00 0.00 C ATOM 52 O TRP A 554 -10.094 -11.707 3.972 1.00 0.00 O ATOM 53 CB TRP A 554 -8.638 -11.638 6.492 1.00 0.00 C ATOM 54 CG TRP A 554 -7.633 -11.735 7.625 1.00 0.00 C ATOM 55 CD1 TRP A 554 -7.427 -10.844 8.643 1.00 0.00 C ATOM 56 CD2 TRP A 554 -6.684 -12.803 7.835 1.00 0.00 C ATOM 57 NE1 TRP A 554 -6.422 -11.293 9.466 1.00 0.00 N ATOM 58 CE2 TRP A 554 -5.946 -12.486 8.986 1.00 0.00 C ATOM 59 CE3 TRP A 554 -6.389 -13.993 7.150 1.00 0.00 C ATOM 60 CZ2 TRP A 554 -4.941 -13.315 9.478 1.00 0.00 C ATOM 61 CZ3 TRP A 554 -5.391 -14.817 7.639 1.00 0.00 C ATOM 62 CH2 TRP A 554 -4.672 -14.469 8.791 1.00 0.00 C ATOM 0 H TRP A 554 -8.142 -9.285 5.763 1.00 0.00 H new ATOM 0 HA TRP A 554 -7.043 -11.816 5.071 1.00 0.00 H new ATOM 0 HB2 TRP A 554 -9.381 -10.880 6.740 1.00 0.00 H new ATOM 0 HB3 TRP A 554 -9.168 -12.587 6.405 1.00 0.00 H new ATOM 0 HD1 TRP A 554 -7.974 -9.923 8.780 1.00 0.00 H new ATOM 0 HE1 TRP A 554 -6.084 -10.815 10.301 1.00 0.00 H new ATOM 0 HE3 TRP A 554 -6.932 -14.261 6.256 1.00 0.00 H new ATOM 0 HZ2 TRP A 554 -4.392 -13.057 10.371 1.00 0.00 H new ATOM 0 HZ3 TRP A 554 -5.163 -15.740 7.127 1.00 0.00 H new ATOM 0 HH2 TRP A 554 -3.890 -15.124 9.144 1.00 0.00 H new ATOM 73 N THR A 555 -8.165 -12.188 2.869 1.00 0.00 N ATOM 74 CA THR A 555 -8.774 -12.644 1.618 1.00 0.00 C ATOM 75 C THR A 555 -9.315 -14.074 1.764 1.00 0.00 C ATOM 76 O THR A 555 -8.900 -14.797 2.667 1.00 0.00 O ATOM 77 CB THR A 555 -7.721 -12.581 0.476 1.00 0.00 C ATOM 78 OG1 THR A 555 -6.530 -13.268 0.893 1.00 0.00 O ATOM 79 CG2 THR A 555 -7.373 -11.132 0.087 1.00 0.00 C ATOM 0 H THR A 555 -7.146 -12.218 2.854 1.00 0.00 H new ATOM 0 HA THR A 555 -9.611 -11.990 1.375 1.00 0.00 H new ATOM 0 HB THR A 555 -8.151 -13.061 -0.403 1.00 0.00 H new ATOM 0 HG1 THR A 555 -5.904 -13.323 0.141 1.00 0.00 H new ATOM 0 HG21 THR A 555 -6.634 -11.138 -0.714 1.00 0.00 H new ATOM 0 HG22 THR A 555 -8.273 -10.620 -0.254 1.00 0.00 H new ATOM 0 HG23 THR A 555 -6.965 -10.611 0.953 1.00 0.00 H new ATOM 87 N THR A 556 -10.203 -14.474 0.840 1.00 0.00 N ATOM 88 CA THR A 556 -10.977 -15.719 0.950 1.00 0.00 C ATOM 89 C THR A 556 -10.074 -16.975 1.061 1.00 0.00 C ATOM 90 O THR A 556 -10.359 -17.875 1.859 1.00 0.00 O ATOM 91 CB THR A 556 -11.951 -15.866 -0.262 1.00 0.00 C ATOM 92 OG1 THR A 556 -12.600 -14.607 -0.509 1.00 0.00 O ATOM 93 CG2 THR A 556 -13.025 -16.945 -0.018 1.00 0.00 C ATOM 0 H THR A 556 -10.404 -13.941 -0.006 1.00 0.00 H new ATOM 0 HA THR A 556 -11.552 -15.651 1.874 1.00 0.00 H new ATOM 0 HB THR A 556 -11.358 -16.171 -1.124 1.00 0.00 H new ATOM 0 HG1 THR A 556 -13.210 -14.697 -1.270 1.00 0.00 H new ATOM 0 HG21 THR A 556 -13.679 -17.011 -0.888 1.00 0.00 H new ATOM 0 HG22 THR A 556 -12.542 -17.908 0.147 1.00 0.00 H new ATOM 0 HG23 THR A 556 -13.614 -16.680 0.860 1.00 0.00 H new ATOM 101 N GLU A 557 -8.977 -17.007 0.273 1.00 0.00 N ATOM 102 CA GLU A 557 -8.020 -18.134 0.283 1.00 0.00 C ATOM 103 C GLU A 557 -7.168 -18.125 1.572 1.00 0.00 C ATOM 104 O GLU A 557 -7.205 -19.099 2.314 1.00 0.00 O ATOM 105 CB GLU A 557 -7.123 -18.200 -0.996 1.00 0.00 C ATOM 106 CG GLU A 557 -6.492 -16.870 -1.470 1.00 0.00 C ATOM 107 CD GLU A 557 -7.417 -16.041 -2.373 1.00 0.00 C ATOM 108 OE1 GLU A 557 -7.513 -16.348 -3.577 1.00 0.00 O ATOM 109 OE2 GLU A 557 -8.063 -15.093 -1.887 1.00 0.00 O ATOM 0 H GLU A 557 -8.732 -16.262 -0.380 1.00 0.00 H new ATOM 0 HA GLU A 557 -8.619 -19.044 0.271 1.00 0.00 H new ATOM 0 HB2 GLU A 557 -6.318 -18.912 -0.811 1.00 0.00 H new ATOM 0 HB3 GLU A 557 -7.723 -18.602 -1.812 1.00 0.00 H new ATOM 0 HG2 GLU A 557 -6.220 -16.275 -0.598 1.00 0.00 H new ATOM 0 HG3 GLU A 557 -5.570 -17.086 -2.009 1.00 0.00 H new ATOM 116 N GLU A 558 -6.461 -17.008 1.877 1.00 0.00 N ATOM 117 CA GLU A 558 -5.565 -16.937 3.072 1.00 0.00 C ATOM 118 C GLU A 558 -6.335 -17.180 4.384 1.00 0.00 C ATOM 119 O GLU A 558 -5.795 -17.767 5.333 1.00 0.00 O ATOM 120 CB GLU A 558 -4.792 -15.583 3.161 1.00 0.00 C ATOM 121 CG GLU A 558 -3.503 -15.523 2.317 1.00 0.00 C ATOM 122 CD GLU A 558 -3.740 -15.393 0.811 1.00 0.00 C ATOM 123 OE1 GLU A 558 -3.952 -14.262 0.332 1.00 0.00 O ATOM 124 OE2 GLU A 558 -3.686 -16.412 0.097 1.00 0.00 O ATOM 0 H GLU A 558 -6.489 -16.152 1.324 1.00 0.00 H new ATOM 0 HA GLU A 558 -4.836 -17.736 2.940 1.00 0.00 H new ATOM 0 HB2 GLU A 558 -5.456 -14.779 2.844 1.00 0.00 H new ATOM 0 HB3 GLU A 558 -4.537 -15.393 4.204 1.00 0.00 H new ATOM 0 HG2 GLU A 558 -2.902 -14.677 2.652 1.00 0.00 H new ATOM 0 HG3 GLU A 558 -2.918 -16.424 2.504 1.00 0.00 H new ATOM 131 N GLN A 559 -7.600 -16.739 4.408 1.00 0.00 N ATOM 132 CA GLN A 559 -8.467 -16.866 5.585 1.00 0.00 C ATOM 133 C GLN A 559 -8.937 -18.329 5.735 1.00 0.00 C ATOM 134 O GLN A 559 -8.950 -18.844 6.843 1.00 0.00 O ATOM 135 CB GLN A 559 -9.696 -15.890 5.505 1.00 0.00 C ATOM 136 CG GLN A 559 -10.044 -15.133 6.811 1.00 0.00 C ATOM 137 CD GLN A 559 -10.110 -16.016 8.056 1.00 0.00 C ATOM 138 OE1 GLN A 559 -9.127 -16.166 8.781 1.00 0.00 O ATOM 139 NE2 GLN A 559 -11.251 -16.637 8.288 1.00 0.00 N ATOM 0 H GLN A 559 -8.050 -16.285 3.613 1.00 0.00 H new ATOM 0 HA GLN A 559 -7.889 -16.586 6.466 1.00 0.00 H new ATOM 0 HB2 GLN A 559 -9.502 -15.156 4.723 1.00 0.00 H new ATOM 0 HB3 GLN A 559 -10.570 -16.462 5.195 1.00 0.00 H new ATOM 0 HG2 GLN A 559 -9.300 -14.353 6.973 1.00 0.00 H new ATOM 0 HG3 GLN A 559 -11.005 -14.635 6.683 1.00 0.00 H new ATOM 0 HE21 GLN A 559 -12.047 -16.490 7.667 1.00 0.00 H new ATOM 0 HE22 GLN A 559 -11.337 -17.264 9.088 1.00 0.00 H new ATOM 148 N LYS A 560 -9.307 -18.999 4.607 1.00 0.00 N ATOM 149 CA LYS A 560 -9.806 -20.402 4.648 1.00 0.00 C ATOM 150 C LYS A 560 -8.673 -21.373 5.024 1.00 0.00 C ATOM 151 O LYS A 560 -8.919 -22.399 5.672 1.00 0.00 O ATOM 152 CB LYS A 560 -10.468 -20.858 3.308 1.00 0.00 C ATOM 153 CG LYS A 560 -9.481 -21.209 2.170 1.00 0.00 C ATOM 154 CD LYS A 560 -10.159 -21.793 0.915 1.00 0.00 C ATOM 155 CE LYS A 560 -11.165 -20.834 0.262 1.00 0.00 C ATOM 156 NZ LYS A 560 -11.654 -21.368 -1.034 1.00 0.00 N ATOM 0 H LYS A 560 -9.270 -18.596 3.671 1.00 0.00 H new ATOM 0 HA LYS A 560 -10.581 -20.425 5.414 1.00 0.00 H new ATOM 0 HB2 LYS A 560 -11.091 -21.730 3.508 1.00 0.00 H new ATOM 0 HB3 LYS A 560 -11.130 -20.065 2.961 1.00 0.00 H new ATOM 0 HG2 LYS A 560 -8.931 -20.311 1.889 1.00 0.00 H new ATOM 0 HG3 LYS A 560 -8.751 -21.927 2.544 1.00 0.00 H new ATOM 0 HD2 LYS A 560 -9.392 -22.055 0.186 1.00 0.00 H new ATOM 0 HD3 LYS A 560 -10.671 -22.717 1.185 1.00 0.00 H new ATOM 0 HE2 LYS A 560 -12.008 -20.675 0.934 1.00 0.00 H new ATOM 0 HE3 LYS A 560 -10.696 -19.863 0.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 560 -12.332 -20.699 -1.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 560 -10.851 -21.497 -1.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 560 -12.123 -22.283 -0.878 1.00 0.00 H new ATOM 170 N LEU A 561 -7.431 -21.026 4.607 1.00 0.00 N ATOM 171 CA LEU A 561 -6.219 -21.790 4.940 1.00 0.00 C ATOM 172 C LEU A 561 -5.989 -21.748 6.452 1.00 0.00 C ATOM 173 O LEU A 561 -5.531 -22.726 7.043 1.00 0.00 O ATOM 174 CB LEU A 561 -4.980 -21.224 4.196 1.00 0.00 C ATOM 175 CG LEU A 561 -5.031 -21.256 2.639 1.00 0.00 C ATOM 176 CD1 LEU A 561 -3.780 -20.588 2.021 1.00 0.00 C ATOM 177 CD2 LEU A 561 -5.254 -22.688 2.104 1.00 0.00 C ATOM 0 H LEU A 561 -7.249 -20.205 4.029 1.00 0.00 H new ATOM 0 HA LEU A 561 -6.360 -22.822 4.620 1.00 0.00 H new ATOM 0 HB2 LEU A 561 -4.835 -20.191 4.512 1.00 0.00 H new ATOM 0 HB3 LEU A 561 -4.102 -21.783 4.520 1.00 0.00 H new ATOM 0 HG LEU A 561 -5.894 -20.669 2.325 1.00 0.00 H new ATOM 0 HD11 LEU A 561 -3.846 -20.627 0.934 1.00 0.00 H new ATOM 0 HD12 LEU A 561 -3.725 -19.548 2.344 1.00 0.00 H new ATOM 0 HD13 LEU A 561 -2.885 -21.117 2.349 1.00 0.00 H new ATOM 0 HD21 LEU A 561 -5.284 -22.669 1.015 1.00 0.00 H new ATOM 0 HD22 LEU A 561 -4.438 -23.331 2.434 1.00 0.00 H new ATOM 0 HD23 LEU A 561 -6.198 -23.076 2.486 1.00 0.00 H new ATOM 189 N LEU A 562 -6.316 -20.588 7.059 1.00 0.00 N ATOM 190 CA LEU A 562 -6.280 -20.415 8.513 1.00 0.00 C ATOM 191 C LEU A 562 -7.398 -21.252 9.167 1.00 0.00 C ATOM 192 O LEU A 562 -7.113 -22.058 10.035 1.00 0.00 O ATOM 193 CB LEU A 562 -6.398 -18.910 8.903 1.00 0.00 C ATOM 194 CG LEU A 562 -6.274 -18.588 10.428 1.00 0.00 C ATOM 195 CD1 LEU A 562 -4.917 -19.054 11.005 1.00 0.00 C ATOM 196 CD2 LEU A 562 -6.525 -17.091 10.709 1.00 0.00 C ATOM 0 H LEU A 562 -6.610 -19.753 6.552 1.00 0.00 H new ATOM 0 HA LEU A 562 -5.318 -20.770 8.884 1.00 0.00 H new ATOM 0 HB2 LEU A 562 -5.626 -18.355 8.370 1.00 0.00 H new ATOM 0 HB3 LEU A 562 -7.359 -18.537 8.550 1.00 0.00 H new ATOM 0 HG LEU A 562 -7.051 -19.154 10.942 1.00 0.00 H new ATOM 0 HD11 LEU A 562 -4.871 -18.812 12.067 1.00 0.00 H new ATOM 0 HD12 LEU A 562 -4.817 -20.131 10.874 1.00 0.00 H new ATOM 0 HD13 LEU A 562 -4.106 -18.548 10.482 1.00 0.00 H new ATOM 0 HD21 LEU A 562 -6.431 -16.901 11.778 1.00 0.00 H new ATOM 0 HD22 LEU A 562 -5.793 -16.492 10.168 1.00 0.00 H new ATOM 0 HD23 LEU A 562 -7.529 -16.822 10.379 1.00 0.00 H new ATOM 208 N GLU A 563 -8.647 -21.093 8.668 1.00 0.00 N ATOM 209 CA GLU A 563 -9.869 -21.772 9.187 1.00 0.00 C ATOM 210 C GLU A 563 -9.673 -23.293 9.357 1.00 0.00 C ATOM 211 O GLU A 563 -10.017 -23.867 10.399 1.00 0.00 O ATOM 212 CB GLU A 563 -11.073 -21.518 8.232 1.00 0.00 C ATOM 213 CG GLU A 563 -11.569 -20.061 8.171 1.00 0.00 C ATOM 214 CD GLU A 563 -12.260 -19.597 9.466 1.00 0.00 C ATOM 215 OE1 GLU A 563 -13.492 -19.785 9.597 1.00 0.00 O ATOM 216 OE2 GLU A 563 -11.584 -19.035 10.355 1.00 0.00 O ATOM 0 H GLU A 563 -8.842 -20.478 7.878 1.00 0.00 H new ATOM 0 HA GLU A 563 -10.070 -21.347 10.171 1.00 0.00 H new ATOM 0 HB2 GLU A 563 -10.790 -21.831 7.227 1.00 0.00 H new ATOM 0 HB3 GLU A 563 -11.902 -22.154 8.542 1.00 0.00 H new ATOM 0 HG2 GLU A 563 -10.723 -19.405 7.964 1.00 0.00 H new ATOM 0 HG3 GLU A 563 -12.265 -19.956 7.339 1.00 0.00 H new ATOM 223 N GLN A 564 -9.110 -23.926 8.314 1.00 0.00 N ATOM 224 CA GLN A 564 -8.846 -25.371 8.308 1.00 0.00 C ATOM 225 C GLN A 564 -7.659 -25.707 9.220 1.00 0.00 C ATOM 226 O GLN A 564 -7.739 -26.654 9.984 1.00 0.00 O ATOM 227 CB GLN A 564 -8.630 -25.899 6.862 1.00 0.00 C ATOM 228 CG GLN A 564 -7.423 -25.294 6.107 1.00 0.00 C ATOM 229 CD GLN A 564 -7.322 -25.729 4.644 1.00 0.00 C ATOM 230 OE1 GLN A 564 -8.329 -26.005 3.999 1.00 0.00 O ATOM 231 NE2 GLN A 564 -6.115 -25.771 4.105 1.00 0.00 N ATOM 0 H GLN A 564 -8.827 -23.452 7.457 1.00 0.00 H new ATOM 0 HA GLN A 564 -9.724 -25.880 8.705 1.00 0.00 H new ATOM 0 HB2 GLN A 564 -8.505 -26.981 6.904 1.00 0.00 H new ATOM 0 HB3 GLN A 564 -9.533 -25.704 6.284 1.00 0.00 H new ATOM 0 HG2 GLN A 564 -7.490 -24.207 6.148 1.00 0.00 H new ATOM 0 HG3 GLN A 564 -6.506 -25.577 6.623 1.00 0.00 H new ATOM 0 HE21 GLN A 564 -5.297 -25.536 4.667 1.00 0.00 H new ATOM 0 HE22 GLN A 564 -6.002 -26.038 3.127 1.00 0.00 H new ATOM 240 N ALA A 565 -6.594 -24.879 9.178 1.00 0.00 N ATOM 241 CA ALA A 565 -5.341 -25.109 9.938 1.00 0.00 C ATOM 242 C ALA A 565 -5.554 -24.988 11.462 1.00 0.00 C ATOM 243 O ALA A 565 -4.816 -25.580 12.249 1.00 0.00 O ATOM 244 CB ALA A 565 -4.250 -24.141 9.471 1.00 0.00 C ATOM 0 H ALA A 565 -6.576 -24.029 8.615 1.00 0.00 H new ATOM 0 HA ALA A 565 -5.022 -26.132 9.737 1.00 0.00 H new ATOM 0 HB1 ALA A 565 -3.337 -24.322 10.038 1.00 0.00 H new ATOM 0 HB2 ALA A 565 -4.056 -24.296 8.410 1.00 0.00 H new ATOM 0 HB3 ALA A 565 -4.580 -23.115 9.633 1.00 0.00 H new ATOM 250 N LEU A 566 -6.555 -24.194 11.858 1.00 0.00 N ATOM 251 CA LEU A 566 -6.962 -24.030 13.265 1.00 0.00 C ATOM 252 C LEU A 566 -7.571 -25.331 13.820 1.00 0.00 C ATOM 253 O LEU A 566 -7.453 -25.618 15.015 1.00 0.00 O ATOM 254 CB LEU A 566 -7.977 -22.861 13.388 1.00 0.00 C ATOM 255 CG LEU A 566 -7.419 -21.440 13.051 1.00 0.00 C ATOM 256 CD1 LEU A 566 -8.555 -20.389 12.946 1.00 0.00 C ATOM 257 CD2 LEU A 566 -6.322 -21.024 14.058 1.00 0.00 C ATOM 0 H LEU A 566 -7.113 -23.641 11.208 1.00 0.00 H new ATOM 0 HA LEU A 566 -6.076 -23.797 13.855 1.00 0.00 H new ATOM 0 HB2 LEU A 566 -8.820 -23.066 12.729 1.00 0.00 H new ATOM 0 HB3 LEU A 566 -8.365 -22.847 14.407 1.00 0.00 H new ATOM 0 HG LEU A 566 -6.952 -21.486 12.067 1.00 0.00 H new ATOM 0 HD11 LEU A 566 -8.128 -19.414 12.711 1.00 0.00 H new ATOM 0 HD12 LEU A 566 -9.249 -20.681 12.158 1.00 0.00 H new ATOM 0 HD13 LEU A 566 -9.087 -20.332 13.896 1.00 0.00 H new ATOM 0 HD21 LEU A 566 -5.950 -20.032 13.802 1.00 0.00 H new ATOM 0 HD22 LEU A 566 -6.740 -21.006 15.065 1.00 0.00 H new ATOM 0 HD23 LEU A 566 -5.501 -21.740 14.019 1.00 0.00 H new ATOM 269 N LYS A 567 -8.228 -26.099 12.939 1.00 0.00 N ATOM 270 CA LYS A 567 -8.902 -27.357 13.298 1.00 0.00 C ATOM 271 C LYS A 567 -8.018 -28.579 12.940 1.00 0.00 C ATOM 272 O LYS A 567 -8.231 -29.670 13.462 1.00 0.00 O ATOM 273 CB LYS A 567 -10.275 -27.422 12.579 1.00 0.00 C ATOM 274 CG LYS A 567 -11.183 -28.587 13.034 1.00 0.00 C ATOM 275 CD LYS A 567 -12.549 -28.577 12.327 1.00 0.00 C ATOM 276 CE LYS A 567 -13.460 -29.728 12.781 1.00 0.00 C ATOM 277 NZ LYS A 567 -14.763 -29.700 12.078 1.00 0.00 N ATOM 0 H LYS A 567 -8.308 -25.864 11.950 1.00 0.00 H new ATOM 0 HA LYS A 567 -9.066 -27.385 14.375 1.00 0.00 H new ATOM 0 HB2 LYS A 567 -10.802 -26.482 12.744 1.00 0.00 H new ATOM 0 HB3 LYS A 567 -10.105 -27.508 11.506 1.00 0.00 H new ATOM 0 HG2 LYS A 567 -10.681 -29.534 12.835 1.00 0.00 H new ATOM 0 HG3 LYS A 567 -11.334 -28.526 14.112 1.00 0.00 H new ATOM 0 HD2 LYS A 567 -13.047 -27.627 12.521 1.00 0.00 H new ATOM 0 HD3 LYS A 567 -12.396 -28.643 11.250 1.00 0.00 H new ATOM 0 HE2 LYS A 567 -12.965 -30.681 12.593 1.00 0.00 H new ATOM 0 HE3 LYS A 567 -13.624 -29.661 13.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 567 -15.353 -30.490 12.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 567 -15.246 -28.801 12.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 567 -14.607 -29.789 11.054 1.00 0.00 H new ATOM 291 N THR A 568 -7.032 -28.387 12.040 1.00 0.00 N ATOM 292 CA THR A 568 -6.052 -29.436 11.683 1.00 0.00 C ATOM 293 C THR A 568 -4.980 -29.523 12.785 1.00 0.00 C ATOM 294 O THR A 568 -4.519 -30.613 13.155 1.00 0.00 O ATOM 295 CB THR A 568 -5.370 -29.144 10.297 1.00 0.00 C ATOM 296 OG1 THR A 568 -6.367 -28.877 9.304 1.00 0.00 O ATOM 297 CG2 THR A 568 -4.502 -30.319 9.809 1.00 0.00 C ATOM 0 H THR A 568 -6.892 -27.507 11.543 1.00 0.00 H new ATOM 0 HA THR A 568 -6.581 -30.385 11.598 1.00 0.00 H new ATOM 0 HB THR A 568 -4.726 -28.277 10.443 1.00 0.00 H new ATOM 0 HG1 THR A 568 -6.824 -28.037 9.517 1.00 0.00 H new ATOM 0 HG21 THR A 568 -4.054 -30.066 8.848 1.00 0.00 H new ATOM 0 HG22 THR A 568 -3.714 -30.516 10.536 1.00 0.00 H new ATOM 0 HG23 THR A 568 -5.123 -31.208 9.697 1.00 0.00 H new ATOM 305 N TYR A 569 -4.604 -28.341 13.305 1.00 0.00 N ATOM 306 CA TYR A 569 -3.622 -28.183 14.389 1.00 0.00 C ATOM 307 C TYR A 569 -4.327 -27.419 15.530 1.00 0.00 C ATOM 308 O TYR A 569 -4.618 -26.223 15.363 1.00 0.00 O ATOM 309 CB TYR A 569 -2.363 -27.395 13.897 1.00 0.00 C ATOM 310 CG TYR A 569 -1.949 -27.707 12.450 1.00 0.00 C ATOM 311 CD1 TYR A 569 -1.530 -28.989 12.070 1.00 0.00 C ATOM 312 CD2 TYR A 569 -2.007 -26.723 11.460 1.00 0.00 C ATOM 313 CE1 TYR A 569 -1.184 -29.268 10.762 1.00 0.00 C ATOM 314 CE2 TYR A 569 -1.668 -27.003 10.149 1.00 0.00 C ATOM 315 CZ TYR A 569 -1.253 -28.272 9.807 1.00 0.00 C ATOM 316 OH TYR A 569 -0.915 -28.551 8.506 1.00 0.00 O ATOM 0 H TYR A 569 -4.982 -27.453 12.976 1.00 0.00 H new ATOM 0 HA TYR A 569 -3.273 -29.157 14.730 1.00 0.00 H new ATOM 0 HB2 TYR A 569 -2.560 -26.327 13.984 1.00 0.00 H new ATOM 0 HB3 TYR A 569 -1.526 -27.620 14.559 1.00 0.00 H new ATOM 0 HD1 TYR A 569 -1.477 -29.772 12.812 1.00 0.00 H new ATOM 0 HD2 TYR A 569 -2.323 -25.724 11.724 1.00 0.00 H new ATOM 0 HE1 TYR A 569 -0.861 -30.261 10.487 1.00 0.00 H new ATOM 0 HE2 TYR A 569 -1.728 -26.231 9.396 1.00 0.00 H new ATOM 0 HH TYR A 569 -1.019 -27.743 7.961 1.00 0.00 H new ATOM 326 N PRO A 570 -4.676 -28.092 16.672 1.00 0.00 N ATOM 327 CA PRO A 570 -5.327 -27.421 17.824 1.00 0.00 C ATOM 328 C PRO A 570 -4.341 -26.556 18.635 1.00 0.00 C ATOM 329 O PRO A 570 -3.123 -26.629 18.435 1.00 0.00 O ATOM 330 CB PRO A 570 -5.857 -28.613 18.664 1.00 0.00 C ATOM 331 CG PRO A 570 -4.896 -29.729 18.374 1.00 0.00 C ATOM 332 CD PRO A 570 -4.482 -29.550 16.922 1.00 0.00 C ATOM 0 HA PRO A 570 -6.106 -26.723 17.516 1.00 0.00 H new ATOM 0 HB2 PRO A 570 -5.878 -28.372 19.727 1.00 0.00 H new ATOM 0 HB3 PRO A 570 -6.874 -28.880 18.378 1.00 0.00 H new ATOM 0 HG2 PRO A 570 -4.031 -29.683 19.036 1.00 0.00 H new ATOM 0 HG3 PRO A 570 -5.365 -30.700 18.530 1.00 0.00 H new ATOM 0 HD2 PRO A 570 -3.446 -29.849 16.762 1.00 0.00 H new ATOM 0 HD3 PRO A 570 -5.095 -30.155 16.254 1.00 0.00 H new ATOM 340 N VAL A 571 -4.896 -25.748 19.559 1.00 0.00 N ATOM 341 CA VAL A 571 -4.118 -24.944 20.532 1.00 0.00 C ATOM 342 C VAL A 571 -3.232 -25.848 21.424 1.00 0.00 C ATOM 343 O VAL A 571 -2.150 -25.451 21.866 1.00 0.00 O ATOM 344 CB VAL A 571 -5.072 -24.053 21.421 1.00 0.00 C ATOM 345 CG1 VAL A 571 -6.172 -24.900 22.120 1.00 0.00 C ATOM 346 CG2 VAL A 571 -4.271 -23.198 22.446 1.00 0.00 C ATOM 0 H VAL A 571 -5.905 -25.631 19.655 1.00 0.00 H new ATOM 0 HA VAL A 571 -3.463 -24.283 19.964 1.00 0.00 H new ATOM 0 HB VAL A 571 -5.579 -23.362 20.748 1.00 0.00 H new ATOM 0 HG11 VAL A 571 -6.806 -24.248 22.721 1.00 0.00 H new ATOM 0 HG12 VAL A 571 -6.779 -25.402 21.366 1.00 0.00 H new ATOM 0 HG13 VAL A 571 -5.704 -25.645 22.763 1.00 0.00 H new ATOM 0 HG21 VAL A 571 -4.962 -22.599 23.039 1.00 0.00 H new ATOM 0 HG22 VAL A 571 -3.704 -23.856 23.105 1.00 0.00 H new ATOM 0 HG23 VAL A 571 -3.585 -22.540 21.913 1.00 0.00 H new ATOM 356 N ASN A 572 -3.701 -27.086 21.621 1.00 0.00 N ATOM 357 CA ASN A 572 -3.011 -28.130 22.405 1.00 0.00 C ATOM 358 C ASN A 572 -1.643 -28.501 21.788 1.00 0.00 C ATOM 359 O ASN A 572 -0.787 -29.078 22.465 1.00 0.00 O ATOM 360 CB ASN A 572 -3.925 -29.378 22.478 1.00 0.00 C ATOM 361 CG ASN A 572 -5.308 -29.062 23.052 1.00 0.00 C ATOM 362 OD1 ASN A 572 -6.205 -28.623 22.328 1.00 0.00 O ATOM 363 ND2 ASN A 572 -5.496 -29.269 24.348 1.00 0.00 N ATOM 0 H ASN A 572 -4.590 -27.402 21.233 1.00 0.00 H new ATOM 0 HA ASN A 572 -2.815 -27.746 23.406 1.00 0.00 H new ATOM 0 HB2 ASN A 572 -4.038 -29.800 21.479 1.00 0.00 H new ATOM 0 HB3 ASN A 572 -3.446 -30.139 23.093 1.00 0.00 H new ATOM 0 HD21 ASN A 572 -6.401 -29.064 24.771 1.00 0.00 H new ATOM 0 HD22 ASN A 572 -4.735 -29.633 24.922 1.00 0.00 H new ATOM 370 N THR A 573 -1.468 -28.194 20.494 1.00 0.00 N ATOM 371 CA THR A 573 -0.198 -28.362 19.780 1.00 0.00 C ATOM 372 C THR A 573 0.700 -27.114 20.010 1.00 0.00 C ATOM 373 O THR A 573 0.310 -26.008 19.622 1.00 0.00 O ATOM 374 CB THR A 573 -0.467 -28.571 18.249 1.00 0.00 C ATOM 375 OG1 THR A 573 -1.420 -29.628 18.075 1.00 0.00 O ATOM 376 CG2 THR A 573 0.810 -28.915 17.454 1.00 0.00 C ATOM 0 H THR A 573 -2.214 -27.818 19.909 1.00 0.00 H new ATOM 0 HA THR A 573 0.318 -29.242 20.163 1.00 0.00 H new ATOM 0 HB THR A 573 -0.849 -27.627 17.861 1.00 0.00 H new ATOM 0 HG1 THR A 573 -1.253 -30.082 17.222 1.00 0.00 H new ATOM 0 HG21 THR A 573 0.559 -29.048 16.402 1.00 0.00 H new ATOM 0 HG22 THR A 573 1.531 -28.104 17.555 1.00 0.00 H new ATOM 0 HG23 THR A 573 1.243 -29.837 17.843 1.00 0.00 H new ATOM 384 N PRO A 574 1.897 -27.261 20.676 1.00 0.00 N ATOM 385 CA PRO A 574 2.867 -26.145 20.855 1.00 0.00 C ATOM 386 C PRO A 574 3.475 -25.664 19.514 1.00 0.00 C ATOM 387 O PRO A 574 3.966 -24.541 19.410 1.00 0.00 O ATOM 388 CB PRO A 574 3.954 -26.759 21.783 1.00 0.00 C ATOM 389 CG PRO A 574 3.855 -28.234 21.548 1.00 0.00 C ATOM 390 CD PRO A 574 2.380 -28.501 21.346 1.00 0.00 C ATOM 0 HA PRO A 574 2.397 -25.254 21.271 1.00 0.00 H new ATOM 0 HB2 PRO A 574 4.947 -26.383 21.535 1.00 0.00 H new ATOM 0 HB3 PRO A 574 3.771 -26.510 22.828 1.00 0.00 H new ATOM 0 HG2 PRO A 574 4.433 -28.534 20.674 1.00 0.00 H new ATOM 0 HG3 PRO A 574 4.245 -28.796 22.397 1.00 0.00 H new ATOM 0 HD2 PRO A 574 2.212 -29.384 20.729 1.00 0.00 H new ATOM 0 HD3 PRO A 574 1.869 -28.672 22.293 1.00 0.00 H new ATOM 398 N GLU A 575 3.433 -26.538 18.490 1.00 0.00 N ATOM 399 CA GLU A 575 3.959 -26.248 17.135 1.00 0.00 C ATOM 400 C GLU A 575 2.828 -25.842 16.170 1.00 0.00 C ATOM 401 O GLU A 575 3.021 -25.872 14.952 1.00 0.00 O ATOM 402 CB GLU A 575 4.723 -27.492 16.605 1.00 0.00 C ATOM 403 CG GLU A 575 5.916 -27.908 17.493 1.00 0.00 C ATOM 404 CD GLU A 575 6.608 -29.190 17.014 1.00 0.00 C ATOM 405 OE1 GLU A 575 6.189 -30.289 17.415 1.00 0.00 O ATOM 406 OE2 GLU A 575 7.567 -29.107 16.221 1.00 0.00 O ATOM 0 H GLU A 575 3.031 -27.472 18.577 1.00 0.00 H new ATOM 0 HA GLU A 575 4.646 -25.404 17.196 1.00 0.00 H new ATOM 0 HB2 GLU A 575 4.029 -28.329 16.528 1.00 0.00 H new ATOM 0 HB3 GLU A 575 5.085 -27.284 15.598 1.00 0.00 H new ATOM 0 HG2 GLU A 575 6.644 -27.097 17.516 1.00 0.00 H new ATOM 0 HG3 GLU A 575 5.567 -28.052 18.515 1.00 0.00 H new ATOM 413 N ARG A 576 1.673 -25.411 16.739 1.00 0.00 N ATOM 414 CA ARG A 576 0.443 -25.095 15.972 1.00 0.00 C ATOM 415 C ARG A 576 0.713 -24.081 14.845 1.00 0.00 C ATOM 416 O ARG A 576 0.562 -24.394 13.666 1.00 0.00 O ATOM 417 CB ARG A 576 -0.658 -24.512 16.908 1.00 0.00 C ATOM 418 CG ARG A 576 -2.034 -24.340 16.223 1.00 0.00 C ATOM 419 CD ARG A 576 -3.004 -23.463 17.019 1.00 0.00 C ATOM 420 NE ARG A 576 -4.392 -23.587 16.527 1.00 0.00 N ATOM 421 CZ ARG A 576 -5.479 -23.185 17.192 1.00 0.00 C ATOM 422 NH1 ARG A 576 -5.377 -22.545 18.348 1.00 0.00 N ATOM 423 NH2 ARG A 576 -6.677 -23.439 16.703 1.00 0.00 N ATOM 0 H ARG A 576 1.570 -25.273 17.744 1.00 0.00 H new ATOM 0 HA ARG A 576 0.103 -26.032 15.531 1.00 0.00 H new ATOM 0 HB2 ARG A 576 -0.772 -25.168 17.771 1.00 0.00 H new ATOM 0 HB3 ARG A 576 -0.327 -23.544 17.284 1.00 0.00 H new ATOM 0 HG2 ARG A 576 -1.888 -23.903 15.235 1.00 0.00 H new ATOM 0 HG3 ARG A 576 -2.483 -25.322 16.074 1.00 0.00 H new ATOM 0 HD2 ARG A 576 -2.966 -23.743 18.072 1.00 0.00 H new ATOM 0 HD3 ARG A 576 -2.688 -22.422 16.955 1.00 0.00 H new ATOM 0 HE ARG A 576 -4.531 -24.012 15.610 1.00 0.00 H new ATOM 0 HH11 ARG A 576 -4.457 -22.352 18.744 1.00 0.00 H new ATOM 0 HH12 ARG A 576 -6.218 -22.246 18.841 1.00 0.00 H new ATOM 0 HH21 ARG A 576 -6.772 -23.941 15.820 1.00 0.00 H new ATOM 0 HH22 ARG A 576 -7.509 -23.134 17.208 1.00 0.00 H new ATOM 437 N TRP A 577 1.178 -22.889 15.246 1.00 0.00 N ATOM 438 CA TRP A 577 1.307 -21.715 14.360 1.00 0.00 C ATOM 439 C TRP A 577 2.499 -21.846 13.396 1.00 0.00 C ATOM 440 O TRP A 577 2.548 -21.153 12.379 1.00 0.00 O ATOM 441 CB TRP A 577 1.404 -20.426 15.213 1.00 0.00 C ATOM 442 CG TRP A 577 0.234 -20.255 16.165 1.00 0.00 C ATOM 443 CD1 TRP A 577 0.222 -20.511 17.507 1.00 0.00 C ATOM 444 CD2 TRP A 577 -1.100 -19.829 15.833 1.00 0.00 C ATOM 445 NE1 TRP A 577 -1.015 -20.246 18.027 1.00 0.00 N ATOM 446 CE2 TRP A 577 -1.844 -19.839 17.024 1.00 0.00 C ATOM 447 CE3 TRP A 577 -1.730 -19.432 14.649 1.00 0.00 C ATOM 448 CZ2 TRP A 577 -3.184 -19.471 17.070 1.00 0.00 C ATOM 449 CZ3 TRP A 577 -3.063 -19.076 14.695 1.00 0.00 C ATOM 450 CH2 TRP A 577 -3.776 -19.097 15.898 1.00 0.00 C ATOM 0 H TRP A 577 1.479 -22.707 16.203 1.00 0.00 H new ATOM 0 HA TRP A 577 0.415 -21.658 13.736 1.00 0.00 H new ATOM 0 HB2 TRP A 577 2.331 -20.445 15.786 1.00 0.00 H new ATOM 0 HB3 TRP A 577 1.456 -19.562 14.551 1.00 0.00 H new ATOM 0 HD1 TRP A 577 1.067 -20.871 18.075 1.00 0.00 H new ATOM 0 HE1 TRP A 577 -1.276 -20.338 19.009 1.00 0.00 H new ATOM 0 HE3 TRP A 577 -1.184 -19.405 13.717 1.00 0.00 H new ATOM 0 HZ2 TRP A 577 -3.736 -19.481 17.998 1.00 0.00 H new ATOM 0 HZ3 TRP A 577 -3.564 -18.776 13.786 1.00 0.00 H new ATOM 0 HH2 TRP A 577 -4.817 -18.811 15.900 1.00 0.00 H new ATOM 461 N LYS A 578 3.453 -22.736 13.727 1.00 0.00 N ATOM 462 CA LYS A 578 4.579 -23.089 12.829 1.00 0.00 C ATOM 463 C LYS A 578 4.054 -23.875 11.612 1.00 0.00 C ATOM 464 O LYS A 578 4.494 -23.673 10.476 1.00 0.00 O ATOM 465 CB LYS A 578 5.639 -23.929 13.590 1.00 0.00 C ATOM 466 CG LYS A 578 6.184 -23.262 14.870 1.00 0.00 C ATOM 467 CD LYS A 578 6.872 -21.898 14.604 1.00 0.00 C ATOM 468 CE LYS A 578 7.294 -21.191 15.904 1.00 0.00 C ATOM 469 NZ LYS A 578 8.171 -22.053 16.739 1.00 0.00 N ATOM 0 H LYS A 578 3.469 -23.231 14.619 1.00 0.00 H new ATOM 0 HA LYS A 578 5.051 -22.169 12.483 1.00 0.00 H new ATOM 0 HB2 LYS A 578 5.200 -24.891 13.855 1.00 0.00 H new ATOM 0 HB3 LYS A 578 6.473 -24.133 12.918 1.00 0.00 H new ATOM 0 HG2 LYS A 578 5.364 -23.117 15.573 1.00 0.00 H new ATOM 0 HG3 LYS A 578 6.897 -23.934 15.347 1.00 0.00 H new ATOM 0 HD2 LYS A 578 7.750 -22.053 13.976 1.00 0.00 H new ATOM 0 HD3 LYS A 578 6.192 -21.253 14.047 1.00 0.00 H new ATOM 0 HE2 LYS A 578 7.817 -20.266 15.662 1.00 0.00 H new ATOM 0 HE3 LYS A 578 6.406 -20.916 16.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 578 8.531 -21.504 17.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 578 7.626 -22.867 17.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 578 8.971 -22.392 16.167 1.00 0.00 H new ATOM 483 N LYS A 579 3.095 -24.767 11.884 1.00 0.00 N ATOM 484 CA LYS A 579 2.410 -25.568 10.858 1.00 0.00 C ATOM 485 C LYS A 579 1.412 -24.700 10.069 1.00 0.00 C ATOM 486 O LYS A 579 1.201 -24.904 8.868 1.00 0.00 O ATOM 487 CB LYS A 579 1.695 -26.750 11.541 1.00 0.00 C ATOM 488 CG LYS A 579 2.639 -27.684 12.317 1.00 0.00 C ATOM 489 CD LYS A 579 1.892 -28.787 13.098 1.00 0.00 C ATOM 490 CE LYS A 579 2.845 -29.803 13.739 1.00 0.00 C ATOM 491 NZ LYS A 579 3.729 -30.443 12.733 1.00 0.00 N ATOM 0 H LYS A 579 2.768 -24.957 12.831 1.00 0.00 H new ATOM 0 HA LYS A 579 3.141 -25.954 10.147 1.00 0.00 H new ATOM 0 HB2 LYS A 579 0.942 -26.360 12.226 1.00 0.00 H new ATOM 0 HB3 LYS A 579 1.168 -27.330 10.784 1.00 0.00 H new ATOM 0 HG2 LYS A 579 3.335 -28.149 11.619 1.00 0.00 H new ATOM 0 HG3 LYS A 579 3.234 -27.093 13.014 1.00 0.00 H new ATOM 0 HD2 LYS A 579 1.281 -28.327 13.875 1.00 0.00 H new ATOM 0 HD3 LYS A 579 1.212 -29.307 12.424 1.00 0.00 H new ATOM 0 HE2 LYS A 579 3.454 -29.304 14.493 1.00 0.00 H new ATOM 0 HE3 LYS A 579 2.266 -30.570 14.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 579 3.791 -31.463 12.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 579 3.338 -30.292 11.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 579 4.679 -30.022 12.787 1.00 0.00 H new ATOM 505 N ILE A 580 0.800 -23.734 10.777 1.00 0.00 N ATOM 506 CA ILE A 580 -0.102 -22.728 10.185 1.00 0.00 C ATOM 507 C ILE A 580 0.688 -21.733 9.301 1.00 0.00 C ATOM 508 O ILE A 580 0.137 -21.158 8.373 1.00 0.00 O ATOM 509 CB ILE A 580 -0.931 -21.987 11.309 1.00 0.00 C ATOM 510 CG1 ILE A 580 -1.862 -23.010 12.045 1.00 0.00 C ATOM 511 CG2 ILE A 580 -1.742 -20.786 10.760 1.00 0.00 C ATOM 512 CD1 ILE A 580 -2.769 -22.424 13.110 1.00 0.00 C ATOM 0 H ILE A 580 0.918 -23.628 11.785 1.00 0.00 H new ATOM 0 HA ILE A 580 -0.815 -23.241 9.539 1.00 0.00 H new ATOM 0 HB ILE A 580 -0.220 -21.571 12.023 1.00 0.00 H new ATOM 0 HG12 ILE A 580 -2.482 -23.510 11.301 1.00 0.00 H new ATOM 0 HG13 ILE A 580 -1.238 -23.775 12.506 1.00 0.00 H new ATOM 0 HG21 ILE A 580 -2.292 -20.315 11.575 1.00 0.00 H new ATOM 0 HG22 ILE A 580 -1.061 -20.061 10.314 1.00 0.00 H new ATOM 0 HG23 ILE A 580 -2.444 -21.137 10.004 1.00 0.00 H new ATOM 0 HD11 ILE A 580 -3.369 -23.218 13.554 1.00 0.00 H new ATOM 0 HD12 ILE A 580 -2.164 -21.951 13.883 1.00 0.00 H new ATOM 0 HD13 ILE A 580 -3.427 -21.681 12.659 1.00 0.00 H new ATOM 524 N ALA A 581 1.985 -21.531 9.600 1.00 0.00 N ATOM 525 CA ALA A 581 2.907 -20.761 8.724 1.00 0.00 C ATOM 526 C ALA A 581 3.077 -21.417 7.345 1.00 0.00 C ATOM 527 O ALA A 581 3.208 -20.726 6.327 1.00 0.00 O ATOM 528 CB ALA A 581 4.278 -20.569 9.403 1.00 0.00 C ATOM 0 H ALA A 581 2.426 -21.891 10.446 1.00 0.00 H new ATOM 0 HA ALA A 581 2.454 -19.782 8.566 1.00 0.00 H new ATOM 0 HB1 ALA A 581 4.935 -20.003 8.743 1.00 0.00 H new ATOM 0 HB2 ALA A 581 4.148 -20.025 10.339 1.00 0.00 H new ATOM 0 HB3 ALA A 581 4.722 -21.543 9.608 1.00 0.00 H new ATOM 534 N GLU A 582 3.077 -22.752 7.335 1.00 0.00 N ATOM 535 CA GLU A 582 3.190 -23.559 6.109 1.00 0.00 C ATOM 536 C GLU A 582 1.827 -23.633 5.386 1.00 0.00 C ATOM 537 O GLU A 582 1.767 -23.776 4.161 1.00 0.00 O ATOM 538 CB GLU A 582 3.682 -24.974 6.476 1.00 0.00 C ATOM 539 CG GLU A 582 4.984 -25.003 7.304 1.00 0.00 C ATOM 540 CD GLU A 582 5.348 -26.417 7.783 1.00 0.00 C ATOM 541 OE1 GLU A 582 4.599 -26.977 8.605 1.00 0.00 O ATOM 542 OE2 GLU A 582 6.378 -26.978 7.345 1.00 0.00 O ATOM 0 H GLU A 582 2.998 -23.312 8.184 1.00 0.00 H new ATOM 0 HA GLU A 582 3.907 -23.092 5.434 1.00 0.00 H new ATOM 0 HB2 GLU A 582 2.898 -25.484 7.036 1.00 0.00 H new ATOM 0 HB3 GLU A 582 3.837 -25.541 5.558 1.00 0.00 H new ATOM 0 HG2 GLU A 582 5.802 -24.605 6.703 1.00 0.00 H new ATOM 0 HG3 GLU A 582 4.876 -24.347 8.168 1.00 0.00 H new ATOM 549 N ALA A 583 0.740 -23.544 6.172 1.00 0.00 N ATOM 550 CA ALA A 583 -0.641 -23.573 5.655 1.00 0.00 C ATOM 551 C ALA A 583 -1.055 -22.206 5.075 1.00 0.00 C ATOM 552 O ALA A 583 -1.727 -22.139 4.047 1.00 0.00 O ATOM 553 CB ALA A 583 -1.615 -24.002 6.771 1.00 0.00 C ATOM 0 H ALA A 583 0.794 -23.450 7.186 1.00 0.00 H new ATOM 0 HA ALA A 583 -0.683 -24.302 4.845 1.00 0.00 H new ATOM 0 HB1 ALA A 583 -2.632 -24.020 6.379 1.00 0.00 H new ATOM 0 HB2 ALA A 583 -1.345 -24.996 7.127 1.00 0.00 H new ATOM 0 HB3 ALA A 583 -1.557 -23.293 7.597 1.00 0.00 H new ATOM 559 N VAL A 584 -0.607 -21.125 5.738 1.00 0.00 N ATOM 560 CA VAL A 584 -1.011 -19.735 5.444 1.00 0.00 C ATOM 561 C VAL A 584 0.263 -18.894 5.175 1.00 0.00 C ATOM 562 O VAL A 584 0.915 -18.433 6.129 1.00 0.00 O ATOM 563 CB VAL A 584 -1.831 -19.082 6.635 1.00 0.00 C ATOM 564 CG1 VAL A 584 -2.484 -17.744 6.209 1.00 0.00 C ATOM 565 CG2 VAL A 584 -2.885 -20.057 7.205 1.00 0.00 C ATOM 0 H VAL A 584 0.059 -21.192 6.508 1.00 0.00 H new ATOM 0 HA VAL A 584 -1.662 -19.750 4.570 1.00 0.00 H new ATOM 0 HB VAL A 584 -1.119 -18.865 7.431 1.00 0.00 H new ATOM 0 HG11 VAL A 584 -3.037 -17.325 7.050 1.00 0.00 H new ATOM 0 HG12 VAL A 584 -1.709 -17.043 5.900 1.00 0.00 H new ATOM 0 HG13 VAL A 584 -3.166 -17.921 5.377 1.00 0.00 H new ATOM 0 HG21 VAL A 584 -3.426 -19.573 8.019 1.00 0.00 H new ATOM 0 HG22 VAL A 584 -3.586 -20.335 6.418 1.00 0.00 H new ATOM 0 HG23 VAL A 584 -2.388 -20.951 7.581 1.00 0.00 H new ATOM 575 N PRO A 585 0.680 -18.737 3.880 1.00 0.00 N ATOM 576 CA PRO A 585 1.807 -17.867 3.503 1.00 0.00 C ATOM 577 C PRO A 585 1.338 -16.411 3.256 1.00 0.00 C ATOM 578 O PRO A 585 0.159 -16.157 2.952 1.00 0.00 O ATOM 579 CB PRO A 585 2.336 -18.553 2.220 1.00 0.00 C ATOM 580 CG PRO A 585 1.116 -19.148 1.568 1.00 0.00 C ATOM 581 CD PRO A 585 0.096 -19.399 2.679 1.00 0.00 C ATOM 0 HA PRO A 585 2.571 -17.768 4.274 1.00 0.00 H new ATOM 0 HB2 PRO A 585 2.826 -17.836 1.562 1.00 0.00 H new ATOM 0 HB3 PRO A 585 3.072 -19.321 2.457 1.00 0.00 H new ATOM 0 HG2 PRO A 585 0.710 -18.470 0.817 1.00 0.00 H new ATOM 0 HG3 PRO A 585 1.366 -20.077 1.056 1.00 0.00 H new ATOM 0 HD2 PRO A 585 -0.877 -18.977 2.427 1.00 0.00 H new ATOM 0 HD3 PRO A 585 -0.053 -20.466 2.847 1.00 0.00 H new ATOM 589 N GLY A 586 2.265 -15.462 3.443 1.00 0.00 N ATOM 590 CA GLY A 586 1.997 -14.029 3.231 1.00 0.00 C ATOM 591 C GLY A 586 1.314 -13.344 4.410 1.00 0.00 C ATOM 592 O GLY A 586 1.171 -12.116 4.416 1.00 0.00 O ATOM 0 H GLY A 586 3.219 -15.662 3.744 1.00 0.00 H new ATOM 0 HA2 GLY A 586 2.939 -13.521 3.025 1.00 0.00 H new ATOM 0 HA3 GLY A 586 1.372 -13.914 2.345 1.00 0.00 H new ATOM 596 N ARG A 587 0.860 -14.142 5.395 1.00 0.00 N ATOM 597 CA ARG A 587 0.239 -13.652 6.641 1.00 0.00 C ATOM 598 C ARG A 587 1.099 -14.108 7.811 1.00 0.00 C ATOM 599 O ARG A 587 1.467 -15.289 7.867 1.00 0.00 O ATOM 600 CB ARG A 587 -1.206 -14.216 6.794 1.00 0.00 C ATOM 601 CG ARG A 587 -2.088 -14.084 5.536 1.00 0.00 C ATOM 602 CD ARG A 587 -2.290 -12.634 5.077 1.00 0.00 C ATOM 603 NE ARG A 587 -2.885 -12.582 3.733 1.00 0.00 N ATOM 604 CZ ARG A 587 -3.675 -11.616 3.264 1.00 0.00 C ATOM 605 NH1 ARG A 587 -3.948 -10.560 4.010 1.00 0.00 N ATOM 606 NH2 ARG A 587 -4.190 -11.724 2.052 1.00 0.00 N ATOM 0 H ARG A 587 0.915 -15.159 5.347 1.00 0.00 H new ATOM 0 HA ARG A 587 0.175 -12.564 6.616 1.00 0.00 H new ATOM 0 HB2 ARG A 587 -1.143 -15.269 7.067 1.00 0.00 H new ATOM 0 HB3 ARG A 587 -1.696 -13.701 7.620 1.00 0.00 H new ATOM 0 HG2 ARG A 587 -1.636 -14.654 4.724 1.00 0.00 H new ATOM 0 HG3 ARG A 587 -3.061 -14.532 5.736 1.00 0.00 H new ATOM 0 HD2 ARG A 587 -2.935 -12.112 5.784 1.00 0.00 H new ATOM 0 HD3 ARG A 587 -1.332 -12.113 5.075 1.00 0.00 H new ATOM 0 HE ARG A 587 -2.674 -13.355 3.102 1.00 0.00 H new ATOM 0 HH11 ARG A 587 -3.554 -10.482 4.948 1.00 0.00 H new ATOM 0 HH12 ARG A 587 -4.553 -9.823 3.648 1.00 0.00 H new ATOM 0 HH21 ARG A 587 -3.982 -12.543 1.481 1.00 0.00 H new ATOM 0 HH22 ARG A 587 -4.795 -10.988 1.688 1.00 0.00 H new ATOM 620 N THR A 588 1.417 -13.190 8.731 1.00 0.00 N ATOM 621 CA THR A 588 2.245 -13.503 9.902 1.00 0.00 C ATOM 622 C THR A 588 1.409 -14.173 10.995 1.00 0.00 C ATOM 623 O THR A 588 0.178 -14.050 11.026 1.00 0.00 O ATOM 624 CB THR A 588 2.951 -12.223 10.456 1.00 0.00 C ATOM 625 OG1 THR A 588 1.972 -11.265 10.872 1.00 0.00 O ATOM 626 CG2 THR A 588 3.884 -11.580 9.413 1.00 0.00 C ATOM 0 H THR A 588 1.111 -12.218 8.686 1.00 0.00 H new ATOM 0 HA THR A 588 3.019 -14.201 9.584 1.00 0.00 H new ATOM 0 HB THR A 588 3.559 -12.531 11.307 1.00 0.00 H new ATOM 0 HG1 THR A 588 1.400 -11.030 10.111 1.00 0.00 H new ATOM 0 HG21 THR A 588 4.353 -10.694 9.841 1.00 0.00 H new ATOM 0 HG22 THR A 588 4.655 -12.295 9.124 1.00 0.00 H new ATOM 0 HG23 THR A 588 3.306 -11.295 8.534 1.00 0.00 H new ATOM 634 N LYS A 589 2.101 -14.897 11.883 1.00 0.00 N ATOM 635 CA LYS A 589 1.470 -15.723 12.924 1.00 0.00 C ATOM 636 C LYS A 589 0.776 -14.840 13.959 1.00 0.00 C ATOM 637 O LYS A 589 -0.235 -15.248 14.511 1.00 0.00 O ATOM 638 CB LYS A 589 2.506 -16.672 13.590 1.00 0.00 C ATOM 639 CG LYS A 589 2.928 -17.930 12.767 1.00 0.00 C ATOM 640 CD LYS A 589 3.477 -17.628 11.338 1.00 0.00 C ATOM 641 CE LYS A 589 2.377 -17.612 10.240 1.00 0.00 C ATOM 642 NZ LYS A 589 2.924 -17.297 8.902 1.00 0.00 N ATOM 0 H LYS A 589 3.120 -14.928 11.901 1.00 0.00 H new ATOM 0 HA LYS A 589 0.712 -16.349 12.453 1.00 0.00 H new ATOM 0 HB2 LYS A 589 3.403 -16.095 13.814 1.00 0.00 H new ATOM 0 HB3 LYS A 589 2.097 -17.009 14.543 1.00 0.00 H new ATOM 0 HG2 LYS A 589 3.691 -18.472 13.326 1.00 0.00 H new ATOM 0 HG3 LYS A 589 2.067 -18.592 12.677 1.00 0.00 H new ATOM 0 HD2 LYS A 589 3.982 -16.662 11.348 1.00 0.00 H new ATOM 0 HD3 LYS A 589 4.226 -18.377 11.080 1.00 0.00 H new ATOM 0 HE2 LYS A 589 1.884 -18.583 10.209 1.00 0.00 H new ATOM 0 HE3 LYS A 589 1.616 -16.876 10.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 589 2.189 -16.841 8.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 589 3.735 -16.654 9.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 589 3.233 -18.175 8.438 1.00 0.00 H new ATOM 656 N LYS A 590 1.310 -13.620 14.181 1.00 0.00 N ATOM 657 CA LYS A 590 0.676 -12.625 15.063 1.00 0.00 C ATOM 658 C LYS A 590 -0.717 -12.212 14.512 1.00 0.00 C ATOM 659 O LYS A 590 -1.660 -12.044 15.288 1.00 0.00 O ATOM 660 CB LYS A 590 1.587 -11.379 15.257 1.00 0.00 C ATOM 661 CG LYS A 590 1.987 -10.673 13.942 1.00 0.00 C ATOM 662 CD LYS A 590 2.802 -9.377 14.148 1.00 0.00 C ATOM 663 CE LYS A 590 1.992 -8.256 14.825 1.00 0.00 C ATOM 664 NZ LYS A 590 2.774 -7.000 14.934 1.00 0.00 N ATOM 0 H LYS A 590 2.182 -13.303 13.758 1.00 0.00 H new ATOM 0 HA LYS A 590 0.535 -13.086 16.040 1.00 0.00 H new ATOM 0 HB2 LYS A 590 1.072 -10.663 15.898 1.00 0.00 H new ATOM 0 HB3 LYS A 590 2.492 -11.684 15.782 1.00 0.00 H new ATOM 0 HG2 LYS A 590 2.570 -11.364 13.333 1.00 0.00 H new ATOM 0 HG3 LYS A 590 1.084 -10.437 13.379 1.00 0.00 H new ATOM 0 HD2 LYS A 590 3.680 -9.600 14.754 1.00 0.00 H new ATOM 0 HD3 LYS A 590 3.163 -9.024 13.182 1.00 0.00 H new ATOM 0 HE2 LYS A 590 1.082 -8.069 14.254 1.00 0.00 H new ATOM 0 HE3 LYS A 590 1.684 -8.580 15.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 590 2.195 -6.269 15.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 590 3.630 -7.172 15.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 590 3.047 -6.677 13.984 1.00 0.00 H new ATOM 678 N ASP A 591 -0.837 -12.068 13.166 1.00 0.00 N ATOM 679 CA ASP A 591 -2.134 -11.784 12.501 1.00 0.00 C ATOM 680 C ASP A 591 -3.076 -12.973 12.651 1.00 0.00 C ATOM 681 O ASP A 591 -4.261 -12.795 12.910 1.00 0.00 O ATOM 682 CB ASP A 591 -1.962 -11.454 10.989 1.00 0.00 C ATOM 683 CG ASP A 591 -1.335 -10.079 10.725 1.00 0.00 C ATOM 684 OD1 ASP A 591 -1.773 -9.093 11.356 1.00 0.00 O ATOM 685 OD2 ASP A 591 -0.407 -9.975 9.891 1.00 0.00 O ATOM 0 H ASP A 591 -0.050 -12.144 12.521 1.00 0.00 H new ATOM 0 HA ASP A 591 -2.557 -10.907 12.992 1.00 0.00 H new ATOM 0 HB2 ASP A 591 -1.341 -12.221 10.527 1.00 0.00 H new ATOM 0 HB3 ASP A 591 -2.937 -11.498 10.503 1.00 0.00 H new ATOM 690 N CYS A 592 -2.522 -14.181 12.470 1.00 0.00 N ATOM 691 CA CYS A 592 -3.269 -15.444 12.574 1.00 0.00 C ATOM 692 C CYS A 592 -3.820 -15.673 14.005 1.00 0.00 C ATOM 693 O CYS A 592 -4.934 -16.175 14.168 1.00 0.00 O ATOM 694 CB CYS A 592 -2.359 -16.614 12.142 1.00 0.00 C ATOM 695 SG CYS A 592 -1.765 -16.490 10.440 1.00 0.00 S ATOM 0 H CYS A 592 -1.535 -14.310 12.246 1.00 0.00 H new ATOM 0 HA CYS A 592 -4.131 -15.389 11.909 1.00 0.00 H new ATOM 0 HB2 CYS A 592 -1.501 -16.661 12.813 1.00 0.00 H new ATOM 0 HB3 CYS A 592 -2.907 -17.549 12.258 1.00 0.00 H new ATOM 0 HG CYS A 592 -0.904 -15.521 10.351 1.00 0.00 H new ATOM 701 N MET A 593 -3.026 -15.278 15.028 1.00 0.00 N ATOM 702 CA MET A 593 -3.400 -15.415 16.459 1.00 0.00 C ATOM 703 C MET A 593 -4.497 -14.407 16.819 1.00 0.00 C ATOM 704 O MET A 593 -5.499 -14.771 17.435 1.00 0.00 O ATOM 705 CB MET A 593 -2.173 -15.195 17.395 1.00 0.00 C ATOM 706 CG MET A 593 -1.062 -16.242 17.287 1.00 0.00 C ATOM 707 SD MET A 593 0.363 -15.843 18.325 1.00 0.00 S ATOM 708 CE MET A 593 1.616 -16.935 17.658 1.00 0.00 C ATOM 0 H MET A 593 -2.108 -14.855 14.887 1.00 0.00 H new ATOM 0 HA MET A 593 -3.768 -16.430 16.605 1.00 0.00 H new ATOM 0 HB2 MET A 593 -1.746 -14.215 17.180 1.00 0.00 H new ATOM 0 HB3 MET A 593 -2.525 -15.170 18.426 1.00 0.00 H new ATOM 0 HG2 MET A 593 -1.456 -17.217 17.574 1.00 0.00 H new ATOM 0 HG3 MET A 593 -0.741 -16.321 16.248 1.00 0.00 H new ATOM 0 HE1 MET A 593 2.054 -17.522 18.465 1.00 0.00 H new ATOM 0 HE2 MET A 593 1.163 -17.605 16.927 1.00 0.00 H new ATOM 0 HE3 MET A 593 2.394 -16.344 17.176 1.00 0.00 H new ATOM 718 N LYS A 594 -4.275 -13.140 16.411 1.00 0.00 N ATOM 719 CA LYS A 594 -5.182 -12.009 16.695 1.00 0.00 C ATOM 720 C LYS A 594 -6.557 -12.264 16.054 1.00 0.00 C ATOM 721 O LYS A 594 -7.574 -12.172 16.726 1.00 0.00 O ATOM 722 CB LYS A 594 -4.567 -10.683 16.157 1.00 0.00 C ATOM 723 CG LYS A 594 -5.357 -9.391 16.486 1.00 0.00 C ATOM 724 CD LYS A 594 -5.465 -9.112 18.010 1.00 0.00 C ATOM 725 CE LYS A 594 -5.988 -7.698 18.328 1.00 0.00 C ATOM 726 NZ LYS A 594 -7.324 -7.430 17.729 1.00 0.00 N ATOM 0 H LYS A 594 -3.453 -12.871 15.870 1.00 0.00 H new ATOM 0 HA LYS A 594 -5.312 -11.919 17.773 1.00 0.00 H new ATOM 0 HB2 LYS A 594 -3.559 -10.582 16.560 1.00 0.00 H new ATOM 0 HB3 LYS A 594 -4.471 -10.762 15.074 1.00 0.00 H new ATOM 0 HG2 LYS A 594 -4.873 -8.543 16.001 1.00 0.00 H new ATOM 0 HG3 LYS A 594 -6.360 -9.469 16.065 1.00 0.00 H new ATOM 0 HD2 LYS A 594 -6.128 -9.849 18.462 1.00 0.00 H new ATOM 0 HD3 LYS A 594 -4.484 -9.242 18.468 1.00 0.00 H new ATOM 0 HE2 LYS A 594 -6.047 -7.572 19.409 1.00 0.00 H new ATOM 0 HE3 LYS A 594 -5.275 -6.960 17.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 594 -7.665 -6.499 18.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 594 -7.247 -7.438 16.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 594 -7.994 -8.165 18.033 1.00 0.00 H new ATOM 740 N ARG A 595 -6.531 -12.634 14.756 1.00 0.00 N ATOM 741 CA ARG A 595 -7.726 -13.012 13.961 1.00 0.00 C ATOM 742 C ARG A 595 -8.517 -14.135 14.657 1.00 0.00 C ATOM 743 O ARG A 595 -9.704 -13.973 14.930 1.00 0.00 O ATOM 744 CB ARG A 595 -7.296 -13.464 12.530 1.00 0.00 C ATOM 745 CG ARG A 595 -8.411 -14.077 11.643 1.00 0.00 C ATOM 746 CD ARG A 595 -9.531 -13.089 11.291 1.00 0.00 C ATOM 747 NE ARG A 595 -10.605 -13.746 10.522 1.00 0.00 N ATOM 748 CZ ARG A 595 -11.558 -13.118 9.824 1.00 0.00 C ATOM 749 NH1 ARG A 595 -11.583 -11.790 9.726 1.00 0.00 N ATOM 750 NH2 ARG A 595 -12.490 -13.838 9.214 1.00 0.00 N ATOM 0 H ARG A 595 -5.665 -12.680 14.219 1.00 0.00 H new ATOM 0 HA ARG A 595 -8.374 -12.139 13.880 1.00 0.00 H new ATOM 0 HB2 ARG A 595 -6.879 -12.602 12.009 1.00 0.00 H new ATOM 0 HB3 ARG A 595 -6.495 -14.196 12.628 1.00 0.00 H new ATOM 0 HG2 ARG A 595 -7.965 -14.451 10.721 1.00 0.00 H new ATOM 0 HG3 ARG A 595 -8.843 -14.934 12.159 1.00 0.00 H new ATOM 0 HD2 ARG A 595 -9.944 -12.664 12.206 1.00 0.00 H new ATOM 0 HD3 ARG A 595 -9.120 -12.262 10.712 1.00 0.00 H new ATOM 0 HE ARG A 595 -10.622 -14.766 10.523 1.00 0.00 H new ATOM 0 HH11 ARG A 595 -10.866 -11.231 10.188 1.00 0.00 H new ATOM 0 HH12 ARG A 595 -12.319 -11.332 9.189 1.00 0.00 H new ATOM 0 HH21 ARG A 595 -12.473 -14.856 9.281 1.00 0.00 H new ATOM 0 HH22 ARG A 595 -13.223 -13.374 8.678 1.00 0.00 H new ATOM 764 N TYR A 596 -7.820 -15.250 14.967 1.00 0.00 N ATOM 765 CA TYR A 596 -8.410 -16.432 15.646 1.00 0.00 C ATOM 766 C TYR A 596 -9.048 -16.047 16.992 1.00 0.00 C ATOM 767 O TYR A 596 -10.122 -16.542 17.350 1.00 0.00 O ATOM 768 CB TYR A 596 -7.323 -17.517 15.862 1.00 0.00 C ATOM 769 CG TYR A 596 -7.765 -18.728 16.702 1.00 0.00 C ATOM 770 CD1 TYR A 596 -8.852 -19.514 16.315 1.00 0.00 C ATOM 771 CD2 TYR A 596 -7.097 -19.085 17.876 1.00 0.00 C ATOM 772 CE1 TYR A 596 -9.252 -20.605 17.058 1.00 0.00 C ATOM 773 CE2 TYR A 596 -7.497 -20.176 18.620 1.00 0.00 C ATOM 774 CZ TYR A 596 -8.572 -20.934 18.210 1.00 0.00 C ATOM 775 OH TYR A 596 -8.955 -22.038 18.943 1.00 0.00 O ATOM 0 H TYR A 596 -6.828 -15.359 14.754 1.00 0.00 H new ATOM 0 HA TYR A 596 -9.196 -16.831 15.005 1.00 0.00 H new ATOM 0 HB2 TYR A 596 -6.989 -17.873 14.887 1.00 0.00 H new ATOM 0 HB3 TYR A 596 -6.462 -17.055 16.345 1.00 0.00 H new ATOM 0 HD1 TYR A 596 -9.392 -19.262 15.414 1.00 0.00 H new ATOM 0 HD2 TYR A 596 -6.253 -18.497 18.207 1.00 0.00 H new ATOM 0 HE1 TYR A 596 -10.095 -21.199 16.738 1.00 0.00 H new ATOM 0 HE2 TYR A 596 -6.967 -20.436 19.524 1.00 0.00 H new ATOM 0 HH TYR A 596 -8.372 -22.130 19.725 1.00 0.00 H new ATOM 785 N LYS A 597 -8.374 -15.143 17.709 1.00 0.00 N ATOM 786 CA LYS A 597 -8.803 -14.677 19.033 1.00 0.00 C ATOM 787 C LYS A 597 -10.099 -13.842 18.890 1.00 0.00 C ATOM 788 O LYS A 597 -11.022 -13.994 19.697 1.00 0.00 O ATOM 789 CB LYS A 597 -7.630 -13.897 19.718 1.00 0.00 C ATOM 790 CG LYS A 597 -7.793 -13.595 21.240 1.00 0.00 C ATOM 791 CD LYS A 597 -8.630 -12.331 21.542 1.00 0.00 C ATOM 792 CE LYS A 597 -7.960 -11.054 21.019 1.00 0.00 C ATOM 793 NZ LYS A 597 -8.778 -9.856 21.287 1.00 0.00 N ATOM 0 H LYS A 597 -7.509 -14.710 17.385 1.00 0.00 H new ATOM 0 HA LYS A 597 -9.042 -15.518 19.684 1.00 0.00 H new ATOM 0 HB2 LYS A 597 -6.713 -14.469 19.580 1.00 0.00 H new ATOM 0 HB3 LYS A 597 -7.497 -12.950 19.194 1.00 0.00 H new ATOM 0 HG2 LYS A 597 -8.262 -14.453 21.722 1.00 0.00 H new ATOM 0 HG3 LYS A 597 -6.805 -13.479 21.685 1.00 0.00 H new ATOM 0 HD2 LYS A 597 -9.616 -12.434 21.089 1.00 0.00 H new ATOM 0 HD3 LYS A 597 -8.781 -12.246 22.618 1.00 0.00 H new ATOM 0 HE2 LYS A 597 -6.982 -10.939 21.487 1.00 0.00 H new ATOM 0 HE3 LYS A 597 -7.791 -11.146 19.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 597 -9.107 -9.452 20.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 597 -9.599 -10.119 21.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 597 -8.206 -9.151 21.794 1.00 0.00 H new ATOM 807 N GLU A 598 -10.174 -13.016 17.812 1.00 0.00 N ATOM 808 CA GLU A 598 -11.385 -12.225 17.473 1.00 0.00 C ATOM 809 C GLU A 598 -12.569 -13.165 17.190 1.00 0.00 C ATOM 810 O GLU A 598 -13.681 -12.923 17.659 1.00 0.00 O ATOM 811 CB GLU A 598 -11.169 -11.320 16.220 1.00 0.00 C ATOM 812 CG GLU A 598 -10.026 -10.290 16.312 1.00 0.00 C ATOM 813 CD GLU A 598 -10.113 -9.384 17.543 1.00 0.00 C ATOM 814 OE1 GLU A 598 -11.036 -8.546 17.613 1.00 0.00 O ATOM 815 OE2 GLU A 598 -9.267 -9.503 18.453 1.00 0.00 O ATOM 0 H GLU A 598 -9.402 -12.881 17.159 1.00 0.00 H new ATOM 0 HA GLU A 598 -11.593 -11.587 18.332 1.00 0.00 H new ATOM 0 HB2 GLU A 598 -10.981 -11.964 15.361 1.00 0.00 H new ATOM 0 HB3 GLU A 598 -12.097 -10.785 16.020 1.00 0.00 H new ATOM 0 HG2 GLU A 598 -9.073 -10.818 16.327 1.00 0.00 H new ATOM 0 HG3 GLU A 598 -10.033 -9.671 15.415 1.00 0.00 H new ATOM 822 N LEU A 599 -12.288 -14.249 16.423 1.00 0.00 N ATOM 823 CA LEU A 599 -13.299 -15.244 15.999 1.00 0.00 C ATOM 824 C LEU A 599 -14.006 -15.858 17.213 1.00 0.00 C ATOM 825 O LEU A 599 -15.239 -15.898 17.265 1.00 0.00 O ATOM 826 CB LEU A 599 -12.650 -16.369 15.135 1.00 0.00 C ATOM 827 CG LEU A 599 -11.937 -15.908 13.824 1.00 0.00 C ATOM 828 CD1 LEU A 599 -11.295 -17.101 13.079 1.00 0.00 C ATOM 829 CD2 LEU A 599 -12.889 -15.099 12.916 1.00 0.00 C ATOM 0 H LEU A 599 -11.349 -14.456 16.081 1.00 0.00 H new ATOM 0 HA LEU A 599 -14.038 -14.723 15.391 1.00 0.00 H new ATOM 0 HB2 LEU A 599 -11.924 -16.899 15.752 1.00 0.00 H new ATOM 0 HB3 LEU A 599 -13.426 -17.087 14.869 1.00 0.00 H new ATOM 0 HG LEU A 599 -11.126 -15.238 14.108 1.00 0.00 H new ATOM 0 HD11 LEU A 599 -10.808 -16.744 12.172 1.00 0.00 H new ATOM 0 HD12 LEU A 599 -10.557 -17.578 13.724 1.00 0.00 H new ATOM 0 HD13 LEU A 599 -12.067 -17.824 12.816 1.00 0.00 H new ATOM 0 HD21 LEU A 599 -12.359 -14.795 12.013 1.00 0.00 H new ATOM 0 HD22 LEU A 599 -13.745 -15.717 12.644 1.00 0.00 H new ATOM 0 HD23 LEU A 599 -13.236 -14.214 13.449 1.00 0.00 H new ATOM 841 N VAL A 600 -13.202 -16.285 18.207 1.00 0.00 N ATOM 842 CA VAL A 600 -13.715 -16.906 19.440 1.00 0.00 C ATOM 843 C VAL A 600 -14.574 -15.901 20.242 1.00 0.00 C ATOM 844 O VAL A 600 -15.695 -16.226 20.619 1.00 0.00 O ATOM 845 CB VAL A 600 -12.558 -17.486 20.338 1.00 0.00 C ATOM 846 CG1 VAL A 600 -13.116 -18.158 21.626 1.00 0.00 C ATOM 847 CG2 VAL A 600 -11.662 -18.466 19.529 1.00 0.00 C ATOM 0 H VAL A 600 -12.185 -16.209 18.177 1.00 0.00 H new ATOM 0 HA VAL A 600 -14.344 -17.745 19.140 1.00 0.00 H new ATOM 0 HB VAL A 600 -11.935 -16.650 20.655 1.00 0.00 H new ATOM 0 HG11 VAL A 600 -12.289 -18.547 22.221 1.00 0.00 H new ATOM 0 HG12 VAL A 600 -13.669 -17.422 22.210 1.00 0.00 H new ATOM 0 HG13 VAL A 600 -13.781 -18.977 21.350 1.00 0.00 H new ATOM 0 HG21 VAL A 600 -10.871 -18.852 20.173 1.00 0.00 H new ATOM 0 HG22 VAL A 600 -12.268 -19.295 19.162 1.00 0.00 H new ATOM 0 HG23 VAL A 600 -11.218 -17.940 18.684 1.00 0.00 H new ATOM 857 N GLU A 601 -14.064 -14.664 20.433 1.00 0.00 N ATOM 858 CA GLU A 601 -14.778 -13.615 21.207 1.00 0.00 C ATOM 859 C GLU A 601 -16.146 -13.272 20.578 1.00 0.00 C ATOM 860 O GLU A 601 -17.142 -13.106 21.294 1.00 0.00 O ATOM 861 CB GLU A 601 -13.924 -12.318 21.315 1.00 0.00 C ATOM 862 CG GLU A 601 -12.577 -12.471 22.047 1.00 0.00 C ATOM 863 CD GLU A 601 -12.709 -13.019 23.475 1.00 0.00 C ATOM 864 OE1 GLU A 601 -13.248 -12.306 24.347 1.00 0.00 O ATOM 865 OE2 GLU A 601 -12.269 -14.155 23.735 1.00 0.00 O ATOM 0 H GLU A 601 -13.162 -14.364 20.064 1.00 0.00 H new ATOM 0 HA GLU A 601 -14.944 -14.021 22.205 1.00 0.00 H new ATOM 0 HB2 GLU A 601 -13.731 -11.946 20.309 1.00 0.00 H new ATOM 0 HB3 GLU A 601 -14.513 -11.558 21.828 1.00 0.00 H new ATOM 0 HG2 GLU A 601 -11.934 -13.136 21.470 1.00 0.00 H new ATOM 0 HG3 GLU A 601 -12.082 -11.501 22.084 1.00 0.00 H new ATOM 872 N MET A 602 -16.180 -13.191 19.234 1.00 0.00 N ATOM 873 CA MET A 602 -17.400 -12.847 18.485 1.00 0.00 C ATOM 874 C MET A 602 -18.458 -13.956 18.614 1.00 0.00 C ATOM 875 O MET A 602 -19.604 -13.667 18.955 1.00 0.00 O ATOM 876 CB MET A 602 -17.084 -12.556 16.987 1.00 0.00 C ATOM 877 CG MET A 602 -16.312 -11.246 16.735 1.00 0.00 C ATOM 878 SD MET A 602 -16.088 -10.884 14.974 1.00 0.00 S ATOM 879 CE MET A 602 -15.083 -12.265 14.419 1.00 0.00 C ATOM 0 H MET A 602 -15.367 -13.361 18.642 1.00 0.00 H new ATOM 0 HA MET A 602 -17.808 -11.936 18.923 1.00 0.00 H new ATOM 0 HB2 MET A 602 -16.505 -13.387 16.584 1.00 0.00 H new ATOM 0 HB3 MET A 602 -18.021 -12.522 16.432 1.00 0.00 H new ATOM 0 HG2 MET A 602 -16.846 -10.420 17.205 1.00 0.00 H new ATOM 0 HG3 MET A 602 -15.335 -11.308 17.215 1.00 0.00 H new ATOM 0 HE1 MET A 602 -14.743 -12.081 13.400 1.00 0.00 H new ATOM 0 HE2 MET A 602 -14.220 -12.374 15.075 1.00 0.00 H new ATOM 0 HE3 MET A 602 -15.675 -13.180 14.445 1.00 0.00 H new ATOM 889 N VAL A 603 -18.057 -15.228 18.389 1.00 0.00 N ATOM 890 CA VAL A 603 -19.002 -16.370 18.428 1.00 0.00 C ATOM 891 C VAL A 603 -19.538 -16.609 19.860 1.00 0.00 C ATOM 892 O VAL A 603 -20.679 -17.062 20.025 1.00 0.00 O ATOM 893 CB VAL A 603 -18.383 -17.694 17.828 1.00 0.00 C ATOM 894 CG1 VAL A 603 -17.938 -17.473 16.358 1.00 0.00 C ATOM 895 CG2 VAL A 603 -17.226 -18.250 18.697 1.00 0.00 C ATOM 0 H VAL A 603 -17.093 -15.489 18.180 1.00 0.00 H new ATOM 0 HA VAL A 603 -19.842 -16.097 17.789 1.00 0.00 H new ATOM 0 HB VAL A 603 -19.166 -18.453 17.837 1.00 0.00 H new ATOM 0 HG11 VAL A 603 -17.515 -18.397 15.963 1.00 0.00 H new ATOM 0 HG12 VAL A 603 -18.800 -17.183 15.757 1.00 0.00 H new ATOM 0 HG13 VAL A 603 -17.187 -16.684 16.320 1.00 0.00 H new ATOM 0 HG21 VAL A 603 -16.834 -19.160 18.242 1.00 0.00 H new ATOM 0 HG22 VAL A 603 -16.431 -17.507 18.764 1.00 0.00 H new ATOM 0 HG23 VAL A 603 -17.597 -18.475 19.697 1.00 0.00 H new ATOM 905 N LYS A 604 -18.714 -16.274 20.883 1.00 0.00 N ATOM 906 CA LYS A 604 -19.115 -16.316 22.311 1.00 0.00 C ATOM 907 C LYS A 604 -20.230 -15.294 22.576 1.00 0.00 C ATOM 908 O LYS A 604 -21.263 -15.626 23.163 1.00 0.00 O ATOM 909 CB LYS A 604 -17.901 -16.013 23.244 1.00 0.00 C ATOM 910 CG LYS A 604 -16.829 -17.122 23.324 1.00 0.00 C ATOM 911 CD LYS A 604 -17.366 -18.435 23.931 1.00 0.00 C ATOM 912 CE LYS A 604 -16.259 -19.478 24.162 1.00 0.00 C ATOM 913 NZ LYS A 604 -15.245 -18.991 25.135 1.00 0.00 N ATOM 0 H LYS A 604 -17.752 -15.967 20.741 1.00 0.00 H new ATOM 0 HA LYS A 604 -19.479 -17.320 22.528 1.00 0.00 H new ATOM 0 HB2 LYS A 604 -17.423 -15.095 22.903 1.00 0.00 H new ATOM 0 HB3 LYS A 604 -18.277 -15.822 24.249 1.00 0.00 H new ATOM 0 HG2 LYS A 604 -16.444 -17.321 22.324 1.00 0.00 H new ATOM 0 HG3 LYS A 604 -15.991 -16.767 23.923 1.00 0.00 H new ATOM 0 HD2 LYS A 604 -17.858 -18.218 24.879 1.00 0.00 H new ATOM 0 HD3 LYS A 604 -18.122 -18.855 23.268 1.00 0.00 H new ATOM 0 HE2 LYS A 604 -16.701 -20.404 24.529 1.00 0.00 H new ATOM 0 HE3 LYS A 604 -15.773 -19.710 23.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 604 -14.654 -19.787 25.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 604 -14.646 -18.272 24.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 604 -15.725 -18.572 25.957 1.00 0.00 H new ATOM 927 N ALA A 605 -19.995 -14.054 22.097 1.00 0.00 N ATOM 928 CA ALA A 605 -20.911 -12.908 22.292 1.00 0.00 C ATOM 929 C ALA A 605 -22.266 -13.154 21.609 1.00 0.00 C ATOM 930 O ALA A 605 -23.322 -12.815 22.166 1.00 0.00 O ATOM 931 CB ALA A 605 -20.267 -11.611 21.762 1.00 0.00 C ATOM 0 H ALA A 605 -19.160 -13.818 21.561 1.00 0.00 H new ATOM 0 HA ALA A 605 -21.091 -12.800 23.361 1.00 0.00 H new ATOM 0 HB1 ALA A 605 -20.952 -10.777 21.912 1.00 0.00 H new ATOM 0 HB2 ALA A 605 -19.339 -11.419 22.300 1.00 0.00 H new ATOM 0 HB3 ALA A 605 -20.054 -11.719 20.698 1.00 0.00 H new ATOM 937 N LYS A 606 -22.217 -13.764 20.404 1.00 0.00 N ATOM 938 CA LYS A 606 -23.426 -14.106 19.633 1.00 0.00 C ATOM 939 C LYS A 606 -24.258 -15.146 20.392 1.00 0.00 C ATOM 940 O LYS A 606 -25.412 -14.894 20.706 1.00 0.00 O ATOM 941 CB LYS A 606 -23.080 -14.646 18.217 1.00 0.00 C ATOM 942 CG LYS A 606 -22.365 -13.634 17.294 1.00 0.00 C ATOM 943 CD LYS A 606 -22.214 -14.140 15.839 1.00 0.00 C ATOM 944 CE LYS A 606 -23.577 -14.327 15.133 1.00 0.00 C ATOM 945 NZ LYS A 606 -23.418 -14.783 13.732 1.00 0.00 N ATOM 0 H LYS A 606 -21.346 -14.030 19.945 1.00 0.00 H new ATOM 0 HA LYS A 606 -24.003 -13.190 19.509 1.00 0.00 H new ATOM 0 HB2 LYS A 606 -22.448 -15.528 18.324 1.00 0.00 H new ATOM 0 HB3 LYS A 606 -24.001 -14.971 17.732 1.00 0.00 H new ATOM 0 HG2 LYS A 606 -22.923 -12.698 17.291 1.00 0.00 H new ATOM 0 HG3 LYS A 606 -21.378 -13.415 17.701 1.00 0.00 H new ATOM 0 HD2 LYS A 606 -21.609 -13.432 15.272 1.00 0.00 H new ATOM 0 HD3 LYS A 606 -21.676 -15.088 15.841 1.00 0.00 H new ATOM 0 HE2 LYS A 606 -24.175 -15.052 15.685 1.00 0.00 H new ATOM 0 HE3 LYS A 606 -24.125 -13.385 15.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 606 -24.355 -14.896 13.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 606 -22.870 -14.079 13.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 606 -22.918 -15.695 13.718 1.00 0.00 H new ATOM 959 N LYS A 607 -23.626 -16.289 20.735 1.00 0.00 N ATOM 960 CA LYS A 607 -24.309 -17.437 21.368 1.00 0.00 C ATOM 961 C LYS A 607 -24.897 -17.063 22.743 1.00 0.00 C ATOM 962 O LYS A 607 -26.002 -17.500 23.089 1.00 0.00 O ATOM 963 CB LYS A 607 -23.338 -18.644 21.481 1.00 0.00 C ATOM 964 CG LYS A 607 -23.949 -19.927 22.098 1.00 0.00 C ATOM 965 CD LYS A 607 -25.175 -20.503 21.324 1.00 0.00 C ATOM 966 CE LYS A 607 -24.835 -21.133 19.954 1.00 0.00 C ATOM 967 NZ LYS A 607 -24.611 -20.126 18.891 1.00 0.00 N ATOM 0 H LYS A 607 -22.629 -16.441 20.581 1.00 0.00 H new ATOM 0 HA LYS A 607 -25.146 -17.724 20.732 1.00 0.00 H new ATOM 0 HB2 LYS A 607 -22.963 -18.882 20.486 1.00 0.00 H new ATOM 0 HB3 LYS A 607 -22.480 -18.344 22.082 1.00 0.00 H new ATOM 0 HG2 LYS A 607 -23.176 -20.693 22.148 1.00 0.00 H new ATOM 0 HG3 LYS A 607 -24.252 -19.712 23.123 1.00 0.00 H new ATOM 0 HD2 LYS A 607 -25.658 -21.257 21.945 1.00 0.00 H new ATOM 0 HD3 LYS A 607 -25.900 -19.703 21.171 1.00 0.00 H new ATOM 0 HE2 LYS A 607 -23.942 -21.750 20.056 1.00 0.00 H new ATOM 0 HE3 LYS A 607 -25.647 -21.795 19.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 607 -24.871 -20.531 17.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 607 -25.196 -19.287 19.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 607 -23.608 -19.852 18.878 1.00 0.00 H new ATOM 981 N ALA A 608 -24.160 -16.225 23.494 1.00 0.00 N ATOM 982 CA ALA A 608 -24.595 -15.724 24.810 1.00 0.00 C ATOM 983 C ALA A 608 -25.857 -14.856 24.665 1.00 0.00 C ATOM 984 O ALA A 608 -26.826 -15.034 25.402 1.00 0.00 O ATOM 985 CB ALA A 608 -23.458 -14.935 25.475 1.00 0.00 C ATOM 0 H ALA A 608 -23.246 -15.876 23.205 1.00 0.00 H new ATOM 0 HA ALA A 608 -24.843 -16.573 25.447 1.00 0.00 H new ATOM 0 HB1 ALA A 608 -23.789 -14.569 26.447 1.00 0.00 H new ATOM 0 HB2 ALA A 608 -22.593 -15.585 25.608 1.00 0.00 H new ATOM 0 HB3 ALA A 608 -23.183 -14.090 24.843 1.00 0.00 H new ATOM 991 N ALA A 609 -25.842 -13.957 23.656 1.00 0.00 N ATOM 992 CA ALA A 609 -26.967 -13.038 23.358 1.00 0.00 C ATOM 993 C ALA A 609 -28.216 -13.809 22.886 1.00 0.00 C ATOM 994 O ALA A 609 -29.332 -13.509 23.308 1.00 0.00 O ATOM 995 CB ALA A 609 -26.546 -11.998 22.306 1.00 0.00 C ATOM 0 H ALA A 609 -25.049 -13.847 23.024 1.00 0.00 H new ATOM 0 HA ALA A 609 -27.227 -12.519 24.281 1.00 0.00 H new ATOM 0 HB1 ALA A 609 -27.383 -11.331 22.098 1.00 0.00 H new ATOM 0 HB2 ALA A 609 -25.705 -11.418 22.685 1.00 0.00 H new ATOM 0 HB3 ALA A 609 -26.252 -12.507 21.388 1.00 0.00 H new ATOM 1001 N GLN A 610 -27.993 -14.822 22.025 1.00 0.00 N ATOM 1002 CA GLN A 610 -29.047 -15.732 21.512 1.00 0.00 C ATOM 1003 C GLN A 610 -29.680 -16.525 22.665 1.00 0.00 C ATOM 1004 O GLN A 610 -30.877 -16.825 22.644 1.00 0.00 O ATOM 1005 CB GLN A 610 -28.434 -16.715 20.469 1.00 0.00 C ATOM 1006 CG GLN A 610 -27.885 -16.043 19.190 1.00 0.00 C ATOM 1007 CD GLN A 610 -26.997 -16.962 18.337 1.00 0.00 C ATOM 1008 OE1 GLN A 610 -26.333 -17.857 18.850 1.00 0.00 O ATOM 1009 NE2 GLN A 610 -26.963 -16.732 17.038 1.00 0.00 N ATOM 0 H GLN A 610 -27.065 -15.037 21.659 1.00 0.00 H new ATOM 0 HA GLN A 610 -29.822 -15.134 21.033 1.00 0.00 H new ATOM 0 HB2 GLN A 610 -27.627 -17.271 20.945 1.00 0.00 H new ATOM 0 HB3 GLN A 610 -29.196 -17.441 20.183 1.00 0.00 H new ATOM 0 HG2 GLN A 610 -28.723 -15.699 18.584 1.00 0.00 H new ATOM 0 HG3 GLN A 610 -27.312 -15.160 19.473 1.00 0.00 H new ATOM 0 HE21 GLN A 610 -27.526 -15.981 16.638 1.00 0.00 H new ATOM 0 HE22 GLN A 610 -26.374 -17.305 16.434 1.00 0.00 H new ATOM 1018 N GLU A 611 -28.847 -16.848 23.669 1.00 0.00 N ATOM 1019 CA GLU A 611 -29.267 -17.586 24.866 1.00 0.00 C ATOM 1020 C GLU A 611 -30.081 -16.677 25.823 1.00 0.00 C ATOM 1021 O GLU A 611 -30.934 -17.170 26.568 1.00 0.00 O ATOM 1022 CB GLU A 611 -28.031 -18.182 25.595 1.00 0.00 C ATOM 1023 CG GLU A 611 -28.389 -19.045 26.814 1.00 0.00 C ATOM 1024 CD GLU A 611 -27.188 -19.670 27.524 1.00 0.00 C ATOM 1025 OE1 GLU A 611 -26.610 -19.020 28.416 1.00 0.00 O ATOM 1026 OE2 GLU A 611 -26.843 -20.827 27.212 1.00 0.00 O ATOM 0 H GLU A 611 -27.857 -16.601 23.670 1.00 0.00 H new ATOM 0 HA GLU A 611 -29.914 -18.405 24.552 1.00 0.00 H new ATOM 0 HB2 GLU A 611 -27.460 -18.785 24.889 1.00 0.00 H new ATOM 0 HB3 GLU A 611 -27.382 -17.367 25.916 1.00 0.00 H new ATOM 0 HG2 GLU A 611 -28.938 -18.432 27.528 1.00 0.00 H new ATOM 0 HG3 GLU A 611 -29.061 -19.842 26.494 1.00 0.00 H new ATOM 1033 N GLN A 612 -29.808 -15.353 25.806 1.00 0.00 N ATOM 1034 CA GLN A 612 -30.579 -14.372 26.611 1.00 0.00 C ATOM 1035 C GLN A 612 -31.967 -14.153 25.983 1.00 0.00 C ATOM 1036 O GLN A 612 -32.969 -14.043 26.696 1.00 0.00 O ATOM 1037 CB GLN A 612 -29.827 -13.014 26.755 1.00 0.00 C ATOM 1038 CG GLN A 612 -28.379 -13.116 27.294 1.00 0.00 C ATOM 1039 CD GLN A 612 -28.220 -13.927 28.589 1.00 0.00 C ATOM 1040 OE1 GLN A 612 -29.099 -13.941 29.456 1.00 0.00 O ATOM 1041 NE2 GLN A 612 -27.095 -14.622 28.724 1.00 0.00 N ATOM 0 H GLN A 612 -29.063 -14.938 25.247 1.00 0.00 H new ATOM 0 HA GLN A 612 -30.696 -14.784 27.613 1.00 0.00 H new ATOM 0 HB2 GLN A 612 -29.801 -12.526 25.781 1.00 0.00 H new ATOM 0 HB3 GLN A 612 -30.400 -12.368 27.420 1.00 0.00 H new ATOM 0 HG2 GLN A 612 -27.752 -13.565 26.524 1.00 0.00 H new ATOM 0 HG3 GLN A 612 -28.000 -12.108 27.466 1.00 0.00 H new ATOM 0 HE21 GLN A 612 -26.386 -14.592 27.991 1.00 0.00 H new ATOM 0 HE22 GLN A 612 -26.941 -15.186 29.560 1.00 0.00 H new ATOM 1050 N VAL A 613 -32.001 -14.116 24.637 1.00 0.00 N ATOM 1051 CA VAL A 613 -33.252 -14.071 23.851 1.00 0.00 C ATOM 1052 C VAL A 613 -34.083 -15.344 24.121 1.00 0.00 C ATOM 1053 O VAL A 613 -35.308 -15.281 24.261 1.00 0.00 O ATOM 1054 CB VAL A 613 -32.952 -13.927 22.307 1.00 0.00 C ATOM 1055 CG1 VAL A 613 -34.248 -13.972 21.445 1.00 0.00 C ATOM 1056 CG2 VAL A 613 -32.143 -12.636 22.021 1.00 0.00 C ATOM 0 H VAL A 613 -31.159 -14.116 24.061 1.00 0.00 H new ATOM 0 HA VAL A 613 -33.823 -13.196 24.161 1.00 0.00 H new ATOM 0 HB VAL A 613 -32.348 -14.787 22.018 1.00 0.00 H new ATOM 0 HG11 VAL A 613 -33.988 -13.869 20.391 1.00 0.00 H new ATOM 0 HG12 VAL A 613 -34.757 -14.923 21.602 1.00 0.00 H new ATOM 0 HG13 VAL A 613 -34.908 -13.155 21.737 1.00 0.00 H new ATOM 0 HG21 VAL A 613 -31.948 -12.558 20.951 1.00 0.00 H new ATOM 0 HG22 VAL A 613 -32.715 -11.768 22.350 1.00 0.00 H new ATOM 0 HG23 VAL A 613 -31.197 -12.673 22.560 1.00 0.00 H new ATOM 1066 N LEU A 614 -33.372 -16.491 24.225 1.00 0.00 N ATOM 1067 CA LEU A 614 -33.961 -17.803 24.566 1.00 0.00 C ATOM 1068 C LEU A 614 -34.582 -17.737 25.974 1.00 0.00 C ATOM 1069 O LEU A 614 -35.715 -18.162 26.167 1.00 0.00 O ATOM 1070 CB LEU A 614 -32.868 -18.920 24.461 1.00 0.00 C ATOM 1071 CG LEU A 614 -33.325 -20.431 24.552 1.00 0.00 C ATOM 1072 CD1 LEU A 614 -32.251 -21.364 23.943 1.00 0.00 C ATOM 1073 CD2 LEU A 614 -33.656 -20.888 26.002 1.00 0.00 C ATOM 0 H LEU A 614 -32.364 -16.530 24.073 1.00 0.00 H new ATOM 0 HA LEU A 614 -34.754 -18.052 23.861 1.00 0.00 H new ATOM 0 HB2 LEU A 614 -32.348 -18.787 23.512 1.00 0.00 H new ATOM 0 HB3 LEU A 614 -32.138 -18.746 25.252 1.00 0.00 H new ATOM 0 HG LEU A 614 -34.248 -20.502 23.976 1.00 0.00 H new ATOM 0 HD11 LEU A 614 -32.585 -22.399 24.016 1.00 0.00 H new ATOM 0 HD12 LEU A 614 -32.096 -21.105 22.896 1.00 0.00 H new ATOM 0 HD13 LEU A 614 -31.315 -21.246 24.488 1.00 0.00 H new ATOM 0 HD21 LEU A 614 -33.963 -21.934 25.993 1.00 0.00 H new ATOM 0 HD22 LEU A 614 -32.772 -20.774 26.630 1.00 0.00 H new ATOM 0 HD23 LEU A 614 -34.465 -20.276 26.400 1.00 0.00 H new ATOM 1085 N ASN A 615 -33.826 -17.173 26.933 1.00 0.00 N ATOM 1086 CA ASN A 615 -34.249 -17.039 28.355 1.00 0.00 C ATOM 1087 C ASN A 615 -35.531 -16.197 28.467 1.00 0.00 C ATOM 1088 O ASN A 615 -36.449 -16.532 29.228 1.00 0.00 O ATOM 1089 CB ASN A 615 -33.111 -16.380 29.184 1.00 0.00 C ATOM 1090 CG ASN A 615 -33.458 -16.163 30.666 1.00 0.00 C ATOM 1091 OD1 ASN A 615 -33.236 -17.033 31.501 1.00 0.00 O ATOM 1092 ND2 ASN A 615 -33.990 -14.991 31.002 1.00 0.00 N ATOM 0 H ASN A 615 -32.897 -16.792 26.751 1.00 0.00 H new ATOM 0 HA ASN A 615 -34.455 -18.034 28.749 1.00 0.00 H new ATOM 0 HB2 ASN A 615 -32.220 -17.004 29.118 1.00 0.00 H new ATOM 0 HB3 ASN A 615 -32.860 -15.418 28.736 1.00 0.00 H new ATOM 0 HD21 ASN A 615 -34.224 -14.798 31.976 1.00 0.00 H new ATOM 0 HD22 ASN A 615 -34.164 -14.286 30.286 1.00 0.00 H new ATOM 1099 N ALA A 616 -35.565 -15.109 27.682 1.00 0.00 N ATOM 1100 CA ALA A 616 -36.685 -14.159 27.650 1.00 0.00 C ATOM 1101 C ALA A 616 -37.958 -14.822 27.083 1.00 0.00 C ATOM 1102 O ALA A 616 -39.054 -14.637 27.617 1.00 0.00 O ATOM 1103 CB ALA A 616 -36.295 -12.924 26.826 1.00 0.00 C ATOM 0 H ALA A 616 -34.807 -14.863 27.045 1.00 0.00 H new ATOM 0 HA ALA A 616 -36.906 -13.845 28.670 1.00 0.00 H new ATOM 0 HB1 ALA A 616 -37.129 -12.222 26.805 1.00 0.00 H new ATOM 0 HB2 ALA A 616 -35.428 -12.444 27.279 1.00 0.00 H new ATOM 0 HB3 ALA A 616 -36.051 -13.228 25.808 1.00 0.00 H new ATOM 1109 N SER A 617 -37.788 -15.613 26.006 1.00 0.00 N ATOM 1110 CA SER A 617 -38.902 -16.306 25.315 1.00 0.00 C ATOM 1111 C SER A 617 -39.300 -17.613 26.037 1.00 0.00 C ATOM 1112 O SER A 617 -40.396 -18.134 25.817 1.00 0.00 O ATOM 1113 CB SER A 617 -38.514 -16.588 23.843 1.00 0.00 C ATOM 1114 OG SER A 617 -37.287 -17.292 23.752 1.00 0.00 O ATOM 0 H SER A 617 -36.875 -15.792 25.587 1.00 0.00 H new ATOM 0 HA SER A 617 -39.773 -15.650 25.336 1.00 0.00 H new ATOM 0 HB2 SER A 617 -39.303 -17.167 23.363 1.00 0.00 H new ATOM 0 HB3 SER A 617 -38.435 -15.646 23.300 1.00 0.00 H new ATOM 0 HG SER A 617 -36.541 -16.664 23.850 1.00 0.00 H new ATOM 1120 N ARG A 618 -38.401 -18.131 26.899 1.00 0.00 N ATOM 1121 CA ARG A 618 -38.627 -19.387 27.656 1.00 0.00 C ATOM 1122 C ARG A 618 -39.485 -19.101 28.901 1.00 0.00 C ATOM 1123 O ARG A 618 -40.476 -19.794 29.161 1.00 0.00 O ATOM 1124 CB ARG A 618 -37.265 -20.042 28.063 1.00 0.00 C ATOM 1125 CG ARG A 618 -37.376 -21.387 28.832 1.00 0.00 C ATOM 1126 CD ARG A 618 -38.151 -22.461 28.047 1.00 0.00 C ATOM 1127 NE ARG A 618 -38.241 -23.736 28.788 1.00 0.00 N ATOM 1128 CZ ARG A 618 -39.295 -24.564 28.787 1.00 0.00 C ATOM 1129 NH1 ARG A 618 -40.412 -24.248 28.142 1.00 0.00 N ATOM 1130 NH2 ARG A 618 -39.225 -25.706 29.451 1.00 0.00 N ATOM 0 H ARG A 618 -37.500 -17.695 27.092 1.00 0.00 H new ATOM 0 HA ARG A 618 -39.160 -20.090 27.016 1.00 0.00 H new ATOM 0 HB2 ARG A 618 -36.676 -20.207 27.161 1.00 0.00 H new ATOM 0 HB3 ARG A 618 -36.711 -19.335 28.680 1.00 0.00 H new ATOM 0 HG2 ARG A 618 -36.375 -21.757 29.054 1.00 0.00 H new ATOM 0 HG3 ARG A 618 -37.871 -21.214 29.788 1.00 0.00 H new ATOM 0 HD2 ARG A 618 -39.155 -22.097 27.830 1.00 0.00 H new ATOM 0 HD3 ARG A 618 -37.661 -22.633 27.089 1.00 0.00 H new ATOM 0 HE ARG A 618 -37.433 -24.009 29.347 1.00 0.00 H new ATOM 0 HH11 ARG A 618 -40.477 -23.364 27.637 1.00 0.00 H new ATOM 0 HH12 ARG A 618 -41.205 -24.889 28.151 1.00 0.00 H new ATOM 0 HH21 ARG A 618 -38.374 -25.950 29.958 1.00 0.00 H new ATOM 0 HH22 ARG A 618 -40.022 -26.343 29.456 1.00 0.00 H new ATOM 1144 N ALA A 619 -39.113 -18.045 29.638 1.00 0.00 N ATOM 1145 CA ALA A 619 -39.804 -17.626 30.867 1.00 0.00 C ATOM 1146 C ALA A 619 -39.999 -16.102 30.849 1.00 0.00 C ATOM 1147 O ALA A 619 -39.100 -15.361 30.431 1.00 0.00 O ATOM 1148 CB ALA A 619 -39.009 -18.073 32.111 1.00 0.00 C ATOM 0 H ALA A 619 -38.318 -17.453 29.397 1.00 0.00 H new ATOM 0 HA ALA A 619 -40.783 -18.102 30.914 1.00 0.00 H new ATOM 0 HB1 ALA A 619 -39.534 -17.755 33.012 1.00 0.00 H new ATOM 0 HB2 ALA A 619 -38.913 -19.159 32.111 1.00 0.00 H new ATOM 0 HB3 ALA A 619 -38.017 -17.621 32.091 1.00 0.00 H new ATOM 1154 N LYS A 620 -41.183 -15.651 31.289 1.00 0.00 N ATOM 1155 CA LYS A 620 -41.524 -14.216 31.369 1.00 0.00 C ATOM 1156 C LYS A 620 -41.008 -13.617 32.687 1.00 0.00 C ATOM 1157 O LYS A 620 -40.880 -14.322 33.698 1.00 0.00 O ATOM 1158 CB LYS A 620 -43.058 -14.015 31.231 1.00 0.00 C ATOM 1159 CG LYS A 620 -43.620 -14.501 29.878 1.00 0.00 C ATOM 1160 CD LYS A 620 -45.125 -14.216 29.695 1.00 0.00 C ATOM 1161 CE LYS A 620 -45.653 -14.734 28.345 1.00 0.00 C ATOM 1162 NZ LYS A 620 -47.062 -14.348 28.108 1.00 0.00 N ATOM 0 H LYS A 620 -41.933 -16.268 31.600 1.00 0.00 H new ATOM 0 HA LYS A 620 -41.038 -13.694 30.545 1.00 0.00 H new ATOM 0 HB2 LYS A 620 -43.561 -14.548 32.038 1.00 0.00 H new ATOM 0 HB3 LYS A 620 -43.291 -12.957 31.354 1.00 0.00 H new ATOM 0 HG2 LYS A 620 -43.067 -14.020 29.071 1.00 0.00 H new ATOM 0 HG3 LYS A 620 -43.448 -15.574 29.787 1.00 0.00 H new ATOM 0 HD2 LYS A 620 -45.683 -14.684 30.506 1.00 0.00 H new ATOM 0 HD3 LYS A 620 -45.301 -13.143 29.765 1.00 0.00 H new ATOM 0 HE2 LYS A 620 -45.031 -14.343 27.540 1.00 0.00 H new ATOM 0 HE3 LYS A 620 -45.566 -15.820 28.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 620 -47.373 -14.719 27.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 620 -47.661 -14.742 28.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 620 -47.143 -13.311 28.109 1.00 0.00 H new ATOM 1176 N LYS A 621 -40.696 -12.318 32.646 1.00 0.00 N ATOM 1177 CA LYS A 621 -40.128 -11.578 33.776 1.00 0.00 C ATOM 1178 C LYS A 621 -41.269 -10.916 34.598 1.00 0.00 C ATOM 1179 CB LYS A 621 -39.115 -10.531 33.226 1.00 0.00 C ATOM 1180 CG LYS A 621 -37.938 -11.129 32.425 1.00 0.00 C ATOM 1181 CD LYS A 621 -36.938 -10.064 31.897 1.00 0.00 C ATOM 1182 CE LYS A 621 -36.135 -9.342 33.011 1.00 0.00 C ATOM 1183 NZ LYS A 621 -36.960 -8.397 33.815 1.00 0.00 N ATOM 0 H LYS A 621 -40.833 -11.743 31.815 1.00 0.00 H new ATOM 0 HA LYS A 621 -39.595 -12.249 34.450 1.00 0.00 H new ATOM 0 HB2 LYS A 621 -39.651 -9.828 32.588 1.00 0.00 H new ATOM 0 HB3 LYS A 621 -38.714 -9.960 34.063 1.00 0.00 H new ATOM 0 HG2 LYS A 621 -37.402 -11.836 33.058 1.00 0.00 H new ATOM 0 HG3 LYS A 621 -38.334 -11.693 31.581 1.00 0.00 H new ATOM 0 HD2 LYS A 621 -36.238 -10.545 31.214 1.00 0.00 H new ATOM 0 HD3 LYS A 621 -37.487 -9.320 31.320 1.00 0.00 H new ATOM 0 HE2 LYS A 621 -35.698 -10.088 33.675 1.00 0.00 H new ATOM 0 HE3 LYS A 621 -35.308 -8.796 32.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 621 -36.456 -7.492 33.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 621 -37.870 -8.237 33.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 621 -37.131 -8.801 34.758 1.00 0.00 H new TER 1197 LYS A 621