USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 901 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 42 ASN : amide:sc= -1.84 K(o=-6.6,f=-15!) USER MOD Set 1.2: A 74 GLN : amide:sc= -1.99 K(o=-6.6,f=-7.9!) USER MOD Set 1.3: A 102 TYR OH : rot -5:sc= -2.75 USER MOD Set 2.1: A 21 GLN : amide:sc= -6.53! C(o=-5.4!,f=-13!) USER MOD Set 2.2: A 52 SER OG : rot -80:sc= 1.14 USER MOD Set 3.1: A 47 SER OG : rot 69:sc= 0.868 USER MOD Set 3.2: A 77 GLN : amide:sc= 0.143 K(o=1,f=-2.8!) USER MOD Single : A 22 CYS SG : rot -120:sc= -0.74 USER MOD Single : A 37 GLN :FLIP amide:sc= -0.794 F(o=-1.6,f=-0.79) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0405) USER MOD Single : A 51 ASN : amide:sc= 0.251 K(o=0.25,f=-0.6) USER MOD Single : A 54 TYR OH : rot -163:sc= -1.82 USER MOD Single : A 58 SER OG : rot -151:sc= 0.294 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= 0.113 K(o=0.11,f=-2.9!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl -140:sc= -0.336 (180deg=-3.04!) USER MOD Single : A 80 GLN : amide:sc= -0.0101 X(o=-0.01,f=-0.15) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 30:sc= -1.23 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 170:sc= -5! USER MOD Single : A 95 MET CE :methyl 168:sc= -4.96! (180deg=-5.61!) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 98 THR OG1 : rot 180:sc= -0.322 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 MET CE :methyl 169:sc= -1.51 (180deg=-1.82) USER MOD Single : A 111 GLN : amide:sc=-0.000376 K(o=-0.00038,f=-1.4!) USER MOD Single : A 113 THR OG1 : rot 30:sc= -0.822 USER MOD Single : A 115 MET CE :methyl -143:sc= -0.357 (180deg=-2.7!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 81 N GLU A 9 9.999 -9.781 9.502 1.00 0.00 N ATOM 82 CA GLU A 9 10.996 -9.561 8.468 1.00 0.00 C ATOM 83 C GLU A 9 10.361 -8.875 7.256 1.00 0.00 C ATOM 84 O GLU A 9 10.830 -7.826 6.816 1.00 0.00 O ATOM 85 CB GLU A 9 11.667 -10.875 8.065 1.00 0.00 C ATOM 86 CG GLU A 9 13.084 -10.965 8.636 1.00 0.00 C ATOM 87 CD GLU A 9 14.131 -10.878 7.523 1.00 0.00 C ATOM 88 OE1 GLU A 9 14.176 -9.814 6.869 1.00 0.00 O ATOM 89 OE2 GLU A 9 14.862 -11.877 7.353 1.00 0.00 O ATOM 0 HA GLU A 9 11.769 -8.905 8.869 1.00 0.00 H new ATOM 0 HB2 GLU A 9 11.073 -11.716 8.423 1.00 0.00 H new ATOM 0 HB3 GLU A 9 11.704 -10.950 6.978 1.00 0.00 H new ATOM 0 HG2 GLU A 9 13.243 -10.160 9.353 1.00 0.00 H new ATOM 0 HG3 GLU A 9 13.202 -11.903 9.179 1.00 0.00 H new ATOM 96 N LEU A 10 9.306 -9.496 6.751 1.00 0.00 N ATOM 97 CA LEU A 10 8.602 -8.959 5.598 1.00 0.00 C ATOM 98 C LEU A 10 8.318 -7.473 5.827 1.00 0.00 C ATOM 99 O LEU A 10 8.789 -6.624 5.073 1.00 0.00 O ATOM 100 CB LEU A 10 7.350 -9.786 5.302 1.00 0.00 C ATOM 101 CG LEU A 10 7.275 -10.414 3.908 1.00 0.00 C ATOM 102 CD1 LEU A 10 6.258 -11.556 3.875 1.00 0.00 C ATOM 103 CD2 LEU A 10 6.981 -9.354 2.844 1.00 0.00 C ATOM 0 H LEU A 10 8.921 -10.366 7.119 1.00 0.00 H new ATOM 0 HA LEU A 10 9.222 -9.032 4.705 1.00 0.00 H new ATOM 0 HB2 LEU A 10 7.282 -10.583 6.042 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.477 -9.148 5.439 1.00 0.00 H new ATOM 0 HG LEU A 10 8.249 -10.844 3.674 1.00 0.00 H new ATOM 0 HD11 LEU A 10 6.225 -11.985 2.873 1.00 0.00 H new ATOM 0 HD12 LEU A 10 6.551 -12.325 4.589 1.00 0.00 H new ATOM 0 HD13 LEU A 10 5.272 -11.173 4.139 1.00 0.00 H new ATOM 0 HD21 LEU A 10 6.933 -9.827 1.863 1.00 0.00 H new ATOM 0 HD22 LEU A 10 6.027 -8.874 3.063 1.00 0.00 H new ATOM 0 HD23 LEU A 10 7.773 -8.605 2.848 1.00 0.00 H new ATOM 115 N GLU A 11 7.548 -7.205 6.871 1.00 0.00 N ATOM 116 CA GLU A 11 7.195 -5.836 7.209 1.00 0.00 C ATOM 117 C GLU A 11 8.393 -4.910 6.992 1.00 0.00 C ATOM 118 O GLU A 11 8.334 -3.995 6.172 1.00 0.00 O ATOM 119 CB GLU A 11 6.682 -5.741 8.647 1.00 0.00 C ATOM 120 CG GLU A 11 5.529 -4.741 8.753 1.00 0.00 C ATOM 121 CD GLU A 11 5.655 -3.891 10.019 1.00 0.00 C ATOM 122 OE1 GLU A 11 5.121 -4.337 11.058 1.00 0.00 O ATOM 123 OE2 GLU A 11 6.283 -2.815 9.920 1.00 0.00 O ATOM 0 H GLU A 11 7.158 -7.912 7.494 1.00 0.00 H new ATOM 0 HA GLU A 11 6.389 -5.516 6.549 1.00 0.00 H new ATOM 0 HB2 GLU A 11 6.349 -6.723 8.984 1.00 0.00 H new ATOM 0 HB3 GLU A 11 7.494 -5.436 9.307 1.00 0.00 H new ATOM 0 HG2 GLU A 11 5.522 -4.094 7.876 1.00 0.00 H new ATOM 0 HG3 GLU A 11 4.579 -5.275 8.763 1.00 0.00 H new ATOM 130 N GLU A 12 9.453 -5.180 7.740 1.00 0.00 N ATOM 131 CA GLU A 12 10.663 -4.382 7.640 1.00 0.00 C ATOM 132 C GLU A 12 10.966 -4.060 6.175 1.00 0.00 C ATOM 133 O GLU A 12 11.110 -2.894 5.809 1.00 0.00 O ATOM 134 CB GLU A 12 11.845 -5.094 8.301 1.00 0.00 C ATOM 135 CG GLU A 12 11.701 -5.097 9.824 1.00 0.00 C ATOM 136 CD GLU A 12 11.666 -3.670 10.375 1.00 0.00 C ATOM 137 OE1 GLU A 12 12.696 -2.978 10.223 1.00 0.00 O ATOM 138 OE2 GLU A 12 10.610 -3.303 10.934 1.00 0.00 O ATOM 0 H GLU A 12 9.499 -5.941 8.418 1.00 0.00 H new ATOM 0 HA GLU A 12 10.502 -3.444 8.172 1.00 0.00 H new ATOM 0 HB2 GLU A 12 11.907 -6.119 7.936 1.00 0.00 H new ATOM 0 HB3 GLU A 12 12.775 -4.599 8.021 1.00 0.00 H new ATOM 0 HG2 GLU A 12 10.788 -5.622 10.105 1.00 0.00 H new ATOM 0 HG3 GLU A 12 12.532 -5.643 10.270 1.00 0.00 H new ATOM 145 N ARG A 13 11.054 -5.113 5.377 1.00 0.00 N ATOM 146 CA ARG A 13 11.338 -4.957 3.960 1.00 0.00 C ATOM 147 C ARG A 13 10.230 -4.148 3.283 1.00 0.00 C ATOM 148 O ARG A 13 10.501 -3.139 2.635 1.00 0.00 O ATOM 149 CB ARG A 13 11.462 -6.317 3.270 1.00 0.00 C ATOM 150 CG ARG A 13 12.917 -6.615 2.903 1.00 0.00 C ATOM 151 CD ARG A 13 13.357 -5.792 1.691 1.00 0.00 C ATOM 152 NE ARG A 13 14.825 -5.873 1.530 1.00 0.00 N ATOM 153 CZ ARG A 13 15.699 -5.111 2.202 1.00 0.00 C ATOM 154 NH1 ARG A 13 15.257 -4.206 3.085 1.00 0.00 N ATOM 155 NH2 ARG A 13 17.014 -5.254 1.991 1.00 0.00 N ATOM 0 H ARG A 13 10.934 -6.078 5.684 1.00 0.00 H new ATOM 0 HA ARG A 13 12.287 -4.428 3.868 1.00 0.00 H new ATOM 0 HB2 ARG A 13 11.082 -7.099 3.928 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.846 -6.330 2.371 1.00 0.00 H new ATOM 0 HG2 ARG A 13 13.563 -6.392 3.752 1.00 0.00 H new ATOM 0 HG3 ARG A 13 13.031 -7.677 2.686 1.00 0.00 H new ATOM 0 HD2 ARG A 13 12.863 -6.161 0.792 1.00 0.00 H new ATOM 0 HD3 ARG A 13 13.054 -4.753 1.817 1.00 0.00 H new ATOM 0 HE ARG A 13 15.196 -6.552 0.865 1.00 0.00 H new ATOM 0 HH11 ARG A 13 14.256 -4.097 3.246 1.00 0.00 H new ATOM 0 HH12 ARG A 13 15.922 -3.626 3.597 1.00 0.00 H new ATOM 0 HH21 ARG A 13 17.351 -5.943 1.319 1.00 0.00 H new ATOM 0 HH22 ARG A 13 17.679 -4.674 2.503 1.00 0.00 H new ATOM 169 N LEU A 14 9.005 -4.622 3.457 1.00 0.00 N ATOM 170 CA LEU A 14 7.854 -3.955 2.870 1.00 0.00 C ATOM 171 C LEU A 14 8.018 -2.441 3.018 1.00 0.00 C ATOM 172 O LEU A 14 7.948 -1.707 2.034 1.00 0.00 O ATOM 173 CB LEU A 14 6.557 -4.496 3.474 1.00 0.00 C ATOM 174 CG LEU A 14 6.023 -5.794 2.866 1.00 0.00 C ATOM 175 CD1 LEU A 14 4.909 -6.388 3.730 1.00 0.00 C ATOM 176 CD2 LEU A 14 5.574 -5.578 1.419 1.00 0.00 C ATOM 0 H LEU A 14 8.784 -5.459 3.996 1.00 0.00 H new ATOM 0 HA LEU A 14 7.793 -4.166 1.802 1.00 0.00 H new ATOM 0 HB2 LEU A 14 6.716 -4.656 4.540 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.788 -3.730 3.378 1.00 0.00 H new ATOM 0 HG LEU A 14 6.835 -6.521 2.846 1.00 0.00 H new ATOM 0 HD11 LEU A 14 4.548 -7.310 3.274 1.00 0.00 H new ATOM 0 HD12 LEU A 14 5.296 -6.603 4.726 1.00 0.00 H new ATOM 0 HD13 LEU A 14 4.088 -5.675 3.806 1.00 0.00 H new ATOM 0 HD21 LEU A 14 5.199 -6.516 1.011 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.783 -4.828 1.391 1.00 0.00 H new ATOM 0 HD23 LEU A 14 6.420 -5.235 0.823 1.00 0.00 H new ATOM 188 N VAL A 15 8.232 -2.020 4.256 1.00 0.00 N ATOM 189 CA VAL A 15 8.406 -0.606 4.545 1.00 0.00 C ATOM 190 C VAL A 15 9.632 -0.083 3.794 1.00 0.00 C ATOM 191 O VAL A 15 9.555 0.934 3.106 1.00 0.00 O ATOM 192 CB VAL A 15 8.494 -0.389 6.057 1.00 0.00 C ATOM 193 CG1 VAL A 15 8.598 1.101 6.391 1.00 0.00 C ATOM 194 CG2 VAL A 15 7.304 -1.030 6.773 1.00 0.00 C ATOM 0 H VAL A 15 8.289 -2.632 5.070 1.00 0.00 H new ATOM 0 HA VAL A 15 7.544 -0.036 4.197 1.00 0.00 H new ATOM 0 HB VAL A 15 9.401 -0.877 6.414 1.00 0.00 H new ATOM 0 HG11 VAL A 15 8.659 1.228 7.472 1.00 0.00 H new ATOM 0 HG12 VAL A 15 9.492 1.517 5.925 1.00 0.00 H new ATOM 0 HG13 VAL A 15 7.717 1.621 6.014 1.00 0.00 H new ATOM 0 HG21 VAL A 15 7.391 -0.861 7.846 1.00 0.00 H new ATOM 0 HG22 VAL A 15 6.378 -0.585 6.410 1.00 0.00 H new ATOM 0 HG23 VAL A 15 7.294 -2.102 6.574 1.00 0.00 H new ATOM 204 N GLU A 16 10.733 -0.802 3.950 1.00 0.00 N ATOM 205 CA GLU A 16 11.974 -0.423 3.295 1.00 0.00 C ATOM 206 C GLU A 16 11.708 -0.037 1.839 1.00 0.00 C ATOM 207 O GLU A 16 12.454 0.747 1.255 1.00 0.00 O ATOM 208 CB GLU A 16 13.007 -1.549 3.384 1.00 0.00 C ATOM 209 CG GLU A 16 13.530 -1.701 4.814 1.00 0.00 C ATOM 210 CD GLU A 16 14.976 -1.212 4.924 1.00 0.00 C ATOM 211 OE1 GLU A 16 15.247 -0.117 4.385 1.00 0.00 O ATOM 212 OE2 GLU A 16 15.777 -1.944 5.544 1.00 0.00 O ATOM 0 H GLU A 16 10.792 -1.645 4.521 1.00 0.00 H new ATOM 0 HA GLU A 16 12.385 0.444 3.812 1.00 0.00 H new ATOM 0 HB2 GLU A 16 12.558 -2.486 3.056 1.00 0.00 H new ATOM 0 HB3 GLU A 16 13.837 -1.340 2.710 1.00 0.00 H new ATOM 0 HG2 GLU A 16 12.898 -1.135 5.498 1.00 0.00 H new ATOM 0 HG3 GLU A 16 13.472 -2.746 5.117 1.00 0.00 H new ATOM 219 N TRP A 17 10.643 -0.606 1.294 1.00 0.00 N ATOM 220 CA TRP A 17 10.269 -0.330 -0.083 1.00 0.00 C ATOM 221 C TRP A 17 9.498 0.991 -0.109 1.00 0.00 C ATOM 222 O TRP A 17 9.909 1.941 -0.774 1.00 0.00 O ATOM 223 CB TRP A 17 9.478 -1.496 -0.680 1.00 0.00 C ATOM 224 CG TRP A 17 8.975 -1.243 -2.103 1.00 0.00 C ATOM 225 CD1 TRP A 17 9.540 -0.489 -3.056 1.00 0.00 C ATOM 226 CD2 TRP A 17 7.774 -1.778 -2.698 1.00 0.00 C ATOM 227 NE1 TRP A 17 8.794 -0.499 -4.217 1.00 0.00 N ATOM 228 CE2 TRP A 17 7.686 -1.308 -3.992 1.00 0.00 C ATOM 229 CE3 TRP A 17 6.795 -2.631 -2.160 1.00 0.00 C ATOM 230 CZ2 TRP A 17 6.636 -1.636 -4.858 1.00 0.00 C ATOM 231 CZ3 TRP A 17 5.751 -2.950 -3.038 1.00 0.00 C ATOM 232 CH2 TRP A 17 5.648 -2.485 -4.344 1.00 0.00 C ATOM 0 H TRP A 17 10.027 -1.257 1.781 1.00 0.00 H new ATOM 0 HA TRP A 17 11.155 -0.228 -0.710 1.00 0.00 H new ATOM 0 HB2 TRP A 17 10.107 -2.386 -0.681 1.00 0.00 H new ATOM 0 HB3 TRP A 17 8.625 -1.710 -0.037 1.00 0.00 H new ATOM 0 HD1 TRP A 17 10.463 0.058 -2.931 1.00 0.00 H new ATOM 0 HE1 TRP A 17 9.015 -0.004 -5.081 1.00 0.00 H new ATOM 0 HE3 TRP A 17 6.844 -3.010 -1.150 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 6.590 -1.255 -5.868 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 4.971 -3.603 -2.675 1.00 0.00 H new ATOM 0 HH2 TRP A 17 4.810 -2.777 -4.959 1.00 0.00 H new ATOM 243 N ILE A 18 8.394 1.009 0.623 1.00 0.00 N ATOM 244 CA ILE A 18 7.562 2.198 0.692 1.00 0.00 C ATOM 245 C ILE A 18 8.442 3.415 0.984 1.00 0.00 C ATOM 246 O ILE A 18 8.069 4.545 0.672 1.00 0.00 O ATOM 247 CB ILE A 18 6.430 2.002 1.703 1.00 0.00 C ATOM 248 CG1 ILE A 18 5.476 0.896 1.249 1.00 0.00 C ATOM 249 CG2 ILE A 18 5.697 3.319 1.968 1.00 0.00 C ATOM 250 CD1 ILE A 18 5.014 0.049 2.436 1.00 0.00 C ATOM 0 H ILE A 18 8.056 0.219 1.173 1.00 0.00 H new ATOM 0 HA ILE A 18 7.075 2.378 -0.267 1.00 0.00 H new ATOM 0 HB ILE A 18 6.868 1.682 2.649 1.00 0.00 H new ATOM 0 HG12 ILE A 18 4.611 1.338 0.754 1.00 0.00 H new ATOM 0 HG13 ILE A 18 5.973 0.261 0.516 1.00 0.00 H new ATOM 0 HG21 ILE A 18 4.898 3.152 2.690 1.00 0.00 H new ATOM 0 HG22 ILE A 18 6.398 4.052 2.367 1.00 0.00 H new ATOM 0 HG23 ILE A 18 5.272 3.693 1.036 1.00 0.00 H new ATOM 0 HD11 ILE A 18 4.337 -0.730 2.086 1.00 0.00 H new ATOM 0 HD12 ILE A 18 5.879 -0.411 2.914 1.00 0.00 H new ATOM 0 HD13 ILE A 18 4.496 0.683 3.156 1.00 0.00 H new ATOM 262 N VAL A 19 9.595 3.143 1.578 1.00 0.00 N ATOM 263 CA VAL A 19 10.532 4.202 1.914 1.00 0.00 C ATOM 264 C VAL A 19 11.165 4.744 0.631 1.00 0.00 C ATOM 265 O VAL A 19 11.137 5.948 0.382 1.00 0.00 O ATOM 266 CB VAL A 19 11.564 3.687 2.919 1.00 0.00 C ATOM 267 CG1 VAL A 19 12.749 4.649 3.030 1.00 0.00 C ATOM 268 CG2 VAL A 19 10.924 3.446 4.288 1.00 0.00 C ATOM 0 H VAL A 19 9.902 2.205 1.835 1.00 0.00 H new ATOM 0 HA VAL A 19 10.014 5.032 2.396 1.00 0.00 H new ATOM 0 HB VAL A 19 11.941 2.732 2.552 1.00 0.00 H new ATOM 0 HG11 VAL A 19 13.468 4.259 3.751 1.00 0.00 H new ATOM 0 HG12 VAL A 19 13.229 4.749 2.057 1.00 0.00 H new ATOM 0 HG13 VAL A 19 12.395 5.625 3.362 1.00 0.00 H new ATOM 0 HG21 VAL A 19 11.679 3.080 4.983 1.00 0.00 H new ATOM 0 HG22 VAL A 19 10.506 4.380 4.664 1.00 0.00 H new ATOM 0 HG23 VAL A 19 10.130 2.706 4.193 1.00 0.00 H new ATOM 278 N VAL A 20 11.720 3.829 -0.149 1.00 0.00 N ATOM 279 CA VAL A 20 12.359 4.200 -1.400 1.00 0.00 C ATOM 280 C VAL A 20 11.302 4.733 -2.369 1.00 0.00 C ATOM 281 O VAL A 20 11.552 5.690 -3.101 1.00 0.00 O ATOM 282 CB VAL A 20 13.139 3.010 -1.963 1.00 0.00 C ATOM 283 CG1 VAL A 20 13.759 2.179 -0.837 1.00 0.00 C ATOM 284 CG2 VAL A 20 12.249 2.144 -2.857 1.00 0.00 C ATOM 0 H VAL A 20 11.741 2.831 0.061 1.00 0.00 H new ATOM 0 HA VAL A 20 13.083 4.998 -1.236 1.00 0.00 H new ATOM 0 HB VAL A 20 13.950 3.401 -2.577 1.00 0.00 H new ATOM 0 HG11 VAL A 20 14.308 1.340 -1.264 1.00 0.00 H new ATOM 0 HG12 VAL A 20 14.441 2.802 -0.258 1.00 0.00 H new ATOM 0 HG13 VAL A 20 12.970 1.803 -0.186 1.00 0.00 H new ATOM 0 HG21 VAL A 20 12.828 1.306 -3.244 1.00 0.00 H new ATOM 0 HG22 VAL A 20 11.407 1.767 -2.276 1.00 0.00 H new ATOM 0 HG23 VAL A 20 11.877 2.742 -3.689 1.00 0.00 H new ATOM 294 N GLN A 21 10.143 4.092 -2.342 1.00 0.00 N ATOM 295 CA GLN A 21 9.047 4.490 -3.209 1.00 0.00 C ATOM 296 C GLN A 21 8.574 5.900 -2.853 1.00 0.00 C ATOM 297 O GLN A 21 8.800 6.844 -3.608 1.00 0.00 O ATOM 298 CB GLN A 21 7.894 3.488 -3.130 1.00 0.00 C ATOM 299 CG GLN A 21 8.266 2.168 -3.807 1.00 0.00 C ATOM 300 CD GLN A 21 7.689 2.096 -5.222 1.00 0.00 C ATOM 301 OE1 GLN A 21 6.742 1.379 -5.498 1.00 0.00 O ATOM 302 NE2 GLN A 21 8.312 2.877 -6.101 1.00 0.00 N ATOM 0 H GLN A 21 9.939 3.299 -1.733 1.00 0.00 H new ATOM 0 HA GLN A 21 9.408 4.498 -4.238 1.00 0.00 H new ATOM 0 HB2 GLN A 21 7.637 3.306 -2.087 1.00 0.00 H new ATOM 0 HB3 GLN A 21 7.009 3.909 -3.607 1.00 0.00 H new ATOM 0 HG2 GLN A 21 9.351 2.069 -3.847 1.00 0.00 H new ATOM 0 HG3 GLN A 21 7.891 1.333 -3.215 1.00 0.00 H new ATOM 0 HE21 GLN A 21 9.099 3.453 -5.803 1.00 0.00 H new ATOM 0 HE22 GLN A 21 8.002 2.900 -7.073 1.00 0.00 H new ATOM 311 N CYS A 22 7.925 5.999 -1.701 1.00 0.00 N ATOM 312 CA CYS A 22 7.418 7.279 -1.236 1.00 0.00 C ATOM 313 C CYS A 22 8.604 8.229 -1.056 1.00 0.00 C ATOM 314 O CYS A 22 8.609 9.331 -1.601 1.00 0.00 O ATOM 315 CB CYS A 22 6.605 7.130 0.052 1.00 0.00 C ATOM 316 SG CYS A 22 4.999 6.333 -0.310 1.00 0.00 S ATOM 0 H CYS A 22 7.739 5.214 -1.077 1.00 0.00 H new ATOM 0 HA CYS A 22 6.732 7.692 -1.976 1.00 0.00 H new ATOM 0 HB2 CYS A 22 7.161 6.534 0.776 1.00 0.00 H new ATOM 0 HB3 CYS A 22 6.441 8.108 0.503 1.00 0.00 H new ATOM 0 HG CYS A 22 4.032 7.130 0.034 1.00 0.00 H new ATOM 322 N GLY A 23 9.581 7.767 -0.289 1.00 0.00 N ATOM 323 CA GLY A 23 10.769 8.561 -0.030 1.00 0.00 C ATOM 324 C GLY A 23 10.827 9.000 1.434 1.00 0.00 C ATOM 325 O GLY A 23 9.911 8.723 2.206 1.00 0.00 O ATOM 0 H GLY A 23 9.573 6.852 0.162 1.00 0.00 H new ATOM 0 HA2 GLY A 23 11.659 7.981 -0.275 1.00 0.00 H new ATOM 0 HA3 GLY A 23 10.772 9.438 -0.677 1.00 0.00 H new ATOM 329 N PRO A 24 11.943 9.696 1.782 1.00 0.00 N ATOM 330 CA PRO A 24 12.133 10.175 3.140 1.00 0.00 C ATOM 331 C PRO A 24 11.246 11.390 3.422 1.00 0.00 C ATOM 332 O PRO A 24 11.739 12.444 3.822 1.00 0.00 O ATOM 333 CB PRO A 24 13.617 10.487 3.243 1.00 0.00 C ATOM 334 CG PRO A 24 14.117 10.613 1.813 1.00 0.00 C ATOM 335 CD PRO A 24 13.049 10.042 0.894 1.00 0.00 C ATOM 0 HA PRO A 24 11.841 9.440 3.890 1.00 0.00 H new ATOM 0 HB2 PRO A 24 13.784 11.410 3.798 1.00 0.00 H new ATOM 0 HB3 PRO A 24 14.147 9.696 3.774 1.00 0.00 H new ATOM 0 HG2 PRO A 24 14.313 11.657 1.568 1.00 0.00 H new ATOM 0 HG3 PRO A 24 15.056 10.074 1.688 1.00 0.00 H new ATOM 0 HD2 PRO A 24 12.741 10.770 0.144 1.00 0.00 H new ATOM 0 HD3 PRO A 24 13.415 9.167 0.357 1.00 0.00 H new ATOM 343 N ASP A 25 9.954 11.203 3.201 1.00 0.00 N ATOM 344 CA ASP A 25 8.994 12.270 3.426 1.00 0.00 C ATOM 345 C ASP A 25 7.854 11.748 4.303 1.00 0.00 C ATOM 346 O ASP A 25 7.443 12.413 5.254 1.00 0.00 O ATOM 347 CB ASP A 25 8.390 12.755 2.106 1.00 0.00 C ATOM 348 CG ASP A 25 8.933 14.093 1.600 1.00 0.00 C ATOM 349 OD1 ASP A 25 8.408 15.129 2.061 1.00 0.00 O ATOM 350 OD2 ASP A 25 9.862 14.049 0.764 1.00 0.00 O ATOM 0 H ASP A 25 9.549 10.328 2.868 1.00 0.00 H new ATOM 0 HA ASP A 25 9.515 13.096 3.910 1.00 0.00 H new ATOM 0 HB2 ASP A 25 8.566 11.997 1.343 1.00 0.00 H new ATOM 0 HB3 ASP A 25 7.310 12.841 2.228 1.00 0.00 H new ATOM 355 N VAL A 26 7.375 10.564 3.953 1.00 0.00 N ATOM 356 CA VAL A 26 6.291 9.945 4.697 1.00 0.00 C ATOM 357 C VAL A 26 6.810 9.487 6.061 1.00 0.00 C ATOM 358 O VAL A 26 6.061 9.454 7.036 1.00 0.00 O ATOM 359 CB VAL A 26 5.676 8.808 3.879 1.00 0.00 C ATOM 360 CG1 VAL A 26 5.058 9.337 2.583 1.00 0.00 C ATOM 361 CG2 VAL A 26 6.712 7.720 3.588 1.00 0.00 C ATOM 0 H VAL A 26 7.718 10.016 3.164 1.00 0.00 H new ATOM 0 HA VAL A 26 5.493 10.665 4.878 1.00 0.00 H new ATOM 0 HB VAL A 26 4.878 8.361 4.473 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.628 8.508 2.020 1.00 0.00 H new ATOM 0 HG12 VAL A 26 4.276 10.059 2.821 1.00 0.00 H new ATOM 0 HG13 VAL A 26 5.829 9.821 1.983 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.249 6.923 3.005 1.00 0.00 H new ATOM 0 HG22 VAL A 26 7.540 8.148 3.024 1.00 0.00 H new ATOM 0 HG23 VAL A 26 7.085 7.312 4.527 1.00 0.00 H new ATOM 371 N GLY A 27 8.090 9.145 6.087 1.00 0.00 N ATOM 372 CA GLY A 27 8.718 8.690 7.316 1.00 0.00 C ATOM 373 C GLY A 27 8.648 7.166 7.436 1.00 0.00 C ATOM 374 O GLY A 27 8.755 6.455 6.438 1.00 0.00 O ATOM 0 H GLY A 27 8.709 9.174 5.277 1.00 0.00 H new ATOM 0 HA2 GLY A 27 9.759 9.013 7.338 1.00 0.00 H new ATOM 0 HA3 GLY A 27 8.224 9.149 8.172 1.00 0.00 H new ATOM 378 N ARG A 28 8.468 6.709 8.667 1.00 0.00 N ATOM 379 CA ARG A 28 8.382 5.283 8.930 1.00 0.00 C ATOM 380 C ARG A 28 7.331 5.005 10.008 1.00 0.00 C ATOM 381 O ARG A 28 6.826 5.931 10.640 1.00 0.00 O ATOM 382 CB ARG A 28 9.731 4.725 9.387 1.00 0.00 C ATOM 383 CG ARG A 28 10.248 3.671 8.406 1.00 0.00 C ATOM 384 CD ARG A 28 11.009 2.565 9.140 1.00 0.00 C ATOM 385 NE ARG A 28 12.286 2.283 8.447 1.00 0.00 N ATOM 386 CZ ARG A 28 13.278 1.549 8.969 1.00 0.00 C ATOM 387 NH1 ARG A 28 13.147 1.019 10.193 1.00 0.00 N ATOM 388 NH2 ARG A 28 14.402 1.346 8.268 1.00 0.00 N ATOM 0 H ARG A 28 8.379 7.301 9.493 1.00 0.00 H new ATOM 0 HA ARG A 28 8.094 4.791 8.001 1.00 0.00 H new ATOM 0 HB2 ARG A 28 10.455 5.536 9.470 1.00 0.00 H new ATOM 0 HB3 ARG A 28 9.630 4.285 10.379 1.00 0.00 H new ATOM 0 HG2 ARG A 28 9.411 3.239 7.857 1.00 0.00 H new ATOM 0 HG3 ARG A 28 10.902 4.142 7.672 1.00 0.00 H new ATOM 0 HD2 ARG A 28 11.203 2.867 10.169 1.00 0.00 H new ATOM 0 HD3 ARG A 28 10.402 1.661 9.183 1.00 0.00 H new ATOM 0 HE ARG A 28 12.419 2.672 7.513 1.00 0.00 H new ATOM 0 HH11 ARG A 28 12.292 1.174 10.727 1.00 0.00 H new ATOM 0 HH12 ARG A 28 13.902 0.460 10.590 1.00 0.00 H new ATOM 0 HH21 ARG A 28 14.502 1.750 7.337 1.00 0.00 H new ATOM 0 HH22 ARG A 28 15.157 0.787 8.666 1.00 0.00 H new ATOM 402 N PRO A 29 7.027 3.692 10.189 1.00 0.00 N ATOM 403 CA PRO A 29 6.046 3.280 11.179 1.00 0.00 C ATOM 404 C PRO A 29 6.621 3.377 12.593 1.00 0.00 C ATOM 405 O PRO A 29 7.838 3.420 12.771 1.00 0.00 O ATOM 406 CB PRO A 29 5.665 1.862 10.789 1.00 0.00 C ATOM 407 CG PRO A 29 6.778 1.366 9.880 1.00 0.00 C ATOM 408 CD PRO A 29 7.606 2.568 9.458 1.00 0.00 C ATOM 0 HA PRO A 29 5.167 3.924 11.194 1.00 0.00 H new ATOM 0 HB2 PRO A 29 5.568 1.227 11.670 1.00 0.00 H new ATOM 0 HB3 PRO A 29 4.704 1.843 10.275 1.00 0.00 H new ATOM 0 HG2 PRO A 29 7.400 0.638 10.401 1.00 0.00 H new ATOM 0 HG3 PRO A 29 6.362 0.863 9.007 1.00 0.00 H new ATOM 0 HD2 PRO A 29 8.658 2.432 9.709 1.00 0.00 H new ATOM 0 HD3 PRO A 29 7.553 2.727 8.381 1.00 0.00 H new ATOM 502 N GLY A 35 1.806 0.282 14.522 1.00 0.00 N ATOM 503 CA GLY A 35 2.287 1.424 13.763 1.00 0.00 C ATOM 504 C GLY A 35 2.146 1.181 12.258 1.00 0.00 C ATOM 505 O GLY A 35 1.530 1.978 11.552 1.00 0.00 O ATOM 0 HA2 GLY A 35 1.726 2.315 14.045 1.00 0.00 H new ATOM 0 HA3 GLY A 35 3.332 1.614 14.008 1.00 0.00 H new ATOM 509 N PHE A 36 2.727 0.077 11.813 1.00 0.00 N ATOM 510 CA PHE A 36 2.675 -0.281 10.406 1.00 0.00 C ATOM 511 C PHE A 36 1.234 -0.273 9.892 1.00 0.00 C ATOM 512 O PHE A 36 0.960 0.244 8.810 1.00 0.00 O ATOM 513 CB PHE A 36 3.240 -1.697 10.283 1.00 0.00 C ATOM 514 CG PHE A 36 3.235 -2.247 8.855 1.00 0.00 C ATOM 515 CD1 PHE A 36 3.961 -1.628 7.886 1.00 0.00 C ATOM 516 CD2 PHE A 36 2.505 -3.355 8.556 1.00 0.00 C ATOM 517 CE1 PHE A 36 3.957 -2.139 6.561 1.00 0.00 C ATOM 518 CE2 PHE A 36 2.501 -3.866 7.231 1.00 0.00 C ATOM 519 CZ PHE A 36 3.227 -3.247 6.261 1.00 0.00 C ATOM 0 H PHE A 36 3.236 -0.582 12.402 1.00 0.00 H new ATOM 0 HA PHE A 36 3.247 0.437 9.818 1.00 0.00 H new ATOM 0 HB2 PHE A 36 4.263 -1.703 10.660 1.00 0.00 H new ATOM 0 HB3 PHE A 36 2.661 -2.365 10.921 1.00 0.00 H new ATOM 0 HD1 PHE A 36 4.540 -0.748 8.124 1.00 0.00 H new ATOM 0 HD2 PHE A 36 1.929 -3.846 9.326 1.00 0.00 H new ATOM 0 HE1 PHE A 36 4.534 -1.648 5.791 1.00 0.00 H new ATOM 0 HE2 PHE A 36 1.922 -4.746 6.993 1.00 0.00 H new ATOM 0 HZ PHE A 36 3.224 -3.635 5.253 1.00 0.00 H new ATOM 529 N GLN A 37 0.351 -0.852 10.692 1.00 0.00 N ATOM 530 CA GLN A 37 -1.055 -0.918 10.331 1.00 0.00 C ATOM 531 C GLN A 37 -1.599 0.485 10.053 1.00 0.00 C ATOM 532 O GLN A 37 -2.231 0.716 9.023 1.00 0.00 O ATOM 533 CB GLN A 37 -1.869 -1.614 11.424 1.00 0.00 C ATOM 534 CG GLN A 37 -3.279 -1.946 10.930 1.00 0.00 C ATOM 535 CD GLN A 37 -4.315 -1.014 11.561 1.00 0.00 C ATOM 536 OE1 GLN A 37 -4.896 -0.187 10.697 1.00 0.00 O flip ATOM 537 NE2 GLN A 37 -4.571 -1.045 12.754 1.00 0.00 N flip ATOM 0 H GLN A 37 0.582 -1.280 11.589 1.00 0.00 H new ATOM 0 HA GLN A 37 -1.148 -1.510 9.420 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -1.363 -2.529 11.732 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -1.929 -0.971 12.302 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -3.318 -1.857 9.844 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -3.519 -2.981 11.174 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -4.087 -1.706 13.362 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -5.269 -0.410 13.143 1.00 0.00 H new ATOM 546 N VAL A 38 -1.332 1.385 10.988 1.00 0.00 N ATOM 547 CA VAL A 38 -1.786 2.758 10.856 1.00 0.00 C ATOM 548 C VAL A 38 -1.011 3.441 9.727 1.00 0.00 C ATOM 549 O VAL A 38 -1.566 4.258 8.994 1.00 0.00 O ATOM 550 CB VAL A 38 -1.654 3.484 12.196 1.00 0.00 C ATOM 551 CG1 VAL A 38 -2.153 4.927 12.090 1.00 0.00 C ATOM 552 CG2 VAL A 38 -2.391 2.729 13.304 1.00 0.00 C ATOM 0 H VAL A 38 -0.807 1.190 11.840 1.00 0.00 H new ATOM 0 HA VAL A 38 -2.842 2.787 10.589 1.00 0.00 H new ATOM 0 HB VAL A 38 -0.596 3.514 12.458 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -2.048 5.420 13.056 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -1.565 5.461 11.344 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -3.202 4.928 11.794 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -2.281 3.267 14.246 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -3.448 2.653 13.051 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -1.969 1.729 13.406 1.00 0.00 H new ATOM 562 N TRP A 39 0.260 3.081 9.624 1.00 0.00 N ATOM 563 CA TRP A 39 1.117 3.649 8.597 1.00 0.00 C ATOM 564 C TRP A 39 0.443 3.426 7.242 1.00 0.00 C ATOM 565 O TRP A 39 0.497 4.289 6.368 1.00 0.00 O ATOM 566 CB TRP A 39 2.526 3.056 8.669 1.00 0.00 C ATOM 567 CG TRP A 39 3.600 3.921 8.006 1.00 0.00 C ATOM 568 CD1 TRP A 39 3.837 5.227 8.191 1.00 0.00 C ATOM 569 CD2 TRP A 39 4.579 3.486 7.039 1.00 0.00 C ATOM 570 NE1 TRP A 39 4.893 5.664 7.416 1.00 0.00 N ATOM 571 CE2 TRP A 39 5.358 4.571 6.694 1.00 0.00 C ATOM 572 CE3 TRP A 39 4.798 2.217 6.475 1.00 0.00 C ATOM 573 CZ2 TRP A 39 6.409 4.498 5.772 1.00 0.00 C ATOM 574 CZ3 TRP A 39 5.852 2.160 5.555 1.00 0.00 C ATOM 575 CH2 TRP A 39 6.646 3.243 5.197 1.00 0.00 C ATOM 0 H TRP A 39 0.717 2.403 10.234 1.00 0.00 H new ATOM 0 HA TRP A 39 1.244 4.721 8.750 1.00 0.00 H new ATOM 0 HB2 TRP A 39 2.792 2.903 9.715 1.00 0.00 H new ATOM 0 HB3 TRP A 39 2.521 2.075 8.195 1.00 0.00 H new ATOM 0 HD1 TRP A 39 3.273 5.858 8.862 1.00 0.00 H new ATOM 0 HE1 TRP A 39 5.263 6.614 7.380 1.00 0.00 H new ATOM 0 HE3 TRP A 39 4.201 1.354 6.731 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 7.005 5.362 5.518 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 6.063 1.208 5.091 1.00 0.00 H new ATOM 0 HH2 TRP A 39 7.442 3.117 4.478 1.00 0.00 H new ATOM 586 N LEU A 40 -0.176 2.262 7.109 1.00 0.00 N ATOM 587 CA LEU A 40 -0.860 1.914 5.876 1.00 0.00 C ATOM 588 C LEU A 40 -2.367 1.849 6.133 1.00 0.00 C ATOM 589 O LEU A 40 -3.042 0.935 5.662 1.00 0.00 O ATOM 590 CB LEU A 40 -0.281 0.626 5.287 1.00 0.00 C ATOM 591 CG LEU A 40 1.239 0.593 5.110 1.00 0.00 C ATOM 592 CD1 LEU A 40 1.673 -0.648 4.328 1.00 0.00 C ATOM 593 CD2 LEU A 40 1.743 1.884 4.463 1.00 0.00 C ATOM 0 H LEU A 40 -0.218 1.548 7.836 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.698 2.684 5.121 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.570 -0.206 5.929 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.744 0.454 4.315 1.00 0.00 H new ATOM 0 HG LEU A 40 1.697 0.527 6.097 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.757 -0.647 4.216 1.00 0.00 H new ATOM 0 HD12 LEU A 40 1.365 -1.544 4.867 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.207 -0.639 3.343 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.826 1.835 4.348 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.280 2.005 3.484 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.483 2.733 5.095 1.00 0.00 H new ATOM 605 N LYS A 41 -2.850 2.830 6.881 1.00 0.00 N ATOM 606 CA LYS A 41 -4.264 2.896 7.207 1.00 0.00 C ATOM 607 C LYS A 41 -4.908 4.050 6.436 1.00 0.00 C ATOM 608 O LYS A 41 -5.827 3.837 5.646 1.00 0.00 O ATOM 609 CB LYS A 41 -4.461 2.983 8.722 1.00 0.00 C ATOM 610 CG LYS A 41 -5.907 3.347 9.067 1.00 0.00 C ATOM 611 CD LYS A 41 -6.041 3.721 10.544 1.00 0.00 C ATOM 612 CE LYS A 41 -7.510 3.877 10.939 1.00 0.00 C ATOM 613 NZ LYS A 41 -7.695 3.579 12.377 1.00 0.00 N ATOM 0 H LYS A 41 -2.287 3.586 7.271 1.00 0.00 H new ATOM 0 HA LYS A 41 -4.770 1.982 6.895 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -4.203 2.029 9.181 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -3.785 3.730 9.138 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -6.234 4.181 8.446 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -6.562 2.505 8.841 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -5.574 2.953 11.161 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -5.508 4.652 10.737 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -7.844 4.893 10.726 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -8.127 3.207 10.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -8.698 3.690 12.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -7.395 2.602 12.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -7.122 4.236 12.944 1.00 0.00 H new ATOM 627 N ASN A 42 -4.399 5.247 6.691 1.00 0.00 N ATOM 628 CA ASN A 42 -4.913 6.434 6.030 1.00 0.00 C ATOM 629 C ASN A 42 -5.196 6.114 4.561 1.00 0.00 C ATOM 630 O ASN A 42 -6.289 6.379 4.064 1.00 0.00 O ATOM 631 CB ASN A 42 -3.895 7.575 6.078 1.00 0.00 C ATOM 632 CG ASN A 42 -4.587 8.919 6.316 1.00 0.00 C ATOM 633 OD1 ASN A 42 -5.782 8.998 6.549 1.00 0.00 O ATOM 634 ND2 ASN A 42 -3.772 9.967 6.246 1.00 0.00 N ATOM 0 H ASN A 42 -3.636 5.420 7.346 1.00 0.00 H new ATOM 0 HA ASN A 42 -5.823 6.740 6.547 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -3.172 7.389 6.872 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -3.338 7.610 5.142 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -4.138 10.908 6.391 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -2.781 9.830 6.047 1.00 0.00 H new ATOM 641 N GLY A 43 -4.192 5.548 3.909 1.00 0.00 N ATOM 642 CA GLY A 43 -4.318 5.188 2.506 1.00 0.00 C ATOM 643 C GLY A 43 -3.535 6.157 1.619 1.00 0.00 C ATOM 644 O GLY A 43 -3.061 5.779 0.549 1.00 0.00 O ATOM 0 H GLY A 43 -3.287 5.329 4.326 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -3.952 4.173 2.353 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -5.369 5.195 2.218 1.00 0.00 H new ATOM 648 N VAL A 44 -3.424 7.388 2.096 1.00 0.00 N ATOM 649 CA VAL A 44 -2.707 8.415 1.359 1.00 0.00 C ATOM 650 C VAL A 44 -1.383 7.840 0.850 1.00 0.00 C ATOM 651 O VAL A 44 -1.101 7.887 -0.346 1.00 0.00 O ATOM 652 CB VAL A 44 -2.522 9.656 2.235 1.00 0.00 C ATOM 653 CG1 VAL A 44 -1.497 10.612 1.622 1.00 0.00 C ATOM 654 CG2 VAL A 44 -3.858 10.362 2.472 1.00 0.00 C ATOM 0 H VAL A 44 -3.819 7.698 2.984 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.281 8.731 0.488 1.00 0.00 H new ATOM 0 HB VAL A 44 -2.139 9.330 3.202 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.384 11.485 2.264 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.537 10.105 1.528 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -1.838 10.928 0.636 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -3.699 11.241 3.097 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -4.282 10.669 1.516 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.546 9.680 2.972 1.00 0.00 H new ATOM 664 N ILE A 45 -0.607 7.311 1.785 1.00 0.00 N ATOM 665 CA ILE A 45 0.681 6.728 1.446 1.00 0.00 C ATOM 666 C ILE A 45 0.481 5.645 0.383 1.00 0.00 C ATOM 667 O ILE A 45 1.057 5.721 -0.701 1.00 0.00 O ATOM 668 CB ILE A 45 1.391 6.230 2.706 1.00 0.00 C ATOM 669 CG1 ILE A 45 1.762 7.396 3.624 1.00 0.00 C ATOM 670 CG2 ILE A 45 2.607 5.373 2.347 1.00 0.00 C ATOM 671 CD1 ILE A 45 2.828 6.978 4.639 1.00 0.00 C ATOM 0 H ILE A 45 -0.845 7.274 2.776 1.00 0.00 H new ATOM 0 HA ILE A 45 1.340 7.482 1.014 1.00 0.00 H new ATOM 0 HB ILE A 45 0.700 5.593 3.259 1.00 0.00 H new ATOM 0 HG12 ILE A 45 2.131 8.230 3.027 1.00 0.00 H new ATOM 0 HG13 ILE A 45 0.873 7.747 4.149 1.00 0.00 H new ATOM 0 HG21 ILE A 45 3.094 5.032 3.260 1.00 0.00 H new ATOM 0 HG22 ILE A 45 2.285 4.511 1.763 1.00 0.00 H new ATOM 0 HG23 ILE A 45 3.310 5.966 1.761 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.073 7.826 5.279 1.00 0.00 H new ATOM 0 HD12 ILE A 45 2.447 6.160 5.250 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.724 6.650 4.112 1.00 0.00 H new ATOM 683 N LEU A 46 -0.336 4.662 0.732 1.00 0.00 N ATOM 684 CA LEU A 46 -0.619 3.566 -0.179 1.00 0.00 C ATOM 685 C LEU A 46 -0.993 4.130 -1.550 1.00 0.00 C ATOM 686 O LEU A 46 -0.565 3.608 -2.578 1.00 0.00 O ATOM 687 CB LEU A 46 -1.680 2.637 0.415 1.00 0.00 C ATOM 688 CG LEU A 46 -1.182 1.619 1.442 1.00 0.00 C ATOM 689 CD1 LEU A 46 -2.349 1.010 2.222 1.00 0.00 C ATOM 690 CD2 LEU A 46 -0.315 0.547 0.778 1.00 0.00 C ATOM 0 H LEU A 46 -0.811 4.602 1.633 1.00 0.00 H new ATOM 0 HA LEU A 46 0.269 2.950 -0.320 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -2.449 3.250 0.884 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.158 2.096 -0.401 1.00 0.00 H new ATOM 0 HG LEU A 46 -0.552 2.142 2.161 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -1.967 0.290 2.945 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -2.888 1.799 2.746 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -3.025 0.506 1.531 1.00 0.00 H new ATOM 0 HD21 LEU A 46 0.025 -0.164 1.531 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -0.900 0.022 0.022 1.00 0.00 H new ATOM 0 HD23 LEU A 46 0.548 1.017 0.307 1.00 0.00 H new ATOM 702 N SER A 47 -1.788 5.190 -1.522 1.00 0.00 N ATOM 703 CA SER A 47 -2.225 5.831 -2.750 1.00 0.00 C ATOM 704 C SER A 47 -1.028 6.462 -3.465 1.00 0.00 C ATOM 705 O SER A 47 -1.025 6.583 -4.689 1.00 0.00 O ATOM 706 CB SER A 47 -3.294 6.889 -2.469 1.00 0.00 C ATOM 707 OG SER A 47 -4.460 6.325 -1.875 1.00 0.00 O ATOM 0 H SER A 47 -2.141 5.621 -0.667 1.00 0.00 H new ATOM 0 HA SER A 47 -2.666 5.071 -3.395 1.00 0.00 H new ATOM 0 HB2 SER A 47 -2.884 7.652 -1.808 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.566 7.386 -3.400 1.00 0.00 H new ATOM 0 HG SER A 47 -4.252 6.028 -0.965 1.00 0.00 H new ATOM 713 N LYS A 48 -0.041 6.849 -2.670 1.00 0.00 N ATOM 714 CA LYS A 48 1.158 7.465 -3.212 1.00 0.00 C ATOM 715 C LYS A 48 2.049 6.383 -3.825 1.00 0.00 C ATOM 716 O LYS A 48 2.673 6.602 -4.862 1.00 0.00 O ATOM 717 CB LYS A 48 1.859 8.305 -2.142 1.00 0.00 C ATOM 718 CG LYS A 48 1.194 9.676 -2.000 1.00 0.00 C ATOM 719 CD LYS A 48 1.819 10.472 -0.852 1.00 0.00 C ATOM 720 CE LYS A 48 1.586 11.973 -1.036 1.00 0.00 C ATOM 721 NZ LYS A 48 2.517 12.522 -2.047 1.00 0.00 N ATOM 0 H LYS A 48 -0.047 6.748 -1.655 1.00 0.00 H new ATOM 0 HA LYS A 48 0.901 8.159 -4.012 1.00 0.00 H new ATOM 0 HB2 LYS A 48 1.830 7.782 -1.186 1.00 0.00 H new ATOM 0 HB3 LYS A 48 2.909 8.431 -2.404 1.00 0.00 H new ATOM 0 HG2 LYS A 48 1.297 10.232 -2.932 1.00 0.00 H new ATOM 0 HG3 LYS A 48 0.126 9.550 -1.821 1.00 0.00 H new ATOM 0 HD2 LYS A 48 1.391 10.147 0.096 1.00 0.00 H new ATOM 0 HD3 LYS A 48 2.889 10.269 -0.804 1.00 0.00 H new ATOM 0 HE2 LYS A 48 0.556 12.152 -1.346 1.00 0.00 H new ATOM 0 HE3 LYS A 48 1.727 12.488 -0.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 2.478 13.561 -2.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 3.485 12.208 -1.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 2.243 12.183 -2.991 1.00 0.00 H new ATOM 735 N LEU A 49 2.080 5.238 -3.158 1.00 0.00 N ATOM 736 CA LEU A 49 2.885 4.122 -3.624 1.00 0.00 C ATOM 737 C LEU A 49 2.437 3.730 -5.033 1.00 0.00 C ATOM 738 O LEU A 49 3.153 3.967 -6.005 1.00 0.00 O ATOM 739 CB LEU A 49 2.834 2.969 -2.619 1.00 0.00 C ATOM 740 CG LEU A 49 3.862 1.854 -2.826 1.00 0.00 C ATOM 741 CD1 LEU A 49 5.247 2.289 -2.342 1.00 0.00 C ATOM 742 CD2 LEU A 49 3.404 0.556 -2.159 1.00 0.00 C ATOM 0 H LEU A 49 1.560 5.060 -2.299 1.00 0.00 H new ATOM 0 HA LEU A 49 3.934 4.410 -3.691 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.969 3.379 -1.618 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.838 2.528 -2.652 1.00 0.00 H new ATOM 0 HG LEU A 49 3.941 1.656 -3.895 1.00 0.00 H new ATOM 0 HD11 LEU A 49 5.959 1.479 -2.500 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.568 3.168 -2.900 1.00 0.00 H new ATOM 0 HD13 LEU A 49 5.202 2.530 -1.280 1.00 0.00 H new ATOM 0 HD21 LEU A 49 4.152 -0.220 -2.321 1.00 0.00 H new ATOM 0 HD22 LEU A 49 3.279 0.721 -1.089 1.00 0.00 H new ATOM 0 HD23 LEU A 49 2.454 0.240 -2.591 1.00 0.00 H new ATOM 754 N VAL A 50 1.255 3.136 -5.100 1.00 0.00 N ATOM 755 CA VAL A 50 0.703 2.708 -6.375 1.00 0.00 C ATOM 756 C VAL A 50 0.963 3.789 -7.426 1.00 0.00 C ATOM 757 O VAL A 50 1.419 3.490 -8.529 1.00 0.00 O ATOM 758 CB VAL A 50 -0.782 2.374 -6.216 1.00 0.00 C ATOM 759 CG1 VAL A 50 -1.582 3.612 -5.806 1.00 0.00 C ATOM 760 CG2 VAL A 50 -1.345 1.757 -7.498 1.00 0.00 C ATOM 0 H VAL A 50 0.664 2.941 -4.292 1.00 0.00 H new ATOM 0 HA VAL A 50 1.193 1.796 -6.717 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.876 1.636 -5.419 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.634 3.347 -5.700 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.206 3.990 -4.856 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.477 4.382 -6.570 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.402 1.529 -7.358 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -1.232 2.462 -8.321 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -0.803 0.840 -7.729 1.00 0.00 H new ATOM 770 N ASN A 51 0.663 5.022 -7.048 1.00 0.00 N ATOM 771 CA ASN A 51 0.858 6.149 -7.945 1.00 0.00 C ATOM 772 C ASN A 51 2.331 6.218 -8.356 1.00 0.00 C ATOM 773 O ASN A 51 2.646 6.250 -9.544 1.00 0.00 O ATOM 774 CB ASN A 51 0.497 7.468 -7.259 1.00 0.00 C ATOM 775 CG ASN A 51 -0.841 8.004 -7.773 1.00 0.00 C ATOM 776 OD1 ASN A 51 -1.042 8.213 -8.958 1.00 0.00 O ATOM 777 ND2 ASN A 51 -1.743 8.213 -6.817 1.00 0.00 N ATOM 0 H ASN A 51 0.286 5.266 -6.132 1.00 0.00 H new ATOM 0 HA ASN A 51 0.214 6.006 -8.812 1.00 0.00 H new ATOM 0 HB2 ASN A 51 0.443 7.319 -6.181 1.00 0.00 H new ATOM 0 HB3 ASN A 51 1.281 8.203 -7.440 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -2.668 8.569 -7.058 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -1.509 8.017 -5.844 1.00 0.00 H new ATOM 784 N SER A 52 3.193 6.238 -7.350 1.00 0.00 N ATOM 785 CA SER A 52 4.624 6.303 -7.592 1.00 0.00 C ATOM 786 C SER A 52 5.006 5.354 -8.730 1.00 0.00 C ATOM 787 O SER A 52 5.831 5.694 -9.576 1.00 0.00 O ATOM 788 CB SER A 52 5.412 5.958 -6.326 1.00 0.00 C ATOM 789 OG SER A 52 5.640 4.557 -6.204 1.00 0.00 O ATOM 0 H SER A 52 2.928 6.210 -6.365 1.00 0.00 H new ATOM 0 HA SER A 52 4.877 7.324 -7.879 1.00 0.00 H new ATOM 0 HB2 SER A 52 6.368 6.481 -6.341 1.00 0.00 H new ATOM 0 HB3 SER A 52 4.867 6.314 -5.452 1.00 0.00 H new ATOM 0 HG SER A 52 4.838 4.125 -5.843 1.00 0.00 H new ATOM 795 N LEU A 53 4.386 4.183 -8.714 1.00 0.00 N ATOM 796 CA LEU A 53 4.651 3.182 -9.734 1.00 0.00 C ATOM 797 C LEU A 53 4.171 3.704 -11.090 1.00 0.00 C ATOM 798 O LEU A 53 4.969 4.190 -11.890 1.00 0.00 O ATOM 799 CB LEU A 53 4.035 1.839 -9.339 1.00 0.00 C ATOM 800 CG LEU A 53 4.450 1.286 -7.974 1.00 0.00 C ATOM 801 CD1 LEU A 53 3.574 0.097 -7.575 1.00 0.00 C ATOM 802 CD2 LEU A 53 5.939 0.933 -7.955 1.00 0.00 C ATOM 0 H LEU A 53 3.701 3.905 -8.011 1.00 0.00 H new ATOM 0 HA LEU A 53 5.722 3.001 -9.822 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.950 1.942 -9.353 1.00 0.00 H new ATOM 0 HB3 LEU A 53 4.295 1.104 -10.101 1.00 0.00 H new ATOM 0 HG LEU A 53 4.294 2.065 -7.228 1.00 0.00 H new ATOM 0 HD11 LEU A 53 3.890 -0.277 -6.601 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.533 0.414 -7.521 1.00 0.00 H new ATOM 0 HD13 LEU A 53 3.675 -0.694 -8.318 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.208 0.542 -6.974 1.00 0.00 H new ATOM 0 HD22 LEU A 53 6.144 0.178 -8.714 1.00 0.00 H new ATOM 0 HD23 LEU A 53 6.527 1.827 -8.163 1.00 0.00 H new ATOM 814 N TYR A 54 2.870 3.585 -11.307 1.00 0.00 N ATOM 815 CA TYR A 54 2.274 4.039 -12.552 1.00 0.00 C ATOM 816 C TYR A 54 2.955 5.314 -13.053 1.00 0.00 C ATOM 817 O TYR A 54 3.493 6.087 -12.261 1.00 0.00 O ATOM 818 CB TYR A 54 0.810 4.348 -12.232 1.00 0.00 C ATOM 819 CG TYR A 54 -0.097 3.116 -12.217 1.00 0.00 C ATOM 820 CD1 TYR A 54 -0.556 2.583 -13.404 1.00 0.00 C ATOM 821 CD2 TYR A 54 -0.456 2.538 -11.016 1.00 0.00 C ATOM 822 CE1 TYR A 54 -1.410 1.423 -13.390 1.00 0.00 C ATOM 823 CE2 TYR A 54 -1.311 1.379 -11.002 1.00 0.00 C ATOM 824 CZ TYR A 54 -1.745 0.879 -12.189 1.00 0.00 C ATOM 825 OH TYR A 54 -2.552 -0.216 -12.176 1.00 0.00 O ATOM 0 H TYR A 54 2.211 3.181 -10.641 1.00 0.00 H new ATOM 0 HA TYR A 54 2.381 3.280 -13.327 1.00 0.00 H new ATOM 0 HB2 TYR A 54 0.757 4.837 -11.260 1.00 0.00 H new ATOM 0 HB3 TYR A 54 0.430 5.057 -12.967 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -0.275 3.035 -14.344 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -0.096 2.955 -10.087 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -1.776 0.995 -14.312 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -1.601 0.918 -10.069 1.00 0.00 H new ATOM 0 HH TYR A 54 -2.925 -0.337 -11.278 1.00 0.00 H new ATOM 835 N PRO A 55 2.908 5.500 -14.399 1.00 0.00 N ATOM 836 CA PRO A 55 3.513 6.669 -15.015 1.00 0.00 C ATOM 837 C PRO A 55 2.661 7.917 -14.778 1.00 0.00 C ATOM 838 O PRO A 55 1.784 7.920 -13.915 1.00 0.00 O ATOM 839 CB PRO A 55 3.648 6.312 -16.486 1.00 0.00 C ATOM 840 CG PRO A 55 2.696 5.152 -16.724 1.00 0.00 C ATOM 841 CD PRO A 55 2.279 4.606 -15.368 1.00 0.00 C ATOM 0 HA PRO A 55 4.485 6.915 -14.587 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.393 7.162 -17.119 1.00 0.00 H new ATOM 0 HB3 PRO A 55 4.673 6.031 -16.727 1.00 0.00 H new ATOM 0 HG2 PRO A 55 1.823 5.484 -17.287 1.00 0.00 H new ATOM 0 HG3 PRO A 55 3.181 4.375 -17.316 1.00 0.00 H new ATOM 0 HD2 PRO A 55 1.195 4.603 -15.259 1.00 0.00 H new ATOM 0 HD3 PRO A 55 2.615 3.578 -15.235 1.00 0.00 H new ATOM 849 N GLU A 56 2.948 8.948 -15.559 1.00 0.00 N ATOM 850 CA GLU A 56 2.218 10.199 -15.445 1.00 0.00 C ATOM 851 C GLU A 56 1.017 10.202 -16.393 1.00 0.00 C ATOM 852 O GLU A 56 0.049 10.928 -16.172 1.00 0.00 O ATOM 853 CB GLU A 56 3.134 11.394 -15.718 1.00 0.00 C ATOM 854 CG GLU A 56 3.889 11.216 -17.037 1.00 0.00 C ATOM 855 CD GLU A 56 4.509 12.538 -17.497 1.00 0.00 C ATOM 856 OE1 GLU A 56 3.723 13.482 -17.729 1.00 0.00 O ATOM 857 OE2 GLU A 56 5.753 12.574 -17.606 1.00 0.00 O ATOM 0 H GLU A 56 3.676 8.943 -16.273 1.00 0.00 H new ATOM 0 HA GLU A 56 1.849 10.290 -14.423 1.00 0.00 H new ATOM 0 HB2 GLU A 56 2.543 12.309 -15.754 1.00 0.00 H new ATOM 0 HB3 GLU A 56 3.845 11.506 -14.900 1.00 0.00 H new ATOM 0 HG2 GLU A 56 4.671 10.467 -16.914 1.00 0.00 H new ATOM 0 HG3 GLU A 56 3.208 10.844 -17.802 1.00 0.00 H new ATOM 864 N GLY A 57 1.118 9.380 -17.427 1.00 0.00 N ATOM 865 CA GLY A 57 0.051 9.278 -18.409 1.00 0.00 C ATOM 866 C GLY A 57 -1.000 8.255 -17.973 1.00 0.00 C ATOM 867 O GLY A 57 -1.769 7.762 -18.795 1.00 0.00 O ATOM 0 H GLY A 57 1.922 8.778 -17.606 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -0.419 10.252 -18.543 1.00 0.00 H new ATOM 0 HA3 GLY A 57 0.467 8.989 -19.374 1.00 0.00 H new ATOM 871 N SER A 58 -0.998 7.968 -16.679 1.00 0.00 N ATOM 872 CA SER A 58 -1.942 7.013 -16.124 1.00 0.00 C ATOM 873 C SER A 58 -2.620 7.606 -14.888 1.00 0.00 C ATOM 874 O SER A 58 -3.813 7.907 -14.915 1.00 0.00 O ATOM 875 CB SER A 58 -1.248 5.696 -15.768 1.00 0.00 C ATOM 876 OG SER A 58 -2.174 4.621 -15.644 1.00 0.00 O ATOM 0 H SER A 58 -0.358 8.380 -16.000 1.00 0.00 H new ATOM 0 HA SER A 58 -2.699 6.801 -16.879 1.00 0.00 H new ATOM 0 HB2 SER A 58 -0.513 5.455 -16.536 1.00 0.00 H new ATOM 0 HB3 SER A 58 -0.703 5.815 -14.831 1.00 0.00 H new ATOM 0 HG SER A 58 -1.828 3.963 -15.006 1.00 0.00 H new ATOM 882 N LYS A 59 -1.832 7.757 -13.834 1.00 0.00 N ATOM 883 CA LYS A 59 -2.342 8.309 -12.590 1.00 0.00 C ATOM 884 C LYS A 59 -3.719 7.710 -12.299 1.00 0.00 C ATOM 885 O LYS A 59 -4.742 8.294 -12.653 1.00 0.00 O ATOM 886 CB LYS A 59 -2.334 9.838 -12.640 1.00 0.00 C ATOM 887 CG LYS A 59 -1.132 10.405 -11.882 1.00 0.00 C ATOM 888 CD LYS A 59 0.148 10.275 -12.709 1.00 0.00 C ATOM 889 CE LYS A 59 1.377 10.652 -11.880 1.00 0.00 C ATOM 890 NZ LYS A 59 1.616 12.112 -11.942 1.00 0.00 N ATOM 0 H LYS A 59 -0.843 7.507 -13.816 1.00 0.00 H new ATOM 0 HA LYS A 59 -1.693 8.037 -11.757 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -2.304 10.171 -13.677 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -3.257 10.224 -12.207 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -1.310 11.453 -11.643 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -1.013 9.878 -10.935 1.00 0.00 H new ATOM 0 HD2 LYS A 59 0.249 9.252 -13.071 1.00 0.00 H new ATOM 0 HD3 LYS A 59 0.085 10.919 -13.586 1.00 0.00 H new ATOM 0 HE2 LYS A 59 1.233 10.345 -10.844 1.00 0.00 H new ATOM 0 HE3 LYS A 59 2.252 10.118 -12.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 2.454 12.351 -11.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 1.775 12.396 -12.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 0.788 12.616 -11.566 1.00 0.00 H new ATOM 904 N PRO A 60 -3.701 6.521 -11.638 1.00 0.00 N ATOM 905 CA PRO A 60 -4.936 5.837 -11.294 1.00 0.00 C ATOM 906 C PRO A 60 -5.632 6.520 -10.116 1.00 0.00 C ATOM 907 O PRO A 60 -6.793 6.914 -10.219 1.00 0.00 O ATOM 908 CB PRO A 60 -4.521 4.406 -10.991 1.00 0.00 C ATOM 909 CG PRO A 60 -3.026 4.454 -10.723 1.00 0.00 C ATOM 910 CD PRO A 60 -2.509 5.800 -11.202 1.00 0.00 C ATOM 0 HA PRO A 60 -5.670 5.863 -12.099 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -5.060 4.017 -10.127 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -4.747 3.748 -11.830 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -2.825 4.324 -9.660 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -2.519 3.643 -11.245 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -1.994 6.333 -10.403 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -1.796 5.683 -12.018 1.00 0.00 H new ATOM 918 N VAL A 61 -4.894 6.640 -9.022 1.00 0.00 N ATOM 919 CA VAL A 61 -5.425 7.270 -7.826 1.00 0.00 C ATOM 920 C VAL A 61 -5.144 8.773 -7.877 1.00 0.00 C ATOM 921 O VAL A 61 -4.332 9.229 -8.680 1.00 0.00 O ATOM 922 CB VAL A 61 -4.849 6.595 -6.579 1.00 0.00 C ATOM 923 CG1 VAL A 61 -5.429 7.211 -5.304 1.00 0.00 C ATOM 924 CG2 VAL A 61 -5.084 5.084 -6.615 1.00 0.00 C ATOM 0 H VAL A 61 -3.932 6.311 -8.939 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.507 7.144 -7.777 1.00 0.00 H new ATOM 0 HB VAL A 61 -3.772 6.766 -6.573 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -5.003 6.713 -4.433 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -5.186 8.273 -5.270 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.512 7.086 -5.300 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -4.665 4.629 -5.717 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -6.154 4.883 -6.658 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.600 4.661 -7.496 1.00 0.00 H new ATOM 934 N LYS A 62 -5.830 9.501 -7.009 1.00 0.00 N ATOM 935 CA LYS A 62 -5.664 10.943 -6.945 1.00 0.00 C ATOM 936 C LYS A 62 -5.440 11.362 -5.490 1.00 0.00 C ATOM 937 O LYS A 62 -6.393 11.492 -4.724 1.00 0.00 O ATOM 938 CB LYS A 62 -6.846 11.649 -7.613 1.00 0.00 C ATOM 939 CG LYS A 62 -6.907 11.322 -9.106 1.00 0.00 C ATOM 940 CD LYS A 62 -7.829 10.129 -9.369 1.00 0.00 C ATOM 941 CE LYS A 62 -8.794 10.426 -10.518 1.00 0.00 C ATOM 942 NZ LYS A 62 -8.121 10.237 -11.823 1.00 0.00 N ATOM 0 H LYS A 62 -6.502 9.119 -6.344 1.00 0.00 H new ATOM 0 HA LYS A 62 -4.781 11.250 -7.506 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -7.775 11.344 -7.132 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -6.755 12.727 -7.476 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -7.265 12.191 -9.658 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -5.905 11.100 -9.475 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -7.232 9.249 -9.609 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -8.393 9.895 -8.466 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -9.661 9.769 -10.451 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -9.162 11.449 -10.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -8.790 10.443 -12.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -7.307 10.881 -11.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -7.792 9.254 -11.905 1.00 0.00 H new ATOM 956 N VAL A 63 -4.174 11.562 -5.154 1.00 0.00 N ATOM 957 CA VAL A 63 -3.812 11.964 -3.806 1.00 0.00 C ATOM 958 C VAL A 63 -4.204 13.427 -3.592 1.00 0.00 C ATOM 959 O VAL A 63 -3.646 14.322 -4.224 1.00 0.00 O ATOM 960 CB VAL A 63 -2.324 11.702 -3.563 1.00 0.00 C ATOM 961 CG1 VAL A 63 -1.931 12.062 -2.129 1.00 0.00 C ATOM 962 CG2 VAL A 63 -1.964 10.250 -3.882 1.00 0.00 C ATOM 0 H VAL A 63 -3.386 11.453 -5.793 1.00 0.00 H new ATOM 0 HA VAL A 63 -4.357 11.371 -3.072 1.00 0.00 H new ATOM 0 HB VAL A 63 -1.756 12.344 -4.237 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -0.869 11.866 -1.983 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -2.133 13.118 -1.950 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -2.511 11.458 -1.430 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -0.901 10.090 -3.701 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -2.545 9.583 -3.245 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -2.189 10.041 -4.928 1.00 0.00 H new ATOM 972 N PRO A 64 -5.188 13.630 -2.674 1.00 0.00 N ATOM 973 CA PRO A 64 -5.661 14.970 -2.369 1.00 0.00 C ATOM 974 C PRO A 64 -4.650 15.725 -1.503 1.00 0.00 C ATOM 975 O PRO A 64 -3.943 15.120 -0.699 1.00 0.00 O ATOM 976 CB PRO A 64 -7.000 14.766 -1.678 1.00 0.00 C ATOM 977 CG PRO A 64 -7.009 13.321 -1.207 1.00 0.00 C ATOM 978 CD PRO A 64 -5.872 12.594 -1.906 1.00 0.00 C ATOM 0 HA PRO A 64 -5.777 15.588 -3.259 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -7.115 15.451 -0.838 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -7.826 14.959 -2.362 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -6.885 13.272 -0.125 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -7.964 12.850 -1.440 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -5.200 12.125 -1.187 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -6.247 11.803 -2.555 1.00 0.00 H new ATOM 986 N GLU A 65 -4.615 17.035 -1.698 1.00 0.00 N ATOM 987 CA GLU A 65 -3.702 17.879 -0.945 1.00 0.00 C ATOM 988 C GLU A 65 -3.792 17.558 0.548 1.00 0.00 C ATOM 989 O GLU A 65 -2.772 17.370 1.209 1.00 0.00 O ATOM 990 CB GLU A 65 -3.984 19.360 -1.206 1.00 0.00 C ATOM 991 CG GLU A 65 -2.739 20.068 -1.745 1.00 0.00 C ATOM 992 CD GLU A 65 -1.547 19.871 -0.806 1.00 0.00 C ATOM 993 OE1 GLU A 65 -1.712 20.179 0.394 1.00 0.00 O ATOM 994 OE2 GLU A 65 -0.497 19.416 -1.310 1.00 0.00 O ATOM 0 H GLU A 65 -5.204 17.533 -2.366 1.00 0.00 H new ATOM 0 HA GLU A 65 -2.686 17.672 -1.280 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -4.801 19.458 -1.921 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -4.309 19.840 -0.283 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -2.495 19.680 -2.734 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -2.943 21.132 -1.861 1.00 0.00 H new ATOM 1001 N ASN A 66 -5.023 17.504 1.036 1.00 0.00 N ATOM 1002 CA ASN A 66 -5.259 17.209 2.439 1.00 0.00 C ATOM 1003 C ASN A 66 -5.613 15.729 2.592 1.00 0.00 C ATOM 1004 O ASN A 66 -6.138 15.113 1.666 1.00 0.00 O ATOM 1005 CB ASN A 66 -6.427 18.033 2.986 1.00 0.00 C ATOM 1006 CG ASN A 66 -7.758 17.546 2.411 1.00 0.00 C ATOM 1007 OD1 ASN A 66 -7.931 17.402 1.212 1.00 0.00 O ATOM 1008 ND2 ASN A 66 -8.687 17.301 3.330 1.00 0.00 N ATOM 0 H ASN A 66 -5.867 17.660 0.485 1.00 0.00 H new ATOM 0 HA ASN A 66 -4.353 17.455 2.992 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -6.449 17.962 4.073 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -6.283 19.085 2.738 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -9.610 16.972 3.047 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -8.477 17.442 4.318 1.00 0.00 H new ATOM 1015 N PRO A 67 -5.302 15.185 3.799 1.00 0.00 N ATOM 1016 CA PRO A 67 -5.581 13.788 4.086 1.00 0.00 C ATOM 1017 C PRO A 67 -7.075 13.567 4.331 1.00 0.00 C ATOM 1018 O PRO A 67 -7.835 14.525 4.463 1.00 0.00 O ATOM 1019 CB PRO A 67 -4.725 13.456 5.296 1.00 0.00 C ATOM 1020 CG PRO A 67 -4.355 14.790 5.924 1.00 0.00 C ATOM 1021 CD PRO A 67 -4.679 15.884 4.920 1.00 0.00 C ATOM 0 HA PRO A 67 -5.338 13.130 3.251 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -5.272 12.831 6.002 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -3.833 12.902 5.003 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -4.911 14.944 6.849 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -3.296 14.810 6.182 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -5.353 16.627 5.347 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -3.779 16.413 4.606 1.00 0.00 H new ATOM 1029 N PRO A 68 -7.462 12.264 4.387 1.00 0.00 N ATOM 1030 CA PRO A 68 -8.851 11.905 4.614 1.00 0.00 C ATOM 1031 C PRO A 68 -9.240 12.119 6.079 1.00 0.00 C ATOM 1032 O PRO A 68 -10.013 13.022 6.394 1.00 0.00 O ATOM 1033 CB PRO A 68 -8.959 10.453 4.177 1.00 0.00 C ATOM 1034 CG PRO A 68 -7.537 9.917 4.160 1.00 0.00 C ATOM 1035 CD PRO A 68 -6.590 11.103 4.235 1.00 0.00 C ATOM 0 HA PRO A 68 -9.544 12.529 4.050 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -9.583 9.883 4.865 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -9.418 10.375 3.191 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -7.373 9.244 5.001 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -7.357 9.342 3.252 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -5.904 11.010 5.077 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -5.980 11.181 3.335 1.00 0.00 H new ATOM 1043 N SER A 69 -8.686 11.272 6.934 1.00 0.00 N ATOM 1044 CA SER A 69 -8.965 11.357 8.358 1.00 0.00 C ATOM 1045 C SER A 69 -10.255 10.603 8.684 1.00 0.00 C ATOM 1046 O SER A 69 -10.232 9.612 9.412 1.00 0.00 O ATOM 1047 CB SER A 69 -9.072 12.814 8.812 1.00 0.00 C ATOM 1048 OG SER A 69 -8.437 13.030 10.069 1.00 0.00 O ATOM 0 H SER A 69 -8.046 10.524 6.669 1.00 0.00 H new ATOM 0 HA SER A 69 -8.137 10.897 8.897 1.00 0.00 H new ATOM 0 HB2 SER A 69 -8.619 13.462 8.061 1.00 0.00 H new ATOM 0 HB3 SER A 69 -10.123 13.095 8.884 1.00 0.00 H new ATOM 0 HG SER A 69 -8.526 13.972 10.323 1.00 0.00 H new ATOM 1054 N MET A 70 -11.350 11.100 8.129 1.00 0.00 N ATOM 1055 CA MET A 70 -12.648 10.486 8.352 1.00 0.00 C ATOM 1056 C MET A 70 -12.633 9.011 7.944 1.00 0.00 C ATOM 1057 O MET A 70 -11.852 8.609 7.083 1.00 0.00 O ATOM 1058 CB MET A 70 -13.711 11.229 7.541 1.00 0.00 C ATOM 1059 CG MET A 70 -14.418 12.282 8.398 1.00 0.00 C ATOM 1060 SD MET A 70 -15.925 12.808 7.599 1.00 0.00 S ATOM 1061 CE MET A 70 -15.989 14.506 8.147 1.00 0.00 C ATOM 0 H MET A 70 -11.365 11.922 7.525 1.00 0.00 H new ATOM 0 HA MET A 70 -12.881 10.548 9.415 1.00 0.00 H new ATOM 0 HB2 MET A 70 -13.247 11.708 6.679 1.00 0.00 H new ATOM 0 HB3 MET A 70 -14.442 10.518 7.155 1.00 0.00 H new ATOM 0 HG2 MET A 70 -14.643 11.871 9.382 1.00 0.00 H new ATOM 0 HG3 MET A 70 -13.761 13.138 8.553 1.00 0.00 H new ATOM 0 HE1 MET A 70 -16.876 14.988 7.736 1.00 0.00 H new ATOM 0 HE2 MET A 70 -16.031 14.536 9.236 1.00 0.00 H new ATOM 0 HE3 MET A 70 -15.099 15.033 7.804 1.00 0.00 H new ATOM 1071 N VAL A 71 -13.506 8.245 8.582 1.00 0.00 N ATOM 1072 CA VAL A 71 -13.604 6.824 8.296 1.00 0.00 C ATOM 1073 C VAL A 71 -13.902 6.626 6.808 1.00 0.00 C ATOM 1074 O VAL A 71 -13.055 6.141 6.061 1.00 0.00 O ATOM 1075 CB VAL A 71 -14.649 6.177 9.207 1.00 0.00 C ATOM 1076 CG1 VAL A 71 -14.864 4.708 8.838 1.00 0.00 C ATOM 1077 CG2 VAL A 71 -14.259 6.322 10.679 1.00 0.00 C ATOM 0 H VAL A 71 -14.152 8.582 9.296 1.00 0.00 H new ATOM 0 HA VAL A 71 -12.657 6.326 8.506 1.00 0.00 H new ATOM 0 HB VAL A 71 -15.593 6.701 9.058 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -15.611 4.272 9.501 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -15.209 4.639 7.806 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -13.925 4.165 8.944 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -15.019 5.854 11.305 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -13.298 5.837 10.850 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -14.182 7.379 10.932 1.00 0.00 H new ATOM 1087 N PHE A 72 -15.110 7.013 6.424 1.00 0.00 N ATOM 1088 CA PHE A 72 -15.531 6.884 5.039 1.00 0.00 C ATOM 1089 C PHE A 72 -14.428 7.347 4.085 1.00 0.00 C ATOM 1090 O PHE A 72 -14.192 6.720 3.053 1.00 0.00 O ATOM 1091 CB PHE A 72 -16.755 7.784 4.859 1.00 0.00 C ATOM 1092 CG PHE A 72 -18.018 7.261 5.546 1.00 0.00 C ATOM 1093 CD1 PHE A 72 -18.621 6.130 5.093 1.00 0.00 C ATOM 1094 CD2 PHE A 72 -18.538 7.929 6.611 1.00 0.00 C ATOM 1095 CE1 PHE A 72 -19.793 5.645 5.731 1.00 0.00 C ATOM 1096 CE2 PHE A 72 -19.711 7.444 7.249 1.00 0.00 C ATOM 1097 CZ PHE A 72 -20.313 6.312 6.796 1.00 0.00 C ATOM 0 H PHE A 72 -15.810 7.416 7.047 1.00 0.00 H new ATOM 0 HA PHE A 72 -15.755 5.841 4.814 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -16.525 8.775 5.250 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -16.955 7.900 3.794 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -18.208 5.600 4.247 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -18.059 8.828 6.971 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -20.272 4.746 5.371 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -20.125 7.974 8.094 1.00 0.00 H new ATOM 0 HZ PHE A 72 -21.204 5.943 7.282 1.00 0.00 H new ATOM 1107 N LYS A 73 -13.782 8.439 4.465 1.00 0.00 N ATOM 1108 CA LYS A 73 -12.709 8.993 3.656 1.00 0.00 C ATOM 1109 C LYS A 73 -11.516 8.036 3.675 1.00 0.00 C ATOM 1110 O LYS A 73 -11.091 7.547 2.629 1.00 0.00 O ATOM 1111 CB LYS A 73 -12.367 10.411 4.117 1.00 0.00 C ATOM 1112 CG LYS A 73 -13.311 11.436 3.485 1.00 0.00 C ATOM 1113 CD LYS A 73 -12.787 11.896 2.123 1.00 0.00 C ATOM 1114 CE LYS A 73 -13.796 12.813 1.429 1.00 0.00 C ATOM 1115 NZ LYS A 73 -13.400 13.050 0.023 1.00 0.00 N ATOM 0 H LYS A 73 -13.980 8.955 5.322 1.00 0.00 H new ATOM 0 HA LYS A 73 -13.026 9.088 2.617 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -12.435 10.470 5.203 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -11.337 10.646 3.849 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -14.303 10.999 3.369 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -13.417 12.295 4.147 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -11.841 12.422 2.252 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -12.586 11.028 1.495 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -14.788 12.363 1.463 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -13.859 13.763 1.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -14.096 13.674 -0.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -12.462 13.499 -0.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -13.363 12.143 -0.485 1.00 0.00 H new ATOM 1129 N GLN A 74 -11.009 7.796 4.875 1.00 0.00 N ATOM 1130 CA GLN A 74 -9.873 6.906 5.044 1.00 0.00 C ATOM 1131 C GLN A 74 -10.108 5.596 4.290 1.00 0.00 C ATOM 1132 O GLN A 74 -9.285 5.189 3.473 1.00 0.00 O ATOM 1133 CB GLN A 74 -9.596 6.645 6.526 1.00 0.00 C ATOM 1134 CG GLN A 74 -8.800 7.794 7.147 1.00 0.00 C ATOM 1135 CD GLN A 74 -8.572 7.559 8.641 1.00 0.00 C ATOM 1136 OE1 GLN A 74 -9.490 7.305 9.403 1.00 0.00 O ATOM 1137 NE2 GLN A 74 -7.299 7.658 9.016 1.00 0.00 N ATOM 0 H GLN A 74 -11.364 8.203 5.740 1.00 0.00 H new ATOM 0 HA GLN A 74 -8.991 7.390 4.624 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -10.539 6.521 7.059 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -9.042 5.713 6.637 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -7.840 7.892 6.640 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -9.335 8.732 7.000 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -6.579 7.873 8.326 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -7.043 7.518 9.993 1.00 0.00 H new ATOM 1146 N MET A 75 -11.237 4.971 4.593 1.00 0.00 N ATOM 1147 CA MET A 75 -11.592 3.715 3.954 1.00 0.00 C ATOM 1148 C MET A 75 -11.521 3.835 2.431 1.00 0.00 C ATOM 1149 O MET A 75 -10.915 2.996 1.766 1.00 0.00 O ATOM 1150 CB MET A 75 -13.009 3.314 4.369 1.00 0.00 C ATOM 1151 CG MET A 75 -13.035 2.810 5.814 1.00 0.00 C ATOM 1152 SD MET A 75 -14.399 1.682 6.043 1.00 0.00 S ATOM 1153 CE MET A 75 -13.522 0.257 6.664 1.00 0.00 C ATOM 0 H MET A 75 -11.917 5.311 5.272 1.00 0.00 H new ATOM 0 HA MET A 75 -10.881 2.953 4.273 1.00 0.00 H new ATOM 0 HB2 MET A 75 -13.678 4.169 4.266 1.00 0.00 H new ATOM 0 HB3 MET A 75 -13.381 2.536 3.702 1.00 0.00 H new ATOM 0 HG2 MET A 75 -12.096 2.310 6.050 1.00 0.00 H new ATOM 0 HG3 MET A 75 -13.130 3.652 6.500 1.00 0.00 H new ATOM 0 HE1 MET A 75 -13.943 -0.648 6.227 1.00 0.00 H new ATOM 0 HE2 MET A 75 -12.468 0.333 6.396 1.00 0.00 H new ATOM 0 HE3 MET A 75 -13.618 0.215 7.749 1.00 0.00 H new ATOM 1163 N GLU A 76 -12.148 4.886 1.922 1.00 0.00 N ATOM 1164 CA GLU A 76 -12.163 5.127 0.489 1.00 0.00 C ATOM 1165 C GLU A 76 -10.736 5.299 -0.035 1.00 0.00 C ATOM 1166 O GLU A 76 -10.344 4.648 -1.002 1.00 0.00 O ATOM 1167 CB GLU A 76 -13.024 6.344 0.147 1.00 0.00 C ATOM 1168 CG GLU A 76 -14.511 5.983 0.151 1.00 0.00 C ATOM 1169 CD GLU A 76 -15.177 6.388 -1.166 1.00 0.00 C ATOM 1170 OE1 GLU A 76 -14.755 5.840 -2.207 1.00 0.00 O ATOM 1171 OE2 GLU A 76 -16.093 7.236 -1.101 1.00 0.00 O ATOM 0 H GLU A 76 -12.649 5.580 2.476 1.00 0.00 H new ATOM 0 HA GLU A 76 -12.607 4.261 -0.001 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -12.838 7.140 0.868 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -12.742 6.729 -0.833 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -14.628 4.911 0.307 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -15.008 6.482 0.983 1.00 0.00 H new ATOM 1178 N GLN A 77 -10.000 6.180 0.625 1.00 0.00 N ATOM 1179 CA GLN A 77 -8.625 6.447 0.238 1.00 0.00 C ATOM 1180 C GLN A 77 -7.903 5.138 -0.090 1.00 0.00 C ATOM 1181 O GLN A 77 -7.240 5.032 -1.121 1.00 0.00 O ATOM 1182 CB GLN A 77 -7.887 7.221 1.332 1.00 0.00 C ATOM 1183 CG GLN A 77 -6.450 7.532 0.909 1.00 0.00 C ATOM 1184 CD GLN A 77 -6.350 8.929 0.293 1.00 0.00 C ATOM 1185 OE1 GLN A 77 -6.647 9.934 0.917 1.00 0.00 O ATOM 1186 NE2 GLN A 77 -5.917 8.935 -0.965 1.00 0.00 N ATOM 0 H GLN A 77 -10.330 6.719 1.426 1.00 0.00 H new ATOM 0 HA GLN A 77 -8.634 7.069 -0.657 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -8.416 8.150 1.545 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -7.881 6.639 2.253 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -5.790 7.464 1.774 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -6.110 6.788 0.189 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -5.685 8.057 -1.429 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -5.817 9.818 -1.466 1.00 0.00 H new ATOM 1195 N VAL A 78 -8.055 4.174 0.806 1.00 0.00 N ATOM 1196 CA VAL A 78 -7.426 2.877 0.625 1.00 0.00 C ATOM 1197 C VAL A 78 -8.047 2.179 -0.587 1.00 0.00 C ATOM 1198 O VAL A 78 -7.331 1.707 -1.469 1.00 0.00 O ATOM 1199 CB VAL A 78 -7.540 2.056 1.911 1.00 0.00 C ATOM 1200 CG1 VAL A 78 -6.910 0.673 1.736 1.00 0.00 C ATOM 1201 CG2 VAL A 78 -6.913 2.799 3.093 1.00 0.00 C ATOM 0 H VAL A 78 -8.605 4.265 1.660 1.00 0.00 H new ATOM 0 HA VAL A 78 -6.361 2.994 0.423 1.00 0.00 H new ATOM 0 HB VAL A 78 -8.599 1.916 2.127 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -7.005 0.110 2.665 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -7.421 0.139 0.934 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -5.855 0.783 1.484 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -7.007 2.194 3.995 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -5.858 2.984 2.889 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -7.426 3.750 3.239 1.00 0.00 H new ATOM 1211 N ALA A 79 -9.371 2.136 -0.591 1.00 0.00 N ATOM 1212 CA ALA A 79 -10.096 1.504 -1.680 1.00 0.00 C ATOM 1213 C ALA A 79 -9.506 1.964 -3.015 1.00 0.00 C ATOM 1214 O ALA A 79 -9.203 1.143 -3.880 1.00 0.00 O ATOM 1215 CB ALA A 79 -11.586 1.829 -1.559 1.00 0.00 C ATOM 0 H ALA A 79 -9.961 2.529 0.143 1.00 0.00 H new ATOM 0 HA ALA A 79 -9.994 0.420 -1.630 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -12.129 1.355 -2.376 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -11.964 1.456 -0.607 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -11.728 2.909 -1.607 1.00 0.00 H new ATOM 1221 N GLN A 80 -9.360 3.275 -3.140 1.00 0.00 N ATOM 1222 CA GLN A 80 -8.811 3.854 -4.355 1.00 0.00 C ATOM 1223 C GLN A 80 -7.514 3.142 -4.743 1.00 0.00 C ATOM 1224 O GLN A 80 -7.283 2.862 -5.919 1.00 0.00 O ATOM 1225 CB GLN A 80 -8.584 5.358 -4.191 1.00 0.00 C ATOM 1226 CG GLN A 80 -9.909 6.093 -3.979 1.00 0.00 C ATOM 1227 CD GLN A 80 -9.673 7.576 -3.690 1.00 0.00 C ATOM 1228 OE1 GLN A 80 -8.914 8.254 -4.363 1.00 0.00 O ATOM 1229 NE2 GLN A 80 -10.364 8.042 -2.653 1.00 0.00 N ATOM 0 H GLN A 80 -9.612 3.953 -2.420 1.00 0.00 H new ATOM 0 HA GLN A 80 -9.533 3.715 -5.160 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -7.924 5.539 -3.343 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -8.083 5.752 -5.075 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -10.534 5.987 -4.866 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -10.452 5.639 -3.150 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -10.982 7.421 -2.132 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -10.275 9.021 -2.379 1.00 0.00 H new ATOM 1238 N PHE A 81 -6.701 2.870 -3.733 1.00 0.00 N ATOM 1239 CA PHE A 81 -5.432 2.196 -3.954 1.00 0.00 C ATOM 1240 C PHE A 81 -5.644 0.706 -4.232 1.00 0.00 C ATOM 1241 O PHE A 81 -5.058 0.155 -5.163 1.00 0.00 O ATOM 1242 CB PHE A 81 -4.613 2.352 -2.671 1.00 0.00 C ATOM 1243 CG PHE A 81 -3.755 1.133 -2.329 1.00 0.00 C ATOM 1244 CD1 PHE A 81 -2.914 0.610 -3.261 1.00 0.00 C ATOM 1245 CD2 PHE A 81 -3.833 0.573 -1.092 1.00 0.00 C ATOM 1246 CE1 PHE A 81 -2.117 -0.522 -2.943 1.00 0.00 C ATOM 1247 CE2 PHE A 81 -3.036 -0.559 -0.774 1.00 0.00 C ATOM 1248 CZ PHE A 81 -2.195 -1.082 -1.706 1.00 0.00 C ATOM 0 H PHE A 81 -6.896 3.104 -2.759 1.00 0.00 H new ATOM 0 HA PHE A 81 -4.925 2.631 -4.815 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -3.965 3.223 -2.769 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -5.291 2.551 -1.841 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -2.852 1.055 -4.243 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -4.501 0.989 -0.352 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -1.449 -0.938 -3.683 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -3.098 -1.004 0.208 1.00 0.00 H new ATOM 0 HZ PHE A 81 -1.589 -1.942 -1.464 1.00 0.00 H new ATOM 1258 N LEU A 82 -6.482 0.096 -3.407 1.00 0.00 N ATOM 1259 CA LEU A 82 -6.778 -1.319 -3.552 1.00 0.00 C ATOM 1260 C LEU A 82 -7.145 -1.612 -5.008 1.00 0.00 C ATOM 1261 O LEU A 82 -6.458 -2.377 -5.683 1.00 0.00 O ATOM 1262 CB LEU A 82 -7.852 -1.747 -2.549 1.00 0.00 C ATOM 1263 CG LEU A 82 -7.381 -1.947 -1.107 1.00 0.00 C ATOM 1264 CD1 LEU A 82 -8.560 -2.262 -0.185 1.00 0.00 C ATOM 1265 CD2 LEU A 82 -6.290 -3.017 -1.030 1.00 0.00 C ATOM 0 H LEU A 82 -6.966 0.556 -2.636 1.00 0.00 H new ATOM 0 HA LEU A 82 -5.898 -1.918 -3.318 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -8.643 -0.997 -2.551 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -8.296 -2.679 -2.898 1.00 0.00 H new ATOM 0 HG LEU A 82 -6.940 -1.013 -0.758 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -8.198 -2.400 0.834 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -9.271 -1.437 -0.209 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -9.052 -3.175 -0.522 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -5.973 -3.139 0.006 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -6.681 -3.963 -1.404 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -5.437 -2.712 -1.637 1.00 0.00 H new ATOM 1277 N LYS A 83 -8.227 -0.988 -5.450 1.00 0.00 N ATOM 1278 CA LYS A 83 -8.693 -1.173 -6.814 1.00 0.00 C ATOM 1279 C LYS A 83 -7.544 -0.892 -7.783 1.00 0.00 C ATOM 1280 O LYS A 83 -7.376 -1.601 -8.775 1.00 0.00 O ATOM 1281 CB LYS A 83 -9.939 -0.323 -7.074 1.00 0.00 C ATOM 1282 CG LYS A 83 -10.903 -1.038 -8.022 1.00 0.00 C ATOM 1283 CD LYS A 83 -12.353 -0.652 -7.724 1.00 0.00 C ATOM 1284 CE LYS A 83 -13.228 -0.806 -8.970 1.00 0.00 C ATOM 1285 NZ LYS A 83 -14.415 0.074 -8.881 1.00 0.00 N ATOM 0 H LYS A 83 -8.794 -0.354 -4.888 1.00 0.00 H new ATOM 0 HA LYS A 83 -9.001 -2.206 -6.975 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -10.442 -0.111 -6.131 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -9.647 0.636 -7.502 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -10.660 -0.783 -9.054 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.783 -2.117 -7.923 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -12.743 -1.279 -6.922 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -12.394 0.379 -7.372 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -12.650 -0.558 -9.860 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -13.544 -1.844 -9.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -14.998 -0.042 -9.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -14.974 -0.181 -8.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -14.108 1.065 -8.804 1.00 0.00 H new ATOM 1299 N ALA A 84 -6.781 0.143 -7.463 1.00 0.00 N ATOM 1300 CA ALA A 84 -5.652 0.526 -8.294 1.00 0.00 C ATOM 1301 C ALA A 84 -4.637 -0.619 -8.326 1.00 0.00 C ATOM 1302 O ALA A 84 -4.109 -0.955 -9.385 1.00 0.00 O ATOM 1303 CB ALA A 84 -5.047 1.827 -7.765 1.00 0.00 C ATOM 0 H ALA A 84 -6.922 0.728 -6.640 1.00 0.00 H new ATOM 0 HA ALA A 84 -5.974 0.710 -9.319 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -4.200 2.114 -8.388 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -5.800 2.615 -7.790 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -4.709 1.680 -6.739 1.00 0.00 H new ATOM 1309 N ALA A 85 -4.394 -1.185 -7.153 1.00 0.00 N ATOM 1310 CA ALA A 85 -3.452 -2.284 -7.034 1.00 0.00 C ATOM 1311 C ALA A 85 -3.855 -3.403 -7.997 1.00 0.00 C ATOM 1312 O ALA A 85 -2.998 -4.040 -8.608 1.00 0.00 O ATOM 1313 CB ALA A 85 -3.400 -2.757 -5.580 1.00 0.00 C ATOM 0 H ALA A 85 -4.833 -0.903 -6.277 1.00 0.00 H new ATOM 0 HA ALA A 85 -2.448 -1.960 -7.308 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -2.693 -3.582 -5.491 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -3.080 -1.934 -4.941 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -4.390 -3.093 -5.271 1.00 0.00 H new ATOM 1319 N GLU A 86 -5.160 -3.608 -8.102 1.00 0.00 N ATOM 1320 CA GLU A 86 -5.687 -4.638 -8.980 1.00 0.00 C ATOM 1321 C GLU A 86 -5.228 -4.395 -10.419 1.00 0.00 C ATOM 1322 O GLU A 86 -4.634 -5.274 -11.042 1.00 0.00 O ATOM 1323 CB GLU A 86 -7.213 -4.703 -8.895 1.00 0.00 C ATOM 1324 CG GLU A 86 -7.700 -6.154 -8.876 1.00 0.00 C ATOM 1325 CD GLU A 86 -8.824 -6.368 -9.891 1.00 0.00 C ATOM 1326 OE1 GLU A 86 -8.707 -5.797 -10.997 1.00 0.00 O ATOM 1327 OE2 GLU A 86 -9.775 -7.099 -9.539 1.00 0.00 O ATOM 0 H GLU A 86 -5.868 -3.078 -7.593 1.00 0.00 H new ATOM 0 HA GLU A 86 -5.296 -5.601 -8.653 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -7.553 -4.190 -7.995 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -7.651 -4.180 -9.745 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -6.870 -6.823 -9.101 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -8.054 -6.410 -7.877 1.00 0.00 H new ATOM 1334 N ASP A 87 -5.521 -3.198 -10.906 1.00 0.00 N ATOM 1335 CA ASP A 87 -5.145 -2.828 -12.260 1.00 0.00 C ATOM 1336 C ASP A 87 -3.700 -3.259 -12.520 1.00 0.00 C ATOM 1337 O ASP A 87 -3.425 -3.970 -13.485 1.00 0.00 O ATOM 1338 CB ASP A 87 -5.231 -1.314 -12.461 1.00 0.00 C ATOM 1339 CG ASP A 87 -6.581 -0.805 -12.970 1.00 0.00 C ATOM 1340 OD1 ASP A 87 -7.222 -1.560 -13.732 1.00 0.00 O ATOM 1341 OD2 ASP A 87 -6.941 0.329 -12.584 1.00 0.00 O ATOM 0 H ASP A 87 -6.015 -2.472 -10.387 1.00 0.00 H new ATOM 0 HA ASP A 87 -5.831 -3.322 -12.947 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.009 -0.824 -11.513 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -4.456 -1.012 -13.166 1.00 0.00 H new ATOM 1346 N TYR A 88 -2.816 -2.810 -11.641 1.00 0.00 N ATOM 1347 CA TYR A 88 -1.406 -3.140 -11.763 1.00 0.00 C ATOM 1348 C TYR A 88 -1.220 -4.573 -12.267 1.00 0.00 C ATOM 1349 O TYR A 88 -0.293 -4.852 -13.025 1.00 0.00 O ATOM 1350 CB TYR A 88 -0.823 -3.028 -10.353 1.00 0.00 C ATOM 1351 CG TYR A 88 0.681 -2.747 -10.322 1.00 0.00 C ATOM 1352 CD1 TYR A 88 1.186 -1.625 -10.946 1.00 0.00 C ATOM 1353 CD2 TYR A 88 1.531 -3.617 -9.671 1.00 0.00 C ATOM 1354 CE1 TYR A 88 2.602 -1.361 -10.916 1.00 0.00 C ATOM 1355 CE2 TYR A 88 2.947 -3.353 -9.642 1.00 0.00 C ATOM 1356 CZ TYR A 88 3.412 -2.238 -10.266 1.00 0.00 C ATOM 1357 OH TYR A 88 4.749 -1.989 -10.238 1.00 0.00 O ATOM 0 H TYR A 88 -3.049 -2.221 -10.842 1.00 0.00 H new ATOM 0 HA TYR A 88 -0.916 -2.473 -12.472 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -1.342 -2.232 -9.818 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -1.020 -3.955 -9.815 1.00 0.00 H new ATOM 0 HD1 TYR A 88 0.520 -0.945 -11.457 1.00 0.00 H new ATOM 0 HD2 TYR A 88 1.135 -4.496 -9.183 1.00 0.00 H new ATOM 0 HE1 TYR A 88 3.011 -0.486 -11.399 1.00 0.00 H new ATOM 0 HE2 TYR A 88 3.624 -4.026 -9.136 1.00 0.00 H new ATOM 0 HH TYR A 88 4.902 -1.022 -10.268 1.00 0.00 H new ATOM 1367 N GLY A 89 -2.116 -5.442 -11.825 1.00 0.00 N ATOM 1368 CA GLY A 89 -2.062 -6.839 -12.221 1.00 0.00 C ATOM 1369 C GLY A 89 -2.441 -7.755 -11.055 1.00 0.00 C ATOM 1370 O GLY A 89 -2.710 -8.939 -11.253 1.00 0.00 O ATOM 0 H GLY A 89 -2.884 -5.206 -11.196 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -2.740 -7.010 -13.057 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -1.058 -7.084 -12.569 1.00 0.00 H new ATOM 1374 N VAL A 90 -2.452 -7.172 -9.866 1.00 0.00 N ATOM 1375 CA VAL A 90 -2.793 -7.920 -8.668 1.00 0.00 C ATOM 1376 C VAL A 90 -4.086 -8.703 -8.912 1.00 0.00 C ATOM 1377 O VAL A 90 -4.932 -8.280 -9.699 1.00 0.00 O ATOM 1378 CB VAL A 90 -2.884 -6.975 -7.468 1.00 0.00 C ATOM 1379 CG1 VAL A 90 -3.381 -7.715 -6.224 1.00 0.00 C ATOM 1380 CG2 VAL A 90 -1.539 -6.296 -7.203 1.00 0.00 C ATOM 0 H VAL A 90 -2.230 -6.189 -9.706 1.00 0.00 H new ATOM 0 HA VAL A 90 -2.012 -8.644 -8.435 1.00 0.00 H new ATOM 0 HB VAL A 90 -3.610 -6.198 -7.707 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -3.437 -7.021 -5.386 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -4.370 -8.129 -6.418 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -2.691 -8.523 -5.981 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -1.631 -5.630 -6.345 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.784 -7.054 -6.995 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -1.243 -5.720 -8.080 1.00 0.00 H new ATOM 1390 N ILE A 91 -4.197 -9.829 -8.223 1.00 0.00 N ATOM 1391 CA ILE A 91 -5.372 -10.674 -8.355 1.00 0.00 C ATOM 1392 C ILE A 91 -6.353 -10.356 -7.225 1.00 0.00 C ATOM 1393 O ILE A 91 -6.164 -9.390 -6.487 1.00 0.00 O ATOM 1394 CB ILE A 91 -4.967 -12.148 -8.422 1.00 0.00 C ATOM 1395 CG1 ILE A 91 -3.969 -12.492 -7.314 1.00 0.00 C ATOM 1396 CG2 ILE A 91 -4.431 -12.507 -9.809 1.00 0.00 C ATOM 1397 CD1 ILE A 91 -3.658 -13.990 -7.304 1.00 0.00 C ATOM 0 H ILE A 91 -3.493 -10.176 -7.572 1.00 0.00 H new ATOM 0 HA ILE A 91 -5.888 -10.466 -9.293 1.00 0.00 H new ATOM 0 HB ILE A 91 -5.856 -12.755 -8.255 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -3.049 -11.927 -7.460 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -4.376 -12.195 -6.348 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -4.150 -13.560 -9.829 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -5.203 -12.323 -10.556 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -3.557 -11.894 -10.031 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -2.947 -14.209 -6.508 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -4.577 -14.551 -7.134 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -3.229 -14.279 -8.263 1.00 0.00 H new ATOM 1409 N LYS A 92 -7.381 -11.186 -7.126 1.00 0.00 N ATOM 1410 CA LYS A 92 -8.392 -11.005 -6.099 1.00 0.00 C ATOM 1411 C LYS A 92 -8.147 -12.005 -4.967 1.00 0.00 C ATOM 1412 O LYS A 92 -8.894 -12.037 -3.990 1.00 0.00 O ATOM 1413 CB LYS A 92 -9.794 -11.095 -6.705 1.00 0.00 C ATOM 1414 CG LYS A 92 -10.264 -9.727 -7.204 1.00 0.00 C ATOM 1415 CD LYS A 92 -11.445 -9.216 -6.375 1.00 0.00 C ATOM 1416 CE LYS A 92 -12.760 -9.832 -6.858 1.00 0.00 C ATOM 1417 NZ LYS A 92 -13.846 -8.827 -6.820 1.00 0.00 N ATOM 0 H LYS A 92 -7.535 -11.986 -7.740 1.00 0.00 H new ATOM 0 HA LYS A 92 -8.320 -10.007 -5.666 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -9.792 -11.806 -7.531 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -10.493 -11.474 -5.959 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -9.441 -9.014 -7.149 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -10.555 -9.799 -8.252 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -11.289 -9.460 -5.324 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -11.500 -8.130 -6.445 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -12.641 -10.209 -7.874 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -13.022 -10.684 -6.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -14.732 -9.260 -7.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -13.970 -8.487 -5.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -13.600 -8.027 -7.437 1.00 0.00 H new ATOM 1431 N THR A 93 -7.098 -12.796 -5.136 1.00 0.00 N ATOM 1432 CA THR A 93 -6.745 -13.794 -4.140 1.00 0.00 C ATOM 1433 C THR A 93 -5.599 -13.289 -3.261 1.00 0.00 C ATOM 1434 O THR A 93 -5.304 -13.876 -2.222 1.00 0.00 O ATOM 1435 CB THR A 93 -6.420 -15.098 -4.872 1.00 0.00 C ATOM 1436 OG1 THR A 93 -5.101 -14.896 -5.372 1.00 0.00 O ATOM 1437 CG2 THR A 93 -7.270 -15.291 -6.130 1.00 0.00 C ATOM 0 H THR A 93 -6.481 -12.766 -5.948 1.00 0.00 H new ATOM 0 HA THR A 93 -7.575 -13.984 -3.460 1.00 0.00 H new ATOM 0 HB THR A 93 -6.573 -15.941 -4.198 1.00 0.00 H new ATOM 0 HG1 THR A 93 -4.749 -15.743 -5.718 1.00 0.00 H new ATOM 0 HG21 THR A 93 -6.999 -16.231 -6.611 1.00 0.00 H new ATOM 0 HG22 THR A 93 -8.325 -15.314 -5.856 1.00 0.00 H new ATOM 0 HG23 THR A 93 -7.092 -14.466 -6.820 1.00 0.00 H new ATOM 1445 N ASP A 94 -4.985 -12.205 -3.711 1.00 0.00 N ATOM 1446 CA ASP A 94 -3.878 -11.614 -2.979 1.00 0.00 C ATOM 1447 C ASP A 94 -4.334 -10.295 -2.351 1.00 0.00 C ATOM 1448 O ASP A 94 -3.642 -9.736 -1.501 1.00 0.00 O ATOM 1449 CB ASP A 94 -2.700 -11.313 -3.908 1.00 0.00 C ATOM 1450 CG ASP A 94 -3.070 -10.597 -5.209 1.00 0.00 C ATOM 1451 OD1 ASP A 94 -4.249 -10.198 -5.322 1.00 0.00 O ATOM 1452 OD2 ASP A 94 -2.164 -10.465 -6.061 1.00 0.00 O ATOM 0 H ASP A 94 -5.233 -11.720 -4.574 1.00 0.00 H new ATOM 0 HA ASP A 94 -3.562 -12.324 -2.215 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -1.977 -10.702 -3.367 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -2.203 -12.251 -4.156 1.00 0.00 H new ATOM 1457 N MET A 95 -5.495 -9.835 -2.794 1.00 0.00 N ATOM 1458 CA MET A 95 -6.051 -8.593 -2.287 1.00 0.00 C ATOM 1459 C MET A 95 -6.760 -8.816 -0.950 1.00 0.00 C ATOM 1460 O MET A 95 -7.346 -9.873 -0.722 1.00 0.00 O ATOM 1461 CB MET A 95 -7.043 -8.024 -3.303 1.00 0.00 C ATOM 1462 CG MET A 95 -6.312 -7.408 -4.498 1.00 0.00 C ATOM 1463 SD MET A 95 -5.524 -5.882 -4.010 1.00 0.00 S ATOM 1464 CE MET A 95 -6.827 -4.724 -4.397 1.00 0.00 C ATOM 0 H MET A 95 -6.066 -10.301 -3.499 1.00 0.00 H new ATOM 0 HA MET A 95 -5.234 -7.888 -2.131 1.00 0.00 H new ATOM 0 HB2 MET A 95 -7.709 -8.815 -3.648 1.00 0.00 H new ATOM 0 HB3 MET A 95 -7.666 -7.268 -2.824 1.00 0.00 H new ATOM 0 HG2 MET A 95 -5.567 -8.106 -4.879 1.00 0.00 H new ATOM 0 HG3 MET A 95 -7.016 -7.220 -5.309 1.00 0.00 H new ATOM 0 HE1 MET A 95 -6.592 -3.753 -3.961 1.00 0.00 H new ATOM 0 HE2 MET A 95 -6.916 -4.624 -5.479 1.00 0.00 H new ATOM 0 HE3 MET A 95 -7.770 -5.087 -3.987 1.00 0.00 H new ATOM 1474 N PHE A 96 -6.685 -7.802 -0.100 1.00 0.00 N ATOM 1475 CA PHE A 96 -7.312 -7.874 1.209 1.00 0.00 C ATOM 1476 C PHE A 96 -8.506 -6.921 1.297 1.00 0.00 C ATOM 1477 O PHE A 96 -8.858 -6.268 0.316 1.00 0.00 O ATOM 1478 CB PHE A 96 -6.259 -7.450 2.234 1.00 0.00 C ATOM 1479 CG PHE A 96 -5.752 -6.018 2.049 1.00 0.00 C ATOM 1480 CD1 PHE A 96 -6.569 -4.966 2.326 1.00 0.00 C ATOM 1481 CD2 PHE A 96 -4.484 -5.797 1.609 1.00 0.00 C ATOM 1482 CE1 PHE A 96 -6.098 -3.637 2.154 1.00 0.00 C ATOM 1483 CE2 PHE A 96 -4.014 -4.469 1.438 1.00 0.00 C ATOM 1484 CZ PHE A 96 -4.830 -3.417 1.714 1.00 0.00 C ATOM 0 H PHE A 96 -6.199 -6.926 -0.292 1.00 0.00 H new ATOM 0 HA PHE A 96 -7.674 -8.886 1.393 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -6.680 -7.549 3.235 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -5.413 -8.135 2.175 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -7.575 -5.141 2.677 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -3.835 -6.632 1.390 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -6.747 -2.802 2.373 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -3.007 -4.294 1.088 1.00 0.00 H new ATOM 0 HZ PHE A 96 -4.471 -2.407 1.584 1.00 0.00 H new ATOM 1494 N GLN A 97 -9.096 -6.871 2.482 1.00 0.00 N ATOM 1495 CA GLN A 97 -10.243 -6.009 2.712 1.00 0.00 C ATOM 1496 C GLN A 97 -9.812 -4.734 3.439 1.00 0.00 C ATOM 1497 O GLN A 97 -9.057 -4.793 4.409 1.00 0.00 O ATOM 1498 CB GLN A 97 -11.334 -6.743 3.494 1.00 0.00 C ATOM 1499 CG GLN A 97 -12.183 -7.613 2.565 1.00 0.00 C ATOM 1500 CD GLN A 97 -13.652 -7.600 2.992 1.00 0.00 C ATOM 1501 OE1 GLN A 97 -13.984 -7.612 4.166 1.00 0.00 O ATOM 1502 NE2 GLN A 97 -14.511 -7.574 1.976 1.00 0.00 N ATOM 0 H GLN A 97 -8.801 -7.414 3.294 1.00 0.00 H new ATOM 0 HA GLN A 97 -10.661 -5.729 1.745 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -10.878 -7.365 4.265 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -11.971 -6.020 4.003 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -12.095 -7.251 1.541 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -11.807 -8.636 2.575 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -14.166 -7.565 1.016 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -15.515 -7.563 2.157 1.00 0.00 H new ATOM 1511 N THR A 98 -10.309 -3.610 2.942 1.00 0.00 N ATOM 1512 CA THR A 98 -9.984 -2.323 3.533 1.00 0.00 C ATOM 1513 C THR A 98 -9.931 -2.434 5.058 1.00 0.00 C ATOM 1514 O THR A 98 -9.082 -1.817 5.699 1.00 0.00 O ATOM 1515 CB THR A 98 -11.008 -1.302 3.033 1.00 0.00 C ATOM 1516 OG1 THR A 98 -10.782 -1.243 1.627 1.00 0.00 O ATOM 1517 CG2 THR A 98 -10.705 0.117 3.519 1.00 0.00 C ATOM 0 H THR A 98 -10.934 -3.564 2.137 1.00 0.00 H new ATOM 0 HA THR A 98 -8.993 -1.987 3.229 1.00 0.00 H new ATOM 0 HB THR A 98 -12.004 -1.595 3.365 1.00 0.00 H new ATOM 0 HG1 THR A 98 -11.406 -0.605 1.222 1.00 0.00 H new ATOM 0 HG21 THR A 98 -11.461 0.802 3.136 1.00 0.00 H new ATOM 0 HG22 THR A 98 -10.715 0.138 4.609 1.00 0.00 H new ATOM 0 HG23 THR A 98 -9.723 0.423 3.159 1.00 0.00 H new ATOM 1525 N VAL A 99 -10.848 -3.225 5.594 1.00 0.00 N ATOM 1526 CA VAL A 99 -10.916 -3.425 7.032 1.00 0.00 C ATOM 1527 C VAL A 99 -9.675 -4.191 7.495 1.00 0.00 C ATOM 1528 O VAL A 99 -8.985 -3.761 8.417 1.00 0.00 O ATOM 1529 CB VAL A 99 -12.225 -4.127 7.401 1.00 0.00 C ATOM 1530 CG1 VAL A 99 -12.177 -5.609 7.023 1.00 0.00 C ATOM 1531 CG2 VAL A 99 -12.541 -3.950 8.887 1.00 0.00 C ATOM 0 H VAL A 99 -11.550 -3.735 5.059 1.00 0.00 H new ATOM 0 HA VAL A 99 -10.919 -2.467 7.552 1.00 0.00 H new ATOM 0 HB VAL A 99 -13.028 -3.661 6.830 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -13.119 -6.085 7.296 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -12.019 -5.706 5.949 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -11.358 -6.094 7.555 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -13.476 -4.458 9.123 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -11.735 -4.377 9.484 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -12.638 -2.888 9.115 1.00 0.00 H new ATOM 1541 N ASP A 100 -9.430 -5.313 6.834 1.00 0.00 N ATOM 1542 CA ASP A 100 -8.285 -6.142 7.167 1.00 0.00 C ATOM 1543 C ASP A 100 -7.079 -5.247 7.459 1.00 0.00 C ATOM 1544 O ASP A 100 -6.206 -5.611 8.245 1.00 0.00 O ATOM 1545 CB ASP A 100 -7.917 -7.066 6.004 1.00 0.00 C ATOM 1546 CG ASP A 100 -8.954 -8.144 5.681 1.00 0.00 C ATOM 1547 OD1 ASP A 100 -9.653 -8.561 6.630 1.00 0.00 O ATOM 1548 OD2 ASP A 100 -9.023 -8.527 4.493 1.00 0.00 O ATOM 0 H ASP A 100 -10.005 -5.667 6.070 1.00 0.00 H new ATOM 0 HA ASP A 100 -8.547 -6.744 8.037 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -7.757 -6.458 5.113 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -6.969 -7.552 6.232 1.00 0.00 H new ATOM 1553 N LEU A 101 -7.070 -4.091 6.810 1.00 0.00 N ATOM 1554 CA LEU A 101 -5.986 -3.141 6.990 1.00 0.00 C ATOM 1555 C LEU A 101 -6.434 -2.040 7.954 1.00 0.00 C ATOM 1556 O LEU A 101 -5.868 -1.888 9.035 1.00 0.00 O ATOM 1557 CB LEU A 101 -5.504 -2.615 5.637 1.00 0.00 C ATOM 1558 CG LEU A 101 -4.690 -1.320 5.672 1.00 0.00 C ATOM 1559 CD1 LEU A 101 -3.482 -1.457 6.601 1.00 0.00 C ATOM 1560 CD2 LEU A 101 -4.282 -0.891 4.261 1.00 0.00 C ATOM 0 H LEU A 101 -7.796 -3.792 6.159 1.00 0.00 H new ATOM 0 HA LEU A 101 -5.122 -3.629 7.442 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -4.899 -3.388 5.164 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -6.374 -2.457 5.000 1.00 0.00 H new ATOM 0 HG LEU A 101 -5.321 -0.530 6.079 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -2.920 -0.523 6.608 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -3.824 -1.682 7.611 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -2.840 -2.264 6.247 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -3.705 0.032 4.314 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -3.675 -1.673 3.804 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.175 -0.726 3.658 1.00 0.00 H new ATOM 1572 N TYR A 102 -7.446 -1.299 7.526 1.00 0.00 N ATOM 1573 CA TYR A 102 -7.976 -0.217 8.338 1.00 0.00 C ATOM 1574 C TYR A 102 -8.090 -0.636 9.805 1.00 0.00 C ATOM 1575 O TYR A 102 -7.526 0.013 10.685 1.00 0.00 O ATOM 1576 CB TYR A 102 -9.376 0.072 7.792 1.00 0.00 C ATOM 1577 CG TYR A 102 -10.001 1.360 8.333 1.00 0.00 C ATOM 1578 CD1 TYR A 102 -9.330 2.559 8.206 1.00 0.00 C ATOM 1579 CD2 TYR A 102 -11.236 1.322 8.948 1.00 0.00 C ATOM 1580 CE1 TYR A 102 -9.918 3.771 8.715 1.00 0.00 C ATOM 1581 CE2 TYR A 102 -11.824 2.534 9.457 1.00 0.00 C ATOM 1582 CZ TYR A 102 -11.136 3.699 9.315 1.00 0.00 C ATOM 1583 OH TYR A 102 -11.692 4.843 9.796 1.00 0.00 O ATOM 0 H TYR A 102 -7.913 -1.427 6.628 1.00 0.00 H new ATOM 0 HA TYR A 102 -7.321 0.653 8.293 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -9.325 0.134 6.705 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -10.029 -0.766 8.034 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -8.364 2.588 7.725 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -11.761 0.384 9.047 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -9.403 4.716 8.622 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -12.790 2.518 9.941 1.00 0.00 H new ATOM 0 HH TYR A 102 -11.056 5.582 9.698 1.00 0.00 H new ATOM 1593 N GLU A 103 -8.823 -1.718 10.023 1.00 0.00 N ATOM 1594 CA GLU A 103 -9.018 -2.231 11.368 1.00 0.00 C ATOM 1595 C GLU A 103 -8.077 -3.410 11.628 1.00 0.00 C ATOM 1596 O GLU A 103 -8.331 -4.227 12.511 1.00 0.00 O ATOM 1597 CB GLU A 103 -10.476 -2.632 11.596 1.00 0.00 C ATOM 1598 CG GLU A 103 -11.412 -1.440 11.390 1.00 0.00 C ATOM 1599 CD GLU A 103 -11.874 -0.867 12.731 1.00 0.00 C ATOM 1600 OE1 GLU A 103 -12.781 -1.484 13.330 1.00 0.00 O ATOM 1601 OE2 GLU A 103 -11.309 0.176 13.127 1.00 0.00 O ATOM 0 H GLU A 103 -9.289 -2.253 9.291 1.00 0.00 H new ATOM 0 HA GLU A 103 -8.779 -1.438 12.077 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -10.747 -3.435 10.910 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -10.596 -3.022 12.607 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -10.901 -0.667 10.817 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -12.278 -1.750 10.805 1.00 0.00 H new ATOM 1608 N GLY A 104 -7.012 -3.460 10.842 1.00 0.00 N ATOM 1609 CA GLY A 104 -6.033 -4.525 10.975 1.00 0.00 C ATOM 1610 C GLY A 104 -6.713 -5.859 11.288 1.00 0.00 C ATOM 1611 O GLY A 104 -6.130 -6.718 11.947 1.00 0.00 O ATOM 0 H GLY A 104 -6.806 -2.780 10.110 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -5.459 -4.613 10.053 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -5.327 -4.278 11.768 1.00 0.00 H new ATOM 1615 N LYS A 105 -7.938 -5.991 10.800 1.00 0.00 N ATOM 1616 CA LYS A 105 -8.704 -7.206 11.019 1.00 0.00 C ATOM 1617 C LYS A 105 -7.845 -8.418 10.652 1.00 0.00 C ATOM 1618 O LYS A 105 -8.025 -9.501 11.206 1.00 0.00 O ATOM 1619 CB LYS A 105 -10.034 -7.144 10.265 1.00 0.00 C ATOM 1620 CG LYS A 105 -11.178 -6.755 11.204 1.00 0.00 C ATOM 1621 CD LYS A 105 -12.155 -7.918 11.388 1.00 0.00 C ATOM 1622 CE LYS A 105 -13.502 -7.424 11.918 1.00 0.00 C ATOM 1623 NZ LYS A 105 -14.207 -8.509 12.637 1.00 0.00 N ATOM 0 H LYS A 105 -8.419 -5.276 10.254 1.00 0.00 H new ATOM 0 HA LYS A 105 -8.966 -7.307 12.072 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -9.963 -6.420 9.453 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -10.244 -8.112 9.811 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -10.774 -6.458 12.172 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -11.707 -5.891 10.801 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -12.300 -8.430 10.437 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -11.733 -8.646 12.080 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -13.348 -6.577 12.587 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -14.117 -7.069 11.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -15.119 -8.156 12.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -14.371 -9.305 11.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -13.626 -8.829 13.438 1.00 0.00 H new ATOM 1637 N ASP A 106 -6.930 -8.195 9.720 1.00 0.00 N ATOM 1638 CA ASP A 106 -6.043 -9.255 9.273 1.00 0.00 C ATOM 1639 C ASP A 106 -4.818 -8.638 8.595 1.00 0.00 C ATOM 1640 O ASP A 106 -4.885 -8.228 7.438 1.00 0.00 O ATOM 1641 CB ASP A 106 -6.738 -10.163 8.257 1.00 0.00 C ATOM 1642 CG ASP A 106 -7.313 -11.458 8.833 1.00 0.00 C ATOM 1643 OD1 ASP A 106 -6.603 -12.077 9.656 1.00 0.00 O ATOM 1644 OD2 ASP A 106 -8.448 -11.801 8.438 1.00 0.00 O ATOM 0 H ASP A 106 -6.784 -7.295 9.262 1.00 0.00 H new ATOM 0 HA ASP A 106 -5.755 -9.843 10.145 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -7.545 -9.603 7.785 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -6.025 -10.417 7.472 1.00 0.00 H new ATOM 1649 N MET A 107 -3.727 -8.590 9.346 1.00 0.00 N ATOM 1650 CA MET A 107 -2.489 -8.030 8.832 1.00 0.00 C ATOM 1651 C MET A 107 -1.892 -8.924 7.744 1.00 0.00 C ATOM 1652 O MET A 107 -1.477 -8.437 6.693 1.00 0.00 O ATOM 1653 CB MET A 107 -1.484 -7.877 9.976 1.00 0.00 C ATOM 1654 CG MET A 107 -1.867 -6.711 10.890 1.00 0.00 C ATOM 1655 SD MET A 107 -0.682 -5.387 10.719 1.00 0.00 S ATOM 1656 CE MET A 107 -1.475 -4.424 9.443 1.00 0.00 C ATOM 0 H MET A 107 -3.675 -8.930 10.306 1.00 0.00 H new ATOM 0 HA MET A 107 -2.707 -7.055 8.395 1.00 0.00 H new ATOM 0 HB2 MET A 107 -1.444 -8.800 10.555 1.00 0.00 H new ATOM 0 HB3 MET A 107 -0.486 -7.712 9.569 1.00 0.00 H new ATOM 0 HG2 MET A 107 -2.865 -6.352 10.637 1.00 0.00 H new ATOM 0 HG3 MET A 107 -1.902 -7.047 11.926 1.00 0.00 H new ATOM 0 HE1 MET A 107 -0.973 -3.461 9.349 1.00 0.00 H new ATOM 0 HE2 MET A 107 -1.416 -4.958 8.495 1.00 0.00 H new ATOM 0 HE3 MET A 107 -2.521 -4.264 9.705 1.00 0.00 H new ATOM 1666 N ALA A 108 -1.868 -10.217 8.033 1.00 0.00 N ATOM 1667 CA ALA A 108 -1.329 -11.184 7.092 1.00 0.00 C ATOM 1668 C ALA A 108 -1.792 -10.826 5.678 1.00 0.00 C ATOM 1669 O ALA A 108 -0.986 -10.781 4.750 1.00 0.00 O ATOM 1670 CB ALA A 108 -1.757 -12.593 7.506 1.00 0.00 C ATOM 0 H ALA A 108 -2.213 -10.617 8.905 1.00 0.00 H new ATOM 0 HA ALA A 108 -0.239 -11.159 7.099 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -1.353 -13.318 6.800 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -1.379 -12.809 8.505 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -2.845 -12.657 7.508 1.00 0.00 H new ATOM 1676 N ALA A 109 -3.088 -10.581 5.558 1.00 0.00 N ATOM 1677 CA ALA A 109 -3.668 -10.228 4.274 1.00 0.00 C ATOM 1678 C ALA A 109 -2.982 -8.970 3.737 1.00 0.00 C ATOM 1679 O ALA A 109 -2.431 -8.980 2.638 1.00 0.00 O ATOM 1680 CB ALA A 109 -5.179 -10.048 4.427 1.00 0.00 C ATOM 0 H ALA A 109 -3.754 -10.620 6.330 1.00 0.00 H new ATOM 0 HA ALA A 109 -3.507 -11.026 3.549 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -5.613 -9.783 3.463 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -5.622 -10.979 4.781 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -5.380 -9.254 5.146 1.00 0.00 H new ATOM 1686 N VAL A 110 -3.038 -7.917 4.540 1.00 0.00 N ATOM 1687 CA VAL A 110 -2.429 -6.654 4.159 1.00 0.00 C ATOM 1688 C VAL A 110 -1.094 -6.925 3.464 1.00 0.00 C ATOM 1689 O VAL A 110 -0.713 -6.206 2.541 1.00 0.00 O ATOM 1690 CB VAL A 110 -2.292 -5.749 5.386 1.00 0.00 C ATOM 1691 CG1 VAL A 110 -1.648 -4.412 5.012 1.00 0.00 C ATOM 1692 CG2 VAL A 110 -3.646 -5.535 6.064 1.00 0.00 C ATOM 0 H VAL A 110 -3.495 -7.913 5.452 1.00 0.00 H new ATOM 0 HA VAL A 110 -3.063 -6.123 3.448 1.00 0.00 H new ATOM 0 HB VAL A 110 -1.636 -6.249 6.099 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -1.562 -3.788 5.902 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.656 -4.590 4.596 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -2.266 -3.905 4.271 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -3.520 -4.889 6.933 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -4.335 -5.068 5.361 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -4.049 -6.496 6.383 1.00 0.00 H new ATOM 1702 N GLN A 111 -0.419 -7.964 3.934 1.00 0.00 N ATOM 1703 CA GLN A 111 0.866 -8.339 3.368 1.00 0.00 C ATOM 1704 C GLN A 111 0.667 -9.110 2.062 1.00 0.00 C ATOM 1705 O GLN A 111 1.274 -8.782 1.044 1.00 0.00 O ATOM 1706 CB GLN A 111 1.687 -9.156 4.368 1.00 0.00 C ATOM 1707 CG GLN A 111 2.237 -8.265 5.484 1.00 0.00 C ATOM 1708 CD GLN A 111 2.802 -9.107 6.630 1.00 0.00 C ATOM 1709 OE1 GLN A 111 2.166 -10.016 7.138 1.00 0.00 O ATOM 1710 NE2 GLN A 111 4.028 -8.756 7.006 1.00 0.00 N ATOM 0 H GLN A 111 -0.738 -8.558 4.700 1.00 0.00 H new ATOM 0 HA GLN A 111 1.424 -7.429 3.147 1.00 0.00 H new ATOM 0 HB2 GLN A 111 1.066 -9.942 4.798 1.00 0.00 H new ATOM 0 HB3 GLN A 111 2.511 -9.648 3.851 1.00 0.00 H new ATOM 0 HG2 GLN A 111 3.017 -7.617 5.085 1.00 0.00 H new ATOM 0 HG3 GLN A 111 1.445 -7.617 5.860 1.00 0.00 H new ATOM 0 HE21 GLN A 111 4.504 -7.985 6.538 1.00 0.00 H new ATOM 0 HE22 GLN A 111 4.493 -9.258 7.763 1.00 0.00 H new ATOM 1719 N ARG A 112 -0.187 -10.121 2.134 1.00 0.00 N ATOM 1720 CA ARG A 112 -0.475 -10.942 0.970 1.00 0.00 C ATOM 1721 C ARG A 112 -0.662 -10.061 -0.267 1.00 0.00 C ATOM 1722 O ARG A 112 -0.324 -10.466 -1.379 1.00 0.00 O ATOM 1723 CB ARG A 112 -1.735 -11.782 1.185 1.00 0.00 C ATOM 1724 CG ARG A 112 -1.451 -13.267 0.954 1.00 0.00 C ATOM 1725 CD ARG A 112 -2.547 -13.909 0.101 1.00 0.00 C ATOM 1726 NE ARG A 112 -1.941 -14.642 -1.033 1.00 0.00 N ATOM 1727 CZ ARG A 112 -2.598 -15.534 -1.787 1.00 0.00 C ATOM 1728 NH1 ARG A 112 -3.884 -15.809 -1.533 1.00 0.00 N ATOM 1729 NH2 ARG A 112 -1.968 -16.152 -2.795 1.00 0.00 N ATOM 0 H ARG A 112 -0.689 -10.390 2.980 1.00 0.00 H new ATOM 0 HA ARG A 112 0.372 -11.612 0.819 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -2.107 -11.633 2.199 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -2.519 -11.448 0.505 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -0.486 -13.384 0.461 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -1.383 -13.781 1.913 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -3.141 -14.591 0.710 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -3.225 -13.142 -0.272 1.00 0.00 H new ATOM 0 HE ARG A 112 -0.963 -14.457 -1.254 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -4.364 -15.339 -0.765 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -4.383 -16.488 -2.107 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -0.988 -15.944 -2.988 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -2.468 -16.831 -3.369 1.00 0.00 H new ATOM 1743 N THR A 113 -1.200 -8.874 -0.033 1.00 0.00 N ATOM 1744 CA THR A 113 -1.437 -7.933 -1.115 1.00 0.00 C ATOM 1745 C THR A 113 -0.112 -7.357 -1.620 1.00 0.00 C ATOM 1746 O THR A 113 0.289 -7.617 -2.754 1.00 0.00 O ATOM 1747 CB THR A 113 -2.409 -6.865 -0.608 1.00 0.00 C ATOM 1748 OG1 THR A 113 -3.675 -7.518 -0.614 1.00 0.00 O ATOM 1749 CG2 THR A 113 -2.580 -5.711 -1.599 1.00 0.00 C ATOM 0 H THR A 113 -1.479 -8.542 0.890 1.00 0.00 H new ATOM 0 HA THR A 113 -1.891 -8.425 -1.975 1.00 0.00 H new ATOM 0 HB THR A 113 -2.054 -6.475 0.346 1.00 0.00 H new ATOM 0 HG1 THR A 113 -3.549 -8.477 -0.456 1.00 0.00 H new ATOM 0 HG21 THR A 113 -3.279 -4.981 -1.191 1.00 0.00 H new ATOM 0 HG22 THR A 113 -1.616 -5.233 -1.770 1.00 0.00 H new ATOM 0 HG23 THR A 113 -2.967 -6.096 -2.543 1.00 0.00 H new ATOM 1757 N LEU A 114 0.530 -6.587 -0.755 1.00 0.00 N ATOM 1758 CA LEU A 114 1.801 -5.973 -1.100 1.00 0.00 C ATOM 1759 C LEU A 114 2.716 -7.024 -1.732 1.00 0.00 C ATOM 1760 O LEU A 114 3.323 -6.779 -2.773 1.00 0.00 O ATOM 1761 CB LEU A 114 2.411 -5.281 0.121 1.00 0.00 C ATOM 1762 CG LEU A 114 1.579 -4.156 0.740 1.00 0.00 C ATOM 1763 CD1 LEU A 114 1.984 -3.910 2.195 1.00 0.00 C ATOM 1764 CD2 LEU A 114 1.668 -2.882 -0.103 1.00 0.00 C ATOM 0 H LEU A 114 0.194 -6.374 0.184 1.00 0.00 H new ATOM 0 HA LEU A 114 1.655 -5.189 -1.843 1.00 0.00 H new ATOM 0 HB2 LEU A 114 2.594 -6.034 0.887 1.00 0.00 H new ATOM 0 HB3 LEU A 114 3.381 -4.874 -0.164 1.00 0.00 H new ATOM 0 HG LEU A 114 0.534 -4.467 0.746 1.00 0.00 H new ATOM 0 HD11 LEU A 114 1.377 -3.106 2.611 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.827 -4.819 2.775 1.00 0.00 H new ATOM 0 HD13 LEU A 114 3.036 -3.629 2.237 1.00 0.00 H new ATOM 0 HD21 LEU A 114 1.068 -2.098 0.358 1.00 0.00 H new ATOM 0 HD22 LEU A 114 2.707 -2.557 -0.162 1.00 0.00 H new ATOM 0 HD23 LEU A 114 1.293 -3.083 -1.107 1.00 0.00 H new ATOM 1776 N MET A 115 2.786 -8.173 -1.075 1.00 0.00 N ATOM 1777 CA MET A 115 3.616 -9.262 -1.560 1.00 0.00 C ATOM 1778 C MET A 115 3.446 -9.452 -3.068 1.00 0.00 C ATOM 1779 O MET A 115 4.400 -9.794 -3.766 1.00 0.00 O ATOM 1780 CB MET A 115 3.236 -10.555 -0.836 1.00 0.00 C ATOM 1781 CG MET A 115 4.200 -10.842 0.318 1.00 0.00 C ATOM 1782 SD MET A 115 5.106 -12.346 -0.003 1.00 0.00 S ATOM 1783 CE MET A 115 6.759 -11.688 -0.142 1.00 0.00 C ATOM 0 H MET A 115 2.282 -8.373 -0.211 1.00 0.00 H new ATOM 0 HA MET A 115 4.659 -9.016 -1.360 1.00 0.00 H new ATOM 0 HB2 MET A 115 2.218 -10.476 -0.453 1.00 0.00 H new ATOM 0 HB3 MET A 115 3.248 -11.387 -1.540 1.00 0.00 H new ATOM 0 HG2 MET A 115 4.893 -10.009 0.440 1.00 0.00 H new ATOM 0 HG3 MET A 115 3.645 -10.934 1.252 1.00 0.00 H new ATOM 0 HE1 MET A 115 7.302 -12.229 -0.917 1.00 0.00 H new ATOM 0 HE2 MET A 115 6.709 -10.631 -0.405 1.00 0.00 H new ATOM 0 HE3 MET A 115 7.277 -11.801 0.811 1.00 0.00 H new ATOM 1793 N ALA A 116 2.224 -9.222 -3.527 1.00 0.00 N ATOM 1794 CA ALA A 116 1.917 -9.364 -4.940 1.00 0.00 C ATOM 1795 C ALA A 116 2.279 -8.068 -5.669 1.00 0.00 C ATOM 1796 O ALA A 116 2.914 -8.101 -6.722 1.00 0.00 O ATOM 1797 CB ALA A 116 0.442 -9.734 -5.107 1.00 0.00 C ATOM 0 H ALA A 116 1.436 -8.938 -2.945 1.00 0.00 H new ATOM 0 HA ALA A 116 2.507 -10.167 -5.382 1.00 0.00 H new ATOM 0 HB1 ALA A 116 0.211 -9.841 -6.167 1.00 0.00 H new ATOM 0 HB2 ALA A 116 0.243 -10.676 -4.596 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -0.181 -8.949 -4.677 1.00 0.00 H new ATOM 1803 N LEU A 117 1.859 -6.958 -5.080 1.00 0.00 N ATOM 1804 CA LEU A 117 2.131 -5.654 -5.660 1.00 0.00 C ATOM 1805 C LEU A 117 3.599 -5.586 -6.084 1.00 0.00 C ATOM 1806 O LEU A 117 3.900 -5.361 -7.255 1.00 0.00 O ATOM 1807 CB LEU A 117 1.718 -4.542 -4.694 1.00 0.00 C ATOM 1808 CG LEU A 117 1.467 -3.169 -5.321 1.00 0.00 C ATOM 1809 CD1 LEU A 117 0.390 -3.249 -6.405 1.00 0.00 C ATOM 1810 CD2 LEU A 117 1.124 -2.131 -4.249 1.00 0.00 C ATOM 0 H LEU A 117 1.332 -6.935 -4.207 1.00 0.00 H new ATOM 0 HA LEU A 117 1.532 -5.504 -6.558 1.00 0.00 H new ATOM 0 HB2 LEU A 117 0.811 -4.855 -4.177 1.00 0.00 H new ATOM 0 HB3 LEU A 117 2.496 -4.437 -3.937 1.00 0.00 H new ATOM 0 HG LEU A 117 2.387 -2.842 -5.805 1.00 0.00 H new ATOM 0 HD11 LEU A 117 0.231 -2.260 -6.834 1.00 0.00 H new ATOM 0 HD12 LEU A 117 0.712 -3.936 -7.187 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -0.541 -3.608 -5.967 1.00 0.00 H new ATOM 0 HD21 LEU A 117 0.950 -1.164 -4.721 1.00 0.00 H new ATOM 0 HD22 LEU A 117 0.225 -2.441 -3.716 1.00 0.00 H new ATOM 0 HD23 LEU A 117 1.952 -2.048 -3.545 1.00 0.00 H new ATOM 1822 N GLY A 118 4.474 -5.784 -5.109 1.00 0.00 N ATOM 1823 CA GLY A 118 5.903 -5.748 -5.367 1.00 0.00 C ATOM 1824 C GLY A 118 6.291 -6.755 -6.451 1.00 0.00 C ATOM 1825 O GLY A 118 6.828 -6.378 -7.491 1.00 0.00 O ATOM 0 H GLY A 118 4.220 -5.970 -4.139 1.00 0.00 H new ATOM 0 HA2 GLY A 118 6.195 -4.745 -5.677 1.00 0.00 H new ATOM 0 HA3 GLY A 118 6.447 -5.969 -4.449 1.00 0.00 H new ATOM 1829 N SER A 119 6.003 -8.018 -6.170 1.00 0.00 N ATOM 1830 CA SER A 119 6.314 -9.083 -7.108 1.00 0.00 C ATOM 1831 C SER A 119 5.970 -8.643 -8.533 1.00 0.00 C ATOM 1832 O SER A 119 6.723 -8.909 -9.468 1.00 0.00 O ATOM 1833 CB SER A 119 5.562 -10.367 -6.753 1.00 0.00 C ATOM 1834 OG SER A 119 6.358 -11.529 -6.969 1.00 0.00 O ATOM 0 H SER A 119 5.558 -8.327 -5.306 1.00 0.00 H new ATOM 0 HA SER A 119 7.382 -9.291 -7.047 1.00 0.00 H new ATOM 0 HB2 SER A 119 5.252 -10.329 -5.709 1.00 0.00 H new ATOM 0 HB3 SER A 119 4.654 -10.433 -7.353 1.00 0.00 H new ATOM 0 HG SER A 119 5.843 -12.328 -6.729 1.00 0.00 H new ATOM 1840 N LEU A 120 4.831 -7.977 -8.653 1.00 0.00 N ATOM 1841 CA LEU A 120 4.378 -7.497 -9.948 1.00 0.00 C ATOM 1842 C LEU A 120 5.462 -6.614 -10.568 1.00 0.00 C ATOM 1843 O LEU A 120 5.798 -6.768 -11.741 1.00 0.00 O ATOM 1844 CB LEU A 120 3.020 -6.804 -9.817 1.00 0.00 C ATOM 1845 CG LEU A 120 1.815 -7.584 -10.346 1.00 0.00 C ATOM 1846 CD1 LEU A 120 0.525 -7.132 -9.660 1.00 0.00 C ATOM 1847 CD2 LEU A 120 1.721 -7.481 -11.870 1.00 0.00 C ATOM 0 H LEU A 120 4.208 -7.758 -7.875 1.00 0.00 H new ATOM 0 HA LEU A 120 4.219 -8.333 -10.630 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.849 -6.580 -8.764 1.00 0.00 H new ATOM 0 HB3 LEU A 120 3.069 -5.850 -10.342 1.00 0.00 H new ATOM 0 HG LEU A 120 1.956 -8.637 -10.103 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -0.316 -7.702 -10.054 1.00 0.00 H new ATOM 0 HD12 LEU A 120 0.606 -7.300 -8.586 1.00 0.00 H new ATOM 0 HD13 LEU A 120 0.365 -6.071 -9.850 1.00 0.00 H new ATOM 0 HD21 LEU A 120 0.856 -8.044 -12.220 1.00 0.00 H new ATOM 0 HD22 LEU A 120 1.614 -6.435 -12.158 1.00 0.00 H new ATOM 0 HD23 LEU A 120 2.626 -7.890 -12.319 1.00 0.00 H new ATOM 1859 N ALA A 121 5.980 -5.707 -9.752 1.00 0.00 N ATOM 1860 CA ALA A 121 7.019 -4.798 -10.206 1.00 0.00 C ATOM 1861 C ALA A 121 8.316 -5.581 -10.419 1.00 0.00 C ATOM 1862 O ALA A 121 9.122 -5.232 -11.281 1.00 0.00 O ATOM 1863 CB ALA A 121 7.182 -3.663 -9.194 1.00 0.00 C ATOM 0 H ALA A 121 5.699 -5.582 -8.779 1.00 0.00 H new ATOM 0 HA ALA A 121 6.746 -4.347 -11.160 1.00 0.00 H new ATOM 0 HB1 ALA A 121 7.961 -2.981 -9.534 1.00 0.00 H new ATOM 0 HB2 ALA A 121 6.241 -3.121 -9.101 1.00 0.00 H new ATOM 0 HB3 ALA A 121 7.460 -4.077 -8.225 1.00 0.00 H new ATOM 1869 N VAL A 122 8.479 -6.624 -9.619 1.00 0.00 N ATOM 1870 CA VAL A 122 9.665 -7.459 -9.709 1.00 0.00 C ATOM 1871 C VAL A 122 9.714 -8.121 -11.087 1.00 0.00 C ATOM 1872 O VAL A 122 10.772 -8.186 -11.711 1.00 0.00 O ATOM 1873 CB VAL A 122 9.683 -8.469 -8.559 1.00 0.00 C ATOM 1874 CG1 VAL A 122 10.797 -9.500 -8.753 1.00 0.00 C ATOM 1875 CG2 VAL A 122 9.819 -7.761 -7.210 1.00 0.00 C ATOM 0 H VAL A 122 7.809 -6.910 -8.905 1.00 0.00 H new ATOM 0 HA VAL A 122 10.566 -6.854 -9.607 1.00 0.00 H new ATOM 0 HB VAL A 122 8.731 -9.000 -8.564 1.00 0.00 H new ATOM 0 HG11 VAL A 122 10.788 -10.206 -7.922 1.00 0.00 H new ATOM 0 HG12 VAL A 122 10.637 -10.037 -9.688 1.00 0.00 H new ATOM 0 HG13 VAL A 122 11.761 -8.992 -8.787 1.00 0.00 H new ATOM 0 HG21 VAL A 122 9.829 -8.501 -6.410 1.00 0.00 H new ATOM 0 HG22 VAL A 122 10.748 -7.192 -7.190 1.00 0.00 H new ATOM 0 HG23 VAL A 122 8.976 -7.084 -7.068 1.00 0.00 H new ATOM 1885 N THR A 123 8.556 -8.595 -11.522 1.00 0.00 N ATOM 1886 CA THR A 123 8.453 -9.250 -12.815 1.00 0.00 C ATOM 1887 C THR A 123 8.932 -8.314 -13.926 1.00 0.00 C ATOM 1888 O THR A 123 9.937 -8.585 -14.582 1.00 0.00 O ATOM 1889 CB THR A 123 7.008 -9.718 -12.995 1.00 0.00 C ATOM 1890 OG1 THR A 123 6.969 -10.986 -12.346 1.00 0.00 O ATOM 1891 CG2 THR A 123 6.672 -10.035 -14.454 1.00 0.00 C ATOM 0 H THR A 123 7.680 -8.539 -11.002 1.00 0.00 H new ATOM 0 HA THR A 123 9.101 -10.125 -12.868 1.00 0.00 H new ATOM 0 HB THR A 123 6.330 -8.949 -12.625 1.00 0.00 H new ATOM 0 HG1 THR A 123 6.066 -11.361 -12.414 1.00 0.00 H new ATOM 0 HG21 THR A 123 5.635 -10.362 -14.526 1.00 0.00 H new ATOM 0 HG22 THR A 123 6.813 -9.142 -15.062 1.00 0.00 H new ATOM 0 HG23 THR A 123 7.328 -10.827 -14.815 1.00 0.00 H new ATOM 2020 N ASP A 132 14.920 -2.351 -5.260 1.00 0.00 N ATOM 2021 CA ASP A 132 15.402 -3.492 -6.019 1.00 0.00 C ATOM 2022 C ASP A 132 14.259 -4.492 -6.208 1.00 0.00 C ATOM 2023 O ASP A 132 13.406 -4.638 -5.334 1.00 0.00 O ATOM 2024 CB ASP A 132 16.537 -4.205 -5.283 1.00 0.00 C ATOM 2025 CG ASP A 132 17.945 -3.732 -5.652 1.00 0.00 C ATOM 2026 OD1 ASP A 132 18.054 -2.570 -6.098 1.00 0.00 O ATOM 2027 OD2 ASP A 132 18.879 -4.544 -5.479 1.00 0.00 O ATOM 0 HA ASP A 132 15.769 -3.128 -6.979 1.00 0.00 H new ATOM 0 HB2 ASP A 132 16.395 -4.072 -4.211 1.00 0.00 H new ATOM 0 HB3 ASP A 132 16.465 -5.274 -5.484 1.00 0.00 H new ATOM 2032 N PRO A 133 14.280 -5.174 -7.385 1.00 0.00 N ATOM 2033 CA PRO A 133 13.257 -6.156 -7.700 1.00 0.00 C ATOM 2034 C PRO A 133 13.475 -7.447 -6.908 1.00 0.00 C ATOM 2035 O PRO A 133 12.539 -8.219 -6.702 1.00 0.00 O ATOM 2036 CB PRO A 133 13.354 -6.357 -9.203 1.00 0.00 C ATOM 2037 CG PRO A 133 14.724 -5.837 -9.606 1.00 0.00 C ATOM 2038 CD PRO A 133 15.275 -5.028 -8.443 1.00 0.00 C ATOM 0 HA PRO A 133 12.256 -5.826 -7.420 1.00 0.00 H new ATOM 0 HB2 PRO A 133 13.244 -7.409 -9.464 1.00 0.00 H new ATOM 0 HB3 PRO A 133 12.563 -5.815 -9.721 1.00 0.00 H new ATOM 0 HG2 PRO A 133 15.391 -6.665 -9.846 1.00 0.00 H new ATOM 0 HG3 PRO A 133 14.650 -5.218 -10.500 1.00 0.00 H new ATOM 0 HD2 PRO A 133 16.248 -5.403 -8.126 1.00 0.00 H new ATOM 0 HD3 PRO A 133 15.410 -3.982 -8.717 1.00 0.00 H new ATOM 2046 N ASN A 134 14.715 -7.643 -6.486 1.00 0.00 N ATOM 2047 CA ASN A 134 15.067 -8.827 -5.721 1.00 0.00 C ATOM 2048 C ASN A 134 14.831 -8.558 -4.234 1.00 0.00 C ATOM 2049 O ASN A 134 15.671 -8.888 -3.399 1.00 0.00 O ATOM 2050 CB ASN A 134 16.543 -9.184 -5.908 1.00 0.00 C ATOM 2051 CG ASN A 134 16.761 -9.951 -7.214 1.00 0.00 C ATOM 2052 OD1 ASN A 134 16.691 -11.168 -7.269 1.00 0.00 O ATOM 2053 ND2 ASN A 134 17.028 -9.174 -8.260 1.00 0.00 N ATOM 0 H ASN A 134 15.489 -7.002 -6.659 1.00 0.00 H new ATOM 0 HA ASN A 134 14.448 -9.652 -6.073 1.00 0.00 H new ATOM 0 HB2 ASN A 134 17.143 -8.274 -5.912 1.00 0.00 H new ATOM 0 HB3 ASN A 134 16.884 -9.787 -5.067 1.00 0.00 H new ATOM 0 HD21 ASN A 134 17.189 -9.591 -9.177 1.00 0.00 H new ATOM 0 HD22 ASN A 134 17.072 -8.161 -8.145 1.00 0.00 H new ATOM 2060 N TRP A 135 13.683 -7.962 -3.949 1.00 0.00 N ATOM 2061 CA TRP A 135 13.325 -7.645 -2.576 1.00 0.00 C ATOM 2062 C TRP A 135 12.192 -8.583 -2.154 1.00 0.00 C ATOM 2063 O TRP A 135 12.198 -9.108 -1.042 1.00 0.00 O ATOM 2064 CB TRP A 135 12.961 -6.166 -2.432 1.00 0.00 C ATOM 2065 CG TRP A 135 14.166 -5.246 -2.226 1.00 0.00 C ATOM 2066 CD1 TRP A 135 15.459 -5.587 -2.138 1.00 0.00 C ATOM 2067 CD2 TRP A 135 14.138 -3.810 -2.084 1.00 0.00 C ATOM 2068 NE1 TRP A 135 16.263 -4.481 -1.950 1.00 0.00 N ATOM 2069 CE2 TRP A 135 15.433 -3.366 -1.917 1.00 0.00 C ATOM 2070 CE3 TRP A 135 13.053 -2.916 -2.097 1.00 0.00 C ATOM 2071 CZ2 TRP A 135 15.766 -2.016 -1.749 1.00 0.00 C ATOM 2072 CZ3 TRP A 135 13.401 -1.571 -1.928 1.00 0.00 C ATOM 2073 CH2 TRP A 135 14.701 -1.107 -1.759 1.00 0.00 C ATOM 0 H TRP A 135 12.988 -7.690 -4.645 1.00 0.00 H new ATOM 0 HA TRP A 135 14.174 -7.802 -1.910 1.00 0.00 H new ATOM 0 HB2 TRP A 135 12.421 -5.847 -3.324 1.00 0.00 H new ATOM 0 HB3 TRP A 135 12.280 -6.050 -1.589 1.00 0.00 H new ATOM 0 HD1 TRP A 135 15.826 -6.600 -2.206 1.00 0.00 H new ATOM 0 HE1 TRP A 135 17.278 -4.482 -1.853 1.00 0.00 H new ATOM 0 HE3 TRP A 135 12.031 -3.242 -2.227 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 16.789 -1.694 -1.619 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 12.604 -0.842 -1.929 1.00 0.00 H new ATOM 0 HH2 TRP A 135 14.888 -0.050 -1.636 1.00 0.00 H new