USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1126 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 43 THR OG1 : rot -170:sc= 0 USER MOD Set 1.2: B 27 LYS NZ :NH3+ -135:sc= -0.372 (180deg=-1.49!) USER MOD Set 2.1: B 14 THR OG1 : rot 143:sc= 0.393 USER MOD Set 2.2: B 53 ASN : amide:sc= 0.364 K(o=0.76,f=-2.5!) USER MOD Set 3.1: A 66 MET CE :methyl -144:sc= -2.33 (180deg=-2.65!) USER MOD Set 3.2: B 30 SER OG : rot -155:sc= 1 USER MOD Set 4.1: A 46 ASN :FLIP amide:sc= -2.74! C(o=-7.4!,f=-1.9!) USER MOD Set 4.2: A 48 GLN :FLIP amide:sc= 0.801 F(o=-4.7,f=-1.9) USER MOD Single : A 5 THR OG1 : rot 38:sc= 0.605 USER MOD Single : A 10 GLN : amide:sc= -0.402 X(o=-0.4,f=0) USER MOD Single : A 13 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 19 HIS : no HE2:sc= -1.85! X(o=-1.8!,f=-1.8) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 ASN : amide:sc= -0.996 X(o=-1,f=-1.3) USER MOD Single : A 24 GLN : amide:sc= -0.421 X(o=-0.42,f=-0.16) USER MOD Single : A 25 SER OG : rot 180:sc= -1.06 USER MOD Single : A 27 LYS NZ :NH3+ 148:sc= -0.265 (180deg=-1.37!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= -1.29 USER MOD Single : A 34 HIS : no HD1:sc= -4.37! C(o=-4.4!,f=-6.3!) USER MOD Single : A 37 GLN : amide:sc= -1.81 K(o=-1.8,f=-3.6!) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.291 K(o=-0.29,f=-1.8!) USER MOD Single : A 56 SER OG : rot 170:sc= -0.0506 USER MOD Single : A 58 MET CE :methyl -169:sc= -0.146 (180deg=-0.415) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ -155:sc=-0.00852 (180deg=-0.331) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -0.827 K(o=-0.83,f=-4.2!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -0.0149 X(o=-0.015,f=0) USER MOD Single : B 5 THR OG1 : rot -45:sc= 0.494 USER MOD Single : B 10 GLN : amide:sc= -0.475 X(o=-0.48,f=-0.088) USER MOD Single : B 13 GLN : amide:sc= -0.0128 X(o=-0.013,f=0) USER MOD Single : B 16 GLN : amide:sc= -0.0452 X(o=-0.045,f=0) USER MOD Single : B 19 HIS : no HD1:sc= -0.38 X(o=-0.38,f=-0.33) USER MOD Single : B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 ASN : amide:sc= -0.781 K(o=-0.78,f=-1.4) USER MOD Single : B 24 GLN :FLIP amide:sc= -0.94 F(o=-2.4!,f=-0.94) USER MOD Single : B 25 SER OG : rot 180:sc= -1.28 USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 HIS : no HD1:sc= -4.09! C(o=-4.1!,f=-6.1!) USER MOD Single : B 37 GLN :FLIP amide:sc= -0.801 F(o=-2.2!,f=-0.8) USER MOD Single : B 38 THR OG1 : rot 180:sc= 0 USER MOD Single : B 43 THR OG1 : rot 180:sc= 0 USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 ASN : amide:sc= -2.82! C(o=-2.8!,f=-3.2!) USER MOD Single : B 48 GLN : amide:sc=-0.00447 X(o=-0.0045,f=-0.0047) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 SER OG : rot 180:sc= -0.872 USER MOD Single : B 58 MET CE :methyl -163:sc= -0.652 (180deg=-2.09) USER MOD Single : B 60 LYS NZ :NH3+ -110:sc= -0.185 (180deg=-0.506) USER MOD Single : B 61 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000168) USER MOD Single : B 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 MET CE :methyl -144:sc= -5.56! (180deg=-10.5!) USER MOD Single : B 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 69 ASN : amide:sc= -0.531 X(o=-0.53,f=-0.18) USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 SER OG : rot 180:sc= -0.0171 USER MOD Single : B 73 ASN : amide:sc=-0.000482 X(o=-0.00048,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 5 -12.840 -17.915 -14.330 1.00 0.00 N ATOM 2 CA THR A 5 -11.439 -17.645 -14.605 1.00 0.00 C ATOM 3 C THR A 5 -10.552 -18.302 -13.546 1.00 0.00 C ATOM 4 O THR A 5 -10.967 -18.472 -12.401 1.00 0.00 O ATOM 5 CB THR A 5 -11.259 -16.129 -14.693 1.00 0.00 C ATOM 6 OG1 THR A 5 -12.306 -15.704 -15.561 1.00 0.00 O ATOM 7 CG2 THR A 5 -9.979 -15.733 -15.433 1.00 0.00 C ATOM 0 HA THR A 5 -11.131 -18.079 -15.556 1.00 0.00 H new ATOM 0 HB THR A 5 -11.243 -15.707 -13.688 1.00 0.00 H new ATOM 0 HG1 THR A 5 -13.112 -16.233 -15.385 1.00 0.00 H new ATOM 0 HG21 THR A 5 -9.900 -14.646 -15.467 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.115 -16.144 -14.911 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.010 -16.127 -16.449 1.00 0.00 H new ATOM 15 N GLU A 6 -9.346 -18.655 -13.967 1.00 0.00 N ATOM 16 CA GLU A 6 -8.396 -19.290 -13.070 1.00 0.00 C ATOM 17 C GLU A 6 -7.189 -18.377 -12.842 1.00 0.00 C ATOM 18 O GLU A 6 -6.171 -18.507 -13.519 1.00 0.00 O ATOM 19 CB GLU A 6 -7.958 -20.653 -13.610 1.00 0.00 C ATOM 20 CG GLU A 6 -7.421 -21.541 -12.486 1.00 0.00 C ATOM 21 CD GLU A 6 -8.461 -22.582 -12.066 1.00 0.00 C ATOM 22 OE1 GLU A 6 -9.464 -22.165 -11.448 1.00 0.00 O ATOM 23 OE2 GLU A 6 -8.230 -23.771 -12.373 1.00 0.00 O ATOM 0 H GLU A 6 -9.005 -18.513 -14.918 1.00 0.00 H new ATOM 0 HA GLU A 6 -8.887 -19.457 -12.111 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -8.802 -21.144 -14.095 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -7.189 -20.517 -14.370 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -6.512 -22.043 -12.817 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -7.151 -20.925 -11.628 1.00 0.00 H new ATOM 30 N LEU A 7 -7.344 -17.473 -11.885 1.00 0.00 N ATOM 31 CA LEU A 7 -6.280 -16.539 -11.560 1.00 0.00 C ATOM 32 C LEU A 7 -5.618 -16.964 -10.248 1.00 0.00 C ATOM 33 O LEU A 7 -6.177 -17.760 -9.495 1.00 0.00 O ATOM 34 CB LEU A 7 -6.812 -15.105 -11.543 1.00 0.00 C ATOM 35 CG LEU A 7 -7.569 -14.656 -12.795 1.00 0.00 C ATOM 36 CD1 LEU A 7 -9.069 -14.922 -12.655 1.00 0.00 C ATOM 37 CD2 LEU A 7 -7.274 -13.189 -13.117 1.00 0.00 C ATOM 0 H LEU A 7 -8.190 -17.368 -11.325 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.508 -16.559 -12.329 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -7.473 -14.994 -10.683 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.971 -14.428 -11.388 1.00 0.00 H new ATOM 0 HG LEU A 7 -7.215 -15.249 -13.639 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -9.583 -14.594 -13.559 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -9.237 -15.989 -12.510 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -9.457 -14.373 -11.797 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -7.824 -12.895 -14.011 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.582 -12.564 -12.279 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -6.205 -13.062 -13.291 1.00 0.00 H new ATOM 49 N ARG A 8 -4.435 -16.414 -10.013 1.00 0.00 N ATOM 50 CA ARG A 8 -3.691 -16.726 -8.805 1.00 0.00 C ATOM 51 C ARG A 8 -3.131 -15.447 -8.181 1.00 0.00 C ATOM 52 O ARG A 8 -3.762 -14.393 -8.244 1.00 0.00 O ATOM 53 CB ARG A 8 -2.539 -17.688 -9.101 1.00 0.00 C ATOM 54 CG ARG A 8 -2.953 -18.739 -10.133 1.00 0.00 C ATOM 55 CD ARG A 8 -2.455 -20.129 -9.730 1.00 0.00 C ATOM 56 NE ARG A 8 -1.912 -20.834 -10.913 1.00 0.00 N ATOM 57 CZ ARG A 8 -1.477 -22.101 -10.897 1.00 0.00 C ATOM 58 NH1 ARG A 8 -1.518 -22.810 -9.761 1.00 0.00 N ATOM 59 NH2 ARG A 8 -1.001 -22.660 -12.019 1.00 0.00 N ATOM 0 H ARG A 8 -3.974 -15.754 -10.639 1.00 0.00 H new ATOM 0 HA ARG A 8 -4.378 -17.204 -8.107 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -1.680 -17.129 -9.471 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -2.226 -18.181 -8.180 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -4.039 -18.751 -10.229 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -2.549 -18.473 -11.110 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -1.685 -20.041 -8.964 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -3.272 -20.705 -9.296 1.00 0.00 H new ATOM 0 HE ARG A 8 -1.866 -20.324 -11.795 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -1.881 -22.385 -8.908 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -1.187 -23.775 -9.750 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -0.970 -22.121 -12.884 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -0.670 -23.625 -12.007 1.00 0.00 H new ATOM 73 N CYS A 9 -1.951 -15.581 -7.592 1.00 0.00 N ATOM 74 CA CYS A 9 -1.299 -14.448 -6.957 1.00 0.00 C ATOM 75 C CYS A 9 -0.318 -13.835 -7.959 1.00 0.00 C ATOM 76 O CYS A 9 0.049 -14.474 -8.944 1.00 0.00 O ATOM 77 CB CYS A 9 -0.606 -14.852 -5.654 1.00 0.00 C ATOM 78 SG CYS A 9 -1.674 -15.734 -4.459 1.00 0.00 S ATOM 0 H CYS A 9 -1.430 -16.456 -7.541 1.00 0.00 H new ATOM 0 HA CYS A 9 -2.046 -13.704 -6.679 1.00 0.00 H new ATOM 0 HB2 CYS A 9 0.247 -15.486 -5.894 1.00 0.00 H new ATOM 0 HB3 CYS A 9 -0.212 -13.955 -5.175 1.00 0.00 H new ATOM 83 N GLN A 10 0.078 -12.604 -7.673 1.00 0.00 N ATOM 84 CA GLN A 10 1.010 -11.898 -8.536 1.00 0.00 C ATOM 85 C GLN A 10 2.443 -12.080 -8.033 1.00 0.00 C ATOM 86 O GLN A 10 3.392 -11.631 -8.675 1.00 0.00 O ATOM 87 CB GLN A 10 0.648 -10.414 -8.635 1.00 0.00 C ATOM 88 CG GLN A 10 1.692 -9.649 -9.451 1.00 0.00 C ATOM 89 CD GLN A 10 1.195 -8.244 -9.797 1.00 0.00 C ATOM 90 OE1 GLN A 10 1.329 -7.767 -10.912 1.00 0.00 O ATOM 91 NE2 GLN A 10 0.615 -7.610 -8.782 1.00 0.00 N ATOM 0 H GLN A 10 -0.229 -12.077 -6.856 1.00 0.00 H new ATOM 0 HA GLN A 10 0.941 -12.324 -9.537 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -0.332 -10.305 -9.099 1.00 0.00 H new ATOM 0 HB3 GLN A 10 0.577 -9.986 -7.635 1.00 0.00 H new ATOM 0 HG2 GLN A 10 2.622 -9.581 -8.886 1.00 0.00 H new ATOM 0 HG3 GLN A 10 1.915 -10.196 -10.367 1.00 0.00 H new ATOM 0 HE21 GLN A 10 0.535 -8.067 -7.874 1.00 0.00 H new ATOM 0 HE22 GLN A 10 0.250 -6.666 -8.912 1.00 0.00 H new ATOM 100 N CYS A 11 2.555 -12.740 -6.890 1.00 0.00 N ATOM 101 CA CYS A 11 3.857 -12.988 -6.294 1.00 0.00 C ATOM 102 C CYS A 11 3.851 -14.396 -5.695 1.00 0.00 C ATOM 103 O CYS A 11 2.973 -14.734 -4.903 1.00 0.00 O ATOM 104 CB CYS A 11 4.213 -11.926 -5.251 1.00 0.00 C ATOM 105 SG CYS A 11 5.753 -10.999 -5.595 1.00 0.00 S ATOM 0 H CYS A 11 1.766 -13.111 -6.361 1.00 0.00 H new ATOM 0 HA CYS A 11 4.629 -12.924 -7.061 1.00 0.00 H new ATOM 0 HB2 CYS A 11 3.388 -11.218 -5.178 1.00 0.00 H new ATOM 0 HB3 CYS A 11 4.306 -12.409 -4.278 1.00 0.00 H new ATOM 110 N LEU A 12 4.841 -15.179 -6.097 1.00 0.00 N ATOM 111 CA LEU A 12 4.961 -16.543 -5.610 1.00 0.00 C ATOM 112 C LEU A 12 5.981 -16.585 -4.470 1.00 0.00 C ATOM 113 O LEU A 12 6.060 -17.572 -3.739 1.00 0.00 O ATOM 114 CB LEU A 12 5.286 -17.497 -6.762 1.00 0.00 C ATOM 115 CG LEU A 12 4.531 -17.250 -8.069 1.00 0.00 C ATOM 116 CD1 LEU A 12 5.369 -17.679 -9.275 1.00 0.00 C ATOM 117 CD2 LEU A 12 3.163 -17.935 -8.050 1.00 0.00 C ATOM 0 H LEU A 12 5.567 -14.895 -6.754 1.00 0.00 H new ATOM 0 HA LEU A 12 4.011 -16.886 -5.201 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.355 -17.438 -6.966 1.00 0.00 H new ATOM 0 HB3 LEU A 12 5.080 -18.516 -6.433 1.00 0.00 H new ATOM 0 HG LEU A 12 4.354 -16.179 -8.164 1.00 0.00 H new ATOM 0 HD11 LEU A 12 4.809 -17.493 -10.192 1.00 0.00 H new ATOM 0 HD12 LEU A 12 6.297 -17.108 -9.294 1.00 0.00 H new ATOM 0 HD13 LEU A 12 5.598 -18.742 -9.199 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.647 -17.744 -8.991 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.296 -19.009 -7.921 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.570 -17.541 -7.224 1.00 0.00 H new ATOM 129 N GLN A 13 6.737 -15.503 -4.355 1.00 0.00 N ATOM 130 CA GLN A 13 7.749 -15.404 -3.316 1.00 0.00 C ATOM 131 C GLN A 13 7.644 -14.056 -2.600 1.00 0.00 C ATOM 132 O GLN A 13 6.937 -13.160 -3.057 1.00 0.00 O ATOM 133 CB GLN A 13 9.150 -15.610 -3.895 1.00 0.00 C ATOM 134 CG GLN A 13 10.084 -16.238 -2.859 1.00 0.00 C ATOM 135 CD GLN A 13 11.249 -16.961 -3.538 1.00 0.00 C ATOM 136 OE1 GLN A 13 11.546 -16.757 -4.704 1.00 0.00 O ATOM 137 NE2 GLN A 13 11.892 -17.815 -2.746 1.00 0.00 N ATOM 0 H GLN A 13 6.669 -14.687 -4.964 1.00 0.00 H new ATOM 0 HA GLN A 13 7.573 -16.195 -2.587 1.00 0.00 H new ATOM 0 HB2 GLN A 13 9.093 -16.251 -4.775 1.00 0.00 H new ATOM 0 HB3 GLN A 13 9.556 -14.653 -4.223 1.00 0.00 H new ATOM 0 HG2 GLN A 13 10.469 -15.464 -2.195 1.00 0.00 H new ATOM 0 HG3 GLN A 13 9.526 -16.941 -2.240 1.00 0.00 H new ATOM 0 HE21 GLN A 13 11.592 -17.939 -1.779 1.00 0.00 H new ATOM 0 HE22 GLN A 13 12.685 -18.346 -3.106 1.00 0.00 H new ATOM 146 N THR A 14 8.358 -13.956 -1.489 1.00 0.00 N ATOM 147 CA THR A 14 8.355 -12.733 -0.704 1.00 0.00 C ATOM 148 C THR A 14 9.660 -12.600 0.082 1.00 0.00 C ATOM 149 O THR A 14 10.408 -13.566 0.218 1.00 0.00 O ATOM 150 CB THR A 14 7.109 -12.744 0.183 1.00 0.00 C ATOM 151 OG1 THR A 14 6.933 -14.118 0.518 1.00 0.00 O ATOM 152 CG2 THR A 14 5.837 -12.383 -0.587 1.00 0.00 C ATOM 0 H THR A 14 8.943 -14.702 -1.113 1.00 0.00 H new ATOM 0 HA THR A 14 8.308 -11.852 -1.344 1.00 0.00 H new ATOM 0 HB THR A 14 7.245 -12.044 1.007 1.00 0.00 H new ATOM 0 HG1 THR A 14 6.146 -14.216 1.094 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.983 -12.406 0.090 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.939 -11.383 -1.009 1.00 0.00 H new ATOM 0 HG23 THR A 14 5.682 -13.102 -1.391 1.00 0.00 H new ATOM 160 N LEU A 15 9.893 -11.394 0.580 1.00 0.00 N ATOM 161 CA LEU A 15 11.095 -11.122 1.350 1.00 0.00 C ATOM 162 C LEU A 15 10.719 -10.910 2.817 1.00 0.00 C ATOM 163 O LEU A 15 9.538 -10.860 3.158 1.00 0.00 O ATOM 164 CB LEU A 15 11.869 -9.952 0.738 1.00 0.00 C ATOM 165 CG LEU A 15 12.233 -10.089 -0.742 1.00 0.00 C ATOM 166 CD1 LEU A 15 12.163 -8.735 -1.450 1.00 0.00 C ATOM 167 CD2 LEU A 15 13.600 -10.755 -0.911 1.00 0.00 C ATOM 0 H LEU A 15 9.270 -10.595 0.465 1.00 0.00 H new ATOM 0 HA LEU A 15 11.772 -11.976 1.315 1.00 0.00 H new ATOM 0 HB2 LEU A 15 11.277 -9.045 0.864 1.00 0.00 H new ATOM 0 HB3 LEU A 15 12.789 -9.814 1.307 1.00 0.00 H new ATOM 0 HG LEU A 15 11.498 -10.739 -1.217 1.00 0.00 H new ATOM 0 HD11 LEU A 15 12.426 -8.860 -2.500 1.00 0.00 H new ATOM 0 HD12 LEU A 15 11.151 -8.337 -1.374 1.00 0.00 H new ATOM 0 HD13 LEU A 15 12.862 -8.042 -0.981 1.00 0.00 H new ATOM 0 HD21 LEU A 15 13.835 -10.840 -1.972 1.00 0.00 H new ATOM 0 HD22 LEU A 15 14.362 -10.151 -0.418 1.00 0.00 H new ATOM 0 HD23 LEU A 15 13.579 -11.749 -0.463 1.00 0.00 H new ATOM 179 N GLN A 16 11.745 -10.792 3.647 1.00 0.00 N ATOM 180 CA GLN A 16 11.537 -10.587 5.070 1.00 0.00 C ATOM 181 C GLN A 16 11.194 -9.122 5.351 1.00 0.00 C ATOM 182 O GLN A 16 10.719 -8.789 6.436 1.00 0.00 O ATOM 183 CB GLN A 16 12.763 -11.027 5.873 1.00 0.00 C ATOM 184 CG GLN A 16 12.701 -10.492 7.305 1.00 0.00 C ATOM 185 CD GLN A 16 13.430 -11.428 8.272 1.00 0.00 C ATOM 186 OE1 GLN A 16 14.506 -11.932 7.995 1.00 0.00 O ATOM 187 NE2 GLN A 16 12.786 -11.631 9.417 1.00 0.00 N ATOM 0 H GLN A 16 12.723 -10.835 3.361 1.00 0.00 H new ATOM 0 HA GLN A 16 10.696 -11.204 5.387 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.820 -12.115 5.890 1.00 0.00 H new ATOM 0 HB3 GLN A 16 13.669 -10.668 5.386 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.150 -9.500 7.346 1.00 0.00 H new ATOM 0 HG3 GLN A 16 11.661 -10.384 7.612 1.00 0.00 H new ATOM 0 HE21 GLN A 16 11.888 -11.177 9.584 1.00 0.00 H new ATOM 0 HE22 GLN A 16 13.190 -12.240 10.128 1.00 0.00 H new ATOM 196 N GLY A 17 11.449 -8.287 4.355 1.00 0.00 N ATOM 197 CA GLY A 17 11.173 -6.866 4.481 1.00 0.00 C ATOM 198 C GLY A 17 12.304 -6.032 3.875 1.00 0.00 C ATOM 199 O GLY A 17 12.069 -4.937 3.366 1.00 0.00 O ATOM 0 H GLY A 17 11.844 -8.567 3.457 1.00 0.00 H new ATOM 0 HA2 GLY A 17 10.234 -6.629 3.982 1.00 0.00 H new ATOM 0 HA3 GLY A 17 11.049 -6.608 5.533 1.00 0.00 H new ATOM 203 N ILE A 18 13.507 -6.582 3.950 1.00 0.00 N ATOM 204 CA ILE A 18 14.675 -5.903 3.415 1.00 0.00 C ATOM 205 C ILE A 18 14.790 -4.517 4.053 1.00 0.00 C ATOM 206 O ILE A 18 13.836 -4.025 4.653 1.00 0.00 O ATOM 207 CB ILE A 18 14.625 -5.874 1.886 1.00 0.00 C ATOM 208 CG1 ILE A 18 15.197 -7.165 1.295 1.00 0.00 C ATOM 209 CG2 ILE A 18 15.329 -4.631 1.338 1.00 0.00 C ATOM 210 CD1 ILE A 18 14.916 -7.250 -0.207 1.00 0.00 C ATOM 0 H ILE A 18 13.698 -7.490 4.373 1.00 0.00 H new ATOM 0 HA ILE A 18 15.583 -6.449 3.670 1.00 0.00 H new ATOM 0 HB ILE A 18 13.581 -5.814 1.579 1.00 0.00 H new ATOM 0 HG12 ILE A 18 16.272 -7.205 1.471 1.00 0.00 H new ATOM 0 HG13 ILE A 18 14.759 -8.026 1.800 1.00 0.00 H new ATOM 0 HG21 ILE A 18 15.279 -4.635 0.249 1.00 0.00 H new ATOM 0 HG22 ILE A 18 14.838 -3.736 1.721 1.00 0.00 H new ATOM 0 HG23 ILE A 18 16.372 -4.635 1.653 1.00 0.00 H new ATOM 0 HD11 ILE A 18 15.332 -8.176 -0.603 1.00 0.00 H new ATOM 0 HD12 ILE A 18 13.839 -7.234 -0.377 1.00 0.00 H new ATOM 0 HD13 ILE A 18 15.376 -6.400 -0.712 1.00 0.00 H new ATOM 222 N HIS A 19 15.967 -3.927 3.901 1.00 0.00 N ATOM 223 CA HIS A 19 16.219 -2.608 4.455 1.00 0.00 C ATOM 224 C HIS A 19 15.152 -1.630 3.959 1.00 0.00 C ATOM 225 O HIS A 19 14.784 -1.650 2.785 1.00 0.00 O ATOM 226 CB HIS A 19 17.642 -2.146 4.132 1.00 0.00 C ATOM 227 CG HIS A 19 18.353 -1.492 5.292 1.00 0.00 C ATOM 228 ND1 HIS A 19 19.638 -1.838 5.675 1.00 0.00 N ATOM 229 CD2 HIS A 19 17.948 -0.511 6.148 1.00 0.00 C ATOM 230 CE1 HIS A 19 19.979 -1.092 6.715 1.00 0.00 C ATOM 231 NE2 HIS A 19 18.930 -0.271 7.008 1.00 0.00 N ATOM 0 H HIS A 19 16.756 -4.338 3.402 1.00 0.00 H new ATOM 0 HA HIS A 19 16.149 -2.647 5.542 1.00 0.00 H new ATOM 0 HB2 HIS A 19 18.225 -3.005 3.799 1.00 0.00 H new ATOM 0 HB3 HIS A 19 17.605 -1.444 3.299 1.00 0.00 H new ATOM 0 HD1 HIS A 19 20.222 -2.547 5.232 1.00 0.00 H new ATOM 0 HD2 HIS A 19 16.990 -0.013 6.129 1.00 0.00 H new ATOM 0 HE1 HIS A 19 20.923 -1.128 7.239 1.00 0.00 H new ATOM 239 N LEU A 20 14.683 -0.799 4.878 1.00 0.00 N ATOM 240 CA LEU A 20 13.665 0.184 4.549 1.00 0.00 C ATOM 241 C LEU A 20 14.338 1.451 4.017 1.00 0.00 C ATOM 242 O LEU A 20 13.693 2.488 3.875 1.00 0.00 O ATOM 243 CB LEU A 20 12.752 0.432 5.752 1.00 0.00 C ATOM 244 CG LEU A 20 11.391 1.058 5.442 1.00 0.00 C ATOM 245 CD1 LEU A 20 11.510 2.574 5.272 1.00 0.00 C ATOM 246 CD2 LEU A 20 10.746 0.394 4.224 1.00 0.00 C ATOM 0 H LEU A 20 14.989 -0.786 5.851 1.00 0.00 H new ATOM 0 HA LEU A 20 13.017 -0.190 3.757 1.00 0.00 H new ATOM 0 HB2 LEU A 20 12.586 -0.518 6.259 1.00 0.00 H new ATOM 0 HB3 LEU A 20 13.277 1.080 6.454 1.00 0.00 H new ATOM 0 HG LEU A 20 10.732 0.880 6.292 1.00 0.00 H new ATOM 0 HD11 LEU A 20 10.528 2.994 5.052 1.00 0.00 H new ATOM 0 HD12 LEU A 20 11.895 3.014 6.192 1.00 0.00 H new ATOM 0 HD13 LEU A 20 12.191 2.796 4.451 1.00 0.00 H new ATOM 0 HD21 LEU A 20 9.780 0.858 4.026 1.00 0.00 H new ATOM 0 HD22 LEU A 20 11.393 0.519 3.356 1.00 0.00 H new ATOM 0 HD23 LEU A 20 10.605 -0.669 4.421 1.00 0.00 H new ATOM 258 N LYS A 21 15.627 1.324 3.736 1.00 0.00 N ATOM 259 CA LYS A 21 16.395 2.445 3.222 1.00 0.00 C ATOM 260 C LYS A 21 16.349 2.431 1.693 1.00 0.00 C ATOM 261 O LYS A 21 16.544 3.463 1.053 1.00 0.00 O ATOM 262 CB LYS A 21 17.813 2.431 3.795 1.00 0.00 C ATOM 263 CG LYS A 21 17.810 2.809 5.277 1.00 0.00 C ATOM 264 CD LYS A 21 19.075 3.585 5.648 1.00 0.00 C ATOM 265 CE LYS A 21 19.558 3.209 7.051 1.00 0.00 C ATOM 266 NZ LYS A 21 19.269 4.301 8.008 1.00 0.00 N ATOM 0 H LYS A 21 16.159 0.462 3.855 1.00 0.00 H new ATOM 0 HA LYS A 21 15.955 3.388 3.546 1.00 0.00 H new ATOM 0 HB2 LYS A 21 18.250 1.440 3.670 1.00 0.00 H new ATOM 0 HB3 LYS A 21 18.440 3.128 3.240 1.00 0.00 H new ATOM 0 HG2 LYS A 21 16.930 3.413 5.500 1.00 0.00 H new ATOM 0 HG3 LYS A 21 17.741 1.907 5.886 1.00 0.00 H new ATOM 0 HD2 LYS A 21 19.860 3.376 4.921 1.00 0.00 H new ATOM 0 HD3 LYS A 21 18.875 4.656 5.603 1.00 0.00 H new ATOM 0 HE2 LYS A 21 19.068 2.292 7.377 1.00 0.00 H new ATOM 0 HE3 LYS A 21 20.629 3.008 7.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 19.603 4.030 8.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 19.757 5.168 7.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 18.244 4.474 8.039 1.00 0.00 H new ATOM 280 N ASN A 22 16.089 1.250 1.152 1.00 0.00 N ATOM 281 CA ASN A 22 16.015 1.088 -0.291 1.00 0.00 C ATOM 282 C ASN A 22 14.561 1.234 -0.742 1.00 0.00 C ATOM 283 O ASN A 22 14.292 1.749 -1.826 1.00 0.00 O ATOM 284 CB ASN A 22 16.505 -0.298 -0.715 1.00 0.00 C ATOM 285 CG ASN A 22 17.925 -0.229 -1.280 1.00 0.00 C ATOM 286 OD1 ASN A 22 18.260 0.626 -2.083 1.00 0.00 O ATOM 287 ND2 ASN A 22 18.738 -1.174 -0.817 1.00 0.00 N ATOM 0 H ASN A 22 15.927 0.396 1.686 1.00 0.00 H new ATOM 0 HA ASN A 22 16.646 1.849 -0.749 1.00 0.00 H new ATOM 0 HB2 ASN A 22 16.483 -0.973 0.141 1.00 0.00 H new ATOM 0 HB3 ASN A 22 15.831 -0.712 -1.465 1.00 0.00 H new ATOM 0 HD21 ASN A 22 19.707 -1.213 -1.133 1.00 0.00 H new ATOM 0 HD22 ASN A 22 18.393 -1.860 -0.145 1.00 0.00 H new ATOM 294 N ILE A 23 13.660 0.771 0.113 1.00 0.00 N ATOM 295 CA ILE A 23 12.240 0.843 -0.184 1.00 0.00 C ATOM 296 C ILE A 23 11.848 2.302 -0.427 1.00 0.00 C ATOM 297 O ILE A 23 12.236 3.188 0.333 1.00 0.00 O ATOM 298 CB ILE A 23 11.426 0.164 0.919 1.00 0.00 C ATOM 299 CG1 ILE A 23 11.279 -1.335 0.647 1.00 0.00 C ATOM 300 CG2 ILE A 23 10.070 0.849 1.102 1.00 0.00 C ATOM 301 CD1 ILE A 23 11.524 -2.149 1.919 1.00 0.00 C ATOM 0 H ILE A 23 13.887 0.345 1.011 1.00 0.00 H new ATOM 0 HA ILE A 23 12.014 0.294 -1.098 1.00 0.00 H new ATOM 0 HB ILE A 23 11.969 0.270 1.858 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.280 -1.543 0.265 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.985 -1.639 -0.126 1.00 0.00 H new ATOM 0 HG21 ILE A 23 9.512 0.346 1.892 1.00 0.00 H new ATOM 0 HG22 ILE A 23 10.224 1.893 1.374 1.00 0.00 H new ATOM 0 HG23 ILE A 23 9.507 0.796 0.170 1.00 0.00 H new ATOM 0 HD11 ILE A 23 11.413 -3.211 1.698 1.00 0.00 H new ATOM 0 HD12 ILE A 23 12.533 -1.957 2.285 1.00 0.00 H new ATOM 0 HD13 ILE A 23 10.801 -1.860 2.681 1.00 0.00 H new ATOM 313 N GLN A 24 11.083 2.507 -1.490 1.00 0.00 N ATOM 314 CA GLN A 24 10.634 3.843 -1.842 1.00 0.00 C ATOM 315 C GLN A 24 9.111 3.937 -1.736 1.00 0.00 C ATOM 316 O GLN A 24 8.565 5.020 -1.528 1.00 0.00 O ATOM 317 CB GLN A 24 11.111 4.230 -3.244 1.00 0.00 C ATOM 318 CG GLN A 24 11.677 5.651 -3.258 1.00 0.00 C ATOM 319 CD GLN A 24 10.579 6.682 -2.991 1.00 0.00 C ATOM 320 OE1 GLN A 24 10.626 7.445 -2.040 1.00 0.00 O ATOM 321 NE2 GLN A 24 9.590 6.661 -3.880 1.00 0.00 N ATOM 0 H GLN A 24 10.763 1.770 -2.118 1.00 0.00 H new ATOM 0 HA GLN A 24 11.072 4.549 -1.137 1.00 0.00 H new ATOM 0 HB2 GLN A 24 11.874 3.528 -3.579 1.00 0.00 H new ATOM 0 HB3 GLN A 24 10.281 4.158 -3.947 1.00 0.00 H new ATOM 0 HG2 GLN A 24 12.458 5.743 -2.503 1.00 0.00 H new ATOM 0 HG3 GLN A 24 12.142 5.851 -4.223 1.00 0.00 H new ATOM 0 HE21 GLN A 24 9.613 5.996 -4.653 1.00 0.00 H new ATOM 0 HE22 GLN A 24 8.808 7.310 -3.789 1.00 0.00 H new ATOM 330 N SER A 25 8.468 2.788 -1.884 1.00 0.00 N ATOM 331 CA SER A 25 7.018 2.727 -1.807 1.00 0.00 C ATOM 332 C SER A 25 6.577 1.341 -1.332 1.00 0.00 C ATOM 333 O SER A 25 7.349 0.386 -1.393 1.00 0.00 O ATOM 334 CB SER A 25 6.381 3.052 -3.159 1.00 0.00 C ATOM 335 OG SER A 25 7.322 3.607 -4.074 1.00 0.00 O ATOM 0 H SER A 25 8.924 1.892 -2.057 1.00 0.00 H new ATOM 0 HA SER A 25 6.682 3.474 -1.088 1.00 0.00 H new ATOM 0 HB2 SER A 25 5.953 2.145 -3.585 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.560 3.754 -3.013 1.00 0.00 H new ATOM 0 HG SER A 25 6.876 3.799 -4.925 1.00 0.00 H new ATOM 341 N VAL A 26 5.337 1.276 -0.869 1.00 0.00 N ATOM 342 CA VAL A 26 4.784 0.023 -0.384 1.00 0.00 C ATOM 343 C VAL A 26 3.430 -0.224 -1.051 1.00 0.00 C ATOM 344 O VAL A 26 2.627 0.697 -1.194 1.00 0.00 O ATOM 345 CB VAL A 26 4.703 0.044 1.144 1.00 0.00 C ATOM 346 CG1 VAL A 26 3.865 -1.125 1.664 1.00 0.00 C ATOM 347 CG2 VAL A 26 6.101 0.037 1.767 1.00 0.00 C ATOM 0 H VAL A 26 4.700 2.071 -0.820 1.00 0.00 H new ATOM 0 HA VAL A 26 5.434 -0.810 -0.651 1.00 0.00 H new ATOM 0 HB VAL A 26 4.209 0.969 1.441 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.823 -1.087 2.753 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.855 -1.057 1.260 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.319 -2.065 1.351 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.015 0.052 2.854 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.633 -0.863 1.458 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.652 0.917 1.434 1.00 0.00 H new ATOM 357 N LYS A 27 3.218 -1.472 -1.442 1.00 0.00 N ATOM 358 CA LYS A 27 1.974 -1.852 -2.090 1.00 0.00 C ATOM 359 C LYS A 27 1.477 -3.172 -1.497 1.00 0.00 C ATOM 360 O LYS A 27 2.215 -4.155 -1.456 1.00 0.00 O ATOM 361 CB LYS A 27 2.152 -1.889 -3.610 1.00 0.00 C ATOM 362 CG LYS A 27 0.849 -1.523 -4.323 1.00 0.00 C ATOM 363 CD LYS A 27 -0.209 -2.610 -4.126 1.00 0.00 C ATOM 364 CE LYS A 27 -0.941 -2.907 -5.436 1.00 0.00 C ATOM 365 NZ LYS A 27 0.023 -3.272 -6.498 1.00 0.00 N ATOM 0 H LYS A 27 3.887 -2.233 -1.323 1.00 0.00 H new ATOM 0 HA LYS A 27 1.202 -1.106 -1.900 1.00 0.00 H new ATOM 0 HB2 LYS A 27 2.939 -1.195 -3.905 1.00 0.00 H new ATOM 0 HB3 LYS A 27 2.472 -2.884 -3.918 1.00 0.00 H new ATOM 0 HG2 LYS A 27 0.475 -0.573 -3.940 1.00 0.00 H new ATOM 0 HG3 LYS A 27 1.039 -1.385 -5.387 1.00 0.00 H new ATOM 0 HD2 LYS A 27 0.264 -3.519 -3.755 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -0.926 -2.292 -3.369 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -1.651 -3.720 -5.286 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -1.517 -2.034 -5.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -0.418 -3.953 -7.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 0.299 -2.419 -7.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 0.867 -3.701 -6.068 1.00 0.00 H new ATOM 379 N VAL A 28 0.229 -3.151 -1.052 1.00 0.00 N ATOM 380 CA VAL A 28 -0.375 -4.333 -0.463 1.00 0.00 C ATOM 381 C VAL A 28 -1.615 -4.723 -1.270 1.00 0.00 C ATOM 382 O VAL A 28 -2.572 -3.954 -1.355 1.00 0.00 O ATOM 383 CB VAL A 28 -0.679 -4.084 1.016 1.00 0.00 C ATOM 384 CG1 VAL A 28 -1.315 -5.317 1.660 1.00 0.00 C ATOM 385 CG2 VAL A 28 0.583 -3.661 1.771 1.00 0.00 C ATOM 0 H VAL A 28 -0.380 -2.334 -1.088 1.00 0.00 H new ATOM 0 HA VAL A 28 0.317 -5.175 -0.502 1.00 0.00 H new ATOM 0 HB VAL A 28 -1.397 -3.266 1.077 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -1.521 -5.113 2.711 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.247 -5.556 1.147 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -0.631 -6.162 1.582 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.340 -3.490 2.820 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.333 -4.448 1.696 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.977 -2.743 1.336 1.00 0.00 H new ATOM 395 N LYS A 29 -1.559 -5.917 -1.842 1.00 0.00 N ATOM 396 CA LYS A 29 -2.665 -6.418 -2.639 1.00 0.00 C ATOM 397 C LYS A 29 -3.318 -7.596 -1.914 1.00 0.00 C ATOM 398 O LYS A 29 -2.808 -8.715 -1.955 1.00 0.00 O ATOM 399 CB LYS A 29 -2.196 -6.751 -4.057 1.00 0.00 C ATOM 400 CG LYS A 29 -3.387 -7.025 -4.978 1.00 0.00 C ATOM 401 CD LYS A 29 -3.718 -8.519 -5.017 1.00 0.00 C ATOM 402 CE LYS A 29 -3.185 -9.166 -6.296 1.00 0.00 C ATOM 403 NZ LYS A 29 -4.245 -9.961 -6.956 1.00 0.00 N ATOM 0 H LYS A 29 -0.764 -6.552 -1.769 1.00 0.00 H new ATOM 0 HA LYS A 29 -3.430 -5.651 -2.754 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -1.608 -5.923 -4.453 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -1.542 -7.623 -4.032 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -4.256 -6.465 -4.631 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -3.162 -6.672 -5.984 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -3.285 -9.014 -4.148 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.798 -8.657 -4.958 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -2.823 -8.395 -6.977 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -2.336 -9.807 -6.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -3.866 -10.393 -7.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -4.571 -10.708 -6.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -5.044 -9.341 -7.199 1.00 0.00 H new ATOM 417 N SER A 30 -4.437 -7.305 -1.267 1.00 0.00 N ATOM 418 CA SER A 30 -5.165 -8.327 -0.534 1.00 0.00 C ATOM 419 C SER A 30 -5.577 -9.457 -1.480 1.00 0.00 C ATOM 420 O SER A 30 -5.442 -9.333 -2.697 1.00 0.00 O ATOM 421 CB SER A 30 -6.397 -7.737 0.156 1.00 0.00 C ATOM 422 OG SER A 30 -7.603 -8.360 -0.280 1.00 0.00 O ATOM 0 H SER A 30 -4.857 -6.376 -1.235 1.00 0.00 H new ATOM 0 HA SER A 30 -4.507 -8.729 0.237 1.00 0.00 H new ATOM 0 HB2 SER A 30 -6.299 -7.853 1.235 1.00 0.00 H new ATOM 0 HB3 SER A 30 -6.448 -6.667 -0.046 1.00 0.00 H new ATOM 0 HG SER A 30 -8.366 -7.957 0.184 1.00 0.00 H new ATOM 428 N PRO A 31 -6.083 -10.562 -0.870 1.00 0.00 N ATOM 429 CA PRO A 31 -6.514 -11.713 -1.644 1.00 0.00 C ATOM 430 C PRO A 31 -7.852 -11.439 -2.334 1.00 0.00 C ATOM 431 O PRO A 31 -8.492 -10.421 -2.074 1.00 0.00 O ATOM 432 CB PRO A 31 -6.585 -12.856 -0.645 1.00 0.00 C ATOM 433 CG PRO A 31 -6.642 -12.206 0.728 1.00 0.00 C ATOM 434 CD PRO A 31 -6.256 -10.744 0.568 1.00 0.00 C ATOM 0 HA PRO A 31 -5.828 -11.954 -2.456 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -7.465 -13.475 -0.821 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -5.715 -13.507 -0.733 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -7.643 -12.292 1.150 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -5.962 -12.707 1.416 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -7.030 -10.085 0.960 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -5.338 -10.515 1.109 1.00 0.00 H new ATOM 442 N GLY A 32 -8.235 -12.365 -3.201 1.00 0.00 N ATOM 443 CA GLY A 32 -9.485 -12.236 -3.930 1.00 0.00 C ATOM 444 C GLY A 32 -10.126 -13.606 -4.166 1.00 0.00 C ATOM 445 O GLY A 32 -9.830 -14.564 -3.454 1.00 0.00 O ATOM 0 H GLY A 32 -7.701 -13.208 -3.415 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -10.172 -11.600 -3.371 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -9.303 -11.746 -4.886 1.00 0.00 H new ATOM 449 N PRO A 33 -11.016 -13.655 -5.193 1.00 0.00 N ATOM 450 CA PRO A 33 -11.701 -14.890 -5.531 1.00 0.00 C ATOM 451 C PRO A 33 -10.762 -15.859 -6.253 1.00 0.00 C ATOM 452 O PRO A 33 -11.167 -16.958 -6.628 1.00 0.00 O ATOM 453 CB PRO A 33 -12.884 -14.463 -6.385 1.00 0.00 C ATOM 454 CG PRO A 33 -12.558 -13.063 -6.879 1.00 0.00 C ATOM 455 CD PRO A 33 -11.391 -12.539 -6.057 1.00 0.00 C ATOM 0 HA PRO A 33 -12.039 -15.437 -4.651 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -13.030 -15.148 -7.220 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -13.807 -14.467 -5.804 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -12.301 -13.082 -7.938 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -13.424 -12.409 -6.773 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -10.561 -12.236 -6.696 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -11.679 -11.665 -5.473 1.00 0.00 H new ATOM 463 N HIS A 34 -9.526 -15.415 -6.425 1.00 0.00 N ATOM 464 CA HIS A 34 -8.525 -16.229 -7.095 1.00 0.00 C ATOM 465 C HIS A 34 -7.373 -16.521 -6.133 1.00 0.00 C ATOM 466 O HIS A 34 -7.049 -17.681 -5.880 1.00 0.00 O ATOM 467 CB HIS A 34 -8.061 -15.561 -8.391 1.00 0.00 C ATOM 468 CG HIS A 34 -8.002 -14.054 -8.319 1.00 0.00 C ATOM 469 ND1 HIS A 34 -9.126 -13.268 -8.136 1.00 0.00 N ATOM 470 CD2 HIS A 34 -6.944 -13.198 -8.405 1.00 0.00 C ATOM 471 CE1 HIS A 34 -8.750 -11.998 -8.116 1.00 0.00 C ATOM 472 NE2 HIS A 34 -7.397 -11.957 -8.283 1.00 0.00 N ATOM 0 H HIS A 34 -9.194 -14.502 -6.112 1.00 0.00 H new ATOM 0 HA HIS A 34 -8.962 -17.185 -7.383 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -7.073 -15.941 -8.650 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -8.735 -15.850 -9.198 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -5.912 -13.482 -8.548 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -9.400 -11.145 -7.990 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -6.827 -11.111 -8.310 1.00 0.00 H new ATOM 480 N CYS A 35 -6.784 -15.450 -5.622 1.00 0.00 N ATOM 481 CA CYS A 35 -5.675 -15.576 -4.693 1.00 0.00 C ATOM 482 C CYS A 35 -6.211 -15.379 -3.274 1.00 0.00 C ATOM 483 O CYS A 35 -6.655 -14.287 -2.920 1.00 0.00 O ATOM 484 CB CYS A 35 -4.549 -14.593 -5.019 1.00 0.00 C ATOM 485 SG CYS A 35 -3.149 -14.610 -3.839 1.00 0.00 S ATOM 0 H CYS A 35 -7.055 -14.490 -5.834 1.00 0.00 H new ATOM 0 HA CYS A 35 -5.237 -16.570 -4.780 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -4.168 -14.816 -6.016 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -4.964 -13.586 -5.054 1.00 0.00 H new ATOM 490 N ALA A 36 -6.154 -16.452 -2.499 1.00 0.00 N ATOM 491 CA ALA A 36 -6.628 -16.411 -1.126 1.00 0.00 C ATOM 492 C ALA A 36 -5.461 -16.071 -0.197 1.00 0.00 C ATOM 493 O ALA A 36 -5.488 -16.402 0.987 1.00 0.00 O ATOM 494 CB ALA A 36 -7.285 -17.746 -0.772 1.00 0.00 C ATOM 0 H ALA A 36 -5.786 -17.356 -2.796 1.00 0.00 H new ATOM 0 HA ALA A 36 -7.383 -15.634 -1.004 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -7.640 -17.715 0.258 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -8.127 -17.926 -1.441 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -6.557 -18.550 -0.880 1.00 0.00 H new ATOM 500 N GLN A 37 -4.463 -15.413 -0.770 1.00 0.00 N ATOM 501 CA GLN A 37 -3.288 -15.025 -0.008 1.00 0.00 C ATOM 502 C GLN A 37 -2.957 -13.552 -0.258 1.00 0.00 C ATOM 503 O GLN A 37 -3.349 -12.989 -1.279 1.00 0.00 O ATOM 504 CB GLN A 37 -2.095 -15.921 -0.346 1.00 0.00 C ATOM 505 CG GLN A 37 -2.519 -17.388 -0.436 1.00 0.00 C ATOM 506 CD GLN A 37 -2.436 -17.895 -1.877 1.00 0.00 C ATOM 507 OE1 GLN A 37 -1.426 -17.770 -2.550 1.00 0.00 O ATOM 508 NE2 GLN A 37 -3.552 -18.473 -2.312 1.00 0.00 N ATOM 0 H GLN A 37 -4.444 -15.139 -1.752 1.00 0.00 H new ATOM 0 HA GLN A 37 -3.507 -15.153 1.052 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -1.657 -15.607 -1.293 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -1.323 -15.808 0.416 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -1.879 -17.995 0.204 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -3.538 -17.499 -0.066 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -4.362 -18.545 -1.697 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -3.598 -18.844 -3.261 1.00 0.00 H new ATOM 517 N THR A 38 -2.238 -12.971 0.691 1.00 0.00 N ATOM 518 CA THR A 38 -1.849 -11.575 0.587 1.00 0.00 C ATOM 519 C THR A 38 -0.657 -11.423 -0.361 1.00 0.00 C ATOM 520 O THR A 38 0.052 -12.390 -0.632 1.00 0.00 O ATOM 521 CB THR A 38 -1.573 -11.054 1.998 1.00 0.00 C ATOM 522 OG1 THR A 38 -2.712 -11.466 2.749 1.00 0.00 O ATOM 523 CG2 THR A 38 -1.607 -9.526 2.076 1.00 0.00 C ATOM 0 H THR A 38 -1.915 -13.442 1.536 1.00 0.00 H new ATOM 0 HA THR A 38 -2.648 -10.973 0.154 1.00 0.00 H new ATOM 0 HB THR A 38 -0.600 -11.412 2.333 1.00 0.00 H new ATOM 0 HG1 THR A 38 -2.615 -11.171 3.678 1.00 0.00 H new ATOM 0 HG21 THR A 38 -1.405 -9.209 3.099 1.00 0.00 H new ATOM 0 HG22 THR A 38 -0.849 -9.111 1.411 1.00 0.00 H new ATOM 0 HG23 THR A 38 -2.591 -9.168 1.773 1.00 0.00 H new ATOM 531 N GLU A 39 -0.474 -10.201 -0.838 1.00 0.00 N ATOM 532 CA GLU A 39 0.619 -9.909 -1.750 1.00 0.00 C ATOM 533 C GLU A 39 1.142 -8.490 -1.516 1.00 0.00 C ATOM 534 O GLU A 39 0.528 -7.519 -1.954 1.00 0.00 O ATOM 535 CB GLU A 39 0.186 -10.101 -3.205 1.00 0.00 C ATOM 536 CG GLU A 39 1.392 -10.386 -4.103 1.00 0.00 C ATOM 537 CD GLU A 39 1.325 -9.560 -5.389 1.00 0.00 C ATOM 538 OE1 GLU A 39 0.219 -9.056 -5.683 1.00 0.00 O ATOM 539 OE2 GLU A 39 2.380 -9.453 -6.050 1.00 0.00 O ATOM 0 H GLU A 39 -1.064 -9.401 -0.610 1.00 0.00 H new ATOM 0 HA GLU A 39 1.429 -10.611 -1.551 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -0.524 -10.925 -3.271 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -0.330 -9.207 -3.556 1.00 0.00 H new ATOM 0 HG2 GLU A 39 2.312 -10.156 -3.566 1.00 0.00 H new ATOM 0 HG3 GLU A 39 1.424 -11.447 -4.349 1.00 0.00 H new ATOM 546 N VAL A 40 2.270 -8.416 -0.825 1.00 0.00 N ATOM 547 CA VAL A 40 2.882 -7.132 -0.527 1.00 0.00 C ATOM 548 C VAL A 40 4.040 -6.887 -1.496 1.00 0.00 C ATOM 549 O VAL A 40 4.972 -7.687 -1.570 1.00 0.00 O ATOM 550 CB VAL A 40 3.310 -7.085 0.941 1.00 0.00 C ATOM 551 CG1 VAL A 40 4.034 -5.775 1.259 1.00 0.00 C ATOM 552 CG2 VAL A 40 2.111 -7.289 1.869 1.00 0.00 C ATOM 0 H VAL A 40 2.776 -9.224 -0.463 1.00 0.00 H new ATOM 0 HA VAL A 40 2.164 -6.324 -0.668 1.00 0.00 H new ATOM 0 HB VAL A 40 4.009 -7.904 1.113 1.00 0.00 H new ATOM 0 HG11 VAL A 40 4.328 -5.767 2.309 1.00 0.00 H new ATOM 0 HG12 VAL A 40 4.922 -5.689 0.633 1.00 0.00 H new ATOM 0 HG13 VAL A 40 3.369 -4.934 1.062 1.00 0.00 H new ATOM 0 HG21 VAL A 40 2.443 -7.251 2.906 1.00 0.00 H new ATOM 0 HG22 VAL A 40 1.377 -6.502 1.694 1.00 0.00 H new ATOM 0 HG23 VAL A 40 1.657 -8.259 1.669 1.00 0.00 H new ATOM 562 N ILE A 41 3.943 -5.779 -2.215 1.00 0.00 N ATOM 563 CA ILE A 41 4.971 -5.418 -3.176 1.00 0.00 C ATOM 564 C ILE A 41 5.489 -4.014 -2.861 1.00 0.00 C ATOM 565 O ILE A 41 4.790 -3.026 -3.083 1.00 0.00 O ATOM 566 CB ILE A 41 4.447 -5.574 -4.605 1.00 0.00 C ATOM 567 CG1 ILE A 41 3.557 -6.812 -4.731 1.00 0.00 C ATOM 568 CG2 ILE A 41 5.598 -5.590 -5.613 1.00 0.00 C ATOM 569 CD1 ILE A 41 2.094 -6.417 -4.939 1.00 0.00 C ATOM 0 H ILE A 41 3.168 -5.119 -2.151 1.00 0.00 H new ATOM 0 HA ILE A 41 5.821 -6.096 -3.097 1.00 0.00 H new ATOM 0 HB ILE A 41 3.828 -4.708 -4.838 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.895 -7.423 -5.568 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.648 -7.423 -3.833 1.00 0.00 H new ATOM 0 HG21 ILE A 41 5.198 -5.702 -6.621 1.00 0.00 H new ATOM 0 HG22 ILE A 41 6.154 -4.655 -5.545 1.00 0.00 H new ATOM 0 HG23 ILE A 41 6.263 -6.425 -5.392 1.00 0.00 H new ATOM 0 HD11 ILE A 41 1.483 -7.316 -5.025 1.00 0.00 H new ATOM 0 HD12 ILE A 41 1.752 -5.826 -4.089 1.00 0.00 H new ATOM 0 HD13 ILE A 41 2.003 -5.827 -5.851 1.00 0.00 H new ATOM 581 N ALA A 42 6.709 -3.969 -2.347 1.00 0.00 N ATOM 582 CA ALA A 42 7.329 -2.701 -1.999 1.00 0.00 C ATOM 583 C ALA A 42 8.214 -2.236 -3.156 1.00 0.00 C ATOM 584 O ALA A 42 8.996 -3.016 -3.698 1.00 0.00 O ATOM 585 CB ALA A 42 8.111 -2.857 -0.693 1.00 0.00 C ATOM 0 H ALA A 42 7.285 -4.790 -2.163 1.00 0.00 H new ATOM 0 HA ALA A 42 6.571 -1.935 -1.836 1.00 0.00 H new ATOM 0 HB1 ALA A 42 8.576 -1.906 -0.432 1.00 0.00 H new ATOM 0 HB2 ALA A 42 7.432 -3.160 0.104 1.00 0.00 H new ATOM 0 HB3 ALA A 42 8.883 -3.616 -0.820 1.00 0.00 H new ATOM 591 N THR A 43 8.062 -0.966 -3.502 1.00 0.00 N ATOM 592 CA THR A 43 8.838 -0.387 -4.586 1.00 0.00 C ATOM 593 C THR A 43 10.225 0.023 -4.088 1.00 0.00 C ATOM 594 O THR A 43 10.367 0.519 -2.971 1.00 0.00 O ATOM 595 CB THR A 43 8.035 0.775 -5.174 1.00 0.00 C ATOM 596 OG1 THR A 43 6.941 0.144 -5.832 1.00 0.00 O ATOM 597 CG2 THR A 43 8.783 1.493 -6.299 1.00 0.00 C ATOM 0 H THR A 43 7.413 -0.321 -3.051 1.00 0.00 H new ATOM 0 HA THR A 43 9.014 -1.114 -5.379 1.00 0.00 H new ATOM 0 HB THR A 43 7.796 1.487 -4.384 1.00 0.00 H new ATOM 0 HG1 THR A 43 6.459 0.805 -6.371 1.00 0.00 H new ATOM 0 HG21 THR A 43 8.169 2.309 -6.681 1.00 0.00 H new ATOM 0 HG22 THR A 43 9.721 1.894 -5.914 1.00 0.00 H new ATOM 0 HG23 THR A 43 8.993 0.789 -7.104 1.00 0.00 H new ATOM 605 N LEU A 44 11.214 -0.200 -4.941 1.00 0.00 N ATOM 606 CA LEU A 44 12.586 0.140 -4.603 1.00 0.00 C ATOM 607 C LEU A 44 12.878 1.573 -5.055 1.00 0.00 C ATOM 608 O LEU A 44 12.292 2.054 -6.023 1.00 0.00 O ATOM 609 CB LEU A 44 13.553 -0.896 -5.179 1.00 0.00 C ATOM 610 CG LEU A 44 14.617 -1.428 -4.217 1.00 0.00 C ATOM 611 CD1 LEU A 44 15.215 -2.739 -4.732 1.00 0.00 C ATOM 612 CD2 LEU A 44 15.692 -0.373 -3.950 1.00 0.00 C ATOM 0 H LEU A 44 11.093 -0.612 -5.866 1.00 0.00 H new ATOM 0 HA LEU A 44 12.731 0.110 -3.523 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.971 -1.740 -5.549 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.057 -0.455 -6.039 1.00 0.00 H new ATOM 0 HG LEU A 44 14.137 -1.646 -3.263 1.00 0.00 H new ATOM 0 HD11 LEU A 44 15.969 -3.096 -4.030 1.00 0.00 H new ATOM 0 HD12 LEU A 44 14.427 -3.485 -4.828 1.00 0.00 H new ATOM 0 HD13 LEU A 44 15.676 -2.571 -5.705 1.00 0.00 H new ATOM 0 HD21 LEU A 44 16.436 -0.777 -3.263 1.00 0.00 H new ATOM 0 HD22 LEU A 44 16.175 -0.100 -4.888 1.00 0.00 H new ATOM 0 HD23 LEU A 44 15.232 0.511 -3.508 1.00 0.00 H new ATOM 624 N LYS A 45 13.785 2.214 -4.332 1.00 0.00 N ATOM 625 CA LYS A 45 14.162 3.581 -4.646 1.00 0.00 C ATOM 626 C LYS A 45 15.048 3.587 -5.894 1.00 0.00 C ATOM 627 O LYS A 45 15.431 4.649 -6.382 1.00 0.00 O ATOM 628 CB LYS A 45 14.806 4.252 -3.432 1.00 0.00 C ATOM 629 CG LYS A 45 14.925 5.764 -3.639 1.00 0.00 C ATOM 630 CD LYS A 45 16.303 6.135 -4.190 1.00 0.00 C ATOM 631 CE LYS A 45 17.129 6.883 -3.141 1.00 0.00 C ATOM 632 NZ LYS A 45 18.535 6.421 -3.164 1.00 0.00 N ATOM 0 H LYS A 45 14.270 1.811 -3.530 1.00 0.00 H new ATOM 0 HA LYS A 45 13.279 4.176 -4.878 1.00 0.00 H new ATOM 0 HB2 LYS A 45 14.211 4.049 -2.542 1.00 0.00 H new ATOM 0 HB3 LYS A 45 15.794 3.826 -3.259 1.00 0.00 H new ATOM 0 HG2 LYS A 45 14.151 6.102 -4.328 1.00 0.00 H new ATOM 0 HG3 LYS A 45 14.757 6.279 -2.693 1.00 0.00 H new ATOM 0 HD2 LYS A 45 16.831 5.232 -4.498 1.00 0.00 H new ATOM 0 HD3 LYS A 45 16.188 6.756 -5.078 1.00 0.00 H new ATOM 0 HE2 LYS A 45 17.089 7.955 -3.334 1.00 0.00 H new ATOM 0 HE3 LYS A 45 16.703 6.721 -2.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 19.082 6.938 -2.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 18.569 5.402 -2.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 18.943 6.597 -4.104 1.00 0.00 H new ATOM 646 N ASN A 46 15.348 2.389 -6.374 1.00 0.00 N ATOM 647 CA ASN A 46 16.181 2.243 -7.555 1.00 0.00 C ATOM 648 C ASN A 46 15.291 1.997 -8.775 1.00 0.00 C ATOM 649 O ASN A 46 15.771 1.994 -9.907 1.00 0.00 O ATOM 650 CB ASN A 46 17.131 1.051 -7.415 1.00 0.00 C ATOM 651 CG ASN A 46 17.255 0.291 -8.737 1.00 0.00 C ATOM 652 OD1 ASN A 46 16.784 -0.952 -8.692 1.00 0.00 O flip ATOM 653 ND2 ASN A 46 17.746 0.799 -9.731 1.00 0.00 N flip ATOM 0 H ASN A 46 15.029 1.510 -5.966 1.00 0.00 H new ATOM 0 HA ASN A 46 16.763 3.157 -7.672 1.00 0.00 H new ATOM 0 HB2 ASN A 46 18.114 1.400 -7.098 1.00 0.00 H new ATOM 0 HB3 ASN A 46 16.766 0.379 -6.638 1.00 0.00 H new ATOM 0 HD21 ASN A 46 18.089 1.759 -9.697 1.00 0.00 H new ATOM 0 HD22 ASN A 46 17.814 0.264 -10.597 1.00 0.00 H new ATOM 660 N GLY A 47 14.010 1.798 -8.502 1.00 0.00 N ATOM 661 CA GLY A 47 13.049 1.552 -9.563 1.00 0.00 C ATOM 662 C GLY A 47 12.619 0.084 -9.585 1.00 0.00 C ATOM 663 O GLY A 47 11.767 -0.306 -10.381 1.00 0.00 O ATOM 0 H GLY A 47 13.615 1.802 -7.561 1.00 0.00 H new ATOM 0 HA2 GLY A 47 12.175 2.188 -9.422 1.00 0.00 H new ATOM 0 HA3 GLY A 47 13.487 1.821 -10.524 1.00 0.00 H new ATOM 667 N GLN A 48 13.229 -0.691 -8.699 1.00 0.00 N ATOM 668 CA GLN A 48 12.920 -2.108 -8.606 1.00 0.00 C ATOM 669 C GLN A 48 11.790 -2.340 -7.600 1.00 0.00 C ATOM 670 O GLN A 48 11.204 -1.387 -7.090 1.00 0.00 O ATOM 671 CB GLN A 48 14.163 -2.917 -8.231 1.00 0.00 C ATOM 672 CG GLN A 48 14.969 -3.293 -9.476 1.00 0.00 C ATOM 673 CD GLN A 48 16.278 -3.986 -9.092 1.00 0.00 C ATOM 674 OE1 GLN A 48 16.366 -5.246 -9.509 1.00 0.00 O flip ATOM 675 NE2 GLN A 48 17.151 -3.414 -8.460 1.00 0.00 N flip ATOM 0 H GLN A 48 13.935 -0.364 -8.040 1.00 0.00 H new ATOM 0 HA GLN A 48 12.585 -2.452 -9.585 1.00 0.00 H new ATOM 0 HB2 GLN A 48 14.787 -2.337 -7.551 1.00 0.00 H new ATOM 0 HB3 GLN A 48 13.866 -3.821 -7.699 1.00 0.00 H new ATOM 0 HG2 GLN A 48 14.377 -3.952 -10.112 1.00 0.00 H new ATOM 0 HG3 GLN A 48 15.185 -2.397 -10.058 1.00 0.00 H new ATOM 0 HE21 GLN A 48 17.019 -2.445 -8.170 1.00 0.00 H new ATOM 0 HE22 GLN A 48 18.013 -3.905 -8.221 1.00 0.00 H new ATOM 684 N LYS A 49 11.520 -3.612 -7.346 1.00 0.00 N ATOM 685 CA LYS A 49 10.471 -3.981 -6.411 1.00 0.00 C ATOM 686 C LYS A 49 10.887 -5.247 -5.659 1.00 0.00 C ATOM 687 O LYS A 49 11.532 -6.127 -6.227 1.00 0.00 O ATOM 688 CB LYS A 49 9.129 -4.109 -7.134 1.00 0.00 C ATOM 689 CG LYS A 49 8.799 -2.832 -7.909 1.00 0.00 C ATOM 690 CD LYS A 49 7.406 -2.915 -8.537 1.00 0.00 C ATOM 691 CE LYS A 49 7.292 -1.980 -9.743 1.00 0.00 C ATOM 692 NZ LYS A 49 5.885 -1.881 -10.190 1.00 0.00 N ATOM 0 H LYS A 49 12.009 -4.400 -7.771 1.00 0.00 H new ATOM 0 HA LYS A 49 10.332 -3.198 -5.666 1.00 0.00 H new ATOM 0 HB2 LYS A 49 9.160 -4.956 -7.819 1.00 0.00 H new ATOM 0 HB3 LYS A 49 8.340 -4.313 -6.410 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.849 -1.973 -7.240 1.00 0.00 H new ATOM 0 HG3 LYS A 49 9.544 -2.673 -8.688 1.00 0.00 H new ATOM 0 HD2 LYS A 49 7.203 -3.940 -8.847 1.00 0.00 H new ATOM 0 HD3 LYS A 49 6.652 -2.651 -7.795 1.00 0.00 H new ATOM 0 HE2 LYS A 49 7.667 -0.991 -9.481 1.00 0.00 H new ATOM 0 HE3 LYS A 49 7.914 -2.351 -10.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 5.825 -1.243 -11.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 5.539 -2.824 -10.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 5.300 -1.506 -9.416 1.00 0.00 H new ATOM 706 N ALA A 50 10.501 -5.298 -4.392 1.00 0.00 N ATOM 707 CA ALA A 50 10.826 -6.441 -3.556 1.00 0.00 C ATOM 708 C ALA A 50 9.576 -6.880 -2.791 1.00 0.00 C ATOM 709 O ALA A 50 9.079 -6.148 -1.936 1.00 0.00 O ATOM 710 CB ALA A 50 11.984 -6.079 -2.624 1.00 0.00 C ATOM 0 H ALA A 50 9.966 -4.566 -3.924 1.00 0.00 H new ATOM 0 HA ALA A 50 11.151 -7.283 -4.167 1.00 0.00 H new ATOM 0 HB1 ALA A 50 12.228 -6.936 -1.997 1.00 0.00 H new ATOM 0 HB2 ALA A 50 12.856 -5.804 -3.217 1.00 0.00 H new ATOM 0 HB3 ALA A 50 11.694 -5.239 -1.993 1.00 0.00 H new ATOM 716 N CYS A 51 9.104 -8.072 -3.125 1.00 0.00 N ATOM 717 CA CYS A 51 7.922 -8.616 -2.480 1.00 0.00 C ATOM 718 C CYS A 51 8.257 -8.886 -1.012 1.00 0.00 C ATOM 719 O CYS A 51 9.352 -9.348 -0.696 1.00 0.00 O ATOM 720 CB CYS A 51 7.419 -9.875 -3.190 1.00 0.00 C ATOM 721 SG CYS A 51 5.941 -9.624 -4.240 1.00 0.00 S ATOM 0 H CYS A 51 9.519 -8.676 -3.834 1.00 0.00 H new ATOM 0 HA CYS A 51 7.108 -7.894 -2.540 1.00 0.00 H new ATOM 0 HB2 CYS A 51 8.224 -10.273 -3.808 1.00 0.00 H new ATOM 0 HB3 CYS A 51 7.190 -10.632 -2.440 1.00 0.00 H new ATOM 726 N LEU A 52 7.293 -8.584 -0.153 1.00 0.00 N ATOM 727 CA LEU A 52 7.472 -8.788 1.274 1.00 0.00 C ATOM 728 C LEU A 52 6.536 -9.902 1.748 1.00 0.00 C ATOM 729 O LEU A 52 5.610 -10.284 1.034 1.00 0.00 O ATOM 730 CB LEU A 52 7.292 -7.470 2.030 1.00 0.00 C ATOM 731 CG LEU A 52 8.059 -6.268 1.476 1.00 0.00 C ATOM 732 CD1 LEU A 52 7.540 -4.961 2.078 1.00 0.00 C ATOM 733 CD2 LEU A 52 9.566 -6.437 1.683 1.00 0.00 C ATOM 0 H LEU A 52 6.386 -8.200 -0.419 1.00 0.00 H new ATOM 0 HA LEU A 52 8.490 -9.115 1.487 1.00 0.00 H new ATOM 0 HB2 LEU A 52 6.230 -7.224 2.043 1.00 0.00 H new ATOM 0 HB3 LEU A 52 7.596 -7.624 3.065 1.00 0.00 H new ATOM 0 HG LEU A 52 7.885 -6.218 0.401 1.00 0.00 H new ATOM 0 HD11 LEU A 52 8.102 -4.123 1.667 1.00 0.00 H new ATOM 0 HD12 LEU A 52 6.484 -4.843 1.836 1.00 0.00 H new ATOM 0 HD13 LEU A 52 7.663 -4.985 3.161 1.00 0.00 H new ATOM 0 HD21 LEU A 52 10.088 -5.569 1.280 1.00 0.00 H new ATOM 0 HD22 LEU A 52 9.779 -6.527 2.748 1.00 0.00 H new ATOM 0 HD23 LEU A 52 9.905 -7.336 1.168 1.00 0.00 H new ATOM 745 N ASN A 53 6.810 -10.391 2.948 1.00 0.00 N ATOM 746 CA ASN A 53 6.004 -11.453 3.525 1.00 0.00 C ATOM 747 C ASN A 53 5.025 -10.853 4.536 1.00 0.00 C ATOM 748 O ASN A 53 5.439 -10.290 5.548 1.00 0.00 O ATOM 749 CB ASN A 53 6.878 -12.471 4.260 1.00 0.00 C ATOM 750 CG ASN A 53 6.137 -13.796 4.448 1.00 0.00 C ATOM 751 OD1 ASN A 53 5.326 -14.205 3.633 1.00 0.00 O ATOM 752 ND2 ASN A 53 6.459 -14.443 5.564 1.00 0.00 N ATOM 0 H ASN A 53 7.579 -10.071 3.537 1.00 0.00 H new ATOM 0 HA ASN A 53 5.474 -11.952 2.714 1.00 0.00 H new ATOM 0 HB2 ASN A 53 7.796 -12.640 3.698 1.00 0.00 H new ATOM 0 HB3 ASN A 53 7.169 -12.072 5.232 1.00 0.00 H new ATOM 0 HD21 ASN A 53 6.019 -15.337 5.780 1.00 0.00 H new ATOM 0 HD22 ASN A 53 7.146 -14.045 6.204 1.00 0.00 H new ATOM 759 N PRO A 54 3.710 -10.997 4.218 1.00 0.00 N ATOM 760 CA PRO A 54 2.669 -10.476 5.087 1.00 0.00 C ATOM 761 C PRO A 54 2.501 -11.353 6.330 1.00 0.00 C ATOM 762 O PRO A 54 1.638 -11.091 7.167 1.00 0.00 O ATOM 763 CB PRO A 54 1.421 -10.428 4.221 1.00 0.00 C ATOM 764 CG PRO A 54 1.693 -11.353 3.046 1.00 0.00 C ATOM 765 CD PRO A 54 3.182 -11.658 3.028 1.00 0.00 C ATOM 0 HA PRO A 54 2.905 -9.486 5.478 1.00 0.00 H new ATOM 0 HB2 PRO A 54 0.545 -10.755 4.781 1.00 0.00 H new ATOM 0 HB3 PRO A 54 1.221 -9.412 3.880 1.00 0.00 H new ATOM 0 HG2 PRO A 54 1.116 -12.273 3.143 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.388 -10.882 2.111 1.00 0.00 H new ATOM 0 HD2 PRO A 54 3.367 -12.732 3.057 1.00 0.00 H new ATOM 0 HD3 PRO A 54 3.653 -11.278 2.122 1.00 0.00 H new ATOM 773 N ALA A 55 3.339 -12.376 6.410 1.00 0.00 N ATOM 774 CA ALA A 55 3.294 -13.293 7.536 1.00 0.00 C ATOM 775 C ALA A 55 4.526 -13.074 8.416 1.00 0.00 C ATOM 776 O ALA A 55 4.922 -13.963 9.169 1.00 0.00 O ATOM 777 CB ALA A 55 3.194 -14.730 7.020 1.00 0.00 C ATOM 0 H ALA A 55 4.053 -12.590 5.714 1.00 0.00 H new ATOM 0 HA ALA A 55 2.413 -13.105 8.150 1.00 0.00 H new ATOM 0 HB1 ALA A 55 3.160 -15.418 7.865 1.00 0.00 H new ATOM 0 HB2 ALA A 55 2.287 -14.841 6.425 1.00 0.00 H new ATOM 0 HB3 ALA A 55 4.063 -14.956 6.402 1.00 0.00 H new ATOM 783 N SER A 56 5.099 -11.886 8.292 1.00 0.00 N ATOM 784 CA SER A 56 6.278 -11.539 9.067 1.00 0.00 C ATOM 785 C SER A 56 5.973 -10.349 9.980 1.00 0.00 C ATOM 786 O SER A 56 5.260 -9.427 9.587 1.00 0.00 O ATOM 787 CB SER A 56 7.462 -11.217 8.153 1.00 0.00 C ATOM 788 OG SER A 56 8.515 -10.562 8.855 1.00 0.00 O ATOM 0 H SER A 56 4.769 -11.151 7.666 1.00 0.00 H new ATOM 0 HA SER A 56 6.550 -12.398 9.680 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.840 -12.139 7.710 1.00 0.00 H new ATOM 0 HB3 SER A 56 7.125 -10.584 7.332 1.00 0.00 H new ATOM 0 HG SER A 56 9.311 -10.518 8.284 1.00 0.00 H new ATOM 794 N PRO A 57 6.543 -10.410 11.213 1.00 0.00 N ATOM 795 CA PRO A 57 6.339 -9.349 12.185 1.00 0.00 C ATOM 796 C PRO A 57 7.164 -8.111 11.826 1.00 0.00 C ATOM 797 O PRO A 57 6.810 -6.995 12.202 1.00 0.00 O ATOM 798 CB PRO A 57 6.732 -9.958 13.521 1.00 0.00 C ATOM 799 CG PRO A 57 7.578 -11.178 13.190 1.00 0.00 C ATOM 800 CD PRO A 57 7.393 -11.486 11.713 1.00 0.00 C ATOM 0 HA PRO A 57 5.308 -8.995 12.212 1.00 0.00 H new ATOM 0 HB2 PRO A 57 7.294 -9.245 14.125 1.00 0.00 H new ATOM 0 HB3 PRO A 57 5.850 -10.239 14.097 1.00 0.00 H new ATOM 0 HG2 PRO A 57 8.628 -10.986 13.411 1.00 0.00 H new ATOM 0 HG3 PRO A 57 7.274 -12.030 13.799 1.00 0.00 H new ATOM 0 HD2 PRO A 57 8.349 -11.510 11.191 1.00 0.00 H new ATOM 0 HD3 PRO A 57 6.926 -12.460 11.567 1.00 0.00 H new ATOM 808 N MET A 58 8.249 -8.351 11.104 1.00 0.00 N ATOM 809 CA MET A 58 9.127 -7.270 10.691 1.00 0.00 C ATOM 810 C MET A 58 8.615 -6.606 9.411 1.00 0.00 C ATOM 811 O MET A 58 9.019 -5.492 9.081 1.00 0.00 O ATOM 812 CB MET A 58 10.535 -7.819 10.453 1.00 0.00 C ATOM 813 CG MET A 58 11.593 -6.741 10.700 1.00 0.00 C ATOM 814 SD MET A 58 12.440 -7.058 12.239 1.00 0.00 S ATOM 815 CE MET A 58 11.102 -6.788 13.390 1.00 0.00 C ATOM 0 H MET A 58 8.540 -9.278 10.795 1.00 0.00 H new ATOM 0 HA MET A 58 9.148 -6.521 11.483 1.00 0.00 H new ATOM 0 HB2 MET A 58 10.715 -8.668 11.113 1.00 0.00 H new ATOM 0 HB3 MET A 58 10.618 -8.187 9.430 1.00 0.00 H new ATOM 0 HG2 MET A 58 12.309 -6.727 9.878 1.00 0.00 H new ATOM 0 HG3 MET A 58 11.123 -5.758 10.730 1.00 0.00 H new ATOM 0 HE1 MET A 58 11.497 -6.752 14.405 1.00 0.00 H new ATOM 0 HE2 MET A 58 10.608 -5.844 13.159 1.00 0.00 H new ATOM 0 HE3 MET A 58 10.383 -7.603 13.309 1.00 0.00 H new ATOM 825 N VAL A 59 7.732 -7.318 8.726 1.00 0.00 N ATOM 826 CA VAL A 59 7.160 -6.811 7.490 1.00 0.00 C ATOM 827 C VAL A 59 6.023 -5.842 7.819 1.00 0.00 C ATOM 828 O VAL A 59 5.556 -5.109 6.948 1.00 0.00 O ATOM 829 CB VAL A 59 6.714 -7.976 6.604 1.00 0.00 C ATOM 830 CG1 VAL A 59 5.776 -7.494 5.495 1.00 0.00 C ATOM 831 CG2 VAL A 59 7.921 -8.713 6.019 1.00 0.00 C ATOM 0 H VAL A 59 7.399 -8.241 9.003 1.00 0.00 H new ATOM 0 HA VAL A 59 7.907 -6.255 6.923 1.00 0.00 H new ATOM 0 HB VAL A 59 6.162 -8.679 7.228 1.00 0.00 H new ATOM 0 HG11 VAL A 59 5.474 -8.342 4.880 1.00 0.00 H new ATOM 0 HG12 VAL A 59 4.893 -7.035 5.939 1.00 0.00 H new ATOM 0 HG13 VAL A 59 6.292 -6.761 4.875 1.00 0.00 H new ATOM 0 HG21 VAL A 59 7.576 -9.536 5.393 1.00 0.00 H new ATOM 0 HG22 VAL A 59 8.512 -8.023 5.417 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.535 -9.106 6.829 1.00 0.00 H new ATOM 841 N LYS A 60 5.611 -5.869 9.078 1.00 0.00 N ATOM 842 CA LYS A 60 4.537 -5.001 9.532 1.00 0.00 C ATOM 843 C LYS A 60 5.136 -3.789 10.248 1.00 0.00 C ATOM 844 O LYS A 60 4.406 -2.954 10.780 1.00 0.00 O ATOM 845 CB LYS A 60 3.538 -5.786 10.384 1.00 0.00 C ATOM 846 CG LYS A 60 3.162 -7.107 9.709 1.00 0.00 C ATOM 847 CD LYS A 60 2.209 -6.871 8.536 1.00 0.00 C ATOM 848 CE LYS A 60 0.806 -6.516 9.031 1.00 0.00 C ATOM 849 NZ LYS A 60 -0.051 -7.722 9.068 1.00 0.00 N ATOM 0 H LYS A 60 6.001 -6.478 9.798 1.00 0.00 H new ATOM 0 HA LYS A 60 3.968 -4.622 8.683 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.968 -5.984 11.366 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.641 -5.187 10.544 1.00 0.00 H new ATOM 0 HG2 LYS A 60 4.063 -7.608 9.355 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.693 -7.770 10.436 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.591 -6.066 7.909 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.164 -7.765 7.914 1.00 0.00 H new ATOM 0 HE2 LYS A 60 0.866 -6.074 10.026 1.00 0.00 H new ATOM 0 HE3 LYS A 60 0.362 -5.767 8.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -1.000 -7.463 9.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -0.122 -8.127 8.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 0.366 -8.425 9.711 1.00 0.00 H new ATOM 863 N LYS A 61 6.460 -3.730 10.239 1.00 0.00 N ATOM 864 CA LYS A 61 7.165 -2.633 10.880 1.00 0.00 C ATOM 865 C LYS A 61 7.961 -1.859 9.828 1.00 0.00 C ATOM 866 O LYS A 61 8.399 -0.737 10.077 1.00 0.00 O ATOM 867 CB LYS A 61 8.019 -3.151 12.039 1.00 0.00 C ATOM 868 CG LYS A 61 7.145 -3.783 13.125 1.00 0.00 C ATOM 869 CD LYS A 61 7.522 -3.253 14.510 1.00 0.00 C ATOM 870 CE LYS A 61 6.732 -3.972 15.605 1.00 0.00 C ATOM 871 NZ LYS A 61 7.538 -4.075 16.842 1.00 0.00 N ATOM 0 H LYS A 61 7.063 -4.424 9.798 1.00 0.00 H new ATOM 0 HA LYS A 61 6.457 -1.932 11.323 1.00 0.00 H new ATOM 0 HB2 LYS A 61 8.733 -3.886 11.669 1.00 0.00 H new ATOM 0 HB3 LYS A 61 8.597 -2.331 12.464 1.00 0.00 H new ATOM 0 HG2 LYS A 61 6.096 -3.568 12.923 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.259 -4.867 13.103 1.00 0.00 H new ATOM 0 HD2 LYS A 61 8.590 -3.390 14.678 1.00 0.00 H new ATOM 0 HD3 LYS A 61 7.327 -2.182 14.559 1.00 0.00 H new ATOM 0 HE2 LYS A 61 5.808 -3.431 15.810 1.00 0.00 H new ATOM 0 HE3 LYS A 61 6.450 -4.968 15.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 6.987 -4.566 17.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 8.408 -4.610 16.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 7.786 -3.122 17.175 1.00 0.00 H new ATOM 885 N ILE A 62 8.124 -2.489 8.674 1.00 0.00 N ATOM 886 CA ILE A 62 8.860 -1.874 7.582 1.00 0.00 C ATOM 887 C ILE A 62 7.882 -1.130 6.670 1.00 0.00 C ATOM 888 O ILE A 62 8.290 -0.285 5.875 1.00 0.00 O ATOM 889 CB ILE A 62 9.710 -2.916 6.854 1.00 0.00 C ATOM 890 CG1 ILE A 62 10.651 -3.632 7.825 1.00 0.00 C ATOM 891 CG2 ILE A 62 10.466 -2.286 5.682 1.00 0.00 C ATOM 892 CD1 ILE A 62 10.922 -5.067 7.368 1.00 0.00 C ATOM 0 H ILE A 62 7.759 -3.420 8.471 1.00 0.00 H new ATOM 0 HA ILE A 62 9.564 -1.135 7.965 1.00 0.00 H new ATOM 0 HB ILE A 62 9.042 -3.670 6.438 1.00 0.00 H new ATOM 0 HG12 ILE A 62 11.591 -3.085 7.896 1.00 0.00 H new ATOM 0 HG13 ILE A 62 10.212 -3.641 8.823 1.00 0.00 H new ATOM 0 HG21 ILE A 62 11.063 -3.049 5.182 1.00 0.00 H new ATOM 0 HG22 ILE A 62 9.753 -1.861 4.975 1.00 0.00 H new ATOM 0 HG23 ILE A 62 11.122 -1.498 6.053 1.00 0.00 H new ATOM 0 HD11 ILE A 62 11.593 -5.553 8.075 1.00 0.00 H new ATOM 0 HD12 ILE A 62 9.982 -5.618 7.322 1.00 0.00 H new ATOM 0 HD13 ILE A 62 11.383 -5.053 6.381 1.00 0.00 H new ATOM 904 N ILE A 63 6.610 -1.472 6.815 1.00 0.00 N ATOM 905 CA ILE A 63 5.572 -0.847 6.013 1.00 0.00 C ATOM 906 C ILE A 63 5.006 0.357 6.768 1.00 0.00 C ATOM 907 O ILE A 63 5.013 1.475 6.255 1.00 0.00 O ATOM 908 CB ILE A 63 4.512 -1.876 5.615 1.00 0.00 C ATOM 909 CG1 ILE A 63 5.024 -2.786 4.496 1.00 0.00 C ATOM 910 CG2 ILE A 63 3.196 -1.190 5.239 1.00 0.00 C ATOM 911 CD1 ILE A 63 4.322 -4.145 4.531 1.00 0.00 C ATOM 0 H ILE A 63 6.275 -2.173 7.475 1.00 0.00 H new ATOM 0 HA ILE A 63 5.987 -0.471 5.078 1.00 0.00 H new ATOM 0 HB ILE A 63 4.310 -2.510 6.478 1.00 0.00 H new ATOM 0 HG12 ILE A 63 4.856 -2.310 3.530 1.00 0.00 H new ATOM 0 HG13 ILE A 63 6.100 -2.926 4.599 1.00 0.00 H new ATOM 0 HG21 ILE A 63 2.460 -1.944 4.960 1.00 0.00 H new ATOM 0 HG22 ILE A 63 2.827 -0.620 6.091 1.00 0.00 H new ATOM 0 HG23 ILE A 63 3.364 -0.518 4.398 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.704 -4.773 3.726 1.00 0.00 H new ATOM 0 HD12 ILE A 63 4.512 -4.628 5.489 1.00 0.00 H new ATOM 0 HD13 ILE A 63 3.249 -4.004 4.403 1.00 0.00 H new ATOM 923 N GLU A 64 4.531 0.089 7.975 1.00 0.00 N ATOM 924 CA GLU A 64 3.963 1.137 8.806 1.00 0.00 C ATOM 925 C GLU A 64 4.930 2.319 8.903 1.00 0.00 C ATOM 926 O GLU A 64 4.504 3.473 8.929 1.00 0.00 O ATOM 927 CB GLU A 64 3.608 0.604 10.195 1.00 0.00 C ATOM 928 CG GLU A 64 2.462 -0.407 10.118 1.00 0.00 C ATOM 929 CD GLU A 64 2.461 -1.329 11.339 1.00 0.00 C ATOM 930 OE1 GLU A 64 3.041 -0.913 12.365 1.00 0.00 O ATOM 931 OE2 GLU A 64 1.880 -2.429 11.219 1.00 0.00 O ATOM 0 H GLU A 64 4.528 -0.839 8.398 1.00 0.00 H new ATOM 0 HA GLU A 64 3.041 1.484 8.340 1.00 0.00 H new ATOM 0 HB2 GLU A 64 4.483 0.133 10.642 1.00 0.00 H new ATOM 0 HB3 GLU A 64 3.324 1.432 10.845 1.00 0.00 H new ATOM 0 HG2 GLU A 64 1.510 0.121 10.056 1.00 0.00 H new ATOM 0 HG3 GLU A 64 2.557 -1.001 9.209 1.00 0.00 H new ATOM 938 N LYS A 65 6.212 1.991 8.955 1.00 0.00 N ATOM 939 CA LYS A 65 7.242 3.012 9.049 1.00 0.00 C ATOM 940 C LYS A 65 7.378 3.719 7.700 1.00 0.00 C ATOM 941 O LYS A 65 7.652 4.918 7.648 1.00 0.00 O ATOM 942 CB LYS A 65 8.551 2.406 9.560 1.00 0.00 C ATOM 943 CG LYS A 65 8.731 2.671 11.057 1.00 0.00 C ATOM 944 CD LYS A 65 10.204 2.899 11.401 1.00 0.00 C ATOM 945 CE LYS A 65 10.455 4.356 11.795 1.00 0.00 C ATOM 946 NZ LYS A 65 10.023 5.268 10.712 1.00 0.00 N ATOM 0 H LYS A 65 6.561 1.033 8.934 1.00 0.00 H new ATOM 0 HA LYS A 65 6.961 3.770 9.780 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.556 1.332 9.374 1.00 0.00 H new ATOM 0 HB3 LYS A 65 9.391 2.828 9.009 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.147 3.544 11.348 1.00 0.00 H new ATOM 0 HG3 LYS A 65 8.347 1.826 11.628 1.00 0.00 H new ATOM 0 HD2 LYS A 65 10.496 2.241 12.220 1.00 0.00 H new ATOM 0 HD3 LYS A 65 10.826 2.638 10.545 1.00 0.00 H new ATOM 0 HE2 LYS A 65 9.914 4.589 12.712 1.00 0.00 H new ATOM 0 HE3 LYS A 65 11.514 4.505 12.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 10.553 6.161 10.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 10.207 4.824 9.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 9.006 5.462 10.806 1.00 0.00 H new ATOM 960 N MET A 66 7.180 2.948 6.641 1.00 0.00 N ATOM 961 CA MET A 66 7.276 3.486 5.294 1.00 0.00 C ATOM 962 C MET A 66 6.284 4.633 5.090 1.00 0.00 C ATOM 963 O MET A 66 6.610 5.635 4.455 1.00 0.00 O ATOM 964 CB MET A 66 6.992 2.377 4.280 1.00 0.00 C ATOM 965 CG MET A 66 8.107 2.291 3.235 1.00 0.00 C ATOM 966 SD MET A 66 8.225 3.830 2.340 1.00 0.00 S ATOM 967 CE MET A 66 6.570 3.933 1.680 1.00 0.00 C ATOM 0 H MET A 66 6.953 1.955 6.688 1.00 0.00 H new ATOM 0 HA MET A 66 8.284 3.873 5.148 1.00 0.00 H new ATOM 0 HB2 MET A 66 6.899 1.422 4.797 1.00 0.00 H new ATOM 0 HB3 MET A 66 6.039 2.566 3.786 1.00 0.00 H new ATOM 0 HG2 MET A 66 9.057 2.070 3.722 1.00 0.00 H new ATOM 0 HG3 MET A 66 7.906 1.473 2.543 1.00 0.00 H new ATOM 0 HE1 MET A 66 6.602 4.373 0.683 1.00 0.00 H new ATOM 0 HE2 MET A 66 6.139 2.934 1.621 1.00 0.00 H new ATOM 0 HE3 MET A 66 5.956 4.555 2.332 1.00 0.00 H new ATOM 977 N LEU A 67 5.092 4.446 5.639 1.00 0.00 N ATOM 978 CA LEU A 67 4.050 5.452 5.524 1.00 0.00 C ATOM 979 C LEU A 67 4.462 6.699 6.309 1.00 0.00 C ATOM 980 O LEU A 67 3.891 7.772 6.122 1.00 0.00 O ATOM 981 CB LEU A 67 2.699 4.875 5.951 1.00 0.00 C ATOM 982 CG LEU A 67 2.011 3.959 4.938 1.00 0.00 C ATOM 983 CD1 LEU A 67 2.955 2.847 4.475 1.00 0.00 C ATOM 984 CD2 LEU A 67 0.702 3.402 5.502 1.00 0.00 C ATOM 0 H LEU A 67 4.825 3.613 6.164 1.00 0.00 H new ATOM 0 HA LEU A 67 3.927 5.756 4.484 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.841 4.318 6.877 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.027 5.703 6.177 1.00 0.00 H new ATOM 0 HG LEU A 67 1.756 4.552 4.060 1.00 0.00 H new ATOM 0 HD11 LEU A 67 2.441 2.210 3.755 1.00 0.00 H new ATOM 0 HD12 LEU A 67 3.835 3.288 4.006 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.263 2.250 5.333 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.233 2.754 4.761 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.910 2.829 6.406 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.029 4.226 5.741 1.00 0.00 H new ATOM 996 N LYS A 68 5.451 6.516 7.172 1.00 0.00 N ATOM 997 CA LYS A 68 5.946 7.612 7.987 1.00 0.00 C ATOM 998 C LYS A 68 7.253 8.137 7.389 1.00 0.00 C ATOM 999 O LYS A 68 7.569 9.319 7.519 1.00 0.00 O ATOM 1000 CB LYS A 68 6.069 7.180 9.450 1.00 0.00 C ATOM 1001 CG LYS A 68 5.305 8.134 10.370 1.00 0.00 C ATOM 1002 CD LYS A 68 6.169 8.559 11.559 1.00 0.00 C ATOM 1003 CE LYS A 68 6.345 10.078 11.594 1.00 0.00 C ATOM 1004 NZ LYS A 68 5.172 10.722 12.228 1.00 0.00 N ATOM 0 H LYS A 68 5.923 5.625 7.324 1.00 0.00 H new ATOM 0 HA LYS A 68 5.237 8.440 7.982 1.00 0.00 H new ATOM 0 HB2 LYS A 68 5.682 6.168 9.568 1.00 0.00 H new ATOM 0 HB3 LYS A 68 7.120 7.155 9.738 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.994 9.015 9.809 1.00 0.00 H new ATOM 0 HG3 LYS A 68 4.398 7.649 10.730 1.00 0.00 H new ATOM 0 HD2 LYS A 68 5.708 8.221 12.487 1.00 0.00 H new ATOM 0 HD3 LYS A 68 7.145 8.078 11.494 1.00 0.00 H new ATOM 0 HE2 LYS A 68 7.250 10.332 12.146 1.00 0.00 H new ATOM 0 HE3 LYS A 68 6.473 10.459 10.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 5.308 11.753 12.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 4.315 10.494 11.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 5.068 10.372 13.202 1.00 0.00 H new ATOM 1018 N ASN A 69 7.976 7.233 6.745 1.00 0.00 N ATOM 1019 CA ASN A 69 9.242 7.590 6.126 1.00 0.00 C ATOM 1020 C ASN A 69 10.208 8.089 7.202 1.00 0.00 C ATOM 1021 O ASN A 69 11.090 7.351 7.639 1.00 0.00 O ATOM 1022 CB ASN A 69 9.057 8.711 5.101 1.00 0.00 C ATOM 1023 CG ASN A 69 10.408 9.257 4.636 1.00 0.00 C ATOM 1024 OD1 ASN A 69 11.004 10.122 5.256 1.00 0.00 O ATOM 1025 ND2 ASN A 69 10.856 8.706 3.511 1.00 0.00 N ATOM 0 H ASN A 69 7.710 6.254 6.638 1.00 0.00 H new ATOM 0 HA ASN A 69 9.634 6.705 5.626 1.00 0.00 H new ATOM 0 HB2 ASN A 69 8.498 8.336 4.244 1.00 0.00 H new ATOM 0 HB3 ASN A 69 8.467 9.516 5.539 1.00 0.00 H new ATOM 0 HD21 ASN A 69 11.749 9.004 3.118 1.00 0.00 H new ATOM 0 HD22 ASN A 69 10.307 7.986 3.042 1.00 0.00 H new ATOM 1032 N GLY A 70 10.010 9.337 7.598 1.00 0.00 N ATOM 1033 CA GLY A 70 10.853 9.943 8.615 1.00 0.00 C ATOM 1034 C GLY A 70 11.175 11.397 8.265 1.00 0.00 C ATOM 1035 O GLY A 70 10.353 12.093 7.670 1.00 0.00 O ATOM 0 H GLY A 70 9.278 9.946 7.233 1.00 0.00 H new ATOM 0 HA2 GLY A 70 10.351 9.901 9.581 1.00 0.00 H new ATOM 0 HA3 GLY A 70 11.778 9.375 8.711 1.00 0.00 H new ATOM 1039 N LYS A 71 12.372 11.814 8.649 1.00 0.00 N ATOM 1040 CA LYS A 71 12.813 13.173 8.384 1.00 0.00 C ATOM 1041 C LYS A 71 13.614 13.199 7.081 1.00 0.00 C ATOM 1042 O LYS A 71 13.135 13.696 6.063 1.00 0.00 O ATOM 1043 CB LYS A 71 13.575 13.733 9.586 1.00 0.00 C ATOM 1044 CG LYS A 71 12.794 14.870 10.249 1.00 0.00 C ATOM 1045 CD LYS A 71 13.666 15.617 11.261 1.00 0.00 C ATOM 1046 CE LYS A 71 12.954 15.745 12.609 1.00 0.00 C ATOM 1047 NZ LYS A 71 12.520 17.142 12.835 1.00 0.00 N ATOM 0 H LYS A 71 13.051 11.234 9.142 1.00 0.00 H new ATOM 0 HA LYS A 71 11.956 13.832 8.245 1.00 0.00 H new ATOM 0 HB2 LYS A 71 13.753 12.938 10.311 1.00 0.00 H new ATOM 0 HB3 LYS A 71 14.551 14.096 9.265 1.00 0.00 H new ATOM 0 HG2 LYS A 71 12.439 15.564 9.488 1.00 0.00 H new ATOM 0 HG3 LYS A 71 11.913 14.468 10.750 1.00 0.00 H new ATOM 0 HD2 LYS A 71 14.610 15.088 11.393 1.00 0.00 H new ATOM 0 HD3 LYS A 71 13.907 16.608 10.877 1.00 0.00 H new ATOM 0 HE2 LYS A 71 12.090 15.081 12.635 1.00 0.00 H new ATOM 0 HE3 LYS A 71 13.622 15.431 13.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 12.039 17.212 13.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 13.350 17.768 12.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 11.866 17.429 12.079 1.00 0.00 H new ATOM 1061 N SER A 72 14.821 12.657 7.155 1.00 0.00 N ATOM 1062 CA SER A 72 15.694 12.612 5.994 1.00 0.00 C ATOM 1063 C SER A 72 16.087 14.032 5.579 1.00 0.00 C ATOM 1064 O SER A 72 15.354 14.694 4.846 1.00 0.00 O ATOM 1065 CB SER A 72 15.021 11.886 4.827 1.00 0.00 C ATOM 1066 OG SER A 72 15.967 11.440 3.859 1.00 0.00 O ATOM 0 H SER A 72 15.215 12.245 8.001 1.00 0.00 H new ATOM 0 HA SER A 72 16.593 12.057 6.263 1.00 0.00 H new ATOM 0 HB2 SER A 72 14.460 11.032 5.206 1.00 0.00 H new ATOM 0 HB3 SER A 72 14.302 12.553 4.351 1.00 0.00 H new ATOM 0 HG SER A 72 15.498 10.980 3.131 1.00 0.00 H new ATOM 1072 N ASN A 73 17.243 14.457 6.067 1.00 0.00 N ATOM 1073 CA ASN A 73 17.743 15.786 5.756 1.00 0.00 C ATOM 1074 C ASN A 73 19.055 16.021 6.508 1.00 0.00 C ATOM 1075 O ASN A 73 19.268 15.461 7.582 1.00 0.00 O ATOM 1076 CB ASN A 73 16.749 16.864 6.191 1.00 0.00 C ATOM 1077 CG ASN A 73 17.214 18.251 5.746 1.00 0.00 C ATOM 1078 OD1 ASN A 73 17.467 18.505 4.579 1.00 0.00 O ATOM 1079 ND2 ASN A 73 17.313 19.133 6.737 1.00 0.00 N ATOM 0 H ASN A 73 17.848 13.905 6.675 1.00 0.00 H new ATOM 0 HA ASN A 73 17.892 15.847 4.678 1.00 0.00 H new ATOM 0 HB2 ASN A 73 15.768 16.652 5.766 1.00 0.00 H new ATOM 0 HB3 ASN A 73 16.638 16.845 7.275 1.00 0.00 H new ATOM 0 HD21 ASN A 73 17.616 20.087 6.542 1.00 0.00 H new ATOM 0 HD22 ASN A 73 17.086 18.855 7.692 1.00 0.00 H new TER 1086 ASN A 73 ATOM 1087 N THR B 5 17.033 17.597 -9.979 1.00 0.00 N ATOM 1088 CA THR B 5 15.856 16.757 -9.833 1.00 0.00 C ATOM 1089 C THR B 5 14.634 17.607 -9.481 1.00 0.00 C ATOM 1090 O THR B 5 14.349 17.834 -8.306 1.00 0.00 O ATOM 1091 CB THR B 5 16.169 15.682 -8.791 1.00 0.00 C ATOM 1092 OG1 THR B 5 16.660 16.415 -7.672 1.00 0.00 O ATOM 1093 CG2 THR B 5 17.347 14.795 -9.200 1.00 0.00 C ATOM 0 HA THR B 5 15.607 16.259 -10.770 1.00 0.00 H new ATOM 0 HB THR B 5 15.286 15.063 -8.633 1.00 0.00 H new ATOM 0 HG1 THR B 5 17.300 17.091 -7.979 1.00 0.00 H new ATOM 0 HG21 THR B 5 17.527 14.049 -8.426 1.00 0.00 H new ATOM 0 HG22 THR B 5 17.116 14.294 -10.140 1.00 0.00 H new ATOM 0 HG23 THR B 5 18.238 15.409 -9.326 1.00 0.00 H new ATOM 1101 N GLU B 6 13.946 18.056 -10.520 1.00 0.00 N ATOM 1102 CA GLU B 6 12.761 18.877 -10.335 1.00 0.00 C ATOM 1103 C GLU B 6 11.498 18.026 -10.483 1.00 0.00 C ATOM 1104 O GLU B 6 10.744 18.191 -11.441 1.00 0.00 O ATOM 1105 CB GLU B 6 12.749 20.052 -11.315 1.00 0.00 C ATOM 1106 CG GLU B 6 11.910 21.210 -10.772 1.00 0.00 C ATOM 1107 CD GLU B 6 12.099 22.469 -11.621 1.00 0.00 C ATOM 1108 OE1 GLU B 6 11.597 22.462 -12.765 1.00 0.00 O ATOM 1109 OE2 GLU B 6 12.740 23.410 -11.105 1.00 0.00 O ATOM 0 H GLU B 6 14.186 17.867 -11.493 1.00 0.00 H new ATOM 0 HA GLU B 6 12.782 19.289 -9.326 1.00 0.00 H new ATOM 0 HB2 GLU B 6 13.769 20.391 -11.495 1.00 0.00 H new ATOM 0 HB3 GLU B 6 12.348 19.726 -12.274 1.00 0.00 H new ATOM 0 HG2 GLU B 6 10.857 20.928 -10.763 1.00 0.00 H new ATOM 0 HG3 GLU B 6 12.194 21.417 -9.740 1.00 0.00 H new ATOM 1116 N LEU B 7 11.306 17.136 -9.521 1.00 0.00 N ATOM 1117 CA LEU B 7 10.147 16.260 -9.533 1.00 0.00 C ATOM 1118 C LEU B 7 9.141 16.737 -8.484 1.00 0.00 C ATOM 1119 O LEU B 7 9.465 17.576 -7.644 1.00 0.00 O ATOM 1120 CB LEU B 7 10.575 14.802 -9.355 1.00 0.00 C ATOM 1121 CG LEU B 7 11.422 14.209 -10.483 1.00 0.00 C ATOM 1122 CD1 LEU B 7 12.909 14.489 -10.258 1.00 0.00 C ATOM 1123 CD2 LEU B 7 11.140 12.715 -10.653 1.00 0.00 C ATOM 0 H LEU B 7 11.933 17.003 -8.728 1.00 0.00 H new ATOM 0 HA LEU B 7 9.646 16.306 -10.500 1.00 0.00 H new ATOM 0 HB2 LEU B 7 11.136 14.720 -8.424 1.00 0.00 H new ATOM 0 HB3 LEU B 7 9.679 14.192 -9.241 1.00 0.00 H new ATOM 0 HG LEU B 7 11.140 14.698 -11.415 1.00 0.00 H new ATOM 0 HD11 LEU B 7 13.488 14.057 -11.074 1.00 0.00 H new ATOM 0 HD12 LEU B 7 13.076 15.566 -10.225 1.00 0.00 H new ATOM 0 HD13 LEU B 7 13.224 14.044 -9.314 1.00 0.00 H new ATOM 0 HD21 LEU B 7 11.755 12.318 -11.461 1.00 0.00 H new ATOM 0 HD22 LEU B 7 11.377 12.192 -9.726 1.00 0.00 H new ATOM 0 HD23 LEU B 7 10.087 12.569 -10.893 1.00 0.00 H new ATOM 1135 N ARG B 8 7.940 16.183 -8.566 1.00 0.00 N ATOM 1136 CA ARG B 8 6.885 16.542 -7.634 1.00 0.00 C ATOM 1137 C ARG B 8 6.173 15.286 -7.129 1.00 0.00 C ATOM 1138 O ARG B 8 6.810 14.262 -6.885 1.00 0.00 O ATOM 1139 CB ARG B 8 5.861 17.470 -8.292 1.00 0.00 C ATOM 1140 CG ARG B 8 6.556 18.567 -9.101 1.00 0.00 C ATOM 1141 CD ARG B 8 6.111 19.956 -8.638 1.00 0.00 C ATOM 1142 NE ARG B 8 7.216 20.925 -8.809 1.00 0.00 N ATOM 1143 CZ ARG B 8 7.458 21.595 -9.944 1.00 0.00 C ATOM 1144 NH1 ARG B 8 6.675 21.406 -11.014 1.00 0.00 N ATOM 1145 NH2 ARG B 8 8.484 22.455 -10.008 1.00 0.00 N ATOM 0 H ARG B 8 7.674 15.488 -9.264 1.00 0.00 H new ATOM 0 HA ARG B 8 7.347 17.064 -6.796 1.00 0.00 H new ATOM 0 HB2 ARG B 8 5.207 16.891 -8.944 1.00 0.00 H new ATOM 0 HB3 ARG B 8 5.230 17.922 -7.527 1.00 0.00 H new ATOM 0 HG2 ARG B 8 7.637 18.473 -8.994 1.00 0.00 H new ATOM 0 HG3 ARG B 8 6.328 18.443 -10.160 1.00 0.00 H new ATOM 0 HD2 ARG B 8 5.242 20.278 -9.211 1.00 0.00 H new ATOM 0 HD3 ARG B 8 5.807 19.920 -7.592 1.00 0.00 H new ATOM 0 HE ARG B 8 7.832 21.093 -8.014 1.00 0.00 H new ATOM 0 HH11 ARG B 8 5.894 20.752 -10.965 1.00 0.00 H new ATOM 0 HH12 ARG B 8 6.860 21.916 -11.878 1.00 0.00 H new ATOM 0 HH21 ARG B 8 9.080 22.599 -9.193 1.00 0.00 H new ATOM 0 HH22 ARG B 8 8.669 22.965 -10.872 1.00 0.00 H new ATOM 1159 N CYS B 9 4.861 15.405 -6.986 1.00 0.00 N ATOM 1160 CA CYS B 9 4.056 14.291 -6.514 1.00 0.00 C ATOM 1161 C CYS B 9 3.398 13.627 -7.725 1.00 0.00 C ATOM 1162 O CYS B 9 3.434 14.166 -8.830 1.00 0.00 O ATOM 1163 CB CYS B 9 3.023 14.739 -5.478 1.00 0.00 C ATOM 1164 SG CYS B 9 3.692 15.012 -3.796 1.00 0.00 S ATOM 0 H CYS B 9 4.336 16.255 -7.189 1.00 0.00 H new ATOM 0 HA CYS B 9 4.694 13.568 -6.006 1.00 0.00 H new ATOM 0 HB2 CYS B 9 2.559 15.663 -5.824 1.00 0.00 H new ATOM 0 HB3 CYS B 9 2.235 13.988 -5.423 1.00 0.00 H new ATOM 1169 N GLN B 10 2.811 12.465 -7.477 1.00 0.00 N ATOM 1170 CA GLN B 10 2.146 11.721 -8.533 1.00 0.00 C ATOM 1171 C GLN B 10 0.631 11.916 -8.446 1.00 0.00 C ATOM 1172 O GLN B 10 -0.112 11.418 -9.291 1.00 0.00 O ATOM 1173 CB GLN B 10 2.512 10.237 -8.473 1.00 0.00 C ATOM 1174 CG GLN B 10 1.976 9.490 -9.695 1.00 0.00 C ATOM 1175 CD GLN B 10 0.970 8.413 -9.282 1.00 0.00 C ATOM 1176 OE1 GLN B 10 -0.105 8.284 -9.844 1.00 0.00 O ATOM 1177 NE2 GLN B 10 1.379 7.650 -8.272 1.00 0.00 N ATOM 0 H GLN B 10 2.782 12.020 -6.559 1.00 0.00 H new ATOM 0 HA GLN B 10 2.488 12.107 -9.493 1.00 0.00 H new ATOM 0 HB2 GLN B 10 3.595 10.128 -8.422 1.00 0.00 H new ATOM 0 HB3 GLN B 10 2.104 9.795 -7.564 1.00 0.00 H new ATOM 0 HG2 GLN B 10 1.500 10.195 -10.377 1.00 0.00 H new ATOM 0 HG3 GLN B 10 2.803 9.031 -10.237 1.00 0.00 H new ATOM 0 HE21 GLN B 10 2.292 7.813 -7.847 1.00 0.00 H new ATOM 0 HE22 GLN B 10 0.780 6.902 -7.923 1.00 0.00 H new ATOM 1186 N CYS B 11 0.218 12.641 -7.417 1.00 0.00 N ATOM 1187 CA CYS B 11 -1.195 12.908 -7.209 1.00 0.00 C ATOM 1188 C CYS B 11 -1.342 14.338 -6.685 1.00 0.00 C ATOM 1189 O CYS B 11 -0.567 14.773 -5.835 1.00 0.00 O ATOM 1190 CB CYS B 11 -1.831 11.885 -6.266 1.00 0.00 C ATOM 1191 SG CYS B 11 -3.357 11.100 -6.900 1.00 0.00 S ATOM 0 H CYS B 11 0.837 13.052 -6.718 1.00 0.00 H new ATOM 0 HA CYS B 11 -1.729 12.813 -8.154 1.00 0.00 H new ATOM 0 HB2 CYS B 11 -1.100 11.105 -6.053 1.00 0.00 H new ATOM 0 HB3 CYS B 11 -2.058 12.376 -5.320 1.00 0.00 H new ATOM 1196 N LEU B 12 -2.342 15.028 -7.213 1.00 0.00 N ATOM 1197 CA LEU B 12 -2.601 16.399 -6.808 1.00 0.00 C ATOM 1198 C LEU B 12 -3.858 16.442 -5.938 1.00 0.00 C ATOM 1199 O LEU B 12 -4.124 17.442 -5.273 1.00 0.00 O ATOM 1200 CB LEU B 12 -2.668 17.315 -8.032 1.00 0.00 C ATOM 1201 CG LEU B 12 -1.619 17.064 -9.117 1.00 0.00 C ATOM 1202 CD1 LEU B 12 -2.160 17.435 -10.499 1.00 0.00 C ATOM 1203 CD2 LEU B 12 -0.314 17.795 -8.797 1.00 0.00 C ATOM 0 H LEU B 12 -2.983 14.663 -7.918 1.00 0.00 H new ATOM 0 HA LEU B 12 -1.780 16.778 -6.199 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -3.656 17.217 -8.481 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.573 18.347 -7.694 1.00 0.00 H new ATOM 0 HG LEU B 12 -1.395 15.998 -9.135 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -1.395 17.247 -11.252 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -3.041 16.832 -10.719 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -2.431 18.491 -10.512 1.00 0.00 H new ATOM 0 HD21 LEU B 12 0.415 17.600 -9.584 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -0.503 18.867 -8.735 1.00 0.00 H new ATOM 0 HD23 LEU B 12 0.078 17.440 -7.844 1.00 0.00 H new ATOM 1215 N GLN B 13 -4.599 15.343 -5.971 1.00 0.00 N ATOM 1216 CA GLN B 13 -5.822 15.242 -5.193 1.00 0.00 C ATOM 1217 C GLN B 13 -5.844 13.931 -4.405 1.00 0.00 C ATOM 1218 O GLN B 13 -5.047 13.032 -4.668 1.00 0.00 O ATOM 1219 CB GLN B 13 -7.055 15.362 -6.092 1.00 0.00 C ATOM 1220 CG GLN B 13 -8.309 15.656 -5.266 1.00 0.00 C ATOM 1221 CD GLN B 13 -9.267 16.571 -6.032 1.00 0.00 C ATOM 1222 OE1 GLN B 13 -9.863 16.194 -7.028 1.00 0.00 O ATOM 1223 NE2 GLN B 13 -9.382 17.790 -5.513 1.00 0.00 N ATOM 0 H GLN B 13 -4.376 14.516 -6.524 1.00 0.00 H new ATOM 0 HA GLN B 13 -5.847 16.069 -4.484 1.00 0.00 H new ATOM 0 HB2 GLN B 13 -6.901 16.157 -6.822 1.00 0.00 H new ATOM 0 HB3 GLN B 13 -7.193 14.437 -6.652 1.00 0.00 H new ATOM 0 HG2 GLN B 13 -8.813 14.722 -5.018 1.00 0.00 H new ATOM 0 HG3 GLN B 13 -8.027 16.126 -4.324 1.00 0.00 H new ATOM 0 HE21 GLN B 13 -8.854 18.040 -4.677 1.00 0.00 H new ATOM 0 HE22 GLN B 13 -9.998 18.475 -5.951 1.00 0.00 H new ATOM 1232 N THR B 14 -6.764 13.863 -3.455 1.00 0.00 N ATOM 1233 CA THR B 14 -6.900 12.677 -2.627 1.00 0.00 C ATOM 1234 C THR B 14 -8.341 12.535 -2.132 1.00 0.00 C ATOM 1235 O THR B 14 -9.124 13.479 -2.211 1.00 0.00 O ATOM 1236 CB THR B 14 -5.875 12.770 -1.496 1.00 0.00 C ATOM 1237 OG1 THR B 14 -5.842 14.157 -1.170 1.00 0.00 O ATOM 1238 CG2 THR B 14 -4.452 12.465 -1.969 1.00 0.00 C ATOM 0 H THR B 14 -7.423 14.611 -3.240 1.00 0.00 H new ATOM 0 HA THR B 14 -6.695 11.771 -3.197 1.00 0.00 H new ATOM 0 HB THR B 14 -6.150 12.078 -0.700 1.00 0.00 H new ATOM 0 HG1 THR B 14 -5.739 14.263 -0.201 1.00 0.00 H new ATOM 0 HG21 THR B 14 -3.764 12.545 -1.127 1.00 0.00 H new ATOM 0 HG22 THR B 14 -4.412 11.454 -2.375 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.165 13.178 -2.742 1.00 0.00 H new ATOM 1246 N LEU B 15 -8.646 11.346 -1.631 1.00 0.00 N ATOM 1247 CA LEU B 15 -9.978 11.068 -1.123 1.00 0.00 C ATOM 1248 C LEU B 15 -9.950 11.088 0.407 1.00 0.00 C ATOM 1249 O LEU B 15 -8.895 10.910 1.014 1.00 0.00 O ATOM 1250 CB LEU B 15 -10.513 9.761 -1.711 1.00 0.00 C ATOM 1251 CG LEU B 15 -10.561 9.682 -3.238 1.00 0.00 C ATOM 1252 CD1 LEU B 15 -10.349 8.246 -3.720 1.00 0.00 C ATOM 1253 CD2 LEU B 15 -11.862 10.281 -3.777 1.00 0.00 C ATOM 0 H LEU B 15 -7.993 10.565 -1.566 1.00 0.00 H new ATOM 0 HA LEU B 15 -10.676 11.843 -1.440 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -9.896 8.941 -1.344 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -11.520 9.598 -1.327 1.00 0.00 H new ATOM 0 HG LEU B 15 -9.741 10.280 -3.637 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -10.388 8.218 -4.809 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -9.376 7.889 -3.382 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -11.132 7.606 -3.313 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -11.871 10.212 -4.865 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -12.711 9.731 -3.372 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -11.932 11.327 -3.479 1.00 0.00 H new ATOM 1265 N GLN B 16 -11.122 11.307 0.985 1.00 0.00 N ATOM 1266 CA GLN B 16 -11.245 11.353 2.432 1.00 0.00 C ATOM 1267 C GLN B 16 -12.105 10.189 2.929 1.00 0.00 C ATOM 1268 O GLN B 16 -13.239 10.390 3.361 1.00 0.00 O ATOM 1269 CB GLN B 16 -11.819 12.694 2.891 1.00 0.00 C ATOM 1270 CG GLN B 16 -12.337 12.606 4.329 1.00 0.00 C ATOM 1271 CD GLN B 16 -11.983 13.869 5.117 1.00 0.00 C ATOM 1272 OE1 GLN B 16 -12.836 14.657 5.492 1.00 0.00 O ATOM 1273 NE2 GLN B 16 -10.681 14.017 5.346 1.00 0.00 N ATOM 0 H GLN B 16 -11.994 11.454 0.478 1.00 0.00 H new ATOM 0 HA GLN B 16 -10.250 11.254 2.865 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -11.051 13.464 2.824 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -12.629 12.993 2.226 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -13.418 12.468 4.322 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -11.908 11.733 4.821 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -10.020 13.319 5.004 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -10.343 14.828 5.864 1.00 0.00 H new ATOM 1282 N GLY B 17 -11.532 8.997 2.852 1.00 0.00 N ATOM 1283 CA GLY B 17 -12.232 7.801 3.289 1.00 0.00 C ATOM 1284 C GLY B 17 -13.136 7.259 2.179 1.00 0.00 C ATOM 1285 O GLY B 17 -14.242 7.756 1.977 1.00 0.00 O ATOM 0 H GLY B 17 -10.591 8.834 2.494 1.00 0.00 H new ATOM 0 HA2 GLY B 17 -11.510 7.038 3.580 1.00 0.00 H new ATOM 0 HA3 GLY B 17 -12.830 8.027 4.172 1.00 0.00 H new ATOM 1289 N ILE B 18 -12.631 6.246 1.490 1.00 0.00 N ATOM 1290 CA ILE B 18 -13.379 5.631 0.407 1.00 0.00 C ATOM 1291 C ILE B 18 -13.769 4.207 0.806 1.00 0.00 C ATOM 1292 O ILE B 18 -13.137 3.606 1.674 1.00 0.00 O ATOM 1293 CB ILE B 18 -12.588 5.708 -0.901 1.00 0.00 C ATOM 1294 CG1 ILE B 18 -12.741 7.084 -1.553 1.00 0.00 C ATOM 1295 CG2 ILE B 18 -12.987 4.576 -1.850 1.00 0.00 C ATOM 1296 CD1 ILE B 18 -14.206 7.375 -1.883 1.00 0.00 C ATOM 0 H ILE B 18 -11.713 5.836 1.661 1.00 0.00 H new ATOM 0 HA ILE B 18 -14.305 6.176 0.226 1.00 0.00 H new ATOM 0 HB ILE B 18 -11.531 5.577 -0.670 1.00 0.00 H new ATOM 0 HG12 ILE B 18 -12.356 7.853 -0.883 1.00 0.00 H new ATOM 0 HG13 ILE B 18 -12.144 7.127 -2.464 1.00 0.00 H new ATOM 0 HG21 ILE B 18 -12.410 4.654 -2.772 1.00 0.00 H new ATOM 0 HG22 ILE B 18 -12.785 3.616 -1.376 1.00 0.00 H new ATOM 0 HG23 ILE B 18 -14.050 4.651 -2.080 1.00 0.00 H new ATOM 0 HD11 ILE B 18 -14.286 8.359 -2.345 1.00 0.00 H new ATOM 0 HD12 ILE B 18 -14.581 6.618 -2.572 1.00 0.00 H new ATOM 0 HD13 ILE B 18 -14.796 7.355 -0.967 1.00 0.00 H new ATOM 1308 N HIS B 19 -14.808 3.707 0.154 1.00 0.00 N ATOM 1309 CA HIS B 19 -15.290 2.364 0.430 1.00 0.00 C ATOM 1310 C HIS B 19 -14.165 1.356 0.190 1.00 0.00 C ATOM 1311 O HIS B 19 -13.501 1.395 -0.845 1.00 0.00 O ATOM 1312 CB HIS B 19 -16.546 2.058 -0.389 1.00 0.00 C ATOM 1313 CG HIS B 19 -17.653 1.407 0.405 1.00 0.00 C ATOM 1314 ND1 HIS B 19 -18.745 0.800 -0.191 1.00 0.00 N ATOM 1315 CD2 HIS B 19 -17.825 1.273 1.751 1.00 0.00 C ATOM 1316 CE1 HIS B 19 -19.532 0.326 0.764 1.00 0.00 C ATOM 1317 NE2 HIS B 19 -18.961 0.621 1.967 1.00 0.00 N ATOM 0 H HIS B 19 -15.330 4.208 -0.565 1.00 0.00 H new ATOM 0 HA HIS B 19 -15.583 2.287 1.477 1.00 0.00 H new ATOM 0 HB2 HIS B 19 -16.920 2.986 -0.822 1.00 0.00 H new ATOM 0 HB3 HIS B 19 -16.276 1.405 -1.219 1.00 0.00 H new ATOM 0 HD2 HIS B 19 -17.151 1.636 2.513 1.00 0.00 H new ATOM 0 HE1 HIS B 19 -20.463 -0.202 0.616 1.00 0.00 H new ATOM 0 HE2 HIS B 19 -19.344 0.380 2.881 1.00 0.00 H new ATOM 1325 N LEU B 20 -13.985 0.475 1.163 1.00 0.00 N ATOM 1326 CA LEU B 20 -12.952 -0.542 1.071 1.00 0.00 C ATOM 1327 C LEU B 20 -13.516 -1.773 0.358 1.00 0.00 C ATOM 1328 O LEU B 20 -12.917 -2.846 0.397 1.00 0.00 O ATOM 1329 CB LEU B 20 -12.372 -0.845 2.454 1.00 0.00 C ATOM 1330 CG LEU B 20 -11.444 -2.058 2.542 1.00 0.00 C ATOM 1331 CD1 LEU B 20 -10.401 -2.032 1.422 1.00 0.00 C ATOM 1332 CD2 LEU B 20 -10.798 -2.155 3.925 1.00 0.00 C ATOM 0 H LEU B 20 -14.538 0.445 2.020 1.00 0.00 H new ATOM 0 HA LEU B 20 -12.116 -0.181 0.472 1.00 0.00 H new ATOM 0 HB2 LEU B 20 -11.823 0.033 2.796 1.00 0.00 H new ATOM 0 HB3 LEU B 20 -13.199 -0.994 3.148 1.00 0.00 H new ATOM 0 HG LEU B 20 -12.043 -2.958 2.403 1.00 0.00 H new ATOM 0 HD11 LEU B 20 -9.754 -2.905 1.507 1.00 0.00 H new ATOM 0 HD12 LEU B 20 -10.905 -2.047 0.455 1.00 0.00 H new ATOM 0 HD13 LEU B 20 -9.801 -1.126 1.505 1.00 0.00 H new ATOM 0 HD21 LEU B 20 -10.143 -3.026 3.961 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -10.215 -1.255 4.118 1.00 0.00 H new ATOM 0 HD23 LEU B 20 -11.575 -2.254 4.683 1.00 0.00 H new ATOM 1344 N LYS B 21 -14.662 -1.575 -0.277 1.00 0.00 N ATOM 1345 CA LYS B 21 -15.314 -2.656 -0.998 1.00 0.00 C ATOM 1346 C LYS B 21 -15.017 -2.518 -2.492 1.00 0.00 C ATOM 1347 O LYS B 21 -15.332 -3.412 -3.276 1.00 0.00 O ATOM 1348 CB LYS B 21 -16.808 -2.695 -0.668 1.00 0.00 C ATOM 1349 CG LYS B 21 -17.034 -2.884 0.833 1.00 0.00 C ATOM 1350 CD LYS B 21 -17.207 -4.365 1.179 1.00 0.00 C ATOM 1351 CE LYS B 21 -17.935 -4.534 2.514 1.00 0.00 C ATOM 1352 NZ LYS B 21 -19.394 -4.658 2.296 1.00 0.00 N ATOM 0 H LYS B 21 -15.156 -0.683 -0.307 1.00 0.00 H new ATOM 0 HA LYS B 21 -14.916 -3.620 -0.682 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -17.281 -1.769 -0.997 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -17.284 -3.508 -1.216 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -16.189 -2.474 1.386 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -17.919 -2.328 1.144 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -17.768 -4.864 0.389 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -16.231 -4.847 1.229 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -17.562 -5.419 3.029 1.00 0.00 H new ATOM 0 HE3 LYS B 21 -17.729 -3.679 3.158 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 -19.873 -4.772 3.212 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 -19.748 -3.802 1.824 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 -19.587 -5.487 1.699 1.00 0.00 H new ATOM 1366 N ASN B 22 -14.415 -1.391 -2.842 1.00 0.00 N ATOM 1367 CA ASN B 22 -14.072 -1.125 -4.229 1.00 0.00 C ATOM 1368 C ASN B 22 -12.552 -1.173 -4.392 1.00 0.00 C ATOM 1369 O ASN B 22 -12.049 -1.477 -5.472 1.00 0.00 O ATOM 1370 CB ASN B 22 -14.550 0.264 -4.657 1.00 0.00 C ATOM 1371 CG ASN B 22 -15.725 0.163 -5.632 1.00 0.00 C ATOM 1372 OD1 ASN B 22 -15.678 -0.537 -6.631 1.00 0.00 O ATOM 1373 ND2 ASN B 22 -16.778 0.898 -5.288 1.00 0.00 N ATOM 0 H ASN B 22 -14.156 -0.651 -2.189 1.00 0.00 H new ATOM 0 HA ASN B 22 -14.557 -1.880 -4.848 1.00 0.00 H new ATOM 0 HB2 ASN B 22 -14.850 0.836 -3.779 1.00 0.00 H new ATOM 0 HB3 ASN B 22 -13.729 0.807 -5.126 1.00 0.00 H new ATOM 0 HD21 ASN B 22 -17.613 0.898 -5.874 1.00 0.00 H new ATOM 0 HD22 ASN B 22 -16.751 1.461 -4.438 1.00 0.00 H new ATOM 1380 N ILE B 23 -11.862 -0.867 -3.303 1.00 0.00 N ATOM 1381 CA ILE B 23 -10.409 -0.872 -3.312 1.00 0.00 C ATOM 1382 C ILE B 23 -9.909 -2.306 -3.495 1.00 0.00 C ATOM 1383 O ILE B 23 -10.317 -3.208 -2.765 1.00 0.00 O ATOM 1384 CB ILE B 23 -9.863 -0.186 -2.057 1.00 0.00 C ATOM 1385 CG1 ILE B 23 -9.649 1.310 -2.300 1.00 0.00 C ATOM 1386 CG2 ILE B 23 -8.589 -0.875 -1.566 1.00 0.00 C ATOM 1387 CD1 ILE B 23 -10.395 2.146 -1.258 1.00 0.00 C ATOM 0 H ILE B 23 -12.282 -0.614 -2.409 1.00 0.00 H new ATOM 0 HA ILE B 23 -10.032 -0.292 -4.154 1.00 0.00 H new ATOM 0 HB ILE B 23 -10.606 -0.281 -1.265 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -8.584 1.540 -2.262 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -9.996 1.573 -3.299 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -8.222 -0.368 -0.674 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -8.807 -1.916 -1.328 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -7.829 -0.833 -2.346 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -10.227 3.205 -1.453 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -11.462 1.932 -1.316 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -10.028 1.898 -0.262 1.00 0.00 H new ATOM 1399 N GLN B 24 -9.031 -2.472 -4.474 1.00 0.00 N ATOM 1400 CA GLN B 24 -8.471 -3.781 -4.762 1.00 0.00 C ATOM 1401 C GLN B 24 -7.070 -3.903 -4.160 1.00 0.00 C ATOM 1402 O GLN B 24 -6.602 -5.008 -3.886 1.00 0.00 O ATOM 1403 CB GLN B 24 -8.445 -4.047 -6.269 1.00 0.00 C ATOM 1404 CG GLN B 24 -8.717 -5.522 -6.570 1.00 0.00 C ATOM 1405 CD GLN B 24 -7.413 -6.321 -6.620 1.00 0.00 C ATOM 1406 OE1 GLN B 24 -7.077 -6.880 -5.460 1.00 0.00 O flip ATOM 1407 NE2 GLN B 24 -6.756 -6.423 -7.642 1.00 0.00 N flip ATOM 0 H GLN B 24 -8.694 -1.722 -5.077 1.00 0.00 H new ATOM 0 HA GLN B 24 -9.109 -4.536 -4.304 1.00 0.00 H new ATOM 0 HB2 GLN B 24 -9.192 -3.427 -6.764 1.00 0.00 H new ATOM 0 HB3 GLN B 24 -7.475 -3.762 -6.676 1.00 0.00 H new ATOM 0 HG2 GLN B 24 -9.373 -5.938 -5.806 1.00 0.00 H new ATOM 0 HG3 GLN B 24 -9.240 -5.612 -7.522 1.00 0.00 H new ATOM 0 HE21 GLN B 24 -7.072 -5.968 -8.499 1.00 0.00 H new ATOM 0 HE22 GLN B 24 -5.891 -6.963 -7.640 1.00 0.00 H new ATOM 1416 N SER B 25 -6.438 -2.754 -3.973 1.00 0.00 N ATOM 1417 CA SER B 25 -5.100 -2.718 -3.409 1.00 0.00 C ATOM 1418 C SER B 25 -4.755 -1.294 -2.969 1.00 0.00 C ATOM 1419 O SER B 25 -5.437 -0.342 -3.346 1.00 0.00 O ATOM 1420 CB SER B 25 -4.065 -3.228 -4.414 1.00 0.00 C ATOM 1421 OG SER B 25 -4.626 -3.416 -5.710 1.00 0.00 O ATOM 0 H SER B 25 -6.828 -1.840 -4.202 1.00 0.00 H new ATOM 0 HA SER B 25 -5.078 -3.375 -2.540 1.00 0.00 H new ATOM 0 HB2 SER B 25 -3.240 -2.519 -4.476 1.00 0.00 H new ATOM 0 HB3 SER B 25 -3.649 -4.171 -4.059 1.00 0.00 H new ATOM 0 HG SER B 25 -3.933 -3.741 -6.322 1.00 0.00 H new ATOM 1427 N VAL B 26 -3.697 -1.193 -2.178 1.00 0.00 N ATOM 1428 CA VAL B 26 -3.254 0.100 -1.682 1.00 0.00 C ATOM 1429 C VAL B 26 -1.780 0.299 -2.039 1.00 0.00 C ATOM 1430 O VAL B 26 -0.972 -0.618 -1.892 1.00 0.00 O ATOM 1431 CB VAL B 26 -3.526 0.206 -0.180 1.00 0.00 C ATOM 1432 CG1 VAL B 26 -2.805 1.413 0.423 1.00 0.00 C ATOM 1433 CG2 VAL B 26 -5.028 0.266 0.102 1.00 0.00 C ATOM 0 H VAL B 26 -3.133 -1.985 -1.868 1.00 0.00 H new ATOM 0 HA VAL B 26 -3.815 0.905 -2.157 1.00 0.00 H new ATOM 0 HB VAL B 26 -3.132 -0.692 0.297 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -3.015 1.466 1.491 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -1.731 1.310 0.269 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -3.155 2.325 -0.061 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -5.194 0.341 1.177 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -5.457 1.137 -0.393 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -5.506 -0.638 -0.277 1.00 0.00 H new ATOM 1443 N LYS B 27 -1.473 1.502 -2.500 1.00 0.00 N ATOM 1444 CA LYS B 27 -0.109 1.834 -2.878 1.00 0.00 C ATOM 1445 C LYS B 27 0.335 3.087 -2.121 1.00 0.00 C ATOM 1446 O LYS B 27 -0.281 4.144 -2.247 1.00 0.00 O ATOM 1447 CB LYS B 27 0.009 1.959 -4.398 1.00 0.00 C ATOM 1448 CG LYS B 27 1.431 2.349 -4.807 1.00 0.00 C ATOM 1449 CD LYS B 27 2.468 1.578 -3.987 1.00 0.00 C ATOM 1450 CE LYS B 27 3.781 1.434 -4.759 1.00 0.00 C ATOM 1451 NZ LYS B 27 3.543 0.795 -6.072 1.00 0.00 N ATOM 0 H LYS B 27 -2.145 2.260 -2.621 1.00 0.00 H new ATOM 0 HA LYS B 27 0.572 1.032 -2.593 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -0.261 1.013 -4.866 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -0.696 2.707 -4.761 1.00 0.00 H new ATOM 0 HG2 LYS B 27 1.577 2.146 -5.868 1.00 0.00 H new ATOM 0 HG3 LYS B 27 1.573 3.420 -4.665 1.00 0.00 H new ATOM 0 HD2 LYS B 27 2.651 2.096 -3.046 1.00 0.00 H new ATOM 0 HD3 LYS B 27 2.079 0.591 -3.737 1.00 0.00 H new ATOM 0 HE2 LYS B 27 4.235 2.415 -4.902 1.00 0.00 H new ATOM 0 HE3 LYS B 27 4.486 0.838 -4.180 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 4.263 0.064 -6.238 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 2.599 0.359 -6.080 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 3.599 1.513 -6.823 1.00 0.00 H new ATOM 1465 N VAL B 28 1.401 2.927 -1.351 1.00 0.00 N ATOM 1466 CA VAL B 28 1.936 4.032 -0.573 1.00 0.00 C ATOM 1467 C VAL B 28 3.244 4.510 -1.207 1.00 0.00 C ATOM 1468 O VAL B 28 4.213 3.757 -1.282 1.00 0.00 O ATOM 1469 CB VAL B 28 2.098 3.613 0.889 1.00 0.00 C ATOM 1470 CG1 VAL B 28 2.862 4.675 1.682 1.00 0.00 C ATOM 1471 CG2 VAL B 28 0.740 3.321 1.530 1.00 0.00 C ATOM 0 H VAL B 28 1.909 2.048 -1.249 1.00 0.00 H new ATOM 0 HA VAL B 28 1.244 4.874 -0.580 1.00 0.00 H new ATOM 0 HB VAL B 28 2.683 2.693 0.911 1.00 0.00 H new ATOM 0 HG11 VAL B 28 2.963 4.352 2.718 1.00 0.00 H new ATOM 0 HG12 VAL B 28 3.852 4.813 1.246 1.00 0.00 H new ATOM 0 HG13 VAL B 28 2.316 5.618 1.647 1.00 0.00 H new ATOM 0 HG21 VAL B 28 0.884 3.025 2.569 1.00 0.00 H new ATOM 0 HG22 VAL B 28 0.119 4.216 1.490 1.00 0.00 H new ATOM 0 HG23 VAL B 28 0.248 2.513 0.988 1.00 0.00 H new ATOM 1481 N LYS B 29 3.229 5.760 -1.647 1.00 0.00 N ATOM 1482 CA LYS B 29 4.402 6.348 -2.271 1.00 0.00 C ATOM 1483 C LYS B 29 4.915 7.498 -1.402 1.00 0.00 C ATOM 1484 O LYS B 29 4.626 8.662 -1.673 1.00 0.00 O ATOM 1485 CB LYS B 29 4.093 6.757 -3.713 1.00 0.00 C ATOM 1486 CG LYS B 29 5.377 6.879 -4.535 1.00 0.00 C ATOM 1487 CD LYS B 29 6.084 8.206 -4.255 1.00 0.00 C ATOM 1488 CE LYS B 29 6.580 8.847 -5.553 1.00 0.00 C ATOM 1489 NZ LYS B 29 5.690 9.959 -5.955 1.00 0.00 N ATOM 0 H LYS B 29 2.423 6.382 -1.584 1.00 0.00 H new ATOM 0 HA LYS B 29 5.206 5.615 -2.337 1.00 0.00 H new ATOM 0 HB2 LYS B 29 3.433 6.020 -4.170 1.00 0.00 H new ATOM 0 HB3 LYS B 29 3.561 7.708 -3.719 1.00 0.00 H new ATOM 0 HG2 LYS B 29 6.044 6.050 -4.298 1.00 0.00 H new ATOM 0 HG3 LYS B 29 5.142 6.805 -5.597 1.00 0.00 H new ATOM 0 HD2 LYS B 29 5.400 8.886 -3.747 1.00 0.00 H new ATOM 0 HD3 LYS B 29 6.926 8.039 -3.583 1.00 0.00 H new ATOM 0 HE2 LYS B 29 7.596 9.217 -5.417 1.00 0.00 H new ATOM 0 HE3 LYS B 29 6.617 8.098 -6.344 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 6.041 10.383 -6.838 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 4.727 9.596 -6.104 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 5.676 10.681 -5.206 1.00 0.00 H new ATOM 1503 N SER B 30 5.668 7.131 -0.375 1.00 0.00 N ATOM 1504 CA SER B 30 6.224 8.117 0.535 1.00 0.00 C ATOM 1505 C SER B 30 6.879 9.250 -0.257 1.00 0.00 C ATOM 1506 O SER B 30 7.160 9.100 -1.446 1.00 0.00 O ATOM 1507 CB SER B 30 7.238 7.479 1.486 1.00 0.00 C ATOM 1508 OG SER B 30 7.959 6.419 0.864 1.00 0.00 O ATOM 0 H SER B 30 5.906 6.164 -0.153 1.00 0.00 H new ATOM 0 HA SER B 30 5.411 8.525 1.135 1.00 0.00 H new ATOM 0 HB2 SER B 30 7.938 8.239 1.833 1.00 0.00 H new ATOM 0 HB3 SER B 30 6.720 7.098 2.366 1.00 0.00 H new ATOM 0 HG SER B 30 8.285 5.799 1.549 1.00 0.00 H new ATOM 1514 N PRO B 31 7.111 10.388 0.451 1.00 0.00 N ATOM 1515 CA PRO B 31 7.728 11.545 -0.174 1.00 0.00 C ATOM 1516 C PRO B 31 9.228 11.325 -0.376 1.00 0.00 C ATOM 1517 O PRO B 31 9.823 10.457 0.262 1.00 0.00 O ATOM 1518 CB PRO B 31 7.418 12.707 0.757 1.00 0.00 C ATOM 1519 CG PRO B 31 7.044 12.082 2.091 1.00 0.00 C ATOM 1520 CD PRO B 31 6.792 10.602 1.859 1.00 0.00 C ATOM 0 HA PRO B 31 7.341 11.739 -1.174 1.00 0.00 H new ATOM 0 HB2 PRO B 31 8.281 13.365 0.862 1.00 0.00 H new ATOM 0 HB3 PRO B 31 6.601 13.313 0.367 1.00 0.00 H new ATOM 0 HG2 PRO B 31 7.845 12.223 2.817 1.00 0.00 H new ATOM 0 HG3 PRO B 31 6.155 12.561 2.501 1.00 0.00 H new ATOM 0 HD2 PRO B 31 7.419 9.988 2.505 1.00 0.00 H new ATOM 0 HD3 PRO B 31 5.757 10.338 2.075 1.00 0.00 H new ATOM 1528 N GLY B 32 9.798 12.125 -1.265 1.00 0.00 N ATOM 1529 CA GLY B 32 11.217 12.028 -1.559 1.00 0.00 C ATOM 1530 C GLY B 32 11.882 13.406 -1.512 1.00 0.00 C ATOM 1531 O GLY B 32 11.358 14.331 -0.895 1.00 0.00 O ATOM 0 H GLY B 32 9.302 12.844 -1.792 1.00 0.00 H new ATOM 0 HA2 GLY B 32 11.697 11.364 -0.840 1.00 0.00 H new ATOM 0 HA3 GLY B 32 11.358 11.585 -2.545 1.00 0.00 H new ATOM 1535 N PRO B 33 13.057 13.500 -2.191 1.00 0.00 N ATOM 1536 CA PRO B 33 13.799 14.748 -2.233 1.00 0.00 C ATOM 1537 C PRO B 33 13.132 15.751 -3.178 1.00 0.00 C ATOM 1538 O PRO B 33 13.635 16.857 -3.369 1.00 0.00 O ATOM 1539 CB PRO B 33 15.200 14.359 -2.673 1.00 0.00 C ATOM 1540 CG PRO B 33 15.071 12.983 -3.308 1.00 0.00 C ATOM 1541 CD PRO B 33 13.707 12.424 -2.934 1.00 0.00 C ATOM 0 HA PRO B 33 13.826 15.254 -1.268 1.00 0.00 H new ATOM 0 HB2 PRO B 33 15.601 15.081 -3.384 1.00 0.00 H new ATOM 0 HB3 PRO B 33 15.883 14.335 -1.824 1.00 0.00 H new ATOM 0 HG2 PRO B 33 15.172 13.051 -4.391 1.00 0.00 H new ATOM 0 HG3 PRO B 33 15.864 12.324 -2.955 1.00 0.00 H new ATOM 0 HD2 PRO B 33 13.134 12.152 -3.820 1.00 0.00 H new ATOM 0 HD3 PRO B 33 13.801 11.524 -2.327 1.00 0.00 H new ATOM 1549 N HIS B 34 12.011 15.327 -3.743 1.00 0.00 N ATOM 1550 CA HIS B 34 11.271 16.174 -4.663 1.00 0.00 C ATOM 1551 C HIS B 34 9.951 16.600 -4.019 1.00 0.00 C ATOM 1552 O HIS B 34 9.653 17.791 -3.934 1.00 0.00 O ATOM 1553 CB HIS B 34 11.075 15.473 -6.009 1.00 0.00 C ATOM 1554 CG HIS B 34 10.942 13.972 -5.906 1.00 0.00 C ATOM 1555 ND1 HIS B 34 11.981 13.154 -5.497 1.00 0.00 N ATOM 1556 CD2 HIS B 34 9.884 13.151 -6.161 1.00 0.00 C ATOM 1557 CE1 HIS B 34 11.556 11.899 -5.510 1.00 0.00 C ATOM 1558 NE2 HIS B 34 10.256 11.900 -5.923 1.00 0.00 N ATOM 0 H HIS B 34 11.597 14.409 -3.582 1.00 0.00 H new ATOM 0 HA HIS B 34 11.843 17.079 -4.870 1.00 0.00 H new ATOM 0 HB2 HIS B 34 10.183 15.874 -6.490 1.00 0.00 H new ATOM 0 HB3 HIS B 34 11.919 15.709 -6.656 1.00 0.00 H new ATOM 0 HD2 HIS B 34 8.908 13.466 -6.500 1.00 0.00 H new ATOM 0 HE1 HIS B 34 12.136 11.029 -5.241 1.00 0.00 H new ATOM 0 HE2 HIS B 34 9.667 11.075 -6.031 1.00 0.00 H new ATOM 1566 N CYS B 35 9.194 15.605 -3.580 1.00 0.00 N ATOM 1567 CA CYS B 35 7.913 15.861 -2.946 1.00 0.00 C ATOM 1568 C CYS B 35 8.030 15.504 -1.463 1.00 0.00 C ATOM 1569 O CYS B 35 8.344 14.366 -1.118 1.00 0.00 O ATOM 1570 CB CYS B 35 6.779 15.094 -3.630 1.00 0.00 C ATOM 1571 SG CYS B 35 5.350 16.121 -4.130 1.00 0.00 S ATOM 0 H CYS B 35 9.444 14.619 -3.651 1.00 0.00 H new ATOM 0 HA CYS B 35 7.661 16.917 -3.045 1.00 0.00 H new ATOM 0 HB2 CYS B 35 7.178 14.596 -4.514 1.00 0.00 H new ATOM 0 HB3 CYS B 35 6.429 14.313 -2.955 1.00 0.00 H new ATOM 1576 N ALA B 36 7.773 16.498 -0.626 1.00 0.00 N ATOM 1577 CA ALA B 36 7.846 16.303 0.812 1.00 0.00 C ATOM 1578 C ALA B 36 6.462 15.924 1.342 1.00 0.00 C ATOM 1579 O ALA B 36 6.167 16.126 2.519 1.00 0.00 O ATOM 1580 CB ALA B 36 8.396 17.570 1.472 1.00 0.00 C ATOM 0 H ALA B 36 7.514 17.441 -0.916 1.00 0.00 H new ATOM 0 HA ALA B 36 8.527 15.487 1.054 1.00 0.00 H new ATOM 0 HB1 ALA B 36 8.451 17.424 2.551 1.00 0.00 H new ATOM 0 HB2 ALA B 36 9.392 17.780 1.083 1.00 0.00 H new ATOM 0 HB3 ALA B 36 7.737 18.410 1.253 1.00 0.00 H new ATOM 1586 N GLN B 37 5.650 15.380 0.448 1.00 0.00 N ATOM 1587 CA GLN B 37 4.304 14.970 0.811 1.00 0.00 C ATOM 1588 C GLN B 37 4.062 13.517 0.398 1.00 0.00 C ATOM 1589 O GLN B 37 4.658 13.033 -0.563 1.00 0.00 O ATOM 1590 CB GLN B 37 3.260 15.898 0.185 1.00 0.00 C ATOM 1591 CG GLN B 37 3.723 17.356 0.234 1.00 0.00 C ATOM 1592 CD GLN B 37 3.755 17.968 -1.168 1.00 0.00 C ATOM 1593 OE1 GLN B 37 4.923 17.838 -1.789 1.00 0.00 O flip ATOM 1594 NE2 GLN B 37 2.782 18.522 -1.653 1.00 0.00 N flip ATOM 0 H GLN B 37 5.898 15.213 -0.527 1.00 0.00 H new ATOM 0 HA GLN B 37 4.204 15.042 1.894 1.00 0.00 H new ATOM 0 HB2 GLN B 37 3.080 15.604 -0.849 1.00 0.00 H new ATOM 0 HB3 GLN B 37 2.313 15.795 0.715 1.00 0.00 H new ATOM 0 HG2 GLN B 37 3.053 17.933 0.871 1.00 0.00 H new ATOM 0 HG3 GLN B 37 4.715 17.411 0.682 1.00 0.00 H new ATOM 0 HE21 GLN B 37 1.914 18.587 -1.121 1.00 0.00 H new ATOM 0 HE22 GLN B 37 2.836 18.920 -2.591 1.00 0.00 H new ATOM 1603 N THR B 38 3.187 12.860 1.147 1.00 0.00 N ATOM 1604 CA THR B 38 2.860 11.472 0.871 1.00 0.00 C ATOM 1605 C THR B 38 1.892 11.377 -0.310 1.00 0.00 C ATOM 1606 O THR B 38 1.245 12.359 -0.668 1.00 0.00 O ATOM 1607 CB THR B 38 2.312 10.851 2.158 1.00 0.00 C ATOM 1608 OG1 THR B 38 3.282 11.188 3.146 1.00 0.00 O ATOM 1609 CG2 THR B 38 2.330 9.322 2.124 1.00 0.00 C ATOM 0 H THR B 38 2.695 13.264 1.944 1.00 0.00 H new ATOM 0 HA THR B 38 3.744 10.909 0.572 1.00 0.00 H new ATOM 0 HB THR B 38 1.292 11.198 2.323 1.00 0.00 H new ATOM 0 HG1 THR B 38 3.005 10.826 4.013 1.00 0.00 H new ATOM 0 HG21 THR B 38 1.931 8.933 3.061 1.00 0.00 H new ATOM 0 HG22 THR B 38 1.718 8.969 1.294 1.00 0.00 H new ATOM 0 HG23 THR B 38 3.354 8.973 1.993 1.00 0.00 H new ATOM 1617 N GLU B 39 1.823 10.184 -0.883 1.00 0.00 N ATOM 1618 CA GLU B 39 0.945 9.947 -2.016 1.00 0.00 C ATOM 1619 C GLU B 39 0.281 8.574 -1.895 1.00 0.00 C ATOM 1620 O GLU B 39 0.582 7.665 -2.666 1.00 0.00 O ATOM 1621 CB GLU B 39 1.708 10.072 -3.336 1.00 0.00 C ATOM 1622 CG GLU B 39 1.005 11.044 -4.286 1.00 0.00 C ATOM 1623 CD GLU B 39 1.070 12.476 -3.751 1.00 0.00 C ATOM 1624 OE1 GLU B 39 2.106 12.806 -3.135 1.00 0.00 O ATOM 1625 OE2 GLU B 39 0.081 13.209 -3.971 1.00 0.00 O ATOM 0 H GLU B 39 2.361 9.371 -0.583 1.00 0.00 H new ATOM 0 HA GLU B 39 0.165 10.708 -2.011 1.00 0.00 H new ATOM 0 HB2 GLU B 39 2.723 10.418 -3.142 1.00 0.00 H new ATOM 0 HB3 GLU B 39 1.790 9.092 -3.807 1.00 0.00 H new ATOM 0 HG2 GLU B 39 1.472 10.998 -5.270 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -0.036 10.746 -4.412 1.00 0.00 H new ATOM 1632 N VAL B 40 -0.611 8.468 -0.921 1.00 0.00 N ATOM 1633 CA VAL B 40 -1.321 7.222 -0.688 1.00 0.00 C ATOM 1634 C VAL B 40 -2.288 6.967 -1.846 1.00 0.00 C ATOM 1635 O VAL B 40 -3.167 7.785 -2.117 1.00 0.00 O ATOM 1636 CB VAL B 40 -2.017 7.261 0.674 1.00 0.00 C ATOM 1637 CG1 VAL B 40 -2.772 5.958 0.942 1.00 0.00 C ATOM 1638 CG2 VAL B 40 -1.015 7.556 1.792 1.00 0.00 C ATOM 0 H VAL B 40 -0.858 9.225 -0.284 1.00 0.00 H new ATOM 0 HA VAL B 40 -0.623 6.386 -0.656 1.00 0.00 H new ATOM 0 HB VAL B 40 -2.746 8.071 0.655 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -3.257 6.013 1.916 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -3.526 5.809 0.169 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -2.072 5.123 0.932 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -1.535 7.578 2.750 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -0.252 6.778 1.811 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -0.543 8.522 1.612 1.00 0.00 H new ATOM 1648 N ILE B 41 -2.094 5.831 -2.499 1.00 0.00 N ATOM 1649 CA ILE B 41 -2.938 5.459 -3.622 1.00 0.00 C ATOM 1650 C ILE B 41 -3.670 4.156 -3.294 1.00 0.00 C ATOM 1651 O ILE B 41 -3.169 3.334 -2.529 1.00 0.00 O ATOM 1652 CB ILE B 41 -2.117 5.395 -4.911 1.00 0.00 C ATOM 1653 CG1 ILE B 41 -0.902 6.322 -4.834 1.00 0.00 C ATOM 1654 CG2 ILE B 41 -2.989 5.695 -6.132 1.00 0.00 C ATOM 1655 CD1 ILE B 41 -1.333 7.788 -4.772 1.00 0.00 C ATOM 0 H ILE B 41 -1.364 5.155 -2.272 1.00 0.00 H new ATOM 0 HA ILE B 41 -3.700 6.219 -3.794 1.00 0.00 H new ATOM 0 HB ILE B 41 -1.740 4.379 -5.026 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -0.308 6.076 -3.954 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -0.264 6.164 -5.703 1.00 0.00 H new ATOM 0 HG21 ILE B 41 -2.381 5.643 -7.035 1.00 0.00 H new ATOM 0 HG22 ILE B 41 -3.793 4.962 -6.194 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -3.415 6.694 -6.038 1.00 0.00 H new ATOM 0 HD11 ILE B 41 -0.450 8.425 -4.718 1.00 0.00 H new ATOM 0 HD12 ILE B 41 -1.906 8.037 -5.665 1.00 0.00 H new ATOM 0 HD13 ILE B 41 -1.951 7.949 -3.888 1.00 0.00 H new ATOM 1667 N ALA B 42 -4.844 4.009 -3.889 1.00 0.00 N ATOM 1668 CA ALA B 42 -5.651 2.820 -3.670 1.00 0.00 C ATOM 1669 C ALA B 42 -6.204 2.330 -5.010 1.00 0.00 C ATOM 1670 O ALA B 42 -6.887 3.073 -5.712 1.00 0.00 O ATOM 1671 CB ALA B 42 -6.758 3.132 -2.662 1.00 0.00 C ATOM 0 H ALA B 42 -5.256 4.693 -4.523 1.00 0.00 H new ATOM 0 HA ALA B 42 -5.045 2.017 -3.250 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -7.363 2.240 -2.498 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -6.313 3.447 -1.718 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -7.389 3.932 -3.050 1.00 0.00 H new ATOM 1677 N THR B 43 -5.887 1.082 -5.324 1.00 0.00 N ATOM 1678 CA THR B 43 -6.344 0.484 -6.567 1.00 0.00 C ATOM 1679 C THR B 43 -7.830 0.135 -6.476 1.00 0.00 C ATOM 1680 O THR B 43 -8.307 -0.299 -5.429 1.00 0.00 O ATOM 1681 CB THR B 43 -5.453 -0.724 -6.866 1.00 0.00 C ATOM 1682 OG1 THR B 43 -4.201 -0.150 -7.233 1.00 0.00 O ATOM 1683 CG2 THR B 43 -5.897 -1.483 -8.118 1.00 0.00 C ATOM 0 H THR B 43 -5.319 0.469 -4.739 1.00 0.00 H new ATOM 0 HA THR B 43 -6.257 1.184 -7.398 1.00 0.00 H new ATOM 0 HB THR B 43 -5.459 -1.400 -6.011 1.00 0.00 H new ATOM 0 HG1 THR B 43 -3.563 -0.864 -7.442 1.00 0.00 H new ATOM 0 HG21 THR B 43 -5.232 -2.330 -8.285 1.00 0.00 H new ATOM 0 HG22 THR B 43 -6.917 -1.844 -7.982 1.00 0.00 H new ATOM 0 HG23 THR B 43 -5.859 -0.817 -8.980 1.00 0.00 H new ATOM 1691 N LEU B 44 -8.522 0.339 -7.588 1.00 0.00 N ATOM 1692 CA LEU B 44 -9.945 0.051 -7.647 1.00 0.00 C ATOM 1693 C LEU B 44 -10.153 -1.362 -8.197 1.00 0.00 C ATOM 1694 O LEU B 44 -9.310 -1.877 -8.930 1.00 0.00 O ATOM 1695 CB LEU B 44 -10.678 1.134 -8.441 1.00 0.00 C ATOM 1696 CG LEU B 44 -11.932 1.715 -7.784 1.00 0.00 C ATOM 1697 CD1 LEU B 44 -12.388 2.987 -8.502 1.00 0.00 C ATOM 1698 CD2 LEU B 44 -13.046 0.669 -7.709 1.00 0.00 C ATOM 0 H LEU B 44 -8.124 0.700 -8.455 1.00 0.00 H new ATOM 0 HA LEU B 44 -10.380 0.071 -6.648 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -9.981 1.950 -8.633 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -10.958 0.720 -9.409 1.00 0.00 H new ATOM 0 HG LEU B 44 -11.683 1.995 -6.760 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -13.281 3.379 -8.015 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -11.594 3.733 -8.460 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -12.614 2.756 -9.543 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -13.926 1.108 -7.238 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -13.301 0.336 -8.715 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -12.706 -0.183 -7.120 1.00 0.00 H new ATOM 1710 N LYS B 45 -11.281 -1.948 -7.822 1.00 0.00 N ATOM 1711 CA LYS B 45 -11.610 -3.291 -8.269 1.00 0.00 C ATOM 1712 C LYS B 45 -12.033 -3.245 -9.739 1.00 0.00 C ATOM 1713 O LYS B 45 -12.244 -4.286 -10.360 1.00 0.00 O ATOM 1714 CB LYS B 45 -12.656 -3.920 -7.347 1.00 0.00 C ATOM 1715 CG LYS B 45 -12.027 -4.994 -6.456 1.00 0.00 C ATOM 1716 CD LYS B 45 -11.707 -4.436 -5.068 1.00 0.00 C ATOM 1717 CE LYS B 45 -11.485 -5.566 -4.061 1.00 0.00 C ATOM 1718 NZ LYS B 45 -12.740 -5.868 -3.336 1.00 0.00 N ATOM 0 H LYS B 45 -11.978 -1.518 -7.214 1.00 0.00 H new ATOM 0 HA LYS B 45 -10.735 -3.938 -8.209 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -13.110 -3.148 -6.726 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -13.455 -4.360 -7.944 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -12.708 -5.840 -6.364 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -11.115 -5.369 -6.921 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -10.816 -3.810 -5.120 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -12.525 -3.799 -4.731 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -11.133 -6.458 -4.579 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -10.708 -5.282 -3.352 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -12.572 -6.637 -2.656 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -13.059 -5.019 -2.826 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -13.472 -6.160 -4.015 1.00 0.00 H new ATOM 1732 N ASN B 46 -12.144 -2.029 -10.252 1.00 0.00 N ATOM 1733 CA ASN B 46 -12.538 -1.835 -11.637 1.00 0.00 C ATOM 1734 C ASN B 46 -11.290 -1.608 -12.491 1.00 0.00 C ATOM 1735 O ASN B 46 -11.369 -1.583 -13.718 1.00 0.00 O ATOM 1736 CB ASN B 46 -13.442 -0.609 -11.786 1.00 0.00 C ATOM 1737 CG ASN B 46 -13.106 0.168 -13.060 1.00 0.00 C ATOM 1738 OD1 ASN B 46 -13.242 -0.320 -14.170 1.00 0.00 O ATOM 1739 ND2 ASN B 46 -12.661 1.402 -12.840 1.00 0.00 N ATOM 0 H ASN B 46 -11.968 -1.168 -9.734 1.00 0.00 H new ATOM 0 HA ASN B 46 -13.079 -2.724 -11.961 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -14.485 -0.923 -11.812 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -13.326 0.040 -10.918 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -12.410 2.001 -13.626 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -12.571 1.749 -11.885 1.00 0.00 H new ATOM 1746 N GLY B 47 -10.166 -1.448 -11.808 1.00 0.00 N ATOM 1747 CA GLY B 47 -8.902 -1.225 -12.489 1.00 0.00 C ATOM 1748 C GLY B 47 -8.410 0.209 -12.276 1.00 0.00 C ATOM 1749 O GLY B 47 -7.260 0.525 -12.576 1.00 0.00 O ATOM 0 H GLY B 47 -10.104 -1.468 -10.790 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -8.156 -1.928 -12.118 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -9.020 -1.418 -13.555 1.00 0.00 H new ATOM 1753 N GLN B 48 -9.306 1.037 -11.758 1.00 0.00 N ATOM 1754 CA GLN B 48 -8.977 2.428 -11.501 1.00 0.00 C ATOM 1755 C GLN B 48 -8.205 2.558 -10.187 1.00 0.00 C ATOM 1756 O GLN B 48 -7.795 1.556 -9.603 1.00 0.00 O ATOM 1757 CB GLN B 48 -10.238 3.295 -11.484 1.00 0.00 C ATOM 1758 CG GLN B 48 -10.489 3.926 -12.855 1.00 0.00 C ATOM 1759 CD GLN B 48 -11.480 5.087 -12.751 1.00 0.00 C ATOM 1760 OE1 GLN B 48 -12.522 4.994 -12.124 1.00 0.00 O ATOM 1761 NE2 GLN B 48 -11.098 6.184 -13.399 1.00 0.00 N ATOM 0 H GLN B 48 -10.259 0.771 -11.510 1.00 0.00 H new ATOM 0 HA GLN B 48 -8.340 2.785 -12.310 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -11.097 2.688 -11.196 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -10.135 4.078 -10.733 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -9.548 4.283 -13.273 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -10.877 3.173 -13.541 1.00 0.00 H new ATOM 0 HE21 GLN B 48 -10.212 6.195 -13.905 1.00 0.00 H new ATOM 0 HE22 GLN B 48 -11.691 7.014 -13.390 1.00 0.00 H new ATOM 1770 N LYS B 49 -8.030 3.800 -9.760 1.00 0.00 N ATOM 1771 CA LYS B 49 -7.314 4.073 -8.525 1.00 0.00 C ATOM 1772 C LYS B 49 -7.937 5.290 -7.838 1.00 0.00 C ATOM 1773 O LYS B 49 -8.370 6.229 -8.504 1.00 0.00 O ATOM 1774 CB LYS B 49 -5.816 4.219 -8.796 1.00 0.00 C ATOM 1775 CG LYS B 49 -5.272 3.002 -9.546 1.00 0.00 C ATOM 1776 CD LYS B 49 -3.755 3.097 -9.721 1.00 0.00 C ATOM 1777 CE LYS B 49 -3.135 1.710 -9.899 1.00 0.00 C ATOM 1778 NZ LYS B 49 -2.217 1.698 -11.060 1.00 0.00 N ATOM 0 H LYS B 49 -8.372 4.629 -10.247 1.00 0.00 H new ATOM 0 HA LYS B 49 -7.409 3.234 -7.835 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -5.635 5.121 -9.380 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -5.282 4.338 -7.853 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -5.522 2.092 -9.000 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -5.750 2.929 -10.523 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -3.524 3.716 -10.587 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -3.315 3.587 -8.852 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -2.593 1.429 -8.996 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -3.922 0.969 -10.042 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -1.805 0.749 -11.167 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -2.744 1.946 -11.922 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -1.456 2.391 -10.908 1.00 0.00 H new ATOM 1792 N ALA B 50 -7.963 5.233 -6.514 1.00 0.00 N ATOM 1793 CA ALA B 50 -8.525 6.319 -5.730 1.00 0.00 C ATOM 1794 C ALA B 50 -7.474 6.825 -4.740 1.00 0.00 C ATOM 1795 O ALA B 50 -7.169 6.153 -3.756 1.00 0.00 O ATOM 1796 CB ALA B 50 -9.800 5.839 -5.033 1.00 0.00 C ATOM 0 H ALA B 50 -7.604 4.452 -5.965 1.00 0.00 H new ATOM 0 HA ALA B 50 -8.800 7.155 -6.374 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -10.222 6.654 -4.445 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -10.525 5.518 -5.781 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -9.563 5.002 -4.376 1.00 0.00 H new ATOM 1802 N CYS B 51 -6.949 8.005 -5.035 1.00 0.00 N ATOM 1803 CA CYS B 51 -5.939 8.609 -4.183 1.00 0.00 C ATOM 1804 C CYS B 51 -6.564 8.876 -2.812 1.00 0.00 C ATOM 1805 O CYS B 51 -7.708 9.318 -2.723 1.00 0.00 O ATOM 1806 CB CYS B 51 -5.362 9.882 -4.805 1.00 0.00 C ATOM 1807 SG CYS B 51 -3.740 9.668 -5.626 1.00 0.00 S ATOM 0 H CYS B 51 -7.204 8.559 -5.852 1.00 0.00 H new ATOM 0 HA CYS B 51 -5.098 7.925 -4.071 1.00 0.00 H new ATOM 0 HB2 CYS B 51 -6.074 10.268 -5.534 1.00 0.00 H new ATOM 0 HB3 CYS B 51 -5.262 10.637 -4.026 1.00 0.00 H new ATOM 1812 N LEU B 52 -5.784 8.598 -1.778 1.00 0.00 N ATOM 1813 CA LEU B 52 -6.246 8.803 -0.416 1.00 0.00 C ATOM 1814 C LEU B 52 -5.498 9.987 0.200 1.00 0.00 C ATOM 1815 O LEU B 52 -4.487 10.435 -0.339 1.00 0.00 O ATOM 1816 CB LEU B 52 -6.122 7.510 0.393 1.00 0.00 C ATOM 1817 CG LEU B 52 -6.895 6.304 -0.147 1.00 0.00 C ATOM 1818 CD1 LEU B 52 -6.356 4.999 0.442 1.00 0.00 C ATOM 1819 CD2 LEU B 52 -8.398 6.465 0.093 1.00 0.00 C ATOM 0 H LEU B 52 -4.835 8.232 -1.856 1.00 0.00 H new ATOM 0 HA LEU B 52 -7.306 9.056 -0.409 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -5.067 7.243 0.454 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -6.460 7.707 1.410 1.00 0.00 H new ATOM 0 HG LEU B 52 -6.745 6.256 -1.225 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -6.922 4.158 0.042 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -5.305 4.887 0.177 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -6.456 5.021 1.527 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -8.924 5.595 -0.300 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -8.588 6.552 1.163 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -8.753 7.363 -0.413 1.00 0.00 H new ATOM 1831 N ASN B 53 -6.024 10.460 1.320 1.00 0.00 N ATOM 1832 CA ASN B 53 -5.419 11.584 2.014 1.00 0.00 C ATOM 1833 C ASN B 53 -4.522 11.060 3.138 1.00 0.00 C ATOM 1834 O ASN B 53 -5.013 10.529 4.133 1.00 0.00 O ATOM 1835 CB ASN B 53 -6.486 12.484 2.641 1.00 0.00 C ATOM 1836 CG ASN B 53 -5.981 13.922 2.773 1.00 0.00 C ATOM 1837 OD1 ASN B 53 -5.517 14.534 1.825 1.00 0.00 O ATOM 1838 ND2 ASN B 53 -6.097 14.426 3.999 1.00 0.00 N ATOM 0 H ASN B 53 -6.862 10.085 1.764 1.00 0.00 H new ATOM 0 HA ASN B 53 -4.844 12.159 1.288 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -7.388 12.466 2.029 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -6.760 12.099 3.623 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -5.788 15.379 4.190 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -6.495 13.859 4.748 1.00 0.00 H new ATOM 1845 N PRO B 54 -3.188 11.233 2.937 1.00 0.00 N ATOM 1846 CA PRO B 54 -2.218 10.783 3.921 1.00 0.00 C ATOM 1847 C PRO B 54 -2.192 11.719 5.131 1.00 0.00 C ATOM 1848 O PRO B 54 -1.122 12.114 5.592 1.00 0.00 O ATOM 1849 CB PRO B 54 -0.894 10.737 3.176 1.00 0.00 C ATOM 1850 CG PRO B 54 -1.081 11.601 1.940 1.00 0.00 C ATOM 1851 CD PRO B 54 -2.570 11.857 1.771 1.00 0.00 C ATOM 0 HA PRO B 54 -2.460 9.804 4.335 1.00 0.00 H new ATOM 0 HB2 PRO B 54 -0.083 11.115 3.798 1.00 0.00 H new ATOM 0 HB3 PRO B 54 -0.635 9.714 2.902 1.00 0.00 H new ATOM 0 HG2 PRO B 54 -0.542 12.542 2.047 1.00 0.00 H new ATOM 0 HG3 PRO B 54 -0.677 11.101 1.060 1.00 0.00 H new ATOM 0 HD2 PRO B 54 -2.786 12.925 1.732 1.00 0.00 H new ATOM 0 HD3 PRO B 54 -2.944 11.422 0.844 1.00 0.00 H new ATOM 1859 N ALA B 55 -3.382 12.048 5.611 1.00 0.00 N ATOM 1860 CA ALA B 55 -3.509 12.930 6.759 1.00 0.00 C ATOM 1861 C ALA B 55 -4.909 12.783 7.357 1.00 0.00 C ATOM 1862 O ALA B 55 -5.439 13.726 7.945 1.00 0.00 O ATOM 1863 CB ALA B 55 -3.204 14.368 6.334 1.00 0.00 C ATOM 0 H ALA B 55 -4.267 11.720 5.226 1.00 0.00 H new ATOM 0 HA ALA B 55 -2.790 12.659 7.533 1.00 0.00 H new ATOM 0 HB1 ALA B 55 -3.299 15.030 7.195 1.00 0.00 H new ATOM 0 HB2 ALA B 55 -2.188 14.424 5.944 1.00 0.00 H new ATOM 0 HB3 ALA B 55 -3.907 14.676 5.560 1.00 0.00 H new ATOM 1869 N SER B 56 -5.469 11.595 7.187 1.00 0.00 N ATOM 1870 CA SER B 56 -6.798 11.313 7.703 1.00 0.00 C ATOM 1871 C SER B 56 -6.771 10.040 8.551 1.00 0.00 C ATOM 1872 O SER B 56 -5.997 9.124 8.278 1.00 0.00 O ATOM 1873 CB SER B 56 -7.812 11.172 6.566 1.00 0.00 C ATOM 1874 OG SER B 56 -9.078 10.715 7.034 1.00 0.00 O ATOM 0 H SER B 56 -5.027 10.816 6.699 1.00 0.00 H new ATOM 0 HA SER B 56 -7.107 12.151 8.327 1.00 0.00 H new ATOM 0 HB2 SER B 56 -7.935 12.134 6.068 1.00 0.00 H new ATOM 0 HB3 SER B 56 -7.427 10.475 5.821 1.00 0.00 H new ATOM 0 HG SER B 56 -9.698 10.640 6.279 1.00 0.00 H new ATOM 1880 N PRO B 57 -7.648 10.023 9.591 1.00 0.00 N ATOM 1881 CA PRO B 57 -7.731 8.877 10.481 1.00 0.00 C ATOM 1882 C PRO B 57 -8.455 7.711 9.806 1.00 0.00 C ATOM 1883 O PRO B 57 -8.616 6.647 10.402 1.00 0.00 O ATOM 1884 CB PRO B 57 -8.454 9.390 11.716 1.00 0.00 C ATOM 1885 CG PRO B 57 -9.156 10.668 11.287 1.00 0.00 C ATOM 1886 CD PRO B 57 -8.579 11.090 9.945 1.00 0.00 C ATOM 0 HA PRO B 57 -6.752 8.478 10.746 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -9.171 8.655 12.083 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -7.752 9.583 12.527 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -10.231 10.504 11.206 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -9.008 11.452 12.029 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -9.361 11.198 9.194 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -8.071 12.052 10.017 1.00 0.00 H new ATOM 1894 N MET B 58 -8.873 7.950 8.572 1.00 0.00 N ATOM 1895 CA MET B 58 -9.577 6.932 7.810 1.00 0.00 C ATOM 1896 C MET B 58 -8.631 6.225 6.836 1.00 0.00 C ATOM 1897 O MET B 58 -8.926 5.127 6.365 1.00 0.00 O ATOM 1898 CB MET B 58 -10.723 7.579 7.030 1.00 0.00 C ATOM 1899 CG MET B 58 -12.033 6.821 7.252 1.00 0.00 C ATOM 1900 SD MET B 58 -13.053 7.696 8.427 1.00 0.00 S ATOM 1901 CE MET B 58 -11.960 7.705 9.839 1.00 0.00 C ATOM 0 H MET B 58 -8.738 8.834 8.081 1.00 0.00 H new ATOM 0 HA MET B 58 -9.972 6.192 8.506 1.00 0.00 H new ATOM 0 HB2 MET B 58 -10.841 8.616 7.344 1.00 0.00 H new ATOM 0 HB3 MET B 58 -10.482 7.593 5.967 1.00 0.00 H new ATOM 0 HG2 MET B 58 -12.565 6.712 6.307 1.00 0.00 H new ATOM 0 HG3 MET B 58 -11.824 5.816 7.617 1.00 0.00 H new ATOM 0 HE1 MET B 58 -12.530 7.934 10.739 1.00 0.00 H new ATOM 0 HE2 MET B 58 -11.494 6.725 9.944 1.00 0.00 H new ATOM 0 HE3 MET B 58 -11.188 8.461 9.697 1.00 0.00 H new ATOM 1911 N VAL B 59 -7.514 6.883 6.563 1.00 0.00 N ATOM 1912 CA VAL B 59 -6.524 6.332 5.654 1.00 0.00 C ATOM 1913 C VAL B 59 -5.748 5.221 6.365 1.00 0.00 C ATOM 1914 O VAL B 59 -5.127 4.380 5.716 1.00 0.00 O ATOM 1915 CB VAL B 59 -5.621 7.447 5.124 1.00 0.00 C ATOM 1916 CG1 VAL B 59 -4.274 6.889 4.660 1.00 0.00 C ATOM 1917 CG2 VAL B 59 -6.310 8.223 4.000 1.00 0.00 C ATOM 0 H VAL B 59 -7.273 7.793 6.956 1.00 0.00 H new ATOM 0 HA VAL B 59 -7.009 5.886 4.786 1.00 0.00 H new ATOM 0 HB VAL B 59 -5.431 8.141 5.943 1.00 0.00 H new ATOM 0 HG11 VAL B 59 -3.652 7.703 4.288 1.00 0.00 H new ATOM 0 HG12 VAL B 59 -3.773 6.403 5.498 1.00 0.00 H new ATOM 0 HG13 VAL B 59 -4.436 6.163 3.863 1.00 0.00 H new ATOM 0 HG21 VAL B 59 -5.646 9.010 3.641 1.00 0.00 H new ATOM 0 HG22 VAL B 59 -6.545 7.544 3.180 1.00 0.00 H new ATOM 0 HG23 VAL B 59 -7.231 8.669 4.377 1.00 0.00 H new ATOM 1927 N LYS B 60 -5.809 5.254 7.688 1.00 0.00 N ATOM 1928 CA LYS B 60 -5.120 4.260 8.494 1.00 0.00 C ATOM 1929 C LYS B 60 -6.094 3.136 8.852 1.00 0.00 C ATOM 1930 O LYS B 60 -5.742 2.217 9.589 1.00 0.00 O ATOM 1931 CB LYS B 60 -4.465 4.918 9.710 1.00 0.00 C ATOM 1932 CG LYS B 60 -3.516 6.040 9.283 1.00 0.00 C ATOM 1933 CD LYS B 60 -4.295 7.234 8.728 1.00 0.00 C ATOM 1934 CE LYS B 60 -3.554 8.545 8.999 1.00 0.00 C ATOM 1935 NZ LYS B 60 -4.029 9.158 10.260 1.00 0.00 N ATOM 0 H LYS B 60 -6.325 5.953 8.222 1.00 0.00 H new ATOM 0 HA LYS B 60 -4.306 3.808 7.928 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -5.235 5.319 10.369 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -3.915 4.170 10.281 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -2.915 6.357 10.135 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -2.825 5.669 8.526 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -4.442 7.110 7.655 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -5.285 7.271 9.183 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -2.482 8.358 9.060 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -3.710 9.236 8.170 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -4.573 10.018 10.045 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -4.636 8.483 10.767 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -3.213 9.404 10.855 1.00 0.00 H new ATOM 1949 N LYS B 61 -7.299 3.246 8.314 1.00 0.00 N ATOM 1950 CA LYS B 61 -8.326 2.250 8.568 1.00 0.00 C ATOM 1951 C LYS B 61 -8.709 1.571 7.251 1.00 0.00 C ATOM 1952 O LYS B 61 -9.335 0.512 7.253 1.00 0.00 O ATOM 1953 CB LYS B 61 -9.512 2.879 9.303 1.00 0.00 C ATOM 1954 CG LYS B 61 -9.096 3.381 10.687 1.00 0.00 C ATOM 1955 CD LYS B 61 -10.105 2.950 11.753 1.00 0.00 C ATOM 1956 CE LYS B 61 -9.718 3.500 13.127 1.00 0.00 C ATOM 1957 NZ LYS B 61 -8.588 2.731 13.694 1.00 0.00 N ATOM 0 H LYS B 61 -7.588 4.010 7.703 1.00 0.00 H new ATOM 0 HA LYS B 61 -7.946 1.472 9.230 1.00 0.00 H new ATOM 0 HB2 LYS B 61 -9.910 3.707 8.716 1.00 0.00 H new ATOM 0 HB3 LYS B 61 -10.312 2.146 9.404 1.00 0.00 H new ATOM 0 HG2 LYS B 61 -8.109 2.992 10.937 1.00 0.00 H new ATOM 0 HG3 LYS B 61 -9.017 4.468 10.675 1.00 0.00 H new ATOM 0 HD2 LYS B 61 -11.100 3.304 11.482 1.00 0.00 H new ATOM 0 HD3 LYS B 61 -10.155 1.862 11.793 1.00 0.00 H new ATOM 0 HE2 LYS B 61 -9.443 4.551 13.040 1.00 0.00 H new ATOM 0 HE3 LYS B 61 -10.574 3.449 13.800 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 -8.349 3.107 14.634 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 -8.857 1.730 13.779 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 -7.762 2.815 13.068 1.00 0.00 H new ATOM 1971 N ILE B 62 -8.317 2.209 6.157 1.00 0.00 N ATOM 1972 CA ILE B 62 -8.611 1.679 4.837 1.00 0.00 C ATOM 1973 C ILE B 62 -7.436 0.820 4.363 1.00 0.00 C ATOM 1974 O ILE B 62 -7.575 0.037 3.425 1.00 0.00 O ATOM 1975 CB ILE B 62 -8.971 2.812 3.874 1.00 0.00 C ATOM 1976 CG1 ILE B 62 -10.142 3.637 4.411 1.00 0.00 C ATOM 1977 CG2 ILE B 62 -9.249 2.271 2.470 1.00 0.00 C ATOM 1978 CD1 ILE B 62 -10.010 5.106 4.005 1.00 0.00 C ATOM 0 H ILE B 62 -7.799 3.087 6.158 1.00 0.00 H new ATOM 0 HA ILE B 62 -9.486 1.031 4.873 1.00 0.00 H new ATOM 0 HB ILE B 62 -8.113 3.480 3.798 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -11.080 3.234 4.030 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -10.179 3.558 5.498 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -9.502 3.097 1.805 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -8.362 1.762 2.094 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -10.081 1.568 2.509 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -10.855 5.670 4.400 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -9.083 5.513 4.408 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -9.998 5.183 2.918 1.00 0.00 H new ATOM 1990 N ILE B 63 -6.307 0.997 5.034 1.00 0.00 N ATOM 1991 CA ILE B 63 -5.110 0.248 4.693 1.00 0.00 C ATOM 1992 C ILE B 63 -5.025 -0.999 5.576 1.00 0.00 C ATOM 1993 O ILE B 63 -4.934 -2.117 5.071 1.00 0.00 O ATOM 1994 CB ILE B 63 -3.874 1.146 4.777 1.00 0.00 C ATOM 1995 CG1 ILE B 63 -3.800 2.090 3.576 1.00 0.00 C ATOM 1996 CG2 ILE B 63 -2.600 0.312 4.931 1.00 0.00 C ATOM 1997 CD1 ILE B 63 -3.086 3.392 3.945 1.00 0.00 C ATOM 0 H ILE B 63 -6.196 1.648 5.812 1.00 0.00 H new ATOM 0 HA ILE B 63 -5.157 -0.095 3.659 1.00 0.00 H new ATOM 0 HB ILE B 63 -3.962 1.767 5.669 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -3.272 1.601 2.757 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -4.806 2.311 3.220 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -1.736 0.974 4.988 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -2.662 -0.283 5.842 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -2.493 -0.350 4.072 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -3.047 4.045 3.073 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -3.630 3.890 4.748 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -2.072 3.169 4.277 1.00 0.00 H new ATOM 2009 N GLU B 64 -5.058 -0.765 6.880 1.00 0.00 N ATOM 2010 CA GLU B 64 -4.987 -1.855 7.838 1.00 0.00 C ATOM 2011 C GLU B 64 -6.068 -2.896 7.540 1.00 0.00 C ATOM 2012 O GLU B 64 -5.852 -4.092 7.729 1.00 0.00 O ATOM 2013 CB GLU B 64 -5.107 -1.334 9.272 1.00 0.00 C ATOM 2014 CG GLU B 64 -3.912 -0.452 9.637 1.00 0.00 C ATOM 2015 CD GLU B 64 -4.249 0.471 10.810 1.00 0.00 C ATOM 2016 OE1 GLU B 64 -5.244 0.167 11.503 1.00 0.00 O ATOM 2017 OE2 GLU B 64 -3.504 1.459 10.987 1.00 0.00 O ATOM 0 H GLU B 64 -5.133 0.164 7.295 1.00 0.00 H new ATOM 0 HA GLU B 64 -4.013 -2.334 7.741 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -6.030 -0.764 9.380 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -5.168 -2.174 9.964 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -3.059 -1.079 9.896 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -3.618 0.144 8.773 1.00 0.00 H new ATOM 2024 N LYS B 65 -7.208 -2.402 7.080 1.00 0.00 N ATOM 2025 CA LYS B 65 -8.324 -3.274 6.754 1.00 0.00 C ATOM 2026 C LYS B 65 -8.010 -4.037 5.465 1.00 0.00 C ATOM 2027 O LYS B 65 -8.391 -5.197 5.318 1.00 0.00 O ATOM 2028 CB LYS B 65 -9.628 -2.477 6.694 1.00 0.00 C ATOM 2029 CG LYS B 65 -10.167 -2.201 8.099 1.00 0.00 C ATOM 2030 CD LYS B 65 -11.379 -1.268 8.048 1.00 0.00 C ATOM 2031 CE LYS B 65 -12.685 -2.063 8.114 1.00 0.00 C ATOM 2032 NZ LYS B 65 -13.700 -1.466 7.217 1.00 0.00 N ATOM 0 H LYS B 65 -7.383 -1.409 6.925 1.00 0.00 H new ATOM 0 HA LYS B 65 -8.468 -4.017 7.538 1.00 0.00 H new ATOM 0 HB2 LYS B 65 -9.459 -1.534 6.174 1.00 0.00 H new ATOM 0 HB3 LYS B 65 -10.370 -3.030 6.118 1.00 0.00 H new ATOM 0 HG2 LYS B 65 -10.447 -3.140 8.576 1.00 0.00 H new ATOM 0 HG3 LYS B 65 -9.384 -1.753 8.711 1.00 0.00 H new ATOM 0 HD2 LYS B 65 -11.335 -0.563 8.879 1.00 0.00 H new ATOM 0 HD3 LYS B 65 -11.352 -0.681 7.130 1.00 0.00 H new ATOM 0 HE2 LYS B 65 -12.502 -3.099 7.828 1.00 0.00 H new ATOM 0 HE3 LYS B 65 -13.058 -2.076 9.138 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 -14.580 -2.017 7.273 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 -13.886 -0.485 7.508 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 -13.347 -1.476 6.239 1.00 0.00 H new ATOM 2046 N MET B 66 -7.317 -3.355 4.565 1.00 0.00 N ATOM 2047 CA MET B 66 -6.948 -3.953 3.294 1.00 0.00 C ATOM 2048 C MET B 66 -6.022 -5.154 3.502 1.00 0.00 C ATOM 2049 O MET B 66 -6.140 -6.161 2.806 1.00 0.00 O ATOM 2050 CB MET B 66 -6.244 -2.910 2.423 1.00 0.00 C ATOM 2051 CG MET B 66 -7.073 -2.586 1.179 1.00 0.00 C ATOM 2052 SD MET B 66 -7.426 -4.083 0.273 1.00 0.00 S ATOM 2053 CE MET B 66 -5.824 -4.392 -0.452 1.00 0.00 C ATOM 0 H MET B 66 -7.001 -2.393 4.691 1.00 0.00 H new ATOM 0 HA MET B 66 -7.856 -4.299 2.799 1.00 0.00 H new ATOM 0 HB2 MET B 66 -6.078 -2.001 3.001 1.00 0.00 H new ATOM 0 HB3 MET B 66 -5.264 -3.282 2.125 1.00 0.00 H new ATOM 0 HG2 MET B 66 -8.004 -2.099 1.469 1.00 0.00 H new ATOM 0 HG3 MET B 66 -6.531 -1.886 0.543 1.00 0.00 H new ATOM 0 HE1 MET B 66 -5.951 -4.809 -1.451 1.00 0.00 H new ATOM 0 HE2 MET B 66 -5.268 -3.457 -0.517 1.00 0.00 H new ATOM 0 HE3 MET B 66 -5.274 -5.099 0.169 1.00 0.00 H new ATOM 2063 N LEU B 67 -5.121 -5.006 4.462 1.00 0.00 N ATOM 2064 CA LEU B 67 -4.176 -6.066 4.770 1.00 0.00 C ATOM 2065 C LEU B 67 -4.916 -7.226 5.438 1.00 0.00 C ATOM 2066 O LEU B 67 -4.388 -8.333 5.530 1.00 0.00 O ATOM 2067 CB LEU B 67 -3.012 -5.520 5.600 1.00 0.00 C ATOM 2068 CG LEU B 67 -1.937 -4.754 4.827 1.00 0.00 C ATOM 2069 CD1 LEU B 67 -2.544 -3.569 4.074 1.00 0.00 C ATOM 2070 CD2 LEU B 67 -0.797 -4.323 5.752 1.00 0.00 C ATOM 0 H LEU B 67 -5.025 -4.169 5.036 1.00 0.00 H new ATOM 0 HA LEU B 67 -3.731 -6.457 3.855 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -3.417 -4.862 6.368 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -2.536 -6.355 6.114 1.00 0.00 H new ATOM 0 HG LEU B 67 -1.509 -5.425 4.082 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -1.759 -3.041 3.533 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -3.291 -3.931 3.368 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -3.015 -2.889 4.784 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -0.047 -3.781 5.177 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -1.190 -3.676 6.537 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -0.341 -5.205 6.203 1.00 0.00 H new ATOM 2082 N LYS B 68 -6.128 -6.933 5.886 1.00 0.00 N ATOM 2083 CA LYS B 68 -6.947 -7.938 6.542 1.00 0.00 C ATOM 2084 C LYS B 68 -8.011 -8.441 5.564 1.00 0.00 C ATOM 2085 O LYS B 68 -8.476 -9.574 5.676 1.00 0.00 O ATOM 2086 CB LYS B 68 -7.523 -7.391 7.849 1.00 0.00 C ATOM 2087 CG LYS B 68 -6.730 -7.902 9.054 1.00 0.00 C ATOM 2088 CD LYS B 68 -7.491 -9.014 9.779 1.00 0.00 C ATOM 2089 CE LYS B 68 -6.832 -10.374 9.542 1.00 0.00 C ATOM 2090 NZ LYS B 68 -7.738 -11.469 9.954 1.00 0.00 N ATOM 0 H LYS B 68 -6.563 -6.014 5.808 1.00 0.00 H new ATOM 0 HA LYS B 68 -6.340 -8.798 6.824 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -7.503 -6.301 7.832 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -8.567 -7.689 7.943 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -5.760 -8.275 8.724 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -6.537 -7.079 9.743 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -7.521 -8.802 10.848 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -8.523 -9.040 9.430 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -6.577 -10.482 8.488 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -5.900 -10.435 10.103 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -7.275 -12.385 9.786 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -7.960 -11.374 10.965 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -8.617 -11.419 9.400 1.00 0.00 H new ATOM 2104 N ASN B 69 -8.366 -7.573 4.628 1.00 0.00 N ATOM 2105 CA ASN B 69 -9.366 -7.915 3.631 1.00 0.00 C ATOM 2106 C ASN B 69 -10.698 -8.201 4.329 1.00 0.00 C ATOM 2107 O ASN B 69 -11.593 -7.357 4.334 1.00 0.00 O ATOM 2108 CB ASN B 69 -8.962 -9.168 2.852 1.00 0.00 C ATOM 2109 CG ASN B 69 -10.112 -9.660 1.970 1.00 0.00 C ATOM 2110 OD1 ASN B 69 -10.457 -10.830 1.951 1.00 0.00 O ATOM 2111 ND2 ASN B 69 -10.683 -8.704 1.244 1.00 0.00 N ATOM 0 H ASN B 69 -7.979 -6.633 4.539 1.00 0.00 H new ATOM 0 HA ASN B 69 -9.456 -7.076 2.941 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -8.091 -8.951 2.233 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -8.670 -9.955 3.548 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -11.460 -8.930 0.623 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -10.344 -7.744 1.308 1.00 0.00 H new ATOM 2118 N GLY B 70 -10.786 -9.393 4.900 1.00 0.00 N ATOM 2119 CA GLY B 70 -11.993 -9.800 5.599 1.00 0.00 C ATOM 2120 C GLY B 70 -13.242 -9.437 4.793 1.00 0.00 C ATOM 2121 O GLY B 70 -13.494 -10.016 3.737 1.00 0.00 O ATOM 0 H GLY B 70 -10.041 -10.090 4.893 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -11.970 -10.875 5.776 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -12.033 -9.317 6.575 1.00 0.00 H new ATOM 2125 N LYS B 71 -13.992 -8.482 5.322 1.00 0.00 N ATOM 2126 CA LYS B 71 -15.208 -8.035 4.665 1.00 0.00 C ATOM 2127 C LYS B 71 -15.420 -6.547 4.951 1.00 0.00 C ATOM 2128 O LYS B 71 -15.428 -5.729 4.032 1.00 0.00 O ATOM 2129 CB LYS B 71 -16.392 -8.914 5.074 1.00 0.00 C ATOM 2130 CG LYS B 71 -17.240 -9.292 3.858 1.00 0.00 C ATOM 2131 CD LYS B 71 -18.088 -10.533 4.145 1.00 0.00 C ATOM 2132 CE LYS B 71 -18.763 -11.043 2.870 1.00 0.00 C ATOM 2133 NZ LYS B 71 -19.830 -10.111 2.442 1.00 0.00 N ATOM 0 H LYS B 71 -13.781 -8.005 6.199 1.00 0.00 H new ATOM 0 HA LYS B 71 -15.118 -8.143 3.584 1.00 0.00 H new ATOM 0 HB2 LYS B 71 -16.027 -9.818 5.562 1.00 0.00 H new ATOM 0 HB3 LYS B 71 -17.008 -8.385 5.801 1.00 0.00 H new ATOM 0 HG2 LYS B 71 -17.889 -8.458 3.589 1.00 0.00 H new ATOM 0 HG3 LYS B 71 -16.592 -9.480 3.002 1.00 0.00 H new ATOM 0 HD2 LYS B 71 -17.460 -11.317 4.567 1.00 0.00 H new ATOM 0 HD3 LYS B 71 -18.846 -10.295 4.892 1.00 0.00 H new ATOM 0 HE2 LYS B 71 -18.023 -11.148 2.076 1.00 0.00 H new ATOM 0 HE3 LYS B 71 -19.185 -12.033 3.045 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 -20.278 -10.471 1.576 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 -20.544 -10.032 3.194 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 -19.418 -9.174 2.255 1.00 0.00 H new ATOM 2147 N SER B 72 -15.587 -6.240 6.230 1.00 0.00 N ATOM 2148 CA SER B 72 -15.799 -4.865 6.648 1.00 0.00 C ATOM 2149 C SER B 72 -15.938 -4.797 8.170 1.00 0.00 C ATOM 2150 O SER B 72 -17.039 -4.623 8.689 1.00 0.00 O ATOM 2151 CB SER B 72 -17.037 -4.269 5.975 1.00 0.00 C ATOM 2152 OG SER B 72 -17.374 -2.993 6.512 1.00 0.00 O ATOM 0 H SER B 72 -15.580 -6.920 6.990 1.00 0.00 H new ATOM 0 HA SER B 72 -14.934 -4.277 6.341 1.00 0.00 H new ATOM 0 HB2 SER B 72 -16.858 -4.176 4.904 1.00 0.00 H new ATOM 0 HB3 SER B 72 -17.880 -4.949 6.099 1.00 0.00 H new ATOM 0 HG SER B 72 -18.168 -2.645 6.055 1.00 0.00 H new ATOM 2158 N ASN B 73 -14.805 -4.937 8.843 1.00 0.00 N ATOM 2159 CA ASN B 73 -14.786 -4.893 10.295 1.00 0.00 C ATOM 2160 C ASN B 73 -15.587 -6.074 10.847 1.00 0.00 C ATOM 2161 O ASN B 73 -15.374 -6.496 11.982 1.00 0.00 O ATOM 2162 CB ASN B 73 -15.425 -3.604 10.815 1.00 0.00 C ATOM 2163 CG ASN B 73 -14.792 -3.174 12.141 1.00 0.00 C ATOM 2164 OD1 ASN B 73 -13.659 -2.727 12.201 1.00 0.00 O ATOM 2165 ND2 ASN B 73 -15.586 -3.335 13.196 1.00 0.00 N ATOM 0 H ASN B 73 -13.893 -5.081 8.409 1.00 0.00 H new ATOM 0 HA ASN B 73 -13.747 -4.937 10.620 1.00 0.00 H new ATOM 0 HB2 ASN B 73 -15.305 -2.811 10.077 1.00 0.00 H new ATOM 0 HB3 ASN B 73 -16.496 -3.754 10.951 1.00 0.00 H new ATOM 0 HD21 ASN B 73 -15.256 -3.078 14.126 1.00 0.00 H new ATOM 0 HD22 ASN B 73 -16.525 -3.715 13.075 1.00 0.00 H new TER 2172 ASN B 73