USER MOD reduce.3.24.130724 H: found=0, std=0, add=1062, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1062 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 115 GLN :FLIP amide:sc= 0.97 F(o=0.027,f=1.6) USER MOD Set 1.2: A 117 TYR OH : rot 107:sc= 0.646 USER MOD Set 2.1: A 14 TYR OH : rot -150:sc= -0.307 USER MOD Set 2.2: A 18 MET CE :methyl 161:sc=-0.00144 (180deg=-0.198) USER MOD Single : A 1 ALA N :NH3+ -133:sc= -0.0531 (180deg=-1.18) USER MOD Single : A 4 SER OG : rot 136:sc= 0.613 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -125:sc= 1.29 (180deg=-0.566) USER MOD Single : A 11 SER OG : rot 180:sc= -1.52! USER MOD Single : A 13 ASN : amide:sc= -0.0424 K(o=-0.042,f=-2.8!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl 178:sc= 0 (180deg=-0.00258) USER MOD Single : A 24 ASN : amide:sc= -0.0701 X(o=-0.07,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HE2:sc= -0.0363 K(o=-0.036,f=-1.2) USER MOD Single : A 35 ASN : amide:sc= -0.267 X(o=-0.27,f=-0.051) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot -0:sc= 0.532 USER MOD Single : A 42 GLN : amide:sc= 0.466 K(o=0.47,f=-0.68) USER MOD Single : A 45 ASN : amide:sc= -1.26 X(o=-1.3,f=-0.9) USER MOD Single : A 46 LYS NZ :NH3+ -140:sc= 0.923 (180deg=0.134) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00299) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot -54:sc= 0.391 USER MOD Single : A 57 ASN :FLIP amide:sc= -0.0448 F(o=-0.56,f=-0.045) USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.15 USER MOD Single : A 69 ASN : amide:sc= -0.136 K(o=-0.14,f=-2.1) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= -0.14 X(o=-0.14,f=-0.6) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ -139:sc= 0.0705 (180deg=-0.097) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 THR OG1 : rot -33:sc= 0.359 USER MOD Single : A 98 ASN : amide:sc= -0.022 X(o=-0.022,f=-0.011) USER MOD Single : A 100 ASN : amide:sc= -4.1! C(o=-4.1!,f=-7.9!) USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 THR OG1 : rot 103:sc= 1.57 USER MOD Single : A 116 THR OG1 : rot -26:sc= 1.04 USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0847) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 14.105 -8.594 -15.086 1.00 0.00 N ATOM 2 CA ALA A 1 14.581 -9.179 -13.812 1.00 0.00 C ATOM 3 C ALA A 1 13.425 -9.632 -12.957 1.00 0.00 C ATOM 4 O ALA A 1 13.493 -10.712 -12.391 1.00 0.00 O ATOM 5 CB ALA A 1 15.423 -8.105 -13.085 1.00 0.00 C ATOM 0 H1 ALA A 1 14.652 -8.991 -15.876 1.00 0.00 H new ATOM 0 H2 ALA A 1 13.098 -8.818 -15.216 1.00 0.00 H new ATOM 0 H3 ALA A 1 14.230 -7.562 -15.062 1.00 0.00 H new ATOM 0 HA ALA A 1 15.189 -10.062 -14.010 1.00 0.00 H new ATOM 0 HB1 ALA A 1 15.789 -8.507 -12.140 1.00 0.00 H new ATOM 0 HB2 ALA A 1 16.269 -7.821 -13.710 1.00 0.00 H new ATOM 0 HB3 ALA A 1 14.805 -7.228 -12.891 1.00 0.00 H new ATOM 13 N PHE A 2 12.367 -8.794 -12.861 1.00 0.00 N ATOM 14 CA PHE A 2 11.222 -9.109 -12.003 1.00 0.00 C ATOM 15 C PHE A 2 11.633 -9.300 -10.554 1.00 0.00 C ATOM 16 O PHE A 2 12.818 -9.319 -10.265 1.00 0.00 O ATOM 17 CB PHE A 2 10.383 -10.282 -12.598 1.00 0.00 C ATOM 18 CG PHE A 2 9.287 -9.782 -13.558 1.00 0.00 C ATOM 19 CD1 PHE A 2 8.249 -8.985 -13.062 1.00 0.00 C ATOM 20 CD2 PHE A 2 9.291 -10.120 -14.917 1.00 0.00 C ATOM 21 CE1 PHE A 2 7.246 -8.503 -13.904 1.00 0.00 C ATOM 22 CE2 PHE A 2 8.247 -9.702 -15.749 1.00 0.00 C ATOM 23 CZ PHE A 2 7.233 -8.882 -15.247 1.00 0.00 C ATOM 0 H PHE A 2 12.290 -7.909 -13.363 1.00 0.00 H new ATOM 0 HA PHE A 2 10.554 -8.248 -11.987 1.00 0.00 H new ATOM 0 HB2 PHE A 2 11.044 -10.967 -13.129 1.00 0.00 H new ATOM 0 HB3 PHE A 2 9.924 -10.847 -11.787 1.00 0.00 H new ATOM 0 HD1 PHE A 2 8.224 -8.739 -12.011 1.00 0.00 H new ATOM 0 HD2 PHE A 2 10.102 -10.705 -15.324 1.00 0.00 H new ATOM 0 HE1 PHE A 2 6.485 -7.841 -13.519 1.00 0.00 H new ATOM 0 HE2 PHE A 2 8.225 -10.014 -16.783 1.00 0.00 H new ATOM 0 HZ PHE A 2 6.441 -8.542 -15.897 1.00 0.00 H new ATOM 33 N ASP A 3 10.639 -9.411 -9.638 1.00 0.00 N ATOM 34 CA ASP A 3 10.881 -9.445 -8.190 1.00 0.00 C ATOM 35 C ASP A 3 11.595 -8.194 -7.731 1.00 0.00 C ATOM 36 O ASP A 3 12.723 -7.972 -8.141 1.00 0.00 O ATOM 37 CB ASP A 3 11.627 -10.722 -7.736 1.00 0.00 C ATOM 38 CG ASP A 3 10.861 -11.935 -8.191 1.00 0.00 C ATOM 39 OD1 ASP A 3 10.888 -12.237 -9.416 1.00 0.00 O ATOM 40 OD2 ASP A 3 10.227 -12.594 -7.324 1.00 0.00 O ATOM 0 H ASP A 3 9.653 -9.479 -9.890 1.00 0.00 H new ATOM 0 HA ASP A 3 9.904 -9.476 -7.709 1.00 0.00 H new ATOM 0 HB2 ASP A 3 12.634 -10.736 -8.153 1.00 0.00 H new ATOM 0 HB3 ASP A 3 11.731 -10.730 -6.651 1.00 0.00 H new ATOM 45 N SER A 4 10.957 -7.334 -6.902 1.00 0.00 N ATOM 46 CA SER A 4 11.507 -6.003 -6.685 1.00 0.00 C ATOM 47 C SER A 4 10.670 -5.239 -5.696 1.00 0.00 C ATOM 48 O SER A 4 9.518 -5.605 -5.519 1.00 0.00 O ATOM 49 CB SER A 4 11.384 -5.111 -7.959 1.00 0.00 C ATOM 50 OG SER A 4 11.802 -5.742 -9.178 1.00 0.00 O ATOM 0 H SER A 4 10.095 -7.539 -6.397 1.00 0.00 H new ATOM 0 HA SER A 4 12.537 -6.172 -6.372 1.00 0.00 H new ATOM 0 HB2 SER A 4 10.346 -4.797 -8.066 1.00 0.00 H new ATOM 0 HB3 SER A 4 11.977 -4.208 -7.812 1.00 0.00 H new ATOM 0 HG SER A 4 11.148 -5.555 -9.884 1.00 0.00 H new ATOM 56 N THR A 5 11.202 -4.132 -5.136 1.00 0.00 N ATOM 57 CA THR A 5 10.294 -3.067 -4.748 1.00 0.00 C ATOM 58 C THR A 5 10.189 -2.292 -6.023 1.00 0.00 C ATOM 59 O THR A 5 11.227 -2.172 -6.655 1.00 0.00 O ATOM 60 CB THR A 5 10.868 -2.107 -3.671 1.00 0.00 C ATOM 61 OG1 THR A 5 11.026 -2.810 -2.427 1.00 0.00 O ATOM 62 CG2 THR A 5 9.893 -0.923 -3.434 1.00 0.00 C ATOM 0 H THR A 5 12.193 -3.968 -4.956 1.00 0.00 H new ATOM 0 HA THR A 5 9.374 -3.468 -4.324 1.00 0.00 H new ATOM 0 HB THR A 5 11.830 -1.734 -4.022 1.00 0.00 H new ATOM 0 HG1 THR A 5 11.390 -2.201 -1.751 1.00 0.00 H new ATOM 0 HG21 THR A 5 10.307 -0.257 -2.677 1.00 0.00 H new ATOM 0 HG22 THR A 5 9.755 -0.373 -4.365 1.00 0.00 H new ATOM 0 HG23 THR A 5 8.931 -1.306 -3.094 1.00 0.00 H new ATOM 70 N TRP A 6 9.026 -1.737 -6.419 1.00 0.00 N ATOM 71 CA TRP A 6 9.069 -0.683 -7.408 1.00 0.00 C ATOM 72 C TRP A 6 8.549 0.590 -6.809 1.00 0.00 C ATOM 73 O TRP A 6 7.867 0.544 -5.799 1.00 0.00 O ATOM 74 CB TRP A 6 8.244 -0.949 -8.663 1.00 0.00 C ATOM 75 CG TRP A 6 8.599 -2.266 -9.270 1.00 0.00 C ATOM 76 CD1 TRP A 6 8.107 -3.511 -9.137 1.00 0.00 C ATOM 77 CD2 TRP A 6 9.739 -2.327 -10.239 1.00 0.00 C ATOM 78 NE1 TRP A 6 8.815 -4.320 -9.890 1.00 0.00 N ATOM 79 CE2 TRP A 6 9.806 -3.666 -10.532 1.00 0.00 C ATOM 80 CE3 TRP A 6 10.589 -1.380 -10.789 1.00 0.00 C ATOM 81 CZ2 TRP A 6 10.804 -4.129 -11.382 1.00 0.00 C ATOM 82 CZ3 TRP A 6 11.695 -1.875 -11.481 1.00 0.00 C ATOM 83 CH2 TRP A 6 11.785 -3.229 -11.806 1.00 0.00 C ATOM 0 H TRP A 6 8.099 -1.995 -6.081 1.00 0.00 H new ATOM 0 HA TRP A 6 10.116 -0.621 -7.705 1.00 0.00 H new ATOM 0 HB2 TRP A 6 7.183 -0.934 -8.414 1.00 0.00 H new ATOM 0 HB3 TRP A 6 8.413 -0.153 -9.389 1.00 0.00 H new ATOM 0 HD1 TRP A 6 7.271 -3.797 -8.516 1.00 0.00 H new ATOM 0 HE1 TRP A 6 8.638 -5.321 -9.979 1.00 0.00 H new ATOM 0 HE3 TRP A 6 10.406 -0.320 -10.688 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 10.821 -5.159 -11.707 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 12.490 -1.203 -11.768 1.00 0.00 H new ATOM 0 HH2 TRP A 6 12.621 -3.585 -12.391 1.00 0.00 H new ATOM 94 N LYS A 7 8.875 1.717 -7.472 1.00 0.00 N ATOM 95 CA LYS A 7 8.465 3.021 -6.994 1.00 0.00 C ATOM 96 C LYS A 7 8.224 3.869 -8.224 1.00 0.00 C ATOM 97 O LYS A 7 9.123 3.916 -9.049 1.00 0.00 O ATOM 98 CB LYS A 7 9.640 3.421 -6.064 1.00 0.00 C ATOM 99 CG LYS A 7 9.397 4.734 -5.282 1.00 0.00 C ATOM 100 CD LYS A 7 9.131 5.898 -6.265 1.00 0.00 C ATOM 101 CE LYS A 7 9.263 7.284 -5.579 1.00 0.00 C ATOM 102 NZ LYS A 7 8.834 8.382 -6.475 1.00 0.00 N ATOM 0 H LYS A 7 9.419 1.735 -8.335 1.00 0.00 H new ATOM 0 HA LYS A 7 7.540 3.107 -6.424 1.00 0.00 H new ATOM 0 HB2 LYS A 7 9.820 2.614 -5.354 1.00 0.00 H new ATOM 0 HB3 LYS A 7 10.545 3.527 -6.662 1.00 0.00 H new ATOM 0 HG2 LYS A 7 8.547 4.614 -4.610 1.00 0.00 H new ATOM 0 HG3 LYS A 7 10.264 4.963 -4.662 1.00 0.00 H new ATOM 0 HD2 LYS A 7 9.833 5.837 -7.096 1.00 0.00 H new ATOM 0 HD3 LYS A 7 8.130 5.796 -6.685 1.00 0.00 H new ATOM 0 HE2 LYS A 7 8.661 7.299 -4.671 1.00 0.00 H new ATOM 0 HE3 LYS A 7 10.298 7.444 -5.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 9.600 9.080 -6.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 8.611 7.996 -7.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 7.989 8.842 -6.080 1.00 0.00 H new ATOM 116 N VAL A 8 7.047 4.529 -8.395 1.00 0.00 N ATOM 117 CA VAL A 8 6.831 5.294 -9.616 1.00 0.00 C ATOM 118 C VAL A 8 7.880 6.368 -9.704 1.00 0.00 C ATOM 119 O VAL A 8 8.148 7.031 -8.717 1.00 0.00 O ATOM 120 CB VAL A 8 5.426 5.915 -9.898 1.00 0.00 C ATOM 121 CG1 VAL A 8 5.464 7.439 -10.195 1.00 0.00 C ATOM 122 CG2 VAL A 8 4.694 5.233 -11.087 1.00 0.00 C ATOM 0 H VAL A 8 6.276 4.539 -7.727 1.00 0.00 H new ATOM 0 HA VAL A 8 6.901 4.533 -10.393 1.00 0.00 H new ATOM 0 HB VAL A 8 4.883 5.742 -8.969 1.00 0.00 H new ATOM 0 HG11 VAL A 8 4.452 7.799 -10.381 1.00 0.00 H new ATOM 0 HG12 VAL A 8 5.885 7.966 -9.339 1.00 0.00 H new ATOM 0 HG13 VAL A 8 6.082 7.623 -11.074 1.00 0.00 H new ATOM 0 HG21 VAL A 8 3.723 5.706 -11.236 1.00 0.00 H new ATOM 0 HG22 VAL A 8 5.292 5.339 -11.992 1.00 0.00 H new ATOM 0 HG23 VAL A 8 4.552 4.175 -10.868 1.00 0.00 H new ATOM 132 N ASP A 9 8.444 6.567 -10.908 1.00 0.00 N ATOM 133 CA ASP A 9 9.358 7.676 -11.133 1.00 0.00 C ATOM 134 C ASP A 9 8.703 8.707 -12.034 1.00 0.00 C ATOM 135 O ASP A 9 8.900 9.886 -11.784 1.00 0.00 O ATOM 136 CB ASP A 9 10.661 7.039 -11.676 1.00 0.00 C ATOM 137 CG ASP A 9 11.637 8.063 -12.193 1.00 0.00 C ATOM 138 OD1 ASP A 9 11.785 9.133 -11.543 1.00 0.00 O ATOM 139 OD2 ASP A 9 12.267 7.809 -13.256 1.00 0.00 O ATOM 0 H ASP A 9 8.280 5.977 -11.724 1.00 0.00 H new ATOM 0 HA ASP A 9 9.607 8.239 -10.234 1.00 0.00 H new ATOM 0 HB2 ASP A 9 11.135 6.459 -10.884 1.00 0.00 H new ATOM 0 HB3 ASP A 9 10.414 6.342 -12.477 1.00 0.00 H new ATOM 144 N ARG A 10 7.933 8.323 -13.082 1.00 0.00 N ATOM 145 CA ARG A 10 7.469 9.303 -14.065 1.00 0.00 C ATOM 146 C ARG A 10 6.374 8.697 -14.908 1.00 0.00 C ATOM 147 O ARG A 10 6.205 7.488 -14.858 1.00 0.00 O ATOM 148 CB ARG A 10 8.703 9.645 -14.942 1.00 0.00 C ATOM 149 CG ARG A 10 9.405 8.320 -15.307 1.00 0.00 C ATOM 150 CD ARG A 10 10.568 8.355 -16.322 1.00 0.00 C ATOM 151 NE ARG A 10 11.141 7.001 -16.344 1.00 0.00 N ATOM 152 CZ ARG A 10 12.030 6.603 -17.230 1.00 0.00 C ATOM 153 NH1 ARG A 10 12.489 7.388 -18.179 1.00 0.00 N ATOM 154 NH2 ARG A 10 12.483 5.372 -17.163 1.00 0.00 N ATOM 0 H ARG A 10 7.632 7.364 -13.257 1.00 0.00 H new ATOM 0 HA ARG A 10 7.063 10.196 -13.590 1.00 0.00 H new ATOM 0 HB2 ARG A 10 8.396 10.175 -15.843 1.00 0.00 H new ATOM 0 HB3 ARG A 10 9.385 10.302 -14.402 1.00 0.00 H new ATOM 0 HG2 ARG A 10 9.784 7.881 -14.384 1.00 0.00 H new ATOM 0 HG3 ARG A 10 8.647 7.640 -15.695 1.00 0.00 H new ATOM 0 HD2 ARG A 10 10.211 8.642 -17.311 1.00 0.00 H new ATOM 0 HD3 ARG A 10 11.318 9.089 -16.028 1.00 0.00 H new ATOM 0 HE ARG A 10 10.834 6.335 -15.635 1.00 0.00 H new ATOM 0 HH11 ARG A 10 12.156 8.350 -18.251 1.00 0.00 H new ATOM 0 HH12 ARG A 10 13.178 7.036 -18.844 1.00 0.00 H new ATOM 0 HH21 ARG A 10 12.146 4.743 -16.434 1.00 0.00 H new ATOM 0 HH22 ARG A 10 13.172 5.045 -17.840 1.00 0.00 H new ATOM 168 N SER A 11 5.607 9.516 -15.663 1.00 0.00 N ATOM 169 CA SER A 11 4.405 8.986 -16.304 1.00 0.00 C ATOM 170 C SER A 11 3.848 9.899 -17.371 1.00 0.00 C ATOM 171 O SER A 11 4.208 11.065 -17.356 1.00 0.00 O ATOM 172 CB SER A 11 3.360 8.911 -15.163 1.00 0.00 C ATOM 173 OG SER A 11 3.893 8.299 -13.974 1.00 0.00 O ATOM 0 H SER A 11 5.795 10.504 -15.833 1.00 0.00 H new ATOM 0 HA SER A 11 4.633 8.037 -16.789 1.00 0.00 H new ATOM 0 HB2 SER A 11 3.011 9.916 -14.926 1.00 0.00 H new ATOM 0 HB3 SER A 11 2.493 8.344 -15.504 1.00 0.00 H new ATOM 0 HG SER A 11 3.201 8.274 -13.281 1.00 0.00 H new ATOM 179 N GLU A 12 2.963 9.407 -18.276 1.00 0.00 N ATOM 180 CA GLU A 12 2.272 10.330 -19.183 1.00 0.00 C ATOM 181 C GLU A 12 1.030 10.851 -18.500 1.00 0.00 C ATOM 182 O GLU A 12 0.662 10.307 -17.471 1.00 0.00 O ATOM 183 CB GLU A 12 1.848 9.668 -20.526 1.00 0.00 C ATOM 184 CG GLU A 12 0.708 8.638 -20.323 1.00 0.00 C ATOM 185 CD GLU A 12 0.086 8.237 -21.636 1.00 0.00 C ATOM 186 OE1 GLU A 12 -0.663 9.073 -22.210 1.00 0.00 O ATOM 187 OE2 GLU A 12 0.336 7.093 -22.104 1.00 0.00 O ATOM 0 H GLU A 12 2.725 8.421 -18.388 1.00 0.00 H new ATOM 0 HA GLU A 12 2.975 11.130 -19.417 1.00 0.00 H new ATOM 0 HB2 GLU A 12 1.522 10.439 -21.224 1.00 0.00 H new ATOM 0 HB3 GLU A 12 2.709 9.174 -20.976 1.00 0.00 H new ATOM 0 HG2 GLU A 12 1.100 7.754 -19.820 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -0.056 9.063 -19.672 1.00 0.00 H new ATOM 194 N ASN A 13 0.377 11.867 -19.114 1.00 0.00 N ATOM 195 CA ASN A 13 -0.963 12.301 -18.725 1.00 0.00 C ATOM 196 C ASN A 13 -1.321 12.058 -17.285 1.00 0.00 C ATOM 197 O ASN A 13 -2.435 11.635 -17.036 1.00 0.00 O ATOM 198 CB ASN A 13 -1.951 11.594 -19.695 1.00 0.00 C ATOM 199 CG ASN A 13 -1.765 12.048 -21.121 1.00 0.00 C ATOM 200 OD1 ASN A 13 -0.895 12.856 -21.405 1.00 0.00 O ATOM 201 ND2 ASN A 13 -2.598 11.532 -22.046 1.00 0.00 N ATOM 0 H ASN A 13 0.773 12.399 -19.889 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.015 13.387 -18.805 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.807 10.515 -19.636 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -2.975 11.796 -19.381 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -2.514 11.815 -23.022 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -3.313 10.859 -21.770 1.00 0.00 H new ATOM 208 N TYR A 14 -0.428 12.309 -16.303 1.00 0.00 N ATOM 209 CA TYR A 14 -0.798 11.980 -14.929 1.00 0.00 C ATOM 210 C TYR A 14 -1.847 12.937 -14.412 1.00 0.00 C ATOM 211 O TYR A 14 -2.668 12.534 -13.603 1.00 0.00 O ATOM 212 CB TYR A 14 0.409 11.944 -13.952 1.00 0.00 C ATOM 213 CG TYR A 14 0.081 10.886 -12.891 1.00 0.00 C ATOM 214 CD1 TYR A 14 0.262 9.539 -13.215 1.00 0.00 C ATOM 215 CD2 TYR A 14 -0.429 11.224 -11.633 1.00 0.00 C ATOM 216 CE1 TYR A 14 -0.277 8.541 -12.404 1.00 0.00 C ATOM 217 CE2 TYR A 14 -0.958 10.219 -10.817 1.00 0.00 C ATOM 218 CZ TYR A 14 -1.021 8.900 -11.285 1.00 0.00 C ATOM 219 OH TYR A 14 -1.812 7.940 -10.655 1.00 0.00 O ATOM 0 H TYR A 14 0.499 12.715 -16.432 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.205 10.969 -14.966 1.00 0.00 H new ATOM 0 HB2 TYR A 14 1.328 11.691 -14.481 1.00 0.00 H new ATOM 0 HB3 TYR A 14 0.564 12.920 -13.492 1.00 0.00 H new ATOM 0 HD1 TYR A 14 0.822 9.269 -14.098 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -0.414 12.250 -11.296 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -0.118 7.500 -12.642 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -1.317 10.459 -9.827 1.00 0.00 H new ATOM 0 HH TYR A 14 -2.588 8.374 -10.244 1.00 0.00 H new ATOM 229 N ASP A 15 -1.823 14.209 -14.871 1.00 0.00 N ATOM 230 CA ASP A 15 -2.781 15.202 -14.390 1.00 0.00 C ATOM 231 C ASP A 15 -4.075 14.996 -15.136 1.00 0.00 C ATOM 232 O ASP A 15 -5.127 14.893 -14.527 1.00 0.00 O ATOM 233 CB ASP A 15 -2.264 16.650 -14.628 1.00 0.00 C ATOM 234 CG ASP A 15 -1.727 16.925 -16.010 1.00 0.00 C ATOM 235 OD1 ASP A 15 -0.578 16.491 -16.296 1.00 0.00 O ATOM 236 OD2 ASP A 15 -2.447 17.564 -16.826 1.00 0.00 O ATOM 0 H ASP A 15 -1.159 14.558 -15.562 1.00 0.00 H new ATOM 0 HA ASP A 15 -2.923 15.076 -13.317 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -3.078 17.346 -14.428 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -1.478 16.861 -13.902 1.00 0.00 H new ATOM 241 N LYS A 16 -3.977 14.934 -16.478 1.00 0.00 N ATOM 242 CA LYS A 16 -5.146 14.706 -17.321 1.00 0.00 C ATOM 243 C LYS A 16 -5.864 13.465 -16.868 1.00 0.00 C ATOM 244 O LYS A 16 -7.049 13.496 -16.578 1.00 0.00 O ATOM 245 CB LYS A 16 -4.589 14.527 -18.766 1.00 0.00 C ATOM 246 CG LYS A 16 -5.569 14.020 -19.849 1.00 0.00 C ATOM 247 CD LYS A 16 -6.608 15.092 -20.275 1.00 0.00 C ATOM 248 CE LYS A 16 -7.328 14.687 -21.592 1.00 0.00 C ATOM 249 NZ LYS A 16 -8.262 15.740 -22.055 1.00 0.00 N ATOM 0 H LYS A 16 -3.102 15.039 -16.991 1.00 0.00 H new ATOM 0 HA LYS A 16 -5.860 15.528 -17.271 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -4.191 15.487 -19.095 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -3.750 13.833 -18.720 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -5.002 13.703 -20.724 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -6.094 13.142 -19.474 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -7.344 15.224 -19.482 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -6.109 16.052 -20.411 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -6.586 14.493 -22.367 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -7.876 13.758 -21.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -8.723 15.433 -22.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -8.985 15.908 -21.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -7.735 16.620 -22.229 1.00 0.00 H new ATOM 263 N PHE A 17 -5.117 12.352 -16.821 1.00 0.00 N ATOM 264 CA PHE A 17 -5.717 11.084 -16.430 1.00 0.00 C ATOM 265 C PHE A 17 -6.357 11.135 -15.061 1.00 0.00 C ATOM 266 O PHE A 17 -7.493 10.712 -14.901 1.00 0.00 O ATOM 267 CB PHE A 17 -4.643 9.969 -16.443 1.00 0.00 C ATOM 268 CG PHE A 17 -5.355 8.672 -16.084 1.00 0.00 C ATOM 269 CD1 PHE A 17 -5.983 7.934 -17.087 1.00 0.00 C ATOM 270 CD2 PHE A 17 -5.413 8.247 -14.755 1.00 0.00 C ATOM 271 CE1 PHE A 17 -6.893 6.944 -16.736 1.00 0.00 C ATOM 272 CE2 PHE A 17 -6.284 7.216 -14.409 1.00 0.00 C ATOM 273 CZ PHE A 17 -7.142 6.705 -15.385 1.00 0.00 C ATOM 0 H PHE A 17 -4.123 12.310 -17.044 1.00 0.00 H new ATOM 0 HA PHE A 17 -6.503 10.872 -17.154 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -4.174 9.894 -17.424 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -3.851 10.187 -15.727 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -5.764 8.130 -18.126 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -4.790 8.712 -14.005 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -7.399 6.369 -17.497 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -6.295 6.819 -13.405 1.00 0.00 H new ATOM 0 HZ PHE A 17 -8.003 6.122 -15.092 1.00 0.00 H new ATOM 283 N MET A 18 -5.628 11.641 -14.044 1.00 0.00 N ATOM 284 CA MET A 18 -6.188 11.651 -12.693 1.00 0.00 C ATOM 285 C MET A 18 -7.423 12.507 -12.692 1.00 0.00 C ATOM 286 O MET A 18 -8.459 12.056 -12.226 1.00 0.00 O ATOM 287 CB MET A 18 -5.172 12.172 -11.645 1.00 0.00 C ATOM 288 CG MET A 18 -4.127 11.090 -11.267 1.00 0.00 C ATOM 289 SD MET A 18 -4.746 9.913 -10.012 1.00 0.00 S ATOM 290 CE MET A 18 -5.196 8.398 -10.918 1.00 0.00 C ATOM 0 H MET A 18 -4.690 12.031 -14.133 1.00 0.00 H new ATOM 0 HA MET A 18 -6.435 10.627 -12.412 1.00 0.00 H new ATOM 0 HB2 MET A 18 -4.660 13.049 -12.040 1.00 0.00 H new ATOM 0 HB3 MET A 18 -5.705 12.491 -10.749 1.00 0.00 H new ATOM 0 HG2 MET A 18 -3.840 10.540 -12.163 1.00 0.00 H new ATOM 0 HG3 MET A 18 -3.228 11.577 -10.890 1.00 0.00 H new ATOM 0 HE1 MET A 18 -5.249 7.560 -10.223 1.00 0.00 H new ATOM 0 HE2 MET A 18 -6.166 8.534 -11.396 1.00 0.00 H new ATOM 0 HE3 MET A 18 -4.443 8.192 -11.678 1.00 0.00 H new ATOM 300 N GLU A 19 -7.339 13.736 -13.237 1.00 0.00 N ATOM 301 CA GLU A 19 -8.526 14.588 -13.281 1.00 0.00 C ATOM 302 C GLU A 19 -9.690 13.787 -13.816 1.00 0.00 C ATOM 303 O GLU A 19 -10.800 13.893 -13.318 1.00 0.00 O ATOM 304 CB GLU A 19 -8.222 15.780 -14.235 1.00 0.00 C ATOM 305 CG GLU A 19 -9.468 16.649 -14.522 1.00 0.00 C ATOM 306 CD GLU A 19 -9.100 17.773 -15.458 1.00 0.00 C ATOM 307 OE1 GLU A 19 -8.818 17.482 -16.653 1.00 0.00 O ATOM 308 OE2 GLU A 19 -9.087 18.951 -15.009 1.00 0.00 O ATOM 0 H GLU A 19 -6.493 14.143 -13.637 1.00 0.00 H new ATOM 0 HA GLU A 19 -8.777 14.957 -12.287 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -7.444 16.403 -13.794 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -7.828 15.395 -15.176 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -10.255 16.038 -14.964 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -9.863 17.054 -13.590 1.00 0.00 H new ATOM 315 N LYS A 20 -9.407 12.966 -14.846 1.00 0.00 N ATOM 316 CA LYS A 20 -10.425 12.136 -15.469 1.00 0.00 C ATOM 317 C LYS A 20 -11.089 11.185 -14.511 1.00 0.00 C ATOM 318 O LYS A 20 -12.284 10.958 -14.620 1.00 0.00 O ATOM 319 CB LYS A 20 -9.845 11.394 -16.706 1.00 0.00 C ATOM 320 CG LYS A 20 -10.874 11.352 -17.828 1.00 0.00 C ATOM 321 CD LYS A 20 -10.978 12.749 -18.479 1.00 0.00 C ATOM 322 CE LYS A 20 -10.136 13.020 -19.755 1.00 0.00 C ATOM 323 NZ LYS A 20 -10.733 12.411 -20.969 1.00 0.00 N ATOM 0 H LYS A 20 -8.478 12.869 -15.255 1.00 0.00 H new ATOM 0 HA LYS A 20 -11.214 12.808 -15.806 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -8.942 11.898 -17.050 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -9.558 10.380 -16.429 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -10.585 10.611 -18.574 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -11.844 11.048 -17.436 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -12.025 12.926 -18.725 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -10.697 13.489 -17.730 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -10.040 14.096 -19.902 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -9.129 12.627 -19.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.134 12.620 -21.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.801 11.381 -20.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -11.683 12.804 -21.123 1.00 0.00 H new ATOM 337 N MET A 21 -10.320 10.632 -13.554 1.00 0.00 N ATOM 338 CA MET A 21 -10.898 9.693 -12.592 1.00 0.00 C ATOM 339 C MET A 21 -11.604 10.342 -11.452 1.00 0.00 C ATOM 340 O MET A 21 -11.884 9.659 -10.478 1.00 0.00 O ATOM 341 CB MET A 21 -9.799 8.704 -12.131 1.00 0.00 C ATOM 342 CG MET A 21 -9.526 7.825 -13.366 1.00 0.00 C ATOM 343 SD MET A 21 -10.931 6.764 -13.849 1.00 0.00 S ATOM 344 CE MET A 21 -11.331 7.457 -15.488 1.00 0.00 C ATOM 0 H MET A 21 -9.324 10.816 -13.432 1.00 0.00 H new ATOM 0 HA MET A 21 -11.689 9.143 -13.101 1.00 0.00 H new ATOM 0 HB2 MET A 21 -8.900 9.231 -11.813 1.00 0.00 H new ATOM 0 HB3 MET A 21 -10.134 8.105 -11.284 1.00 0.00 H new ATOM 0 HG2 MET A 21 -9.264 8.468 -14.206 1.00 0.00 H new ATOM 0 HG3 MET A 21 -8.660 7.194 -13.166 1.00 0.00 H new ATOM 0 HE1 MET A 21 -12.150 6.891 -15.932 1.00 0.00 H new ATOM 0 HE2 MET A 21 -11.628 8.500 -15.379 1.00 0.00 H new ATOM 0 HE3 MET A 21 -10.455 7.395 -16.133 1.00 0.00 H new ATOM 354 N GLY A 22 -11.927 11.644 -11.555 1.00 0.00 N ATOM 355 CA GLY A 22 -12.647 12.252 -10.461 1.00 0.00 C ATOM 356 C GLY A 22 -11.781 12.464 -9.283 1.00 0.00 C ATOM 357 O GLY A 22 -12.252 12.500 -8.156 1.00 0.00 O ATOM 0 H GLY A 22 -11.709 12.253 -12.344 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -13.060 13.207 -10.785 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -13.489 11.618 -10.183 1.00 0.00 H new ATOM 361 N VAL A 23 -10.481 12.561 -9.572 1.00 0.00 N ATOM 362 CA VAL A 23 -9.550 12.516 -8.481 1.00 0.00 C ATOM 363 C VAL A 23 -9.609 13.953 -8.110 1.00 0.00 C ATOM 364 O VAL A 23 -8.955 14.794 -8.702 1.00 0.00 O ATOM 365 CB VAL A 23 -8.285 11.878 -9.053 1.00 0.00 C ATOM 366 CG1 VAL A 23 -7.157 11.974 -8.057 1.00 0.00 C ATOM 367 CG2 VAL A 23 -8.615 10.390 -9.239 1.00 0.00 C ATOM 0 H VAL A 23 -10.080 12.665 -10.504 1.00 0.00 H new ATOM 0 HA VAL A 23 -9.692 11.923 -7.578 1.00 0.00 H new ATOM 0 HB VAL A 23 -7.987 12.372 -9.978 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -6.261 11.516 -8.476 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -6.958 13.022 -7.833 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -7.436 11.454 -7.141 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -7.747 9.873 -9.648 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -8.878 9.952 -8.276 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -9.455 10.287 -9.926 1.00 0.00 H new ATOM 377 N ASN A 24 -10.527 14.195 -7.159 1.00 0.00 N ATOM 378 CA ASN A 24 -11.019 15.535 -6.972 1.00 0.00 C ATOM 379 C ASN A 24 -9.882 16.356 -6.436 1.00 0.00 C ATOM 380 O ASN A 24 -8.907 15.784 -5.984 1.00 0.00 O ATOM 381 CB ASN A 24 -12.310 15.443 -6.119 1.00 0.00 C ATOM 382 CG ASN A 24 -13.266 16.539 -6.495 1.00 0.00 C ATOM 383 OD1 ASN A 24 -13.486 17.462 -5.727 1.00 0.00 O ATOM 384 ND2 ASN A 24 -13.838 16.411 -7.717 1.00 0.00 N ATOM 0 H ASN A 24 -10.922 13.492 -6.534 1.00 0.00 H new ATOM 0 HA ASN A 24 -11.330 16.053 -7.880 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -12.783 14.472 -6.268 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -12.060 15.517 -5.061 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -14.499 17.114 -8.047 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -13.607 15.612 -8.307 1.00 0.00 H new ATOM 391 N ILE A 25 -9.985 17.692 -6.542 1.00 0.00 N ATOM 392 CA ILE A 25 -8.837 18.566 -6.369 1.00 0.00 C ATOM 393 C ILE A 25 -7.880 18.093 -5.310 1.00 0.00 C ATOM 394 O ILE A 25 -6.688 18.123 -5.552 1.00 0.00 O ATOM 395 CB ILE A 25 -9.286 20.040 -6.123 1.00 0.00 C ATOM 396 CG1 ILE A 25 -8.095 20.933 -5.676 1.00 0.00 C ATOM 397 CG2 ILE A 25 -10.426 20.185 -5.067 1.00 0.00 C ATOM 398 CD1 ILE A 25 -6.955 21.066 -6.720 1.00 0.00 C ATOM 0 H ILE A 25 -10.857 18.180 -6.747 1.00 0.00 H new ATOM 0 HA ILE A 25 -8.281 18.530 -7.306 1.00 0.00 H new ATOM 0 HB ILE A 25 -9.673 20.371 -7.087 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -8.473 21.928 -5.442 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -7.679 20.526 -4.754 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -10.683 21.238 -4.951 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -11.304 19.632 -5.401 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -10.088 19.787 -4.110 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -6.169 21.707 -6.321 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -6.544 20.080 -6.938 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -7.350 21.505 -7.636 1.00 0.00 H new ATOM 410 N VAL A 26 -8.351 17.651 -4.132 1.00 0.00 N ATOM 411 CA VAL A 26 -7.404 17.211 -3.104 1.00 0.00 C ATOM 412 C VAL A 26 -6.965 15.788 -3.384 1.00 0.00 C ATOM 413 O VAL A 26 -5.786 15.500 -3.279 1.00 0.00 O ATOM 414 CB VAL A 26 -7.856 17.430 -1.630 1.00 0.00 C ATOM 415 CG1 VAL A 26 -6.753 18.207 -0.846 1.00 0.00 C ATOM 416 CG2 VAL A 26 -9.200 18.186 -1.496 1.00 0.00 C ATOM 0 H VAL A 26 -9.337 17.591 -3.878 1.00 0.00 H new ATOM 0 HA VAL A 26 -6.543 17.874 -3.184 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.007 16.436 -1.210 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -7.076 18.357 0.184 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.827 17.633 -0.856 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.585 19.175 -1.318 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -9.449 18.301 -0.441 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -9.112 19.170 -1.957 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.987 17.621 -1.995 1.00 0.00 H new ATOM 426 N LYS A 27 -7.893 14.895 -3.781 1.00 0.00 N ATOM 427 CA LYS A 27 -7.521 13.549 -4.262 1.00 0.00 C ATOM 428 C LYS A 27 -6.348 13.648 -5.213 1.00 0.00 C ATOM 429 O LYS A 27 -5.368 12.930 -5.106 1.00 0.00 O ATOM 430 CB LYS A 27 -8.796 12.811 -4.761 1.00 0.00 C ATOM 431 CG LYS A 27 -9.190 11.644 -3.826 1.00 0.00 C ATOM 432 CD LYS A 27 -9.503 12.117 -2.376 1.00 0.00 C ATOM 433 CE LYS A 27 -10.841 12.898 -2.298 1.00 0.00 C ATOM 434 NZ LYS A 27 -11.285 13.068 -0.894 1.00 0.00 N ATOM 0 H LYS A 27 -8.896 15.078 -3.779 1.00 0.00 H new ATOM 0 HA LYS A 27 -7.143 12.908 -3.466 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -9.623 13.518 -4.827 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -8.624 12.428 -5.767 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -10.063 11.135 -4.234 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -8.380 10.915 -3.799 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -9.548 11.252 -1.714 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -8.692 12.750 -2.018 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -10.721 13.876 -2.765 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -11.608 12.367 -2.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -12.182 13.594 -0.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -11.422 12.134 -0.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -10.563 13.596 -0.363 1.00 0.00 H new ATOM 448 N ARG A 28 -6.436 14.604 -6.140 1.00 0.00 N ATOM 449 CA ARG A 28 -5.311 14.940 -7.022 1.00 0.00 C ATOM 450 C ARG A 28 -4.127 15.473 -6.251 1.00 0.00 C ATOM 451 O ARG A 28 -3.022 15.048 -6.543 1.00 0.00 O ATOM 452 CB ARG A 28 -5.834 16.018 -7.987 1.00 0.00 C ATOM 453 CG ARG A 28 -4.912 16.595 -9.082 1.00 0.00 C ATOM 454 CD ARG A 28 -5.006 15.841 -10.439 1.00 0.00 C ATOM 455 NE ARG A 28 -4.517 16.788 -11.445 1.00 0.00 N ATOM 456 CZ ARG A 28 -3.278 17.235 -11.471 1.00 0.00 C ATOM 457 NH1 ARG A 28 -2.295 16.673 -10.804 1.00 0.00 N ATOM 458 NH2 ARG A 28 -3.011 18.301 -12.188 1.00 0.00 N ATOM 0 H ARG A 28 -7.275 15.161 -6.301 1.00 0.00 H new ATOM 0 HA ARG A 28 -4.963 14.049 -7.545 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -6.710 15.606 -8.487 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -6.178 16.856 -7.380 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -5.163 17.644 -9.241 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -3.881 16.564 -8.730 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -4.402 14.934 -10.427 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -6.032 15.538 -10.650 1.00 0.00 H new ATOM 0 HE ARG A 28 -5.167 17.117 -12.159 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -2.474 15.849 -10.230 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -1.353 17.061 -10.860 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -3.755 18.764 -12.709 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -2.059 18.666 -12.224 1.00 0.00 H new ATOM 472 N LYS A 29 -4.296 16.412 -5.288 1.00 0.00 N ATOM 473 CA LYS A 29 -3.105 16.949 -4.644 1.00 0.00 C ATOM 474 C LYS A 29 -2.384 15.828 -3.944 1.00 0.00 C ATOM 475 O LYS A 29 -1.175 15.736 -4.073 1.00 0.00 O ATOM 476 CB LYS A 29 -3.329 18.093 -3.619 1.00 0.00 C ATOM 477 CG LYS A 29 -3.958 19.399 -4.185 1.00 0.00 C ATOM 478 CD LYS A 29 -3.317 19.926 -5.499 1.00 0.00 C ATOM 479 CE LYS A 29 -1.788 20.124 -5.344 1.00 0.00 C ATOM 480 NZ LYS A 29 -1.213 20.943 -6.436 1.00 0.00 N ATOM 0 H LYS A 29 -5.189 16.784 -4.966 1.00 0.00 H new ATOM 0 HA LYS A 29 -2.531 17.396 -5.456 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.971 17.719 -2.821 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -2.369 18.342 -3.166 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -5.020 19.225 -4.361 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -3.884 20.178 -3.426 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -3.514 19.223 -6.309 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -3.781 20.872 -5.778 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -1.581 20.602 -4.387 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -1.298 19.151 -5.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -0.189 21.048 -6.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -1.386 20.475 -7.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -1.660 21.882 -6.438 1.00 0.00 H new ATOM 494 N LEU A 30 -3.117 14.958 -3.219 1.00 0.00 N ATOM 495 CA LEU A 30 -2.505 13.783 -2.651 1.00 0.00 C ATOM 496 C LEU A 30 -1.914 13.009 -3.804 1.00 0.00 C ATOM 497 O LEU A 30 -0.773 12.583 -3.709 1.00 0.00 O ATOM 498 CB LEU A 30 -3.579 12.946 -1.902 1.00 0.00 C ATOM 499 CG LEU A 30 -3.970 13.521 -0.505 1.00 0.00 C ATOM 500 CD1 LEU A 30 -5.054 14.634 -0.524 1.00 0.00 C ATOM 501 CD2 LEU A 30 -4.447 12.361 0.408 1.00 0.00 C ATOM 0 H LEU A 30 -4.113 15.061 -3.027 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.730 14.036 -1.927 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -4.474 12.884 -2.521 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.208 11.929 -1.774 1.00 0.00 H new ATOM 0 HG LEU A 30 -3.068 13.999 -0.124 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -5.253 14.965 0.495 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -4.699 15.477 -1.117 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -5.971 14.241 -0.964 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.722 12.757 1.386 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -5.312 11.875 -0.043 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.643 11.635 0.524 1.00 0.00 H new ATOM 513 N ALA A 31 -2.691 12.830 -4.896 1.00 0.00 N ATOM 514 CA ALA A 31 -2.245 11.992 -5.993 1.00 0.00 C ATOM 515 C ALA A 31 -0.832 12.326 -6.388 1.00 0.00 C ATOM 516 O ALA A 31 0.014 11.450 -6.465 1.00 0.00 O ATOM 517 CB ALA A 31 -3.113 11.941 -7.276 1.00 0.00 C ATOM 0 H ALA A 31 -3.610 13.253 -5.025 1.00 0.00 H new ATOM 0 HA ALA A 31 -2.338 10.996 -5.559 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -2.650 11.274 -8.003 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -4.108 11.572 -7.028 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -3.193 12.941 -7.701 1.00 0.00 H new ATOM 523 N ALA A 32 -0.604 13.632 -6.641 1.00 0.00 N ATOM 524 CA ALA A 32 0.700 14.086 -7.107 1.00 0.00 C ATOM 525 C ALA A 32 1.692 14.175 -5.970 1.00 0.00 C ATOM 526 O ALA A 32 2.868 13.928 -6.188 1.00 0.00 O ATOM 527 CB ALA A 32 0.536 15.478 -7.771 1.00 0.00 C ATOM 0 H ALA A 32 -1.299 14.370 -6.530 1.00 0.00 H new ATOM 0 HA ALA A 32 1.085 13.364 -7.827 1.00 0.00 H new ATOM 0 HB1 ALA A 32 1.506 15.829 -8.124 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -0.151 15.400 -8.614 1.00 0.00 H new ATOM 0 HB3 ALA A 32 0.138 16.184 -7.042 1.00 0.00 H new ATOM 533 N HIS A 33 1.239 14.539 -4.752 1.00 0.00 N ATOM 534 CA HIS A 33 2.166 14.701 -3.632 1.00 0.00 C ATOM 535 C HIS A 33 2.844 13.390 -3.326 1.00 0.00 C ATOM 536 O HIS A 33 4.063 13.335 -3.260 1.00 0.00 O ATOM 537 CB HIS A 33 1.452 15.238 -2.354 1.00 0.00 C ATOM 538 CG HIS A 33 1.381 16.746 -2.365 1.00 0.00 C ATOM 539 ND1 HIS A 33 0.912 17.461 -3.368 1.00 0.00 N ATOM 540 CD2 HIS A 33 1.788 17.555 -1.365 1.00 0.00 C ATOM 541 CE1 HIS A 33 0.996 18.722 -3.085 1.00 0.00 C ATOM 542 NE2 HIS A 33 1.493 18.839 -1.939 1.00 0.00 N ATOM 0 H HIS A 33 0.260 14.721 -4.530 1.00 0.00 H new ATOM 0 HA HIS A 33 2.911 15.439 -3.930 1.00 0.00 H new ATOM 0 HB2 HIS A 33 0.446 14.824 -2.295 1.00 0.00 H new ATOM 0 HB3 HIS A 33 1.988 14.902 -1.466 1.00 0.00 H new ATOM 0 HD1 HIS A 33 0.539 17.079 -4.237 1.00 0.00 H new ATOM 0 HD2 HIS A 33 2.215 17.308 -0.404 1.00 0.00 H new ATOM 0 HE1 HIS A 33 0.690 19.535 -3.727 1.00 0.00 H new ATOM 551 N ASP A 34 2.052 12.322 -3.125 1.00 0.00 N ATOM 552 CA ASP A 34 2.649 11.041 -2.750 1.00 0.00 C ATOM 553 C ASP A 34 3.237 10.345 -3.943 1.00 0.00 C ATOM 554 O ASP A 34 4.292 9.740 -3.840 1.00 0.00 O ATOM 555 CB ASP A 34 1.576 10.023 -2.296 1.00 0.00 C ATOM 556 CG ASP A 34 2.167 8.995 -1.363 1.00 0.00 C ATOM 557 OD1 ASP A 34 2.651 7.943 -1.864 1.00 0.00 O ATOM 558 OD2 ASP A 34 2.153 9.234 -0.125 1.00 0.00 O ATOM 0 H ASP A 34 1.036 12.322 -3.213 1.00 0.00 H new ATOM 0 HA ASP A 34 3.374 11.292 -1.976 1.00 0.00 H new ATOM 0 HB2 ASP A 34 0.761 10.547 -1.797 1.00 0.00 H new ATOM 0 HB3 ASP A 34 1.149 9.526 -3.167 1.00 0.00 H new ATOM 563 N ASN A 35 2.464 10.390 -5.050 1.00 0.00 N ATOM 564 CA ASN A 35 2.693 9.470 -6.149 1.00 0.00 C ATOM 565 C ASN A 35 2.338 8.036 -5.813 1.00 0.00 C ATOM 566 O ASN A 35 1.286 7.812 -5.238 1.00 0.00 O ATOM 567 CB ASN A 35 4.071 9.737 -6.790 1.00 0.00 C ATOM 568 CG ASN A 35 4.198 11.228 -6.976 1.00 0.00 C ATOM 569 OD1 ASN A 35 4.994 11.849 -6.290 1.00 0.00 O ATOM 570 ND2 ASN A 35 3.395 11.833 -7.876 1.00 0.00 N ATOM 0 H ASN A 35 1.695 11.045 -5.191 1.00 0.00 H new ATOM 0 HA ASN A 35 1.981 9.668 -6.950 1.00 0.00 H new ATOM 0 HB2 ASN A 35 4.871 9.360 -6.153 1.00 0.00 H new ATOM 0 HB3 ASN A 35 4.156 9.222 -7.747 1.00 0.00 H new ATOM 0 HD21 ASN A 35 3.441 12.844 -8.002 1.00 0.00 H new ATOM 0 HD22 ASN A 35 2.742 11.279 -8.431 1.00 0.00 H new ATOM 577 N LEU A 36 3.174 7.056 -6.217 1.00 0.00 N ATOM 578 CA LEU A 36 2.697 5.782 -6.754 1.00 0.00 C ATOM 579 C LEU A 36 3.815 4.789 -6.569 1.00 0.00 C ATOM 580 O LEU A 36 4.963 5.199 -6.619 1.00 0.00 O ATOM 581 CB LEU A 36 2.267 5.831 -8.257 1.00 0.00 C ATOM 582 CG LEU A 36 0.738 5.875 -8.569 1.00 0.00 C ATOM 583 CD1 LEU A 36 0.125 7.281 -8.333 1.00 0.00 C ATOM 584 CD2 LEU A 36 0.471 5.475 -10.048 1.00 0.00 C ATOM 0 H LEU A 36 4.190 7.133 -6.177 1.00 0.00 H new ATOM 0 HA LEU A 36 1.791 5.504 -6.216 1.00 0.00 H new ATOM 0 HB2 LEU A 36 2.728 6.709 -8.710 1.00 0.00 H new ATOM 0 HB3 LEU A 36 2.687 4.957 -8.755 1.00 0.00 H new ATOM 0 HG LEU A 36 0.268 5.168 -7.886 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.940 7.257 -8.564 1.00 0.00 H new ATOM 0 HD12 LEU A 36 0.263 7.568 -7.291 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.620 8.007 -8.978 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.600 5.511 -10.247 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.987 6.169 -10.711 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.839 4.464 -10.223 1.00 0.00 H new ATOM 596 N LYS A 37 3.494 3.496 -6.356 1.00 0.00 N ATOM 597 CA LYS A 37 4.548 2.504 -6.207 1.00 0.00 C ATOM 598 C LYS A 37 3.916 1.168 -6.106 1.00 0.00 C ATOM 599 O LYS A 37 2.699 1.086 -6.083 1.00 0.00 O ATOM 600 CB LYS A 37 5.340 2.668 -4.899 1.00 0.00 C ATOM 601 CG LYS A 37 4.455 2.442 -3.666 1.00 0.00 C ATOM 602 CD LYS A 37 5.177 2.651 -2.317 1.00 0.00 C ATOM 603 CE LYS A 37 6.428 1.732 -2.181 1.00 0.00 C ATOM 604 NZ LYS A 37 6.917 1.686 -0.783 1.00 0.00 N ATOM 0 H LYS A 37 2.543 3.135 -6.287 1.00 0.00 H new ATOM 0 HA LYS A 37 5.214 2.623 -7.062 1.00 0.00 H new ATOM 0 HB2 LYS A 37 6.170 1.962 -4.885 1.00 0.00 H new ATOM 0 HB3 LYS A 37 5.772 3.668 -4.858 1.00 0.00 H new ATOM 0 HG2 LYS A 37 3.602 3.119 -3.717 1.00 0.00 H new ATOM 0 HG3 LYS A 37 4.059 1.427 -3.699 1.00 0.00 H new ATOM 0 HD2 LYS A 37 5.481 3.694 -2.225 1.00 0.00 H new ATOM 0 HD3 LYS A 37 4.486 2.447 -1.499 1.00 0.00 H new ATOM 0 HE2 LYS A 37 6.179 0.724 -2.514 1.00 0.00 H new ATOM 0 HE3 LYS A 37 7.221 2.096 -2.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 7.750 1.066 -0.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 7.177 2.644 -0.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 6.167 1.315 -0.165 1.00 0.00 H new ATOM 618 N LEU A 38 4.760 0.129 -6.038 1.00 0.00 N ATOM 619 CA LEU A 38 4.200 -1.197 -6.113 1.00 0.00 C ATOM 620 C LEU A 38 5.313 -2.162 -5.855 1.00 0.00 C ATOM 621 O LEU A 38 6.395 -1.945 -6.370 1.00 0.00 O ATOM 622 CB LEU A 38 3.549 -1.246 -7.506 1.00 0.00 C ATOM 623 CG LEU A 38 3.657 -2.584 -8.267 1.00 0.00 C ATOM 624 CD1 LEU A 38 2.273 -3.179 -8.597 1.00 0.00 C ATOM 625 CD2 LEU A 38 4.365 -2.198 -9.569 1.00 0.00 C ATOM 0 H LEU A 38 5.773 0.186 -5.937 1.00 0.00 H new ATOM 0 HA LEU A 38 3.436 -1.458 -5.380 1.00 0.00 H new ATOM 0 HB2 LEU A 38 2.493 -0.998 -7.398 1.00 0.00 H new ATOM 0 HB3 LEU A 38 3.998 -0.466 -8.121 1.00 0.00 H new ATOM 0 HG LEU A 38 4.177 -3.340 -7.679 1.00 0.00 H new ATOM 0 HD11 LEU A 38 2.400 -4.120 -9.132 1.00 0.00 H new ATOM 0 HD12 LEU A 38 1.724 -3.359 -7.672 1.00 0.00 H new ATOM 0 HD13 LEU A 38 1.715 -2.479 -9.220 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.493 -3.085 -10.190 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.765 -1.463 -10.105 1.00 0.00 H new ATOM 0 HD23 LEU A 38 5.341 -1.771 -9.340 1.00 0.00 H new ATOM 637 N THR A 39 5.044 -3.212 -5.061 1.00 0.00 N ATOM 638 CA THR A 39 6.078 -4.187 -4.764 1.00 0.00 C ATOM 639 C THR A 39 5.653 -5.364 -5.570 1.00 0.00 C ATOM 640 O THR A 39 4.499 -5.726 -5.418 1.00 0.00 O ATOM 641 CB THR A 39 6.142 -4.619 -3.275 1.00 0.00 C ATOM 642 OG1 THR A 39 6.780 -3.630 -2.449 1.00 0.00 O ATOM 643 CG2 THR A 39 6.789 -6.017 -3.126 1.00 0.00 C ATOM 0 H THR A 39 4.139 -3.396 -4.628 1.00 0.00 H new ATOM 0 HA THR A 39 7.064 -3.777 -4.984 1.00 0.00 H new ATOM 0 HB THR A 39 5.117 -4.698 -2.914 1.00 0.00 H new ATOM 0 HG1 THR A 39 6.797 -3.942 -1.520 1.00 0.00 H new ATOM 0 HG21 THR A 39 6.820 -6.293 -2.072 1.00 0.00 H new ATOM 0 HG22 THR A 39 6.200 -6.751 -3.676 1.00 0.00 H new ATOM 0 HG23 THR A 39 7.803 -5.993 -3.525 1.00 0.00 H new ATOM 651 N ILE A 40 6.545 -5.974 -6.372 1.00 0.00 N ATOM 652 CA ILE A 40 6.196 -7.245 -6.964 1.00 0.00 C ATOM 653 C ILE A 40 7.010 -8.238 -6.175 1.00 0.00 C ATOM 654 O ILE A 40 8.127 -7.916 -5.802 1.00 0.00 O ATOM 655 CB ILE A 40 6.512 -7.185 -8.481 1.00 0.00 C ATOM 656 CG1 ILE A 40 5.430 -7.920 -9.301 1.00 0.00 C ATOM 657 CG2 ILE A 40 7.890 -7.783 -8.802 1.00 0.00 C ATOM 658 CD1 ILE A 40 4.258 -6.932 -9.574 1.00 0.00 C ATOM 0 H ILE A 40 7.470 -5.614 -6.608 1.00 0.00 H new ATOM 0 HA ILE A 40 5.143 -7.522 -6.916 1.00 0.00 H new ATOM 0 HB ILE A 40 6.521 -6.131 -8.759 1.00 0.00 H new ATOM 0 HG12 ILE A 40 5.848 -8.281 -10.241 1.00 0.00 H new ATOM 0 HG13 ILE A 40 5.070 -8.793 -8.756 1.00 0.00 H new ATOM 0 HG21 ILE A 40 8.072 -7.721 -9.875 1.00 0.00 H new ATOM 0 HG22 ILE A 40 8.661 -7.226 -8.270 1.00 0.00 H new ATOM 0 HG23 ILE A 40 7.916 -8.827 -8.489 1.00 0.00 H new ATOM 0 HD11 ILE A 40 3.484 -7.436 -10.153 1.00 0.00 H new ATOM 0 HD12 ILE A 40 3.839 -6.593 -8.626 1.00 0.00 H new ATOM 0 HD13 ILE A 40 4.629 -6.074 -10.134 1.00 0.00 H new ATOM 670 N THR A 41 6.474 -9.443 -5.908 1.00 0.00 N ATOM 671 CA THR A 41 7.248 -10.435 -5.175 1.00 0.00 C ATOM 672 C THR A 41 6.682 -11.754 -5.620 1.00 0.00 C ATOM 673 O THR A 41 5.548 -12.043 -5.276 1.00 0.00 O ATOM 674 CB THR A 41 7.136 -10.245 -3.643 1.00 0.00 C ATOM 675 OG1 THR A 41 7.722 -8.978 -3.305 1.00 0.00 O ATOM 676 CG2 THR A 41 7.882 -11.389 -2.904 1.00 0.00 C ATOM 0 H THR A 41 5.537 -9.738 -6.183 1.00 0.00 H new ATOM 0 HA THR A 41 8.315 -10.355 -5.382 1.00 0.00 H new ATOM 0 HB THR A 41 6.089 -10.270 -3.340 1.00 0.00 H new ATOM 0 HG1 THR A 41 8.054 -8.544 -4.118 1.00 0.00 H new ATOM 0 HG21 THR A 41 7.796 -11.244 -1.827 1.00 0.00 H new ATOM 0 HG22 THR A 41 7.440 -12.347 -3.177 1.00 0.00 H new ATOM 0 HG23 THR A 41 8.934 -11.380 -3.188 1.00 0.00 H new ATOM 684 N GLN A 42 7.430 -12.545 -6.410 1.00 0.00 N ATOM 685 CA GLN A 42 6.850 -13.780 -6.908 1.00 0.00 C ATOM 686 C GLN A 42 6.953 -14.818 -5.818 1.00 0.00 C ATOM 687 O GLN A 42 7.738 -14.647 -4.899 1.00 0.00 O ATOM 688 CB GLN A 42 7.591 -14.280 -8.170 1.00 0.00 C ATOM 689 CG GLN A 42 7.627 -13.254 -9.335 1.00 0.00 C ATOM 690 CD GLN A 42 6.230 -13.176 -9.816 1.00 0.00 C ATOM 691 OE1 GLN A 42 5.516 -12.220 -9.551 1.00 0.00 O ATOM 692 NE2 GLN A 42 5.825 -14.262 -10.474 1.00 0.00 N ATOM 0 H GLN A 42 8.389 -12.356 -6.700 1.00 0.00 H new ATOM 0 HA GLN A 42 5.810 -13.603 -7.182 1.00 0.00 H new ATOM 0 HB2 GLN A 42 8.614 -14.540 -7.898 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.112 -15.194 -8.521 1.00 0.00 H new ATOM 0 HG2 GLN A 42 7.983 -12.282 -8.994 1.00 0.00 H new ATOM 0 HG3 GLN A 42 8.300 -13.580 -10.128 1.00 0.00 H new ATOM 0 HE21 GLN A 42 6.481 -15.021 -10.658 1.00 0.00 H new ATOM 0 HE22 GLN A 42 4.859 -14.334 -10.793 1.00 0.00 H new ATOM 701 N GLU A 43 6.167 -15.906 -5.953 1.00 0.00 N ATOM 702 CA GLU A 43 6.264 -17.038 -5.021 1.00 0.00 C ATOM 703 C GLU A 43 5.498 -18.223 -5.556 1.00 0.00 C ATOM 704 O GLU A 43 4.348 -18.005 -5.884 1.00 0.00 O ATOM 705 CB GLU A 43 5.820 -16.735 -3.555 1.00 0.00 C ATOM 706 CG GLU A 43 4.321 -16.432 -3.282 1.00 0.00 C ATOM 707 CD GLU A 43 3.419 -17.641 -3.268 1.00 0.00 C ATOM 708 OE1 GLU A 43 3.926 -18.794 -3.289 1.00 0.00 O ATOM 709 OE2 GLU A 43 2.177 -17.443 -3.210 1.00 0.00 O ATOM 0 H GLU A 43 5.469 -16.020 -6.688 1.00 0.00 H new ATOM 0 HA GLU A 43 7.329 -17.260 -4.959 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.103 -17.589 -2.940 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.400 -15.882 -3.203 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.238 -15.924 -2.321 1.00 0.00 H new ATOM 0 HG3 GLU A 43 3.962 -15.738 -4.042 1.00 0.00 H new ATOM 716 N GLY A 44 6.048 -19.455 -5.669 1.00 0.00 N ATOM 717 CA GLY A 44 5.236 -20.594 -6.112 1.00 0.00 C ATOM 718 C GLY A 44 4.302 -20.270 -7.260 1.00 0.00 C ATOM 719 O GLY A 44 3.098 -20.366 -7.080 1.00 0.00 O ATOM 0 H GLY A 44 7.023 -19.675 -5.464 1.00 0.00 H new ATOM 0 HA2 GLY A 44 5.899 -21.405 -6.413 1.00 0.00 H new ATOM 0 HA3 GLY A 44 4.648 -20.959 -5.270 1.00 0.00 H new ATOM 723 N ASN A 45 4.837 -19.873 -8.440 1.00 0.00 N ATOM 724 CA ASN A 45 3.979 -19.504 -9.574 1.00 0.00 C ATOM 725 C ASN A 45 2.891 -18.537 -9.170 1.00 0.00 C ATOM 726 O ASN A 45 1.827 -18.556 -9.765 1.00 0.00 O ATOM 727 CB ASN A 45 3.410 -20.781 -10.251 1.00 0.00 C ATOM 728 CG ASN A 45 2.612 -20.478 -11.499 1.00 0.00 C ATOM 729 OD1 ASN A 45 3.216 -20.161 -12.511 1.00 0.00 O ATOM 730 ND2 ASN A 45 1.263 -20.562 -11.469 1.00 0.00 N ATOM 0 H ASN A 45 5.838 -19.803 -8.622 1.00 0.00 H new ATOM 0 HA ASN A 45 4.590 -18.978 -10.307 1.00 0.00 H new ATOM 0 HB2 ASN A 45 4.233 -21.449 -10.505 1.00 0.00 H new ATOM 0 HB3 ASN A 45 2.776 -21.312 -9.540 1.00 0.00 H new ATOM 0 HD21 ASN A 45 0.721 -20.358 -12.308 1.00 0.00 H new ATOM 0 HD22 ASN A 45 0.788 -20.830 -10.607 1.00 0.00 H new ATOM 737 N LYS A 46 3.158 -17.676 -8.165 1.00 0.00 N ATOM 738 CA LYS A 46 2.184 -16.686 -7.724 1.00 0.00 C ATOM 739 C LYS A 46 2.841 -15.358 -7.956 1.00 0.00 C ATOM 740 O LYS A 46 4.055 -15.306 -8.077 1.00 0.00 O ATOM 741 CB LYS A 46 1.841 -16.819 -6.218 1.00 0.00 C ATOM 742 CG LYS A 46 0.439 -16.327 -5.758 1.00 0.00 C ATOM 743 CD LYS A 46 -0.740 -17.241 -6.168 1.00 0.00 C ATOM 744 CE LYS A 46 -0.515 -18.719 -5.744 1.00 0.00 C ATOM 745 NZ LYS A 46 -1.778 -19.492 -5.718 1.00 0.00 N ATOM 0 H LYS A 46 4.040 -17.656 -7.653 1.00 0.00 H new ATOM 0 HA LYS A 46 1.248 -16.813 -8.268 1.00 0.00 H new ATOM 0 HB2 LYS A 46 1.937 -17.869 -5.942 1.00 0.00 H new ATOM 0 HB3 LYS A 46 2.593 -16.270 -5.651 1.00 0.00 H new ATOM 0 HG2 LYS A 46 0.443 -16.229 -4.672 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.267 -15.332 -6.167 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -1.659 -16.871 -5.714 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -0.876 -17.192 -7.248 1.00 0.00 H new ATOM 0 HE2 LYS A 46 0.184 -19.191 -6.435 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -0.054 -18.746 -4.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -1.781 -20.125 -4.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -2.584 -18.838 -5.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -1.857 -20.057 -6.587 1.00 0.00 H new ATOM 759 N PHE A 47 2.030 -14.290 -7.999 1.00 0.00 N ATOM 760 CA PHE A 47 2.556 -12.960 -8.130 1.00 0.00 C ATOM 761 C PHE A 47 1.877 -12.235 -6.996 1.00 0.00 C ATOM 762 O PHE A 47 0.762 -11.778 -7.201 1.00 0.00 O ATOM 763 CB PHE A 47 2.038 -12.471 -9.502 1.00 0.00 C ATOM 764 CG PHE A 47 2.482 -13.332 -10.694 1.00 0.00 C ATOM 765 CD1 PHE A 47 2.016 -14.647 -10.818 1.00 0.00 C ATOM 766 CD2 PHE A 47 3.355 -12.839 -11.668 1.00 0.00 C ATOM 767 CE1 PHE A 47 2.568 -15.530 -11.747 1.00 0.00 C ATOM 768 CE2 PHE A 47 3.895 -13.721 -12.611 1.00 0.00 C ATOM 769 CZ PHE A 47 3.453 -15.041 -12.706 1.00 0.00 C ATOM 0 H PHE A 47 1.013 -14.341 -7.944 1.00 0.00 H new ATOM 0 HA PHE A 47 3.638 -12.839 -8.089 1.00 0.00 H new ATOM 0 HB2 PHE A 47 0.949 -12.443 -9.476 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.379 -11.448 -9.662 1.00 0.00 H new ATOM 0 HD1 PHE A 47 1.212 -14.985 -10.181 1.00 0.00 H new ATOM 0 HD2 PHE A 47 3.610 -11.790 -11.693 1.00 0.00 H new ATOM 0 HE1 PHE A 47 2.313 -16.579 -11.723 1.00 0.00 H new ATOM 0 HE2 PHE A 47 4.669 -13.373 -13.279 1.00 0.00 H new ATOM 0 HZ PHE A 47 3.792 -15.675 -13.512 1.00 0.00 H new ATOM 779 N THR A 48 2.504 -12.156 -5.800 1.00 0.00 N ATOM 780 CA THR A 48 1.851 -11.443 -4.705 1.00 0.00 C ATOM 781 C THR A 48 2.355 -10.040 -4.865 1.00 0.00 C ATOM 782 O THR A 48 3.512 -9.883 -5.226 1.00 0.00 O ATOM 783 CB THR A 48 2.020 -12.012 -3.270 1.00 0.00 C ATOM 784 OG1 THR A 48 0.987 -11.432 -2.447 1.00 0.00 O ATOM 785 CG2 THR A 48 3.401 -11.695 -2.641 1.00 0.00 C ATOM 0 H THR A 48 3.416 -12.559 -5.584 1.00 0.00 H new ATOM 0 HA THR A 48 0.769 -11.542 -4.787 1.00 0.00 H new ATOM 0 HB THR A 48 1.946 -13.098 -3.328 1.00 0.00 H new ATOM 0 HG1 THR A 48 1.067 -11.775 -1.532 1.00 0.00 H new ATOM 0 HG21 THR A 48 3.451 -12.122 -1.639 1.00 0.00 H new ATOM 0 HG22 THR A 48 4.189 -12.125 -3.258 1.00 0.00 H new ATOM 0 HG23 THR A 48 3.535 -10.615 -2.582 1.00 0.00 H new ATOM 793 N VAL A 49 1.499 -9.020 -4.648 1.00 0.00 N ATOM 794 CA VAL A 49 1.893 -7.687 -5.065 1.00 0.00 C ATOM 795 C VAL A 49 1.161 -6.642 -4.273 1.00 0.00 C ATOM 796 O VAL A 49 0.103 -6.921 -3.737 1.00 0.00 O ATOM 797 CB VAL A 49 1.725 -7.557 -6.605 1.00 0.00 C ATOM 798 CG1 VAL A 49 0.450 -8.284 -7.078 1.00 0.00 C ATOM 799 CG2 VAL A 49 1.653 -6.093 -7.112 1.00 0.00 C ATOM 0 H VAL A 49 0.581 -9.098 -4.209 1.00 0.00 H new ATOM 0 HA VAL A 49 2.948 -7.518 -4.851 1.00 0.00 H new ATOM 0 HB VAL A 49 2.622 -8.013 -7.024 1.00 0.00 H new ATOM 0 HG11 VAL A 49 0.352 -8.180 -8.159 1.00 0.00 H new ATOM 0 HG12 VAL A 49 0.517 -9.341 -6.819 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -0.421 -7.845 -6.591 1.00 0.00 H new ATOM 0 HG21 VAL A 49 1.536 -6.089 -8.196 1.00 0.00 H new ATOM 0 HG22 VAL A 49 0.802 -5.590 -6.653 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.571 -5.570 -6.844 1.00 0.00 H new ATOM 809 N LYS A 50 1.742 -5.429 -4.199 1.00 0.00 N ATOM 810 CA LYS A 50 1.096 -4.299 -3.558 1.00 0.00 C ATOM 811 C LYS A 50 1.024 -3.235 -4.601 1.00 0.00 C ATOM 812 O LYS A 50 1.970 -3.202 -5.368 1.00 0.00 O ATOM 813 CB LYS A 50 2.043 -3.777 -2.447 1.00 0.00 C ATOM 814 CG LYS A 50 1.450 -4.060 -1.043 1.00 0.00 C ATOM 815 CD LYS A 50 2.393 -3.591 0.095 1.00 0.00 C ATOM 816 CE LYS A 50 1.716 -3.671 1.493 1.00 0.00 C ATOM 817 NZ LYS A 50 1.214 -5.023 1.832 1.00 0.00 N ATOM 0 H LYS A 50 2.664 -5.220 -4.582 1.00 0.00 H new ATOM 0 HA LYS A 50 0.121 -4.561 -3.147 1.00 0.00 H new ATOM 0 HB2 LYS A 50 3.018 -4.256 -2.539 1.00 0.00 H new ATOM 0 HB3 LYS A 50 2.201 -2.706 -2.571 1.00 0.00 H new ATOM 0 HG2 LYS A 50 0.489 -3.555 -0.948 1.00 0.00 H new ATOM 0 HG3 LYS A 50 1.261 -5.128 -0.939 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.293 -4.205 0.094 1.00 0.00 H new ATOM 0 HD3 LYS A 50 2.707 -2.565 -0.096 1.00 0.00 H new ATOM 0 HE2 LYS A 50 2.432 -3.357 2.253 1.00 0.00 H new ATOM 0 HE3 LYS A 50 0.886 -2.965 1.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 0.806 -5.012 2.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 0.483 -5.304 1.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 2.000 -5.704 1.798 1.00 0.00 H new ATOM 831 N GLU A 51 -0.001 -2.358 -4.637 1.00 0.00 N ATOM 832 CA GLU A 51 0.115 -1.236 -5.554 1.00 0.00 C ATOM 833 C GLU A 51 -0.459 -0.047 -4.875 1.00 0.00 C ATOM 834 O GLU A 51 -1.469 -0.211 -4.223 1.00 0.00 O ATOM 835 CB GLU A 51 -0.707 -1.496 -6.842 1.00 0.00 C ATOM 836 CG GLU A 51 -0.715 -0.210 -7.709 1.00 0.00 C ATOM 837 CD GLU A 51 -0.635 -0.478 -9.186 1.00 0.00 C ATOM 838 OE1 GLU A 51 -1.679 -0.881 -9.751 1.00 0.00 O ATOM 839 OE2 GLU A 51 0.456 -0.281 -9.789 1.00 0.00 O ATOM 0 H GLU A 51 -0.855 -2.405 -4.081 1.00 0.00 H new ATOM 0 HA GLU A 51 1.161 -1.090 -5.824 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -0.275 -2.325 -7.403 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.727 -1.783 -6.585 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -1.624 0.353 -7.499 1.00 0.00 H new ATOM 0 HG3 GLU A 51 0.125 0.420 -7.417 1.00 0.00 H new ATOM 846 N SER A 52 0.178 1.127 -4.986 1.00 0.00 N ATOM 847 CA SER A 52 -0.102 2.165 -4.029 1.00 0.00 C ATOM 848 C SER A 52 -0.144 3.438 -4.812 1.00 0.00 C ATOM 849 O SER A 52 0.422 3.472 -5.893 1.00 0.00 O ATOM 850 CB SER A 52 1.059 1.949 -3.029 1.00 0.00 C ATOM 851 OG SER A 52 1.240 3.057 -2.134 1.00 0.00 O ATOM 0 H SER A 52 0.862 1.361 -5.705 1.00 0.00 H new ATOM 0 HA SER A 52 -1.040 2.175 -3.474 1.00 0.00 H new ATOM 0 HB2 SER A 52 0.868 1.047 -2.448 1.00 0.00 H new ATOM 0 HB3 SER A 52 1.983 1.782 -3.583 1.00 0.00 H new ATOM 0 HG SER A 52 1.983 2.867 -1.524 1.00 0.00 H new ATOM 857 N SER A 53 -0.872 4.451 -4.306 1.00 0.00 N ATOM 858 CA SER A 53 -1.215 5.563 -5.183 1.00 0.00 C ATOM 859 C SER A 53 -1.673 6.732 -4.369 1.00 0.00 C ATOM 860 O SER A 53 -2.777 7.197 -4.599 1.00 0.00 O ATOM 861 CB SER A 53 -2.312 5.075 -6.169 1.00 0.00 C ATOM 862 OG SER A 53 -2.690 6.097 -7.104 1.00 0.00 O ATOM 0 H SER A 53 -1.214 4.516 -3.347 1.00 0.00 H new ATOM 0 HA SER A 53 -0.347 5.894 -5.754 1.00 0.00 H new ATOM 0 HB2 SER A 53 -1.948 4.203 -6.713 1.00 0.00 H new ATOM 0 HB3 SER A 53 -3.189 4.757 -5.606 1.00 0.00 H new ATOM 0 HG SER A 53 -2.947 6.908 -6.617 1.00 0.00 H new ATOM 868 N ALA A 54 -0.842 7.202 -3.415 1.00 0.00 N ATOM 869 CA ALA A 54 -1.288 8.236 -2.479 1.00 0.00 C ATOM 870 C ALA A 54 -2.446 7.864 -1.559 1.00 0.00 C ATOM 871 O ALA A 54 -2.320 7.982 -0.350 1.00 0.00 O ATOM 872 CB ALA A 54 -1.598 9.529 -3.285 1.00 0.00 C ATOM 0 H ALA A 54 0.118 6.886 -3.280 1.00 0.00 H new ATOM 0 HA ALA A 54 -0.464 8.385 -1.781 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -1.932 10.311 -2.603 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -0.698 9.859 -3.803 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -2.382 9.324 -4.014 1.00 0.00 H new ATOM 878 N PHE A 55 -3.594 7.430 -2.120 1.00 0.00 N ATOM 879 CA PHE A 55 -4.810 7.159 -1.352 1.00 0.00 C ATOM 880 C PHE A 55 -4.493 6.174 -0.242 1.00 0.00 C ATOM 881 O PHE A 55 -4.667 6.518 0.916 1.00 0.00 O ATOM 882 CB PHE A 55 -5.956 6.713 -2.316 1.00 0.00 C ATOM 883 CG PHE A 55 -5.928 7.466 -3.657 1.00 0.00 C ATOM 884 CD1 PHE A 55 -6.123 8.851 -3.704 1.00 0.00 C ATOM 885 CD2 PHE A 55 -5.670 6.775 -4.846 1.00 0.00 C ATOM 886 CE1 PHE A 55 -6.063 9.526 -4.926 1.00 0.00 C ATOM 887 CE2 PHE A 55 -5.681 7.439 -6.076 1.00 0.00 C ATOM 888 CZ PHE A 55 -5.852 8.823 -6.115 1.00 0.00 C ATOM 0 H PHE A 55 -3.696 7.260 -3.121 1.00 0.00 H new ATOM 0 HA PHE A 55 -5.178 8.059 -0.859 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -5.872 5.642 -2.503 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -6.918 6.878 -1.831 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -6.320 9.399 -2.794 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -5.460 5.716 -4.813 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -6.181 10.599 -4.952 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -5.558 6.882 -6.993 1.00 0.00 H new ATOM 0 HZ PHE A 55 -5.821 9.348 -7.058 1.00 0.00 H new ATOM 898 N ARG A 56 -4.002 4.957 -0.579 1.00 0.00 N ATOM 899 CA ARG A 56 -3.612 3.971 0.441 1.00 0.00 C ATOM 900 C ARG A 56 -3.019 2.793 -0.290 1.00 0.00 C ATOM 901 O ARG A 56 -3.460 2.544 -1.402 1.00 0.00 O ATOM 902 CB ARG A 56 -4.810 3.442 1.281 1.00 0.00 C ATOM 903 CG ARG A 56 -4.462 2.598 2.543 1.00 0.00 C ATOM 904 CD ARG A 56 -3.884 3.449 3.710 1.00 0.00 C ATOM 905 NE ARG A 56 -3.880 2.710 4.977 1.00 0.00 N ATOM 906 CZ ARG A 56 -3.641 3.269 6.148 1.00 0.00 C ATOM 907 NH1 ARG A 56 -3.317 4.535 6.282 1.00 0.00 N ATOM 908 NH2 ARG A 56 -3.732 2.531 7.231 1.00 0.00 N ATOM 0 H ARG A 56 -3.870 4.643 -1.540 1.00 0.00 H new ATOM 0 HA ARG A 56 -2.920 4.457 1.129 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -5.407 4.297 1.598 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -5.441 2.836 0.630 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -5.359 2.084 2.887 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -3.739 1.829 2.270 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -2.867 3.756 3.466 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -4.474 4.359 3.822 1.00 0.00 H new ATOM 0 HE ARG A 56 -4.073 1.709 4.951 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -3.241 5.132 5.458 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -3.142 4.921 7.210 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -3.983 1.545 7.157 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -3.551 2.944 8.146 1.00 0.00 H new ATOM 922 N ASN A 57 -2.039 2.059 0.279 1.00 0.00 N ATOM 923 CA ASN A 57 -1.483 0.944 -0.477 1.00 0.00 C ATOM 924 C ASN A 57 -2.560 -0.059 -0.804 1.00 0.00 C ATOM 925 O ASN A 57 -3.478 -0.171 -0.007 1.00 0.00 O ATOM 926 CB ASN A 57 -0.284 0.254 0.216 1.00 0.00 C ATOM 927 CG ASN A 57 -0.725 -0.355 1.528 1.00 0.00 C ATOM 928 OD1 ASN A 57 -1.374 -1.543 1.521 1.00 0.00 O flip ATOM 929 ND2 ASN A 57 -0.492 0.248 2.563 1.00 0.00 N flip ATOM 0 H ASN A 57 -1.642 2.213 1.206 1.00 0.00 H new ATOM 0 HA ASN A 57 -1.088 1.370 -1.399 1.00 0.00 H new ATOM 0 HB2 ASN A 57 0.126 -0.519 -0.434 1.00 0.00 H new ATOM 0 HB3 ASN A 57 0.511 0.978 0.391 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -0.001 1.141 2.533 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -0.789 -0.141 3.458 1.00 0.00 H new ATOM 936 N ILE A 58 -2.469 -0.773 -1.954 1.00 0.00 N ATOM 937 CA ILE A 58 -3.525 -1.718 -2.323 1.00 0.00 C ATOM 938 C ILE A 58 -2.904 -3.085 -2.351 1.00 0.00 C ATOM 939 O ILE A 58 -2.141 -3.321 -3.270 1.00 0.00 O ATOM 940 CB ILE A 58 -4.130 -1.360 -3.716 1.00 0.00 C ATOM 941 CG1 ILE A 58 -4.401 0.169 -3.745 1.00 0.00 C ATOM 942 CG2 ILE A 58 -5.420 -2.194 -3.972 1.00 0.00 C ATOM 943 CD1 ILE A 58 -5.001 0.690 -5.071 1.00 0.00 C ATOM 0 H ILE A 58 -1.696 -0.709 -2.616 1.00 0.00 H new ATOM 0 HA ILE A 58 -4.342 -1.679 -1.602 1.00 0.00 H new ATOM 0 HB ILE A 58 -3.435 -1.608 -4.518 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -5.080 0.420 -2.930 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -3.465 0.694 -3.553 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -5.833 -1.935 -4.947 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -5.177 -3.256 -3.951 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -6.155 -1.975 -3.197 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -5.157 1.767 -5.002 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -4.315 0.475 -5.890 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -5.955 0.196 -5.258 1.00 0.00 H new ATOM 955 N GLU A 59 -3.183 -4.008 -1.403 1.00 0.00 N ATOM 956 CA GLU A 59 -2.631 -5.346 -1.581 1.00 0.00 C ATOM 957 C GLU A 59 -3.301 -5.909 -2.809 1.00 0.00 C ATOM 958 O GLU A 59 -4.469 -5.619 -3.017 1.00 0.00 O ATOM 959 CB GLU A 59 -2.760 -6.292 -0.354 1.00 0.00 C ATOM 960 CG GLU A 59 -4.184 -6.886 -0.176 1.00 0.00 C ATOM 961 CD GLU A 59 -4.542 -7.895 -1.244 1.00 0.00 C ATOM 962 OE1 GLU A 59 -3.675 -8.741 -1.593 1.00 0.00 O ATOM 963 OE2 GLU A 59 -5.697 -7.851 -1.748 1.00 0.00 O ATOM 0 H GLU A 59 -3.748 -3.858 -0.567 1.00 0.00 H new ATOM 0 HA GLU A 59 -1.550 -5.269 -1.697 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -2.045 -7.108 -0.458 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -2.489 -5.743 0.548 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -4.254 -7.361 0.803 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -4.914 -6.076 -0.190 1.00 0.00 H new ATOM 970 N VAL A 60 -2.591 -6.706 -3.635 1.00 0.00 N ATOM 971 CA VAL A 60 -3.224 -7.309 -4.800 1.00 0.00 C ATOM 972 C VAL A 60 -2.558 -8.642 -5.012 1.00 0.00 C ATOM 973 O VAL A 60 -1.457 -8.829 -4.520 1.00 0.00 O ATOM 974 CB VAL A 60 -3.218 -6.432 -6.096 1.00 0.00 C ATOM 975 CG1 VAL A 60 -4.646 -6.256 -6.688 1.00 0.00 C ATOM 976 CG2 VAL A 60 -2.575 -5.040 -5.856 1.00 0.00 C ATOM 0 H VAL A 60 -1.605 -6.936 -3.512 1.00 0.00 H new ATOM 0 HA VAL A 60 -4.289 -7.416 -4.595 1.00 0.00 H new ATOM 0 HB VAL A 60 -2.608 -6.972 -6.820 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.594 -5.641 -7.586 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -5.058 -7.233 -6.941 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -5.288 -5.771 -5.952 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.593 -4.466 -6.783 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -3.137 -4.507 -5.089 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.543 -5.167 -5.528 1.00 0.00 H new ATOM 986 N VAL A 61 -3.200 -9.581 -5.732 1.00 0.00 N ATOM 987 CA VAL A 61 -2.518 -10.841 -5.981 1.00 0.00 C ATOM 988 C VAL A 61 -3.165 -11.619 -7.077 1.00 0.00 C ATOM 989 O VAL A 61 -4.369 -11.539 -7.263 1.00 0.00 O ATOM 990 CB VAL A 61 -2.393 -11.741 -4.714 1.00 0.00 C ATOM 991 CG1 VAL A 61 -3.759 -11.829 -3.980 1.00 0.00 C ATOM 992 CG2 VAL A 61 -1.880 -13.176 -5.041 1.00 0.00 C ATOM 0 H VAL A 61 -4.136 -9.492 -6.127 1.00 0.00 H new ATOM 0 HA VAL A 61 -1.511 -10.557 -6.286 1.00 0.00 H new ATOM 0 HB VAL A 61 -1.652 -11.271 -4.068 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -3.658 -12.460 -3.097 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -4.075 -10.830 -3.678 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -4.505 -12.258 -4.649 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -1.813 -13.757 -4.121 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -2.573 -13.662 -5.728 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -0.895 -13.114 -5.503 1.00 0.00 H new ATOM 1002 N PHE A 62 -2.316 -12.383 -7.795 1.00 0.00 N ATOM 1003 CA PHE A 62 -2.841 -13.196 -8.856 1.00 0.00 C ATOM 1004 C PHE A 62 -1.882 -14.324 -9.123 1.00 0.00 C ATOM 1005 O PHE A 62 -0.748 -14.243 -8.679 1.00 0.00 O ATOM 1006 CB PHE A 62 -3.069 -12.212 -10.023 1.00 0.00 C ATOM 1007 CG PHE A 62 -1.978 -11.142 -10.223 1.00 0.00 C ATOM 1008 CD1 PHE A 62 -0.832 -11.436 -10.965 1.00 0.00 C ATOM 1009 CD2 PHE A 62 -2.156 -9.875 -9.670 1.00 0.00 C ATOM 1010 CE1 PHE A 62 0.187 -10.488 -11.061 1.00 0.00 C ATOM 1011 CE2 PHE A 62 -1.212 -8.882 -9.926 1.00 0.00 C ATOM 1012 CZ PHE A 62 0.004 -9.204 -10.538 1.00 0.00 C ATOM 0 H PHE A 62 -1.308 -12.440 -7.652 1.00 0.00 H new ATOM 0 HA PHE A 62 -3.785 -13.697 -8.641 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -3.161 -12.787 -10.945 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -4.022 -11.707 -9.866 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -0.735 -12.390 -11.461 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -3.015 -9.665 -9.050 1.00 0.00 H new ATOM 0 HE1 PHE A 62 1.120 -10.746 -11.540 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -1.420 -7.859 -9.650 1.00 0.00 H new ATOM 0 HZ PHE A 62 0.793 -8.469 -10.606 1.00 0.00 H new ATOM 1022 N GLU A 63 -2.356 -15.380 -9.819 1.00 0.00 N ATOM 1023 CA GLU A 63 -1.533 -16.544 -10.073 1.00 0.00 C ATOM 1024 C GLU A 63 -1.210 -16.517 -11.546 1.00 0.00 C ATOM 1025 O GLU A 63 -0.077 -16.239 -11.895 1.00 0.00 O ATOM 1026 CB GLU A 63 -2.224 -17.838 -9.560 1.00 0.00 C ATOM 1027 CG GLU A 63 -1.240 -19.029 -9.594 1.00 0.00 C ATOM 1028 CD GLU A 63 -1.941 -20.335 -9.316 1.00 0.00 C ATOM 1029 OE1 GLU A 63 -2.743 -20.775 -10.184 1.00 0.00 O ATOM 1030 OE2 GLU A 63 -1.701 -20.929 -8.230 1.00 0.00 O ATOM 0 H GLU A 63 -3.299 -15.434 -10.205 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.594 -16.531 -9.519 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -2.584 -17.686 -8.543 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -3.095 -18.061 -10.177 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -0.757 -19.075 -10.570 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -0.453 -18.873 -8.856 1.00 0.00 H new ATOM 1037 N LEU A 64 -2.169 -16.786 -12.455 1.00 0.00 N ATOM 1038 CA LEU A 64 -1.831 -16.828 -13.875 1.00 0.00 C ATOM 1039 C LEU A 64 -3.142 -16.743 -14.630 1.00 0.00 C ATOM 1040 O LEU A 64 -3.510 -17.675 -15.327 1.00 0.00 O ATOM 1041 CB LEU A 64 -0.996 -18.132 -14.079 1.00 0.00 C ATOM 1042 CG LEU A 64 0.000 -18.124 -15.273 1.00 0.00 C ATOM 1043 CD1 LEU A 64 -0.720 -17.886 -16.626 1.00 0.00 C ATOM 1044 CD2 LEU A 64 1.174 -17.116 -15.092 1.00 0.00 C ATOM 0 H LEU A 64 -3.148 -16.970 -12.234 1.00 0.00 H new ATOM 0 HA LEU A 64 -1.217 -16.009 -14.250 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.435 -18.327 -13.165 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -1.687 -18.965 -14.213 1.00 0.00 H new ATOM 0 HG LEU A 64 0.440 -19.121 -15.288 1.00 0.00 H new ATOM 0 HD11 LEU A 64 0.012 -17.888 -17.433 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.448 -18.679 -16.795 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.231 -16.923 -16.602 1.00 0.00 H new ATOM 0 HD21 LEU A 64 1.830 -17.162 -15.961 1.00 0.00 H new ATOM 0 HD22 LEU A 64 0.775 -16.107 -14.992 1.00 0.00 H new ATOM 0 HD23 LEU A 64 1.739 -17.373 -14.196 1.00 0.00 H new ATOM 1056 N GLY A 65 -3.870 -15.614 -14.443 1.00 0.00 N ATOM 1057 CA GLY A 65 -5.245 -15.504 -14.925 1.00 0.00 C ATOM 1058 C GLY A 65 -6.174 -15.658 -13.748 1.00 0.00 C ATOM 1059 O GLY A 65 -6.889 -16.646 -13.696 1.00 0.00 O ATOM 0 H GLY A 65 -3.521 -14.783 -13.966 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -5.402 -14.540 -15.408 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.448 -16.272 -15.672 1.00 0.00 H new ATOM 1063 N VAL A 66 -6.168 -14.687 -12.799 1.00 0.00 N ATOM 1064 CA VAL A 66 -7.073 -14.761 -11.645 1.00 0.00 C ATOM 1065 C VAL A 66 -7.758 -13.428 -11.476 1.00 0.00 C ATOM 1066 O VAL A 66 -7.092 -12.457 -11.799 1.00 0.00 O ATOM 1067 CB VAL A 66 -6.238 -15.081 -10.376 1.00 0.00 C ATOM 1068 CG1 VAL A 66 -6.952 -14.689 -9.059 1.00 0.00 C ATOM 1069 CG2 VAL A 66 -5.864 -16.587 -10.344 1.00 0.00 C ATOM 0 H VAL A 66 -5.560 -13.868 -12.816 1.00 0.00 H new ATOM 0 HA VAL A 66 -7.821 -15.539 -11.798 1.00 0.00 H new ATOM 0 HB VAL A 66 -5.336 -14.473 -10.440 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -6.314 -14.939 -8.211 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -7.152 -13.618 -9.059 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -7.893 -15.234 -8.979 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.279 -16.798 -9.449 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -6.774 -17.188 -10.332 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -5.277 -16.835 -11.228 1.00 0.00 H new ATOM 1079 N THR A 67 -9.027 -13.411 -10.973 1.00 0.00 N ATOM 1080 CA THR A 67 -9.805 -12.181 -10.790 1.00 0.00 C ATOM 1081 C THR A 67 -9.775 -11.754 -9.339 1.00 0.00 C ATOM 1082 O THR A 67 -9.647 -12.622 -8.490 1.00 0.00 O ATOM 1083 CB THR A 67 -11.295 -12.397 -11.198 1.00 0.00 C ATOM 1084 OG1 THR A 67 -11.412 -12.966 -12.514 1.00 0.00 O ATOM 1085 CG2 THR A 67 -12.113 -11.077 -11.203 1.00 0.00 C ATOM 0 H THR A 67 -9.524 -14.255 -10.688 1.00 0.00 H new ATOM 0 HA THR A 67 -9.358 -11.414 -11.422 1.00 0.00 H new ATOM 0 HB THR A 67 -11.693 -13.077 -10.445 1.00 0.00 H new ATOM 0 HG1 THR A 67 -12.359 -13.088 -12.734 1.00 0.00 H new ATOM 0 HG21 THR A 67 -13.142 -11.288 -11.494 1.00 0.00 H new ATOM 0 HG22 THR A 67 -12.101 -10.638 -10.206 1.00 0.00 H new ATOM 0 HG23 THR A 67 -11.671 -10.378 -11.913 1.00 0.00 H new ATOM 1093 N PHE A 68 -9.899 -10.437 -9.035 1.00 0.00 N ATOM 1094 CA PHE A 68 -9.841 -9.980 -7.644 1.00 0.00 C ATOM 1095 C PHE A 68 -10.295 -8.550 -7.491 1.00 0.00 C ATOM 1096 O PHE A 68 -10.478 -7.907 -8.511 1.00 0.00 O ATOM 1097 CB PHE A 68 -8.361 -10.047 -7.211 1.00 0.00 C ATOM 1098 CG PHE A 68 -7.513 -9.337 -8.277 1.00 0.00 C ATOM 1099 CD1 PHE A 68 -7.432 -7.940 -8.281 1.00 0.00 C ATOM 1100 CD2 PHE A 68 -6.835 -10.060 -9.266 1.00 0.00 C ATOM 1101 CE1 PHE A 68 -6.818 -7.272 -9.344 1.00 0.00 C ATOM 1102 CE2 PHE A 68 -6.208 -9.394 -10.322 1.00 0.00 C ATOM 1103 CZ PHE A 68 -6.257 -8.000 -10.397 1.00 0.00 C ATOM 0 H PHE A 68 -10.036 -9.697 -9.724 1.00 0.00 H new ATOM 0 HA PHE A 68 -10.497 -10.609 -7.042 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -8.228 -9.570 -6.240 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -8.044 -11.084 -7.103 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.846 -7.375 -7.459 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -6.797 -11.138 -9.212 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -6.777 -6.193 -9.352 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -5.685 -9.957 -11.081 1.00 0.00 H new ATOM 0 HZ PHE A 68 -5.864 -7.488 -11.263 1.00 0.00 H new ATOM 1113 N ASN A 69 -10.459 -8.045 -6.240 1.00 0.00 N ATOM 1114 CA ASN A 69 -10.877 -6.659 -6.046 1.00 0.00 C ATOM 1115 C ASN A 69 -9.687 -5.741 -5.905 1.00 0.00 C ATOM 1116 O ASN A 69 -8.721 -6.137 -5.274 1.00 0.00 O ATOM 1117 CB ASN A 69 -11.772 -6.474 -4.794 1.00 0.00 C ATOM 1118 CG ASN A 69 -12.467 -5.127 -4.829 1.00 0.00 C ATOM 1119 OD1 ASN A 69 -11.834 -4.133 -4.510 1.00 0.00 O ATOM 1120 ND2 ASN A 69 -13.760 -5.057 -5.220 1.00 0.00 N ATOM 0 H ASN A 69 -10.309 -8.573 -5.380 1.00 0.00 H new ATOM 0 HA ASN A 69 -11.453 -6.403 -6.935 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -12.514 -7.271 -4.750 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -11.165 -6.553 -3.892 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -14.234 -4.155 -5.255 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -14.261 -5.907 -5.480 1.00 0.00 H new ATOM 1127 N TYR A 70 -9.764 -4.510 -6.462 1.00 0.00 N ATOM 1128 CA TYR A 70 -8.748 -3.490 -6.204 1.00 0.00 C ATOM 1129 C TYR A 70 -9.588 -2.379 -5.613 1.00 0.00 C ATOM 1130 O TYR A 70 -10.258 -1.678 -6.357 1.00 0.00 O ATOM 1131 CB TYR A 70 -8.027 -3.255 -7.557 1.00 0.00 C ATOM 1132 CG TYR A 70 -7.116 -2.019 -7.691 1.00 0.00 C ATOM 1133 CD1 TYR A 70 -7.646 -0.729 -7.813 1.00 0.00 C ATOM 1134 CD2 TYR A 70 -5.724 -2.169 -7.744 1.00 0.00 C ATOM 1135 CE1 TYR A 70 -6.827 0.357 -8.131 1.00 0.00 C ATOM 1136 CE2 TYR A 70 -4.898 -1.084 -8.050 1.00 0.00 C ATOM 1137 CZ TYR A 70 -5.450 0.187 -8.260 1.00 0.00 C ATOM 1138 OH TYR A 70 -4.653 1.288 -8.593 1.00 0.00 O ATOM 0 H TYR A 70 -10.514 -4.211 -7.085 1.00 0.00 H new ATOM 0 HA TYR A 70 -7.926 -3.687 -5.515 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -7.424 -4.138 -7.771 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -8.789 -3.193 -8.334 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -8.703 -0.571 -7.659 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -5.284 -3.135 -7.546 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -7.264 1.334 -8.278 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -3.830 -1.226 -8.125 1.00 0.00 H new ATOM 0 HH TYR A 70 -3.715 1.009 -8.645 1.00 0.00 H new ATOM 1148 N ASN A 71 -9.608 -2.254 -4.264 1.00 0.00 N ATOM 1149 CA ASN A 71 -10.413 -1.218 -3.624 1.00 0.00 C ATOM 1150 C ASN A 71 -9.525 -0.008 -3.491 1.00 0.00 C ATOM 1151 O ASN A 71 -8.530 -0.102 -2.788 1.00 0.00 O ATOM 1152 CB ASN A 71 -10.895 -1.635 -2.207 1.00 0.00 C ATOM 1153 CG ASN A 71 -11.536 -0.484 -1.464 1.00 0.00 C ATOM 1154 OD1 ASN A 71 -10.954 -0.002 -0.504 1.00 0.00 O ATOM 1155 ND2 ASN A 71 -12.734 -0.021 -1.877 1.00 0.00 N ATOM 0 H ASN A 71 -9.085 -2.849 -3.622 1.00 0.00 H new ATOM 0 HA ASN A 71 -11.302 -1.031 -4.226 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -11.610 -2.453 -2.294 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -10.048 -2.011 -1.632 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -13.179 0.753 -1.384 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -13.195 -0.445 -2.682 1.00 0.00 H new ATOM 1162 N LEU A 72 -9.858 1.137 -4.129 1.00 0.00 N ATOM 1163 CA LEU A 72 -9.077 2.344 -3.870 1.00 0.00 C ATOM 1164 C LEU A 72 -9.394 2.790 -2.456 1.00 0.00 C ATOM 1165 O LEU A 72 -10.318 2.258 -1.863 1.00 0.00 O ATOM 1166 CB LEU A 72 -9.396 3.497 -4.848 1.00 0.00 C ATOM 1167 CG LEU A 72 -8.684 3.312 -6.214 1.00 0.00 C ATOM 1168 CD1 LEU A 72 -9.503 4.047 -7.294 1.00 0.00 C ATOM 1169 CD2 LEU A 72 -7.245 3.896 -6.190 1.00 0.00 C ATOM 0 H LEU A 72 -10.625 1.241 -4.793 1.00 0.00 H new ATOM 0 HA LEU A 72 -8.022 2.106 -4.006 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -10.473 3.552 -5.005 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -9.090 4.444 -4.404 1.00 0.00 H new ATOM 0 HG LEU A 72 -8.614 2.246 -6.428 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -9.017 3.928 -8.263 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -10.508 3.627 -7.338 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -9.564 5.107 -7.046 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -6.776 3.749 -7.163 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -7.289 4.962 -5.966 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -6.659 3.388 -5.424 1.00 0.00 H new ATOM 1181 N ALA A 73 -8.648 3.767 -1.897 1.00 0.00 N ATOM 1182 CA ALA A 73 -8.886 4.178 -0.509 1.00 0.00 C ATOM 1183 C ALA A 73 -10.033 5.143 -0.369 1.00 0.00 C ATOM 1184 O ALA A 73 -10.777 5.068 0.596 1.00 0.00 O ATOM 1185 CB ALA A 73 -7.700 4.945 0.126 1.00 0.00 C ATOM 0 H ALA A 73 -7.899 4.269 -2.374 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.071 3.224 -0.015 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -7.949 5.216 1.152 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.813 4.311 0.123 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -7.501 5.849 -0.450 1.00 0.00 H new ATOM 1191 N ASP A 74 -10.117 6.095 -1.322 1.00 0.00 N ATOM 1192 CA ASP A 74 -10.975 7.258 -1.136 1.00 0.00 C ATOM 1193 C ASP A 74 -12.370 6.740 -0.909 1.00 0.00 C ATOM 1194 O ASP A 74 -13.053 7.209 -0.012 1.00 0.00 O ATOM 1195 CB ASP A 74 -10.874 8.184 -2.374 1.00 0.00 C ATOM 1196 CG ASP A 74 -9.435 8.538 -2.659 1.00 0.00 C ATOM 1197 OD1 ASP A 74 -8.700 8.879 -1.693 1.00 0.00 O ATOM 1198 OD2 ASP A 74 -9.022 8.460 -3.849 1.00 0.00 O ATOM 0 H ASP A 74 -9.609 6.073 -2.206 1.00 0.00 H new ATOM 0 HA ASP A 74 -10.674 7.860 -0.279 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -11.311 7.689 -3.241 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -11.450 9.093 -2.202 1.00 0.00 H new ATOM 1203 N GLY A 75 -12.760 5.726 -1.712 1.00 0.00 N ATOM 1204 CA GLY A 75 -13.976 4.976 -1.421 1.00 0.00 C ATOM 1205 C GLY A 75 -14.578 4.585 -2.745 1.00 0.00 C ATOM 1206 O GLY A 75 -15.611 5.105 -3.137 1.00 0.00 O ATOM 0 H GLY A 75 -12.256 5.422 -2.545 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -13.751 4.093 -0.824 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -14.674 5.582 -0.843 1.00 0.00 H new ATOM 1210 N THR A 76 -13.867 3.687 -3.458 1.00 0.00 N ATOM 1211 CA THR A 76 -14.160 3.436 -4.864 1.00 0.00 C ATOM 1212 C THR A 76 -13.610 2.069 -5.153 1.00 0.00 C ATOM 1213 O THR A 76 -12.818 1.575 -4.366 1.00 0.00 O ATOM 1214 CB THR A 76 -13.399 4.497 -5.698 1.00 0.00 C ATOM 1215 OG1 THR A 76 -13.945 5.822 -5.561 1.00 0.00 O ATOM 1216 CG2 THR A 76 -13.266 4.204 -7.208 1.00 0.00 C ATOM 0 H THR A 76 -13.097 3.135 -3.079 1.00 0.00 H new ATOM 0 HA THR A 76 -15.223 3.490 -5.099 1.00 0.00 H new ATOM 0 HB THR A 76 -12.402 4.439 -5.260 1.00 0.00 H new ATOM 0 HG1 THR A 76 -13.425 6.448 -6.107 1.00 0.00 H new ATOM 0 HG21 THR A 76 -12.716 5.013 -7.689 1.00 0.00 H new ATOM 0 HG22 THR A 76 -12.729 3.266 -7.351 1.00 0.00 H new ATOM 0 HG23 THR A 76 -14.258 4.126 -7.652 1.00 0.00 H new ATOM 1224 N GLU A 77 -14.044 1.448 -6.263 1.00 0.00 N ATOM 1225 CA GLU A 77 -13.741 0.060 -6.460 1.00 0.00 C ATOM 1226 C GLU A 77 -13.706 -0.365 -7.917 1.00 0.00 C ATOM 1227 O GLU A 77 -14.609 0.006 -8.650 1.00 0.00 O ATOM 1228 CB GLU A 77 -14.862 -0.641 -5.646 1.00 0.00 C ATOM 1229 CG GLU A 77 -16.237 0.085 -5.537 1.00 0.00 C ATOM 1230 CD GLU A 77 -17.292 -0.769 -4.876 1.00 0.00 C ATOM 1231 OE1 GLU A 77 -16.930 -1.663 -4.064 1.00 0.00 O ATOM 1232 OE2 GLU A 77 -18.501 -0.547 -5.159 1.00 0.00 O ATOM 0 H GLU A 77 -14.588 1.887 -7.005 1.00 0.00 H new ATOM 0 HA GLU A 77 -12.735 -0.201 -6.131 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -15.034 -1.622 -6.088 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -14.489 -0.808 -4.635 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -16.113 1.007 -4.970 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -16.575 0.367 -6.534 1.00 0.00 H new ATOM 1239 N LEU A 78 -12.692 -1.176 -8.327 1.00 0.00 N ATOM 1240 CA LEU A 78 -12.761 -1.903 -9.599 1.00 0.00 C ATOM 1241 C LEU A 78 -12.263 -3.292 -9.323 1.00 0.00 C ATOM 1242 O LEU A 78 -11.454 -3.437 -8.421 1.00 0.00 O ATOM 1243 CB LEU A 78 -12.047 -1.413 -10.910 1.00 0.00 C ATOM 1244 CG LEU A 78 -10.877 -0.390 -10.858 1.00 0.00 C ATOM 1245 CD1 LEU A 78 -11.216 0.742 -9.884 1.00 0.00 C ATOM 1246 CD2 LEU A 78 -9.446 -0.915 -10.606 1.00 0.00 C ATOM 0 H LEU A 78 -11.836 -1.333 -7.796 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.806 -1.755 -9.871 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -11.671 -2.301 -11.418 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -12.817 -0.983 -11.550 1.00 0.00 H new ATOM 0 HG LEU A 78 -10.813 -0.042 -11.889 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -10.392 1.454 -9.853 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -12.122 1.249 -10.217 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -11.376 0.329 -8.888 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -8.747 -0.078 -10.599 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -9.410 -1.426 -9.644 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -9.169 -1.612 -11.397 1.00 0.00 H new ATOM 1258 N ARG A 79 -12.728 -4.297 -10.098 1.00 0.00 N ATOM 1259 CA ARG A 79 -12.169 -5.635 -9.962 1.00 0.00 C ATOM 1260 C ARG A 79 -11.451 -5.958 -11.222 1.00 0.00 C ATOM 1261 O ARG A 79 -11.859 -5.398 -12.224 1.00 0.00 O ATOM 1262 CB ARG A 79 -13.244 -6.735 -9.831 1.00 0.00 C ATOM 1263 CG ARG A 79 -14.151 -6.421 -8.622 1.00 0.00 C ATOM 1264 CD ARG A 79 -14.824 -7.722 -8.094 1.00 0.00 C ATOM 1265 NE ARG A 79 -15.838 -8.187 -9.048 1.00 0.00 N ATOM 1266 CZ ARG A 79 -16.649 -9.202 -8.825 1.00 0.00 C ATOM 1267 NH1 ARG A 79 -16.597 -9.921 -7.729 1.00 0.00 N ATOM 1268 NH2 ARG A 79 -17.548 -9.504 -9.736 1.00 0.00 N ATOM 0 H ARG A 79 -13.464 -4.202 -10.798 1.00 0.00 H new ATOM 0 HA ARG A 79 -11.546 -5.623 -9.068 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -13.839 -6.788 -10.743 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -12.771 -7.708 -9.702 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -13.563 -5.961 -7.828 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -14.916 -5.700 -8.911 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -14.071 -8.496 -7.945 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -15.285 -7.535 -7.124 1.00 0.00 H new ATOM 0 HE ARG A 79 -15.920 -7.695 -9.938 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -15.909 -9.703 -7.008 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -17.244 -10.698 -7.598 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -17.608 -8.957 -10.595 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -18.186 -10.286 -9.584 1.00 0.00 H new ATOM 1282 N GLY A 80 -10.443 -6.855 -11.193 1.00 0.00 N ATOM 1283 CA GLY A 80 -9.811 -7.209 -12.444 1.00 0.00 C ATOM 1284 C GLY A 80 -8.948 -8.423 -12.379 1.00 0.00 C ATOM 1285 O GLY A 80 -8.828 -9.012 -11.318 1.00 0.00 O ATOM 0 H GLY A 80 -10.078 -7.315 -10.359 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -10.585 -7.369 -13.195 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -9.207 -6.367 -12.782 1.00 0.00 H new ATOM 1289 N THR A 81 -8.373 -8.760 -13.554 1.00 0.00 N ATOM 1290 CA THR A 81 -7.586 -9.963 -13.700 1.00 0.00 C ATOM 1291 C THR A 81 -6.161 -9.614 -13.981 1.00 0.00 C ATOM 1292 O THR A 81 -5.911 -8.491 -14.394 1.00 0.00 O ATOM 1293 CB THR A 81 -8.120 -10.800 -14.896 1.00 0.00 C ATOM 1294 OG1 THR A 81 -8.026 -10.058 -16.126 1.00 0.00 O ATOM 1295 CG2 THR A 81 -9.614 -11.150 -14.694 1.00 0.00 C ATOM 0 H THR A 81 -8.450 -8.203 -14.405 1.00 0.00 H new ATOM 0 HA THR A 81 -7.657 -10.534 -12.774 1.00 0.00 H new ATOM 0 HB THR A 81 -7.513 -11.704 -14.946 1.00 0.00 H new ATOM 0 HG1 THR A 81 -8.366 -10.605 -16.865 1.00 0.00 H new ATOM 0 HG21 THR A 81 -9.968 -11.736 -15.542 1.00 0.00 H new ATOM 0 HG22 THR A 81 -9.731 -11.729 -13.778 1.00 0.00 H new ATOM 0 HG23 THR A 81 -10.196 -10.231 -14.619 1.00 0.00 H new ATOM 1303 N TRP A 82 -5.248 -10.595 -13.800 1.00 0.00 N ATOM 1304 CA TRP A 82 -3.932 -10.466 -14.375 1.00 0.00 C ATOM 1305 C TRP A 82 -3.475 -11.798 -14.916 1.00 0.00 C ATOM 1306 O TRP A 82 -3.866 -12.807 -14.339 1.00 0.00 O ATOM 1307 CB TRP A 82 -2.961 -10.018 -13.263 1.00 0.00 C ATOM 1308 CG TRP A 82 -2.974 -8.534 -13.052 1.00 0.00 C ATOM 1309 CD1 TRP A 82 -3.283 -7.804 -11.974 1.00 0.00 C ATOM 1310 CD2 TRP A 82 -2.578 -7.537 -14.092 1.00 0.00 C ATOM 1311 NE1 TRP A 82 -3.099 -6.528 -12.203 1.00 0.00 N ATOM 1312 CE2 TRP A 82 -2.648 -6.326 -13.457 1.00 0.00 C ATOM 1313 CE3 TRP A 82 -2.184 -7.657 -15.407 1.00 0.00 C ATOM 1314 CZ2 TRP A 82 -2.248 -5.185 -14.143 1.00 0.00 C ATOM 1315 CZ3 TRP A 82 -1.714 -6.527 -16.072 1.00 0.00 C ATOM 1316 CH2 TRP A 82 -1.834 -5.274 -15.471 1.00 0.00 C ATOM 0 H TRP A 82 -5.411 -11.453 -13.273 1.00 0.00 H new ATOM 0 HA TRP A 82 -3.953 -9.739 -15.187 1.00 0.00 H new ATOM 0 HB2 TRP A 82 -3.227 -10.516 -12.331 1.00 0.00 H new ATOM 0 HB3 TRP A 82 -1.950 -10.337 -13.518 1.00 0.00 H new ATOM 0 HD1 TRP A 82 -3.637 -8.213 -11.039 1.00 0.00 H new ATOM 0 HE1 TRP A 82 -3.273 -5.787 -11.524 1.00 0.00 H new ATOM 0 HE3 TRP A 82 -2.239 -8.610 -15.913 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 -2.258 -4.227 -13.645 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 -1.259 -6.620 -17.047 1.00 0.00 H new ATOM 0 HH2 TRP A 82 -1.608 -4.379 -16.031 1.00 0.00 H new ATOM 1327 N SER A 83 -2.643 -11.776 -15.993 1.00 0.00 N ATOM 1328 CA SER A 83 -2.023 -13.025 -16.442 1.00 0.00 C ATOM 1329 C SER A 83 -0.680 -12.648 -16.976 1.00 0.00 C ATOM 1330 O SER A 83 -0.591 -12.167 -18.096 1.00 0.00 O ATOM 1331 CB SER A 83 -2.881 -13.787 -17.478 1.00 0.00 C ATOM 1332 OG SER A 83 -2.237 -14.983 -17.942 1.00 0.00 O ATOM 0 H SER A 83 -2.403 -10.945 -16.534 1.00 0.00 H new ATOM 0 HA SER A 83 -1.932 -13.728 -15.614 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.842 -14.044 -17.033 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.087 -13.135 -18.327 1.00 0.00 H new ATOM 0 HG SER A 83 -2.814 -15.434 -18.593 1.00 0.00 H new ATOM 1338 N LEU A 84 0.360 -12.879 -16.141 1.00 0.00 N ATOM 1339 CA LEU A 84 1.697 -12.693 -16.634 1.00 0.00 C ATOM 1340 C LEU A 84 1.848 -13.664 -17.778 1.00 0.00 C ATOM 1341 O LEU A 84 1.333 -14.768 -17.682 1.00 0.00 O ATOM 1342 CB LEU A 84 2.727 -12.686 -15.472 1.00 0.00 C ATOM 1343 CG LEU A 84 4.155 -12.461 -16.047 1.00 0.00 C ATOM 1344 CD1 LEU A 84 5.179 -11.674 -15.166 1.00 0.00 C ATOM 1345 CD2 LEU A 84 4.660 -13.871 -16.365 1.00 0.00 C ATOM 0 H LEU A 84 0.283 -13.180 -15.170 1.00 0.00 H new ATOM 0 HA LEU A 84 1.910 -11.712 -17.059 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.482 -11.899 -14.759 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.686 -13.631 -14.930 1.00 0.00 H new ATOM 0 HG LEU A 84 4.076 -11.795 -16.906 1.00 0.00 H new ATOM 0 HD11 LEU A 84 6.129 -11.595 -15.695 1.00 0.00 H new ATOM 0 HD12 LEU A 84 4.792 -10.675 -14.963 1.00 0.00 H new ATOM 0 HD13 LEU A 84 5.331 -12.202 -14.225 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.667 -13.812 -16.778 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.677 -14.466 -15.452 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.996 -14.340 -17.092 1.00 0.00 H new ATOM 1357 N GLU A 85 2.528 -13.252 -18.873 1.00 0.00 N ATOM 1358 CA GLU A 85 2.554 -14.072 -20.076 1.00 0.00 C ATOM 1359 C GLU A 85 3.744 -13.693 -20.926 1.00 0.00 C ATOM 1360 O GLU A 85 4.324 -12.647 -20.671 1.00 0.00 O ATOM 1361 CB GLU A 85 1.217 -13.779 -20.805 1.00 0.00 C ATOM 1362 CG GLU A 85 1.152 -12.318 -21.335 1.00 0.00 C ATOM 1363 CD GLU A 85 -0.245 -11.896 -21.716 1.00 0.00 C ATOM 1364 OE1 GLU A 85 -1.217 -12.355 -21.060 1.00 0.00 O ATOM 1365 OE2 GLU A 85 -0.386 -11.101 -22.684 1.00 0.00 O ATOM 0 H GLU A 85 3.049 -12.377 -18.936 1.00 0.00 H new ATOM 0 HA GLU A 85 2.652 -15.135 -19.857 1.00 0.00 H new ATOM 0 HB2 GLU A 85 1.098 -14.473 -21.637 1.00 0.00 H new ATOM 0 HB3 GLU A 85 0.386 -13.955 -20.122 1.00 0.00 H new ATOM 0 HG2 GLU A 85 1.535 -11.642 -20.571 1.00 0.00 H new ATOM 0 HG3 GLU A 85 1.805 -12.222 -22.202 1.00 0.00 H new ATOM 1372 N GLY A 86 4.115 -14.517 -21.934 1.00 0.00 N ATOM 1373 CA GLY A 86 5.246 -14.155 -22.785 1.00 0.00 C ATOM 1374 C GLY A 86 5.062 -12.729 -23.236 1.00 0.00 C ATOM 1375 O GLY A 86 5.970 -11.925 -23.088 1.00 0.00 O ATOM 0 H GLY A 86 3.661 -15.401 -22.164 1.00 0.00 H new ATOM 0 HA2 GLY A 86 6.182 -14.262 -22.238 1.00 0.00 H new ATOM 0 HA3 GLY A 86 5.302 -14.821 -23.646 1.00 0.00 H new ATOM 1379 N ASN A 87 3.859 -12.412 -23.765 1.00 0.00 N ATOM 1380 CA ASN A 87 3.538 -11.034 -24.121 1.00 0.00 C ATOM 1381 C ASN A 87 3.022 -10.220 -22.945 1.00 0.00 C ATOM 1382 O ASN A 87 1.939 -9.678 -23.096 1.00 0.00 O ATOM 1383 CB ASN A 87 2.527 -11.014 -25.306 1.00 0.00 C ATOM 1384 CG ASN A 87 3.069 -11.786 -26.487 1.00 0.00 C ATOM 1385 OD1 ASN A 87 3.870 -11.231 -27.222 1.00 0.00 O ATOM 1386 ND2 ASN A 87 2.667 -13.059 -26.700 1.00 0.00 N ATOM 0 H ASN A 87 3.115 -13.085 -23.948 1.00 0.00 H new ATOM 0 HA ASN A 87 4.467 -10.555 -24.431 1.00 0.00 H new ATOM 0 HB2 ASN A 87 1.578 -11.446 -24.988 1.00 0.00 H new ATOM 0 HB3 ASN A 87 2.325 -9.984 -25.601 1.00 0.00 H new ATOM 0 HD21 ASN A 87 3.035 -13.584 -27.494 1.00 0.00 H new ATOM 0 HD22 ASN A 87 1.996 -13.495 -26.067 1.00 0.00 H new ATOM 1393 N LYS A 88 3.769 -10.073 -21.813 1.00 0.00 N ATOM 1394 CA LYS A 88 3.570 -8.930 -20.901 1.00 0.00 C ATOM 1395 C LYS A 88 2.279 -8.995 -20.154 1.00 0.00 C ATOM 1396 O LYS A 88 1.267 -9.228 -20.793 1.00 0.00 O ATOM 1397 CB LYS A 88 3.607 -7.619 -21.731 1.00 0.00 C ATOM 1398 CG LYS A 88 4.956 -7.624 -22.483 1.00 0.00 C ATOM 1399 CD LYS A 88 4.985 -6.712 -23.737 1.00 0.00 C ATOM 1400 CE LYS A 88 4.917 -5.204 -23.388 1.00 0.00 C ATOM 1401 NZ LYS A 88 4.857 -4.365 -24.607 1.00 0.00 N ATOM 0 H LYS A 88 4.499 -10.724 -21.522 1.00 0.00 H new ATOM 0 HA LYS A 88 4.370 -8.960 -20.162 1.00 0.00 H new ATOM 0 HB2 LYS A 88 2.772 -7.577 -22.430 1.00 0.00 H new ATOM 0 HB3 LYS A 88 3.525 -6.746 -21.084 1.00 0.00 H new ATOM 0 HG2 LYS A 88 5.743 -7.307 -21.798 1.00 0.00 H new ATOM 0 HG3 LYS A 88 5.188 -8.645 -22.784 1.00 0.00 H new ATOM 0 HD2 LYS A 88 5.896 -6.908 -24.302 1.00 0.00 H new ATOM 0 HD3 LYS A 88 4.147 -6.968 -24.385 1.00 0.00 H new ATOM 0 HE2 LYS A 88 4.040 -5.012 -22.770 1.00 0.00 H new ATOM 0 HE3 LYS A 88 5.790 -4.927 -22.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 4.812 -3.362 -24.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 5.706 -4.530 -25.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 4.010 -4.613 -25.158 1.00 0.00 H new ATOM 1415 N LEU A 89 2.273 -8.797 -18.816 1.00 0.00 N ATOM 1416 CA LEU A 89 1.047 -9.074 -18.124 1.00 0.00 C ATOM 1417 C LEU A 89 -0.061 -8.359 -18.824 1.00 0.00 C ATOM 1418 O LEU A 89 0.072 -7.158 -19.009 1.00 0.00 O ATOM 1419 CB LEU A 89 0.820 -8.596 -16.682 1.00 0.00 C ATOM 1420 CG LEU A 89 1.312 -9.397 -15.477 1.00 0.00 C ATOM 1421 CD1 LEU A 89 2.827 -9.313 -15.464 1.00 0.00 C ATOM 1422 CD2 LEU A 89 0.860 -8.782 -14.150 1.00 0.00 C ATOM 0 H LEU A 89 3.055 -8.470 -18.249 1.00 0.00 H new ATOM 0 HA LEU A 89 1.086 -10.163 -18.110 1.00 0.00 H new ATOM 0 HB2 LEU A 89 1.268 -7.605 -16.605 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -0.256 -8.470 -16.558 1.00 0.00 H new ATOM 0 HG LEU A 89 0.919 -10.410 -15.567 1.00 0.00 H new ATOM 0 HD11 LEU A 89 3.215 -9.875 -14.615 1.00 0.00 H new ATOM 0 HD12 LEU A 89 3.223 -9.733 -16.389 1.00 0.00 H new ATOM 0 HD13 LEU A 89 3.133 -8.270 -15.379 1.00 0.00 H new ATOM 0 HD21 LEU A 89 1.234 -9.386 -13.323 1.00 0.00 H new ATOM 0 HD22 LEU A 89 1.253 -7.769 -14.066 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -0.229 -8.753 -14.115 1.00 0.00 H new ATOM 1434 N ILE A 90 -1.125 -9.143 -19.112 1.00 0.00 N ATOM 1435 CA ILE A 90 -2.352 -8.540 -19.579 1.00 0.00 C ATOM 1436 C ILE A 90 -3.244 -8.465 -18.382 1.00 0.00 C ATOM 1437 O ILE A 90 -3.504 -9.507 -17.803 1.00 0.00 O ATOM 1438 CB ILE A 90 -3.008 -9.395 -20.702 1.00 0.00 C ATOM 1439 CG1 ILE A 90 -4.029 -8.525 -21.480 1.00 0.00 C ATOM 1440 CG2 ILE A 90 -3.674 -10.725 -20.249 1.00 0.00 C ATOM 1441 CD1 ILE A 90 -4.589 -9.208 -22.755 1.00 0.00 C ATOM 0 H ILE A 90 -1.142 -10.159 -19.027 1.00 0.00 H new ATOM 0 HA ILE A 90 -2.171 -7.556 -20.011 1.00 0.00 H new ATOM 0 HB ILE A 90 -2.181 -9.712 -21.337 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -4.859 -8.276 -20.818 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -3.552 -7.586 -21.761 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -4.096 -11.234 -21.115 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -2.926 -11.365 -19.781 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -4.467 -10.509 -19.533 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -5.296 -8.539 -23.245 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -3.769 -9.433 -23.437 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -5.096 -10.133 -22.480 1.00 0.00 H new ATOM 1453 N GLY A 91 -3.715 -7.258 -18.003 1.00 0.00 N ATOM 1454 CA GLY A 91 -4.737 -7.194 -16.975 1.00 0.00 C ATOM 1455 C GLY A 91 -5.960 -6.561 -17.540 1.00 0.00 C ATOM 1456 O GLY A 91 -5.930 -6.004 -18.626 1.00 0.00 O ATOM 0 H GLY A 91 -3.412 -6.361 -18.382 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -4.966 -8.195 -16.611 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -4.376 -6.619 -16.122 1.00 0.00 H new ATOM 1460 N LYS A 92 -7.049 -6.701 -16.762 1.00 0.00 N ATOM 1461 CA LYS A 92 -8.353 -6.383 -17.315 1.00 0.00 C ATOM 1462 C LYS A 92 -9.271 -6.086 -16.163 1.00 0.00 C ATOM 1463 O LYS A 92 -9.382 -6.942 -15.304 1.00 0.00 O ATOM 1464 CB LYS A 92 -8.858 -7.617 -18.111 1.00 0.00 C ATOM 1465 CG LYS A 92 -9.668 -7.212 -19.366 1.00 0.00 C ATOM 1466 CD LYS A 92 -10.741 -6.126 -19.082 1.00 0.00 C ATOM 1467 CE LYS A 92 -11.771 -6.092 -20.245 1.00 0.00 C ATOM 1468 NZ LYS A 92 -11.139 -5.991 -21.582 1.00 0.00 N ATOM 0 H LYS A 92 -7.045 -7.019 -15.793 1.00 0.00 H new ATOM 0 HA LYS A 92 -8.313 -5.523 -17.984 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -8.006 -8.227 -18.412 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -9.480 -8.235 -17.463 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -8.982 -6.844 -20.129 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -10.156 -8.096 -19.776 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -11.248 -6.339 -18.141 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -10.266 -5.151 -18.975 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -12.383 -6.993 -20.207 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -12.442 -5.245 -20.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -11.682 -5.330 -22.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -10.164 -5.644 -21.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -11.127 -6.928 -22.032 1.00 0.00 H new ATOM 1482 N PHE A 93 -9.900 -4.898 -16.107 1.00 0.00 N ATOM 1483 CA PHE A 93 -10.577 -4.476 -14.893 1.00 0.00 C ATOM 1484 C PHE A 93 -11.967 -3.996 -15.159 1.00 0.00 C ATOM 1485 O PHE A 93 -12.334 -3.935 -16.320 1.00 0.00 O ATOM 1486 CB PHE A 93 -9.712 -3.369 -14.280 1.00 0.00 C ATOM 1487 CG PHE A 93 -8.562 -3.961 -13.497 1.00 0.00 C ATOM 1488 CD1 PHE A 93 -7.432 -4.520 -14.105 1.00 0.00 C ATOM 1489 CD2 PHE A 93 -8.639 -3.950 -12.099 1.00 0.00 C ATOM 1490 CE1 PHE A 93 -6.410 -5.059 -13.314 1.00 0.00 C ATOM 1491 CE2 PHE A 93 -7.510 -4.239 -11.333 1.00 0.00 C ATOM 1492 CZ PHE A 93 -6.389 -4.800 -11.943 1.00 0.00 C ATOM 0 H PHE A 93 -9.947 -4.233 -16.879 1.00 0.00 H new ATOM 0 HA PHE A 93 -10.689 -5.316 -14.208 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -9.327 -2.723 -15.069 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -10.321 -2.745 -13.626 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -7.349 -4.536 -15.182 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -9.575 -3.717 -11.613 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -5.642 -5.672 -13.763 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -7.504 -4.029 -10.274 1.00 0.00 H new ATOM 0 HZ PHE A 93 -5.511 -5.032 -11.359 1.00 0.00 H new ATOM 1502 N LYS A 94 -12.725 -3.614 -14.104 1.00 0.00 N ATOM 1503 CA LYS A 94 -13.903 -2.817 -14.373 1.00 0.00 C ATOM 1504 C LYS A 94 -14.431 -2.077 -13.175 1.00 0.00 C ATOM 1505 O LYS A 94 -14.568 -2.672 -12.117 1.00 0.00 O ATOM 1506 CB LYS A 94 -15.099 -3.545 -15.061 1.00 0.00 C ATOM 1507 CG LYS A 94 -15.379 -4.907 -14.393 1.00 0.00 C ATOM 1508 CD LYS A 94 -16.792 -5.475 -14.717 1.00 0.00 C ATOM 1509 CE LYS A 94 -17.972 -4.792 -13.960 1.00 0.00 C ATOM 1510 NZ LYS A 94 -17.973 -5.057 -12.500 1.00 0.00 N ATOM 0 H LYS A 94 -12.544 -3.836 -13.125 1.00 0.00 H new ATOM 0 HA LYS A 94 -13.496 -2.113 -15.099 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -15.990 -2.919 -15.006 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -14.879 -3.693 -16.118 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -14.624 -5.624 -14.716 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -15.277 -4.802 -13.313 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -16.967 -5.382 -15.789 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -16.800 -6.540 -14.484 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -17.925 -3.716 -14.126 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -18.914 -5.139 -14.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -18.782 -4.574 -12.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -18.048 -6.081 -12.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -17.089 -4.702 -12.082 1.00 0.00 H new ATOM 1524 N ARG A 95 -14.747 -0.774 -13.382 1.00 0.00 N ATOM 1525 CA ARG A 95 -15.451 -0.015 -12.377 1.00 0.00 C ATOM 1526 C ARG A 95 -16.724 -0.767 -12.116 1.00 0.00 C ATOM 1527 O ARG A 95 -17.504 -0.954 -13.039 1.00 0.00 O ATOM 1528 CB ARG A 95 -15.843 1.388 -12.900 1.00 0.00 C ATOM 1529 CG ARG A 95 -14.655 2.356 -13.103 1.00 0.00 C ATOM 1530 CD ARG A 95 -14.113 2.850 -11.743 1.00 0.00 C ATOM 1531 NE ARG A 95 -14.919 3.886 -11.098 1.00 0.00 N ATOM 1532 CZ ARG A 95 -15.551 3.763 -9.951 1.00 0.00 C ATOM 1533 NH1 ARG A 95 -15.674 2.632 -9.291 1.00 0.00 N ATOM 1534 NH2 ARG A 95 -16.098 4.841 -9.430 1.00 0.00 N ATOM 0 H ARG A 95 -14.520 -0.254 -14.230 1.00 0.00 H new ATOM 0 HA ARG A 95 -14.823 0.108 -11.495 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -16.367 1.274 -13.849 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -16.546 1.839 -12.199 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -13.861 1.854 -13.656 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -14.972 3.208 -13.704 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -14.036 1.998 -11.068 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -13.103 3.234 -11.889 1.00 0.00 H new ATOM 0 HE ARG A 95 -14.998 4.782 -11.579 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -15.264 1.776 -9.665 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -16.179 2.611 -8.405 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -16.024 5.735 -9.915 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -16.596 4.782 -8.542 1.00 0.00 H new ATOM 1548 N THR A 96 -16.937 -1.173 -10.850 1.00 0.00 N ATOM 1549 CA THR A 96 -18.235 -1.690 -10.470 1.00 0.00 C ATOM 1550 C THR A 96 -19.126 -0.506 -10.175 1.00 0.00 C ATOM 1551 O THR A 96 -20.286 -0.766 -9.893 1.00 0.00 O ATOM 1552 CB THR A 96 -18.150 -2.722 -9.313 1.00 0.00 C ATOM 1553 OG1 THR A 96 -19.417 -3.381 -9.135 1.00 0.00 O ATOM 1554 CG2 THR A 96 -17.666 -2.123 -7.968 1.00 0.00 C ATOM 0 H THR A 96 -16.242 -1.149 -10.104 1.00 0.00 H new ATOM 0 HA THR A 96 -18.671 -2.264 -11.288 1.00 0.00 H new ATOM 0 HB THR A 96 -17.391 -3.445 -9.613 1.00 0.00 H new ATOM 0 HG1 THR A 96 -20.143 -2.759 -9.352 1.00 0.00 H new ATOM 0 HG21 THR A 96 -17.634 -2.907 -7.211 1.00 0.00 H new ATOM 0 HG22 THR A 96 -16.669 -1.701 -8.096 1.00 0.00 H new ATOM 0 HG23 THR A 96 -18.354 -1.340 -7.650 1.00 0.00 H new ATOM 1562 N ASP A 97 -18.656 0.771 -10.245 1.00 0.00 N ATOM 1563 CA ASP A 97 -19.604 1.874 -10.124 1.00 0.00 C ATOM 1564 C ASP A 97 -20.106 2.114 -11.526 1.00 0.00 C ATOM 1565 O ASP A 97 -21.088 1.503 -11.917 1.00 0.00 O ATOM 1566 CB ASP A 97 -19.020 3.058 -9.319 1.00 0.00 C ATOM 1567 CG ASP A 97 -19.904 4.274 -9.414 1.00 0.00 C ATOM 1568 OD1 ASP A 97 -20.896 4.350 -8.640 1.00 0.00 O ATOM 1569 OD2 ASP A 97 -19.613 5.162 -10.263 1.00 0.00 O ATOM 0 H ASP A 97 -17.680 1.036 -10.377 1.00 0.00 H new ATOM 0 HA ASP A 97 -20.476 1.662 -9.506 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -18.906 2.769 -8.274 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -18.025 3.299 -9.693 1.00 0.00 H new ATOM 1574 N ASN A 98 -19.410 2.973 -12.290 1.00 0.00 N ATOM 1575 CA ASN A 98 -19.662 3.123 -13.721 1.00 0.00 C ATOM 1576 C ASN A 98 -20.345 1.970 -14.423 1.00 0.00 C ATOM 1577 O ASN A 98 -21.337 2.210 -15.092 1.00 0.00 O ATOM 1578 CB ASN A 98 -18.280 3.226 -14.413 1.00 0.00 C ATOM 1579 CG ASN A 98 -18.083 4.418 -15.273 1.00 0.00 C ATOM 1580 OD1 ASN A 98 -18.581 4.490 -16.387 1.00 0.00 O ATOM 1581 ND2 ASN A 98 -17.286 5.345 -14.728 1.00 0.00 N ATOM 0 H ASN A 98 -18.667 3.573 -11.932 1.00 0.00 H new ATOM 0 HA ASN A 98 -20.324 3.985 -13.795 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -17.507 3.223 -13.644 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -18.130 2.333 -15.020 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -17.054 6.189 -15.251 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -16.911 5.207 -13.790 1.00 0.00 H new ATOM 1588 N GLY A 99 -19.798 0.731 -14.331 1.00 0.00 N ATOM 1589 CA GLY A 99 -20.226 -0.309 -15.261 1.00 0.00 C ATOM 1590 C GLY A 99 -19.440 -0.128 -16.539 1.00 0.00 C ATOM 1591 O GLY A 99 -20.011 0.098 -17.594 1.00 0.00 O ATOM 0 H GLY A 99 -19.093 0.449 -13.650 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.048 -1.298 -14.838 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -21.296 -0.233 -15.455 1.00 0.00 H new ATOM 1595 N ASN A 100 -18.098 -0.218 -16.429 1.00 0.00 N ATOM 1596 CA ASN A 100 -17.222 0.011 -17.579 1.00 0.00 C ATOM 1597 C ASN A 100 -15.890 -0.538 -17.190 1.00 0.00 C ATOM 1598 O ASN A 100 -15.621 -0.697 -16.010 1.00 0.00 O ATOM 1599 CB ASN A 100 -17.098 1.519 -17.932 1.00 0.00 C ATOM 1600 CG ASN A 100 -15.681 1.989 -17.915 1.00 0.00 C ATOM 1601 OD1 ASN A 100 -14.942 1.724 -18.851 1.00 0.00 O ATOM 1602 ND2 ASN A 100 -15.289 2.693 -16.852 1.00 0.00 N ATOM 0 H ASN A 100 -17.609 -0.445 -15.563 1.00 0.00 H new ATOM 0 HA ASN A 100 -17.628 -0.473 -18.467 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -17.525 1.695 -18.919 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -17.682 2.105 -17.222 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -14.331 3.038 -16.794 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -15.947 2.886 -16.097 1.00 0.00 H new ATOM 1609 N GLU A 101 -15.090 -0.845 -18.223 1.00 0.00 N ATOM 1610 CA GLU A 101 -13.964 -1.715 -18.015 1.00 0.00 C ATOM 1611 C GLU A 101 -12.712 -0.903 -18.127 1.00 0.00 C ATOM 1612 O GLU A 101 -12.760 0.244 -18.540 1.00 0.00 O ATOM 1613 CB GLU A 101 -14.129 -2.990 -18.885 1.00 0.00 C ATOM 1614 CG GLU A 101 -13.536 -2.645 -20.252 1.00 0.00 C ATOM 1615 CD GLU A 101 -13.885 -3.545 -21.409 1.00 0.00 C ATOM 1616 OE1 GLU A 101 -14.948 -4.218 -21.356 1.00 0.00 O ATOM 1617 OE2 GLU A 101 -13.087 -3.586 -22.385 1.00 0.00 O ATOM 0 H GLU A 101 -15.211 -0.506 -19.178 1.00 0.00 H new ATOM 0 HA GLU A 101 -13.896 -2.135 -17.011 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -13.611 -3.838 -18.437 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -15.179 -3.269 -18.974 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -13.847 -1.632 -20.508 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -12.451 -2.629 -20.154 1.00 0.00 H new ATOM 1624 N LEU A 102 -11.588 -1.520 -17.724 1.00 0.00 N ATOM 1625 CA LEU A 102 -10.340 -0.786 -17.652 1.00 0.00 C ATOM 1626 C LEU A 102 -9.286 -1.733 -18.164 1.00 0.00 C ATOM 1627 O LEU A 102 -9.077 -2.752 -17.528 1.00 0.00 O ATOM 1628 CB LEU A 102 -10.162 -0.348 -16.172 1.00 0.00 C ATOM 1629 CG LEU A 102 -8.682 -0.061 -15.816 1.00 0.00 C ATOM 1630 CD1 LEU A 102 -8.098 0.939 -16.821 1.00 0.00 C ATOM 1631 CD2 LEU A 102 -8.482 0.422 -14.361 1.00 0.00 C ATOM 0 H LEU A 102 -11.530 -2.501 -17.452 1.00 0.00 H new ATOM 0 HA LEU A 102 -10.290 0.123 -18.252 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -10.758 0.546 -15.986 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -10.546 -1.129 -15.516 1.00 0.00 H new ATOM 0 HG LEU A 102 -8.142 -1.006 -15.884 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -7.057 1.141 -16.570 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -8.155 0.520 -17.826 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -8.667 1.868 -16.782 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -7.423 0.604 -14.180 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -9.041 1.345 -14.204 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -8.842 -0.342 -13.671 1.00 0.00 H new ATOM 1643 N ASN A 103 -8.616 -1.434 -19.299 1.00 0.00 N ATOM 1644 CA ASN A 103 -7.579 -2.346 -19.766 1.00 0.00 C ATOM 1645 C ASN A 103 -6.286 -1.927 -19.111 1.00 0.00 C ATOM 1646 O ASN A 103 -6.058 -0.734 -19.001 1.00 0.00 O ATOM 1647 CB ASN A 103 -7.426 -2.308 -21.304 1.00 0.00 C ATOM 1648 CG ASN A 103 -8.522 -3.080 -21.994 1.00 0.00 C ATOM 1649 OD1 ASN A 103 -8.243 -4.119 -22.574 1.00 0.00 O ATOM 1650 ND2 ASN A 103 -9.778 -2.583 -21.951 1.00 0.00 N ATOM 0 H ASN A 103 -8.771 -0.607 -19.876 1.00 0.00 H new ATOM 0 HA ASN A 103 -7.849 -3.368 -19.501 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -7.440 -1.273 -21.645 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -6.458 -2.723 -21.583 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -10.539 -3.079 -22.415 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -9.965 -1.712 -21.455 1.00 0.00 H new ATOM 1657 N THR A 104 -5.437 -2.888 -18.677 1.00 0.00 N ATOM 1658 CA THR A 104 -4.189 -2.528 -18.009 1.00 0.00 C ATOM 1659 C THR A 104 -3.055 -3.438 -18.390 1.00 0.00 C ATOM 1660 O THR A 104 -3.322 -4.581 -18.722 1.00 0.00 O ATOM 1661 CB THR A 104 -4.333 -2.653 -16.475 1.00 0.00 C ATOM 1662 OG1 THR A 104 -4.587 -4.033 -16.175 1.00 0.00 O ATOM 1663 CG2 THR A 104 -5.517 -1.807 -15.963 1.00 0.00 C ATOM 0 H THR A 104 -5.597 -3.890 -18.779 1.00 0.00 H new ATOM 0 HA THR A 104 -3.977 -1.504 -18.318 1.00 0.00 H new ATOM 0 HB THR A 104 -3.423 -2.297 -15.992 1.00 0.00 H new ATOM 0 HG1 THR A 104 -3.767 -4.451 -15.838 1.00 0.00 H new ATOM 0 HG21 THR A 104 -5.598 -1.911 -14.881 1.00 0.00 H new ATOM 0 HG22 THR A 104 -5.352 -0.760 -16.215 1.00 0.00 H new ATOM 0 HG23 THR A 104 -6.439 -2.151 -16.431 1.00 0.00 H new ATOM 1671 N VAL A 105 -1.796 -2.943 -18.308 1.00 0.00 N ATOM 1672 CA VAL A 105 -0.638 -3.809 -18.502 1.00 0.00 C ATOM 1673 C VAL A 105 0.400 -3.542 -17.464 1.00 0.00 C ATOM 1674 O VAL A 105 0.462 -2.409 -17.030 1.00 0.00 O ATOM 1675 CB VAL A 105 -0.055 -3.726 -19.932 1.00 0.00 C ATOM 1676 CG1 VAL A 105 1.409 -4.223 -20.079 1.00 0.00 C ATOM 1677 CG2 VAL A 105 -0.972 -4.538 -20.864 1.00 0.00 C ATOM 0 H VAL A 105 -1.573 -1.967 -18.112 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.985 -4.836 -18.383 1.00 0.00 H new ATOM 0 HB VAL A 105 -0.020 -2.669 -20.195 1.00 0.00 H new ATOM 0 HG11 VAL A 105 1.724 -4.124 -21.118 1.00 0.00 H new ATOM 0 HG12 VAL A 105 2.062 -3.625 -19.443 1.00 0.00 H new ATOM 0 HG13 VAL A 105 1.470 -5.269 -19.780 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -0.584 -4.497 -21.882 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -1.005 -5.575 -20.529 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -1.978 -4.118 -20.842 1.00 0.00 H new ATOM 1687 N ARG A 106 1.168 -4.592 -17.095 1.00 0.00 N ATOM 1688 CA ARG A 106 2.184 -4.500 -16.059 1.00 0.00 C ATOM 1689 C ARG A 106 3.306 -5.303 -16.661 1.00 0.00 C ATOM 1690 O ARG A 106 3.024 -6.356 -17.215 1.00 0.00 O ATOM 1691 CB ARG A 106 1.687 -5.219 -14.778 1.00 0.00 C ATOM 1692 CG ARG A 106 0.997 -4.310 -13.743 1.00 0.00 C ATOM 1693 CD ARG A 106 0.475 -5.008 -12.459 1.00 0.00 C ATOM 1694 NE ARG A 106 -0.378 -4.083 -11.699 1.00 0.00 N ATOM 1695 CZ ARG A 106 -0.860 -4.338 -10.503 1.00 0.00 C ATOM 1696 NH1 ARG A 106 -0.563 -5.425 -9.833 1.00 0.00 N ATOM 1697 NH2 ARG A 106 -1.678 -3.471 -9.953 1.00 0.00 N ATOM 0 H ARG A 106 1.090 -5.518 -17.515 1.00 0.00 H new ATOM 0 HA ARG A 106 2.448 -3.479 -15.783 1.00 0.00 H new ATOM 0 HB2 ARG A 106 0.991 -6.006 -15.069 1.00 0.00 H new ATOM 0 HB3 ARG A 106 2.537 -5.706 -14.301 1.00 0.00 H new ATOM 0 HG2 ARG A 106 1.700 -3.531 -13.448 1.00 0.00 H new ATOM 0 HG3 ARG A 106 0.157 -3.814 -14.229 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -0.089 -5.902 -12.724 1.00 0.00 H new ATOM 0 HD3 ARG A 106 1.314 -5.332 -11.843 1.00 0.00 H new ATOM 0 HE ARG A 106 -0.611 -3.187 -12.127 1.00 0.00 H new ATOM 0 HH11 ARG A 106 0.068 -6.117 -10.238 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -0.962 -5.579 -8.907 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -1.929 -2.618 -10.453 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -2.063 -3.650 -9.026 1.00 0.00 H new ATOM 1711 N GLU A 107 4.568 -4.841 -16.632 1.00 0.00 N ATOM 1712 CA GLU A 107 5.534 -5.577 -17.438 1.00 0.00 C ATOM 1713 C GLU A 107 6.897 -5.164 -17.001 1.00 0.00 C ATOM 1714 O GLU A 107 7.049 -3.982 -16.737 1.00 0.00 O ATOM 1715 CB GLU A 107 5.226 -5.195 -18.910 1.00 0.00 C ATOM 1716 CG GLU A 107 6.413 -4.645 -19.752 1.00 0.00 C ATOM 1717 CD GLU A 107 7.335 -5.739 -20.223 1.00 0.00 C ATOM 1718 OE1 GLU A 107 7.308 -6.854 -19.634 1.00 0.00 O ATOM 1719 OE2 GLU A 107 8.100 -5.491 -21.195 1.00 0.00 O ATOM 0 H GLU A 107 4.914 -4.037 -16.109 1.00 0.00 H new ATOM 0 HA GLU A 107 5.477 -6.660 -17.330 1.00 0.00 H new ATOM 0 HB2 GLU A 107 4.830 -6.076 -19.415 1.00 0.00 H new ATOM 0 HB3 GLU A 107 4.434 -4.446 -18.909 1.00 0.00 H new ATOM 0 HG2 GLU A 107 6.024 -4.104 -20.615 1.00 0.00 H new ATOM 0 HG3 GLU A 107 6.978 -3.929 -19.155 1.00 0.00 H new ATOM 1726 N ILE A 108 7.877 -6.091 -16.928 1.00 0.00 N ATOM 1727 CA ILE A 108 9.214 -5.634 -16.620 1.00 0.00 C ATOM 1728 C ILE A 108 9.704 -5.085 -17.932 1.00 0.00 C ATOM 1729 O ILE A 108 9.700 -5.842 -18.889 1.00 0.00 O ATOM 1730 CB ILE A 108 10.300 -6.600 -16.056 1.00 0.00 C ATOM 1731 CG1 ILE A 108 11.650 -5.857 -15.800 1.00 0.00 C ATOM 1732 CG2 ILE A 108 10.648 -7.736 -17.053 1.00 0.00 C ATOM 1733 CD1 ILE A 108 11.666 -4.952 -14.552 1.00 0.00 C ATOM 0 H ILE A 108 7.764 -7.095 -17.071 1.00 0.00 H new ATOM 0 HA ILE A 108 9.099 -4.963 -15.769 1.00 0.00 H new ATOM 0 HB ILE A 108 9.871 -6.997 -15.136 1.00 0.00 H new ATOM 0 HG12 ILE A 108 12.443 -6.598 -15.704 1.00 0.00 H new ATOM 0 HG13 ILE A 108 11.885 -5.250 -16.674 1.00 0.00 H new ATOM 0 HG21 ILE A 108 11.409 -8.383 -16.616 1.00 0.00 H new ATOM 0 HG22 ILE A 108 9.753 -8.320 -17.266 1.00 0.00 H new ATOM 0 HG23 ILE A 108 11.028 -7.304 -17.979 1.00 0.00 H new ATOM 0 HD11 ILE A 108 12.644 -4.480 -14.458 1.00 0.00 H new ATOM 0 HD12 ILE A 108 10.899 -4.183 -14.650 1.00 0.00 H new ATOM 0 HD13 ILE A 108 11.466 -5.552 -13.665 1.00 0.00 H new ATOM 1745 N ILE A 109 10.149 -3.815 -17.998 1.00 0.00 N ATOM 1746 CA ILE A 109 10.945 -3.371 -19.134 1.00 0.00 C ATOM 1747 C ILE A 109 12.392 -3.340 -18.694 1.00 0.00 C ATOM 1748 O ILE A 109 12.744 -2.468 -17.920 1.00 0.00 O ATOM 1749 CB ILE A 109 10.491 -2.036 -19.798 1.00 0.00 C ATOM 1750 CG1 ILE A 109 11.432 -1.734 -21.009 1.00 0.00 C ATOM 1751 CG2 ILE A 109 10.337 -0.823 -18.839 1.00 0.00 C ATOM 1752 CD1 ILE A 109 12.625 -0.766 -20.765 1.00 0.00 C ATOM 0 H ILE A 109 9.971 -3.102 -17.291 1.00 0.00 H new ATOM 0 HA ILE A 109 10.796 -4.088 -19.942 1.00 0.00 H new ATOM 0 HB ILE A 109 9.468 -2.187 -20.144 1.00 0.00 H new ATOM 0 HG12 ILE A 109 11.835 -2.681 -21.367 1.00 0.00 H new ATOM 0 HG13 ILE A 109 10.823 -1.322 -21.814 1.00 0.00 H new ATOM 0 HG21 ILE A 109 10.018 0.051 -19.406 1.00 0.00 H new ATOM 0 HG22 ILE A 109 9.592 -1.053 -18.078 1.00 0.00 H new ATOM 0 HG23 ILE A 109 11.293 -0.615 -18.359 1.00 0.00 H new ATOM 0 HD11 ILE A 109 13.192 -0.648 -21.688 1.00 0.00 H new ATOM 0 HD12 ILE A 109 12.246 0.205 -20.445 1.00 0.00 H new ATOM 0 HD13 ILE A 109 13.274 -1.176 -19.991 1.00 0.00 H new ATOM 1764 N GLY A 110 13.264 -4.265 -19.158 1.00 0.00 N ATOM 1765 CA GLY A 110 14.666 -4.232 -18.746 1.00 0.00 C ATOM 1766 C GLY A 110 14.822 -4.319 -17.238 1.00 0.00 C ATOM 1767 O GLY A 110 14.499 -5.355 -16.681 1.00 0.00 O ATOM 0 H GLY A 110 13.021 -5.020 -19.800 1.00 0.00 H new ATOM 0 HA2 GLY A 110 15.200 -5.059 -19.213 1.00 0.00 H new ATOM 0 HA3 GLY A 110 15.127 -3.312 -19.105 1.00 0.00 H new ATOM 1771 N ASP A 111 15.307 -3.243 -16.570 1.00 0.00 N ATOM 1772 CA ASP A 111 15.362 -3.171 -15.104 1.00 0.00 C ATOM 1773 C ASP A 111 14.388 -2.151 -14.570 1.00 0.00 C ATOM 1774 O ASP A 111 14.529 -1.724 -13.434 1.00 0.00 O ATOM 1775 CB ASP A 111 16.797 -2.807 -14.657 1.00 0.00 C ATOM 1776 CG ASP A 111 17.145 -1.402 -15.078 1.00 0.00 C ATOM 1777 OD1 ASP A 111 17.273 -1.167 -16.310 1.00 0.00 O ATOM 1778 OD2 ASP A 111 17.289 -0.521 -14.187 1.00 0.00 O ATOM 0 H ASP A 111 15.667 -2.410 -17.037 1.00 0.00 H new ATOM 0 HA ASP A 111 15.086 -4.146 -14.703 1.00 0.00 H new ATOM 0 HB2 ASP A 111 16.880 -2.899 -13.574 1.00 0.00 H new ATOM 0 HB3 ASP A 111 17.508 -3.509 -15.092 1.00 0.00 H new ATOM 1783 N GLU A 112 13.385 -1.777 -15.390 1.00 0.00 N ATOM 1784 CA GLU A 112 12.303 -0.918 -14.954 1.00 0.00 C ATOM 1785 C GLU A 112 11.027 -1.659 -15.164 1.00 0.00 C ATOM 1786 O GLU A 112 11.037 -2.568 -15.973 1.00 0.00 O ATOM 1787 CB GLU A 112 12.268 0.394 -15.765 1.00 0.00 C ATOM 1788 CG GLU A 112 12.991 1.484 -14.957 1.00 0.00 C ATOM 1789 CD GLU A 112 14.426 1.123 -14.678 1.00 0.00 C ATOM 1790 OE1 GLU A 112 15.176 0.873 -15.661 1.00 0.00 O ATOM 1791 OE2 GLU A 112 14.816 1.088 -13.479 1.00 0.00 O ATOM 0 H GLU A 112 13.316 -2.068 -16.365 1.00 0.00 H new ATOM 0 HA GLU A 112 12.446 -0.658 -13.905 1.00 0.00 H new ATOM 0 HB2 GLU A 112 12.752 0.255 -16.732 1.00 0.00 H new ATOM 0 HB3 GLU A 112 11.238 0.690 -15.964 1.00 0.00 H new ATOM 0 HG2 GLU A 112 12.954 2.426 -15.505 1.00 0.00 H new ATOM 0 HG3 GLU A 112 12.468 1.643 -14.014 1.00 0.00 H new ATOM 1798 N LEU A 113 9.945 -1.276 -14.459 1.00 0.00 N ATOM 1799 CA LEU A 113 8.680 -1.962 -14.630 1.00 0.00 C ATOM 1800 C LEU A 113 7.809 -0.931 -15.280 1.00 0.00 C ATOM 1801 O LEU A 113 7.685 0.147 -14.719 1.00 0.00 O ATOM 1802 CB LEU A 113 8.203 -2.514 -13.266 1.00 0.00 C ATOM 1803 CG LEU A 113 6.739 -3.038 -13.236 1.00 0.00 C ATOM 1804 CD1 LEU A 113 6.451 -4.034 -12.080 1.00 0.00 C ATOM 1805 CD2 LEU A 113 5.782 -1.855 -12.992 1.00 0.00 C ATOM 0 H LEU A 113 9.934 -0.511 -13.784 1.00 0.00 H new ATOM 0 HA LEU A 113 8.699 -2.853 -15.257 1.00 0.00 H new ATOM 0 HB2 LEU A 113 8.868 -3.325 -12.968 1.00 0.00 H new ATOM 0 HB3 LEU A 113 8.305 -1.727 -12.519 1.00 0.00 H new ATOM 0 HG LEU A 113 6.593 -3.540 -14.193 1.00 0.00 H new ATOM 0 HD11 LEU A 113 5.410 -4.354 -12.126 1.00 0.00 H new ATOM 0 HD12 LEU A 113 7.102 -4.903 -12.177 1.00 0.00 H new ATOM 0 HD13 LEU A 113 6.638 -3.545 -11.124 1.00 0.00 H new ATOM 0 HD21 LEU A 113 4.754 -2.217 -12.970 1.00 0.00 H new ATOM 0 HD22 LEU A 113 6.021 -1.384 -12.039 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.893 -1.126 -13.795 1.00 0.00 H new ATOM 1817 N VAL A 114 7.220 -1.226 -16.457 1.00 0.00 N ATOM 1818 CA VAL A 114 6.319 -0.258 -17.069 1.00 0.00 C ATOM 1819 C VAL A 114 4.905 -0.578 -16.658 1.00 0.00 C ATOM 1820 O VAL A 114 4.669 -1.677 -16.176 1.00 0.00 O ATOM 1821 CB VAL A 114 6.444 -0.353 -18.617 1.00 0.00 C ATOM 1822 CG1 VAL A 114 5.378 -1.304 -19.206 1.00 0.00 C ATOM 1823 CG2 VAL A 114 6.469 1.044 -19.291 1.00 0.00 C ATOM 0 H VAL A 114 7.351 -2.094 -16.977 1.00 0.00 H new ATOM 0 HA VAL A 114 6.577 0.750 -16.744 1.00 0.00 H new ATOM 0 HB VAL A 114 7.412 -0.797 -18.847 1.00 0.00 H new ATOM 0 HG11 VAL A 114 5.490 -1.350 -20.289 1.00 0.00 H new ATOM 0 HG12 VAL A 114 5.507 -2.301 -18.785 1.00 0.00 H new ATOM 0 HG13 VAL A 114 4.383 -0.933 -18.960 1.00 0.00 H new ATOM 0 HG21 VAL A 114 6.557 0.925 -20.371 1.00 0.00 H new ATOM 0 HG22 VAL A 114 5.547 1.577 -19.059 1.00 0.00 H new ATOM 0 HG23 VAL A 114 7.321 1.613 -18.918 1.00 0.00 H new ATOM 1833 N GLN A 115 3.957 0.357 -16.908 1.00 0.00 N ATOM 1834 CA GLN A 115 2.544 0.003 -16.803 1.00 0.00 C ATOM 1835 C GLN A 115 1.757 0.824 -17.795 1.00 0.00 C ATOM 1836 O GLN A 115 2.181 1.946 -18.012 1.00 0.00 O ATOM 1837 CB GLN A 115 2.120 0.308 -15.351 1.00 0.00 C ATOM 1838 CG GLN A 115 0.934 -0.528 -14.814 1.00 0.00 C ATOM 1839 CD GLN A 115 0.906 -0.446 -13.310 1.00 0.00 C ATOM 1840 OE1 GLN A 115 1.921 -1.083 -12.689 1.00 0.00 O flip ATOM 1841 NE2 GLN A 115 0.020 0.158 -12.727 1.00 0.00 N flip ATOM 0 H GLN A 115 4.146 1.324 -17.173 1.00 0.00 H new ATOM 0 HA GLN A 115 2.361 -1.048 -17.029 1.00 0.00 H new ATOM 0 HB2 GLN A 115 2.979 0.149 -14.699 1.00 0.00 H new ATOM 0 HB3 GLN A 115 1.859 1.364 -15.281 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -0.004 -0.157 -15.227 1.00 0.00 H new ATOM 0 HG3 GLN A 115 1.033 -1.566 -15.131 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -0.719 0.618 -13.259 1.00 0.00 H new ATOM 0 HE22 GLN A 115 0.018 0.203 -11.708 1.00 0.00 H new ATOM 1850 N THR A 116 0.657 0.319 -18.400 1.00 0.00 N ATOM 1851 CA THR A 116 -0.077 1.078 -19.416 1.00 0.00 C ATOM 1852 C THR A 116 -1.540 0.934 -19.061 1.00 0.00 C ATOM 1853 O THR A 116 -2.074 -0.127 -19.343 1.00 0.00 O ATOM 1854 CB THR A 116 0.284 0.692 -20.888 1.00 0.00 C ATOM 1855 OG1 THR A 116 -0.775 -0.006 -21.562 1.00 0.00 O ATOM 1856 CG2 THR A 116 1.628 -0.095 -20.958 1.00 0.00 C ATOM 0 H THR A 116 0.268 -0.602 -18.199 1.00 0.00 H new ATOM 0 HA THR A 116 0.211 2.129 -19.400 1.00 0.00 H new ATOM 0 HB THR A 116 0.418 1.630 -21.427 1.00 0.00 H new ATOM 0 HG1 THR A 116 -1.330 -0.474 -20.903 1.00 0.00 H new ATOM 0 HG21 THR A 116 1.848 -0.347 -21.995 1.00 0.00 H new ATOM 0 HG22 THR A 116 2.432 0.521 -20.556 1.00 0.00 H new ATOM 0 HG23 THR A 116 1.545 -1.010 -20.372 1.00 0.00 H new ATOM 1864 N TYR A 117 -2.187 1.950 -18.432 1.00 0.00 N ATOM 1865 CA TYR A 117 -3.606 1.828 -18.093 1.00 0.00 C ATOM 1866 C TYR A 117 -4.426 2.479 -19.182 1.00 0.00 C ATOM 1867 O TYR A 117 -3.887 3.273 -19.933 1.00 0.00 O ATOM 1868 CB TYR A 117 -4.010 2.409 -16.708 1.00 0.00 C ATOM 1869 CG TYR A 117 -3.458 1.716 -15.449 1.00 0.00 C ATOM 1870 CD1 TYR A 117 -2.789 0.487 -15.471 1.00 0.00 C ATOM 1871 CD2 TYR A 117 -3.678 2.344 -14.218 1.00 0.00 C ATOM 1872 CE1 TYR A 117 -2.576 -0.205 -14.275 1.00 0.00 C ATOM 1873 CE2 TYR A 117 -3.452 1.663 -13.020 1.00 0.00 C ATOM 1874 CZ TYR A 117 -2.968 0.350 -13.055 1.00 0.00 C ATOM 1875 OH TYR A 117 -2.871 -0.421 -11.897 1.00 0.00 O ATOM 0 H TYR A 117 -1.754 2.833 -18.161 1.00 0.00 H new ATOM 0 HA TYR A 117 -3.807 0.759 -18.018 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -3.698 3.453 -16.679 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -5.098 2.399 -16.645 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -2.439 0.076 -16.406 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -4.026 3.366 -14.194 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -2.105 -1.176 -14.295 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -3.649 2.145 -12.074 1.00 0.00 H new ATOM 0 HH TYR A 117 -2.127 -0.095 -11.348 1.00 0.00 H new ATOM 1885 N VAL A 118 -5.729 2.126 -19.286 1.00 0.00 N ATOM 1886 CA VAL A 118 -6.593 2.639 -20.347 1.00 0.00 C ATOM 1887 C VAL A 118 -8.010 2.778 -19.816 1.00 0.00 C ATOM 1888 O VAL A 118 -8.656 1.747 -19.690 1.00 0.00 O ATOM 1889 CB VAL A 118 -6.531 1.628 -21.526 1.00 0.00 C ATOM 1890 CG1 VAL A 118 -7.600 1.911 -22.621 1.00 0.00 C ATOM 1891 CG2 VAL A 118 -5.121 1.500 -22.171 1.00 0.00 C ATOM 0 H VAL A 118 -6.194 1.487 -18.642 1.00 0.00 H new ATOM 0 HA VAL A 118 -6.268 3.621 -20.689 1.00 0.00 H new ATOM 0 HB VAL A 118 -6.761 0.667 -21.065 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -7.508 1.173 -23.418 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -8.596 1.849 -22.182 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -7.446 2.909 -23.031 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -5.158 0.777 -22.986 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -4.810 2.469 -22.560 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -4.406 1.164 -21.420 1.00 0.00 H new ATOM 1901 N TYR A 119 -8.509 4.010 -19.513 1.00 0.00 N ATOM 1902 CA TYR A 119 -9.880 4.178 -19.008 1.00 0.00 C ATOM 1903 C TYR A 119 -10.695 4.920 -20.054 1.00 0.00 C ATOM 1904 O TYR A 119 -10.514 6.120 -20.205 1.00 0.00 O ATOM 1905 CB TYR A 119 -10.022 4.984 -17.684 1.00 0.00 C ATOM 1906 CG TYR A 119 -9.411 4.336 -16.428 1.00 0.00 C ATOM 1907 CD1 TYR A 119 -8.054 3.997 -16.354 1.00 0.00 C ATOM 1908 CD2 TYR A 119 -10.214 4.110 -15.304 1.00 0.00 C ATOM 1909 CE1 TYR A 119 -7.474 3.679 -15.120 1.00 0.00 C ATOM 1910 CE2 TYR A 119 -9.635 3.819 -14.066 1.00 0.00 C ATOM 1911 CZ TYR A 119 -8.254 3.641 -13.959 1.00 0.00 C ATOM 1912 OH TYR A 119 -7.684 3.420 -12.701 1.00 0.00 O ATOM 0 H TYR A 119 -7.984 4.879 -19.611 1.00 0.00 H new ATOM 0 HA TYR A 119 -10.226 3.165 -18.802 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -9.560 5.961 -17.826 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -11.082 5.157 -17.500 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -7.453 3.981 -17.251 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -11.289 4.161 -15.394 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -6.418 3.462 -15.064 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -10.258 3.731 -13.188 1.00 0.00 H new ATOM 0 HH TYR A 119 -8.386 3.430 -12.017 1.00 0.00 H new ATOM 1922 N GLU A 120 -11.599 4.221 -20.783 1.00 0.00 N ATOM 1923 CA GLU A 120 -12.566 4.859 -21.684 1.00 0.00 C ATOM 1924 C GLU A 120 -12.091 5.942 -22.607 1.00 0.00 C ATOM 1925 O GLU A 120 -12.910 6.686 -23.125 1.00 0.00 O ATOM 1926 CB GLU A 120 -13.781 5.380 -20.875 1.00 0.00 C ATOM 1927 CG GLU A 120 -14.288 4.255 -19.957 1.00 0.00 C ATOM 1928 CD GLU A 120 -15.703 4.518 -19.507 1.00 0.00 C ATOM 1929 OE1 GLU A 120 -16.643 4.182 -20.279 1.00 0.00 O ATOM 1930 OE2 GLU A 120 -15.889 5.058 -18.383 1.00 0.00 O ATOM 0 H GLU A 120 -11.671 3.204 -20.757 1.00 0.00 H new ATOM 0 HA GLU A 120 -12.816 4.045 -22.364 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -13.495 6.249 -20.283 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -14.574 5.701 -21.551 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -14.242 3.302 -20.485 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -13.636 4.170 -19.087 1.00 0.00 H new ATOM 1937 N GLY A 121 -10.778 6.049 -22.845 1.00 0.00 N ATOM 1938 CA GLY A 121 -10.332 7.091 -23.750 1.00 0.00 C ATOM 1939 C GLY A 121 -8.883 7.291 -23.534 1.00 0.00 C ATOM 1940 O GLY A 121 -8.072 7.207 -24.444 1.00 0.00 O ATOM 0 H GLY A 121 -10.049 5.459 -22.445 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -10.528 6.808 -24.784 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -10.877 8.017 -23.564 1.00 0.00 H new ATOM 1944 N VAL A 122 -8.609 7.597 -22.252 1.00 0.00 N ATOM 1945 CA VAL A 122 -7.282 8.050 -21.959 1.00 0.00 C ATOM 1946 C VAL A 122 -6.377 6.849 -21.864 1.00 0.00 C ATOM 1947 O VAL A 122 -6.587 6.054 -20.962 1.00 0.00 O ATOM 1948 CB VAL A 122 -7.300 8.845 -20.632 1.00 0.00 C ATOM 1949 CG1 VAL A 122 -5.888 9.429 -20.504 1.00 0.00 C ATOM 1950 CG2 VAL A 122 -8.325 10.010 -20.603 1.00 0.00 C ATOM 0 H VAL A 122 -9.256 7.538 -21.465 1.00 0.00 H new ATOM 0 HA VAL A 122 -6.912 8.708 -22.745 1.00 0.00 H new ATOM 0 HB VAL A 122 -7.593 8.181 -19.819 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -5.817 10.010 -19.585 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -5.160 8.618 -20.478 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -5.682 10.074 -21.358 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -8.274 10.516 -19.639 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -8.092 10.719 -21.397 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -9.330 9.614 -20.752 1.00 0.00 H new ATOM 1960 N GLU A 123 -5.360 6.724 -22.752 1.00 0.00 N ATOM 1961 CA GLU A 123 -4.319 5.751 -22.520 1.00 0.00 C ATOM 1962 C GLU A 123 -3.448 6.429 -21.497 1.00 0.00 C ATOM 1963 O GLU A 123 -2.866 7.448 -21.833 1.00 0.00 O ATOM 1964 CB GLU A 123 -3.477 5.458 -23.787 1.00 0.00 C ATOM 1965 CG GLU A 123 -4.322 4.968 -24.991 1.00 0.00 C ATOM 1966 CD GLU A 123 -3.397 4.681 -26.148 1.00 0.00 C ATOM 1967 OE1 GLU A 123 -2.873 3.537 -26.225 1.00 0.00 O ATOM 1968 OE2 GLU A 123 -3.183 5.599 -26.986 1.00 0.00 O ATOM 0 H GLU A 123 -5.258 7.276 -23.604 1.00 0.00 H new ATOM 0 HA GLU A 123 -4.731 4.790 -22.213 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -2.940 6.362 -24.074 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -2.727 4.704 -23.549 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -4.879 4.071 -24.721 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -5.054 5.725 -25.272 1.00 0.00 H new ATOM 1975 N ALA A 124 -3.351 5.898 -20.261 1.00 0.00 N ATOM 1976 CA ALA A 124 -2.422 6.457 -19.293 1.00 0.00 C ATOM 1977 C ALA A 124 -1.301 5.462 -19.218 1.00 0.00 C ATOM 1978 O ALA A 124 -1.445 4.362 -19.729 1.00 0.00 O ATOM 1979 CB ALA A 124 -3.097 6.680 -17.921 1.00 0.00 C ATOM 0 H ALA A 124 -3.895 5.103 -19.927 1.00 0.00 H new ATOM 0 HA ALA A 124 -2.063 7.443 -19.590 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -2.372 7.099 -17.223 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -3.933 7.371 -18.035 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -3.463 5.728 -17.537 1.00 0.00 H new ATOM 1985 N LYS A 125 -0.169 5.836 -18.591 1.00 0.00 N ATOM 1986 CA LYS A 125 0.967 4.933 -18.597 1.00 0.00 C ATOM 1987 C LYS A 125 2.001 5.402 -17.620 1.00 0.00 C ATOM 1988 O LYS A 125 2.386 6.557 -17.695 1.00 0.00 O ATOM 1989 CB LYS A 125 1.597 4.852 -20.009 1.00 0.00 C ATOM 1990 CG LYS A 125 2.800 3.876 -20.116 1.00 0.00 C ATOM 1991 CD LYS A 125 3.834 4.370 -21.164 1.00 0.00 C ATOM 1992 CE LYS A 125 4.692 5.512 -20.548 1.00 0.00 C ATOM 1993 NZ LYS A 125 5.496 6.227 -21.563 1.00 0.00 N ATOM 0 H LYS A 125 -0.031 6.718 -18.099 1.00 0.00 H new ATOM 0 HA LYS A 125 0.614 3.942 -18.310 1.00 0.00 H new ATOM 0 HB2 LYS A 125 0.830 4.544 -20.719 1.00 0.00 H new ATOM 0 HB3 LYS A 125 1.925 5.848 -20.306 1.00 0.00 H new ATOM 0 HG2 LYS A 125 3.282 3.781 -19.143 1.00 0.00 H new ATOM 0 HG3 LYS A 125 2.443 2.884 -20.393 1.00 0.00 H new ATOM 0 HD2 LYS A 125 4.476 3.545 -21.474 1.00 0.00 H new ATOM 0 HD3 LYS A 125 3.321 4.727 -22.057 1.00 0.00 H new ATOM 0 HE2 LYS A 125 4.037 6.222 -20.042 1.00 0.00 H new ATOM 0 HE3 LYS A 125 5.356 5.095 -19.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 6.049 6.977 -21.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 6.141 5.558 -22.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 4.864 6.649 -22.272 1.00 0.00 H new ATOM 2007 N ARG A 126 2.435 4.517 -16.698 1.00 0.00 N ATOM 2008 CA ARG A 126 3.423 4.915 -15.715 1.00 0.00 C ATOM 2009 C ARG A 126 4.708 4.238 -16.084 1.00 0.00 C ATOM 2010 O ARG A 126 4.694 3.299 -16.865 1.00 0.00 O ATOM 2011 CB ARG A 126 3.019 4.389 -14.316 1.00 0.00 C ATOM 2012 CG ARG A 126 1.912 5.192 -13.584 1.00 0.00 C ATOM 2013 CD ARG A 126 0.482 5.140 -14.208 1.00 0.00 C ATOM 2014 NE ARG A 126 0.290 6.297 -15.092 1.00 0.00 N ATOM 2015 CZ ARG A 126 -0.798 7.037 -15.182 1.00 0.00 C ATOM 2016 NH1 ARG A 126 -1.935 6.763 -14.581 1.00 0.00 N ATOM 2017 NH2 ARG A 126 -0.755 8.124 -15.925 1.00 0.00 N ATOM 0 H ARG A 126 2.117 3.550 -16.626 1.00 0.00 H new ATOM 0 HA ARG A 126 3.510 6.001 -15.694 1.00 0.00 H new ATOM 0 HB2 ARG A 126 2.684 3.357 -14.420 1.00 0.00 H new ATOM 0 HB3 ARG A 126 3.907 4.373 -13.685 1.00 0.00 H new ATOM 0 HG2 ARG A 126 1.849 4.829 -12.558 1.00 0.00 H new ATOM 0 HG3 ARG A 126 2.224 6.235 -13.534 1.00 0.00 H new ATOM 0 HD2 ARG A 126 0.352 4.215 -14.769 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -0.271 5.143 -13.419 1.00 0.00 H new ATOM 0 HE ARG A 126 1.073 6.553 -15.694 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -2.016 5.930 -13.998 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -2.736 7.384 -14.698 1.00 0.00 H new ATOM 0 HH21 ARG A 126 0.105 8.375 -16.413 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -1.582 8.715 -16.013 1.00 0.00 H new ATOM 2031 N ILE A 127 5.816 4.715 -15.479 1.00 0.00 N ATOM 2032 CA ILE A 127 7.071 3.988 -15.576 1.00 0.00 C ATOM 2033 C ILE A 127 7.608 3.990 -14.172 1.00 0.00 C ATOM 2034 O ILE A 127 7.626 5.044 -13.547 1.00 0.00 O ATOM 2035 CB ILE A 127 8.121 4.582 -16.541 1.00 0.00 C ATOM 2036 CG1 ILE A 127 7.445 5.025 -17.868 1.00 0.00 C ATOM 2037 CG2 ILE A 127 9.293 3.581 -16.760 1.00 0.00 C ATOM 2038 CD1 ILE A 127 8.275 6.074 -18.648 1.00 0.00 C ATOM 0 H ILE A 127 5.856 5.577 -14.936 1.00 0.00 H new ATOM 0 HA ILE A 127 6.878 3.001 -15.995 1.00 0.00 H new ATOM 0 HB ILE A 127 8.557 5.476 -16.095 1.00 0.00 H new ATOM 0 HG12 ILE A 127 7.289 4.150 -18.500 1.00 0.00 H new ATOM 0 HG13 ILE A 127 6.461 5.439 -17.648 1.00 0.00 H new ATOM 0 HG21 ILE A 127 10.022 4.018 -17.443 1.00 0.00 H new ATOM 0 HG22 ILE A 127 9.773 3.368 -15.805 1.00 0.00 H new ATOM 0 HG23 ILE A 127 8.906 2.655 -17.186 1.00 0.00 H new ATOM 0 HD11 ILE A 127 7.751 6.344 -19.565 1.00 0.00 H new ATOM 0 HD12 ILE A 127 8.409 6.963 -18.032 1.00 0.00 H new ATOM 0 HD13 ILE A 127 9.250 5.655 -18.897 1.00 0.00 H new ATOM 2050 N PHE A 128 8.013 2.795 -13.703 1.00 0.00 N ATOM 2051 CA PHE A 128 8.398 2.635 -12.320 1.00 0.00 C ATOM 2052 C PHE A 128 9.821 2.190 -12.261 1.00 0.00 C ATOM 2053 O PHE A 128 10.280 1.701 -13.278 1.00 0.00 O ATOM 2054 CB PHE A 128 7.647 1.437 -11.716 1.00 0.00 C ATOM 2055 CG PHE A 128 6.143 1.548 -11.457 1.00 0.00 C ATOM 2056 CD1 PHE A 128 5.232 1.534 -12.519 1.00 0.00 C ATOM 2057 CD2 PHE A 128 5.644 1.659 -10.148 1.00 0.00 C ATOM 2058 CE1 PHE A 128 3.857 1.553 -12.259 1.00 0.00 C ATOM 2059 CE2 PHE A 128 4.271 1.672 -9.895 1.00 0.00 C ATOM 2060 CZ PHE A 128 3.369 1.578 -10.951 1.00 0.00 C ATOM 0 H PHE A 128 8.076 1.947 -14.266 1.00 0.00 H new ATOM 0 HA PHE A 128 8.204 3.578 -11.808 1.00 0.00 H new ATOM 0 HB2 PHE A 128 7.803 0.585 -12.378 1.00 0.00 H new ATOM 0 HB3 PHE A 128 8.126 1.195 -10.767 1.00 0.00 H new ATOM 0 HD1 PHE A 128 5.589 1.509 -13.538 1.00 0.00 H new ATOM 0 HD2 PHE A 128 6.336 1.736 -9.322 1.00 0.00 H new ATOM 0 HE1 PHE A 128 3.161 1.548 -13.085 1.00 0.00 H new ATOM 0 HE2 PHE A 128 3.909 1.755 -8.881 1.00 0.00 H new ATOM 0 HZ PHE A 128 2.307 1.525 -10.761 1.00 0.00 H new ATOM 2070 N LYS A 129 10.452 2.310 -11.069 1.00 0.00 N ATOM 2071 CA LYS A 129 11.842 1.910 -10.932 1.00 0.00 C ATOM 2072 C LYS A 129 12.117 1.154 -9.648 1.00 0.00 C ATOM 2073 O LYS A 129 11.357 1.246 -8.702 1.00 0.00 O ATOM 2074 CB LYS A 129 12.747 3.118 -11.296 1.00 0.00 C ATOM 2075 CG LYS A 129 14.169 3.259 -10.706 1.00 0.00 C ATOM 2076 CD LYS A 129 14.227 3.448 -9.170 1.00 0.00 C ATOM 2077 CE LYS A 129 15.565 4.146 -8.782 1.00 0.00 C ATOM 2078 NZ LYS A 129 15.799 4.246 -7.324 1.00 0.00 N ATOM 0 H LYS A 129 10.021 2.672 -10.219 1.00 0.00 H new ATOM 0 HA LYS A 129 12.110 1.138 -11.654 1.00 0.00 H new ATOM 0 HB2 LYS A 129 12.851 3.123 -12.381 1.00 0.00 H new ATOM 0 HB3 LYS A 129 12.199 4.020 -11.024 1.00 0.00 H new ATOM 0 HG2 LYS A 129 14.744 2.372 -10.969 1.00 0.00 H new ATOM 0 HG3 LYS A 129 14.660 4.109 -11.180 1.00 0.00 H new ATOM 0 HD2 LYS A 129 13.381 4.048 -8.835 1.00 0.00 H new ATOM 0 HD3 LYS A 129 14.150 2.482 -8.671 1.00 0.00 H new ATOM 0 HE2 LYS A 129 16.392 3.598 -9.234 1.00 0.00 H new ATOM 0 HE3 LYS A 129 15.576 5.149 -9.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 16.645 4.824 -7.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 14.976 4.690 -6.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 15.941 3.294 -6.929 1.00 0.00 H new ATOM 2092 N LYS A 130 13.207 0.361 -9.723 1.00 0.00 N ATOM 2093 CA LYS A 130 13.541 -0.761 -8.824 1.00 0.00 C ATOM 2094 C LYS A 130 13.945 -0.387 -7.418 1.00 0.00 C ATOM 2095 O LYS A 130 15.121 -0.161 -7.179 1.00 0.00 O ATOM 2096 CB LYS A 130 14.783 -1.368 -9.531 1.00 0.00 C ATOM 2097 CG LYS A 130 15.228 -2.786 -9.078 1.00 0.00 C ATOM 2098 CD LYS A 130 14.409 -3.875 -9.838 1.00 0.00 C ATOM 2099 CE LYS A 130 14.810 -5.333 -9.477 1.00 0.00 C ATOM 2100 NZ LYS A 130 16.201 -5.673 -9.860 1.00 0.00 N ATOM 0 H LYS A 130 13.912 0.494 -10.448 1.00 0.00 H new ATOM 0 HA LYS A 130 12.669 -1.400 -8.686 1.00 0.00 H new ATOM 0 HB2 LYS A 130 14.581 -1.402 -10.602 1.00 0.00 H new ATOM 0 HB3 LYS A 130 15.622 -0.687 -9.387 1.00 0.00 H new ATOM 0 HG2 LYS A 130 16.292 -2.920 -9.271 1.00 0.00 H new ATOM 0 HG3 LYS A 130 15.083 -2.895 -8.003 1.00 0.00 H new ATOM 0 HD2 LYS A 130 13.350 -3.736 -9.621 1.00 0.00 H new ATOM 0 HD3 LYS A 130 14.537 -3.729 -10.911 1.00 0.00 H new ATOM 0 HE2 LYS A 130 14.690 -5.480 -8.404 1.00 0.00 H new ATOM 0 HE3 LYS A 130 14.126 -6.023 -9.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 16.404 -6.657 -9.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 16.315 -5.564 -10.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 16.862 -5.037 -9.369 1.00 0.00 H new ATOM 2114 N ASP A 131 12.981 -0.289 -6.474 1.00 0.00 N ATOM 2115 CA ASP A 131 13.201 0.555 -5.302 1.00 0.00 C ATOM 2116 C ASP A 131 12.054 0.732 -4.359 1.00 0.00 C ATOM 2117 O ASP A 131 12.270 0.948 -3.168 1.00 0.00 O ATOM 2118 CB ASP A 131 13.330 1.931 -5.977 1.00 0.00 C ATOM 2119 CG ASP A 131 13.206 3.172 -5.127 1.00 0.00 C ATOM 2120 OD1 ASP A 131 13.575 3.125 -3.923 1.00 0.00 O ATOM 2121 OD2 ASP A 131 12.756 4.217 -5.668 1.00 0.00 O ATOM 2122 OXT ASP A 131 10.757 0.652 -4.824 1.00 0.00 O ATOM 0 H ASP A 131 12.081 -0.768 -6.505 1.00 0.00 H new ATOM 0 HA ASP A 131 14.011 0.132 -4.709 1.00 0.00 H new ATOM 0 HB2 ASP A 131 14.300 1.966 -6.473 1.00 0.00 H new ATOM 0 HB3 ASP A 131 12.571 1.988 -6.757 1.00 0.00 H new TER 2127 ASP A 131