USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1047 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 40 THR OG1 : rot -106:sc= 0.633 USER MOD Set 1.2: A 128 TYR OH : rot 150:sc= 1.77 USER MOD Set 2.1: A 93 HIS : no HD1:sc= -0.477 K(o=1.6,f=-4.1!) USER MOD Set 2.2: A 95 GLN : amide:sc= 1.05 K(o=1.6,f=-1.8) USER MOD Set 2.3: A 102 THR OG1 : rot -109:sc= 1.07 USER MOD Set 3.1: A 53 THR OG1 : rot 107:sc= 3.03 USER MOD Set 3.2: A 58 LYS NZ :NH3+ 174:sc= 2.32 (180deg=0.938) USER MOD Set 3.3: A 60 THR OG1 : rot 24:sc= 1.57 USER MOD Set 4.1: A 55 SER OG : rot 180:sc= -0.0591 USER MOD Set 4.2: A 56 THR OG1 : rot 110:sc= 0.827 USER MOD Single : A 1 VAL N :NH3+ -177:sc= -0.0183 (180deg=-0.0389) USER MOD Single : A 7 THR OG1 : rot 180:sc=-0.000328 USER MOD Single : A 9 LYS NZ :NH3+ -107:sc= 1.01 (180deg=-2.61) USER MOD Single : A 13 SER OG : rot 46:sc= 2.42 USER MOD Single : A 14 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00345) USER MOD Single : A 15 ASN : amide:sc= 1.7 K(o=1.7,f=-0.29) USER MOD Single : A 19 TYR OH : rot 169:sc= -1.13 USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 171:sc= 1.64 (180deg=0.953) USER MOD Single : A 22 SER OG : rot 59:sc= 1.21 USER MOD Single : A 29 THR OG1 : rot 160:sc= 0.912 USER MOD Single : A 31 GLN : amide:sc= -0.133 X(o=-0.13,f=-0.13) USER MOD Single : A 34 ASN : amide:sc= -0.534 K(o=-0.53,f=-3.3!) USER MOD Single : A 35 MET CE :methyl -147:sc= 0 (180deg=-0.118) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0.0287 USER MOD Single : A 37 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0426) USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.0475 USER MOD Single : A 45 ASN : amide:sc= 0.326 K(o=0.33,f=-5.6!) USER MOD Single : A 48 THR OG1 : rot -86:sc= 1.22 USER MOD Single : A 52 LYS NZ :NH3+ 152:sc= 0.223! (180deg=-3.17!) USER MOD Single : A 54 GLN : amide:sc= -1.16 K(o=-1.2,f=-3.6!) USER MOD Single : A 59 ASN : amide:sc= 1.41 K(o=1.4,f=-0.0025) USER MOD Single : A 63 SER OG : rot 38:sc= 0.641 USER MOD Single : A 65 LYS NZ :NH3+ -173:sc= 2.29 (180deg=2.22) USER MOD Single : A 73 THR OG1 : rot 54:sc= 1.05 USER MOD Single : A 74 THR OG1 : rot -108:sc= 1.23 USER MOD Single : A 79 LYS NZ :NH3+ 170:sc= 2.25 (180deg=1.92) USER MOD Single : A 81 LYS NZ :NH3+ -130:sc= 1.22 (180deg=0.777) USER MOD Single : A 82 SER OG : rot 118:sc= 1.01 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0.0645 USER MOD Single : A 90 LYS NZ :NH3+ -176:sc= 1.14 (180deg=1.07) USER MOD Single : A 96 LYS NZ :NH3+ 166:sc= 1.11 (180deg=0.841) USER MOD Single : A 98 ASN : amide:sc= 0.659 K(o=0.66,f=-0.024) USER MOD Single : A 100 GLN : amide:sc= 0.375 K(o=0.37,f=-3.2!) USER MOD Single : A 103 SER OG : rot -63:sc= 0.675 USER MOD Single : A 108 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ -103:sc= 0.896 (180deg=-1.18!) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 160:sc= 0.145 USER MOD Single : A 119 HIS : no HE2:sc= -2.01! C(o=-2!,f=-6.3!) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot -109:sc= -1.39 USER MOD Single : A 125 THR OG1 : rot 34:sc= 0.0552 USER MOD Single : A 127 THR OG1 : rot -28:sc= 1.02 USER MOD Single : A 130 LYS NZ :NH3+ 168:sc= 2.22 (180deg=2.05) USER MOD Single : A 131 GLN : amide:sc= -0.415 X(o=-0.42,f=-0.32) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 10.422 -12.059 -4.312 1.00 0.00 N ATOM 2 CA VAL A 1 10.514 -11.271 -3.094 1.00 0.00 C ATOM 3 C VAL A 1 11.764 -10.383 -3.111 1.00 0.00 C ATOM 4 O VAL A 1 11.680 -9.200 -2.760 1.00 0.00 O ATOM 5 CB VAL A 1 10.378 -12.181 -1.861 1.00 0.00 C ATOM 6 CG1 VAL A 1 11.518 -13.188 -1.696 1.00 0.00 C ATOM 7 CG2 VAL A 1 10.239 -11.364 -0.573 1.00 0.00 C ATOM 0 H1 VAL A 1 9.543 -12.614 -4.301 1.00 0.00 H new ATOM 0 H2 VAL A 1 10.421 -11.425 -5.136 1.00 0.00 H new ATOM 0 H3 VAL A 1 11.237 -12.703 -4.371 1.00 0.00 H new ATOM 0 HA VAL A 1 9.679 -10.573 -3.034 1.00 0.00 H new ATOM 0 HB VAL A 1 9.468 -12.753 -2.042 1.00 0.00 H new ATOM 0 HG11 VAL A 1 11.346 -13.790 -0.804 1.00 0.00 H new ATOM 0 HG12 VAL A 1 11.559 -13.838 -2.570 1.00 0.00 H new ATOM 0 HG13 VAL A 1 12.463 -12.654 -1.597 1.00 0.00 H new ATOM 0 HG21 VAL A 1 10.145 -12.039 0.278 1.00 0.00 H new ATOM 0 HG22 VAL A 1 11.121 -10.737 -0.443 1.00 0.00 H new ATOM 0 HG23 VAL A 1 9.352 -10.734 -0.636 1.00 0.00 H new ATOM 19 N ASP A 2 12.898 -10.933 -3.568 1.00 0.00 N ATOM 20 CA ASP A 2 14.187 -10.278 -3.793 1.00 0.00 C ATOM 21 C ASP A 2 14.073 -9.248 -4.923 1.00 0.00 C ATOM 22 O ASP A 2 14.664 -9.372 -5.994 1.00 0.00 O ATOM 23 CB ASP A 2 15.244 -11.344 -4.130 1.00 0.00 C ATOM 24 CG ASP A 2 15.201 -12.523 -3.173 1.00 0.00 C ATOM 25 OD1 ASP A 2 14.207 -13.276 -3.293 1.00 0.00 O ATOM 26 OD2 ASP A 2 16.122 -12.626 -2.338 1.00 0.00 O ATOM 0 H ASP A 2 12.937 -11.924 -3.807 1.00 0.00 H new ATOM 0 HA ASP A 2 14.489 -9.750 -2.889 1.00 0.00 H new ATOM 0 HB2 ASP A 2 15.086 -11.700 -5.148 1.00 0.00 H new ATOM 0 HB3 ASP A 2 16.235 -10.891 -4.101 1.00 0.00 H new ATOM 31 N ALA A 3 13.260 -8.228 -4.675 1.00 0.00 N ATOM 32 CA ALA A 3 12.594 -7.423 -5.682 1.00 0.00 C ATOM 33 C ALA A 3 11.847 -6.316 -4.950 1.00 0.00 C ATOM 34 O ALA A 3 11.972 -5.143 -5.292 1.00 0.00 O ATOM 35 CB ALA A 3 11.609 -8.303 -6.465 1.00 0.00 C ATOM 0 H ALA A 3 13.040 -7.930 -3.725 1.00 0.00 H new ATOM 0 HA ALA A 3 13.308 -6.998 -6.387 1.00 0.00 H new ATOM 0 HB1 ALA A 3 11.107 -7.701 -7.223 1.00 0.00 H new ATOM 0 HB2 ALA A 3 12.152 -9.116 -6.948 1.00 0.00 H new ATOM 0 HB3 ALA A 3 10.868 -8.717 -5.781 1.00 0.00 H new ATOM 41 N PHE A 4 11.103 -6.700 -3.910 1.00 0.00 N ATOM 42 CA PHE A 4 10.265 -5.819 -3.119 1.00 0.00 C ATOM 43 C PHE A 4 11.043 -5.255 -1.931 1.00 0.00 C ATOM 44 O PHE A 4 10.990 -4.051 -1.700 1.00 0.00 O ATOM 45 CB PHE A 4 9.016 -6.599 -2.679 1.00 0.00 C ATOM 46 CG PHE A 4 8.287 -7.305 -3.813 1.00 0.00 C ATOM 47 CD1 PHE A 4 8.195 -6.710 -5.087 1.00 0.00 C ATOM 48 CD2 PHE A 4 7.858 -8.635 -3.643 1.00 0.00 C ATOM 49 CE1 PHE A 4 7.778 -7.466 -6.195 1.00 0.00 C ATOM 50 CE2 PHE A 4 7.466 -9.398 -4.756 1.00 0.00 C ATOM 51 CZ PHE A 4 7.445 -8.818 -6.036 1.00 0.00 C ATOM 0 H PHE A 4 11.072 -7.668 -3.591 1.00 0.00 H new ATOM 0 HA PHE A 4 9.950 -4.962 -3.715 1.00 0.00 H new ATOM 0 HB2 PHE A 4 9.308 -7.339 -1.934 1.00 0.00 H new ATOM 0 HB3 PHE A 4 8.325 -5.911 -2.191 1.00 0.00 H new ATOM 0 HD1 PHE A 4 8.446 -5.667 -5.212 1.00 0.00 H new ATOM 0 HD2 PHE A 4 7.830 -9.070 -2.655 1.00 0.00 H new ATOM 0 HE1 PHE A 4 7.714 -7.005 -7.170 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.180 -10.432 -4.628 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.173 -9.413 -6.895 1.00 0.00 H new ATOM 61 N VAL A 5 11.768 -6.118 -1.210 1.00 0.00 N ATOM 62 CA VAL A 5 12.453 -5.821 0.052 1.00 0.00 C ATOM 63 C VAL A 5 13.296 -4.543 -0.024 1.00 0.00 C ATOM 64 O VAL A 5 14.436 -4.603 -0.492 1.00 0.00 O ATOM 65 CB VAL A 5 13.344 -7.020 0.442 1.00 0.00 C ATOM 66 CG1 VAL A 5 14.098 -6.786 1.759 1.00 0.00 C ATOM 67 CG2 VAL A 5 12.508 -8.286 0.621 1.00 0.00 C ATOM 0 H VAL A 5 11.899 -7.086 -1.504 1.00 0.00 H new ATOM 0 HA VAL A 5 11.690 -5.653 0.812 1.00 0.00 H new ATOM 0 HB VAL A 5 14.059 -7.133 -0.373 1.00 0.00 H new ATOM 0 HG11 VAL A 5 14.710 -7.659 1.988 1.00 0.00 H new ATOM 0 HG12 VAL A 5 14.738 -5.909 1.661 1.00 0.00 H new ATOM 0 HG13 VAL A 5 13.382 -6.624 2.564 1.00 0.00 H new ATOM 0 HG21 VAL A 5 13.159 -9.116 0.895 1.00 0.00 H new ATOM 0 HG22 VAL A 5 11.771 -8.127 1.408 1.00 0.00 H new ATOM 0 HG23 VAL A 5 11.997 -8.519 -0.313 1.00 0.00 H new ATOM 77 N GLY A 6 12.773 -3.407 0.446 1.00 0.00 N ATOM 78 CA GLY A 6 13.498 -2.149 0.532 1.00 0.00 C ATOM 79 C GLY A 6 12.589 -0.962 0.221 1.00 0.00 C ATOM 80 O GLY A 6 11.363 -1.069 0.269 1.00 0.00 O ATOM 0 H GLY A 6 11.813 -3.341 0.783 1.00 0.00 H new ATOM 0 HA2 GLY A 6 13.918 -2.036 1.532 1.00 0.00 H new ATOM 0 HA3 GLY A 6 14.335 -2.161 -0.166 1.00 0.00 H new ATOM 84 N THR A 7 13.208 0.177 -0.099 1.00 0.00 N ATOM 85 CA THR A 7 12.511 1.419 -0.387 1.00 0.00 C ATOM 86 C THR A 7 12.350 1.590 -1.899 1.00 0.00 C ATOM 87 O THR A 7 13.323 1.495 -2.652 1.00 0.00 O ATOM 88 CB THR A 7 13.279 2.595 0.229 1.00 0.00 C ATOM 89 OG1 THR A 7 13.755 2.235 1.511 1.00 0.00 O ATOM 90 CG2 THR A 7 12.386 3.840 0.316 1.00 0.00 C ATOM 0 H THR A 7 14.223 0.257 -0.165 1.00 0.00 H new ATOM 0 HA THR A 7 11.515 1.392 0.055 1.00 0.00 H new ATOM 0 HB THR A 7 14.129 2.834 -0.411 1.00 0.00 H new ATOM 0 HG1 THR A 7 14.247 2.988 1.901 1.00 0.00 H new ATOM 0 HG21 THR A 7 12.950 4.662 0.756 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.055 4.121 -0.684 1.00 0.00 H new ATOM 0 HG23 THR A 7 11.518 3.622 0.938 1.00 0.00 H new ATOM 98 N TRP A 8 11.122 1.842 -2.342 1.00 0.00 N ATOM 99 CA TRP A 8 10.780 2.160 -3.716 1.00 0.00 C ATOM 100 C TRP A 8 10.646 3.680 -3.805 1.00 0.00 C ATOM 101 O TRP A 8 9.994 4.265 -2.942 1.00 0.00 O ATOM 102 CB TRP A 8 9.454 1.476 -4.078 1.00 0.00 C ATOM 103 CG TRP A 8 9.296 -0.005 -3.884 1.00 0.00 C ATOM 104 CD1 TRP A 8 10.208 -0.875 -3.388 1.00 0.00 C ATOM 105 CD2 TRP A 8 8.096 -0.800 -4.134 1.00 0.00 C ATOM 106 NE1 TRP A 8 9.643 -2.126 -3.272 1.00 0.00 N ATOM 107 CE2 TRP A 8 8.346 -2.147 -3.737 1.00 0.00 C ATOM 108 CE3 TRP A 8 6.812 -0.512 -4.645 1.00 0.00 C ATOM 109 CZ2 TRP A 8 7.373 -3.153 -3.848 1.00 0.00 C ATOM 110 CZ3 TRP A 8 5.831 -1.513 -4.762 1.00 0.00 C ATOM 111 CH2 TRP A 8 6.110 -2.834 -4.371 1.00 0.00 C ATOM 0 H TRP A 8 10.309 1.829 -1.726 1.00 0.00 H new ATOM 0 HA TRP A 8 11.542 1.809 -4.411 1.00 0.00 H new ATOM 0 HB2 TRP A 8 8.669 1.964 -3.500 1.00 0.00 H new ATOM 0 HB3 TRP A 8 9.256 1.688 -5.129 1.00 0.00 H new ATOM 0 HD1 TRP A 8 11.225 -0.626 -3.123 1.00 0.00 H new ATOM 0 HE1 TRP A 8 10.126 -2.938 -2.888 1.00 0.00 H new ATOM 0 HE3 TRP A 8 6.578 0.497 -4.952 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 7.594 -4.162 -3.534 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 4.856 -1.265 -5.155 1.00 0.00 H new ATOM 0 HH2 TRP A 8 5.356 -3.600 -4.473 1.00 0.00 H new ATOM 122 N LYS A 9 11.251 4.325 -4.810 1.00 0.00 N ATOM 123 CA LYS A 9 11.061 5.754 -5.072 1.00 0.00 C ATOM 124 C LYS A 9 10.261 5.930 -6.366 1.00 0.00 C ATOM 125 O LYS A 9 10.613 5.322 -7.377 1.00 0.00 O ATOM 126 CB LYS A 9 12.410 6.496 -5.061 1.00 0.00 C ATOM 127 CG LYS A 9 13.352 6.155 -6.223 1.00 0.00 C ATOM 128 CD LYS A 9 14.717 6.832 -6.015 1.00 0.00 C ATOM 129 CE LYS A 9 15.548 6.863 -7.308 1.00 0.00 C ATOM 130 NZ LYS A 9 15.945 5.523 -7.777 1.00 0.00 N ATOM 0 H LYS A 9 11.887 3.869 -5.464 1.00 0.00 H new ATOM 0 HA LYS A 9 10.476 6.212 -4.275 1.00 0.00 H new ATOM 0 HB2 LYS A 9 12.217 7.569 -5.074 1.00 0.00 H new ATOM 0 HB3 LYS A 9 12.920 6.275 -4.124 1.00 0.00 H new ATOM 0 HG2 LYS A 9 13.480 5.075 -6.292 1.00 0.00 H new ATOM 0 HG3 LYS A 9 12.914 6.485 -7.165 1.00 0.00 H new ATOM 0 HD2 LYS A 9 14.566 7.850 -5.657 1.00 0.00 H new ATOM 0 HD3 LYS A 9 15.271 6.301 -5.241 1.00 0.00 H new ATOM 0 HE2 LYS A 9 14.973 7.359 -8.090 1.00 0.00 H new ATOM 0 HE3 LYS A 9 16.443 7.463 -7.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 16.961 5.381 -7.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 15.402 4.800 -7.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 15.753 5.441 -8.796 1.00 0.00 H new ATOM 144 N LEU A 10 9.146 6.671 -6.321 1.00 0.00 N ATOM 145 CA LEU A 10 8.249 6.820 -7.465 1.00 0.00 C ATOM 146 C LEU A 10 8.912 7.670 -8.545 1.00 0.00 C ATOM 147 O LEU A 10 9.668 8.585 -8.219 1.00 0.00 O ATOM 148 CB LEU A 10 6.926 7.446 -6.998 1.00 0.00 C ATOM 149 CG LEU A 10 5.865 7.569 -8.111 1.00 0.00 C ATOM 150 CD1 LEU A 10 4.475 7.304 -7.525 1.00 0.00 C ATOM 151 CD2 LEU A 10 5.852 8.954 -8.780 1.00 0.00 C ATOM 0 H LEU A 10 8.845 7.181 -5.491 1.00 0.00 H new ATOM 0 HA LEU A 10 8.037 5.841 -7.895 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.518 6.845 -6.185 1.00 0.00 H new ATOM 0 HB3 LEU A 10 7.128 8.437 -6.591 1.00 0.00 H new ATOM 0 HG LEU A 10 6.124 6.833 -8.872 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.726 7.391 -8.312 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.443 6.299 -7.103 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.265 8.033 -6.742 1.00 0.00 H new ATOM 0 HD21 LEU A 10 5.085 8.977 -9.554 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.636 9.717 -8.032 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.826 9.150 -9.229 1.00 0.00 H new ATOM 163 N VAL A 11 8.598 7.407 -9.820 1.00 0.00 N ATOM 164 CA VAL A 11 9.035 8.277 -10.905 1.00 0.00 C ATOM 165 C VAL A 11 7.923 8.509 -11.941 1.00 0.00 C ATOM 166 O VAL A 11 7.406 9.622 -12.023 1.00 0.00 O ATOM 167 CB VAL A 11 10.405 7.816 -11.443 1.00 0.00 C ATOM 168 CG1 VAL A 11 10.467 6.346 -11.860 1.00 0.00 C ATOM 169 CG2 VAL A 11 10.888 8.687 -12.604 1.00 0.00 C ATOM 0 H VAL A 11 8.046 6.603 -10.118 1.00 0.00 H new ATOM 0 HA VAL A 11 9.217 9.284 -10.529 1.00 0.00 H new ATOM 0 HB VAL A 11 11.071 7.932 -10.588 1.00 0.00 H new ATOM 0 HG11 VAL A 11 11.467 6.113 -12.225 1.00 0.00 H new ATOM 0 HG12 VAL A 11 10.238 5.714 -11.002 1.00 0.00 H new ATOM 0 HG13 VAL A 11 9.740 6.161 -12.651 1.00 0.00 H new ATOM 0 HG21 VAL A 11 11.856 8.326 -12.951 1.00 0.00 H new ATOM 0 HG22 VAL A 11 10.168 8.637 -13.421 1.00 0.00 H new ATOM 0 HG23 VAL A 11 10.985 9.720 -12.269 1.00 0.00 H new ATOM 179 N ASP A 12 7.533 7.491 -12.713 1.00 0.00 N ATOM 180 CA ASP A 12 6.651 7.655 -13.870 1.00 0.00 C ATOM 181 C ASP A 12 5.239 7.180 -13.532 1.00 0.00 C ATOM 182 O ASP A 12 5.048 6.027 -13.140 1.00 0.00 O ATOM 183 CB ASP A 12 7.177 6.884 -15.090 1.00 0.00 C ATOM 184 CG ASP A 12 8.602 7.258 -15.460 1.00 0.00 C ATOM 185 OD1 ASP A 12 8.783 8.383 -15.964 1.00 0.00 O ATOM 186 OD2 ASP A 12 9.491 6.405 -15.235 1.00 0.00 O ATOM 0 H ASP A 12 7.822 6.526 -12.552 1.00 0.00 H new ATOM 0 HA ASP A 12 6.627 8.716 -14.119 1.00 0.00 H new ATOM 0 HB2 ASP A 12 7.130 5.815 -14.885 1.00 0.00 H new ATOM 0 HB3 ASP A 12 6.524 7.074 -15.942 1.00 0.00 H new ATOM 191 N SER A 13 4.233 8.049 -13.691 1.00 0.00 N ATOM 192 CA SER A 13 2.848 7.725 -13.386 1.00 0.00 C ATOM 193 C SER A 13 1.922 8.805 -13.953 1.00 0.00 C ATOM 194 O SER A 13 2.316 9.967 -13.997 1.00 0.00 O ATOM 195 CB SER A 13 2.697 7.635 -11.862 1.00 0.00 C ATOM 196 OG SER A 13 1.413 7.146 -11.498 1.00 0.00 O ATOM 0 H SER A 13 4.365 8.999 -14.037 1.00 0.00 H new ATOM 0 HA SER A 13 2.575 6.772 -13.839 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.467 6.979 -11.456 1.00 0.00 H new ATOM 0 HB3 SER A 13 2.852 8.619 -11.420 1.00 0.00 H new ATOM 0 HG SER A 13 1.194 6.363 -12.045 1.00 0.00 H new ATOM 202 N LYS A 14 0.695 8.437 -14.351 1.00 0.00 N ATOM 203 CA LYS A 14 -0.366 9.362 -14.751 1.00 0.00 C ATOM 204 C LYS A 14 -1.711 8.619 -14.747 1.00 0.00 C ATOM 205 O LYS A 14 -1.729 7.410 -14.512 1.00 0.00 O ATOM 206 CB LYS A 14 -0.049 10.024 -16.103 1.00 0.00 C ATOM 207 CG LYS A 14 0.068 9.037 -17.275 1.00 0.00 C ATOM 208 CD LYS A 14 0.442 9.766 -18.579 1.00 0.00 C ATOM 209 CE LYS A 14 1.915 10.207 -18.666 1.00 0.00 C ATOM 210 NZ LYS A 14 2.847 9.067 -18.801 1.00 0.00 N ATOM 0 H LYS A 14 0.409 7.459 -14.404 1.00 0.00 H new ATOM 0 HA LYS A 14 -0.433 10.179 -14.032 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -0.829 10.751 -16.331 1.00 0.00 H new ATOM 0 HB3 LYS A 14 0.886 10.577 -16.014 1.00 0.00 H new ATOM 0 HG2 LYS A 14 0.822 8.284 -17.046 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -0.877 8.511 -17.407 1.00 0.00 H new ATOM 0 HD2 LYS A 14 0.222 9.111 -19.422 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -0.194 10.645 -18.684 1.00 0.00 H new ATOM 0 HE2 LYS A 14 2.040 10.875 -19.518 1.00 0.00 H new ATOM 0 HE3 LYS A 14 2.172 10.777 -17.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 3.820 9.423 -18.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 2.776 8.459 -17.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 2.602 8.516 -19.648 1.00 0.00 H new ATOM 224 N ASN A 15 -2.818 9.336 -14.974 1.00 0.00 N ATOM 225 CA ASN A 15 -4.173 8.797 -15.114 1.00 0.00 C ATOM 226 C ASN A 15 -4.677 8.184 -13.800 1.00 0.00 C ATOM 227 O ASN A 15 -5.341 7.148 -13.802 1.00 0.00 O ATOM 228 CB ASN A 15 -4.260 7.831 -16.313 1.00 0.00 C ATOM 229 CG ASN A 15 -5.668 7.750 -16.915 1.00 0.00 C ATOM 230 OD1 ASN A 15 -5.885 8.200 -18.035 1.00 0.00 O ATOM 231 ND2 ASN A 15 -6.628 7.198 -16.181 1.00 0.00 N ATOM 0 H ASN A 15 -2.791 10.351 -15.069 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.851 9.622 -15.332 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.559 8.153 -17.083 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -3.949 6.836 -15.994 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -7.579 7.139 -16.546 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -6.414 6.833 -15.253 1.00 0.00 H new ATOM 238 N PHE A 16 -4.354 8.802 -12.662 1.00 0.00 N ATOM 239 CA PHE A 16 -4.818 8.375 -11.334 1.00 0.00 C ATOM 240 C PHE A 16 -5.859 9.380 -10.834 1.00 0.00 C ATOM 241 O PHE A 16 -6.893 8.994 -10.302 1.00 0.00 O ATOM 242 CB PHE A 16 -3.633 8.183 -10.374 1.00 0.00 C ATOM 243 CG PHE A 16 -3.796 7.129 -9.289 1.00 0.00 C ATOM 244 CD1 PHE A 16 -4.887 7.167 -8.398 1.00 0.00 C ATOM 245 CD2 PHE A 16 -2.799 6.146 -9.117 1.00 0.00 C ATOM 246 CE1 PHE A 16 -5.007 6.202 -7.383 1.00 0.00 C ATOM 247 CE2 PHE A 16 -2.908 5.198 -8.086 1.00 0.00 C ATOM 248 CZ PHE A 16 -4.019 5.216 -7.227 1.00 0.00 C ATOM 0 H PHE A 16 -3.754 9.626 -12.633 1.00 0.00 H new ATOM 0 HA PHE A 16 -5.301 7.399 -11.391 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -2.754 7.929 -10.966 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -3.428 9.139 -9.892 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -5.634 7.941 -8.495 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -1.948 6.122 -9.781 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -5.861 6.219 -6.722 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -2.136 4.454 -7.954 1.00 0.00 H new ATOM 0 HZ PHE A 16 -4.113 4.473 -6.448 1.00 0.00 H new ATOM 258 N ASP A 17 -5.597 10.664 -11.080 1.00 0.00 N ATOM 259 CA ASP A 17 -6.581 11.711 -11.337 1.00 0.00 C ATOM 260 C ASP A 17 -7.905 11.135 -11.877 1.00 0.00 C ATOM 261 O ASP A 17 -8.889 11.001 -11.143 1.00 0.00 O ATOM 262 CB ASP A 17 -5.940 12.692 -12.345 1.00 0.00 C ATOM 263 CG ASP A 17 -5.144 11.966 -13.432 1.00 0.00 C ATOM 264 OD1 ASP A 17 -4.044 11.452 -13.104 1.00 0.00 O ATOM 265 OD2 ASP A 17 -5.733 11.757 -14.508 1.00 0.00 O ATOM 0 H ASP A 17 -4.641 11.018 -11.106 1.00 0.00 H new ATOM 0 HA ASP A 17 -6.839 12.223 -10.410 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -6.721 13.294 -12.810 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.282 13.379 -11.813 1.00 0.00 H new ATOM 270 N ASP A 18 -7.921 10.783 -13.165 1.00 0.00 N ATOM 271 CA ASP A 18 -9.052 10.195 -13.860 1.00 0.00 C ATOM 272 C ASP A 18 -9.631 8.993 -13.108 1.00 0.00 C ATOM 273 O ASP A 18 -10.847 8.873 -12.970 1.00 0.00 O ATOM 274 CB ASP A 18 -8.587 9.796 -15.259 1.00 0.00 C ATOM 275 CG ASP A 18 -9.607 8.908 -15.947 1.00 0.00 C ATOM 276 OD1 ASP A 18 -10.743 9.407 -16.102 1.00 0.00 O ATOM 277 OD2 ASP A 18 -9.246 7.749 -16.247 1.00 0.00 O ATOM 0 H ASP A 18 -7.110 10.908 -13.770 1.00 0.00 H new ATOM 0 HA ASP A 18 -9.857 10.927 -13.921 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -8.419 10.691 -15.858 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -7.633 9.273 -15.192 1.00 0.00 H new ATOM 282 N TYR A 19 -8.754 8.115 -12.618 1.00 0.00 N ATOM 283 CA TYR A 19 -9.144 6.924 -11.875 1.00 0.00 C ATOM 284 C TYR A 19 -10.022 7.287 -10.671 1.00 0.00 C ATOM 285 O TYR A 19 -11.142 6.793 -10.534 1.00 0.00 O ATOM 286 CB TYR A 19 -7.878 6.167 -11.455 1.00 0.00 C ATOM 287 CG TYR A 19 -8.029 4.672 -11.314 1.00 0.00 C ATOM 288 CD1 TYR A 19 -8.160 3.901 -12.480 1.00 0.00 C ATOM 289 CD2 TYR A 19 -7.748 4.038 -10.090 1.00 0.00 C ATOM 290 CE1 TYR A 19 -7.985 2.514 -12.429 1.00 0.00 C ATOM 291 CE2 TYR A 19 -7.633 2.641 -10.030 1.00 0.00 C ATOM 292 CZ TYR A 19 -7.737 1.882 -11.204 1.00 0.00 C ATOM 293 OH TYR A 19 -7.538 0.542 -11.190 1.00 0.00 O ATOM 0 H TYR A 19 -7.745 8.215 -12.729 1.00 0.00 H new ATOM 0 HA TYR A 19 -9.747 6.275 -12.510 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -7.096 6.368 -12.188 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -7.534 6.571 -10.503 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -8.396 4.380 -13.419 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -7.621 4.628 -9.194 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -8.041 1.930 -13.336 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -7.465 2.152 -9.082 1.00 0.00 H new ATOM 0 HH TYR A 19 -7.207 0.270 -10.309 1.00 0.00 H new ATOM 303 N MET A 20 -9.520 8.170 -9.800 1.00 0.00 N ATOM 304 CA MET A 20 -10.265 8.707 -8.671 1.00 0.00 C ATOM 305 C MET A 20 -11.587 9.281 -9.163 1.00 0.00 C ATOM 306 O MET A 20 -12.614 9.038 -8.525 1.00 0.00 O ATOM 307 CB MET A 20 -9.431 9.766 -7.918 1.00 0.00 C ATOM 308 CG MET A 20 -10.250 10.908 -7.282 1.00 0.00 C ATOM 309 SD MET A 20 -11.573 10.445 -6.119 1.00 0.00 S ATOM 310 CE MET A 20 -12.633 11.909 -6.211 1.00 0.00 C ATOM 0 H MET A 20 -8.569 8.533 -9.867 1.00 0.00 H new ATOM 0 HA MET A 20 -10.478 7.905 -7.964 1.00 0.00 H new ATOM 0 HB2 MET A 20 -8.861 9.268 -7.134 1.00 0.00 H new ATOM 0 HB3 MET A 20 -8.709 10.199 -8.611 1.00 0.00 H new ATOM 0 HG2 MET A 20 -9.558 11.568 -6.759 1.00 0.00 H new ATOM 0 HG3 MET A 20 -10.698 11.490 -8.087 1.00 0.00 H new ATOM 0 HE1 MET A 20 -13.491 11.779 -5.552 1.00 0.00 H new ATOM 0 HE2 MET A 20 -12.067 12.788 -5.901 1.00 0.00 H new ATOM 0 HE3 MET A 20 -12.980 12.043 -7.236 1.00 0.00 H new ATOM 320 N LYS A 21 -11.540 10.074 -10.236 1.00 0.00 N ATOM 321 CA LYS A 21 -12.685 10.720 -10.865 1.00 0.00 C ATOM 322 C LYS A 21 -13.602 9.670 -11.521 1.00 0.00 C ATOM 323 O LYS A 21 -13.803 9.691 -12.734 1.00 0.00 O ATOM 324 CB LYS A 21 -12.135 11.729 -11.889 1.00 0.00 C ATOM 325 CG LYS A 21 -13.180 12.604 -12.598 1.00 0.00 C ATOM 326 CD LYS A 21 -12.736 12.939 -14.036 1.00 0.00 C ATOM 327 CE LYS A 21 -13.220 11.932 -15.102 1.00 0.00 C ATOM 328 NZ LYS A 21 -12.671 10.564 -14.959 1.00 0.00 N ATOM 0 H LYS A 21 -10.662 10.290 -10.708 1.00 0.00 H new ATOM 0 HA LYS A 21 -13.296 11.243 -10.130 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -11.427 12.383 -11.381 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -11.575 11.180 -12.646 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -14.138 12.085 -12.621 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -13.330 13.526 -12.036 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -13.106 13.931 -14.296 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -11.647 12.986 -14.066 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -14.308 11.878 -15.063 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -12.955 12.313 -16.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -13.161 9.923 -15.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -11.654 10.573 -15.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -12.812 10.234 -13.983 1.00 0.00 H new ATOM 342 N SER A 22 -14.158 8.766 -10.714 1.00 0.00 N ATOM 343 CA SER A 22 -14.975 7.604 -11.044 1.00 0.00 C ATOM 344 C SER A 22 -14.931 6.674 -9.833 1.00 0.00 C ATOM 345 O SER A 22 -15.964 6.312 -9.279 1.00 0.00 O ATOM 346 CB SER A 22 -14.469 6.848 -12.286 1.00 0.00 C ATOM 347 OG SER A 22 -14.982 7.423 -13.468 1.00 0.00 O ATOM 0 H SER A 22 -14.031 8.841 -9.705 1.00 0.00 H new ATOM 0 HA SER A 22 -15.986 7.938 -11.278 1.00 0.00 H new ATOM 0 HB2 SER A 22 -13.379 6.868 -12.310 1.00 0.00 H new ATOM 0 HB3 SER A 22 -14.767 5.801 -12.226 1.00 0.00 H new ATOM 0 HG SER A 22 -14.707 8.362 -13.521 1.00 0.00 H new ATOM 353 N LEU A 23 -13.722 6.269 -9.435 1.00 0.00 N ATOM 354 CA LEU A 23 -13.539 5.182 -8.487 1.00 0.00 C ATOM 355 C LEU A 23 -13.695 5.623 -7.029 1.00 0.00 C ATOM 356 O LEU A 23 -14.034 4.805 -6.170 1.00 0.00 O ATOM 357 CB LEU A 23 -12.178 4.538 -8.754 1.00 0.00 C ATOM 358 CG LEU A 23 -12.085 3.112 -8.204 1.00 0.00 C ATOM 359 CD1 LEU A 23 -13.119 2.195 -8.871 1.00 0.00 C ATOM 360 CD2 LEU A 23 -10.670 2.596 -8.451 1.00 0.00 C ATOM 0 H LEU A 23 -12.851 6.687 -9.762 1.00 0.00 H new ATOM 0 HA LEU A 23 -14.330 4.448 -8.637 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.992 4.522 -9.828 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -11.396 5.149 -8.304 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.300 3.117 -7.135 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -13.031 1.189 -8.462 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -14.122 2.578 -8.680 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -12.940 2.166 -9.946 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -10.581 1.580 -8.066 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -10.464 2.598 -9.521 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -9.954 3.241 -7.942 1.00 0.00 H new ATOM 372 N GLY A 24 -13.440 6.903 -6.734 1.00 0.00 N ATOM 373 CA GLY A 24 -13.709 7.464 -5.416 1.00 0.00 C ATOM 374 C GLY A 24 -12.848 6.843 -4.313 1.00 0.00 C ATOM 375 O GLY A 24 -13.375 6.488 -3.259 1.00 0.00 O ATOM 0 H GLY A 24 -13.045 7.569 -7.398 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -13.535 8.540 -5.443 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -14.761 7.318 -5.173 1.00 0.00 H new ATOM 379 N VAL A 25 -11.541 6.699 -4.562 1.00 0.00 N ATOM 380 CA VAL A 25 -10.557 6.190 -3.601 1.00 0.00 C ATOM 381 C VAL A 25 -9.472 7.249 -3.397 1.00 0.00 C ATOM 382 O VAL A 25 -9.266 7.735 -2.290 1.00 0.00 O ATOM 383 CB VAL A 25 -10.012 4.794 -4.009 1.00 0.00 C ATOM 384 CG1 VAL A 25 -10.544 4.292 -5.355 1.00 0.00 C ATOM 385 CG2 VAL A 25 -8.480 4.655 -4.031 1.00 0.00 C ATOM 0 H VAL A 25 -11.128 6.940 -5.463 1.00 0.00 H new ATOM 0 HA VAL A 25 -11.035 6.017 -2.637 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.395 4.175 -3.198 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -10.119 3.312 -5.572 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -11.630 4.215 -5.311 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -10.262 4.992 -6.142 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -8.211 3.642 -4.329 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -8.060 5.366 -4.743 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -8.082 4.859 -3.037 1.00 0.00 H new ATOM 395 N GLY A 26 -8.800 7.637 -4.486 1.00 0.00 N ATOM 396 CA GLY A 26 -7.803 8.695 -4.440 1.00 0.00 C ATOM 397 C GLY A 26 -8.472 10.062 -4.292 1.00 0.00 C ATOM 398 O GLY A 26 -9.658 10.136 -3.979 1.00 0.00 O ATOM 0 H GLY A 26 -8.934 7.228 -5.411 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -7.123 8.525 -3.605 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -7.202 8.675 -5.349 1.00 0.00 H new ATOM 402 N PHE A 27 -7.720 11.125 -4.596 1.00 0.00 N ATOM 403 CA PHE A 27 -8.025 12.555 -4.461 1.00 0.00 C ATOM 404 C PHE A 27 -7.010 13.146 -3.489 1.00 0.00 C ATOM 405 O PHE A 27 -6.729 12.542 -2.460 1.00 0.00 O ATOM 406 CB PHE A 27 -9.455 12.884 -4.005 1.00 0.00 C ATOM 407 CG PHE A 27 -9.888 14.317 -4.235 1.00 0.00 C ATOM 408 CD1 PHE A 27 -9.987 14.806 -5.552 1.00 0.00 C ATOM 409 CD2 PHE A 27 -10.416 15.072 -3.172 1.00 0.00 C ATOM 410 CE1 PHE A 27 -10.611 16.039 -5.803 1.00 0.00 C ATOM 411 CE2 PHE A 27 -11.045 16.302 -3.425 1.00 0.00 C ATOM 412 CZ PHE A 27 -11.150 16.782 -4.742 1.00 0.00 C ATOM 0 H PHE A 27 -6.786 10.992 -4.983 1.00 0.00 H new ATOM 0 HA PHE A 27 -7.957 12.995 -5.456 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -10.147 12.223 -4.527 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -9.541 12.661 -2.942 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -9.582 14.231 -6.372 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -10.338 14.705 -2.159 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -10.676 16.415 -6.813 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -11.449 16.880 -2.607 1.00 0.00 H new ATOM 0 HZ PHE A 27 -11.645 17.722 -4.937 1.00 0.00 H new ATOM 422 N ALA A 28 -6.383 14.262 -3.873 1.00 0.00 N ATOM 423 CA ALA A 28 -5.173 14.780 -3.238 1.00 0.00 C ATOM 424 C ALA A 28 -3.984 13.810 -3.348 1.00 0.00 C ATOM 425 O ALA A 28 -2.939 14.058 -2.757 1.00 0.00 O ATOM 426 CB ALA A 28 -5.444 15.205 -1.788 1.00 0.00 C ATOM 0 H ALA A 28 -6.710 14.839 -4.648 1.00 0.00 H new ATOM 0 HA ALA A 28 -4.881 15.673 -3.791 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -4.525 15.586 -1.343 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -6.205 15.986 -1.774 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -5.795 14.346 -1.217 1.00 0.00 H new ATOM 432 N THR A 29 -4.118 12.727 -4.122 1.00 0.00 N ATOM 433 CA THR A 29 -3.133 11.670 -4.268 1.00 0.00 C ATOM 434 C THR A 29 -2.274 11.936 -5.500 1.00 0.00 C ATOM 435 O THR A 29 -1.060 12.123 -5.415 1.00 0.00 O ATOM 436 CB THR A 29 -3.906 10.348 -4.418 1.00 0.00 C ATOM 437 OG1 THR A 29 -4.987 10.535 -5.337 1.00 0.00 O ATOM 438 CG2 THR A 29 -4.466 9.891 -3.061 1.00 0.00 C ATOM 0 H THR A 29 -4.954 12.564 -4.684 1.00 0.00 H new ATOM 0 HA THR A 29 -2.470 11.624 -3.404 1.00 0.00 H new ATOM 0 HB THR A 29 -3.225 9.583 -4.791 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.277 9.665 -5.682 1.00 0.00 H new ATOM 0 HG21 THR A 29 -5.009 8.955 -3.188 1.00 0.00 H new ATOM 0 HG22 THR A 29 -3.645 9.742 -2.360 1.00 0.00 H new ATOM 0 HG23 THR A 29 -5.142 10.652 -2.671 1.00 0.00 H new ATOM 446 N ARG A 30 -2.920 11.945 -6.668 1.00 0.00 N ATOM 447 CA ARG A 30 -2.233 12.108 -7.937 1.00 0.00 C ATOM 448 C ARG A 30 -1.366 13.359 -7.921 1.00 0.00 C ATOM 449 O ARG A 30 -0.195 13.286 -8.276 1.00 0.00 O ATOM 450 CB ARG A 30 -3.238 12.191 -9.091 1.00 0.00 C ATOM 451 CG ARG A 30 -2.576 12.559 -10.434 1.00 0.00 C ATOM 452 CD ARG A 30 -1.820 11.421 -11.129 1.00 0.00 C ATOM 453 NE ARG A 30 -0.660 10.920 -10.373 1.00 0.00 N ATOM 454 CZ ARG A 30 -0.112 9.715 -10.597 1.00 0.00 C ATOM 455 NH1 ARG A 30 -0.576 8.932 -11.569 1.00 0.00 N ATOM 456 NH2 ARG A 30 0.907 9.253 -9.879 1.00 0.00 N ATOM 0 H ARG A 30 -3.931 11.839 -6.754 1.00 0.00 H new ATOM 0 HA ARG A 30 -1.595 11.237 -8.087 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -3.748 11.233 -9.193 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -3.999 12.933 -8.851 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -3.347 12.926 -11.111 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -1.882 13.382 -10.264 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -2.510 10.595 -11.305 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -1.482 11.767 -12.106 1.00 0.00 H new ATOM 0 HE ARG A 30 -0.256 11.513 -9.649 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -1.353 9.246 -12.150 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -0.154 8.018 -11.733 1.00 0.00 H new ATOM 0 HH21 ARG A 30 1.300 9.820 -9.127 1.00 0.00 H new ATOM 0 HH22 ARG A 30 1.296 8.332 -10.080 1.00 0.00 H new ATOM 470 N GLN A 31 -1.982 14.485 -7.549 1.00 0.00 N ATOM 471 CA GLN A 31 -1.426 15.828 -7.661 1.00 0.00 C ATOM 472 C GLN A 31 -0.134 16.013 -6.864 1.00 0.00 C ATOM 473 O GLN A 31 0.649 16.911 -7.173 1.00 0.00 O ATOM 474 CB GLN A 31 -2.492 16.860 -7.259 1.00 0.00 C ATOM 475 CG GLN A 31 -2.964 16.695 -5.806 1.00 0.00 C ATOM 476 CD GLN A 31 -4.035 17.716 -5.439 1.00 0.00 C ATOM 477 OE1 GLN A 31 -3.827 18.557 -4.575 1.00 0.00 O ATOM 478 NE2 GLN A 31 -5.200 17.637 -6.077 1.00 0.00 N ATOM 0 H GLN A 31 -2.919 14.481 -7.146 1.00 0.00 H new ATOM 0 HA GLN A 31 -1.147 15.984 -8.703 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -2.088 17.863 -7.393 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -3.349 16.769 -7.927 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -3.357 15.688 -5.664 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -2.113 16.803 -5.133 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -5.342 16.924 -6.793 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -5.951 18.289 -5.850 1.00 0.00 H new ATOM 487 N VAL A 32 0.077 15.192 -5.827 1.00 0.00 N ATOM 488 CA VAL A 32 1.353 15.124 -5.136 1.00 0.00 C ATOM 489 C VAL A 32 2.230 14.095 -5.854 1.00 0.00 C ATOM 490 O VAL A 32 3.340 14.407 -6.289 1.00 0.00 O ATOM 491 CB VAL A 32 1.146 14.898 -3.623 1.00 0.00 C ATOM 492 CG1 VAL A 32 0.440 13.596 -3.227 1.00 0.00 C ATOM 493 CG2 VAL A 32 2.458 15.003 -2.843 1.00 0.00 C ATOM 0 H VAL A 32 -0.633 14.563 -5.452 1.00 0.00 H new ATOM 0 HA VAL A 32 1.892 16.070 -5.179 1.00 0.00 H new ATOM 0 HB VAL A 32 0.468 15.708 -3.352 1.00 0.00 H new ATOM 0 HG11 VAL A 32 0.350 13.546 -2.142 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.553 13.570 -3.675 1.00 0.00 H new ATOM 0 HG13 VAL A 32 1.020 12.745 -3.583 1.00 0.00 H new ATOM 0 HG21 VAL A 32 2.265 14.837 -1.783 1.00 0.00 H new ATOM 0 HG22 VAL A 32 3.159 14.251 -3.206 1.00 0.00 H new ATOM 0 HG23 VAL A 32 2.886 15.996 -2.983 1.00 0.00 H new ATOM 503 N GLY A 33 1.711 12.881 -6.057 1.00 0.00 N ATOM 504 CA GLY A 33 2.463 11.775 -6.632 1.00 0.00 C ATOM 505 C GLY A 33 2.633 11.846 -8.152 1.00 0.00 C ATOM 506 O GLY A 33 2.772 10.802 -8.785 1.00 0.00 O ATOM 0 H GLY A 33 0.748 12.641 -5.823 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.450 11.744 -6.170 1.00 0.00 H new ATOM 0 HA3 GLY A 33 1.962 10.841 -6.378 1.00 0.00 H new ATOM 510 N ASN A 34 2.616 13.038 -8.749 1.00 0.00 N ATOM 511 CA ASN A 34 3.071 13.311 -10.111 1.00 0.00 C ATOM 512 C ASN A 34 3.794 14.658 -10.149 1.00 0.00 C ATOM 513 O ASN A 34 3.874 15.288 -11.201 1.00 0.00 O ATOM 514 CB ASN A 34 1.901 13.292 -11.112 1.00 0.00 C ATOM 515 CG ASN A 34 0.898 14.439 -10.941 1.00 0.00 C ATOM 516 OD1 ASN A 34 1.006 15.270 -10.043 1.00 0.00 O ATOM 517 ND2 ASN A 34 -0.116 14.489 -11.804 1.00 0.00 N ATOM 0 H ASN A 34 2.271 13.873 -8.277 1.00 0.00 H new ATOM 0 HA ASN A 34 3.763 12.523 -10.408 1.00 0.00 H new ATOM 0 HB2 ASN A 34 2.305 13.327 -12.124 1.00 0.00 H new ATOM 0 HB3 ASN A 34 1.371 12.345 -11.013 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -0.817 15.225 -11.725 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -0.191 13.791 -12.544 1.00 0.00 H new ATOM 524 N MET A 35 4.277 15.114 -8.989 1.00 0.00 N ATOM 525 CA MET A 35 4.728 16.479 -8.786 1.00 0.00 C ATOM 526 C MET A 35 5.939 16.452 -7.862 1.00 0.00 C ATOM 527 O MET A 35 7.002 16.944 -8.231 1.00 0.00 O ATOM 528 CB MET A 35 3.547 17.277 -8.225 1.00 0.00 C ATOM 529 CG MET A 35 3.790 18.783 -8.154 1.00 0.00 C ATOM 530 SD MET A 35 2.288 19.727 -7.764 1.00 0.00 S ATOM 531 CE MET A 35 1.426 19.644 -9.357 1.00 0.00 C ATOM 0 H MET A 35 4.364 14.530 -8.157 1.00 0.00 H new ATOM 0 HA MET A 35 5.046 16.963 -9.709 1.00 0.00 H new ATOM 0 HB2 MET A 35 2.669 17.090 -8.844 1.00 0.00 H new ATOM 0 HB3 MET A 35 3.316 16.909 -7.225 1.00 0.00 H new ATOM 0 HG2 MET A 35 4.548 18.988 -7.398 1.00 0.00 H new ATOM 0 HG3 MET A 35 4.191 19.126 -9.108 1.00 0.00 H new ATOM 0 HE1 MET A 35 0.858 20.561 -9.512 1.00 0.00 H new ATOM 0 HE2 MET A 35 2.155 19.529 -10.159 1.00 0.00 H new ATOM 0 HE3 MET A 35 0.746 18.792 -9.359 1.00 0.00 H new ATOM 541 N THR A 36 5.794 15.823 -6.691 1.00 0.00 N ATOM 542 CA THR A 36 6.946 15.293 -5.980 1.00 0.00 C ATOM 543 C THR A 36 7.136 13.832 -6.387 1.00 0.00 C ATOM 544 O THR A 36 6.343 13.273 -7.148 1.00 0.00 O ATOM 545 CB THR A 36 6.824 15.497 -4.461 1.00 0.00 C ATOM 546 OG1 THR A 36 8.073 15.215 -3.864 1.00 0.00 O ATOM 547 CG2 THR A 36 5.782 14.611 -3.779 1.00 0.00 C ATOM 0 H THR A 36 4.899 15.673 -6.226 1.00 0.00 H new ATOM 0 HA THR A 36 7.844 15.844 -6.259 1.00 0.00 H new ATOM 0 HB THR A 36 6.505 16.530 -4.326 1.00 0.00 H new ATOM 0 HG1 THR A 36 8.009 15.343 -2.895 1.00 0.00 H new ATOM 0 HG21 THR A 36 5.767 14.824 -2.710 1.00 0.00 H new ATOM 0 HG22 THR A 36 4.799 14.813 -4.204 1.00 0.00 H new ATOM 0 HG23 THR A 36 6.037 13.563 -3.936 1.00 0.00 H new ATOM 555 N LYS A 37 8.204 13.226 -5.872 1.00 0.00 N ATOM 556 CA LYS A 37 8.570 11.841 -6.108 1.00 0.00 C ATOM 557 C LYS A 37 8.526 11.125 -4.757 1.00 0.00 C ATOM 558 O LYS A 37 9.557 11.024 -4.095 1.00 0.00 O ATOM 559 CB LYS A 37 9.957 11.767 -6.774 1.00 0.00 C ATOM 560 CG LYS A 37 9.918 12.230 -8.242 1.00 0.00 C ATOM 561 CD LYS A 37 10.132 13.745 -8.416 1.00 0.00 C ATOM 562 CE LYS A 37 11.588 14.113 -8.737 1.00 0.00 C ATOM 563 NZ LYS A 37 11.984 13.712 -10.104 1.00 0.00 N ATOM 0 H LYS A 37 8.859 13.709 -5.257 1.00 0.00 H new ATOM 0 HA LYS A 37 7.878 11.352 -6.793 1.00 0.00 H new ATOM 0 HB2 LYS A 37 10.660 12.387 -6.217 1.00 0.00 H new ATOM 0 HB3 LYS A 37 10.328 10.743 -6.727 1.00 0.00 H new ATOM 0 HG2 LYS A 37 10.685 11.696 -8.803 1.00 0.00 H new ATOM 0 HG3 LYS A 37 8.957 11.955 -8.676 1.00 0.00 H new ATOM 0 HD2 LYS A 37 9.487 14.108 -9.216 1.00 0.00 H new ATOM 0 HD3 LYS A 37 9.827 14.257 -7.503 1.00 0.00 H new ATOM 0 HE2 LYS A 37 11.721 15.189 -8.624 1.00 0.00 H new ATOM 0 HE3 LYS A 37 12.249 13.633 -8.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 12.901 14.141 -10.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 12.064 12.676 -10.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 11.266 14.036 -10.783 1.00 0.00 H new ATOM 577 N PRO A 38 7.341 10.682 -4.303 1.00 0.00 N ATOM 578 CA PRO A 38 7.197 10.068 -2.997 1.00 0.00 C ATOM 579 C PRO A 38 7.929 8.729 -2.956 1.00 0.00 C ATOM 580 O PRO A 38 8.148 8.091 -3.991 1.00 0.00 O ATOM 581 CB PRO A 38 5.690 9.908 -2.787 1.00 0.00 C ATOM 582 CG PRO A 38 5.155 9.762 -4.209 1.00 0.00 C ATOM 583 CD PRO A 38 6.060 10.713 -4.994 1.00 0.00 C ATOM 0 HA PRO A 38 7.636 10.671 -2.202 1.00 0.00 H new ATOM 0 HB2 PRO A 38 5.459 9.034 -2.178 1.00 0.00 H new ATOM 0 HB3 PRO A 38 5.260 10.772 -2.281 1.00 0.00 H new ATOM 0 HG2 PRO A 38 5.232 8.736 -4.570 1.00 0.00 H new ATOM 0 HG3 PRO A 38 4.105 10.047 -4.280 1.00 0.00 H new ATOM 0 HD2 PRO A 38 6.164 10.391 -6.030 1.00 0.00 H new ATOM 0 HD3 PRO A 38 5.648 11.722 -5.013 1.00 0.00 H new ATOM 591 N THR A 39 8.295 8.307 -1.747 1.00 0.00 N ATOM 592 CA THR A 39 8.957 7.043 -1.503 1.00 0.00 C ATOM 593 C THR A 39 7.996 6.115 -0.763 1.00 0.00 C ATOM 594 O THR A 39 7.034 6.563 -0.139 1.00 0.00 O ATOM 595 CB THR A 39 10.259 7.295 -0.729 1.00 0.00 C ATOM 596 OG1 THR A 39 10.023 8.167 0.353 1.00 0.00 O ATOM 597 CG2 THR A 39 11.305 7.973 -1.617 1.00 0.00 C ATOM 0 H THR A 39 8.133 8.850 -0.899 1.00 0.00 H new ATOM 0 HA THR A 39 9.229 6.553 -2.438 1.00 0.00 H new ATOM 0 HB THR A 39 10.618 6.324 -0.387 1.00 0.00 H new ATOM 0 HG1 THR A 39 10.860 8.319 0.839 1.00 0.00 H new ATOM 0 HG21 THR A 39 12.217 8.139 -1.043 1.00 0.00 H new ATOM 0 HG22 THR A 39 11.526 7.334 -2.472 1.00 0.00 H new ATOM 0 HG23 THR A 39 10.918 8.929 -1.969 1.00 0.00 H new ATOM 605 N THR A 40 8.241 4.811 -0.842 1.00 0.00 N ATOM 606 CA THR A 40 7.437 3.809 -0.169 1.00 0.00 C ATOM 607 C THR A 40 8.401 2.776 0.415 1.00 0.00 C ATOM 608 O THR A 40 9.238 2.257 -0.319 1.00 0.00 O ATOM 609 CB THR A 40 6.446 3.194 -1.175 1.00 0.00 C ATOM 610 OG1 THR A 40 5.780 4.199 -1.921 1.00 0.00 O ATOM 611 CG2 THR A 40 5.363 2.377 -0.471 1.00 0.00 C ATOM 0 H THR A 40 9.013 4.421 -1.382 1.00 0.00 H new ATOM 0 HA THR A 40 6.841 4.232 0.640 1.00 0.00 H new ATOM 0 HB THR A 40 7.041 2.556 -1.829 1.00 0.00 H new ATOM 0 HG1 THR A 40 4.855 4.281 -1.607 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.683 1.959 -1.213 1.00 0.00 H new ATOM 0 HG22 THR A 40 5.827 1.568 0.093 1.00 0.00 H new ATOM 0 HG23 THR A 40 4.806 3.021 0.210 1.00 0.00 H new ATOM 619 N ILE A 41 8.307 2.478 1.713 1.00 0.00 N ATOM 620 CA ILE A 41 9.040 1.383 2.342 1.00 0.00 C ATOM 621 C ILE A 41 8.212 0.117 2.149 1.00 0.00 C ATOM 622 O ILE A 41 7.020 0.129 2.465 1.00 0.00 O ATOM 623 CB ILE A 41 9.281 1.702 3.833 1.00 0.00 C ATOM 624 CG1 ILE A 41 10.552 2.548 4.014 1.00 0.00 C ATOM 625 CG2 ILE A 41 9.334 0.460 4.736 1.00 0.00 C ATOM 626 CD1 ILE A 41 11.856 1.745 3.980 1.00 0.00 C ATOM 0 H ILE A 41 7.714 2.996 2.361 1.00 0.00 H new ATOM 0 HA ILE A 41 10.022 1.243 1.891 1.00 0.00 H new ATOM 0 HB ILE A 41 8.411 2.275 4.154 1.00 0.00 H new ATOM 0 HG12 ILE A 41 10.585 3.305 3.230 1.00 0.00 H new ATOM 0 HG13 ILE A 41 10.490 3.077 4.965 1.00 0.00 H new ATOM 0 HG21 ILE A 41 9.506 0.767 5.768 1.00 0.00 H new ATOM 0 HG22 ILE A 41 8.388 -0.078 4.671 1.00 0.00 H new ATOM 0 HG23 ILE A 41 10.145 -0.192 4.411 1.00 0.00 H new ATOM 0 HD11 ILE A 41 12.702 2.419 4.115 1.00 0.00 H new ATOM 0 HD12 ILE A 41 11.849 1.006 4.781 1.00 0.00 H new ATOM 0 HD13 ILE A 41 11.946 1.238 3.019 1.00 0.00 H new ATOM 638 N ILE A 42 8.819 -0.942 1.598 1.00 0.00 N ATOM 639 CA ILE A 42 8.201 -2.252 1.466 1.00 0.00 C ATOM 640 C ILE A 42 9.111 -3.273 2.150 1.00 0.00 C ATOM 641 O ILE A 42 10.225 -3.515 1.682 1.00 0.00 O ATOM 642 CB ILE A 42 7.937 -2.605 -0.009 1.00 0.00 C ATOM 643 CG1 ILE A 42 6.904 -1.660 -0.648 1.00 0.00 C ATOM 644 CG2 ILE A 42 7.369 -4.027 -0.097 1.00 0.00 C ATOM 645 CD1 ILE A 42 7.473 -0.304 -1.054 1.00 0.00 C ATOM 0 H ILE A 42 9.769 -0.904 1.228 1.00 0.00 H new ATOM 0 HA ILE A 42 7.224 -2.256 1.950 1.00 0.00 H new ATOM 0 HB ILE A 42 8.885 -2.514 -0.538 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.480 -2.143 -1.528 1.00 0.00 H new ATOM 0 HG13 ILE A 42 6.086 -1.504 0.055 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.181 -4.280 -1.140 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.086 -4.732 0.324 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.436 -4.081 0.463 1.00 0.00 H new ATOM 0 HD11 ILE A 42 6.684 0.304 -1.496 1.00 0.00 H new ATOM 0 HD12 ILE A 42 7.871 0.202 -0.174 1.00 0.00 H new ATOM 0 HD13 ILE A 42 8.271 -0.448 -1.782 1.00 0.00 H new ATOM 657 N GLU A 43 8.645 -3.861 3.256 1.00 0.00 N ATOM 658 CA GLU A 43 9.418 -4.792 4.069 1.00 0.00 C ATOM 659 C GLU A 43 8.762 -6.174 4.046 1.00 0.00 C ATOM 660 O GLU A 43 7.544 -6.287 4.206 1.00 0.00 O ATOM 661 CB GLU A 43 9.517 -4.239 5.495 1.00 0.00 C ATOM 662 CG GLU A 43 10.435 -5.068 6.399 1.00 0.00 C ATOM 663 CD GLU A 43 10.367 -4.540 7.824 1.00 0.00 C ATOM 664 OE1 GLU A 43 9.471 -5.011 8.554 1.00 0.00 O ATOM 665 OE2 GLU A 43 11.185 -3.648 8.135 1.00 0.00 O ATOM 0 H GLU A 43 7.704 -3.698 3.614 1.00 0.00 H new ATOM 0 HA GLU A 43 10.425 -4.900 3.666 1.00 0.00 H new ATOM 0 HB2 GLU A 43 9.885 -3.214 5.456 1.00 0.00 H new ATOM 0 HB3 GLU A 43 8.520 -4.203 5.934 1.00 0.00 H new ATOM 0 HG2 GLU A 43 10.135 -6.116 6.375 1.00 0.00 H new ATOM 0 HG3 GLU A 43 11.460 -5.021 6.033 1.00 0.00 H new ATOM 672 N VAL A 44 9.570 -7.225 3.861 1.00 0.00 N ATOM 673 CA VAL A 44 9.130 -8.609 3.979 1.00 0.00 C ATOM 674 C VAL A 44 8.888 -8.942 5.454 1.00 0.00 C ATOM 675 O VAL A 44 9.716 -9.552 6.125 1.00 0.00 O ATOM 676 CB VAL A 44 10.091 -9.570 3.247 1.00 0.00 C ATOM 677 CG1 VAL A 44 11.549 -9.544 3.735 1.00 0.00 C ATOM 678 CG2 VAL A 44 9.571 -11.014 3.276 1.00 0.00 C ATOM 0 H VAL A 44 10.557 -7.131 3.623 1.00 0.00 H new ATOM 0 HA VAL A 44 8.175 -8.746 3.471 1.00 0.00 H new ATOM 0 HB VAL A 44 10.108 -9.190 2.225 1.00 0.00 H new ATOM 0 HG11 VAL A 44 12.139 -10.254 3.156 1.00 0.00 H new ATOM 0 HG12 VAL A 44 11.958 -8.542 3.606 1.00 0.00 H new ATOM 0 HG13 VAL A 44 11.585 -9.817 4.790 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.272 -11.664 2.752 1.00 0.00 H new ATOM 0 HG22 VAL A 44 9.473 -11.345 4.310 1.00 0.00 H new ATOM 0 HG23 VAL A 44 8.598 -11.060 2.787 1.00 0.00 H new ATOM 688 N ASN A 45 7.731 -8.520 5.959 1.00 0.00 N ATOM 689 CA ASN A 45 7.225 -8.967 7.251 1.00 0.00 C ATOM 690 C ASN A 45 7.175 -10.505 7.282 1.00 0.00 C ATOM 691 O ASN A 45 7.098 -11.129 6.229 1.00 0.00 O ATOM 692 CB ASN A 45 5.849 -8.336 7.482 1.00 0.00 C ATOM 693 CG ASN A 45 5.322 -8.540 8.900 1.00 0.00 C ATOM 694 OD1 ASN A 45 6.005 -9.072 9.771 1.00 0.00 O ATOM 695 ND2 ASN A 45 4.097 -8.089 9.155 1.00 0.00 N ATOM 0 H ASN A 45 7.119 -7.858 5.482 1.00 0.00 H new ATOM 0 HA ASN A 45 7.885 -8.650 8.059 1.00 0.00 H new ATOM 0 HB2 ASN A 45 5.907 -7.268 7.274 1.00 0.00 H new ATOM 0 HB3 ASN A 45 5.138 -8.761 6.773 1.00 0.00 H new ATOM 0 HD21 ASN A 45 3.704 -8.181 10.092 1.00 0.00 H new ATOM 0 HD22 ASN A 45 3.550 -7.651 8.414 1.00 0.00 H new ATOM 702 N GLY A 46 7.244 -11.106 8.475 1.00 0.00 N ATOM 703 CA GLY A 46 7.441 -12.532 8.744 1.00 0.00 C ATOM 704 C GLY A 46 7.170 -13.480 7.570 1.00 0.00 C ATOM 705 O GLY A 46 8.105 -14.017 6.978 1.00 0.00 O ATOM 0 H GLY A 46 7.157 -10.569 9.338 1.00 0.00 H new ATOM 0 HA2 GLY A 46 8.469 -12.681 9.076 1.00 0.00 H new ATOM 0 HA3 GLY A 46 6.794 -12.818 9.573 1.00 0.00 H new ATOM 709 N ASP A 47 5.891 -13.706 7.259 1.00 0.00 N ATOM 710 CA ASP A 47 5.413 -14.551 6.168 1.00 0.00 C ATOM 711 C ASP A 47 4.721 -13.705 5.084 1.00 0.00 C ATOM 712 O ASP A 47 4.005 -14.241 4.232 1.00 0.00 O ATOM 713 CB ASP A 47 4.388 -15.524 6.768 1.00 0.00 C ATOM 714 CG ASP A 47 3.076 -14.800 7.041 1.00 0.00 C ATOM 715 OD1 ASP A 47 3.151 -13.725 7.678 1.00 0.00 O ATOM 716 OD2 ASP A 47 2.049 -15.282 6.510 1.00 0.00 O ATOM 0 H ASP A 47 5.127 -13.284 7.787 1.00 0.00 H new ATOM 0 HA ASP A 47 6.251 -15.075 5.708 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.218 -16.354 6.082 1.00 0.00 H new ATOM 0 HB3 ASP A 47 4.777 -15.949 7.693 1.00 0.00 H new ATOM 721 N THR A 48 4.851 -12.388 5.188 1.00 0.00 N ATOM 722 CA THR A 48 3.917 -11.381 4.726 1.00 0.00 C ATOM 723 C THR A 48 4.718 -10.318 3.967 1.00 0.00 C ATOM 724 O THR A 48 5.897 -10.505 3.673 1.00 0.00 O ATOM 725 CB THR A 48 3.207 -10.801 5.980 1.00 0.00 C ATOM 726 OG1 THR A 48 3.857 -11.190 7.178 1.00 0.00 O ATOM 727 CG2 THR A 48 1.758 -11.268 6.122 1.00 0.00 C ATOM 0 H THR A 48 5.671 -11.971 5.629 1.00 0.00 H new ATOM 0 HA THR A 48 3.158 -11.779 4.052 1.00 0.00 H new ATOM 0 HB THR A 48 3.243 -9.722 5.832 1.00 0.00 H new ATOM 0 HG1 THR A 48 3.511 -12.059 7.471 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.320 -10.827 7.017 1.00 0.00 H new ATOM 0 HG22 THR A 48 1.188 -10.956 5.247 1.00 0.00 H new ATOM 0 HG23 THR A 48 1.732 -12.355 6.203 1.00 0.00 H new ATOM 735 N VAL A 49 4.102 -9.179 3.659 1.00 0.00 N ATOM 736 CA VAL A 49 4.836 -7.981 3.306 1.00 0.00 C ATOM 737 C VAL A 49 4.058 -6.791 3.863 1.00 0.00 C ATOM 738 O VAL A 49 2.832 -6.862 3.967 1.00 0.00 O ATOM 739 CB VAL A 49 5.069 -7.944 1.787 1.00 0.00 C ATOM 740 CG1 VAL A 49 3.777 -7.690 1.007 1.00 0.00 C ATOM 741 CG2 VAL A 49 6.115 -6.898 1.394 1.00 0.00 C ATOM 0 H VAL A 49 3.088 -9.067 3.649 1.00 0.00 H new ATOM 0 HA VAL A 49 5.834 -7.954 3.744 1.00 0.00 H new ATOM 0 HB VAL A 49 5.443 -8.933 1.521 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.994 -7.673 -0.061 1.00 0.00 H new ATOM 0 HG12 VAL A 49 3.062 -8.485 1.219 1.00 0.00 H new ATOM 0 HG13 VAL A 49 3.354 -6.731 1.307 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.249 -6.906 0.312 1.00 0.00 H new ATOM 0 HG22 VAL A 49 5.779 -5.911 1.711 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.063 -7.132 1.878 1.00 0.00 H new ATOM 751 N ILE A 50 4.754 -5.728 4.270 1.00 0.00 N ATOM 752 CA ILE A 50 4.134 -4.492 4.732 1.00 0.00 C ATOM 753 C ILE A 50 4.621 -3.335 3.873 1.00 0.00 C ATOM 754 O ILE A 50 5.810 -3.266 3.561 1.00 0.00 O ATOM 755 CB ILE A 50 4.358 -4.276 6.242 1.00 0.00 C ATOM 756 CG1 ILE A 50 3.572 -3.043 6.725 1.00 0.00 C ATOM 757 CG2 ILE A 50 5.846 -4.158 6.594 1.00 0.00 C ATOM 758 CD1 ILE A 50 3.653 -2.835 8.240 1.00 0.00 C ATOM 0 H ILE A 50 5.774 -5.704 4.287 1.00 0.00 H new ATOM 0 HA ILE A 50 3.052 -4.556 4.613 1.00 0.00 H new ATOM 0 HB ILE A 50 3.982 -5.157 6.763 1.00 0.00 H new ATOM 0 HG12 ILE A 50 3.955 -2.155 6.221 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.527 -3.149 6.434 1.00 0.00 H new ATOM 0 HG21 ILE A 50 5.955 -4.007 7.668 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.363 -5.072 6.302 1.00 0.00 H new ATOM 0 HG23 ILE A 50 6.280 -3.311 6.062 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.079 -1.951 8.517 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.244 -3.707 8.749 1.00 0.00 H new ATOM 0 HD13 ILE A 50 4.694 -2.698 8.533 1.00 0.00 H new ATOM 770 N ILE A 51 3.684 -2.464 3.480 1.00 0.00 N ATOM 771 CA ILE A 51 3.927 -1.272 2.684 1.00 0.00 C ATOM 772 C ILE A 51 3.651 -0.048 3.565 1.00 0.00 C ATOM 773 O ILE A 51 2.685 -0.060 4.329 1.00 0.00 O ATOM 774 CB ILE A 51 3.048 -1.322 1.416 1.00 0.00 C ATOM 775 CG1 ILE A 51 3.391 -2.602 0.621 1.00 0.00 C ATOM 776 CG2 ILE A 51 3.239 -0.058 0.568 1.00 0.00 C ATOM 777 CD1 ILE A 51 3.018 -2.556 -0.866 1.00 0.00 C ATOM 0 H ILE A 51 2.700 -2.582 3.721 1.00 0.00 H new ATOM 0 HA ILE A 51 4.961 -1.211 2.345 1.00 0.00 H new ATOM 0 HB ILE A 51 1.996 -1.354 1.698 1.00 0.00 H new ATOM 0 HG12 ILE A 51 4.461 -2.790 0.707 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.881 -3.447 1.083 1.00 0.00 H new ATOM 0 HG21 ILE A 51 2.609 -0.117 -0.320 1.00 0.00 H new ATOM 0 HG22 ILE A 51 2.960 0.818 1.153 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.283 0.024 0.267 1.00 0.00 H new ATOM 0 HD11 ILE A 51 3.296 -3.497 -1.340 1.00 0.00 H new ATOM 0 HD12 ILE A 51 1.944 -2.403 -0.967 1.00 0.00 H new ATOM 0 HD13 ILE A 51 3.549 -1.735 -1.349 1.00 0.00 H new ATOM 789 N LYS A 52 4.506 0.979 3.465 1.00 0.00 N ATOM 790 CA LYS A 52 4.464 2.247 4.195 1.00 0.00 C ATOM 791 C LYS A 52 4.733 3.389 3.203 1.00 0.00 C ATOM 792 O LYS A 52 5.825 3.423 2.637 1.00 0.00 O ATOM 793 CB LYS A 52 5.597 2.225 5.237 1.00 0.00 C ATOM 794 CG LYS A 52 5.204 1.660 6.604 1.00 0.00 C ATOM 795 CD LYS A 52 4.926 2.810 7.586 1.00 0.00 C ATOM 796 CE LYS A 52 4.579 2.248 8.970 1.00 0.00 C ATOM 797 NZ LYS A 52 4.072 3.287 9.888 1.00 0.00 N ATOM 0 H LYS A 52 5.300 0.940 2.826 1.00 0.00 H new ATOM 0 HA LYS A 52 3.496 2.388 4.676 1.00 0.00 H new ATOM 0 HB2 LYS A 52 6.424 1.636 4.841 1.00 0.00 H new ATOM 0 HB3 LYS A 52 5.966 3.242 5.373 1.00 0.00 H new ATOM 0 HG2 LYS A 52 4.319 1.032 6.506 1.00 0.00 H new ATOM 0 HG3 LYS A 52 6.003 1.027 6.989 1.00 0.00 H new ATOM 0 HD2 LYS A 52 5.800 3.458 7.656 1.00 0.00 H new ATOM 0 HD3 LYS A 52 4.104 3.423 7.217 1.00 0.00 H new ATOM 0 HE2 LYS A 52 3.829 1.464 8.863 1.00 0.00 H new ATOM 0 HE3 LYS A 52 5.465 1.785 9.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 3.434 2.853 10.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 4.871 3.734 10.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 3.554 4.007 9.345 1.00 0.00 H new ATOM 811 N THR A 53 3.794 4.322 2.989 1.00 0.00 N ATOM 812 CA THR A 53 3.912 5.376 1.977 1.00 0.00 C ATOM 813 C THR A 53 4.559 6.656 2.530 1.00 0.00 C ATOM 814 O THR A 53 3.889 7.477 3.154 1.00 0.00 O ATOM 815 CB THR A 53 2.529 5.673 1.362 1.00 0.00 C ATOM 816 OG1 THR A 53 1.628 6.195 2.314 1.00 0.00 O ATOM 817 CG2 THR A 53 1.873 4.428 0.773 1.00 0.00 C ATOM 0 H THR A 53 2.924 4.365 3.520 1.00 0.00 H new ATOM 0 HA THR A 53 4.578 5.009 1.196 1.00 0.00 H new ATOM 0 HB THR A 53 2.726 6.403 0.577 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.496 7.152 2.149 1.00 0.00 H new ATOM 0 HG21 THR A 53 0.902 4.692 0.353 1.00 0.00 H new ATOM 0 HG22 THR A 53 2.509 4.019 -0.012 1.00 0.00 H new ATOM 0 HG23 THR A 53 1.739 3.682 1.557 1.00 0.00 H new ATOM 825 N GLN A 54 5.847 6.889 2.268 1.00 0.00 N ATOM 826 CA GLN A 54 6.478 8.173 2.549 1.00 0.00 C ATOM 827 C GLN A 54 6.191 9.126 1.384 1.00 0.00 C ATOM 828 O GLN A 54 7.072 9.485 0.601 1.00 0.00 O ATOM 829 CB GLN A 54 7.982 8.022 2.817 1.00 0.00 C ATOM 830 CG GLN A 54 8.316 7.491 4.217 1.00 0.00 C ATOM 831 CD GLN A 54 8.359 5.971 4.248 1.00 0.00 C ATOM 832 OE1 GLN A 54 9.425 5.373 4.191 1.00 0.00 O ATOM 833 NE2 GLN A 54 7.198 5.334 4.319 1.00 0.00 N ATOM 0 H GLN A 54 6.474 6.197 1.858 1.00 0.00 H new ATOM 0 HA GLN A 54 6.056 8.592 3.462 1.00 0.00 H new ATOM 0 HB2 GLN A 54 8.407 7.348 2.073 1.00 0.00 H new ATOM 0 HB3 GLN A 54 8.464 8.991 2.682 1.00 0.00 H new ATOM 0 HG2 GLN A 54 9.279 7.889 4.537 1.00 0.00 H new ATOM 0 HG3 GLN A 54 7.572 7.848 4.929 1.00 0.00 H new ATOM 0 HE21 GLN A 54 6.328 5.864 4.365 1.00 0.00 H new ATOM 0 HE22 GLN A 54 7.175 4.314 4.327 1.00 0.00 H new ATOM 842 N SER A 55 4.936 9.571 1.303 1.00 0.00 N ATOM 843 CA SER A 55 4.633 10.846 0.674 1.00 0.00 C ATOM 844 C SER A 55 4.723 11.931 1.746 1.00 0.00 C ATOM 845 O SER A 55 5.003 11.642 2.910 1.00 0.00 O ATOM 846 CB SER A 55 3.241 10.800 0.037 1.00 0.00 C ATOM 847 OG SER A 55 3.021 11.942 -0.773 1.00 0.00 O ATOM 0 H SER A 55 4.124 9.069 1.663 1.00 0.00 H new ATOM 0 HA SER A 55 5.344 11.064 -0.123 1.00 0.00 H new ATOM 0 HB2 SER A 55 3.141 9.897 -0.565 1.00 0.00 H new ATOM 0 HB3 SER A 55 2.481 10.749 0.816 1.00 0.00 H new ATOM 0 HG SER A 55 2.127 11.893 -1.172 1.00 0.00 H new ATOM 853 N THR A 56 4.445 13.172 1.355 1.00 0.00 N ATOM 854 CA THR A 56 4.294 14.281 2.275 1.00 0.00 C ATOM 855 C THR A 56 2.915 14.150 2.916 1.00 0.00 C ATOM 856 O THR A 56 2.785 13.832 4.093 1.00 0.00 O ATOM 857 CB THR A 56 4.431 15.586 1.479 1.00 0.00 C ATOM 858 OG1 THR A 56 3.662 15.489 0.294 1.00 0.00 O ATOM 859 CG2 THR A 56 5.880 15.826 1.053 1.00 0.00 C ATOM 0 H THR A 56 4.318 13.432 0.377 1.00 0.00 H new ATOM 0 HA THR A 56 5.052 14.282 3.058 1.00 0.00 H new ATOM 0 HB THR A 56 4.093 16.402 2.118 1.00 0.00 H new ATOM 0 HG1 THR A 56 2.885 16.082 0.359 1.00 0.00 H new ATOM 0 HG21 THR A 56 5.944 16.758 0.491 1.00 0.00 H new ATOM 0 HG22 THR A 56 6.513 15.891 1.938 1.00 0.00 H new ATOM 0 HG23 THR A 56 6.216 15.000 0.426 1.00 0.00 H new ATOM 867 N PHE A 57 1.878 14.361 2.105 1.00 0.00 N ATOM 868 CA PHE A 57 0.493 14.420 2.551 1.00 0.00 C ATOM 869 C PHE A 57 -0.261 13.133 2.214 1.00 0.00 C ATOM 870 O PHE A 57 -1.443 13.178 1.882 1.00 0.00 O ATOM 871 CB PHE A 57 -0.170 15.666 1.949 1.00 0.00 C ATOM 872 CG PHE A 57 0.625 16.939 2.185 1.00 0.00 C ATOM 873 CD1 PHE A 57 0.845 17.388 3.499 1.00 0.00 C ATOM 874 CD2 PHE A 57 1.259 17.593 1.112 1.00 0.00 C ATOM 875 CE1 PHE A 57 1.687 18.486 3.740 1.00 0.00 C ATOM 876 CE2 PHE A 57 2.096 18.695 1.353 1.00 0.00 C ATOM 877 CZ PHE A 57 2.313 19.140 2.668 1.00 0.00 C ATOM 0 H PHE A 57 1.984 14.498 1.100 1.00 0.00 H new ATOM 0 HA PHE A 57 0.462 14.503 3.637 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -0.299 15.519 0.877 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -1.166 15.782 2.377 1.00 0.00 H new ATOM 0 HD1 PHE A 57 0.365 16.887 4.326 1.00 0.00 H new ATOM 0 HD2 PHE A 57 1.102 17.247 0.101 1.00 0.00 H new ATOM 0 HE1 PHE A 57 1.853 18.827 4.751 1.00 0.00 H new ATOM 0 HE2 PHE A 57 2.573 19.201 0.527 1.00 0.00 H new ATOM 0 HZ PHE A 57 2.961 19.984 2.853 1.00 0.00 H new ATOM 887 N LYS A 58 0.413 11.984 2.329 1.00 0.00 N ATOM 888 CA LYS A 58 -0.214 10.670 2.270 1.00 0.00 C ATOM 889 C LYS A 58 0.699 9.659 2.960 1.00 0.00 C ATOM 890 O LYS A 58 1.452 8.939 2.300 1.00 0.00 O ATOM 891 CB LYS A 58 -0.539 10.256 0.824 1.00 0.00 C ATOM 892 CG LYS A 58 -1.394 8.979 0.815 1.00 0.00 C ATOM 893 CD LYS A 58 -1.473 8.396 -0.600 1.00 0.00 C ATOM 894 CE LYS A 58 -2.467 7.227 -0.667 1.00 0.00 C ATOM 895 NZ LYS A 58 -2.009 6.039 0.080 1.00 0.00 N ATOM 0 H LYS A 58 1.423 11.946 2.467 1.00 0.00 H new ATOM 0 HA LYS A 58 -1.170 10.704 2.793 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -1.071 11.062 0.319 1.00 0.00 H new ATOM 0 HB3 LYS A 58 0.385 10.087 0.270 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -0.965 8.243 1.495 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -2.397 9.203 1.179 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -1.776 9.175 -1.300 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -0.486 8.055 -0.911 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -3.429 7.551 -0.269 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -2.629 6.954 -1.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -2.761 5.321 0.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -1.160 5.648 -0.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -1.783 6.310 1.058 1.00 0.00 H new ATOM 909 N ASN A 59 0.614 9.588 4.288 1.00 0.00 N ATOM 910 CA ASN A 59 1.275 8.551 5.064 1.00 0.00 C ATOM 911 C ASN A 59 0.223 7.527 5.458 1.00 0.00 C ATOM 912 O ASN A 59 -0.603 7.773 6.333 1.00 0.00 O ATOM 913 CB ASN A 59 2.061 9.141 6.239 1.00 0.00 C ATOM 914 CG ASN A 59 3.102 10.163 5.775 1.00 0.00 C ATOM 915 OD1 ASN A 59 3.225 11.228 6.368 1.00 0.00 O ATOM 916 ND2 ASN A 59 3.840 9.868 4.706 1.00 0.00 N ATOM 0 H ASN A 59 0.083 10.251 4.853 1.00 0.00 H new ATOM 0 HA ASN A 59 2.036 8.041 4.473 1.00 0.00 H new ATOM 0 HB2 ASN A 59 1.370 9.617 6.935 1.00 0.00 H new ATOM 0 HB3 ASN A 59 2.558 8.338 6.783 1.00 0.00 H new ATOM 0 HD21 ASN A 59 4.529 10.537 4.362 1.00 0.00 H new ATOM 0 HD22 ASN A 59 3.716 8.973 4.232 1.00 0.00 H new ATOM 923 N THR A 60 0.234 6.404 4.743 1.00 0.00 N ATOM 924 CA THR A 60 -0.668 5.277 4.886 1.00 0.00 C ATOM 925 C THR A 60 0.209 4.029 4.931 1.00 0.00 C ATOM 926 O THR A 60 1.343 4.056 4.442 1.00 0.00 O ATOM 927 CB THR A 60 -1.654 5.233 3.699 1.00 0.00 C ATOM 928 OG1 THR A 60 -1.070 5.760 2.519 1.00 0.00 O ATOM 929 CG2 THR A 60 -2.902 6.061 3.995 1.00 0.00 C ATOM 0 H THR A 60 0.919 6.253 4.003 1.00 0.00 H new ATOM 0 HA THR A 60 -1.271 5.352 5.791 1.00 0.00 H new ATOM 0 HB THR A 60 -1.913 4.184 3.554 1.00 0.00 H new ATOM 0 HG1 THR A 60 -0.094 5.695 2.580 1.00 0.00 H new ATOM 0 HG21 THR A 60 -3.581 6.014 3.143 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.401 5.664 4.879 1.00 0.00 H new ATOM 0 HG23 THR A 60 -2.617 7.098 4.174 1.00 0.00 H new ATOM 937 N GLU A 61 -0.300 2.952 5.526 1.00 0.00 N ATOM 938 CA GLU A 61 0.462 1.743 5.754 1.00 0.00 C ATOM 939 C GLU A 61 -0.483 0.554 5.799 1.00 0.00 C ATOM 940 O GLU A 61 -1.615 0.697 6.261 1.00 0.00 O ATOM 941 CB GLU A 61 1.282 1.889 7.040 1.00 0.00 C ATOM 942 CG GLU A 61 0.449 2.241 8.288 1.00 0.00 C ATOM 943 CD GLU A 61 1.324 2.941 9.308 1.00 0.00 C ATOM 944 OE1 GLU A 61 1.785 4.065 9.005 1.00 0.00 O ATOM 945 OE2 GLU A 61 1.731 2.302 10.304 1.00 0.00 O ATOM 0 H GLU A 61 -1.261 2.901 5.863 1.00 0.00 H new ATOM 0 HA GLU A 61 1.165 1.573 4.939 1.00 0.00 H new ATOM 0 HB2 GLU A 61 1.815 0.956 7.225 1.00 0.00 H new ATOM 0 HB3 GLU A 61 2.035 2.662 6.891 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -0.386 2.884 8.010 1.00 0.00 H new ATOM 0 HG3 GLU A 61 0.024 1.335 8.720 1.00 0.00 H new ATOM 952 N ILE A 62 -0.039 -0.599 5.289 1.00 0.00 N ATOM 953 CA ILE A 62 -0.885 -1.781 5.206 1.00 0.00 C ATOM 954 C ILE A 62 0.007 -3.024 5.075 1.00 0.00 C ATOM 955 O ILE A 62 0.944 -3.046 4.272 1.00 0.00 O ATOM 956 CB ILE A 62 -1.926 -1.591 4.074 1.00 0.00 C ATOM 957 CG1 ILE A 62 -3.260 -2.324 4.305 1.00 0.00 C ATOM 958 CG2 ILE A 62 -1.356 -1.839 2.675 1.00 0.00 C ATOM 959 CD1 ILE A 62 -3.169 -3.839 4.499 1.00 0.00 C ATOM 0 H ILE A 62 0.905 -0.733 4.928 1.00 0.00 H new ATOM 0 HA ILE A 62 -1.471 -1.930 6.113 1.00 0.00 H new ATOM 0 HB ILE A 62 -2.174 -0.531 4.120 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.741 -1.894 5.184 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -3.913 -2.125 3.455 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -2.139 -1.689 1.931 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.538 -1.144 2.487 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -0.985 -2.862 2.609 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -4.168 -4.247 4.653 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.724 -4.293 3.614 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -2.550 -4.058 5.369 1.00 0.00 H new ATOM 971 N SER A 63 -0.249 -4.032 5.915 1.00 0.00 N ATOM 972 CA SER A 63 0.394 -5.335 5.940 1.00 0.00 C ATOM 973 C SER A 63 -0.498 -6.349 5.229 1.00 0.00 C ATOM 974 O SER A 63 -1.660 -6.473 5.616 1.00 0.00 O ATOM 975 CB SER A 63 0.543 -5.730 7.411 1.00 0.00 C ATOM 976 OG SER A 63 -0.701 -5.535 8.060 1.00 0.00 O ATOM 0 H SER A 63 -0.960 -3.946 6.641 1.00 0.00 H new ATOM 0 HA SER A 63 1.363 -5.308 5.442 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.853 -6.772 7.493 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.317 -5.128 7.888 1.00 0.00 H new ATOM 0 HG SER A 63 -1.429 -5.784 7.453 1.00 0.00 H new ATOM 982 N PHE A 64 0.020 -7.098 4.251 1.00 0.00 N ATOM 983 CA PHE A 64 -0.748 -8.140 3.585 1.00 0.00 C ATOM 984 C PHE A 64 0.094 -9.381 3.313 1.00 0.00 C ATOM 985 O PHE A 64 1.322 -9.322 3.253 1.00 0.00 O ATOM 986 CB PHE A 64 -1.405 -7.595 2.307 1.00 0.00 C ATOM 987 CG PHE A 64 -0.453 -6.998 1.294 1.00 0.00 C ATOM 988 CD1 PHE A 64 0.255 -7.827 0.410 1.00 0.00 C ATOM 989 CD2 PHE A 64 -0.296 -5.604 1.218 1.00 0.00 C ATOM 990 CE1 PHE A 64 1.126 -7.263 -0.536 1.00 0.00 C ATOM 991 CE2 PHE A 64 0.587 -5.041 0.286 1.00 0.00 C ATOM 992 CZ PHE A 64 1.319 -5.875 -0.577 1.00 0.00 C ATOM 0 H PHE A 64 0.974 -6.997 3.905 1.00 0.00 H new ATOM 0 HA PHE A 64 -1.545 -8.453 4.260 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.957 -8.404 1.829 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -2.133 -6.835 2.589 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.130 -8.899 0.457 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -0.858 -4.963 1.881 1.00 0.00 H new ATOM 0 HE1 PHE A 64 1.649 -7.900 -1.234 1.00 0.00 H new ATOM 0 HE2 PHE A 64 0.705 -3.969 0.231 1.00 0.00 H new ATOM 0 HZ PHE A 64 2.028 -5.447 -1.270 1.00 0.00 H new ATOM 1002 N LYS A 65 -0.592 -10.518 3.170 1.00 0.00 N ATOM 1003 CA LYS A 65 -0.002 -11.812 2.876 1.00 0.00 C ATOM 1004 C LYS A 65 -0.233 -12.097 1.397 1.00 0.00 C ATOM 1005 O LYS A 65 -1.374 -12.247 0.963 1.00 0.00 O ATOM 1006 CB LYS A 65 -0.646 -12.882 3.772 1.00 0.00 C ATOM 1007 CG LYS A 65 0.235 -14.117 4.009 1.00 0.00 C ATOM 1008 CD LYS A 65 0.735 -14.812 2.734 1.00 0.00 C ATOM 1009 CE LYS A 65 1.246 -16.227 3.034 1.00 0.00 C ATOM 1010 NZ LYS A 65 2.260 -16.233 4.108 1.00 0.00 N ATOM 0 H LYS A 65 -1.607 -10.557 3.260 1.00 0.00 H new ATOM 0 HA LYS A 65 1.069 -11.821 3.079 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.891 -12.434 4.735 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -1.585 -13.201 3.320 1.00 0.00 H new ATOM 0 HG2 LYS A 65 1.098 -13.820 4.605 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.328 -14.838 4.601 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -0.073 -14.862 2.004 1.00 0.00 H new ATOM 0 HD3 LYS A 65 1.534 -14.222 2.285 1.00 0.00 H new ATOM 0 HE2 LYS A 65 0.408 -16.861 3.323 1.00 0.00 H new ATOM 0 HE3 LYS A 65 1.674 -16.657 2.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 2.664 -17.187 4.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 3.016 -15.557 3.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 1.815 -15.959 5.007 1.00 0.00 H new ATOM 1024 N LEU A 66 0.850 -12.184 0.625 1.00 0.00 N ATOM 1025 CA LEU A 66 0.807 -12.568 -0.775 1.00 0.00 C ATOM 1026 C LEU A 66 0.424 -14.045 -0.938 1.00 0.00 C ATOM 1027 O LEU A 66 1.244 -14.871 -1.326 1.00 0.00 O ATOM 1028 CB LEU A 66 2.121 -12.187 -1.476 1.00 0.00 C ATOM 1029 CG LEU A 66 3.386 -12.671 -0.733 1.00 0.00 C ATOM 1030 CD1 LEU A 66 4.368 -13.350 -1.694 1.00 0.00 C ATOM 1031 CD2 LEU A 66 4.101 -11.501 -0.041 1.00 0.00 C ATOM 0 H LEU A 66 1.791 -11.986 0.964 1.00 0.00 H new ATOM 0 HA LEU A 66 0.017 -12.008 -1.275 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.120 -12.605 -2.483 1.00 0.00 H new ATOM 0 HB3 LEU A 66 2.165 -11.103 -1.581 1.00 0.00 H new ATOM 0 HG LEU A 66 3.058 -13.391 0.016 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.248 -13.680 -1.142 1.00 0.00 H new ATOM 0 HD12 LEU A 66 3.887 -14.211 -2.158 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.669 -12.643 -2.467 1.00 0.00 H new ATOM 0 HD21 LEU A 66 4.988 -11.870 0.474 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.396 -10.762 -0.787 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.428 -11.039 0.681 1.00 0.00 H new ATOM 1043 N GLY A 67 -0.844 -14.361 -0.663 1.00 0.00 N ATOM 1044 CA GLY A 67 -1.469 -15.636 -0.989 1.00 0.00 C ATOM 1045 C GLY A 67 -2.738 -15.875 -0.167 1.00 0.00 C ATOM 1046 O GLY A 67 -2.961 -17.001 0.270 1.00 0.00 O ATOM 0 H GLY A 67 -1.479 -13.715 -0.194 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.714 -15.659 -2.051 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -0.761 -16.445 -0.807 1.00 0.00 H new ATOM 1050 N VAL A 68 -3.544 -14.834 0.085 1.00 0.00 N ATOM 1051 CA VAL A 68 -4.699 -14.884 0.988 1.00 0.00 C ATOM 1052 C VAL A 68 -5.742 -13.849 0.533 1.00 0.00 C ATOM 1053 O VAL A 68 -5.381 -12.856 -0.105 1.00 0.00 O ATOM 1054 CB VAL A 68 -4.252 -14.631 2.453 1.00 0.00 C ATOM 1055 CG1 VAL A 68 -5.369 -14.801 3.496 1.00 0.00 C ATOM 1056 CG2 VAL A 68 -3.147 -15.594 2.906 1.00 0.00 C ATOM 0 H VAL A 68 -3.408 -13.918 -0.342 1.00 0.00 H new ATOM 0 HA VAL A 68 -5.151 -15.875 0.951 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.914 -13.595 2.419 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.970 -14.606 4.491 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -6.175 -14.098 3.284 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.755 -15.819 3.453 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -2.872 -15.373 3.937 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.509 -16.620 2.839 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -2.274 -15.474 2.264 1.00 0.00 H new ATOM 1066 N GLU A 69 -7.016 -14.094 0.878 1.00 0.00 N ATOM 1067 CA GLU A 69 -8.132 -13.155 0.821 1.00 0.00 C ATOM 1068 C GLU A 69 -8.491 -12.731 2.256 1.00 0.00 C ATOM 1069 O GLU A 69 -8.777 -13.598 3.080 1.00 0.00 O ATOM 1070 CB GLU A 69 -9.335 -13.823 0.123 1.00 0.00 C ATOM 1071 CG GLU A 69 -10.589 -12.945 0.274 1.00 0.00 C ATOM 1072 CD GLU A 69 -11.756 -13.290 -0.646 1.00 0.00 C ATOM 1073 OE1 GLU A 69 -11.516 -13.926 -1.690 1.00 0.00 O ATOM 1074 OE2 GLU A 69 -12.879 -12.851 -0.297 1.00 0.00 O ATOM 0 H GLU A 69 -7.305 -15.009 1.224 1.00 0.00 H new ATOM 0 HA GLU A 69 -7.857 -12.270 0.247 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.114 -13.976 -0.933 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -9.516 -14.807 0.556 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.933 -13.010 1.306 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -10.306 -11.907 0.097 1.00 0.00 H new ATOM 1081 N PHE A 70 -8.486 -11.428 2.572 1.00 0.00 N ATOM 1082 CA PHE A 70 -8.869 -10.898 3.888 1.00 0.00 C ATOM 1083 C PHE A 70 -9.099 -9.380 3.795 1.00 0.00 C ATOM 1084 O PHE A 70 -8.742 -8.782 2.782 1.00 0.00 O ATOM 1085 CB PHE A 70 -7.810 -11.259 4.945 1.00 0.00 C ATOM 1086 CG PHE A 70 -6.460 -10.616 4.711 1.00 0.00 C ATOM 1087 CD1 PHE A 70 -5.630 -11.075 3.671 1.00 0.00 C ATOM 1088 CD2 PHE A 70 -6.124 -9.441 5.405 1.00 0.00 C ATOM 1089 CE1 PHE A 70 -4.527 -10.313 3.261 1.00 0.00 C ATOM 1090 CE2 PHE A 70 -5.014 -8.685 5.005 1.00 0.00 C ATOM 1091 CZ PHE A 70 -4.253 -9.096 3.902 1.00 0.00 C ATOM 0 H PHE A 70 -8.212 -10.702 1.910 1.00 0.00 H new ATOM 0 HA PHE A 70 -9.806 -11.357 4.204 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -8.177 -10.962 5.928 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -7.686 -12.342 4.965 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -5.843 -12.017 3.188 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.721 -9.121 6.246 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.894 -10.660 2.458 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.746 -7.789 5.545 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.449 -8.470 3.543 1.00 0.00 H new ATOM 1101 N ASP A 71 -9.747 -8.759 4.794 1.00 0.00 N ATOM 1102 CA ASP A 71 -10.103 -7.336 4.738 1.00 0.00 C ATOM 1103 C ASP A 71 -8.859 -6.442 4.784 1.00 0.00 C ATOM 1104 O ASP A 71 -7.879 -6.764 5.453 1.00 0.00 O ATOM 1105 CB ASP A 71 -11.124 -6.956 5.822 1.00 0.00 C ATOM 1106 CG ASP A 71 -11.718 -5.566 5.583 1.00 0.00 C ATOM 1107 OD1 ASP A 71 -11.029 -4.571 5.904 1.00 0.00 O ATOM 1108 OD2 ASP A 71 -12.868 -5.511 5.085 1.00 0.00 O ATOM 0 H ASP A 71 -10.035 -9.225 5.654 1.00 0.00 H new ATOM 0 HA ASP A 71 -10.587 -7.164 3.777 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -11.925 -7.695 5.841 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -10.643 -6.982 6.800 1.00 0.00 H new ATOM 1113 N GLU A 72 -8.914 -5.333 4.049 1.00 0.00 N ATOM 1114 CA GLU A 72 -7.845 -4.383 3.806 1.00 0.00 C ATOM 1115 C GLU A 72 -8.421 -2.988 4.036 1.00 0.00 C ATOM 1116 O GLU A 72 -8.658 -2.216 3.112 1.00 0.00 O ATOM 1117 CB GLU A 72 -7.343 -4.621 2.378 1.00 0.00 C ATOM 1118 CG GLU A 72 -6.225 -3.705 1.869 1.00 0.00 C ATOM 1119 CD GLU A 72 -5.721 -4.170 0.512 1.00 0.00 C ATOM 1120 OE1 GLU A 72 -6.558 -4.502 -0.360 1.00 0.00 O ATOM 1121 OE2 GLU A 72 -4.486 -4.275 0.352 1.00 0.00 O ATOM 0 H GLU A 72 -9.775 -5.060 3.575 1.00 0.00 H new ATOM 0 HA GLU A 72 -6.990 -4.496 4.473 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.994 -5.651 2.310 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -8.192 -4.527 1.701 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -6.593 -2.682 1.794 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -5.402 -3.696 2.584 1.00 0.00 H new ATOM 1128 N THR A 73 -8.665 -2.666 5.302 1.00 0.00 N ATOM 1129 CA THR A 73 -9.069 -1.334 5.708 1.00 0.00 C ATOM 1130 C THR A 73 -7.881 -0.378 5.573 1.00 0.00 C ATOM 1131 O THR A 73 -6.952 -0.453 6.374 1.00 0.00 O ATOM 1132 CB THR A 73 -9.642 -1.407 7.128 1.00 0.00 C ATOM 1133 OG1 THR A 73 -10.791 -2.235 7.146 1.00 0.00 O ATOM 1134 CG2 THR A 73 -10.075 -0.028 7.636 1.00 0.00 C ATOM 0 H THR A 73 -8.586 -3.327 6.075 1.00 0.00 H new ATOM 0 HA THR A 73 -9.855 -0.940 5.064 1.00 0.00 H new ATOM 0 HB THR A 73 -8.853 -1.805 7.766 1.00 0.00 H new ATOM 0 HG1 THR A 73 -10.570 -3.109 6.763 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.476 -0.121 8.645 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.215 0.642 7.647 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.843 0.378 6.977 1.00 0.00 H new ATOM 1142 N THR A 74 -7.911 0.522 4.581 1.00 0.00 N ATOM 1143 CA THR A 74 -6.861 1.517 4.373 1.00 0.00 C ATOM 1144 C THR A 74 -7.467 2.867 3.960 1.00 0.00 C ATOM 1145 O THR A 74 -8.505 2.922 3.295 1.00 0.00 O ATOM 1146 CB THR A 74 -5.813 0.972 3.390 1.00 0.00 C ATOM 1147 OG1 THR A 74 -4.812 1.936 3.154 1.00 0.00 O ATOM 1148 CG2 THR A 74 -6.420 0.531 2.056 1.00 0.00 C ATOM 0 H THR A 74 -8.669 0.577 3.900 1.00 0.00 H new ATOM 0 HA THR A 74 -6.335 1.708 5.308 1.00 0.00 H new ATOM 0 HB THR A 74 -5.380 0.089 3.860 1.00 0.00 H new ATOM 0 HG1 THR A 74 -4.915 2.300 2.250 1.00 0.00 H new ATOM 0 HG21 THR A 74 -5.631 0.156 1.404 1.00 0.00 H new ATOM 0 HG22 THR A 74 -7.151 -0.258 2.232 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.910 1.381 1.581 1.00 0.00 H new ATOM 1156 N ALA A 75 -6.850 3.965 4.416 1.00 0.00 N ATOM 1157 CA ALA A 75 -7.400 5.317 4.368 1.00 0.00 C ATOM 1158 C ALA A 75 -7.224 5.958 2.988 1.00 0.00 C ATOM 1159 O ALA A 75 -6.627 7.026 2.862 1.00 0.00 O ATOM 1160 CB ALA A 75 -6.766 6.161 5.480 1.00 0.00 C ATOM 0 H ALA A 75 -5.924 3.930 4.842 1.00 0.00 H new ATOM 0 HA ALA A 75 -8.475 5.266 4.538 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.174 7.171 5.448 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -6.986 5.712 6.448 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -5.686 6.201 5.336 1.00 0.00 H new ATOM 1166 N ASP A 76 -7.762 5.293 1.967 1.00 0.00 N ATOM 1167 CA ASP A 76 -7.567 5.597 0.556 1.00 0.00 C ATOM 1168 C ASP A 76 -8.392 4.614 -0.270 1.00 0.00 C ATOM 1169 O ASP A 76 -9.415 4.987 -0.840 1.00 0.00 O ATOM 1170 CB ASP A 76 -6.076 5.574 0.161 1.00 0.00 C ATOM 1171 CG ASP A 76 -5.249 4.436 0.756 1.00 0.00 C ATOM 1172 OD1 ASP A 76 -5.838 3.467 1.273 1.00 0.00 O ATOM 1173 OD2 ASP A 76 -4.008 4.577 0.717 1.00 0.00 O ATOM 0 H ASP A 76 -8.374 4.490 2.111 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.909 6.612 0.355 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -6.008 5.518 -0.925 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -5.626 6.520 0.460 1.00 0.00 H new ATOM 1178 N ASP A 77 -7.979 3.348 -0.315 1.00 0.00 N ATOM 1179 CA ASP A 77 -8.704 2.306 -1.028 1.00 0.00 C ATOM 1180 C ASP A 77 -9.975 1.909 -0.264 1.00 0.00 C ATOM 1181 O ASP A 77 -10.890 1.347 -0.872 1.00 0.00 O ATOM 1182 CB ASP A 77 -7.784 1.132 -1.383 1.00 0.00 C ATOM 1183 CG ASP A 77 -6.642 1.565 -2.300 1.00 0.00 C ATOM 1184 OD1 ASP A 77 -6.877 1.611 -3.527 1.00 0.00 O ATOM 1185 OD2 ASP A 77 -5.548 1.848 -1.766 1.00 0.00 O ATOM 0 H ASP A 77 -7.130 3.019 0.144 1.00 0.00 H new ATOM 0 HA ASP A 77 -9.046 2.697 -1.986 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -7.374 0.702 -0.469 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.365 0.349 -1.870 1.00 0.00 H new ATOM 1190 N ARG A 78 -10.070 2.284 1.023 1.00 0.00 N ATOM 1191 CA ARG A 78 -11.242 2.244 1.903 1.00 0.00 C ATOM 1192 C ARG A 78 -11.277 0.904 2.639 1.00 0.00 C ATOM 1193 O ARG A 78 -10.235 0.277 2.818 1.00 0.00 O ATOM 1194 CB ARG A 78 -12.560 2.607 1.186 1.00 0.00 C ATOM 1195 CG ARG A 78 -12.495 3.985 0.504 1.00 0.00 C ATOM 1196 CD ARG A 78 -13.299 4.049 -0.802 1.00 0.00 C ATOM 1197 NE ARG A 78 -12.784 3.077 -1.778 1.00 0.00 N ATOM 1198 CZ ARG A 78 -13.100 2.998 -3.076 1.00 0.00 C ATOM 1199 NH1 ARG A 78 -13.856 3.936 -3.648 1.00 0.00 N ATOM 1200 NH2 ARG A 78 -12.635 1.974 -3.792 1.00 0.00 N ATOM 0 H ARG A 78 -9.256 2.654 1.513 1.00 0.00 H new ATOM 0 HA ARG A 78 -11.143 3.031 2.651 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -12.786 1.845 0.440 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -13.377 2.600 1.907 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -12.870 4.742 1.192 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -11.454 4.232 0.295 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -14.350 3.845 -0.598 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -13.245 5.054 -1.219 1.00 0.00 H new ATOM 0 HE ARG A 78 -12.115 2.391 -1.429 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -14.198 4.722 -3.095 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -14.092 3.867 -4.638 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -12.048 1.267 -3.349 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -12.866 1.898 -4.783 1.00 0.00 H new ATOM 1214 N LYS A 79 -12.457 0.442 3.070 1.00 0.00 N ATOM 1215 CA LYS A 79 -12.604 -0.886 3.651 1.00 0.00 C ATOM 1216 C LYS A 79 -12.643 -1.927 2.529 1.00 0.00 C ATOM 1217 O LYS A 79 -13.630 -2.653 2.377 1.00 0.00 O ATOM 1218 CB LYS A 79 -13.827 -0.939 4.579 1.00 0.00 C ATOM 1219 CG LYS A 79 -13.646 -2.083 5.591 1.00 0.00 C ATOM 1220 CD LYS A 79 -14.960 -2.694 6.095 1.00 0.00 C ATOM 1221 CE LYS A 79 -15.781 -3.388 4.998 1.00 0.00 C ATOM 1222 NZ LYS A 79 -14.940 -4.233 4.125 1.00 0.00 N ATOM 0 H LYS A 79 -13.325 0.976 3.024 1.00 0.00 H new ATOM 0 HA LYS A 79 -11.745 -1.121 4.280 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -13.943 0.010 5.102 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -14.735 -1.094 3.996 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.047 -2.868 5.130 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -13.081 -1.711 6.445 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -14.737 -3.416 6.880 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -15.565 -1.908 6.547 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -16.555 -4.001 5.459 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -16.288 -2.635 4.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -15.548 -4.811 3.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -14.331 -3.628 3.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -14.348 -4.856 4.711 1.00 0.00 H new ATOM 1236 N VAL A 80 -11.580 -1.974 1.730 1.00 0.00 N ATOM 1237 CA VAL A 80 -11.458 -2.893 0.611 1.00 0.00 C ATOM 1238 C VAL A 80 -11.093 -4.286 1.134 1.00 0.00 C ATOM 1239 O VAL A 80 -10.851 -4.440 2.328 1.00 0.00 O ATOM 1240 CB VAL A 80 -10.469 -2.295 -0.407 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -9.076 -1.962 0.132 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -10.314 -3.186 -1.638 1.00 0.00 C ATOM 0 H VAL A 80 -10.770 -1.365 1.847 1.00 0.00 H new ATOM 0 HA VAL A 80 -12.400 -3.025 0.078 1.00 0.00 H new ATOM 0 HB VAL A 80 -10.935 -1.345 -0.668 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -8.465 -1.548 -0.670 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -9.162 -1.232 0.937 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -8.607 -2.869 0.514 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -9.608 -2.729 -2.332 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -9.942 -4.165 -1.334 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -11.281 -3.301 -2.128 1.00 0.00 H new ATOM 1252 N LYS A 81 -11.097 -5.315 0.279 1.00 0.00 N ATOM 1253 CA LYS A 81 -10.582 -6.631 0.611 1.00 0.00 C ATOM 1254 C LYS A 81 -9.305 -6.903 -0.193 1.00 0.00 C ATOM 1255 O LYS A 81 -9.303 -6.822 -1.426 1.00 0.00 O ATOM 1256 CB LYS A 81 -11.665 -7.702 0.392 1.00 0.00 C ATOM 1257 CG LYS A 81 -11.301 -8.932 1.224 1.00 0.00 C ATOM 1258 CD LYS A 81 -12.153 -10.173 0.985 1.00 0.00 C ATOM 1259 CE LYS A 81 -13.617 -10.086 1.415 1.00 0.00 C ATOM 1260 NZ LYS A 81 -14.209 -11.442 1.424 1.00 0.00 N ATOM 0 H LYS A 81 -11.464 -5.248 -0.670 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.316 -6.670 1.667 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.642 -7.320 0.687 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.731 -7.964 -0.664 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -10.260 -9.186 1.025 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -11.369 -8.666 2.279 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -12.123 -10.408 -0.079 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -11.692 -11.010 1.510 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.690 -9.639 2.406 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -14.170 -9.440 0.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -15.105 -11.433 0.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -13.550 -12.111 0.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -14.389 -11.736 2.405 1.00 0.00 H new ATOM 1274 N SER A 82 -8.230 -7.258 0.515 1.00 0.00 N ATOM 1275 CA SER A 82 -6.989 -7.716 -0.070 1.00 0.00 C ATOM 1276 C SER A 82 -7.181 -9.162 -0.478 1.00 0.00 C ATOM 1277 O SER A 82 -7.211 -10.028 0.395 1.00 0.00 O ATOM 1278 CB SER A 82 -5.853 -7.634 0.960 1.00 0.00 C ATOM 1279 OG SER A 82 -6.338 -7.854 2.265 1.00 0.00 O ATOM 0 H SER A 82 -8.208 -7.231 1.534 1.00 0.00 H new ATOM 0 HA SER A 82 -6.729 -7.094 -0.927 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.088 -8.374 0.723 1.00 0.00 H new ATOM 0 HB3 SER A 82 -5.377 -6.655 0.905 1.00 0.00 H new ATOM 0 HG SER A 82 -5.918 -8.657 2.639 1.00 0.00 H new ATOM 1285 N ILE A 83 -7.259 -9.417 -1.784 1.00 0.00 N ATOM 1286 CA ILE A 83 -6.928 -10.710 -2.348 1.00 0.00 C ATOM 1287 C ILE A 83 -5.536 -10.520 -2.945 1.00 0.00 C ATOM 1288 O ILE A 83 -5.377 -9.757 -3.901 1.00 0.00 O ATOM 1289 CB ILE A 83 -7.978 -11.130 -3.388 1.00 0.00 C ATOM 1290 CG1 ILE A 83 -9.386 -11.139 -2.769 1.00 0.00 C ATOM 1291 CG2 ILE A 83 -7.620 -12.506 -3.970 1.00 0.00 C ATOM 1292 CD1 ILE A 83 -10.487 -11.474 -3.777 1.00 0.00 C ATOM 0 H ILE A 83 -7.555 -8.727 -2.475 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.928 -11.515 -1.613 1.00 0.00 H new ATOM 0 HB ILE A 83 -7.979 -10.402 -4.200 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.414 -11.865 -1.956 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -9.589 -10.162 -2.331 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -8.370 -12.796 -4.706 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -6.642 -12.455 -4.448 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -7.594 -13.244 -3.169 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -11.455 -11.464 -3.276 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -10.485 -10.734 -4.577 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -10.307 -12.463 -4.197 1.00 0.00 H new ATOM 1304 N VAL A 84 -4.513 -11.137 -2.346 1.00 0.00 N ATOM 1305 CA VAL A 84 -3.147 -11.015 -2.840 1.00 0.00 C ATOM 1306 C VAL A 84 -2.564 -12.400 -3.067 1.00 0.00 C ATOM 1307 O VAL A 84 -2.863 -13.324 -2.311 1.00 0.00 O ATOM 1308 CB VAL A 84 -2.258 -10.185 -1.897 1.00 0.00 C ATOM 1309 CG1 VAL A 84 -0.980 -9.730 -2.610 1.00 0.00 C ATOM 1310 CG2 VAL A 84 -2.949 -8.921 -1.399 1.00 0.00 C ATOM 0 H VAL A 84 -4.610 -11.725 -1.518 1.00 0.00 H new ATOM 0 HA VAL A 84 -3.176 -10.477 -3.787 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.037 -10.842 -1.056 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.368 -9.145 -1.923 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.418 -10.603 -2.943 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -1.243 -9.118 -3.473 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -2.276 -8.375 -0.738 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -3.213 -8.292 -2.249 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -3.853 -9.191 -0.853 1.00 0.00 H new ATOM 1320 N THR A 85 -1.726 -12.518 -4.097 1.00 0.00 N ATOM 1321 CA THR A 85 -0.927 -13.684 -4.422 1.00 0.00 C ATOM 1322 C THR A 85 0.276 -13.194 -5.234 1.00 0.00 C ATOM 1323 O THR A 85 0.534 -11.989 -5.292 1.00 0.00 O ATOM 1324 CB THR A 85 -1.793 -14.724 -5.157 1.00 0.00 C ATOM 1325 OG1 THR A 85 -1.041 -15.890 -5.413 1.00 0.00 O ATOM 1326 CG2 THR A 85 -2.346 -14.221 -6.492 1.00 0.00 C ATOM 0 H THR A 85 -1.584 -11.756 -4.760 1.00 0.00 H new ATOM 0 HA THR A 85 -0.555 -14.193 -3.533 1.00 0.00 H new ATOM 0 HB THR A 85 -2.635 -14.928 -4.495 1.00 0.00 H new ATOM 0 HG1 THR A 85 -1.602 -16.545 -5.879 1.00 0.00 H new ATOM 0 HG21 THR A 85 -2.946 -15.004 -6.955 1.00 0.00 H new ATOM 0 HG22 THR A 85 -2.967 -13.342 -6.321 1.00 0.00 H new ATOM 0 HG23 THR A 85 -1.520 -13.959 -7.152 1.00 0.00 H new ATOM 1334 N LEU A 86 0.991 -14.107 -5.887 1.00 0.00 N ATOM 1335 CA LEU A 86 2.001 -13.794 -6.882 1.00 0.00 C ATOM 1336 C LEU A 86 1.843 -14.801 -8.026 1.00 0.00 C ATOM 1337 O LEU A 86 1.433 -15.933 -7.774 1.00 0.00 O ATOM 1338 CB LEU A 86 3.388 -13.730 -6.213 1.00 0.00 C ATOM 1339 CG LEU A 86 4.171 -15.053 -6.161 1.00 0.00 C ATOM 1340 CD1 LEU A 86 5.201 -15.093 -7.297 1.00 0.00 C ATOM 1341 CD2 LEU A 86 4.905 -15.198 -4.822 1.00 0.00 C ATOM 0 H LEU A 86 0.877 -15.109 -5.731 1.00 0.00 H new ATOM 0 HA LEU A 86 1.881 -12.805 -7.325 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.992 -12.994 -6.743 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.262 -13.365 -5.194 1.00 0.00 H new ATOM 0 HG LEU A 86 3.461 -15.873 -6.270 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.753 -16.032 -7.255 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.688 -15.016 -8.256 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.895 -14.260 -7.188 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.452 -16.141 -4.807 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.604 -14.371 -4.699 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.181 -15.186 -4.007 1.00 0.00 H new ATOM 1353 N ASP A 87 2.079 -14.396 -9.279 1.00 0.00 N ATOM 1354 CA ASP A 87 1.684 -15.198 -10.445 1.00 0.00 C ATOM 1355 C ASP A 87 2.690 -16.296 -10.811 1.00 0.00 C ATOM 1356 O ASP A 87 2.499 -17.002 -11.799 1.00 0.00 O ATOM 1357 CB ASP A 87 1.413 -14.293 -11.657 1.00 0.00 C ATOM 1358 CG ASP A 87 2.661 -14.000 -12.477 1.00 0.00 C ATOM 1359 OD1 ASP A 87 3.731 -13.781 -11.868 1.00 0.00 O ATOM 1360 OD2 ASP A 87 2.541 -13.923 -13.720 1.00 0.00 O ATOM 0 H ASP A 87 2.542 -13.518 -9.513 1.00 0.00 H new ATOM 0 HA ASP A 87 0.766 -15.711 -10.158 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.669 -14.767 -12.297 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.984 -13.352 -11.311 1.00 0.00 H new ATOM 1365 N GLY A 88 3.778 -16.403 -10.050 1.00 0.00 N ATOM 1366 CA GLY A 88 4.996 -17.082 -10.453 1.00 0.00 C ATOM 1367 C GLY A 88 6.164 -16.103 -10.361 1.00 0.00 C ATOM 1368 O GLY A 88 7.246 -16.480 -9.917 1.00 0.00 O ATOM 0 H GLY A 88 3.832 -16.007 -9.112 1.00 0.00 H new ATOM 0 HA2 GLY A 88 5.176 -17.945 -9.811 1.00 0.00 H new ATOM 0 HA3 GLY A 88 4.899 -17.457 -11.472 1.00 0.00 H new ATOM 1372 N GLY A 89 5.935 -14.842 -10.747 1.00 0.00 N ATOM 1373 CA GLY A 89 6.900 -13.757 -10.648 1.00 0.00 C ATOM 1374 C GLY A 89 6.276 -12.522 -9.996 1.00 0.00 C ATOM 1375 O GLY A 89 6.698 -12.114 -8.914 1.00 0.00 O ATOM 0 H GLY A 89 5.045 -14.547 -11.148 1.00 0.00 H new ATOM 0 HA2 GLY A 89 7.761 -14.084 -10.065 1.00 0.00 H new ATOM 0 HA3 GLY A 89 7.267 -13.501 -11.642 1.00 0.00 H new ATOM 1379 N LYS A 90 5.259 -11.931 -10.635 1.00 0.00 N ATOM 1380 CA LYS A 90 4.768 -10.626 -10.210 1.00 0.00 C ATOM 1381 C LYS A 90 3.898 -10.816 -8.976 1.00 0.00 C ATOM 1382 O LYS A 90 3.137 -11.780 -8.907 1.00 0.00 O ATOM 1383 CB LYS A 90 3.982 -9.897 -11.312 1.00 0.00 C ATOM 1384 CG LYS A 90 4.665 -9.943 -12.691 1.00 0.00 C ATOM 1385 CD LYS A 90 3.868 -10.858 -13.621 1.00 0.00 C ATOM 1386 CE LYS A 90 4.727 -11.488 -14.723 1.00 0.00 C ATOM 1387 NZ LYS A 90 3.991 -12.576 -15.399 1.00 0.00 N ATOM 0 H LYS A 90 4.770 -12.332 -11.435 1.00 0.00 H new ATOM 0 HA LYS A 90 5.628 -9.997 -9.982 1.00 0.00 H new ATOM 0 HB2 LYS A 90 2.990 -10.341 -11.393 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.843 -8.856 -11.019 1.00 0.00 H new ATOM 0 HG2 LYS A 90 4.725 -8.940 -13.113 1.00 0.00 H new ATOM 0 HG3 LYS A 90 5.687 -10.308 -12.591 1.00 0.00 H new ATOM 0 HD2 LYS A 90 3.404 -11.650 -13.033 1.00 0.00 H new ATOM 0 HD3 LYS A 90 3.061 -10.287 -14.079 1.00 0.00 H new ATOM 0 HE2 LYS A 90 5.010 -10.727 -15.450 1.00 0.00 H new ATOM 0 HE3 LYS A 90 5.650 -11.878 -14.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 4.612 -13.035 -16.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 3.683 -13.277 -14.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.159 -12.183 -15.883 1.00 0.00 H new ATOM 1401 N LEU A 91 3.975 -9.883 -8.026 1.00 0.00 N ATOM 1402 CA LEU A 91 3.108 -9.854 -6.860 1.00 0.00 C ATOM 1403 C LEU A 91 1.780 -9.247 -7.300 1.00 0.00 C ATOM 1404 O LEU A 91 1.738 -8.079 -7.684 1.00 0.00 O ATOM 1405 CB LEU A 91 3.805 -9.068 -5.744 1.00 0.00 C ATOM 1406 CG LEU A 91 3.024 -9.028 -4.421 1.00 0.00 C ATOM 1407 CD1 LEU A 91 3.970 -8.610 -3.289 1.00 0.00 C ATOM 1408 CD2 LEU A 91 1.844 -8.047 -4.486 1.00 0.00 C ATOM 0 H LEU A 91 4.651 -9.120 -8.050 1.00 0.00 H new ATOM 0 HA LEU A 91 2.907 -10.846 -6.456 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.785 -9.509 -5.562 1.00 0.00 H new ATOM 0 HB3 LEU A 91 3.974 -8.046 -6.085 1.00 0.00 H new ATOM 0 HG LEU A 91 2.622 -10.024 -4.235 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.421 -8.580 -2.348 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.784 -9.330 -3.211 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.378 -7.622 -3.502 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.317 -8.048 -3.532 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.216 -7.044 -4.694 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.160 -8.352 -5.278 1.00 0.00 H new ATOM 1420 N VAL A 92 0.705 -10.037 -7.264 1.00 0.00 N ATOM 1421 CA VAL A 92 -0.615 -9.657 -7.738 1.00 0.00 C ATOM 1422 C VAL A 92 -1.489 -9.354 -6.525 1.00 0.00 C ATOM 1423 O VAL A 92 -1.943 -10.279 -5.854 1.00 0.00 O ATOM 1424 CB VAL A 92 -1.223 -10.790 -8.588 1.00 0.00 C ATOM 1425 CG1 VAL A 92 -2.586 -10.371 -9.158 1.00 0.00 C ATOM 1426 CG2 VAL A 92 -0.309 -11.176 -9.757 1.00 0.00 C ATOM 0 H VAL A 92 0.736 -10.986 -6.892 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.550 -8.772 -8.370 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.340 -11.649 -7.927 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.997 -11.186 -9.755 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.268 -10.141 -8.339 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.462 -9.488 -9.786 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.773 -11.978 -10.332 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.156 -10.310 -10.400 1.00 0.00 H new ATOM 0 HG23 VAL A 92 0.652 -11.516 -9.371 1.00 0.00 H new ATOM 1436 N HIS A 93 -1.752 -8.072 -6.256 1.00 0.00 N ATOM 1437 CA HIS A 93 -2.845 -7.659 -5.384 1.00 0.00 C ATOM 1438 C HIS A 93 -4.032 -7.375 -6.296 1.00 0.00 C ATOM 1439 O HIS A 93 -4.004 -6.380 -7.018 1.00 0.00 O ATOM 1440 CB HIS A 93 -2.396 -6.435 -4.570 1.00 0.00 C ATOM 1441 CG HIS A 93 -3.443 -5.682 -3.774 1.00 0.00 C ATOM 1442 ND1 HIS A 93 -3.282 -4.376 -3.351 1.00 0.00 N ATOM 1443 CD2 HIS A 93 -4.579 -6.177 -3.184 1.00 0.00 C ATOM 1444 CE1 HIS A 93 -4.279 -4.085 -2.504 1.00 0.00 C ATOM 1445 NE2 HIS A 93 -5.074 -5.159 -2.386 1.00 0.00 N ATOM 0 H HIS A 93 -1.212 -7.296 -6.638 1.00 0.00 H new ATOM 0 HA HIS A 93 -3.131 -8.420 -4.658 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -1.622 -6.762 -3.876 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.930 -5.730 -5.258 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -5.002 -7.162 -3.316 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -4.419 -3.141 -1.999 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -5.909 -5.217 -1.803 1.00 0.00 H new ATOM 1454 N VAL A 94 -5.048 -8.243 -6.287 1.00 0.00 N ATOM 1455 CA VAL A 94 -6.325 -7.936 -6.911 1.00 0.00 C ATOM 1456 C VAL A 94 -7.194 -7.354 -5.797 1.00 0.00 C ATOM 1457 O VAL A 94 -7.612 -8.033 -4.862 1.00 0.00 O ATOM 1458 CB VAL A 94 -6.888 -9.130 -7.701 1.00 0.00 C ATOM 1459 CG1 VAL A 94 -7.297 -10.334 -6.861 1.00 0.00 C ATOM 1460 CG2 VAL A 94 -8.105 -8.706 -8.527 1.00 0.00 C ATOM 0 H VAL A 94 -5.004 -9.164 -5.852 1.00 0.00 H new ATOM 0 HA VAL A 94 -6.256 -7.191 -7.703 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.054 -9.444 -8.329 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -7.680 -11.119 -7.513 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -6.431 -10.707 -6.314 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.073 -10.038 -6.155 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -8.488 -9.565 -9.078 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -8.881 -8.326 -7.863 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -7.814 -7.925 -9.229 1.00 0.00 H new ATOM 1470 N GLN A 95 -7.309 -6.033 -5.816 1.00 0.00 N ATOM 1471 CA GLN A 95 -7.830 -5.237 -4.731 1.00 0.00 C ATOM 1472 C GLN A 95 -9.337 -5.106 -4.931 1.00 0.00 C ATOM 1473 O GLN A 95 -9.768 -4.345 -5.799 1.00 0.00 O ATOM 1474 CB GLN A 95 -7.084 -3.905 -4.796 1.00 0.00 C ATOM 1475 CG GLN A 95 -7.643 -2.908 -3.793 1.00 0.00 C ATOM 1476 CD GLN A 95 -6.800 -1.653 -3.701 1.00 0.00 C ATOM 1477 OE1 GLN A 95 -6.028 -1.495 -2.762 1.00 0.00 O ATOM 1478 NE2 GLN A 95 -6.955 -0.761 -4.670 1.00 0.00 N ATOM 0 H GLN A 95 -7.029 -5.473 -6.621 1.00 0.00 H new ATOM 0 HA GLN A 95 -7.682 -5.671 -3.742 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -6.025 -4.069 -4.597 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.159 -3.493 -5.802 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -8.660 -2.640 -4.079 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -7.701 -3.377 -2.811 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -7.612 -0.942 -5.429 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -6.418 0.106 -4.656 1.00 0.00 H new ATOM 1487 N LYS A 96 -10.130 -5.874 -4.174 1.00 0.00 N ATOM 1488 CA LYS A 96 -11.545 -6.083 -4.459 1.00 0.00 C ATOM 1489 C LYS A 96 -12.414 -5.535 -3.336 1.00 0.00 C ATOM 1490 O LYS A 96 -12.248 -5.915 -2.181 1.00 0.00 O ATOM 1491 CB LYS A 96 -11.805 -7.584 -4.671 1.00 0.00 C ATOM 1492 CG LYS A 96 -13.223 -7.873 -5.196 1.00 0.00 C ATOM 1493 CD LYS A 96 -13.585 -9.357 -5.074 1.00 0.00 C ATOM 1494 CE LYS A 96 -13.968 -9.764 -3.644 1.00 0.00 C ATOM 1495 NZ LYS A 96 -15.192 -9.080 -3.175 1.00 0.00 N ATOM 0 H LYS A 96 -9.802 -6.368 -3.344 1.00 0.00 H new ATOM 0 HA LYS A 96 -11.808 -5.543 -5.368 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.073 -7.979 -5.376 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -11.657 -8.111 -3.728 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -13.945 -7.276 -4.639 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -13.293 -7.567 -6.240 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -14.415 -9.579 -5.744 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -12.739 -9.960 -5.404 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -14.119 -10.843 -3.604 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -13.144 -9.532 -2.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -15.545 -9.550 -2.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -14.974 -8.086 -2.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -15.919 -9.123 -3.917 1.00 0.00 H new ATOM 1509 N TRP A 97 -13.386 -4.690 -3.684 1.00 0.00 N ATOM 1510 CA TRP A 97 -14.474 -4.339 -2.789 1.00 0.00 C ATOM 1511 C TRP A 97 -15.657 -5.231 -3.178 1.00 0.00 C ATOM 1512 O TRP A 97 -15.625 -6.443 -2.935 1.00 0.00 O ATOM 1513 CB TRP A 97 -14.726 -2.816 -2.821 1.00 0.00 C ATOM 1514 CG TRP A 97 -14.330 -2.092 -4.077 1.00 0.00 C ATOM 1515 CD1 TRP A 97 -15.066 -1.971 -5.200 1.00 0.00 C ATOM 1516 CD2 TRP A 97 -13.064 -1.431 -4.373 1.00 0.00 C ATOM 1517 NE1 TRP A 97 -14.343 -1.302 -6.163 1.00 0.00 N ATOM 1518 CE2 TRP A 97 -13.085 -0.973 -5.719 1.00 0.00 C ATOM 1519 CE3 TRP A 97 -11.903 -1.155 -3.633 1.00 0.00 C ATOM 1520 CZ2 TRP A 97 -11.994 -0.320 -6.306 1.00 0.00 C ATOM 1521 CZ3 TRP A 97 -10.781 -0.542 -4.219 1.00 0.00 C ATOM 1522 CH2 TRP A 97 -10.821 -0.127 -5.559 1.00 0.00 C ATOM 0 H TRP A 97 -13.435 -4.234 -4.595 1.00 0.00 H new ATOM 0 HA TRP A 97 -14.255 -4.530 -1.739 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -15.788 -2.643 -2.650 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -14.191 -2.365 -1.985 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -16.072 -2.343 -5.326 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -14.698 -1.078 -7.093 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -11.871 -1.420 -2.587 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -12.054 0.032 -7.325 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -9.885 -0.390 -3.635 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -9.957 0.337 -6.012 1.00 0.00 H new ATOM 1533 N ASN A 98 -16.674 -4.657 -3.817 1.00 0.00 N ATOM 1534 CA ASN A 98 -17.899 -5.319 -4.225 1.00 0.00 C ATOM 1535 C ASN A 98 -18.325 -4.764 -5.580 1.00 0.00 C ATOM 1536 O ASN A 98 -18.238 -3.559 -5.812 1.00 0.00 O ATOM 1537 CB ASN A 98 -18.993 -5.114 -3.166 1.00 0.00 C ATOM 1538 CG ASN A 98 -19.045 -3.713 -2.547 1.00 0.00 C ATOM 1539 OD1 ASN A 98 -19.026 -3.578 -1.328 1.00 0.00 O ATOM 1540 ND2 ASN A 98 -19.085 -2.655 -3.353 1.00 0.00 N ATOM 0 H ASN A 98 -16.660 -3.670 -4.074 1.00 0.00 H new ATOM 0 HA ASN A 98 -17.733 -6.392 -4.317 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -19.961 -5.330 -3.619 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -18.845 -5.842 -2.368 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -19.100 -1.714 -2.959 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -19.100 -2.785 -4.365 1.00 0.00 H new ATOM 1547 N GLY A 99 -18.738 -5.630 -6.504 1.00 0.00 N ATOM 1548 CA GLY A 99 -19.131 -5.224 -7.843 1.00 0.00 C ATOM 1549 C GLY A 99 -17.912 -5.066 -8.746 1.00 0.00 C ATOM 1550 O GLY A 99 -17.927 -5.535 -9.879 1.00 0.00 O ATOM 0 H GLY A 99 -18.808 -6.634 -6.340 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -19.809 -5.965 -8.267 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -19.677 -4.282 -7.796 1.00 0.00 H new ATOM 1554 N GLN A 100 -16.859 -4.402 -8.255 1.00 0.00 N ATOM 1555 CA GLN A 100 -15.626 -4.216 -9.000 1.00 0.00 C ATOM 1556 C GLN A 100 -14.400 -4.280 -8.084 1.00 0.00 C ATOM 1557 O GLN A 100 -14.519 -4.445 -6.866 1.00 0.00 O ATOM 1558 CB GLN A 100 -15.674 -2.946 -9.876 1.00 0.00 C ATOM 1559 CG GLN A 100 -16.858 -1.990 -9.662 1.00 0.00 C ATOM 1560 CD GLN A 100 -16.698 -1.150 -8.403 1.00 0.00 C ATOM 1561 OE1 GLN A 100 -15.816 -0.297 -8.343 1.00 0.00 O ATOM 1562 NE2 GLN A 100 -17.498 -1.383 -7.368 1.00 0.00 N ATOM 0 H GLN A 100 -16.846 -3.980 -7.326 1.00 0.00 H new ATOM 0 HA GLN A 100 -15.524 -5.050 -9.694 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -14.754 -2.386 -9.710 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -15.675 -3.256 -10.921 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -16.953 -1.332 -10.526 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -17.781 -2.566 -9.598 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -18.225 -2.095 -7.436 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -17.385 -0.850 -6.506 1.00 0.00 H new ATOM 1571 N GLU A 101 -13.227 -4.171 -8.710 1.00 0.00 N ATOM 1572 CA GLU A 101 -11.917 -4.345 -8.121 1.00 0.00 C ATOM 1573 C GLU A 101 -10.911 -3.520 -8.915 1.00 0.00 C ATOM 1574 O GLU A 101 -11.269 -2.894 -9.916 1.00 0.00 O ATOM 1575 CB GLU A 101 -11.543 -5.835 -8.128 1.00 0.00 C ATOM 1576 CG GLU A 101 -11.911 -6.610 -9.401 1.00 0.00 C ATOM 1577 CD GLU A 101 -11.602 -8.093 -9.226 1.00 0.00 C ATOM 1578 OE1 GLU A 101 -12.100 -8.658 -8.227 1.00 0.00 O ATOM 1579 OE2 GLU A 101 -10.867 -8.623 -10.082 1.00 0.00 O ATOM 0 H GLU A 101 -13.174 -3.945 -9.703 1.00 0.00 H new ATOM 0 HA GLU A 101 -11.915 -4.003 -7.086 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -10.468 -5.921 -7.971 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -12.029 -6.316 -7.279 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -12.970 -6.476 -9.623 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -11.354 -6.213 -10.250 1.00 0.00 H new ATOM 1586 N THR A 102 -9.661 -3.521 -8.456 1.00 0.00 N ATOM 1587 CA THR A 102 -8.531 -2.898 -9.120 1.00 0.00 C ATOM 1588 C THR A 102 -7.354 -3.865 -9.156 1.00 0.00 C ATOM 1589 O THR A 102 -7.093 -4.556 -8.172 1.00 0.00 O ATOM 1590 CB THR A 102 -8.179 -1.588 -8.403 1.00 0.00 C ATOM 1591 OG1 THR A 102 -8.245 -1.716 -6.999 1.00 0.00 O ATOM 1592 CG2 THR A 102 -9.197 -0.514 -8.751 1.00 0.00 C ATOM 0 H THR A 102 -9.404 -3.974 -7.579 1.00 0.00 H new ATOM 0 HA THR A 102 -8.787 -2.657 -10.152 1.00 0.00 H new ATOM 0 HB THR A 102 -7.168 -1.334 -8.722 1.00 0.00 H new ATOM 0 HG1 THR A 102 -9.022 -1.223 -6.662 1.00 0.00 H new ATOM 0 HG21 THR A 102 -8.939 0.412 -8.237 1.00 0.00 H new ATOM 0 HG22 THR A 102 -9.194 -0.345 -9.828 1.00 0.00 H new ATOM 0 HG23 THR A 102 -10.189 -0.838 -8.438 1.00 0.00 H new ATOM 1600 N SER A 103 -6.640 -3.931 -10.284 1.00 0.00 N ATOM 1601 CA SER A 103 -5.373 -4.635 -10.313 1.00 0.00 C ATOM 1602 C SER A 103 -4.330 -3.751 -9.633 1.00 0.00 C ATOM 1603 O SER A 103 -4.307 -2.546 -9.867 1.00 0.00 O ATOM 1604 CB SER A 103 -4.986 -4.959 -11.760 1.00 0.00 C ATOM 1605 OG SER A 103 -4.939 -3.793 -12.564 1.00 0.00 O ATOM 0 H SER A 103 -6.919 -3.510 -11.170 1.00 0.00 H new ATOM 0 HA SER A 103 -5.442 -5.584 -9.781 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.013 -5.451 -11.775 1.00 0.00 H new ATOM 0 HB3 SER A 103 -5.705 -5.662 -12.180 1.00 0.00 H new ATOM 0 HG SER A 103 -5.833 -3.395 -12.615 1.00 0.00 H new ATOM 1611 N LEU A 104 -3.486 -4.340 -8.787 1.00 0.00 N ATOM 1612 CA LEU A 104 -2.253 -3.752 -8.295 1.00 0.00 C ATOM 1613 C LEU A 104 -1.198 -4.850 -8.433 1.00 0.00 C ATOM 1614 O LEU A 104 -0.852 -5.518 -7.456 1.00 0.00 O ATOM 1615 CB LEU A 104 -2.419 -3.277 -6.839 1.00 0.00 C ATOM 1616 CG LEU A 104 -3.140 -1.928 -6.692 1.00 0.00 C ATOM 1617 CD1 LEU A 104 -3.578 -1.732 -5.239 1.00 0.00 C ATOM 1618 CD2 LEU A 104 -2.237 -0.745 -7.058 1.00 0.00 C ATOM 0 H LEU A 104 -3.654 -5.275 -8.415 1.00 0.00 H new ATOM 0 HA LEU A 104 -1.962 -2.865 -8.857 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.972 -4.034 -6.283 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.434 -3.201 -6.379 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.992 -1.952 -7.371 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.089 -0.774 -5.139 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -4.255 -2.536 -4.951 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.702 -1.746 -4.590 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -2.791 0.186 -6.938 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -1.366 -0.736 -6.403 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -1.911 -0.843 -8.094 1.00 0.00 H new ATOM 1630 N VAL A 105 -0.726 -5.069 -9.664 1.00 0.00 N ATOM 1631 CA VAL A 105 0.290 -6.071 -9.963 1.00 0.00 C ATOM 1632 C VAL A 105 1.653 -5.385 -10.021 1.00 0.00 C ATOM 1633 O VAL A 105 1.819 -4.441 -10.792 1.00 0.00 O ATOM 1634 CB VAL A 105 -0.068 -6.876 -11.227 1.00 0.00 C ATOM 1635 CG1 VAL A 105 -0.293 -6.024 -12.478 1.00 0.00 C ATOM 1636 CG2 VAL A 105 1.023 -7.906 -11.533 1.00 0.00 C ATOM 0 H VAL A 105 -1.043 -4.550 -10.483 1.00 0.00 H new ATOM 0 HA VAL A 105 0.334 -6.817 -9.169 1.00 0.00 H new ATOM 0 HB VAL A 105 -1.016 -7.359 -10.993 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -0.540 -6.671 -13.319 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -1.114 -5.329 -12.302 1.00 0.00 H new ATOM 0 HG13 VAL A 105 0.614 -5.464 -12.705 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.754 -8.466 -12.429 1.00 0.00 H new ATOM 0 HG22 VAL A 105 1.971 -7.394 -11.696 1.00 0.00 H new ATOM 0 HG23 VAL A 105 1.121 -8.593 -10.692 1.00 0.00 H new ATOM 1646 N ARG A 106 2.586 -5.824 -9.166 1.00 0.00 N ATOM 1647 CA ARG A 106 3.910 -5.245 -8.967 1.00 0.00 C ATOM 1648 C ARG A 106 4.985 -6.252 -9.379 1.00 0.00 C ATOM 1649 O ARG A 106 4.924 -7.404 -8.947 1.00 0.00 O ATOM 1650 CB ARG A 106 4.110 -4.905 -7.481 1.00 0.00 C ATOM 1651 CG ARG A 106 3.143 -3.831 -6.966 1.00 0.00 C ATOM 1652 CD ARG A 106 2.250 -4.361 -5.839 1.00 0.00 C ATOM 1653 NE ARG A 106 1.463 -3.275 -5.231 1.00 0.00 N ATOM 1654 CZ ARG A 106 0.778 -3.377 -4.080 1.00 0.00 C ATOM 1655 NH1 ARG A 106 0.668 -4.566 -3.475 1.00 0.00 N ATOM 1656 NH2 ARG A 106 0.208 -2.293 -3.538 1.00 0.00 N ATOM 0 H ARG A 106 2.424 -6.634 -8.567 1.00 0.00 H new ATOM 0 HA ARG A 106 3.991 -4.343 -9.573 1.00 0.00 H new ATOM 0 HB2 ARG A 106 3.984 -5.811 -6.888 1.00 0.00 H new ATOM 0 HB3 ARG A 106 5.134 -4.564 -7.329 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.711 -2.973 -6.606 1.00 0.00 H new ATOM 0 HG3 ARG A 106 2.520 -3.479 -7.788 1.00 0.00 H new ATOM 0 HD2 ARG A 106 1.579 -5.125 -6.231 1.00 0.00 H new ATOM 0 HD3 ARG A 106 2.866 -4.839 -5.077 1.00 0.00 H new ATOM 0 HE ARG A 106 1.436 -2.380 -5.719 1.00 0.00 H new ATOM 0 HH11 ARG A 106 1.104 -5.391 -3.888 1.00 0.00 H new ATOM 0 HH12 ARG A 106 0.149 -4.647 -2.601 1.00 0.00 H new ATOM 0 HH21 ARG A 106 0.293 -1.387 -3.999 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -0.312 -2.373 -2.664 1.00 0.00 H new ATOM 1670 N GLU A 107 5.984 -5.820 -10.155 1.00 0.00 N ATOM 1671 CA GLU A 107 7.152 -6.637 -10.478 1.00 0.00 C ATOM 1672 C GLU A 107 8.379 -5.743 -10.630 1.00 0.00 C ATOM 1673 O GLU A 107 8.236 -4.610 -11.087 1.00 0.00 O ATOM 1674 CB GLU A 107 6.865 -7.422 -11.763 1.00 0.00 C ATOM 1675 CG GLU A 107 8.034 -8.275 -12.275 1.00 0.00 C ATOM 1676 CD GLU A 107 8.476 -9.312 -11.254 1.00 0.00 C ATOM 1677 OE1 GLU A 107 9.174 -8.890 -10.304 1.00 0.00 O ATOM 1678 OE2 GLU A 107 8.089 -10.484 -11.440 1.00 0.00 O ATOM 0 H GLU A 107 6.003 -4.891 -10.577 1.00 0.00 H new ATOM 0 HA GLU A 107 7.356 -7.346 -9.675 1.00 0.00 H new ATOM 0 HB2 GLU A 107 6.008 -8.073 -11.590 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.578 -6.719 -12.545 1.00 0.00 H new ATOM 0 HG2 GLU A 107 7.739 -8.777 -13.197 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.875 -7.627 -12.520 1.00 0.00 H new ATOM 1685 N MET A 108 9.563 -6.242 -10.254 1.00 0.00 N ATOM 1686 CA MET A 108 10.848 -5.582 -10.431 1.00 0.00 C ATOM 1687 C MET A 108 11.778 -6.510 -11.201 1.00 0.00 C ATOM 1688 O MET A 108 12.348 -7.436 -10.629 1.00 0.00 O ATOM 1689 CB MET A 108 11.451 -5.172 -9.076 1.00 0.00 C ATOM 1690 CG MET A 108 12.778 -4.401 -9.167 1.00 0.00 C ATOM 1691 SD MET A 108 14.267 -5.362 -9.583 1.00 0.00 S ATOM 1692 CE MET A 108 15.500 -4.036 -9.565 1.00 0.00 C ATOM 0 H MET A 108 9.648 -7.152 -9.801 1.00 0.00 H new ATOM 0 HA MET A 108 10.710 -4.664 -11.003 1.00 0.00 H new ATOM 0 HB2 MET A 108 10.726 -4.557 -8.543 1.00 0.00 H new ATOM 0 HB3 MET A 108 11.609 -6.070 -8.478 1.00 0.00 H new ATOM 0 HG2 MET A 108 12.663 -3.615 -9.914 1.00 0.00 H new ATOM 0 HG3 MET A 108 12.950 -3.908 -8.210 1.00 0.00 H new ATOM 0 HE1 MET A 108 16.481 -4.448 -9.801 1.00 0.00 H new ATOM 0 HE2 MET A 108 15.235 -3.282 -10.307 1.00 0.00 H new ATOM 0 HE3 MET A 108 15.527 -3.578 -8.576 1.00 0.00 H new ATOM 1702 N VAL A 109 12.028 -6.177 -12.462 1.00 0.00 N ATOM 1703 CA VAL A 109 13.059 -6.784 -13.288 1.00 0.00 C ATOM 1704 C VAL A 109 13.831 -5.645 -13.947 1.00 0.00 C ATOM 1705 O VAL A 109 13.528 -4.479 -13.682 1.00 0.00 O ATOM 1706 CB VAL A 109 12.441 -7.779 -14.289 1.00 0.00 C ATOM 1707 CG1 VAL A 109 11.859 -8.994 -13.555 1.00 0.00 C ATOM 1708 CG2 VAL A 109 11.357 -7.131 -15.161 1.00 0.00 C ATOM 0 H VAL A 109 11.501 -5.454 -12.951 1.00 0.00 H new ATOM 0 HA VAL A 109 13.754 -7.380 -12.697 1.00 0.00 H new ATOM 0 HB VAL A 109 13.246 -8.104 -14.948 1.00 0.00 H new ATOM 0 HG11 VAL A 109 11.427 -9.684 -14.280 1.00 0.00 H new ATOM 0 HG12 VAL A 109 12.651 -9.498 -13.001 1.00 0.00 H new ATOM 0 HG13 VAL A 109 11.085 -8.664 -12.862 1.00 0.00 H new ATOM 0 HG21 VAL A 109 10.952 -7.873 -15.850 1.00 0.00 H new ATOM 0 HG22 VAL A 109 10.557 -6.752 -14.525 1.00 0.00 H new ATOM 0 HG23 VAL A 109 11.791 -6.308 -15.728 1.00 0.00 H new ATOM 1718 N ASP A 110 14.838 -5.979 -14.759 1.00 0.00 N ATOM 1719 CA ASP A 110 15.712 -5.011 -15.407 1.00 0.00 C ATOM 1720 C ASP A 110 16.345 -4.096 -14.348 1.00 0.00 C ATOM 1721 O ASP A 110 17.295 -4.502 -13.681 1.00 0.00 O ATOM 1722 CB ASP A 110 14.937 -4.288 -16.519 1.00 0.00 C ATOM 1723 CG ASP A 110 15.710 -3.103 -17.069 1.00 0.00 C ATOM 1724 OD1 ASP A 110 16.699 -3.350 -17.789 1.00 0.00 O ATOM 1725 OD2 ASP A 110 15.304 -1.978 -16.708 1.00 0.00 O ATOM 0 H ASP A 110 15.068 -6.947 -14.985 1.00 0.00 H new ATOM 0 HA ASP A 110 16.551 -5.498 -15.904 1.00 0.00 H new ATOM 0 HB2 ASP A 110 14.723 -4.988 -17.326 1.00 0.00 H new ATOM 0 HB3 ASP A 110 13.978 -3.947 -16.130 1.00 0.00 H new ATOM 1730 N GLY A 111 15.792 -2.902 -14.143 1.00 0.00 N ATOM 1731 CA GLY A 111 16.270 -1.931 -13.177 1.00 0.00 C ATOM 1732 C GLY A 111 15.164 -0.947 -12.805 1.00 0.00 C ATOM 1733 O GLY A 111 15.444 0.210 -12.501 1.00 0.00 O ATOM 0 H GLY A 111 14.976 -2.580 -14.663 1.00 0.00 H new ATOM 0 HA2 GLY A 111 16.622 -2.444 -12.282 1.00 0.00 H new ATOM 0 HA3 GLY A 111 17.121 -1.389 -13.590 1.00 0.00 H new ATOM 1737 N LYS A 112 13.908 -1.404 -12.793 1.00 0.00 N ATOM 1738 CA LYS A 112 12.764 -0.602 -12.389 1.00 0.00 C ATOM 1739 C LYS A 112 11.718 -1.544 -11.810 1.00 0.00 C ATOM 1740 O LYS A 112 11.760 -2.744 -12.077 1.00 0.00 O ATOM 1741 CB LYS A 112 12.202 0.191 -13.584 1.00 0.00 C ATOM 1742 CG LYS A 112 12.513 1.686 -13.443 1.00 0.00 C ATOM 1743 CD LYS A 112 11.943 2.483 -14.624 1.00 0.00 C ATOM 1744 CE LYS A 112 11.950 3.986 -14.302 1.00 0.00 C ATOM 1745 NZ LYS A 112 11.402 4.797 -15.408 1.00 0.00 N ATOM 0 H LYS A 112 13.661 -2.355 -13.068 1.00 0.00 H new ATOM 0 HA LYS A 112 13.060 0.130 -11.637 1.00 0.00 H new ATOM 0 HB2 LYS A 112 12.631 -0.188 -14.511 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.124 0.044 -13.648 1.00 0.00 H new ATOM 0 HG2 LYS A 112 12.093 2.062 -12.510 1.00 0.00 H new ATOM 0 HG3 LYS A 112 13.592 1.833 -13.388 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.534 2.293 -15.520 1.00 0.00 H new ATOM 0 HD3 LYS A 112 10.926 2.154 -14.837 1.00 0.00 H new ATOM 0 HE2 LYS A 112 11.366 4.165 -13.399 1.00 0.00 H new ATOM 0 HE3 LYS A 112 12.970 4.306 -14.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 12.182 5.248 -15.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 10.864 4.185 -16.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 10.774 5.530 -15.022 1.00 0.00 H new ATOM 1759 N LEU A 113 10.802 -1.000 -11.007 1.00 0.00 N ATOM 1760 CA LEU A 113 9.645 -1.717 -10.510 1.00 0.00 C ATOM 1761 C LEU A 113 8.421 -1.146 -11.213 1.00 0.00 C ATOM 1762 O LEU A 113 8.183 0.062 -11.181 1.00 0.00 O ATOM 1763 CB LEU A 113 9.590 -1.643 -8.981 1.00 0.00 C ATOM 1764 CG LEU A 113 8.571 -2.617 -8.360 1.00 0.00 C ATOM 1765 CD1 LEU A 113 8.900 -2.829 -6.884 1.00 0.00 C ATOM 1766 CD2 LEU A 113 7.122 -2.124 -8.494 1.00 0.00 C ATOM 0 H LEU A 113 10.851 -0.034 -10.684 1.00 0.00 H new ATOM 0 HA LEU A 113 9.693 -2.783 -10.735 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.580 -1.858 -8.578 1.00 0.00 H new ATOM 0 HB3 LEU A 113 9.338 -0.625 -8.682 1.00 0.00 H new ATOM 0 HG LEU A 113 8.647 -3.556 -8.909 1.00 0.00 H new ATOM 0 HD11 LEU A 113 8.178 -3.518 -6.446 1.00 0.00 H new ATOM 0 HD12 LEU A 113 9.903 -3.246 -6.791 1.00 0.00 H new ATOM 0 HD13 LEU A 113 8.854 -1.874 -6.360 1.00 0.00 H new ATOM 0 HD21 LEU A 113 6.447 -2.849 -8.039 1.00 0.00 H new ATOM 0 HD22 LEU A 113 7.016 -1.164 -7.989 1.00 0.00 H new ATOM 0 HD23 LEU A 113 6.873 -2.009 -9.549 1.00 0.00 H new ATOM 1778 N ILE A 114 7.679 -2.008 -11.900 1.00 0.00 N ATOM 1779 CA ILE A 114 6.489 -1.654 -12.647 1.00 0.00 C ATOM 1780 C ILE A 114 5.302 -2.096 -11.800 1.00 0.00 C ATOM 1781 O ILE A 114 5.178 -3.284 -11.496 1.00 0.00 O ATOM 1782 CB ILE A 114 6.530 -2.328 -14.033 1.00 0.00 C ATOM 1783 CG1 ILE A 114 7.741 -1.801 -14.831 1.00 0.00 C ATOM 1784 CG2 ILE A 114 5.224 -2.055 -14.798 1.00 0.00 C ATOM 1785 CD1 ILE A 114 8.020 -2.603 -16.105 1.00 0.00 C ATOM 0 H ILE A 114 7.901 -3.002 -11.950 1.00 0.00 H new ATOM 0 HA ILE A 114 6.413 -0.583 -12.837 1.00 0.00 H new ATOM 0 HB ILE A 114 6.632 -3.405 -13.903 1.00 0.00 H new ATOM 0 HG12 ILE A 114 7.567 -0.758 -15.097 1.00 0.00 H new ATOM 0 HG13 ILE A 114 8.625 -1.824 -14.194 1.00 0.00 H new ATOM 0 HG21 ILE A 114 5.267 -2.537 -15.775 1.00 0.00 H new ATOM 0 HG22 ILE A 114 4.381 -2.454 -14.233 1.00 0.00 H new ATOM 0 HG23 ILE A 114 5.097 -0.980 -14.929 1.00 0.00 H new ATOM 0 HD11 ILE A 114 8.883 -2.181 -16.619 1.00 0.00 H new ATOM 0 HD12 ILE A 114 8.225 -3.641 -15.844 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.150 -2.559 -16.760 1.00 0.00 H new ATOM 1797 N LEU A 115 4.456 -1.138 -11.402 1.00 0.00 N ATOM 1798 CA LEU A 115 3.161 -1.398 -10.799 1.00 0.00 C ATOM 1799 C LEU A 115 2.084 -0.911 -11.770 1.00 0.00 C ATOM 1800 O LEU A 115 2.016 0.283 -12.077 1.00 0.00 O ATOM 1801 CB LEU A 115 3.086 -0.779 -9.393 1.00 0.00 C ATOM 1802 CG LEU A 115 1.674 -0.444 -8.884 1.00 0.00 C ATOM 1803 CD1 LEU A 115 0.713 -1.636 -8.911 1.00 0.00 C ATOM 1804 CD2 LEU A 115 1.783 0.117 -7.463 1.00 0.00 C ATOM 0 H LEU A 115 4.665 -0.144 -11.496 1.00 0.00 H new ATOM 0 HA LEU A 115 2.996 -2.463 -10.638 1.00 0.00 H new ATOM 0 HB2 LEU A 115 3.552 -1.467 -8.688 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.680 0.135 -9.387 1.00 0.00 H new ATOM 0 HG LEU A 115 1.250 0.295 -9.564 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -0.263 -1.325 -8.538 1.00 0.00 H new ATOM 0 HD12 LEU A 115 0.612 -1.999 -9.934 1.00 0.00 H new ATOM 0 HD13 LEU A 115 1.105 -2.434 -8.280 1.00 0.00 H new ATOM 0 HD21 LEU A 115 0.788 0.359 -7.090 1.00 0.00 H new ATOM 0 HD22 LEU A 115 2.243 -0.627 -6.813 1.00 0.00 H new ATOM 0 HD23 LEU A 115 2.395 1.019 -7.474 1.00 0.00 H new ATOM 1816 N THR A 116 1.266 -1.842 -12.269 1.00 0.00 N ATOM 1817 CA THR A 116 0.153 -1.554 -13.165 1.00 0.00 C ATOM 1818 C THR A 116 -1.120 -1.454 -12.323 1.00 0.00 C ATOM 1819 O THR A 116 -1.424 -2.383 -11.572 1.00 0.00 O ATOM 1820 CB THR A 116 0.046 -2.653 -14.232 1.00 0.00 C ATOM 1821 OG1 THR A 116 1.323 -2.930 -14.761 1.00 0.00 O ATOM 1822 CG2 THR A 116 -0.853 -2.227 -15.394 1.00 0.00 C ATOM 0 H THR A 116 1.364 -2.834 -12.055 1.00 0.00 H new ATOM 0 HA THR A 116 0.307 -0.610 -13.688 1.00 0.00 H new ATOM 0 HB THR A 116 -0.381 -3.531 -13.748 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.250 -3.633 -15.440 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.904 -3.031 -16.128 1.00 0.00 H new ATOM 0 HG22 THR A 116 -1.854 -2.013 -15.020 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.442 -1.333 -15.863 1.00 0.00 H new ATOM 1830 N LEU A 117 -1.830 -0.324 -12.425 1.00 0.00 N ATOM 1831 CA LEU A 117 -2.959 0.026 -11.572 1.00 0.00 C ATOM 1832 C LEU A 117 -4.160 0.329 -12.467 1.00 0.00 C ATOM 1833 O LEU A 117 -4.281 1.442 -12.976 1.00 0.00 O ATOM 1834 CB LEU A 117 -2.528 1.188 -10.657 1.00 0.00 C ATOM 1835 CG LEU A 117 -3.563 1.732 -9.650 1.00 0.00 C ATOM 1836 CD1 LEU A 117 -4.302 2.970 -10.166 1.00 0.00 C ATOM 1837 CD2 LEU A 117 -4.580 0.688 -9.183 1.00 0.00 C ATOM 0 H LEU A 117 -1.624 0.389 -13.125 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.265 -0.787 -10.914 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -1.652 0.865 -10.095 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -2.212 2.015 -11.292 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.962 2.017 -8.787 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -5.016 3.307 -9.415 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -3.584 3.765 -10.366 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -4.832 2.720 -11.085 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -5.273 1.146 -8.477 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -5.134 0.310 -10.042 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -4.058 -0.136 -8.696 1.00 0.00 H new ATOM 1849 N THR A 118 -5.006 -0.671 -12.733 1.00 0.00 N ATOM 1850 CA THR A 118 -6.000 -0.602 -13.803 1.00 0.00 C ATOM 1851 C THR A 118 -7.305 -1.300 -13.399 1.00 0.00 C ATOM 1852 O THR A 118 -7.297 -2.206 -12.564 1.00 0.00 O ATOM 1853 CB THR A 118 -5.352 -1.203 -15.064 1.00 0.00 C ATOM 1854 OG1 THR A 118 -4.331 -0.320 -15.497 1.00 0.00 O ATOM 1855 CG2 THR A 118 -6.317 -1.471 -16.223 1.00 0.00 C ATOM 0 H THR A 118 -5.019 -1.548 -12.213 1.00 0.00 H new ATOM 0 HA THR A 118 -6.289 0.429 -14.007 1.00 0.00 H new ATOM 0 HB THR A 118 -4.966 -2.182 -14.780 1.00 0.00 H new ATOM 0 HG1 THR A 118 -3.705 -0.803 -16.076 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.767 -1.893 -17.064 1.00 0.00 H new ATOM 0 HG22 THR A 118 -7.085 -2.174 -15.902 1.00 0.00 H new ATOM 0 HG23 THR A 118 -6.786 -0.536 -16.529 1.00 0.00 H new ATOM 1863 N HIS A 119 -8.435 -0.873 -13.988 1.00 0.00 N ATOM 1864 CA HIS A 119 -9.685 -1.621 -13.931 1.00 0.00 C ATOM 1865 C HIS A 119 -10.640 -1.177 -15.042 1.00 0.00 C ATOM 1866 O HIS A 119 -10.796 0.022 -15.286 1.00 0.00 O ATOM 1867 CB HIS A 119 -10.352 -1.512 -12.550 1.00 0.00 C ATOM 1868 CG HIS A 119 -11.155 -0.259 -12.308 1.00 0.00 C ATOM 1869 ND1 HIS A 119 -10.818 1.012 -12.728 1.00 0.00 N ATOM 1870 CD2 HIS A 119 -12.419 -0.216 -11.791 1.00 0.00 C ATOM 1871 CE1 HIS A 119 -11.866 1.817 -12.480 1.00 0.00 C ATOM 1872 NE2 HIS A 119 -12.850 1.090 -11.915 1.00 0.00 N ATOM 0 H HIS A 119 -8.499 -0.001 -14.514 1.00 0.00 H new ATOM 0 HA HIS A 119 -9.444 -2.672 -14.091 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -11.007 -2.373 -12.414 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -9.577 -1.578 -11.786 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -9.933 1.291 -13.151 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -12.972 -1.041 -11.368 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -11.912 2.874 -12.698 1.00 0.00 H new ATOM 1881 N GLY A 120 -11.314 -2.143 -15.668 1.00 0.00 N ATOM 1882 CA GLY A 120 -12.306 -1.899 -16.702 1.00 0.00 C ATOM 1883 C GLY A 120 -11.788 -0.917 -17.752 1.00 0.00 C ATOM 1884 O GLY A 120 -10.786 -1.179 -18.410 1.00 0.00 O ATOM 0 H GLY A 120 -11.179 -3.133 -15.463 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -12.572 -2.841 -17.182 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -13.216 -1.504 -16.250 1.00 0.00 H new ATOM 1888 N THR A 121 -12.471 0.221 -17.892 1.00 0.00 N ATOM 1889 CA THR A 121 -12.123 1.239 -18.871 1.00 0.00 C ATOM 1890 C THR A 121 -10.865 2.022 -18.471 1.00 0.00 C ATOM 1891 O THR A 121 -10.142 2.498 -19.343 1.00 0.00 O ATOM 1892 CB THR A 121 -13.341 2.153 -19.112 1.00 0.00 C ATOM 1893 OG1 THR A 121 -13.081 3.089 -20.134 1.00 0.00 O ATOM 1894 CG2 THR A 121 -13.779 2.938 -17.870 1.00 0.00 C ATOM 0 H THR A 121 -13.284 0.458 -17.324 1.00 0.00 H new ATOM 0 HA THR A 121 -11.869 0.751 -19.812 1.00 0.00 H new ATOM 0 HB THR A 121 -14.145 1.473 -19.394 1.00 0.00 H new ATOM 0 HG1 THR A 121 -13.870 3.655 -20.268 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.641 3.558 -18.117 1.00 0.00 H new ATOM 0 HG22 THR A 121 -14.049 2.242 -17.076 1.00 0.00 H new ATOM 0 HG23 THR A 121 -12.959 3.573 -17.533 1.00 0.00 H new ATOM 1902 N ALA A 122 -10.611 2.195 -17.168 1.00 0.00 N ATOM 1903 CA ALA A 122 -9.620 3.152 -16.696 1.00 0.00 C ATOM 1904 C ALA A 122 -8.300 2.435 -16.411 1.00 0.00 C ATOM 1905 O ALA A 122 -8.272 1.459 -15.658 1.00 0.00 O ATOM 1906 CB ALA A 122 -10.160 3.902 -15.476 1.00 0.00 C ATOM 0 H ALA A 122 -11.083 1.680 -16.425 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.421 3.896 -17.467 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -9.414 4.616 -15.128 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -11.071 4.434 -15.750 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -10.380 3.191 -14.680 1.00 0.00 H new ATOM 1912 N VAL A 123 -7.211 2.924 -17.010 1.00 0.00 N ATOM 1913 CA VAL A 123 -5.885 2.317 -16.988 1.00 0.00 C ATOM 1914 C VAL A 123 -4.915 3.258 -16.280 1.00 0.00 C ATOM 1915 O VAL A 123 -5.075 4.474 -16.351 1.00 0.00 O ATOM 1916 CB VAL A 123 -5.461 2.004 -18.435 1.00 0.00 C ATOM 1917 CG1 VAL A 123 -5.197 3.260 -19.281 1.00 0.00 C ATOM 1918 CG2 VAL A 123 -4.231 1.090 -18.479 1.00 0.00 C ATOM 0 H VAL A 123 -7.234 3.792 -17.546 1.00 0.00 H new ATOM 0 HA VAL A 123 -5.887 1.379 -16.433 1.00 0.00 H new ATOM 0 HB VAL A 123 -6.314 1.487 -18.875 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -4.903 2.965 -20.288 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -6.104 3.863 -19.330 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -4.397 3.844 -18.826 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -3.962 0.892 -19.517 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -3.397 1.578 -17.975 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -4.458 0.150 -17.977 1.00 0.00 H new ATOM 1928 N CYS A 124 -3.944 2.742 -15.517 1.00 0.00 N ATOM 1929 CA CYS A 124 -2.889 3.576 -14.938 1.00 0.00 C ATOM 1930 C CYS A 124 -1.599 2.781 -14.773 1.00 0.00 C ATOM 1931 O CYS A 124 -1.630 1.572 -14.535 1.00 0.00 O ATOM 1932 CB CYS A 124 -3.255 4.183 -13.570 1.00 0.00 C ATOM 1933 SG CYS A 124 -5.030 4.380 -13.310 1.00 0.00 S ATOM 0 H CYS A 124 -3.869 1.751 -15.287 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.758 4.396 -15.644 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -2.850 3.548 -12.782 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -2.773 5.156 -13.474 1.00 0.00 H new ATOM 0 HG CYS A 124 -5.337 5.643 -13.351 1.00 0.00 H new ATOM 1939 N THR A 125 -0.475 3.495 -14.836 1.00 0.00 N ATOM 1940 CA THR A 125 0.860 3.010 -14.538 1.00 0.00 C ATOM 1941 C THR A 125 1.356 3.766 -13.306 1.00 0.00 C ATOM 1942 O THR A 125 1.102 4.970 -13.192 1.00 0.00 O ATOM 1943 CB THR A 125 1.758 3.333 -15.741 1.00 0.00 C ATOM 1944 OG1 THR A 125 1.605 4.702 -16.078 1.00 0.00 O ATOM 1945 CG2 THR A 125 1.381 2.492 -16.960 1.00 0.00 C ATOM 0 H THR A 125 -0.478 4.477 -15.111 1.00 0.00 H new ATOM 0 HA THR A 125 0.871 1.936 -14.349 1.00 0.00 H new ATOM 0 HB THR A 125 2.788 3.109 -15.465 1.00 0.00 H new ATOM 0 HG1 THR A 125 1.459 5.225 -15.262 1.00 0.00 H new ATOM 0 HG21 THR A 125 2.036 2.746 -17.794 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.491 1.434 -16.721 1.00 0.00 H new ATOM 0 HG23 THR A 125 0.346 2.695 -17.237 1.00 0.00 H new ATOM 1953 N ARG A 126 2.085 3.101 -12.410 1.00 0.00 N ATOM 1954 CA ARG A 126 2.790 3.751 -11.317 1.00 0.00 C ATOM 1955 C ARG A 126 4.147 3.069 -11.168 1.00 0.00 C ATOM 1956 O ARG A 126 4.300 2.181 -10.336 1.00 0.00 O ATOM 1957 CB ARG A 126 1.923 3.690 -10.049 1.00 0.00 C ATOM 1958 CG ARG A 126 2.594 4.348 -8.837 1.00 0.00 C ATOM 1959 CD ARG A 126 1.617 4.445 -7.658 1.00 0.00 C ATOM 1960 NE ARG A 126 2.335 4.763 -6.409 1.00 0.00 N ATOM 1961 CZ ARG A 126 2.072 5.735 -5.518 1.00 0.00 C ATOM 1962 NH1 ARG A 126 1.036 6.565 -5.684 1.00 0.00 N ATOM 1963 NH2 ARG A 126 2.865 5.865 -4.448 1.00 0.00 N ATOM 0 H ARG A 126 2.201 2.088 -12.427 1.00 0.00 H new ATOM 0 HA ARG A 126 2.971 4.808 -11.510 1.00 0.00 H new ATOM 0 HB2 ARG A 126 0.970 4.182 -10.242 1.00 0.00 H new ATOM 0 HB3 ARG A 126 1.702 2.648 -9.815 1.00 0.00 H new ATOM 0 HG2 ARG A 126 3.470 3.770 -8.542 1.00 0.00 H new ATOM 0 HG3 ARG A 126 2.945 5.344 -9.107 1.00 0.00 H new ATOM 0 HD2 ARG A 126 0.871 5.214 -7.860 1.00 0.00 H new ATOM 0 HD3 ARG A 126 1.081 3.503 -7.545 1.00 0.00 H new ATOM 0 HE ARG A 126 3.135 4.168 -6.193 1.00 0.00 H new ATOM 0 HH11 ARG A 126 0.429 6.467 -6.498 1.00 0.00 H new ATOM 0 HH12 ARG A 126 0.853 7.296 -4.997 1.00 0.00 H new ATOM 0 HH21 ARG A 126 3.654 5.232 -4.318 1.00 0.00 H new ATOM 0 HH22 ARG A 126 2.680 6.597 -3.762 1.00 0.00 H new ATOM 1977 N THR A 127 5.133 3.454 -11.982 1.00 0.00 N ATOM 1978 CA THR A 127 6.444 2.830 -11.901 1.00 0.00 C ATOM 1979 C THR A 127 7.258 3.483 -10.782 1.00 0.00 C ATOM 1980 O THR A 127 7.208 4.700 -10.565 1.00 0.00 O ATOM 1981 CB THR A 127 7.152 2.795 -13.271 1.00 0.00 C ATOM 1982 OG1 THR A 127 7.667 1.504 -13.518 1.00 0.00 O ATOM 1983 CG2 THR A 127 8.328 3.757 -13.396 1.00 0.00 C ATOM 0 H THR A 127 5.046 4.182 -12.691 1.00 0.00 H new ATOM 0 HA THR A 127 6.331 1.779 -11.633 1.00 0.00 H new ATOM 0 HB THR A 127 6.384 3.091 -13.986 1.00 0.00 H new ATOM 0 HG1 THR A 127 7.874 1.066 -12.666 1.00 0.00 H new ATOM 0 HG21 THR A 127 8.767 3.667 -14.389 1.00 0.00 H new ATOM 0 HG22 THR A 127 7.980 4.779 -13.244 1.00 0.00 H new ATOM 0 HG23 THR A 127 9.079 3.514 -12.644 1.00 0.00 H new ATOM 1991 N TYR A 128 8.020 2.644 -10.086 1.00 0.00 N ATOM 1992 CA TYR A 128 8.972 3.018 -9.067 1.00 0.00 C ATOM 1993 C TYR A 128 10.355 2.541 -9.498 1.00 0.00 C ATOM 1994 O TYR A 128 10.491 1.725 -10.408 1.00 0.00 O ATOM 1995 CB TYR A 128 8.602 2.321 -7.754 1.00 0.00 C ATOM 1996 CG TYR A 128 7.380 2.839 -7.025 1.00 0.00 C ATOM 1997 CD1 TYR A 128 6.123 2.237 -7.223 1.00 0.00 C ATOM 1998 CD2 TYR A 128 7.558 3.725 -5.949 1.00 0.00 C ATOM 1999 CE1 TYR A 128 5.079 2.476 -6.311 1.00 0.00 C ATOM 2000 CE2 TYR A 128 6.497 4.027 -5.088 1.00 0.00 C ATOM 2001 CZ TYR A 128 5.278 3.352 -5.231 1.00 0.00 C ATOM 2002 OH TYR A 128 4.281 3.559 -4.321 1.00 0.00 O ATOM 0 H TYR A 128 7.981 1.635 -10.232 1.00 0.00 H new ATOM 0 HA TYR A 128 8.966 4.099 -8.929 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.449 1.262 -7.963 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.455 2.393 -7.080 1.00 0.00 H new ATOM 0 HD1 TYR A 128 5.960 1.592 -8.074 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.525 4.178 -5.785 1.00 0.00 H new ATOM 0 HE1 TYR A 128 4.125 1.986 -6.441 1.00 0.00 H new ATOM 0 HE2 TYR A 128 6.617 4.775 -4.319 1.00 0.00 H new ATOM 0 HH TYR A 128 4.673 3.771 -3.448 1.00 0.00 H new ATOM 2012 N GLU A 129 11.374 3.004 -8.781 1.00 0.00 N ATOM 2013 CA GLU A 129 12.706 2.436 -8.788 1.00 0.00 C ATOM 2014 C GLU A 129 12.984 1.916 -7.379 1.00 0.00 C ATOM 2015 O GLU A 129 12.990 2.692 -6.422 1.00 0.00 O ATOM 2016 CB GLU A 129 13.702 3.518 -9.195 1.00 0.00 C ATOM 2017 CG GLU A 129 13.560 3.874 -10.678 1.00 0.00 C ATOM 2018 CD GLU A 129 14.414 5.071 -11.068 1.00 0.00 C ATOM 2019 OE1 GLU A 129 15.299 5.426 -10.254 1.00 0.00 O ATOM 2020 OE2 GLU A 129 14.151 5.615 -12.159 1.00 0.00 O ATOM 0 H GLU A 129 11.287 3.810 -8.162 1.00 0.00 H new ATOM 0 HA GLU A 129 12.798 1.616 -9.500 1.00 0.00 H new ATOM 0 HB2 GLU A 129 13.543 4.409 -8.588 1.00 0.00 H new ATOM 0 HB3 GLU A 129 14.717 3.174 -8.997 1.00 0.00 H new ATOM 0 HG2 GLU A 129 13.844 3.014 -11.285 1.00 0.00 H new ATOM 0 HG3 GLU A 129 12.515 4.089 -10.900 1.00 0.00 H new ATOM 2027 N LYS A 130 13.189 0.605 -7.250 1.00 0.00 N ATOM 2028 CA LYS A 130 13.539 -0.036 -5.994 1.00 0.00 C ATOM 2029 C LYS A 130 15.012 0.253 -5.694 1.00 0.00 C ATOM 2030 O LYS A 130 15.885 -0.234 -6.407 1.00 0.00 O ATOM 2031 CB LYS A 130 13.223 -1.530 -6.110 1.00 0.00 C ATOM 2032 CG LYS A 130 13.257 -2.215 -4.743 1.00 0.00 C ATOM 2033 CD LYS A 130 14.451 -3.165 -4.614 1.00 0.00 C ATOM 2034 CE LYS A 130 14.334 -3.830 -3.242 1.00 0.00 C ATOM 2035 NZ LYS A 130 15.518 -4.626 -2.875 1.00 0.00 N ATOM 0 H LYS A 130 13.114 -0.047 -8.031 1.00 0.00 H new ATOM 0 HA LYS A 130 12.960 0.353 -5.157 1.00 0.00 H new ATOM 0 HB2 LYS A 130 12.239 -1.661 -6.560 1.00 0.00 H new ATOM 0 HB3 LYS A 130 13.944 -2.005 -6.775 1.00 0.00 H new ATOM 0 HG2 LYS A 130 13.307 -1.460 -3.959 1.00 0.00 H new ATOM 0 HG3 LYS A 130 12.332 -2.771 -4.592 1.00 0.00 H new ATOM 0 HD2 LYS A 130 14.440 -3.911 -5.408 1.00 0.00 H new ATOM 0 HD3 LYS A 130 15.391 -2.620 -4.702 1.00 0.00 H new ATOM 0 HE2 LYS A 130 14.174 -3.061 -2.486 1.00 0.00 H new ATOM 0 HE3 LYS A 130 13.455 -4.474 -3.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 15.467 -4.879 -1.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 15.545 -5.493 -3.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 16.379 -4.069 -3.049 1.00 0.00 H new ATOM 2049 N GLN A 131 15.292 1.098 -4.696 1.00 0.00 N ATOM 2050 CA GLN A 131 16.552 1.835 -4.675 1.00 0.00 C ATOM 2051 C GLN A 131 17.755 1.018 -4.196 1.00 0.00 C ATOM 2052 O GLN A 131 18.876 1.301 -4.609 1.00 0.00 O ATOM 2053 CB GLN A 131 16.395 3.151 -3.901 1.00 0.00 C ATOM 2054 CG GLN A 131 16.358 2.971 -2.378 1.00 0.00 C ATOM 2055 CD GLN A 131 16.020 4.279 -1.668 1.00 0.00 C ATOM 2056 OE1 GLN A 131 16.796 4.776 -0.862 1.00 0.00 O ATOM 2057 NE2 GLN A 131 14.848 4.844 -1.951 1.00 0.00 N ATOM 0 H GLN A 131 14.673 1.284 -3.907 1.00 0.00 H new ATOM 0 HA GLN A 131 16.784 2.069 -5.714 1.00 0.00 H new ATOM 0 HB2 GLN A 131 17.220 3.815 -4.159 1.00 0.00 H new ATOM 0 HB3 GLN A 131 15.477 3.644 -4.222 1.00 0.00 H new ATOM 0 HG2 GLN A 131 15.619 2.213 -2.118 1.00 0.00 H new ATOM 0 HG3 GLN A 131 17.324 2.606 -2.030 1.00 0.00 H new ATOM 0 HE21 GLN A 131 14.221 4.407 -2.627 1.00 0.00 H new ATOM 0 HE22 GLN A 131 14.577 5.714 -1.492 1.00 0.00 H new ATOM 2066 N ALA A 132 17.549 0.055 -3.292 1.00 0.00 N ATOM 2067 CA ALA A 132 18.645 -0.646 -2.626 1.00 0.00 C ATOM 2068 C ALA A 132 18.282 -2.096 -2.318 1.00 0.00 C ATOM 2069 O ALA A 132 17.188 -2.560 -2.637 1.00 0.00 O ATOM 2070 CB ALA A 132 19.026 0.099 -1.343 1.00 0.00 C ATOM 2071 OXT ALA A 132 19.197 -2.901 -1.671 1.00 0.00 O ATOM 0 H ALA A 132 16.622 -0.257 -3.004 1.00 0.00 H new ATOM 0 HA ALA A 132 19.500 -0.664 -3.302 1.00 0.00 H new ATOM 0 HB1 ALA A 132 19.843 -0.425 -0.847 1.00 0.00 H new ATOM 0 HB2 ALA A 132 19.342 1.112 -1.591 1.00 0.00 H new ATOM 0 HB3 ALA A 132 18.164 0.140 -0.677 1.00 0.00 H new