USER MOD reduce.3.24.130724 H: found=0, std=0, add=809, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 811 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 55 TYR OH : rot -63:sc= 0.211 USER MOD Set 1.2: A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HD1:sc= -0.0694 X(o=-0.069,f=-0.075) USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 171:sc= -2.6! USER MOD Single : A 46 ASN : amide:sc=0.000865 K(o=0.00087,f=-8.4!) USER MOD Single : A 48 GLN : amide:sc= -0.0511 K(o=-0.051,f=-1.5!) USER MOD Single : A 49 SER OG : rot 180:sc= -0.168 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=-0.0063) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 68:sc= -0.664 USER MOD Single : A 74 LYS NZ :NH3+ -129:sc= -1.3! (180deg=-5.75!) USER MOD Single : A 77 SER OG : rot 180:sc= -0.211 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.0622 USER MOD Single : A 81 LYS NZ :NH3+ 150:sc= -2.23 (180deg=-4.86!) USER MOD Single : A 83 THR OG1 : rot 160:sc= 0.00598 USER MOD Single : A 89 THR OG1 : rot 75:sc= -0.476! USER MOD Single : A 91 GLN : amide:sc= -0.186 K(o=-0.19,f=-2.6!) USER MOD Single : A 99 LYS NZ :NH3+ 145:sc= -0.123 (180deg=-0.892) USER MOD Single : A 101 ASN : amide:sc= -0.348 K(o=-0.35,f=-0.92) USER MOD Single : A 106 GLN : amide:sc=-0.00428 K(o=-0.0043,f=-2.3!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 101:sc= 0.0326 USER MOD Single : A 115 GLN : amide:sc= -0.188 K(o=-0.19,f=-1.7) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.112 USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 GLN : amide:sc=0.000812 X(o=0.00081,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 26 30.766 10.823 4.270 1.00 0.00 N ATOM 2 CA GLY A 26 31.120 10.458 2.868 1.00 0.00 C ATOM 3 C GLY A 26 29.852 10.067 2.103 1.00 0.00 C ATOM 4 O GLY A 26 29.127 9.178 2.509 1.00 0.00 O ATOM 0 HA2 GLY A 26 31.610 11.298 2.375 1.00 0.00 H new ATOM 0 HA3 GLY A 26 31.829 9.630 2.865 1.00 0.00 H new ATOM 10 N SER A 27 29.586 10.729 0.998 1.00 0.00 N ATOM 11 CA SER A 27 28.365 10.411 0.183 1.00 0.00 C ATOM 12 C SER A 27 27.096 10.533 1.041 1.00 0.00 C ATOM 13 O SER A 27 27.093 11.185 2.070 1.00 0.00 O ATOM 14 CB SER A 27 28.562 8.971 -0.303 1.00 0.00 C ATOM 15 OG SER A 27 29.855 8.839 -0.881 1.00 0.00 O ATOM 0 H SER A 27 30.166 11.480 0.624 1.00 0.00 H new ATOM 0 HA SER A 27 28.242 11.101 -0.651 1.00 0.00 H new ATOM 0 HB2 SER A 27 28.451 8.276 0.530 1.00 0.00 H new ATOM 0 HB3 SER A 27 27.796 8.715 -1.035 1.00 0.00 H new ATOM 0 HG SER A 27 29.982 7.918 -1.191 1.00 0.00 H new ATOM 21 N HIS A 28 26.018 9.915 0.622 1.00 0.00 N ATOM 22 CA HIS A 28 24.749 9.997 1.408 1.00 0.00 C ATOM 23 C HIS A 28 24.150 8.597 1.586 1.00 0.00 C ATOM 24 O HIS A 28 23.665 7.996 0.644 1.00 0.00 O ATOM 25 CB HIS A 28 23.819 10.882 0.573 1.00 0.00 C ATOM 26 CG HIS A 28 24.365 12.284 0.523 1.00 0.00 C ATOM 27 ND1 HIS A 28 24.416 13.097 1.644 1.00 0.00 N ATOM 28 CD2 HIS A 28 24.895 13.025 -0.503 1.00 0.00 C ATOM 29 CE1 HIS A 28 24.960 14.270 1.270 1.00 0.00 C ATOM 30 NE2 HIS A 28 25.269 14.279 -0.030 1.00 0.00 N ATOM 0 H HIS A 28 25.963 9.358 -0.230 1.00 0.00 H new ATOM 0 HA HIS A 28 24.905 10.405 2.407 1.00 0.00 H new ATOM 0 HB2 HIS A 28 23.728 10.480 -0.436 1.00 0.00 H new ATOM 0 HB3 HIS A 28 22.819 10.886 1.006 1.00 0.00 H new ATOM 0 HD2 HIS A 28 25.005 12.686 -1.523 1.00 0.00 H new ATOM 0 HE1 HIS A 28 25.126 15.102 1.939 1.00 0.00 H new ATOM 0 HE2 HIS A 28 25.689 15.042 -0.562 1.00 0.00 H new ATOM 38 N MET A 29 24.181 8.076 2.786 1.00 0.00 N ATOM 39 CA MET A 29 23.615 6.713 3.032 1.00 0.00 C ATOM 40 C MET A 29 22.185 6.825 3.579 1.00 0.00 C ATOM 41 O MET A 29 21.901 6.424 4.694 1.00 0.00 O ATOM 42 CB MET A 29 24.548 6.074 4.067 1.00 0.00 C ATOM 43 CG MET A 29 25.891 5.734 3.412 1.00 0.00 C ATOM 44 SD MET A 29 26.212 3.960 3.579 1.00 0.00 S ATOM 45 CE MET A 29 25.344 3.430 2.082 1.00 0.00 C ATOM 0 H MET A 29 24.574 8.535 3.608 1.00 0.00 H new ATOM 0 HA MET A 29 23.557 6.117 2.121 1.00 0.00 H new ATOM 0 HB2 MET A 29 24.702 6.757 4.902 1.00 0.00 H new ATOM 0 HB3 MET A 29 24.092 5.171 4.474 1.00 0.00 H new ATOM 0 HG2 MET A 29 25.875 6.014 2.359 1.00 0.00 H new ATOM 0 HG3 MET A 29 26.692 6.305 3.882 1.00 0.00 H new ATOM 0 HE1 MET A 29 25.416 2.347 1.984 1.00 0.00 H new ATOM 0 HE2 MET A 29 24.295 3.720 2.148 1.00 0.00 H new ATOM 0 HE3 MET A 29 25.798 3.904 1.211 1.00 0.00 H new ATOM 55 N GLN A 30 21.284 7.372 2.800 1.00 0.00 N ATOM 56 CA GLN A 30 19.869 7.519 3.263 1.00 0.00 C ATOM 57 C GLN A 30 18.898 7.137 2.139 1.00 0.00 C ATOM 58 O GLN A 30 19.145 7.402 0.979 1.00 0.00 O ATOM 59 CB GLN A 30 19.720 9.001 3.622 1.00 0.00 C ATOM 60 CG GLN A 30 20.513 9.305 4.897 1.00 0.00 C ATOM 61 CD GLN A 30 20.485 10.810 5.172 1.00 0.00 C ATOM 62 OE1 GLN A 30 21.144 11.575 4.496 1.00 0.00 O ATOM 63 NE2 GLN A 30 19.746 11.271 6.144 1.00 0.00 N ATOM 0 H GLN A 30 21.468 7.724 1.861 1.00 0.00 H new ATOM 0 HA GLN A 30 19.643 6.870 4.109 1.00 0.00 H new ATOM 0 HB2 GLN A 30 20.080 9.622 2.802 1.00 0.00 H new ATOM 0 HB3 GLN A 30 18.668 9.246 3.769 1.00 0.00 H new ATOM 0 HG2 GLN A 30 20.086 8.763 5.741 1.00 0.00 H new ATOM 0 HG3 GLN A 30 21.543 8.964 4.787 1.00 0.00 H new ATOM 0 HE21 GLN A 30 19.192 10.630 6.712 1.00 0.00 H new ATOM 0 HE22 GLN A 30 19.722 12.273 6.336 1.00 0.00 H new ATOM 72 N ALA A 31 17.792 6.518 2.477 1.00 0.00 N ATOM 73 CA ALA A 31 16.799 6.117 1.434 1.00 0.00 C ATOM 74 C ALA A 31 15.368 6.343 1.938 1.00 0.00 C ATOM 75 O ALA A 31 15.146 6.615 3.103 1.00 0.00 O ATOM 76 CB ALA A 31 17.051 4.627 1.192 1.00 0.00 C ATOM 0 H ALA A 31 17.535 6.273 3.433 1.00 0.00 H new ATOM 0 HA ALA A 31 16.908 6.703 0.522 1.00 0.00 H new ATOM 0 HB1 ALA A 31 16.358 4.259 0.436 1.00 0.00 H new ATOM 0 HB2 ALA A 31 18.075 4.482 0.847 1.00 0.00 H new ATOM 0 HB3 ALA A 31 16.900 4.077 2.121 1.00 0.00 H new ATOM 82 N LEU A 32 14.400 6.229 1.061 1.00 0.00 N ATOM 83 CA LEU A 32 12.972 6.435 1.475 1.00 0.00 C ATOM 84 C LEU A 32 12.575 5.439 2.579 1.00 0.00 C ATOM 85 O LEU A 32 13.270 4.474 2.840 1.00 0.00 O ATOM 86 CB LEU A 32 12.135 6.216 0.202 1.00 0.00 C ATOM 87 CG LEU A 32 12.225 4.756 -0.259 1.00 0.00 C ATOM 88 CD1 LEU A 32 10.861 4.298 -0.780 1.00 0.00 C ATOM 89 CD2 LEU A 32 13.255 4.638 -1.385 1.00 0.00 C ATOM 0 H LEU A 32 14.535 6.002 0.076 1.00 0.00 H new ATOM 0 HA LEU A 32 12.811 7.430 1.889 1.00 0.00 H new ATOM 0 HB2 LEU A 32 11.095 6.479 0.395 1.00 0.00 H new ATOM 0 HB3 LEU A 32 12.489 6.876 -0.590 1.00 0.00 H new ATOM 0 HG LEU A 32 12.526 4.132 0.582 1.00 0.00 H new ATOM 0 HD11 LEU A 32 10.926 3.260 -1.107 1.00 0.00 H new ATOM 0 HD12 LEU A 32 10.121 4.382 0.016 1.00 0.00 H new ATOM 0 HD13 LEU A 32 10.563 4.925 -1.620 1.00 0.00 H new ATOM 0 HD21 LEU A 32 13.319 3.600 -1.712 1.00 0.00 H new ATOM 0 HD22 LEU A 32 12.951 5.265 -2.223 1.00 0.00 H new ATOM 0 HD23 LEU A 32 14.230 4.965 -1.022 1.00 0.00 H new ATOM 101 N SER A 33 11.466 5.681 3.234 1.00 0.00 N ATOM 102 CA SER A 33 11.014 4.774 4.339 1.00 0.00 C ATOM 103 C SER A 33 10.260 3.543 3.812 1.00 0.00 C ATOM 104 O SER A 33 9.579 2.876 4.566 1.00 0.00 O ATOM 105 CB SER A 33 10.078 5.634 5.182 1.00 0.00 C ATOM 106 OG SER A 33 10.841 6.370 6.130 1.00 0.00 O ATOM 0 H SER A 33 10.849 6.473 3.051 1.00 0.00 H new ATOM 0 HA SER A 33 11.865 4.384 4.898 1.00 0.00 H new ATOM 0 HB2 SER A 33 9.517 6.315 4.542 1.00 0.00 H new ATOM 0 HB3 SER A 33 9.350 5.005 5.694 1.00 0.00 H new ATOM 0 HG SER A 33 10.242 6.925 6.672 1.00 0.00 H new ATOM 112 N TYR A 34 10.369 3.252 2.533 1.00 0.00 N ATOM 113 CA TYR A 34 9.661 2.072 1.920 1.00 0.00 C ATOM 114 C TYR A 34 8.146 2.303 1.897 1.00 0.00 C ATOM 115 O TYR A 34 7.518 2.200 0.862 1.00 0.00 O ATOM 116 CB TYR A 34 10.026 0.847 2.776 1.00 0.00 C ATOM 117 CG TYR A 34 9.199 -0.341 2.345 1.00 0.00 C ATOM 118 CD1 TYR A 34 9.556 -1.065 1.201 1.00 0.00 C ATOM 119 CD2 TYR A 34 8.073 -0.713 3.088 1.00 0.00 C ATOM 120 CE1 TYR A 34 8.785 -2.161 0.799 1.00 0.00 C ATOM 121 CE2 TYR A 34 7.303 -1.807 2.688 1.00 0.00 C ATOM 122 CZ TYR A 34 7.656 -2.532 1.543 1.00 0.00 C ATOM 123 OH TYR A 34 6.896 -3.613 1.150 1.00 0.00 O ATOM 0 H TYR A 34 10.930 3.793 1.874 1.00 0.00 H new ATOM 0 HA TYR A 34 9.968 1.922 0.885 1.00 0.00 H new ATOM 0 HB2 TYR A 34 11.087 0.621 2.671 1.00 0.00 H new ATOM 0 HB3 TYR A 34 9.849 1.062 3.830 1.00 0.00 H new ATOM 0 HD1 TYR A 34 10.426 -0.778 0.629 1.00 0.00 H new ATOM 0 HD2 TYR A 34 7.800 -0.154 3.971 1.00 0.00 H new ATOM 0 HE1 TYR A 34 9.059 -2.721 -0.083 1.00 0.00 H new ATOM 0 HE2 TYR A 34 6.435 -2.094 3.262 1.00 0.00 H new ATOM 0 HH TYR A 34 6.241 -3.823 1.848 1.00 0.00 H new ATOM 133 N ARG A 35 7.559 2.620 3.026 1.00 0.00 N ATOM 134 CA ARG A 35 6.088 2.867 3.076 1.00 0.00 C ATOM 135 C ARG A 35 5.698 3.953 2.064 1.00 0.00 C ATOM 136 O ARG A 35 4.640 3.897 1.470 1.00 0.00 O ATOM 137 CB ARG A 35 5.812 3.335 4.507 1.00 0.00 C ATOM 138 CG ARG A 35 4.429 2.850 4.951 1.00 0.00 C ATOM 139 CD ARG A 35 4.464 2.506 6.443 1.00 0.00 C ATOM 140 NE ARG A 35 3.601 1.297 6.588 1.00 0.00 N ATOM 141 CZ ARG A 35 2.495 1.361 7.282 1.00 0.00 C ATOM 142 NH1 ARG A 35 2.547 1.527 8.578 1.00 0.00 N ATOM 143 NH2 ARG A 35 1.339 1.260 6.678 1.00 0.00 N ATOM 0 H ARG A 35 8.041 2.718 3.919 1.00 0.00 H new ATOM 0 HA ARG A 35 5.510 1.978 2.822 1.00 0.00 H new ATOM 0 HB2 ARG A 35 6.577 2.948 5.180 1.00 0.00 H new ATOM 0 HB3 ARG A 35 5.861 4.423 4.560 1.00 0.00 H new ATOM 0 HG2 ARG A 35 3.683 3.622 4.762 1.00 0.00 H new ATOM 0 HG3 ARG A 35 4.135 1.975 4.372 1.00 0.00 H new ATOM 0 HD2 ARG A 35 5.482 2.305 6.777 1.00 0.00 H new ATOM 0 HD3 ARG A 35 4.088 3.332 7.046 1.00 0.00 H new ATOM 0 HE ARG A 35 3.874 0.420 6.145 1.00 0.00 H new ATOM 0 HH11 ARG A 35 3.450 1.606 9.046 1.00 0.00 H new ATOM 0 HH12 ARG A 35 1.685 1.577 9.121 1.00 0.00 H new ATOM 0 HH21 ARG A 35 1.301 1.131 5.667 1.00 0.00 H new ATOM 0 HH22 ARG A 35 0.475 1.310 7.218 1.00 0.00 H new ATOM 157 N GLU A 36 6.552 4.931 1.856 1.00 0.00 N ATOM 158 CA GLU A 36 6.230 6.013 0.868 1.00 0.00 C ATOM 159 C GLU A 36 6.094 5.416 -0.538 1.00 0.00 C ATOM 160 O GLU A 36 5.198 5.763 -1.284 1.00 0.00 O ATOM 161 CB GLU A 36 7.409 6.989 0.930 1.00 0.00 C ATOM 162 CG GLU A 36 6.942 8.382 0.496 1.00 0.00 C ATOM 163 CD GLU A 36 8.157 9.261 0.187 1.00 0.00 C ATOM 164 OE1 GLU A 36 8.686 9.854 1.112 1.00 0.00 O ATOM 165 OE2 GLU A 36 8.536 9.327 -0.972 1.00 0.00 O ATOM 0 H GLU A 36 7.453 5.026 2.325 1.00 0.00 H new ATOM 0 HA GLU A 36 5.288 6.511 1.097 1.00 0.00 H new ATOM 0 HB2 GLU A 36 7.810 7.027 1.943 1.00 0.00 H new ATOM 0 HB3 GLU A 36 8.214 6.645 0.281 1.00 0.00 H new ATOM 0 HG2 GLU A 36 6.304 8.304 -0.384 1.00 0.00 H new ATOM 0 HG3 GLU A 36 6.343 8.837 1.285 1.00 0.00 H new ATOM 172 N ALA A 37 6.971 4.508 -0.894 1.00 0.00 N ATOM 173 CA ALA A 37 6.892 3.870 -2.243 1.00 0.00 C ATOM 174 C ALA A 37 5.635 2.998 -2.333 1.00 0.00 C ATOM 175 O ALA A 37 5.000 2.923 -3.364 1.00 0.00 O ATOM 176 CB ALA A 37 8.155 3.011 -2.364 1.00 0.00 C ATOM 0 H ALA A 37 7.738 4.182 -0.307 1.00 0.00 H new ATOM 0 HA ALA A 37 6.832 4.606 -3.045 1.00 0.00 H new ATOM 0 HB1 ALA A 37 8.164 2.511 -3.333 1.00 0.00 H new ATOM 0 HB2 ALA A 37 9.037 3.646 -2.275 1.00 0.00 H new ATOM 0 HB3 ALA A 37 8.164 2.264 -1.570 1.00 0.00 H new ATOM 182 N VAL A 38 5.270 2.347 -1.252 1.00 0.00 N ATOM 183 CA VAL A 38 4.046 1.484 -1.263 1.00 0.00 C ATOM 184 C VAL A 38 2.795 2.351 -1.446 1.00 0.00 C ATOM 185 O VAL A 38 1.886 1.989 -2.167 1.00 0.00 O ATOM 186 CB VAL A 38 4.027 0.780 0.099 1.00 0.00 C ATOM 187 CG1 VAL A 38 2.831 -0.174 0.172 1.00 0.00 C ATOM 188 CG2 VAL A 38 5.322 -0.019 0.286 1.00 0.00 C ATOM 0 H VAL A 38 5.768 2.377 -0.362 1.00 0.00 H new ATOM 0 HA VAL A 38 4.058 0.764 -2.081 1.00 0.00 H new ATOM 0 HB VAL A 38 3.944 1.530 0.886 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.822 -0.672 1.142 1.00 0.00 H new ATOM 0 HG12 VAL A 38 1.907 0.390 0.045 1.00 0.00 H new ATOM 0 HG13 VAL A 38 2.912 -0.920 -0.618 1.00 0.00 H new ATOM 0 HG21 VAL A 38 5.305 -0.518 1.255 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.407 -0.765 -0.505 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.176 0.657 0.241 1.00 0.00 H new ATOM 198 N LEU A 39 2.749 3.498 -0.810 1.00 0.00 N ATOM 199 CA LEU A 39 1.562 4.395 -0.960 1.00 0.00 C ATOM 200 C LEU A 39 1.430 4.830 -2.423 1.00 0.00 C ATOM 201 O LEU A 39 0.353 4.819 -2.989 1.00 0.00 O ATOM 202 CB LEU A 39 1.848 5.606 -0.066 1.00 0.00 C ATOM 203 CG LEU A 39 1.685 5.216 1.405 1.00 0.00 C ATOM 204 CD1 LEU A 39 2.598 6.088 2.270 1.00 0.00 C ATOM 205 CD2 LEU A 39 0.230 5.422 1.831 1.00 0.00 C ATOM 0 H LEU A 39 3.482 3.850 -0.194 1.00 0.00 H new ATOM 0 HA LEU A 39 0.632 3.902 -0.678 1.00 0.00 H new ATOM 0 HB2 LEU A 39 2.860 5.971 -0.245 1.00 0.00 H new ATOM 0 HB3 LEU A 39 1.167 6.421 -0.313 1.00 0.00 H new ATOM 0 HG LEU A 39 1.956 4.168 1.533 1.00 0.00 H new ATOM 0 HD11 LEU A 39 2.481 5.810 3.317 1.00 0.00 H new ATOM 0 HD12 LEU A 39 3.635 5.940 1.969 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.329 7.136 2.141 1.00 0.00 H new ATOM 0 HD21 LEU A 39 0.115 5.144 2.879 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -0.042 6.469 1.701 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -0.421 4.799 1.217 1.00 0.00 H new ATOM 217 N ARG A 40 2.528 5.198 -3.037 1.00 0.00 N ATOM 218 CA ARG A 40 2.483 5.620 -4.469 1.00 0.00 C ATOM 219 C ARG A 40 2.242 4.399 -5.365 1.00 0.00 C ATOM 220 O ARG A 40 1.482 4.457 -6.312 1.00 0.00 O ATOM 221 CB ARG A 40 3.855 6.239 -4.750 1.00 0.00 C ATOM 222 CG ARG A 40 3.703 7.365 -5.772 1.00 0.00 C ATOM 223 CD ARG A 40 3.808 6.789 -7.188 1.00 0.00 C ATOM 224 NE ARG A 40 4.595 7.795 -7.958 1.00 0.00 N ATOM 225 CZ ARG A 40 5.896 7.834 -7.849 1.00 0.00 C ATOM 226 NH1 ARG A 40 6.637 7.089 -8.627 1.00 0.00 N ATOM 227 NH2 ARG A 40 6.452 8.616 -6.961 1.00 0.00 N ATOM 0 H ARG A 40 3.453 5.224 -2.607 1.00 0.00 H new ATOM 0 HA ARG A 40 1.677 6.327 -4.669 1.00 0.00 H new ATOM 0 HB2 ARG A 40 4.288 6.626 -3.827 1.00 0.00 H new ATOM 0 HB3 ARG A 40 4.539 5.479 -5.128 1.00 0.00 H new ATOM 0 HG2 ARG A 40 2.742 7.862 -5.641 1.00 0.00 H new ATOM 0 HG3 ARG A 40 4.475 8.118 -5.616 1.00 0.00 H new ATOM 0 HD2 ARG A 40 4.305 5.819 -7.183 1.00 0.00 H new ATOM 0 HD3 ARG A 40 2.822 6.640 -7.627 1.00 0.00 H new ATOM 0 HE ARG A 40 4.116 8.454 -8.571 1.00 0.00 H new ATOM 0 HH11 ARG A 40 6.199 6.479 -9.317 1.00 0.00 H new ATOM 0 HH12 ARG A 40 7.653 7.118 -8.544 1.00 0.00 H new ATOM 0 HH21 ARG A 40 5.870 9.194 -6.355 1.00 0.00 H new ATOM 0 HH22 ARG A 40 7.468 8.648 -6.874 1.00 0.00 H new ATOM 241 N ALA A 41 2.876 3.289 -5.059 1.00 0.00 N ATOM 242 CA ALA A 41 2.679 2.050 -5.873 1.00 0.00 C ATOM 243 C ALA A 41 1.217 1.600 -5.791 1.00 0.00 C ATOM 244 O ALA A 41 0.637 1.182 -6.774 1.00 0.00 O ATOM 245 CB ALA A 41 3.597 0.999 -5.245 1.00 0.00 C ATOM 0 H ALA A 41 3.523 3.191 -4.277 1.00 0.00 H new ATOM 0 HA ALA A 41 2.912 2.209 -6.926 1.00 0.00 H new ATOM 0 HB1 ALA A 41 3.504 0.061 -5.793 1.00 0.00 H new ATOM 0 HB2 ALA A 41 4.630 1.345 -5.290 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.312 0.842 -4.205 1.00 0.00 H new ATOM 251 N VAL A 42 0.614 1.694 -4.627 1.00 0.00 N ATOM 252 CA VAL A 42 -0.818 1.284 -4.487 1.00 0.00 C ATOM 253 C VAL A 42 -1.696 2.189 -5.364 1.00 0.00 C ATOM 254 O VAL A 42 -2.614 1.730 -6.019 1.00 0.00 O ATOM 255 CB VAL A 42 -1.138 1.456 -2.992 1.00 0.00 C ATOM 256 CG1 VAL A 42 -2.644 1.656 -2.788 1.00 0.00 C ATOM 257 CG2 VAL A 42 -0.692 0.202 -2.234 1.00 0.00 C ATOM 0 H VAL A 42 1.052 2.036 -3.772 1.00 0.00 H new ATOM 0 HA VAL A 42 -1.004 0.260 -4.810 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.609 2.332 -2.616 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -2.854 1.776 -1.725 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -2.969 2.547 -3.325 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -3.181 0.787 -3.168 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -0.916 0.319 -1.174 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -1.223 -0.667 -2.624 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.381 0.060 -2.364 1.00 0.00 H new ATOM 267 N ASP A 43 -1.404 3.468 -5.398 1.00 0.00 N ATOM 268 CA ASP A 43 -2.200 4.401 -6.253 1.00 0.00 C ATOM 269 C ASP A 43 -1.919 4.102 -7.731 1.00 0.00 C ATOM 270 O ASP A 43 -2.813 4.116 -8.558 1.00 0.00 O ATOM 271 CB ASP A 43 -1.714 5.808 -5.881 1.00 0.00 C ATOM 272 CG ASP A 43 -2.680 6.437 -4.873 1.00 0.00 C ATOM 273 OD1 ASP A 43 -2.767 5.932 -3.765 1.00 0.00 O ATOM 274 OD2 ASP A 43 -3.316 7.416 -5.225 1.00 0.00 O ATOM 0 H ASP A 43 -0.648 3.905 -4.870 1.00 0.00 H new ATOM 0 HA ASP A 43 -3.274 4.299 -6.098 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -0.712 5.757 -5.456 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -1.650 6.429 -6.774 1.00 0.00 H new ATOM 279 N ARG A 44 -0.683 3.809 -8.061 1.00 0.00 N ATOM 280 CA ARG A 44 -0.335 3.483 -9.477 1.00 0.00 C ATOM 281 C ARG A 44 -0.951 2.131 -9.856 1.00 0.00 C ATOM 282 O ARG A 44 -1.413 1.940 -10.965 1.00 0.00 O ATOM 283 CB ARG A 44 1.197 3.408 -9.514 1.00 0.00 C ATOM 284 CG ARG A 44 1.733 4.338 -10.606 1.00 0.00 C ATOM 285 CD ARG A 44 1.847 3.567 -11.925 1.00 0.00 C ATOM 286 NE ARG A 44 2.296 4.575 -12.930 1.00 0.00 N ATOM 287 CZ ARG A 44 2.698 4.183 -14.111 1.00 0.00 C ATOM 288 NH1 ARG A 44 1.829 3.738 -14.980 1.00 0.00 N ATOM 289 NH2 ARG A 44 3.966 4.239 -14.421 1.00 0.00 N ATOM 0 H ARG A 44 0.100 3.782 -7.408 1.00 0.00 H new ATOM 0 HA ARG A 44 -0.714 4.224 -10.181 1.00 0.00 H new ATOM 0 HB2 ARG A 44 1.608 3.693 -8.546 1.00 0.00 H new ATOM 0 HB3 ARG A 44 1.516 2.384 -9.706 1.00 0.00 H new ATOM 0 HG2 ARG A 44 1.068 5.193 -10.729 1.00 0.00 H new ATOM 0 HG3 ARG A 44 2.708 4.731 -10.317 1.00 0.00 H new ATOM 0 HD2 ARG A 44 2.562 2.748 -11.842 1.00 0.00 H new ATOM 0 HD3 ARG A 44 0.891 3.128 -12.208 1.00 0.00 H new ATOM 0 HE ARG A 44 2.289 5.568 -12.696 1.00 0.00 H new ATOM 0 HH11 ARG A 44 0.839 3.697 -14.736 1.00 0.00 H new ATOM 0 HH12 ARG A 44 2.140 3.432 -15.902 1.00 0.00 H new ATOM 0 HH21 ARG A 44 4.642 4.588 -13.742 1.00 0.00 H new ATOM 0 HH22 ARG A 44 4.280 3.933 -15.342 1.00 0.00 H new ATOM 303 N LEU A 45 -0.968 1.198 -8.932 1.00 0.00 N ATOM 304 CA LEU A 45 -1.560 -0.146 -9.210 1.00 0.00 C ATOM 305 C LEU A 45 -3.053 -0.005 -9.530 1.00 0.00 C ATOM 306 O LEU A 45 -3.565 -0.645 -10.428 1.00 0.00 O ATOM 307 CB LEU A 45 -1.356 -0.943 -7.916 1.00 0.00 C ATOM 308 CG LEU A 45 -1.804 -2.393 -8.118 1.00 0.00 C ATOM 309 CD1 LEU A 45 -0.817 -3.333 -7.422 1.00 0.00 C ATOM 310 CD2 LEU A 45 -3.198 -2.586 -7.516 1.00 0.00 C ATOM 0 H LEU A 45 -0.593 1.314 -7.990 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.097 -0.637 -10.066 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -0.306 -0.915 -7.624 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -1.925 -0.488 -7.105 1.00 0.00 H new ATOM 0 HG LEU A 45 -1.833 -2.618 -9.184 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -1.135 -4.366 -7.565 1.00 0.00 H new ATOM 0 HD12 LEU A 45 0.177 -3.197 -7.848 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -0.789 -3.107 -6.356 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.517 -3.618 -7.660 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.168 -2.361 -6.450 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -3.903 -1.917 -8.009 1.00 0.00 H new ATOM 322 N ASN A 46 -3.747 0.836 -8.802 1.00 0.00 N ATOM 323 CA ASN A 46 -5.208 1.035 -9.059 1.00 0.00 C ATOM 324 C ASN A 46 -5.419 1.628 -10.458 1.00 0.00 C ATOM 325 O ASN A 46 -6.280 1.194 -11.200 1.00 0.00 O ATOM 326 CB ASN A 46 -5.679 2.021 -7.982 1.00 0.00 C ATOM 327 CG ASN A 46 -6.848 1.416 -7.201 1.00 0.00 C ATOM 328 OD1 ASN A 46 -6.843 1.411 -5.987 1.00 0.00 O ATOM 329 ND2 ASN A 46 -7.864 0.910 -7.850 1.00 0.00 N ATOM 0 H ASN A 46 -3.364 1.394 -8.039 1.00 0.00 H new ATOM 0 HA ASN A 46 -5.764 0.098 -9.019 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -4.858 2.253 -7.304 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -5.985 2.960 -8.444 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -8.650 0.512 -7.336 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -7.870 0.913 -8.870 1.00 0.00 H new ATOM 336 N GLU A 47 -4.633 2.613 -10.821 1.00 0.00 N ATOM 337 CA GLU A 47 -4.775 3.237 -12.172 1.00 0.00 C ATOM 338 C GLU A 47 -4.315 2.258 -13.264 1.00 0.00 C ATOM 339 O GLU A 47 -4.848 2.246 -14.356 1.00 0.00 O ATOM 340 CB GLU A 47 -3.872 4.474 -12.140 1.00 0.00 C ATOM 341 CG GLU A 47 -4.215 5.394 -13.318 1.00 0.00 C ATOM 342 CD GLU A 47 -4.413 6.827 -12.815 1.00 0.00 C ATOM 343 OE1 GLU A 47 -3.419 7.492 -12.570 1.00 0.00 O ATOM 344 OE2 GLU A 47 -5.554 7.234 -12.687 1.00 0.00 O ATOM 0 H GLU A 47 -3.898 3.012 -10.237 1.00 0.00 H new ATOM 0 HA GLU A 47 -5.809 3.497 -12.397 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.003 5.008 -11.199 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.825 4.174 -12.193 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -3.416 5.366 -14.058 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -5.121 5.044 -13.813 1.00 0.00 H new ATOM 351 N GLN A 48 -3.332 1.438 -12.973 1.00 0.00 N ATOM 352 CA GLN A 48 -2.834 0.454 -13.989 1.00 0.00 C ATOM 353 C GLN A 48 -3.916 -0.586 -14.321 1.00 0.00 C ATOM 354 O GLN A 48 -3.952 -1.119 -15.414 1.00 0.00 O ATOM 355 CB GLN A 48 -1.629 -0.227 -13.331 1.00 0.00 C ATOM 356 CG GLN A 48 -0.623 -0.647 -14.406 1.00 0.00 C ATOM 357 CD GLN A 48 0.793 -0.592 -13.829 1.00 0.00 C ATOM 358 OE1 GLN A 48 1.330 0.475 -13.607 1.00 0.00 O ATOM 359 NE2 GLN A 48 1.428 -1.705 -13.572 1.00 0.00 N ATOM 0 H GLN A 48 -2.852 1.408 -12.074 1.00 0.00 H new ATOM 0 HA GLN A 48 -2.571 0.943 -14.927 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -1.156 0.454 -12.623 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -1.956 -1.099 -12.765 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -0.846 -1.655 -14.754 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -0.701 0.013 -15.270 1.00 0.00 H new ATOM 0 HE21 GLN A 48 0.980 -2.602 -13.757 1.00 0.00 H new ATOM 0 HE22 GLN A 48 2.372 -1.676 -13.186 1.00 0.00 H new ATOM 368 N SER A 49 -4.793 -0.880 -13.391 1.00 0.00 N ATOM 369 CA SER A 49 -5.864 -1.885 -13.655 1.00 0.00 C ATOM 370 C SER A 49 -7.127 -1.200 -14.191 1.00 0.00 C ATOM 371 O SER A 49 -7.228 0.013 -14.221 1.00 0.00 O ATOM 372 CB SER A 49 -6.147 -2.531 -12.296 1.00 0.00 C ATOM 373 OG SER A 49 -6.901 -3.723 -12.487 1.00 0.00 O ATOM 0 H SER A 49 -4.811 -0.465 -12.459 1.00 0.00 H new ATOM 0 HA SER A 49 -5.560 -2.616 -14.404 1.00 0.00 H new ATOM 0 HB2 SER A 49 -5.210 -2.758 -11.787 1.00 0.00 H new ATOM 0 HB3 SER A 49 -6.697 -1.838 -11.659 1.00 0.00 H new ATOM 0 HG SER A 49 -7.082 -4.139 -11.618 1.00 0.00 H new ATOM 379 N SER A 50 -8.094 -1.979 -14.598 1.00 0.00 N ATOM 380 CA SER A 50 -9.370 -1.408 -15.121 1.00 0.00 C ATOM 381 C SER A 50 -10.489 -1.660 -14.105 1.00 0.00 C ATOM 382 O SER A 50 -11.591 -2.045 -14.454 1.00 0.00 O ATOM 383 CB SER A 50 -9.639 -2.161 -16.428 1.00 0.00 C ATOM 384 OG SER A 50 -8.630 -1.839 -17.376 1.00 0.00 O ATOM 0 H SER A 50 -8.054 -2.998 -14.590 1.00 0.00 H new ATOM 0 HA SER A 50 -9.317 -0.332 -15.287 1.00 0.00 H new ATOM 0 HB2 SER A 50 -9.652 -3.235 -16.245 1.00 0.00 H new ATOM 0 HB3 SER A 50 -10.620 -1.893 -16.820 1.00 0.00 H new ATOM 0 HG SER A 50 -8.800 -2.322 -18.212 1.00 0.00 H new ATOM 390 N GLU A 51 -10.199 -1.462 -12.844 1.00 0.00 N ATOM 391 CA GLU A 51 -11.223 -1.707 -11.783 1.00 0.00 C ATOM 392 C GLU A 51 -12.309 -0.626 -11.798 1.00 0.00 C ATOM 393 O GLU A 51 -12.172 0.410 -12.421 1.00 0.00 O ATOM 394 CB GLU A 51 -10.463 -1.647 -10.458 1.00 0.00 C ATOM 395 CG GLU A 51 -9.334 -2.678 -10.442 1.00 0.00 C ATOM 396 CD GLU A 51 -8.307 -2.280 -9.380 1.00 0.00 C ATOM 397 OE1 GLU A 51 -7.573 -1.333 -9.616 1.00 0.00 O ATOM 398 OE2 GLU A 51 -8.275 -2.925 -8.346 1.00 0.00 O ATOM 0 H GLU A 51 -9.294 -1.140 -12.502 1.00 0.00 H new ATOM 0 HA GLU A 51 -11.722 -2.664 -11.938 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -10.053 -0.648 -10.312 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -11.147 -1.835 -9.631 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -9.733 -3.669 -10.226 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -8.860 -2.732 -11.422 1.00 0.00 H new ATOM 405 N ALA A 52 -13.385 -0.868 -11.090 1.00 0.00 N ATOM 406 CA ALA A 52 -14.492 0.128 -11.021 1.00 0.00 C ATOM 407 C ALA A 52 -14.442 0.872 -9.679 1.00 0.00 C ATOM 408 O ALA A 52 -14.802 2.029 -9.592 1.00 0.00 O ATOM 409 CB ALA A 52 -15.777 -0.695 -11.135 1.00 0.00 C ATOM 0 H ALA A 52 -13.542 -1.721 -10.553 1.00 0.00 H new ATOM 0 HA ALA A 52 -14.425 0.880 -11.807 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -16.640 -0.030 -11.092 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -15.781 -1.234 -12.082 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -15.827 -1.408 -10.312 1.00 0.00 H new ATOM 415 N ASN A 53 -13.992 0.212 -8.635 1.00 0.00 N ATOM 416 CA ASN A 53 -13.905 0.868 -7.295 1.00 0.00 C ATOM 417 C ASN A 53 -12.434 1.032 -6.889 1.00 0.00 C ATOM 418 O ASN A 53 -11.597 0.215 -7.228 1.00 0.00 O ATOM 419 CB ASN A 53 -14.624 -0.085 -6.332 1.00 0.00 C ATOM 420 CG ASN A 53 -16.100 -0.212 -6.730 1.00 0.00 C ATOM 421 OD1 ASN A 53 -16.465 -1.105 -7.470 1.00 0.00 O ATOM 422 ND2 ASN A 53 -16.968 0.649 -6.273 1.00 0.00 N ATOM 0 H ASN A 53 -13.680 -0.759 -8.658 1.00 0.00 H new ATOM 0 HA ASN A 53 -14.354 1.861 -7.291 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -14.147 -1.065 -6.352 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -14.544 0.287 -5.311 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -17.950 0.572 -6.537 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -16.664 1.399 -5.652 1.00 0.00 H new ATOM 429 N LEU A 54 -12.113 2.077 -6.165 1.00 0.00 N ATOM 430 CA LEU A 54 -10.692 2.289 -5.737 1.00 0.00 C ATOM 431 C LEU A 54 -10.322 1.314 -4.612 1.00 0.00 C ATOM 432 O LEU A 54 -11.178 0.815 -3.905 1.00 0.00 O ATOM 433 CB LEU A 54 -10.619 3.739 -5.240 1.00 0.00 C ATOM 434 CG LEU A 54 -10.118 4.652 -6.365 1.00 0.00 C ATOM 435 CD1 LEU A 54 -10.051 6.094 -5.861 1.00 0.00 C ATOM 436 CD2 LEU A 54 -8.722 4.211 -6.810 1.00 0.00 C ATOM 0 H LEU A 54 -12.771 2.791 -5.852 1.00 0.00 H new ATOM 0 HA LEU A 54 -9.994 2.111 -6.555 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -11.603 4.067 -4.904 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -9.951 3.805 -4.381 1.00 0.00 H new ATOM 0 HG LEU A 54 -10.805 4.587 -7.209 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -9.695 6.743 -6.661 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -11.044 6.416 -5.547 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -9.366 6.152 -5.015 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -8.372 4.864 -7.610 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -8.035 4.271 -5.966 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -8.763 3.184 -7.172 1.00 0.00 H new ATOM 448 N TYR A 55 -9.051 1.040 -4.443 1.00 0.00 N ATOM 449 CA TYR A 55 -8.617 0.094 -3.372 1.00 0.00 C ATOM 450 C TYR A 55 -7.481 0.702 -2.548 1.00 0.00 C ATOM 451 O TYR A 55 -6.318 0.585 -2.890 1.00 0.00 O ATOM 452 CB TYR A 55 -8.129 -1.154 -4.113 1.00 0.00 C ATOM 453 CG TYR A 55 -9.295 -2.075 -4.379 1.00 0.00 C ATOM 454 CD1 TYR A 55 -10.093 -1.879 -5.510 1.00 0.00 C ATOM 455 CD2 TYR A 55 -9.572 -3.126 -3.498 1.00 0.00 C ATOM 456 CE1 TYR A 55 -11.171 -2.734 -5.758 1.00 0.00 C ATOM 457 CE2 TYR A 55 -10.650 -3.982 -3.749 1.00 0.00 C ATOM 458 CZ TYR A 55 -11.449 -3.784 -4.879 1.00 0.00 C ATOM 459 OH TYR A 55 -12.506 -4.630 -5.132 1.00 0.00 O ATOM 0 H TYR A 55 -8.295 1.433 -5.003 1.00 0.00 H new ATOM 0 HA TYR A 55 -9.426 -0.133 -2.677 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -7.656 -0.869 -5.053 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -7.374 -1.669 -3.519 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -9.877 -1.069 -6.191 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -8.954 -3.276 -2.625 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -11.790 -2.583 -6.630 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -10.865 -4.795 -3.071 1.00 0.00 H new ATOM 0 HH TYR A 55 -13.344 -4.122 -5.109 1.00 0.00 H new ATOM 469 N ARG A 56 -7.812 1.342 -1.458 1.00 0.00 N ATOM 470 CA ARG A 56 -6.761 1.953 -0.592 1.00 0.00 C ATOM 471 C ARG A 56 -6.005 0.846 0.154 1.00 0.00 C ATOM 472 O ARG A 56 -6.572 -0.178 0.496 1.00 0.00 O ATOM 473 CB ARG A 56 -7.524 2.851 0.389 1.00 0.00 C ATOM 474 CG ARG A 56 -6.534 3.662 1.231 1.00 0.00 C ATOM 475 CD ARG A 56 -6.535 3.134 2.669 1.00 0.00 C ATOM 476 NE ARG A 56 -5.159 3.399 3.182 1.00 0.00 N ATOM 477 CZ ARG A 56 -4.754 4.626 3.392 1.00 0.00 C ATOM 478 NH1 ARG A 56 -5.429 5.410 4.194 1.00 0.00 N ATOM 479 NH2 ARG A 56 -3.677 5.067 2.793 1.00 0.00 N ATOM 0 H ARG A 56 -8.769 1.468 -1.129 1.00 0.00 H new ATOM 0 HA ARG A 56 -6.023 2.520 -1.160 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -8.185 3.523 -0.158 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -8.154 2.243 1.038 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -5.533 3.589 0.806 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.809 4.717 1.219 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -7.286 3.641 3.275 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -6.768 2.070 2.698 1.00 0.00 H new ATOM 0 HE ARG A 56 -4.530 2.619 3.370 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -6.271 5.065 4.655 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -5.113 6.366 4.358 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -3.156 4.455 2.165 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -3.359 6.023 2.954 1.00 0.00 H new ATOM 493 N LEU A 57 -4.731 1.034 0.398 1.00 0.00 N ATOM 494 CA LEU A 57 -3.940 -0.019 1.111 1.00 0.00 C ATOM 495 C LEU A 57 -4.414 -0.160 2.564 1.00 0.00 C ATOM 496 O LEU A 57 -4.238 0.730 3.379 1.00 0.00 O ATOM 497 CB LEU A 57 -2.485 0.457 1.057 1.00 0.00 C ATOM 498 CG LEU A 57 -1.569 -0.616 1.661 1.00 0.00 C ATOM 499 CD1 LEU A 57 -0.297 -0.737 0.823 1.00 0.00 C ATOM 500 CD2 LEU A 57 -1.195 -0.226 3.095 1.00 0.00 C ATOM 0 H LEU A 57 -4.205 1.868 0.136 1.00 0.00 H new ATOM 0 HA LEU A 57 -4.060 -0.999 0.648 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.196 0.658 0.025 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -2.377 1.392 1.606 1.00 0.00 H new ATOM 0 HG LEU A 57 -2.093 -1.572 1.668 1.00 0.00 H new ATOM 0 HD11 LEU A 57 0.352 -1.500 1.254 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -0.559 -1.018 -0.197 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.225 0.220 0.813 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.545 -0.989 3.522 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.674 0.732 3.088 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -2.100 -0.142 3.697 1.00 0.00 H new ATOM 512 N LEU A 58 -5.000 -1.285 2.888 1.00 0.00 N ATOM 513 CA LEU A 58 -5.483 -1.523 4.282 1.00 0.00 C ATOM 514 C LEU A 58 -4.296 -1.873 5.188 1.00 0.00 C ATOM 515 O LEU A 58 -4.197 -1.402 6.305 1.00 0.00 O ATOM 516 CB LEU A 58 -6.448 -2.710 4.170 1.00 0.00 C ATOM 517 CG LEU A 58 -6.902 -3.146 5.567 1.00 0.00 C ATOM 518 CD1 LEU A 58 -8.364 -2.745 5.782 1.00 0.00 C ATOM 519 CD2 LEU A 58 -6.765 -4.665 5.699 1.00 0.00 C ATOM 0 H LEU A 58 -5.166 -2.055 2.240 1.00 0.00 H new ATOM 0 HA LEU A 58 -5.969 -0.648 4.713 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -7.313 -2.432 3.567 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -5.959 -3.541 3.661 1.00 0.00 H new ATOM 0 HG LEU A 58 -6.279 -2.658 6.317 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -8.684 -3.056 6.776 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -8.462 -1.663 5.691 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -8.988 -3.230 5.031 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -7.088 -4.974 6.693 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -7.386 -5.153 4.947 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -5.724 -4.951 5.551 1.00 0.00 H new ATOM 531 N GLU A 59 -3.397 -2.697 4.709 1.00 0.00 N ATOM 532 CA GLU A 59 -2.210 -3.082 5.531 1.00 0.00 C ATOM 533 C GLU A 59 -1.014 -3.398 4.623 1.00 0.00 C ATOM 534 O GLU A 59 -1.165 -3.958 3.554 1.00 0.00 O ATOM 535 CB GLU A 59 -2.646 -4.329 6.307 1.00 0.00 C ATOM 536 CG GLU A 59 -2.311 -4.152 7.791 1.00 0.00 C ATOM 537 CD GLU A 59 -2.815 -5.363 8.582 1.00 0.00 C ATOM 538 OE1 GLU A 59 -2.320 -6.452 8.338 1.00 0.00 O ATOM 539 OE2 GLU A 59 -3.684 -5.179 9.418 1.00 0.00 O ATOM 0 H GLU A 59 -3.435 -3.120 3.782 1.00 0.00 H new ATOM 0 HA GLU A 59 -1.895 -2.280 6.199 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -3.716 -4.492 6.182 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -2.141 -5.211 5.912 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -1.234 -4.044 7.920 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -2.771 -3.240 8.171 1.00 0.00 H new ATOM 546 N LEU A 60 0.173 -3.040 5.047 1.00 0.00 N ATOM 547 CA LEU A 60 1.392 -3.312 4.224 1.00 0.00 C ATOM 548 C LEU A 60 2.233 -4.409 4.883 1.00 0.00 C ATOM 549 O LEU A 60 2.389 -4.450 6.090 1.00 0.00 O ATOM 550 CB LEU A 60 2.153 -1.983 4.191 1.00 0.00 C ATOM 551 CG LEU A 60 3.531 -2.168 3.541 1.00 0.00 C ATOM 552 CD1 LEU A 60 3.369 -2.614 2.086 1.00 0.00 C ATOM 553 CD2 LEU A 60 4.287 -0.838 3.582 1.00 0.00 C ATOM 0 H LEU A 60 0.351 -2.568 5.934 1.00 0.00 H new ATOM 0 HA LEU A 60 1.150 -3.661 3.220 1.00 0.00 H new ATOM 0 HB2 LEU A 60 1.579 -1.242 3.635 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.271 -1.600 5.204 1.00 0.00 H new ATOM 0 HG LEU A 60 4.087 -2.930 4.087 1.00 0.00 H new ATOM 0 HD11 LEU A 60 4.352 -2.743 1.633 1.00 0.00 H new ATOM 0 HD12 LEU A 60 2.828 -3.560 2.053 1.00 0.00 H new ATOM 0 HD13 LEU A 60 2.811 -1.858 1.534 1.00 0.00 H new ATOM 0 HD21 LEU A 60 5.267 -0.962 3.122 1.00 0.00 H new ATOM 0 HD22 LEU A 60 3.723 -0.082 3.036 1.00 0.00 H new ATOM 0 HD23 LEU A 60 4.410 -0.521 4.618 1.00 0.00 H new ATOM 565 N ASP A 61 2.768 -5.295 4.092 1.00 0.00 N ATOM 566 CA ASP A 61 3.597 -6.406 4.648 1.00 0.00 C ATOM 567 C ASP A 61 5.077 -6.004 4.696 1.00 0.00 C ATOM 568 O ASP A 61 5.486 -5.025 4.097 1.00 0.00 O ATOM 569 CB ASP A 61 3.385 -7.574 3.679 1.00 0.00 C ATOM 570 CG ASP A 61 3.712 -8.894 4.383 1.00 0.00 C ATOM 571 OD1 ASP A 61 2.838 -9.416 5.056 1.00 0.00 O ATOM 572 OD2 ASP A 61 4.829 -9.361 4.234 1.00 0.00 O ATOM 0 H ASP A 61 2.667 -5.300 3.077 1.00 0.00 H new ATOM 0 HA ASP A 61 3.313 -6.662 5.669 1.00 0.00 H new ATOM 0 HB2 ASP A 61 2.354 -7.584 3.327 1.00 0.00 H new ATOM 0 HB3 ASP A 61 4.020 -7.451 2.802 1.00 0.00 H new ATOM 577 N GLN A 62 5.878 -6.762 5.401 1.00 0.00 N ATOM 578 CA GLN A 62 7.335 -6.448 5.497 1.00 0.00 C ATOM 579 C GLN A 62 8.133 -7.463 4.660 1.00 0.00 C ATOM 580 O GLN A 62 8.316 -8.595 5.068 1.00 0.00 O ATOM 581 CB GLN A 62 7.671 -6.578 6.987 1.00 0.00 C ATOM 582 CG GLN A 62 8.936 -5.776 7.308 1.00 0.00 C ATOM 583 CD GLN A 62 8.753 -5.031 8.635 1.00 0.00 C ATOM 584 OE1 GLN A 62 8.557 -5.643 9.667 1.00 0.00 O ATOM 585 NE2 GLN A 62 8.811 -3.727 8.654 1.00 0.00 N ATOM 0 H GLN A 62 5.583 -7.590 5.918 1.00 0.00 H new ATOM 0 HA GLN A 62 7.582 -5.456 5.119 1.00 0.00 H new ATOM 0 HB2 GLN A 62 6.838 -6.216 7.590 1.00 0.00 H new ATOM 0 HB3 GLN A 62 7.819 -7.627 7.245 1.00 0.00 H new ATOM 0 HG2 GLN A 62 9.795 -6.444 7.370 1.00 0.00 H new ATOM 0 HG3 GLN A 62 9.141 -5.066 6.507 1.00 0.00 H new ATOM 0 HE21 GLN A 62 8.975 -3.211 7.790 1.00 0.00 H new ATOM 0 HE22 GLN A 62 8.692 -3.224 9.533 1.00 0.00 H new ATOM 594 N PRO A 63 8.567 -7.019 3.503 1.00 0.00 N ATOM 595 CA PRO A 63 9.339 -7.893 2.579 1.00 0.00 C ATOM 596 C PRO A 63 10.767 -8.122 3.093 1.00 0.00 C ATOM 597 O PRO A 63 11.147 -7.601 4.127 1.00 0.00 O ATOM 598 CB PRO A 63 9.363 -7.093 1.278 1.00 0.00 C ATOM 599 CG PRO A 63 9.193 -5.669 1.692 1.00 0.00 C ATOM 600 CD PRO A 63 8.376 -5.672 2.952 1.00 0.00 C ATOM 0 HA PRO A 63 8.899 -8.884 2.472 1.00 0.00 H new ATOM 0 HB2 PRO A 63 10.302 -7.238 0.743 1.00 0.00 H new ATOM 0 HB3 PRO A 63 8.563 -7.407 0.608 1.00 0.00 H new ATOM 0 HG2 PRO A 63 10.162 -5.199 1.862 1.00 0.00 H new ATOM 0 HG3 PRO A 63 8.693 -5.097 0.910 1.00 0.00 H new ATOM 0 HD2 PRO A 63 8.715 -4.905 3.648 1.00 0.00 H new ATOM 0 HD3 PRO A 63 7.325 -5.472 2.745 1.00 0.00 H new ATOM 608 N PRO A 64 11.523 -8.888 2.338 1.00 0.00 N ATOM 609 CA PRO A 64 12.932 -9.179 2.709 1.00 0.00 C ATOM 610 C PRO A 64 13.784 -7.904 2.626 1.00 0.00 C ATOM 611 O PRO A 64 13.983 -7.353 1.560 1.00 0.00 O ATOM 612 CB PRO A 64 13.368 -10.215 1.668 1.00 0.00 C ATOM 613 CG PRO A 64 12.459 -9.997 0.506 1.00 0.00 C ATOM 614 CD PRO A 64 11.144 -9.553 1.080 1.00 0.00 C ATOM 0 HA PRO A 64 13.045 -9.542 3.730 1.00 0.00 H new ATOM 0 HB2 PRO A 64 14.411 -10.076 1.385 1.00 0.00 H new ATOM 0 HB3 PRO A 64 13.276 -11.229 2.057 1.00 0.00 H new ATOM 0 HG2 PRO A 64 12.864 -9.243 -0.169 1.00 0.00 H new ATOM 0 HG3 PRO A 64 12.341 -10.913 -0.073 1.00 0.00 H new ATOM 0 HD2 PRO A 64 10.622 -8.872 0.408 1.00 0.00 H new ATOM 0 HD3 PRO A 64 10.478 -10.398 1.258 1.00 0.00 H new ATOM 622 N LYS A 65 14.280 -7.437 3.754 1.00 0.00 N ATOM 623 CA LYS A 65 15.122 -6.193 3.774 1.00 0.00 C ATOM 624 C LYS A 65 14.382 -5.035 3.090 1.00 0.00 C ATOM 625 O LYS A 65 14.806 -4.528 2.067 1.00 0.00 O ATOM 626 CB LYS A 65 16.399 -6.563 3.008 1.00 0.00 C ATOM 627 CG LYS A 65 17.406 -7.211 3.964 1.00 0.00 C ATOM 628 CD LYS A 65 17.948 -8.501 3.339 1.00 0.00 C ATOM 629 CE LYS A 65 18.478 -9.426 4.441 1.00 0.00 C ATOM 630 NZ LYS A 65 18.184 -10.811 3.966 1.00 0.00 N ATOM 0 H LYS A 65 14.136 -7.869 4.667 1.00 0.00 H new ATOM 0 HA LYS A 65 15.344 -5.860 4.788 1.00 0.00 H new ATOM 0 HB2 LYS A 65 16.161 -7.249 2.195 1.00 0.00 H new ATOM 0 HB3 LYS A 65 16.834 -5.672 2.556 1.00 0.00 H new ATOM 0 HG2 LYS A 65 18.225 -6.521 4.168 1.00 0.00 H new ATOM 0 HG3 LYS A 65 16.928 -7.430 4.919 1.00 0.00 H new ATOM 0 HD2 LYS A 65 17.160 -9.003 2.777 1.00 0.00 H new ATOM 0 HD3 LYS A 65 18.745 -8.268 2.633 1.00 0.00 H new ATOM 0 HE2 LYS A 65 19.547 -9.282 4.596 1.00 0.00 H new ATOM 0 HE3 LYS A 65 17.988 -9.224 5.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 18.519 -11.498 4.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 17.158 -10.923 3.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 18.669 -10.978 3.061 1.00 0.00 H new ATOM 644 N ALA A 66 13.268 -4.629 3.648 1.00 0.00 N ATOM 645 CA ALA A 66 12.462 -3.515 3.042 1.00 0.00 C ATOM 646 C ALA A 66 13.309 -2.251 2.847 1.00 0.00 C ATOM 647 O ALA A 66 13.230 -1.600 1.822 1.00 0.00 O ATOM 648 CB ALA A 66 11.330 -3.250 4.037 1.00 0.00 C ATOM 0 H ALA A 66 12.877 -5.023 4.504 1.00 0.00 H new ATOM 0 HA ALA A 66 12.090 -3.788 2.054 1.00 0.00 H new ATOM 0 HB1 ALA A 66 10.697 -2.446 3.662 1.00 0.00 H new ATOM 0 HB2 ALA A 66 10.734 -4.154 4.159 1.00 0.00 H new ATOM 0 HB3 ALA A 66 11.752 -2.961 4.999 1.00 0.00 H new ATOM 654 N ASP A 67 14.113 -1.901 3.818 1.00 0.00 N ATOM 655 CA ASP A 67 14.965 -0.678 3.688 1.00 0.00 C ATOM 656 C ASP A 67 16.436 -1.075 3.512 1.00 0.00 C ATOM 657 O ASP A 67 17.326 -0.491 4.103 1.00 0.00 O ATOM 658 CB ASP A 67 14.747 0.102 4.991 1.00 0.00 C ATOM 659 CG ASP A 67 13.481 0.958 4.871 1.00 0.00 C ATOM 660 OD1 ASP A 67 12.398 0.395 4.930 1.00 0.00 O ATOM 661 OD2 ASP A 67 13.614 2.162 4.724 1.00 0.00 O ATOM 0 H ASP A 67 14.217 -2.409 4.696 1.00 0.00 H new ATOM 0 HA ASP A 67 14.703 -0.076 2.818 1.00 0.00 H new ATOM 0 HB2 ASP A 67 14.653 -0.589 5.829 1.00 0.00 H new ATOM 0 HB3 ASP A 67 15.609 0.736 5.196 1.00 0.00 H new ATOM 666 N GLU A 68 16.691 -2.059 2.687 1.00 0.00 N ATOM 667 CA GLU A 68 18.093 -2.504 2.442 1.00 0.00 C ATOM 668 C GLU A 68 18.283 -2.800 0.951 1.00 0.00 C ATOM 669 O GLU A 68 17.396 -3.321 0.300 1.00 0.00 O ATOM 670 CB GLU A 68 18.264 -3.772 3.282 1.00 0.00 C ATOM 671 CG GLU A 68 18.839 -3.403 4.654 1.00 0.00 C ATOM 672 CD GLU A 68 18.087 -4.157 5.755 1.00 0.00 C ATOM 673 OE1 GLU A 68 16.900 -3.914 5.913 1.00 0.00 O ATOM 674 OE2 GLU A 68 18.712 -4.964 6.424 1.00 0.00 O ATOM 0 H GLU A 68 15.980 -2.576 2.169 1.00 0.00 H new ATOM 0 HA GLU A 68 18.829 -1.748 2.714 1.00 0.00 H new ATOM 0 HB2 GLU A 68 17.304 -4.274 3.401 1.00 0.00 H new ATOM 0 HB3 GLU A 68 18.928 -4.471 2.774 1.00 0.00 H new ATOM 0 HG2 GLU A 68 19.900 -3.650 4.692 1.00 0.00 H new ATOM 0 HG3 GLU A 68 18.756 -2.328 4.816 1.00 0.00 H new ATOM 681 N ASP A 69 19.430 -2.454 0.410 1.00 0.00 N ATOM 682 CA ASP A 69 19.704 -2.686 -1.048 1.00 0.00 C ATOM 683 C ASP A 69 18.656 -1.946 -1.901 1.00 0.00 C ATOM 684 O ASP A 69 17.739 -2.549 -2.431 1.00 0.00 O ATOM 685 CB ASP A 69 19.632 -4.207 -1.261 1.00 0.00 C ATOM 686 CG ASP A 69 20.492 -4.923 -0.215 1.00 0.00 C ATOM 687 OD1 ASP A 69 21.704 -4.796 -0.284 1.00 0.00 O ATOM 688 OD2 ASP A 69 19.922 -5.585 0.637 1.00 0.00 O ATOM 0 H ASP A 69 20.196 -2.016 0.922 1.00 0.00 H new ATOM 0 HA ASP A 69 20.681 -2.305 -1.347 1.00 0.00 H new ATOM 0 HB2 ASP A 69 18.598 -4.544 -1.187 1.00 0.00 H new ATOM 0 HB3 ASP A 69 19.978 -4.459 -2.263 1.00 0.00 H new ATOM 693 N PRO A 70 18.831 -0.646 -1.982 1.00 0.00 N ATOM 694 CA PRO A 70 17.896 0.221 -2.751 1.00 0.00 C ATOM 695 C PRO A 70 18.117 0.094 -4.268 1.00 0.00 C ATOM 696 O PRO A 70 17.188 0.226 -5.043 1.00 0.00 O ATOM 697 CB PRO A 70 18.239 1.629 -2.268 1.00 0.00 C ATOM 698 CG PRO A 70 19.656 1.551 -1.795 1.00 0.00 C ATOM 699 CD PRO A 70 19.914 0.129 -1.363 1.00 0.00 C ATOM 0 HA PRO A 70 16.852 -0.048 -2.590 1.00 0.00 H new ATOM 0 HB2 PRO A 70 18.132 2.357 -3.072 1.00 0.00 H new ATOM 0 HB3 PRO A 70 17.573 1.942 -1.464 1.00 0.00 H new ATOM 0 HG2 PRO A 70 20.342 1.840 -2.591 1.00 0.00 H new ATOM 0 HG3 PRO A 70 19.822 2.239 -0.966 1.00 0.00 H new ATOM 0 HD2 PRO A 70 20.892 -0.217 -1.699 1.00 0.00 H new ATOM 0 HD3 PRO A 70 19.899 0.035 -0.277 1.00 0.00 H new ATOM 707 N GLY A 71 19.332 -0.154 -4.699 1.00 0.00 N ATOM 708 CA GLY A 71 19.601 -0.287 -6.165 1.00 0.00 C ATOM 709 C GLY A 71 18.853 -1.506 -6.717 1.00 0.00 C ATOM 710 O GLY A 71 18.251 -1.450 -7.773 1.00 0.00 O ATOM 0 H GLY A 71 20.148 -0.270 -4.098 1.00 0.00 H new ATOM 0 HA2 GLY A 71 19.282 0.615 -6.687 1.00 0.00 H new ATOM 0 HA3 GLY A 71 20.671 -0.395 -6.340 1.00 0.00 H new ATOM 714 N THR A 72 18.890 -2.601 -6.001 1.00 0.00 N ATOM 715 CA THR A 72 18.189 -3.846 -6.452 1.00 0.00 C ATOM 716 C THR A 72 16.667 -3.633 -6.453 1.00 0.00 C ATOM 717 O THR A 72 16.179 -2.652 -5.922 1.00 0.00 O ATOM 718 CB THR A 72 18.572 -4.929 -5.424 1.00 0.00 C ATOM 719 OG1 THR A 72 19.194 -4.338 -4.290 1.00 0.00 O ATOM 720 CG2 THR A 72 19.533 -5.932 -6.069 1.00 0.00 C ATOM 0 H THR A 72 19.382 -2.688 -5.112 1.00 0.00 H new ATOM 0 HA THR A 72 18.476 -4.126 -7.466 1.00 0.00 H new ATOM 0 HB THR A 72 17.666 -5.443 -5.102 1.00 0.00 H new ATOM 0 HG1 THR A 72 18.539 -3.796 -3.803 1.00 0.00 H new ATOM 0 HG21 THR A 72 19.803 -6.697 -5.341 1.00 0.00 H new ATOM 0 HG22 THR A 72 19.049 -6.401 -6.926 1.00 0.00 H new ATOM 0 HG23 THR A 72 20.432 -5.413 -6.400 1.00 0.00 H new ATOM 728 N PRO A 73 15.959 -4.569 -7.043 1.00 0.00 N ATOM 729 CA PRO A 73 14.473 -4.480 -7.099 1.00 0.00 C ATOM 730 C PRO A 73 13.883 -4.672 -5.697 1.00 0.00 C ATOM 731 O PRO A 73 14.355 -5.484 -4.921 1.00 0.00 O ATOM 732 CB PRO A 73 14.079 -5.627 -8.030 1.00 0.00 C ATOM 733 CG PRO A 73 15.212 -6.597 -7.942 1.00 0.00 C ATOM 734 CD PRO A 73 16.458 -5.785 -7.703 1.00 0.00 C ATOM 0 HA PRO A 73 14.107 -3.516 -7.453 1.00 0.00 H new ATOM 0 HB2 PRO A 73 13.141 -6.085 -7.718 1.00 0.00 H new ATOM 0 HB3 PRO A 73 13.937 -5.276 -9.052 1.00 0.00 H new ATOM 0 HG2 PRO A 73 15.051 -7.307 -7.131 1.00 0.00 H new ATOM 0 HG3 PRO A 73 15.298 -7.177 -8.861 1.00 0.00 H new ATOM 0 HD2 PRO A 73 17.170 -6.319 -7.074 1.00 0.00 H new ATOM 0 HD3 PRO A 73 16.970 -5.553 -8.637 1.00 0.00 H new ATOM 742 N LYS A 74 12.865 -3.919 -5.359 1.00 0.00 N ATOM 743 CA LYS A 74 12.265 -4.048 -4.001 1.00 0.00 C ATOM 744 C LYS A 74 10.949 -4.831 -4.046 1.00 0.00 C ATOM 745 O LYS A 74 9.964 -4.361 -4.584 1.00 0.00 O ATOM 746 CB LYS A 74 12.016 -2.614 -3.524 1.00 0.00 C ATOM 747 CG LYS A 74 12.950 -2.296 -2.356 1.00 0.00 C ATOM 748 CD LYS A 74 12.712 -3.286 -1.213 1.00 0.00 C ATOM 749 CE LYS A 74 14.022 -4.015 -0.889 1.00 0.00 C ATOM 750 NZ LYS A 74 13.621 -5.257 -0.165 1.00 0.00 N ATOM 0 H LYS A 74 12.427 -3.224 -5.964 1.00 0.00 H new ATOM 0 HA LYS A 74 12.926 -4.595 -3.329 1.00 0.00 H new ATOM 0 HB2 LYS A 74 12.186 -1.913 -4.341 1.00 0.00 H new ATOM 0 HB3 LYS A 74 10.977 -2.497 -3.215 1.00 0.00 H new ATOM 0 HG2 LYS A 74 13.988 -2.349 -2.684 1.00 0.00 H new ATOM 0 HG3 LYS A 74 12.778 -1.277 -2.008 1.00 0.00 H new ATOM 0 HD2 LYS A 74 12.348 -2.759 -0.331 1.00 0.00 H new ATOM 0 HD3 LYS A 74 11.943 -4.005 -1.494 1.00 0.00 H new ATOM 0 HE2 LYS A 74 14.574 -4.252 -1.798 1.00 0.00 H new ATOM 0 HE3 LYS A 74 14.674 -3.395 -0.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 14.164 -5.335 0.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 12.605 -5.218 0.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 13.814 -6.085 -0.764 1.00 0.00 H new ATOM 764 N PRO A 75 10.978 -5.997 -3.449 1.00 0.00 N ATOM 765 CA PRO A 75 9.772 -6.858 -3.382 1.00 0.00 C ATOM 766 C PRO A 75 8.773 -6.253 -2.389 1.00 0.00 C ATOM 767 O PRO A 75 9.085 -6.051 -1.232 1.00 0.00 O ATOM 768 CB PRO A 75 10.319 -8.200 -2.893 1.00 0.00 C ATOM 769 CG PRO A 75 11.580 -7.867 -2.165 1.00 0.00 C ATOM 770 CD PRO A 75 12.132 -6.615 -2.789 1.00 0.00 C ATOM 0 HA PRO A 75 9.240 -6.958 -4.328 1.00 0.00 H new ATOM 0 HB2 PRO A 75 9.606 -8.700 -2.237 1.00 0.00 H new ATOM 0 HB3 PRO A 75 10.512 -8.874 -3.727 1.00 0.00 H new ATOM 0 HG2 PRO A 75 11.384 -7.714 -1.104 1.00 0.00 H new ATOM 0 HG3 PRO A 75 12.297 -8.684 -2.242 1.00 0.00 H new ATOM 0 HD2 PRO A 75 12.562 -5.953 -2.037 1.00 0.00 H new ATOM 0 HD3 PRO A 75 12.923 -6.843 -3.503 1.00 0.00 H new ATOM 778 N VAL A 76 7.587 -5.936 -2.840 1.00 0.00 N ATOM 779 CA VAL A 76 6.573 -5.315 -1.930 1.00 0.00 C ATOM 780 C VAL A 76 5.280 -6.142 -1.905 1.00 0.00 C ATOM 781 O VAL A 76 4.902 -6.761 -2.884 1.00 0.00 O ATOM 782 CB VAL A 76 6.303 -3.923 -2.516 1.00 0.00 C ATOM 783 CG1 VAL A 76 5.454 -3.102 -1.543 1.00 0.00 C ATOM 784 CG2 VAL A 76 7.629 -3.194 -2.762 1.00 0.00 C ATOM 0 H VAL A 76 7.275 -6.080 -3.800 1.00 0.00 H new ATOM 0 HA VAL A 76 6.933 -5.266 -0.902 1.00 0.00 H new ATOM 0 HB VAL A 76 5.768 -4.038 -3.459 1.00 0.00 H new ATOM 0 HG11 VAL A 76 5.267 -2.115 -1.967 1.00 0.00 H new ATOM 0 HG12 VAL A 76 4.505 -3.609 -1.371 1.00 0.00 H new ATOM 0 HG13 VAL A 76 5.985 -2.996 -0.597 1.00 0.00 H new ATOM 0 HG21 VAL A 76 7.430 -2.206 -3.178 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.167 -3.089 -1.820 1.00 0.00 H new ATOM 0 HG23 VAL A 76 8.235 -3.768 -3.463 1.00 0.00 H new ATOM 794 N SER A 77 4.597 -6.136 -0.789 1.00 0.00 N ATOM 795 CA SER A 77 3.317 -6.901 -0.665 1.00 0.00 C ATOM 796 C SER A 77 2.374 -6.175 0.301 1.00 0.00 C ATOM 797 O SER A 77 2.781 -5.742 1.361 1.00 0.00 O ATOM 798 CB SER A 77 3.717 -8.265 -0.100 1.00 0.00 C ATOM 799 OG SER A 77 4.385 -9.017 -1.106 1.00 0.00 O ATOM 0 H SER A 77 4.874 -5.628 0.051 1.00 0.00 H new ATOM 0 HA SER A 77 2.796 -6.998 -1.617 1.00 0.00 H new ATOM 0 HB2 SER A 77 4.368 -8.136 0.765 1.00 0.00 H new ATOM 0 HB3 SER A 77 2.833 -8.802 0.244 1.00 0.00 H new ATOM 0 HG SER A 77 4.643 -9.890 -0.744 1.00 0.00 H new ATOM 805 N PHE A 78 1.118 -6.030 -0.052 1.00 0.00 N ATOM 806 CA PHE A 78 0.166 -5.322 0.861 1.00 0.00 C ATOM 807 C PHE A 78 -1.281 -5.703 0.544 1.00 0.00 C ATOM 808 O PHE A 78 -1.586 -6.191 -0.528 1.00 0.00 O ATOM 809 CB PHE A 78 0.378 -3.820 0.621 1.00 0.00 C ATOM 810 CG PHE A 78 0.472 -3.517 -0.862 1.00 0.00 C ATOM 811 CD1 PHE A 78 -0.690 -3.466 -1.642 1.00 0.00 C ATOM 812 CD2 PHE A 78 1.721 -3.278 -1.451 1.00 0.00 C ATOM 813 CE1 PHE A 78 -0.604 -3.177 -3.009 1.00 0.00 C ATOM 814 CE2 PHE A 78 1.806 -2.991 -2.818 1.00 0.00 C ATOM 815 CZ PHE A 78 0.645 -2.940 -3.598 1.00 0.00 C ATOM 0 H PHE A 78 0.714 -6.368 -0.925 1.00 0.00 H new ATOM 0 HA PHE A 78 0.350 -5.595 1.900 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -0.446 -3.258 1.060 1.00 0.00 H new ATOM 0 HB3 PHE A 78 1.289 -3.493 1.122 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -1.653 -3.650 -1.189 1.00 0.00 H new ATOM 0 HD2 PHE A 78 2.618 -3.315 -0.850 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -1.501 -3.137 -3.610 1.00 0.00 H new ATOM 0 HE2 PHE A 78 2.769 -2.809 -3.272 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.712 -2.718 -4.653 1.00 0.00 H new ATOM 825 N THR A 79 -2.172 -5.465 1.468 1.00 0.00 N ATOM 826 CA THR A 79 -3.606 -5.794 1.226 1.00 0.00 C ATOM 827 C THR A 79 -4.397 -4.510 0.991 1.00 0.00 C ATOM 828 O THR A 79 -4.217 -3.521 1.678 1.00 0.00 O ATOM 829 CB THR A 79 -4.106 -6.514 2.487 1.00 0.00 C ATOM 830 OG1 THR A 79 -3.414 -6.033 3.633 1.00 0.00 O ATOM 831 CG2 THR A 79 -3.878 -8.018 2.348 1.00 0.00 C ATOM 0 H THR A 79 -1.969 -5.057 2.380 1.00 0.00 H new ATOM 0 HA THR A 79 -3.731 -6.424 0.345 1.00 0.00 H new ATOM 0 HB THR A 79 -5.172 -6.317 2.605 1.00 0.00 H new ATOM 0 HG1 THR A 79 -3.741 -6.497 4.432 1.00 0.00 H new ATOM 0 HG21 THR A 79 -4.234 -8.524 3.245 1.00 0.00 H new ATOM 0 HG22 THR A 79 -4.423 -8.390 1.481 1.00 0.00 H new ATOM 0 HG23 THR A 79 -2.814 -8.214 2.219 1.00 0.00 H new ATOM 839 N VAL A 80 -5.273 -4.523 0.025 1.00 0.00 N ATOM 840 CA VAL A 80 -6.094 -3.314 -0.272 1.00 0.00 C ATOM 841 C VAL A 80 -7.582 -3.662 -0.152 1.00 0.00 C ATOM 842 O VAL A 80 -7.994 -4.775 -0.428 1.00 0.00 O ATOM 843 CB VAL A 80 -5.724 -2.900 -1.707 1.00 0.00 C ATOM 844 CG1 VAL A 80 -4.236 -2.539 -1.770 1.00 0.00 C ATOM 845 CG2 VAL A 80 -6.006 -4.050 -2.683 1.00 0.00 C ATOM 0 H VAL A 80 -5.457 -5.326 -0.577 1.00 0.00 H new ATOM 0 HA VAL A 80 -5.903 -2.497 0.424 1.00 0.00 H new ATOM 0 HB VAL A 80 -6.327 -2.037 -1.989 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -3.975 -2.246 -2.787 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -4.033 -1.711 -1.091 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -3.639 -3.403 -1.477 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -5.739 -3.743 -3.694 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -5.414 -4.920 -2.400 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -7.065 -4.305 -2.649 1.00 0.00 H new ATOM 855 N LYS A 81 -8.386 -2.723 0.272 1.00 0.00 N ATOM 856 CA LYS A 81 -9.845 -3.000 0.428 1.00 0.00 C ATOM 857 C LYS A 81 -10.685 -2.017 -0.396 1.00 0.00 C ATOM 858 O LYS A 81 -10.284 -0.899 -0.655 1.00 0.00 O ATOM 859 CB LYS A 81 -10.124 -2.820 1.924 1.00 0.00 C ATOM 860 CG LYS A 81 -10.470 -4.172 2.556 1.00 0.00 C ATOM 861 CD LYS A 81 -11.850 -4.100 3.212 1.00 0.00 C ATOM 862 CE LYS A 81 -12.914 -4.566 2.213 1.00 0.00 C ATOM 863 NZ LYS A 81 -13.417 -3.326 1.563 1.00 0.00 N ATOM 0 H LYS A 81 -8.096 -1.776 0.517 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.106 -3.998 0.075 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -9.251 -2.391 2.417 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -10.947 -2.120 2.068 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -10.459 -4.953 1.795 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -9.718 -4.440 3.298 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -11.874 -4.726 4.104 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -12.059 -3.080 3.533 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -12.490 -5.250 1.478 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.720 -5.099 2.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -13.723 -3.542 0.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -14.222 -2.952 2.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.658 -2.616 1.536 1.00 0.00 H new ATOM 877 N GLU A 82 -11.855 -2.435 -0.806 1.00 0.00 N ATOM 878 CA GLU A 82 -12.746 -1.544 -1.613 1.00 0.00 C ATOM 879 C GLU A 82 -13.155 -0.301 -0.806 1.00 0.00 C ATOM 880 O GLU A 82 -13.683 -0.402 0.287 1.00 0.00 O ATOM 881 CB GLU A 82 -13.985 -2.393 -1.925 1.00 0.00 C ATOM 882 CG GLU A 82 -14.359 -2.241 -3.402 1.00 0.00 C ATOM 883 CD GLU A 82 -15.337 -3.348 -3.816 1.00 0.00 C ATOM 884 OE1 GLU A 82 -16.239 -3.641 -3.046 1.00 0.00 O ATOM 885 OE2 GLU A 82 -15.166 -3.886 -4.899 1.00 0.00 O ATOM 0 H GLU A 82 -12.235 -3.362 -0.615 1.00 0.00 H new ATOM 0 HA GLU A 82 -12.246 -1.188 -2.514 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -13.787 -3.440 -1.696 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -14.819 -2.082 -1.295 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -14.811 -1.264 -3.572 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -13.462 -2.289 -4.019 1.00 0.00 H new ATOM 892 N THR A 83 -12.928 0.867 -1.354 1.00 0.00 N ATOM 893 CA THR A 83 -13.321 2.132 -0.648 1.00 0.00 C ATOM 894 C THR A 83 -14.730 2.544 -1.100 1.00 0.00 C ATOM 895 O THR A 83 -15.447 1.760 -1.697 1.00 0.00 O ATOM 896 CB THR A 83 -12.294 3.193 -1.083 1.00 0.00 C ATOM 897 OG1 THR A 83 -12.309 3.330 -2.504 1.00 0.00 O ATOM 898 CG2 THR A 83 -10.894 2.791 -0.613 1.00 0.00 C ATOM 0 H THR A 83 -12.486 1.002 -2.263 1.00 0.00 H new ATOM 0 HA THR A 83 -13.333 2.013 0.435 1.00 0.00 H new ATOM 0 HB THR A 83 -12.559 4.149 -0.630 1.00 0.00 H new ATOM 0 HG1 THR A 83 -11.916 4.192 -2.754 1.00 0.00 H new ATOM 0 HG21 THR A 83 -10.174 3.548 -0.925 1.00 0.00 H new ATOM 0 HG22 THR A 83 -10.885 2.708 0.474 1.00 0.00 H new ATOM 0 HG23 THR A 83 -10.625 1.831 -1.052 1.00 0.00 H new ATOM 906 N VAL A 84 -15.124 3.765 -0.843 1.00 0.00 N ATOM 907 CA VAL A 84 -16.477 4.223 -1.285 1.00 0.00 C ATOM 908 C VAL A 84 -16.367 5.042 -2.586 1.00 0.00 C ATOM 909 O VAL A 84 -17.334 5.623 -3.040 1.00 0.00 O ATOM 910 CB VAL A 84 -17.021 5.096 -0.142 1.00 0.00 C ATOM 911 CG1 VAL A 84 -16.991 4.311 1.173 1.00 0.00 C ATOM 912 CG2 VAL A 84 -16.166 6.360 0.004 1.00 0.00 C ATOM 0 H VAL A 84 -14.570 4.463 -0.348 1.00 0.00 H new ATOM 0 HA VAL A 84 -17.138 3.381 -1.492 1.00 0.00 H new ATOM 0 HB VAL A 84 -18.048 5.378 -0.374 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -17.378 4.935 1.978 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -17.609 3.418 1.078 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -15.965 4.020 1.400 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -16.558 6.973 0.816 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -15.136 6.079 0.226 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -16.195 6.928 -0.926 1.00 0.00 H new ATOM 922 N CYS A 85 -15.196 5.099 -3.183 1.00 0.00 N ATOM 923 CA CYS A 85 -15.033 5.889 -4.442 1.00 0.00 C ATOM 924 C CYS A 85 -14.692 4.976 -5.626 1.00 0.00 C ATOM 925 O CYS A 85 -14.063 3.946 -5.456 1.00 0.00 O ATOM 926 CB CYS A 85 -13.874 6.843 -4.160 1.00 0.00 C ATOM 927 SG CYS A 85 -14.481 8.269 -3.228 1.00 0.00 S ATOM 0 H CYS A 85 -14.351 4.633 -2.851 1.00 0.00 H new ATOM 0 HA CYS A 85 -15.950 6.414 -4.710 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -13.096 6.330 -3.595 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -13.423 7.172 -5.096 1.00 0.00 H new ATOM 932 N PRO A 86 -15.116 5.398 -6.794 1.00 0.00 N ATOM 933 CA PRO A 86 -14.853 4.623 -8.031 1.00 0.00 C ATOM 934 C PRO A 86 -13.406 4.834 -8.503 1.00 0.00 C ATOM 935 O PRO A 86 -12.662 5.601 -7.923 1.00 0.00 O ATOM 936 CB PRO A 86 -15.839 5.210 -9.037 1.00 0.00 C ATOM 937 CG PRO A 86 -16.119 6.599 -8.556 1.00 0.00 C ATOM 938 CD PRO A 86 -15.878 6.625 -7.067 1.00 0.00 C ATOM 0 HA PRO A 86 -14.975 3.548 -7.895 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -15.416 5.220 -10.042 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -16.753 4.618 -9.082 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -15.472 7.316 -9.061 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -17.147 6.882 -8.782 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -15.319 7.513 -6.771 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -16.817 6.640 -6.514 1.00 0.00 H new ATOM 946 N ARG A 87 -13.008 4.165 -9.556 1.00 0.00 N ATOM 947 CA ARG A 87 -11.615 4.330 -10.074 1.00 0.00 C ATOM 948 C ARG A 87 -11.656 4.698 -11.565 1.00 0.00 C ATOM 949 O ARG A 87 -12.323 4.030 -12.334 1.00 0.00 O ATOM 950 CB ARG A 87 -10.956 2.957 -9.882 1.00 0.00 C ATOM 951 CG ARG A 87 -9.553 2.944 -10.509 1.00 0.00 C ATOM 952 CD ARG A 87 -9.455 1.810 -11.536 1.00 0.00 C ATOM 953 NE ARG A 87 -10.015 2.381 -12.796 1.00 0.00 N ATOM 954 CZ ARG A 87 -9.236 2.605 -13.821 1.00 0.00 C ATOM 955 NH1 ARG A 87 -8.244 3.451 -13.722 1.00 0.00 N ATOM 956 NH2 ARG A 87 -9.460 1.991 -14.953 1.00 0.00 N ATOM 0 H ARG A 87 -13.589 3.510 -10.080 1.00 0.00 H new ATOM 0 HA ARG A 87 -11.069 5.120 -9.559 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -10.889 2.724 -8.819 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -11.573 2.183 -10.339 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -9.350 3.901 -10.990 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -8.799 2.811 -9.733 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -8.422 1.489 -11.673 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -10.020 0.935 -11.214 1.00 0.00 H new ATOM 0 HE ARG A 87 -11.010 2.597 -12.857 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -8.076 3.939 -12.842 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -7.638 3.623 -14.524 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -10.241 1.340 -15.034 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -8.854 2.163 -15.755 1.00 0.00 H new ATOM 970 N PRO A 88 -10.933 5.733 -11.949 1.00 0.00 N ATOM 971 CA PRO A 88 -10.119 6.548 -11.010 1.00 0.00 C ATOM 972 C PRO A 88 -10.930 7.730 -10.449 1.00 0.00 C ATOM 973 O PRO A 88 -11.699 8.357 -11.156 1.00 0.00 O ATOM 974 CB PRO A 88 -8.990 7.062 -11.902 1.00 0.00 C ATOM 975 CG PRO A 88 -9.540 7.062 -13.301 1.00 0.00 C ATOM 976 CD PRO A 88 -10.802 6.229 -13.319 1.00 0.00 C ATOM 0 HA PRO A 88 -9.777 5.982 -10.143 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -8.681 8.064 -11.603 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -8.111 6.422 -11.828 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -9.754 8.081 -13.624 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -8.807 6.654 -13.997 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -11.667 6.825 -13.610 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -10.726 5.409 -14.033 1.00 0.00 H new ATOM 984 N THR A 89 -10.745 8.050 -9.191 1.00 0.00 N ATOM 985 CA THR A 89 -11.481 9.206 -8.585 1.00 0.00 C ATOM 986 C THR A 89 -10.654 10.488 -8.782 1.00 0.00 C ATOM 987 O THR A 89 -9.470 10.426 -9.054 1.00 0.00 O ATOM 988 CB THR A 89 -11.614 8.848 -7.091 1.00 0.00 C ATOM 989 OG1 THR A 89 -12.734 7.997 -6.913 1.00 0.00 O ATOM 990 CG2 THR A 89 -11.807 10.108 -6.241 1.00 0.00 C ATOM 0 H THR A 89 -10.115 7.560 -8.556 1.00 0.00 H new ATOM 0 HA THR A 89 -12.457 9.382 -9.037 1.00 0.00 H new ATOM 0 HB THR A 89 -10.700 8.347 -6.773 1.00 0.00 H new ATOM 0 HG1 THR A 89 -12.515 7.097 -7.233 1.00 0.00 H new ATOM 0 HG21 THR A 89 -11.898 9.828 -5.191 1.00 0.00 H new ATOM 0 HG22 THR A 89 -10.948 10.767 -6.368 1.00 0.00 H new ATOM 0 HG23 THR A 89 -12.712 10.626 -6.558 1.00 0.00 H new ATOM 998 N ARG A 90 -11.263 11.646 -8.642 1.00 0.00 N ATOM 999 CA ARG A 90 -10.501 12.927 -8.813 1.00 0.00 C ATOM 1000 C ARG A 90 -9.237 12.893 -7.947 1.00 0.00 C ATOM 1001 O ARG A 90 -8.143 13.133 -8.421 1.00 0.00 O ATOM 1002 CB ARG A 90 -11.450 14.036 -8.339 1.00 0.00 C ATOM 1003 CG ARG A 90 -11.877 14.894 -9.533 1.00 0.00 C ATOM 1004 CD ARG A 90 -11.675 16.377 -9.198 1.00 0.00 C ATOM 1005 NE ARG A 90 -10.930 16.944 -10.360 1.00 0.00 N ATOM 1006 CZ ARG A 90 -10.309 18.088 -10.242 1.00 0.00 C ATOM 1007 NH1 ARG A 90 -10.961 19.206 -10.424 1.00 0.00 N ATOM 1008 NH2 ARG A 90 -9.036 18.111 -9.941 1.00 0.00 N ATOM 0 H ARG A 90 -12.252 11.758 -8.417 1.00 0.00 H new ATOM 0 HA ARG A 90 -10.186 13.087 -9.844 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -12.327 13.598 -7.861 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -10.956 14.656 -7.591 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -11.293 14.627 -10.413 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -12.923 14.704 -9.775 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -12.631 16.883 -9.059 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -11.112 16.498 -8.273 1.00 0.00 H new ATOM 0 HE ARG A 90 -10.905 16.439 -11.246 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -11.954 19.185 -10.658 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -10.477 20.099 -10.332 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -8.530 17.237 -9.799 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -8.550 19.003 -9.849 1.00 0.00 H new ATOM 1022 N GLN A 91 -9.384 12.577 -6.686 1.00 0.00 N ATOM 1023 CA GLN A 91 -8.205 12.497 -5.778 1.00 0.00 C ATOM 1024 C GLN A 91 -7.837 11.020 -5.538 1.00 0.00 C ATOM 1025 O GLN A 91 -8.478 10.136 -6.077 1.00 0.00 O ATOM 1026 CB GLN A 91 -8.665 13.175 -4.481 1.00 0.00 C ATOM 1027 CG GLN A 91 -8.053 14.578 -4.392 1.00 0.00 C ATOM 1028 CD GLN A 91 -9.117 15.637 -4.711 1.00 0.00 C ATOM 1029 OE1 GLN A 91 -10.134 15.341 -5.306 1.00 0.00 O ATOM 1030 NE2 GLN A 91 -8.920 16.874 -4.342 1.00 0.00 N ATOM 0 H GLN A 91 -10.280 12.369 -6.244 1.00 0.00 H new ATOM 0 HA GLN A 91 -7.317 12.979 -6.186 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -9.753 13.239 -4.458 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -8.362 12.579 -3.620 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -7.650 14.745 -3.393 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -7.221 14.665 -5.090 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -8.068 17.128 -3.842 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -9.618 17.587 -4.554 1.00 0.00 H new ATOM 1039 N PRO A 92 -6.816 10.795 -4.743 1.00 0.00 N ATOM 1040 CA PRO A 92 -6.370 9.401 -4.445 1.00 0.00 C ATOM 1041 C PRO A 92 -7.426 8.648 -3.616 1.00 0.00 C ATOM 1042 O PRO A 92 -8.355 9.248 -3.105 1.00 0.00 O ATOM 1043 CB PRO A 92 -5.081 9.605 -3.648 1.00 0.00 C ATOM 1044 CG PRO A 92 -5.208 10.970 -3.057 1.00 0.00 C ATOM 1045 CD PRO A 92 -5.985 11.791 -4.049 1.00 0.00 C ATOM 0 HA PRO A 92 -6.222 8.799 -5.342 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -4.972 8.847 -2.872 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -4.203 9.532 -4.290 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -5.723 10.931 -2.097 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -4.226 11.407 -2.875 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -6.594 12.547 -3.554 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -5.325 12.315 -4.740 1.00 0.00 H new ATOM 1053 N PRO A 93 -7.246 7.347 -3.507 1.00 0.00 N ATOM 1054 CA PRO A 93 -8.194 6.501 -2.728 1.00 0.00 C ATOM 1055 C PRO A 93 -8.122 6.841 -1.233 1.00 0.00 C ATOM 1056 O PRO A 93 -9.108 6.746 -0.524 1.00 0.00 O ATOM 1057 CB PRO A 93 -7.712 5.076 -3.001 1.00 0.00 C ATOM 1058 CG PRO A 93 -6.273 5.227 -3.370 1.00 0.00 C ATOM 1059 CD PRO A 93 -6.157 6.546 -4.086 1.00 0.00 C ATOM 0 HA PRO A 93 -9.236 6.650 -3.013 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -7.831 4.442 -2.122 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -8.281 4.613 -3.807 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -5.640 5.209 -2.483 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -5.948 4.407 -4.010 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -5.185 7.010 -3.919 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -6.273 6.430 -5.164 1.00 0.00 H new ATOM 1067 N GLU A 94 -6.971 7.252 -0.753 1.00 0.00 N ATOM 1068 CA GLU A 94 -6.845 7.618 0.692 1.00 0.00 C ATOM 1069 C GLU A 94 -7.771 8.802 1.010 1.00 0.00 C ATOM 1070 O GLU A 94 -8.313 8.903 2.096 1.00 0.00 O ATOM 1071 CB GLU A 94 -5.376 8.011 0.877 1.00 0.00 C ATOM 1072 CG GLU A 94 -5.080 8.223 2.364 1.00 0.00 C ATOM 1073 CD GLU A 94 -4.273 9.508 2.545 1.00 0.00 C ATOM 1074 OE1 GLU A 94 -4.867 10.570 2.469 1.00 0.00 O ATOM 1075 OE2 GLU A 94 -3.076 9.409 2.754 1.00 0.00 O ATOM 0 H GLU A 94 -6.116 7.349 -1.300 1.00 0.00 H new ATOM 0 HA GLU A 94 -7.129 6.802 1.357 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -4.728 7.232 0.475 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -5.161 8.923 0.320 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -6.012 8.284 2.926 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -4.524 7.373 2.760 1.00 0.00 H new ATOM 1082 N LEU A 95 -7.963 9.690 0.060 1.00 0.00 N ATOM 1083 CA LEU A 95 -8.862 10.865 0.281 1.00 0.00 C ATOM 1084 C LEU A 95 -10.308 10.404 0.525 1.00 0.00 C ATOM 1085 O LEU A 95 -11.076 11.075 1.189 1.00 0.00 O ATOM 1086 CB LEU A 95 -8.778 11.674 -1.019 1.00 0.00 C ATOM 1087 CG LEU A 95 -9.711 12.888 -0.940 1.00 0.00 C ATOM 1088 CD1 LEU A 95 -8.906 14.171 -1.157 1.00 0.00 C ATOM 1089 CD2 LEU A 95 -10.790 12.769 -2.023 1.00 0.00 C ATOM 0 H LEU A 95 -7.532 9.648 -0.863 1.00 0.00 H new ATOM 0 HA LEU A 95 -8.565 11.447 1.154 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -7.753 12.003 -1.187 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -9.054 11.047 -1.866 1.00 0.00 H new ATOM 0 HG LEU A 95 -10.182 12.922 0.043 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -9.572 15.032 -1.100 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -8.139 14.254 -0.387 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -8.433 14.142 -2.139 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -11.455 13.631 -1.970 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -10.318 12.735 -3.005 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -11.365 11.856 -1.865 1.00 0.00 H new ATOM 1101 N CYS A 96 -10.681 9.268 -0.014 1.00 0.00 N ATOM 1102 CA CYS A 96 -12.074 8.763 0.173 1.00 0.00 C ATOM 1103 C CYS A 96 -12.173 7.884 1.428 1.00 0.00 C ATOM 1104 O CYS A 96 -11.209 7.699 2.149 1.00 0.00 O ATOM 1105 CB CYS A 96 -12.366 7.947 -1.089 1.00 0.00 C ATOM 1106 SG CYS A 96 -12.809 9.075 -2.435 1.00 0.00 S ATOM 0 H CYS A 96 -10.077 8.669 -0.577 1.00 0.00 H new ATOM 0 HA CYS A 96 -12.789 9.573 0.313 1.00 0.00 H new ATOM 0 HB2 CYS A 96 -11.492 7.357 -1.365 1.00 0.00 H new ATOM 0 HB3 CYS A 96 -13.179 7.245 -0.903 1.00 0.00 H new ATOM 1111 N ASP A 97 -13.340 7.351 1.695 1.00 0.00 N ATOM 1112 CA ASP A 97 -13.524 6.492 2.905 1.00 0.00 C ATOM 1113 C ASP A 97 -12.995 5.071 2.656 1.00 0.00 C ATOM 1114 O ASP A 97 -12.283 4.817 1.701 1.00 0.00 O ATOM 1115 CB ASP A 97 -15.038 6.467 3.160 1.00 0.00 C ATOM 1116 CG ASP A 97 -15.565 7.893 3.372 1.00 0.00 C ATOM 1117 OD1 ASP A 97 -14.946 8.632 4.119 1.00 0.00 O ATOM 1118 OD2 ASP A 97 -16.581 8.217 2.782 1.00 0.00 O ATOM 0 H ASP A 97 -14.176 7.475 1.124 1.00 0.00 H new ATOM 0 HA ASP A 97 -12.973 6.882 3.761 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -15.549 6.005 2.315 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -15.256 5.857 4.037 1.00 0.00 H new ATOM 1123 N PHE A 98 -13.340 4.149 3.519 1.00 0.00 N ATOM 1124 CA PHE A 98 -12.870 2.740 3.372 1.00 0.00 C ATOM 1125 C PHE A 98 -13.983 1.785 3.821 1.00 0.00 C ATOM 1126 O PHE A 98 -14.425 1.830 4.954 1.00 0.00 O ATOM 1127 CB PHE A 98 -11.665 2.653 4.315 1.00 0.00 C ATOM 1128 CG PHE A 98 -10.618 1.677 3.809 1.00 0.00 C ATOM 1129 CD1 PHE A 98 -10.512 1.371 2.445 1.00 0.00 C ATOM 1130 CD2 PHE A 98 -9.736 1.086 4.724 1.00 0.00 C ATOM 1131 CE1 PHE A 98 -9.530 0.477 2.003 1.00 0.00 C ATOM 1132 CE2 PHE A 98 -8.756 0.193 4.281 1.00 0.00 C ATOM 1133 CZ PHE A 98 -8.652 -0.111 2.921 1.00 0.00 C ATOM 0 H PHE A 98 -13.936 4.316 4.330 1.00 0.00 H new ATOM 0 HA PHE A 98 -12.611 2.471 2.348 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -11.217 3.641 4.424 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -12.001 2.344 5.305 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -11.188 1.825 1.735 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -9.814 1.321 5.775 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -9.450 0.241 0.952 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -8.080 -0.262 4.989 1.00 0.00 H new ATOM 0 HZ PHE A 98 -7.894 -0.800 2.578 1.00 0.00 H new ATOM 1143 N LYS A 99 -14.447 0.931 2.945 1.00 0.00 N ATOM 1144 CA LYS A 99 -15.541 -0.015 3.336 1.00 0.00 C ATOM 1145 C LYS A 99 -14.956 -1.304 3.914 1.00 0.00 C ATOM 1146 O LYS A 99 -13.868 -1.712 3.562 1.00 0.00 O ATOM 1147 CB LYS A 99 -16.315 -0.325 2.049 1.00 0.00 C ATOM 1148 CG LYS A 99 -16.875 0.968 1.451 1.00 0.00 C ATOM 1149 CD LYS A 99 -18.238 0.689 0.811 1.00 0.00 C ATOM 1150 CE LYS A 99 -19.342 0.829 1.865 1.00 0.00 C ATOM 1151 NZ LYS A 99 -19.966 2.159 1.603 1.00 0.00 N ATOM 0 H LYS A 99 -14.120 0.846 1.983 1.00 0.00 H new ATOM 0 HA LYS A 99 -16.184 0.423 4.100 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -15.659 -0.814 1.329 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -17.128 -1.019 2.262 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -16.975 1.726 2.227 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -16.186 1.364 0.705 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -18.415 1.385 -0.009 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -18.253 -0.315 0.386 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -20.074 0.026 1.777 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -18.932 0.778 2.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -20.986 2.109 1.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -19.529 2.875 2.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -19.819 2.421 0.607 1.00 0.00 H new ATOM 1165 N GLU A 100 -15.685 -1.951 4.784 1.00 0.00 N ATOM 1166 CA GLU A 100 -15.199 -3.231 5.379 1.00 0.00 C ATOM 1167 C GLU A 100 -15.805 -4.407 4.601 1.00 0.00 C ATOM 1168 O GLU A 100 -15.138 -5.382 4.312 1.00 0.00 O ATOM 1169 CB GLU A 100 -15.700 -3.211 6.828 1.00 0.00 C ATOM 1170 CG GLU A 100 -15.278 -4.496 7.551 1.00 0.00 C ATOM 1171 CD GLU A 100 -16.378 -5.556 7.415 1.00 0.00 C ATOM 1172 OE1 GLU A 100 -17.508 -5.263 7.773 1.00 0.00 O ATOM 1173 OE2 GLU A 100 -16.071 -6.642 6.953 1.00 0.00 O ATOM 0 H GLU A 100 -16.602 -1.646 5.110 1.00 0.00 H new ATOM 0 HA GLU A 100 -14.115 -3.339 5.338 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -15.296 -2.343 7.348 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -16.786 -3.116 6.844 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -14.345 -4.871 7.130 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -15.091 -4.286 8.604 1.00 0.00 H new ATOM 1180 N ASN A 101 -17.064 -4.308 4.248 1.00 0.00 N ATOM 1181 CA ASN A 101 -17.729 -5.403 3.473 1.00 0.00 C ATOM 1182 C ASN A 101 -17.292 -5.380 1.992 1.00 0.00 C ATOM 1183 O ASN A 101 -17.660 -6.248 1.226 1.00 0.00 O ATOM 1184 CB ASN A 101 -19.240 -5.140 3.598 1.00 0.00 C ATOM 1185 CG ASN A 101 -19.600 -3.785 2.969 1.00 0.00 C ATOM 1186 OD1 ASN A 101 -19.689 -3.664 1.764 1.00 0.00 O ATOM 1187 ND2 ASN A 101 -19.822 -2.755 3.741 1.00 0.00 N ATOM 0 H ASN A 101 -17.663 -3.511 4.465 1.00 0.00 H new ATOM 0 HA ASN A 101 -17.456 -6.385 3.859 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -19.797 -5.937 3.105 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -19.532 -5.150 4.648 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -20.069 -1.854 3.331 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -19.749 -2.851 4.754 1.00 0.00 H new ATOM 1194 N GLY A 102 -16.509 -4.401 1.586 1.00 0.00 N ATOM 1195 CA GLY A 102 -16.050 -4.335 0.165 1.00 0.00 C ATOM 1196 C GLY A 102 -15.114 -5.512 -0.139 1.00 0.00 C ATOM 1197 O GLY A 102 -14.699 -6.237 0.745 1.00 0.00 O ATOM 0 H GLY A 102 -16.171 -3.646 2.183 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -16.909 -4.361 -0.505 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -15.533 -3.392 -0.015 1.00 0.00 H new ATOM 1201 N ARG A 103 -14.773 -5.691 -1.387 1.00 0.00 N ATOM 1202 CA ARG A 103 -13.856 -6.807 -1.776 1.00 0.00 C ATOM 1203 C ARG A 103 -12.440 -6.544 -1.240 1.00 0.00 C ATOM 1204 O ARG A 103 -11.988 -5.415 -1.186 1.00 0.00 O ATOM 1205 CB ARG A 103 -13.870 -6.807 -3.311 1.00 0.00 C ATOM 1206 CG ARG A 103 -12.674 -7.597 -3.861 1.00 0.00 C ATOM 1207 CD ARG A 103 -12.890 -9.097 -3.632 1.00 0.00 C ATOM 1208 NE ARG A 103 -14.041 -9.466 -4.507 1.00 0.00 N ATOM 1209 CZ ARG A 103 -13.851 -9.687 -5.780 1.00 0.00 C ATOM 1210 NH1 ARG A 103 -13.477 -10.871 -6.189 1.00 0.00 N ATOM 1211 NH2 ARG A 103 -14.034 -8.719 -6.641 1.00 0.00 N ATOM 0 H ARG A 103 -15.092 -5.108 -2.161 1.00 0.00 H new ATOM 0 HA ARG A 103 -14.169 -7.767 -1.366 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -14.800 -7.246 -3.672 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -13.837 -5.782 -3.681 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -12.553 -7.396 -4.926 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -11.756 -7.274 -3.370 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -11.999 -9.667 -3.893 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -13.108 -9.308 -2.585 1.00 0.00 H new ATOM 0 HE ARG A 103 -14.977 -9.546 -4.110 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -13.334 -11.622 -5.514 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -13.329 -11.044 -7.183 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -14.324 -7.796 -6.317 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -13.887 -8.887 -7.636 1.00 0.00 H new ATOM 1225 N VAL A 104 -11.743 -7.581 -0.847 1.00 0.00 N ATOM 1226 CA VAL A 104 -10.356 -7.403 -0.315 1.00 0.00 C ATOM 1227 C VAL A 104 -9.349 -8.128 -1.219 1.00 0.00 C ATOM 1228 O VAL A 104 -9.528 -9.283 -1.559 1.00 0.00 O ATOM 1229 CB VAL A 104 -10.357 -8.033 1.087 1.00 0.00 C ATOM 1230 CG1 VAL A 104 -9.093 -7.604 1.833 1.00 0.00 C ATOM 1231 CG2 VAL A 104 -11.588 -7.572 1.880 1.00 0.00 C ATOM 0 H VAL A 104 -12.075 -8.545 -0.872 1.00 0.00 H new ATOM 0 HA VAL A 104 -10.071 -6.352 -0.281 1.00 0.00 H new ATOM 0 HB VAL A 104 -10.385 -9.118 0.986 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -9.089 -8.049 2.828 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -8.214 -7.939 1.282 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -9.073 -6.518 1.921 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -11.574 -8.027 2.870 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -11.572 -6.487 1.979 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -12.494 -7.875 1.354 1.00 0.00 H new ATOM 1241 N LYS A 105 -8.292 -7.458 -1.608 1.00 0.00 N ATOM 1242 CA LYS A 105 -7.270 -8.104 -2.486 1.00 0.00 C ATOM 1243 C LYS A 105 -5.858 -7.771 -1.993 1.00 0.00 C ATOM 1244 O LYS A 105 -5.630 -6.744 -1.388 1.00 0.00 O ATOM 1245 CB LYS A 105 -7.498 -7.502 -3.877 1.00 0.00 C ATOM 1246 CG LYS A 105 -8.606 -8.271 -4.601 1.00 0.00 C ATOM 1247 CD LYS A 105 -8.837 -7.657 -5.986 1.00 0.00 C ATOM 1248 CE LYS A 105 -9.723 -6.413 -5.857 1.00 0.00 C ATOM 1249 NZ LYS A 105 -10.594 -6.425 -7.067 1.00 0.00 N ATOM 0 H LYS A 105 -8.094 -6.490 -1.354 1.00 0.00 H new ATOM 0 HA LYS A 105 -7.363 -9.190 -2.488 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -7.771 -6.451 -3.788 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -6.576 -7.543 -4.457 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -8.330 -9.321 -4.699 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -9.527 -8.237 -4.019 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -7.883 -7.390 -6.440 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -9.310 -8.386 -6.644 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -10.317 -6.446 -4.944 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -9.122 -5.505 -5.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -11.228 -5.601 -7.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -10.002 -6.385 -7.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -11.160 -7.297 -7.079 1.00 0.00 H new ATOM 1263 N GLN A 106 -4.907 -8.626 -2.271 1.00 0.00 N ATOM 1264 CA GLN A 106 -3.503 -8.356 -1.844 1.00 0.00 C ATOM 1265 C GLN A 106 -2.591 -8.375 -3.067 1.00 0.00 C ATOM 1266 O GLN A 106 -2.356 -9.410 -3.662 1.00 0.00 O ATOM 1267 CB GLN A 106 -3.139 -9.479 -0.871 1.00 0.00 C ATOM 1268 CG GLN A 106 -1.807 -9.149 -0.186 1.00 0.00 C ATOM 1269 CD GLN A 106 -1.338 -10.350 0.640 1.00 0.00 C ATOM 1270 OE1 GLN A 106 -1.553 -10.399 1.835 1.00 0.00 O ATOM 1271 NE2 GLN A 106 -0.706 -11.329 0.052 1.00 0.00 N ATOM 0 H GLN A 106 -5.044 -9.501 -2.777 1.00 0.00 H new ATOM 0 HA GLN A 106 -3.392 -7.381 -1.369 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -3.925 -9.597 -0.125 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -3.061 -10.426 -1.405 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -1.056 -8.895 -0.934 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -1.924 -8.277 0.457 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -0.525 -11.290 -0.951 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -0.393 -12.134 0.595 1.00 0.00 H new ATOM 1280 N CYS A 107 -2.081 -7.233 -3.450 1.00 0.00 N ATOM 1281 CA CYS A 107 -1.185 -7.180 -4.643 1.00 0.00 C ATOM 1282 C CYS A 107 0.276 -7.255 -4.211 1.00 0.00 C ATOM 1283 O CYS A 107 0.764 -6.413 -3.477 1.00 0.00 O ATOM 1284 CB CYS A 107 -1.478 -5.846 -5.327 1.00 0.00 C ATOM 1285 SG CYS A 107 -2.640 -6.115 -6.689 1.00 0.00 S ATOM 0 H CYS A 107 -2.246 -6.338 -2.990 1.00 0.00 H new ATOM 0 HA CYS A 107 -1.361 -8.018 -5.317 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -1.898 -5.141 -4.610 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -0.554 -5.406 -5.703 1.00 0.00 H new ATOM 1290 N VAL A 108 0.973 -8.258 -4.668 1.00 0.00 N ATOM 1291 CA VAL A 108 2.410 -8.407 -4.298 1.00 0.00 C ATOM 1292 C VAL A 108 3.283 -8.422 -5.557 1.00 0.00 C ATOM 1293 O VAL A 108 2.941 -9.027 -6.558 1.00 0.00 O ATOM 1294 CB VAL A 108 2.511 -9.739 -3.540 1.00 0.00 C ATOM 1295 CG1 VAL A 108 1.573 -9.720 -2.328 1.00 0.00 C ATOM 1296 CG2 VAL A 108 2.125 -10.901 -4.459 1.00 0.00 C ATOM 0 H VAL A 108 0.608 -8.984 -5.284 1.00 0.00 H new ATOM 0 HA VAL A 108 2.760 -7.578 -3.683 1.00 0.00 H new ATOM 0 HB VAL A 108 3.540 -9.872 -3.205 1.00 0.00 H new ATOM 0 HG11 VAL A 108 1.649 -10.667 -1.794 1.00 0.00 H new ATOM 0 HG12 VAL A 108 1.855 -8.905 -1.662 1.00 0.00 H new ATOM 0 HG13 VAL A 108 0.547 -9.574 -2.665 1.00 0.00 H new ATOM 0 HG21 VAL A 108 2.201 -11.840 -3.910 1.00 0.00 H new ATOM 0 HG22 VAL A 108 1.101 -10.765 -4.806 1.00 0.00 H new ATOM 0 HG23 VAL A 108 2.798 -10.926 -5.316 1.00 0.00 H new ATOM 1306 N GLY A 109 4.404 -7.750 -5.519 1.00 0.00 N ATOM 1307 CA GLY A 109 5.298 -7.714 -6.712 1.00 0.00 C ATOM 1308 C GLY A 109 6.623 -7.041 -6.359 1.00 0.00 C ATOM 1309 O GLY A 109 6.981 -6.913 -5.204 1.00 0.00 O ATOM 0 H GLY A 109 4.739 -7.224 -4.712 1.00 0.00 H new ATOM 0 HA2 GLY A 109 5.481 -8.727 -7.069 1.00 0.00 H new ATOM 0 HA3 GLY A 109 4.812 -7.173 -7.524 1.00 0.00 H new ATOM 1313 N THR A 110 7.351 -6.605 -7.353 1.00 0.00 N ATOM 1314 CA THR A 110 8.660 -5.930 -7.089 1.00 0.00 C ATOM 1315 C THR A 110 8.734 -4.594 -7.838 1.00 0.00 C ATOM 1316 O THR A 110 8.346 -4.490 -8.988 1.00 0.00 O ATOM 1317 CB THR A 110 9.746 -6.897 -7.590 1.00 0.00 C ATOM 1318 OG1 THR A 110 9.609 -7.100 -8.994 1.00 0.00 O ATOM 1319 CG2 THR A 110 9.630 -8.239 -6.861 1.00 0.00 C ATOM 0 H THR A 110 7.097 -6.686 -8.338 1.00 0.00 H new ATOM 0 HA THR A 110 8.789 -5.707 -6.030 1.00 0.00 H new ATOM 0 HB THR A 110 10.725 -6.462 -7.386 1.00 0.00 H new ATOM 0 HG1 THR A 110 10.305 -7.715 -9.305 1.00 0.00 H new ATOM 0 HG21 THR A 110 10.403 -8.917 -7.222 1.00 0.00 H new ATOM 0 HG22 THR A 110 9.756 -8.083 -5.790 1.00 0.00 H new ATOM 0 HG23 THR A 110 8.648 -8.673 -7.052 1.00 0.00 H new ATOM 1327 N VAL A 111 9.237 -3.576 -7.185 1.00 0.00 N ATOM 1328 CA VAL A 111 9.357 -2.230 -7.830 1.00 0.00 C ATOM 1329 C VAL A 111 10.704 -1.596 -7.461 1.00 0.00 C ATOM 1330 O VAL A 111 11.282 -1.911 -6.438 1.00 0.00 O ATOM 1331 CB VAL A 111 8.199 -1.390 -7.266 1.00 0.00 C ATOM 1332 CG1 VAL A 111 6.866 -1.937 -7.782 1.00 0.00 C ATOM 1333 CG2 VAL A 111 8.207 -1.441 -5.732 1.00 0.00 C ATOM 0 H VAL A 111 9.573 -3.620 -6.223 1.00 0.00 H new ATOM 0 HA VAL A 111 9.310 -2.294 -8.917 1.00 0.00 H new ATOM 0 HB VAL A 111 8.323 -0.357 -7.592 1.00 0.00 H new ATOM 0 HG11 VAL A 111 6.048 -1.339 -7.380 1.00 0.00 H new ATOM 0 HG12 VAL A 111 6.850 -1.889 -8.871 1.00 0.00 H new ATOM 0 HG13 VAL A 111 6.750 -2.973 -7.463 1.00 0.00 H new ATOM 0 HG21 VAL A 111 7.383 -0.843 -5.344 1.00 0.00 H new ATOM 0 HG22 VAL A 111 8.093 -2.473 -5.402 1.00 0.00 H new ATOM 0 HG23 VAL A 111 9.151 -1.043 -5.360 1.00 0.00 H new ATOM 1343 N THR A 112 11.208 -0.708 -8.281 1.00 0.00 N ATOM 1344 CA THR A 112 12.523 -0.058 -7.965 1.00 0.00 C ATOM 1345 C THR A 112 12.384 0.839 -6.727 1.00 0.00 C ATOM 1346 O THR A 112 11.466 1.634 -6.628 1.00 0.00 O ATOM 1347 CB THR A 112 12.876 0.787 -9.196 1.00 0.00 C ATOM 1348 OG1 THR A 112 12.452 0.119 -10.379 1.00 0.00 O ATOM 1349 CG2 THR A 112 14.390 1.006 -9.252 1.00 0.00 C ATOM 0 H THR A 112 10.771 -0.404 -9.151 1.00 0.00 H new ATOM 0 HA THR A 112 13.296 -0.795 -7.748 1.00 0.00 H new ATOM 0 HB THR A 112 12.370 1.750 -9.124 1.00 0.00 H new ATOM 0 HG1 THR A 112 11.611 0.512 -10.693 1.00 0.00 H new ATOM 0 HG21 THR A 112 14.639 1.606 -10.127 1.00 0.00 H new ATOM 0 HG22 THR A 112 14.716 1.525 -8.351 1.00 0.00 H new ATOM 0 HG23 THR A 112 14.895 0.042 -9.318 1.00 0.00 H new ATOM 1357 N LEU A 113 13.288 0.713 -5.785 1.00 0.00 N ATOM 1358 CA LEU A 113 13.213 1.551 -4.547 1.00 0.00 C ATOM 1359 C LEU A 113 13.817 2.943 -4.789 1.00 0.00 C ATOM 1360 O LEU A 113 13.244 3.943 -4.401 1.00 0.00 O ATOM 1361 CB LEU A 113 14.025 0.789 -3.491 1.00 0.00 C ATOM 1362 CG LEU A 113 13.836 1.451 -2.121 1.00 0.00 C ATOM 1363 CD1 LEU A 113 12.491 1.031 -1.522 1.00 0.00 C ATOM 1364 CD2 LEU A 113 14.966 1.020 -1.184 1.00 0.00 C ATOM 0 H LEU A 113 14.075 0.065 -5.820 1.00 0.00 H new ATOM 0 HA LEU A 113 12.182 1.711 -4.233 1.00 0.00 H new ATOM 0 HB2 LEU A 113 13.703 -0.252 -3.451 1.00 0.00 H new ATOM 0 HB3 LEU A 113 15.081 0.786 -3.762 1.00 0.00 H new ATOM 0 HG LEU A 113 13.854 2.534 -2.242 1.00 0.00 H new ATOM 0 HD11 LEU A 113 12.362 1.504 -0.549 1.00 0.00 H new ATOM 0 HD12 LEU A 113 11.684 1.341 -2.186 1.00 0.00 H new ATOM 0 HD13 LEU A 113 12.468 -0.052 -1.404 1.00 0.00 H new ATOM 0 HD21 LEU A 113 14.831 1.491 -0.210 1.00 0.00 H new ATOM 0 HD22 LEU A 113 14.949 -0.064 -1.068 1.00 0.00 H new ATOM 0 HD23 LEU A 113 15.924 1.325 -1.605 1.00 0.00 H new ATOM 1376 N ASP A 114 14.966 3.018 -5.422 1.00 0.00 N ATOM 1377 CA ASP A 114 15.596 4.353 -5.680 1.00 0.00 C ATOM 1378 C ASP A 114 14.681 5.204 -6.568 1.00 0.00 C ATOM 1379 O ASP A 114 14.320 6.313 -6.221 1.00 0.00 O ATOM 1380 CB ASP A 114 16.913 4.056 -6.406 1.00 0.00 C ATOM 1381 CG ASP A 114 18.085 4.167 -5.427 1.00 0.00 C ATOM 1382 OD1 ASP A 114 18.369 5.273 -4.997 1.00 0.00 O ATOM 1383 OD2 ASP A 114 18.683 3.148 -5.131 1.00 0.00 O ATOM 0 H ASP A 114 15.492 2.216 -5.769 1.00 0.00 H new ATOM 0 HA ASP A 114 15.762 4.908 -4.757 1.00 0.00 H new ATOM 0 HB2 ASP A 114 16.882 3.056 -6.838 1.00 0.00 H new ATOM 0 HB3 ASP A 114 17.049 4.756 -7.231 1.00 0.00 H new ATOM 1388 N GLN A 115 14.300 4.683 -7.706 1.00 0.00 N ATOM 1389 CA GLN A 115 13.400 5.438 -8.625 1.00 0.00 C ATOM 1390 C GLN A 115 12.289 4.515 -9.138 1.00 0.00 C ATOM 1391 O GLN A 115 12.509 3.680 -9.995 1.00 0.00 O ATOM 1392 CB GLN A 115 14.293 5.928 -9.780 1.00 0.00 C ATOM 1393 CG GLN A 115 15.120 4.767 -10.358 1.00 0.00 C ATOM 1394 CD GLN A 115 14.731 4.531 -11.820 1.00 0.00 C ATOM 1395 OE1 GLN A 115 14.332 3.443 -12.185 1.00 0.00 O ATOM 1396 NE2 GLN A 115 14.833 5.508 -12.680 1.00 0.00 N ATOM 0 H GLN A 115 14.577 3.760 -8.039 1.00 0.00 H new ATOM 0 HA GLN A 115 12.913 6.277 -8.128 1.00 0.00 H new ATOM 0 HB2 GLN A 115 13.675 6.366 -10.564 1.00 0.00 H new ATOM 0 HB3 GLN A 115 14.959 6.713 -9.423 1.00 0.00 H new ATOM 0 HG2 GLN A 115 16.183 4.995 -10.287 1.00 0.00 H new ATOM 0 HG3 GLN A 115 14.949 3.861 -9.776 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.168 6.422 -12.376 1.00 0.00 H new ATOM 0 HE22 GLN A 115 14.578 5.357 -13.656 1.00 0.00 H new ATOM 1405 N ILE A 116 11.098 4.653 -8.611 1.00 0.00 N ATOM 1406 CA ILE A 116 9.968 3.779 -9.061 1.00 0.00 C ATOM 1407 C ILE A 116 9.783 3.909 -10.578 1.00 0.00 C ATOM 1408 O ILE A 116 9.531 4.983 -11.090 1.00 0.00 O ATOM 1409 CB ILE A 116 8.728 4.293 -8.314 1.00 0.00 C ATOM 1410 CG1 ILE A 116 8.913 4.090 -6.805 1.00 0.00 C ATOM 1411 CG2 ILE A 116 7.488 3.522 -8.776 1.00 0.00 C ATOM 1412 CD1 ILE A 116 8.264 5.252 -6.047 1.00 0.00 C ATOM 0 H ILE A 116 10.858 5.332 -7.889 1.00 0.00 H new ATOM 0 HA ILE A 116 10.150 2.726 -8.848 1.00 0.00 H new ATOM 0 HB ILE A 116 8.599 5.354 -8.528 1.00 0.00 H new ATOM 0 HG12 ILE A 116 8.464 3.146 -6.497 1.00 0.00 H new ATOM 0 HG13 ILE A 116 9.974 4.032 -6.563 1.00 0.00 H new ATOM 0 HG21 ILE A 116 6.611 3.890 -8.243 1.00 0.00 H new ATOM 0 HG22 ILE A 116 7.348 3.666 -9.847 1.00 0.00 H new ATOM 0 HG23 ILE A 116 7.621 2.461 -8.567 1.00 0.00 H new ATOM 0 HD11 ILE A 116 8.396 5.106 -4.975 1.00 0.00 H new ATOM 0 HD12 ILE A 116 8.733 6.189 -6.346 1.00 0.00 H new ATOM 0 HD13 ILE A 116 7.200 5.289 -6.279 1.00 0.00 H new ATOM 1424 N LYS A 117 9.918 2.824 -11.299 1.00 0.00 N ATOM 1425 CA LYS A 117 9.761 2.883 -12.783 1.00 0.00 C ATOM 1426 C LYS A 117 8.826 1.768 -13.272 1.00 0.00 C ATOM 1427 O LYS A 117 8.693 0.733 -12.645 1.00 0.00 O ATOM 1428 CB LYS A 117 11.175 2.683 -13.338 1.00 0.00 C ATOM 1429 CG LYS A 117 11.362 3.546 -14.590 1.00 0.00 C ATOM 1430 CD LYS A 117 11.785 2.661 -15.766 1.00 0.00 C ATOM 1431 CE LYS A 117 11.065 3.121 -17.040 1.00 0.00 C ATOM 1432 NZ LYS A 117 12.097 3.073 -18.117 1.00 0.00 N ATOM 0 H LYS A 117 10.130 1.900 -10.923 1.00 0.00 H new ATOM 0 HA LYS A 117 9.321 3.825 -13.112 1.00 0.00 H new ATOM 0 HB2 LYS A 117 11.914 2.953 -12.584 1.00 0.00 H new ATOM 0 HB3 LYS A 117 11.336 1.633 -13.580 1.00 0.00 H new ATOM 0 HG2 LYS A 117 10.434 4.065 -14.828 1.00 0.00 H new ATOM 0 HG3 LYS A 117 12.117 4.311 -14.407 1.00 0.00 H new ATOM 0 HD2 LYS A 117 12.865 2.716 -15.906 1.00 0.00 H new ATOM 0 HD3 LYS A 117 11.544 1.619 -15.556 1.00 0.00 H new ATOM 0 HE2 LYS A 117 10.223 2.469 -17.273 1.00 0.00 H new ATOM 0 HE3 LYS A 117 10.665 4.128 -16.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 11.673 3.375 -19.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 12.883 3.709 -17.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 12.455 2.101 -18.212 1.00 0.00 H new ATOM 1446 N ASP A 118 8.181 1.980 -14.393 1.00 0.00 N ATOM 1447 CA ASP A 118 7.253 0.945 -14.941 1.00 0.00 C ATOM 1448 C ASP A 118 7.933 0.175 -16.088 1.00 0.00 C ATOM 1449 O ASP A 118 8.864 0.673 -16.692 1.00 0.00 O ATOM 1450 CB ASP A 118 6.033 1.733 -15.449 1.00 0.00 C ATOM 1451 CG ASP A 118 6.352 2.415 -16.789 1.00 0.00 C ATOM 1452 OD1 ASP A 118 7.175 3.318 -16.794 1.00 0.00 O ATOM 1453 OD2 ASP A 118 5.767 2.023 -17.784 1.00 0.00 O ATOM 0 H ASP A 118 8.258 2.829 -14.953 1.00 0.00 H new ATOM 0 HA ASP A 118 6.969 0.203 -14.195 1.00 0.00 H new ATOM 0 HB2 ASP A 118 5.183 1.061 -15.570 1.00 0.00 H new ATOM 0 HB3 ASP A 118 5.745 2.483 -14.712 1.00 0.00 H new ATOM 1458 N PRO A 119 7.446 -1.016 -16.358 1.00 0.00 N ATOM 1459 CA PRO A 119 6.310 -1.591 -15.596 1.00 0.00 C ATOM 1460 C PRO A 119 6.798 -2.236 -14.289 1.00 0.00 C ATOM 1461 O PRO A 119 7.973 -2.505 -14.118 1.00 0.00 O ATOM 1462 CB PRO A 119 5.753 -2.651 -16.540 1.00 0.00 C ATOM 1463 CG PRO A 119 6.896 -3.046 -17.427 1.00 0.00 C ATOM 1464 CD PRO A 119 7.912 -1.926 -17.410 1.00 0.00 C ATOM 0 HA PRO A 119 5.572 -0.843 -15.306 1.00 0.00 H new ATOM 0 HB2 PRO A 119 5.374 -3.509 -15.985 1.00 0.00 H new ATOM 0 HB3 PRO A 119 4.922 -2.257 -17.125 1.00 0.00 H new ATOM 0 HG2 PRO A 119 7.347 -3.974 -17.076 1.00 0.00 H new ATOM 0 HG3 PRO A 119 6.545 -3.226 -18.443 1.00 0.00 H new ATOM 0 HD2 PRO A 119 8.912 -2.302 -17.194 1.00 0.00 H new ATOM 0 HD3 PRO A 119 7.962 -1.422 -18.375 1.00 0.00 H new ATOM 1472 N LEU A 120 5.896 -2.501 -13.375 1.00 0.00 N ATOM 1473 CA LEU A 120 6.291 -3.146 -12.085 1.00 0.00 C ATOM 1474 C LEU A 120 5.663 -4.540 -11.994 1.00 0.00 C ATOM 1475 O LEU A 120 4.461 -4.702 -12.099 1.00 0.00 O ATOM 1476 CB LEU A 120 5.786 -2.224 -10.958 1.00 0.00 C ATOM 1477 CG LEU A 120 4.350 -1.752 -11.223 1.00 0.00 C ATOM 1478 CD1 LEU A 120 3.564 -1.750 -9.911 1.00 0.00 C ATOM 1479 CD2 LEU A 120 4.377 -0.329 -11.793 1.00 0.00 C ATOM 0 H LEU A 120 4.901 -2.298 -13.468 1.00 0.00 H new ATOM 0 HA LEU A 120 7.371 -3.275 -12.007 1.00 0.00 H new ATOM 0 HB2 LEU A 120 5.827 -2.754 -10.006 1.00 0.00 H new ATOM 0 HB3 LEU A 120 6.444 -1.360 -10.870 1.00 0.00 H new ATOM 0 HG LEU A 120 3.874 -2.425 -11.936 1.00 0.00 H new ATOM 0 HD11 LEU A 120 2.544 -1.415 -10.098 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.544 -2.758 -9.497 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.043 -1.076 -9.201 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.357 0.007 -11.981 1.00 0.00 H new ATOM 0 HD22 LEU A 120 4.853 0.341 -11.077 1.00 0.00 H new ATOM 0 HD23 LEU A 120 4.940 -0.322 -12.726 1.00 0.00 H new ATOM 1491 N ASP A 121 6.482 -5.546 -11.825 1.00 0.00 N ATOM 1492 CA ASP A 121 5.965 -6.952 -11.751 1.00 0.00 C ATOM 1493 C ASP A 121 5.159 -7.186 -10.467 1.00 0.00 C ATOM 1494 O ASP A 121 5.654 -7.742 -9.504 1.00 0.00 O ATOM 1495 CB ASP A 121 7.215 -7.835 -11.768 1.00 0.00 C ATOM 1496 CG ASP A 121 7.690 -8.026 -13.209 1.00 0.00 C ATOM 1497 OD1 ASP A 121 7.175 -8.916 -13.868 1.00 0.00 O ATOM 1498 OD2 ASP A 121 8.558 -7.280 -13.629 1.00 0.00 O ATOM 0 H ASP A 121 7.494 -5.456 -11.734 1.00 0.00 H new ATOM 0 HA ASP A 121 5.289 -7.173 -12.577 1.00 0.00 H new ATOM 0 HB2 ASP A 121 8.004 -7.377 -11.172 1.00 0.00 H new ATOM 0 HB3 ASP A 121 6.995 -8.802 -11.316 1.00 0.00 H new ATOM 1503 N ILE A 122 3.915 -6.784 -10.462 1.00 0.00 N ATOM 1504 CA ILE A 122 3.048 -6.995 -9.258 1.00 0.00 C ATOM 1505 C ILE A 122 1.777 -7.754 -9.651 1.00 0.00 C ATOM 1506 O ILE A 122 1.275 -7.614 -10.751 1.00 0.00 O ATOM 1507 CB ILE A 122 2.701 -5.597 -8.715 1.00 0.00 C ATOM 1508 CG1 ILE A 122 2.037 -4.741 -9.807 1.00 0.00 C ATOM 1509 CG2 ILE A 122 3.974 -4.901 -8.227 1.00 0.00 C ATOM 1510 CD1 ILE A 122 0.519 -4.944 -9.780 1.00 0.00 C ATOM 0 H ILE A 122 3.457 -6.315 -11.244 1.00 0.00 H new ATOM 0 HA ILE A 122 3.559 -7.588 -8.500 1.00 0.00 H new ATOM 0 HB ILE A 122 2.003 -5.712 -7.885 1.00 0.00 H new ATOM 0 HG12 ILE A 122 2.274 -3.689 -9.651 1.00 0.00 H new ATOM 0 HG13 ILE A 122 2.432 -5.015 -10.786 1.00 0.00 H new ATOM 0 HG21 ILE A 122 3.724 -3.912 -7.844 1.00 0.00 H new ATOM 0 HG22 ILE A 122 4.431 -5.493 -7.434 1.00 0.00 H new ATOM 0 HG23 ILE A 122 4.675 -4.802 -9.056 1.00 0.00 H new ATOM 0 HD11 ILE A 122 0.057 -4.334 -10.556 1.00 0.00 H new ATOM 0 HD12 ILE A 122 0.289 -5.994 -9.958 1.00 0.00 H new ATOM 0 HD13 ILE A 122 0.130 -4.648 -8.806 1.00 0.00 H new ATOM 1522 N THR A 123 1.257 -8.563 -8.761 1.00 0.00 N ATOM 1523 CA THR A 123 0.019 -9.337 -9.080 1.00 0.00 C ATOM 1524 C THR A 123 -0.842 -9.515 -7.823 1.00 0.00 C ATOM 1525 O THR A 123 -0.336 -9.696 -6.730 1.00 0.00 O ATOM 1526 CB THR A 123 0.511 -10.700 -9.583 1.00 0.00 C ATOM 1527 OG1 THR A 123 1.375 -10.517 -10.699 1.00 0.00 O ATOM 1528 CG2 THR A 123 -0.684 -11.557 -10.004 1.00 0.00 C ATOM 0 H THR A 123 1.637 -8.720 -7.828 1.00 0.00 H new ATOM 0 HA THR A 123 -0.598 -8.826 -9.820 1.00 0.00 H new ATOM 0 HB THR A 123 1.054 -11.201 -8.781 1.00 0.00 H new ATOM 0 HG1 THR A 123 1.689 -11.390 -11.017 1.00 0.00 H new ATOM 0 HG21 THR A 123 -0.330 -12.524 -10.361 1.00 0.00 H new ATOM 0 HG22 THR A 123 -1.345 -11.705 -9.150 1.00 0.00 H new ATOM 0 HG23 THR A 123 -1.230 -11.053 -10.802 1.00 0.00 H new ATOM 1536 N CYS A 124 -2.141 -9.479 -7.977 1.00 0.00 N ATOM 1537 CA CYS A 124 -3.043 -9.658 -6.800 1.00 0.00 C ATOM 1538 C CYS A 124 -3.565 -11.090 -6.760 1.00 0.00 C ATOM 1539 O CYS A 124 -3.766 -11.714 -7.787 1.00 0.00 O ATOM 1540 CB CYS A 124 -4.206 -8.690 -7.019 1.00 0.00 C ATOM 1541 SG CYS A 124 -4.072 -7.288 -5.883 1.00 0.00 S ATOM 0 H CYS A 124 -2.616 -9.333 -8.868 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.525 -9.465 -5.861 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -4.204 -8.334 -8.049 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -5.153 -9.206 -6.862 1.00 0.00 H new ATOM 1546 N ASN A 125 -3.795 -11.618 -5.586 1.00 0.00 N ATOM 1547 CA ASN A 125 -4.316 -13.012 -5.495 1.00 0.00 C ATOM 1548 C ASN A 125 -5.617 -13.062 -4.682 1.00 0.00 C ATOM 1549 O ASN A 125 -5.871 -14.007 -3.958 1.00 0.00 O ATOM 1550 CB ASN A 125 -3.202 -13.814 -4.814 1.00 0.00 C ATOM 1551 CG ASN A 125 -2.957 -15.108 -5.594 1.00 0.00 C ATOM 1552 OD1 ASN A 125 -2.119 -15.153 -6.471 1.00 0.00 O ATOM 1553 ND2 ASN A 125 -3.662 -16.170 -5.313 1.00 0.00 N ATOM 0 H ASN A 125 -3.646 -11.148 -4.693 1.00 0.00 H new ATOM 0 HA ASN A 125 -4.562 -13.419 -6.476 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -2.287 -13.223 -4.772 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -3.481 -14.044 -3.786 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -3.508 -17.036 -5.830 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -4.367 -16.134 -4.576 1.00 0.00 H new ATOM 1560 N GLU A 126 -6.447 -12.052 -4.822 1.00 0.00 N ATOM 1561 CA GLU A 126 -7.763 -12.001 -4.093 1.00 0.00 C ATOM 1562 C GLU A 126 -7.618 -12.434 -2.622 1.00 0.00 C ATOM 1563 O GLU A 126 -8.412 -13.203 -2.112 1.00 0.00 O ATOM 1564 CB GLU A 126 -8.674 -12.971 -4.855 1.00 0.00 C ATOM 1565 CG GLU A 126 -8.869 -12.475 -6.295 1.00 0.00 C ATOM 1566 CD GLU A 126 -10.196 -11.717 -6.408 1.00 0.00 C ATOM 1567 OE1 GLU A 126 -10.326 -10.686 -5.764 1.00 0.00 O ATOM 1568 OE2 GLU A 126 -11.057 -12.175 -7.139 1.00 0.00 O ATOM 0 H GLU A 126 -6.266 -11.246 -5.421 1.00 0.00 H new ATOM 0 HA GLU A 126 -8.163 -10.988 -4.065 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -8.235 -13.969 -4.860 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -9.639 -13.049 -4.353 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -8.042 -11.824 -6.580 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -8.862 -13.319 -6.984 1.00 0.00 H new ATOM 1575 N VAL A 127 -6.616 -11.943 -1.938 1.00 0.00 N ATOM 1576 CA VAL A 127 -6.426 -12.327 -0.503 1.00 0.00 C ATOM 1577 C VAL A 127 -7.230 -11.394 0.412 1.00 0.00 C ATOM 1578 O VAL A 127 -7.458 -10.241 0.094 1.00 0.00 O ATOM 1579 CB VAL A 127 -4.924 -12.176 -0.239 1.00 0.00 C ATOM 1580 CG1 VAL A 127 -4.611 -12.558 1.211 1.00 0.00 C ATOM 1581 CG2 VAL A 127 -4.141 -13.092 -1.184 1.00 0.00 C ATOM 0 H VAL A 127 -5.922 -11.294 -2.309 1.00 0.00 H new ATOM 0 HA VAL A 127 -6.773 -13.341 -0.303 1.00 0.00 H new ATOM 0 HB VAL A 127 -4.634 -11.139 -0.411 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -3.542 -12.449 1.393 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -5.163 -11.905 1.887 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -4.905 -13.593 1.386 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -3.073 -12.983 -0.995 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -4.436 -14.128 -1.014 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -4.356 -12.818 -2.217 1.00 0.00 H new ATOM 1591 N GLN A 128 -7.652 -11.889 1.548 1.00 0.00 N ATOM 1592 CA GLN A 128 -8.435 -11.044 2.498 1.00 0.00 C ATOM 1593 C GLN A 128 -7.515 -10.470 3.586 1.00 0.00 C ATOM 1594 O GLN A 128 -6.338 -10.780 3.644 1.00 0.00 O ATOM 1595 CB GLN A 128 -9.474 -11.990 3.110 1.00 0.00 C ATOM 1596 CG GLN A 128 -10.655 -12.153 2.147 1.00 0.00 C ATOM 1597 CD GLN A 128 -10.614 -13.545 1.506 1.00 0.00 C ATOM 1598 OE1 GLN A 128 -11.014 -14.517 2.114 1.00 0.00 O ATOM 1599 NE2 GLN A 128 -10.146 -13.683 0.295 1.00 0.00 N ATOM 0 H GLN A 128 -7.487 -12.846 1.859 1.00 0.00 H new ATOM 0 HA GLN A 128 -8.903 -10.193 2.003 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -9.021 -12.961 3.313 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -9.822 -11.595 4.064 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -11.594 -12.017 2.683 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -10.615 -11.385 1.374 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -9.809 -12.868 -0.218 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -10.117 -14.606 -0.138 1.00 0.00 H new ATOM 1608 N GLY A 129 -8.045 -9.634 4.446 1.00 0.00 N ATOM 1609 CA GLY A 129 -7.213 -9.038 5.532 1.00 0.00 C ATOM 1610 C GLY A 129 -7.128 -10.017 6.703 1.00 0.00 C ATOM 1611 O GLY A 129 -7.751 -9.825 7.732 1.00 0.00 O ATOM 0 H GLY A 129 -9.022 -9.339 4.440 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -6.214 -8.814 5.158 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -7.649 -8.095 5.863 1.00 0.00 H new ATOM 1615 N VAL A 130 -6.365 -11.066 6.549 1.00 0.00 N ATOM 1616 CA VAL A 130 -6.229 -12.074 7.648 1.00 0.00 C ATOM 1617 C VAL A 130 -4.890 -11.897 8.388 1.00 0.00 C ATOM 1618 O VAL A 130 -3.960 -11.378 7.789 1.00 0.00 O ATOM 1619 CB VAL A 130 -6.306 -13.443 6.949 1.00 0.00 C ATOM 1620 CG1 VAL A 130 -5.025 -13.706 6.149 1.00 0.00 C ATOM 1621 CG2 VAL A 130 -6.480 -14.542 8.002 1.00 0.00 C ATOM 1622 OXT VAL A 130 -4.822 -12.283 9.544 1.00 0.00 O ATOM 0 H VAL A 130 -5.827 -11.271 5.707 1.00 0.00 H new ATOM 0 HA VAL A 130 -7.007 -11.966 8.404 1.00 0.00 H new ATOM 0 HB VAL A 130 -7.156 -13.444 6.267 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -5.094 -14.678 5.660 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -4.901 -12.929 5.395 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -4.168 -13.699 6.822 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -6.535 -15.513 7.509 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -5.631 -14.529 8.685 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -7.399 -14.367 8.562 1.00 0.00 H new TER 1632 VAL A 130