USER MOD reduce.3.24.130724 H: found=0, std=0, add=941, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 934 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 98 ASN : amide:sc= 0 K(o=-1.7,f=-3.2) USER MOD Set 1.2: A 102 SER OG : rot 20:sc= -1.67! USER MOD Set 2.1: A 35 LYS NZ :NH3+ 150:sc= 1.2 (180deg=0) USER MOD Set 2.2: A 36 HIS : no HE2:sc= -7.93! C(o=-6.7!,f=-17!) USER MOD Single : A 1 GLY N :NH3+ -178:sc= -1.37 (180deg=-1.38) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.00547 USER MOD Single : A 12 LYS NZ :NH3+ -156:sc= 0 (180deg=-0.25) USER MOD Single : A 16 GLN : amide:sc= -0.138 K(o=-0.14,f=-1.4) USER MOD Single : A 17 LYS NZ :NH3+ 169:sc=-0.00112 (180deg=-0.225) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 137:sc= 1.03 (180deg=-0.559) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.0237 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= -0.935 X(o=-0.94,f=-0.44) USER MOD Single : A 45 CYS SG : rot 180:sc= 0 USER MOD Single : A 50 HIS :FLIP no HD1:sc= -0.276 F(o=-0.98,f=-0.28) USER MOD Single : A 51 ASN :FLIP amide:sc= -0.49 F(o=-2,f=-0.49) USER MOD Single : A 52 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 54 ASN : amide:sc= -0.0875 X(o=-0.088,f=-0.37) USER MOD Single : A 58 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.131) USER MOD Single : A 59 LYS NZ :NH3+ 157:sc= -0.0177 (180deg=-0.234) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 180:sc= -0.312 USER MOD Single : A 63 THR OG1 : rot 120:sc= -2.62 USER MOD Single : A 74 HIS : no HD1:sc= -15.3! C(o=-15!,f=-18!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= 0.397 K(o=0.4,f=-2.6!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 146:sc= -1.1! USER MOD Single : A 94 ASN : amide:sc= 0.041 K(o=0.041,f=-6.3!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 HIS : no HD1:sc= -11.3! C(o=-11!,f=-12!) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 34.204 -12.964 27.832 1.00 0.00 N ATOM 2 CA GLY A 1 34.350 -12.596 29.230 1.00 0.00 C ATOM 3 C GLY A 1 35.108 -11.274 29.372 1.00 0.00 C ATOM 4 O GLY A 1 35.597 -10.948 30.453 1.00 0.00 O ATOM 0 H1 GLY A 1 33.658 -13.846 27.760 1.00 0.00 H new ATOM 0 H2 GLY A 1 33.706 -12.206 27.324 1.00 0.00 H new ATOM 0 H3 GLY A 1 35.144 -13.104 27.410 1.00 0.00 H new ATOM 0 HA2 GLY A 1 33.366 -12.507 29.691 1.00 0.00 H new ATOM 0 HA3 GLY A 1 34.882 -13.384 29.764 1.00 0.00 H new ATOM 8 N ILE A 2 35.181 -10.548 28.266 1.00 0.00 N ATOM 9 CA ILE A 2 35.871 -9.270 28.254 1.00 0.00 C ATOM 10 C ILE A 2 34.841 -8.139 28.303 1.00 0.00 C ATOM 11 O ILE A 2 33.675 -8.341 27.966 1.00 0.00 O ATOM 12 CB ILE A 2 36.821 -9.184 27.058 1.00 0.00 C ATOM 13 CG1 ILE A 2 36.136 -9.669 25.778 1.00 0.00 C ATOM 14 CG2 ILE A 2 38.120 -9.943 27.335 1.00 0.00 C ATOM 15 CD1 ILE A 2 34.775 -8.995 25.596 1.00 0.00 C ATOM 0 H ILE A 2 34.773 -10.821 27.372 1.00 0.00 H new ATOM 0 HA ILE A 2 36.500 -9.169 29.139 1.00 0.00 H new ATOM 0 HB ILE A 2 37.085 -8.138 26.906 1.00 0.00 H new ATOM 0 HG12 ILE A 2 36.770 -9.454 24.918 1.00 0.00 H new ATOM 0 HG13 ILE A 2 36.008 -10.751 25.817 1.00 0.00 H new ATOM 0 HG21 ILE A 2 38.778 -9.866 26.469 1.00 0.00 H new ATOM 0 HG22 ILE A 2 38.614 -9.512 28.206 1.00 0.00 H new ATOM 0 HG23 ILE A 2 37.895 -10.992 27.528 1.00 0.00 H new ATOM 0 HD11 ILE A 2 34.309 -9.357 24.679 1.00 0.00 H new ATOM 0 HD12 ILE A 2 34.135 -9.232 26.446 1.00 0.00 H new ATOM 0 HD13 ILE A 2 34.909 -7.915 25.533 1.00 0.00 H new ATOM 27 N PRO A 3 35.321 -6.943 28.737 1.00 0.00 N ATOM 28 CA PRO A 3 34.455 -5.780 28.835 1.00 0.00 C ATOM 29 C PRO A 3 34.160 -5.198 27.451 1.00 0.00 C ATOM 30 O PRO A 3 34.334 -5.876 26.439 1.00 0.00 O ATOM 31 CB PRO A 3 35.198 -4.811 29.740 1.00 0.00 C ATOM 32 CG PRO A 3 36.648 -5.269 29.740 1.00 0.00 C ATOM 33 CD PRO A 3 36.695 -6.667 29.145 1.00 0.00 C ATOM 0 HA PRO A 3 33.475 -6.019 29.249 1.00 0.00 H new ATOM 0 HB2 PRO A 3 35.111 -3.789 29.372 1.00 0.00 H new ATOM 0 HB3 PRO A 3 34.785 -4.823 30.748 1.00 0.00 H new ATOM 0 HG2 PRO A 3 37.264 -4.585 29.157 1.00 0.00 H new ATOM 0 HG3 PRO A 3 37.047 -5.272 30.754 1.00 0.00 H new ATOM 0 HD2 PRO A 3 37.377 -6.713 28.296 1.00 0.00 H new ATOM 0 HD3 PRO A 3 37.045 -7.396 29.875 1.00 0.00 H new ATOM 41 N ASP A 4 33.719 -3.949 27.451 1.00 0.00 N ATOM 42 CA ASP A 4 33.398 -3.269 26.208 1.00 0.00 C ATOM 43 C ASP A 4 32.848 -4.284 25.203 1.00 0.00 C ATOM 44 O ASP A 4 33.572 -4.743 24.321 1.00 0.00 O ATOM 45 CB ASP A 4 34.643 -2.624 25.596 1.00 0.00 C ATOM 46 CG ASP A 4 34.570 -2.380 24.087 1.00 0.00 C ATOM 47 OD1 ASP A 4 33.828 -1.453 23.697 1.00 0.00 O ATOM 48 OD2 ASP A 4 35.257 -3.127 23.357 1.00 0.00 O ATOM 0 H ASP A 4 33.576 -3.390 28.292 1.00 0.00 H new ATOM 0 HA ASP A 4 32.662 -2.496 26.427 1.00 0.00 H new ATOM 0 HB2 ASP A 4 34.823 -1.671 26.095 1.00 0.00 H new ATOM 0 HB3 ASP A 4 35.503 -3.260 25.805 1.00 0.00 H new ATOM 53 N LEU A 5 31.574 -4.604 25.371 1.00 0.00 N ATOM 54 CA LEU A 5 30.919 -5.556 24.490 1.00 0.00 C ATOM 55 C LEU A 5 31.656 -6.895 24.555 1.00 0.00 C ATOM 56 O LEU A 5 32.881 -6.939 24.460 1.00 0.00 O ATOM 57 CB LEU A 5 30.805 -4.985 23.074 1.00 0.00 C ATOM 58 CG LEU A 5 29.653 -4.008 22.836 1.00 0.00 C ATOM 59 CD1 LEU A 5 30.179 -2.610 22.503 1.00 0.00 C ATOM 60 CD2 LEU A 5 28.702 -4.534 21.759 1.00 0.00 C ATOM 0 H LEU A 5 30.977 -4.221 26.104 1.00 0.00 H new ATOM 0 HA LEU A 5 29.896 -5.738 24.819 1.00 0.00 H new ATOM 0 HB2 LEU A 5 31.740 -4.480 22.831 1.00 0.00 H new ATOM 0 HB3 LEU A 5 30.701 -5.816 22.376 1.00 0.00 H new ATOM 0 HG LEU A 5 29.080 -3.925 23.759 1.00 0.00 H new ATOM 0 HD11 LEU A 5 29.339 -1.935 22.338 1.00 0.00 H new ATOM 0 HD12 LEU A 5 30.784 -2.242 23.332 1.00 0.00 H new ATOM 0 HD13 LEU A 5 30.789 -2.656 21.601 1.00 0.00 H new ATOM 0 HD21 LEU A 5 27.892 -3.820 21.609 1.00 0.00 H new ATOM 0 HD22 LEU A 5 29.248 -4.665 20.825 1.00 0.00 H new ATOM 0 HD23 LEU A 5 28.288 -5.492 22.075 1.00 0.00 H new ATOM 72 N VAL A 6 30.877 -7.955 24.718 1.00 0.00 N ATOM 73 CA VAL A 6 31.440 -9.292 24.797 1.00 0.00 C ATOM 74 C VAL A 6 31.281 -9.989 23.445 1.00 0.00 C ATOM 75 O VAL A 6 31.059 -9.334 22.427 1.00 0.00 O ATOM 76 CB VAL A 6 30.793 -10.065 25.948 1.00 0.00 C ATOM 77 CG1 VAL A 6 31.768 -11.083 26.542 1.00 0.00 C ATOM 78 CG2 VAL A 6 30.273 -9.111 27.025 1.00 0.00 C ATOM 0 H VAL A 6 29.861 -7.915 24.797 1.00 0.00 H new ATOM 0 HA VAL A 6 32.507 -9.244 25.014 1.00 0.00 H new ATOM 0 HB VAL A 6 29.941 -10.613 25.546 1.00 0.00 H new ATOM 0 HG11 VAL A 6 31.283 -11.618 27.358 1.00 0.00 H new ATOM 0 HG12 VAL A 6 32.068 -11.792 25.771 1.00 0.00 H new ATOM 0 HG13 VAL A 6 32.649 -10.565 26.921 1.00 0.00 H new ATOM 0 HG21 VAL A 6 29.818 -9.686 27.831 1.00 0.00 H new ATOM 0 HG22 VAL A 6 31.101 -8.523 27.421 1.00 0.00 H new ATOM 0 HG23 VAL A 6 29.529 -8.443 26.591 1.00 0.00 H new ATOM 88 N LYS A 7 31.401 -11.308 23.477 1.00 0.00 N ATOM 89 CA LYS A 7 31.273 -12.101 22.266 1.00 0.00 C ATOM 90 C LYS A 7 29.793 -12.375 21.995 1.00 0.00 C ATOM 91 O LYS A 7 29.455 -13.155 21.107 1.00 0.00 O ATOM 92 CB LYS A 7 32.125 -13.368 22.363 1.00 0.00 C ATOM 93 CG LYS A 7 33.220 -13.376 21.295 1.00 0.00 C ATOM 94 CD LYS A 7 34.408 -12.512 21.721 1.00 0.00 C ATOM 95 CE LYS A 7 35.521 -13.369 22.326 1.00 0.00 C ATOM 96 NZ LYS A 7 36.581 -12.511 22.902 1.00 0.00 N ATOM 0 H LYS A 7 31.586 -11.848 24.323 1.00 0.00 H new ATOM 0 HA LYS A 7 31.658 -11.550 21.408 1.00 0.00 H new ATOM 0 HB2 LYS A 7 32.577 -13.431 23.353 1.00 0.00 H new ATOM 0 HB3 LYS A 7 31.491 -14.247 22.245 1.00 0.00 H new ATOM 0 HG2 LYS A 7 33.554 -14.399 21.119 1.00 0.00 H new ATOM 0 HG3 LYS A 7 32.816 -13.006 20.352 1.00 0.00 H new ATOM 0 HD2 LYS A 7 34.792 -11.966 20.859 1.00 0.00 H new ATOM 0 HD3 LYS A 7 34.080 -11.770 22.448 1.00 0.00 H new ATOM 0 HE2 LYS A 7 35.109 -14.017 23.100 1.00 0.00 H new ATOM 0 HE3 LYS A 7 35.946 -14.017 21.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 37.329 -13.109 23.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 36.985 -11.910 22.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 36.175 -11.910 23.647 1.00 0.00 H new ATOM 110 N GLY A 8 28.949 -11.717 22.777 1.00 0.00 N ATOM 111 CA GLY A 8 27.513 -11.879 22.632 1.00 0.00 C ATOM 112 C GLY A 8 26.759 -11.047 23.672 1.00 0.00 C ATOM 113 O GLY A 8 26.008 -11.590 24.480 1.00 0.00 O ATOM 0 H GLY A 8 29.233 -11.071 23.513 1.00 0.00 H new ATOM 0 HA2 GLY A 8 27.209 -11.577 21.630 1.00 0.00 H new ATOM 0 HA3 GLY A 8 27.249 -12.931 22.742 1.00 0.00 H new ATOM 117 N PRO A 9 26.992 -9.708 23.615 1.00 0.00 N ATOM 118 CA PRO A 9 26.344 -8.796 24.541 1.00 0.00 C ATOM 119 C PRO A 9 24.874 -8.591 24.171 1.00 0.00 C ATOM 120 O PRO A 9 24.300 -9.388 23.431 1.00 0.00 O ATOM 121 CB PRO A 9 27.159 -7.515 24.468 1.00 0.00 C ATOM 122 CG PRO A 9 27.947 -7.597 23.170 1.00 0.00 C ATOM 123 CD PRO A 9 27.875 -9.030 22.670 1.00 0.00 C ATOM 0 HA PRO A 9 26.321 -9.180 25.561 1.00 0.00 H new ATOM 0 HB2 PRO A 9 26.511 -6.639 24.477 1.00 0.00 H new ATOM 0 HB3 PRO A 9 27.826 -7.427 25.325 1.00 0.00 H new ATOM 0 HG2 PRO A 9 27.534 -6.913 22.429 1.00 0.00 H new ATOM 0 HG3 PRO A 9 28.983 -7.301 23.333 1.00 0.00 H new ATOM 0 HD2 PRO A 9 27.479 -9.076 21.655 1.00 0.00 H new ATOM 0 HD3 PRO A 9 28.862 -9.492 22.649 1.00 0.00 H new ATOM 131 N TRP A 10 24.307 -7.518 24.703 1.00 0.00 N ATOM 132 CA TRP A 10 22.915 -7.198 24.437 1.00 0.00 C ATOM 133 C TRP A 10 22.728 -7.122 22.921 1.00 0.00 C ATOM 134 O TRP A 10 23.698 -7.187 22.168 1.00 0.00 O ATOM 135 CB TRP A 10 22.501 -5.912 25.155 1.00 0.00 C ATOM 136 CG TRP A 10 22.666 -5.967 26.675 1.00 0.00 C ATOM 137 CD1 TRP A 10 23.459 -6.777 27.390 1.00 0.00 C ATOM 138 CD2 TRP A 10 21.987 -5.141 27.645 1.00 0.00 C ATOM 139 NE1 TRP A 10 23.340 -6.535 28.744 1.00 0.00 N ATOM 140 CE2 TRP A 10 22.417 -5.509 28.903 1.00 0.00 C ATOM 141 CE3 TRP A 10 21.040 -4.117 27.464 1.00 0.00 C ATOM 142 CZ2 TRP A 10 21.955 -4.904 30.078 1.00 0.00 C ATOM 143 CZ3 TRP A 10 20.588 -3.523 28.648 1.00 0.00 C ATOM 144 CH2 TRP A 10 21.011 -3.881 29.922 1.00 0.00 C ATOM 0 H TRP A 10 24.786 -6.859 25.317 1.00 0.00 H new ATOM 0 HA TRP A 10 22.259 -7.975 24.830 1.00 0.00 H new ATOM 0 HB2 TRP A 10 23.093 -5.084 24.765 1.00 0.00 H new ATOM 0 HB3 TRP A 10 21.459 -5.697 24.921 1.00 0.00 H new ATOM 0 HD1 TRP A 10 24.109 -7.525 26.961 1.00 0.00 H new ATOM 0 HE1 TRP A 10 23.838 -7.020 29.490 1.00 0.00 H new ATOM 0 HE3 TRP A 10 20.689 -3.813 26.489 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 22.307 -5.210 31.052 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 19.859 -2.730 28.565 1.00 0.00 H new ATOM 0 HH2 TRP A 10 20.614 -3.373 30.788 1.00 0.00 H new ATOM 155 N THR A 11 21.473 -6.986 22.517 1.00 0.00 N ATOM 156 CA THR A 11 21.147 -6.901 21.104 1.00 0.00 C ATOM 157 C THR A 11 19.870 -6.082 20.900 1.00 0.00 C ATOM 158 O THR A 11 19.445 -5.355 21.796 1.00 0.00 O ATOM 159 CB THR A 11 21.049 -8.326 20.555 1.00 0.00 C ATOM 160 OG1 THR A 11 19.777 -8.785 21.005 1.00 0.00 O ATOM 161 CG2 THR A 11 22.045 -9.279 21.218 1.00 0.00 C ATOM 0 H THR A 11 20.670 -6.933 23.144 1.00 0.00 H new ATOM 0 HA THR A 11 21.925 -6.376 20.549 1.00 0.00 H new ATOM 0 HB THR A 11 21.221 -8.313 19.479 1.00 0.00 H new ATOM 0 HG1 THR A 11 19.631 -9.702 20.692 1.00 0.00 H new ATOM 0 HG21 THR A 11 21.933 -10.276 20.792 1.00 0.00 H new ATOM 0 HG22 THR A 11 23.060 -8.922 21.045 1.00 0.00 H new ATOM 0 HG23 THR A 11 21.852 -9.319 22.290 1.00 0.00 H new ATOM 169 N LYS A 12 19.295 -6.228 19.715 1.00 0.00 N ATOM 170 CA LYS A 12 18.076 -5.511 19.382 1.00 0.00 C ATOM 171 C LYS A 12 17.055 -5.701 20.505 1.00 0.00 C ATOM 172 O LYS A 12 16.279 -4.794 20.803 1.00 0.00 O ATOM 173 CB LYS A 12 17.563 -5.938 18.005 1.00 0.00 C ATOM 174 CG LYS A 12 16.166 -5.373 17.741 1.00 0.00 C ATOM 175 CD LYS A 12 16.244 -4.060 16.959 1.00 0.00 C ATOM 176 CE LYS A 12 15.631 -2.908 17.757 1.00 0.00 C ATOM 177 NZ LYS A 12 15.085 -1.878 16.846 1.00 0.00 N ATOM 0 H LYS A 12 19.651 -6.832 18.974 1.00 0.00 H new ATOM 0 HA LYS A 12 18.271 -4.441 19.306 1.00 0.00 H new ATOM 0 HB2 LYS A 12 18.251 -5.592 17.233 1.00 0.00 H new ATOM 0 HB3 LYS A 12 17.537 -7.026 17.944 1.00 0.00 H new ATOM 0 HG2 LYS A 12 15.576 -6.099 17.182 1.00 0.00 H new ATOM 0 HG3 LYS A 12 15.652 -5.206 18.688 1.00 0.00 H new ATOM 0 HD2 LYS A 12 17.284 -3.833 16.726 1.00 0.00 H new ATOM 0 HD3 LYS A 12 15.721 -4.167 16.009 1.00 0.00 H new ATOM 0 HE2 LYS A 12 14.839 -3.287 18.403 1.00 0.00 H new ATOM 0 HE3 LYS A 12 16.387 -2.465 18.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 15.050 -0.963 17.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 15.695 -1.797 16.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 14.125 -2.149 16.550 1.00 0.00 H new ATOM 191 N GLU A 13 17.088 -6.885 21.097 1.00 0.00 N ATOM 192 CA GLU A 13 16.174 -7.206 22.180 1.00 0.00 C ATOM 193 C GLU A 13 16.192 -6.097 23.235 1.00 0.00 C ATOM 194 O GLU A 13 15.274 -5.281 23.298 1.00 0.00 O ATOM 195 CB GLU A 13 16.516 -8.560 22.804 1.00 0.00 C ATOM 196 CG GLU A 13 15.247 -9.325 23.185 1.00 0.00 C ATOM 197 CD GLU A 13 15.186 -9.570 24.694 1.00 0.00 C ATOM 198 OE1 GLU A 13 15.902 -10.487 25.149 1.00 0.00 O ATOM 199 OE2 GLU A 13 14.425 -8.833 25.358 1.00 0.00 O ATOM 0 H GLU A 13 17.733 -7.634 20.847 1.00 0.00 H new ATOM 0 HA GLU A 13 15.167 -7.276 21.770 1.00 0.00 H new ATOM 0 HB2 GLU A 13 17.103 -9.150 22.101 1.00 0.00 H new ATOM 0 HB3 GLU A 13 17.134 -8.411 23.689 1.00 0.00 H new ATOM 0 HG2 GLU A 13 14.369 -8.761 22.869 1.00 0.00 H new ATOM 0 HG3 GLU A 13 15.220 -10.278 22.657 1.00 0.00 H new ATOM 206 N GLU A 14 17.247 -6.103 24.036 1.00 0.00 N ATOM 207 CA GLU A 14 17.396 -5.109 25.085 1.00 0.00 C ATOM 208 C GLU A 14 17.217 -3.702 24.511 1.00 0.00 C ATOM 209 O GLU A 14 16.607 -2.842 25.144 1.00 0.00 O ATOM 210 CB GLU A 14 18.750 -5.247 25.784 1.00 0.00 C ATOM 211 CG GLU A 14 18.806 -6.528 26.620 1.00 0.00 C ATOM 212 CD GLU A 14 19.122 -7.741 25.743 1.00 0.00 C ATOM 213 OE1 GLU A 14 20.148 -7.675 25.031 1.00 0.00 O ATOM 214 OE2 GLU A 14 18.332 -8.707 25.805 1.00 0.00 O ATOM 0 H GLU A 14 18.007 -6.781 23.980 1.00 0.00 H new ATOM 0 HA GLU A 14 16.620 -5.278 25.832 1.00 0.00 H new ATOM 0 HB2 GLU A 14 19.548 -5.258 25.041 1.00 0.00 H new ATOM 0 HB3 GLU A 14 18.923 -4.382 26.425 1.00 0.00 H new ATOM 0 HG2 GLU A 14 19.565 -6.428 27.395 1.00 0.00 H new ATOM 0 HG3 GLU A 14 17.852 -6.679 27.126 1.00 0.00 H new ATOM 221 N ASP A 15 17.761 -3.510 23.318 1.00 0.00 N ATOM 222 CA ASP A 15 17.669 -2.223 22.651 1.00 0.00 C ATOM 223 C ASP A 15 16.201 -1.910 22.355 1.00 0.00 C ATOM 224 O ASP A 15 15.811 -0.745 22.292 1.00 0.00 O ATOM 225 CB ASP A 15 18.427 -2.235 21.322 1.00 0.00 C ATOM 226 CG ASP A 15 19.907 -1.860 21.419 1.00 0.00 C ATOM 227 OD1 ASP A 15 20.628 -2.577 22.144 1.00 0.00 O ATOM 228 OD2 ASP A 15 20.284 -0.863 20.764 1.00 0.00 O ATOM 0 H ASP A 15 18.267 -4.225 22.796 1.00 0.00 H new ATOM 0 HA ASP A 15 18.106 -1.471 23.308 1.00 0.00 H new ATOM 0 HB2 ASP A 15 18.348 -3.230 20.885 1.00 0.00 H new ATOM 0 HB3 ASP A 15 17.937 -1.545 20.635 1.00 0.00 H new ATOM 233 N GLN A 16 15.427 -2.971 22.180 1.00 0.00 N ATOM 234 CA GLN A 16 14.010 -2.824 21.892 1.00 0.00 C ATOM 235 C GLN A 16 13.283 -2.221 23.096 1.00 0.00 C ATOM 236 O GLN A 16 12.271 -1.541 22.937 1.00 0.00 O ATOM 237 CB GLN A 16 13.390 -4.165 21.493 1.00 0.00 C ATOM 238 CG GLN A 16 12.846 -4.904 22.717 1.00 0.00 C ATOM 239 CD GLN A 16 11.325 -4.769 22.808 1.00 0.00 C ATOM 240 OE1 GLN A 16 10.792 -3.912 23.494 1.00 0.00 O ATOM 241 NE2 GLN A 16 10.658 -5.659 22.079 1.00 0.00 N ATOM 0 H GLN A 16 15.754 -3.936 22.232 1.00 0.00 H new ATOM 0 HA GLN A 16 13.900 -2.144 21.048 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.585 -3.999 20.777 1.00 0.00 H new ATOM 0 HB3 GLN A 16 14.138 -4.781 20.994 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.118 -5.958 22.661 1.00 0.00 H new ATOM 0 HG3 GLN A 16 13.305 -4.504 23.621 1.00 0.00 H new ATOM 0 HE21 GLN A 16 11.166 -6.350 21.527 1.00 0.00 H new ATOM 0 HE22 GLN A 16 9.638 -5.651 22.072 1.00 0.00 H new ATOM 250 N LYS A 17 13.828 -2.493 24.273 1.00 0.00 N ATOM 251 CA LYS A 17 13.244 -1.985 25.503 1.00 0.00 C ATOM 252 C LYS A 17 13.401 -0.464 25.547 1.00 0.00 C ATOM 253 O LYS A 17 12.440 0.255 25.818 1.00 0.00 O ATOM 254 CB LYS A 17 13.844 -2.701 26.715 1.00 0.00 C ATOM 255 CG LYS A 17 12.803 -2.866 27.824 1.00 0.00 C ATOM 256 CD LYS A 17 13.349 -2.376 29.167 1.00 0.00 C ATOM 257 CE LYS A 17 12.252 -2.362 30.233 1.00 0.00 C ATOM 258 NZ LYS A 17 11.677 -3.715 30.403 1.00 0.00 N ATOM 0 H LYS A 17 14.667 -3.058 24.401 1.00 0.00 H new ATOM 0 HA LYS A 17 12.175 -2.196 25.533 1.00 0.00 H new ATOM 0 HB2 LYS A 17 14.219 -3.679 26.415 1.00 0.00 H new ATOM 0 HB3 LYS A 17 14.696 -2.135 27.092 1.00 0.00 H new ATOM 0 HG2 LYS A 17 11.902 -2.308 27.568 1.00 0.00 H new ATOM 0 HG3 LYS A 17 12.516 -3.914 27.905 1.00 0.00 H new ATOM 0 HD2 LYS A 17 14.166 -3.022 29.489 1.00 0.00 H new ATOM 0 HD3 LYS A 17 13.762 -1.374 29.052 1.00 0.00 H new ATOM 0 HE2 LYS A 17 12.662 -2.013 31.181 1.00 0.00 H new ATOM 0 HE3 LYS A 17 11.468 -1.661 29.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 11.073 -3.732 31.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 11.109 -3.958 29.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 12.445 -4.407 30.513 1.00 0.00 H new ATOM 272 N VAL A 18 14.619 -0.018 25.276 1.00 0.00 N ATOM 273 CA VAL A 18 14.913 1.405 25.282 1.00 0.00 C ATOM 274 C VAL A 18 13.880 2.138 24.424 1.00 0.00 C ATOM 275 O VAL A 18 13.276 3.112 24.870 1.00 0.00 O ATOM 276 CB VAL A 18 16.352 1.643 24.820 1.00 0.00 C ATOM 277 CG1 VAL A 18 16.471 2.964 24.057 1.00 0.00 C ATOM 278 CG2 VAL A 18 17.321 1.604 26.003 1.00 0.00 C ATOM 0 H VAL A 18 15.413 -0.617 25.051 1.00 0.00 H new ATOM 0 HA VAL A 18 14.840 1.807 26.293 1.00 0.00 H new ATOM 0 HB VAL A 18 16.623 0.837 24.138 1.00 0.00 H new ATOM 0 HG11 VAL A 18 17.504 3.109 23.740 1.00 0.00 H new ATOM 0 HG12 VAL A 18 15.823 2.938 23.181 1.00 0.00 H new ATOM 0 HG13 VAL A 18 16.172 3.787 24.706 1.00 0.00 H new ATOM 0 HG21 VAL A 18 18.337 1.776 25.647 1.00 0.00 H new ATOM 0 HG22 VAL A 18 17.051 2.380 26.720 1.00 0.00 H new ATOM 0 HG23 VAL A 18 17.266 0.629 26.486 1.00 0.00 H new ATOM 288 N ILE A 19 13.709 1.642 23.207 1.00 0.00 N ATOM 289 CA ILE A 19 12.760 2.238 22.282 1.00 0.00 C ATOM 290 C ILE A 19 11.392 2.343 22.960 1.00 0.00 C ATOM 291 O ILE A 19 10.686 3.336 22.789 1.00 0.00 O ATOM 292 CB ILE A 19 12.735 1.460 20.965 1.00 0.00 C ATOM 293 CG1 ILE A 19 13.872 1.907 20.043 1.00 0.00 C ATOM 294 CG2 ILE A 19 11.369 1.574 20.286 1.00 0.00 C ATOM 295 CD1 ILE A 19 15.113 2.294 20.851 1.00 0.00 C ATOM 0 H ILE A 19 14.212 0.834 22.840 1.00 0.00 H new ATOM 0 HA ILE A 19 13.066 3.251 22.021 1.00 0.00 H new ATOM 0 HB ILE A 19 12.896 0.405 21.188 1.00 0.00 H new ATOM 0 HG12 ILE A 19 14.121 1.103 19.350 1.00 0.00 H new ATOM 0 HG13 ILE A 19 13.546 2.756 19.442 1.00 0.00 H new ATOM 0 HG21 ILE A 19 11.379 1.012 19.352 1.00 0.00 H new ATOM 0 HG22 ILE A 19 10.600 1.170 20.945 1.00 0.00 H new ATOM 0 HG23 ILE A 19 11.153 2.622 20.077 1.00 0.00 H new ATOM 0 HD11 ILE A 19 15.906 2.608 20.172 1.00 0.00 H new ATOM 0 HD12 ILE A 19 14.867 3.114 21.525 1.00 0.00 H new ATOM 0 HD13 ILE A 19 15.451 1.436 21.432 1.00 0.00 H new ATOM 307 N GLU A 20 11.060 1.306 23.714 1.00 0.00 N ATOM 308 CA GLU A 20 9.789 1.270 24.418 1.00 0.00 C ATOM 309 C GLU A 20 9.793 2.275 25.572 1.00 0.00 C ATOM 310 O GLU A 20 8.735 2.703 26.030 1.00 0.00 O ATOM 311 CB GLU A 20 9.481 -0.142 24.921 1.00 0.00 C ATOM 312 CG GLU A 20 7.985 -0.444 24.823 1.00 0.00 C ATOM 313 CD GLU A 20 7.209 0.254 25.942 1.00 0.00 C ATOM 314 OE1 GLU A 20 7.610 0.068 27.112 1.00 0.00 O ATOM 315 OE2 GLU A 20 6.233 0.957 25.603 1.00 0.00 O ATOM 0 H GLU A 20 11.648 0.485 23.853 1.00 0.00 H new ATOM 0 HA GLU A 20 9.001 1.551 23.720 1.00 0.00 H new ATOM 0 HB2 GLU A 20 10.042 -0.871 24.336 1.00 0.00 H new ATOM 0 HB3 GLU A 20 9.809 -0.243 25.955 1.00 0.00 H new ATOM 0 HG2 GLU A 20 7.607 -0.116 23.855 1.00 0.00 H new ATOM 0 HG3 GLU A 20 7.823 -1.520 24.880 1.00 0.00 H new ATOM 322 N LEU A 21 10.995 2.621 26.009 1.00 0.00 N ATOM 323 CA LEU A 21 11.150 3.567 27.101 1.00 0.00 C ATOM 324 C LEU A 21 11.064 4.992 26.552 1.00 0.00 C ATOM 325 O LEU A 21 10.074 5.688 26.772 1.00 0.00 O ATOM 326 CB LEU A 21 12.438 3.284 27.876 1.00 0.00 C ATOM 327 CG LEU A 21 12.331 2.251 29.001 1.00 0.00 C ATOM 328 CD1 LEU A 21 13.570 1.354 29.041 1.00 0.00 C ATOM 329 CD2 LEU A 21 12.073 2.932 30.347 1.00 0.00 C ATOM 0 H LEU A 21 11.870 2.263 25.627 1.00 0.00 H new ATOM 0 HA LEU A 21 10.340 3.453 27.821 1.00 0.00 H new ATOM 0 HB2 LEU A 21 13.197 2.946 27.170 1.00 0.00 H new ATOM 0 HB3 LEU A 21 12.795 4.221 28.303 1.00 0.00 H new ATOM 0 HG LEU A 21 11.475 1.609 28.795 1.00 0.00 H new ATOM 0 HD11 LEU A 21 13.469 0.629 29.849 1.00 0.00 H new ATOM 0 HD12 LEU A 21 13.669 0.828 28.092 1.00 0.00 H new ATOM 0 HD13 LEU A 21 14.456 1.965 29.211 1.00 0.00 H new ATOM 0 HD21 LEU A 21 12.001 2.176 31.129 1.00 0.00 H new ATOM 0 HD22 LEU A 21 12.894 3.612 30.574 1.00 0.00 H new ATOM 0 HD23 LEU A 21 11.140 3.493 30.298 1.00 0.00 H new ATOM 341 N VAL A 22 12.115 5.385 25.846 1.00 0.00 N ATOM 342 CA VAL A 22 12.170 6.714 25.263 1.00 0.00 C ATOM 343 C VAL A 22 10.799 7.071 24.686 1.00 0.00 C ATOM 344 O VAL A 22 10.429 8.243 24.634 1.00 0.00 O ATOM 345 CB VAL A 22 13.292 6.784 24.225 1.00 0.00 C ATOM 346 CG1 VAL A 22 13.526 8.225 23.767 1.00 0.00 C ATOM 347 CG2 VAL A 22 14.581 6.165 24.769 1.00 0.00 C ATOM 0 H VAL A 22 12.935 4.806 25.665 1.00 0.00 H new ATOM 0 HA VAL A 22 12.404 7.456 26.026 1.00 0.00 H new ATOM 0 HB VAL A 22 12.982 6.203 23.356 1.00 0.00 H new ATOM 0 HG11 VAL A 22 14.328 8.247 23.030 1.00 0.00 H new ATOM 0 HG12 VAL A 22 12.612 8.618 23.321 1.00 0.00 H new ATOM 0 HG13 VAL A 22 13.804 8.839 24.624 1.00 0.00 H new ATOM 0 HG21 VAL A 22 15.362 6.228 24.012 1.00 0.00 H new ATOM 0 HG22 VAL A 22 14.896 6.706 25.661 1.00 0.00 H new ATOM 0 HG23 VAL A 22 14.404 5.120 25.022 1.00 0.00 H new ATOM 357 N LYS A 23 10.082 6.039 24.267 1.00 0.00 N ATOM 358 CA LYS A 23 8.759 6.229 23.696 1.00 0.00 C ATOM 359 C LYS A 23 7.789 6.658 24.799 1.00 0.00 C ATOM 360 O LYS A 23 7.116 7.680 24.674 1.00 0.00 O ATOM 361 CB LYS A 23 8.316 4.974 22.942 1.00 0.00 C ATOM 362 CG LYS A 23 8.762 5.027 21.479 1.00 0.00 C ATOM 363 CD LYS A 23 7.568 5.249 20.549 1.00 0.00 C ATOM 364 CE LYS A 23 7.816 6.432 19.611 1.00 0.00 C ATOM 365 NZ LYS A 23 7.308 6.133 18.254 1.00 0.00 N ATOM 0 H LYS A 23 10.392 5.068 24.311 1.00 0.00 H new ATOM 0 HA LYS A 23 8.775 7.029 22.956 1.00 0.00 H new ATOM 0 HB2 LYS A 23 8.736 4.090 23.422 1.00 0.00 H new ATOM 0 HB3 LYS A 23 7.231 4.879 22.992 1.00 0.00 H new ATOM 0 HG2 LYS A 23 9.486 5.831 21.345 1.00 0.00 H new ATOM 0 HG3 LYS A 23 9.265 4.097 21.215 1.00 0.00 H new ATOM 0 HD2 LYS A 23 7.386 4.348 19.963 1.00 0.00 H new ATOM 0 HD3 LYS A 23 6.671 5.431 21.140 1.00 0.00 H new ATOM 0 HE2 LYS A 23 7.324 7.323 20.002 1.00 0.00 H new ATOM 0 HE3 LYS A 23 8.883 6.651 19.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 7.484 6.946 17.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 7.796 5.295 17.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 6.286 5.947 18.299 1.00 0.00 H new ATOM 379 N LYS A 24 7.749 5.856 25.852 1.00 0.00 N ATOM 380 CA LYS A 24 6.872 6.141 26.976 1.00 0.00 C ATOM 381 C LYS A 24 7.336 7.425 27.666 1.00 0.00 C ATOM 382 O LYS A 24 6.551 8.089 28.342 1.00 0.00 O ATOM 383 CB LYS A 24 6.792 4.933 27.912 1.00 0.00 C ATOM 384 CG LYS A 24 5.492 4.950 28.718 1.00 0.00 C ATOM 385 CD LYS A 24 5.778 4.957 30.221 1.00 0.00 C ATOM 386 CE LYS A 24 6.346 6.307 30.665 1.00 0.00 C ATOM 387 NZ LYS A 24 5.298 7.350 30.618 1.00 0.00 N ATOM 0 H LYS A 24 8.309 5.009 25.951 1.00 0.00 H new ATOM 0 HA LYS A 24 5.853 6.315 26.631 1.00 0.00 H new ATOM 0 HB2 LYS A 24 6.852 4.013 27.330 1.00 0.00 H new ATOM 0 HB3 LYS A 24 7.645 4.937 28.591 1.00 0.00 H new ATOM 0 HG2 LYS A 24 4.906 5.830 28.452 1.00 0.00 H new ATOM 0 HG3 LYS A 24 4.890 4.078 28.463 1.00 0.00 H new ATOM 0 HD2 LYS A 24 4.860 4.746 30.770 1.00 0.00 H new ATOM 0 HD3 LYS A 24 6.485 4.163 30.464 1.00 0.00 H new ATOM 0 HE2 LYS A 24 6.742 6.226 31.677 1.00 0.00 H new ATOM 0 HE3 LYS A 24 7.177 6.589 30.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 5.360 7.943 31.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 5.435 7.942 29.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 4.362 6.900 30.577 1.00 0.00 H new ATOM 401 N TYR A 25 8.609 7.736 27.473 1.00 0.00 N ATOM 402 CA TYR A 25 9.187 8.929 28.069 1.00 0.00 C ATOM 403 C TYR A 25 8.942 10.156 27.188 1.00 0.00 C ATOM 404 O TYR A 25 8.322 11.124 27.624 1.00 0.00 O ATOM 405 CB TYR A 25 10.692 8.670 28.157 1.00 0.00 C ATOM 406 CG TYR A 25 11.109 7.820 29.358 1.00 0.00 C ATOM 407 CD1 TYR A 25 10.252 6.858 29.853 1.00 0.00 C ATOM 408 CD2 TYR A 25 12.341 8.015 29.947 1.00 0.00 C ATOM 409 CE1 TYR A 25 10.644 6.057 30.984 1.00 0.00 C ATOM 410 CE2 TYR A 25 12.734 7.214 31.078 1.00 0.00 C ATOM 411 CZ TYR A 25 11.866 6.275 31.541 1.00 0.00 C ATOM 412 OH TYR A 25 12.236 5.519 32.609 1.00 0.00 O ATOM 0 H TYR A 25 9.257 7.183 26.912 1.00 0.00 H new ATOM 0 HA TYR A 25 8.740 9.127 29.043 1.00 0.00 H new ATOM 0 HB2 TYR A 25 11.019 8.174 27.243 1.00 0.00 H new ATOM 0 HB3 TYR A 25 11.213 9.627 28.204 1.00 0.00 H new ATOM 0 HD1 TYR A 25 9.287 6.706 29.392 1.00 0.00 H new ATOM 0 HD2 TYR A 25 13.011 8.768 29.560 1.00 0.00 H new ATOM 0 HE1 TYR A 25 9.983 5.301 31.381 1.00 0.00 H new ATOM 0 HE2 TYR A 25 13.696 7.356 31.548 1.00 0.00 H new ATOM 0 HH TYR A 25 13.133 5.783 32.902 1.00 0.00 H new ATOM 422 N GLY A 26 9.443 10.074 25.964 1.00 0.00 N ATOM 423 CA GLY A 26 9.286 11.166 25.018 1.00 0.00 C ATOM 424 C GLY A 26 9.497 12.518 25.701 1.00 0.00 C ATOM 425 O GLY A 26 8.639 12.977 26.455 1.00 0.00 O ATOM 0 H GLY A 26 9.957 9.269 25.606 1.00 0.00 H new ATOM 0 HA2 GLY A 26 10.000 11.051 24.203 1.00 0.00 H new ATOM 0 HA3 GLY A 26 8.290 11.129 24.577 1.00 0.00 H new ATOM 429 N THR A 27 10.642 13.119 25.413 1.00 0.00 N ATOM 430 CA THR A 27 10.975 14.410 25.991 1.00 0.00 C ATOM 431 C THR A 27 12.464 14.709 25.804 1.00 0.00 C ATOM 432 O THR A 27 12.832 15.598 25.038 1.00 0.00 O ATOM 433 CB THR A 27 10.536 14.400 27.456 1.00 0.00 C ATOM 434 OG1 THR A 27 11.431 15.308 28.093 1.00 0.00 O ATOM 435 CG2 THR A 27 10.814 13.061 28.142 1.00 0.00 C ATOM 0 H THR A 27 11.351 12.736 24.787 1.00 0.00 H new ATOM 0 HA THR A 27 10.447 15.218 25.485 1.00 0.00 H new ATOM 0 HB THR A 27 9.471 14.625 27.517 1.00 0.00 H new ATOM 0 HG1 THR A 27 11.216 15.363 29.048 1.00 0.00 H new ATOM 0 HG21 THR A 27 10.483 13.108 29.180 1.00 0.00 H new ATOM 0 HG22 THR A 27 10.274 12.268 27.625 1.00 0.00 H new ATOM 0 HG23 THR A 27 11.883 12.851 28.111 1.00 0.00 H new ATOM 443 N LYS A 28 13.282 13.949 26.519 1.00 0.00 N ATOM 444 CA LYS A 28 14.722 14.121 26.442 1.00 0.00 C ATOM 445 C LYS A 28 15.385 13.357 27.590 1.00 0.00 C ATOM 446 O LYS A 28 16.016 13.958 28.458 1.00 0.00 O ATOM 447 CB LYS A 28 15.083 15.607 26.403 1.00 0.00 C ATOM 448 CG LYS A 28 16.555 15.824 26.761 1.00 0.00 C ATOM 449 CD LYS A 28 16.693 16.521 28.116 1.00 0.00 C ATOM 450 CE LYS A 28 17.717 15.805 28.999 1.00 0.00 C ATOM 451 NZ LYS A 28 18.670 16.777 29.580 1.00 0.00 N ATOM 0 H LYS A 28 12.974 13.213 27.154 1.00 0.00 H new ATOM 0 HA LYS A 28 15.107 13.699 25.514 1.00 0.00 H new ATOM 0 HB2 LYS A 28 14.884 16.007 25.409 1.00 0.00 H new ATOM 0 HB3 LYS A 28 14.451 16.157 27.100 1.00 0.00 H new ATOM 0 HG2 LYS A 28 17.072 14.865 26.787 1.00 0.00 H new ATOM 0 HG3 LYS A 28 17.036 16.424 25.989 1.00 0.00 H new ATOM 0 HD2 LYS A 28 16.997 17.557 27.967 1.00 0.00 H new ATOM 0 HD3 LYS A 28 15.726 16.542 28.618 1.00 0.00 H new ATOM 0 HE2 LYS A 28 17.205 15.267 29.797 1.00 0.00 H new ATOM 0 HE3 LYS A 28 18.258 15.064 28.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 19.358 16.275 30.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 19.171 17.272 28.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 18.151 17.469 30.158 1.00 0.00 H new ATOM 465 N GLN A 29 15.219 12.043 27.557 1.00 0.00 N ATOM 466 CA GLN A 29 15.794 11.190 28.584 1.00 0.00 C ATOM 467 C GLN A 29 16.656 10.098 27.946 1.00 0.00 C ATOM 468 O GLN A 29 16.219 8.956 27.814 1.00 0.00 O ATOM 469 CB GLN A 29 14.701 10.581 29.465 1.00 0.00 C ATOM 470 CG GLN A 29 14.407 11.476 30.670 1.00 0.00 C ATOM 471 CD GLN A 29 13.769 10.674 31.806 1.00 0.00 C ATOM 472 OE1 GLN A 29 14.436 10.015 32.586 1.00 0.00 O ATOM 473 NE2 GLN A 29 12.443 10.766 31.856 1.00 0.00 N ATOM 0 H GLN A 29 14.695 11.548 26.836 1.00 0.00 H new ATOM 0 HA GLN A 29 16.431 11.802 29.223 1.00 0.00 H new ATOM 0 HB2 GLN A 29 13.792 10.443 28.880 1.00 0.00 H new ATOM 0 HB3 GLN A 29 15.013 9.594 29.808 1.00 0.00 H new ATOM 0 HG2 GLN A 29 15.331 11.936 31.020 1.00 0.00 H new ATOM 0 HG3 GLN A 29 13.740 12.285 30.372 1.00 0.00 H new ATOM 0 HE21 GLN A 29 11.945 11.336 31.172 1.00 0.00 H new ATOM 0 HE22 GLN A 29 11.924 10.267 32.579 1.00 0.00 H new ATOM 482 N TRP A 30 17.864 10.489 27.568 1.00 0.00 N ATOM 483 CA TRP A 30 18.791 9.558 26.948 1.00 0.00 C ATOM 484 C TRP A 30 19.530 8.814 28.062 1.00 0.00 C ATOM 485 O TRP A 30 20.266 7.864 27.797 1.00 0.00 O ATOM 486 CB TRP A 30 19.734 10.282 25.985 1.00 0.00 C ATOM 487 CG TRP A 30 19.217 10.358 24.547 1.00 0.00 C ATOM 488 CD1 TRP A 30 18.663 11.407 23.924 1.00 0.00 C ATOM 489 CD2 TRP A 30 19.230 9.295 23.572 1.00 0.00 C ATOM 490 NE1 TRP A 30 18.319 11.099 22.624 1.00 0.00 N ATOM 491 CE2 TRP A 30 18.674 9.774 22.403 1.00 0.00 C ATOM 492 CE3 TRP A 30 19.695 7.972 23.674 1.00 0.00 C ATOM 493 CZ2 TRP A 30 18.532 8.997 21.247 1.00 0.00 C ATOM 494 CZ3 TRP A 30 19.545 7.208 22.510 1.00 0.00 C ATOM 495 CH2 TRP A 30 18.988 7.675 21.325 1.00 0.00 C ATOM 0 H TRP A 30 18.222 11.438 27.679 1.00 0.00 H new ATOM 0 HA TRP A 30 18.256 8.830 26.338 1.00 0.00 H new ATOM 0 HB2 TRP A 30 19.905 11.294 26.353 1.00 0.00 H new ATOM 0 HB3 TRP A 30 20.699 9.774 25.987 1.00 0.00 H new ATOM 0 HD1 TRP A 30 18.506 12.372 24.382 1.00 0.00 H new ATOM 0 HE1 TRP A 30 17.884 11.728 21.949 1.00 0.00 H new ATOM 0 HE3 TRP A 30 20.133 7.576 24.578 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 18.094 9.396 20.344 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 19.886 6.184 22.535 1.00 0.00 H new ATOM 0 HH2 TRP A 30 18.907 7.022 20.469 1.00 0.00 H new ATOM 506 N THR A 31 19.308 9.273 29.285 1.00 0.00 N ATOM 507 CA THR A 31 19.944 8.662 30.440 1.00 0.00 C ATOM 508 C THR A 31 19.386 7.257 30.675 1.00 0.00 C ATOM 509 O THR A 31 20.135 6.332 30.986 1.00 0.00 O ATOM 510 CB THR A 31 19.753 9.600 31.635 1.00 0.00 C ATOM 511 OG1 THR A 31 21.074 9.805 32.128 1.00 0.00 O ATOM 512 CG2 THR A 31 19.022 8.925 32.797 1.00 0.00 C ATOM 0 H THR A 31 18.697 10.061 29.501 1.00 0.00 H new ATOM 0 HA THR A 31 21.014 8.530 30.279 1.00 0.00 H new ATOM 0 HB THR A 31 19.196 10.482 31.320 1.00 0.00 H new ATOM 0 HG1 THR A 31 21.045 10.404 32.903 1.00 0.00 H new ATOM 0 HG21 THR A 31 18.912 9.633 33.618 1.00 0.00 H new ATOM 0 HG22 THR A 31 18.036 8.598 32.466 1.00 0.00 H new ATOM 0 HG23 THR A 31 19.596 8.062 33.136 1.00 0.00 H new ATOM 520 N LEU A 32 18.076 7.142 30.519 1.00 0.00 N ATOM 521 CA LEU A 32 17.409 5.865 30.711 1.00 0.00 C ATOM 522 C LEU A 32 18.114 4.795 29.874 1.00 0.00 C ATOM 523 O LEU A 32 18.428 3.717 30.375 1.00 0.00 O ATOM 524 CB LEU A 32 15.914 5.991 30.413 1.00 0.00 C ATOM 525 CG LEU A 32 15.475 5.597 29.001 1.00 0.00 C ATOM 526 CD1 LEU A 32 15.541 4.081 28.809 1.00 0.00 C ATOM 527 CD2 LEU A 32 14.087 6.156 28.682 1.00 0.00 C ATOM 0 H LEU A 32 17.458 7.912 30.262 1.00 0.00 H new ATOM 0 HA LEU A 32 17.478 5.553 31.753 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.368 5.374 31.127 1.00 0.00 H new ATOM 0 HB3 LEU A 32 15.614 7.024 30.590 1.00 0.00 H new ATOM 0 HG LEU A 32 16.172 6.042 28.290 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.224 3.828 27.797 1.00 0.00 H new ATOM 0 HD12 LEU A 32 16.564 3.739 28.965 1.00 0.00 H new ATOM 0 HD13 LEU A 32 14.882 3.594 29.528 1.00 0.00 H new ATOM 0 HD21 LEU A 32 13.799 5.861 27.673 1.00 0.00 H new ATOM 0 HD22 LEU A 32 13.363 5.762 29.395 1.00 0.00 H new ATOM 0 HD23 LEU A 32 14.108 7.244 28.750 1.00 0.00 H new ATOM 539 N ILE A 33 18.343 5.132 28.613 1.00 0.00 N ATOM 540 CA ILE A 33 19.006 4.214 27.702 1.00 0.00 C ATOM 541 C ILE A 33 20.369 3.827 28.277 1.00 0.00 C ATOM 542 O ILE A 33 20.559 2.698 28.727 1.00 0.00 O ATOM 543 CB ILE A 33 19.079 4.814 26.296 1.00 0.00 C ATOM 544 CG1 ILE A 33 17.680 5.123 25.758 1.00 0.00 C ATOM 545 CG2 ILE A 33 19.868 3.904 25.353 1.00 0.00 C ATOM 546 CD1 ILE A 33 17.296 6.578 26.034 1.00 0.00 C ATOM 0 H ILE A 33 18.081 6.028 28.201 1.00 0.00 H new ATOM 0 HA ILE A 33 18.430 3.294 27.602 1.00 0.00 H new ATOM 0 HB ILE A 33 19.617 5.760 26.355 1.00 0.00 H new ATOM 0 HG12 ILE A 33 17.649 4.932 24.685 1.00 0.00 H new ATOM 0 HG13 ILE A 33 16.953 4.457 26.222 1.00 0.00 H new ATOM 0 HG21 ILE A 33 19.905 4.353 24.360 1.00 0.00 H new ATOM 0 HG22 ILE A 33 20.882 3.778 25.733 1.00 0.00 H new ATOM 0 HG23 ILE A 33 19.380 2.931 25.293 1.00 0.00 H new ATOM 0 HD11 ILE A 33 16.298 6.772 25.642 1.00 0.00 H new ATOM 0 HD12 ILE A 33 17.305 6.759 27.109 1.00 0.00 H new ATOM 0 HD13 ILE A 33 18.012 7.242 25.548 1.00 0.00 H new ATOM 558 N ALA A 34 21.284 4.785 28.244 1.00 0.00 N ATOM 559 CA ALA A 34 22.624 4.558 28.757 1.00 0.00 C ATOM 560 C ALA A 34 22.534 3.918 30.144 1.00 0.00 C ATOM 561 O ALA A 34 23.457 3.229 30.574 1.00 0.00 O ATOM 562 CB ALA A 34 23.395 5.880 28.774 1.00 0.00 C ATOM 0 H ALA A 34 21.123 5.720 27.870 1.00 0.00 H new ATOM 0 HA ALA A 34 23.170 3.870 28.112 1.00 0.00 H new ATOM 0 HB1 ALA A 34 24.400 5.710 29.159 1.00 0.00 H new ATOM 0 HB2 ALA A 34 23.457 6.278 27.761 1.00 0.00 H new ATOM 0 HB3 ALA A 34 22.878 6.595 29.414 1.00 0.00 H new ATOM 568 N LYS A 35 21.413 4.169 30.804 1.00 0.00 N ATOM 569 CA LYS A 35 21.190 3.625 32.133 1.00 0.00 C ATOM 570 C LYS A 35 20.718 2.175 32.014 1.00 0.00 C ATOM 571 O LYS A 35 21.081 1.331 32.832 1.00 0.00 O ATOM 572 CB LYS A 35 20.233 4.520 32.924 1.00 0.00 C ATOM 573 CG LYS A 35 20.106 4.041 34.372 1.00 0.00 C ATOM 574 CD LYS A 35 18.834 3.213 34.565 1.00 0.00 C ATOM 575 CE LYS A 35 17.585 4.077 34.389 1.00 0.00 C ATOM 576 NZ LYS A 35 16.380 3.345 34.841 1.00 0.00 N ATOM 0 H LYS A 35 20.650 4.742 30.444 1.00 0.00 H new ATOM 0 HA LYS A 35 22.121 3.612 32.700 1.00 0.00 H new ATOM 0 HB2 LYS A 35 20.594 5.548 32.908 1.00 0.00 H new ATOM 0 HB3 LYS A 35 19.252 4.519 32.449 1.00 0.00 H new ATOM 0 HG2 LYS A 35 20.978 3.443 34.639 1.00 0.00 H new ATOM 0 HG3 LYS A 35 20.091 4.900 35.043 1.00 0.00 H new ATOM 0 HD2 LYS A 35 18.817 2.393 33.847 1.00 0.00 H new ATOM 0 HD3 LYS A 35 18.834 2.766 35.559 1.00 0.00 H new ATOM 0 HE2 LYS A 35 17.691 5.001 34.958 1.00 0.00 H new ATOM 0 HE3 LYS A 35 17.475 4.359 33.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 15.676 4.022 35.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 15.977 2.814 34.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 16.640 2.684 35.600 1.00 0.00 H new ATOM 590 N HIS A 36 19.916 1.929 30.988 1.00 0.00 N ATOM 591 CA HIS A 36 19.391 0.595 30.751 1.00 0.00 C ATOM 592 C HIS A 36 20.416 -0.228 29.968 1.00 0.00 C ATOM 593 O HIS A 36 20.898 -1.250 30.453 1.00 0.00 O ATOM 594 CB HIS A 36 18.029 0.663 30.056 1.00 0.00 C ATOM 595 CG HIS A 36 16.922 1.208 30.927 1.00 0.00 C ATOM 596 ND1 HIS A 36 15.622 0.738 30.869 1.00 0.00 N ATOM 597 CD2 HIS A 36 16.936 2.188 31.876 1.00 0.00 C ATOM 598 CE1 HIS A 36 14.894 1.411 31.747 1.00 0.00 C ATOM 599 NE2 HIS A 36 15.710 2.310 32.370 1.00 0.00 N ATOM 0 H HIS A 36 19.617 2.631 30.311 1.00 0.00 H new ATOM 0 HA HIS A 36 19.223 0.091 31.703 1.00 0.00 H new ATOM 0 HB2 HIS A 36 18.117 1.286 29.166 1.00 0.00 H new ATOM 0 HB3 HIS A 36 17.754 -0.337 29.719 1.00 0.00 H new ATOM 0 HD1 HIS A 36 15.282 -0.001 30.254 1.00 0.00 H new ATOM 0 HD2 HIS A 36 17.798 2.766 32.175 1.00 0.00 H new ATOM 0 HE1 HIS A 36 13.840 1.273 31.937 1.00 0.00 H new ATOM 607 N LEU A 37 20.718 0.248 28.769 1.00 0.00 N ATOM 608 CA LEU A 37 21.676 -0.431 27.913 1.00 0.00 C ATOM 609 C LEU A 37 23.063 0.181 28.122 1.00 0.00 C ATOM 610 O LEU A 37 23.419 1.159 27.467 1.00 0.00 O ATOM 611 CB LEU A 37 21.206 -0.407 26.457 1.00 0.00 C ATOM 612 CG LEU A 37 19.705 -0.209 26.240 1.00 0.00 C ATOM 613 CD1 LEU A 37 19.381 -0.061 24.752 1.00 0.00 C ATOM 614 CD2 LEU A 37 18.903 -1.338 26.892 1.00 0.00 C ATOM 0 H LEU A 37 20.316 1.096 28.370 1.00 0.00 H new ATOM 0 HA LEU A 37 21.748 -1.485 28.183 1.00 0.00 H new ATOM 0 HB2 LEU A 37 21.736 0.391 25.938 1.00 0.00 H new ATOM 0 HB3 LEU A 37 21.501 -1.345 25.985 1.00 0.00 H new ATOM 0 HG LEU A 37 19.409 0.720 26.728 1.00 0.00 H new ATOM 0 HD11 LEU A 37 18.307 0.078 24.626 1.00 0.00 H new ATOM 0 HD12 LEU A 37 19.909 0.803 24.349 1.00 0.00 H new ATOM 0 HD13 LEU A 37 19.695 -0.959 24.220 1.00 0.00 H new ATOM 0 HD21 LEU A 37 17.839 -1.173 26.723 1.00 0.00 H new ATOM 0 HD22 LEU A 37 19.196 -2.292 26.455 1.00 0.00 H new ATOM 0 HD23 LEU A 37 19.102 -1.354 27.964 1.00 0.00 H new ATOM 626 N LYS A 38 23.808 -0.421 29.038 1.00 0.00 N ATOM 627 CA LYS A 38 25.148 0.053 29.342 1.00 0.00 C ATOM 628 C LYS A 38 26.153 -0.662 28.437 1.00 0.00 C ATOM 629 O LYS A 38 27.262 -0.980 28.865 1.00 0.00 O ATOM 630 CB LYS A 38 25.445 -0.102 30.835 1.00 0.00 C ATOM 631 CG LYS A 38 25.430 -1.575 31.247 1.00 0.00 C ATOM 632 CD LYS A 38 26.818 -2.201 31.098 1.00 0.00 C ATOM 633 CE LYS A 38 27.163 -3.065 32.312 1.00 0.00 C ATOM 634 NZ LYS A 38 28.606 -2.964 32.627 1.00 0.00 N ATOM 0 H LYS A 38 23.509 -1.232 29.579 1.00 0.00 H new ATOM 0 HA LYS A 38 25.232 1.120 29.133 1.00 0.00 H new ATOM 0 HB2 LYS A 38 26.418 0.333 31.063 1.00 0.00 H new ATOM 0 HB3 LYS A 38 24.705 0.449 31.416 1.00 0.00 H new ATOM 0 HG2 LYS A 38 25.096 -1.664 32.281 1.00 0.00 H new ATOM 0 HG3 LYS A 38 24.713 -2.121 30.633 1.00 0.00 H new ATOM 0 HD2 LYS A 38 26.852 -2.808 30.194 1.00 0.00 H new ATOM 0 HD3 LYS A 38 27.565 -1.415 30.982 1.00 0.00 H new ATOM 0 HE2 LYS A 38 26.574 -2.746 33.172 1.00 0.00 H new ATOM 0 HE3 LYS A 38 26.900 -4.104 32.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 28.823 -3.557 33.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 29.163 -3.290 31.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 28.847 -1.974 32.838 1.00 0.00 H new ATOM 648 N GLY A 39 25.731 -0.894 27.203 1.00 0.00 N ATOM 649 CA GLY A 39 26.581 -1.565 26.234 1.00 0.00 C ATOM 650 C GLY A 39 27.489 -0.565 25.516 1.00 0.00 C ATOM 651 O GLY A 39 28.463 -0.955 24.874 1.00 0.00 O ATOM 0 H GLY A 39 24.811 -0.629 26.852 1.00 0.00 H new ATOM 0 HA2 GLY A 39 27.189 -2.317 26.737 1.00 0.00 H new ATOM 0 HA3 GLY A 39 25.964 -2.090 25.505 1.00 0.00 H new ATOM 655 N ARG A 40 27.139 0.706 25.650 1.00 0.00 N ATOM 656 CA ARG A 40 27.911 1.765 25.022 1.00 0.00 C ATOM 657 C ARG A 40 27.559 3.118 25.643 1.00 0.00 C ATOM 658 O ARG A 40 26.543 3.247 26.324 1.00 0.00 O ATOM 659 CB ARG A 40 27.648 1.819 23.516 1.00 0.00 C ATOM 660 CG ARG A 40 28.839 1.265 22.731 1.00 0.00 C ATOM 661 CD ARG A 40 29.856 2.368 22.427 1.00 0.00 C ATOM 662 NE ARG A 40 30.187 2.366 20.984 1.00 0.00 N ATOM 663 CZ ARG A 40 31.129 1.591 20.430 1.00 0.00 C ATOM 664 NH1 ARG A 40 31.839 0.750 21.194 1.00 0.00 N ATOM 665 NH2 ARG A 40 31.361 1.657 19.112 1.00 0.00 N ATOM 0 H ARG A 40 26.331 1.026 26.184 1.00 0.00 H new ATOM 0 HA ARG A 40 28.966 1.549 25.188 1.00 0.00 H new ATOM 0 HB2 ARG A 40 26.753 1.244 23.279 1.00 0.00 H new ATOM 0 HB3 ARG A 40 27.456 2.848 23.214 1.00 0.00 H new ATOM 0 HG2 ARG A 40 29.319 0.471 23.303 1.00 0.00 H new ATOM 0 HG3 ARG A 40 28.490 0.820 21.799 1.00 0.00 H new ATOM 0 HD2 ARG A 40 29.450 3.338 22.714 1.00 0.00 H new ATOM 0 HD3 ARG A 40 30.760 2.214 23.016 1.00 0.00 H new ATOM 0 HE ARG A 40 29.665 2.994 20.373 1.00 0.00 H new ATOM 0 HH11 ARG A 40 31.662 0.700 22.197 1.00 0.00 H new ATOM 0 HH12 ARG A 40 32.556 0.160 20.772 1.00 0.00 H new ATOM 0 HH21 ARG A 40 30.820 2.297 18.530 1.00 0.00 H new ATOM 0 HH22 ARG A 40 32.078 1.067 18.690 1.00 0.00 H new ATOM 679 N LEU A 41 28.419 4.093 25.387 1.00 0.00 N ATOM 680 CA LEU A 41 28.212 5.432 25.912 1.00 0.00 C ATOM 681 C LEU A 41 26.976 6.048 25.253 1.00 0.00 C ATOM 682 O LEU A 41 26.278 5.382 24.490 1.00 0.00 O ATOM 683 CB LEU A 41 29.479 6.273 25.751 1.00 0.00 C ATOM 684 CG LEU A 41 30.452 6.254 26.932 1.00 0.00 C ATOM 685 CD1 LEU A 41 29.924 7.102 28.091 1.00 0.00 C ATOM 686 CD2 LEU A 41 30.760 4.819 27.365 1.00 0.00 C ATOM 0 H LEU A 41 29.261 3.982 24.822 1.00 0.00 H new ATOM 0 HA LEU A 41 28.017 5.395 26.984 1.00 0.00 H new ATOM 0 HB2 LEU A 41 30.009 5.928 24.863 1.00 0.00 H new ATOM 0 HB3 LEU A 41 29.184 7.306 25.565 1.00 0.00 H new ATOM 0 HG LEU A 41 31.392 6.701 26.608 1.00 0.00 H new ATOM 0 HD11 LEU A 41 30.634 7.071 28.917 1.00 0.00 H new ATOM 0 HD12 LEU A 41 29.797 8.133 27.759 1.00 0.00 H new ATOM 0 HD13 LEU A 41 28.964 6.707 28.423 1.00 0.00 H new ATOM 0 HD21 LEU A 41 31.454 4.834 28.206 1.00 0.00 H new ATOM 0 HD22 LEU A 41 29.837 4.323 27.665 1.00 0.00 H new ATOM 0 HD23 LEU A 41 31.209 4.276 26.533 1.00 0.00 H new ATOM 698 N GLY A 42 26.744 7.313 25.570 1.00 0.00 N ATOM 699 CA GLY A 42 25.606 8.027 25.018 1.00 0.00 C ATOM 700 C GLY A 42 25.989 8.758 23.730 1.00 0.00 C ATOM 701 O GLY A 42 25.355 9.746 23.361 1.00 0.00 O ATOM 0 H GLY A 42 27.326 7.862 26.203 1.00 0.00 H new ATOM 0 HA2 GLY A 42 24.796 7.326 24.815 1.00 0.00 H new ATOM 0 HA3 GLY A 42 25.232 8.743 25.749 1.00 0.00 H new ATOM 705 N LYS A 43 27.024 8.246 23.082 1.00 0.00 N ATOM 706 CA LYS A 43 27.500 8.838 21.843 1.00 0.00 C ATOM 707 C LYS A 43 26.742 8.222 20.665 1.00 0.00 C ATOM 708 O LYS A 43 25.835 8.844 20.113 1.00 0.00 O ATOM 709 CB LYS A 43 29.020 8.704 21.734 1.00 0.00 C ATOM 710 CG LYS A 43 29.705 10.060 21.917 1.00 0.00 C ATOM 711 CD LYS A 43 29.647 10.510 23.378 1.00 0.00 C ATOM 712 CE LYS A 43 31.025 10.414 24.036 1.00 0.00 C ATOM 713 NZ LYS A 43 30.968 10.905 25.432 1.00 0.00 N ATOM 0 H LYS A 43 27.547 7.427 23.392 1.00 0.00 H new ATOM 0 HA LYS A 43 27.296 9.909 21.829 1.00 0.00 H new ATOM 0 HB2 LYS A 43 29.382 8.005 22.488 1.00 0.00 H new ATOM 0 HB3 LYS A 43 29.283 8.288 20.761 1.00 0.00 H new ATOM 0 HG2 LYS A 43 30.744 9.993 21.594 1.00 0.00 H new ATOM 0 HG3 LYS A 43 29.222 10.804 21.284 1.00 0.00 H new ATOM 0 HD2 LYS A 43 29.285 11.537 23.432 1.00 0.00 H new ATOM 0 HD3 LYS A 43 28.935 9.892 23.925 1.00 0.00 H new ATOM 0 HE2 LYS A 43 31.370 9.380 24.022 1.00 0.00 H new ATOM 0 HE3 LYS A 43 31.748 10.999 23.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 31.911 10.833 25.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 30.659 11.898 25.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 30.294 10.329 25.975 1.00 0.00 H new ATOM 727 N GLN A 44 27.142 7.009 20.315 1.00 0.00 N ATOM 728 CA GLN A 44 26.512 6.303 19.212 1.00 0.00 C ATOM 729 C GLN A 44 25.228 5.617 19.685 1.00 0.00 C ATOM 730 O GLN A 44 25.043 4.421 19.469 1.00 0.00 O ATOM 731 CB GLN A 44 27.475 5.291 18.587 1.00 0.00 C ATOM 732 CG GLN A 44 27.177 5.098 17.099 1.00 0.00 C ATOM 733 CD GLN A 44 27.457 6.381 16.313 1.00 0.00 C ATOM 734 OE1 GLN A 44 28.588 6.713 15.999 1.00 0.00 O ATOM 735 NE2 GLN A 44 26.367 7.081 16.014 1.00 0.00 N ATOM 0 H GLN A 44 27.894 6.497 20.775 1.00 0.00 H new ATOM 0 HA GLN A 44 26.251 7.030 18.443 1.00 0.00 H new ATOM 0 HB2 GLN A 44 28.502 5.634 18.714 1.00 0.00 H new ATOM 0 HB3 GLN A 44 27.391 4.336 19.105 1.00 0.00 H new ATOM 0 HG2 GLN A 44 27.787 4.285 16.705 1.00 0.00 H new ATOM 0 HG3 GLN A 44 26.135 4.807 16.968 1.00 0.00 H new ATOM 0 HE21 GLN A 44 25.449 6.746 16.307 1.00 0.00 H new ATOM 0 HE22 GLN A 44 26.448 7.953 15.491 1.00 0.00 H new ATOM 744 N CYS A 45 24.375 6.406 20.322 1.00 0.00 N ATOM 745 CA CYS A 45 23.114 5.890 20.828 1.00 0.00 C ATOM 746 C CYS A 45 22.027 6.175 19.789 1.00 0.00 C ATOM 747 O CYS A 45 21.305 5.269 19.376 1.00 0.00 O ATOM 748 CB CYS A 45 22.766 6.484 22.194 1.00 0.00 C ATOM 749 SG CYS A 45 22.642 5.152 23.442 1.00 0.00 S ATOM 0 H CYS A 45 24.532 7.398 20.499 1.00 0.00 H new ATOM 0 HA CYS A 45 23.195 4.814 20.983 1.00 0.00 H new ATOM 0 HB2 CYS A 45 23.529 7.203 22.492 1.00 0.00 H new ATOM 0 HB3 CYS A 45 21.823 7.027 22.134 1.00 0.00 H new ATOM 0 HG CYS A 45 22.348 5.667 24.599 1.00 0.00 H new ATOM 755 N ARG A 46 21.945 7.438 19.396 1.00 0.00 N ATOM 756 CA ARG A 46 20.959 7.853 18.413 1.00 0.00 C ATOM 757 C ARG A 46 21.182 7.114 17.092 1.00 0.00 C ATOM 758 O ARG A 46 21.779 7.659 16.165 1.00 0.00 O ATOM 759 CB ARG A 46 21.031 9.361 18.164 1.00 0.00 C ATOM 760 CG ARG A 46 20.728 10.143 19.444 1.00 0.00 C ATOM 761 CD ARG A 46 21.463 11.485 19.454 1.00 0.00 C ATOM 762 NE ARG A 46 21.377 12.100 20.797 1.00 0.00 N ATOM 763 CZ ARG A 46 21.507 13.412 21.033 1.00 0.00 C ATOM 764 NH1 ARG A 46 21.731 14.256 20.016 1.00 0.00 N ATOM 765 NH2 ARG A 46 21.415 13.881 22.285 1.00 0.00 N ATOM 0 H ARG A 46 22.545 8.187 19.741 1.00 0.00 H new ATOM 0 HA ARG A 46 19.973 7.608 18.808 1.00 0.00 H new ATOM 0 HB2 ARG A 46 22.023 9.626 17.798 1.00 0.00 H new ATOM 0 HB3 ARG A 46 20.320 9.639 17.387 1.00 0.00 H new ATOM 0 HG2 ARG A 46 19.654 10.312 19.526 1.00 0.00 H new ATOM 0 HG3 ARG A 46 21.025 9.555 20.312 1.00 0.00 H new ATOM 0 HD2 ARG A 46 22.507 11.339 19.178 1.00 0.00 H new ATOM 0 HD3 ARG A 46 21.028 12.153 18.711 1.00 0.00 H new ATOM 0 HE ARG A 46 21.208 11.486 21.594 1.00 0.00 H new ATOM 0 HH11 ARG A 46 21.802 13.899 19.063 1.00 0.00 H new ATOM 0 HH12 ARG A 46 21.830 15.255 20.195 1.00 0.00 H new ATOM 0 HH21 ARG A 46 21.246 13.239 23.059 1.00 0.00 H new ATOM 0 HH22 ARG A 46 21.514 14.880 22.464 1.00 0.00 H new ATOM 779 N GLU A 47 20.690 5.885 17.049 1.00 0.00 N ATOM 780 CA GLU A 47 20.828 5.066 15.857 1.00 0.00 C ATOM 781 C GLU A 47 19.643 4.105 15.732 1.00 0.00 C ATOM 782 O GLU A 47 19.125 3.891 14.638 1.00 0.00 O ATOM 783 CB GLU A 47 22.154 4.302 15.866 1.00 0.00 C ATOM 784 CG GLU A 47 22.209 3.285 14.725 1.00 0.00 C ATOM 785 CD GLU A 47 23.649 3.060 14.260 1.00 0.00 C ATOM 786 OE1 GLU A 47 24.179 3.974 13.592 1.00 0.00 O ATOM 787 OE2 GLU A 47 24.188 1.980 14.583 1.00 0.00 O ATOM 0 H GLU A 47 20.195 5.437 17.820 1.00 0.00 H new ATOM 0 HA GLU A 47 20.831 5.724 14.988 1.00 0.00 H new ATOM 0 HB2 GLU A 47 22.983 5.004 15.772 1.00 0.00 H new ATOM 0 HB3 GLU A 47 22.276 3.790 16.820 1.00 0.00 H new ATOM 0 HG2 GLU A 47 21.778 2.340 15.054 1.00 0.00 H new ATOM 0 HG3 GLU A 47 21.604 3.637 13.890 1.00 0.00 H new ATOM 794 N ARG A 48 19.249 3.552 16.870 1.00 0.00 N ATOM 795 CA ARG A 48 18.135 2.620 16.903 1.00 0.00 C ATOM 796 C ARG A 48 17.040 3.067 15.932 1.00 0.00 C ATOM 797 O ARG A 48 16.371 2.236 15.321 1.00 0.00 O ATOM 798 CB ARG A 48 17.547 2.514 18.311 1.00 0.00 C ATOM 799 CG ARG A 48 18.154 1.333 19.071 1.00 0.00 C ATOM 800 CD ARG A 48 18.039 0.041 18.260 1.00 0.00 C ATOM 801 NE ARG A 48 19.385 -0.431 17.867 1.00 0.00 N ATOM 802 CZ ARG A 48 19.610 -1.384 16.952 1.00 0.00 C ATOM 803 NH1 ARG A 48 18.578 -1.973 16.331 1.00 0.00 N ATOM 804 NH2 ARG A 48 20.865 -1.749 16.658 1.00 0.00 N ATOM 0 H ARG A 48 19.682 3.732 17.776 1.00 0.00 H new ATOM 0 HA ARG A 48 18.512 1.642 16.605 1.00 0.00 H new ATOM 0 HB2 ARG A 48 17.735 3.438 18.858 1.00 0.00 H new ATOM 0 HB3 ARG A 48 16.465 2.394 18.249 1.00 0.00 H new ATOM 0 HG2 ARG A 48 19.202 1.537 19.290 1.00 0.00 H new ATOM 0 HG3 ARG A 48 17.646 1.212 20.028 1.00 0.00 H new ATOM 0 HD2 ARG A 48 17.534 -0.724 18.849 1.00 0.00 H new ATOM 0 HD3 ARG A 48 17.431 0.212 17.372 1.00 0.00 H new ATOM 0 HE ARG A 48 20.193 -0.004 18.321 1.00 0.00 H new ATOM 0 HH11 ARG A 48 17.622 -1.696 16.555 1.00 0.00 H new ATOM 0 HH12 ARG A 48 18.749 -2.698 15.634 1.00 0.00 H new ATOM 0 HH21 ARG A 48 21.650 -1.301 17.131 1.00 0.00 H new ATOM 0 HH22 ARG A 48 21.035 -2.474 15.961 1.00 0.00 H new ATOM 818 N TRP A 49 16.891 4.379 15.822 1.00 0.00 N ATOM 819 CA TRP A 49 15.889 4.947 14.937 1.00 0.00 C ATOM 820 C TRP A 49 16.613 5.762 13.863 1.00 0.00 C ATOM 821 O TRP A 49 16.254 5.705 12.688 1.00 0.00 O ATOM 822 CB TRP A 49 14.865 5.769 15.722 1.00 0.00 C ATOM 823 CG TRP A 49 15.221 5.960 17.198 1.00 0.00 C ATOM 824 CD1 TRP A 49 16.353 6.455 17.717 1.00 0.00 C ATOM 825 CD2 TRP A 49 14.389 5.636 18.332 1.00 0.00 C ATOM 826 NE1 TRP A 49 16.312 6.474 19.096 1.00 0.00 N ATOM 827 CE2 TRP A 49 15.079 5.960 19.482 1.00 0.00 C ATOM 828 CE3 TRP A 49 13.096 5.087 18.384 1.00 0.00 C ATOM 829 CZ2 TRP A 49 14.558 5.772 20.768 1.00 0.00 C ATOM 830 CZ3 TRP A 49 12.589 4.905 19.676 1.00 0.00 C ATOM 831 CH2 TRP A 49 13.271 5.226 20.844 1.00 0.00 C ATOM 0 H TRP A 49 17.448 5.065 16.332 1.00 0.00 H new ATOM 0 HA TRP A 49 15.316 4.159 14.449 1.00 0.00 H new ATOM 0 HB2 TRP A 49 14.764 6.748 15.253 1.00 0.00 H new ATOM 0 HB3 TRP A 49 13.893 5.281 15.653 1.00 0.00 H new ATOM 0 HD1 TRP A 49 17.192 6.796 17.129 1.00 0.00 H new ATOM 0 HE1 TRP A 49 17.050 6.804 19.718 1.00 0.00 H new ATOM 0 HE3 TRP A 49 12.538 4.826 17.497 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 15.118 6.034 21.653 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 11.598 4.486 19.772 1.00 0.00 H new ATOM 0 HH2 TRP A 49 12.810 5.055 21.806 1.00 0.00 H new ATOM 842 N HIS A 50 17.619 6.501 14.306 1.00 0.00 N ATOM 843 CA HIS A 50 18.397 7.327 13.397 1.00 0.00 C ATOM 844 C HIS A 50 18.681 6.548 12.111 1.00 0.00 C ATOM 845 O HIS A 50 18.112 6.847 11.062 1.00 0.00 O ATOM 846 CB HIS A 50 19.672 7.831 14.078 1.00 0.00 C ATOM 847 CG HIS A 50 19.764 9.335 14.170 1.00 0.00 C ATOM 848 ND1 HIS A 50 19.301 10.200 15.118 1.00 0.00 N flip ATOM 849 CD2 HIS A 50 20.393 10.108 13.210 1.00 0.00 C flip ATOM 850 CE1 HIS A 50 19.630 11.434 14.756 1.00 0.00 C flip ATOM 851 NE2 HIS A 50 20.307 11.379 13.573 1.00 0.00 N flip ATOM 0 H HIS A 50 17.914 6.546 15.281 1.00 0.00 H new ATOM 0 HA HIS A 50 17.824 8.213 13.125 1.00 0.00 H new ATOM 0 HB2 HIS A 50 19.725 7.412 15.083 1.00 0.00 H new ATOM 0 HB3 HIS A 50 20.537 7.457 13.530 1.00 0.00 H new ATOM 0 HD2 HIS A 50 20.873 9.738 12.316 1.00 0.00 H new ATOM 0 HE1 HIS A 50 19.400 12.334 15.307 1.00 0.00 H new ATOM 0 HE2 HIS A 50 20.681 12.176 13.058 1.00 0.00 H new ATOM 859 N ASN A 51 19.560 5.564 12.234 1.00 0.00 N ATOM 860 CA ASN A 51 19.925 4.740 11.095 1.00 0.00 C ATOM 861 C ASN A 51 19.223 3.386 11.204 1.00 0.00 C ATOM 862 O ASN A 51 19.845 2.386 11.560 1.00 0.00 O ATOM 863 CB ASN A 51 21.434 4.489 11.058 1.00 0.00 C ATOM 864 CG ASN A 51 22.209 5.808 11.044 1.00 0.00 C ATOM 865 OD1 ASN A 51 22.233 6.434 12.217 1.00 0.00 O flip ATOM 866 ND2 ASN A 51 22.750 6.229 10.035 1.00 0.00 N flip ATOM 0 H ASN A 51 20.030 5.319 13.106 1.00 0.00 H new ATOM 0 HA ASN A 51 19.624 5.266 10.189 1.00 0.00 H new ATOM 0 HB2 ASN A 51 21.729 3.899 11.925 1.00 0.00 H new ATOM 0 HB3 ASN A 51 21.688 3.905 10.173 1.00 0.00 H new ATOM 0 HD21 ASN A 51 22.693 5.698 9.166 1.00 0.00 H new ATOM 0 HD22 ASN A 51 23.260 7.112 10.060 1.00 0.00 H new ATOM 873 N HIS A 52 17.935 3.396 10.892 1.00 0.00 N ATOM 874 CA HIS A 52 17.141 2.180 10.950 1.00 0.00 C ATOM 875 C HIS A 52 16.017 2.251 9.915 1.00 0.00 C ATOM 876 O HIS A 52 15.799 1.302 9.164 1.00 0.00 O ATOM 877 CB HIS A 52 16.626 1.936 12.370 1.00 0.00 C ATOM 878 CG HIS A 52 16.475 0.476 12.726 1.00 0.00 C ATOM 879 ND1 HIS A 52 15.364 -0.270 12.376 1.00 0.00 N ATOM 880 CD2 HIS A 52 17.307 -0.367 13.403 1.00 0.00 C ATOM 881 CE1 HIS A 52 15.529 -1.505 12.828 1.00 0.00 C ATOM 882 NE2 HIS A 52 16.735 -1.562 13.464 1.00 0.00 N ATOM 0 H HIS A 52 17.422 4.227 10.598 1.00 0.00 H new ATOM 0 HA HIS A 52 17.764 1.322 10.699 1.00 0.00 H new ATOM 0 HB2 HIS A 52 17.310 2.403 13.079 1.00 0.00 H new ATOM 0 HB3 HIS A 52 15.661 2.429 12.485 1.00 0.00 H new ATOM 0 HD2 HIS A 52 18.269 -0.105 13.819 1.00 0.00 H new ATOM 0 HE1 HIS A 52 14.832 -2.322 12.713 1.00 0.00 H new ATOM 0 HE2 HIS A 52 17.131 -2.388 13.913 1.00 0.00 H new ATOM 890 N LEU A 53 15.332 3.385 9.910 1.00 0.00 N ATOM 891 CA LEU A 53 14.235 3.593 8.979 1.00 0.00 C ATOM 892 C LEU A 53 14.607 2.999 7.619 1.00 0.00 C ATOM 893 O LEU A 53 15.275 3.648 6.816 1.00 0.00 O ATOM 894 CB LEU A 53 13.855 5.074 8.921 1.00 0.00 C ATOM 895 CG LEU A 53 14.920 6.018 8.358 1.00 0.00 C ATOM 896 CD1 LEU A 53 14.404 6.750 7.119 1.00 0.00 C ATOM 897 CD2 LEU A 53 15.415 6.988 9.433 1.00 0.00 C ATOM 0 H LEU A 53 15.515 4.170 10.536 1.00 0.00 H new ATOM 0 HA LEU A 53 13.341 3.072 9.321 1.00 0.00 H new ATOM 0 HB2 LEU A 53 12.953 5.174 8.317 1.00 0.00 H new ATOM 0 HB3 LEU A 53 13.602 5.404 9.929 1.00 0.00 H new ATOM 0 HG LEU A 53 15.776 5.420 8.045 1.00 0.00 H new ATOM 0 HD11 LEU A 53 15.180 7.414 6.739 1.00 0.00 H new ATOM 0 HD12 LEU A 53 14.140 6.023 6.351 1.00 0.00 H new ATOM 0 HD13 LEU A 53 13.523 7.335 7.383 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.171 7.648 9.007 1.00 0.00 H new ATOM 0 HD22 LEU A 53 14.578 7.583 9.799 1.00 0.00 H new ATOM 0 HD23 LEU A 53 15.849 6.425 10.259 1.00 0.00 H new ATOM 909 N ASN A 54 14.157 1.771 7.402 1.00 0.00 N ATOM 910 CA ASN A 54 14.434 1.083 6.153 1.00 0.00 C ATOM 911 C ASN A 54 13.112 0.717 5.474 1.00 0.00 C ATOM 912 O ASN A 54 12.510 -0.308 5.792 1.00 0.00 O ATOM 913 CB ASN A 54 15.214 -0.210 6.398 1.00 0.00 C ATOM 914 CG ASN A 54 15.216 -1.094 5.150 1.00 0.00 C ATOM 915 OD1 ASN A 54 15.319 -0.628 4.027 1.00 0.00 O ATOM 916 ND2 ASN A 54 15.096 -2.394 5.407 1.00 0.00 N ATOM 0 H ASN A 54 13.603 1.236 8.070 1.00 0.00 H new ATOM 0 HA ASN A 54 15.027 1.748 5.525 1.00 0.00 H new ATOM 0 HB2 ASN A 54 16.239 0.028 6.681 1.00 0.00 H new ATOM 0 HB3 ASN A 54 14.771 -0.754 7.232 1.00 0.00 H new ATOM 0 HD21 ASN A 54 15.086 -3.067 4.640 1.00 0.00 H new ATOM 0 HD22 ASN A 54 15.014 -2.718 6.371 1.00 0.00 H new ATOM 923 N PRO A 55 12.690 1.596 4.527 1.00 0.00 N ATOM 924 CA PRO A 55 11.451 1.375 3.800 1.00 0.00 C ATOM 925 C PRO A 55 11.619 0.274 2.752 1.00 0.00 C ATOM 926 O PRO A 55 12.509 -0.567 2.868 1.00 0.00 O ATOM 927 CB PRO A 55 11.105 2.725 3.193 1.00 0.00 C ATOM 928 CG PRO A 55 12.393 3.533 3.212 1.00 0.00 C ATOM 929 CD PRO A 55 13.377 2.819 4.124 1.00 0.00 C ATOM 0 HA PRO A 55 10.644 1.023 4.442 1.00 0.00 H new ATOM 0 HB2 PRO A 55 10.730 2.611 2.176 1.00 0.00 H new ATOM 0 HB3 PRO A 55 10.323 3.223 3.767 1.00 0.00 H new ATOM 0 HG2 PRO A 55 12.802 3.624 2.206 1.00 0.00 H new ATOM 0 HG3 PRO A 55 12.204 4.544 3.572 1.00 0.00 H new ATOM 0 HD2 PRO A 55 14.309 2.597 3.604 1.00 0.00 H new ATOM 0 HD3 PRO A 55 13.633 3.432 4.988 1.00 0.00 H new ATOM 937 N GLU A 56 10.750 0.315 1.753 1.00 0.00 N ATOM 938 CA GLU A 56 10.791 -0.669 0.685 1.00 0.00 C ATOM 939 C GLU A 56 11.120 0.007 -0.648 1.00 0.00 C ATOM 940 O GLU A 56 11.524 1.168 -0.676 1.00 0.00 O ATOM 941 CB GLU A 56 9.472 -1.439 0.598 1.00 0.00 C ATOM 942 CG GLU A 56 9.711 -2.948 0.687 1.00 0.00 C ATOM 943 CD GLU A 56 8.440 -3.679 1.126 1.00 0.00 C ATOM 944 OE1 GLU A 56 7.591 -3.012 1.755 1.00 0.00 O ATOM 945 OE2 GLU A 56 8.348 -4.888 0.823 1.00 0.00 O ATOM 0 H GLU A 56 10.013 1.014 1.661 1.00 0.00 H new ATOM 0 HA GLU A 56 11.579 -1.387 0.910 1.00 0.00 H new ATOM 0 HB2 GLU A 56 8.809 -1.124 1.404 1.00 0.00 H new ATOM 0 HB3 GLU A 56 8.969 -1.201 -0.340 1.00 0.00 H new ATOM 0 HG2 GLU A 56 10.036 -3.326 -0.282 1.00 0.00 H new ATOM 0 HG3 GLU A 56 10.515 -3.152 1.395 1.00 0.00 H new ATOM 952 N VAL A 57 10.935 -0.749 -1.720 1.00 0.00 N ATOM 953 CA VAL A 57 11.207 -0.238 -3.053 1.00 0.00 C ATOM 954 C VAL A 57 10.074 0.699 -3.476 1.00 0.00 C ATOM 955 O VAL A 57 10.003 1.839 -3.020 1.00 0.00 O ATOM 956 CB VAL A 57 11.418 -1.399 -4.026 1.00 0.00 C ATOM 957 CG1 VAL A 57 11.570 -0.891 -5.461 1.00 0.00 C ATOM 958 CG2 VAL A 57 12.623 -2.247 -3.615 1.00 0.00 C ATOM 0 H VAL A 57 10.600 -1.712 -1.693 1.00 0.00 H new ATOM 0 HA VAL A 57 12.129 0.344 -3.058 1.00 0.00 H new ATOM 0 HB VAL A 57 10.533 -2.033 -3.987 1.00 0.00 H new ATOM 0 HG11 VAL A 57 11.719 -1.737 -6.132 1.00 0.00 H new ATOM 0 HG12 VAL A 57 10.670 -0.350 -5.753 1.00 0.00 H new ATOM 0 HG13 VAL A 57 12.430 -0.224 -5.522 1.00 0.00 H new ATOM 0 HG21 VAL A 57 12.751 -3.065 -4.323 1.00 0.00 H new ATOM 0 HG22 VAL A 57 13.520 -1.627 -3.611 1.00 0.00 H new ATOM 0 HG23 VAL A 57 12.459 -2.653 -2.617 1.00 0.00 H new ATOM 968 N LYS A 58 9.215 0.183 -4.343 1.00 0.00 N ATOM 969 CA LYS A 58 8.089 0.959 -4.833 1.00 0.00 C ATOM 970 C LYS A 58 8.608 2.211 -5.542 1.00 0.00 C ATOM 971 O LYS A 58 9.797 2.314 -5.838 1.00 0.00 O ATOM 972 CB LYS A 58 7.109 1.256 -3.697 1.00 0.00 C ATOM 973 CG LYS A 58 5.904 0.314 -3.751 1.00 0.00 C ATOM 974 CD LYS A 58 4.613 1.090 -4.017 1.00 0.00 C ATOM 975 CE LYS A 58 4.089 0.816 -5.428 1.00 0.00 C ATOM 976 NZ LYS A 58 4.640 1.800 -6.385 1.00 0.00 N ATOM 0 H LYS A 58 9.276 -0.763 -4.719 1.00 0.00 H new ATOM 0 HA LYS A 58 7.523 0.388 -5.569 1.00 0.00 H new ATOM 0 HB2 LYS A 58 7.616 1.149 -2.738 1.00 0.00 H new ATOM 0 HB3 LYS A 58 6.770 2.290 -3.765 1.00 0.00 H new ATOM 0 HG2 LYS A 58 6.054 -0.429 -4.534 1.00 0.00 H new ATOM 0 HG3 LYS A 58 5.819 -0.228 -2.809 1.00 0.00 H new ATOM 0 HD2 LYS A 58 3.857 0.808 -3.284 1.00 0.00 H new ATOM 0 HD3 LYS A 58 4.794 2.158 -3.894 1.00 0.00 H new ATOM 0 HE2 LYS A 58 4.365 -0.193 -5.735 1.00 0.00 H new ATOM 0 HE3 LYS A 58 3.000 0.865 -5.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 4.161 1.698 -7.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 4.488 2.762 -6.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 5.659 1.633 -6.506 1.00 0.00 H new ATOM 990 N LYS A 59 7.690 3.133 -5.793 1.00 0.00 N ATOM 991 CA LYS A 59 8.040 4.375 -6.461 1.00 0.00 C ATOM 992 C LYS A 59 8.853 4.061 -7.719 1.00 0.00 C ATOM 993 O LYS A 59 8.981 2.900 -8.106 1.00 0.00 O ATOM 994 CB LYS A 59 8.747 5.324 -5.492 1.00 0.00 C ATOM 995 CG LYS A 59 10.235 4.984 -5.380 1.00 0.00 C ATOM 996 CD LYS A 59 10.530 4.237 -4.078 1.00 0.00 C ATOM 997 CE LYS A 59 11.437 5.064 -3.165 1.00 0.00 C ATOM 998 NZ LYS A 59 10.789 6.348 -2.815 1.00 0.00 N ATOM 0 H LYS A 59 6.704 3.045 -5.546 1.00 0.00 H new ATOM 0 HA LYS A 59 7.141 4.900 -6.785 1.00 0.00 H new ATOM 0 HB2 LYS A 59 8.630 6.352 -5.834 1.00 0.00 H new ATOM 0 HB3 LYS A 59 8.281 5.260 -4.509 1.00 0.00 H new ATOM 0 HG2 LYS A 59 10.537 4.373 -6.231 1.00 0.00 H new ATOM 0 HG3 LYS A 59 10.825 5.900 -5.420 1.00 0.00 H new ATOM 0 HD2 LYS A 59 9.596 4.014 -3.563 1.00 0.00 H new ATOM 0 HD3 LYS A 59 11.006 3.283 -4.302 1.00 0.00 H new ATOM 0 HE2 LYS A 59 11.658 4.502 -2.257 1.00 0.00 H new ATOM 0 HE3 LYS A 59 12.388 5.254 -3.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 11.197 6.713 -1.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 10.947 7.036 -3.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 9.767 6.198 -2.689 1.00 0.00 H new ATOM 1012 N SER A 60 9.382 5.116 -8.321 1.00 0.00 N ATOM 1013 CA SER A 60 10.179 4.967 -9.527 1.00 0.00 C ATOM 1014 C SER A 60 11.158 3.802 -9.367 1.00 0.00 C ATOM 1015 O SER A 60 11.347 3.293 -8.263 1.00 0.00 O ATOM 1016 CB SER A 60 10.937 6.257 -9.848 1.00 0.00 C ATOM 1017 OG SER A 60 10.515 6.831 -11.082 1.00 0.00 O ATOM 0 H SER A 60 9.274 6.077 -7.996 1.00 0.00 H new ATOM 0 HA SER A 60 9.506 4.756 -10.358 1.00 0.00 H new ATOM 0 HB2 SER A 60 10.786 6.976 -9.043 1.00 0.00 H new ATOM 0 HB3 SER A 60 12.006 6.048 -9.892 1.00 0.00 H new ATOM 0 HG SER A 60 11.021 7.653 -11.250 1.00 0.00 H new ATOM 1023 N SER A 61 11.753 3.413 -10.484 1.00 0.00 N ATOM 1024 CA SER A 61 12.708 2.318 -10.482 1.00 0.00 C ATOM 1025 C SER A 61 11.974 0.985 -10.322 1.00 0.00 C ATOM 1026 O SER A 61 10.845 0.834 -10.787 1.00 0.00 O ATOM 1027 CB SER A 61 13.742 2.491 -9.368 1.00 0.00 C ATOM 1028 OG SER A 61 14.002 3.864 -9.089 1.00 0.00 O ATOM 0 H SER A 61 11.592 3.837 -11.398 1.00 0.00 H new ATOM 0 HA SER A 61 13.237 2.323 -11.435 1.00 0.00 H new ATOM 0 HB2 SER A 61 13.386 1.998 -8.463 1.00 0.00 H new ATOM 0 HB3 SER A 61 14.670 1.997 -9.655 1.00 0.00 H new ATOM 0 HG SER A 61 14.666 3.932 -8.371 1.00 0.00 H new ATOM 1034 N TRP A 62 12.645 0.052 -9.662 1.00 0.00 N ATOM 1035 CA TRP A 62 12.070 -1.263 -9.435 1.00 0.00 C ATOM 1036 C TRP A 62 10.812 -1.089 -8.583 1.00 0.00 C ATOM 1037 O TRP A 62 10.388 0.035 -8.318 1.00 0.00 O ATOM 1038 CB TRP A 62 13.094 -2.207 -8.802 1.00 0.00 C ATOM 1039 CG TRP A 62 14.444 -2.233 -9.522 1.00 0.00 C ATOM 1040 CD1 TRP A 62 15.537 -1.506 -9.252 1.00 0.00 C ATOM 1041 CD2 TRP A 62 14.802 -3.062 -10.648 1.00 0.00 C ATOM 1042 NE1 TRP A 62 16.569 -1.804 -10.119 1.00 0.00 N ATOM 1043 CE2 TRP A 62 16.108 -2.780 -10.995 1.00 0.00 C ATOM 1044 CE3 TRP A 62 14.048 -4.017 -11.351 1.00 0.00 C ATOM 1045 CZ2 TRP A 62 16.774 -3.411 -12.053 1.00 0.00 C ATOM 1046 CZ3 TRP A 62 14.727 -4.639 -12.406 1.00 0.00 C ATOM 1047 CH2 TRP A 62 16.041 -4.366 -12.767 1.00 0.00 C ATOM 0 H TRP A 62 13.581 0.181 -9.277 1.00 0.00 H new ATOM 0 HA TRP A 62 11.789 -1.729 -10.380 1.00 0.00 H new ATOM 0 HB2 TRP A 62 13.253 -1.912 -7.765 1.00 0.00 H new ATOM 0 HB3 TRP A 62 12.682 -3.216 -8.787 1.00 0.00 H new ATOM 0 HD1 TRP A 62 15.602 -0.779 -8.456 1.00 0.00 H new ATOM 0 HE1 TRP A 62 17.499 -1.385 -10.117 1.00 0.00 H new ATOM 0 HE3 TRP A 62 13.025 -4.253 -11.097 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 17.797 -3.174 -12.304 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 14.193 -5.382 -12.979 1.00 0.00 H new ATOM 0 HH2 TRP A 62 16.495 -4.889 -13.596 1.00 0.00 H new ATOM 1058 N THR A 63 10.249 -2.217 -8.177 1.00 0.00 N ATOM 1059 CA THR A 63 9.048 -2.203 -7.360 1.00 0.00 C ATOM 1060 C THR A 63 9.026 -3.412 -6.422 1.00 0.00 C ATOM 1061 O THR A 63 10.054 -4.051 -6.203 1.00 0.00 O ATOM 1062 CB THR A 63 7.840 -2.140 -8.296 1.00 0.00 C ATOM 1063 OG1 THR A 63 8.030 -3.239 -9.183 1.00 0.00 O ATOM 1064 CG2 THR A 63 7.871 -0.914 -9.211 1.00 0.00 C ATOM 0 H THR A 63 10.603 -3.148 -8.399 1.00 0.00 H new ATOM 0 HA THR A 63 9.022 -1.327 -6.712 1.00 0.00 H new ATOM 0 HB THR A 63 6.924 -2.129 -7.705 1.00 0.00 H new ATOM 0 HG1 THR A 63 7.272 -3.856 -9.107 1.00 0.00 H new ATOM 0 HG21 THR A 63 6.991 -0.918 -9.855 1.00 0.00 H new ATOM 0 HG22 THR A 63 7.873 -0.008 -8.605 1.00 0.00 H new ATOM 0 HG23 THR A 63 8.771 -0.942 -9.826 1.00 0.00 H new ATOM 1072 N GLU A 64 7.844 -3.688 -5.892 1.00 0.00 N ATOM 1073 CA GLU A 64 7.675 -4.809 -4.982 1.00 0.00 C ATOM 1074 C GLU A 64 7.719 -6.130 -5.753 1.00 0.00 C ATOM 1075 O GLU A 64 8.724 -6.838 -5.722 1.00 0.00 O ATOM 1076 CB GLU A 64 6.374 -4.680 -4.188 1.00 0.00 C ATOM 1077 CG GLU A 64 6.577 -3.823 -2.937 1.00 0.00 C ATOM 1078 CD GLU A 64 7.323 -4.605 -1.853 1.00 0.00 C ATOM 1079 OE1 GLU A 64 6.733 -5.588 -1.355 1.00 0.00 O ATOM 1080 OE2 GLU A 64 8.466 -4.202 -1.547 1.00 0.00 O ATOM 0 H GLU A 64 6.994 -3.155 -6.075 1.00 0.00 H new ATOM 0 HA GLU A 64 8.499 -4.800 -4.269 1.00 0.00 H new ATOM 0 HB2 GLU A 64 5.603 -4.235 -4.817 1.00 0.00 H new ATOM 0 HB3 GLU A 64 6.019 -5.670 -3.901 1.00 0.00 H new ATOM 0 HG2 GLU A 64 7.138 -2.925 -3.194 1.00 0.00 H new ATOM 0 HG3 GLU A 64 5.610 -3.496 -2.555 1.00 0.00 H new ATOM 1087 N GLU A 65 6.615 -6.421 -6.426 1.00 0.00 N ATOM 1088 CA GLU A 65 6.515 -7.645 -7.204 1.00 0.00 C ATOM 1089 C GLU A 65 7.789 -7.860 -8.022 1.00 0.00 C ATOM 1090 O GLU A 65 8.244 -8.991 -8.184 1.00 0.00 O ATOM 1091 CB GLU A 65 5.281 -7.620 -8.108 1.00 0.00 C ATOM 1092 CG GLU A 65 3.997 -7.514 -7.281 1.00 0.00 C ATOM 1093 CD GLU A 65 2.867 -8.326 -7.917 1.00 0.00 C ATOM 1094 OE1 GLU A 65 2.763 -8.275 -9.161 1.00 0.00 O ATOM 1095 OE2 GLU A 65 2.133 -8.979 -7.144 1.00 0.00 O ATOM 0 H GLU A 65 5.783 -5.831 -6.449 1.00 0.00 H new ATOM 0 HA GLU A 65 6.404 -8.482 -6.515 1.00 0.00 H new ATOM 0 HB2 GLU A 65 5.346 -6.776 -8.795 1.00 0.00 H new ATOM 0 HB3 GLU A 65 5.253 -8.524 -8.716 1.00 0.00 H new ATOM 0 HG2 GLU A 65 4.182 -7.872 -6.268 1.00 0.00 H new ATOM 0 HG3 GLU A 65 3.698 -6.469 -7.200 1.00 0.00 H new ATOM 1102 N GLU A 66 8.330 -6.756 -8.517 1.00 0.00 N ATOM 1103 CA GLU A 66 9.544 -6.810 -9.315 1.00 0.00 C ATOM 1104 C GLU A 66 10.706 -7.347 -8.477 1.00 0.00 C ATOM 1105 O GLU A 66 11.578 -8.044 -8.994 1.00 0.00 O ATOM 1106 CB GLU A 66 9.878 -5.435 -9.898 1.00 0.00 C ATOM 1107 CG GLU A 66 9.053 -5.159 -11.157 1.00 0.00 C ATOM 1108 CD GLU A 66 9.859 -4.345 -12.172 1.00 0.00 C ATOM 1109 OE1 GLU A 66 11.082 -4.590 -12.253 1.00 0.00 O ATOM 1110 OE2 GLU A 66 9.233 -3.497 -12.843 1.00 0.00 O ATOM 0 H GLU A 66 7.950 -5.819 -8.381 1.00 0.00 H new ATOM 0 HA GLU A 66 9.378 -7.492 -10.149 1.00 0.00 H new ATOM 0 HB2 GLU A 66 9.682 -4.663 -9.154 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.940 -5.385 -10.137 1.00 0.00 H new ATOM 0 HG2 GLU A 66 8.742 -6.102 -11.606 1.00 0.00 H new ATOM 0 HG3 GLU A 66 8.145 -4.618 -10.890 1.00 0.00 H new ATOM 1117 N ASP A 67 10.680 -7.003 -7.198 1.00 0.00 N ATOM 1118 CA ASP A 67 11.721 -7.442 -6.284 1.00 0.00 C ATOM 1119 C ASP A 67 11.591 -8.950 -6.056 1.00 0.00 C ATOM 1120 O ASP A 67 12.554 -9.693 -6.230 1.00 0.00 O ATOM 1121 CB ASP A 67 11.593 -6.746 -4.928 1.00 0.00 C ATOM 1122 CG ASP A 67 12.915 -6.514 -4.193 1.00 0.00 C ATOM 1123 OD1 ASP A 67 13.565 -7.529 -3.862 1.00 0.00 O ATOM 1124 OD2 ASP A 67 13.245 -5.328 -3.978 1.00 0.00 O ATOM 0 H ASP A 67 9.955 -6.425 -6.773 1.00 0.00 H new ATOM 0 HA ASP A 67 12.685 -7.193 -6.727 1.00 0.00 H new ATOM 0 HB2 ASP A 67 11.103 -5.784 -5.075 1.00 0.00 H new ATOM 0 HB3 ASP A 67 10.940 -7.342 -4.291 1.00 0.00 H new ATOM 1129 N ARG A 68 10.390 -9.355 -5.668 1.00 0.00 N ATOM 1130 CA ARG A 68 10.121 -10.760 -5.414 1.00 0.00 C ATOM 1131 C ARG A 68 10.437 -11.595 -6.657 1.00 0.00 C ATOM 1132 O ARG A 68 11.256 -12.510 -6.602 1.00 0.00 O ATOM 1133 CB ARG A 68 8.659 -10.978 -5.020 1.00 0.00 C ATOM 1134 CG ARG A 68 8.348 -10.314 -3.677 1.00 0.00 C ATOM 1135 CD ARG A 68 8.746 -11.222 -2.511 1.00 0.00 C ATOM 1136 NE ARG A 68 8.030 -12.514 -2.609 1.00 0.00 N ATOM 1137 CZ ARG A 68 8.154 -13.510 -1.721 1.00 0.00 C ATOM 1138 NH1 ARG A 68 8.965 -13.369 -0.665 1.00 0.00 N ATOM 1139 NH2 ARG A 68 7.465 -14.647 -1.890 1.00 0.00 N ATOM 0 H ARG A 68 9.593 -8.735 -5.524 1.00 0.00 H new ATOM 0 HA ARG A 68 10.759 -11.076 -4.589 1.00 0.00 H new ATOM 0 HB2 ARG A 68 8.006 -10.570 -5.791 1.00 0.00 H new ATOM 0 HB3 ARG A 68 8.451 -12.046 -4.959 1.00 0.00 H new ATOM 0 HG2 ARG A 68 8.882 -9.367 -3.603 1.00 0.00 H new ATOM 0 HG3 ARG A 68 7.284 -10.086 -3.618 1.00 0.00 H new ATOM 0 HD2 ARG A 68 9.823 -11.392 -2.522 1.00 0.00 H new ATOM 0 HD3 ARG A 68 8.510 -10.737 -1.564 1.00 0.00 H new ATOM 0 HE ARG A 68 7.403 -12.655 -3.401 1.00 0.00 H new ATOM 0 HH11 ARG A 68 9.489 -12.503 -0.536 1.00 0.00 H new ATOM 0 HH12 ARG A 68 9.059 -14.127 0.011 1.00 0.00 H new ATOM 0 HH21 ARG A 68 6.847 -14.754 -2.694 1.00 0.00 H new ATOM 0 HH22 ARG A 68 7.559 -15.405 -1.214 1.00 0.00 H new ATOM 1153 N ILE A 69 9.770 -11.248 -7.748 1.00 0.00 N ATOM 1154 CA ILE A 69 9.969 -11.954 -9.003 1.00 0.00 C ATOM 1155 C ILE A 69 11.462 -12.223 -9.200 1.00 0.00 C ATOM 1156 O ILE A 69 11.917 -13.357 -9.053 1.00 0.00 O ATOM 1157 CB ILE A 69 9.325 -11.185 -10.158 1.00 0.00 C ATOM 1158 CG1 ILE A 69 7.799 -11.215 -10.054 1.00 0.00 C ATOM 1159 CG2 ILE A 69 9.818 -11.710 -11.508 1.00 0.00 C ATOM 1160 CD1 ILE A 69 7.156 -10.394 -11.173 1.00 0.00 C ATOM 0 H ILE A 69 9.091 -10.488 -7.789 1.00 0.00 H new ATOM 0 HA ILE A 69 9.470 -12.923 -8.979 1.00 0.00 H new ATOM 0 HB ILE A 69 9.632 -10.141 -10.087 1.00 0.00 H new ATOM 0 HG12 ILE A 69 7.448 -12.246 -10.107 1.00 0.00 H new ATOM 0 HG13 ILE A 69 7.489 -10.822 -9.086 1.00 0.00 H new ATOM 0 HG21 ILE A 69 9.345 -11.146 -12.312 1.00 0.00 H new ATOM 0 HG22 ILE A 69 10.900 -11.593 -11.571 1.00 0.00 H new ATOM 0 HG23 ILE A 69 9.561 -12.765 -11.604 1.00 0.00 H new ATOM 0 HD11 ILE A 69 6.071 -10.432 -11.075 1.00 0.00 H new ATOM 0 HD12 ILE A 69 7.490 -9.359 -11.103 1.00 0.00 H new ATOM 0 HD13 ILE A 69 7.448 -10.805 -12.139 1.00 0.00 H new ATOM 1172 N ILE A 70 12.184 -11.161 -9.528 1.00 0.00 N ATOM 1173 CA ILE A 70 13.617 -11.269 -9.747 1.00 0.00 C ATOM 1174 C ILE A 70 14.237 -12.111 -8.630 1.00 0.00 C ATOM 1175 O ILE A 70 14.905 -13.109 -8.898 1.00 0.00 O ATOM 1176 CB ILE A 70 14.242 -9.880 -9.889 1.00 0.00 C ATOM 1177 CG1 ILE A 70 13.573 -9.090 -11.015 1.00 0.00 C ATOM 1178 CG2 ILE A 70 15.757 -9.978 -10.080 1.00 0.00 C ATOM 1179 CD1 ILE A 70 14.291 -7.760 -11.253 1.00 0.00 C ATOM 0 H ILE A 70 11.804 -10.222 -9.647 1.00 0.00 H new ATOM 0 HA ILE A 70 13.822 -11.784 -10.686 1.00 0.00 H new ATOM 0 HB ILE A 70 14.068 -9.331 -8.963 1.00 0.00 H new ATOM 0 HG12 ILE A 70 13.579 -9.680 -11.932 1.00 0.00 H new ATOM 0 HG13 ILE A 70 12.529 -8.904 -10.763 1.00 0.00 H new ATOM 0 HG21 ILE A 70 16.177 -8.977 -10.178 1.00 0.00 H new ATOM 0 HG22 ILE A 70 16.201 -10.475 -9.217 1.00 0.00 H new ATOM 0 HG23 ILE A 70 15.974 -10.552 -10.981 1.00 0.00 H new ATOM 0 HD11 ILE A 70 13.795 -7.218 -12.058 1.00 0.00 H new ATOM 0 HD12 ILE A 70 14.262 -7.163 -10.342 1.00 0.00 H new ATOM 0 HD13 ILE A 70 15.328 -7.951 -11.529 1.00 0.00 H new ATOM 1191 N PHE A 71 13.993 -11.680 -7.402 1.00 0.00 N ATOM 1192 CA PHE A 71 14.519 -12.382 -6.243 1.00 0.00 C ATOM 1193 C PHE A 71 14.255 -13.885 -6.347 1.00 0.00 C ATOM 1194 O PHE A 71 14.929 -14.684 -5.698 1.00 0.00 O ATOM 1195 CB PHE A 71 13.788 -11.832 -5.017 1.00 0.00 C ATOM 1196 CG PHE A 71 13.900 -12.719 -3.776 1.00 0.00 C ATOM 1197 CD1 PHE A 71 14.973 -12.600 -2.948 1.00 0.00 C ATOM 1198 CD2 PHE A 71 12.927 -13.628 -3.500 1.00 0.00 C ATOM 1199 CE1 PHE A 71 15.077 -13.424 -1.797 1.00 0.00 C ATOM 1200 CE2 PHE A 71 13.030 -14.452 -2.348 1.00 0.00 C ATOM 1201 CZ PHE A 71 14.103 -14.333 -1.521 1.00 0.00 C ATOM 0 H PHE A 71 13.438 -10.853 -7.183 1.00 0.00 H new ATOM 0 HA PHE A 71 15.597 -12.233 -6.175 1.00 0.00 H new ATOM 0 HB2 PHE A 71 14.186 -10.845 -4.782 1.00 0.00 H new ATOM 0 HB3 PHE A 71 12.734 -11.701 -5.263 1.00 0.00 H new ATOM 0 HD1 PHE A 71 15.746 -11.878 -3.167 1.00 0.00 H new ATOM 0 HD2 PHE A 71 12.075 -13.723 -4.157 1.00 0.00 H new ATOM 0 HE1 PHE A 71 15.929 -13.329 -1.140 1.00 0.00 H new ATOM 0 HE2 PHE A 71 12.256 -15.173 -2.129 1.00 0.00 H new ATOM 0 HZ PHE A 71 14.182 -14.960 -0.645 1.00 0.00 H new ATOM 1211 N GLU A 72 13.273 -14.226 -7.169 1.00 0.00 N ATOM 1212 CA GLU A 72 12.912 -15.620 -7.366 1.00 0.00 C ATOM 1213 C GLU A 72 13.606 -16.177 -8.611 1.00 0.00 C ATOM 1214 O GLU A 72 14.157 -17.276 -8.579 1.00 0.00 O ATOM 1215 CB GLU A 72 11.394 -15.784 -7.465 1.00 0.00 C ATOM 1216 CG GLU A 72 11.018 -16.728 -8.609 1.00 0.00 C ATOM 1217 CD GLU A 72 9.557 -17.169 -8.498 1.00 0.00 C ATOM 1218 OE1 GLU A 72 8.695 -16.266 -8.433 1.00 0.00 O ATOM 1219 OE2 GLU A 72 9.336 -18.399 -8.481 1.00 0.00 O ATOM 0 H GLU A 72 12.716 -13.561 -7.706 1.00 0.00 H new ATOM 0 HA GLU A 72 13.250 -16.189 -6.500 1.00 0.00 H new ATOM 0 HB2 GLU A 72 11.005 -16.174 -6.524 1.00 0.00 H new ATOM 0 HB3 GLU A 72 10.929 -14.811 -7.624 1.00 0.00 H new ATOM 0 HG2 GLU A 72 11.180 -16.229 -9.565 1.00 0.00 H new ATOM 0 HG3 GLU A 72 11.668 -17.603 -8.592 1.00 0.00 H new ATOM 1226 N ALA A 73 13.556 -15.393 -9.678 1.00 0.00 N ATOM 1227 CA ALA A 73 14.173 -15.794 -10.931 1.00 0.00 C ATOM 1228 C ALA A 73 15.638 -16.158 -10.680 1.00 0.00 C ATOM 1229 O ALA A 73 16.205 -16.987 -11.389 1.00 0.00 O ATOM 1230 CB ALA A 73 14.019 -14.671 -11.958 1.00 0.00 C ATOM 0 H ALA A 73 13.098 -14.482 -9.701 1.00 0.00 H new ATOM 0 HA ALA A 73 13.679 -16.677 -11.337 1.00 0.00 H new ATOM 0 HB1 ALA A 73 14.482 -14.972 -12.898 1.00 0.00 H new ATOM 0 HB2 ALA A 73 12.960 -14.471 -12.122 1.00 0.00 H new ATOM 0 HB3 ALA A 73 14.505 -13.769 -11.586 1.00 0.00 H new ATOM 1236 N HIS A 74 16.207 -15.520 -9.668 1.00 0.00 N ATOM 1237 CA HIS A 74 17.595 -15.766 -9.314 1.00 0.00 C ATOM 1238 C HIS A 74 17.722 -17.145 -8.664 1.00 0.00 C ATOM 1239 O HIS A 74 18.827 -17.667 -8.518 1.00 0.00 O ATOM 1240 CB HIS A 74 18.138 -14.641 -8.430 1.00 0.00 C ATOM 1241 CG HIS A 74 19.619 -14.395 -8.590 1.00 0.00 C ATOM 1242 ND1 HIS A 74 20.563 -14.902 -7.715 1.00 0.00 N ATOM 1243 CD2 HIS A 74 20.308 -13.690 -9.534 1.00 0.00 C ATOM 1244 CE1 HIS A 74 21.762 -14.514 -8.122 1.00 0.00 C ATOM 1245 NE2 HIS A 74 21.602 -13.762 -9.249 1.00 0.00 N ATOM 0 H HIS A 74 15.732 -14.833 -9.082 1.00 0.00 H new ATOM 0 HA HIS A 74 18.209 -15.770 -10.215 1.00 0.00 H new ATOM 0 HB2 HIS A 74 17.600 -13.721 -8.659 1.00 0.00 H new ATOM 0 HB3 HIS A 74 17.930 -14.880 -7.387 1.00 0.00 H new ATOM 0 HD2 HIS A 74 19.874 -13.163 -10.371 1.00 0.00 H new ATOM 0 HE1 HIS A 74 22.702 -14.751 -7.645 1.00 0.00 H new ATOM 0 HE2 HIS A 74 22.353 -13.327 -9.784 1.00 0.00 H new ATOM 1253 N LYS A 75 16.576 -17.697 -8.293 1.00 0.00 N ATOM 1254 CA LYS A 75 16.546 -19.005 -7.662 1.00 0.00 C ATOM 1255 C LYS A 75 16.111 -20.052 -8.690 1.00 0.00 C ATOM 1256 O LYS A 75 15.768 -21.177 -8.329 1.00 0.00 O ATOM 1257 CB LYS A 75 15.670 -18.975 -6.408 1.00 0.00 C ATOM 1258 CG LYS A 75 14.290 -19.573 -6.688 1.00 0.00 C ATOM 1259 CD LYS A 75 13.281 -19.148 -5.619 1.00 0.00 C ATOM 1260 CE LYS A 75 12.058 -20.067 -5.623 1.00 0.00 C ATOM 1261 NZ LYS A 75 12.058 -20.935 -4.425 1.00 0.00 N ATOM 0 H LYS A 75 15.662 -17.262 -8.417 1.00 0.00 H new ATOM 0 HA LYS A 75 17.542 -19.286 -7.321 1.00 0.00 H new ATOM 0 HB2 LYS A 75 16.156 -19.532 -5.607 1.00 0.00 H new ATOM 0 HB3 LYS A 75 15.561 -17.948 -6.061 1.00 0.00 H new ATOM 0 HG2 LYS A 75 13.943 -19.251 -7.670 1.00 0.00 H new ATOM 0 HG3 LYS A 75 14.360 -20.660 -6.716 1.00 0.00 H new ATOM 0 HD2 LYS A 75 13.754 -19.171 -4.637 1.00 0.00 H new ATOM 0 HD3 LYS A 75 12.968 -18.119 -5.798 1.00 0.00 H new ATOM 0 HE2 LYS A 75 11.147 -19.469 -5.646 1.00 0.00 H new ATOM 0 HE3 LYS A 75 12.060 -20.681 -6.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 11.221 -21.552 -4.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 12.919 -21.519 -4.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 12.034 -20.345 -3.569 1.00 0.00 H new ATOM 1275 N VAL A 76 16.140 -19.644 -9.950 1.00 0.00 N ATOM 1276 CA VAL A 76 15.754 -20.533 -11.033 1.00 0.00 C ATOM 1277 C VAL A 76 16.959 -20.772 -11.946 1.00 0.00 C ATOM 1278 O VAL A 76 17.124 -21.864 -12.488 1.00 0.00 O ATOM 1279 CB VAL A 76 14.546 -19.958 -11.776 1.00 0.00 C ATOM 1280 CG1 VAL A 76 13.678 -21.076 -12.358 1.00 0.00 C ATOM 1281 CG2 VAL A 76 13.725 -19.045 -10.864 1.00 0.00 C ATOM 0 H VAL A 76 16.425 -18.710 -10.245 1.00 0.00 H new ATOM 0 HA VAL A 76 15.447 -21.502 -10.640 1.00 0.00 H new ATOM 0 HB VAL A 76 14.918 -19.356 -12.605 1.00 0.00 H new ATOM 0 HG11 VAL A 76 12.826 -20.641 -12.881 1.00 0.00 H new ATOM 0 HG12 VAL A 76 14.268 -21.669 -13.057 1.00 0.00 H new ATOM 0 HG13 VAL A 76 13.320 -21.716 -11.552 1.00 0.00 H new ATOM 0 HG21 VAL A 76 12.873 -18.650 -11.417 1.00 0.00 H new ATOM 0 HG22 VAL A 76 13.368 -19.614 -10.005 1.00 0.00 H new ATOM 0 HG23 VAL A 76 14.348 -18.220 -10.519 1.00 0.00 H new ATOM 1291 N LEU A 77 17.769 -19.733 -12.087 1.00 0.00 N ATOM 1292 CA LEU A 77 18.953 -19.816 -12.925 1.00 0.00 C ATOM 1293 C LEU A 77 20.176 -19.382 -12.115 1.00 0.00 C ATOM 1294 O LEU A 77 20.997 -20.213 -11.730 1.00 0.00 O ATOM 1295 CB LEU A 77 18.754 -19.018 -14.215 1.00 0.00 C ATOM 1296 CG LEU A 77 17.311 -18.884 -14.705 1.00 0.00 C ATOM 1297 CD1 LEU A 77 16.703 -17.552 -14.260 1.00 0.00 C ATOM 1298 CD2 LEU A 77 17.226 -19.075 -16.220 1.00 0.00 C ATOM 0 H LEU A 77 17.629 -18.829 -11.635 1.00 0.00 H new ATOM 0 HA LEU A 77 19.127 -20.845 -13.239 1.00 0.00 H new ATOM 0 HB2 LEU A 77 19.161 -18.018 -14.066 1.00 0.00 H new ATOM 0 HB3 LEU A 77 19.342 -19.487 -15.003 1.00 0.00 H new ATOM 0 HG LEU A 77 16.720 -19.677 -14.247 1.00 0.00 H new ATOM 0 HD11 LEU A 77 15.677 -17.482 -14.621 1.00 0.00 H new ATOM 0 HD12 LEU A 77 16.709 -17.495 -13.172 1.00 0.00 H new ATOM 0 HD13 LEU A 77 17.289 -16.729 -14.670 1.00 0.00 H new ATOM 0 HD21 LEU A 77 16.189 -18.975 -16.542 1.00 0.00 H new ATOM 0 HD22 LEU A 77 17.835 -18.320 -16.717 1.00 0.00 H new ATOM 0 HD23 LEU A 77 17.593 -20.067 -16.483 1.00 0.00 H new ATOM 1310 N GLY A 78 20.259 -18.080 -11.881 1.00 0.00 N ATOM 1311 CA GLY A 78 21.369 -17.525 -11.124 1.00 0.00 C ATOM 1312 C GLY A 78 21.613 -16.063 -11.502 1.00 0.00 C ATOM 1313 O GLY A 78 20.742 -15.215 -11.313 1.00 0.00 O ATOM 0 H GLY A 78 19.576 -17.394 -12.202 1.00 0.00 H new ATOM 0 HA2 GLY A 78 21.159 -17.598 -10.057 1.00 0.00 H new ATOM 0 HA3 GLY A 78 22.270 -18.108 -11.312 1.00 0.00 H new ATOM 1317 N ASN A 79 22.803 -15.812 -12.029 1.00 0.00 N ATOM 1318 CA ASN A 79 23.173 -14.467 -12.435 1.00 0.00 C ATOM 1319 C ASN A 79 22.758 -14.246 -13.892 1.00 0.00 C ATOM 1320 O ASN A 79 23.268 -13.345 -14.556 1.00 0.00 O ATOM 1321 CB ASN A 79 24.685 -14.258 -12.337 1.00 0.00 C ATOM 1322 CG ASN A 79 25.400 -15.572 -12.015 1.00 0.00 C ATOM 1323 OD1 ASN A 79 25.270 -16.566 -12.711 1.00 0.00 O ATOM 1324 ND2 ASN A 79 26.160 -15.521 -10.926 1.00 0.00 N ATOM 0 H ASN A 79 23.523 -16.518 -12.184 1.00 0.00 H new ATOM 0 HA ASN A 79 22.668 -13.764 -11.772 1.00 0.00 H new ATOM 0 HB2 ASN A 79 25.062 -13.856 -13.277 1.00 0.00 H new ATOM 0 HB3 ASN A 79 24.905 -13.521 -11.564 1.00 0.00 H new ATOM 0 HD21 ASN A 79 26.679 -16.347 -10.627 1.00 0.00 H new ATOM 0 HD22 ASN A 79 26.224 -14.656 -10.389 1.00 0.00 H new ATOM 1331 N ARG A 80 21.838 -15.085 -14.345 1.00 0.00 N ATOM 1332 CA ARG A 80 21.350 -14.993 -15.710 1.00 0.00 C ATOM 1333 C ARG A 80 20.473 -13.751 -15.878 1.00 0.00 C ATOM 1334 O ARG A 80 19.312 -13.854 -16.272 1.00 0.00 O ATOM 1335 CB ARG A 80 20.541 -16.235 -16.091 1.00 0.00 C ATOM 1336 CG ARG A 80 21.412 -17.249 -16.836 1.00 0.00 C ATOM 1337 CD ARG A 80 21.610 -18.518 -16.003 1.00 0.00 C ATOM 1338 NE ARG A 80 21.178 -19.703 -16.777 1.00 0.00 N ATOM 1339 CZ ARG A 80 21.109 -20.943 -16.275 1.00 0.00 C ATOM 1340 NH1 ARG A 80 21.442 -21.168 -14.997 1.00 0.00 N ATOM 1341 NH2 ARG A 80 20.706 -21.959 -17.051 1.00 0.00 N ATOM 0 H ARG A 80 21.418 -15.831 -13.791 1.00 0.00 H new ATOM 0 HA ARG A 80 22.217 -14.922 -16.367 1.00 0.00 H new ATOM 0 HB2 ARG A 80 20.129 -16.695 -15.193 1.00 0.00 H new ATOM 0 HB3 ARG A 80 19.697 -15.946 -16.717 1.00 0.00 H new ATOM 0 HG2 ARG A 80 20.947 -17.504 -17.788 1.00 0.00 H new ATOM 0 HG3 ARG A 80 22.381 -16.804 -17.064 1.00 0.00 H new ATOM 0 HD2 ARG A 80 22.658 -18.619 -15.722 1.00 0.00 H new ATOM 0 HD3 ARG A 80 21.038 -18.449 -15.078 1.00 0.00 H new ATOM 0 HE ARG A 80 20.917 -19.567 -17.754 1.00 0.00 H new ATOM 0 HH11 ARG A 80 21.748 -20.395 -14.406 1.00 0.00 H new ATOM 0 HH12 ARG A 80 21.389 -22.112 -14.615 1.00 0.00 H new ATOM 0 HH21 ARG A 80 20.452 -21.788 -18.024 1.00 0.00 H new ATOM 0 HH22 ARG A 80 20.654 -22.903 -16.669 1.00 0.00 H new ATOM 1355 N TRP A 81 21.061 -12.604 -15.570 1.00 0.00 N ATOM 1356 CA TRP A 81 20.347 -11.343 -15.681 1.00 0.00 C ATOM 1357 C TRP A 81 19.759 -11.256 -17.090 1.00 0.00 C ATOM 1358 O TRP A 81 18.682 -10.694 -17.284 1.00 0.00 O ATOM 1359 CB TRP A 81 21.261 -10.164 -15.341 1.00 0.00 C ATOM 1360 CG TRP A 81 22.269 -10.459 -14.228 1.00 0.00 C ATOM 1361 CD1 TRP A 81 23.605 -10.515 -14.319 1.00 0.00 C ATOM 1362 CD2 TRP A 81 21.966 -10.738 -12.845 1.00 0.00 C ATOM 1363 NE1 TRP A 81 24.183 -10.808 -13.100 1.00 0.00 N ATOM 1364 CE2 TRP A 81 23.154 -10.948 -12.176 1.00 0.00 C ATOM 1365 CE3 TRP A 81 20.729 -10.810 -12.181 1.00 0.00 C ATOM 1366 CZ2 TRP A 81 23.222 -11.243 -10.809 1.00 0.00 C ATOM 1367 CZ3 TRP A 81 20.814 -11.106 -10.816 1.00 0.00 C ATOM 1368 CH2 TRP A 81 22.002 -11.320 -10.127 1.00 0.00 C ATOM 0 H TRP A 81 22.024 -12.522 -15.244 1.00 0.00 H new ATOM 0 HA TRP A 81 19.531 -11.296 -14.960 1.00 0.00 H new ATOM 0 HB2 TRP A 81 21.803 -9.867 -16.239 1.00 0.00 H new ATOM 0 HB3 TRP A 81 20.646 -9.314 -15.044 1.00 0.00 H new ATOM 0 HD1 TRP A 81 24.160 -10.351 -15.231 1.00 0.00 H new ATOM 0 HE1 TRP A 81 25.181 -10.904 -12.912 1.00 0.00 H new ATOM 0 HE3 TRP A 81 19.787 -10.650 -12.685 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 24.165 -11.403 -10.308 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 19.891 -11.173 -10.259 1.00 0.00 H new ATOM 0 HH2 TRP A 81 21.984 -11.545 -9.071 1.00 0.00 H new ATOM 1379 N ALA A 82 20.491 -11.821 -18.039 1.00 0.00 N ATOM 1380 CA ALA A 82 20.055 -11.814 -19.425 1.00 0.00 C ATOM 1381 C ALA A 82 18.750 -12.602 -19.549 1.00 0.00 C ATOM 1382 O ALA A 82 17.965 -12.371 -20.467 1.00 0.00 O ATOM 1383 CB ALA A 82 21.165 -12.381 -20.313 1.00 0.00 C ATOM 0 H ALA A 82 21.384 -12.287 -17.875 1.00 0.00 H new ATOM 0 HA ALA A 82 19.858 -10.795 -19.760 1.00 0.00 H new ATOM 0 HB1 ALA A 82 20.838 -12.376 -21.353 1.00 0.00 H new ATOM 0 HB2 ALA A 82 22.061 -11.768 -20.211 1.00 0.00 H new ATOM 0 HB3 ALA A 82 21.388 -13.403 -20.008 1.00 0.00 H new ATOM 1389 N GLU A 83 18.558 -13.517 -18.610 1.00 0.00 N ATOM 1390 CA GLU A 83 17.361 -14.341 -18.602 1.00 0.00 C ATOM 1391 C GLU A 83 16.482 -13.989 -17.400 1.00 0.00 C ATOM 1392 O GLU A 83 15.342 -14.442 -17.306 1.00 0.00 O ATOM 1393 CB GLU A 83 17.719 -15.829 -18.602 1.00 0.00 C ATOM 1394 CG GLU A 83 18.949 -16.096 -19.472 1.00 0.00 C ATOM 1395 CD GLU A 83 18.608 -15.972 -20.958 1.00 0.00 C ATOM 1396 OE1 GLU A 83 18.012 -16.935 -21.486 1.00 0.00 O ATOM 1397 OE2 GLU A 83 18.951 -14.916 -21.533 1.00 0.00 O ATOM 0 H GLU A 83 19.211 -13.706 -17.850 1.00 0.00 H new ATOM 0 HA GLU A 83 16.797 -14.137 -19.512 1.00 0.00 H new ATOM 0 HB2 GLU A 83 17.912 -16.161 -17.582 1.00 0.00 H new ATOM 0 HB3 GLU A 83 16.874 -16.410 -18.972 1.00 0.00 H new ATOM 0 HG2 GLU A 83 19.739 -15.390 -19.217 1.00 0.00 H new ATOM 0 HG3 GLU A 83 19.335 -17.094 -19.266 1.00 0.00 H new ATOM 1404 N ILE A 84 17.046 -13.185 -16.511 1.00 0.00 N ATOM 1405 CA ILE A 84 16.328 -12.767 -15.318 1.00 0.00 C ATOM 1406 C ILE A 84 15.361 -11.638 -15.680 1.00 0.00 C ATOM 1407 O ILE A 84 14.201 -11.655 -15.272 1.00 0.00 O ATOM 1408 CB ILE A 84 17.309 -12.403 -14.202 1.00 0.00 C ATOM 1409 CG1 ILE A 84 17.007 -13.193 -12.927 1.00 0.00 C ATOM 1410 CG2 ILE A 84 17.319 -10.893 -13.952 1.00 0.00 C ATOM 1411 CD1 ILE A 84 17.727 -14.542 -12.935 1.00 0.00 C ATOM 0 H ILE A 84 17.992 -12.812 -16.592 1.00 0.00 H new ATOM 0 HA ILE A 84 15.728 -13.588 -14.927 1.00 0.00 H new ATOM 0 HB ILE A 84 18.312 -12.683 -14.524 1.00 0.00 H new ATOM 0 HG12 ILE A 84 17.317 -12.616 -12.056 1.00 0.00 H new ATOM 0 HG13 ILE A 84 15.932 -13.351 -12.839 1.00 0.00 H new ATOM 0 HG21 ILE A 84 18.024 -10.661 -13.154 1.00 0.00 H new ATOM 0 HG22 ILE A 84 17.619 -10.375 -14.863 1.00 0.00 H new ATOM 0 HG23 ILE A 84 16.321 -10.566 -13.660 1.00 0.00 H new ATOM 0 HD11 ILE A 84 17.495 -15.083 -12.018 1.00 0.00 H new ATOM 0 HD12 ILE A 84 17.397 -15.126 -13.794 1.00 0.00 H new ATOM 0 HD13 ILE A 84 18.803 -14.380 -12.999 1.00 0.00 H new ATOM 1423 N ALA A 85 15.875 -10.683 -16.441 1.00 0.00 N ATOM 1424 CA ALA A 85 15.071 -9.548 -16.863 1.00 0.00 C ATOM 1425 C ALA A 85 13.848 -10.052 -17.631 1.00 0.00 C ATOM 1426 O ALA A 85 12.875 -9.320 -17.804 1.00 0.00 O ATOM 1427 CB ALA A 85 15.931 -8.595 -17.695 1.00 0.00 C ATOM 0 H ALA A 85 16.838 -10.672 -16.776 1.00 0.00 H new ATOM 0 HA ALA A 85 14.710 -8.991 -15.999 1.00 0.00 H new ATOM 0 HB1 ALA A 85 15.328 -7.744 -18.012 1.00 0.00 H new ATOM 0 HB2 ALA A 85 16.769 -8.243 -17.094 1.00 0.00 H new ATOM 0 HB3 ALA A 85 16.309 -9.119 -18.573 1.00 0.00 H new ATOM 1433 N LYS A 86 13.938 -11.298 -18.072 1.00 0.00 N ATOM 1434 CA LYS A 86 12.850 -11.908 -18.817 1.00 0.00 C ATOM 1435 C LYS A 86 11.663 -12.141 -17.881 1.00 0.00 C ATOM 1436 O LYS A 86 11.271 -13.282 -17.641 1.00 0.00 O ATOM 1437 CB LYS A 86 13.332 -13.176 -19.526 1.00 0.00 C ATOM 1438 CG LYS A 86 14.199 -12.830 -20.738 1.00 0.00 C ATOM 1439 CD LYS A 86 13.355 -12.747 -22.011 1.00 0.00 C ATOM 1440 CE LYS A 86 13.526 -11.388 -22.695 1.00 0.00 C ATOM 1441 NZ LYS A 86 12.237 -10.922 -23.253 1.00 0.00 N ATOM 0 H LYS A 86 14.747 -11.902 -17.928 1.00 0.00 H new ATOM 0 HA LYS A 86 12.507 -11.239 -19.606 1.00 0.00 H new ATOM 0 HB2 LYS A 86 13.902 -13.792 -18.830 1.00 0.00 H new ATOM 0 HB3 LYS A 86 12.474 -13.767 -19.845 1.00 0.00 H new ATOM 0 HG2 LYS A 86 14.703 -11.878 -20.569 1.00 0.00 H new ATOM 0 HG3 LYS A 86 14.976 -13.585 -20.861 1.00 0.00 H new ATOM 0 HD2 LYS A 86 13.646 -13.543 -22.697 1.00 0.00 H new ATOM 0 HD3 LYS A 86 12.305 -12.905 -21.766 1.00 0.00 H new ATOM 0 HE2 LYS A 86 13.904 -10.659 -21.978 1.00 0.00 H new ATOM 0 HE3 LYS A 86 14.267 -11.466 -23.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 12.371 -9.999 -23.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 11.892 -11.610 -23.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 11.540 -10.828 -22.486 1.00 0.00 H new ATOM 1455 N LEU A 87 11.123 -11.041 -17.378 1.00 0.00 N ATOM 1456 CA LEU A 87 9.988 -11.110 -16.473 1.00 0.00 C ATOM 1457 C LEU A 87 9.235 -9.779 -16.503 1.00 0.00 C ATOM 1458 O LEU A 87 8.007 -9.755 -16.437 1.00 0.00 O ATOM 1459 CB LEU A 87 10.443 -11.528 -15.073 1.00 0.00 C ATOM 1460 CG LEU A 87 10.321 -13.017 -14.745 1.00 0.00 C ATOM 1461 CD1 LEU A 87 11.420 -13.458 -13.777 1.00 0.00 C ATOM 1462 CD2 LEU A 87 8.924 -13.349 -14.215 1.00 0.00 C ATOM 0 H LEU A 87 11.450 -10.096 -17.580 1.00 0.00 H new ATOM 0 HA LEU A 87 9.288 -11.880 -16.798 1.00 0.00 H new ATOM 0 HB2 LEU A 87 11.485 -11.233 -14.948 1.00 0.00 H new ATOM 0 HB3 LEU A 87 9.863 -10.966 -14.341 1.00 0.00 H new ATOM 0 HG LEU A 87 10.459 -13.582 -15.667 1.00 0.00 H new ATOM 0 HD11 LEU A 87 11.310 -14.521 -13.561 1.00 0.00 H new ATOM 0 HD12 LEU A 87 12.396 -13.279 -14.228 1.00 0.00 H new ATOM 0 HD13 LEU A 87 11.339 -12.889 -12.851 1.00 0.00 H new ATOM 0 HD21 LEU A 87 8.864 -14.414 -13.990 1.00 0.00 H new ATOM 0 HD22 LEU A 87 8.733 -12.775 -13.308 1.00 0.00 H new ATOM 0 HD23 LEU A 87 8.179 -13.095 -14.969 1.00 0.00 H new ATOM 1474 N LEU A 88 10.003 -8.704 -16.602 1.00 0.00 N ATOM 1475 CA LEU A 88 9.423 -7.372 -16.642 1.00 0.00 C ATOM 1476 C LEU A 88 9.188 -6.965 -18.098 1.00 0.00 C ATOM 1477 O LEU A 88 9.404 -7.761 -19.011 1.00 0.00 O ATOM 1478 CB LEU A 88 10.294 -6.385 -15.861 1.00 0.00 C ATOM 1479 CG LEU A 88 11.162 -6.987 -14.754 1.00 0.00 C ATOM 1480 CD1 LEU A 88 10.401 -8.073 -13.991 1.00 0.00 C ATOM 1481 CD2 LEU A 88 12.488 -7.504 -15.316 1.00 0.00 C ATOM 0 H LEU A 88 11.021 -8.728 -16.656 1.00 0.00 H new ATOM 0 HA LEU A 88 8.451 -7.365 -16.148 1.00 0.00 H new ATOM 0 HB2 LEU A 88 10.946 -5.869 -16.566 1.00 0.00 H new ATOM 0 HB3 LEU A 88 9.645 -5.631 -15.417 1.00 0.00 H new ATOM 0 HG LEU A 88 11.401 -6.198 -14.040 1.00 0.00 H new ATOM 0 HD11 LEU A 88 11.040 -8.485 -13.210 1.00 0.00 H new ATOM 0 HD12 LEU A 88 9.508 -7.642 -13.539 1.00 0.00 H new ATOM 0 HD13 LEU A 88 10.112 -8.867 -14.680 1.00 0.00 H new ATOM 0 HD21 LEU A 88 13.085 -7.927 -14.508 1.00 0.00 H new ATOM 0 HD22 LEU A 88 12.291 -8.273 -16.063 1.00 0.00 H new ATOM 0 HD23 LEU A 88 13.033 -6.681 -15.778 1.00 0.00 H new ATOM 1493 N PRO A 89 8.736 -5.695 -18.274 1.00 0.00 N ATOM 1494 CA PRO A 89 8.469 -5.173 -19.604 1.00 0.00 C ATOM 1495 C PRO A 89 9.772 -4.849 -20.338 1.00 0.00 C ATOM 1496 O PRO A 89 9.748 -4.363 -21.467 1.00 0.00 O ATOM 1497 CB PRO A 89 7.594 -3.951 -19.379 1.00 0.00 C ATOM 1498 CG PRO A 89 7.786 -3.564 -17.922 1.00 0.00 C ATOM 1499 CD PRO A 89 8.468 -4.725 -17.217 1.00 0.00 C ATOM 0 HA PRO A 89 7.964 -5.895 -20.245 1.00 0.00 H new ATOM 0 HB2 PRO A 89 7.884 -3.135 -20.041 1.00 0.00 H new ATOM 0 HB3 PRO A 89 6.548 -4.175 -19.589 1.00 0.00 H new ATOM 0 HG2 PRO A 89 8.391 -2.661 -17.844 1.00 0.00 H new ATOM 0 HG3 PRO A 89 6.826 -3.345 -17.455 1.00 0.00 H new ATOM 0 HD2 PRO A 89 9.389 -4.406 -16.729 1.00 0.00 H new ATOM 0 HD3 PRO A 89 7.828 -5.149 -16.443 1.00 0.00 H new ATOM 1507 N GLY A 90 10.878 -5.130 -19.665 1.00 0.00 N ATOM 1508 CA GLY A 90 12.188 -4.874 -20.239 1.00 0.00 C ATOM 1509 C GLY A 90 13.169 -4.386 -19.171 1.00 0.00 C ATOM 1510 O GLY A 90 12.944 -3.352 -18.543 1.00 0.00 O ATOM 0 H GLY A 90 10.894 -5.532 -18.728 1.00 0.00 H new ATOM 0 HA2 GLY A 90 12.571 -5.784 -20.701 1.00 0.00 H new ATOM 0 HA3 GLY A 90 12.103 -4.127 -21.029 1.00 0.00 H new ATOM 1514 N ARG A 91 14.235 -5.152 -18.997 1.00 0.00 N ATOM 1515 CA ARG A 91 15.251 -4.810 -18.016 1.00 0.00 C ATOM 1516 C ARG A 91 16.626 -5.289 -18.486 1.00 0.00 C ATOM 1517 O ARG A 91 17.549 -5.419 -17.684 1.00 0.00 O ATOM 1518 CB ARG A 91 14.937 -5.438 -16.656 1.00 0.00 C ATOM 1519 CG ARG A 91 13.814 -4.679 -15.948 1.00 0.00 C ATOM 1520 CD ARG A 91 14.303 -3.318 -15.447 1.00 0.00 C ATOM 1521 NE ARG A 91 13.162 -2.529 -14.932 1.00 0.00 N ATOM 1522 CZ ARG A 91 13.191 -1.202 -14.742 1.00 0.00 C ATOM 1523 NH1 ARG A 91 14.302 -0.509 -15.024 1.00 0.00 N ATOM 1524 NH2 ARG A 91 12.108 -0.569 -14.270 1.00 0.00 N ATOM 0 H ARG A 91 14.418 -6.009 -19.519 1.00 0.00 H new ATOM 0 HA ARG A 91 15.257 -3.725 -17.910 1.00 0.00 H new ATOM 0 HB2 ARG A 91 14.648 -6.480 -16.791 1.00 0.00 H new ATOM 0 HB3 ARG A 91 15.832 -5.434 -16.034 1.00 0.00 H new ATOM 0 HG2 ARG A 91 12.977 -4.539 -16.632 1.00 0.00 H new ATOM 0 HG3 ARG A 91 13.445 -5.268 -15.109 1.00 0.00 H new ATOM 0 HD2 ARG A 91 15.045 -3.456 -14.661 1.00 0.00 H new ATOM 0 HD3 ARG A 91 14.793 -2.778 -16.257 1.00 0.00 H new ATOM 0 HE ARG A 91 12.300 -3.026 -14.708 1.00 0.00 H new ATOM 0 HH11 ARG A 91 15.126 -0.991 -15.383 1.00 0.00 H new ATOM 0 HH12 ARG A 91 14.324 0.500 -14.879 1.00 0.00 H new ATOM 0 HH21 ARG A 91 11.262 -1.097 -14.055 1.00 0.00 H new ATOM 0 HH22 ARG A 91 12.130 0.440 -14.125 1.00 0.00 H new ATOM 1538 N THR A 92 16.718 -5.539 -19.784 1.00 0.00 N ATOM 1539 CA THR A 92 17.965 -6.001 -20.370 1.00 0.00 C ATOM 1540 C THR A 92 18.618 -7.054 -19.473 1.00 0.00 C ATOM 1541 O THR A 92 18.190 -8.207 -19.451 1.00 0.00 O ATOM 1542 CB THR A 92 18.852 -4.779 -20.617 1.00 0.00 C ATOM 1543 OG1 THR A 92 19.114 -4.270 -19.312 1.00 0.00 O ATOM 1544 CG2 THR A 92 18.104 -3.643 -21.317 1.00 0.00 C ATOM 0 H THR A 92 15.950 -5.430 -20.446 1.00 0.00 H new ATOM 0 HA THR A 92 17.794 -6.495 -21.326 1.00 0.00 H new ATOM 0 HB THR A 92 19.712 -5.072 -21.219 1.00 0.00 H new ATOM 0 HG1 THR A 92 20.017 -3.891 -19.284 1.00 0.00 H new ATOM 0 HG21 THR A 92 18.780 -2.801 -21.468 1.00 0.00 H new ATOM 0 HG22 THR A 92 17.736 -3.990 -22.282 1.00 0.00 H new ATOM 0 HG23 THR A 92 17.263 -3.327 -20.700 1.00 0.00 H new ATOM 1552 N ASP A 93 19.644 -6.621 -18.756 1.00 0.00 N ATOM 1553 CA ASP A 93 20.360 -7.513 -17.860 1.00 0.00 C ATOM 1554 C ASP A 93 21.201 -6.684 -16.887 1.00 0.00 C ATOM 1555 O ASP A 93 21.225 -6.961 -15.689 1.00 0.00 O ATOM 1556 CB ASP A 93 21.305 -8.432 -18.636 1.00 0.00 C ATOM 1557 CG ASP A 93 21.583 -8.004 -20.078 1.00 0.00 C ATOM 1558 OD1 ASP A 93 22.491 -7.164 -20.255 1.00 0.00 O ATOM 1559 OD2 ASP A 93 20.882 -8.527 -20.971 1.00 0.00 O ATOM 0 H ASP A 93 19.997 -5.664 -18.777 1.00 0.00 H new ATOM 0 HA ASP A 93 19.625 -8.117 -17.328 1.00 0.00 H new ATOM 0 HB2 ASP A 93 22.253 -8.489 -18.101 1.00 0.00 H new ATOM 0 HB3 ASP A 93 20.883 -9.437 -18.646 1.00 0.00 H new ATOM 1564 N ASN A 94 21.871 -5.683 -17.439 1.00 0.00 N ATOM 1565 CA ASN A 94 22.711 -4.811 -16.635 1.00 0.00 C ATOM 1566 C ASN A 94 21.847 -4.090 -15.599 1.00 0.00 C ATOM 1567 O ASN A 94 22.365 -3.530 -14.634 1.00 0.00 O ATOM 1568 CB ASN A 94 23.394 -3.751 -17.501 1.00 0.00 C ATOM 1569 CG ASN A 94 23.810 -4.334 -18.854 1.00 0.00 C ATOM 1570 OD1 ASN A 94 22.996 -4.783 -19.643 1.00 0.00 O ATOM 1571 ND2 ASN A 94 25.121 -4.301 -19.076 1.00 0.00 N ATOM 0 H ASN A 94 21.849 -5.456 -18.433 1.00 0.00 H new ATOM 0 HA ASN A 94 23.470 -5.427 -16.153 1.00 0.00 H new ATOM 0 HB2 ASN A 94 22.717 -2.911 -17.656 1.00 0.00 H new ATOM 0 HB3 ASN A 94 24.271 -3.363 -16.983 1.00 0.00 H new ATOM 0 HD21 ASN A 94 25.500 -4.666 -19.950 1.00 0.00 H new ATOM 0 HD22 ASN A 94 25.748 -3.911 -18.372 1.00 0.00 H new ATOM 1578 N ALA A 95 20.543 -4.128 -15.834 1.00 0.00 N ATOM 1579 CA ALA A 95 19.602 -3.484 -14.933 1.00 0.00 C ATOM 1580 C ALA A 95 19.483 -4.311 -13.651 1.00 0.00 C ATOM 1581 O ALA A 95 19.858 -3.851 -12.574 1.00 0.00 O ATOM 1582 CB ALA A 95 18.257 -3.309 -15.641 1.00 0.00 C ATOM 0 H ALA A 95 20.116 -4.594 -16.635 1.00 0.00 H new ATOM 0 HA ALA A 95 19.955 -2.491 -14.653 1.00 0.00 H new ATOM 0 HB1 ALA A 95 17.551 -2.826 -14.966 1.00 0.00 H new ATOM 0 HB2 ALA A 95 18.391 -2.691 -16.529 1.00 0.00 H new ATOM 0 HB3 ALA A 95 17.870 -4.285 -15.933 1.00 0.00 H new ATOM 1588 N VAL A 96 18.958 -5.518 -13.810 1.00 0.00 N ATOM 1589 CA VAL A 96 18.785 -6.413 -12.679 1.00 0.00 C ATOM 1590 C VAL A 96 20.155 -6.753 -12.089 1.00 0.00 C ATOM 1591 O VAL A 96 20.350 -6.672 -10.877 1.00 0.00 O ATOM 1592 CB VAL A 96 17.995 -7.651 -13.108 1.00 0.00 C ATOM 1593 CG1 VAL A 96 17.767 -8.594 -11.924 1.00 0.00 C ATOM 1594 CG2 VAL A 96 16.667 -7.256 -13.757 1.00 0.00 C ATOM 0 H VAL A 96 18.647 -5.896 -14.705 1.00 0.00 H new ATOM 0 HA VAL A 96 18.204 -5.929 -11.894 1.00 0.00 H new ATOM 0 HB VAL A 96 18.587 -8.184 -13.852 1.00 0.00 H new ATOM 0 HG11 VAL A 96 17.203 -9.466 -12.256 1.00 0.00 H new ATOM 0 HG12 VAL A 96 18.729 -8.915 -11.524 1.00 0.00 H new ATOM 0 HG13 VAL A 96 17.206 -8.074 -11.147 1.00 0.00 H new ATOM 0 HG21 VAL A 96 16.125 -8.154 -14.053 1.00 0.00 H new ATOM 0 HG22 VAL A 96 16.068 -6.689 -13.044 1.00 0.00 H new ATOM 0 HG23 VAL A 96 16.860 -6.643 -14.637 1.00 0.00 H new ATOM 1604 N LYS A 97 21.068 -7.127 -12.973 1.00 0.00 N ATOM 1605 CA LYS A 97 22.414 -7.480 -12.554 1.00 0.00 C ATOM 1606 C LYS A 97 22.859 -6.538 -11.434 1.00 0.00 C ATOM 1607 O LYS A 97 23.346 -6.987 -10.397 1.00 0.00 O ATOM 1608 CB LYS A 97 23.362 -7.497 -13.756 1.00 0.00 C ATOM 1609 CG LYS A 97 24.802 -7.761 -13.314 1.00 0.00 C ATOM 1610 CD LYS A 97 25.713 -7.992 -14.522 1.00 0.00 C ATOM 1611 CE LYS A 97 25.981 -6.682 -15.264 1.00 0.00 C ATOM 1612 NZ LYS A 97 27.379 -6.243 -15.054 1.00 0.00 N ATOM 0 H LYS A 97 20.902 -7.193 -13.977 1.00 0.00 H new ATOM 0 HA LYS A 97 22.433 -8.491 -12.147 1.00 0.00 H new ATOM 0 HB2 LYS A 97 23.047 -8.266 -14.461 1.00 0.00 H new ATOM 0 HB3 LYS A 97 23.308 -6.543 -14.280 1.00 0.00 H new ATOM 0 HG2 LYS A 97 25.169 -6.914 -12.734 1.00 0.00 H new ATOM 0 HG3 LYS A 97 24.831 -8.632 -12.660 1.00 0.00 H new ATOM 0 HD2 LYS A 97 26.656 -8.427 -14.193 1.00 0.00 H new ATOM 0 HD3 LYS A 97 25.250 -8.710 -15.199 1.00 0.00 H new ATOM 0 HE2 LYS A 97 25.792 -6.815 -16.329 1.00 0.00 H new ATOM 0 HE3 LYS A 97 25.295 -5.911 -14.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 27.544 -5.352 -15.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 27.548 -6.096 -14.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 28.029 -6.972 -15.411 1.00 0.00 H new ATOM 1626 N ASN A 98 22.675 -5.249 -11.680 1.00 0.00 N ATOM 1627 CA ASN A 98 23.051 -4.240 -10.705 1.00 0.00 C ATOM 1628 C ASN A 98 22.042 -4.246 -9.555 1.00 0.00 C ATOM 1629 O ASN A 98 22.416 -4.083 -8.395 1.00 0.00 O ATOM 1630 CB ASN A 98 23.048 -2.843 -11.328 1.00 0.00 C ATOM 1631 CG ASN A 98 24.124 -1.958 -10.697 1.00 0.00 C ATOM 1632 OD1 ASN A 98 24.031 -1.543 -9.553 1.00 0.00 O ATOM 1633 ND2 ASN A 98 25.148 -1.692 -11.503 1.00 0.00 N ATOM 0 H ASN A 98 22.270 -4.880 -12.541 1.00 0.00 H new ATOM 0 HA ASN A 98 24.054 -4.474 -10.349 1.00 0.00 H new ATOM 0 HB2 ASN A 98 23.219 -2.920 -12.402 1.00 0.00 H new ATOM 0 HB3 ASN A 98 22.069 -2.383 -11.193 1.00 0.00 H new ATOM 0 HD21 ASN A 98 25.918 -1.109 -11.174 1.00 0.00 H new ATOM 0 HD22 ASN A 98 25.164 -2.071 -12.450 1.00 0.00 H new ATOM 1640 N HIS A 99 20.781 -4.437 -9.918 1.00 0.00 N ATOM 1641 CA HIS A 99 19.715 -4.467 -8.931 1.00 0.00 C ATOM 1642 C HIS A 99 20.064 -5.470 -7.830 1.00 0.00 C ATOM 1643 O HIS A 99 19.503 -5.416 -6.736 1.00 0.00 O ATOM 1644 CB HIS A 99 18.368 -4.760 -9.595 1.00 0.00 C ATOM 1645 CG HIS A 99 17.176 -4.505 -8.704 1.00 0.00 C ATOM 1646 ND1 HIS A 99 17.239 -3.700 -7.580 1.00 0.00 N ATOM 1647 CD2 HIS A 99 15.891 -4.955 -8.785 1.00 0.00 C ATOM 1648 CE1 HIS A 99 16.040 -3.676 -7.016 1.00 0.00 C ATOM 1649 NE2 HIS A 99 15.206 -4.454 -7.764 1.00 0.00 N ATOM 0 H HIS A 99 20.474 -4.572 -10.881 1.00 0.00 H new ATOM 0 HA HIS A 99 19.618 -3.487 -8.464 1.00 0.00 H new ATOM 0 HB2 HIS A 99 18.276 -4.148 -10.492 1.00 0.00 H new ATOM 0 HB3 HIS A 99 18.352 -5.801 -9.917 1.00 0.00 H new ATOM 0 HD2 HIS A 99 15.497 -5.608 -9.550 1.00 0.00 H new ATOM 0 HE1 HIS A 99 15.770 -3.135 -6.121 1.00 0.00 H new ATOM 0 HE2 HIS A 99 14.219 -4.623 -7.571 1.00 0.00 H new ATOM 1657 N TRP A 100 20.987 -6.362 -8.156 1.00 0.00 N ATOM 1658 CA TRP A 100 21.417 -7.376 -7.208 1.00 0.00 C ATOM 1659 C TRP A 100 22.267 -6.691 -6.136 1.00 0.00 C ATOM 1660 O TRP A 100 22.038 -6.881 -4.943 1.00 0.00 O ATOM 1661 CB TRP A 100 22.153 -8.514 -7.919 1.00 0.00 C ATOM 1662 CG TRP A 100 21.857 -9.901 -7.345 1.00 0.00 C ATOM 1663 CD1 TRP A 100 22.731 -10.862 -7.018 1.00 0.00 C ATOM 1664 CD2 TRP A 100 20.556 -10.445 -7.041 1.00 0.00 C ATOM 1665 NE1 TRP A 100 22.091 -11.982 -6.528 1.00 0.00 N ATOM 1666 CE2 TRP A 100 20.726 -11.721 -6.542 1.00 0.00 C ATOM 1667 CE3 TRP A 100 19.277 -9.879 -7.182 1.00 0.00 C ATOM 1668 CZ2 TRP A 100 19.661 -12.538 -6.145 1.00 0.00 C ATOM 1669 CZ3 TRP A 100 18.222 -10.708 -6.781 1.00 0.00 C ATOM 1670 CH2 TRP A 100 18.377 -11.994 -6.278 1.00 0.00 C ATOM 0 H TRP A 100 21.450 -6.404 -9.064 1.00 0.00 H new ATOM 0 HA TRP A 100 20.558 -7.842 -6.725 1.00 0.00 H new ATOM 0 HB2 TRP A 100 21.883 -8.504 -8.975 1.00 0.00 H new ATOM 0 HB3 TRP A 100 23.226 -8.330 -7.863 1.00 0.00 H new ATOM 0 HD1 TRP A 100 23.802 -10.772 -7.124 1.00 0.00 H new ATOM 0 HE1 TRP A 100 22.538 -12.843 -6.213 1.00 0.00 H new ATOM 0 HE3 TRP A 100 19.120 -8.883 -7.569 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 19.821 -13.533 -5.757 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 17.218 -10.321 -6.869 1.00 0.00 H new ATOM 0 HH2 TRP A 100 17.511 -12.572 -5.991 1.00 0.00 H new ATOM 1681 N ASN A 101 23.230 -5.908 -6.601 1.00 0.00 N ATOM 1682 CA ASN A 101 24.115 -5.194 -5.696 1.00 0.00 C ATOM 1683 C ASN A 101 23.488 -3.846 -5.335 1.00 0.00 C ATOM 1684 O ASN A 101 24.014 -3.118 -4.494 1.00 0.00 O ATOM 1685 CB ASN A 101 25.471 -4.925 -6.351 1.00 0.00 C ATOM 1686 CG ASN A 101 26.328 -6.192 -6.379 1.00 0.00 C ATOM 1687 OD1 ASN A 101 26.816 -6.664 -5.366 1.00 0.00 O ATOM 1688 ND2 ASN A 101 26.482 -6.714 -7.593 1.00 0.00 N ATOM 0 H ASN A 101 23.417 -5.753 -7.592 1.00 0.00 H new ATOM 0 HA ASN A 101 24.259 -5.810 -4.808 1.00 0.00 H new ATOM 0 HB2 ASN A 101 25.322 -4.560 -7.367 1.00 0.00 H new ATOM 0 HB3 ASN A 101 25.994 -4.140 -5.804 1.00 0.00 H new ATOM 0 HD21 ASN A 101 27.037 -7.561 -7.717 1.00 0.00 H new ATOM 0 HD22 ASN A 101 26.045 -6.267 -8.399 1.00 0.00 H new ATOM 1695 N SER A 102 22.373 -3.553 -5.989 1.00 0.00 N ATOM 1696 CA SER A 102 21.670 -2.305 -5.748 1.00 0.00 C ATOM 1697 C SER A 102 20.987 -2.346 -4.379 1.00 0.00 C ATOM 1698 O SER A 102 21.455 -1.721 -3.429 1.00 0.00 O ATOM 1699 CB SER A 102 20.641 -2.032 -6.846 1.00 0.00 C ATOM 1700 OG SER A 102 21.228 -2.048 -8.144 1.00 0.00 O ATOM 0 H SER A 102 21.940 -4.159 -6.686 1.00 0.00 H new ATOM 0 HA SER A 102 22.398 -1.494 -5.760 1.00 0.00 H new ATOM 0 HB2 SER A 102 19.851 -2.781 -6.796 1.00 0.00 H new ATOM 0 HB3 SER A 102 20.173 -1.063 -6.672 1.00 0.00 H new ATOM 0 HG SER A 102 22.081 -2.529 -8.111 1.00 0.00 H new ATOM 1706 N THR A 103 19.891 -3.088 -4.322 1.00 0.00 N ATOM 1707 CA THR A 103 19.139 -3.218 -3.086 1.00 0.00 C ATOM 1708 C THR A 103 18.765 -4.682 -2.841 1.00 0.00 C ATOM 1709 O THR A 103 18.237 -5.022 -1.783 1.00 0.00 O ATOM 1710 CB THR A 103 17.927 -2.287 -3.169 1.00 0.00 C ATOM 1711 OG1 THR A 103 18.448 -1.008 -2.820 1.00 0.00 O ATOM 1712 CG2 THR A 103 16.891 -2.577 -2.081 1.00 0.00 C ATOM 0 H THR A 103 19.506 -3.605 -5.112 1.00 0.00 H new ATOM 0 HA THR A 103 19.738 -2.919 -2.226 1.00 0.00 H new ATOM 0 HB THR A 103 17.461 -2.384 -4.149 1.00 0.00 H new ATOM 0 HG1 THR A 103 17.729 -0.343 -2.850 1.00 0.00 H new ATOM 0 HG21 THR A 103 16.052 -1.889 -2.185 1.00 0.00 H new ATOM 0 HG22 THR A 103 16.534 -3.602 -2.182 1.00 0.00 H new ATOM 0 HG23 THR A 103 17.348 -2.447 -1.100 1.00 0.00 H new ATOM 1720 N ILE A 104 19.053 -5.507 -3.836 1.00 0.00 N ATOM 1721 CA ILE A 104 18.753 -6.926 -3.742 1.00 0.00 C ATOM 1722 C ILE A 104 20.022 -7.686 -3.350 1.00 0.00 C ATOM 1723 O ILE A 104 20.227 -8.821 -3.776 1.00 0.00 O ATOM 1724 CB ILE A 104 18.114 -7.426 -5.039 1.00 0.00 C ATOM 1725 CG1 ILE A 104 17.244 -6.340 -5.675 1.00 0.00 C ATOM 1726 CG2 ILE A 104 17.333 -8.720 -4.802 1.00 0.00 C ATOM 1727 CD1 ILE A 104 15.792 -6.454 -5.204 1.00 0.00 C ATOM 0 H ILE A 104 19.491 -5.221 -4.712 1.00 0.00 H new ATOM 0 HA ILE A 104 18.016 -7.108 -2.960 1.00 0.00 H new ATOM 0 HB ILE A 104 18.911 -7.656 -5.746 1.00 0.00 H new ATOM 0 HG12 ILE A 104 17.637 -5.357 -5.417 1.00 0.00 H new ATOM 0 HG13 ILE A 104 17.286 -6.425 -6.761 1.00 0.00 H new ATOM 0 HG21 ILE A 104 16.889 -9.054 -5.740 1.00 0.00 H new ATOM 0 HG22 ILE A 104 18.008 -9.489 -4.426 1.00 0.00 H new ATOM 0 HG23 ILE A 104 16.545 -8.541 -4.071 1.00 0.00 H new ATOM 0 HD11 ILE A 104 15.195 -5.670 -5.671 1.00 0.00 H new ATOM 0 HD12 ILE A 104 15.394 -7.429 -5.485 1.00 0.00 H new ATOM 0 HD13 ILE A 104 15.751 -6.344 -4.120 1.00 0.00 H new ATOM 1739 N LYS A 105 20.840 -7.029 -2.541 1.00 0.00 N ATOM 1740 CA LYS A 105 22.084 -7.628 -2.086 1.00 0.00 C ATOM 1741 C LYS A 105 22.049 -7.771 -0.563 1.00 0.00 C ATOM 1742 O LYS A 105 23.058 -7.560 0.107 1.00 0.00 O ATOM 1743 CB LYS A 105 23.283 -6.830 -2.601 1.00 0.00 C ATOM 1744 CG LYS A 105 22.918 -5.357 -2.799 1.00 0.00 C ATOM 1745 CD LYS A 105 22.489 -4.716 -1.478 1.00 0.00 C ATOM 1746 CE LYS A 105 23.704 -4.234 -0.683 1.00 0.00 C ATOM 1747 NZ LYS A 105 23.292 -3.270 0.362 1.00 0.00 N ATOM 0 H LYS A 105 20.666 -6.088 -2.189 1.00 0.00 H new ATOM 0 HA LYS A 105 22.197 -8.631 -2.498 1.00 0.00 H new ATOM 0 HB2 LYS A 105 24.109 -6.912 -1.895 1.00 0.00 H new ATOM 0 HB3 LYS A 105 23.627 -7.253 -3.545 1.00 0.00 H new ATOM 0 HG2 LYS A 105 23.773 -4.819 -3.208 1.00 0.00 H new ATOM 0 HG3 LYS A 105 22.111 -5.273 -3.527 1.00 0.00 H new ATOM 0 HD2 LYS A 105 21.823 -3.876 -1.676 1.00 0.00 H new ATOM 0 HD3 LYS A 105 21.925 -5.437 -0.886 1.00 0.00 H new ATOM 0 HE2 LYS A 105 24.206 -5.085 -0.223 1.00 0.00 H new ATOM 0 HE3 LYS A 105 24.423 -3.765 -1.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 24.129 -2.953 0.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 22.834 -2.450 -0.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 22.623 -3.729 1.013 1.00 0.00 H new ATOM 1761 N ARG A 106 20.876 -8.129 -0.061 1.00 0.00 N ATOM 1762 CA ARG A 106 20.696 -8.303 1.370 1.00 0.00 C ATOM 1763 C ARG A 106 21.327 -9.620 1.828 1.00 0.00 C ATOM 1764 O ARG A 106 22.332 -9.617 2.536 1.00 0.00 O ATOM 1765 CB ARG A 106 19.212 -8.299 1.743 1.00 0.00 C ATOM 1766 CG ARG A 106 18.840 -7.022 2.499 1.00 0.00 C ATOM 1767 CD ARG A 106 19.358 -7.066 3.938 1.00 0.00 C ATOM 1768 NE ARG A 106 20.736 -6.528 3.996 1.00 0.00 N ATOM 1769 CZ ARG A 106 21.571 -6.711 5.028 1.00 0.00 C ATOM 1770 NH1 ARG A 106 21.173 -7.418 6.095 1.00 0.00 N ATOM 1771 NH2 ARG A 106 22.803 -6.186 4.994 1.00 0.00 N ATOM 0 H ARG A 106 20.041 -8.303 -0.620 1.00 0.00 H new ATOM 0 HA ARG A 106 21.187 -7.468 1.870 1.00 0.00 H new ATOM 0 HB2 ARG A 106 18.606 -8.381 0.840 1.00 0.00 H new ATOM 0 HB3 ARG A 106 18.986 -9.169 2.359 1.00 0.00 H new ATOM 0 HG2 ARG A 106 19.257 -6.156 1.985 1.00 0.00 H new ATOM 0 HG3 ARG A 106 17.757 -6.899 2.502 1.00 0.00 H new ATOM 0 HD2 ARG A 106 18.704 -6.484 4.587 1.00 0.00 H new ATOM 0 HD3 ARG A 106 19.343 -8.091 4.308 1.00 0.00 H new ATOM 0 HE ARG A 106 21.071 -5.984 3.201 1.00 0.00 H new ATOM 0 HH11 ARG A 106 20.235 -7.817 6.121 1.00 0.00 H new ATOM 0 HH12 ARG A 106 21.809 -7.557 6.880 1.00 0.00 H new ATOM 0 HH21 ARG A 106 23.105 -5.647 4.183 1.00 0.00 H new ATOM 0 HH22 ARG A 106 23.439 -6.325 5.780 1.00 0.00 H new ATOM 1785 N LYS A 107 20.709 -10.713 1.405 1.00 0.00 N ATOM 1786 CA LYS A 107 21.198 -12.034 1.763 1.00 0.00 C ATOM 1787 C LYS A 107 22.516 -12.301 1.033 1.00 0.00 C ATOM 1788 O LYS A 107 22.619 -13.251 0.259 1.00 0.00 O ATOM 1789 CB LYS A 107 20.124 -13.092 1.500 1.00 0.00 C ATOM 1790 CG LYS A 107 20.007 -14.060 2.679 1.00 0.00 C ATOM 1791 CD LYS A 107 20.275 -15.499 2.235 1.00 0.00 C ATOM 1792 CE LYS A 107 20.258 -16.454 3.431 1.00 0.00 C ATOM 1793 NZ LYS A 107 21.172 -17.594 3.197 1.00 0.00 N ATOM 0 H LYS A 107 19.875 -10.711 0.818 1.00 0.00 H new ATOM 0 HA LYS A 107 21.409 -12.085 2.831 1.00 0.00 H new ATOM 0 HB2 LYS A 107 19.164 -12.606 1.328 1.00 0.00 H new ATOM 0 HB3 LYS A 107 20.368 -13.646 0.593 1.00 0.00 H new ATOM 0 HG2 LYS A 107 20.716 -13.778 3.458 1.00 0.00 H new ATOM 0 HG3 LYS A 107 19.010 -13.990 3.115 1.00 0.00 H new ATOM 0 HD2 LYS A 107 19.522 -15.806 1.509 1.00 0.00 H new ATOM 0 HD3 LYS A 107 21.241 -15.555 1.734 1.00 0.00 H new ATOM 0 HE2 LYS A 107 20.556 -15.921 4.334 1.00 0.00 H new ATOM 0 HE3 LYS A 107 19.245 -16.821 3.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 21.148 -18.232 4.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 20.870 -18.112 2.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 22.141 -17.240 3.061 1.00 0.00 H new ATOM 1807 N VAL A 108 23.490 -11.445 1.307 1.00 0.00 N ATOM 1808 CA VAL A 108 24.797 -11.577 0.686 1.00 0.00 C ATOM 1809 C VAL A 108 25.600 -12.652 1.420 1.00 0.00 C ATOM 1810 O VAL A 108 25.894 -13.705 0.857 1.00 0.00 O ATOM 1811 CB VAL A 108 25.502 -10.219 0.658 1.00 0.00 C ATOM 1812 CG1 VAL A 108 27.016 -10.384 0.803 1.00 0.00 C ATOM 1813 CG2 VAL A 108 25.155 -9.447 -0.617 1.00 0.00 C ATOM 0 H VAL A 108 23.400 -10.658 1.950 1.00 0.00 H new ATOM 0 HA VAL A 108 24.696 -11.898 -0.351 1.00 0.00 H new ATOM 0 HB VAL A 108 25.145 -9.639 1.509 1.00 0.00 H new ATOM 0 HG11 VAL A 108 27.493 -9.404 0.780 1.00 0.00 H new ATOM 0 HG12 VAL A 108 27.239 -10.874 1.751 1.00 0.00 H new ATOM 0 HG13 VAL A 108 27.396 -10.992 -0.018 1.00 0.00 H new ATOM 0 HG21 VAL A 108 25.669 -8.486 -0.612 1.00 0.00 H new ATOM 0 HG22 VAL A 108 25.470 -10.022 -1.488 1.00 0.00 H new ATOM 0 HG23 VAL A 108 24.078 -9.282 -0.661 1.00 0.00 H new ATOM 1823 N ASP A 109 25.931 -12.350 2.667 1.00 0.00 N ATOM 1824 CA ASP A 109 26.694 -13.278 3.484 1.00 0.00 C ATOM 1825 C ASP A 109 27.749 -13.967 2.616 1.00 0.00 C ATOM 1826 O ASP A 109 27.645 -15.161 2.339 1.00 0.00 O ATOM 1827 CB ASP A 109 25.791 -14.359 4.079 1.00 0.00 C ATOM 1828 CG ASP A 109 26.526 -15.575 4.648 1.00 0.00 C ATOM 1829 OD1 ASP A 109 27.578 -15.355 5.285 1.00 0.00 O ATOM 1830 OD2 ASP A 109 26.018 -16.697 4.433 1.00 0.00 O ATOM 0 H ASP A 109 25.685 -11.476 3.131 1.00 0.00 H new ATOM 0 HA ASP A 109 27.159 -12.712 4.292 1.00 0.00 H new ATOM 0 HB2 ASP A 109 25.190 -13.913 4.871 1.00 0.00 H new ATOM 0 HB3 ASP A 109 25.100 -14.699 3.308 1.00 0.00 H new ATOM 1835 N THR A 110 28.739 -13.186 2.212 1.00 0.00 N ATOM 1836 CA THR A 110 29.812 -13.706 1.381 1.00 0.00 C ATOM 1837 C THR A 110 29.257 -14.694 0.352 1.00 0.00 C ATOM 1838 O THR A 110 29.595 -14.621 -0.829 1.00 0.00 O ATOM 1839 CB THR A 110 30.869 -14.318 2.302 1.00 0.00 C ATOM 1840 OG1 THR A 110 31.878 -14.785 1.410 1.00 0.00 O ATOM 1841 CG2 THR A 110 30.374 -15.585 3.001 1.00 0.00 C ATOM 0 H THR A 110 28.821 -12.196 2.445 1.00 0.00 H new ATOM 0 HA THR A 110 30.285 -12.913 0.802 1.00 0.00 H new ATOM 0 HB THR A 110 31.167 -13.584 3.051 1.00 0.00 H new ATOM 0 HG1 THR A 110 32.604 -15.196 1.924 1.00 0.00 H new ATOM 0 HG21 THR A 110 31.163 -15.979 3.642 1.00 0.00 H new ATOM 0 HG22 THR A 110 29.499 -15.348 3.606 1.00 0.00 H new ATOM 0 HG23 THR A 110 30.107 -16.332 2.254 1.00 0.00 H new TER 1849 THR A 110