USER MOD reduce.3.24.130724 H: found=0, std=0, add=1293, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1293 hydrogens (26 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 39 MET CE :methyl -123:sc= -2.04 (180deg=-1.6) USER MOD Set 1.2: A 59 ASN : amide:sc= -3.61 K(o=-5.6,f=-15!) USER MOD Set 2.1: A 33 GLN : amide:sc= -0.534 K(o=-0.53,f=-1.8!) USER MOD Set 2.2: A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 THR N :NH3+ -143:sc= 0.429 (180deg=0.0101) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.164 USER MOD Single : A 7 GLN : amide:sc= -4.61 K(o=-4.6,f=-7.8!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HD1:sc= -1.35 K(o=-1.3,f=-0.44) USER MOD Single : A 22 HIS : no HD1:sc= -0.198 X(o=-0.2,f=-0.057) USER MOD Single : A 28 HIS : no HD1:sc= -0.0694 X(o=-0.069,f=0) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 68:sc= 0.315 USER MOD Single : A 45 THR OG1 : rot 110:sc= -0.696 USER MOD Single : A 46 TYR OH : rot 180:sc= -0.041 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot -140:sc= -0.305 USER MOD Single : A 63 THR OG1 : rot 118:sc= -2.32! USER MOD Single : A 64 HIS : no HD1:sc= -0.989 K(o=-0.99,f=-0.32) USER MOD Single : A 65 GLN : amide:sc= -0.231 X(o=-0.23,f=-0.1) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.347 X(o=-0.35,f=0) USER MOD Single : A 71 GLN : amide:sc= -0.307 K(o=-0.31,f=-2.2!) USER MOD Single : A 77 HIS : no HD1:sc= -1.72! C(o=-1.7!,f=-5!) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0195) USER MOD Single : A 88 GLN : amide:sc= -0.255 X(o=-0.26,f=-0.26) USER MOD Single : A 89 HIS : no HD1:sc= -2.95 K(o=-2.9,f=-2) USER MOD Single : A 92 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 101 GLN : amide:sc= -0.306 X(o=-0.31,f=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 160:sc= -1.35 USER MOD Single : A 121 SER OG : rot -72:sc= 0.0983 USER MOD Single : A 126 THR OG1 : rot 93:sc= 0.91 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl 152:sc= -0.364 (180deg=-2.16!) USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= -0.0854 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 33:sc= 0.385 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 ASN : amide:sc= -1.21 K(o=-1.2,f=-4.6!) USER MOD Single : A 152 THR OG1 : rot -150:sc= -1.15 USER MOD Single : A 153 HIS : no HE2:sc= -3.8 X(o=-3.8,f=-3.9!) USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 159 GLN : amide:sc= -0.0135 K(o=-0.013,f=-1.5) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 170 NDP O2D : rot 180:sc= 0 USER MOD Single : A 170 NDP O3B : rot 54:sc= -0.168 USER MOD Single : A 170 NDP O3D : rot 95:sc= -1.39 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -11.536 -3.093 3.546 1.00 1.00 N ATOM 2 CA THR A 1 -10.561 -3.331 4.637 1.00 1.00 C ATOM 3 C THR A 1 -9.327 -4.063 4.125 1.00 1.00 C ATOM 4 O THR A 1 -9.267 -5.295 4.151 1.00 1.00 O ATOM 5 CB THR A 1 -11.229 -4.143 5.743 1.00 1.00 C ATOM 6 OG1 THR A 1 -12.343 -4.856 5.225 1.00 1.00 O ATOM 7 CG2 THR A 1 -11.731 -3.298 6.908 1.00 1.00 C ATOM 0 H1 THR A 1 -11.986 -2.165 3.679 1.00 1.00 H new ATOM 0 H2 THR A 1 -11.043 -3.110 2.630 1.00 1.00 H new ATOM 0 H3 THR A 1 -12.263 -3.836 3.562 1.00 1.00 H new ATOM 0 HA THR A 1 -10.238 -2.367 5.030 1.00 1.00 H new ATOM 0 HB THR A 1 -10.454 -4.813 6.116 1.00 1.00 H new ATOM 0 HG1 THR A 1 -12.762 -5.374 5.943 1.00 1.00 H new ATOM 0 HG21 THR A 1 -12.193 -3.945 7.654 1.00 1.00 H new ATOM 0 HG22 THR A 1 -10.894 -2.765 7.359 1.00 1.00 H new ATOM 0 HG23 THR A 1 -12.466 -2.579 6.546 1.00 1.00 H new ATOM 17 N ALA A 2 -8.345 -3.289 3.670 1.00 1.00 N ATOM 18 CA ALA A 2 -7.104 -3.852 3.158 1.00 1.00 C ATOM 19 C ALA A 2 -5.936 -2.901 3.391 1.00 1.00 C ATOM 20 O ALA A 2 -6.100 -1.689 3.438 1.00 1.00 O ATOM 21 CB ALA A 2 -7.241 -4.173 1.684 1.00 1.00 C ATOM 0 H ALA A 2 -8.387 -2.270 3.646 1.00 1.00 H new ATOM 0 HA ALA A 2 -6.900 -4.776 3.700 1.00 1.00 H new ATOM 0 HB1 ALA A 2 -6.306 -4.593 1.315 1.00 1.00 H new ATOM 0 HB2 ALA A 2 -8.044 -4.896 1.542 1.00 1.00 H new ATOM 0 HB3 ALA A 2 -7.472 -3.261 1.133 1.00 1.00 H new ATOM 27 N PHE A 3 -4.750 -3.478 3.511 1.00 1.00 N ATOM 28 CA PHE A 3 -3.535 -2.699 3.721 1.00 1.00 C ATOM 29 C PHE A 3 -2.622 -2.789 2.495 1.00 1.00 C ATOM 30 O PHE A 3 -2.344 -3.882 2.000 1.00 1.00 O ATOM 31 CB PHE A 3 -2.798 -3.215 4.960 1.00 1.00 C ATOM 32 CG PHE A 3 -3.350 -2.714 6.273 1.00 1.00 C ATOM 33 CD1 PHE A 3 -4.516 -1.966 6.325 1.00 1.00 C ATOM 34 CD2 PHE A 3 -2.690 -3.002 7.457 1.00 1.00 C ATOM 35 CE1 PHE A 3 -5.014 -1.517 7.532 1.00 1.00 C ATOM 36 CE2 PHE A 3 -3.183 -2.554 8.668 1.00 1.00 C ATOM 37 CZ PHE A 3 -4.347 -1.810 8.705 1.00 1.00 C ATOM 0 H PHE A 3 -4.601 -4.486 3.467 1.00 1.00 H new ATOM 0 HA PHE A 3 -3.809 -1.655 3.873 1.00 1.00 H new ATOM 0 HB2 PHE A 3 -2.831 -4.304 4.959 1.00 1.00 H new ATOM 0 HB3 PHE A 3 -1.749 -2.928 4.889 1.00 1.00 H new ATOM 0 HD1 PHE A 3 -5.041 -1.732 5.411 1.00 1.00 H new ATOM 0 HD2 PHE A 3 -1.780 -3.583 7.433 1.00 1.00 H new ATOM 0 HE1 PHE A 3 -5.925 -0.937 7.559 1.00 1.00 H new ATOM 0 HE2 PHE A 3 -2.659 -2.785 9.584 1.00 1.00 H new ATOM 0 HZ PHE A 3 -4.734 -1.458 9.650 1.00 1.00 H new ATOM 47 N LEU A 4 -2.161 -1.648 1.987 1.00 1.00 N ATOM 48 CA LEU A 4 -1.289 -1.657 0.804 1.00 1.00 C ATOM 49 C LEU A 4 0.124 -1.165 1.117 1.00 1.00 C ATOM 50 O LEU A 4 0.311 -0.055 1.640 1.00 1.00 O ATOM 51 CB LEU A 4 -1.895 -0.805 -0.301 1.00 1.00 C ATOM 52 CG LEU A 4 -1.041 -0.678 -1.565 1.00 1.00 C ATOM 53 CD1 LEU A 4 -1.915 -0.698 -2.810 1.00 1.00 C ATOM 54 CD2 LEU A 4 -0.227 0.602 -1.499 1.00 1.00 C ATOM 0 H LEU A 4 -2.368 -0.722 2.362 1.00 1.00 H new ATOM 0 HA LEU A 4 -1.210 -2.693 0.474 1.00 1.00 H new ATOM 0 HB2 LEU A 4 -2.862 -1.227 -0.575 1.00 1.00 H new ATOM 0 HB3 LEU A 4 -2.084 0.194 0.093 1.00 1.00 H new ATOM 0 HG LEU A 4 -0.362 -1.529 -1.623 1.00 1.00 H new ATOM 0 HD11 LEU A 4 -1.288 -0.606 -3.697 1.00 1.00 H new ATOM 0 HD12 LEU A 4 -2.467 -1.637 -2.852 1.00 1.00 H new ATOM 0 HD13 LEU A 4 -2.617 0.135 -2.775 1.00 1.00 H new ATOM 0 HD21 LEU A 4 0.381 0.693 -2.399 1.00 1.00 H new ATOM 0 HD22 LEU A 4 -0.899 1.457 -1.427 1.00 1.00 H new ATOM 0 HD23 LEU A 4 0.422 0.576 -0.623 1.00 1.00 H new ATOM 66 N TRP A 5 1.124 -1.972 0.765 1.00 1.00 N ATOM 67 CA TRP A 5 2.520 -1.595 0.985 1.00 1.00 C ATOM 68 C TRP A 5 3.439 -2.186 -0.075 1.00 1.00 C ATOM 69 O TRP A 5 3.097 -3.159 -0.734 1.00 1.00 O ATOM 70 CB TRP A 5 2.982 -2.027 2.380 1.00 1.00 C ATOM 71 CG TRP A 5 3.590 -3.400 2.433 1.00 1.00 C ATOM 72 CD1 TRP A 5 4.852 -3.759 2.058 1.00 1.00 C ATOM 73 CD2 TRP A 5 2.959 -4.593 2.912 1.00 1.00 C ATOM 74 NE1 TRP A 5 5.043 -5.101 2.273 1.00 1.00 N ATOM 75 CE2 TRP A 5 3.897 -5.635 2.796 1.00 1.00 C ATOM 76 CE3 TRP A 5 1.691 -4.883 3.430 1.00 1.00 C ATOM 77 CZ2 TRP A 5 3.610 -6.942 3.176 1.00 1.00 C ATOM 78 CZ3 TRP A 5 1.408 -6.183 3.807 1.00 1.00 C ATOM 79 CH2 TRP A 5 2.364 -7.197 3.678 1.00 1.00 C ATOM 0 H TRP A 5 0.995 -2.885 0.329 1.00 1.00 H new ATOM 0 HA TRP A 5 2.577 -0.509 0.910 1.00 1.00 H new ATOM 0 HB2 TRP A 5 3.711 -1.305 2.748 1.00 1.00 H new ATOM 0 HB3 TRP A 5 2.130 -1.993 3.059 1.00 1.00 H new ATOM 0 HD1 TRP A 5 5.592 -3.086 1.652 1.00 1.00 H new ATOM 0 HE1 TRP A 5 5.900 -5.617 2.075 1.00 1.00 H new ATOM 0 HE3 TRP A 5 0.948 -4.106 3.533 1.00 1.00 H new ATOM 0 HZ2 TRP A 5 4.345 -7.727 3.078 1.00 1.00 H new ATOM 0 HZ3 TRP A 5 0.433 -6.420 4.208 1.00 1.00 H new ATOM 0 HH2 TRP A 5 2.112 -8.202 3.981 1.00 1.00 H new ATOM 90 N ALA A 6 4.620 -1.601 -0.206 1.00 1.00 N ATOM 91 CA ALA A 6 5.603 -2.086 -1.163 1.00 1.00 C ATOM 92 C ALA A 6 6.960 -2.243 -0.486 1.00 1.00 C ATOM 93 O ALA A 6 7.337 -1.436 0.363 1.00 1.00 O ATOM 94 CB ALA A 6 5.698 -1.132 -2.349 1.00 1.00 C ATOM 0 H ALA A 6 4.921 -0.792 0.337 1.00 1.00 H new ATOM 0 HA ALA A 6 5.287 -3.062 -1.532 1.00 1.00 H new ATOM 0 HB1 ALA A 6 6.437 -1.506 -3.058 1.00 1.00 H new ATOM 0 HB2 ALA A 6 4.727 -1.063 -2.839 1.00 1.00 H new ATOM 0 HB3 ALA A 6 5.998 -0.145 -1.999 1.00 1.00 H new ATOM 100 N GLN A 7 7.678 -3.283 -0.884 1.00 1.00 N ATOM 101 CA GLN A 7 9.002 -3.566 -0.318 1.00 1.00 C ATOM 102 C GLN A 7 9.961 -4.088 -1.397 1.00 1.00 C ATOM 103 O GLN A 7 9.534 -4.713 -2.361 1.00 1.00 O ATOM 104 CB GLN A 7 8.832 -4.600 0.810 1.00 1.00 C ATOM 105 CG GLN A 7 10.129 -5.199 1.336 1.00 1.00 C ATOM 106 CD GLN A 7 10.248 -6.688 1.059 1.00 1.00 C ATOM 107 OE1 GLN A 7 10.708 -7.455 1.903 1.00 1.00 O ATOM 108 NE2 GLN A 7 9.817 -7.102 -0.127 1.00 1.00 N ATOM 0 H GLN A 7 7.373 -3.948 -1.595 1.00 1.00 H new ATOM 0 HA GLN A 7 9.436 -2.649 0.081 1.00 1.00 H new ATOM 0 HB2 GLN A 7 8.305 -4.127 1.639 1.00 1.00 H new ATOM 0 HB3 GLN A 7 8.197 -5.408 0.448 1.00 1.00 H new ATOM 0 HG2 GLN A 7 10.973 -4.681 0.881 1.00 1.00 H new ATOM 0 HG3 GLN A 7 10.192 -5.028 2.411 1.00 1.00 H new ATOM 0 HE21 GLN A 7 9.443 -6.430 -0.797 1.00 1.00 H new ATOM 0 HE22 GLN A 7 9.860 -8.092 -0.368 1.00 1.00 H new ATOM 117 N ASP A 8 11.252 -3.843 -1.203 1.00 1.00 N ATOM 118 CA ASP A 8 12.276 -4.300 -2.132 1.00 1.00 C ATOM 119 C ASP A 8 12.547 -5.788 -1.929 1.00 1.00 C ATOM 120 O ASP A 8 12.131 -6.358 -0.934 1.00 1.00 O ATOM 121 CB ASP A 8 13.568 -3.496 -1.929 1.00 1.00 C ATOM 122 CG ASP A 8 13.337 -2.003 -2.088 1.00 1.00 C ATOM 123 OD1 ASP A 8 12.378 -1.481 -1.478 1.00 1.00 O ATOM 124 OD2 ASP A 8 14.111 -1.358 -2.825 1.00 1.00 O ATOM 0 H ASP A 8 11.615 -3.326 -0.403 1.00 1.00 H new ATOM 0 HA ASP A 8 11.920 -4.145 -3.150 1.00 1.00 H new ATOM 0 HB2 ASP A 8 13.969 -3.698 -0.936 1.00 1.00 H new ATOM 0 HB3 ASP A 8 14.318 -3.826 -2.648 1.00 1.00 H new ATOM 129 N ARG A 9 13.227 -6.417 -2.881 1.00 1.00 N ATOM 130 CA ARG A 9 13.518 -7.844 -2.778 1.00 1.00 C ATOM 131 C ARG A 9 14.367 -8.130 -1.544 1.00 1.00 C ATOM 132 O ARG A 9 14.130 -9.098 -0.837 1.00 1.00 O ATOM 133 CB ARG A 9 14.241 -8.323 -4.042 1.00 1.00 C ATOM 134 CG ARG A 9 15.753 -8.342 -3.907 1.00 1.00 C ATOM 135 CD ARG A 9 16.428 -8.772 -5.199 1.00 1.00 C ATOM 136 NE ARG A 9 15.461 -9.234 -6.176 1.00 1.00 N ATOM 137 CZ ARG A 9 14.950 -10.464 -6.193 1.00 1.00 C ATOM 138 NH1 ARG A 9 15.276 -11.343 -5.252 1.00 1.00 N ATOM 139 NH2 ARG A 9 14.106 -10.816 -7.152 1.00 1.00 N ATOM 0 H ARG A 9 13.584 -5.968 -3.724 1.00 1.00 H new ATOM 0 HA ARG A 9 12.577 -8.386 -2.681 1.00 1.00 H new ATOM 0 HB2 ARG A 9 13.894 -9.326 -4.291 1.00 1.00 H new ATOM 0 HB3 ARG A 9 13.967 -7.675 -4.875 1.00 1.00 H new ATOM 0 HG2 ARG A 9 16.106 -7.350 -3.625 1.00 1.00 H new ATOM 0 HG3 ARG A 9 16.038 -9.022 -3.104 1.00 1.00 H new ATOM 0 HD2 ARG A 9 16.992 -7.936 -5.612 1.00 1.00 H new ATOM 0 HD3 ARG A 9 17.144 -9.567 -4.990 1.00 1.00 H new ATOM 0 HE ARG A 9 15.154 -8.577 -6.893 1.00 1.00 H new ATOM 0 HH11 ARG A 9 15.922 -11.078 -4.509 1.00 1.00 H new ATOM 0 HH12 ARG A 9 14.880 -12.283 -5.273 1.00 1.00 H new ATOM 0 HH21 ARG A 9 13.848 -10.145 -7.876 1.00 1.00 H new ATOM 0 HH22 ARG A 9 13.714 -11.758 -7.166 1.00 1.00 H new ATOM 153 N ASP A 10 15.343 -7.276 -1.287 1.00 1.00 N ATOM 154 CA ASP A 10 16.203 -7.445 -0.134 1.00 1.00 C ATOM 155 C ASP A 10 15.416 -7.282 1.158 1.00 1.00 C ATOM 156 O ASP A 10 15.589 -8.045 2.113 1.00 1.00 O ATOM 157 CB ASP A 10 17.349 -6.434 -0.194 1.00 1.00 C ATOM 158 CG ASP A 10 18.473 -6.793 0.757 1.00 1.00 C ATOM 159 OD1 ASP A 10 19.102 -7.852 0.552 1.00 1.00 O ATOM 160 OD2 ASP A 10 18.729 -6.017 1.702 1.00 1.00 O ATOM 0 H ASP A 10 15.557 -6.461 -1.861 1.00 1.00 H new ATOM 0 HA ASP A 10 16.615 -8.454 -0.150 1.00 1.00 H new ATOM 0 HB2 ASP A 10 17.737 -6.385 -1.212 1.00 1.00 H new ATOM 0 HB3 ASP A 10 16.970 -5.442 0.051 1.00 1.00 H new ATOM 165 N GLY A 11 14.521 -6.293 1.181 1.00 1.00 N ATOM 166 CA GLY A 11 13.710 -6.071 2.368 1.00 1.00 C ATOM 167 C GLY A 11 13.768 -4.630 2.869 1.00 1.00 C ATOM 168 O GLY A 11 14.144 -4.383 4.018 1.00 1.00 O ATOM 0 H GLY A 11 14.345 -5.650 0.409 1.00 1.00 H new ATOM 0 HA2 GLY A 11 12.675 -6.332 2.148 1.00 1.00 H new ATOM 0 HA3 GLY A 11 14.046 -6.739 3.161 1.00 1.00 H new ATOM 172 N LEU A 12 13.406 -3.685 2.003 1.00 1.00 N ATOM 173 CA LEU A 12 13.431 -2.266 2.359 1.00 1.00 C ATOM 174 C LEU A 12 12.112 -1.591 1.999 1.00 1.00 C ATOM 175 O LEU A 12 11.620 -1.734 0.874 1.00 1.00 O ATOM 176 CB LEU A 12 14.580 -1.570 1.633 1.00 1.00 C ATOM 177 CG LEU A 12 15.364 -0.566 2.482 1.00 1.00 C ATOM 178 CD1 LEU A 12 16.609 -1.212 3.061 1.00 1.00 C ATOM 179 CD2 LEU A 12 15.732 0.661 1.657 1.00 1.00 C ATOM 0 H LEU A 12 13.092 -3.875 1.051 1.00 1.00 H new ATOM 0 HA LEU A 12 13.577 -2.186 3.436 1.00 1.00 H new ATOM 0 HB2 LEU A 12 15.270 -2.329 1.264 1.00 1.00 H new ATOM 0 HB3 LEU A 12 14.179 -1.052 0.761 1.00 1.00 H new ATOM 0 HG LEU A 12 14.728 -0.247 3.308 1.00 1.00 H new ATOM 0 HD11 LEU A 12 17.152 -0.482 3.661 1.00 1.00 H new ATOM 0 HD12 LEU A 12 16.323 -2.056 3.688 1.00 1.00 H new ATOM 0 HD13 LEU A 12 17.248 -1.562 2.250 1.00 1.00 H new ATOM 0 HD21 LEU A 12 16.289 1.363 2.278 1.00 1.00 H new ATOM 0 HD22 LEU A 12 16.347 0.359 0.810 1.00 1.00 H new ATOM 0 HD23 LEU A 12 14.823 1.140 1.293 1.00 1.00 H new ATOM 191 N ILE A 13 11.557 -0.843 2.938 1.00 1.00 N ATOM 192 CA ILE A 13 10.294 -0.125 2.698 1.00 1.00 C ATOM 193 C ILE A 13 10.526 1.382 2.611 1.00 1.00 C ATOM 194 O ILE A 13 9.726 2.101 2.017 1.00 1.00 O ATOM 195 CB ILE A 13 9.252 -0.432 3.798 1.00 1.00 C ATOM 196 CG1 ILE A 13 9.808 -0.097 5.184 1.00 1.00 C ATOM 197 CG2 ILE A 13 8.842 -1.893 3.734 1.00 1.00 C ATOM 198 CD1 ILE A 13 8.732 0.259 6.196 1.00 1.00 C ATOM 0 H ILE A 13 11.949 -0.711 3.870 1.00 1.00 H new ATOM 0 HA ILE A 13 9.902 -0.476 1.743 1.00 1.00 H new ATOM 0 HB ILE A 13 8.374 0.191 3.624 1.00 1.00 H new ATOM 0 HG12 ILE A 13 10.377 -0.949 5.555 1.00 1.00 H new ATOM 0 HG13 ILE A 13 10.504 0.737 5.096 1.00 1.00 H new ATOM 0 HG21 ILE A 13 8.108 -2.099 4.513 1.00 1.00 H new ATOM 0 HG22 ILE A 13 8.406 -2.106 2.758 1.00 1.00 H new ATOM 0 HG23 ILE A 13 9.718 -2.524 3.885 1.00 1.00 H new ATOM 0 HD11 ILE A 13 9.196 0.485 7.156 1.00 1.00 H new ATOM 0 HD12 ILE A 13 8.178 1.130 5.847 1.00 1.00 H new ATOM 0 HD13 ILE A 13 8.049 -0.583 6.312 1.00 1.00 H new ATOM 210 N GLY A 14 11.631 1.850 3.214 1.00 1.00 N ATOM 211 CA GLY A 14 11.943 3.264 3.196 1.00 1.00 C ATOM 212 C GLY A 14 13.111 3.608 4.105 1.00 1.00 C ATOM 213 O GLY A 14 13.711 2.730 4.716 1.00 1.00 O ATOM 0 H GLY A 14 12.307 1.269 3.710 1.00 1.00 H new ATOM 0 HA2 GLY A 14 12.177 3.569 2.176 1.00 1.00 H new ATOM 0 HA3 GLY A 14 11.065 3.832 3.505 1.00 1.00 H new ATOM 217 N LYS A 15 13.422 4.903 4.194 1.00 1.00 N ATOM 218 CA LYS A 15 14.512 5.374 5.041 1.00 1.00 C ATOM 219 C LYS A 15 13.994 6.259 6.173 1.00 1.00 C ATOM 220 O LYS A 15 13.896 5.833 7.324 1.00 1.00 O ATOM 221 CB LYS A 15 15.547 6.135 4.213 1.00 1.00 C ATOM 222 CG LYS A 15 15.065 6.546 2.829 1.00 1.00 C ATOM 223 CD LYS A 15 16.224 7.043 1.979 1.00 1.00 C ATOM 224 CE LYS A 15 15.744 7.734 0.717 1.00 1.00 C ATOM 225 NZ LYS A 15 16.348 9.091 0.562 1.00 1.00 N ATOM 0 H LYS A 15 12.933 5.642 3.689 1.00 1.00 H new ATOM 0 HA LYS A 15 14.987 4.498 5.484 1.00 1.00 H new ATOM 0 HB2 LYS A 15 15.847 7.029 4.760 1.00 1.00 H new ATOM 0 HB3 LYS A 15 16.436 5.514 4.105 1.00 1.00 H new ATOM 0 HG2 LYS A 15 14.586 5.698 2.339 1.00 1.00 H new ATOM 0 HG3 LYS A 15 14.312 7.329 2.919 1.00 1.00 H new ATOM 0 HD2 LYS A 15 16.832 7.734 2.563 1.00 1.00 H new ATOM 0 HD3 LYS A 15 16.865 6.203 1.712 1.00 1.00 H new ATOM 0 HE2 LYS A 15 15.996 7.123 -0.150 1.00 1.00 H new ATOM 0 HE3 LYS A 15 14.658 7.821 0.741 1.00 1.00 H new ATOM 0 HZ1 LYS A 15 15.995 9.530 -0.312 1.00 1.00 H new ATOM 0 HZ2 LYS A 15 16.087 9.682 1.377 1.00 1.00 H new ATOM 0 HZ3 LYS A 15 17.383 9.007 0.513 1.00 1.00 H new ATOM 239 N ASP A 16 13.678 7.509 5.845 1.00 1.00 N ATOM 240 CA ASP A 16 13.188 8.467 6.831 1.00 1.00 C ATOM 241 C ASP A 16 12.121 9.374 6.224 1.00 1.00 C ATOM 242 O ASP A 16 12.277 10.601 6.198 1.00 1.00 O ATOM 243 CB ASP A 16 14.347 9.322 7.373 1.00 1.00 C ATOM 244 CG ASP A 16 15.106 8.643 8.490 1.00 1.00 C ATOM 245 OD1 ASP A 16 14.476 8.317 9.519 1.00 1.00 O ATOM 246 OD2 ASP A 16 16.331 8.444 8.346 1.00 1.00 O ATOM 0 H ASP A 16 13.753 7.883 4.899 1.00 1.00 H new ATOM 0 HA ASP A 16 12.744 7.905 7.652 1.00 1.00 H new ATOM 0 HB2 ASP A 16 15.035 9.550 6.559 1.00 1.00 H new ATOM 0 HB3 ASP A 16 13.953 10.272 7.733 1.00 1.00 H new ATOM 251 N GLY A 17 11.048 8.770 5.741 1.00 1.00 N ATOM 252 CA GLY A 17 9.968 9.530 5.143 1.00 1.00 C ATOM 253 C GLY A 17 10.249 9.867 3.690 1.00 1.00 C ATOM 254 O GLY A 17 9.952 10.967 3.232 1.00 1.00 O ATOM 0 H GLY A 17 10.904 7.760 5.752 1.00 1.00 H new ATOM 0 HA2 GLY A 17 9.042 8.959 5.211 1.00 1.00 H new ATOM 0 HA3 GLY A 17 9.817 10.451 5.706 1.00 1.00 H new ATOM 258 N HIS A 18 10.822 8.915 2.965 1.00 1.00 N ATOM 259 CA HIS A 18 11.131 9.120 1.553 1.00 1.00 C ATOM 260 C HIS A 18 11.308 7.780 0.835 1.00 1.00 C ATOM 261 O HIS A 18 11.593 6.767 1.465 1.00 1.00 O ATOM 262 CB HIS A 18 12.400 9.974 1.404 1.00 1.00 C ATOM 263 CG HIS A 18 12.639 10.452 0.008 1.00 1.00 C ATOM 264 ND1 HIS A 18 12.297 11.718 -0.417 1.00 1.00 N ATOM 265 CD2 HIS A 18 13.177 9.830 -1.060 1.00 1.00 C ATOM 266 CE1 HIS A 18 12.617 11.852 -1.693 1.00 1.00 C ATOM 267 NE2 HIS A 18 13.153 10.718 -2.107 1.00 1.00 N ATOM 0 H HIS A 18 11.082 7.998 3.327 1.00 1.00 H new ATOM 0 HA HIS A 18 10.295 9.647 1.093 1.00 1.00 H new ATOM 0 HB2 HIS A 18 12.328 10.836 2.067 1.00 1.00 H new ATOM 0 HB3 HIS A 18 13.261 9.391 1.732 1.00 1.00 H new ATOM 0 HD2 HIS A 18 13.557 8.819 -1.087 1.00 1.00 H new ATOM 0 HE1 HIS A 18 12.466 12.737 -2.294 1.00 1.00 H new ATOM 0 HE2 HIS A 18 13.493 10.532 -3.050 1.00 1.00 H new ATOM 276 N LEU A 19 11.135 7.801 -0.491 1.00 1.00 N ATOM 277 CA LEU A 19 11.273 6.610 -1.312 1.00 1.00 C ATOM 278 C LEU A 19 12.599 6.618 -2.088 1.00 1.00 C ATOM 279 O LEU A 19 12.750 7.367 -3.055 1.00 1.00 O ATOM 280 CB LEU A 19 10.093 6.503 -2.289 1.00 1.00 C ATOM 281 CG LEU A 19 8.793 5.983 -1.667 1.00 1.00 C ATOM 282 CD1 LEU A 19 7.826 7.131 -1.415 1.00 1.00 C ATOM 283 CD2 LEU A 19 8.160 4.933 -2.570 1.00 1.00 C ATOM 0 H LEU A 19 10.897 8.643 -1.016 1.00 1.00 H new ATOM 0 HA LEU A 19 11.273 5.743 -0.651 1.00 1.00 H new ATOM 0 HB2 LEU A 19 9.906 7.486 -2.720 1.00 1.00 H new ATOM 0 HB3 LEU A 19 10.377 5.844 -3.109 1.00 1.00 H new ATOM 0 HG LEU A 19 9.026 5.518 -0.709 1.00 1.00 H new ATOM 0 HD11 LEU A 19 6.908 6.743 -0.973 1.00 1.00 H new ATOM 0 HD12 LEU A 19 8.282 7.848 -0.733 1.00 1.00 H new ATOM 0 HD13 LEU A 19 7.594 7.625 -2.359 1.00 1.00 H new ATOM 0 HD21 LEU A 19 7.237 4.572 -2.116 1.00 1.00 H new ATOM 0 HD22 LEU A 19 7.938 5.375 -3.542 1.00 1.00 H new ATOM 0 HD23 LEU A 19 8.851 4.100 -2.699 1.00 1.00 H new ATOM 295 N PRO A 20 13.580 5.784 -1.674 1.00 1.00 N ATOM 296 CA PRO A 20 14.882 5.717 -2.341 1.00 1.00 C ATOM 297 C PRO A 20 14.756 5.247 -3.795 1.00 1.00 C ATOM 298 O PRO A 20 15.457 5.746 -4.676 1.00 1.00 O ATOM 299 CB PRO A 20 15.664 4.684 -1.522 1.00 1.00 C ATOM 300 CG PRO A 20 14.936 4.549 -0.231 1.00 1.00 C ATOM 301 CD PRO A 20 13.493 4.857 -0.534 1.00 1.00 C ATOM 0 HA PRO A 20 15.364 6.694 -2.384 1.00 1.00 H new ATOM 0 HB2 PRO A 20 15.713 3.728 -2.044 1.00 1.00 H new ATOM 0 HB3 PRO A 20 16.691 5.012 -1.359 1.00 1.00 H new ATOM 0 HG2 PRO A 20 15.043 3.543 0.174 1.00 1.00 H new ATOM 0 HG3 PRO A 20 15.334 5.237 0.515 1.00 1.00 H new ATOM 0 HD2 PRO A 20 12.934 3.957 -0.789 1.00 1.00 H new ATOM 0 HD3 PRO A 20 12.991 5.313 0.319 1.00 1.00 H new ATOM 309 N TRP A 21 13.857 4.296 -4.026 1.00 1.00 N ATOM 310 CA TRP A 21 13.639 3.777 -5.373 1.00 1.00 C ATOM 311 C TRP A 21 12.413 4.423 -6.003 1.00 1.00 C ATOM 312 O TRP A 21 11.483 4.824 -5.298 1.00 1.00 O ATOM 313 CB TRP A 21 13.451 2.251 -5.337 1.00 1.00 C ATOM 314 CG TRP A 21 12.037 1.833 -5.042 1.00 1.00 C ATOM 315 CD1 TRP A 21 11.016 1.704 -5.942 1.00 1.00 C ATOM 316 CD2 TRP A 21 11.497 1.480 -3.768 1.00 1.00 C ATOM 317 NE1 TRP A 21 9.872 1.297 -5.300 1.00 1.00 N ATOM 318 CE2 TRP A 21 10.143 1.152 -3.964 1.00 1.00 C ATOM 319 CE3 TRP A 21 12.029 1.410 -2.481 1.00 1.00 C ATOM 320 CZ2 TRP A 21 9.315 0.761 -2.916 1.00 1.00 C ATOM 321 CZ3 TRP A 21 11.207 1.024 -1.441 1.00 1.00 C ATOM 322 CH2 TRP A 21 9.862 0.703 -1.665 1.00 1.00 C ATOM 0 H TRP A 21 13.272 3.872 -3.306 1.00 1.00 H new ATOM 0 HA TRP A 21 14.517 4.016 -5.973 1.00 1.00 H new ATOM 0 HB2 TRP A 21 13.754 1.832 -6.297 1.00 1.00 H new ATOM 0 HB3 TRP A 21 14.113 1.828 -4.581 1.00 1.00 H new ATOM 0 HD1 TRP A 21 11.097 1.894 -7.002 1.00 1.00 H new ATOM 0 HE1 TRP A 21 8.969 1.130 -5.744 1.00 1.00 H new ATOM 0 HE3 TRP A 21 13.066 1.653 -2.301 1.00 1.00 H new ATOM 0 HZ2 TRP A 21 8.278 0.512 -3.085 1.00 1.00 H new ATOM 0 HZ3 TRP A 21 11.607 0.969 -0.439 1.00 1.00 H new ATOM 0 HH2 TRP A 21 9.244 0.403 -0.831 1.00 1.00 H new ATOM 333 N HIS A 22 12.401 4.516 -7.326 1.00 1.00 N ATOM 334 CA HIS A 22 11.271 5.113 -8.045 1.00 1.00 C ATOM 335 C HIS A 22 10.729 4.134 -9.084 1.00 1.00 C ATOM 336 O HIS A 22 11.368 3.891 -10.115 1.00 1.00 O ATOM 337 CB HIS A 22 11.697 6.416 -8.714 1.00 1.00 C ATOM 338 CG HIS A 22 11.599 7.617 -7.826 1.00 1.00 C ATOM 339 ND1 HIS A 22 12.421 8.718 -7.944 1.00 1.00 N ATOM 340 CD2 HIS A 22 10.752 7.890 -6.806 1.00 1.00 C ATOM 341 CE1 HIS A 22 12.084 9.615 -7.035 1.00 1.00 C ATOM 342 NE2 HIS A 22 11.075 9.137 -6.333 1.00 1.00 N ATOM 0 H HIS A 22 13.157 4.188 -7.927 1.00 1.00 H new ATOM 0 HA HIS A 22 10.479 5.334 -7.329 1.00 1.00 H new ATOM 0 HB2 HIS A 22 12.726 6.315 -9.060 1.00 1.00 H new ATOM 0 HB3 HIS A 22 11.079 6.578 -9.597 1.00 1.00 H new ATOM 0 HD2 HIS A 22 9.968 7.247 -6.434 1.00 1.00 H new ATOM 0 HE1 HIS A 22 12.555 10.576 -6.891 1.00 1.00 H new ATOM 0 HE2 HIS A 22 10.610 9.617 -5.563 1.00 1.00 H new ATOM 351 N LEU A 23 9.558 3.581 -8.809 1.00 1.00 N ATOM 352 CA LEU A 23 8.935 2.624 -9.715 1.00 1.00 C ATOM 353 C LEU A 23 7.630 3.175 -10.279 1.00 1.00 C ATOM 354 O LEU A 23 6.556 2.970 -9.714 1.00 1.00 O ATOM 355 CB LEU A 23 8.665 1.312 -8.980 1.00 1.00 C ATOM 356 CG LEU A 23 9.132 0.056 -9.715 1.00 1.00 C ATOM 357 CD1 LEU A 23 10.654 -0.042 -9.719 1.00 1.00 C ATOM 358 CD2 LEU A 23 8.515 -1.167 -9.066 1.00 1.00 C ATOM 0 H LEU A 23 9.018 3.777 -7.966 1.00 1.00 H new ATOM 0 HA LEU A 23 9.620 2.444 -10.544 1.00 1.00 H new ATOM 0 HB2 LEU A 23 9.155 1.350 -8.007 1.00 1.00 H new ATOM 0 HB3 LEU A 23 7.594 1.230 -8.794 1.00 1.00 H new ATOM 0 HG LEU A 23 8.805 0.112 -10.753 1.00 1.00 H new ATOM 0 HD11 LEU A 23 10.959 -0.945 -10.248 1.00 1.00 H new ATOM 0 HD12 LEU A 23 11.074 0.831 -10.219 1.00 1.00 H new ATOM 0 HD13 LEU A 23 11.019 -0.083 -8.693 1.00 1.00 H new ATOM 0 HD21 LEU A 23 8.847 -2.063 -9.589 1.00 1.00 H new ATOM 0 HD22 LEU A 23 8.825 -1.220 -8.022 1.00 1.00 H new ATOM 0 HD23 LEU A 23 7.428 -1.098 -9.119 1.00 1.00 H new ATOM 370 N PRO A 24 7.705 3.891 -11.412 1.00 1.00 N ATOM 371 CA PRO A 24 6.530 4.468 -12.056 1.00 1.00 C ATOM 372 C PRO A 24 5.418 3.438 -12.246 1.00 1.00 C ATOM 373 O PRO A 24 4.245 3.745 -12.045 1.00 1.00 O ATOM 374 CB PRO A 24 7.050 4.941 -13.409 1.00 1.00 C ATOM 375 CG PRO A 24 8.504 5.189 -13.183 1.00 1.00 C ATOM 376 CD PRO A 24 8.946 4.188 -12.151 1.00 1.00 C ATOM 0 HA PRO A 24 6.090 5.266 -11.457 1.00 1.00 H new ATOM 0 HB2 PRO A 24 6.891 4.188 -14.181 1.00 1.00 H new ATOM 0 HB3 PRO A 24 6.539 5.846 -13.737 1.00 1.00 H new ATOM 0 HG2 PRO A 24 9.068 5.069 -14.108 1.00 1.00 H new ATOM 0 HG3 PRO A 24 8.676 6.208 -12.835 1.00 1.00 H new ATOM 0 HD2 PRO A 24 9.364 3.293 -12.612 1.00 1.00 H new ATOM 0 HD3 PRO A 24 9.715 4.598 -11.497 1.00 1.00 H new ATOM 384 N ASP A 25 5.797 2.229 -12.646 1.00 1.00 N ATOM 385 CA ASP A 25 4.824 1.164 -12.873 1.00 1.00 C ATOM 386 C ASP A 25 3.965 0.949 -11.631 1.00 1.00 C ATOM 387 O ASP A 25 2.743 0.858 -11.715 1.00 1.00 O ATOM 388 CB ASP A 25 5.539 -0.127 -13.260 1.00 1.00 C ATOM 389 CG ASP A 25 5.432 -0.421 -14.741 1.00 1.00 C ATOM 390 OD1 ASP A 25 6.076 0.296 -15.536 1.00 1.00 O ATOM 391 OD2 ASP A 25 4.710 -1.372 -15.107 1.00 1.00 O ATOM 0 H ASP A 25 6.766 1.962 -12.819 1.00 1.00 H new ATOM 0 HA ASP A 25 4.169 1.459 -13.693 1.00 1.00 H new ATOM 0 HB2 ASP A 25 6.590 -0.055 -12.981 1.00 1.00 H new ATOM 0 HB3 ASP A 25 5.115 -0.958 -12.695 1.00 1.00 H new ATOM 396 N ASP A 26 4.615 0.840 -10.470 1.00 1.00 N ATOM 397 CA ASP A 26 3.901 0.619 -9.218 1.00 1.00 C ATOM 398 C ASP A 26 3.012 1.822 -8.882 1.00 1.00 C ATOM 399 O ASP A 26 1.924 1.666 -8.332 1.00 1.00 O ATOM 400 CB ASP A 26 4.887 0.358 -8.080 1.00 1.00 C ATOM 401 CG ASP A 26 4.255 -0.401 -6.932 1.00 1.00 C ATOM 402 OD1 ASP A 26 3.045 -0.211 -6.690 1.00 1.00 O ATOM 403 OD2 ASP A 26 4.968 -1.191 -6.276 1.00 1.00 O ATOM 0 H ASP A 26 5.629 0.901 -10.374 1.00 1.00 H new ATOM 0 HA ASP A 26 3.265 -0.258 -9.339 1.00 1.00 H new ATOM 0 HB2 ASP A 26 5.737 -0.208 -8.462 1.00 1.00 H new ATOM 0 HB3 ASP A 26 5.275 1.308 -7.714 1.00 1.00 H new ATOM 408 N LEU A 27 3.483 3.016 -9.218 1.00 1.00 N ATOM 409 CA LEU A 27 2.736 4.231 -8.954 1.00 1.00 C ATOM 410 C LEU A 27 1.415 4.237 -9.720 1.00 1.00 C ATOM 411 O LEU A 27 0.376 4.622 -9.181 1.00 1.00 O ATOM 412 CB LEU A 27 3.572 5.459 -9.330 1.00 1.00 C ATOM 413 CG LEU A 27 4.338 6.093 -8.166 1.00 1.00 C ATOM 414 CD1 LEU A 27 3.395 6.805 -7.221 1.00 1.00 C ATOM 415 CD2 LEU A 27 5.146 5.039 -7.428 1.00 1.00 C ATOM 0 H LEU A 27 4.382 3.165 -9.675 1.00 1.00 H new ATOM 0 HA LEU A 27 2.512 4.268 -7.888 1.00 1.00 H new ATOM 0 HB2 LEU A 27 4.285 5.173 -10.103 1.00 1.00 H new ATOM 0 HB3 LEU A 27 2.913 6.210 -9.766 1.00 1.00 H new ATOM 0 HG LEU A 27 5.026 6.834 -8.573 1.00 1.00 H new ATOM 0 HD11 LEU A 27 3.964 7.247 -6.403 1.00 1.00 H new ATOM 0 HD12 LEU A 27 2.865 7.590 -7.759 1.00 1.00 H new ATOM 0 HD13 LEU A 27 2.676 6.092 -6.819 1.00 1.00 H new ATOM 0 HD21 LEU A 27 5.685 5.505 -6.603 1.00 1.00 H new ATOM 0 HD22 LEU A 27 4.475 4.274 -7.037 1.00 1.00 H new ATOM 0 HD23 LEU A 27 5.858 4.580 -8.114 1.00 1.00 H new ATOM 427 N HIS A 28 1.458 3.805 -10.977 1.00 1.00 N ATOM 428 CA HIS A 28 0.263 3.770 -11.803 1.00 1.00 C ATOM 429 C HIS A 28 -0.782 2.898 -11.159 1.00 1.00 C ATOM 430 O HIS A 28 -1.954 3.265 -11.066 1.00 1.00 O ATOM 431 CB HIS A 28 0.589 3.254 -13.212 1.00 1.00 C ATOM 432 CG HIS A 28 1.159 4.292 -14.127 1.00 1.00 C ATOM 433 ND1 HIS A 28 2.250 4.068 -14.941 1.00 1.00 N ATOM 434 CD2 HIS A 28 0.776 5.570 -14.360 1.00 1.00 C ATOM 435 CE1 HIS A 28 2.513 5.161 -15.634 1.00 1.00 C ATOM 436 NE2 HIS A 28 1.633 6.086 -15.301 1.00 1.00 N ATOM 0 H HIS A 28 2.305 3.476 -11.441 1.00 1.00 H new ATOM 0 HA HIS A 28 -0.125 4.785 -11.892 1.00 1.00 H new ATOM 0 HB2 HIS A 28 1.297 2.429 -13.130 1.00 1.00 H new ATOM 0 HB3 HIS A 28 -0.320 2.851 -13.659 1.00 1.00 H new ATOM 0 HD2 HIS A 28 -0.049 6.087 -13.893 1.00 1.00 H new ATOM 0 HE1 HIS A 28 3.312 5.278 -16.351 1.00 1.00 H new ATOM 0 HE2 HIS A 28 1.595 7.032 -15.681 1.00 1.00 H new ATOM 445 N TYR A 29 -0.353 1.741 -10.685 1.00 1.00 N ATOM 446 CA TYR A 29 -1.242 0.813 -10.026 1.00 1.00 C ATOM 447 C TYR A 29 -1.841 1.470 -8.792 1.00 1.00 C ATOM 448 O TYR A 29 -3.048 1.374 -8.546 1.00 1.00 O ATOM 449 CB TYR A 29 -0.493 -0.465 -9.637 1.00 1.00 C ATOM 450 CG TYR A 29 -1.397 -1.676 -9.514 1.00 1.00 C ATOM 451 CD1 TYR A 29 -2.213 -1.852 -8.403 1.00 1.00 C ATOM 452 CD2 TYR A 29 -1.430 -2.643 -10.511 1.00 1.00 C ATOM 453 CE1 TYR A 29 -3.033 -2.959 -8.288 1.00 1.00 C ATOM 454 CE2 TYR A 29 -2.248 -3.752 -10.404 1.00 1.00 C ATOM 455 CZ TYR A 29 -3.047 -3.905 -9.290 1.00 1.00 C ATOM 456 OH TYR A 29 -3.855 -5.012 -9.174 1.00 1.00 O ATOM 0 H TYR A 29 0.615 1.424 -10.748 1.00 1.00 H new ATOM 0 HA TYR A 29 -2.044 0.542 -10.713 1.00 1.00 H new ATOM 0 HB2 TYR A 29 0.276 -0.668 -10.382 1.00 1.00 H new ATOM 0 HB3 TYR A 29 0.018 -0.304 -8.688 1.00 1.00 H new ATOM 0 HD1 TYR A 29 -2.206 -1.112 -7.617 1.00 1.00 H new ATOM 0 HD2 TYR A 29 -0.806 -2.526 -11.385 1.00 1.00 H new ATOM 0 HE1 TYR A 29 -3.660 -3.082 -7.417 1.00 1.00 H new ATOM 0 HE2 TYR A 29 -2.262 -4.495 -11.188 1.00 1.00 H new ATOM 0 HH TYR A 29 -3.748 -5.580 -9.966 1.00 1.00 H new ATOM 466 N PHE A 30 -0.989 2.141 -8.025 1.00 1.00 N ATOM 467 CA PHE A 30 -1.428 2.822 -6.817 1.00 1.00 C ATOM 468 C PHE A 30 -2.459 3.903 -7.149 1.00 1.00 C ATOM 469 O PHE A 30 -3.505 4.012 -6.497 1.00 1.00 O ATOM 470 CB PHE A 30 -0.236 3.456 -6.109 1.00 1.00 C ATOM 471 CG PHE A 30 -0.612 4.629 -5.255 1.00 1.00 C ATOM 472 CD1 PHE A 30 -1.457 4.469 -4.170 1.00 1.00 C ATOM 473 CD2 PHE A 30 -0.129 5.895 -5.545 1.00 1.00 C ATOM 474 CE1 PHE A 30 -1.814 5.549 -3.387 1.00 1.00 C ATOM 475 CE2 PHE A 30 -0.484 6.980 -4.765 1.00 1.00 C ATOM 476 CZ PHE A 30 -1.327 6.808 -3.684 1.00 1.00 C ATOM 0 H PHE A 30 0.009 2.227 -8.220 1.00 1.00 H new ATOM 0 HA PHE A 30 -1.890 2.085 -6.160 1.00 1.00 H new ATOM 0 HB2 PHE A 30 0.252 2.704 -5.488 1.00 1.00 H new ATOM 0 HB3 PHE A 30 0.493 3.776 -6.854 1.00 1.00 H new ATOM 0 HD1 PHE A 30 -1.841 3.488 -3.933 1.00 1.00 H new ATOM 0 HD2 PHE A 30 0.531 6.036 -6.388 1.00 1.00 H new ATOM 0 HE1 PHE A 30 -2.473 5.410 -2.543 1.00 1.00 H new ATOM 0 HE2 PHE A 30 -0.102 7.962 -5.001 1.00 1.00 H new ATOM 0 HZ PHE A 30 -1.604 7.654 -3.073 1.00 1.00 H new ATOM 486 N ARG A 31 -2.167 4.702 -8.169 1.00 1.00 N ATOM 487 CA ARG A 31 -3.086 5.759 -8.578 1.00 1.00 C ATOM 488 C ARG A 31 -4.429 5.179 -9.021 1.00 1.00 C ATOM 489 O ARG A 31 -5.479 5.699 -8.662 1.00 1.00 O ATOM 490 CB ARG A 31 -2.471 6.583 -9.704 1.00 1.00 C ATOM 491 CG ARG A 31 -1.230 7.349 -9.285 1.00 1.00 C ATOM 492 CD ARG A 31 -1.583 8.713 -8.715 1.00 1.00 C ATOM 493 NE ARG A 31 -1.451 9.771 -9.710 1.00 1.00 N ATOM 494 CZ ARG A 31 -0.287 10.160 -10.229 1.00 1.00 C ATOM 495 NH1 ARG A 31 0.848 9.584 -9.848 1.00 1.00 N ATOM 496 NH2 ARG A 31 -0.255 11.130 -11.133 1.00 1.00 N ATOM 0 H ARG A 31 -1.312 4.640 -8.722 1.00 1.00 H new ATOM 0 HA ARG A 31 -3.263 6.406 -7.719 1.00 1.00 H new ATOM 0 HB2 ARG A 31 -2.217 5.921 -10.532 1.00 1.00 H new ATOM 0 HB3 ARG A 31 -3.215 7.287 -10.076 1.00 1.00 H new ATOM 0 HG2 ARG A 31 -0.680 6.774 -8.540 1.00 1.00 H new ATOM 0 HG3 ARG A 31 -0.570 7.472 -10.144 1.00 1.00 H new ATOM 0 HD2 ARG A 31 -2.606 8.695 -8.338 1.00 1.00 H new ATOM 0 HD3 ARG A 31 -0.934 8.930 -7.866 1.00 1.00 H new ATOM 0 HE ARG A 31 -2.299 10.241 -10.027 1.00 1.00 H new ATOM 0 HH11 ARG A 31 0.833 8.838 -9.153 1.00 1.00 H new ATOM 0 HH12 ARG A 31 1.734 9.888 -10.251 1.00 1.00 H new ATOM 0 HH21 ARG A 31 -1.121 11.578 -11.431 1.00 1.00 H new ATOM 0 HH22 ARG A 31 0.636 11.428 -11.530 1.00 1.00 H new ATOM 510 N ALA A 32 -4.378 4.086 -9.782 1.00 1.00 N ATOM 511 CA ALA A 32 -5.593 3.420 -10.258 1.00 1.00 C ATOM 512 C ALA A 32 -6.396 2.879 -9.080 1.00 1.00 C ATOM 513 O ALA A 32 -7.622 2.916 -9.076 1.00 1.00 O ATOM 514 CB ALA A 32 -5.242 2.292 -11.215 1.00 1.00 C ATOM 0 H ALA A 32 -3.510 3.642 -10.083 1.00 1.00 H new ATOM 0 HA ALA A 32 -6.201 4.151 -10.791 1.00 1.00 H new ATOM 0 HB1 ALA A 32 -6.156 1.808 -11.559 1.00 1.00 H new ATOM 0 HB2 ALA A 32 -4.702 2.696 -12.071 1.00 1.00 H new ATOM 0 HB3 ALA A 32 -4.616 1.562 -10.702 1.00 1.00 H new ATOM 520 N GLN A 33 -5.690 2.366 -8.080 1.00 1.00 N ATOM 521 CA GLN A 33 -6.325 1.807 -6.893 1.00 1.00 C ATOM 522 C GLN A 33 -7.084 2.880 -6.108 1.00 1.00 C ATOM 523 O GLN A 33 -8.162 2.631 -5.577 1.00 1.00 O ATOM 524 CB GLN A 33 -5.288 1.152 -5.991 1.00 1.00 C ATOM 525 CG GLN A 33 -5.489 -0.343 -5.835 1.00 1.00 C ATOM 526 CD GLN A 33 -6.884 -0.690 -5.354 1.00 1.00 C ATOM 527 OE1 GLN A 33 -7.813 -0.827 -6.151 1.00 1.00 O ATOM 528 NE2 GLN A 33 -7.042 -0.820 -4.041 1.00 1.00 N ATOM 0 H GLN A 33 -4.671 2.326 -8.068 1.00 1.00 H new ATOM 0 HA GLN A 33 -7.039 1.055 -7.228 1.00 1.00 H new ATOM 0 HB2 GLN A 33 -4.294 1.338 -6.397 1.00 1.00 H new ATOM 0 HB3 GLN A 33 -5.323 1.621 -5.008 1.00 1.00 H new ATOM 0 HG2 GLN A 33 -5.304 -0.834 -6.791 1.00 1.00 H new ATOM 0 HG3 GLN A 33 -4.756 -0.734 -5.129 1.00 1.00 H new ATOM 0 HE21 GLN A 33 -6.245 -0.698 -3.417 1.00 1.00 H new ATOM 0 HE22 GLN A 33 -7.961 -1.042 -3.657 1.00 1.00 H new ATOM 537 N THR A 34 -6.501 4.065 -6.026 1.00 1.00 N ATOM 538 CA THR A 34 -7.109 5.156 -5.277 1.00 1.00 C ATOM 539 C THR A 34 -8.281 5.808 -6.018 1.00 1.00 C ATOM 540 O THR A 34 -8.908 6.730 -5.496 1.00 1.00 O ATOM 541 CB THR A 34 -6.065 6.225 -4.956 1.00 1.00 C ATOM 542 OG1 THR A 34 -4.765 5.675 -4.961 1.00 1.00 O ATOM 543 CG2 THR A 34 -6.277 6.877 -3.609 1.00 1.00 C ATOM 0 H THR A 34 -5.611 4.297 -6.467 1.00 1.00 H new ATOM 0 HA THR A 34 -7.500 4.718 -4.359 1.00 1.00 H new ATOM 0 HB THR A 34 -6.177 6.980 -5.734 1.00 1.00 H new ATOM 0 HG1 THR A 34 -4.525 5.411 -5.874 1.00 1.00 H new ATOM 0 HG21 THR A 34 -5.503 7.626 -3.442 1.00 1.00 H new ATOM 0 HG22 THR A 34 -7.256 7.356 -3.586 1.00 1.00 H new ATOM 0 HG23 THR A 34 -6.225 6.120 -2.826 1.00 1.00 H new ATOM 551 N VAL A 35 -8.607 5.318 -7.205 1.00 1.00 N ATOM 552 CA VAL A 35 -9.726 5.869 -7.960 1.00 1.00 C ATOM 553 C VAL A 35 -10.995 5.067 -7.663 1.00 1.00 C ATOM 554 O VAL A 35 -11.045 3.850 -7.843 1.00 1.00 O ATOM 555 CB VAL A 35 -9.460 5.915 -9.480 1.00 1.00 C ATOM 556 CG1 VAL A 35 -7.975 6.032 -9.743 1.00 1.00 C ATOM 557 CG2 VAL A 35 -10.038 4.701 -10.184 1.00 1.00 C ATOM 0 H VAL A 35 -8.120 4.548 -7.664 1.00 1.00 H new ATOM 0 HA VAL A 35 -9.857 6.902 -7.637 1.00 1.00 H new ATOM 0 HB VAL A 35 -9.961 6.794 -9.885 1.00 1.00 H new ATOM 0 HG11 VAL A 35 -7.797 6.064 -10.818 1.00 1.00 H new ATOM 0 HG12 VAL A 35 -7.595 6.945 -9.285 1.00 1.00 H new ATOM 0 HG13 VAL A 35 -7.461 5.171 -9.316 1.00 1.00 H new ATOM 0 HG21 VAL A 35 -9.832 4.767 -11.252 1.00 1.00 H new ATOM 0 HG22 VAL A 35 -9.582 3.796 -9.782 1.00 1.00 H new ATOM 0 HG23 VAL A 35 -11.116 4.666 -10.024 1.00 1.00 H new ATOM 567 N GLY A 36 -12.006 5.764 -7.153 1.00 1.00 N ATOM 568 CA GLY A 36 -13.227 5.105 -6.779 1.00 1.00 C ATOM 569 C GLY A 36 -13.109 4.415 -5.429 1.00 1.00 C ATOM 570 O GLY A 36 -13.932 3.566 -5.088 1.00 1.00 O ATOM 0 H GLY A 36 -11.994 6.772 -6.995 1.00 1.00 H new ATOM 0 HA2 GLY A 36 -14.037 5.834 -6.745 1.00 1.00 H new ATOM 0 HA3 GLY A 36 -13.491 4.371 -7.540 1.00 1.00 H new ATOM 574 N LYS A 37 -12.068 4.768 -4.662 1.00 1.00 N ATOM 575 CA LYS A 37 -11.847 4.166 -3.354 1.00 1.00 C ATOM 576 C LYS A 37 -11.345 5.207 -2.355 1.00 1.00 C ATOM 577 O LYS A 37 -10.745 6.211 -2.738 1.00 1.00 O ATOM 578 CB LYS A 37 -10.843 3.017 -3.478 1.00 1.00 C ATOM 579 CG LYS A 37 -11.142 2.062 -4.625 1.00 1.00 C ATOM 580 CD LYS A 37 -10.235 0.845 -4.603 1.00 1.00 C ATOM 581 CE LYS A 37 -11.003 -0.433 -4.295 1.00 1.00 C ATOM 582 NZ LYS A 37 -11.437 -1.137 -5.524 1.00 1.00 N ATOM 0 H LYS A 37 -11.373 5.465 -4.929 1.00 1.00 H new ATOM 0 HA LYS A 37 -12.795 3.774 -2.984 1.00 1.00 H new ATOM 0 HB2 LYS A 37 -9.844 3.432 -3.614 1.00 1.00 H new ATOM 0 HB3 LYS A 37 -10.830 2.456 -2.544 1.00 1.00 H new ATOM 0 HG2 LYS A 37 -12.182 1.740 -4.567 1.00 1.00 H new ATOM 0 HG3 LYS A 37 -11.023 2.586 -5.573 1.00 1.00 H new ATOM 0 HD2 LYS A 37 -9.738 0.746 -5.568 1.00 1.00 H new ATOM 0 HD3 LYS A 37 -9.454 0.988 -3.856 1.00 1.00 H new ATOM 0 HE2 LYS A 37 -10.376 -1.097 -3.701 1.00 1.00 H new ATOM 0 HE3 LYS A 37 -11.876 -0.192 -3.689 1.00 1.00 H new ATOM 0 HZ1 LYS A 37 -11.955 -2.000 -5.265 1.00 1.00 H new ATOM 0 HZ2 LYS A 37 -12.057 -0.514 -6.080 1.00 1.00 H new ATOM 0 HZ3 LYS A 37 -10.603 -1.391 -6.091 1.00 1.00 H new ATOM 596 N ILE A 38 -11.583 4.960 -1.072 1.00 1.00 N ATOM 597 CA ILE A 38 -11.147 5.876 -0.028 1.00 1.00 C ATOM 598 C ILE A 38 -9.947 5.292 0.706 1.00 1.00 C ATOM 599 O ILE A 38 -9.980 4.150 1.156 1.00 1.00 O ATOM 600 CB ILE A 38 -12.272 6.176 0.997 1.00 1.00 C ATOM 601 CG1 ILE A 38 -13.574 6.523 0.274 1.00 1.00 C ATOM 602 CG2 ILE A 38 -11.849 7.303 1.919 1.00 1.00 C ATOM 603 CD1 ILE A 38 -14.792 6.465 1.162 1.00 1.00 C ATOM 0 H ILE A 38 -12.075 4.134 -0.731 1.00 1.00 H new ATOM 0 HA ILE A 38 -10.876 6.813 -0.515 1.00 1.00 H new ATOM 0 HB ILE A 38 -12.447 5.285 1.600 1.00 1.00 H new ATOM 0 HG12 ILE A 38 -13.490 7.524 -0.148 1.00 1.00 H new ATOM 0 HG13 ILE A 38 -13.710 5.836 -0.561 1.00 1.00 H new ATOM 0 HG21 ILE A 38 -12.646 7.506 2.635 1.00 1.00 H new ATOM 0 HG22 ILE A 38 -10.945 7.015 2.455 1.00 1.00 H new ATOM 0 HG23 ILE A 38 -11.652 8.200 1.331 1.00 1.00 H new ATOM 0 HD11 ILE A 38 -15.678 6.723 0.582 1.00 1.00 H new ATOM 0 HD12 ILE A 38 -14.902 5.458 1.564 1.00 1.00 H new ATOM 0 HD13 ILE A 38 -14.678 7.173 1.983 1.00 1.00 H new ATOM 615 N MET A 39 -8.887 6.075 0.798 1.00 1.00 N ATOM 616 CA MET A 39 -7.672 5.611 1.450 1.00 1.00 C ATOM 617 C MET A 39 -7.199 6.576 2.529 1.00 1.00 C ATOM 618 O MET A 39 -7.400 7.786 2.436 1.00 1.00 O ATOM 619 CB MET A 39 -6.566 5.393 0.428 1.00 1.00 C ATOM 620 CG MET A 39 -5.884 6.674 -0.021 1.00 1.00 C ATOM 621 SD MET A 39 -4.225 6.843 0.661 1.00 1.00 S ATOM 622 CE MET A 39 -3.303 7.318 -0.802 1.00 1.00 C ATOM 0 H MET A 39 -8.841 7.027 0.434 1.00 1.00 H new ATOM 0 HA MET A 39 -7.909 4.663 1.932 1.00 1.00 H new ATOM 0 HB2 MET A 39 -5.818 4.724 0.853 1.00 1.00 H new ATOM 0 HB3 MET A 39 -6.984 4.890 -0.444 1.00 1.00 H new ATOM 0 HG2 MET A 39 -5.830 6.692 -1.110 1.00 1.00 H new ATOM 0 HG3 MET A 39 -6.488 7.529 0.282 1.00 1.00 H new ATOM 0 HE1 MET A 39 -2.492 6.609 -0.967 1.00 1.00 H new ATOM 0 HE2 MET A 39 -3.967 7.317 -1.667 1.00 1.00 H new ATOM 0 HE3 MET A 39 -2.889 8.317 -0.663 1.00 1.00 H new ATOM 632 N VAL A 40 -6.569 6.025 3.565 1.00 1.00 N ATOM 633 CA VAL A 40 -6.061 6.828 4.671 1.00 1.00 C ATOM 634 C VAL A 40 -4.554 6.661 4.824 1.00 1.00 C ATOM 635 O VAL A 40 -4.057 5.538 4.837 1.00 1.00 O ATOM 636 CB VAL A 40 -6.734 6.445 6.000 1.00 1.00 C ATOM 637 CG1 VAL A 40 -6.474 7.505 7.067 1.00 1.00 C ATOM 638 CG2 VAL A 40 -8.231 6.227 5.790 1.00 1.00 C ATOM 0 H VAL A 40 -6.399 5.024 3.660 1.00 1.00 H new ATOM 0 HA VAL A 40 -6.293 7.867 4.436 1.00 1.00 H new ATOM 0 HB VAL A 40 -6.299 5.510 6.353 1.00 1.00 H new ATOM 0 HG11 VAL A 40 -6.960 7.212 7.997 1.00 1.00 H new ATOM 0 HG12 VAL A 40 -5.401 7.599 7.232 1.00 1.00 H new ATOM 0 HG13 VAL A 40 -6.875 8.462 6.734 1.00 1.00 H new ATOM 0 HG21 VAL A 40 -8.696 5.956 6.738 1.00 1.00 H new ATOM 0 HG22 VAL A 40 -8.683 7.144 5.413 1.00 1.00 H new ATOM 0 HG23 VAL A 40 -8.384 5.424 5.069 1.00 1.00 H new ATOM 648 N VAL A 41 -3.840 7.779 4.920 1.00 1.00 N ATOM 649 CA VAL A 41 -2.398 7.743 5.048 1.00 1.00 C ATOM 650 C VAL A 41 -1.936 8.400 6.333 1.00 1.00 C ATOM 651 O VAL A 41 -2.334 9.517 6.655 1.00 1.00 O ATOM 652 CB VAL A 41 -1.710 8.450 3.856 1.00 1.00 C ATOM 653 CG1 VAL A 41 -1.683 7.536 2.644 1.00 1.00 C ATOM 654 CG2 VAL A 41 -2.426 9.764 3.538 1.00 1.00 C ATOM 0 H VAL A 41 -4.242 8.717 4.911 1.00 1.00 H new ATOM 0 HA VAL A 41 -2.115 6.690 5.060 1.00 1.00 H new ATOM 0 HB VAL A 41 -0.680 8.680 4.127 1.00 1.00 H new ATOM 0 HG11 VAL A 41 -1.196 8.047 1.814 1.00 1.00 H new ATOM 0 HG12 VAL A 41 -1.130 6.628 2.885 1.00 1.00 H new ATOM 0 HG13 VAL A 41 -2.703 7.276 2.362 1.00 1.00 H new ATOM 0 HG21 VAL A 41 -1.933 10.253 2.698 1.00 1.00 H new ATOM 0 HG22 VAL A 41 -3.465 9.559 3.280 1.00 1.00 H new ATOM 0 HG23 VAL A 41 -2.391 10.418 4.409 1.00 1.00 H new ATOM 664 N GLY A 42 -1.070 7.706 7.059 1.00 1.00 N ATOM 665 CA GLY A 42 -0.552 8.259 8.299 1.00 1.00 C ATOM 666 C GLY A 42 0.330 9.454 8.049 1.00 1.00 C ATOM 667 O GLY A 42 0.769 9.688 6.912 1.00 1.00 O ATOM 0 H GLY A 42 -0.719 6.780 6.817 1.00 1.00 H new ATOM 0 HA2 GLY A 42 -1.382 8.548 8.944 1.00 1.00 H new ATOM 0 HA3 GLY A 42 0.014 7.494 8.831 1.00 1.00 H new ATOM 671 N ARG A 43 0.575 10.243 9.091 1.00 1.00 N ATOM 672 CA ARG A 43 1.394 11.446 8.951 1.00 1.00 C ATOM 673 C ARG A 43 2.817 11.094 8.491 1.00 1.00 C ATOM 674 O ARG A 43 3.353 11.717 7.593 1.00 1.00 O ATOM 675 CB ARG A 43 1.449 12.216 10.267 1.00 1.00 C ATOM 676 CG ARG A 43 1.674 13.703 10.087 1.00 1.00 C ATOM 677 CD ARG A 43 3.020 14.132 10.632 1.00 1.00 C ATOM 678 NE ARG A 43 4.106 13.863 9.693 1.00 1.00 N ATOM 679 CZ ARG A 43 5.396 14.040 9.976 1.00 1.00 C ATOM 680 NH1 ARG A 43 5.764 14.523 11.157 1.00 1.00 N ATOM 681 NH2 ARG A 43 6.324 13.736 9.079 1.00 1.00 N ATOM 0 H ARG A 43 0.223 10.075 10.033 1.00 1.00 H new ATOM 0 HA ARG A 43 0.931 12.076 8.192 1.00 1.00 H new ATOM 0 HB2 ARG A 43 0.516 12.061 10.809 1.00 1.00 H new ATOM 0 HB3 ARG A 43 2.249 11.808 10.885 1.00 1.00 H new ATOM 0 HG2 ARG A 43 1.612 13.956 9.029 1.00 1.00 H new ATOM 0 HG3 ARG A 43 0.883 14.255 10.594 1.00 1.00 H new ATOM 0 HD2 ARG A 43 2.995 15.198 10.860 1.00 1.00 H new ATOM 0 HD3 ARG A 43 3.214 13.610 11.569 1.00 1.00 H new ATOM 0 HE ARG A 43 3.862 13.519 8.764 1.00 1.00 H new ATOM 0 HH11 ARG A 43 5.058 14.761 11.853 1.00 1.00 H new ATOM 0 HH12 ARG A 43 6.753 14.656 11.368 1.00 1.00 H new ATOM 0 HH21 ARG A 43 6.051 13.365 8.169 1.00 1.00 H new ATOM 0 HH22 ARG A 43 7.310 13.873 9.299 1.00 1.00 H new ATOM 695 N ARG A 44 3.394 10.065 9.062 1.00 1.00 N ATOM 696 CA ARG A 44 4.741 9.665 8.678 1.00 1.00 C ATOM 697 C ARG A 44 4.762 9.314 7.206 1.00 1.00 C ATOM 698 O ARG A 44 5.714 9.597 6.482 1.00 1.00 O ATOM 699 CB ARG A 44 5.206 8.463 9.506 1.00 1.00 C ATOM 700 CG ARG A 44 6.177 8.821 10.613 1.00 1.00 C ATOM 701 CD ARG A 44 7.597 8.393 10.258 1.00 1.00 C ATOM 702 NE ARG A 44 8.574 9.416 10.614 1.00 1.00 N ATOM 703 CZ ARG A 44 9.881 9.185 10.714 1.00 1.00 C ATOM 704 NH1 ARG A 44 10.367 7.973 10.478 1.00 1.00 N ATOM 705 NH2 ARG A 44 10.704 10.169 11.051 1.00 1.00 N ATOM 0 H ARG A 44 2.965 9.490 9.787 1.00 1.00 H new ATOM 0 HA ARG A 44 5.421 10.496 8.867 1.00 1.00 H new ATOM 0 HB2 ARG A 44 4.334 7.976 9.943 1.00 1.00 H new ATOM 0 HB3 ARG A 44 5.677 7.737 8.843 1.00 1.00 H new ATOM 0 HG2 ARG A 44 6.151 9.896 10.790 1.00 1.00 H new ATOM 0 HG3 ARG A 44 5.870 8.338 11.541 1.00 1.00 H new ATOM 0 HD2 ARG A 44 7.837 7.464 10.776 1.00 1.00 H new ATOM 0 HD3 ARG A 44 7.659 8.187 9.189 1.00 1.00 H new ATOM 0 HE ARG A 44 8.237 10.361 10.796 1.00 1.00 H new ATOM 0 HH11 ARG A 44 9.738 7.213 10.219 1.00 1.00 H new ATOM 0 HH12 ARG A 44 11.369 7.801 10.556 1.00 1.00 H new ATOM 0 HH21 ARG A 44 10.335 11.102 11.233 1.00 1.00 H new ATOM 0 HH22 ARG A 44 11.706 9.992 11.128 1.00 1.00 H new ATOM 719 N THR A 45 3.685 8.697 6.761 1.00 1.00 N ATOM 720 CA THR A 45 3.539 8.306 5.367 1.00 1.00 C ATOM 721 C THR A 45 3.536 9.531 4.460 1.00 1.00 C ATOM 722 O THR A 45 4.201 9.551 3.418 1.00 1.00 O ATOM 723 CB THR A 45 2.266 7.467 5.172 1.00 1.00 C ATOM 724 OG1 THR A 45 2.404 6.200 5.787 1.00 1.00 O ATOM 725 CG2 THR A 45 1.922 7.218 3.723 1.00 1.00 C ATOM 0 H THR A 45 2.889 8.452 7.350 1.00 1.00 H new ATOM 0 HA THR A 45 4.394 7.689 5.090 1.00 1.00 H new ATOM 0 HB THR A 45 1.469 8.055 5.627 1.00 1.00 H new ATOM 0 HG1 THR A 45 1.820 6.153 6.573 1.00 1.00 H new ATOM 0 HG21 THR A 45 1.013 6.620 3.662 1.00 1.00 H new ATOM 0 HG22 THR A 45 1.764 8.171 3.218 1.00 1.00 H new ATOM 0 HG23 THR A 45 2.741 6.683 3.241 1.00 1.00 H new ATOM 733 N TYR A 46 2.786 10.549 4.860 1.00 1.00 N ATOM 734 CA TYR A 46 2.687 11.783 4.099 1.00 1.00 C ATOM 735 C TYR A 46 4.068 12.281 3.672 1.00 1.00 C ATOM 736 O TYR A 46 4.308 12.533 2.498 1.00 1.00 O ATOM 737 CB TYR A 46 1.966 12.863 4.902 1.00 1.00 C ATOM 738 CG TYR A 46 1.606 14.097 4.101 1.00 1.00 C ATOM 739 CD1 TYR A 46 1.702 14.114 2.716 1.00 1.00 C ATOM 740 CD2 TYR A 46 1.175 15.249 4.744 1.00 1.00 C ATOM 741 CE1 TYR A 46 1.379 15.246 1.992 1.00 1.00 C ATOM 742 CE2 TYR A 46 0.851 16.385 4.029 1.00 1.00 C ATOM 743 CZ TYR A 46 0.955 16.379 2.654 1.00 1.00 C ATOM 744 OH TYR A 46 0.646 17.505 1.930 1.00 1.00 O ATOM 0 H TYR A 46 2.233 10.541 5.717 1.00 1.00 H new ATOM 0 HA TYR A 46 2.106 11.569 3.202 1.00 1.00 H new ATOM 0 HB2 TYR A 46 1.055 12.439 5.324 1.00 1.00 H new ATOM 0 HB3 TYR A 46 2.597 13.159 5.740 1.00 1.00 H new ATOM 0 HD1 TYR A 46 2.035 13.228 2.196 1.00 1.00 H new ATOM 0 HD2 TYR A 46 1.092 15.257 5.821 1.00 1.00 H new ATOM 0 HE1 TYR A 46 1.458 15.243 0.915 1.00 1.00 H new ATOM 0 HE2 TYR A 46 0.518 17.274 4.544 1.00 1.00 H new ATOM 0 HH TYR A 46 0.362 18.218 2.539 1.00 1.00 H new ATOM 754 N GLU A 47 4.969 12.415 4.635 1.00 1.00 N ATOM 755 CA GLU A 47 6.323 12.879 4.360 1.00 1.00 C ATOM 756 C GLU A 47 6.987 12.031 3.266 1.00 1.00 C ATOM 757 O GLU A 47 7.899 12.493 2.582 1.00 1.00 O ATOM 758 CB GLU A 47 7.154 12.832 5.634 1.00 1.00 C ATOM 759 CG GLU A 47 7.657 14.192 6.075 1.00 1.00 C ATOM 760 CD GLU A 47 8.895 14.106 6.940 1.00 1.00 C ATOM 761 OE1 GLU A 47 9.962 13.722 6.417 1.00 1.00 O ATOM 762 OE2 GLU A 47 8.797 14.424 8.144 1.00 1.00 O ATOM 0 H GLU A 47 4.787 12.208 5.617 1.00 1.00 H new ATOM 0 HA GLU A 47 6.266 13.907 4.003 1.00 1.00 H new ATOM 0 HB2 GLU A 47 6.555 12.398 6.434 1.00 1.00 H new ATOM 0 HB3 GLU A 47 8.006 12.170 5.479 1.00 1.00 H new ATOM 0 HG2 GLU A 47 7.875 14.797 5.195 1.00 1.00 H new ATOM 0 HG3 GLU A 47 6.869 14.705 6.626 1.00 1.00 H new ATOM 769 N SER A 48 6.526 10.795 3.118 1.00 1.00 N ATOM 770 CA SER A 48 7.085 9.899 2.115 1.00 1.00 C ATOM 771 C SER A 48 6.446 10.115 0.742 1.00 1.00 C ATOM 772 O SER A 48 6.984 9.660 -0.265 1.00 1.00 O ATOM 773 CB SER A 48 6.914 8.435 2.545 1.00 1.00 C ATOM 774 OG SER A 48 6.320 7.671 1.513 1.00 1.00 O ATOM 0 H SER A 48 5.772 10.393 3.675 1.00 1.00 H new ATOM 0 HA SER A 48 8.147 10.128 2.032 1.00 1.00 H new ATOM 0 HB2 SER A 48 7.885 8.012 2.803 1.00 1.00 H new ATOM 0 HB3 SER A 48 6.296 8.385 3.441 1.00 1.00 H new ATOM 0 HG SER A 48 6.222 6.742 1.809 1.00 1.00 H new ATOM 780 N PHE A 49 5.298 10.781 0.708 1.00 1.00 N ATOM 781 CA PHE A 49 4.595 11.023 -0.549 1.00 1.00 C ATOM 782 C PHE A 49 5.555 11.502 -1.641 1.00 1.00 C ATOM 783 O PHE A 49 5.979 12.659 -1.642 1.00 1.00 O ATOM 784 CB PHE A 49 3.487 12.068 -0.369 1.00 1.00 C ATOM 785 CG PHE A 49 2.188 11.484 0.122 1.00 1.00 C ATOM 786 CD1 PHE A 49 2.160 10.256 0.767 1.00 1.00 C ATOM 787 CD2 PHE A 49 0.994 12.159 -0.068 1.00 1.00 C ATOM 788 CE1 PHE A 49 0.966 9.716 1.209 1.00 1.00 C ATOM 789 CE2 PHE A 49 -0.201 11.626 0.374 1.00 1.00 C ATOM 790 CZ PHE A 49 -0.215 10.402 1.012 1.00 1.00 C ATOM 0 H PHE A 49 4.834 11.162 1.532 1.00 1.00 H new ATOM 0 HA PHE A 49 4.153 10.074 -0.852 1.00 1.00 H new ATOM 0 HB2 PHE A 49 3.825 12.827 0.336 1.00 1.00 H new ATOM 0 HB3 PHE A 49 3.314 12.571 -1.320 1.00 1.00 H new ATOM 0 HD1 PHE A 49 3.081 9.715 0.926 1.00 1.00 H new ATOM 0 HD2 PHE A 49 0.997 13.116 -0.569 1.00 1.00 H new ATOM 0 HE1 PHE A 49 0.958 8.758 1.708 1.00 1.00 H new ATOM 0 HE2 PHE A 49 -1.123 12.166 0.221 1.00 1.00 H new ATOM 0 HZ PHE A 49 -1.149 9.982 1.356 1.00 1.00 H new ATOM 800 N PRO A 50 5.907 10.634 -2.588 1.00 1.00 N ATOM 801 CA PRO A 50 6.822 10.990 -3.674 1.00 1.00 C ATOM 802 C PRO A 50 6.166 11.896 -4.706 1.00 1.00 C ATOM 803 O PRO A 50 6.843 12.664 -5.392 1.00 1.00 O ATOM 804 CB PRO A 50 7.194 9.639 -4.285 1.00 1.00 C ATOM 805 CG PRO A 50 6.026 8.760 -4.003 1.00 1.00 C ATOM 806 CD PRO A 50 5.461 9.234 -2.692 1.00 1.00 C ATOM 0 HA PRO A 50 7.684 11.554 -3.318 1.00 1.00 H new ATOM 0 HB2 PRO A 50 7.374 9.726 -5.356 1.00 1.00 H new ATOM 0 HB3 PRO A 50 8.106 9.241 -3.839 1.00 1.00 H new ATOM 0 HG2 PRO A 50 5.283 8.831 -4.797 1.00 1.00 H new ATOM 0 HG3 PRO A 50 6.329 7.715 -3.943 1.00 1.00 H new ATOM 0 HD2 PRO A 50 4.374 9.161 -2.678 1.00 1.00 H new ATOM 0 HD3 PRO A 50 5.831 8.636 -1.860 1.00 1.00 H new ATOM 814 N LYS A 51 4.845 11.798 -4.820 1.00 1.00 N ATOM 815 CA LYS A 51 4.091 12.605 -5.775 1.00 1.00 C ATOM 816 C LYS A 51 2.885 13.266 -5.100 1.00 1.00 C ATOM 817 O LYS A 51 1.752 12.806 -5.241 1.00 1.00 O ATOM 818 CB LYS A 51 3.622 11.731 -6.947 1.00 1.00 C ATOM 819 CG LYS A 51 4.749 11.332 -7.890 1.00 1.00 C ATOM 820 CD LYS A 51 5.008 12.406 -8.930 1.00 1.00 C ATOM 821 CE LYS A 51 4.155 12.206 -10.172 1.00 1.00 C ATOM 822 NZ LYS A 51 4.296 13.335 -11.125 1.00 1.00 N ATOM 0 H LYS A 51 4.272 11.166 -4.261 1.00 1.00 H new ATOM 0 HA LYS A 51 4.746 13.390 -6.152 1.00 1.00 H new ATOM 0 HB2 LYS A 51 3.151 10.830 -6.554 1.00 1.00 H new ATOM 0 HB3 LYS A 51 2.860 12.269 -7.510 1.00 1.00 H new ATOM 0 HG2 LYS A 51 5.658 11.152 -7.317 1.00 1.00 H new ATOM 0 HG3 LYS A 51 4.495 10.396 -8.387 1.00 1.00 H new ATOM 0 HD2 LYS A 51 4.800 13.386 -8.500 1.00 1.00 H new ATOM 0 HD3 LYS A 51 6.062 12.397 -9.208 1.00 1.00 H new ATOM 0 HE2 LYS A 51 4.442 11.277 -10.664 1.00 1.00 H new ATOM 0 HE3 LYS A 51 3.109 12.103 -9.882 1.00 1.00 H new ATOM 0 HZ1 LYS A 51 3.699 13.162 -11.959 1.00 1.00 H new ATOM 0 HZ2 LYS A 51 3.998 14.218 -10.663 1.00 1.00 H new ATOM 0 HZ3 LYS A 51 5.289 13.417 -11.421 1.00 1.00 H new ATOM 836 N ARG A 52 3.134 14.347 -4.365 1.00 1.00 N ATOM 837 CA ARG A 52 2.065 15.065 -3.673 1.00 1.00 C ATOM 838 C ARG A 52 1.901 16.477 -4.233 1.00 1.00 C ATOM 839 O ARG A 52 2.826 17.051 -4.802 1.00 1.00 O ATOM 840 CB ARG A 52 2.358 15.135 -2.177 1.00 1.00 C ATOM 841 CG ARG A 52 2.747 16.527 -1.702 1.00 1.00 C ATOM 842 CD ARG A 52 3.281 16.508 -0.281 1.00 1.00 C ATOM 843 NE ARG A 52 4.508 17.287 -0.148 1.00 1.00 N ATOM 844 CZ ARG A 52 5.224 17.366 0.968 1.00 1.00 C ATOM 845 NH1 ARG A 52 4.830 16.729 2.065 1.00 1.00 N ATOM 846 NH2 ARG A 52 6.340 18.082 0.990 1.00 1.00 N ATOM 0 H ARG A 52 4.064 14.745 -4.233 1.00 1.00 H new ATOM 0 HA ARG A 52 1.135 14.519 -3.833 1.00 1.00 H new ATOM 0 HB2 ARG A 52 1.478 14.804 -1.626 1.00 1.00 H new ATOM 0 HB3 ARG A 52 3.163 14.440 -1.939 1.00 1.00 H new ATOM 0 HG2 ARG A 52 3.503 16.941 -2.369 1.00 1.00 H new ATOM 0 HG3 ARG A 52 1.880 17.185 -1.756 1.00 1.00 H new ATOM 0 HD2 ARG A 52 2.524 16.905 0.396 1.00 1.00 H new ATOM 0 HD3 ARG A 52 3.471 15.478 0.021 1.00 1.00 H new ATOM 0 HE ARG A 52 4.837 17.804 -0.964 1.00 1.00 H new ATOM 0 HH11 ARG A 52 3.973 16.175 2.053 1.00 1.00 H new ATOM 0 HH12 ARG A 52 5.384 16.793 2.919 1.00 1.00 H new ATOM 0 HH21 ARG A 52 6.648 18.572 0.150 1.00 1.00 H new ATOM 0 HH22 ARG A 52 6.890 18.143 1.847 1.00 1.00 H new ATOM 860 N PRO A 53 0.703 17.069 -4.064 1.00 1.00 N ATOM 861 CA PRO A 53 -0.421 16.410 -3.395 1.00 1.00 C ATOM 862 C PRO A 53 -1.150 15.429 -4.306 1.00 1.00 C ATOM 863 O PRO A 53 -0.713 15.159 -5.416 1.00 1.00 O ATOM 864 CB PRO A 53 -1.330 17.577 -3.021 1.00 1.00 C ATOM 865 CG PRO A 53 -1.091 18.583 -4.095 1.00 1.00 C ATOM 866 CD PRO A 53 0.349 18.418 -4.532 1.00 1.00 C ATOM 0 HA PRO A 53 -0.099 15.810 -2.544 1.00 1.00 H new ATOM 0 HB2 PRO A 53 -2.376 17.272 -2.986 1.00 1.00 H new ATOM 0 HB3 PRO A 53 -1.081 17.977 -2.038 1.00 1.00 H new ATOM 0 HG2 PRO A 53 -1.770 18.424 -4.932 1.00 1.00 H new ATOM 0 HG3 PRO A 53 -1.270 19.593 -3.726 1.00 1.00 H new ATOM 0 HD2 PRO A 53 0.452 18.506 -5.614 1.00 1.00 H new ATOM 0 HD3 PRO A 53 0.992 19.178 -4.087 1.00 1.00 H new ATOM 874 N LEU A 54 -2.267 14.913 -3.820 1.00 1.00 N ATOM 875 CA LEU A 54 -3.059 13.972 -4.580 1.00 1.00 C ATOM 876 C LEU A 54 -4.538 14.350 -4.571 1.00 1.00 C ATOM 877 O LEU A 54 -5.354 13.724 -3.880 1.00 1.00 O ATOM 878 CB LEU A 54 -2.887 12.545 -4.030 1.00 1.00 C ATOM 879 CG LEU A 54 -1.821 11.697 -4.729 1.00 1.00 C ATOM 880 CD1 LEU A 54 -1.265 10.649 -3.777 1.00 1.00 C ATOM 881 CD2 LEU A 54 -2.406 11.041 -5.977 1.00 1.00 C ATOM 0 H LEU A 54 -2.643 15.134 -2.898 1.00 1.00 H new ATOM 0 HA LEU A 54 -2.701 14.005 -5.609 1.00 1.00 H new ATOM 0 HB2 LEU A 54 -2.639 12.609 -2.971 1.00 1.00 H new ATOM 0 HB3 LEU A 54 -3.844 12.028 -4.102 1.00 1.00 H new ATOM 0 HG LEU A 54 -1.000 12.346 -5.033 1.00 1.00 H new ATOM 0 HD11 LEU A 54 -0.509 10.056 -4.291 1.00 1.00 H new ATOM 0 HD12 LEU A 54 -0.816 11.142 -2.915 1.00 1.00 H new ATOM 0 HD13 LEU A 54 -2.072 9.997 -3.442 1.00 1.00 H new ATOM 0 HD21 LEU A 54 -1.639 10.440 -6.466 1.00 1.00 H new ATOM 0 HD22 LEU A 54 -3.242 10.401 -5.694 1.00 1.00 H new ATOM 0 HD23 LEU A 54 -2.755 11.812 -6.664 1.00 1.00 H new ATOM 893 N PRO A 55 -4.909 15.367 -5.340 1.00 1.00 N ATOM 894 CA PRO A 55 -6.294 15.835 -5.434 1.00 1.00 C ATOM 895 C PRO A 55 -7.169 14.900 -6.256 1.00 1.00 C ATOM 896 O PRO A 55 -6.675 13.947 -6.863 1.00 1.00 O ATOM 897 CB PRO A 55 -6.166 17.178 -6.139 1.00 1.00 C ATOM 898 CG PRO A 55 -4.921 17.076 -6.953 1.00 1.00 C ATOM 899 CD PRO A 55 -3.992 16.151 -6.195 1.00 1.00 C ATOM 0 HA PRO A 55 -6.768 15.889 -4.454 1.00 1.00 H new ATOM 0 HB2 PRO A 55 -7.033 17.376 -6.769 1.00 1.00 H new ATOM 0 HB3 PRO A 55 -6.101 17.995 -5.421 1.00 1.00 H new ATOM 0 HG2 PRO A 55 -5.137 16.682 -7.946 1.00 1.00 H new ATOM 0 HG3 PRO A 55 -4.466 18.057 -7.091 1.00 1.00 H new ATOM 0 HD2 PRO A 55 -3.425 15.510 -6.870 1.00 1.00 H new ATOM 0 HD3 PRO A 55 -3.267 16.708 -5.601 1.00 1.00 H new ATOM 907 N GLU A 56 -8.466 15.190 -6.295 1.00 1.00 N ATOM 908 CA GLU A 56 -9.405 14.380 -7.066 1.00 1.00 C ATOM 909 C GLU A 56 -9.461 12.950 -6.528 1.00 1.00 C ATOM 910 O GLU A 56 -9.803 12.016 -7.258 1.00 1.00 O ATOM 911 CB GLU A 56 -9.000 14.359 -8.542 1.00 1.00 C ATOM 912 CG GLU A 56 -8.662 15.730 -9.099 1.00 1.00 C ATOM 913 CD GLU A 56 -8.473 15.709 -10.607 1.00 1.00 C ATOM 914 OE1 GLU A 56 -7.494 15.086 -11.070 1.00 1.00 O ATOM 915 OE2 GLU A 56 -9.301 16.312 -11.323 1.00 1.00 O ATOM 0 H GLU A 56 -8.890 15.977 -5.804 1.00 1.00 H new ATOM 0 HA GLU A 56 -10.394 14.828 -6.970 1.00 1.00 H new ATOM 0 HB2 GLU A 56 -8.138 13.704 -8.664 1.00 1.00 H new ATOM 0 HB3 GLU A 56 -9.813 13.929 -9.127 1.00 1.00 H new ATOM 0 HG2 GLU A 56 -9.458 16.430 -8.844 1.00 1.00 H new ATOM 0 HG3 GLU A 56 -7.751 16.098 -8.626 1.00 1.00 H new ATOM 922 N ARG A 57 -9.147 12.803 -5.244 1.00 1.00 N ATOM 923 CA ARG A 57 -9.166 11.504 -4.592 1.00 1.00 C ATOM 924 C ARG A 57 -9.498 11.657 -3.109 1.00 1.00 C ATOM 925 O ARG A 57 -8.964 12.539 -2.429 1.00 1.00 O ATOM 926 CB ARG A 57 -7.808 10.804 -4.774 1.00 1.00 C ATOM 927 CG ARG A 57 -7.821 9.757 -5.875 1.00 1.00 C ATOM 928 CD ARG A 57 -7.602 10.377 -7.245 1.00 1.00 C ATOM 929 NE ARG A 57 -6.459 9.778 -7.944 1.00 1.00 N ATOM 930 CZ ARG A 57 -6.165 10.008 -9.223 1.00 1.00 C ATOM 931 NH1 ARG A 57 -6.914 10.832 -9.944 1.00 1.00 N ATOM 932 NH2 ARG A 57 -5.117 9.416 -9.779 1.00 1.00 N ATOM 0 H ARG A 57 -8.875 13.574 -4.634 1.00 1.00 H new ATOM 0 HA ARG A 57 -9.939 10.890 -5.053 1.00 1.00 H new ATOM 0 HB2 ARG A 57 -7.048 11.552 -5.001 1.00 1.00 H new ATOM 0 HB3 ARG A 57 -7.520 10.332 -3.835 1.00 1.00 H new ATOM 0 HG2 ARG A 57 -7.044 9.017 -5.682 1.00 1.00 H new ATOM 0 HG3 ARG A 57 -8.774 9.229 -5.863 1.00 1.00 H new ATOM 0 HD2 ARG A 57 -8.502 10.251 -7.848 1.00 1.00 H new ATOM 0 HD3 ARG A 57 -7.439 11.449 -7.136 1.00 1.00 H new ATOM 0 HE ARG A 57 -5.853 9.148 -7.419 1.00 1.00 H new ATOM 0 HH11 ARG A 57 -7.719 11.293 -9.520 1.00 1.00 H new ATOM 0 HH12 ARG A 57 -6.685 11.005 -10.923 1.00 1.00 H new ATOM 0 HH21 ARG A 57 -4.536 8.785 -9.228 1.00 1.00 H new ATOM 0 HH22 ARG A 57 -4.892 9.592 -10.758 1.00 1.00 H new ATOM 946 N THR A 58 -10.403 10.799 -2.633 1.00 1.00 N ATOM 947 CA THR A 58 -10.841 10.832 -1.243 1.00 1.00 C ATOM 948 C THR A 58 -9.769 10.276 -0.307 1.00 1.00 C ATOM 949 O THR A 58 -9.828 9.129 0.135 1.00 1.00 O ATOM 950 CB THR A 58 -12.149 10.052 -1.081 1.00 1.00 C ATOM 951 OG1 THR A 58 -12.016 8.740 -1.610 1.00 1.00 O ATOM 952 CG2 THR A 58 -13.319 10.708 -1.777 1.00 1.00 C ATOM 0 H THR A 58 -10.846 10.072 -3.195 1.00 1.00 H new ATOM 0 HA THR A 58 -11.013 11.873 -0.970 1.00 1.00 H new ATOM 0 HB THR A 58 -12.347 10.029 -0.009 1.00 1.00 H new ATOM 0 HG1 THR A 58 -12.838 8.493 -2.082 1.00 1.00 H new ATOM 0 HG21 THR A 58 -14.216 10.108 -1.625 1.00 1.00 H new ATOM 0 HG22 THR A 58 -13.475 11.705 -1.365 1.00 1.00 H new ATOM 0 HG23 THR A 58 -13.111 10.786 -2.844 1.00 1.00 H new ATOM 960 N ASN A 59 -8.782 11.099 -0.009 1.00 1.00 N ATOM 961 CA ASN A 59 -7.689 10.707 0.863 1.00 1.00 C ATOM 962 C ASN A 59 -7.856 11.292 2.264 1.00 1.00 C ATOM 963 O ASN A 59 -8.312 12.425 2.422 1.00 1.00 O ATOM 964 CB ASN A 59 -6.352 11.176 0.269 1.00 1.00 C ATOM 965 CG ASN A 59 -5.545 10.026 -0.307 1.00 1.00 C ATOM 966 OD1 ASN A 59 -4.472 9.695 0.197 1.00 1.00 O ATOM 967 ND2 ASN A 59 -6.048 9.418 -1.374 1.00 1.00 N ATOM 0 H ASN A 59 -8.714 12.054 -0.362 1.00 1.00 H new ATOM 0 HA ASN A 59 -7.698 9.620 0.942 1.00 1.00 H new ATOM 0 HB2 ASN A 59 -6.542 11.912 -0.513 1.00 1.00 H new ATOM 0 HB3 ASN A 59 -5.768 11.676 1.042 1.00 1.00 H new ATOM 0 HD21 ASN A 59 -5.542 8.646 -1.807 1.00 1.00 H new ATOM 0 HD22 ASN A 59 -6.941 9.723 -1.761 1.00 1.00 H new ATOM 974 N VAL A 60 -7.493 10.513 3.278 1.00 1.00 N ATOM 975 CA VAL A 60 -7.601 10.966 4.659 1.00 1.00 C ATOM 976 C VAL A 60 -6.253 10.902 5.377 1.00 1.00 C ATOM 977 O VAL A 60 -5.605 9.860 5.380 1.00 1.00 O ATOM 978 CB VAL A 60 -8.609 10.114 5.442 1.00 1.00 C ATOM 979 CG1 VAL A 60 -8.718 10.594 6.879 1.00 1.00 C ATOM 980 CG2 VAL A 60 -9.969 10.152 4.776 1.00 1.00 C ATOM 0 H VAL A 60 -7.123 9.569 3.170 1.00 1.00 H new ATOM 0 HA VAL A 60 -7.942 12.001 4.622 1.00 1.00 H new ATOM 0 HB VAL A 60 -8.250 9.085 5.446 1.00 1.00 H new ATOM 0 HG11 VAL A 60 -9.438 9.976 7.415 1.00 1.00 H new ATOM 0 HG12 VAL A 60 -7.744 10.519 7.363 1.00 1.00 H new ATOM 0 HG13 VAL A 60 -9.050 11.632 6.892 1.00 1.00 H new ATOM 0 HG21 VAL A 60 -10.670 9.542 5.346 1.00 1.00 H new ATOM 0 HG22 VAL A 60 -10.328 11.181 4.741 1.00 1.00 H new ATOM 0 HG23 VAL A 60 -9.889 9.761 3.762 1.00 1.00 H new ATOM 990 N VAL A 61 -5.844 12.005 6.021 1.00 1.00 N ATOM 991 CA VAL A 61 -4.584 12.013 6.757 1.00 1.00 C ATOM 992 C VAL A 61 -4.813 11.598 8.203 1.00 1.00 C ATOM 993 O VAL A 61 -5.687 12.137 8.868 1.00 1.00 O ATOM 994 CB VAL A 61 -3.908 13.402 6.746 1.00 1.00 C ATOM 995 CG1 VAL A 61 -3.350 13.751 8.117 1.00 1.00 C ATOM 996 CG2 VAL A 61 -2.807 13.445 5.691 1.00 1.00 C ATOM 0 H VAL A 61 -6.360 12.884 6.044 1.00 1.00 H new ATOM 0 HA VAL A 61 -3.926 11.304 6.256 1.00 1.00 H new ATOM 0 HB VAL A 61 -4.663 14.146 6.494 1.00 1.00 H new ATOM 0 HG11 VAL A 61 -2.880 14.734 8.079 1.00 1.00 H new ATOM 0 HG12 VAL A 61 -4.159 13.764 8.847 1.00 1.00 H new ATOM 0 HG13 VAL A 61 -2.610 13.006 8.409 1.00 1.00 H new ATOM 0 HG21 VAL A 61 -2.339 14.429 5.694 1.00 1.00 H new ATOM 0 HG22 VAL A 61 -2.058 12.686 5.916 1.00 1.00 H new ATOM 0 HG23 VAL A 61 -3.237 13.250 4.708 1.00 1.00 H new ATOM 1006 N LEU A 62 -4.027 10.652 8.694 1.00 1.00 N ATOM 1007 CA LEU A 62 -4.185 10.199 10.070 1.00 1.00 C ATOM 1008 C LEU A 62 -3.166 10.880 10.972 1.00 1.00 C ATOM 1009 O LEU A 62 -1.966 10.842 10.707 1.00 1.00 O ATOM 1010 CB LEU A 62 -4.003 8.675 10.154 1.00 1.00 C ATOM 1011 CG LEU A 62 -5.227 7.896 10.638 1.00 1.00 C ATOM 1012 CD1 LEU A 62 -4.987 6.394 10.524 1.00 1.00 C ATOM 1013 CD2 LEU A 62 -5.564 8.275 12.074 1.00 1.00 C ATOM 0 H LEU A 62 -3.284 10.188 8.171 1.00 1.00 H new ATOM 0 HA LEU A 62 -5.190 10.460 10.403 1.00 1.00 H new ATOM 0 HB2 LEU A 62 -3.724 8.304 9.168 1.00 1.00 H new ATOM 0 HB3 LEU A 62 -3.169 8.462 10.823 1.00 1.00 H new ATOM 0 HG LEU A 62 -6.074 8.157 10.003 1.00 1.00 H new ATOM 0 HD11 LEU A 62 -5.869 5.857 10.873 1.00 1.00 H new ATOM 0 HD12 LEU A 62 -4.792 6.135 9.483 1.00 1.00 H new ATOM 0 HD13 LEU A 62 -4.128 6.116 11.134 1.00 1.00 H new ATOM 0 HD21 LEU A 62 -6.437 7.712 12.404 1.00 1.00 H new ATOM 0 HD22 LEU A 62 -4.717 8.042 12.720 1.00 1.00 H new ATOM 0 HD23 LEU A 62 -5.779 9.342 12.128 1.00 1.00 H new ATOM 1025 N THR A 63 -3.653 11.523 12.029 1.00 1.00 N ATOM 1026 CA THR A 63 -2.774 12.222 12.947 1.00 1.00 C ATOM 1027 C THR A 63 -3.158 11.941 14.398 1.00 1.00 C ATOM 1028 O THR A 63 -4.291 11.588 14.694 1.00 1.00 O ATOM 1029 CB THR A 63 -2.821 13.724 12.674 1.00 1.00 C ATOM 1030 OG1 THR A 63 -4.161 14.154 12.464 1.00 1.00 O ATOM 1031 CG2 THR A 63 -2.028 14.109 11.446 1.00 1.00 C ATOM 0 H THR A 63 -4.644 11.572 12.266 1.00 1.00 H new ATOM 0 HA THR A 63 -1.759 11.859 12.789 1.00 1.00 H new ATOM 0 HB THR A 63 -2.387 14.203 13.552 1.00 1.00 H new ATOM 0 HG1 THR A 63 -4.409 14.801 13.157 1.00 1.00 H new ATOM 0 HG21 THR A 63 -2.092 15.186 11.294 1.00 1.00 H new ATOM 0 HG22 THR A 63 -0.985 13.823 11.582 1.00 1.00 H new ATOM 0 HG23 THR A 63 -2.434 13.595 10.575 1.00 1.00 H new ATOM 1039 N HIS A 64 -2.186 12.085 15.288 1.00 1.00 N ATOM 1040 CA HIS A 64 -2.396 11.837 16.705 1.00 1.00 C ATOM 1041 C HIS A 64 -3.357 12.856 17.298 1.00 1.00 C ATOM 1042 O HIS A 64 -4.198 12.523 18.126 1.00 1.00 O ATOM 1043 CB HIS A 64 -1.072 11.890 17.458 1.00 1.00 C ATOM 1044 CG HIS A 64 -0.467 10.545 17.726 1.00 1.00 C ATOM 1045 ND1 HIS A 64 0.732 10.397 18.390 1.00 1.00 N ATOM 1046 CD2 HIS A 64 -0.894 9.292 17.442 1.00 1.00 C ATOM 1047 CE1 HIS A 64 1.016 9.110 18.502 1.00 1.00 C ATOM 1048 NE2 HIS A 64 0.044 8.420 17.935 1.00 1.00 N ATOM 0 H HIS A 64 -1.237 12.375 15.050 1.00 1.00 H new ATOM 0 HA HIS A 64 -2.829 10.842 16.808 1.00 1.00 H new ATOM 0 HB2 HIS A 64 -0.364 12.488 16.884 1.00 1.00 H new ATOM 0 HB3 HIS A 64 -1.226 12.403 18.407 1.00 1.00 H new ATOM 0 HD2 HIS A 64 -1.804 9.028 16.924 1.00 1.00 H new ATOM 0 HE1 HIS A 64 1.893 8.695 18.976 1.00 1.00 H new ATOM 0 HE2 HIS A 64 -0.002 7.403 17.873 1.00 1.00 H new ATOM 1057 N GLN A 65 -3.208 14.117 16.893 1.00 1.00 N ATOM 1058 CA GLN A 65 -4.049 15.196 17.406 1.00 1.00 C ATOM 1059 C GLN A 65 -5.115 15.639 16.402 1.00 1.00 C ATOM 1060 O GLN A 65 -4.825 15.903 15.236 1.00 1.00 O ATOM 1061 CB GLN A 65 -3.190 16.400 17.791 1.00 1.00 C ATOM 1062 CG GLN A 65 -3.686 17.137 19.022 1.00 1.00 C ATOM 1063 CD GLN A 65 -3.546 16.302 20.281 1.00 1.00 C ATOM 1064 OE1 GLN A 65 -4.519 16.063 20.996 1.00 1.00 O ATOM 1065 NE2 GLN A 65 -2.332 15.830 20.546 1.00 1.00 N ATOM 0 H GLN A 65 -2.512 14.416 16.210 1.00 1.00 H new ATOM 0 HA GLN A 65 -4.561 14.802 18.284 1.00 1.00 H new ATOM 0 HB2 GLN A 65 -2.168 16.064 17.967 1.00 1.00 H new ATOM 0 HB3 GLN A 65 -3.157 17.095 16.952 1.00 1.00 H new ATOM 0 HG2 GLN A 65 -3.126 18.065 19.139 1.00 1.00 H new ATOM 0 HG3 GLN A 65 -4.732 17.411 18.883 1.00 1.00 H new ATOM 0 HE21 GLN A 65 -1.552 16.052 19.927 1.00 1.00 H new ATOM 0 HE22 GLN A 65 -2.180 15.246 21.368 1.00 1.00 H new ATOM 1074 N GLU A 66 -6.342 15.745 16.893 1.00 1.00 N ATOM 1075 CA GLU A 66 -7.486 16.185 16.083 1.00 1.00 C ATOM 1076 C GLU A 66 -7.328 17.643 15.670 1.00 1.00 C ATOM 1077 O GLU A 66 -7.723 18.049 14.581 1.00 1.00 O ATOM 1078 CB GLU A 66 -8.783 16.017 16.870 1.00 1.00 C ATOM 1079 CG GLU A 66 -8.970 17.046 17.969 1.00 1.00 C ATOM 1080 CD GLU A 66 -10.304 16.900 18.673 1.00 1.00 C ATOM 1081 OE1 GLU A 66 -10.597 15.783 19.151 1.00 1.00 O ATOM 1082 OE2 GLU A 66 -11.052 17.895 18.754 1.00 1.00 O ATOM 0 H GLU A 66 -6.580 15.530 17.861 1.00 1.00 H new ATOM 0 HA GLU A 66 -7.523 15.568 15.185 1.00 1.00 H new ATOM 0 HB2 GLU A 66 -9.626 16.078 16.181 1.00 1.00 H new ATOM 0 HB3 GLU A 66 -8.803 15.020 17.311 1.00 1.00 H new ATOM 0 HG2 GLU A 66 -8.165 16.947 18.697 1.00 1.00 H new ATOM 0 HG3 GLU A 66 -8.894 18.047 17.544 1.00 1.00 H new ATOM 1089 N ASP A 67 -6.748 18.430 16.576 1.00 1.00 N ATOM 1090 CA ASP A 67 -6.541 19.854 16.356 1.00 1.00 C ATOM 1091 C ASP A 67 -5.570 20.095 15.203 1.00 1.00 C ATOM 1092 O ASP A 67 -5.701 21.074 14.462 1.00 1.00 O ATOM 1093 CB ASP A 67 -6.007 20.494 17.631 1.00 1.00 C ATOM 1094 CG ASP A 67 -5.864 22.000 17.511 1.00 1.00 C ATOM 1095 OD1 ASP A 67 -4.783 22.453 17.082 1.00 1.00 O ATOM 1096 OD2 ASP A 67 -6.830 22.724 17.835 1.00 1.00 O ATOM 0 H ASP A 67 -6.411 18.096 17.479 1.00 1.00 H new ATOM 0 HA ASP A 67 -7.497 20.307 16.092 1.00 1.00 H new ATOM 0 HB2 ASP A 67 -6.677 20.261 18.459 1.00 1.00 H new ATOM 0 HB3 ASP A 67 -5.038 20.059 17.873 1.00 1.00 H new ATOM 1101 N TYR A 68 -4.610 19.212 15.048 1.00 1.00 N ATOM 1102 CA TYR A 68 -3.624 19.354 13.972 1.00 1.00 C ATOM 1103 C TYR A 68 -4.320 19.346 12.615 1.00 1.00 C ATOM 1104 O TYR A 68 -5.240 18.583 12.384 1.00 1.00 O ATOM 1105 CB TYR A 68 -2.595 18.234 14.037 1.00 1.00 C ATOM 1106 CG TYR A 68 -1.215 18.669 13.610 1.00 1.00 C ATOM 1107 CD1 TYR A 68 -0.945 18.962 12.276 1.00 1.00 C ATOM 1108 CD2 TYR A 68 -0.179 18.784 14.530 1.00 1.00 C ATOM 1109 CE1 TYR A 68 0.317 19.356 11.874 1.00 1.00 C ATOM 1110 CE2 TYR A 68 1.085 19.177 14.135 1.00 1.00 C ATOM 1111 CZ TYR A 68 1.328 19.462 12.807 1.00 1.00 C ATOM 1112 OH TYR A 68 2.585 19.848 12.394 1.00 1.00 O ATOM 0 H TYR A 68 -4.481 18.392 15.641 1.00 1.00 H new ATOM 0 HA TYR A 68 -3.109 20.306 14.101 1.00 1.00 H new ATOM 0 HB2 TYR A 68 -2.549 17.851 15.056 1.00 1.00 H new ATOM 0 HB3 TYR A 68 -2.922 17.411 13.401 1.00 1.00 H new ATOM 0 HD1 TYR A 68 -1.735 18.880 11.544 1.00 1.00 H new ATOM 0 HD2 TYR A 68 -0.366 18.562 15.570 1.00 1.00 H new ATOM 0 HE1 TYR A 68 0.511 19.580 10.835 1.00 1.00 H new ATOM 0 HE2 TYR A 68 1.879 19.261 14.862 1.00 1.00 H new ATOM 0 HH TYR A 68 3.188 19.878 13.166 1.00 1.00 H new ATOM 1122 N GLN A 69 -3.892 20.253 11.742 1.00 1.00 N ATOM 1123 CA GLN A 69 -4.486 20.390 10.417 1.00 1.00 C ATOM 1124 C GLN A 69 -3.619 19.750 9.351 1.00 1.00 C ATOM 1125 O GLN A 69 -2.401 19.911 9.347 1.00 1.00 O ATOM 1126 CB GLN A 69 -4.731 21.862 10.084 1.00 1.00 C ATOM 1127 CG GLN A 69 -3.470 22.707 10.041 1.00 1.00 C ATOM 1128 CD GLN A 69 -3.765 24.184 9.856 1.00 1.00 C ATOM 1129 OE1 GLN A 69 -3.195 24.839 8.984 1.00 1.00 O ATOM 1130 NE2 GLN A 69 -4.648 24.717 10.692 1.00 1.00 N ATOM 0 H GLN A 69 -3.132 20.907 11.930 1.00 1.00 H new ATOM 0 HA GLN A 69 -5.443 19.868 10.432 1.00 1.00 H new ATOM 0 HB2 GLN A 69 -5.231 21.926 9.118 1.00 1.00 H new ATOM 0 HB3 GLN A 69 -5.412 22.282 10.824 1.00 1.00 H new ATOM 0 HG2 GLN A 69 -2.910 22.565 10.965 1.00 1.00 H new ATOM 0 HG3 GLN A 69 -2.833 22.362 9.226 1.00 1.00 H new ATOM 0 HE21 GLN A 69 -5.096 24.135 11.400 1.00 1.00 H new ATOM 0 HE22 GLN A 69 -4.878 25.708 10.626 1.00 1.00 H new ATOM 1139 N ALA A 70 -4.259 19.037 8.440 1.00 1.00 N ATOM 1140 CA ALA A 70 -3.563 18.365 7.351 1.00 1.00 C ATOM 1141 C ALA A 70 -4.148 18.790 6.010 1.00 1.00 C ATOM 1142 O ALA A 70 -5.346 19.051 5.904 1.00 1.00 O ATOM 1143 CB ALA A 70 -3.625 16.866 7.504 1.00 1.00 C ATOM 0 H ALA A 70 -5.271 18.907 8.432 1.00 1.00 H new ATOM 0 HA ALA A 70 -2.514 18.660 7.387 1.00 1.00 H new ATOM 0 HB1 ALA A 70 -3.097 16.394 6.676 1.00 1.00 H new ATOM 0 HB2 ALA A 70 -3.157 16.577 8.445 1.00 1.00 H new ATOM 0 HB3 ALA A 70 -4.666 16.543 7.502 1.00 1.00 H new ATOM 1149 N GLN A 71 -3.289 18.893 5.004 1.00 1.00 N ATOM 1150 CA GLN A 71 -3.733 19.330 3.695 1.00 1.00 C ATOM 1151 C GLN A 71 -3.822 18.170 2.698 1.00 1.00 C ATOM 1152 O GLN A 71 -2.909 17.355 2.578 1.00 1.00 O ATOM 1153 CB GLN A 71 -2.778 20.401 3.148 1.00 1.00 C ATOM 1154 CG GLN A 71 -3.303 21.813 3.313 1.00 1.00 C ATOM 1155 CD GLN A 71 -2.239 22.800 3.775 1.00 1.00 C ATOM 1156 OE1 GLN A 71 -1.218 22.401 4.335 1.00 1.00 O ATOM 1157 NE2 GLN A 71 -2.470 24.086 3.540 1.00 1.00 N ATOM 0 H GLN A 71 -2.293 18.682 5.071 1.00 1.00 H new ATOM 0 HA GLN A 71 -4.734 19.745 3.815 1.00 1.00 H new ATOM 0 HB2 GLN A 71 -1.818 20.316 3.657 1.00 1.00 H new ATOM 0 HB3 GLN A 71 -2.596 20.210 2.090 1.00 1.00 H new ATOM 0 HG2 GLN A 71 -3.717 22.153 2.364 1.00 1.00 H new ATOM 0 HG3 GLN A 71 -4.121 21.807 4.033 1.00 1.00 H new ATOM 0 HE21 GLN A 71 -3.330 24.373 3.073 1.00 1.00 H new ATOM 0 HE22 GLN A 71 -1.787 24.787 3.827 1.00 1.00 H new ATOM 1166 N GLY A 72 -4.944 18.115 1.996 1.00 1.00 N ATOM 1167 CA GLY A 72 -5.139 17.080 1.002 1.00 1.00 C ATOM 1168 C GLY A 72 -5.839 15.862 1.554 1.00 1.00 C ATOM 1169 O GLY A 72 -6.393 15.070 0.798 1.00 1.00 O ATOM 0 H GLY A 72 -5.722 18.767 2.097 1.00 1.00 H new ATOM 0 HA2 GLY A 72 -5.721 17.484 0.174 1.00 1.00 H new ATOM 0 HA3 GLY A 72 -4.171 16.785 0.597 1.00 1.00 H new ATOM 1173 N ALA A 73 -5.826 15.717 2.865 1.00 1.00 N ATOM 1174 CA ALA A 73 -6.494 14.574 3.475 1.00 1.00 C ATOM 1175 C ALA A 73 -7.083 14.918 4.853 1.00 1.00 C ATOM 1176 O ALA A 73 -6.467 15.613 5.648 1.00 1.00 O ATOM 1177 CB ALA A 73 -5.528 13.415 3.572 1.00 1.00 C ATOM 0 H ALA A 73 -5.373 16.356 3.518 1.00 1.00 H new ATOM 0 HA ALA A 73 -7.332 14.291 2.839 1.00 1.00 H new ATOM 0 HB1 ALA A 73 -6.029 12.561 4.028 1.00 1.00 H new ATOM 0 HB2 ALA A 73 -5.184 13.143 2.574 1.00 1.00 H new ATOM 0 HB3 ALA A 73 -4.673 13.704 4.184 1.00 1.00 H new ATOM 1183 N VAL A 74 -8.263 14.373 5.141 1.00 1.00 N ATOM 1184 CA VAL A 74 -8.959 14.615 6.412 1.00 1.00 C ATOM 1185 C VAL A 74 -8.189 14.099 7.618 1.00 1.00 C ATOM 1186 O VAL A 74 -7.607 13.012 7.602 1.00 1.00 O ATOM 1187 CB VAL A 74 -10.364 13.978 6.392 1.00 1.00 C ATOM 1188 CG1 VAL A 74 -10.852 13.729 7.803 1.00 1.00 C ATOM 1189 CG2 VAL A 74 -11.343 14.844 5.625 1.00 1.00 C ATOM 0 H VAL A 74 -8.766 13.753 4.506 1.00 1.00 H new ATOM 0 HA VAL A 74 -9.041 15.697 6.513 1.00 1.00 H new ATOM 0 HB VAL A 74 -10.296 13.019 5.878 1.00 1.00 H new ATOM 0 HG11 VAL A 74 -11.844 13.279 7.771 1.00 1.00 H new ATOM 0 HG12 VAL A 74 -10.164 13.054 8.312 1.00 1.00 H new ATOM 0 HG13 VAL A 74 -10.899 14.674 8.344 1.00 1.00 H new ATOM 0 HG21 VAL A 74 -12.325 14.372 5.627 1.00 1.00 H new ATOM 0 HG22 VAL A 74 -11.411 15.824 6.098 1.00 1.00 H new ATOM 0 HG23 VAL A 74 -10.998 14.961 4.598 1.00 1.00 H new ATOM 1199 N VAL A 75 -8.168 14.895 8.698 1.00 1.00 N ATOM 1200 CA VAL A 75 -7.456 14.498 9.912 1.00 1.00 C ATOM 1201 C VAL A 75 -8.382 13.792 10.884 1.00 1.00 C ATOM 1202 O VAL A 75 -9.328 14.367 11.407 1.00 1.00 O ATOM 1203 CB VAL A 75 -6.820 15.712 10.634 1.00 1.00 C ATOM 1204 CG1 VAL A 75 -6.761 15.463 12.144 1.00 1.00 C ATOM 1205 CG2 VAL A 75 -5.421 15.978 10.083 1.00 1.00 C ATOM 0 H VAL A 75 -8.630 15.803 8.752 1.00 1.00 H new ATOM 0 HA VAL A 75 -6.665 13.819 9.593 1.00 1.00 H new ATOM 0 HB VAL A 75 -7.439 16.591 10.453 1.00 1.00 H new ATOM 0 HG11 VAL A 75 -6.312 16.325 12.638 1.00 1.00 H new ATOM 0 HG12 VAL A 75 -7.770 15.311 12.527 1.00 1.00 H new ATOM 0 HG13 VAL A 75 -6.159 14.576 12.343 1.00 1.00 H new ATOM 0 HG21 VAL A 75 -4.984 16.833 10.598 1.00 1.00 H new ATOM 0 HG22 VAL A 75 -4.795 15.100 10.241 1.00 1.00 H new ATOM 0 HG23 VAL A 75 -5.485 16.191 9.016 1.00 1.00 H new ATOM 1215 N VAL A 76 -8.079 12.517 11.136 1.00 1.00 N ATOM 1216 CA VAL A 76 -8.851 11.697 12.054 1.00 1.00 C ATOM 1217 C VAL A 76 -7.943 11.129 13.139 1.00 1.00 C ATOM 1218 O VAL A 76 -6.892 10.562 12.843 1.00 1.00 O ATOM 1219 CB VAL A 76 -9.547 10.526 11.325 1.00 1.00 C ATOM 1220 CG1 VAL A 76 -10.508 9.801 12.258 1.00 1.00 C ATOM 1221 CG2 VAL A 76 -10.280 11.038 10.098 1.00 1.00 C ATOM 0 H VAL A 76 -7.292 12.030 10.707 1.00 1.00 H new ATOM 0 HA VAL A 76 -9.615 12.336 12.497 1.00 1.00 H new ATOM 0 HB VAL A 76 -8.785 9.814 11.008 1.00 1.00 H new ATOM 0 HG11 VAL A 76 -10.986 8.981 11.722 1.00 1.00 H new ATOM 0 HG12 VAL A 76 -9.957 9.405 13.111 1.00 1.00 H new ATOM 0 HG13 VAL A 76 -11.269 10.498 12.609 1.00 1.00 H new ATOM 0 HG21 VAL A 76 -10.767 10.205 9.591 1.00 1.00 H new ATOM 0 HG22 VAL A 76 -11.031 11.768 10.401 1.00 1.00 H new ATOM 0 HG23 VAL A 76 -9.569 11.509 9.420 1.00 1.00 H new ATOM 1231 N HIS A 77 -8.344 11.278 14.395 1.00 1.00 N ATOM 1232 CA HIS A 77 -7.542 10.774 15.504 1.00 1.00 C ATOM 1233 C HIS A 77 -8.103 9.480 16.086 1.00 1.00 C ATOM 1234 O HIS A 77 -7.428 8.830 16.888 1.00 1.00 O ATOM 1235 CB HIS A 77 -7.434 11.829 16.603 1.00 1.00 C ATOM 1236 CG HIS A 77 -8.765 12.277 17.135 1.00 1.00 C ATOM 1237 ND1 HIS A 77 -9.629 13.078 16.420 1.00 1.00 N ATOM 1238 CD2 HIS A 77 -9.375 12.029 18.318 1.00 1.00 C ATOM 1239 CE1 HIS A 77 -10.713 13.304 17.139 1.00 1.00 C ATOM 1240 NE2 HIS A 77 -10.585 12.678 18.295 1.00 1.00 N ATOM 0 H HIS A 77 -9.211 11.739 14.671 1.00 1.00 H new ATOM 0 HA HIS A 77 -6.552 10.554 15.106 1.00 1.00 H new ATOM 0 HB2 HIS A 77 -6.840 11.428 17.424 1.00 1.00 H new ATOM 0 HB3 HIS A 77 -6.897 12.694 16.214 1.00 1.00 H new ATOM 0 HD2 HIS A 77 -8.983 11.432 19.128 1.00 1.00 H new ATOM 0 HE1 HIS A 77 -11.561 13.900 16.834 1.00 1.00 H new ATOM 0 HE2 HIS A 77 -11.273 12.677 19.048 1.00 1.00 H new ATOM 1249 N ASP A 78 -9.321 9.118 15.708 1.00 1.00 N ATOM 1250 CA ASP A 78 -9.932 7.902 16.239 1.00 1.00 C ATOM 1251 C ASP A 78 -9.819 6.734 15.268 1.00 1.00 C ATOM 1252 O ASP A 78 -10.503 6.680 14.253 1.00 1.00 O ATOM 1253 CB ASP A 78 -11.391 8.156 16.588 1.00 1.00 C ATOM 1254 CG ASP A 78 -11.939 7.136 17.568 1.00 1.00 C ATOM 1255 OD1 ASP A 78 -11.142 6.385 18.168 1.00 1.00 O ATOM 1256 OD2 ASP A 78 -13.175 7.098 17.739 1.00 1.00 O ATOM 0 H ASP A 78 -9.899 9.637 15.047 1.00 1.00 H new ATOM 0 HA ASP A 78 -9.386 7.630 17.142 1.00 1.00 H new ATOM 0 HB2 ASP A 78 -11.491 9.154 17.014 1.00 1.00 H new ATOM 0 HB3 ASP A 78 -11.988 8.137 15.676 1.00 1.00 H new ATOM 1261 N VAL A 79 -8.958 5.779 15.617 1.00 1.00 N ATOM 1262 CA VAL A 79 -8.766 4.574 14.809 1.00 1.00 C ATOM 1263 C VAL A 79 -10.045 3.745 14.745 1.00 1.00 C ATOM 1264 O VAL A 79 -10.413 3.225 13.686 1.00 1.00 O ATOM 1265 CB VAL A 79 -7.603 3.696 15.338 1.00 1.00 C ATOM 1266 CG1 VAL A 79 -7.763 3.393 16.821 1.00 1.00 C ATOM 1267 CG2 VAL A 79 -7.519 2.415 14.528 1.00 1.00 C ATOM 0 H VAL A 79 -8.380 5.816 16.457 1.00 1.00 H new ATOM 0 HA VAL A 79 -8.507 4.912 13.805 1.00 1.00 H new ATOM 0 HB VAL A 79 -6.672 4.251 15.222 1.00 1.00 H new ATOM 0 HG11 VAL A 79 -6.930 2.776 17.158 1.00 1.00 H new ATOM 0 HG12 VAL A 79 -7.774 4.326 17.384 1.00 1.00 H new ATOM 0 HG13 VAL A 79 -8.699 2.860 16.984 1.00 1.00 H new ATOM 0 HG21 VAL A 79 -6.700 1.801 14.903 1.00 1.00 H new ATOM 0 HG22 VAL A 79 -8.456 1.865 14.618 1.00 1.00 H new ATOM 0 HG23 VAL A 79 -7.340 2.658 13.481 1.00 1.00 H new ATOM 1277 N ALA A 80 -10.709 3.613 15.889 1.00 1.00 N ATOM 1278 CA ALA A 80 -11.943 2.837 15.988 1.00 1.00 C ATOM 1279 C ALA A 80 -13.065 3.439 15.143 1.00 1.00 C ATOM 1280 O ALA A 80 -13.847 2.710 14.542 1.00 1.00 O ATOM 1281 CB ALA A 80 -12.373 2.737 17.445 1.00 1.00 C ATOM 0 H ALA A 80 -10.411 4.037 16.768 1.00 1.00 H new ATOM 0 HA ALA A 80 -11.743 1.839 15.597 1.00 1.00 H new ATOM 0 HB1 ALA A 80 -13.294 2.157 17.514 1.00 1.00 H new ATOM 0 HB2 ALA A 80 -11.590 2.245 18.022 1.00 1.00 H new ATOM 0 HB3 ALA A 80 -12.543 3.737 17.844 1.00 1.00 H new ATOM 1287 N ALA A 81 -13.132 4.759 15.097 1.00 1.00 N ATOM 1288 CA ALA A 81 -14.164 5.425 14.315 1.00 1.00 C ATOM 1289 C ALA A 81 -14.016 5.086 12.840 1.00 1.00 C ATOM 1290 O ALA A 81 -15.006 4.887 12.133 1.00 1.00 O ATOM 1291 CB ALA A 81 -14.102 6.936 14.509 1.00 1.00 C ATOM 0 H ALA A 81 -12.493 5.386 15.585 1.00 1.00 H new ATOM 0 HA ALA A 81 -15.133 5.069 14.665 1.00 1.00 H new ATOM 0 HB1 ALA A 81 -14.882 7.411 13.915 1.00 1.00 H new ATOM 0 HB2 ALA A 81 -14.252 7.174 15.562 1.00 1.00 H new ATOM 0 HB3 ALA A 81 -13.127 7.304 14.189 1.00 1.00 H new ATOM 1297 N VAL A 82 -12.780 4.997 12.375 1.00 1.00 N ATOM 1298 CA VAL A 82 -12.524 4.651 10.980 1.00 1.00 C ATOM 1299 C VAL A 82 -13.053 3.255 10.662 1.00 1.00 C ATOM 1300 O VAL A 82 -13.668 3.035 9.622 1.00 1.00 O ATOM 1301 CB VAL A 82 -11.023 4.693 10.655 1.00 1.00 C ATOM 1302 CG1 VAL A 82 -10.766 4.249 9.213 1.00 1.00 C ATOM 1303 CG2 VAL A 82 -10.485 6.098 10.899 1.00 1.00 C ATOM 0 H VAL A 82 -11.943 5.157 12.935 1.00 1.00 H new ATOM 0 HA VAL A 82 -13.042 5.391 10.370 1.00 1.00 H new ATOM 0 HB VAL A 82 -10.499 3.998 11.311 1.00 1.00 H new ATOM 0 HG11 VAL A 82 -9.697 4.287 9.006 1.00 1.00 H new ATOM 0 HG12 VAL A 82 -11.126 3.229 9.077 1.00 1.00 H new ATOM 0 HG13 VAL A 82 -11.292 4.914 8.528 1.00 1.00 H new ATOM 0 HG21 VAL A 82 -9.420 6.125 10.668 1.00 1.00 H new ATOM 0 HG22 VAL A 82 -11.013 6.806 10.260 1.00 1.00 H new ATOM 0 HG23 VAL A 82 -10.636 6.369 11.944 1.00 1.00 H new ATOM 1313 N PHE A 83 -12.809 2.310 11.581 1.00 1.00 N ATOM 1314 CA PHE A 83 -13.260 0.936 11.418 1.00 1.00 C ATOM 1315 C PHE A 83 -14.778 0.878 11.319 1.00 1.00 C ATOM 1316 O PHE A 83 -15.329 0.186 10.465 1.00 1.00 O ATOM 1317 CB PHE A 83 -12.784 0.071 12.586 1.00 1.00 C ATOM 1318 CG PHE A 83 -13.213 -1.356 12.499 1.00 1.00 C ATOM 1319 CD1 PHE A 83 -13.520 -1.927 11.273 1.00 1.00 C ATOM 1320 CD2 PHE A 83 -13.317 -2.134 13.642 1.00 1.00 C ATOM 1321 CE1 PHE A 83 -13.919 -3.247 11.189 1.00 1.00 C ATOM 1322 CE2 PHE A 83 -13.717 -3.454 13.564 1.00 1.00 C ATOM 1323 CZ PHE A 83 -14.019 -4.011 12.336 1.00 1.00 C ATOM 0 H PHE A 83 -12.298 2.482 12.447 1.00 1.00 H new ATOM 0 HA PHE A 83 -12.831 0.548 10.494 1.00 1.00 H new ATOM 0 HB2 PHE A 83 -11.696 0.110 12.634 1.00 1.00 H new ATOM 0 HB3 PHE A 83 -13.160 0.497 13.517 1.00 1.00 H new ATOM 0 HD1 PHE A 83 -13.446 -1.333 10.374 1.00 1.00 H new ATOM 0 HD2 PHE A 83 -13.083 -1.703 14.604 1.00 1.00 H new ATOM 0 HE1 PHE A 83 -14.152 -3.681 10.228 1.00 1.00 H new ATOM 0 HE2 PHE A 83 -13.794 -4.050 14.462 1.00 1.00 H new ATOM 0 HZ PHE A 83 -14.333 -5.042 12.273 1.00 1.00 H new ATOM 1333 N ALA A 84 -15.446 1.604 12.212 1.00 1.00 N ATOM 1334 CA ALA A 84 -16.911 1.636 12.235 1.00 1.00 C ATOM 1335 C ALA A 84 -17.490 2.235 10.959 1.00 1.00 C ATOM 1336 O ALA A 84 -18.517 1.772 10.473 1.00 1.00 O ATOM 1337 CB ALA A 84 -17.389 2.434 13.430 1.00 1.00 C ATOM 0 H ALA A 84 -15.000 2.177 12.928 1.00 1.00 H new ATOM 0 HA ALA A 84 -17.260 0.606 12.308 1.00 1.00 H new ATOM 0 HB1 ALA A 84 -18.479 2.454 13.442 1.00 1.00 H new ATOM 0 HB2 ALA A 84 -17.025 1.970 14.347 1.00 1.00 H new ATOM 0 HB3 ALA A 84 -17.008 3.453 13.363 1.00 1.00 H new ATOM 1343 N TYR A 85 -16.827 3.263 10.426 1.00 1.00 N ATOM 1344 CA TYR A 85 -17.295 3.919 9.207 1.00 1.00 C ATOM 1345 C TYR A 85 -17.335 2.930 8.032 1.00 1.00 C ATOM 1346 O TYR A 85 -18.343 2.854 7.317 1.00 1.00 O ATOM 1347 CB TYR A 85 -16.406 5.113 8.868 1.00 1.00 C ATOM 1348 CG TYR A 85 -16.811 6.375 9.597 1.00 1.00 C ATOM 1349 CD1 TYR A 85 -18.083 6.911 9.435 1.00 1.00 C ATOM 1350 CD2 TYR A 85 -15.928 7.027 10.447 1.00 1.00 C ATOM 1351 CE1 TYR A 85 -18.462 8.062 10.100 1.00 1.00 C ATOM 1352 CE2 TYR A 85 -16.300 8.178 11.116 1.00 1.00 C ATOM 1353 CZ TYR A 85 -17.567 8.692 10.939 1.00 1.00 C ATOM 1354 OH TYR A 85 -17.941 9.843 11.614 1.00 1.00 O ATOM 0 H TYR A 85 -15.971 3.656 10.817 1.00 1.00 H new ATOM 0 HA TYR A 85 -18.309 4.278 9.384 1.00 1.00 H new ATOM 0 HB2 TYR A 85 -15.372 4.872 9.116 1.00 1.00 H new ATOM 0 HB3 TYR A 85 -16.442 5.293 7.794 1.00 1.00 H new ATOM 0 HD1 TYR A 85 -18.787 6.420 8.779 1.00 1.00 H new ATOM 0 HD2 TYR A 85 -14.934 6.628 10.588 1.00 1.00 H new ATOM 0 HE1 TYR A 85 -19.454 8.466 9.963 1.00 1.00 H new ATOM 0 HE2 TYR A 85 -15.601 8.672 11.774 1.00 1.00 H new ATOM 0 HH TYR A 85 -17.193 10.158 12.163 1.00 1.00 H new ATOM 1364 N ALA A 86 -16.260 2.164 7.850 1.00 1.00 N ATOM 1365 CA ALA A 86 -16.194 1.173 6.784 1.00 1.00 C ATOM 1366 C ALA A 86 -17.257 0.090 6.997 1.00 1.00 C ATOM 1367 O ALA A 86 -17.888 -0.379 6.047 1.00 1.00 O ATOM 1368 CB ALA A 86 -14.803 0.555 6.710 1.00 1.00 C ATOM 0 H ALA A 86 -15.422 2.213 8.430 1.00 1.00 H new ATOM 0 HA ALA A 86 -16.395 1.671 5.836 1.00 1.00 H new ATOM 0 HB1 ALA A 86 -14.775 -0.182 5.908 1.00 1.00 H new ATOM 0 HB2 ALA A 86 -14.068 1.335 6.512 1.00 1.00 H new ATOM 0 HB3 ALA A 86 -14.570 0.069 7.658 1.00 1.00 H new ATOM 1374 N LYS A 87 -17.467 -0.281 8.259 1.00 1.00 N ATOM 1375 CA LYS A 87 -18.460 -1.286 8.615 1.00 1.00 C ATOM 1376 C LYS A 87 -19.856 -0.813 8.238 1.00 1.00 C ATOM 1377 O LYS A 87 -20.689 -1.595 7.800 1.00 1.00 O ATOM 1378 CB LYS A 87 -18.385 -1.603 10.118 1.00 1.00 C ATOM 1379 CG LYS A 87 -19.336 -2.718 10.541 1.00 1.00 C ATOM 1380 CD LYS A 87 -19.955 -2.427 11.894 1.00 1.00 C ATOM 1381 CE LYS A 87 -18.956 -2.645 13.020 1.00 1.00 C ATOM 1382 NZ LYS A 87 -18.777 -4.089 13.313 1.00 1.00 N ATOM 0 H LYS A 87 -16.958 0.104 9.055 1.00 1.00 H new ATOM 0 HA LYS A 87 -18.245 -2.198 8.058 1.00 1.00 H new ATOM 0 HB2 LYS A 87 -17.364 -1.888 10.373 1.00 1.00 H new ATOM 0 HB3 LYS A 87 -18.616 -0.702 10.686 1.00 1.00 H new ATOM 0 HG2 LYS A 87 -20.123 -2.831 9.795 1.00 1.00 H new ATOM 0 HG3 LYS A 87 -18.796 -3.664 10.581 1.00 1.00 H new ATOM 0 HD2 LYS A 87 -20.314 -1.398 11.918 1.00 1.00 H new ATOM 0 HD3 LYS A 87 -20.822 -3.070 12.045 1.00 1.00 H new ATOM 0 HE2 LYS A 87 -17.996 -2.206 12.747 1.00 1.00 H new ATOM 0 HE3 LYS A 87 -19.299 -2.130 13.917 1.00 1.00 H new ATOM 0 HZ1 LYS A 87 -18.184 -4.200 14.160 1.00 1.00 H new ATOM 0 HZ2 LYS A 87 -19.705 -4.527 13.481 1.00 1.00 H new ATOM 0 HZ3 LYS A 87 -18.317 -4.553 12.504 1.00 1.00 H new ATOM 1396 N GLN A 88 -20.106 0.479 8.438 1.00 1.00 N ATOM 1397 CA GLN A 88 -21.416 1.044 8.125 1.00 1.00 C ATOM 1398 C GLN A 88 -21.691 0.936 6.629 1.00 1.00 C ATOM 1399 O GLN A 88 -22.814 0.631 6.208 1.00 1.00 O ATOM 1400 CB GLN A 88 -21.490 2.497 8.578 1.00 1.00 C ATOM 1401 CG GLN A 88 -21.611 2.670 10.080 1.00 1.00 C ATOM 1402 CD GLN A 88 -22.796 1.919 10.649 1.00 1.00 C ATOM 1403 OE1 GLN A 88 -23.945 2.331 10.492 1.00 1.00 O ATOM 1404 NE2 GLN A 88 -22.520 0.809 11.324 1.00 1.00 N ATOM 0 H GLN A 88 -19.430 1.146 8.810 1.00 1.00 H new ATOM 0 HA GLN A 88 -22.178 0.478 8.661 1.00 1.00 H new ATOM 0 HB2 GLN A 88 -20.598 3.020 8.233 1.00 1.00 H new ATOM 0 HB3 GLN A 88 -22.345 2.973 8.098 1.00 1.00 H new ATOM 0 HG2 GLN A 88 -20.697 2.319 10.559 1.00 1.00 H new ATOM 0 HG3 GLN A 88 -21.708 3.730 10.315 1.00 1.00 H new ATOM 0 HE21 GLN A 88 -21.553 0.504 11.430 1.00 1.00 H new ATOM 0 HE22 GLN A 88 -23.276 0.262 11.736 1.00 1.00 H new ATOM 1413 N HIS A 89 -20.652 1.171 5.821 1.00 1.00 N ATOM 1414 CA HIS A 89 -20.776 1.088 4.371 1.00 1.00 C ATOM 1415 C HIS A 89 -19.903 -0.036 3.813 1.00 1.00 C ATOM 1416 O HIS A 89 -18.764 0.181 3.421 1.00 1.00 O ATOM 1417 CB HIS A 89 -20.402 2.411 3.714 1.00 1.00 C ATOM 1418 CG HIS A 89 -19.979 3.467 4.679 1.00 1.00 C ATOM 1419 ND1 HIS A 89 -18.746 4.082 4.620 1.00 1.00 N ATOM 1420 CD2 HIS A 89 -20.625 4.023 5.731 1.00 1.00 C ATOM 1421 CE1 HIS A 89 -18.652 4.969 5.595 1.00 1.00 C ATOM 1422 NE2 HIS A 89 -19.779 4.953 6.283 1.00 1.00 N ATOM 0 H HIS A 89 -19.719 1.419 6.151 1.00 1.00 H new ATOM 0 HA HIS A 89 -21.819 0.868 4.141 1.00 1.00 H new ATOM 0 HB2 HIS A 89 -19.594 2.237 3.004 1.00 1.00 H new ATOM 0 HB3 HIS A 89 -21.256 2.776 3.143 1.00 1.00 H new ATOM 0 HD2 HIS A 89 -21.620 3.780 6.072 1.00 1.00 H new ATOM 0 HE1 HIS A 89 -17.799 5.600 5.795 1.00 1.00 H new ATOM 0 HE2 HIS A 89 -19.987 5.537 7.093 1.00 1.00 H new ATOM 1431 N PRO A 90 -20.458 -1.263 3.766 1.00 1.00 N ATOM 1432 CA PRO A 90 -19.740 -2.435 3.254 1.00 1.00 C ATOM 1433 C PRO A 90 -19.275 -2.239 1.813 1.00 1.00 C ATOM 1434 O PRO A 90 -18.223 -2.742 1.411 1.00 1.00 O ATOM 1435 CB PRO A 90 -20.775 -3.567 3.323 1.00 1.00 C ATOM 1436 CG PRO A 90 -21.814 -3.089 4.283 1.00 1.00 C ATOM 1437 CD PRO A 90 -21.822 -1.594 4.208 1.00 1.00 C ATOM 0 HA PRO A 90 -18.837 -2.635 3.832 1.00 1.00 H new ATOM 0 HB2 PRO A 90 -21.207 -3.766 2.342 1.00 1.00 H new ATOM 0 HB3 PRO A 90 -20.320 -4.496 3.666 1.00 1.00 H new ATOM 0 HG2 PRO A 90 -22.793 -3.494 4.025 1.00 1.00 H new ATOM 0 HG3 PRO A 90 -21.587 -3.423 5.295 1.00 1.00 H new ATOM 0 HD2 PRO A 90 -22.571 -1.232 3.504 1.00 1.00 H new ATOM 0 HD3 PRO A 90 -22.050 -1.145 5.175 1.00 1.00 H new ATOM 1445 N ASP A 91 -20.073 -1.488 1.043 1.00 1.00 N ATOM 1446 CA ASP A 91 -19.756 -1.215 -0.356 1.00 1.00 C ATOM 1447 C ASP A 91 -18.469 -0.400 -0.475 1.00 1.00 C ATOM 1448 O ASP A 91 -17.690 -0.586 -1.416 1.00 1.00 O ATOM 1449 CB ASP A 91 -20.899 -0.463 -1.031 1.00 1.00 C ATOM 1450 CG ASP A 91 -21.803 -1.384 -1.841 1.00 1.00 C ATOM 1451 OD1 ASP A 91 -21.273 -2.328 -2.463 1.00 1.00 O ATOM 1452 OD2 ASP A 91 -23.033 -1.166 -1.843 1.00 1.00 O ATOM 0 H ASP A 91 -20.940 -1.061 1.369 1.00 1.00 H new ATOM 0 HA ASP A 91 -19.614 -2.173 -0.856 1.00 1.00 H new ATOM 0 HB2 ASP A 91 -21.492 0.048 -0.272 1.00 1.00 H new ATOM 0 HB3 ASP A 91 -20.488 0.306 -1.686 1.00 1.00 H new ATOM 1457 N GLN A 92 -18.250 0.502 0.476 1.00 1.00 N ATOM 1458 CA GLN A 92 -17.054 1.334 0.481 1.00 1.00 C ATOM 1459 C GLN A 92 -15.849 0.541 0.990 1.00 1.00 C ATOM 1460 O GLN A 92 -15.933 -0.175 1.985 1.00 1.00 O ATOM 1461 CB GLN A 92 -17.280 2.574 1.340 1.00 1.00 C ATOM 1462 CG GLN A 92 -16.780 3.867 0.696 1.00 1.00 C ATOM 1463 CD GLN A 92 -17.796 4.496 -0.236 1.00 1.00 C ATOM 1464 OE1 GLN A 92 -18.188 3.903 -1.239 1.00 1.00 O ATOM 1465 NE2 GLN A 92 -18.221 5.708 0.091 1.00 1.00 N ATOM 0 H GLN A 92 -18.887 0.675 1.254 1.00 1.00 H new ATOM 0 HA GLN A 92 -16.846 1.651 -0.541 1.00 1.00 H new ATOM 0 HB2 GLN A 92 -18.345 2.671 1.549 1.00 1.00 H new ATOM 0 HB3 GLN A 92 -16.778 2.438 2.298 1.00 1.00 H new ATOM 0 HG2 GLN A 92 -16.523 4.580 1.479 1.00 1.00 H new ATOM 0 HG3 GLN A 92 -15.865 3.660 0.141 1.00 1.00 H new ATOM 0 HE21 GLN A 92 -17.868 6.162 0.933 1.00 1.00 H new ATOM 0 HE22 GLN A 92 -18.901 6.187 -0.500 1.00 1.00 H new ATOM 1474 N GLU A 93 -14.732 0.665 0.284 1.00 1.00 N ATOM 1475 CA GLU A 93 -13.511 -0.045 0.668 1.00 1.00 C ATOM 1476 C GLU A 93 -12.434 0.931 1.113 1.00 1.00 C ATOM 1477 O GLU A 93 -12.114 1.885 0.404 1.00 1.00 O ATOM 1478 CB GLU A 93 -13.008 -0.883 -0.506 1.00 1.00 C ATOM 1479 CG GLU A 93 -14.103 -1.688 -1.190 1.00 1.00 C ATOM 1480 CD GLU A 93 -14.413 -3.005 -0.470 1.00 1.00 C ATOM 1481 OE1 GLU A 93 -13.498 -3.538 0.192 1.00 1.00 O ATOM 1482 OE2 GLU A 93 -15.560 -3.489 -0.565 1.00 1.00 O ATOM 0 H GLU A 93 -14.643 1.244 -0.551 1.00 1.00 H new ATOM 0 HA GLU A 93 -13.742 -0.702 1.506 1.00 1.00 H new ATOM 0 HB2 GLU A 93 -12.541 -0.225 -1.238 1.00 1.00 H new ATOM 0 HB3 GLU A 93 -12.235 -1.564 -0.151 1.00 1.00 H new ATOM 0 HG2 GLU A 93 -15.010 -1.086 -1.243 1.00 1.00 H new ATOM 0 HG3 GLU A 93 -13.803 -1.902 -2.216 1.00 1.00 H new ATOM 1489 N LEU A 94 -11.892 0.689 2.299 1.00 1.00 N ATOM 1490 CA LEU A 94 -10.852 1.551 2.858 1.00 1.00 C ATOM 1491 C LEU A 94 -9.478 0.889 2.827 1.00 1.00 C ATOM 1492 O LEU A 94 -9.290 -0.205 3.346 1.00 1.00 O ATOM 1493 CB LEU A 94 -11.205 1.925 4.296 1.00 1.00 C ATOM 1494 CG LEU A 94 -10.627 3.263 4.774 1.00 1.00 C ATOM 1495 CD1 LEU A 94 -11.375 4.436 4.143 1.00 1.00 C ATOM 1496 CD2 LEU A 94 -10.679 3.348 6.289 1.00 1.00 C ATOM 0 H LEU A 94 -12.153 -0.097 2.895 1.00 1.00 H new ATOM 0 HA LEU A 94 -10.804 2.446 2.238 1.00 1.00 H new ATOM 0 HB2 LEU A 94 -12.290 1.959 4.391 1.00 1.00 H new ATOM 0 HB3 LEU A 94 -10.852 1.135 4.959 1.00 1.00 H new ATOM 0 HG LEU A 94 -9.585 3.319 4.458 1.00 1.00 H new ATOM 0 HD11 LEU A 94 -10.947 5.374 4.497 1.00 1.00 H new ATOM 0 HD12 LEU A 94 -11.285 4.383 3.058 1.00 1.00 H new ATOM 0 HD13 LEU A 94 -12.427 4.389 4.423 1.00 1.00 H new ATOM 0 HD21 LEU A 94 -10.266 4.303 6.614 1.00 1.00 H new ATOM 0 HD22 LEU A 94 -11.714 3.268 6.623 1.00 1.00 H new ATOM 0 HD23 LEU A 94 -10.095 2.534 6.719 1.00 1.00 H new ATOM 1508 N VAL A 95 -8.511 1.582 2.233 1.00 1.00 N ATOM 1509 CA VAL A 95 -7.136 1.088 2.151 1.00 1.00 C ATOM 1510 C VAL A 95 -6.182 2.083 2.780 1.00 1.00 C ATOM 1511 O VAL A 95 -6.243 3.272 2.474 1.00 1.00 O ATOM 1512 CB VAL A 95 -6.718 0.818 0.690 1.00 1.00 C ATOM 1513 CG1 VAL A 95 -7.176 -0.555 0.250 1.00 1.00 C ATOM 1514 CG2 VAL A 95 -7.278 1.889 -0.236 1.00 1.00 C ATOM 0 H VAL A 95 -8.654 2.494 1.798 1.00 1.00 H new ATOM 0 HA VAL A 95 -7.091 0.146 2.698 1.00 1.00 H new ATOM 0 HB VAL A 95 -5.630 0.852 0.635 1.00 1.00 H new ATOM 0 HG11 VAL A 95 -6.872 -0.726 -0.783 1.00 1.00 H new ATOM 0 HG12 VAL A 95 -6.725 -1.312 0.892 1.00 1.00 H new ATOM 0 HG13 VAL A 95 -8.262 -0.617 0.323 1.00 1.00 H new ATOM 0 HG21 VAL A 95 -6.972 1.680 -1.261 1.00 1.00 H new ATOM 0 HG22 VAL A 95 -8.366 1.890 -0.175 1.00 1.00 H new ATOM 0 HG23 VAL A 95 -6.897 2.865 0.065 1.00 1.00 H new ATOM 1524 N ILE A 96 -5.303 1.607 3.661 1.00 1.00 N ATOM 1525 CA ILE A 96 -4.355 2.506 4.305 1.00 1.00 C ATOM 1526 C ILE A 96 -2.940 2.343 3.741 1.00 1.00 C ATOM 1527 O ILE A 96 -2.300 1.322 3.934 1.00 1.00 O ATOM 1528 CB ILE A 96 -4.327 2.252 5.820 1.00 1.00 C ATOM 1529 CG1 ILE A 96 -5.640 2.686 6.461 1.00 1.00 C ATOM 1530 CG2 ILE A 96 -3.155 2.966 6.461 1.00 1.00 C ATOM 1531 CD1 ILE A 96 -6.326 1.593 7.247 1.00 1.00 C ATOM 0 H ILE A 96 -5.229 0.628 3.938 1.00 1.00 H new ATOM 0 HA ILE A 96 -4.688 3.524 4.104 1.00 1.00 H new ATOM 0 HB ILE A 96 -4.204 1.182 5.985 1.00 1.00 H new ATOM 0 HG12 ILE A 96 -5.449 3.531 7.123 1.00 1.00 H new ATOM 0 HG13 ILE A 96 -6.315 3.038 5.681 1.00 1.00 H new ATOM 0 HG21 ILE A 96 -3.154 2.773 7.534 1.00 1.00 H new ATOM 0 HG22 ILE A 96 -2.225 2.601 6.026 1.00 1.00 H new ATOM 0 HG23 ILE A 96 -3.242 4.038 6.285 1.00 1.00 H new ATOM 0 HD11 ILE A 96 -7.253 1.978 7.673 1.00 1.00 H new ATOM 0 HD12 ILE A 96 -6.550 0.756 6.586 1.00 1.00 H new ATOM 0 HD13 ILE A 96 -5.670 1.256 8.050 1.00 1.00 H new ATOM 1543 N ALA A 97 -2.459 3.367 3.069 1.00 1.00 N ATOM 1544 CA ALA A 97 -1.125 3.350 2.482 1.00 1.00 C ATOM 1545 C ALA A 97 -0.033 3.180 3.531 1.00 1.00 C ATOM 1546 O ALA A 97 1.064 2.733 3.219 1.00 1.00 O ATOM 1547 CB ALA A 97 -0.894 4.616 1.668 1.00 1.00 C ATOM 0 H ALA A 97 -2.974 4.233 2.911 1.00 1.00 H new ATOM 0 HA ALA A 97 -1.069 2.484 1.823 1.00 1.00 H new ATOM 0 HB1 ALA A 97 0.106 4.592 1.234 1.00 1.00 H new ATOM 0 HB2 ALA A 97 -1.634 4.676 0.870 1.00 1.00 H new ATOM 0 HB3 ALA A 97 -0.988 5.487 2.316 1.00 1.00 H new ATOM 1553 N GLY A 98 -0.325 3.588 4.758 1.00 1.00 N ATOM 1554 CA GLY A 98 0.684 3.514 5.815 1.00 1.00 C ATOM 1555 C GLY A 98 0.193 4.028 7.152 1.00 1.00 C ATOM 1556 O GLY A 98 -0.982 4.374 7.291 1.00 1.00 O ATOM 0 H GLY A 98 -1.228 3.965 5.046 1.00 1.00 H new ATOM 0 HA2 GLY A 98 1.006 2.479 5.928 1.00 1.00 H new ATOM 0 HA3 GLY A 98 1.559 4.089 5.512 1.00 1.00 H new ATOM 1560 N GLY A 99 1.082 4.105 8.163 1.00 1.00 N ATOM 1561 CA GLY A 99 2.484 3.705 8.011 1.00 1.00 C ATOM 1562 C GLY A 99 2.735 2.240 8.344 1.00 1.00 C ATOM 1563 O GLY A 99 1.813 1.503 8.660 1.00 1.00 O ATOM 0 H GLY A 99 0.846 4.443 9.096 1.00 1.00 H new ATOM 0 HA2 GLY A 99 2.799 3.896 6.985 1.00 1.00 H new ATOM 0 HA3 GLY A 99 3.104 4.328 8.656 1.00 1.00 H new ATOM 1567 N ALA A 100 3.995 1.826 8.267 1.00 1.00 N ATOM 1568 CA ALA A 100 4.372 0.434 8.543 1.00 1.00 C ATOM 1569 C ALA A 100 4.067 0.072 9.994 1.00 1.00 C ATOM 1570 O ALA A 100 3.625 -1.040 10.285 1.00 1.00 O ATOM 1571 CB ALA A 100 5.853 0.212 8.251 1.00 1.00 C ATOM 0 H ALA A 100 4.777 2.431 8.016 1.00 1.00 H new ATOM 0 HA ALA A 100 3.785 -0.212 7.890 1.00 1.00 H new ATOM 0 HB1 ALA A 100 6.114 -0.825 8.461 1.00 1.00 H new ATOM 0 HB2 ALA A 100 6.054 0.431 7.202 1.00 1.00 H new ATOM 0 HB3 ALA A 100 6.451 0.871 8.880 1.00 1.00 H new ATOM 1577 N GLN A 101 4.289 1.017 10.902 1.00 1.00 N ATOM 1578 CA GLN A 101 4.003 0.801 12.313 1.00 1.00 C ATOM 1579 C GLN A 101 2.512 0.569 12.492 1.00 1.00 C ATOM 1580 O GLN A 101 2.074 -0.286 13.270 1.00 1.00 O ATOM 1581 CB GLN A 101 4.451 2.011 13.129 1.00 1.00 C ATOM 1582 CG GLN A 101 5.698 1.761 13.984 1.00 1.00 C ATOM 1583 CD GLN A 101 5.751 2.644 15.222 1.00 1.00 C ATOM 1584 OE1 GLN A 101 6.048 2.174 16.320 1.00 1.00 O ATOM 1585 NE2 GLN A 101 5.454 3.928 15.051 1.00 1.00 N ATOM 0 H GLN A 101 4.666 1.939 10.684 1.00 1.00 H new ATOM 0 HA GLN A 101 4.549 -0.074 12.665 1.00 1.00 H new ATOM 0 HB2 GLN A 101 4.649 2.841 12.450 1.00 1.00 H new ATOM 0 HB3 GLN A 101 3.633 2.320 13.780 1.00 1.00 H new ATOM 0 HG2 GLN A 101 5.720 0.715 14.288 1.00 1.00 H new ATOM 0 HG3 GLN A 101 6.588 1.936 13.380 1.00 1.00 H new ATOM 0 HE21 GLN A 101 5.213 4.277 14.123 1.00 1.00 H new ATOM 0 HE22 GLN A 101 5.467 4.565 15.848 1.00 1.00 H new ATOM 1594 N ILE A 102 1.736 1.324 11.731 1.00 1.00 N ATOM 1595 CA ILE A 102 0.296 1.205 11.735 1.00 1.00 C ATOM 1596 C ILE A 102 -0.107 -0.171 11.197 1.00 1.00 C ATOM 1597 O ILE A 102 -1.022 -0.810 11.718 1.00 1.00 O ATOM 1598 CB ILE A 102 -0.364 2.314 10.895 1.00 1.00 C ATOM 1599 CG1 ILE A 102 0.039 3.703 11.426 1.00 1.00 C ATOM 1600 CG2 ILE A 102 -1.876 2.155 10.886 1.00 1.00 C ATOM 1601 CD1 ILE A 102 -0.027 3.817 12.934 1.00 1.00 C ATOM 0 H ILE A 102 2.092 2.036 11.094 1.00 1.00 H new ATOM 0 HA ILE A 102 -0.052 1.315 12.762 1.00 1.00 H new ATOM 0 HB ILE A 102 -0.010 2.225 9.868 1.00 1.00 H new ATOM 0 HG12 ILE A 102 1.053 3.928 11.097 1.00 1.00 H new ATOM 0 HG13 ILE A 102 -0.614 4.455 10.984 1.00 1.00 H new ATOM 0 HG21 ILE A 102 -2.322 2.949 10.287 1.00 1.00 H new ATOM 0 HG22 ILE A 102 -2.138 1.187 10.458 1.00 1.00 H new ATOM 0 HG23 ILE A 102 -2.254 2.215 11.907 1.00 1.00 H new ATOM 0 HD11 ILE A 102 0.270 4.821 13.236 1.00 1.00 H new ATOM 0 HD12 ILE A 102 -1.046 3.623 13.269 1.00 1.00 H new ATOM 0 HD13 ILE A 102 0.647 3.088 13.384 1.00 1.00 H new ATOM 1613 N PHE A 103 0.559 -0.600 10.129 1.00 1.00 N ATOM 1614 CA PHE A 103 0.263 -1.875 9.483 1.00 1.00 C ATOM 1615 C PHE A 103 0.458 -3.073 10.416 1.00 1.00 C ATOM 1616 O PHE A 103 -0.381 -3.961 10.485 1.00 1.00 O ATOM 1617 CB PHE A 103 1.180 -2.072 8.273 1.00 1.00 C ATOM 1618 CG PHE A 103 0.675 -1.474 6.997 1.00 1.00 C ATOM 1619 CD1 PHE A 103 0.153 -0.192 6.965 1.00 1.00 C ATOM 1620 CD2 PHE A 103 0.737 -2.200 5.819 1.00 1.00 C ATOM 1621 CE1 PHE A 103 -0.300 0.356 5.779 1.00 1.00 C ATOM 1622 CE2 PHE A 103 0.286 -1.658 4.632 1.00 1.00 C ATOM 1623 CZ PHE A 103 -0.232 -0.378 4.611 1.00 1.00 C ATOM 0 H PHE A 103 1.316 -0.077 9.689 1.00 1.00 H new ATOM 0 HA PHE A 103 -0.785 -1.832 9.188 1.00 1.00 H new ATOM 0 HB2 PHE A 103 2.155 -1.639 8.499 1.00 1.00 H new ATOM 0 HB3 PHE A 103 1.333 -3.140 8.121 1.00 1.00 H new ATOM 0 HD1 PHE A 103 0.099 0.386 7.876 1.00 1.00 H new ATOM 0 HD2 PHE A 103 1.143 -3.201 5.829 1.00 1.00 H new ATOM 0 HE1 PHE A 103 -0.706 1.357 5.766 1.00 1.00 H new ATOM 0 HE2 PHE A 103 0.338 -2.235 3.720 1.00 1.00 H new ATOM 0 HZ PHE A 103 -0.583 0.048 3.683 1.00 1.00 H new ATOM 1633 N THR A 104 1.577 -3.099 11.117 1.00 1.00 N ATOM 1634 CA THR A 104 1.864 -4.208 12.008 1.00 1.00 C ATOM 1635 C THR A 104 0.838 -4.313 13.124 1.00 1.00 C ATOM 1636 O THR A 104 0.351 -5.412 13.431 1.00 1.00 O ATOM 1637 CB THR A 104 3.272 -4.078 12.607 1.00 1.00 C ATOM 1638 OG1 THR A 104 3.510 -5.076 13.586 1.00 1.00 O ATOM 1639 CG2 THR A 104 3.525 -2.744 13.266 1.00 1.00 C ATOM 0 H THR A 104 2.294 -2.374 11.088 1.00 1.00 H new ATOM 0 HA THR A 104 1.813 -5.119 11.412 1.00 1.00 H new ATOM 0 HB THR A 104 3.944 -4.188 11.756 1.00 1.00 H new ATOM 0 HG1 THR A 104 4.414 -4.969 13.949 1.00 1.00 H new ATOM 0 HG21 THR A 104 4.538 -2.723 13.667 1.00 1.00 H new ATOM 0 HG22 THR A 104 3.408 -1.947 12.531 1.00 1.00 H new ATOM 0 HG23 THR A 104 2.811 -2.597 14.077 1.00 1.00 H new ATOM 1647 N ALA A 105 0.517 -3.179 13.739 1.00 1.00 N ATOM 1648 CA ALA A 105 -0.444 -3.142 14.837 1.00 1.00 C ATOM 1649 C ALA A 105 -1.832 -3.567 14.383 1.00 1.00 C ATOM 1650 O ALA A 105 -2.570 -4.223 15.115 1.00 1.00 O ATOM 1651 CB ALA A 105 -0.489 -1.766 15.475 1.00 1.00 C ATOM 0 H ALA A 105 0.910 -2.270 13.495 1.00 1.00 H new ATOM 0 HA ALA A 105 -0.106 -3.858 15.586 1.00 1.00 H new ATOM 0 HB1 ALA A 105 -1.213 -1.766 16.290 1.00 1.00 H new ATOM 0 HB2 ALA A 105 0.497 -1.514 15.865 1.00 1.00 H new ATOM 0 HB3 ALA A 105 -0.783 -1.028 14.729 1.00 1.00 H new ATOM 1657 N PHE A 106 -2.197 -3.150 13.175 1.00 1.00 N ATOM 1658 CA PHE A 106 -3.508 -3.464 12.612 1.00 1.00 C ATOM 1659 C PHE A 106 -3.424 -4.538 11.522 1.00 1.00 C ATOM 1660 O PHE A 106 -4.314 -4.649 10.685 1.00 1.00 O ATOM 1661 CB PHE A 106 -4.161 -2.185 12.065 1.00 1.00 C ATOM 1662 CG PHE A 106 -4.176 -1.038 13.037 1.00 1.00 C ATOM 1663 CD1 PHE A 106 -4.054 -1.265 14.396 1.00 1.00 C ATOM 1664 CD2 PHE A 106 -4.305 0.266 12.586 1.00 1.00 C ATOM 1665 CE1 PHE A 106 -4.060 -0.213 15.292 1.00 1.00 C ATOM 1666 CE2 PHE A 106 -4.313 1.323 13.478 1.00 1.00 C ATOM 1667 CZ PHE A 106 -4.189 1.083 14.833 1.00 1.00 C ATOM 0 H PHE A 106 -1.601 -2.591 12.564 1.00 1.00 H new ATOM 0 HA PHE A 106 -4.127 -3.871 13.412 1.00 1.00 H new ATOM 0 HB2 PHE A 106 -3.631 -1.876 11.164 1.00 1.00 H new ATOM 0 HB3 PHE A 106 -5.186 -2.411 11.770 1.00 1.00 H new ATOM 0 HD1 PHE A 106 -3.953 -2.276 14.761 1.00 1.00 H new ATOM 0 HD2 PHE A 106 -4.400 0.459 11.528 1.00 1.00 H new ATOM 0 HE1 PHE A 106 -3.964 -0.404 16.351 1.00 1.00 H new ATOM 0 HE2 PHE A 106 -4.416 2.335 13.116 1.00 1.00 H new ATOM 0 HZ PHE A 106 -4.193 1.907 15.531 1.00 1.00 H new ATOM 1677 N LYS A 107 -2.332 -5.312 11.516 1.00 1.00 N ATOM 1678 CA LYS A 107 -2.136 -6.360 10.507 1.00 1.00 C ATOM 1679 C LYS A 107 -3.241 -7.410 10.592 1.00 1.00 C ATOM 1680 O LYS A 107 -3.774 -7.843 9.568 1.00 1.00 O ATOM 1681 CB LYS A 107 -0.762 -7.018 10.681 1.00 1.00 C ATOM 1682 CG LYS A 107 -0.826 -8.533 10.919 1.00 1.00 C ATOM 1683 CD LYS A 107 0.559 -9.120 11.140 1.00 1.00 C ATOM 1684 CE LYS A 107 1.415 -8.959 9.894 1.00 1.00 C ATOM 1685 NZ LYS A 107 2.737 -9.622 10.010 1.00 1.00 N ATOM 0 H LYS A 107 -1.574 -5.233 12.194 1.00 1.00 H new ATOM 0 HA LYS A 107 -2.181 -5.896 9.522 1.00 1.00 H new ATOM 0 HB2 LYS A 107 -0.162 -6.824 9.792 1.00 1.00 H new ATOM 0 HB3 LYS A 107 -0.249 -6.549 11.521 1.00 1.00 H new ATOM 0 HG2 LYS A 107 -1.453 -8.740 11.786 1.00 1.00 H new ATOM 0 HG3 LYS A 107 -1.296 -9.018 10.063 1.00 1.00 H new ATOM 0 HD2 LYS A 107 1.039 -8.625 11.984 1.00 1.00 H new ATOM 0 HD3 LYS A 107 0.475 -10.176 11.396 1.00 1.00 H new ATOM 0 HE2 LYS A 107 0.882 -9.371 9.038 1.00 1.00 H new ATOM 0 HE3 LYS A 107 1.563 -7.897 9.696 1.00 1.00 H new ATOM 0 HZ1 LYS A 107 3.276 -9.479 9.132 1.00 1.00 H new ATOM 0 HZ2 LYS A 107 3.262 -9.212 10.809 1.00 1.00 H new ATOM 0 HZ3 LYS A 107 2.602 -10.641 10.171 1.00 1.00 H new ATOM 1699 N ASP A 108 -3.580 -7.800 11.811 1.00 1.00 N ATOM 1700 CA ASP A 108 -4.630 -8.784 12.043 1.00 1.00 C ATOM 1701 C ASP A 108 -6.027 -8.152 11.973 1.00 1.00 C ATOM 1702 O ASP A 108 -7.037 -8.849 12.078 1.00 1.00 O ATOM 1703 CB ASP A 108 -4.433 -9.455 13.405 1.00 1.00 C ATOM 1704 CG ASP A 108 -5.235 -10.733 13.549 1.00 1.00 C ATOM 1705 OD1 ASP A 108 -4.822 -11.764 12.975 1.00 1.00 O ATOM 1706 OD2 ASP A 108 -6.270 -10.706 14.248 1.00 1.00 O ATOM 0 H ASP A 108 -3.141 -7.448 12.662 1.00 1.00 H new ATOM 0 HA ASP A 108 -4.560 -9.532 11.253 1.00 1.00 H new ATOM 0 HB2 ASP A 108 -3.375 -9.677 13.547 1.00 1.00 H new ATOM 0 HB3 ASP A 108 -4.721 -8.759 14.193 1.00 1.00 H new ATOM 1711 N ASP A 109 -6.085 -6.825 11.816 1.00 1.00 N ATOM 1712 CA ASP A 109 -7.364 -6.122 11.755 1.00 1.00 C ATOM 1713 C ASP A 109 -7.875 -5.993 10.306 1.00 1.00 C ATOM 1714 O ASP A 109 -8.955 -5.448 10.077 1.00 1.00 O ATOM 1715 CB ASP A 109 -7.232 -4.738 12.397 1.00 1.00 C ATOM 1716 CG ASP A 109 -6.863 -4.815 13.865 1.00 1.00 C ATOM 1717 OD1 ASP A 109 -6.977 -5.911 14.455 1.00 1.00 O ATOM 1718 OD2 ASP A 109 -6.459 -3.775 14.426 1.00 1.00 O ATOM 0 H ASP A 109 -5.266 -6.223 11.730 1.00 1.00 H new ATOM 0 HA ASP A 109 -8.095 -6.709 12.310 1.00 1.00 H new ATOM 0 HB2 ASP A 109 -6.474 -4.164 11.864 1.00 1.00 H new ATOM 0 HB3 ASP A 109 -8.173 -4.199 12.290 1.00 1.00 H new ATOM 1723 N VAL A 110 -7.110 -6.489 9.327 1.00 1.00 N ATOM 1724 CA VAL A 110 -7.524 -6.418 7.933 1.00 1.00 C ATOM 1725 C VAL A 110 -7.691 -7.807 7.336 1.00 1.00 C ATOM 1726 O VAL A 110 -6.782 -8.652 7.412 1.00 1.00 O ATOM 1727 CB VAL A 110 -6.519 -5.616 7.095 1.00 1.00 C ATOM 1728 CG1 VAL A 110 -7.097 -4.267 6.710 1.00 1.00 C ATOM 1729 CG2 VAL A 110 -5.215 -5.447 7.851 1.00 1.00 C ATOM 0 H VAL A 110 -6.208 -6.940 9.479 1.00 1.00 H new ATOM 0 HA VAL A 110 -8.487 -5.908 7.911 1.00 1.00 H new ATOM 0 HB VAL A 110 -6.315 -6.170 6.179 1.00 1.00 H new ATOM 0 HG11 VAL A 110 -6.368 -3.715 6.116 1.00 1.00 H new ATOM 0 HG12 VAL A 110 -8.005 -4.414 6.125 1.00 1.00 H new ATOM 0 HG13 VAL A 110 -7.334 -3.702 7.612 1.00 1.00 H new ATOM 0 HG21 VAL A 110 -4.513 -4.876 7.243 1.00 1.00 H new ATOM 0 HG22 VAL A 110 -5.402 -4.916 8.784 1.00 1.00 H new ATOM 0 HG23 VAL A 110 -4.792 -6.427 8.070 1.00 1.00 H new ATOM 1739 N ASP A 111 -8.852 -8.049 6.723 1.00 1.00 N ATOM 1740 CA ASP A 111 -9.131 -9.331 6.104 1.00 1.00 C ATOM 1741 C ASP A 111 -8.214 -9.606 4.916 1.00 1.00 C ATOM 1742 O ASP A 111 -7.837 -10.745 4.660 1.00 1.00 O ATOM 1743 CB ASP A 111 -10.586 -9.385 5.634 1.00 1.00 C ATOM 1744 CG ASP A 111 -11.510 -9.873 6.718 1.00 1.00 C ATOM 1745 OD1 ASP A 111 -11.188 -10.896 7.359 1.00 1.00 O ATOM 1746 OD2 ASP A 111 -12.556 -9.228 6.938 1.00 1.00 O ATOM 0 H ASP A 111 -9.609 -7.369 6.646 1.00 1.00 H new ATOM 0 HA ASP A 111 -8.950 -10.096 6.859 1.00 1.00 H new ATOM 0 HB2 ASP A 111 -10.899 -8.393 5.310 1.00 1.00 H new ATOM 0 HB3 ASP A 111 -10.663 -10.043 4.768 1.00 1.00 H new ATOM 1751 N THR A 112 -7.872 -8.551 4.164 1.00 1.00 N ATOM 1752 CA THR A 112 -7.016 -8.714 2.990 1.00 1.00 C ATOM 1753 C THR A 112 -5.746 -7.867 3.100 1.00 1.00 C ATOM 1754 O THR A 112 -5.823 -6.668 3.337 1.00 1.00 O ATOM 1755 CB THR A 112 -7.786 -8.326 1.731 1.00 1.00 C ATOM 1756 OG1 THR A 112 -6.917 -7.761 0.758 1.00 1.00 O ATOM 1757 CG2 THR A 112 -8.883 -7.314 1.988 1.00 1.00 C ATOM 0 H THR A 112 -8.171 -7.593 4.346 1.00 1.00 H new ATOM 0 HA THR A 112 -6.719 -9.761 2.933 1.00 1.00 H new ATOM 0 HB THR A 112 -8.234 -9.254 1.376 1.00 1.00 H new ATOM 0 HG1 THR A 112 -7.432 -7.521 -0.041 1.00 1.00 H new ATOM 0 HG21 THR A 112 -9.391 -7.082 1.052 1.00 1.00 H new ATOM 0 HG22 THR A 112 -9.600 -7.727 2.697 1.00 1.00 H new ATOM 0 HG23 THR A 112 -8.449 -6.403 2.401 1.00 1.00 H new ATOM 1765 N LEU A 113 -4.596 -8.497 2.904 1.00 1.00 N ATOM 1766 CA LEU A 113 -3.333 -7.778 2.954 1.00 1.00 C ATOM 1767 C LEU A 113 -2.662 -7.777 1.577 1.00 1.00 C ATOM 1768 O LEU A 113 -2.484 -8.830 0.970 1.00 1.00 O ATOM 1769 CB LEU A 113 -2.407 -8.405 3.997 1.00 1.00 C ATOM 1770 CG LEU A 113 -2.730 -8.019 5.448 1.00 1.00 C ATOM 1771 CD1 LEU A 113 -2.650 -9.237 6.354 1.00 1.00 C ATOM 1772 CD2 LEU A 113 -1.775 -6.928 5.940 1.00 1.00 C ATOM 0 H LEU A 113 -4.512 -9.495 2.711 1.00 1.00 H new ATOM 0 HA LEU A 113 -3.533 -6.746 3.241 1.00 1.00 H new ATOM 0 HB2 LEU A 113 -2.456 -9.490 3.903 1.00 1.00 H new ATOM 0 HB3 LEU A 113 -1.381 -8.112 3.776 1.00 1.00 H new ATOM 0 HG LEU A 113 -3.747 -7.629 5.479 1.00 1.00 H new ATOM 0 HD11 LEU A 113 -2.882 -8.945 7.378 1.00 1.00 H new ATOM 0 HD12 LEU A 113 -3.367 -9.987 6.020 1.00 1.00 H new ATOM 0 HD13 LEU A 113 -1.644 -9.654 6.315 1.00 1.00 H new ATOM 0 HD21 LEU A 113 -2.020 -6.668 6.970 1.00 1.00 H new ATOM 0 HD22 LEU A 113 -0.749 -7.294 5.892 1.00 1.00 H new ATOM 0 HD23 LEU A 113 -1.875 -6.045 5.309 1.00 1.00 H new ATOM 1784 N LEU A 114 -2.291 -6.588 1.090 1.00 1.00 N ATOM 1785 CA LEU A 114 -1.649 -6.491 -0.223 1.00 1.00 C ATOM 1786 C LEU A 114 -0.135 -6.272 -0.082 1.00 1.00 C ATOM 1787 O LEU A 114 0.324 -5.309 0.543 1.00 1.00 O ATOM 1788 CB LEU A 114 -2.265 -5.338 -1.029 1.00 1.00 C ATOM 1789 CG LEU A 114 -3.743 -5.503 -1.405 1.00 1.00 C ATOM 1790 CD1 LEU A 114 -4.134 -6.978 -1.434 1.00 1.00 C ATOM 1791 CD2 LEU A 114 -4.634 -4.746 -0.432 1.00 1.00 C ATOM 0 H LEU A 114 -2.421 -5.699 1.573 1.00 1.00 H new ATOM 0 HA LEU A 114 -1.815 -7.431 -0.750 1.00 1.00 H new ATOM 0 HB2 LEU A 114 -2.156 -4.419 -0.454 1.00 1.00 H new ATOM 0 HB3 LEU A 114 -1.688 -5.211 -1.945 1.00 1.00 H new ATOM 0 HG LEU A 114 -3.883 -5.087 -2.403 1.00 1.00 H new ATOM 0 HD11 LEU A 114 -5.186 -7.070 -1.703 1.00 1.00 H new ATOM 0 HD12 LEU A 114 -3.524 -7.502 -2.170 1.00 1.00 H new ATOM 0 HD13 LEU A 114 -3.971 -7.417 -0.450 1.00 1.00 H new ATOM 0 HD21 LEU A 114 -5.678 -4.877 -0.717 1.00 1.00 H new ATOM 0 HD22 LEU A 114 -4.482 -5.132 0.576 1.00 1.00 H new ATOM 0 HD23 LEU A 114 -4.381 -3.686 -0.456 1.00 1.00 H new ATOM 1803 N VAL A 115 0.636 -7.181 -0.686 1.00 1.00 N ATOM 1804 CA VAL A 115 2.090 -7.094 -0.646 1.00 1.00 C ATOM 1805 C VAL A 115 2.695 -7.012 -2.044 1.00 1.00 C ATOM 1806 O VAL A 115 2.395 -7.834 -2.909 1.00 1.00 O ATOM 1807 CB VAL A 115 2.703 -8.296 0.085 1.00 1.00 C ATOM 1808 CG1 VAL A 115 1.833 -9.536 -0.048 1.00 1.00 C ATOM 1809 CG2 VAL A 115 4.105 -8.571 -0.436 1.00 1.00 C ATOM 0 H VAL A 115 0.275 -7.981 -1.205 1.00 1.00 H new ATOM 0 HA VAL A 115 2.324 -6.178 -0.103 1.00 1.00 H new ATOM 0 HB VAL A 115 2.761 -8.047 1.145 1.00 1.00 H new ATOM 0 HG11 VAL A 115 2.299 -10.366 0.482 1.00 1.00 H new ATOM 0 HG12 VAL A 115 0.850 -9.338 0.380 1.00 1.00 H new ATOM 0 HG13 VAL A 115 1.725 -9.793 -1.102 1.00 1.00 H new ATOM 0 HG21 VAL A 115 4.528 -9.426 0.091 1.00 1.00 H new ATOM 0 HG22 VAL A 115 4.060 -8.789 -1.503 1.00 1.00 H new ATOM 0 HG23 VAL A 115 4.733 -7.696 -0.270 1.00 1.00 H new ATOM 1819 N THR A 116 3.571 -6.035 -2.254 1.00 1.00 N ATOM 1820 CA THR A 116 4.223 -5.875 -3.550 1.00 1.00 C ATOM 1821 C THR A 116 5.731 -6.053 -3.413 1.00 1.00 C ATOM 1822 O THR A 116 6.369 -5.404 -2.578 1.00 1.00 O ATOM 1823 CB THR A 116 3.903 -4.503 -4.128 1.00 1.00 C ATOM 1824 OG1 THR A 116 4.842 -3.535 -3.704 1.00 1.00 O ATOM 1825 CG2 THR A 116 2.522 -4.000 -3.738 1.00 1.00 C ATOM 0 H THR A 116 3.844 -5.348 -1.551 1.00 1.00 H new ATOM 0 HA THR A 116 3.846 -6.640 -4.229 1.00 1.00 H new ATOM 0 HB THR A 116 3.942 -4.635 -5.209 1.00 1.00 H new ATOM 0 HG1 THR A 116 4.819 -2.768 -4.314 1.00 1.00 H new ATOM 0 HG21 THR A 116 2.354 -3.018 -4.181 1.00 1.00 H new ATOM 0 HG22 THR A 116 1.765 -4.696 -4.101 1.00 1.00 H new ATOM 0 HG23 THR A 116 2.455 -3.925 -2.653 1.00 1.00 H new ATOM 1833 N ARG A 117 6.296 -6.937 -4.233 1.00 1.00 N ATOM 1834 CA ARG A 117 7.728 -7.208 -4.197 1.00 1.00 C ATOM 1835 C ARG A 117 8.439 -6.603 -5.402 1.00 1.00 C ATOM 1836 O ARG A 117 8.004 -6.768 -6.548 1.00 1.00 O ATOM 1837 CB ARG A 117 7.978 -8.721 -4.150 1.00 1.00 C ATOM 1838 CG ARG A 117 8.835 -9.158 -2.971 1.00 1.00 C ATOM 1839 CD ARG A 117 8.890 -10.672 -2.862 1.00 1.00 C ATOM 1840 NE ARG A 117 10.073 -11.133 -2.140 1.00 1.00 N ATOM 1841 CZ ARG A 117 10.295 -12.407 -1.830 1.00 1.00 C ATOM 1842 NH1 ARG A 117 9.420 -13.344 -2.175 1.00 1.00 N ATOM 1843 NH2 ARG A 117 11.395 -12.747 -1.171 1.00 1.00 N ATOM 0 H ARG A 117 5.782 -7.477 -4.930 1.00 1.00 H new ATOM 0 HA ARG A 117 8.133 -6.745 -3.297 1.00 1.00 H new ATOM 0 HB2 ARG A 117 7.020 -9.238 -4.104 1.00 1.00 H new ATOM 0 HB3 ARG A 117 8.463 -9.030 -5.076 1.00 1.00 H new ATOM 0 HG2 ARG A 117 9.844 -8.762 -3.085 1.00 1.00 H new ATOM 0 HG3 ARG A 117 8.431 -8.739 -2.049 1.00 1.00 H new ATOM 0 HD2 ARG A 117 7.995 -11.030 -2.354 1.00 1.00 H new ATOM 0 HD3 ARG A 117 8.885 -11.106 -3.862 1.00 1.00 H new ATOM 0 HE ARG A 117 10.767 -10.440 -1.858 1.00 1.00 H new ATOM 0 HH11 ARG A 117 8.572 -13.088 -2.681 1.00 1.00 H new ATOM 0 HH12 ARG A 117 9.596 -14.319 -1.934 1.00 1.00 H new ATOM 0 HH21 ARG A 117 12.070 -12.031 -0.902 1.00 1.00 H new ATOM 0 HH22 ARG A 117 11.566 -13.724 -0.933 1.00 1.00 H new ATOM 1857 N LEU A 118 9.532 -5.898 -5.138 1.00 1.00 N ATOM 1858 CA LEU A 118 10.318 -5.276 -6.195 1.00 1.00 C ATOM 1859 C LEU A 118 11.648 -5.989 -6.350 1.00 1.00 C ATOM 1860 O LEU A 118 12.363 -6.175 -5.371 1.00 1.00 O ATOM 1861 CB LEU A 118 10.553 -3.791 -5.882 1.00 1.00 C ATOM 1862 CG LEU A 118 9.291 -2.972 -5.615 1.00 1.00 C ATOM 1863 CD1 LEU A 118 9.546 -1.496 -5.862 1.00 1.00 C ATOM 1864 CD2 LEU A 118 8.151 -3.468 -6.492 1.00 1.00 C ATOM 0 H LEU A 118 9.895 -5.743 -4.197 1.00 1.00 H new ATOM 0 HA LEU A 118 9.764 -5.355 -7.130 1.00 1.00 H new ATOM 0 HB2 LEU A 118 11.204 -3.719 -5.011 1.00 1.00 H new ATOM 0 HB3 LEU A 118 11.088 -3.341 -6.718 1.00 1.00 H new ATOM 0 HG LEU A 118 9.011 -3.098 -4.569 1.00 1.00 H new ATOM 0 HD11 LEU A 118 8.634 -0.931 -5.666 1.00 1.00 H new ATOM 0 HD12 LEU A 118 10.338 -1.148 -5.199 1.00 1.00 H new ATOM 0 HD13 LEU A 118 9.849 -1.348 -6.899 1.00 1.00 H new ATOM 0 HD21 LEU A 118 7.256 -2.878 -6.294 1.00 1.00 H new ATOM 0 HD22 LEU A 118 8.428 -3.366 -7.541 1.00 1.00 H new ATOM 0 HD23 LEU A 118 7.951 -4.516 -6.270 1.00 1.00 H new ATOM 1876 N ALA A 119 11.977 -6.386 -7.575 1.00 1.00 N ATOM 1877 CA ALA A 119 13.238 -7.081 -7.814 1.00 1.00 C ATOM 1878 C ALA A 119 14.407 -6.174 -7.474 1.00 1.00 C ATOM 1879 O ALA A 119 15.414 -6.612 -6.897 1.00 1.00 O ATOM 1880 CB ALA A 119 13.326 -7.558 -9.256 1.00 1.00 C ATOM 0 H ALA A 119 11.401 -6.242 -8.404 1.00 1.00 H new ATOM 0 HA ALA A 119 13.280 -7.958 -7.168 1.00 1.00 H new ATOM 0 HB1 ALA A 119 14.274 -8.073 -9.412 1.00 1.00 H new ATOM 0 HB2 ALA A 119 12.503 -8.242 -9.464 1.00 1.00 H new ATOM 0 HB3 ALA A 119 13.264 -6.701 -9.927 1.00 1.00 H new ATOM 1886 N GLY A 120 14.267 -4.894 -7.804 1.00 1.00 N ATOM 1887 CA GLY A 120 15.310 -3.938 -7.490 1.00 1.00 C ATOM 1888 C GLY A 120 15.404 -3.696 -5.994 1.00 1.00 C ATOM 1889 O GLY A 120 14.403 -3.818 -5.279 1.00 1.00 O ATOM 0 H GLY A 120 13.454 -4.504 -8.281 1.00 1.00 H new ATOM 0 HA2 GLY A 120 16.267 -4.305 -7.862 1.00 1.00 H new ATOM 0 HA3 GLY A 120 15.109 -2.996 -8.001 1.00 1.00 H new ATOM 1893 N SER A 121 16.581 -3.328 -5.511 1.00 1.00 N ATOM 1894 CA SER A 121 16.757 -3.069 -4.091 1.00 1.00 C ATOM 1895 C SER A 121 17.550 -1.786 -3.854 1.00 1.00 C ATOM 1896 O SER A 121 18.420 -1.421 -4.637 1.00 1.00 O ATOM 1897 CB SER A 121 17.463 -4.247 -3.427 1.00 1.00 C ATOM 1898 OG SER A 121 16.526 -5.122 -2.820 1.00 1.00 O ATOM 0 H SER A 121 17.421 -3.203 -6.076 1.00 1.00 H new ATOM 0 HA SER A 121 15.769 -2.943 -3.648 1.00 1.00 H new ATOM 0 HB2 SER A 121 18.047 -4.791 -4.169 1.00 1.00 H new ATOM 0 HB3 SER A 121 18.163 -3.880 -2.677 1.00 1.00 H new ATOM 0 HG SER A 121 16.156 -4.699 -2.017 1.00 1.00 H new ATOM 1904 N PHE A 122 17.237 -1.119 -2.752 1.00 1.00 N ATOM 1905 CA PHE A 122 17.914 0.120 -2.396 1.00 1.00 C ATOM 1906 C PHE A 122 18.362 0.107 -0.950 1.00 1.00 C ATOM 1907 O PHE A 122 17.717 -0.506 -0.094 1.00 1.00 O ATOM 1908 CB PHE A 122 17.007 1.323 -2.638 1.00 1.00 C ATOM 1909 CG PHE A 122 17.430 2.181 -3.793 1.00 1.00 C ATOM 1910 CD1 PHE A 122 17.405 1.689 -5.089 1.00 1.00 C ATOM 1911 CD2 PHE A 122 17.856 3.483 -3.583 1.00 1.00 C ATOM 1912 CE1 PHE A 122 17.796 2.479 -6.153 1.00 1.00 C ATOM 1913 CE2 PHE A 122 18.249 4.278 -4.642 1.00 1.00 C ATOM 1914 CZ PHE A 122 18.219 3.775 -5.929 1.00 1.00 C ATOM 0 H PHE A 122 16.520 -1.414 -2.090 1.00 1.00 H new ATOM 0 HA PHE A 122 18.795 0.202 -3.033 1.00 1.00 H new ATOM 0 HB2 PHE A 122 15.991 0.970 -2.814 1.00 1.00 H new ATOM 0 HB3 PHE A 122 16.981 1.933 -1.735 1.00 1.00 H new ATOM 0 HD1 PHE A 122 17.076 0.676 -5.269 1.00 1.00 H new ATOM 0 HD2 PHE A 122 17.881 3.881 -2.579 1.00 1.00 H new ATOM 0 HE1 PHE A 122 17.771 2.084 -7.158 1.00 1.00 H new ATOM 0 HE2 PHE A 122 18.579 5.291 -4.465 1.00 1.00 H new ATOM 0 HZ PHE A 122 18.526 4.394 -6.759 1.00 1.00 H new ATOM 1924 N GLU A 123 19.457 0.793 -0.670 1.00 1.00 N ATOM 1925 CA GLU A 123 19.982 0.875 0.685 1.00 1.00 C ATOM 1926 C GLU A 123 19.072 1.732 1.577 1.00 1.00 C ATOM 1927 O GLU A 123 18.591 2.784 1.145 1.00 1.00 O ATOM 1928 CB GLU A 123 21.388 1.469 0.678 1.00 1.00 C ATOM 1929 CG GLU A 123 22.483 0.443 0.437 1.00 1.00 C ATOM 1930 CD GLU A 123 23.553 0.464 1.513 1.00 1.00 C ATOM 1931 OE1 GLU A 123 23.202 0.269 2.695 1.00 1.00 O ATOM 1932 OE2 GLU A 123 24.739 0.664 1.174 1.00 1.00 O ATOM 0 H GLU A 123 20.002 1.303 -1.365 1.00 1.00 H new ATOM 0 HA GLU A 123 20.019 -0.137 1.088 1.00 1.00 H new ATOM 0 HB2 GLU A 123 21.445 2.236 -0.094 1.00 1.00 H new ATOM 0 HB3 GLU A 123 21.569 1.963 1.633 1.00 1.00 H new ATOM 0 HG2 GLU A 123 22.039 -0.552 0.391 1.00 1.00 H new ATOM 0 HG3 GLU A 123 22.945 0.631 -0.532 1.00 1.00 H new ATOM 1939 N GLY A 124 18.863 1.283 2.801 1.00 1.00 N ATOM 1940 CA GLY A 124 18.027 2.030 3.727 1.00 1.00 C ATOM 1941 C GLY A 124 18.165 1.569 5.165 1.00 1.00 C ATOM 1942 O GLY A 124 18.733 0.513 5.434 1.00 1.00 O ATOM 0 H GLY A 124 19.253 0.418 3.175 1.00 1.00 H new ATOM 0 HA2 GLY A 124 18.284 3.088 3.666 1.00 1.00 H new ATOM 0 HA3 GLY A 124 16.985 1.937 3.421 1.00 1.00 H new ATOM 1946 N ASP A 125 17.638 2.372 6.078 1.00 1.00 N ATOM 1947 CA ASP A 125 17.682 2.076 7.496 1.00 1.00 C ATOM 1948 C ASP A 125 16.403 1.388 7.986 1.00 1.00 C ATOM 1949 O ASP A 125 16.273 1.107 9.183 1.00 1.00 O ATOM 1950 CB ASP A 125 17.939 3.344 8.302 1.00 1.00 C ATOM 1951 CG ASP A 125 16.875 4.385 8.031 1.00 1.00 C ATOM 1952 OD1 ASP A 125 15.686 4.101 8.281 1.00 1.00 O ATOM 1953 OD2 ASP A 125 17.230 5.483 7.552 1.00 1.00 O ATOM 0 H ASP A 125 17.168 3.248 5.852 1.00 1.00 H new ATOM 0 HA ASP A 125 18.507 1.380 7.650 1.00 1.00 H new ATOM 0 HB2 ASP A 125 17.957 3.106 9.365 1.00 1.00 H new ATOM 0 HB3 ASP A 125 18.920 3.747 8.049 1.00 1.00 H new ATOM 1958 N THR A 126 15.450 1.131 7.085 1.00 1.00 N ATOM 1959 CA THR A 126 14.194 0.498 7.494 1.00 1.00 C ATOM 1960 C THR A 126 14.007 -0.871 6.850 1.00 1.00 C ATOM 1961 O THR A 126 14.118 -1.040 5.632 1.00 1.00 O ATOM 1962 CB THR A 126 13.008 1.409 7.137 1.00 1.00 C ATOM 1963 OG1 THR A 126 13.335 2.760 7.353 1.00 1.00 O ATOM 1964 CG2 THR A 126 11.758 1.106 7.933 1.00 1.00 C ATOM 0 H THR A 126 15.521 1.346 6.090 1.00 1.00 H new ATOM 0 HA THR A 126 14.236 0.352 8.573 1.00 1.00 H new ATOM 0 HB THR A 126 12.803 1.216 6.084 1.00 1.00 H new ATOM 0 HG1 THR A 126 13.679 3.150 6.522 1.00 1.00 H new ATOM 0 HG21 THR A 126 10.961 1.785 7.631 1.00 1.00 H new ATOM 0 HG22 THR A 126 11.448 0.078 7.747 1.00 1.00 H new ATOM 0 HG23 THR A 126 11.963 1.237 8.996 1.00 1.00 H new ATOM 1972 N LYS A 127 13.716 -1.850 7.696 1.00 1.00 N ATOM 1973 CA LYS A 127 13.507 -3.219 7.249 1.00 1.00 C ATOM 1974 C LYS A 127 12.102 -3.701 7.577 1.00 1.00 C ATOM 1975 O LYS A 127 11.535 -3.354 8.611 1.00 1.00 O ATOM 1976 CB LYS A 127 14.554 -4.135 7.882 1.00 1.00 C ATOM 1977 CG LYS A 127 15.812 -3.396 8.321 1.00 1.00 C ATOM 1978 CD LYS A 127 16.781 -4.319 9.050 1.00 1.00 C ATOM 1979 CE LYS A 127 18.081 -4.494 8.289 1.00 1.00 C ATOM 1980 NZ LYS A 127 18.124 -5.776 7.532 1.00 1.00 N ATOM 0 H LYS A 127 13.619 -1.719 8.703 1.00 1.00 H new ATOM 0 HA LYS A 127 13.617 -3.247 6.165 1.00 1.00 H new ATOM 0 HB2 LYS A 127 14.115 -4.636 8.745 1.00 1.00 H new ATOM 0 HB3 LYS A 127 14.827 -4.912 7.168 1.00 1.00 H new ATOM 0 HG2 LYS A 127 16.305 -2.966 7.449 1.00 1.00 H new ATOM 0 HG3 LYS A 127 15.538 -2.567 8.973 1.00 1.00 H new ATOM 0 HD2 LYS A 127 16.992 -3.914 10.040 1.00 1.00 H new ATOM 0 HD3 LYS A 127 16.313 -5.292 9.197 1.00 1.00 H new ATOM 0 HE2 LYS A 127 18.209 -3.662 7.597 1.00 1.00 H new ATOM 0 HE3 LYS A 127 18.916 -4.459 8.988 1.00 1.00 H new ATOM 0 HZ1 LYS A 127 19.031 -5.851 7.028 1.00 1.00 H new ATOM 0 HZ2 LYS A 127 18.028 -6.573 8.193 1.00 1.00 H new ATOM 0 HZ3 LYS A 127 17.343 -5.800 6.845 1.00 1.00 H new ATOM 1994 N MET A 128 11.542 -4.500 6.680 1.00 1.00 N ATOM 1995 CA MET A 128 10.194 -5.043 6.880 1.00 1.00 C ATOM 1996 C MET A 128 10.184 -6.141 7.946 1.00 1.00 C ATOM 1997 O MET A 128 11.140 -6.905 8.083 1.00 1.00 O ATOM 1998 CB MET A 128 9.628 -5.595 5.560 1.00 1.00 C ATOM 1999 CG MET A 128 10.314 -6.869 5.083 1.00 1.00 C ATOM 2000 SD MET A 128 9.163 -8.261 4.961 1.00 1.00 S ATOM 2001 CE MET A 128 7.904 -7.538 3.937 1.00 1.00 C ATOM 0 H MET A 128 11.991 -4.789 5.811 1.00 1.00 H new ATOM 0 HA MET A 128 9.563 -4.224 7.225 1.00 1.00 H new ATOM 0 HB2 MET A 128 8.563 -5.792 5.686 1.00 1.00 H new ATOM 0 HB3 MET A 128 9.722 -4.832 4.788 1.00 1.00 H new ATOM 0 HG2 MET A 128 10.771 -6.691 4.109 1.00 1.00 H new ATOM 0 HG3 MET A 128 11.120 -7.125 5.771 1.00 1.00 H new ATOM 0 HE1 MET A 128 7.406 -8.321 3.365 1.00 1.00 H new ATOM 0 HE2 MET A 128 7.174 -7.027 4.564 1.00 1.00 H new ATOM 0 HE3 MET A 128 8.359 -6.822 3.252 1.00 1.00 H new ATOM 2011 N ILE A 129 9.100 -6.192 8.707 1.00 1.00 N ATOM 2012 CA ILE A 129 8.963 -7.181 9.779 1.00 1.00 C ATOM 2013 C ILE A 129 8.607 -8.552 9.228 1.00 1.00 C ATOM 2014 O ILE A 129 8.039 -8.664 8.142 1.00 1.00 O ATOM 2015 CB ILE A 129 7.876 -6.752 10.788 1.00 1.00 C ATOM 2016 CG1 ILE A 129 6.592 -6.360 10.064 1.00 1.00 C ATOM 2017 CG2 ILE A 129 8.376 -5.607 11.649 1.00 1.00 C ATOM 2018 CD1 ILE A 129 6.296 -4.879 10.101 1.00 1.00 C ATOM 0 H ILE A 129 8.302 -5.564 8.607 1.00 1.00 H new ATOM 0 HA ILE A 129 9.928 -7.239 10.282 1.00 1.00 H new ATOM 0 HB ILE A 129 7.654 -7.600 11.436 1.00 1.00 H new ATOM 0 HG12 ILE A 129 6.660 -6.681 9.025 1.00 1.00 H new ATOM 0 HG13 ILE A 129 5.756 -6.899 10.510 1.00 1.00 H new ATOM 0 HG21 ILE A 129 7.598 -5.316 12.355 1.00 1.00 H new ATOM 0 HG22 ILE A 129 9.263 -5.924 12.197 1.00 1.00 H new ATOM 0 HG23 ILE A 129 8.626 -4.757 11.014 1.00 1.00 H new ATOM 0 HD11 ILE A 129 5.368 -4.680 9.565 1.00 1.00 H new ATOM 0 HD12 ILE A 129 6.194 -4.554 11.136 1.00 1.00 H new ATOM 0 HD13 ILE A 129 7.112 -4.333 9.628 1.00 1.00 H new ATOM 2030 N PRO A 130 8.925 -9.623 9.987 1.00 1.00 N ATOM 2031 CA PRO A 130 8.628 -11.000 9.581 1.00 1.00 C ATOM 2032 C PRO A 130 7.140 -11.242 9.381 1.00 1.00 C ATOM 2033 O PRO A 130 6.310 -10.693 10.095 1.00 1.00 O ATOM 2034 CB PRO A 130 9.165 -11.847 10.747 1.00 1.00 C ATOM 2035 CG PRO A 130 9.276 -10.909 11.897 1.00 1.00 C ATOM 2036 CD PRO A 130 9.604 -9.564 11.292 1.00 1.00 C ATOM 0 HA PRO A 130 9.082 -11.244 8.620 1.00 1.00 H new ATOM 0 HB2 PRO A 130 8.491 -12.672 10.976 1.00 1.00 H new ATOM 0 HB3 PRO A 130 10.133 -12.285 10.502 1.00 1.00 H new ATOM 0 HG2 PRO A 130 8.344 -10.869 12.461 1.00 1.00 H new ATOM 0 HG3 PRO A 130 10.055 -11.228 12.590 1.00 1.00 H new ATOM 0 HD2 PRO A 130 9.233 -8.743 11.905 1.00 1.00 H new ATOM 0 HD3 PRO A 130 10.679 -9.420 11.183 1.00 1.00 H new ATOM 2044 N LEU A 131 6.812 -12.064 8.396 1.00 1.00 N ATOM 2045 CA LEU A 131 5.421 -12.378 8.073 1.00 1.00 C ATOM 2046 C LEU A 131 5.053 -13.780 8.546 1.00 1.00 C ATOM 2047 O LEU A 131 5.756 -14.749 8.248 1.00 1.00 O ATOM 2048 CB LEU A 131 5.190 -12.264 6.563 1.00 1.00 C ATOM 2049 CG LEU A 131 5.181 -10.829 6.032 1.00 1.00 C ATOM 2050 CD1 LEU A 131 5.739 -10.791 4.621 1.00 1.00 C ATOM 2051 CD2 LEU A 131 3.785 -10.248 6.080 1.00 1.00 C ATOM 0 H LEU A 131 7.494 -12.532 7.799 1.00 1.00 H new ATOM 0 HA LEU A 131 4.784 -11.660 8.591 1.00 1.00 H new ATOM 0 HB2 LEU A 131 5.968 -12.825 6.045 1.00 1.00 H new ATOM 0 HB3 LEU A 131 4.239 -12.736 6.317 1.00 1.00 H new ATOM 0 HG LEU A 131 5.817 -10.216 6.670 1.00 1.00 H new ATOM 0 HD11 LEU A 131 5.728 -9.765 4.253 1.00 1.00 H new ATOM 0 HD12 LEU A 131 6.763 -11.164 4.625 1.00 1.00 H new ATOM 0 HD13 LEU A 131 5.127 -11.416 3.971 1.00 1.00 H new ATOM 0 HD21 LEU A 131 3.802 -9.227 5.698 1.00 1.00 H new ATOM 0 HD22 LEU A 131 3.118 -10.854 5.467 1.00 1.00 H new ATOM 0 HD23 LEU A 131 3.428 -10.244 7.110 1.00 1.00 H new ATOM 2063 N ASN A 132 3.952 -13.889 9.283 1.00 1.00 N ATOM 2064 CA ASN A 132 3.524 -15.187 9.790 1.00 1.00 C ATOM 2065 C ASN A 132 2.662 -15.890 8.737 1.00 1.00 C ATOM 2066 O ASN A 132 1.515 -15.503 8.501 1.00 1.00 O ATOM 2067 CB ASN A 132 2.732 -15.031 11.100 1.00 1.00 C ATOM 2068 CG ASN A 132 3.611 -15.190 12.335 1.00 1.00 C ATOM 2069 OD1 ASN A 132 3.443 -16.124 13.120 1.00 1.00 O ATOM 2070 ND2 ASN A 132 4.553 -14.269 12.506 1.00 1.00 N ATOM 0 H ASN A 132 3.349 -13.107 9.539 1.00 1.00 H new ATOM 0 HA ASN A 132 4.409 -15.789 9.998 1.00 1.00 H new ATOM 0 HB2 ASN A 132 2.257 -14.050 11.119 1.00 1.00 H new ATOM 0 HB3 ASN A 132 1.933 -15.772 11.128 1.00 1.00 H new ATOM 0 HD21 ASN A 132 5.174 -14.318 13.314 1.00 1.00 H new ATOM 0 HD22 ASN A 132 4.656 -13.513 11.829 1.00 1.00 H new ATOM 2077 N TRP A 133 3.234 -16.911 8.121 1.00 1.00 N ATOM 2078 CA TRP A 133 2.545 -17.670 7.094 1.00 1.00 C ATOM 2079 C TRP A 133 1.256 -18.300 7.632 1.00 1.00 C ATOM 2080 O TRP A 133 0.240 -18.337 6.938 1.00 1.00 O ATOM 2081 CB TRP A 133 3.458 -18.758 6.532 1.00 1.00 C ATOM 2082 CG TRP A 133 4.547 -18.215 5.650 1.00 1.00 C ATOM 2083 CD1 TRP A 133 4.791 -16.901 5.375 1.00 1.00 C ATOM 2084 CD2 TRP A 133 5.524 -18.967 4.929 1.00 1.00 C ATOM 2085 NE1 TRP A 133 5.866 -16.792 4.526 1.00 1.00 N ATOM 2086 CE2 TRP A 133 6.332 -18.047 4.238 1.00 1.00 C ATOM 2087 CE3 TRP A 133 5.795 -20.331 4.802 1.00 1.00 C ATOM 2088 CZ2 TRP A 133 7.391 -18.447 3.432 1.00 1.00 C ATOM 2089 CZ3 TRP A 133 6.848 -20.728 4.001 1.00 1.00 C ATOM 2090 CH2 TRP A 133 7.635 -19.788 3.325 1.00 1.00 C ATOM 0 H TRP A 133 4.181 -17.234 8.317 1.00 1.00 H new ATOM 0 HA TRP A 133 2.278 -16.977 6.296 1.00 1.00 H new ATOM 0 HB2 TRP A 133 3.908 -19.309 7.358 1.00 1.00 H new ATOM 0 HB3 TRP A 133 2.859 -19.469 5.964 1.00 1.00 H new ATOM 0 HD1 TRP A 133 4.223 -16.070 5.767 1.00 1.00 H new ATOM 0 HE1 TRP A 133 6.254 -15.919 4.169 1.00 1.00 H new ATOM 0 HE3 TRP A 133 5.192 -21.062 5.321 1.00 1.00 H new ATOM 0 HZ2 TRP A 133 8.000 -17.724 2.909 1.00 1.00 H new ATOM 0 HZ3 TRP A 133 7.068 -21.780 3.895 1.00 1.00 H new ATOM 0 HH2 TRP A 133 8.452 -20.129 2.706 1.00 1.00 H new ATOM 2101 N ASP A 134 1.304 -18.799 8.860 1.00 1.00 N ATOM 2102 CA ASP A 134 0.136 -19.412 9.473 1.00 1.00 C ATOM 2103 C ASP A 134 -0.983 -18.390 9.697 1.00 1.00 C ATOM 2104 O ASP A 134 -2.165 -18.720 9.574 1.00 1.00 O ATOM 2105 CB ASP A 134 0.506 -20.064 10.807 1.00 1.00 C ATOM 2106 CG ASP A 134 1.189 -21.405 10.616 1.00 1.00 C ATOM 2107 OD1 ASP A 134 0.660 -22.237 9.849 1.00 1.00 O ATOM 2108 OD2 ASP A 134 2.260 -21.619 11.224 1.00 1.00 O ATOM 0 H ASP A 134 2.137 -18.791 9.449 1.00 1.00 H new ATOM 0 HA ASP A 134 -0.226 -20.176 8.785 1.00 1.00 H new ATOM 0 HB2 ASP A 134 1.164 -19.398 11.365 1.00 1.00 H new ATOM 0 HB3 ASP A 134 -0.394 -20.198 11.407 1.00 1.00 H new ATOM 2113 N ASP A 135 -0.600 -17.161 10.033 1.00 1.00 N ATOM 2114 CA ASP A 135 -1.573 -16.095 10.300 1.00 1.00 C ATOM 2115 C ASP A 135 -2.394 -15.713 9.064 1.00 1.00 C ATOM 2116 O ASP A 135 -3.568 -15.376 9.177 1.00 1.00 O ATOM 2117 CB ASP A 135 -0.853 -14.855 10.848 1.00 1.00 C ATOM 2118 CG ASP A 135 -1.518 -13.560 10.431 1.00 1.00 C ATOM 2119 OD1 ASP A 135 -2.634 -13.290 10.922 1.00 1.00 O ATOM 2120 OD2 ASP A 135 -0.920 -12.808 9.632 1.00 1.00 O ATOM 0 H ASP A 135 0.374 -16.875 10.128 1.00 1.00 H new ATOM 0 HA ASP A 135 -2.272 -16.483 11.041 1.00 1.00 H new ATOM 0 HB2 ASP A 135 -0.823 -14.909 11.936 1.00 1.00 H new ATOM 0 HB3 ASP A 135 0.180 -14.856 10.500 1.00 1.00 H new ATOM 2125 N PHE A 136 -1.767 -15.736 7.889 1.00 1.00 N ATOM 2126 CA PHE A 136 -2.447 -15.360 6.646 1.00 1.00 C ATOM 2127 C PHE A 136 -1.977 -16.201 5.470 1.00 1.00 C ATOM 2128 O PHE A 136 -0.890 -16.758 5.486 1.00 1.00 O ATOM 2129 CB PHE A 136 -2.177 -13.887 6.343 1.00 1.00 C ATOM 2130 CG PHE A 136 -3.402 -13.009 6.382 1.00 1.00 C ATOM 2131 CD1 PHE A 136 -4.118 -12.828 7.554 1.00 1.00 C ATOM 2132 CD2 PHE A 136 -3.829 -12.363 5.232 1.00 1.00 C ATOM 2133 CE1 PHE A 136 -5.238 -12.018 7.580 1.00 1.00 C ATOM 2134 CE2 PHE A 136 -4.949 -11.552 5.253 1.00 1.00 C ATOM 2135 CZ PHE A 136 -5.653 -11.379 6.428 1.00 1.00 C ATOM 0 H PHE A 136 -0.792 -16.010 7.769 1.00 1.00 H new ATOM 0 HA PHE A 136 -3.514 -15.533 6.785 1.00 1.00 H new ATOM 0 HB2 PHE A 136 -1.450 -13.508 7.061 1.00 1.00 H new ATOM 0 HB3 PHE A 136 -1.720 -13.809 5.356 1.00 1.00 H new ATOM 0 HD1 PHE A 136 -3.798 -13.325 8.458 1.00 1.00 H new ATOM 0 HD2 PHE A 136 -3.281 -12.494 4.310 1.00 1.00 H new ATOM 0 HE1 PHE A 136 -5.788 -11.885 8.500 1.00 1.00 H new ATOM 0 HE2 PHE A 136 -5.273 -11.054 4.351 1.00 1.00 H new ATOM 0 HZ PHE A 136 -6.527 -10.745 6.446 1.00 1.00 H new ATOM 2145 N THR A 137 -2.799 -16.275 4.431 1.00 1.00 N ATOM 2146 CA THR A 137 -2.446 -17.039 3.245 1.00 1.00 C ATOM 2147 C THR A 137 -2.654 -16.212 1.987 1.00 1.00 C ATOM 2148 O THR A 137 -3.425 -15.250 1.993 1.00 1.00 O ATOM 2149 CB THR A 137 -3.274 -18.321 3.175 1.00 1.00 C ATOM 2150 OG1 THR A 137 -3.152 -18.922 1.899 1.00 1.00 O ATOM 2151 CG2 THR A 137 -4.746 -18.109 3.449 1.00 1.00 C ATOM 0 H THR A 137 -3.710 -15.817 4.387 1.00 1.00 H new ATOM 0 HA THR A 137 -1.391 -17.303 3.311 1.00 1.00 H new ATOM 0 HB THR A 137 -2.873 -18.965 3.958 1.00 1.00 H new ATOM 0 HG1 THR A 137 -3.687 -19.743 1.871 1.00 1.00 H new ATOM 0 HG21 THR A 137 -5.270 -19.063 3.382 1.00 1.00 H new ATOM 0 HG22 THR A 137 -4.874 -17.694 4.449 1.00 1.00 H new ATOM 0 HG23 THR A 137 -5.157 -17.417 2.714 1.00 1.00 H new ATOM 2159 N LYS A 138 -1.958 -16.583 0.906 1.00 1.00 N ATOM 2160 CA LYS A 138 -2.078 -15.857 -0.367 1.00 1.00 C ATOM 2161 C LYS A 138 -3.212 -16.413 -1.221 1.00 1.00 C ATOM 2162 O LYS A 138 -3.184 -17.572 -1.649 1.00 1.00 O ATOM 2163 CB LYS A 138 -0.764 -15.937 -1.145 1.00 1.00 C ATOM 2164 CG LYS A 138 -0.346 -17.349 -1.502 1.00 1.00 C ATOM 2165 CD LYS A 138 1.139 -17.564 -1.275 1.00 1.00 C ATOM 2166 CE LYS A 138 1.390 -18.484 -0.093 1.00 1.00 C ATOM 2167 NZ LYS A 138 1.312 -19.913 -0.500 1.00 1.00 N ATOM 0 H LYS A 138 -1.312 -17.372 0.885 1.00 1.00 H new ATOM 0 HA LYS A 138 -2.303 -14.816 -0.135 1.00 1.00 H new ATOM 0 HB2 LYS A 138 -0.860 -15.354 -2.061 1.00 1.00 H new ATOM 0 HB3 LYS A 138 0.026 -15.473 -0.554 1.00 1.00 H new ATOM 0 HG2 LYS A 138 -0.914 -18.060 -0.902 1.00 1.00 H new ATOM 0 HG3 LYS A 138 -0.588 -17.548 -2.546 1.00 1.00 H new ATOM 0 HD2 LYS A 138 1.588 -17.990 -2.172 1.00 1.00 H new ATOM 0 HD3 LYS A 138 1.625 -16.604 -1.101 1.00 1.00 H new ATOM 0 HE2 LYS A 138 2.373 -18.277 0.331 1.00 1.00 H new ATOM 0 HE3 LYS A 138 0.657 -18.285 0.689 1.00 1.00 H new ATOM 0 HZ1 LYS A 138 1.487 -20.519 0.327 1.00 1.00 H new ATOM 0 HZ2 LYS A 138 0.366 -20.114 -0.882 1.00 1.00 H new ATOM 0 HZ3 LYS A 138 2.028 -20.106 -1.229 1.00 1.00 H new ATOM 2181 N VAL A 139 -4.217 -15.582 -1.469 1.00 1.00 N ATOM 2182 CA VAL A 139 -5.345 -15.966 -2.281 1.00 1.00 C ATOM 2183 C VAL A 139 -4.895 -16.263 -3.706 1.00 1.00 C ATOM 2184 O VAL A 139 -5.346 -17.221 -4.329 1.00 1.00 O ATOM 2185 CB VAL A 139 -6.433 -14.879 -2.294 1.00 1.00 C ATOM 2186 CG1 VAL A 139 -6.660 -14.332 -0.890 1.00 1.00 C ATOM 2187 CG2 VAL A 139 -6.069 -13.755 -3.257 1.00 1.00 C ATOM 0 H VAL A 139 -4.265 -14.628 -1.110 1.00 1.00 H new ATOM 0 HA VAL A 139 -5.773 -16.866 -1.841 1.00 1.00 H new ATOM 0 HB VAL A 139 -7.361 -15.333 -2.641 1.00 1.00 H new ATOM 0 HG11 VAL A 139 -7.433 -13.564 -0.919 1.00 1.00 H new ATOM 0 HG12 VAL A 139 -6.976 -15.141 -0.231 1.00 1.00 H new ATOM 0 HG13 VAL A 139 -5.733 -13.899 -0.514 1.00 1.00 H new ATOM 0 HG21 VAL A 139 -6.854 -12.999 -3.248 1.00 1.00 H new ATOM 0 HG22 VAL A 139 -5.126 -13.303 -2.949 1.00 1.00 H new ATOM 0 HG23 VAL A 139 -5.966 -14.158 -4.264 1.00 1.00 H new ATOM 2197 N SER A 140 -4.026 -15.405 -4.223 1.00 1.00 N ATOM 2198 CA SER A 140 -3.534 -15.533 -5.594 1.00 1.00 C ATOM 2199 C SER A 140 -2.182 -14.835 -5.781 1.00 1.00 C ATOM 2200 O SER A 140 -1.766 -14.049 -4.928 1.00 1.00 O ATOM 2201 CB SER A 140 -4.550 -14.949 -6.569 1.00 1.00 C ATOM 2202 OG SER A 140 -5.479 -15.926 -6.991 1.00 1.00 O ATOM 0 H SER A 140 -3.644 -14.608 -3.713 1.00 1.00 H new ATOM 0 HA SER A 140 -3.395 -16.595 -5.796 1.00 1.00 H new ATOM 0 HB2 SER A 140 -5.079 -14.123 -6.094 1.00 1.00 H new ATOM 0 HB3 SER A 140 -4.031 -14.539 -7.436 1.00 1.00 H new ATOM 0 HG SER A 140 -5.637 -16.563 -6.263 1.00 1.00 H new ATOM 2208 N SER A 141 -1.508 -15.117 -6.901 1.00 1.00 N ATOM 2209 CA SER A 141 -0.221 -14.506 -7.182 1.00 1.00 C ATOM 2210 C SER A 141 -0.145 -13.997 -8.615 1.00 1.00 C ATOM 2211 O SER A 141 -0.778 -14.548 -9.519 1.00 1.00 O ATOM 2212 CB SER A 141 0.904 -15.520 -6.948 1.00 1.00 C ATOM 2213 OG SER A 141 0.375 -16.788 -6.574 1.00 1.00 O ATOM 0 H SER A 141 -1.837 -15.762 -7.619 1.00 1.00 H new ATOM 0 HA SER A 141 -0.105 -13.658 -6.507 1.00 1.00 H new ATOM 0 HB2 SER A 141 1.500 -15.623 -7.855 1.00 1.00 H new ATOM 0 HB3 SER A 141 1.571 -15.155 -6.167 1.00 1.00 H new ATOM 0 HG SER A 141 1.110 -17.420 -6.431 1.00 1.00 H new ATOM 2219 N ARG A 142 0.638 -12.933 -8.817 1.00 1.00 N ATOM 2220 CA ARG A 142 0.813 -12.330 -10.137 1.00 1.00 C ATOM 2221 C ARG A 142 2.292 -12.044 -10.417 1.00 1.00 C ATOM 2222 O ARG A 142 3.044 -11.677 -9.508 1.00 1.00 O ATOM 2223 CB ARG A 142 0.025 -11.027 -10.241 1.00 1.00 C ATOM 2224 CG ARG A 142 -1.210 -11.134 -11.108 1.00 1.00 C ATOM 2225 CD ARG A 142 -1.593 -9.782 -11.689 1.00 1.00 C ATOM 2226 NE ARG A 142 -1.796 -9.852 -13.132 1.00 1.00 N ATOM 2227 CZ ARG A 142 -2.218 -8.828 -13.872 1.00 1.00 C ATOM 2228 NH1 ARG A 142 -2.497 -7.659 -13.308 1.00 1.00 N ATOM 2229 NH2 ARG A 142 -2.354 -8.972 -15.183 1.00 1.00 N ATOM 0 H ARG A 142 1.163 -12.470 -8.075 1.00 1.00 H new ATOM 0 HA ARG A 142 0.440 -13.040 -10.875 1.00 1.00 H new ATOM 0 HB2 ARG A 142 -0.270 -10.710 -9.241 1.00 1.00 H new ATOM 0 HB3 ARG A 142 0.675 -10.250 -10.643 1.00 1.00 H new ATOM 0 HG2 ARG A 142 -1.030 -11.842 -11.917 1.00 1.00 H new ATOM 0 HG3 ARG A 142 -2.038 -11.527 -10.519 1.00 1.00 H new ATOM 0 HD2 ARG A 142 -2.505 -9.425 -11.210 1.00 1.00 H new ATOM 0 HD3 ARG A 142 -0.811 -9.056 -11.466 1.00 1.00 H new ATOM 0 HE ARG A 142 -1.604 -10.737 -13.602 1.00 1.00 H new ATOM 0 HH11 ARG A 142 -2.389 -7.540 -12.301 1.00 1.00 H new ATOM 0 HH12 ARG A 142 -2.820 -6.880 -13.882 1.00 1.00 H new ATOM 0 HH21 ARG A 142 -2.136 -9.866 -15.623 1.00 1.00 H new ATOM 0 HH22 ARG A 142 -2.677 -8.189 -15.751 1.00 1.00 H new ATOM 2243 N THR A 143 2.703 -12.213 -11.678 1.00 1.00 N ATOM 2244 CA THR A 143 4.085 -11.979 -12.068 1.00 1.00 C ATOM 2245 C THR A 143 4.181 -10.899 -13.144 1.00 1.00 C ATOM 2246 O THR A 143 3.461 -10.938 -14.150 1.00 1.00 O ATOM 2247 CB THR A 143 4.722 -13.287 -12.562 1.00 1.00 C ATOM 2248 OG1 THR A 143 4.357 -14.375 -11.741 1.00 1.00 O ATOM 2249 CG2 THR A 143 6.234 -13.241 -12.610 1.00 1.00 C ATOM 0 H THR A 143 2.094 -12.511 -12.440 1.00 1.00 H new ATOM 0 HA THR A 143 4.631 -11.627 -11.193 1.00 1.00 H new ATOM 0 HB THR A 143 4.343 -13.416 -13.576 1.00 1.00 H new ATOM 0 HG1 THR A 143 4.775 -15.195 -12.079 1.00 1.00 H new ATOM 0 HG21 THR A 143 6.616 -14.197 -12.968 1.00 1.00 H new ATOM 0 HG22 THR A 143 6.553 -12.447 -13.286 1.00 1.00 H new ATOM 0 HG23 THR A 143 6.624 -13.045 -11.611 1.00 1.00 H new ATOM 2257 N VAL A 144 5.066 -9.933 -12.938 1.00 1.00 N ATOM 2258 CA VAL A 144 5.249 -8.840 -13.883 1.00 1.00 C ATOM 2259 C VAL A 144 6.666 -8.845 -14.450 1.00 1.00 C ATOM 2260 O VAL A 144 7.636 -8.912 -13.693 1.00 1.00 O ATOM 2261 CB VAL A 144 4.957 -7.466 -13.233 1.00 1.00 C ATOM 2262 CG1 VAL A 144 4.734 -6.405 -14.304 1.00 1.00 C ATOM 2263 CG2 VAL A 144 3.757 -7.550 -12.297 1.00 1.00 C ATOM 0 H VAL A 144 5.672 -9.885 -12.119 1.00 1.00 H new ATOM 0 HA VAL A 144 4.536 -8.996 -14.693 1.00 1.00 H new ATOM 0 HB VAL A 144 5.825 -7.179 -12.640 1.00 1.00 H new ATOM 0 HG11 VAL A 144 4.530 -5.446 -13.829 1.00 1.00 H new ATOM 0 HG12 VAL A 144 5.627 -6.320 -14.924 1.00 1.00 H new ATOM 0 HG13 VAL A 144 3.886 -6.689 -14.927 1.00 1.00 H new ATOM 0 HG21 VAL A 144 3.573 -6.572 -11.853 1.00 1.00 H new ATOM 0 HG22 VAL A 144 2.878 -7.865 -12.860 1.00 1.00 H new ATOM 0 HG23 VAL A 144 3.961 -8.274 -11.508 1.00 1.00 H new ATOM 2273 N GLU A 145 6.777 -8.790 -15.782 1.00 1.00 N ATOM 2274 CA GLU A 145 8.064 -8.803 -16.471 1.00 1.00 C ATOM 2275 C GLU A 145 8.308 -7.511 -17.241 1.00 1.00 C ATOM 2276 O GLU A 145 7.392 -6.949 -17.838 1.00 1.00 O ATOM 2277 CB GLU A 145 8.139 -9.999 -17.427 1.00 1.00 C ATOM 2278 CG GLU A 145 7.795 -11.333 -16.768 1.00 1.00 C ATOM 2279 CD GLU A 145 7.043 -12.261 -17.700 1.00 1.00 C ATOM 2280 OE1 GLU A 145 7.513 -12.470 -18.839 1.00 1.00 O ATOM 2281 OE2 GLU A 145 5.978 -12.771 -17.295 1.00 1.00 O ATOM 0 H GLU A 145 5.974 -8.735 -16.409 1.00 1.00 H new ATOM 0 HA GLU A 145 8.841 -8.892 -15.712 1.00 1.00 H new ATOM 0 HB2 GLU A 145 7.458 -9.830 -18.261 1.00 1.00 H new ATOM 0 HB3 GLU A 145 9.145 -10.058 -17.843 1.00 1.00 H new ATOM 0 HG2 GLU A 145 8.713 -11.820 -16.438 1.00 1.00 H new ATOM 0 HG3 GLU A 145 7.193 -11.151 -15.878 1.00 1.00 H new ATOM 2288 N ASP A 146 9.558 -7.050 -17.226 1.00 1.00 N ATOM 2289 CA ASP A 146 9.954 -5.828 -17.907 1.00 1.00 C ATOM 2290 C ASP A 146 11.424 -5.898 -18.296 1.00 1.00 C ATOM 2291 O ASP A 146 12.128 -6.842 -17.917 1.00 1.00 O ATOM 2292 CB ASP A 146 9.702 -4.603 -17.023 1.00 1.00 C ATOM 2293 CG ASP A 146 8.606 -3.720 -17.569 1.00 1.00 C ATOM 2294 OD1 ASP A 146 8.535 -3.570 -18.806 1.00 1.00 O ATOM 2295 OD2 ASP A 146 7.826 -3.164 -16.767 1.00 1.00 O ATOM 0 H ASP A 146 10.323 -7.518 -16.739 1.00 1.00 H new ATOM 0 HA ASP A 146 9.350 -5.729 -18.809 1.00 1.00 H new ATOM 0 HB2 ASP A 146 9.435 -4.931 -16.018 1.00 1.00 H new ATOM 0 HB3 ASP A 146 10.622 -4.025 -16.936 1.00 1.00 H new ATOM 2300 N THR A 147 11.887 -4.918 -19.069 1.00 1.00 N ATOM 2301 CA THR A 147 13.277 -4.905 -19.530 1.00 1.00 C ATOM 2302 C THR A 147 14.253 -4.812 -18.367 1.00 1.00 C ATOM 2303 O THR A 147 15.245 -5.533 -18.332 1.00 1.00 O ATOM 2304 CB THR A 147 13.502 -3.737 -20.500 1.00 1.00 C ATOM 2305 OG1 THR A 147 14.822 -3.772 -21.036 1.00 1.00 O ATOM 2306 CG2 THR A 147 13.295 -2.381 -19.875 1.00 1.00 C ATOM 0 H THR A 147 11.327 -4.128 -19.388 1.00 1.00 H new ATOM 0 HA THR A 147 13.463 -5.846 -20.048 1.00 1.00 H new ATOM 0 HB THR A 147 12.754 -3.870 -21.281 1.00 1.00 H new ATOM 0 HG1 THR A 147 14.945 -3.020 -21.653 1.00 1.00 H new ATOM 0 HG21 THR A 147 13.472 -1.606 -20.621 1.00 1.00 H new ATOM 0 HG22 THR A 147 12.272 -2.303 -19.506 1.00 1.00 H new ATOM 0 HG23 THR A 147 13.991 -2.252 -19.046 1.00 1.00 H new ATOM 2314 N ASN A 148 13.981 -3.931 -17.426 1.00 1.00 N ATOM 2315 CA ASN A 148 14.846 -3.763 -16.271 1.00 1.00 C ATOM 2316 C ASN A 148 14.464 -4.722 -15.143 1.00 1.00 C ATOM 2317 O ASN A 148 13.298 -4.811 -14.782 1.00 1.00 O ATOM 2318 CB ASN A 148 14.748 -2.328 -15.757 1.00 1.00 C ATOM 2319 CG ASN A 148 16.012 -1.869 -15.059 1.00 1.00 C ATOM 2320 OD1 ASN A 148 17.088 -2.429 -15.272 1.00 1.00 O ATOM 2321 ND2 ASN A 148 15.889 -0.850 -14.217 1.00 1.00 N ATOM 0 H ASN A 148 13.166 -3.318 -17.437 1.00 1.00 H new ATOM 0 HA ASN A 148 15.866 -3.984 -16.584 1.00 1.00 H new ATOM 0 HB2 ASN A 148 14.537 -1.661 -16.593 1.00 1.00 H new ATOM 0 HB3 ASN A 148 13.908 -2.250 -15.067 1.00 1.00 H new ATOM 0 HD21 ASN A 148 16.706 -0.501 -13.716 1.00 1.00 H new ATOM 0 HD22 ASN A 148 14.977 -0.416 -14.071 1.00 1.00 H new ATOM 2328 N PRO A 149 15.434 -5.440 -14.561 1.00 1.00 N ATOM 2329 CA PRO A 149 15.156 -6.368 -13.468 1.00 1.00 C ATOM 2330 C PRO A 149 14.467 -5.672 -12.297 1.00 1.00 C ATOM 2331 O PRO A 149 13.590 -6.243 -11.655 1.00 1.00 O ATOM 2332 CB PRO A 149 16.547 -6.860 -13.049 1.00 1.00 C ATOM 2333 CG PRO A 149 17.409 -6.645 -14.247 1.00 1.00 C ATOM 2334 CD PRO A 149 16.866 -5.410 -14.912 1.00 1.00 C ATOM 0 HA PRO A 149 14.484 -7.170 -13.772 1.00 1.00 H new ATOM 0 HB2 PRO A 149 16.920 -6.304 -12.189 1.00 1.00 H new ATOM 0 HB3 PRO A 149 16.524 -7.911 -12.763 1.00 1.00 H new ATOM 0 HG2 PRO A 149 18.452 -6.511 -13.962 1.00 1.00 H new ATOM 0 HG3 PRO A 149 17.370 -7.503 -14.919 1.00 1.00 H new ATOM 0 HD2 PRO A 149 17.352 -4.507 -14.543 1.00 1.00 H new ATOM 0 HD3 PRO A 149 17.017 -5.435 -15.991 1.00 1.00 H new ATOM 2342 N ALA A 150 14.863 -4.431 -12.045 1.00 1.00 N ATOM 2343 CA ALA A 150 14.282 -3.639 -10.967 1.00 1.00 C ATOM 2344 C ALA A 150 12.801 -3.381 -11.235 1.00 1.00 C ATOM 2345 O ALA A 150 11.980 -3.379 -10.323 1.00 1.00 O ATOM 2346 CB ALA A 150 15.034 -2.324 -10.813 1.00 1.00 C ATOM 0 H ALA A 150 15.588 -3.948 -12.575 1.00 1.00 H new ATOM 0 HA ALA A 150 14.371 -4.199 -10.036 1.00 1.00 H new ATOM 0 HB1 ALA A 150 14.589 -1.743 -10.005 1.00 1.00 H new ATOM 0 HB2 ALA A 150 16.079 -2.528 -10.581 1.00 1.00 H new ATOM 0 HB3 ALA A 150 14.972 -1.758 -11.743 1.00 1.00 H new ATOM 2352 N LEU A 151 12.481 -3.162 -12.512 1.00 1.00 N ATOM 2353 CA LEU A 151 11.108 -2.882 -12.959 1.00 1.00 C ATOM 2354 C LEU A 151 10.188 -4.069 -12.705 1.00 1.00 C ATOM 2355 O LEU A 151 9.017 -3.893 -12.354 1.00 1.00 O ATOM 2356 CB LEU A 151 11.108 -2.518 -14.443 1.00 1.00 C ATOM 2357 CG LEU A 151 11.155 -1.018 -14.740 1.00 1.00 C ATOM 2358 CD1 LEU A 151 11.362 -0.759 -16.225 1.00 1.00 C ATOM 2359 CD2 LEU A 151 9.876 -0.350 -14.260 1.00 1.00 C ATOM 0 H LEU A 151 13.165 -3.173 -13.269 1.00 1.00 H new ATOM 0 HA LEU A 151 10.728 -2.039 -12.382 1.00 1.00 H new ATOM 0 HB2 LEU A 151 11.965 -2.994 -14.919 1.00 1.00 H new ATOM 0 HB3 LEU A 151 10.214 -2.937 -14.905 1.00 1.00 H new ATOM 0 HG LEU A 151 12.002 -0.591 -14.203 1.00 1.00 H new ATOM 0 HD11 LEU A 151 11.391 0.315 -16.406 1.00 1.00 H new ATOM 0 HD12 LEU A 151 12.303 -1.207 -16.545 1.00 1.00 H new ATOM 0 HD13 LEU A 151 10.540 -1.200 -16.789 1.00 1.00 H new ATOM 0 HD21 LEU A 151 9.920 0.717 -14.476 1.00 1.00 H new ATOM 0 HD22 LEU A 151 9.021 -0.790 -14.774 1.00 1.00 H new ATOM 0 HD23 LEU A 151 9.769 -0.498 -13.185 1.00 1.00 H new ATOM 2371 N THR A 152 10.710 -5.285 -12.898 1.00 1.00 N ATOM 2372 CA THR A 152 9.914 -6.497 -12.700 1.00 1.00 C ATOM 2373 C THR A 152 9.502 -6.633 -11.244 1.00 1.00 C ATOM 2374 O THR A 152 10.295 -6.393 -10.328 1.00 1.00 O ATOM 2375 CB THR A 152 10.704 -7.726 -13.152 1.00 1.00 C ATOM 2376 OG1 THR A 152 10.461 -8.004 -14.523 1.00 1.00 O ATOM 2377 CG2 THR A 152 10.370 -8.978 -12.368 1.00 1.00 C ATOM 0 H THR A 152 11.673 -5.454 -13.189 1.00 1.00 H new ATOM 0 HA THR A 152 9.010 -6.423 -13.304 1.00 1.00 H new ATOM 0 HB THR A 152 11.750 -7.474 -12.977 1.00 1.00 H new ATOM 0 HG1 THR A 152 10.546 -8.967 -14.681 1.00 1.00 H new ATOM 0 HG21 THR A 152 10.966 -9.811 -12.741 1.00 1.00 H new ATOM 0 HG22 THR A 152 10.592 -8.817 -11.313 1.00 1.00 H new ATOM 0 HG23 THR A 152 9.311 -9.209 -12.485 1.00 1.00 H new ATOM 2385 N HIS A 153 8.249 -6.997 -11.034 1.00 1.00 N ATOM 2386 CA HIS A 153 7.714 -7.145 -9.690 1.00 1.00 C ATOM 2387 C HIS A 153 6.637 -8.214 -9.652 1.00 1.00 C ATOM 2388 O HIS A 153 6.063 -8.573 -10.676 1.00 1.00 O ATOM 2389 CB HIS A 153 7.143 -5.808 -9.189 1.00 1.00 C ATOM 2390 CG HIS A 153 6.147 -5.192 -10.121 1.00 1.00 C ATOM 2391 ND1 HIS A 153 4.946 -4.662 -9.700 1.00 1.00 N ATOM 2392 CD2 HIS A 153 6.197 -4.992 -11.459 1.00 1.00 C ATOM 2393 CE1 HIS A 153 4.299 -4.165 -10.740 1.00 1.00 C ATOM 2394 NE2 HIS A 153 5.038 -4.352 -11.818 1.00 1.00 N ATOM 0 H HIS A 153 7.581 -7.196 -11.778 1.00 1.00 H new ATOM 0 HA HIS A 153 8.529 -7.450 -9.034 1.00 1.00 H new ATOM 0 HB2 HIS A 153 6.671 -5.965 -8.219 1.00 1.00 H new ATOM 0 HB3 HIS A 153 7.964 -5.108 -9.034 1.00 1.00 H new ATOM 0 HD1 HIS A 153 4.609 -4.655 -8.737 1.00 1.00 H new ATOM 0 HD2 HIS A 153 7.000 -5.282 -12.121 1.00 1.00 H new ATOM 0 HE1 HIS A 153 3.331 -3.687 -10.713 1.00 1.00 H new ATOM 2403 N THR A 154 6.342 -8.707 -8.465 1.00 1.00 N ATOM 2404 CA THR A 154 5.311 -9.720 -8.299 1.00 1.00 C ATOM 2405 C THR A 154 4.210 -9.196 -7.376 1.00 1.00 C ATOM 2406 O THR A 154 4.491 -8.736 -6.262 1.00 1.00 O ATOM 2407 CB THR A 154 5.907 -10.998 -7.719 1.00 1.00 C ATOM 2408 OG1 THR A 154 7.241 -10.786 -7.289 1.00 1.00 O ATOM 2409 CG2 THR A 154 5.941 -12.158 -8.705 1.00 1.00 C ATOM 0 H THR A 154 6.801 -8.424 -7.599 1.00 1.00 H new ATOM 0 HA THR A 154 4.884 -9.946 -9.276 1.00 1.00 H new ATOM 0 HB THR A 154 5.251 -11.257 -6.888 1.00 1.00 H new ATOM 0 HG1 THR A 154 7.602 -11.619 -6.919 1.00 1.00 H new ATOM 0 HG21 THR A 154 6.378 -13.033 -8.223 1.00 1.00 H new ATOM 0 HG22 THR A 154 4.926 -12.390 -9.028 1.00 1.00 H new ATOM 0 HG23 THR A 154 6.544 -11.882 -9.570 1.00 1.00 H new ATOM 2417 N TYR A 155 2.965 -9.289 -7.832 1.00 1.00 N ATOM 2418 CA TYR A 155 1.836 -8.828 -7.033 1.00 1.00 C ATOM 2419 C TYR A 155 1.075 -10.030 -6.458 1.00 1.00 C ATOM 2420 O TYR A 155 0.702 -10.938 -7.193 1.00 1.00 O ATOM 2421 CB TYR A 155 0.893 -7.959 -7.873 1.00 1.00 C ATOM 2422 CG TYR A 155 0.350 -6.763 -7.129 1.00 1.00 C ATOM 2423 CD1 TYR A 155 -0.443 -6.923 -6.000 1.00 1.00 C ATOM 2424 CD2 TYR A 155 0.627 -5.473 -7.561 1.00 1.00 C ATOM 2425 CE1 TYR A 155 -0.945 -5.829 -5.321 1.00 1.00 C ATOM 2426 CE2 TYR A 155 0.129 -4.373 -6.887 1.00 1.00 C ATOM 2427 CZ TYR A 155 -0.656 -4.556 -5.768 1.00 1.00 C ATOM 2428 OH TYR A 155 -1.150 -3.467 -5.084 1.00 1.00 O ATOM 0 H TYR A 155 2.714 -9.676 -8.742 1.00 1.00 H new ATOM 0 HA TYR A 155 2.219 -8.222 -6.212 1.00 1.00 H new ATOM 0 HB2 TYR A 155 1.424 -7.614 -8.760 1.00 1.00 H new ATOM 0 HB3 TYR A 155 0.060 -8.571 -8.218 1.00 1.00 H new ATOM 0 HD1 TYR A 155 -0.671 -7.918 -5.647 1.00 1.00 H new ATOM 0 HD2 TYR A 155 1.241 -5.326 -8.437 1.00 1.00 H new ATOM 0 HE1 TYR A 155 -1.560 -5.970 -4.445 1.00 1.00 H new ATOM 0 HE2 TYR A 155 0.354 -3.376 -7.235 1.00 1.00 H new ATOM 0 HH TYR A 155 -0.856 -2.643 -5.525 1.00 1.00 H new ATOM 2438 N GLU A 156 0.862 -10.011 -5.147 1.00 1.00 N ATOM 2439 CA GLU A 156 0.158 -11.089 -4.475 1.00 1.00 C ATOM 2440 C GLU A 156 -0.854 -10.553 -3.459 1.00 1.00 C ATOM 2441 O GLU A 156 -0.629 -9.519 -2.817 1.00 1.00 O ATOM 2442 CB GLU A 156 1.160 -12.020 -3.781 1.00 1.00 C ATOM 2443 CG GLU A 156 2.138 -12.679 -4.739 1.00 1.00 C ATOM 2444 CD GLU A 156 2.987 -13.728 -4.060 1.00 1.00 C ATOM 2445 OE1 GLU A 156 2.560 -14.233 -3.000 1.00 1.00 O ATOM 2446 OE2 GLU A 156 4.073 -14.052 -4.585 1.00 1.00 O ATOM 0 H GLU A 156 1.169 -9.258 -4.531 1.00 1.00 H new ATOM 0 HA GLU A 156 -0.393 -11.650 -5.230 1.00 1.00 H new ATOM 0 HB2 GLU A 156 1.719 -11.451 -3.038 1.00 1.00 H new ATOM 0 HB3 GLU A 156 0.613 -12.794 -3.243 1.00 1.00 H new ATOM 0 HG2 GLU A 156 1.586 -13.137 -5.560 1.00 1.00 H new ATOM 0 HG3 GLU A 156 2.785 -11.918 -5.175 1.00 1.00 H new ATOM 2453 N VAL A 157 -1.964 -11.267 -3.302 1.00 1.00 N ATOM 2454 CA VAL A 157 -2.997 -10.873 -2.355 1.00 1.00 C ATOM 2455 C VAL A 157 -3.193 -11.963 -1.299 1.00 1.00 C ATOM 2456 O VAL A 157 -3.331 -13.142 -1.644 1.00 1.00 O ATOM 2457 CB VAL A 157 -4.339 -10.589 -3.051 1.00 1.00 C ATOM 2458 CG1 VAL A 157 -5.410 -10.250 -2.024 1.00 1.00 C ATOM 2459 CG2 VAL A 157 -4.180 -9.468 -4.062 1.00 1.00 C ATOM 0 H VAL A 157 -2.170 -12.122 -3.819 1.00 1.00 H new ATOM 0 HA VAL A 157 -2.661 -9.952 -1.879 1.00 1.00 H new ATOM 0 HB VAL A 157 -4.655 -11.486 -3.584 1.00 1.00 H new ATOM 0 HG11 VAL A 157 -6.353 -10.052 -2.534 1.00 1.00 H new ATOM 0 HG12 VAL A 157 -5.537 -11.089 -1.340 1.00 1.00 H new ATOM 0 HG13 VAL A 157 -5.108 -9.366 -1.462 1.00 1.00 H new ATOM 0 HG21 VAL A 157 -5.137 -9.277 -4.547 1.00 1.00 H new ATOM 0 HG22 VAL A 157 -3.845 -8.564 -3.553 1.00 1.00 H new ATOM 0 HG23 VAL A 157 -3.444 -9.756 -4.812 1.00 1.00 H new ATOM 2469 N TRP A 158 -3.176 -11.565 -0.025 1.00 1.00 N ATOM 2470 CA TRP A 158 -3.340 -12.510 1.068 1.00 1.00 C ATOM 2471 C TRP A 158 -4.628 -12.272 1.848 1.00 1.00 C ATOM 2472 O TRP A 158 -5.074 -11.139 2.019 1.00 1.00 O ATOM 2473 CB TRP A 158 -2.136 -12.465 2.015 1.00 1.00 C ATOM 2474 CG TRP A 158 -0.831 -12.676 1.314 1.00 1.00 C ATOM 2475 CD1 TRP A 158 -0.308 -11.897 0.323 1.00 1.00 C ATOM 2476 CD2 TRP A 158 0.114 -13.729 1.539 1.00 1.00 C ATOM 2477 NE1 TRP A 158 0.903 -12.403 -0.085 1.00 1.00 N ATOM 2478 CE2 TRP A 158 1.184 -13.527 0.646 1.00 1.00 C ATOM 2479 CE3 TRP A 158 0.159 -14.824 2.407 1.00 1.00 C ATOM 2480 CZ2 TRP A 158 2.285 -14.379 0.599 1.00 1.00 C ATOM 2481 CZ3 TRP A 158 1.252 -15.668 2.359 1.00 1.00 C ATOM 2482 CH2 TRP A 158 2.302 -15.442 1.460 1.00 1.00 C ATOM 0 H TRP A 158 -3.050 -10.596 0.269 1.00 1.00 H new ATOM 0 HA TRP A 158 -3.404 -13.501 0.619 1.00 1.00 H new ATOM 0 HB2 TRP A 158 -2.117 -11.501 2.524 1.00 1.00 H new ATOM 0 HB3 TRP A 158 -2.257 -13.229 2.783 1.00 1.00 H new ATOM 0 HD1 TRP A 158 -0.777 -11.012 -0.081 1.00 1.00 H new ATOM 0 HE1 TRP A 158 1.496 -12.006 -0.814 1.00 1.00 H new ATOM 0 HE3 TRP A 158 -0.646 -15.007 3.103 1.00 1.00 H new ATOM 0 HZ2 TRP A 158 3.096 -14.207 -0.093 1.00 1.00 H new ATOM 0 HZ3 TRP A 158 1.297 -16.516 3.026 1.00 1.00 H new ATOM 0 HH2 TRP A 158 3.142 -16.121 1.446 1.00 1.00 H new ATOM 2493 N GLN A 159 -5.220 -13.362 2.330 1.00 1.00 N ATOM 2494 CA GLN A 159 -6.455 -13.278 3.103 1.00 1.00 C ATOM 2495 C GLN A 159 -6.414 -14.224 4.289 1.00 1.00 C ATOM 2496 O GLN A 159 -5.706 -15.217 4.251 1.00 1.00 O ATOM 2497 CB GLN A 159 -7.661 -13.592 2.210 1.00 1.00 C ATOM 2498 CG GLN A 159 -8.182 -12.377 1.463 1.00 1.00 C ATOM 2499 CD GLN A 159 -9.588 -12.007 1.873 1.00 1.00 C ATOM 2500 OE1 GLN A 159 -9.815 -10.940 2.442 1.00 1.00 O ATOM 2501 NE2 GLN A 159 -10.544 -12.884 1.586 1.00 1.00 N ATOM 0 H GLN A 159 -4.866 -14.310 2.199 1.00 1.00 H new ATOM 0 HA GLN A 159 -6.554 -12.261 3.483 1.00 1.00 H new ATOM 0 HB2 GLN A 159 -7.382 -14.361 1.490 1.00 1.00 H new ATOM 0 HB3 GLN A 159 -8.462 -14.005 2.823 1.00 1.00 H new ATOM 0 HG2 GLN A 159 -7.519 -11.531 1.644 1.00 1.00 H new ATOM 0 HG3 GLN A 159 -8.159 -12.576 0.391 1.00 1.00 H new ATOM 0 HE21 GLN A 159 -10.310 -13.757 1.113 1.00 1.00 H new ATOM 0 HE22 GLN A 159 -11.512 -12.684 1.839 1.00 1.00 H new ATOM 2510 N LYS A 160 -7.166 -13.904 5.330 1.00 1.00 N ATOM 2511 CA LYS A 160 -7.188 -14.755 6.519 1.00 1.00 C ATOM 2512 C LYS A 160 -7.850 -16.090 6.202 1.00 1.00 C ATOM 2513 O LYS A 160 -8.906 -16.127 5.571 1.00 1.00 O ATOM 2514 CB LYS A 160 -7.924 -14.060 7.666 1.00 1.00 C ATOM 2515 CG LYS A 160 -7.522 -14.568 9.034 1.00 1.00 C ATOM 2516 CD LYS A 160 -7.669 -13.492 10.105 1.00 1.00 C ATOM 2517 CE LYS A 160 -9.043 -13.549 10.746 1.00 1.00 C ATOM 2518 NZ LYS A 160 -9.163 -12.653 11.919 1.00 1.00 N ATOM 0 H LYS A 160 -7.761 -13.077 5.381 1.00 1.00 H new ATOM 0 HA LYS A 160 -6.159 -14.938 6.829 1.00 1.00 H new ATOM 0 HB2 LYS A 160 -7.733 -12.988 7.614 1.00 1.00 H new ATOM 0 HB3 LYS A 160 -8.997 -14.199 7.536 1.00 1.00 H new ATOM 0 HG2 LYS A 160 -8.137 -15.429 9.297 1.00 1.00 H new ATOM 0 HG3 LYS A 160 -6.488 -14.912 9.004 1.00 1.00 H new ATOM 0 HD2 LYS A 160 -6.902 -13.625 10.868 1.00 1.00 H new ATOM 0 HD3 LYS A 160 -7.511 -12.509 9.662 1.00 1.00 H new ATOM 0 HE2 LYS A 160 -9.796 -13.276 10.007 1.00 1.00 H new ATOM 0 HE3 LYS A 160 -9.254 -14.573 11.053 1.00 1.00 H new ATOM 0 HZ1 LYS A 160 -10.120 -12.731 12.319 1.00 1.00 H new ATOM 0 HZ2 LYS A 160 -8.464 -12.928 12.639 1.00 1.00 H new ATOM 0 HZ3 LYS A 160 -8.989 -11.671 11.625 1.00 1.00 H new ATOM 2532 N LYS A 161 -7.218 -17.184 6.645 1.00 1.00 N ATOM 2533 CA LYS A 161 -7.746 -18.516 6.410 1.00 1.00 C ATOM 2534 C LYS A 161 -9.053 -18.717 7.161 1.00 1.00 C ATOM 2535 O LYS A 161 -9.175 -18.339 8.325 1.00 1.00 O ATOM 2536 CB LYS A 161 -6.739 -19.572 6.876 1.00 1.00 C ATOM 2537 CG LYS A 161 -6.211 -19.311 8.284 1.00 1.00 C ATOM 2538 CD LYS A 161 -5.714 -20.595 8.919 1.00 1.00 C ATOM 2539 CE LYS A 161 -4.411 -21.056 8.300 1.00 1.00 C ATOM 2540 NZ LYS A 161 -3.808 -22.200 9.043 1.00 1.00 N ATOM 0 H LYS A 161 -6.342 -17.164 7.167 1.00 1.00 H new ATOM 0 HA LYS A 161 -7.926 -18.623 5.340 1.00 1.00 H new ATOM 0 HB2 LYS A 161 -7.211 -20.554 6.847 1.00 1.00 H new ATOM 0 HB3 LYS A 161 -5.901 -19.600 6.179 1.00 1.00 H new ATOM 0 HG2 LYS A 161 -5.401 -18.582 8.244 1.00 1.00 H new ATOM 0 HG3 LYS A 161 -7.000 -18.878 8.899 1.00 1.00 H new ATOM 0 HD2 LYS A 161 -5.575 -20.442 9.989 1.00 1.00 H new ATOM 0 HD3 LYS A 161 -6.468 -21.374 8.804 1.00 1.00 H new ATOM 0 HE2 LYS A 161 -4.586 -21.349 7.265 1.00 1.00 H new ATOM 0 HE3 LYS A 161 -3.706 -20.225 8.281 1.00 1.00 H new ATOM 0 HZ1 LYS A 161 -2.918 -22.482 8.584 1.00 1.00 H new ATOM 0 HZ2 LYS A 161 -3.616 -21.914 10.024 1.00 1.00 H new ATOM 0 HZ3 LYS A 161 -4.469 -23.003 9.040 1.00 1.00 H new ATOM 2554 N ALA A 162 -10.036 -19.300 6.488 1.00 1.00 N ATOM 2555 CA ALA A 162 -11.335 -19.540 7.100 1.00 1.00 C ATOM 2556 C ALA A 162 -11.804 -20.974 6.849 1.00 1.00 C ATOM 2557 O ALA A 162 -12.420 -21.563 7.752 1.00 1.00 O ATOM 2558 CB ALA A 162 -12.368 -18.559 6.561 1.00 1.00 C ATOM 2559 OXT ALA A 162 -11.565 -21.492 5.737 1.00 1.00 O ATOM 0 H ALA A 162 -9.959 -19.615 5.521 1.00 1.00 H new ATOM 0 HA ALA A 162 -11.229 -19.393 8.175 1.00 1.00 H new ATOM 0 HB1 ALA A 162 -13.333 -18.753 7.029 1.00 1.00 H new ATOM 0 HB2 ALA A 162 -12.054 -17.540 6.786 1.00 1.00 H new ATOM 0 HB3 ALA A 162 -12.457 -18.681 5.482 1.00 1.00 H new TER 2565 ALA A 162 HETATM 2566 PA NDP A 170 4.458 6.222 12.543 1.00 1.00 P HETATM 2567 O1A NDP A 170 5.176 6.618 13.772 1.00 1.00 O HETATM 2568 O2A NDP A 170 3.679 4.964 12.584 1.00 1.00 O HETATM 2569 O5B NDP A 170 3.592 7.432 11.965 1.00 1.00 O HETATM 2570 C5B NDP A 170 2.154 7.332 11.856 1.00 1.00 C HETATM 2571 C4B NDP A 170 1.507 8.613 12.325 1.00 1.00 C HETATM 2572 O4B NDP A 170 0.071 8.506 12.162 1.00 1.00 O HETATM 2573 C3B NDP A 170 1.723 8.962 13.794 1.00 1.00 C HETATM 2574 O3B NDP A 170 2.925 9.740 13.939 1.00 1.00 O HETATM 2575 C2B NDP A 170 0.493 9.801 14.102 1.00 1.00 C HETATM 2576 O2B NDP A 170 0.613 11.145 13.706 1.00 1.00 O HETATM 2577 C1B NDP A 170 -0.583 9.095 13.272 1.00 1.00 C HETATM 2578 N9A NDP A 170 -1.289 8.047 13.998 1.00 1.00 N HETATM 2579 C8A NDP A 170 -0.836 6.777 14.258 1.00 1.00 C HETATM 2580 N7A NDP A 170 -1.685 6.042 14.940 1.00 1.00 N HETATM 2581 C5A NDP A 170 -2.766 6.883 15.143 1.00 1.00 C HETATM 2582 C6A NDP A 170 -3.981 6.721 15.841 1.00 1.00 C HETATM 2583 N6A NDP A 170 -4.346 5.581 16.424 1.00 1.00 N HETATM 2584 N1A NDP A 170 -4.817 7.782 15.906 1.00 1.00 N HETATM 2585 C2A NDP A 170 -4.452 8.921 15.304 1.00 1.00 C HETATM 2586 N3A NDP A 170 -3.345 9.195 14.624 1.00 1.00 N HETATM 2587 C4A NDP A 170 -2.535 8.125 14.575 1.00 1.00 C HETATM 2588 O3 NDP A 170 5.564 6.118 11.322 1.00 1.00 O HETATM 2589 PN NDP A 170 6.739 5.049 10.893 1.00 1.00 P HETATM 2590 O1N NDP A 170 7.872 5.217 11.819 1.00 1.00 O HETATM 2591 O2N NDP A 170 6.130 3.711 10.790 1.00 1.00 O HETATM 2592 O5D NDP A 170 7.078 5.657 9.459 1.00 1.00 O HETATM 2593 C5D NDP A 170 6.242 5.363 8.321 1.00 1.00 C HETATM 2594 C4D NDP A 170 7.055 5.389 7.052 1.00 1.00 C HETATM 2595 O4D NDP A 170 7.382 4.031 6.654 1.00 1.00 O HETATM 2596 C3D NDP A 170 6.364 6.004 5.845 1.00 1.00 C HETATM 2597 O3D NDP A 170 6.622 7.405 5.820 1.00 1.00 O HETATM 2598 C2D NDP A 170 7.051 5.300 4.679 1.00 1.00 C HETATM 2599 O2D NDP A 170 8.281 5.922 4.300 1.00 1.00 O HETATM 2600 C1D NDP A 170 7.284 3.905 5.250 1.00 1.00 C HETATM 2601 N1N NDP A 170 6.213 2.947 4.954 1.00 1.00 N HETATM 2602 C2N NDP A 170 6.286 1.717 4.461 1.00 1.00 C HETATM 2603 C3N NDP A 170 5.289 0.909 4.232 1.00 1.00 C HETATM 2604 C7N NDP A 170 5.778 -0.344 3.719 1.00 1.00 C HETATM 2605 O7N NDP A 170 5.689 -1.168 4.743 1.00 1.00 O HETATM 2606 N7N NDP A 170 6.242 -0.670 2.485 1.00 1.00 N HETATM 2607 C4N NDP A 170 3.911 1.394 4.551 1.00 1.00 C HETATM 2608 C5N NDP A 170 3.762 2.711 5.082 1.00 1.00 C HETATM 2609 C6N NDP A 170 4.838 3.548 5.314 1.00 1.00 C HETATM 2610 P2B NDP A 170 1.608 12.310 14.354 1.00 1.00 P HETATM 2611 O1X NDP A 170 2.750 12.214 13.269 1.00 1.00 O HETATM 2612 O2X NDP A 170 0.772 13.568 14.102 1.00 1.00 O HETATM 2613 O3X NDP A 170 2.058 11.611 15.637 1.00 1.00 O HETATM 0 HO3N NDP A 170 7.396 7.585 5.246 1.00 1.00 H new HETATM 0 HO3A NDP A 170 2.885 10.518 13.345 1.00 1.00 H new HETATM 0 HO2N NDP A 170 8.679 5.431 3.551 1.00 1.00 H new HETATM 0 H72N NDP A 170 6.553 -1.622 2.292 1.00 1.00 H new HETATM 0 H71N NDP A 170 6.279 0.037 1.751 1.00 1.00 H new HETATM 0 H62A NDP A 170 -5.238 5.522 16.916 1.00 1.00 H new HETATM 0 H61A NDP A 170 -3.734 4.766 16.379 1.00 1.00 H new HETATM 0 H52N NDP A 170 5.780 4.384 8.444 1.00 1.00 H new HETATM 0 H52A NDP A 170 1.873 7.131 10.822 1.00 1.00 H new HETATM 0 H51N NDP A 170 5.434 6.091 8.258 1.00 1.00 H new HETATM 0 H51A NDP A 170 1.794 6.494 12.453 1.00 1.00 H new HETATM 0 H42N NDP A 170 3.318 1.335 3.638 1.00 1.00 H new HETATM 0 H41N NDP A 170 3.470 0.697 5.263 1.00 1.00 H new HETATM 0 H8A NDP A 170 0.137 6.413 13.929 1.00 1.00 H new HETATM 0 H6N NDP A 170 4.724 4.553 5.719 1.00 1.00 H new HETATM 0 H5N NDP A 170 2.760 3.071 5.314 1.00 1.00 H new HETATM 0 H4D NDP A 170 7.918 6.004 7.306 1.00 1.00 H new HETATM 0 H4B NDP A 170 1.978 9.389 11.721 1.00 1.00 H new HETATM 0 H3D NDP A 170 5.280 5.887 5.833 1.00 1.00 H new HETATM 0 H3B NDP A 170 1.838 8.101 14.452 1.00 1.00 H new HETATM 0 H2N NDP A 170 7.282 1.344 4.223 1.00 1.00 H new HETATM 0 H2D NDP A 170 6.461 5.319 3.763 1.00 1.00 H new HETATM 0 H2B NDP A 170 0.293 9.861 15.172 1.00 1.00 H new HETATM 0 H2A NDP A 170 -5.166 9.741 15.384 1.00 1.00 H new HETATM 0 H1D NDP A 170 8.189 3.515 4.785 1.00 1.00 H new HETATM 0 H1B NDP A 170 -1.331 9.836 12.990 1.00 1.00 H new