USER MOD reduce.3.24.130724 H: found=0, std=0, add=1143, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1141 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 74 HIS : no HD1:sc= -3.89! C(o=-4.2!,f=-25!) USER MOD Set 1.2: A 137 TYR OH : rot -169:sc= -0.287! USER MOD Set 2.1: A 6 SER OG : rot 32:sc= -3.62! USER MOD Set 2.2: A 125 THR OG1 : rot -116:sc= 1.81 USER MOD Set 2.3: A 126 ASN : amide:sc= -4.11! C(o=-5.9!,f=-9.1!) USER MOD Single : A 1 GLY N :NH3+ -171:sc= 0.0756 (180deg=0.064) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ -122:sc= 1.14 (180deg=-0.144) USER MOD Single : A 8 HIS : no HE2:sc= -2.31! C(o=-2.3!,f=-7.4!) USER MOD Single : A 10 LYS NZ :NH3+ 162:sc= -0.042 (180deg=-0.492) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0.0185 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot -40:sc= 0.665 USER MOD Single : A 35 GLN : amide:sc= -8.64! C(o=-8.6!,f=-13!) USER MOD Single : A 40 THR OG1 : rot 92:sc= -0.263 USER MOD Single : A 45 THR OG1 : rot 149:sc= 0.238 USER MOD Single : A 46 ASN :FLIP amide:sc= -0.51 F(o=-1.4,f=-0.51) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 170:sc= 0.0988 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -0.361 X(o=-0.36,f=-0.093) USER MOD Single : A 68 GLN :FLIP amide:sc= -0.181 F(o=-1.7!,f=-0.18) USER MOD Single : A 69 ASN : amide:sc= -5.96! C(o=-6!,f=-5.8!) USER MOD Single : A 73 TYR OH : rot -87:sc= -0.35 USER MOD Single : A 76 THR OG1 : rot 180:sc= -5.82! USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0.0211 USER MOD Single : A 91 ASN : amide:sc= -1.64! C(o=-1.6!,f=-5.1!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot -64:sc= 1.21 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= -6.91! C(o=-6.9!,f=-23!) USER MOD Single : A 99 SER OG : rot 180:sc= -0.208 USER MOD Single : A 100 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.092) USER MOD Single : A 104 LYS NZ :NH3+ -133:sc= -1.3 (180deg=-2.43!) USER MOD Single : A 107 ASN : amide:sc= -0.149 K(o=-0.15,f=-3.1!) USER MOD Single : A 109 THR OG1 : rot 74:sc= 0.302 USER MOD Single : A 113 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 116 LYS NZ :NH3+ 151:sc= -1.02 (180deg=-1.76) USER MOD Single : A 117 SER OG : rot 160:sc= -0.131 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot -99:sc= -2.85! USER MOD Single : A 123 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 124 THR OG1 : rot -2:sc= -0.0875 USER MOD Single : A 130 HIS : no HE2:sc= -12.1! C(o=-12!,f=-12!) USER MOD Single : A 134 LYS NZ :NH3+ -139:sc= -1.37 (180deg=-5.12!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -19.237 1.671 5.684 1.00 0.00 N ATOM 2 CA GLY A 1 -20.035 2.892 5.717 1.00 0.00 C ATOM 3 C GLY A 1 -19.154 4.109 5.976 1.00 0.00 C ATOM 4 O GLY A 1 -18.302 4.092 6.864 1.00 0.00 O ATOM 0 H1 GLY A 1 -19.827 0.879 5.357 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.436 1.797 5.033 1.00 0.00 H new ATOM 0 H3 GLY A 1 -18.878 1.465 6.638 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -20.561 3.013 4.770 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -20.794 2.815 6.496 1.00 0.00 H new ATOM 8 N ALA A 2 -19.362 5.162 5.193 1.00 0.00 N ATOM 9 CA ALA A 2 -18.577 6.381 5.347 1.00 0.00 C ATOM 10 C ALA A 2 -19.337 7.578 4.787 1.00 0.00 C ATOM 11 O ALA A 2 -19.935 7.494 3.714 1.00 0.00 O ATOM 12 CB ALA A 2 -17.243 6.235 4.616 1.00 0.00 C ATOM 0 H ALA A 2 -20.061 5.197 4.451 1.00 0.00 H new ATOM 0 HA ALA A 2 -18.394 6.544 6.409 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -16.661 7.149 4.735 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -16.689 5.395 5.035 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -17.426 6.057 3.556 1.00 0.00 H new ATOM 18 N MET A 3 -19.310 8.687 5.522 1.00 0.00 N ATOM 19 CA MET A 3 -20.000 9.898 5.091 1.00 0.00 C ATOM 20 C MET A 3 -19.007 11.023 4.824 1.00 0.00 C ATOM 21 O MET A 3 -19.394 12.178 4.644 1.00 0.00 O ATOM 22 CB MET A 3 -20.997 10.339 6.166 1.00 0.00 C ATOM 23 CG MET A 3 -22.105 11.180 5.528 1.00 0.00 C ATOM 24 SD MET A 3 -23.536 10.126 5.182 1.00 0.00 S ATOM 25 CE MET A 3 -24.798 11.225 5.869 1.00 0.00 C ATOM 0 H MET A 3 -18.821 8.771 6.413 1.00 0.00 H new ATOM 0 HA MET A 3 -20.532 9.677 4.166 1.00 0.00 H new ATOM 0 HB2 MET A 3 -21.427 9.466 6.657 1.00 0.00 H new ATOM 0 HB3 MET A 3 -20.485 10.918 6.935 1.00 0.00 H new ATOM 0 HG2 MET A 3 -22.391 11.992 6.196 1.00 0.00 H new ATOM 0 HG3 MET A 3 -21.745 11.637 4.606 1.00 0.00 H new ATOM 0 HE1 MET A 3 -25.780 10.764 5.760 1.00 0.00 H new ATOM 0 HE2 MET A 3 -24.594 11.398 6.926 1.00 0.00 H new ATOM 0 HE3 MET A 3 -24.782 12.176 5.336 1.00 0.00 H new ATOM 35 N GLU A 4 -17.727 10.679 4.795 1.00 0.00 N ATOM 36 CA GLU A 4 -16.682 11.667 4.546 1.00 0.00 C ATOM 37 C GLU A 4 -15.574 11.070 3.686 1.00 0.00 C ATOM 38 O GLU A 4 -14.395 11.161 4.025 1.00 0.00 O ATOM 39 CB GLU A 4 -16.094 12.150 5.869 1.00 0.00 C ATOM 40 CG GLU A 4 -16.974 13.258 6.449 1.00 0.00 C ATOM 41 CD GLU A 4 -16.462 13.666 7.827 1.00 0.00 C ATOM 42 OE1 GLU A 4 -16.219 12.783 8.633 1.00 0.00 O ATOM 43 OE2 GLU A 4 -16.319 14.856 8.055 1.00 0.00 O ATOM 0 H GLU A 4 -17.386 9.729 4.940 1.00 0.00 H new ATOM 0 HA GLU A 4 -17.126 12.510 4.016 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -16.026 11.320 6.573 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -15.081 12.520 5.714 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -16.973 14.120 5.782 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -18.005 12.913 6.523 1.00 0.00 H new ATOM 50 N LYS A 5 -15.964 10.452 2.581 1.00 0.00 N ATOM 51 CA LYS A 5 -14.995 9.834 1.675 1.00 0.00 C ATOM 52 C LYS A 5 -14.182 8.768 2.407 1.00 0.00 C ATOM 53 O LYS A 5 -13.817 8.941 3.566 1.00 0.00 O ATOM 54 CB LYS A 5 -14.054 10.898 1.102 1.00 0.00 C ATOM 55 CG LYS A 5 -14.803 11.747 0.078 1.00 0.00 C ATOM 56 CD LYS A 5 -14.538 11.202 -1.325 1.00 0.00 C ATOM 57 CE LYS A 5 -15.403 11.956 -2.336 1.00 0.00 C ATOM 58 NZ LYS A 5 -16.674 11.210 -2.556 1.00 0.00 N ATOM 0 H LYS A 5 -16.937 10.363 2.287 1.00 0.00 H new ATOM 0 HA LYS A 5 -15.541 9.362 0.859 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -13.672 11.530 1.904 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -13.192 10.422 0.634 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -15.872 11.733 0.290 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -14.479 12.786 0.144 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -13.484 11.314 -1.577 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -14.763 10.136 -1.361 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -15.617 12.960 -1.970 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -14.866 12.067 -3.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -16.769 10.976 -3.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -16.663 10.333 -1.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -17.478 11.799 -2.260 1.00 0.00 H new ATOM 72 N SER A 6 -13.911 7.665 1.719 1.00 0.00 N ATOM 73 CA SER A 6 -13.148 6.567 2.309 1.00 0.00 C ATOM 74 C SER A 6 -12.062 6.095 1.349 1.00 0.00 C ATOM 75 O SER A 6 -11.831 6.711 0.308 1.00 0.00 O ATOM 76 CB SER A 6 -14.072 5.401 2.652 1.00 0.00 C ATOM 77 OG SER A 6 -14.125 5.247 4.064 1.00 0.00 O ATOM 0 H SER A 6 -14.206 7.506 0.756 1.00 0.00 H new ATOM 0 HA SER A 6 -12.679 6.931 3.223 1.00 0.00 H new ATOM 0 HB2 SER A 6 -15.071 5.584 2.256 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.708 4.484 2.188 1.00 0.00 H new ATOM 0 HG SER A 6 -14.031 6.123 4.492 1.00 0.00 H new ATOM 83 N LEU A 7 -11.390 5.003 1.708 1.00 0.00 N ATOM 84 CA LEU A 7 -10.332 4.470 0.869 1.00 0.00 C ATOM 85 C LEU A 7 -10.881 4.093 -0.506 1.00 0.00 C ATOM 86 O LEU A 7 -10.404 4.572 -1.528 1.00 0.00 O ATOM 87 CB LEU A 7 -9.726 3.234 1.530 1.00 0.00 C ATOM 88 CG LEU A 7 -8.994 3.648 2.814 1.00 0.00 C ATOM 89 CD1 LEU A 7 -8.600 2.405 3.623 1.00 0.00 C ATOM 90 CD2 LEU A 7 -7.730 4.445 2.466 1.00 0.00 C ATOM 0 H LEU A 7 -11.561 4.478 2.566 1.00 0.00 H new ATOM 0 HA LEU A 7 -9.565 5.235 0.746 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -10.509 2.512 1.762 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -9.033 2.745 0.845 1.00 0.00 H new ATOM 0 HG LEU A 7 -9.664 4.269 3.409 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -8.081 2.711 4.531 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -9.496 1.844 3.888 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -7.942 1.775 3.025 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -7.218 4.734 3.384 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.067 3.829 1.859 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -8.006 5.339 1.908 1.00 0.00 H new ATOM 102 N HIS A 8 -11.886 3.223 -0.526 1.00 0.00 N ATOM 103 CA HIS A 8 -12.475 2.791 -1.792 1.00 0.00 C ATOM 104 C HIS A 8 -12.668 3.977 -2.731 1.00 0.00 C ATOM 105 O HIS A 8 -12.020 4.068 -3.773 1.00 0.00 O ATOM 106 CB HIS A 8 -13.820 2.145 -1.505 1.00 0.00 C ATOM 107 CG HIS A 8 -13.983 0.951 -2.371 1.00 0.00 C ATOM 108 ND1 HIS A 8 -14.191 1.057 -3.728 1.00 0.00 N ATOM 109 CD2 HIS A 8 -13.975 -0.380 -2.084 1.00 0.00 C ATOM 110 CE1 HIS A 8 -14.294 -0.176 -4.218 1.00 0.00 C ATOM 111 NE2 HIS A 8 -14.169 -1.108 -3.265 1.00 0.00 N ATOM 0 H HIS A 8 -12.306 2.808 0.306 1.00 0.00 H new ATOM 0 HA HIS A 8 -11.806 2.079 -2.275 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -13.883 1.859 -0.455 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -14.625 2.856 -1.690 1.00 0.00 H new ATOM 0 HD1 HIS A 8 -14.255 1.924 -4.261 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -13.840 -0.807 -1.101 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -14.459 -0.399 -5.262 1.00 0.00 H new ATOM 120 N GLU A 9 -13.560 4.877 -2.355 1.00 0.00 N ATOM 121 CA GLU A 9 -13.833 6.065 -3.163 1.00 0.00 C ATOM 122 C GLU A 9 -12.533 6.628 -3.728 1.00 0.00 C ATOM 123 O GLU A 9 -12.453 6.963 -4.908 1.00 0.00 O ATOM 124 CB GLU A 9 -14.518 7.142 -2.314 1.00 0.00 C ATOM 125 CG GLU A 9 -15.931 6.687 -1.950 1.00 0.00 C ATOM 126 CD GLU A 9 -16.535 7.629 -0.913 1.00 0.00 C ATOM 127 OE1 GLU A 9 -16.968 8.704 -1.297 1.00 0.00 O ATOM 128 OE2 GLU A 9 -16.555 7.263 0.250 1.00 0.00 O ATOM 0 H GLU A 9 -14.109 4.813 -1.498 1.00 0.00 H new ATOM 0 HA GLU A 9 -14.492 5.776 -3.982 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -13.940 7.327 -1.408 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -14.558 8.082 -2.864 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -16.556 6.667 -2.843 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -15.904 5.671 -1.557 1.00 0.00 H new ATOM 135 N LYS A 10 -11.511 6.719 -2.884 1.00 0.00 N ATOM 136 CA LYS A 10 -10.215 7.227 -3.327 1.00 0.00 C ATOM 137 C LYS A 10 -9.709 6.428 -4.525 1.00 0.00 C ATOM 138 O LYS A 10 -9.256 6.998 -5.514 1.00 0.00 O ATOM 139 CB LYS A 10 -9.200 7.128 -2.190 1.00 0.00 C ATOM 140 CG LYS A 10 -8.038 8.093 -2.453 1.00 0.00 C ATOM 141 CD LYS A 10 -8.284 9.423 -1.736 1.00 0.00 C ATOM 142 CE LYS A 10 -7.008 10.260 -1.765 1.00 0.00 C ATOM 143 NZ LYS A 10 -6.558 10.437 -3.174 1.00 0.00 N ATOM 0 H LYS A 10 -11.552 6.452 -1.901 1.00 0.00 H new ATOM 0 HA LYS A 10 -10.336 8.270 -3.620 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -9.678 7.368 -1.240 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -8.827 6.107 -2.110 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -7.104 7.652 -2.106 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -7.932 8.263 -3.524 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -9.098 9.964 -2.219 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -8.590 9.242 -0.706 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -7.188 11.232 -1.305 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -6.227 9.771 -1.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -5.892 11.234 -3.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -6.086 9.569 -3.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -7.381 10.632 -3.779 1.00 0.00 H new ATOM 157 N LEU A 11 -9.793 5.105 -4.430 1.00 0.00 N ATOM 158 CA LEU A 11 -9.337 4.238 -5.519 1.00 0.00 C ATOM 159 C LEU A 11 -10.240 4.388 -6.740 1.00 0.00 C ATOM 160 O LEU A 11 -9.775 4.348 -7.878 1.00 0.00 O ATOM 161 CB LEU A 11 -9.338 2.780 -5.060 1.00 0.00 C ATOM 162 CG LEU A 11 -8.621 2.671 -3.712 1.00 0.00 C ATOM 163 CD1 LEU A 11 -8.642 1.217 -3.241 1.00 0.00 C ATOM 164 CD2 LEU A 11 -7.165 3.138 -3.869 1.00 0.00 C ATOM 0 H LEU A 11 -10.168 4.610 -3.621 1.00 0.00 H new ATOM 0 HA LEU A 11 -8.324 4.534 -5.792 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -10.362 2.416 -4.970 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -8.841 2.154 -5.801 1.00 0.00 H new ATOM 0 HG LEU A 11 -9.127 3.298 -2.978 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -8.132 1.138 -2.281 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -9.674 0.885 -3.131 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -8.135 0.590 -3.974 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -6.653 3.061 -2.910 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -6.659 2.510 -4.602 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -7.150 4.174 -4.206 1.00 0.00 H new ATOM 176 N LYS A 12 -11.531 4.556 -6.494 1.00 0.00 N ATOM 177 CA LYS A 12 -12.490 4.706 -7.581 1.00 0.00 C ATOM 178 C LYS A 12 -12.303 6.041 -8.292 1.00 0.00 C ATOM 179 O LYS A 12 -12.540 6.150 -9.496 1.00 0.00 O ATOM 180 CB LYS A 12 -13.911 4.624 -7.031 1.00 0.00 C ATOM 181 CG LYS A 12 -14.277 3.176 -6.693 1.00 0.00 C ATOM 182 CD LYS A 12 -15.592 3.127 -5.906 1.00 0.00 C ATOM 183 CE LYS A 12 -16.761 3.096 -6.885 1.00 0.00 C ATOM 184 NZ LYS A 12 -17.994 3.571 -6.200 1.00 0.00 N ATOM 0 H LYS A 12 -11.937 4.592 -5.559 1.00 0.00 H new ATOM 0 HA LYS A 12 -12.322 3.901 -8.297 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -13.997 5.244 -6.139 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -14.614 5.020 -7.764 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -14.373 2.595 -7.610 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -13.479 2.719 -6.108 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -15.614 2.245 -5.266 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -15.672 3.996 -5.253 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -16.545 3.727 -7.747 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -16.908 2.083 -7.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -18.792 3.550 -6.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -18.203 2.951 -5.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -17.851 4.544 -5.862 1.00 0.00 H new ATOM 198 N GLN A 13 -11.880 7.052 -7.546 1.00 0.00 N ATOM 199 CA GLN A 13 -11.669 8.374 -8.124 1.00 0.00 C ATOM 200 C GLN A 13 -10.302 8.459 -8.797 1.00 0.00 C ATOM 201 O GLN A 13 -10.141 9.142 -9.808 1.00 0.00 O ATOM 202 CB GLN A 13 -11.762 9.437 -7.029 1.00 0.00 C ATOM 203 CG GLN A 13 -12.278 10.746 -7.629 1.00 0.00 C ATOM 204 CD GLN A 13 -11.918 11.914 -6.718 1.00 0.00 C ATOM 205 OE1 GLN A 13 -10.982 12.661 -7.007 1.00 0.00 O ATOM 206 NE2 GLN A 13 -12.607 12.119 -5.629 1.00 0.00 N ATOM 0 H GLN A 13 -11.677 6.985 -6.549 1.00 0.00 H new ATOM 0 HA GLN A 13 -12.440 8.548 -8.874 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -12.430 9.100 -6.236 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -10.783 9.594 -6.576 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -11.845 10.898 -8.618 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -13.359 10.695 -7.759 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -13.382 11.499 -5.391 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -12.371 12.899 -5.015 1.00 0.00 H new ATOM 215 N ASP A 14 -9.322 7.760 -8.235 1.00 0.00 N ATOM 216 CA ASP A 14 -7.978 7.769 -8.795 1.00 0.00 C ATOM 217 C ASP A 14 -7.834 6.688 -9.861 1.00 0.00 C ATOM 218 O ASP A 14 -7.635 5.515 -9.545 1.00 0.00 O ATOM 219 CB ASP A 14 -6.954 7.531 -7.687 1.00 0.00 C ATOM 220 CG ASP A 14 -6.534 8.859 -7.066 1.00 0.00 C ATOM 221 OD1 ASP A 14 -7.316 9.407 -6.305 1.00 0.00 O ATOM 222 OD2 ASP A 14 -5.438 9.309 -7.358 1.00 0.00 O ATOM 0 H ASP A 14 -9.432 7.185 -7.400 1.00 0.00 H new ATOM 0 HA ASP A 14 -7.801 8.742 -9.254 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -7.379 6.881 -6.922 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -6.082 7.018 -8.092 1.00 0.00 H new ATOM 227 N LYS A 15 -7.930 7.094 -11.124 1.00 0.00 N ATOM 228 CA LYS A 15 -7.808 6.156 -12.232 1.00 0.00 C ATOM 229 C LYS A 15 -6.477 5.415 -12.153 1.00 0.00 C ATOM 230 O LYS A 15 -6.370 4.261 -12.566 1.00 0.00 O ATOM 231 CB LYS A 15 -7.908 6.900 -13.562 1.00 0.00 C ATOM 232 CG LYS A 15 -9.377 7.178 -13.873 1.00 0.00 C ATOM 233 CD LYS A 15 -9.973 6.010 -14.661 1.00 0.00 C ATOM 234 CE LYS A 15 -11.497 6.022 -14.523 1.00 0.00 C ATOM 235 NZ LYS A 15 -12.102 5.247 -15.643 1.00 0.00 N ATOM 0 H LYS A 15 -8.091 8.062 -11.403 1.00 0.00 H new ATOM 0 HA LYS A 15 -8.620 5.432 -12.166 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -7.351 7.836 -13.512 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -7.461 6.306 -14.359 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -9.932 7.324 -12.947 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -9.468 8.100 -14.448 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -9.692 6.086 -15.711 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -9.572 5.066 -14.291 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -11.790 5.589 -13.567 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -11.866 7.048 -14.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -13.138 5.254 -15.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -11.832 5.679 -16.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -11.759 4.266 -15.612 1.00 0.00 H new ATOM 249 N ARG A 16 -5.464 6.089 -11.614 1.00 0.00 N ATOM 250 CA ARG A 16 -4.139 5.486 -11.477 1.00 0.00 C ATOM 251 C ARG A 16 -4.248 4.110 -10.827 1.00 0.00 C ATOM 252 O ARG A 16 -3.590 3.158 -11.242 1.00 0.00 O ATOM 253 CB ARG A 16 -3.245 6.387 -10.630 1.00 0.00 C ATOM 254 CG ARG A 16 -3.125 7.758 -11.298 1.00 0.00 C ATOM 255 CD ARG A 16 -1.700 7.947 -11.808 1.00 0.00 C ATOM 256 NE ARG A 16 -1.554 9.260 -12.432 1.00 0.00 N ATOM 257 CZ ARG A 16 -0.539 9.530 -13.247 1.00 0.00 C ATOM 258 NH1 ARG A 16 0.357 8.615 -13.500 1.00 0.00 N ATOM 259 NH2 ARG A 16 -0.437 10.710 -13.798 1.00 0.00 N ATOM 0 H ARG A 16 -5.533 7.046 -11.267 1.00 0.00 H new ATOM 0 HA ARG A 16 -3.701 5.373 -12.469 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -3.662 6.494 -9.629 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -2.258 5.937 -10.518 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -3.832 7.836 -12.124 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -3.377 8.545 -10.587 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -0.995 7.849 -10.982 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -1.458 7.166 -12.528 1.00 0.00 H new ATOM 0 HE ARG A 16 -2.245 9.985 -12.238 1.00 0.00 H new ATOM 0 HH11 ARG A 16 0.279 7.692 -13.072 1.00 0.00 H new ATOM 0 HH12 ARG A 16 1.136 8.823 -14.125 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -1.137 11.426 -13.603 1.00 0.00 H new ATOM 0 HH22 ARG A 16 0.342 10.915 -14.423 1.00 0.00 H new ATOM 273 N PHE A 17 -5.088 4.022 -9.806 1.00 0.00 N ATOM 274 CA PHE A 17 -5.294 2.757 -9.091 1.00 0.00 C ATOM 275 C PHE A 17 -6.478 1.992 -9.657 1.00 0.00 C ATOM 276 O PHE A 17 -7.066 1.147 -8.981 1.00 0.00 O ATOM 277 CB PHE A 17 -5.510 3.022 -7.600 1.00 0.00 C ATOM 278 CG PHE A 17 -4.597 4.140 -7.139 1.00 0.00 C ATOM 279 CD1 PHE A 17 -3.305 4.279 -7.679 1.00 0.00 C ATOM 280 CD2 PHE A 17 -5.042 5.038 -6.161 1.00 0.00 C ATOM 281 CE1 PHE A 17 -2.474 5.313 -7.240 1.00 0.00 C ATOM 282 CE2 PHE A 17 -4.208 6.070 -5.725 1.00 0.00 C ATOM 283 CZ PHE A 17 -2.923 6.207 -6.263 1.00 0.00 C ATOM 0 H PHE A 17 -5.639 4.804 -9.450 1.00 0.00 H new ATOM 0 HA PHE A 17 -4.400 2.148 -9.223 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -6.550 3.291 -7.416 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -5.309 2.117 -7.028 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -2.956 3.587 -8.432 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -6.032 4.932 -5.743 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -1.483 5.422 -7.656 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -4.555 6.763 -4.972 1.00 0.00 H new ATOM 0 HZ PHE A 17 -2.278 7.004 -5.923 1.00 0.00 H new ATOM 293 N SER A 18 -6.814 2.278 -10.906 1.00 0.00 N ATOM 294 CA SER A 18 -7.924 1.601 -11.560 1.00 0.00 C ATOM 295 C SER A 18 -7.670 0.091 -11.617 1.00 0.00 C ATOM 296 O SER A 18 -8.548 -0.724 -11.298 1.00 0.00 O ATOM 297 CB SER A 18 -8.099 2.148 -12.979 1.00 0.00 C ATOM 298 OG SER A 18 -9.039 1.344 -13.678 1.00 0.00 O ATOM 0 H SER A 18 -6.337 2.970 -11.484 1.00 0.00 H new ATOM 0 HA SER A 18 -8.832 1.783 -10.986 1.00 0.00 H new ATOM 0 HB2 SER A 18 -8.443 3.182 -12.943 1.00 0.00 H new ATOM 0 HB3 SER A 18 -7.143 2.148 -13.502 1.00 0.00 H new ATOM 0 HG SER A 18 -9.155 1.692 -14.587 1.00 0.00 H new ATOM 304 N THR A 19 -6.460 -0.280 -12.024 1.00 0.00 N ATOM 305 CA THR A 19 -6.107 -1.690 -12.121 1.00 0.00 C ATOM 306 C THR A 19 -6.345 -2.385 -10.782 1.00 0.00 C ATOM 307 O THR A 19 -6.921 -3.475 -10.728 1.00 0.00 O ATOM 308 CB THR A 19 -4.642 -1.837 -12.539 1.00 0.00 C ATOM 309 OG1 THR A 19 -4.347 -0.888 -13.556 1.00 0.00 O ATOM 310 CG2 THR A 19 -4.404 -3.250 -13.069 1.00 0.00 C ATOM 0 H THR A 19 -5.717 0.367 -12.288 1.00 0.00 H new ATOM 0 HA THR A 19 -6.737 -2.160 -12.876 1.00 0.00 H new ATOM 0 HB THR A 19 -3.995 -1.661 -11.680 1.00 0.00 H new ATOM 0 HG1 THR A 19 -3.409 -0.978 -13.825 1.00 0.00 H new ATOM 0 HG21 THR A 19 -3.361 -3.356 -13.367 1.00 0.00 H new ATOM 0 HG22 THR A 19 -4.634 -3.975 -12.288 1.00 0.00 H new ATOM 0 HG23 THR A 19 -5.047 -3.429 -13.931 1.00 0.00 H new ATOM 318 N PHE A 20 -5.908 -1.737 -9.707 1.00 0.00 N ATOM 319 CA PHE A 20 -6.089 -2.287 -8.374 1.00 0.00 C ATOM 320 C PHE A 20 -7.559 -2.567 -8.123 1.00 0.00 C ATOM 321 O PHE A 20 -7.934 -3.642 -7.674 1.00 0.00 O ATOM 322 CB PHE A 20 -5.546 -1.313 -7.324 1.00 0.00 C ATOM 323 CG PHE A 20 -4.091 -1.629 -7.045 1.00 0.00 C ATOM 324 CD1 PHE A 20 -3.589 -1.513 -5.743 1.00 0.00 C ATOM 325 CD2 PHE A 20 -3.244 -2.045 -8.086 1.00 0.00 C ATOM 326 CE1 PHE A 20 -2.243 -1.806 -5.480 1.00 0.00 C ATOM 327 CE2 PHE A 20 -1.901 -2.337 -7.821 1.00 0.00 C ATOM 328 CZ PHE A 20 -1.402 -2.222 -6.520 1.00 0.00 C ATOM 0 H PHE A 20 -5.429 -0.837 -9.735 1.00 0.00 H new ATOM 0 HA PHE A 20 -5.536 -3.223 -8.299 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -5.645 -0.287 -7.679 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -6.128 -1.390 -6.406 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -4.239 -1.198 -4.940 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -3.629 -2.139 -9.091 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -1.855 -1.711 -4.476 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -1.249 -2.652 -8.623 1.00 0.00 H new ATOM 0 HZ PHE A 20 -0.367 -2.454 -6.317 1.00 0.00 H new ATOM 338 N LEU A 21 -8.391 -1.600 -8.439 1.00 0.00 N ATOM 339 CA LEU A 21 -9.823 -1.755 -8.245 1.00 0.00 C ATOM 340 C LEU A 21 -10.306 -3.032 -8.908 1.00 0.00 C ATOM 341 O LEU A 21 -11.160 -3.741 -8.372 1.00 0.00 O ATOM 342 CB LEU A 21 -10.564 -0.549 -8.829 1.00 0.00 C ATOM 343 CG LEU A 21 -11.784 -0.202 -7.958 1.00 0.00 C ATOM 344 CD1 LEU A 21 -12.533 0.946 -8.577 1.00 0.00 C ATOM 345 CD2 LEU A 21 -12.703 -1.419 -7.847 1.00 0.00 C ATOM 0 H LEU A 21 -8.107 -0.701 -8.829 1.00 0.00 H new ATOM 0 HA LEU A 21 -10.029 -1.814 -7.176 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -9.892 0.308 -8.885 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -10.886 -0.769 -9.847 1.00 0.00 H new ATOM 0 HG LEU A 21 -11.447 0.082 -6.961 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -13.397 1.192 -7.960 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -11.877 1.814 -8.645 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -12.868 0.666 -9.576 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -13.565 -1.169 -7.229 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -13.041 -1.711 -8.841 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -12.158 -2.246 -7.391 1.00 0.00 H new ATOM 357 N SER A 22 -9.757 -3.317 -10.078 1.00 0.00 N ATOM 358 CA SER A 22 -10.163 -4.506 -10.825 1.00 0.00 C ATOM 359 C SER A 22 -9.743 -5.804 -10.145 1.00 0.00 C ATOM 360 O SER A 22 -10.575 -6.656 -9.826 1.00 0.00 O ATOM 361 CB SER A 22 -9.555 -4.468 -12.223 1.00 0.00 C ATOM 362 OG SER A 22 -10.120 -5.515 -13.014 1.00 0.00 O ATOM 0 H SER A 22 -9.038 -2.752 -10.530 1.00 0.00 H new ATOM 0 HA SER A 22 -11.252 -4.491 -10.871 1.00 0.00 H new ATOM 0 HB2 SER A 22 -9.747 -3.501 -12.689 1.00 0.00 H new ATOM 0 HB3 SER A 22 -8.473 -4.585 -12.164 1.00 0.00 H new ATOM 0 HG SER A 22 -9.732 -5.491 -13.914 1.00 0.00 H new ATOM 368 N LEU A 23 -8.455 -5.958 -9.950 1.00 0.00 N ATOM 369 CA LEU A 23 -7.918 -7.166 -9.331 1.00 0.00 C ATOM 370 C LEU A 23 -8.314 -7.280 -7.864 1.00 0.00 C ATOM 371 O LEU A 23 -8.740 -8.348 -7.413 1.00 0.00 O ATOM 372 CB LEU A 23 -6.394 -7.176 -9.439 1.00 0.00 C ATOM 373 CG LEU A 23 -5.820 -5.803 -9.039 1.00 0.00 C ATOM 374 CD1 LEU A 23 -5.044 -5.924 -7.722 1.00 0.00 C ATOM 375 CD2 LEU A 23 -4.887 -5.303 -10.149 1.00 0.00 C ATOM 0 H LEU A 23 -7.751 -5.266 -10.208 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.340 -8.017 -9.865 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -5.982 -7.952 -8.794 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.097 -7.419 -10.459 1.00 0.00 H new ATOM 0 HG LEU A 23 -6.637 -5.094 -8.902 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.641 -4.949 -7.446 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -5.713 -6.276 -6.937 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -4.225 -6.633 -7.846 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -4.478 -4.332 -9.871 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -4.072 -6.014 -10.287 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -5.447 -5.208 -11.079 1.00 0.00 H new ATOM 387 N LEU A 24 -8.175 -6.192 -7.126 1.00 0.00 N ATOM 388 CA LEU A 24 -8.524 -6.202 -5.720 1.00 0.00 C ATOM 389 C LEU A 24 -10.003 -6.529 -5.552 1.00 0.00 C ATOM 390 O LEU A 24 -10.410 -7.090 -4.533 1.00 0.00 O ATOM 391 CB LEU A 24 -8.181 -4.845 -5.083 1.00 0.00 C ATOM 392 CG LEU A 24 -9.421 -3.937 -5.074 1.00 0.00 C ATOM 393 CD1 LEU A 24 -10.357 -4.307 -3.913 1.00 0.00 C ATOM 394 CD2 LEU A 24 -8.991 -2.495 -4.891 1.00 0.00 C ATOM 0 H LEU A 24 -7.826 -5.299 -7.475 1.00 0.00 H new ATOM 0 HA LEU A 24 -7.946 -6.973 -5.211 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -7.822 -4.993 -4.065 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -7.375 -4.367 -5.639 1.00 0.00 H new ATOM 0 HG LEU A 24 -9.945 -4.067 -6.021 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -11.228 -3.652 -3.925 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -10.680 -5.342 -4.022 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -9.828 -4.189 -2.967 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.870 -1.851 -4.885 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -8.458 -2.391 -3.946 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -8.334 -2.204 -5.711 1.00 0.00 H new ATOM 406 N GLU A 25 -10.811 -6.170 -6.549 1.00 0.00 N ATOM 407 CA GLU A 25 -12.234 -6.440 -6.477 1.00 0.00 C ATOM 408 C GLU A 25 -12.509 -7.919 -6.725 1.00 0.00 C ATOM 409 O GLU A 25 -13.417 -8.503 -6.135 1.00 0.00 O ATOM 410 CB GLU A 25 -12.965 -5.596 -7.522 1.00 0.00 C ATOM 411 CG GLU A 25 -14.358 -6.158 -7.758 1.00 0.00 C ATOM 412 CD GLU A 25 -15.250 -5.105 -8.408 1.00 0.00 C ATOM 413 OE1 GLU A 25 -14.750 -4.356 -9.233 1.00 0.00 O ATOM 414 OE2 GLU A 25 -16.423 -5.061 -8.073 1.00 0.00 O ATOM 0 H GLU A 25 -10.505 -5.699 -7.401 1.00 0.00 H new ATOM 0 HA GLU A 25 -12.593 -6.182 -5.481 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -13.033 -4.562 -7.184 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -12.403 -5.590 -8.456 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -14.299 -7.039 -8.397 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -14.793 -6.479 -6.812 1.00 0.00 H new ATOM 421 N ALA A 26 -11.713 -8.518 -7.597 1.00 0.00 N ATOM 422 CA ALA A 26 -11.877 -9.932 -7.915 1.00 0.00 C ATOM 423 C ALA A 26 -11.487 -10.799 -6.723 1.00 0.00 C ATOM 424 O ALA A 26 -12.122 -11.817 -6.449 1.00 0.00 O ATOM 425 CB ALA A 26 -11.012 -10.300 -9.120 1.00 0.00 C ATOM 0 H ALA A 26 -10.953 -8.054 -8.094 1.00 0.00 H new ATOM 0 HA ALA A 26 -12.926 -10.112 -8.152 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -11.140 -11.358 -9.351 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -11.313 -9.702 -9.980 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -9.965 -10.103 -8.890 1.00 0.00 H new ATOM 431 N ALA A 27 -10.441 -10.385 -6.015 1.00 0.00 N ATOM 432 CA ALA A 27 -9.974 -11.133 -4.852 1.00 0.00 C ATOM 433 C ALA A 27 -10.913 -10.921 -3.677 1.00 0.00 C ATOM 434 O ALA A 27 -10.772 -11.567 -2.640 1.00 0.00 O ATOM 435 CB ALA A 27 -8.565 -10.685 -4.466 1.00 0.00 C ATOM 0 H ALA A 27 -9.904 -9.543 -6.223 1.00 0.00 H new ATOM 0 HA ALA A 27 -9.956 -12.192 -5.109 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -8.229 -11.251 -3.597 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -7.886 -10.862 -5.300 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -8.574 -9.622 -4.225 1.00 0.00 H new ATOM 441 N ASP A 28 -11.880 -10.013 -3.844 1.00 0.00 N ATOM 442 CA ASP A 28 -12.844 -9.733 -2.783 1.00 0.00 C ATOM 443 C ASP A 28 -12.205 -8.896 -1.683 1.00 0.00 C ATOM 444 O ASP A 28 -12.383 -9.178 -0.496 1.00 0.00 O ATOM 445 CB ASP A 28 -13.379 -11.044 -2.190 1.00 0.00 C ATOM 446 CG ASP A 28 -13.414 -12.133 -3.259 1.00 0.00 C ATOM 447 OD1 ASP A 28 -12.851 -13.189 -3.019 1.00 0.00 O ATOM 448 OD2 ASP A 28 -13.993 -11.892 -4.305 1.00 0.00 O ATOM 0 H ASP A 28 -12.013 -9.466 -4.695 1.00 0.00 H new ATOM 0 HA ASP A 28 -13.672 -9.171 -3.216 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -12.747 -11.360 -1.360 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -14.380 -10.887 -1.788 1.00 0.00 H new ATOM 453 N LEU A 29 -11.450 -7.873 -2.090 1.00 0.00 N ATOM 454 CA LEU A 29 -10.768 -7.003 -1.134 1.00 0.00 C ATOM 455 C LEU A 29 -11.382 -5.611 -1.110 1.00 0.00 C ATOM 456 O LEU A 29 -10.756 -4.638 -0.691 1.00 0.00 O ATOM 457 CB LEU A 29 -9.279 -6.906 -1.472 1.00 0.00 C ATOM 458 CG LEU A 29 -8.516 -8.032 -0.768 1.00 0.00 C ATOM 459 CD1 LEU A 29 -8.397 -7.761 0.734 1.00 0.00 C ATOM 460 CD2 LEU A 29 -9.235 -9.368 -0.987 1.00 0.00 C ATOM 0 H LEU A 29 -11.297 -7.629 -3.069 1.00 0.00 H new ATOM 0 HA LEU A 29 -10.887 -7.444 -0.144 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -9.136 -6.975 -2.550 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -8.888 -5.938 -1.160 1.00 0.00 H new ATOM 0 HG LEU A 29 -7.514 -8.078 -1.195 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -7.851 -8.576 1.209 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -7.862 -6.825 0.894 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -9.393 -7.689 1.171 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -8.686 -10.164 -0.483 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -10.244 -9.309 -0.579 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -9.287 -9.583 -2.054 1.00 0.00 H new ATOM 472 N LYS A 30 -12.609 -5.536 -1.553 1.00 0.00 N ATOM 473 CA LYS A 30 -13.336 -4.281 -1.596 1.00 0.00 C ATOM 474 C LYS A 30 -14.261 -4.149 -0.388 1.00 0.00 C ATOM 475 O LYS A 30 -14.647 -3.042 -0.013 1.00 0.00 O ATOM 476 CB LYS A 30 -14.165 -4.192 -2.887 1.00 0.00 C ATOM 477 CG LYS A 30 -14.732 -5.567 -3.296 1.00 0.00 C ATOM 478 CD LYS A 30 -16.122 -5.739 -2.695 1.00 0.00 C ATOM 479 CE LYS A 30 -16.489 -7.220 -2.702 1.00 0.00 C ATOM 480 NZ LYS A 30 -17.952 -7.360 -2.935 1.00 0.00 N ATOM 0 H LYS A 30 -13.138 -6.338 -1.895 1.00 0.00 H new ATOM 0 HA LYS A 30 -12.610 -3.468 -1.574 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -14.985 -3.488 -2.745 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -13.544 -3.800 -3.692 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -14.781 -5.644 -4.382 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -14.073 -6.363 -2.949 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -16.142 -5.351 -1.676 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -16.853 -5.168 -3.268 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -15.933 -7.741 -3.481 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -16.214 -7.680 -1.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -18.208 -8.368 -2.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -18.472 -6.875 -2.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -18.200 -6.935 -3.851 1.00 0.00 H new ATOM 494 N GLU A 31 -14.624 -5.286 0.208 1.00 0.00 N ATOM 495 CA GLU A 31 -15.520 -5.269 1.362 1.00 0.00 C ATOM 496 C GLU A 31 -14.808 -4.715 2.592 1.00 0.00 C ATOM 497 O GLU A 31 -15.126 -3.643 3.076 1.00 0.00 O ATOM 498 CB GLU A 31 -15.992 -6.694 1.657 1.00 0.00 C ATOM 499 CG GLU A 31 -17.515 -6.763 1.550 1.00 0.00 C ATOM 500 CD GLU A 31 -17.990 -8.192 1.790 1.00 0.00 C ATOM 501 OE1 GLU A 31 -17.178 -9.095 1.673 1.00 0.00 O ATOM 502 OE2 GLU A 31 -19.161 -8.363 2.088 1.00 0.00 O ATOM 0 H GLU A 31 -14.317 -6.214 -0.084 1.00 0.00 H new ATOM 0 HA GLU A 31 -16.371 -4.629 1.131 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -15.536 -7.391 0.954 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -15.674 -6.994 2.655 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -17.970 -6.092 2.279 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -17.834 -6.426 0.564 1.00 0.00 H new ATOM 509 N LEU A 32 -13.814 -5.434 3.067 1.00 0.00 N ATOM 510 CA LEU A 32 -13.042 -4.990 4.219 1.00 0.00 C ATOM 511 C LEU A 32 -12.483 -3.590 3.977 1.00 0.00 C ATOM 512 O LEU A 32 -12.035 -2.919 4.906 1.00 0.00 O ATOM 513 CB LEU A 32 -11.900 -5.977 4.511 1.00 0.00 C ATOM 514 CG LEU A 32 -10.685 -5.698 3.607 1.00 0.00 C ATOM 515 CD1 LEU A 32 -9.510 -6.553 4.051 1.00 0.00 C ATOM 516 CD2 LEU A 32 -11.041 -6.041 2.160 1.00 0.00 C ATOM 0 H LEU A 32 -13.518 -6.329 2.677 1.00 0.00 H new ATOM 0 HA LEU A 32 -13.702 -4.956 5.086 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -11.605 -5.898 5.557 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -12.248 -6.998 4.354 1.00 0.00 H new ATOM 0 HG LEU A 32 -10.415 -4.645 3.680 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -8.652 -6.353 3.409 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -9.255 -6.313 5.083 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -9.779 -7.607 3.979 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -10.183 -5.844 1.518 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -11.311 -7.095 2.092 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -11.883 -5.429 1.838 1.00 0.00 H new ATOM 528 N LEU A 33 -12.455 -3.181 2.716 1.00 0.00 N ATOM 529 CA LEU A 33 -11.896 -1.884 2.359 1.00 0.00 C ATOM 530 C LEU A 33 -12.880 -0.765 2.639 1.00 0.00 C ATOM 531 O LEU A 33 -12.499 0.295 3.134 1.00 0.00 O ATOM 532 CB LEU A 33 -11.517 -1.874 0.871 1.00 0.00 C ATOM 533 CG LEU A 33 -10.014 -1.642 0.695 1.00 0.00 C ATOM 534 CD1 LEU A 33 -9.652 -0.259 1.222 1.00 0.00 C ATOM 535 CD2 LEU A 33 -9.235 -2.712 1.459 1.00 0.00 C ATOM 0 H LEU A 33 -12.810 -3.723 1.928 1.00 0.00 H new ATOM 0 HA LEU A 33 -11.008 -1.719 2.969 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -11.799 -2.822 0.413 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -12.073 -1.092 0.355 1.00 0.00 H new ATOM 0 HG LEU A 33 -9.756 -1.704 -0.362 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.582 -0.091 1.098 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.205 0.498 0.666 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -9.909 -0.194 2.279 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -8.166 -2.544 1.332 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -9.487 -2.659 2.518 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -9.496 -3.697 1.073 1.00 0.00 H new ATOM 547 N THR A 34 -14.140 -1.003 2.315 1.00 0.00 N ATOM 548 CA THR A 34 -15.169 0.002 2.531 1.00 0.00 C ATOM 549 C THR A 34 -15.702 -0.075 3.954 1.00 0.00 C ATOM 550 O THR A 34 -16.683 0.587 4.299 1.00 0.00 O ATOM 551 CB THR A 34 -16.308 -0.199 1.526 1.00 0.00 C ATOM 552 OG1 THR A 34 -17.229 0.874 1.637 1.00 0.00 O ATOM 553 CG2 THR A 34 -17.023 -1.519 1.801 1.00 0.00 C ATOM 0 H THR A 34 -14.474 -1.875 1.905 1.00 0.00 H new ATOM 0 HA THR A 34 -14.732 0.990 2.383 1.00 0.00 H new ATOM 0 HB THR A 34 -15.895 -0.224 0.518 1.00 0.00 H new ATOM 0 HG1 THR A 34 -17.349 1.106 2.582 1.00 0.00 H new ATOM 0 HG21 THR A 34 -17.831 -1.652 1.081 1.00 0.00 H new ATOM 0 HG22 THR A 34 -16.315 -2.343 1.708 1.00 0.00 H new ATOM 0 HG23 THR A 34 -17.435 -1.506 2.810 1.00 0.00 H new ATOM 561 N GLN A 35 -15.057 -0.895 4.776 1.00 0.00 N ATOM 562 CA GLN A 35 -15.486 -1.052 6.155 1.00 0.00 C ATOM 563 C GLN A 35 -14.865 0.026 7.039 1.00 0.00 C ATOM 564 O GLN A 35 -13.845 0.612 6.683 1.00 0.00 O ATOM 565 CB GLN A 35 -15.089 -2.435 6.675 1.00 0.00 C ATOM 566 CG GLN A 35 -16.300 -3.365 6.616 1.00 0.00 C ATOM 567 CD GLN A 35 -16.846 -3.435 5.195 1.00 0.00 C ATOM 568 OE1 GLN A 35 -17.394 -2.461 4.684 1.00 0.00 O ATOM 569 NE2 GLN A 35 -16.748 -4.546 4.525 1.00 0.00 N ATOM 0 H GLN A 35 -14.245 -1.454 4.513 1.00 0.00 H new ATOM 0 HA GLN A 35 -16.571 -0.951 6.189 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -14.275 -2.841 6.075 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -14.724 -2.360 7.699 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -16.018 -4.362 6.954 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -17.075 -3.007 7.293 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -16.294 -5.357 4.945 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -17.125 -4.606 3.579 1.00 0.00 H new ATOM 578 N PRO A 36 -15.456 0.299 8.176 1.00 0.00 N ATOM 579 CA PRO A 36 -14.942 1.332 9.118 1.00 0.00 C ATOM 580 C PRO A 36 -13.828 0.803 10.019 1.00 0.00 C ATOM 581 O PRO A 36 -14.033 -0.138 10.785 1.00 0.00 O ATOM 582 CB PRO A 36 -16.179 1.685 9.937 1.00 0.00 C ATOM 583 CG PRO A 36 -16.989 0.431 9.981 1.00 0.00 C ATOM 584 CD PRO A 36 -16.679 -0.341 8.702 1.00 0.00 C ATOM 0 HA PRO A 36 -14.494 2.180 8.599 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -15.907 2.014 10.940 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -16.738 2.499 9.476 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -16.737 -0.161 10.861 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -18.053 0.660 10.046 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -16.518 -1.400 8.906 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -17.501 -0.275 7.989 1.00 0.00 H new ATOM 592 N GLY A 37 -12.650 1.418 9.929 1.00 0.00 N ATOM 593 CA GLY A 37 -11.522 1.002 10.749 1.00 0.00 C ATOM 594 C GLY A 37 -10.319 1.898 10.498 1.00 0.00 C ATOM 595 O GLY A 37 -10.449 2.963 9.905 1.00 0.00 O ATOM 0 H GLY A 37 -12.456 2.199 9.302 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -11.798 1.041 11.803 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -11.264 -0.033 10.525 1.00 0.00 H new ATOM 599 N ASP A 38 -9.157 1.460 10.957 1.00 0.00 N ATOM 600 CA ASP A 38 -7.929 2.229 10.770 1.00 0.00 C ATOM 601 C ASP A 38 -6.762 1.310 10.424 1.00 0.00 C ATOM 602 O ASP A 38 -6.340 0.494 11.243 1.00 0.00 O ATOM 603 CB ASP A 38 -7.601 3.012 12.040 1.00 0.00 C ATOM 604 CG ASP A 38 -8.508 2.563 13.178 1.00 0.00 C ATOM 605 OD1 ASP A 38 -8.603 1.366 13.396 1.00 0.00 O ATOM 606 OD2 ASP A 38 -9.096 3.421 13.814 1.00 0.00 O ATOM 0 H ASP A 38 -9.035 0.581 11.460 1.00 0.00 H new ATOM 0 HA ASP A 38 -8.086 2.923 9.945 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -6.557 2.857 12.313 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -7.729 4.080 11.862 1.00 0.00 H new ATOM 611 N TRP A 39 -6.231 1.462 9.217 1.00 0.00 N ATOM 612 CA TRP A 39 -5.104 0.647 8.784 1.00 0.00 C ATOM 613 C TRP A 39 -4.254 1.408 7.774 1.00 0.00 C ATOM 614 O TRP A 39 -4.664 2.460 7.281 1.00 0.00 O ATOM 615 CB TRP A 39 -5.596 -0.653 8.145 1.00 0.00 C ATOM 616 CG TRP A 39 -6.996 -0.952 8.573 1.00 0.00 C ATOM 617 CD1 TRP A 39 -7.351 -1.462 9.774 1.00 0.00 C ATOM 618 CD2 TRP A 39 -8.230 -0.804 7.811 1.00 0.00 C ATOM 619 NE1 TRP A 39 -8.725 -1.626 9.803 1.00 0.00 N ATOM 620 CE2 TRP A 39 -9.311 -1.234 8.615 1.00 0.00 C ATOM 621 CE3 TRP A 39 -8.512 -0.334 6.515 1.00 0.00 C ATOM 622 CZ2 TRP A 39 -10.624 -1.207 8.147 1.00 0.00 C ATOM 623 CZ3 TRP A 39 -9.834 -0.304 6.044 1.00 0.00 C ATOM 624 CH2 TRP A 39 -10.887 -0.740 6.858 1.00 0.00 C ATOM 0 H TRP A 39 -6.560 2.136 8.526 1.00 0.00 H new ATOM 0 HA TRP A 39 -4.502 0.413 9.662 1.00 0.00 H new ATOM 0 HB2 TRP A 39 -5.552 -0.570 7.059 1.00 0.00 H new ATOM 0 HB3 TRP A 39 -4.940 -1.475 8.429 1.00 0.00 H new ATOM 0 HD1 TRP A 39 -6.673 -1.702 10.579 1.00 0.00 H new ATOM 0 HE1 TRP A 39 -9.241 -1.991 10.603 1.00 0.00 H new ATOM 0 HE3 TRP A 39 -7.707 0.005 5.880 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 -11.433 -1.545 8.778 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 -10.040 0.058 5.048 1.00 0.00 H new ATOM 0 HH2 TRP A 39 -11.902 -0.715 6.489 1.00 0.00 H new ATOM 635 N THR A 40 -3.075 0.868 7.469 1.00 0.00 N ATOM 636 CA THR A 40 -2.177 1.507 6.510 1.00 0.00 C ATOM 637 C THR A 40 -1.894 0.568 5.345 1.00 0.00 C ATOM 638 O THR A 40 -1.632 -0.619 5.543 1.00 0.00 O ATOM 639 CB THR A 40 -0.859 1.891 7.190 1.00 0.00 C ATOM 640 OG1 THR A 40 -1.135 2.472 8.456 1.00 0.00 O ATOM 641 CG2 THR A 40 -0.098 2.895 6.318 1.00 0.00 C ATOM 0 H THR A 40 -2.722 -0.002 7.868 1.00 0.00 H new ATOM 0 HA THR A 40 -2.661 2.408 6.134 1.00 0.00 H new ATOM 0 HB THR A 40 -0.247 0.999 7.323 1.00 0.00 H new ATOM 0 HG1 THR A 40 -1.127 1.775 9.145 1.00 0.00 H new ATOM 0 HG21 THR A 40 0.838 3.165 6.806 1.00 0.00 H new ATOM 0 HG22 THR A 40 0.115 2.446 5.348 1.00 0.00 H new ATOM 0 HG23 THR A 40 -0.705 3.789 6.179 1.00 0.00 H new ATOM 649 N LEU A 41 -1.959 1.105 4.131 1.00 0.00 N ATOM 650 CA LEU A 41 -1.714 0.305 2.936 1.00 0.00 C ATOM 651 C LEU A 41 -0.702 0.994 2.019 1.00 0.00 C ATOM 652 O LEU A 41 -0.725 2.218 1.848 1.00 0.00 O ATOM 653 CB LEU A 41 -3.034 0.086 2.189 1.00 0.00 C ATOM 654 CG LEU A 41 -3.418 1.365 1.436 1.00 0.00 C ATOM 655 CD1 LEU A 41 -2.905 1.310 -0.010 1.00 0.00 C ATOM 656 CD2 LEU A 41 -4.938 1.515 1.415 1.00 0.00 C ATOM 0 H LEU A 41 -2.178 2.084 3.949 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.300 -0.658 3.237 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -2.934 -0.744 1.489 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -3.821 -0.184 2.893 1.00 0.00 H new ATOM 0 HG LEU A 41 -2.966 2.215 1.947 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -3.186 2.225 -0.531 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -1.819 1.213 -0.007 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -3.345 0.453 -0.520 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -5.206 2.425 0.879 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.382 0.655 0.914 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -5.312 1.572 2.437 1.00 0.00 H new ATOM 668 N PHE A 42 0.173 0.198 1.416 1.00 0.00 N ATOM 669 CA PHE A 42 1.178 0.734 0.509 1.00 0.00 C ATOM 670 C PHE A 42 0.770 0.481 -0.936 1.00 0.00 C ATOM 671 O PHE A 42 1.019 -0.593 -1.486 1.00 0.00 O ATOM 672 CB PHE A 42 2.530 0.085 0.778 1.00 0.00 C ATOM 673 CG PHE A 42 3.304 0.926 1.767 1.00 0.00 C ATOM 674 CD1 PHE A 42 2.696 1.343 2.959 1.00 0.00 C ATOM 675 CD2 PHE A 42 4.629 1.285 1.495 1.00 0.00 C ATOM 676 CE1 PHE A 42 3.418 2.119 3.877 1.00 0.00 C ATOM 677 CE2 PHE A 42 5.346 2.059 2.413 1.00 0.00 C ATOM 678 CZ PHE A 42 4.742 2.471 3.604 1.00 0.00 C ATOM 0 H PHE A 42 0.207 -0.814 1.538 1.00 0.00 H new ATOM 0 HA PHE A 42 1.257 1.808 0.676 1.00 0.00 H new ATOM 0 HB2 PHE A 42 2.390 -0.922 1.171 1.00 0.00 H new ATOM 0 HB3 PHE A 42 3.091 -0.011 -0.152 1.00 0.00 H new ATOM 0 HD1 PHE A 42 1.673 1.067 3.170 1.00 0.00 H new ATOM 0 HD2 PHE A 42 5.098 0.964 0.576 1.00 0.00 H new ATOM 0 HE1 PHE A 42 2.951 2.444 4.795 1.00 0.00 H new ATOM 0 HE2 PHE A 42 6.367 2.339 2.201 1.00 0.00 H new ATOM 0 HZ PHE A 42 5.300 3.063 4.315 1.00 0.00 H new ATOM 688 N VAL A 43 0.129 1.472 -1.537 1.00 0.00 N ATOM 689 CA VAL A 43 -0.328 1.343 -2.912 1.00 0.00 C ATOM 690 C VAL A 43 0.683 1.935 -3.907 1.00 0.00 C ATOM 691 O VAL A 43 0.889 3.147 -3.939 1.00 0.00 O ATOM 692 CB VAL A 43 -1.675 2.044 -3.099 1.00 0.00 C ATOM 693 CG1 VAL A 43 -1.603 3.490 -2.619 1.00 0.00 C ATOM 694 CG2 VAL A 43 -2.068 2.028 -4.581 1.00 0.00 C ATOM 0 H VAL A 43 -0.085 2.368 -1.098 1.00 0.00 H new ATOM 0 HA VAL A 43 -0.433 0.277 -3.113 1.00 0.00 H new ATOM 0 HB VAL A 43 -2.421 1.511 -2.510 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -2.572 3.969 -2.761 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.340 3.510 -1.561 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.845 4.026 -3.191 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -3.028 2.528 -4.708 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -1.308 2.547 -5.165 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.148 0.997 -4.925 1.00 0.00 H new ATOM 704 N PRO A 44 1.308 1.125 -4.728 1.00 0.00 N ATOM 705 CA PRO A 44 2.279 1.614 -5.747 1.00 0.00 C ATOM 706 C PRO A 44 1.574 2.178 -6.977 1.00 0.00 C ATOM 707 O PRO A 44 0.514 1.690 -7.373 1.00 0.00 O ATOM 708 CB PRO A 44 3.079 0.363 -6.100 1.00 0.00 C ATOM 709 CG PRO A 44 2.147 -0.775 -5.870 1.00 0.00 C ATOM 710 CD PRO A 44 1.177 -0.342 -4.782 1.00 0.00 C ATOM 0 HA PRO A 44 2.898 2.431 -5.376 1.00 0.00 H new ATOM 0 HB2 PRO A 44 3.417 0.391 -7.136 1.00 0.00 H new ATOM 0 HB3 PRO A 44 3.969 0.276 -5.476 1.00 0.00 H new ATOM 0 HG2 PRO A 44 1.612 -1.027 -6.786 1.00 0.00 H new ATOM 0 HG3 PRO A 44 2.695 -1.667 -5.566 1.00 0.00 H new ATOM 0 HD2 PRO A 44 0.156 -0.640 -5.020 1.00 0.00 H new ATOM 0 HD3 PRO A 44 1.427 -0.798 -3.824 1.00 0.00 H new ATOM 718 N THR A 45 2.162 3.209 -7.577 1.00 0.00 N ATOM 719 CA THR A 45 1.571 3.824 -8.762 1.00 0.00 C ATOM 720 C THR A 45 1.792 2.952 -9.991 1.00 0.00 C ATOM 721 O THR A 45 2.754 2.191 -10.058 1.00 0.00 O ATOM 722 CB THR A 45 2.192 5.203 -8.992 1.00 0.00 C ATOM 723 OG1 THR A 45 3.512 5.216 -8.464 1.00 0.00 O ATOM 724 CG2 THR A 45 1.352 6.274 -8.293 1.00 0.00 C ATOM 0 H THR A 45 3.037 3.632 -7.267 1.00 0.00 H new ATOM 0 HA THR A 45 0.498 3.928 -8.599 1.00 0.00 H new ATOM 0 HB THR A 45 2.221 5.413 -10.061 1.00 0.00 H new ATOM 0 HG1 THR A 45 4.071 5.820 -8.996 1.00 0.00 H new ATOM 0 HG21 THR A 45 1.799 7.254 -8.460 1.00 0.00 H new ATOM 0 HG22 THR A 45 0.340 6.263 -8.697 1.00 0.00 H new ATOM 0 HG23 THR A 45 1.318 6.069 -7.223 1.00 0.00 H new ATOM 732 N ASN A 46 0.892 3.069 -10.963 1.00 0.00 N ATOM 733 CA ASN A 46 1.002 2.286 -12.188 1.00 0.00 C ATOM 734 C ASN A 46 2.409 2.404 -12.767 1.00 0.00 C ATOM 735 O ASN A 46 2.937 1.452 -13.338 1.00 0.00 O ATOM 736 CB ASN A 46 -0.020 2.778 -13.215 1.00 0.00 C ATOM 737 CG ASN A 46 0.699 3.353 -14.432 1.00 0.00 C ATOM 738 OD1 ASN A 46 1.200 4.557 -14.373 1.00 0.00 O flip ATOM 739 ND2 ASN A 46 0.807 2.689 -15.462 1.00 0.00 N flip ATOM 0 H ASN A 46 0.086 3.693 -10.927 1.00 0.00 H new ATOM 0 HA ASN A 46 0.802 1.241 -11.953 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -0.667 1.955 -13.520 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -0.660 3.538 -12.768 1.00 0.00 H new ATOM 0 HD21 ASN A 46 0.415 1.748 -15.506 1.00 0.00 H new ATOM 0 HD22 ASN A 46 1.289 3.079 -16.272 1.00 0.00 H new ATOM 746 N ASP A 47 3.008 3.582 -12.616 1.00 0.00 N ATOM 747 CA ASP A 47 4.353 3.815 -13.131 1.00 0.00 C ATOM 748 C ASP A 47 5.353 2.871 -12.475 1.00 0.00 C ATOM 749 O ASP A 47 6.466 2.683 -12.967 1.00 0.00 O ATOM 750 CB ASP A 47 4.768 5.263 -12.873 1.00 0.00 C ATOM 751 CG ASP A 47 6.222 5.317 -12.418 1.00 0.00 C ATOM 752 OD1 ASP A 47 6.454 5.705 -11.285 1.00 0.00 O ATOM 753 OD2 ASP A 47 7.082 4.969 -13.210 1.00 0.00 O ATOM 0 H ASP A 47 2.588 4.383 -12.145 1.00 0.00 H new ATOM 0 HA ASP A 47 4.346 3.625 -14.204 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.640 5.853 -13.780 1.00 0.00 H new ATOM 0 HB3 ASP A 47 4.124 5.704 -12.112 1.00 0.00 H new ATOM 758 N ALA A 48 4.947 2.281 -11.362 1.00 0.00 N ATOM 759 CA ALA A 48 5.806 1.354 -10.635 1.00 0.00 C ATOM 760 C ALA A 48 5.975 0.057 -11.418 1.00 0.00 C ATOM 761 O ALA A 48 6.956 -0.664 -11.239 1.00 0.00 O ATOM 762 CB ALA A 48 5.204 1.040 -9.265 1.00 0.00 C ATOM 0 H ALA A 48 4.029 2.426 -10.941 1.00 0.00 H new ATOM 0 HA ALA A 48 6.781 1.824 -10.505 1.00 0.00 H new ATOM 0 HB1 ALA A 48 5.855 0.347 -8.732 1.00 0.00 H new ATOM 0 HB2 ALA A 48 5.107 1.961 -8.690 1.00 0.00 H new ATOM 0 HB3 ALA A 48 4.221 0.588 -9.395 1.00 0.00 H new ATOM 768 N PHE A 49 5.009 -0.234 -12.282 1.00 0.00 N ATOM 769 CA PHE A 49 5.058 -1.450 -13.081 1.00 0.00 C ATOM 770 C PHE A 49 6.071 -1.310 -14.214 1.00 0.00 C ATOM 771 O PHE A 49 6.478 -2.301 -14.823 1.00 0.00 O ATOM 772 CB PHE A 49 3.676 -1.748 -13.668 1.00 0.00 C ATOM 773 CG PHE A 49 3.775 -1.818 -15.175 1.00 0.00 C ATOM 774 CD1 PHE A 49 3.763 -0.640 -15.932 1.00 0.00 C ATOM 775 CD2 PHE A 49 3.874 -3.060 -15.813 1.00 0.00 C ATOM 776 CE1 PHE A 49 3.858 -0.704 -17.327 1.00 0.00 C ATOM 777 CE2 PHE A 49 3.968 -3.123 -17.209 1.00 0.00 C ATOM 778 CZ PHE A 49 3.957 -1.946 -17.966 1.00 0.00 C ATOM 0 H PHE A 49 4.189 0.351 -12.446 1.00 0.00 H new ATOM 0 HA PHE A 49 5.364 -2.272 -12.434 1.00 0.00 H new ATOM 0 HB2 PHE A 49 3.297 -2.691 -13.273 1.00 0.00 H new ATOM 0 HB3 PHE A 49 2.969 -0.972 -13.375 1.00 0.00 H new ATOM 0 HD1 PHE A 49 3.680 0.318 -15.440 1.00 0.00 H new ATOM 0 HD2 PHE A 49 3.878 -3.969 -15.229 1.00 0.00 H new ATOM 0 HE1 PHE A 49 3.855 0.205 -17.911 1.00 0.00 H new ATOM 0 HE2 PHE A 49 4.049 -4.081 -17.702 1.00 0.00 H new ATOM 0 HZ PHE A 49 4.025 -1.996 -19.043 1.00 0.00 H new ATOM 788 N LYS A 50 6.471 -0.076 -14.493 1.00 0.00 N ATOM 789 CA LYS A 50 7.435 0.182 -15.555 1.00 0.00 C ATOM 790 C LYS A 50 8.786 -0.434 -15.210 1.00 0.00 C ATOM 791 O LYS A 50 9.479 0.039 -14.311 1.00 0.00 O ATOM 792 CB LYS A 50 7.601 1.686 -15.753 1.00 0.00 C ATOM 793 CG LYS A 50 6.287 2.282 -16.274 1.00 0.00 C ATOM 794 CD LYS A 50 6.362 3.813 -16.259 1.00 0.00 C ATOM 795 CE LYS A 50 7.012 4.307 -17.553 1.00 0.00 C ATOM 796 NZ LYS A 50 7.388 5.740 -17.403 1.00 0.00 N ATOM 0 H LYS A 50 6.146 0.757 -14.002 1.00 0.00 H new ATOM 0 HA LYS A 50 7.063 -0.269 -16.475 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.879 2.159 -14.811 1.00 0.00 H new ATOM 0 HB3 LYS A 50 8.407 1.884 -16.459 1.00 0.00 H new ATOM 0 HG2 LYS A 50 6.095 1.929 -17.287 1.00 0.00 H new ATOM 0 HG3 LYS A 50 5.455 1.945 -15.656 1.00 0.00 H new ATOM 0 HD2 LYS A 50 5.362 4.235 -16.158 1.00 0.00 H new ATOM 0 HD3 LYS A 50 6.939 4.151 -15.398 1.00 0.00 H new ATOM 0 HE2 LYS A 50 7.895 3.710 -17.780 1.00 0.00 H new ATOM 0 HE3 LYS A 50 6.322 4.186 -18.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 7.830 6.077 -18.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 6.536 6.304 -17.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 8.061 5.842 -16.616 1.00 0.00 H new ATOM 810 N GLY A 51 9.147 -1.491 -15.930 1.00 0.00 N ATOM 811 CA GLY A 51 10.416 -2.171 -15.694 1.00 0.00 C ATOM 812 C GLY A 51 10.202 -3.672 -15.520 1.00 0.00 C ATOM 813 O GLY A 51 11.040 -4.478 -15.922 1.00 0.00 O ATOM 0 H GLY A 51 8.582 -1.894 -16.678 1.00 0.00 H new ATOM 0 HA2 GLY A 51 11.092 -1.990 -16.530 1.00 0.00 H new ATOM 0 HA3 GLY A 51 10.893 -1.761 -14.804 1.00 0.00 H new ATOM 817 N MET A 52 9.073 -4.043 -14.918 1.00 0.00 N ATOM 818 CA MET A 52 8.758 -5.445 -14.697 1.00 0.00 C ATOM 819 C MET A 52 8.509 -6.151 -16.025 1.00 0.00 C ATOM 820 O MET A 52 7.958 -5.565 -16.957 1.00 0.00 O ATOM 821 CB MET A 52 7.515 -5.563 -13.814 1.00 0.00 C ATOM 822 CG MET A 52 7.899 -6.200 -12.482 1.00 0.00 C ATOM 823 SD MET A 52 9.111 -5.155 -11.635 1.00 0.00 S ATOM 824 CE MET A 52 7.930 -4.108 -10.749 1.00 0.00 C ATOM 0 H MET A 52 8.366 -3.391 -14.577 1.00 0.00 H new ATOM 0 HA MET A 52 9.605 -5.918 -14.200 1.00 0.00 H new ATOM 0 HB2 MET A 52 7.079 -4.578 -13.647 1.00 0.00 H new ATOM 0 HB3 MET A 52 6.757 -6.166 -14.313 1.00 0.00 H new ATOM 0 HG2 MET A 52 7.014 -6.325 -11.859 1.00 0.00 H new ATOM 0 HG3 MET A 52 8.314 -7.194 -12.649 1.00 0.00 H new ATOM 0 HE1 MET A 52 8.471 -3.375 -10.150 1.00 0.00 H new ATOM 0 HE2 MET A 52 7.293 -3.591 -11.466 1.00 0.00 H new ATOM 0 HE3 MET A 52 7.314 -4.726 -10.096 1.00 0.00 H new ATOM 834 N THR A 53 8.916 -7.414 -16.100 1.00 0.00 N ATOM 835 CA THR A 53 8.730 -8.192 -17.318 1.00 0.00 C ATOM 836 C THR A 53 7.422 -8.970 -17.254 1.00 0.00 C ATOM 837 O THR A 53 7.011 -9.423 -16.185 1.00 0.00 O ATOM 838 CB THR A 53 9.894 -9.162 -17.509 1.00 0.00 C ATOM 839 OG1 THR A 53 9.639 -10.354 -16.780 1.00 0.00 O ATOM 840 CG2 THR A 53 11.173 -8.510 -16.995 1.00 0.00 C ATOM 0 H THR A 53 9.373 -7.916 -15.339 1.00 0.00 H new ATOM 0 HA THR A 53 8.695 -7.505 -18.163 1.00 0.00 H new ATOM 0 HB THR A 53 10.006 -9.404 -18.566 1.00 0.00 H new ATOM 0 HG1 THR A 53 10.299 -11.035 -17.026 1.00 0.00 H new ATOM 0 HG21 THR A 53 12.010 -9.196 -17.127 1.00 0.00 H new ATOM 0 HG22 THR A 53 11.364 -7.593 -17.553 1.00 0.00 H new ATOM 0 HG23 THR A 53 11.061 -8.274 -15.937 1.00 0.00 H new ATOM 848 N SER A 54 6.772 -9.114 -18.400 1.00 0.00 N ATOM 849 CA SER A 54 5.503 -9.835 -18.468 1.00 0.00 C ATOM 850 C SER A 54 5.619 -11.194 -17.786 1.00 0.00 C ATOM 851 O SER A 54 4.657 -11.690 -17.200 1.00 0.00 O ATOM 852 CB SER A 54 5.081 -10.028 -19.926 1.00 0.00 C ATOM 853 OG SER A 54 4.247 -11.176 -20.025 1.00 0.00 O ATOM 0 H SER A 54 7.098 -8.744 -19.293 1.00 0.00 H new ATOM 0 HA SER A 54 4.748 -9.244 -17.950 1.00 0.00 H new ATOM 0 HB2 SER A 54 4.549 -9.146 -20.283 1.00 0.00 H new ATOM 0 HB3 SER A 54 5.961 -10.147 -20.559 1.00 0.00 H new ATOM 0 HG SER A 54 3.973 -11.302 -20.958 1.00 0.00 H new ATOM 859 N GLU A 55 6.802 -11.787 -17.864 1.00 0.00 N ATOM 860 CA GLU A 55 7.037 -13.088 -17.254 1.00 0.00 C ATOM 861 C GLU A 55 7.102 -12.960 -15.737 1.00 0.00 C ATOM 862 O GLU A 55 6.580 -13.802 -15.008 1.00 0.00 O ATOM 863 CB GLU A 55 8.345 -13.685 -17.776 1.00 0.00 C ATOM 864 CG GLU A 55 8.340 -15.199 -17.551 1.00 0.00 C ATOM 865 CD GLU A 55 9.770 -15.716 -17.448 1.00 0.00 C ATOM 866 OE1 GLU A 55 10.638 -15.127 -18.073 1.00 0.00 O ATOM 867 OE2 GLU A 55 9.979 -16.692 -16.748 1.00 0.00 O ATOM 0 H GLU A 55 7.611 -11.390 -18.342 1.00 0.00 H new ATOM 0 HA GLU A 55 6.210 -13.747 -17.518 1.00 0.00 H new ATOM 0 HB2 GLU A 55 8.460 -13.465 -18.837 1.00 0.00 H new ATOM 0 HB3 GLU A 55 9.194 -13.233 -17.263 1.00 0.00 H new ATOM 0 HG2 GLU A 55 7.792 -15.438 -16.640 1.00 0.00 H new ATOM 0 HG3 GLU A 55 7.824 -15.695 -18.373 1.00 0.00 H new ATOM 874 N GLU A 56 7.748 -11.900 -15.268 1.00 0.00 N ATOM 875 CA GLU A 56 7.880 -11.676 -13.833 1.00 0.00 C ATOM 876 C GLU A 56 6.508 -11.559 -13.176 1.00 0.00 C ATOM 877 O GLU A 56 6.131 -12.385 -12.338 1.00 0.00 O ATOM 878 CB GLU A 56 8.677 -10.391 -13.577 1.00 0.00 C ATOM 879 CG GLU A 56 10.120 -10.740 -13.208 1.00 0.00 C ATOM 880 CD GLU A 56 10.780 -11.502 -14.351 1.00 0.00 C ATOM 881 OE1 GLU A 56 10.505 -12.682 -14.488 1.00 0.00 O ATOM 882 OE2 GLU A 56 11.551 -10.893 -15.076 1.00 0.00 O ATOM 0 H GLU A 56 8.185 -11.188 -15.853 1.00 0.00 H new ATOM 0 HA GLU A 56 8.406 -12.527 -13.401 1.00 0.00 H new ATOM 0 HB2 GLU A 56 8.662 -9.760 -14.466 1.00 0.00 H new ATOM 0 HB3 GLU A 56 8.214 -9.820 -12.772 1.00 0.00 H new ATOM 0 HG2 GLU A 56 10.680 -9.829 -12.996 1.00 0.00 H new ATOM 0 HG3 GLU A 56 10.136 -11.343 -12.300 1.00 0.00 H new ATOM 889 N LYS A 57 5.760 -10.534 -13.563 1.00 0.00 N ATOM 890 CA LYS A 57 4.433 -10.320 -12.998 1.00 0.00 C ATOM 891 C LYS A 57 3.556 -11.549 -13.208 1.00 0.00 C ATOM 892 O LYS A 57 2.692 -11.853 -12.387 1.00 0.00 O ATOM 893 CB LYS A 57 3.780 -9.099 -13.647 1.00 0.00 C ATOM 894 CG LYS A 57 3.554 -9.376 -15.130 1.00 0.00 C ATOM 895 CD LYS A 57 3.117 -8.088 -15.829 1.00 0.00 C ATOM 896 CE LYS A 57 2.247 -8.427 -17.041 1.00 0.00 C ATOM 897 NZ LYS A 57 0.811 -8.394 -16.644 1.00 0.00 N ATOM 0 H LYS A 57 6.045 -9.844 -14.258 1.00 0.00 H new ATOM 0 HA LYS A 57 4.537 -10.146 -11.927 1.00 0.00 H new ATOM 0 HB2 LYS A 57 2.831 -8.877 -13.158 1.00 0.00 H new ATOM 0 HB3 LYS A 57 4.416 -8.223 -13.522 1.00 0.00 H new ATOM 0 HG2 LYS A 57 4.470 -9.756 -15.583 1.00 0.00 H new ATOM 0 HG3 LYS A 57 2.793 -10.146 -15.255 1.00 0.00 H new ATOM 0 HD2 LYS A 57 2.561 -7.457 -15.135 1.00 0.00 H new ATOM 0 HD3 LYS A 57 3.992 -7.520 -16.145 1.00 0.00 H new ATOM 0 HE2 LYS A 57 2.430 -7.714 -17.845 1.00 0.00 H new ATOM 0 HE3 LYS A 57 2.507 -9.414 -17.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 0.218 -8.624 -17.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 0.643 -9.091 -15.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 0.568 -7.444 -16.297 1.00 0.00 H new ATOM 911 N GLU A 58 3.784 -12.255 -14.309 1.00 0.00 N ATOM 912 CA GLU A 58 3.009 -13.443 -14.610 1.00 0.00 C ATOM 913 C GLU A 58 3.324 -14.549 -13.609 1.00 0.00 C ATOM 914 O GLU A 58 2.436 -15.265 -13.170 1.00 0.00 O ATOM 915 CB GLU A 58 3.330 -13.926 -16.026 1.00 0.00 C ATOM 916 CG GLU A 58 2.720 -15.305 -16.246 1.00 0.00 C ATOM 917 CD GLU A 58 2.260 -15.453 -17.693 1.00 0.00 C ATOM 918 OE1 GLU A 58 1.099 -15.187 -17.957 1.00 0.00 O ATOM 919 OE2 GLU A 58 3.075 -15.835 -18.518 1.00 0.00 O ATOM 0 H GLU A 58 4.496 -12.024 -15.002 1.00 0.00 H new ATOM 0 HA GLU A 58 1.950 -13.196 -14.542 1.00 0.00 H new ATOM 0 HB2 GLU A 58 2.937 -13.222 -16.759 1.00 0.00 H new ATOM 0 HB3 GLU A 58 4.410 -13.967 -16.171 1.00 0.00 H new ATOM 0 HG2 GLU A 58 3.452 -16.077 -16.009 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.876 -15.449 -15.572 1.00 0.00 H new ATOM 926 N ILE A 59 4.596 -14.677 -13.251 1.00 0.00 N ATOM 927 CA ILE A 59 5.010 -15.702 -12.298 1.00 0.00 C ATOM 928 C ILE A 59 4.326 -15.485 -10.955 1.00 0.00 C ATOM 929 O ILE A 59 4.013 -16.442 -10.244 1.00 0.00 O ATOM 930 CB ILE A 59 6.526 -15.659 -12.115 1.00 0.00 C ATOM 931 CG1 ILE A 59 7.204 -16.274 -13.341 1.00 0.00 C ATOM 932 CG2 ILE A 59 6.913 -16.456 -10.868 1.00 0.00 C ATOM 933 CD1 ILE A 59 8.596 -15.663 -13.519 1.00 0.00 C ATOM 0 H ILE A 59 5.353 -14.090 -13.602 1.00 0.00 H new ATOM 0 HA ILE A 59 4.720 -16.678 -12.688 1.00 0.00 H new ATOM 0 HB ILE A 59 6.848 -14.624 -12.000 1.00 0.00 H new ATOM 0 HG12 ILE A 59 7.283 -17.355 -13.222 1.00 0.00 H new ATOM 0 HG13 ILE A 59 6.601 -16.095 -14.231 1.00 0.00 H new ATOM 0 HG21 ILE A 59 7.995 -16.425 -10.738 1.00 0.00 H new ATOM 0 HG22 ILE A 59 6.430 -16.021 -9.993 1.00 0.00 H new ATOM 0 HG23 ILE A 59 6.591 -17.491 -10.983 1.00 0.00 H new ATOM 0 HD11 ILE A 59 9.077 -16.102 -14.393 1.00 0.00 H new ATOM 0 HD12 ILE A 59 8.505 -14.586 -13.658 1.00 0.00 H new ATOM 0 HD13 ILE A 59 9.198 -15.865 -12.633 1.00 0.00 H new ATOM 945 N LEU A 60 4.097 -14.223 -10.614 1.00 0.00 N ATOM 946 CA LEU A 60 3.446 -13.896 -9.348 1.00 0.00 C ATOM 947 C LEU A 60 1.958 -14.227 -9.411 1.00 0.00 C ATOM 948 O LEU A 60 1.456 -15.023 -8.624 1.00 0.00 O ATOM 949 CB LEU A 60 3.621 -12.412 -9.029 1.00 0.00 C ATOM 950 CG LEU A 60 4.899 -12.210 -8.216 1.00 0.00 C ATOM 951 CD1 LEU A 60 6.091 -12.778 -8.985 1.00 0.00 C ATOM 952 CD2 LEU A 60 5.115 -10.713 -7.974 1.00 0.00 C ATOM 0 H LEU A 60 4.348 -13.417 -11.187 1.00 0.00 H new ATOM 0 HA LEU A 60 3.912 -14.491 -8.563 1.00 0.00 H new ATOM 0 HB2 LEU A 60 3.670 -11.835 -9.952 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.760 -12.046 -8.469 1.00 0.00 H new ATOM 0 HG LEU A 60 4.807 -12.726 -7.260 1.00 0.00 H new ATOM 0 HD11 LEU A 60 7.002 -12.633 -8.404 1.00 0.00 H new ATOM 0 HD12 LEU A 60 5.937 -13.843 -9.159 1.00 0.00 H new ATOM 0 HD13 LEU A 60 6.185 -12.264 -9.941 1.00 0.00 H new ATOM 0 HD21 LEU A 60 6.026 -10.566 -7.394 1.00 0.00 H new ATOM 0 HD22 LEU A 60 5.207 -10.199 -8.931 1.00 0.00 H new ATOM 0 HD23 LEU A 60 4.266 -10.307 -7.424 1.00 0.00 H new ATOM 964 N ILE A 61 1.254 -13.602 -10.347 1.00 0.00 N ATOM 965 CA ILE A 61 -0.178 -13.834 -10.494 1.00 0.00 C ATOM 966 C ILE A 61 -0.461 -15.285 -10.866 1.00 0.00 C ATOM 967 O ILE A 61 -1.615 -15.713 -10.900 1.00 0.00 O ATOM 968 CB ILE A 61 -0.757 -12.902 -11.559 1.00 0.00 C ATOM 969 CG1 ILE A 61 -0.234 -13.310 -12.931 1.00 0.00 C ATOM 970 CG2 ILE A 61 -0.326 -11.464 -11.267 1.00 0.00 C ATOM 971 CD1 ILE A 61 -1.332 -14.044 -13.704 1.00 0.00 C ATOM 0 H ILE A 61 1.647 -12.935 -11.011 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.655 -13.625 -9.536 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.845 -12.970 -11.545 1.00 0.00 H new ATOM 0 HG12 ILE A 61 0.087 -12.428 -13.485 1.00 0.00 H new ATOM 0 HG13 ILE A 61 0.639 -13.953 -12.822 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -0.739 -10.799 -12.026 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -0.694 -11.166 -10.285 1.00 0.00 H new ATOM 0 HG23 ILE A 61 0.762 -11.400 -11.281 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -0.955 -14.334 -14.685 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -1.632 -14.935 -13.152 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -2.193 -13.386 -13.827 1.00 0.00 H new ATOM 983 N ARG A 62 0.597 -16.033 -11.147 1.00 0.00 N ATOM 984 CA ARG A 62 0.450 -17.433 -11.520 1.00 0.00 C ATOM 985 C ARG A 62 -0.214 -18.225 -10.399 1.00 0.00 C ATOM 986 O ARG A 62 -0.942 -19.184 -10.653 1.00 0.00 O ATOM 987 CB ARG A 62 1.822 -18.042 -11.823 1.00 0.00 C ATOM 988 CG ARG A 62 1.652 -19.466 -12.353 1.00 0.00 C ATOM 989 CD ARG A 62 2.367 -19.596 -13.700 1.00 0.00 C ATOM 990 NE ARG A 62 1.889 -18.579 -14.631 1.00 0.00 N ATOM 991 CZ ARG A 62 0.697 -18.681 -15.209 1.00 0.00 C ATOM 992 NH1 ARG A 62 -0.071 -19.701 -14.942 1.00 0.00 N ATOM 993 NH2 ARG A 62 0.297 -17.763 -16.045 1.00 0.00 N ATOM 0 H ARG A 62 1.560 -15.697 -11.124 1.00 0.00 H new ATOM 0 HA ARG A 62 -0.179 -17.483 -12.409 1.00 0.00 H new ATOM 0 HB2 ARG A 62 2.347 -17.431 -12.558 1.00 0.00 H new ATOM 0 HB3 ARG A 62 2.433 -18.051 -10.921 1.00 0.00 H new ATOM 0 HG2 ARG A 62 2.062 -20.182 -11.641 1.00 0.00 H new ATOM 0 HG3 ARG A 62 0.593 -19.700 -12.467 1.00 0.00 H new ATOM 0 HD2 ARG A 62 3.443 -19.492 -13.559 1.00 0.00 H new ATOM 0 HD3 ARG A 62 2.194 -20.589 -14.116 1.00 0.00 H new ATOM 0 HE ARG A 62 2.481 -17.775 -14.842 1.00 0.00 H new ATOM 0 HH11 ARG A 62 0.244 -20.419 -14.290 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -0.986 -19.780 -15.385 1.00 0.00 H new ATOM 0 HH21 ARG A 62 0.899 -16.967 -16.255 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -0.618 -17.841 -16.489 1.00 0.00 H new ATOM 1007 N ASP A 63 0.049 -17.817 -9.159 1.00 0.00 N ATOM 1008 CA ASP A 63 -0.517 -18.496 -7.997 1.00 0.00 C ATOM 1009 C ASP A 63 -1.469 -17.575 -7.249 1.00 0.00 C ATOM 1010 O ASP A 63 -1.164 -16.406 -7.010 1.00 0.00 O ATOM 1011 CB ASP A 63 0.598 -18.954 -7.057 1.00 0.00 C ATOM 1012 CG ASP A 63 1.887 -19.161 -7.844 1.00 0.00 C ATOM 1013 OD1 ASP A 63 1.813 -19.724 -8.924 1.00 0.00 O ATOM 1014 OD2 ASP A 63 2.928 -18.754 -7.356 1.00 0.00 O ATOM 0 H ASP A 63 0.648 -17.023 -8.934 1.00 0.00 H new ATOM 0 HA ASP A 63 -1.072 -19.366 -8.348 1.00 0.00 H new ATOM 0 HB2 ASP A 63 0.754 -18.211 -6.275 1.00 0.00 H new ATOM 0 HB3 ASP A 63 0.311 -19.882 -6.562 1.00 0.00 H new ATOM 1019 N LYS A 64 -2.631 -18.099 -6.896 1.00 0.00 N ATOM 1020 CA LYS A 64 -3.614 -17.304 -6.187 1.00 0.00 C ATOM 1021 C LYS A 64 -3.029 -16.768 -4.885 1.00 0.00 C ATOM 1022 O LYS A 64 -3.322 -15.651 -4.478 1.00 0.00 O ATOM 1023 CB LYS A 64 -4.860 -18.153 -5.882 1.00 0.00 C ATOM 1024 CG LYS A 64 -5.651 -17.590 -4.678 1.00 0.00 C ATOM 1025 CD LYS A 64 -6.337 -16.282 -5.082 1.00 0.00 C ATOM 1026 CE LYS A 64 -7.765 -16.588 -5.518 1.00 0.00 C ATOM 1027 NZ LYS A 64 -8.351 -15.383 -6.167 1.00 0.00 N ATOM 0 H LYS A 64 -2.913 -19.061 -7.087 1.00 0.00 H new ATOM 0 HA LYS A 64 -3.897 -16.463 -6.820 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -5.505 -18.182 -6.760 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -4.559 -19.180 -5.673 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -6.394 -18.315 -4.347 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -4.979 -17.416 -3.838 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -6.340 -15.584 -4.245 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -5.789 -15.804 -5.894 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -7.773 -17.429 -6.212 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -8.366 -16.879 -4.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -9.326 -15.589 -6.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -8.356 -14.592 -5.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -7.782 -15.125 -6.998 1.00 0.00 H new ATOM 1041 N ASN A 65 -2.244 -17.587 -4.210 1.00 0.00 N ATOM 1042 CA ASN A 65 -1.666 -17.187 -2.938 1.00 0.00 C ATOM 1043 C ASN A 65 -0.625 -16.090 -3.140 1.00 0.00 C ATOM 1044 O ASN A 65 -0.444 -15.211 -2.286 1.00 0.00 O ATOM 1045 CB ASN A 65 -1.017 -18.399 -2.264 1.00 0.00 C ATOM 1046 CG ASN A 65 -2.008 -19.068 -1.312 1.00 0.00 C ATOM 1047 OD1 ASN A 65 -2.204 -20.283 -1.372 1.00 0.00 O ATOM 1048 ND2 ASN A 65 -2.643 -18.346 -0.429 1.00 0.00 N ATOM 0 H ASN A 65 -1.993 -18.527 -4.517 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.460 -16.797 -2.302 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -0.690 -19.113 -3.020 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -0.129 -18.086 -1.715 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -3.302 -18.788 0.212 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -2.480 -17.340 -0.380 1.00 0.00 H new ATOM 1055 N ALA A 66 0.063 -16.148 -4.274 1.00 0.00 N ATOM 1056 CA ALA A 66 1.100 -15.166 -4.563 1.00 0.00 C ATOM 1057 C ALA A 66 0.520 -13.757 -4.711 1.00 0.00 C ATOM 1058 O ALA A 66 0.819 -12.844 -3.921 1.00 0.00 O ATOM 1059 CB ALA A 66 1.802 -15.551 -5.864 1.00 0.00 C ATOM 0 H ALA A 66 -0.075 -16.853 -4.998 1.00 0.00 H new ATOM 0 HA ALA A 66 1.802 -15.160 -3.729 1.00 0.00 H new ATOM 0 HB1 ALA A 66 2.580 -14.821 -6.088 1.00 0.00 H new ATOM 0 HB2 ALA A 66 2.251 -16.538 -5.757 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.077 -15.569 -6.677 1.00 0.00 H new ATOM 1065 N LEU A 67 -0.329 -13.585 -5.716 1.00 0.00 N ATOM 1066 CA LEU A 67 -0.940 -12.293 -5.945 1.00 0.00 C ATOM 1067 C LEU A 67 -1.701 -11.861 -4.696 1.00 0.00 C ATOM 1068 O LEU A 67 -1.862 -10.671 -4.446 1.00 0.00 O ATOM 1069 CB LEU A 67 -1.873 -12.356 -7.172 1.00 0.00 C ATOM 1070 CG LEU A 67 -3.340 -12.208 -6.758 1.00 0.00 C ATOM 1071 CD1 LEU A 67 -4.219 -12.074 -7.985 1.00 0.00 C ATOM 1072 CD2 LEU A 67 -3.740 -13.442 -5.962 1.00 0.00 C ATOM 0 H LEU A 67 -0.604 -14.315 -6.374 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.166 -11.554 -6.152 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.609 -11.566 -7.874 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -1.732 -13.304 -7.691 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.466 -11.313 -6.149 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -5.259 -11.969 -7.678 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.918 -11.194 -8.554 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -4.112 -12.962 -8.608 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -4.783 -13.356 -5.657 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.615 -14.331 -6.581 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -3.109 -13.524 -5.077 1.00 0.00 H new ATOM 1084 N GLN A 68 -2.193 -12.830 -3.929 1.00 0.00 N ATOM 1085 CA GLN A 68 -2.958 -12.510 -2.739 1.00 0.00 C ATOM 1086 C GLN A 68 -2.096 -11.722 -1.760 1.00 0.00 C ATOM 1087 O GLN A 68 -2.527 -10.712 -1.181 1.00 0.00 O ATOM 1088 CB GLN A 68 -3.458 -13.796 -2.083 1.00 0.00 C ATOM 1089 CG GLN A 68 -4.976 -13.942 -2.290 1.00 0.00 C ATOM 1090 CD GLN A 68 -5.721 -13.024 -1.331 1.00 0.00 C ATOM 1091 OE1 GLN A 68 -5.785 -11.744 -1.593 1.00 0.00 O flip ATOM 1092 NE2 GLN A 68 -6.236 -13.479 -0.307 1.00 0.00 N flip ATOM 0 H GLN A 68 -2.076 -13.827 -4.110 1.00 0.00 H new ATOM 0 HA GLN A 68 -3.816 -11.899 -3.021 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -2.941 -14.655 -2.510 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -3.228 -13.783 -1.018 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -5.237 -13.696 -3.319 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -5.277 -14.977 -2.124 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -6.182 -14.478 -0.110 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -6.716 -12.856 0.343 1.00 0.00 H new ATOM 1101 N ASN A 69 -0.860 -12.184 -1.592 1.00 0.00 N ATOM 1102 CA ASN A 69 0.062 -11.510 -0.696 1.00 0.00 C ATOM 1103 C ASN A 69 0.293 -10.086 -1.175 1.00 0.00 C ATOM 1104 O ASN A 69 0.284 -9.143 -0.385 1.00 0.00 O ATOM 1105 CB ASN A 69 1.393 -12.259 -0.645 1.00 0.00 C ATOM 1106 CG ASN A 69 1.148 -13.754 -0.796 1.00 0.00 C ATOM 1107 OD1 ASN A 69 0.236 -14.301 -0.178 1.00 0.00 O ATOM 1108 ND2 ASN A 69 1.911 -14.449 -1.590 1.00 0.00 N ATOM 0 H ASN A 69 -0.482 -13.009 -2.058 1.00 0.00 H new ATOM 0 HA ASN A 69 -0.370 -11.490 0.305 1.00 0.00 H new ATOM 0 HB2 ASN A 69 2.050 -11.907 -1.440 1.00 0.00 H new ATOM 0 HB3 ASN A 69 1.899 -12.057 0.299 1.00 0.00 H new ATOM 0 HD21 ASN A 69 1.753 -15.451 -1.701 1.00 0.00 H new ATOM 0 HD22 ASN A 69 2.666 -13.992 -2.101 1.00 0.00 H new ATOM 1115 N ILE A 70 0.492 -9.936 -2.481 1.00 0.00 N ATOM 1116 CA ILE A 70 0.715 -8.604 -3.049 1.00 0.00 C ATOM 1117 C ILE A 70 -0.580 -7.792 -3.031 1.00 0.00 C ATOM 1118 O ILE A 70 -0.564 -6.575 -2.845 1.00 0.00 O ATOM 1119 CB ILE A 70 1.221 -8.719 -4.484 1.00 0.00 C ATOM 1120 CG1 ILE A 70 2.718 -9.035 -4.472 1.00 0.00 C ATOM 1121 CG2 ILE A 70 0.986 -7.398 -5.223 1.00 0.00 C ATOM 1122 CD1 ILE A 70 2.974 -10.279 -3.624 1.00 0.00 C ATOM 0 H ILE A 70 0.504 -10.700 -3.156 1.00 0.00 H new ATOM 0 HA ILE A 70 1.464 -8.095 -2.442 1.00 0.00 H new ATOM 0 HB ILE A 70 0.682 -9.518 -4.993 1.00 0.00 H new ATOM 0 HG12 ILE A 70 3.074 -9.197 -5.490 1.00 0.00 H new ATOM 0 HG13 ILE A 70 3.275 -8.188 -4.071 1.00 0.00 H new ATOM 0 HG21 ILE A 70 1.349 -7.485 -6.247 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -0.080 -7.172 -5.234 1.00 0.00 H new ATOM 0 HG23 ILE A 70 1.522 -6.596 -4.715 1.00 0.00 H new ATOM 0 HD11 ILE A 70 4.041 -10.502 -3.617 1.00 0.00 H new ATOM 0 HD12 ILE A 70 2.634 -10.100 -2.604 1.00 0.00 H new ATOM 0 HD13 ILE A 70 2.430 -11.124 -4.045 1.00 0.00 H new ATOM 1134 N ILE A 71 -1.698 -8.470 -3.229 1.00 0.00 N ATOM 1135 CA ILE A 71 -2.993 -7.802 -3.236 1.00 0.00 C ATOM 1136 C ILE A 71 -3.150 -6.939 -1.995 1.00 0.00 C ATOM 1137 O ILE A 71 -3.432 -5.746 -2.096 1.00 0.00 O ATOM 1138 CB ILE A 71 -4.115 -8.831 -3.272 1.00 0.00 C ATOM 1139 CG1 ILE A 71 -4.418 -9.218 -4.719 1.00 0.00 C ATOM 1140 CG2 ILE A 71 -5.371 -8.268 -2.610 1.00 0.00 C ATOM 1141 CD1 ILE A 71 -5.459 -8.274 -5.305 1.00 0.00 C ATOM 0 H ILE A 71 -1.738 -9.477 -3.386 1.00 0.00 H new ATOM 0 HA ILE A 71 -3.047 -7.172 -4.124 1.00 0.00 H new ATOM 0 HB ILE A 71 -3.797 -9.717 -2.723 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -3.505 -9.179 -5.313 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -4.782 -10.245 -4.761 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -6.165 -9.014 -2.643 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -5.153 -8.015 -1.572 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -5.692 -7.372 -3.142 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -5.668 -8.558 -6.336 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -6.376 -8.335 -4.719 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -5.079 -7.253 -5.280 1.00 0.00 H new ATOM 1153 N LEU A 72 -2.990 -7.548 -0.817 1.00 0.00 N ATOM 1154 CA LEU A 72 -3.135 -6.799 0.426 1.00 0.00 C ATOM 1155 C LEU A 72 -2.195 -5.602 0.459 1.00 0.00 C ATOM 1156 O LEU A 72 -2.198 -4.829 1.418 1.00 0.00 O ATOM 1157 CB LEU A 72 -2.854 -7.712 1.612 1.00 0.00 C ATOM 1158 CG LEU A 72 -3.893 -8.840 1.623 1.00 0.00 C ATOM 1159 CD1 LEU A 72 -3.180 -10.169 1.844 1.00 0.00 C ATOM 1160 CD2 LEU A 72 -4.907 -8.594 2.755 1.00 0.00 C ATOM 0 H LEU A 72 -2.765 -8.536 -0.701 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.158 -6.428 0.485 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -1.848 -8.126 1.540 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -2.900 -7.147 2.543 1.00 0.00 H new ATOM 0 HG LEU A 72 -4.423 -8.866 0.671 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.911 -10.977 1.853 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -2.465 -10.336 1.039 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -2.653 -10.145 2.798 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -5.645 -9.396 2.763 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -4.386 -8.572 3.712 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -5.409 -7.640 2.593 1.00 0.00 H new ATOM 1172 N TYR A 73 -1.398 -5.446 -0.593 1.00 0.00 N ATOM 1173 CA TYR A 73 -0.468 -4.333 -0.664 1.00 0.00 C ATOM 1174 C TYR A 73 0.198 -4.092 0.684 1.00 0.00 C ATOM 1175 O TYR A 73 0.483 -2.948 1.047 1.00 0.00 O ATOM 1176 CB TYR A 73 -1.203 -3.072 -1.104 1.00 0.00 C ATOM 1177 CG TYR A 73 -2.210 -3.421 -2.176 1.00 0.00 C ATOM 1178 CD1 TYR A 73 -1.794 -4.068 -3.347 1.00 0.00 C ATOM 1179 CD2 TYR A 73 -3.563 -3.102 -1.999 1.00 0.00 C ATOM 1180 CE1 TYR A 73 -2.729 -4.397 -4.336 1.00 0.00 C ATOM 1181 CE2 TYR A 73 -4.496 -3.430 -2.988 1.00 0.00 C ATOM 1182 CZ TYR A 73 -4.079 -4.077 -4.157 1.00 0.00 C ATOM 1183 OH TYR A 73 -5.000 -4.400 -5.133 1.00 0.00 O ATOM 0 H TYR A 73 -1.379 -6.071 -1.399 1.00 0.00 H new ATOM 0 HA TYR A 73 0.305 -4.580 -1.392 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -1.707 -2.616 -0.252 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -0.492 -2.338 -1.484 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -0.752 -4.313 -3.487 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -3.886 -2.602 -1.098 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -2.408 -4.898 -5.237 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -5.538 -3.184 -2.850 1.00 0.00 H new ATOM 0 HH TYR A 73 -5.043 -3.678 -5.794 1.00 0.00 H new ATOM 1193 N HIS A 74 0.460 -5.169 1.420 1.00 0.00 N ATOM 1194 CA HIS A 74 1.107 -5.047 2.721 1.00 0.00 C ATOM 1195 C HIS A 74 0.188 -4.349 3.709 1.00 0.00 C ATOM 1196 O HIS A 74 0.603 -3.427 4.413 1.00 0.00 O ATOM 1197 CB HIS A 74 2.416 -4.264 2.589 1.00 0.00 C ATOM 1198 CG HIS A 74 3.077 -4.598 1.279 1.00 0.00 C ATOM 1199 ND1 HIS A 74 2.742 -3.958 0.098 1.00 0.00 N ATOM 1200 CD2 HIS A 74 4.052 -5.505 0.947 1.00 0.00 C ATOM 1201 CE1 HIS A 74 3.500 -4.481 -0.879 1.00 0.00 C ATOM 1202 NE2 HIS A 74 4.317 -5.426 -0.416 1.00 0.00 N ATOM 0 H HIS A 74 0.237 -6.125 1.141 1.00 0.00 H new ATOM 0 HA HIS A 74 1.326 -6.049 3.091 1.00 0.00 H new ATOM 0 HB2 HIS A 74 2.218 -3.194 2.645 1.00 0.00 H new ATOM 0 HB3 HIS A 74 3.082 -4.509 3.416 1.00 0.00 H new ATOM 0 HD2 HIS A 74 4.539 -6.177 1.638 1.00 0.00 H new ATOM 0 HE1 HIS A 74 3.453 -4.173 -1.913 1.00 0.00 H new ATOM 0 HE2 HIS A 74 4.993 -5.975 -0.948 1.00 0.00 H new ATOM 1211 N LEU A 75 -1.065 -4.791 3.760 1.00 0.00 N ATOM 1212 CA LEU A 75 -2.023 -4.190 4.672 1.00 0.00 C ATOM 1213 C LEU A 75 -1.541 -4.327 6.110 1.00 0.00 C ATOM 1214 O LEU A 75 -1.324 -5.441 6.589 1.00 0.00 O ATOM 1215 CB LEU A 75 -3.392 -4.868 4.524 1.00 0.00 C ATOM 1216 CG LEU A 75 -4.293 -4.524 5.719 1.00 0.00 C ATOM 1217 CD1 LEU A 75 -4.457 -3.008 5.815 1.00 0.00 C ATOM 1218 CD2 LEU A 75 -5.662 -5.173 5.523 1.00 0.00 C ATOM 0 H LEU A 75 -1.433 -5.551 3.189 1.00 0.00 H new ATOM 0 HA LEU A 75 -2.117 -3.132 4.426 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -3.867 -4.544 3.598 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.264 -5.948 4.456 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.840 -4.898 6.637 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -5.097 -2.764 6.663 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -3.480 -2.544 5.952 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -4.911 -2.632 4.898 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -6.304 -4.931 6.370 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -6.115 -4.798 4.605 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -5.545 -6.255 5.454 1.00 0.00 H new ATOM 1230 N THR A 76 -1.400 -3.198 6.798 1.00 0.00 N ATOM 1231 CA THR A 76 -0.965 -3.224 8.183 1.00 0.00 C ATOM 1232 C THR A 76 -2.031 -2.620 9.105 1.00 0.00 C ATOM 1233 O THR A 76 -2.680 -1.644 8.738 1.00 0.00 O ATOM 1234 CB THR A 76 0.335 -2.439 8.322 1.00 0.00 C ATOM 1235 OG1 THR A 76 1.355 -3.316 8.775 1.00 0.00 O ATOM 1236 CG2 THR A 76 0.189 -1.287 9.327 1.00 0.00 C ATOM 0 H THR A 76 -1.579 -2.267 6.422 1.00 0.00 H new ATOM 0 HA THR A 76 -0.806 -4.262 8.476 1.00 0.00 H new ATOM 0 HB THR A 76 0.587 -2.017 7.349 1.00 0.00 H new ATOM 0 HG1 THR A 76 2.196 -2.821 8.866 1.00 0.00 H new ATOM 0 HG21 THR A 76 1.133 -0.748 9.402 1.00 0.00 H new ATOM 0 HG22 THR A 76 -0.592 -0.606 8.989 1.00 0.00 H new ATOM 0 HG23 THR A 76 -0.078 -1.689 10.304 1.00 0.00 H new ATOM 1244 N PRO A 77 -2.194 -3.135 10.298 1.00 0.00 N ATOM 1245 CA PRO A 77 -3.176 -2.587 11.278 1.00 0.00 C ATOM 1246 C PRO A 77 -2.635 -1.369 12.024 1.00 0.00 C ATOM 1247 O PRO A 77 -1.458 -1.318 12.382 1.00 0.00 O ATOM 1248 CB PRO A 77 -3.399 -3.756 12.233 1.00 0.00 C ATOM 1249 CG PRO A 77 -2.111 -4.509 12.230 1.00 0.00 C ATOM 1250 CD PRO A 77 -1.481 -4.300 10.858 1.00 0.00 C ATOM 0 HA PRO A 77 -4.088 -2.233 10.797 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -3.649 -3.405 13.234 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -4.225 -4.385 11.901 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -1.450 -4.147 13.018 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -2.282 -5.569 12.419 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -0.411 -4.110 10.937 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -1.602 -5.181 10.227 1.00 0.00 H new ATOM 1258 N GLY A 78 -3.507 -0.392 12.258 1.00 0.00 N ATOM 1259 CA GLY A 78 -3.112 0.819 12.964 1.00 0.00 C ATOM 1260 C GLY A 78 -2.502 1.836 12.004 1.00 0.00 C ATOM 1261 O GLY A 78 -1.433 1.608 11.439 1.00 0.00 O ATOM 0 H GLY A 78 -4.485 -0.416 11.970 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -3.980 1.255 13.459 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -2.391 0.571 13.744 1.00 0.00 H new ATOM 1265 N VAL A 79 -3.189 2.958 11.826 1.00 0.00 N ATOM 1266 CA VAL A 79 -2.706 4.010 10.934 1.00 0.00 C ATOM 1267 C VAL A 79 -1.316 4.476 11.357 1.00 0.00 C ATOM 1268 O VAL A 79 -0.993 4.496 12.545 1.00 0.00 O ATOM 1269 CB VAL A 79 -3.671 5.197 10.956 1.00 0.00 C ATOM 1270 CG1 VAL A 79 -5.046 4.744 10.464 1.00 0.00 C ATOM 1271 CG2 VAL A 79 -3.792 5.734 12.384 1.00 0.00 C ATOM 0 H VAL A 79 -4.077 3.164 12.283 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.650 3.605 9.924 1.00 0.00 H new ATOM 0 HB VAL A 79 -3.292 5.984 10.304 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -5.734 5.589 10.479 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -4.961 4.364 9.446 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -5.424 3.956 11.115 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -4.480 6.580 12.398 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -4.170 4.948 13.038 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -2.812 6.058 12.735 1.00 0.00 H new ATOM 1281 N PHE A 80 -0.500 4.848 10.377 1.00 0.00 N ATOM 1282 CA PHE A 80 0.851 5.313 10.659 1.00 0.00 C ATOM 1283 C PHE A 80 0.844 6.789 11.042 1.00 0.00 C ATOM 1284 O PHE A 80 0.108 7.585 10.458 1.00 0.00 O ATOM 1285 CB PHE A 80 1.736 5.113 9.430 1.00 0.00 C ATOM 1286 CG PHE A 80 2.657 3.941 9.656 1.00 0.00 C ATOM 1287 CD1 PHE A 80 2.320 2.682 9.147 1.00 0.00 C ATOM 1288 CD2 PHE A 80 3.850 4.113 10.367 1.00 0.00 C ATOM 1289 CE1 PHE A 80 3.177 1.597 9.347 1.00 0.00 C ATOM 1290 CE2 PHE A 80 4.707 3.025 10.571 1.00 0.00 C ATOM 1291 CZ PHE A 80 4.370 1.768 10.059 1.00 0.00 C ATOM 0 H PHE A 80 -0.749 4.837 9.388 1.00 0.00 H new ATOM 0 HA PHE A 80 1.246 4.734 11.494 1.00 0.00 H new ATOM 0 HB2 PHE A 80 1.118 4.939 8.549 1.00 0.00 H new ATOM 0 HB3 PHE A 80 2.318 6.014 9.238 1.00 0.00 H new ATOM 0 HD1 PHE A 80 1.398 2.549 8.600 1.00 0.00 H new ATOM 0 HD2 PHE A 80 4.110 5.085 10.758 1.00 0.00 H new ATOM 0 HE1 PHE A 80 2.919 0.626 8.952 1.00 0.00 H new ATOM 0 HE2 PHE A 80 5.626 3.156 11.123 1.00 0.00 H new ATOM 0 HZ PHE A 80 5.031 0.928 10.213 1.00 0.00 H new ATOM 1301 N ILE A 81 1.666 7.144 12.025 1.00 0.00 N ATOM 1302 CA ILE A 81 1.750 8.527 12.483 1.00 0.00 C ATOM 1303 C ILE A 81 3.198 9.007 12.477 1.00 0.00 C ATOM 1304 O ILE A 81 4.021 8.534 13.263 1.00 0.00 O ATOM 1305 CB ILE A 81 1.174 8.648 13.894 1.00 0.00 C ATOM 1306 CG1 ILE A 81 0.125 7.553 14.112 1.00 0.00 C ATOM 1307 CG2 ILE A 81 0.519 10.021 14.065 1.00 0.00 C ATOM 1308 CD1 ILE A 81 -0.562 7.765 15.461 1.00 0.00 C ATOM 0 H ILE A 81 2.281 6.496 12.518 1.00 0.00 H new ATOM 0 HA ILE A 81 1.171 9.150 11.802 1.00 0.00 H new ATOM 0 HB ILE A 81 1.976 8.536 14.623 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -0.612 7.576 13.309 1.00 0.00 H new ATOM 0 HG13 ILE A 81 0.598 6.571 14.083 1.00 0.00 H new ATOM 0 HG21 ILE A 81 0.109 10.106 15.071 1.00 0.00 H new ATOM 0 HG22 ILE A 81 1.264 10.801 13.910 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -0.283 10.135 13.336 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -1.308 6.986 15.616 1.00 0.00 H new ATOM 0 HD12 ILE A 81 0.180 7.720 16.258 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -1.048 8.740 15.472 1.00 0.00 H new ATOM 1320 N GLY A 82 3.502 9.946 11.589 1.00 0.00 N ATOM 1321 CA GLY A 82 4.855 10.482 11.492 1.00 0.00 C ATOM 1322 C GLY A 82 5.171 11.384 12.679 1.00 0.00 C ATOM 1323 O GLY A 82 6.280 11.907 12.792 1.00 0.00 O ATOM 0 H GLY A 82 2.836 10.350 10.930 1.00 0.00 H new ATOM 0 HA2 GLY A 82 5.573 9.663 11.452 1.00 0.00 H new ATOM 0 HA3 GLY A 82 4.962 11.045 10.565 1.00 0.00 H new ATOM 1327 N LYS A 83 4.189 11.563 13.559 1.00 0.00 N ATOM 1328 CA LYS A 83 4.370 12.406 14.737 1.00 0.00 C ATOM 1329 C LYS A 83 4.417 11.562 16.004 1.00 0.00 C ATOM 1330 O LYS A 83 4.592 12.087 17.104 1.00 0.00 O ATOM 1331 CB LYS A 83 3.223 13.412 14.836 1.00 0.00 C ATOM 1332 CG LYS A 83 3.352 14.445 13.715 1.00 0.00 C ATOM 1333 CD LYS A 83 2.013 14.580 12.986 1.00 0.00 C ATOM 1334 CE LYS A 83 2.105 15.699 11.947 1.00 0.00 C ATOM 1335 NZ LYS A 83 1.088 16.746 12.253 1.00 0.00 N ATOM 0 H LYS A 83 3.265 11.138 13.479 1.00 0.00 H new ATOM 0 HA LYS A 83 5.316 12.937 14.636 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.266 12.896 14.761 1.00 0.00 H new ATOM 0 HB3 LYS A 83 3.243 13.908 15.806 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.652 15.408 14.127 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.130 14.142 13.015 1.00 0.00 H new ATOM 0 HD2 LYS A 83 1.756 13.639 12.500 1.00 0.00 H new ATOM 0 HD3 LYS A 83 1.219 14.798 13.700 1.00 0.00 H new ATOM 0 HE2 LYS A 83 3.104 16.134 11.953 1.00 0.00 H new ATOM 0 HE3 LYS A 83 1.939 15.297 10.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 1.150 17.507 11.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 0.137 16.325 12.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 1.266 17.137 13.200 1.00 0.00 H new ATOM 1349 N GLY A 84 4.260 10.253 15.841 1.00 0.00 N ATOM 1350 CA GLY A 84 4.285 9.339 16.980 1.00 0.00 C ATOM 1351 C GLY A 84 5.550 8.487 16.968 1.00 0.00 C ATOM 1352 O GLY A 84 6.088 8.145 18.022 1.00 0.00 O ATOM 0 H GLY A 84 4.115 9.802 14.938 1.00 0.00 H new ATOM 0 HA2 GLY A 84 4.234 9.908 17.909 1.00 0.00 H new ATOM 0 HA3 GLY A 84 3.407 8.694 16.953 1.00 0.00 H new ATOM 1356 N PHE A 85 6.018 8.145 15.771 1.00 0.00 N ATOM 1357 CA PHE A 85 7.220 7.327 15.636 1.00 0.00 C ATOM 1358 C PHE A 85 8.470 8.194 15.712 1.00 0.00 C ATOM 1359 O PHE A 85 8.429 9.389 15.414 1.00 0.00 O ATOM 1360 CB PHE A 85 7.195 6.574 14.307 1.00 0.00 C ATOM 1361 CG PHE A 85 6.380 5.313 14.464 1.00 0.00 C ATOM 1362 CD1 PHE A 85 5.107 5.225 13.890 1.00 0.00 C ATOM 1363 CD2 PHE A 85 6.899 4.230 15.186 1.00 0.00 C ATOM 1364 CE1 PHE A 85 4.351 4.056 14.037 1.00 0.00 C ATOM 1365 CE2 PHE A 85 6.144 3.061 15.333 1.00 0.00 C ATOM 1366 CZ PHE A 85 4.871 2.973 14.759 1.00 0.00 C ATOM 0 H PHE A 85 5.588 8.419 14.887 1.00 0.00 H new ATOM 0 HA PHE A 85 7.241 6.609 16.456 1.00 0.00 H new ATOM 0 HB2 PHE A 85 6.766 7.203 13.527 1.00 0.00 H new ATOM 0 HB3 PHE A 85 8.210 6.328 13.996 1.00 0.00 H new ATOM 0 HD1 PHE A 85 4.707 6.060 13.333 1.00 0.00 H new ATOM 0 HD2 PHE A 85 7.882 4.298 15.629 1.00 0.00 H new ATOM 0 HE1 PHE A 85 3.368 3.989 13.595 1.00 0.00 H new ATOM 0 HE2 PHE A 85 6.544 2.226 15.890 1.00 0.00 H new ATOM 0 HZ PHE A 85 4.289 2.070 14.872 1.00 0.00 H new ATOM 1376 N GLU A 86 9.582 7.585 16.124 1.00 0.00 N ATOM 1377 CA GLU A 86 10.826 8.329 16.243 1.00 0.00 C ATOM 1378 C GLU A 86 11.538 8.421 14.887 1.00 0.00 C ATOM 1379 O GLU A 86 11.842 7.395 14.278 1.00 0.00 O ATOM 1380 CB GLU A 86 11.748 7.649 17.257 1.00 0.00 C ATOM 1381 CG GLU A 86 13.181 8.165 17.080 1.00 0.00 C ATOM 1382 CD GLU A 86 13.949 8.021 18.389 1.00 0.00 C ATOM 1383 OE1 GLU A 86 14.213 9.036 19.013 1.00 0.00 O ATOM 1384 OE2 GLU A 86 14.262 6.899 18.750 1.00 0.00 O ATOM 0 H GLU A 86 9.643 6.598 16.375 1.00 0.00 H new ATOM 0 HA GLU A 86 10.588 9.337 16.584 1.00 0.00 H new ATOM 0 HB2 GLU A 86 11.401 7.851 18.271 1.00 0.00 H new ATOM 0 HB3 GLU A 86 11.721 6.568 17.120 1.00 0.00 H new ATOM 0 HG2 GLU A 86 13.683 7.606 16.290 1.00 0.00 H new ATOM 0 HG3 GLU A 86 13.165 9.210 16.771 1.00 0.00 H new ATOM 1391 N PRO A 87 11.822 9.608 14.404 1.00 0.00 N ATOM 1392 CA PRO A 87 12.523 9.792 13.099 1.00 0.00 C ATOM 1393 C PRO A 87 14.029 9.578 13.216 1.00 0.00 C ATOM 1394 O PRO A 87 14.663 10.075 14.148 1.00 0.00 O ATOM 1395 CB PRO A 87 12.206 11.241 12.736 1.00 0.00 C ATOM 1396 CG PRO A 87 12.041 11.940 14.040 1.00 0.00 C ATOM 1397 CD PRO A 87 11.503 10.913 15.021 1.00 0.00 C ATOM 0 HA PRO A 87 12.197 9.071 12.349 1.00 0.00 H new ATOM 0 HB2 PRO A 87 13.010 11.685 12.149 1.00 0.00 H new ATOM 0 HB3 PRO A 87 11.299 11.308 12.135 1.00 0.00 H new ATOM 0 HG2 PRO A 87 12.993 12.344 14.386 1.00 0.00 H new ATOM 0 HG3 PRO A 87 11.354 12.781 13.944 1.00 0.00 H new ATOM 0 HD2 PRO A 87 11.973 11.015 15.999 1.00 0.00 H new ATOM 0 HD3 PRO A 87 10.429 11.030 15.169 1.00 0.00 H new ATOM 1405 N GLY A 88 14.593 8.839 12.264 1.00 0.00 N ATOM 1406 CA GLY A 88 16.027 8.567 12.265 1.00 0.00 C ATOM 1407 C GLY A 88 16.301 7.076 12.425 1.00 0.00 C ATOM 1408 O GLY A 88 17.216 6.535 11.803 1.00 0.00 O ATOM 0 H GLY A 88 14.082 8.420 11.487 1.00 0.00 H new ATOM 0 HA2 GLY A 88 16.469 8.924 11.335 1.00 0.00 H new ATOM 0 HA3 GLY A 88 16.504 9.117 13.076 1.00 0.00 H new ATOM 1412 N VAL A 89 15.507 6.416 13.265 1.00 0.00 N ATOM 1413 CA VAL A 89 15.680 4.991 13.497 1.00 0.00 C ATOM 1414 C VAL A 89 14.658 4.190 12.698 1.00 0.00 C ATOM 1415 O VAL A 89 13.566 4.676 12.404 1.00 0.00 O ATOM 1416 CB VAL A 89 15.520 4.689 14.985 1.00 0.00 C ATOM 1417 CG1 VAL A 89 16.361 5.670 15.804 1.00 0.00 C ATOM 1418 CG2 VAL A 89 14.048 4.828 15.380 1.00 0.00 C ATOM 0 H VAL A 89 14.745 6.844 13.791 1.00 0.00 H new ATOM 0 HA VAL A 89 16.680 4.704 13.172 1.00 0.00 H new ATOM 0 HB VAL A 89 15.856 3.671 15.183 1.00 0.00 H new ATOM 0 HG11 VAL A 89 16.244 5.451 16.865 1.00 0.00 H new ATOM 0 HG12 VAL A 89 17.410 5.570 15.526 1.00 0.00 H new ATOM 0 HG13 VAL A 89 16.029 6.689 15.605 1.00 0.00 H new ATOM 0 HG21 VAL A 89 13.934 4.612 16.442 1.00 0.00 H new ATOM 0 HG22 VAL A 89 13.712 5.845 15.178 1.00 0.00 H new ATOM 0 HG23 VAL A 89 13.448 4.126 14.801 1.00 0.00 H new ATOM 1428 N THR A 90 15.017 2.958 12.351 1.00 0.00 N ATOM 1429 CA THR A 90 14.121 2.100 11.587 1.00 0.00 C ATOM 1430 C THR A 90 13.176 1.353 12.525 1.00 0.00 C ATOM 1431 O THR A 90 13.560 0.981 13.634 1.00 0.00 O ATOM 1432 CB THR A 90 14.932 1.093 10.768 1.00 0.00 C ATOM 1433 OG1 THR A 90 16.257 1.578 10.604 1.00 0.00 O ATOM 1434 CG2 THR A 90 14.282 0.906 9.396 1.00 0.00 C ATOM 0 H THR A 90 15.915 2.535 12.585 1.00 0.00 H new ATOM 0 HA THR A 90 13.534 2.723 10.913 1.00 0.00 H new ATOM 0 HB THR A 90 14.956 0.136 11.289 1.00 0.00 H new ATOM 0 HG1 THR A 90 16.779 0.934 10.081 1.00 0.00 H new ATOM 0 HG21 THR A 90 14.861 0.189 8.814 1.00 0.00 H new ATOM 0 HG22 THR A 90 13.265 0.534 9.523 1.00 0.00 H new ATOM 0 HG23 THR A 90 14.256 1.862 8.872 1.00 0.00 H new ATOM 1442 N ASN A 91 11.943 1.142 12.072 1.00 0.00 N ATOM 1443 CA ASN A 91 10.946 0.441 12.878 1.00 0.00 C ATOM 1444 C ASN A 91 10.405 -0.772 12.129 1.00 0.00 C ATOM 1445 O ASN A 91 9.911 -0.652 11.007 1.00 0.00 O ATOM 1446 CB ASN A 91 9.796 1.389 13.216 1.00 0.00 C ATOM 1447 CG ASN A 91 10.160 2.816 12.815 1.00 0.00 C ATOM 1448 OD1 ASN A 91 9.771 3.277 11.742 1.00 0.00 O ATOM 1449 ND2 ASN A 91 10.889 3.544 13.615 1.00 0.00 N ATOM 0 H ASN A 91 11.611 1.444 11.156 1.00 0.00 H new ATOM 0 HA ASN A 91 11.422 0.100 13.798 1.00 0.00 H new ATOM 0 HB2 ASN A 91 8.891 1.076 12.695 1.00 0.00 H new ATOM 0 HB3 ASN A 91 9.581 1.346 14.284 1.00 0.00 H new ATOM 0 HD21 ASN A 91 11.138 4.498 13.352 1.00 0.00 H new ATOM 0 HD22 ASN A 91 11.210 3.160 14.504 1.00 0.00 H new ATOM 1456 N ILE A 92 10.505 -1.941 12.756 1.00 0.00 N ATOM 1457 CA ILE A 92 10.025 -3.176 12.140 1.00 0.00 C ATOM 1458 C ILE A 92 8.587 -3.454 12.549 1.00 0.00 C ATOM 1459 O ILE A 92 8.320 -3.827 13.693 1.00 0.00 O ATOM 1460 CB ILE A 92 10.912 -4.347 12.561 1.00 0.00 C ATOM 1461 CG1 ILE A 92 12.377 -3.898 12.575 1.00 0.00 C ATOM 1462 CG2 ILE A 92 10.741 -5.502 11.571 1.00 0.00 C ATOM 1463 CD1 ILE A 92 12.735 -3.246 11.234 1.00 0.00 C ATOM 0 H ILE A 92 10.911 -2.060 13.684 1.00 0.00 H new ATOM 0 HA ILE A 92 10.066 -3.060 11.057 1.00 0.00 H new ATOM 0 HB ILE A 92 10.624 -4.680 13.558 1.00 0.00 H new ATOM 0 HG12 ILE A 92 12.542 -3.192 13.389 1.00 0.00 H new ATOM 0 HG13 ILE A 92 13.027 -4.753 12.759 1.00 0.00 H new ATOM 0 HG21 ILE A 92 11.374 -6.336 11.873 1.00 0.00 H new ATOM 0 HG22 ILE A 92 9.699 -5.822 11.562 1.00 0.00 H new ATOM 0 HG23 ILE A 92 11.028 -5.171 10.573 1.00 0.00 H new ATOM 0 HD11 ILE A 92 13.778 -2.929 11.250 1.00 0.00 H new ATOM 0 HD12 ILE A 92 12.587 -3.965 10.429 1.00 0.00 H new ATOM 0 HD13 ILE A 92 12.095 -2.379 11.068 1.00 0.00 H new ATOM 1475 N LEU A 93 7.666 -3.267 11.608 1.00 0.00 N ATOM 1476 CA LEU A 93 6.252 -3.498 11.884 1.00 0.00 C ATOM 1477 C LEU A 93 5.737 -4.692 11.096 1.00 0.00 C ATOM 1478 O LEU A 93 6.139 -4.919 9.955 1.00 0.00 O ATOM 1479 CB LEU A 93 5.435 -2.254 11.519 1.00 0.00 C ATOM 1480 CG LEU A 93 5.454 -1.236 12.673 1.00 0.00 C ATOM 1481 CD1 LEU A 93 6.726 -0.387 12.582 1.00 0.00 C ATOM 1482 CD2 LEU A 93 4.225 -0.325 12.584 1.00 0.00 C ATOM 0 H LEU A 93 7.870 -2.959 10.657 1.00 0.00 H new ATOM 0 HA LEU A 93 6.143 -3.706 12.948 1.00 0.00 H new ATOM 0 HB2 LEU A 93 5.842 -1.797 10.617 1.00 0.00 H new ATOM 0 HB3 LEU A 93 4.407 -2.540 11.296 1.00 0.00 H new ATOM 0 HG LEU A 93 5.437 -1.770 13.623 1.00 0.00 H new ATOM 0 HD11 LEU A 93 6.741 0.335 13.399 1.00 0.00 H new ATOM 0 HD12 LEU A 93 7.601 -1.033 12.653 1.00 0.00 H new ATOM 0 HD13 LEU A 93 6.743 0.143 11.630 1.00 0.00 H new ATOM 0 HD21 LEU A 93 4.244 0.393 13.404 1.00 0.00 H new ATOM 0 HD22 LEU A 93 4.236 0.209 11.634 1.00 0.00 H new ATOM 0 HD23 LEU A 93 3.319 -0.928 12.651 1.00 0.00 H new ATOM 1494 N LYS A 94 4.843 -5.454 11.720 1.00 0.00 N ATOM 1495 CA LYS A 94 4.275 -6.629 11.074 1.00 0.00 C ATOM 1496 C LYS A 94 2.962 -6.280 10.388 1.00 0.00 C ATOM 1497 O LYS A 94 2.155 -5.522 10.927 1.00 0.00 O ATOM 1498 CB LYS A 94 4.040 -7.731 12.104 1.00 0.00 C ATOM 1499 CG LYS A 94 2.904 -7.320 13.038 1.00 0.00 C ATOM 1500 CD LYS A 94 3.047 -8.061 14.371 1.00 0.00 C ATOM 1501 CE LYS A 94 3.857 -7.208 15.350 1.00 0.00 C ATOM 1502 NZ LYS A 94 2.943 -6.271 16.063 1.00 0.00 N ATOM 0 H LYS A 94 4.500 -5.280 12.664 1.00 0.00 H new ATOM 0 HA LYS A 94 4.981 -6.983 10.322 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.792 -8.666 11.602 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.950 -7.908 12.677 1.00 0.00 H new ATOM 0 HG2 LYS A 94 2.927 -6.243 13.204 1.00 0.00 H new ATOM 0 HG3 LYS A 94 1.942 -7.552 12.582 1.00 0.00 H new ATOM 0 HD2 LYS A 94 2.062 -8.274 14.787 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.541 -9.020 14.214 1.00 0.00 H new ATOM 0 HE2 LYS A 94 4.372 -7.847 16.067 1.00 0.00 H new ATOM 0 HE3 LYS A 94 4.624 -6.648 14.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 3.492 -5.690 16.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.471 -5.653 15.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 2.227 -6.815 16.586 1.00 0.00 H new ATOM 1516 N THR A 95 2.755 -6.836 9.197 1.00 0.00 N ATOM 1517 CA THR A 95 1.535 -6.573 8.443 1.00 0.00 C ATOM 1518 C THR A 95 0.703 -7.845 8.312 1.00 0.00 C ATOM 1519 O THR A 95 1.191 -8.948 8.557 1.00 0.00 O ATOM 1520 CB THR A 95 1.883 -6.036 7.053 1.00 0.00 C ATOM 1521 OG1 THR A 95 2.467 -7.073 6.279 1.00 0.00 O ATOM 1522 CG2 THR A 95 2.867 -4.870 7.176 1.00 0.00 C ATOM 0 H THR A 95 3.412 -7.467 8.737 1.00 0.00 H new ATOM 0 HA THR A 95 0.951 -5.826 8.980 1.00 0.00 H new ATOM 0 HB THR A 95 0.974 -5.685 6.565 1.00 0.00 H new ATOM 0 HG1 THR A 95 3.318 -7.343 6.683 1.00 0.00 H new ATOM 0 HG21 THR A 95 3.110 -4.493 6.183 1.00 0.00 H new ATOM 0 HG22 THR A 95 2.415 -4.073 7.766 1.00 0.00 H new ATOM 0 HG23 THR A 95 3.778 -5.213 7.667 1.00 0.00 H new ATOM 1530 N THR A 96 -0.558 -7.687 7.924 1.00 0.00 N ATOM 1531 CA THR A 96 -1.444 -8.832 7.769 1.00 0.00 C ATOM 1532 C THR A 96 -0.973 -9.726 6.623 1.00 0.00 C ATOM 1533 O THR A 96 -1.215 -10.933 6.627 1.00 0.00 O ATOM 1534 CB THR A 96 -2.876 -8.353 7.501 1.00 0.00 C ATOM 1535 OG1 THR A 96 -3.796 -9.268 8.078 1.00 0.00 O ATOM 1536 CG2 THR A 96 -3.122 -8.260 5.996 1.00 0.00 C ATOM 0 H THR A 96 -0.986 -6.785 7.713 1.00 0.00 H new ATOM 0 HA THR A 96 -1.425 -9.411 8.692 1.00 0.00 H new ATOM 0 HB THR A 96 -3.013 -7.367 7.946 1.00 0.00 H new ATOM 0 HG1 THR A 96 -4.711 -8.962 7.909 1.00 0.00 H new ATOM 0 HG21 THR A 96 -4.141 -7.919 5.814 1.00 0.00 H new ATOM 0 HG22 THR A 96 -2.419 -7.553 5.555 1.00 0.00 H new ATOM 0 HG23 THR A 96 -2.981 -9.241 5.543 1.00 0.00 H new ATOM 1544 N GLN A 97 -0.310 -9.123 5.639 1.00 0.00 N ATOM 1545 CA GLN A 97 0.174 -9.873 4.493 1.00 0.00 C ATOM 1546 C GLN A 97 1.017 -11.058 4.956 1.00 0.00 C ATOM 1547 O GLN A 97 1.202 -12.027 4.219 1.00 0.00 O ATOM 1548 CB GLN A 97 1.022 -8.961 3.602 1.00 0.00 C ATOM 1549 CG GLN A 97 1.634 -9.777 2.462 1.00 0.00 C ATOM 1550 CD GLN A 97 3.073 -10.159 2.801 1.00 0.00 C ATOM 1551 OE1 GLN A 97 3.353 -10.629 3.903 1.00 0.00 O ATOM 1552 NE2 GLN A 97 4.010 -9.982 1.913 1.00 0.00 N ATOM 0 H GLN A 97 -0.099 -8.125 5.616 1.00 0.00 H new ATOM 0 HA GLN A 97 -0.681 -10.244 3.928 1.00 0.00 H new ATOM 0 HB2 GLN A 97 0.406 -8.158 3.197 1.00 0.00 H new ATOM 0 HB3 GLN A 97 1.811 -8.493 4.191 1.00 0.00 H new ATOM 0 HG2 GLN A 97 1.042 -10.676 2.290 1.00 0.00 H new ATOM 0 HG3 GLN A 97 1.611 -9.199 1.538 1.00 0.00 H new ATOM 0 HE21 GLN A 97 3.779 -9.592 0.999 1.00 0.00 H new ATOM 0 HE22 GLN A 97 4.974 -10.233 2.132 1.00 0.00 H new ATOM 1561 N GLY A 98 1.524 -10.976 6.182 1.00 0.00 N ATOM 1562 CA GLY A 98 2.342 -12.052 6.731 1.00 0.00 C ATOM 1563 C GLY A 98 3.822 -11.701 6.664 1.00 0.00 C ATOM 1564 O GLY A 98 4.676 -12.524 6.991 1.00 0.00 O ATOM 0 H GLY A 98 1.385 -10.184 6.809 1.00 0.00 H new ATOM 0 HA2 GLY A 98 2.056 -12.240 7.766 1.00 0.00 H new ATOM 0 HA3 GLY A 98 2.158 -12.973 6.177 1.00 0.00 H new ATOM 1568 N SER A 99 4.114 -10.474 6.240 1.00 0.00 N ATOM 1569 CA SER A 99 5.498 -10.017 6.134 1.00 0.00 C ATOM 1570 C SER A 99 5.709 -8.755 6.964 1.00 0.00 C ATOM 1571 O SER A 99 4.750 -8.106 7.384 1.00 0.00 O ATOM 1572 CB SER A 99 5.842 -9.736 4.671 1.00 0.00 C ATOM 1573 OG SER A 99 7.193 -9.305 4.582 1.00 0.00 O ATOM 0 H SER A 99 3.417 -9.782 5.966 1.00 0.00 H new ATOM 0 HA SER A 99 6.153 -10.801 6.515 1.00 0.00 H new ATOM 0 HB2 SER A 99 5.694 -10.634 4.071 1.00 0.00 H new ATOM 0 HB3 SER A 99 5.177 -8.972 4.269 1.00 0.00 H new ATOM 0 HG SER A 99 7.418 -9.125 3.645 1.00 0.00 H new ATOM 1579 N LYS A 100 6.973 -8.417 7.201 1.00 0.00 N ATOM 1580 CA LYS A 100 7.306 -7.232 7.985 1.00 0.00 C ATOM 1581 C LYS A 100 7.719 -6.084 7.074 1.00 0.00 C ATOM 1582 O LYS A 100 8.197 -6.304 5.961 1.00 0.00 O ATOM 1583 CB LYS A 100 8.446 -7.551 8.956 1.00 0.00 C ATOM 1584 CG LYS A 100 9.424 -8.524 8.291 1.00 0.00 C ATOM 1585 CD LYS A 100 10.625 -8.749 9.211 1.00 0.00 C ATOM 1586 CE LYS A 100 11.491 -9.882 8.654 1.00 0.00 C ATOM 1587 NZ LYS A 100 12.149 -9.432 7.396 1.00 0.00 N ATOM 0 H LYS A 100 7.779 -8.943 6.864 1.00 0.00 H new ATOM 0 HA LYS A 100 6.422 -6.933 8.548 1.00 0.00 H new ATOM 0 HB2 LYS A 100 8.964 -6.635 9.240 1.00 0.00 H new ATOM 0 HB3 LYS A 100 8.047 -7.988 9.871 1.00 0.00 H new ATOM 0 HG2 LYS A 100 8.927 -9.472 8.086 1.00 0.00 H new ATOM 0 HG3 LYS A 100 9.756 -8.124 7.333 1.00 0.00 H new ATOM 0 HD2 LYS A 100 11.212 -7.834 9.290 1.00 0.00 H new ATOM 0 HD3 LYS A 100 10.285 -8.998 10.216 1.00 0.00 H new ATOM 0 HE2 LYS A 100 12.244 -10.173 9.387 1.00 0.00 H new ATOM 0 HE3 LYS A 100 10.877 -10.762 8.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 12.852 -10.139 7.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 11.433 -9.321 6.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 12.623 -8.521 7.559 1.00 0.00 H new ATOM 1601 N ILE A 101 7.529 -4.858 7.555 1.00 0.00 N ATOM 1602 CA ILE A 101 7.883 -3.677 6.780 1.00 0.00 C ATOM 1603 C ILE A 101 8.710 -2.717 7.625 1.00 0.00 C ATOM 1604 O ILE A 101 8.372 -2.437 8.777 1.00 0.00 O ATOM 1605 CB ILE A 101 6.615 -2.979 6.287 1.00 0.00 C ATOM 1606 CG1 ILE A 101 6.995 -1.878 5.296 1.00 0.00 C ATOM 1607 CG2 ILE A 101 5.875 -2.365 7.477 1.00 0.00 C ATOM 1608 CD1 ILE A 101 5.732 -1.281 4.666 1.00 0.00 C ATOM 0 H ILE A 101 7.134 -4.659 8.474 1.00 0.00 H new ATOM 0 HA ILE A 101 8.478 -3.987 5.921 1.00 0.00 H new ATOM 0 HB ILE A 101 5.967 -3.704 5.794 1.00 0.00 H new ATOM 0 HG12 ILE A 101 7.561 -1.098 5.806 1.00 0.00 H new ATOM 0 HG13 ILE A 101 7.642 -2.285 4.519 1.00 0.00 H new ATOM 0 HG21 ILE A 101 4.971 -1.867 7.126 1.00 0.00 H new ATOM 0 HG22 ILE A 101 5.606 -3.151 8.183 1.00 0.00 H new ATOM 0 HG23 ILE A 101 6.520 -1.639 7.971 1.00 0.00 H new ATOM 0 HD11 ILE A 101 6.012 -0.498 3.962 1.00 0.00 H new ATOM 0 HD12 ILE A 101 5.183 -2.062 4.140 1.00 0.00 H new ATOM 0 HD13 ILE A 101 5.101 -0.858 5.447 1.00 0.00 H new ATOM 1620 N PHE A 102 9.803 -2.227 7.049 1.00 0.00 N ATOM 1621 CA PHE A 102 10.684 -1.308 7.760 1.00 0.00 C ATOM 1622 C PHE A 102 10.329 0.138 7.448 1.00 0.00 C ATOM 1623 O PHE A 102 10.319 0.546 6.286 1.00 0.00 O ATOM 1624 CB PHE A 102 12.139 -1.564 7.362 1.00 0.00 C ATOM 1625 CG PHE A 102 12.292 -2.989 6.886 1.00 0.00 C ATOM 1626 CD1 PHE A 102 13.066 -3.268 5.752 1.00 0.00 C ATOM 1627 CD2 PHE A 102 11.664 -4.030 7.578 1.00 0.00 C ATOM 1628 CE1 PHE A 102 13.206 -4.589 5.310 1.00 0.00 C ATOM 1629 CE2 PHE A 102 11.804 -5.348 7.136 1.00 0.00 C ATOM 1630 CZ PHE A 102 12.575 -5.630 6.002 1.00 0.00 C ATOM 0 H PHE A 102 10.098 -2.449 6.098 1.00 0.00 H new ATOM 0 HA PHE A 102 10.557 -1.480 8.829 1.00 0.00 H new ATOM 0 HB2 PHE A 102 12.438 -0.873 6.574 1.00 0.00 H new ATOM 0 HB3 PHE A 102 12.796 -1.382 8.212 1.00 0.00 H new ATOM 0 HD1 PHE A 102 13.554 -2.465 5.220 1.00 0.00 H new ATOM 0 HD2 PHE A 102 11.071 -3.815 8.454 1.00 0.00 H new ATOM 0 HE1 PHE A 102 13.801 -4.805 4.435 1.00 0.00 H new ATOM 0 HE2 PHE A 102 11.317 -6.150 7.670 1.00 0.00 H new ATOM 0 HZ PHE A 102 12.683 -6.649 5.661 1.00 0.00 H new ATOM 1640 N LEU A 103 10.042 0.909 8.495 1.00 0.00 N ATOM 1641 CA LEU A 103 9.685 2.314 8.325 1.00 0.00 C ATOM 1642 C LEU A 103 10.743 3.209 8.948 1.00 0.00 C ATOM 1643 O LEU A 103 11.332 2.865 9.970 1.00 0.00 O ATOM 1644 CB LEU A 103 8.325 2.598 8.975 1.00 0.00 C ATOM 1645 CG LEU A 103 7.208 2.405 7.947 1.00 0.00 C ATOM 1646 CD1 LEU A 103 7.276 3.489 6.875 1.00 0.00 C ATOM 1647 CD2 LEU A 103 7.355 1.036 7.290 1.00 0.00 C ATOM 0 H LEU A 103 10.050 0.587 9.463 1.00 0.00 H new ATOM 0 HA LEU A 103 9.624 2.526 7.257 1.00 0.00 H new ATOM 0 HB2 LEU A 103 8.171 1.931 9.823 1.00 0.00 H new ATOM 0 HB3 LEU A 103 8.303 3.616 9.363 1.00 0.00 H new ATOM 0 HG LEU A 103 6.247 2.472 8.456 1.00 0.00 H new ATOM 0 HD11 LEU A 103 6.475 3.337 6.152 1.00 0.00 H new ATOM 0 HD12 LEU A 103 7.164 4.468 7.340 1.00 0.00 H new ATOM 0 HD13 LEU A 103 8.238 3.437 6.366 1.00 0.00 H new ATOM 0 HD21 LEU A 103 6.560 0.897 6.557 1.00 0.00 H new ATOM 0 HD22 LEU A 103 8.323 0.973 6.792 1.00 0.00 H new ATOM 0 HD23 LEU A 103 7.288 0.258 8.051 1.00 0.00 H new ATOM 1659 N LYS A 104 10.978 4.360 8.322 1.00 0.00 N ATOM 1660 CA LYS A 104 11.969 5.298 8.828 1.00 0.00 C ATOM 1661 C LYS A 104 11.700 6.700 8.297 1.00 0.00 C ATOM 1662 O LYS A 104 11.585 6.903 7.091 1.00 0.00 O ATOM 1663 CB LYS A 104 13.371 4.848 8.408 1.00 0.00 C ATOM 1664 CG LYS A 104 14.392 5.919 8.801 1.00 0.00 C ATOM 1665 CD LYS A 104 15.805 5.346 8.679 1.00 0.00 C ATOM 1666 CE LYS A 104 16.056 4.903 7.237 1.00 0.00 C ATOM 1667 NZ LYS A 104 15.644 3.480 7.076 1.00 0.00 N ATOM 0 H LYS A 104 10.500 4.661 7.473 1.00 0.00 H new ATOM 0 HA LYS A 104 11.904 5.318 9.916 1.00 0.00 H new ATOM 0 HB2 LYS A 104 13.619 3.901 8.887 1.00 0.00 H new ATOM 0 HB3 LYS A 104 13.403 4.678 7.332 1.00 0.00 H new ATOM 0 HG2 LYS A 104 14.285 6.792 8.157 1.00 0.00 H new ATOM 0 HG3 LYS A 104 14.210 6.252 9.823 1.00 0.00 H new ATOM 0 HD2 LYS A 104 16.539 6.096 8.973 1.00 0.00 H new ATOM 0 HD3 LYS A 104 15.925 4.500 9.356 1.00 0.00 H new ATOM 0 HE2 LYS A 104 15.496 5.535 6.548 1.00 0.00 H new ATOM 0 HE3 LYS A 104 17.111 5.018 6.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 16.391 2.957 6.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 15.492 3.055 8.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 14.762 3.434 6.527 1.00 0.00 H new ATOM 1681 N GLU A 105 11.603 7.664 9.207 1.00 0.00 N ATOM 1682 CA GLU A 105 11.354 9.049 8.819 1.00 0.00 C ATOM 1683 C GLU A 105 12.591 9.901 9.081 1.00 0.00 C ATOM 1684 O GLU A 105 13.143 9.889 10.181 1.00 0.00 O ATOM 1685 CB GLU A 105 10.169 9.611 9.607 1.00 0.00 C ATOM 1686 CG GLU A 105 9.978 11.087 9.254 1.00 0.00 C ATOM 1687 CD GLU A 105 8.495 11.396 9.091 1.00 0.00 C ATOM 1688 OE1 GLU A 105 7.799 11.409 10.092 1.00 0.00 O ATOM 1689 OE2 GLU A 105 8.076 11.616 7.966 1.00 0.00 O ATOM 0 H GLU A 105 11.692 7.514 10.212 1.00 0.00 H new ATOM 0 HA GLU A 105 11.122 9.074 7.754 1.00 0.00 H new ATOM 0 HB2 GLU A 105 9.264 9.050 9.374 1.00 0.00 H new ATOM 0 HB3 GLU A 105 10.345 9.501 10.677 1.00 0.00 H new ATOM 0 HG2 GLU A 105 10.405 11.715 10.036 1.00 0.00 H new ATOM 0 HG3 GLU A 105 10.510 11.321 8.332 1.00 0.00 H new ATOM 1696 N VAL A 106 13.022 10.637 8.062 1.00 0.00 N ATOM 1697 CA VAL A 106 14.198 11.493 8.191 1.00 0.00 C ATOM 1698 C VAL A 106 13.948 12.850 7.542 1.00 0.00 C ATOM 1699 O VAL A 106 13.299 12.938 6.500 1.00 0.00 O ATOM 1700 CB VAL A 106 15.404 10.825 7.527 1.00 0.00 C ATOM 1701 CG1 VAL A 106 16.477 11.876 7.237 1.00 0.00 C ATOM 1702 CG2 VAL A 106 15.973 9.763 8.466 1.00 0.00 C ATOM 0 H VAL A 106 12.579 10.659 7.143 1.00 0.00 H new ATOM 0 HA VAL A 106 14.401 11.642 9.252 1.00 0.00 H new ATOM 0 HB VAL A 106 15.093 10.359 6.592 1.00 0.00 H new ATOM 0 HG11 VAL A 106 17.335 11.399 6.764 1.00 0.00 H new ATOM 0 HG12 VAL A 106 16.071 12.636 6.569 1.00 0.00 H new ATOM 0 HG13 VAL A 106 16.790 12.343 8.171 1.00 0.00 H new ATOM 0 HG21 VAL A 106 16.833 9.285 7.996 1.00 0.00 H new ATOM 0 HG22 VAL A 106 16.284 10.232 9.400 1.00 0.00 H new ATOM 0 HG23 VAL A 106 15.209 9.014 8.673 1.00 0.00 H new ATOM 1712 N ASN A 107 14.467 13.903 8.168 1.00 0.00 N ATOM 1713 CA ASN A 107 14.296 15.252 7.643 1.00 0.00 C ATOM 1714 C ASN A 107 12.842 15.497 7.257 1.00 0.00 C ATOM 1715 O ASN A 107 12.558 16.047 6.193 1.00 0.00 O ATOM 1716 CB ASN A 107 15.190 15.453 6.417 1.00 0.00 C ATOM 1717 CG ASN A 107 16.657 15.395 6.827 1.00 0.00 C ATOM 1718 OD1 ASN A 107 16.972 15.051 7.966 1.00 0.00 O ATOM 1719 ND2 ASN A 107 17.581 15.714 5.961 1.00 0.00 N ATOM 0 H ASN A 107 15.005 13.848 9.033 1.00 0.00 H new ATOM 0 HA ASN A 107 14.579 15.962 8.421 1.00 0.00 H new ATOM 0 HB2 ASN A 107 14.981 14.683 5.674 1.00 0.00 H new ATOM 0 HB3 ASN A 107 14.972 16.414 5.951 1.00 0.00 H new ATOM 0 HD21 ASN A 107 18.565 15.678 6.228 1.00 0.00 H new ATOM 0 HD22 ASN A 107 17.319 15.999 5.017 1.00 0.00 H new ATOM 1726 N ASP A 108 11.927 15.085 8.129 1.00 0.00 N ATOM 1727 CA ASP A 108 10.503 15.264 7.869 1.00 0.00 C ATOM 1728 C ASP A 108 10.114 14.623 6.541 1.00 0.00 C ATOM 1729 O ASP A 108 9.307 15.173 5.791 1.00 0.00 O ATOM 1730 CB ASP A 108 10.158 16.755 7.840 1.00 0.00 C ATOM 1731 CG ASP A 108 10.452 17.384 9.196 1.00 0.00 C ATOM 1732 OD1 ASP A 108 11.606 17.687 9.449 1.00 0.00 O ATOM 1733 OD2 ASP A 108 9.518 17.556 9.962 1.00 0.00 O ATOM 0 H ASP A 108 12.144 14.628 9.015 1.00 0.00 H new ATOM 0 HA ASP A 108 9.945 14.779 8.670 1.00 0.00 H new ATOM 0 HB2 ASP A 108 10.737 17.256 7.064 1.00 0.00 H new ATOM 0 HB3 ASP A 108 9.106 16.888 7.588 1.00 0.00 H new ATOM 1738 N THR A 109 10.694 13.462 6.259 1.00 0.00 N ATOM 1739 CA THR A 109 10.402 12.751 5.017 1.00 0.00 C ATOM 1740 C THR A 109 10.127 11.277 5.289 1.00 0.00 C ATOM 1741 O THR A 109 10.916 10.604 5.957 1.00 0.00 O ATOM 1742 CB THR A 109 11.583 12.872 4.056 1.00 0.00 C ATOM 1743 OG1 THR A 109 11.994 14.231 3.988 1.00 0.00 O ATOM 1744 CG2 THR A 109 11.148 12.397 2.672 1.00 0.00 C ATOM 0 H THR A 109 11.365 12.994 6.868 1.00 0.00 H new ATOM 0 HA THR A 109 9.515 13.200 4.570 1.00 0.00 H new ATOM 0 HB THR A 109 12.414 12.261 4.408 1.00 0.00 H new ATOM 0 HG1 THR A 109 12.463 14.473 4.814 1.00 0.00 H new ATOM 0 HG21 THR A 109 11.985 12.480 1.979 1.00 0.00 H new ATOM 0 HG22 THR A 109 10.826 11.357 2.729 1.00 0.00 H new ATOM 0 HG23 THR A 109 10.322 13.014 2.318 1.00 0.00 H new ATOM 1752 N LEU A 110 9.005 10.776 4.771 1.00 0.00 N ATOM 1753 CA LEU A 110 8.649 9.386 4.971 1.00 0.00 C ATOM 1754 C LEU A 110 9.504 8.483 4.083 1.00 0.00 C ATOM 1755 O LEU A 110 9.332 8.457 2.857 1.00 0.00 O ATOM 1756 CB LEU A 110 7.175 9.176 4.632 1.00 0.00 C ATOM 1757 CG LEU A 110 6.608 8.035 5.476 1.00 0.00 C ATOM 1758 CD1 LEU A 110 5.194 7.713 4.997 1.00 0.00 C ATOM 1759 CD2 LEU A 110 7.485 6.785 5.324 1.00 0.00 C ATOM 0 H LEU A 110 8.338 11.312 4.216 1.00 0.00 H new ATOM 0 HA LEU A 110 8.827 9.130 6.015 1.00 0.00 H new ATOM 0 HB2 LEU A 110 6.615 10.092 4.819 1.00 0.00 H new ATOM 0 HB3 LEU A 110 7.065 8.946 3.572 1.00 0.00 H new ATOM 0 HG LEU A 110 6.590 8.338 6.523 1.00 0.00 H new ATOM 0 HD11 LEU A 110 4.784 6.899 5.595 1.00 0.00 H new ATOM 0 HD12 LEU A 110 4.564 8.596 5.104 1.00 0.00 H new ATOM 0 HD13 LEU A 110 5.224 7.414 3.949 1.00 0.00 H new ATOM 0 HD21 LEU A 110 7.074 5.977 5.929 1.00 0.00 H new ATOM 0 HD22 LEU A 110 7.507 6.481 4.278 1.00 0.00 H new ATOM 0 HD23 LEU A 110 8.498 7.009 5.658 1.00 0.00 H new ATOM 1771 N LEU A 111 10.412 7.738 4.711 1.00 0.00 N ATOM 1772 CA LEU A 111 11.287 6.830 3.979 1.00 0.00 C ATOM 1773 C LEU A 111 11.041 5.391 4.412 1.00 0.00 C ATOM 1774 O LEU A 111 11.234 5.036 5.578 1.00 0.00 O ATOM 1775 CB LEU A 111 12.755 7.210 4.221 1.00 0.00 C ATOM 1776 CG LEU A 111 12.969 8.687 3.872 1.00 0.00 C ATOM 1777 CD1 LEU A 111 14.433 9.040 4.015 1.00 0.00 C ATOM 1778 CD2 LEU A 111 12.568 8.921 2.423 1.00 0.00 C ATOM 0 H LEU A 111 10.559 7.746 5.720 1.00 0.00 H new ATOM 0 HA LEU A 111 11.068 6.914 2.915 1.00 0.00 H new ATOM 0 HB2 LEU A 111 13.021 7.030 5.263 1.00 0.00 H new ATOM 0 HB3 LEU A 111 13.408 6.584 3.613 1.00 0.00 H new ATOM 0 HG LEU A 111 12.368 9.301 4.543 1.00 0.00 H new ATOM 0 HD11 LEU A 111 14.580 10.091 3.766 1.00 0.00 H new ATOM 0 HD12 LEU A 111 14.751 8.863 5.042 1.00 0.00 H new ATOM 0 HD13 LEU A 111 15.024 8.421 3.340 1.00 0.00 H new ATOM 0 HD21 LEU A 111 12.718 9.970 2.169 1.00 0.00 H new ATOM 0 HD22 LEU A 111 13.181 8.298 1.771 1.00 0.00 H new ATOM 0 HD23 LEU A 111 11.518 8.662 2.290 1.00 0.00 H new ATOM 1790 N VAL A 112 10.611 4.564 3.460 1.00 0.00 N ATOM 1791 CA VAL A 112 10.338 3.161 3.754 1.00 0.00 C ATOM 1792 C VAL A 112 11.407 2.277 3.129 1.00 0.00 C ATOM 1793 O VAL A 112 11.902 2.575 2.043 1.00 0.00 O ATOM 1794 CB VAL A 112 8.964 2.767 3.209 1.00 0.00 C ATOM 1795 CG1 VAL A 112 8.855 3.177 1.744 1.00 0.00 C ATOM 1796 CG2 VAL A 112 8.780 1.253 3.334 1.00 0.00 C ATOM 0 H VAL A 112 10.446 4.838 2.491 1.00 0.00 H new ATOM 0 HA VAL A 112 10.347 3.024 4.835 1.00 0.00 H new ATOM 0 HB VAL A 112 8.189 3.275 3.782 1.00 0.00 H new ATOM 0 HG11 VAL A 112 7.875 2.895 1.359 1.00 0.00 H new ATOM 0 HG12 VAL A 112 8.982 4.256 1.658 1.00 0.00 H new ATOM 0 HG13 VAL A 112 9.630 2.673 1.167 1.00 0.00 H new ATOM 0 HG21 VAL A 112 7.801 0.972 2.946 1.00 0.00 H new ATOM 0 HG22 VAL A 112 9.556 0.744 2.763 1.00 0.00 H new ATOM 0 HG23 VAL A 112 8.851 0.963 4.382 1.00 0.00 H new ATOM 1806 N ASN A 113 11.761 1.196 3.823 1.00 0.00 N ATOM 1807 CA ASN A 113 12.778 0.274 3.328 1.00 0.00 C ATOM 1808 C ASN A 113 14.087 1.015 3.071 1.00 0.00 C ATOM 1809 O ASN A 113 15.036 0.902 3.848 1.00 0.00 O ATOM 1810 CB ASN A 113 12.299 -0.397 2.037 1.00 0.00 C ATOM 1811 CG ASN A 113 11.397 -1.580 2.367 1.00 0.00 C ATOM 1812 OD1 ASN A 113 10.750 -1.600 3.500 1.00 0.00 O flip ATOM 1813 ND2 ASN A 113 11.276 -2.510 1.569 1.00 0.00 N flip ATOM 0 H ASN A 113 11.360 0.939 4.725 1.00 0.00 H new ATOM 0 HA ASN A 113 12.949 -0.491 4.085 1.00 0.00 H new ATOM 0 HB2 ASN A 113 11.758 0.323 1.423 1.00 0.00 H new ATOM 0 HB3 ASN A 113 13.156 -0.734 1.453 1.00 0.00 H new ATOM 0 HD21 ASN A 113 11.783 -2.492 0.684 1.00 0.00 H new ATOM 0 HD22 ASN A 113 10.669 -3.298 1.793 1.00 0.00 H new ATOM 1820 N GLU A 114 14.128 1.775 1.983 1.00 0.00 N ATOM 1821 CA GLU A 114 15.322 2.537 1.637 1.00 0.00 C ATOM 1822 C GLU A 114 15.049 3.459 0.452 1.00 0.00 C ATOM 1823 O GLU A 114 15.796 3.467 -0.526 1.00 0.00 O ATOM 1824 CB GLU A 114 16.466 1.583 1.292 1.00 0.00 C ATOM 1825 CG GLU A 114 17.801 2.287 1.530 1.00 0.00 C ATOM 1826 CD GLU A 114 18.941 1.444 0.970 1.00 0.00 C ATOM 1827 OE1 GLU A 114 19.487 1.826 -0.052 1.00 0.00 O ATOM 1828 OE2 GLU A 114 19.250 0.428 1.570 1.00 0.00 O ATOM 0 H GLU A 114 13.353 1.880 1.328 1.00 0.00 H new ATOM 0 HA GLU A 114 15.602 3.146 2.496 1.00 0.00 H new ATOM 0 HB2 GLU A 114 16.402 0.684 1.905 1.00 0.00 H new ATOM 0 HB3 GLU A 114 16.389 1.266 0.252 1.00 0.00 H new ATOM 0 HG2 GLU A 114 17.795 3.267 1.054 1.00 0.00 H new ATOM 0 HG3 GLU A 114 17.950 2.452 2.597 1.00 0.00 H new ATOM 1835 N LEU A 115 13.968 4.230 0.544 1.00 0.00 N ATOM 1836 CA LEU A 115 13.597 5.140 -0.533 1.00 0.00 C ATOM 1837 C LEU A 115 12.501 6.093 -0.075 1.00 0.00 C ATOM 1838 O LEU A 115 11.939 5.933 1.011 1.00 0.00 O ATOM 1839 CB LEU A 115 13.103 4.345 -1.749 1.00 0.00 C ATOM 1840 CG LEU A 115 12.125 3.238 -1.304 1.00 0.00 C ATOM 1841 CD1 LEU A 115 10.686 3.770 -1.309 1.00 0.00 C ATOM 1842 CD2 LEU A 115 12.241 2.047 -2.256 1.00 0.00 C ATOM 0 H LEU A 115 13.339 4.242 1.347 1.00 0.00 H new ATOM 0 HA LEU A 115 14.479 5.718 -0.810 1.00 0.00 H new ATOM 0 HB2 LEU A 115 12.609 5.014 -2.453 1.00 0.00 H new ATOM 0 HB3 LEU A 115 13.951 3.902 -2.271 1.00 0.00 H new ATOM 0 HG LEU A 115 12.378 2.922 -0.292 1.00 0.00 H new ATOM 0 HD11 LEU A 115 10.005 2.980 -0.993 1.00 0.00 H new ATOM 0 HD12 LEU A 115 10.607 4.613 -0.622 1.00 0.00 H new ATOM 0 HD13 LEU A 115 10.422 4.096 -2.315 1.00 0.00 H new ATOM 0 HD21 LEU A 115 11.551 1.263 -1.944 1.00 0.00 H new ATOM 0 HD22 LEU A 115 11.994 2.365 -3.269 1.00 0.00 H new ATOM 0 HD23 LEU A 115 13.261 1.662 -2.235 1.00 0.00 H new ATOM 1854 N LYS A 116 12.199 7.079 -0.913 1.00 0.00 N ATOM 1855 CA LYS A 116 11.169 8.055 -0.588 1.00 0.00 C ATOM 1856 C LYS A 116 9.819 7.660 -1.169 1.00 0.00 C ATOM 1857 O LYS A 116 9.739 7.103 -2.263 1.00 0.00 O ATOM 1858 CB LYS A 116 11.578 9.428 -1.113 1.00 0.00 C ATOM 1859 CG LYS A 116 10.379 10.381 -1.062 1.00 0.00 C ATOM 1860 CD LYS A 116 10.868 11.821 -0.886 1.00 0.00 C ATOM 1861 CE LYS A 116 11.911 12.154 -1.952 1.00 0.00 C ATOM 1862 NZ LYS A 116 11.451 11.640 -3.273 1.00 0.00 N ATOM 0 H LYS A 116 12.650 7.222 -1.816 1.00 0.00 H new ATOM 0 HA LYS A 116 11.068 8.089 0.497 1.00 0.00 H new ATOM 0 HB2 LYS A 116 12.397 9.827 -0.515 1.00 0.00 H new ATOM 0 HB3 LYS A 116 11.943 9.342 -2.137 1.00 0.00 H new ATOM 0 HG2 LYS A 116 9.795 10.295 -1.978 1.00 0.00 H new ATOM 0 HG3 LYS A 116 9.720 10.108 -0.238 1.00 0.00 H new ATOM 0 HD2 LYS A 116 10.027 12.511 -0.960 1.00 0.00 H new ATOM 0 HD3 LYS A 116 11.298 11.949 0.107 1.00 0.00 H new ATOM 0 HE2 LYS A 116 12.064 13.232 -2.002 1.00 0.00 H new ATOM 0 HE3 LYS A 116 12.870 11.708 -1.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 11.839 12.236 -4.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 11.780 10.662 -3.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 10.412 11.663 -3.312 1.00 0.00 H new ATOM 1876 N SER A 117 8.761 7.956 -0.421 1.00 0.00 N ATOM 1877 CA SER A 117 7.398 7.633 -0.869 1.00 0.00 C ATOM 1878 C SER A 117 6.862 8.701 -1.794 1.00 0.00 C ATOM 1879 O SER A 117 7.325 9.842 -1.779 1.00 0.00 O ATOM 1880 CB SER A 117 6.475 7.490 0.336 1.00 0.00 C ATOM 1881 OG SER A 117 6.640 8.614 1.189 1.00 0.00 O ATOM 0 H SER A 117 8.812 8.414 0.489 1.00 0.00 H new ATOM 0 HA SER A 117 7.436 6.691 -1.416 1.00 0.00 H new ATOM 0 HB2 SER A 117 5.438 7.417 0.008 1.00 0.00 H new ATOM 0 HB3 SER A 117 6.704 6.572 0.877 1.00 0.00 H new ATOM 0 HG SER A 117 5.857 8.700 1.772 1.00 0.00 H new ATOM 1887 N LYS A 118 5.893 8.317 -2.622 1.00 0.00 N ATOM 1888 CA LYS A 118 5.320 9.240 -3.559 1.00 0.00 C ATOM 1889 C LYS A 118 4.410 10.223 -2.840 1.00 0.00 C ATOM 1890 O LYS A 118 4.464 11.425 -3.093 1.00 0.00 O ATOM 1891 CB LYS A 118 4.527 8.475 -4.618 1.00 0.00 C ATOM 1892 CG LYS A 118 4.955 8.937 -6.018 1.00 0.00 C ATOM 1893 CD LYS A 118 4.637 10.432 -6.228 1.00 0.00 C ATOM 1894 CE LYS A 118 3.161 10.673 -5.965 1.00 0.00 C ATOM 1895 NZ LYS A 118 2.696 11.840 -6.765 1.00 0.00 N ATOM 0 H LYS A 118 5.500 7.376 -2.652 1.00 0.00 H new ATOM 0 HA LYS A 118 6.123 9.796 -4.043 1.00 0.00 H new ATOM 0 HB2 LYS A 118 4.697 7.404 -4.510 1.00 0.00 H new ATOM 0 HB3 LYS A 118 3.459 8.644 -4.479 1.00 0.00 H new ATOM 0 HG2 LYS A 118 6.023 8.767 -6.150 1.00 0.00 H new ATOM 0 HG3 LYS A 118 4.442 8.343 -6.774 1.00 0.00 H new ATOM 0 HD2 LYS A 118 5.242 11.042 -5.557 1.00 0.00 H new ATOM 0 HD3 LYS A 118 4.890 10.730 -7.245 1.00 0.00 H new ATOM 0 HE2 LYS A 118 2.585 9.786 -6.228 1.00 0.00 H new ATOM 0 HE3 LYS A 118 2.996 10.858 -4.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 1.685 12.004 -6.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 3.238 12.685 -6.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 2.840 11.647 -7.777 1.00 0.00 H new ATOM 1909 N GLU A 119 3.574 9.697 -1.945 1.00 0.00 N ATOM 1910 CA GLU A 119 2.645 10.539 -1.192 1.00 0.00 C ATOM 1911 C GLU A 119 1.858 9.700 -0.186 1.00 0.00 C ATOM 1912 O GLU A 119 1.068 8.840 -0.565 1.00 0.00 O ATOM 1913 CB GLU A 119 1.661 11.235 -2.147 1.00 0.00 C ATOM 1914 CG GLU A 119 0.764 12.188 -1.356 1.00 0.00 C ATOM 1915 CD GLU A 119 0.966 13.619 -1.844 1.00 0.00 C ATOM 1916 OE1 GLU A 119 1.765 14.318 -1.243 1.00 0.00 O ATOM 1917 OE2 GLU A 119 0.321 13.994 -2.809 1.00 0.00 O ATOM 0 H GLU A 119 3.521 8.702 -1.725 1.00 0.00 H new ATOM 0 HA GLU A 119 3.226 11.291 -0.658 1.00 0.00 H new ATOM 0 HB2 GLU A 119 2.209 11.786 -2.911 1.00 0.00 H new ATOM 0 HB3 GLU A 119 1.053 10.492 -2.663 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -0.280 11.899 -1.473 1.00 0.00 H new ATOM 0 HG3 GLU A 119 0.996 12.121 -0.293 1.00 0.00 H new ATOM 1924 N SER A 120 2.081 9.954 1.098 1.00 0.00 N ATOM 1925 CA SER A 120 1.388 9.218 2.141 1.00 0.00 C ATOM 1926 C SER A 120 0.901 10.169 3.219 1.00 0.00 C ATOM 1927 O SER A 120 1.035 11.385 3.079 1.00 0.00 O ATOM 1928 CB SER A 120 2.346 8.219 2.766 1.00 0.00 C ATOM 1929 OG SER A 120 3.356 8.948 3.439 1.00 0.00 O ATOM 0 H SER A 120 2.733 10.661 1.438 1.00 0.00 H new ATOM 0 HA SER A 120 0.534 8.702 1.703 1.00 0.00 H new ATOM 0 HB2 SER A 120 1.818 7.567 3.462 1.00 0.00 H new ATOM 0 HB3 SER A 120 2.783 7.579 2.000 1.00 0.00 H new ATOM 0 HG SER A 120 4.155 8.997 2.874 1.00 0.00 H new ATOM 1935 N ASP A 121 0.346 9.603 4.290 1.00 0.00 N ATOM 1936 CA ASP A 121 -0.154 10.411 5.410 1.00 0.00 C ATOM 1937 C ASP A 121 -1.583 10.890 5.154 1.00 0.00 C ATOM 1938 O ASP A 121 -2.216 11.494 6.021 1.00 0.00 O ATOM 1939 CB ASP A 121 0.758 11.622 5.634 1.00 0.00 C ATOM 1940 CG ASP A 121 0.772 12.006 7.105 1.00 0.00 C ATOM 1941 OD1 ASP A 121 0.509 13.161 7.395 1.00 0.00 O ATOM 1942 OD2 ASP A 121 1.052 11.143 7.918 1.00 0.00 O ATOM 0 H ASP A 121 0.230 8.597 4.409 1.00 0.00 H new ATOM 0 HA ASP A 121 -0.155 9.782 6.300 1.00 0.00 H new ATOM 0 HB2 ASP A 121 1.770 11.390 5.302 1.00 0.00 H new ATOM 0 HB3 ASP A 121 0.411 12.463 5.035 1.00 0.00 H new ATOM 1947 N ILE A 122 -2.086 10.604 3.965 1.00 0.00 N ATOM 1948 CA ILE A 122 -3.437 10.994 3.595 1.00 0.00 C ATOM 1949 C ILE A 122 -4.432 10.411 4.588 1.00 0.00 C ATOM 1950 O ILE A 122 -4.617 9.198 4.663 1.00 0.00 O ATOM 1951 CB ILE A 122 -3.761 10.497 2.186 1.00 0.00 C ATOM 1952 CG1 ILE A 122 -2.478 10.016 1.468 1.00 0.00 C ATOM 1953 CG2 ILE A 122 -4.412 11.615 1.373 1.00 0.00 C ATOM 1954 CD1 ILE A 122 -1.542 11.214 1.234 1.00 0.00 C ATOM 0 H ILE A 122 -1.578 10.102 3.237 1.00 0.00 H new ATOM 0 HA ILE A 122 -3.508 12.082 3.611 1.00 0.00 H new ATOM 0 HB ILE A 122 -4.453 9.659 2.270 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -1.974 9.259 2.069 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -2.734 9.549 0.517 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -4.639 11.251 0.371 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -5.334 11.931 1.862 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -3.728 12.461 1.306 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -0.638 10.876 0.728 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -2.048 11.956 0.616 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -1.276 11.661 2.192 1.00 0.00 H new ATOM 1966 N MET A 123 -5.054 11.287 5.353 1.00 0.00 N ATOM 1967 CA MET A 123 -6.018 10.870 6.361 1.00 0.00 C ATOM 1968 C MET A 123 -7.373 10.588 5.731 1.00 0.00 C ATOM 1969 O MET A 123 -7.943 11.443 5.051 1.00 0.00 O ATOM 1970 CB MET A 123 -6.164 11.958 7.428 1.00 0.00 C ATOM 1971 CG MET A 123 -6.945 11.405 8.619 1.00 0.00 C ATOM 1972 SD MET A 123 -5.799 10.949 9.945 1.00 0.00 S ATOM 1973 CE MET A 123 -6.086 9.163 9.886 1.00 0.00 C ATOM 0 H MET A 123 -4.911 12.295 5.298 1.00 0.00 H new ATOM 0 HA MET A 123 -5.652 9.953 6.824 1.00 0.00 H new ATOM 0 HB2 MET A 123 -5.180 12.299 7.752 1.00 0.00 H new ATOM 0 HB3 MET A 123 -6.680 12.823 7.012 1.00 0.00 H new ATOM 0 HG2 MET A 123 -7.654 12.151 8.979 1.00 0.00 H new ATOM 0 HG3 MET A 123 -7.526 10.535 8.313 1.00 0.00 H new ATOM 0 HE1 MET A 123 -5.468 8.670 10.637 1.00 0.00 H new ATOM 0 HE2 MET A 123 -7.137 8.956 10.089 1.00 0.00 H new ATOM 0 HE3 MET A 123 -5.826 8.785 8.897 1.00 0.00 H new ATOM 1983 N THR A 124 -7.882 9.382 5.968 1.00 0.00 N ATOM 1984 CA THR A 124 -9.176 8.985 5.426 1.00 0.00 C ATOM 1985 C THR A 124 -10.153 8.657 6.548 1.00 0.00 C ATOM 1986 O THR A 124 -9.855 8.856 7.725 1.00 0.00 O ATOM 1987 CB THR A 124 -9.017 7.772 4.510 1.00 0.00 C ATOM 1988 OG1 THR A 124 -8.462 6.693 5.246 1.00 0.00 O ATOM 1989 CG2 THR A 124 -8.089 8.129 3.353 1.00 0.00 C ATOM 0 H THR A 124 -7.420 8.666 6.529 1.00 0.00 H new ATOM 0 HA THR A 124 -9.573 9.820 4.849 1.00 0.00 H new ATOM 0 HB THR A 124 -9.992 7.481 4.119 1.00 0.00 H new ATOM 0 HG1 THR A 124 -8.276 6.984 6.163 1.00 0.00 H new ATOM 0 HG21 THR A 124 -7.974 7.265 2.699 1.00 0.00 H new ATOM 0 HG22 THR A 124 -8.514 8.958 2.788 1.00 0.00 H new ATOM 0 HG23 THR A 124 -7.114 8.419 3.745 1.00 0.00 H new ATOM 1997 N THR A 125 -11.323 8.159 6.170 1.00 0.00 N ATOM 1998 CA THR A 125 -12.347 7.810 7.154 1.00 0.00 C ATOM 1999 C THR A 125 -12.167 6.377 7.642 1.00 0.00 C ATOM 2000 O THR A 125 -12.727 5.990 8.669 1.00 0.00 O ATOM 2001 CB THR A 125 -13.736 7.966 6.539 1.00 0.00 C ATOM 2002 OG1 THR A 125 -13.815 7.194 5.350 1.00 0.00 O ATOM 2003 CG2 THR A 125 -13.988 9.434 6.209 1.00 0.00 C ATOM 0 H THR A 125 -11.588 7.988 5.200 1.00 0.00 H new ATOM 0 HA THR A 125 -12.244 8.484 8.004 1.00 0.00 H new ATOM 0 HB THR A 125 -14.487 7.621 7.249 1.00 0.00 H new ATOM 0 HG1 THR A 125 -13.952 7.788 4.583 1.00 0.00 H new ATOM 0 HG21 THR A 125 -14.980 9.543 5.770 1.00 0.00 H new ATOM 0 HG22 THR A 125 -13.927 10.028 7.121 1.00 0.00 H new ATOM 0 HG23 THR A 125 -13.237 9.782 5.499 1.00 0.00 H new ATOM 2011 N ASN A 126 -11.387 5.597 6.898 1.00 0.00 N ATOM 2012 CA ASN A 126 -11.141 4.205 7.261 1.00 0.00 C ATOM 2013 C ASN A 126 -9.688 4.004 7.674 1.00 0.00 C ATOM 2014 O ASN A 126 -9.246 2.876 7.902 1.00 0.00 O ATOM 2015 CB ASN A 126 -11.475 3.292 6.083 1.00 0.00 C ATOM 2016 CG ASN A 126 -12.914 3.521 5.636 1.00 0.00 C ATOM 2017 OD1 ASN A 126 -13.688 4.177 6.336 1.00 0.00 O ATOM 2018 ND2 ASN A 126 -13.324 3.017 4.505 1.00 0.00 N ATOM 0 H ASN A 126 -10.917 5.903 6.046 1.00 0.00 H new ATOM 0 HA ASN A 126 -11.780 3.952 8.107 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -10.793 3.488 5.256 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -11.336 2.250 6.370 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -14.286 3.166 4.199 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -12.683 2.474 3.926 1.00 0.00 H new ATOM 2025 N GLY A 127 -8.955 5.100 7.784 1.00 0.00 N ATOM 2026 CA GLY A 127 -7.555 5.029 8.193 1.00 0.00 C ATOM 2027 C GLY A 127 -6.698 6.013 7.410 1.00 0.00 C ATOM 2028 O GLY A 127 -7.124 7.135 7.136 1.00 0.00 O ATOM 0 H GLY A 127 -9.298 6.042 7.599 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -7.474 5.242 9.259 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -7.181 4.017 8.041 1.00 0.00 H new ATOM 2032 N VAL A 128 -5.489 5.587 7.059 1.00 0.00 N ATOM 2033 CA VAL A 128 -4.576 6.439 6.305 1.00 0.00 C ATOM 2034 C VAL A 128 -4.144 5.749 5.024 1.00 0.00 C ATOM 2035 O VAL A 128 -4.356 4.547 4.855 1.00 0.00 O ATOM 2036 CB VAL A 128 -3.343 6.758 7.151 1.00 0.00 C ATOM 2037 CG1 VAL A 128 -2.334 5.611 7.049 1.00 0.00 C ATOM 2038 CG2 VAL A 128 -2.698 8.057 6.658 1.00 0.00 C ATOM 0 H VAL A 128 -5.120 4.663 7.283 1.00 0.00 H new ATOM 0 HA VAL A 128 -5.094 7.364 6.053 1.00 0.00 H new ATOM 0 HB VAL A 128 -3.645 6.879 8.191 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -1.457 5.843 7.653 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -2.792 4.691 7.412 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -2.034 5.482 6.009 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -1.820 8.280 7.264 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -2.400 7.943 5.616 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -3.414 8.874 6.743 1.00 0.00 H new ATOM 2048 N ILE A 129 -3.548 6.520 4.121 1.00 0.00 N ATOM 2049 CA ILE A 129 -3.090 5.979 2.850 1.00 0.00 C ATOM 2050 C ILE A 129 -1.593 6.220 2.650 1.00 0.00 C ATOM 2051 O ILE A 129 -1.045 7.238 3.101 1.00 0.00 O ATOM 2052 CB ILE A 129 -3.855 6.644 1.702 1.00 0.00 C ATOM 2053 CG1 ILE A 129 -5.288 6.110 1.661 1.00 0.00 C ATOM 2054 CG2 ILE A 129 -3.164 6.340 0.370 1.00 0.00 C ATOM 2055 CD1 ILE A 129 -6.172 7.054 0.835 1.00 0.00 C ATOM 0 H ILE A 129 -3.372 7.517 4.246 1.00 0.00 H new ATOM 0 HA ILE A 129 -3.274 4.905 2.858 1.00 0.00 H new ATOM 0 HB ILE A 129 -3.871 7.722 1.864 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -5.301 5.111 1.225 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -5.682 6.021 2.674 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -3.714 6.816 -0.442 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -2.145 6.725 0.393 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -3.141 5.262 0.210 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -7.191 6.669 0.809 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -6.170 8.045 1.289 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -5.783 7.120 -0.181 1.00 0.00 H new ATOM 2067 N HIS A 130 -0.945 5.288 1.952 1.00 0.00 N ATOM 2068 CA HIS A 130 0.475 5.419 1.672 1.00 0.00 C ATOM 2069 C HIS A 130 0.750 5.033 0.230 1.00 0.00 C ATOM 2070 O HIS A 130 0.613 3.874 -0.145 1.00 0.00 O ATOM 2071 CB HIS A 130 1.299 4.540 2.619 1.00 0.00 C ATOM 2072 CG HIS A 130 2.765 4.828 2.438 1.00 0.00 C ATOM 2073 ND1 HIS A 130 3.606 5.083 3.508 1.00 0.00 N ATOM 2074 CD2 HIS A 130 3.563 4.875 1.321 1.00 0.00 C ATOM 2075 CE1 HIS A 130 4.847 5.260 3.015 1.00 0.00 C ATOM 2076 NE2 HIS A 130 4.872 5.144 1.690 1.00 0.00 N ATOM 0 H HIS A 130 -1.379 4.445 1.576 1.00 0.00 H new ATOM 0 HA HIS A 130 0.767 6.457 1.830 1.00 0.00 H new ATOM 0 HB2 HIS A 130 1.007 4.730 3.652 1.00 0.00 H new ATOM 0 HB3 HIS A 130 1.099 3.487 2.419 1.00 0.00 H new ATOM 0 HD1 HIS A 130 3.335 5.129 4.490 1.00 0.00 H new ATOM 0 HD2 HIS A 130 3.222 4.725 0.307 1.00 0.00 H new ATOM 0 HE1 HIS A 130 5.716 5.470 3.621 1.00 0.00 H new ATOM 2085 N VAL A 131 1.143 6.018 -0.573 1.00 0.00 N ATOM 2086 CA VAL A 131 1.435 5.775 -1.985 1.00 0.00 C ATOM 2087 C VAL A 131 2.936 5.728 -2.241 1.00 0.00 C ATOM 2088 O VAL A 131 3.677 6.619 -1.816 1.00 0.00 O ATOM 2089 CB VAL A 131 0.820 6.877 -2.843 1.00 0.00 C ATOM 2090 CG1 VAL A 131 1.007 6.541 -4.322 1.00 0.00 C ATOM 2091 CG2 VAL A 131 -0.671 6.996 -2.528 1.00 0.00 C ATOM 0 H VAL A 131 1.266 6.985 -0.274 1.00 0.00 H new ATOM 0 HA VAL A 131 1.004 4.809 -2.250 1.00 0.00 H new ATOM 0 HB VAL A 131 1.313 7.824 -2.624 1.00 0.00 H new ATOM 0 HG11 VAL A 131 0.567 7.329 -4.933 1.00 0.00 H new ATOM 0 HG12 VAL A 131 2.071 6.460 -4.545 1.00 0.00 H new ATOM 0 HG13 VAL A 131 0.517 5.593 -4.545 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -1.111 7.783 -3.141 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -1.165 6.049 -2.744 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -0.802 7.241 -1.474 1.00 0.00 H new ATOM 2101 N VAL A 132 3.370 4.693 -2.959 1.00 0.00 N ATOM 2102 CA VAL A 132 4.789 4.543 -3.289 1.00 0.00 C ATOM 2103 C VAL A 132 4.976 4.463 -4.800 1.00 0.00 C ATOM 2104 O VAL A 132 3.999 4.431 -5.548 1.00 0.00 O ATOM 2105 CB VAL A 132 5.363 3.287 -2.630 1.00 0.00 C ATOM 2106 CG1 VAL A 132 5.160 3.366 -1.118 1.00 0.00 C ATOM 2107 CG2 VAL A 132 4.650 2.058 -3.178 1.00 0.00 C ATOM 0 H VAL A 132 2.768 3.953 -3.320 1.00 0.00 H new ATOM 0 HA VAL A 132 5.322 5.415 -2.910 1.00 0.00 H new ATOM 0 HB VAL A 132 6.429 3.215 -2.848 1.00 0.00 H new ATOM 0 HG11 VAL A 132 5.569 2.471 -0.649 1.00 0.00 H new ATOM 0 HG12 VAL A 132 5.671 4.246 -0.728 1.00 0.00 H new ATOM 0 HG13 VAL A 132 4.095 3.437 -0.897 1.00 0.00 H new ATOM 0 HG21 VAL A 132 5.057 1.162 -2.710 1.00 0.00 H new ATOM 0 HG22 VAL A 132 3.584 2.128 -2.960 1.00 0.00 H new ATOM 0 HG23 VAL A 132 4.797 2.003 -4.257 1.00 0.00 H new ATOM 2117 N ASP A 133 6.231 4.439 -5.241 1.00 0.00 N ATOM 2118 CA ASP A 133 6.529 4.370 -6.671 1.00 0.00 C ATOM 2119 C ASP A 133 7.371 3.138 -6.991 1.00 0.00 C ATOM 2120 O ASP A 133 8.180 3.150 -7.920 1.00 0.00 O ATOM 2121 CB ASP A 133 7.275 5.629 -7.106 1.00 0.00 C ATOM 2122 CG ASP A 133 7.107 5.842 -8.606 1.00 0.00 C ATOM 2123 OD1 ASP A 133 6.149 6.496 -8.988 1.00 0.00 O ATOM 2124 OD2 ASP A 133 7.937 5.349 -9.351 1.00 0.00 O ATOM 0 H ASP A 133 7.052 4.466 -4.636 1.00 0.00 H new ATOM 0 HA ASP A 133 5.587 4.297 -7.215 1.00 0.00 H new ATOM 0 HB2 ASP A 133 6.894 6.494 -6.563 1.00 0.00 H new ATOM 0 HB3 ASP A 133 8.333 5.538 -6.859 1.00 0.00 H new ATOM 2129 N LYS A 134 7.174 2.081 -6.217 1.00 0.00 N ATOM 2130 CA LYS A 134 7.917 0.843 -6.421 1.00 0.00 C ATOM 2131 C LYS A 134 7.355 -0.262 -5.526 1.00 0.00 C ATOM 2132 O LYS A 134 6.633 0.011 -4.569 1.00 0.00 O ATOM 2133 CB LYS A 134 9.410 1.067 -6.104 1.00 0.00 C ATOM 2134 CG LYS A 134 9.746 0.645 -4.660 1.00 0.00 C ATOM 2135 CD LYS A 134 8.986 1.537 -3.664 1.00 0.00 C ATOM 2136 CE LYS A 134 8.617 0.734 -2.422 1.00 0.00 C ATOM 2137 NZ LYS A 134 7.811 1.593 -1.510 1.00 0.00 N ATOM 0 H LYS A 134 6.509 2.054 -5.444 1.00 0.00 H new ATOM 0 HA LYS A 134 7.815 0.539 -7.463 1.00 0.00 H new ATOM 0 HB2 LYS A 134 10.022 0.497 -6.803 1.00 0.00 H new ATOM 0 HB3 LYS A 134 9.660 2.118 -6.245 1.00 0.00 H new ATOM 0 HG2 LYS A 134 9.476 -0.400 -4.505 1.00 0.00 H new ATOM 0 HG3 LYS A 134 10.819 0.726 -4.489 1.00 0.00 H new ATOM 0 HD2 LYS A 134 9.602 2.392 -3.385 1.00 0.00 H new ATOM 0 HD3 LYS A 134 8.085 1.933 -4.132 1.00 0.00 H new ATOM 0 HE2 LYS A 134 8.050 -0.153 -2.702 1.00 0.00 H new ATOM 0 HE3 LYS A 134 9.518 0.389 -1.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 8.111 1.433 -0.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 7.955 2.593 -1.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 6.804 1.354 -1.608 1.00 0.00 H new ATOM 2151 N LEU A 135 7.720 -1.512 -5.828 1.00 0.00 N ATOM 2152 CA LEU A 135 7.274 -2.642 -5.035 1.00 0.00 C ATOM 2153 C LEU A 135 8.119 -2.788 -3.785 1.00 0.00 C ATOM 2154 O LEU A 135 9.327 -2.563 -3.793 1.00 0.00 O ATOM 2155 CB LEU A 135 7.368 -3.917 -5.868 1.00 0.00 C ATOM 2156 CG LEU A 135 5.961 -4.427 -6.184 1.00 0.00 C ATOM 2157 CD1 LEU A 135 5.198 -3.377 -6.992 1.00 0.00 C ATOM 2158 CD2 LEU A 135 6.057 -5.722 -6.998 1.00 0.00 C ATOM 0 H LEU A 135 8.321 -1.758 -6.615 1.00 0.00 H new ATOM 0 HA LEU A 135 6.240 -2.471 -4.736 1.00 0.00 H new ATOM 0 HB2 LEU A 135 7.911 -3.720 -6.793 1.00 0.00 H new ATOM 0 HB3 LEU A 135 7.928 -4.678 -5.325 1.00 0.00 H new ATOM 0 HG LEU A 135 5.432 -4.619 -5.250 1.00 0.00 H new ATOM 0 HD11 LEU A 135 4.197 -3.746 -7.214 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.125 -2.455 -6.414 1.00 0.00 H new ATOM 0 HD13 LEU A 135 5.727 -3.180 -7.924 1.00 0.00 H new ATOM 0 HD21 LEU A 135 5.054 -6.085 -7.223 1.00 0.00 H new ATOM 0 HD22 LEU A 135 6.590 -5.528 -7.929 1.00 0.00 H new ATOM 0 HD23 LEU A 135 6.595 -6.475 -6.422 1.00 0.00 H new ATOM 2170 N LEU A 136 7.468 -3.166 -2.707 1.00 0.00 N ATOM 2171 CA LEU A 136 8.162 -3.333 -1.426 1.00 0.00 C ATOM 2172 C LEU A 136 9.202 -4.444 -1.501 1.00 0.00 C ATOM 2173 O LEU A 136 9.594 -5.022 -0.487 1.00 0.00 O ATOM 2174 CB LEU A 136 7.153 -3.639 -0.305 1.00 0.00 C ATOM 2175 CG LEU A 136 6.648 -2.337 0.328 1.00 0.00 C ATOM 2176 CD1 LEU A 136 7.806 -1.593 1.003 1.00 0.00 C ATOM 2177 CD2 LEU A 136 6.025 -1.451 -0.751 1.00 0.00 C ATOM 0 H LEU A 136 6.468 -3.365 -2.680 1.00 0.00 H new ATOM 0 HA LEU A 136 8.675 -2.397 -1.203 1.00 0.00 H new ATOM 0 HB2 LEU A 136 6.313 -4.205 -0.707 1.00 0.00 H new ATOM 0 HB3 LEU A 136 7.623 -4.263 0.456 1.00 0.00 H new ATOM 0 HG LEU A 136 5.897 -2.576 1.081 1.00 0.00 H new ATOM 0 HD11 LEU A 136 7.435 -0.670 1.449 1.00 0.00 H new ATOM 0 HD12 LEU A 136 8.239 -2.223 1.780 1.00 0.00 H new ATOM 0 HD13 LEU A 136 8.568 -1.356 0.261 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.666 -0.526 -0.300 1.00 0.00 H new ATOM 0 HD22 LEU A 136 6.774 -1.219 -1.508 1.00 0.00 H new ATOM 0 HD23 LEU A 136 5.190 -1.976 -1.215 1.00 0.00 H new ATOM 2189 N TYR A 137 9.655 -4.732 -2.705 1.00 0.00 N ATOM 2190 CA TYR A 137 10.651 -5.767 -2.896 1.00 0.00 C ATOM 2191 C TYR A 137 11.017 -5.881 -4.368 1.00 0.00 C ATOM 2192 O TYR A 137 10.256 -5.437 -5.220 1.00 0.00 O ATOM 2193 CB TYR A 137 10.116 -7.110 -2.402 1.00 0.00 C ATOM 2194 CG TYR A 137 8.611 -7.093 -2.426 1.00 0.00 C ATOM 2195 CD1 TYR A 137 7.937 -6.893 -3.634 1.00 0.00 C ATOM 2196 CD2 TYR A 137 7.890 -7.265 -1.241 1.00 0.00 C ATOM 2197 CE1 TYR A 137 6.543 -6.857 -3.658 1.00 0.00 C ATOM 2198 CE2 TYR A 137 6.494 -7.236 -1.266 1.00 0.00 C ATOM 2199 CZ TYR A 137 5.820 -7.033 -2.474 1.00 0.00 C ATOM 2200 OH TYR A 137 4.442 -6.993 -2.493 1.00 0.00 O ATOM 0 H TYR A 137 9.352 -4.267 -3.561 1.00 0.00 H new ATOM 0 HA TYR A 137 11.540 -5.500 -2.324 1.00 0.00 H new ATOM 0 HB2 TYR A 137 10.491 -7.916 -3.032 1.00 0.00 H new ATOM 0 HB3 TYR A 137 10.472 -7.305 -1.390 1.00 0.00 H new ATOM 0 HD1 TYR A 137 8.496 -6.766 -4.549 1.00 0.00 H new ATOM 0 HD2 TYR A 137 8.411 -7.420 -0.308 1.00 0.00 H new ATOM 0 HE1 TYR A 137 6.022 -6.693 -4.590 1.00 0.00 H new ATOM 0 HE2 TYR A 137 5.935 -7.370 -0.352 1.00 0.00 H new ATOM 0 HH TYR A 137 4.103 -6.953 -1.574 1.00 0.00 H new ATOM 2210 N PRO A 138 12.154 -6.462 -4.676 1.00 0.00 N ATOM 2211 CA PRO A 138 12.604 -6.665 -6.090 1.00 0.00 C ATOM 2212 C PRO A 138 11.485 -7.210 -6.997 1.00 0.00 C ATOM 2213 O PRO A 138 10.355 -6.733 -6.987 1.00 0.00 O ATOM 2214 CB PRO A 138 13.728 -7.698 -5.950 1.00 0.00 C ATOM 2215 CG PRO A 138 14.291 -7.487 -4.590 1.00 0.00 C ATOM 2216 CD PRO A 138 13.154 -6.975 -3.714 1.00 0.00 C ATOM 0 HA PRO A 138 12.912 -5.730 -6.558 1.00 0.00 H new ATOM 0 HB2 PRO A 138 13.346 -8.712 -6.064 1.00 0.00 H new ATOM 0 HB3 PRO A 138 14.490 -7.556 -6.717 1.00 0.00 H new ATOM 0 HG2 PRO A 138 14.697 -8.417 -4.192 1.00 0.00 H new ATOM 0 HG3 PRO A 138 15.110 -6.768 -4.618 1.00 0.00 H new ATOM 0 HD2 PRO A 138 12.739 -7.771 -3.095 1.00 0.00 H new ATOM 0 HD3 PRO A 138 13.495 -6.191 -3.038 1.00 0.00 H new ATOM 2224 N ALA A 139 11.811 -8.216 -7.793 1.00 0.00 N ATOM 2225 CA ALA A 139 10.828 -8.803 -8.693 1.00 0.00 C ATOM 2226 C ALA A 139 9.942 -9.800 -7.955 1.00 0.00 C ATOM 2227 O ALA A 139 8.752 -9.928 -8.247 1.00 0.00 O ATOM 2228 CB ALA A 139 11.537 -9.502 -9.850 1.00 0.00 C ATOM 0 H ALA A 139 12.738 -8.640 -7.836 1.00 0.00 H new ATOM 0 HA ALA A 139 10.198 -8.003 -9.081 1.00 0.00 H new ATOM 0 HB1 ALA A 139 10.796 -9.939 -10.520 1.00 0.00 H new ATOM 0 HB2 ALA A 139 12.140 -8.778 -10.398 1.00 0.00 H new ATOM 0 HB3 ALA A 139 12.182 -10.289 -9.459 1.00 0.00 H new ATOM 2234 N ASP A 140 10.531 -10.504 -7.001 1.00 0.00 N ATOM 2235 CA ASP A 140 9.791 -11.494 -6.225 1.00 0.00 C ATOM 2236 C ASP A 140 10.195 -11.440 -4.755 1.00 0.00 C ATOM 2237 O ASP A 140 9.390 -11.731 -3.869 1.00 0.00 O ATOM 2238 CB ASP A 140 10.059 -12.896 -6.778 1.00 0.00 C ATOM 2239 CG ASP A 140 10.535 -12.804 -8.224 1.00 0.00 C ATOM 2240 OD1 ASP A 140 9.819 -12.232 -9.029 1.00 0.00 O ATOM 2241 OD2 ASP A 140 11.612 -13.306 -8.504 1.00 0.00 O ATOM 0 H ASP A 140 11.514 -10.411 -6.744 1.00 0.00 H new ATOM 0 HA ASP A 140 8.728 -11.267 -6.304 1.00 0.00 H new ATOM 0 HB2 ASP A 140 10.812 -13.398 -6.170 1.00 0.00 H new ATOM 0 HB3 ASP A 140 9.152 -13.497 -6.723 1.00 0.00 H new TER 2246 ASP A 140