USER MOD reduce.3.24.130724 H: found=0, std=0, add=1696, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1692 hydrogens (26 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 18 THR OG1 : rot -14:sc= 0.119 USER MOD Set 2.2: A 19 THR OG1 : rot 87:sc= 1.21 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 178:sc= -0.0277 (180deg=-0.0355) USER MOD Single : A 7 THR OG1 : rot -91:sc= 0.0324 USER MOD Single : A 12 SER OG : rot 63:sc= 0.0738 USER MOD Single : A 15 THR OG1 : rot 86:sc= 1.31 USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.0121 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot -130:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0204) USER MOD Single : A 43 THR OG1 : rot 75:sc= 0.16 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 GLN : amide:sc= -0.217 K(o=-0.22,f=-3.1!) USER MOD Single : A 48 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 51 LYS NZ :NH3+ 169:sc= 0.287 (180deg=0.24) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 171:sc= 0.385 (180deg=0.365) USER MOD Single : A 60 MET CE :methyl 163:sc= 0 (180deg=-0.0911) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc=-0.00515 X(o=-0.0051,f=0) USER MOD Single : A 67 GLN : amide:sc= -0.0445 K(o=-0.045,f=-0.97) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -138:sc= -0.139 (180deg=-1.57!) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0.22) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 171:sc= 0.0244 (180deg=0.0162) USER MOD Single : A 90 LYS NZ :NH3+ -178:sc= 0.432 (180deg=0.404) USER MOD Single : A 91 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00458) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 165:sc= -0.0626 (180deg=-0.407) USER MOD Single : A 98 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000151) USER MOD Single : A 99 ANW OAV : rot 101:sc= 1.54! USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 175:sc= -0.102 (180deg=-0.117) USER MOD Single : B 7 THR OG1 : rot 108:sc= 0.431 USER MOD Single : B 12 SER OG : rot 67:sc= 0.945 USER MOD Single : B 15 THR OG1 : rot 70:sc= 0.653 USER MOD Single : B 18 THR OG1 : rot -127:sc= 0.165 USER MOD Single : B 19 THR OG1 : rot 70:sc= 1.2 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 30 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0235) USER MOD Single : B 32 SER OG : rot -110:sc=-0.00452 USER MOD Single : B 34 SER OG : rot -170:sc= 0 USER MOD Single : B 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 THR OG1 : rot 73:sc= 0.0723 USER MOD Single : B 44 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : B 45 GLN : amide:sc= -0.0417 K(o=-0.042,f=-2.7!) USER MOD Single : B 48 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 51 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0179) USER MOD Single : B 55 SER OG : rot -11:sc= 0.615 USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0319) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= -0.234 X(o=-0.23,f=0) USER MOD Single : B 67 GLN : amide:sc= -0.0993 X(o=-0.099,f=0) USER MOD Single : B 69 SER OG : rot -49:sc= 0.321 USER MOD Single : B 74 ASN : amide:sc= -0.0228 X(o=-0.023,f=0.07!) USER MOD Single : B 76 TYR OH : rot 180:sc= -0.0786 USER MOD Single : B 85 LYS NZ :NH3+ 143:sc= -0.16 (180deg=-1.4!) USER MOD Single : B 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 90 LYS NZ :NH3+ -175:sc= 0.0174 (180deg=0.00749) USER MOD Single : B 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 98 LYS NZ :NH3+ 168:sc= -0.0197 (180deg=-0.171) USER MOD Single : B 99 ANW OAV : rot 179:sc= 0.583! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.072 18.044 8.157 1.00 1.04 N ATOM 2 CA MET A 1 6.626 16.917 7.346 1.00 0.91 C ATOM 3 C MET A 1 7.124 15.762 8.245 1.00 0.73 C ATOM 4 O MET A 1 8.331 15.505 8.345 1.00 0.96 O ATOM 5 CB MET A 1 7.737 17.412 6.375 1.00 1.31 C ATOM 6 CG MET A 1 8.864 18.217 7.029 1.00 1.57 C ATOM 7 SD MET A 1 10.086 18.824 5.845 1.00 2.18 S ATOM 8 CE MET A 1 11.238 19.656 6.940 1.00 2.71 C ATOM 0 H1 MET A 1 5.778 18.815 7.524 1.00 1.04 H new ATOM 0 H2 MET A 1 5.250 17.710 8.700 1.00 1.04 H new ATOM 0 H3 MET A 1 6.801 18.392 8.812 1.00 1.04 H new ATOM 0 HA MET A 1 5.814 16.521 6.736 1.00 0.91 H new ATOM 0 HB2 MET A 1 8.173 16.547 5.876 1.00 1.31 H new ATOM 0 HB3 MET A 1 7.275 18.026 5.602 1.00 1.31 H new ATOM 0 HG2 MET A 1 8.434 19.064 7.563 1.00 1.57 H new ATOM 0 HG3 MET A 1 9.364 17.593 7.770 1.00 1.57 H new ATOM 0 HE1 MET A 1 12.052 20.084 6.355 1.00 2.71 H new ATOM 0 HE2 MET A 1 10.720 20.451 7.477 1.00 2.71 H new ATOM 0 HE3 MET A 1 11.643 18.939 7.655 1.00 2.71 H new ATOM 20 N ALA A 2 6.173 15.074 8.913 1.00 0.77 N ATOM 21 CA ALA A 2 6.494 13.942 9.806 1.00 0.71 C ATOM 22 C ALA A 2 5.337 12.927 9.886 1.00 0.59 C ATOM 23 O ALA A 2 4.234 13.193 9.396 1.00 0.68 O ATOM 24 CB ALA A 2 6.864 14.453 11.201 1.00 1.02 C ATOM 0 H ALA A 2 5.177 15.284 8.850 1.00 0.77 H new ATOM 0 HA ALA A 2 7.352 13.420 9.382 1.00 0.71 H new ATOM 0 HB1 ALA A 2 7.098 13.608 11.848 1.00 1.02 H new ATOM 0 HB2 ALA A 2 7.733 15.107 11.130 1.00 1.02 H new ATOM 0 HB3 ALA A 2 6.025 15.009 11.619 1.00 1.02 H new ATOM 30 N ALA A 3 5.603 11.762 10.508 1.00 0.56 N ATOM 31 CA ALA A 3 4.605 10.694 10.663 1.00 0.54 C ATOM 32 C ALA A 3 3.937 10.757 12.052 1.00 0.55 C ATOM 33 O ALA A 3 4.507 10.277 13.040 1.00 0.70 O ATOM 34 CB ALA A 3 5.262 9.335 10.424 1.00 0.66 C ATOM 0 H ALA A 3 6.512 11.539 10.914 1.00 0.56 H new ATOM 0 HA ALA A 3 3.819 10.836 9.921 1.00 0.54 H new ATOM 0 HB1 ALA A 3 4.519 8.546 10.540 1.00 0.66 H new ATOM 0 HB2 ALA A 3 5.672 9.302 9.415 1.00 0.66 H new ATOM 0 HB3 ALA A 3 6.064 9.187 11.147 1.00 0.66 H new ATOM 40 N GLU A 4 2.730 11.368 12.117 1.00 0.52 N ATOM 41 CA GLU A 4 1.972 11.516 13.380 1.00 0.55 C ATOM 42 C GLU A 4 0.663 10.680 13.333 1.00 0.52 C ATOM 43 O GLU A 4 -0.065 10.746 12.336 1.00 0.50 O ATOM 44 CB GLU A 4 1.658 13.009 13.634 1.00 0.61 C ATOM 45 CG GLU A 4 1.230 13.335 15.066 1.00 0.74 C ATOM 46 CD GLU A 4 0.850 14.798 15.252 1.00 0.86 C ATOM 47 OE1 GLU A 4 -0.315 15.150 14.974 1.00 0.94 O ATOM 48 OE2 GLU A 4 1.722 15.592 15.670 1.00 1.02 O ATOM 0 H GLU A 4 2.260 11.768 11.305 1.00 0.52 H new ATOM 0 HA GLU A 4 2.582 11.142 14.202 1.00 0.55 H new ATOM 0 HB2 GLU A 4 2.541 13.599 13.389 1.00 0.61 H new ATOM 0 HB3 GLU A 4 0.867 13.321 12.952 1.00 0.61 H new ATOM 0 HG2 GLU A 4 0.382 12.707 15.338 1.00 0.74 H new ATOM 0 HG3 GLU A 4 2.043 13.086 15.748 1.00 0.74 H new ATOM 55 N PRO A 5 0.337 9.887 14.410 1.00 0.57 N ATOM 56 CA PRO A 5 -0.881 9.037 14.449 1.00 0.59 C ATOM 57 C PRO A 5 -2.181 9.809 14.777 1.00 0.53 C ATOM 58 O PRO A 5 -2.149 10.786 15.533 1.00 0.59 O ATOM 59 CB PRO A 5 -0.548 8.035 15.565 1.00 0.74 C ATOM 60 CG PRO A 5 0.327 8.789 16.505 1.00 0.73 C ATOM 61 CD PRO A 5 1.128 9.748 15.663 1.00 0.67 C ATOM 0 HA PRO A 5 -1.090 8.591 13.477 1.00 0.59 H new ATOM 0 HB2 PRO A 5 -1.451 7.682 16.062 1.00 0.74 H new ATOM 0 HB3 PRO A 5 -0.039 7.157 15.169 1.00 0.74 H new ATOM 0 HG2 PRO A 5 -0.268 9.325 17.244 1.00 0.73 H new ATOM 0 HG3 PRO A 5 0.983 8.112 17.053 1.00 0.73 H new ATOM 0 HD2 PRO A 5 1.252 10.708 16.163 1.00 0.67 H new ATOM 0 HD3 PRO A 5 2.127 9.362 15.462 1.00 0.67 H new ATOM 69 N LEU A 6 -3.319 9.349 14.202 1.00 0.58 N ATOM 70 CA LEU A 6 -4.641 9.976 14.425 1.00 0.67 C ATOM 71 C LEU A 6 -5.743 8.903 14.597 1.00 0.71 C ATOM 72 O LEU A 6 -6.270 8.735 15.699 1.00 1.19 O ATOM 73 CB LEU A 6 -4.994 10.940 13.262 1.00 0.84 C ATOM 74 CG LEU A 6 -4.116 12.208 13.132 1.00 0.91 C ATOM 75 CD1 LEU A 6 -4.467 12.982 11.857 1.00 1.14 C ATOM 76 CD2 LEU A 6 -4.248 13.109 14.368 1.00 1.03 C ATOM 0 H LEU A 6 -3.345 8.542 13.578 1.00 0.58 H new ATOM 0 HA LEU A 6 -4.587 10.555 15.347 1.00 0.67 H new ATOM 0 HB2 LEU A 6 -4.933 10.384 12.326 1.00 0.84 H new ATOM 0 HB3 LEU A 6 -6.031 11.253 13.380 1.00 0.84 H new ATOM 0 HG LEU A 6 -3.077 11.887 13.065 1.00 0.91 H new ATOM 0 HD11 LEU A 6 -3.838 13.869 11.785 1.00 1.14 H new ATOM 0 HD12 LEU A 6 -4.298 12.347 10.988 1.00 1.14 H new ATOM 0 HD13 LEU A 6 -5.515 13.281 11.890 1.00 1.14 H new ATOM 0 HD21 LEU A 6 -3.619 13.990 14.245 1.00 1.03 H new ATOM 0 HD22 LEU A 6 -5.287 13.418 14.484 1.00 1.03 H new ATOM 0 HD23 LEU A 6 -3.932 12.559 15.255 1.00 1.03 H new ATOM 88 N THR A 7 -6.079 8.184 13.503 1.00 0.52 N ATOM 89 CA THR A 7 -7.113 7.125 13.518 1.00 0.52 C ATOM 90 C THR A 7 -6.465 5.730 13.429 1.00 0.49 C ATOM 91 O THR A 7 -5.247 5.623 13.256 1.00 0.56 O ATOM 92 CB THR A 7 -8.132 7.310 12.354 1.00 0.58 C ATOM 93 OG1 THR A 7 -7.434 7.442 11.108 1.00 0.98 O ATOM 94 CG2 THR A 7 -9.019 8.536 12.567 1.00 0.94 C ATOM 0 H THR A 7 -5.644 8.320 12.590 1.00 0.52 H new ATOM 0 HA THR A 7 -7.652 7.207 14.462 1.00 0.52 H new ATOM 0 HB THR A 7 -8.770 6.427 12.334 1.00 0.58 H new ATOM 0 HG1 THR A 7 -7.263 8.390 10.927 1.00 0.98 H new ATOM 0 HG21 THR A 7 -9.716 8.630 11.734 1.00 0.94 H new ATOM 0 HG22 THR A 7 -9.578 8.424 13.496 1.00 0.94 H new ATOM 0 HG23 THR A 7 -8.397 9.430 12.623 1.00 0.94 H new ATOM 102 N GLU A 8 -7.286 4.660 13.548 1.00 0.51 N ATOM 103 CA GLU A 8 -6.791 3.264 13.494 1.00 0.50 C ATOM 104 C GLU A 8 -6.083 2.939 12.156 1.00 0.46 C ATOM 105 O GLU A 8 -5.005 2.336 12.164 1.00 0.48 O ATOM 106 CB GLU A 8 -7.950 2.271 13.737 1.00 0.55 C ATOM 107 CG GLU A 8 -7.504 0.831 14.010 1.00 0.91 C ATOM 108 CD GLU A 8 -8.668 -0.144 14.104 1.00 0.95 C ATOM 109 OE1 GLU A 8 -9.266 -0.252 15.197 1.00 1.14 O ATOM 110 OE2 GLU A 8 -8.979 -0.801 13.087 1.00 1.42 O ATOM 0 H GLU A 8 -8.294 4.737 13.682 1.00 0.51 H new ATOM 0 HA GLU A 8 -6.050 3.158 14.287 1.00 0.50 H new ATOM 0 HB2 GLU A 8 -8.541 2.622 14.583 1.00 0.55 H new ATOM 0 HB3 GLU A 8 -8.605 2.276 12.866 1.00 0.55 H new ATOM 0 HG2 GLU A 8 -6.830 0.508 13.216 1.00 0.91 H new ATOM 0 HG3 GLU A 8 -6.937 0.802 14.941 1.00 0.91 H new ATOM 117 N LEU A 9 -6.693 3.341 11.020 1.00 0.45 N ATOM 118 CA LEU A 9 -6.117 3.082 9.680 1.00 0.44 C ATOM 119 C LEU A 9 -4.919 4.001 9.392 1.00 0.42 C ATOM 120 O LEU A 9 -3.932 3.552 8.799 1.00 0.43 O ATOM 121 CB LEU A 9 -7.189 3.226 8.580 1.00 0.48 C ATOM 122 CG LEU A 9 -8.405 2.274 8.694 1.00 0.56 C ATOM 123 CD1 LEU A 9 -9.433 2.588 7.608 1.00 0.65 C ATOM 124 CD2 LEU A 9 -7.977 0.800 8.628 1.00 0.65 C ATOM 0 H LEU A 9 -7.580 3.844 11.002 1.00 0.45 H new ATOM 0 HA LEU A 9 -5.756 2.054 9.675 1.00 0.44 H new ATOM 0 HB2 LEU A 9 -7.554 4.253 8.587 1.00 0.48 H new ATOM 0 HB3 LEU A 9 -6.714 3.063 7.613 1.00 0.48 H new ATOM 0 HG LEU A 9 -8.866 2.438 9.668 1.00 0.56 H new ATOM 0 HD11 LEU A 9 -10.281 1.910 7.703 1.00 0.65 H new ATOM 0 HD12 LEU A 9 -9.777 3.616 7.719 1.00 0.65 H new ATOM 0 HD13 LEU A 9 -8.976 2.462 6.627 1.00 0.65 H new ATOM 0 HD21 LEU A 9 -8.857 0.162 8.711 1.00 0.65 H new ATOM 0 HD22 LEU A 9 -7.478 0.608 7.678 1.00 0.65 H new ATOM 0 HD23 LEU A 9 -7.292 0.583 9.448 1.00 0.65 H new ATOM 136 N GLU A 10 -5.006 5.290 9.802 1.00 0.42 N ATOM 137 CA GLU A 10 -3.889 6.246 9.613 1.00 0.44 C ATOM 138 C GLU A 10 -2.669 5.815 10.446 1.00 0.44 C ATOM 139 O GLU A 10 -1.534 6.015 10.017 1.00 0.48 O ATOM 140 CB GLU A 10 -4.291 7.682 9.999 1.00 0.49 C ATOM 141 CG GLU A 10 -5.255 8.349 9.023 1.00 0.54 C ATOM 142 CD GLU A 10 -5.495 9.819 9.339 1.00 0.63 C ATOM 143 OE1 GLU A 10 -4.613 10.647 9.020 1.00 1.03 O ATOM 144 OE2 GLU A 10 -6.562 10.142 9.904 1.00 0.96 O ATOM 0 H GLU A 10 -5.827 5.687 10.260 1.00 0.42 H new ATOM 0 HA GLU A 10 -3.633 6.238 8.553 1.00 0.44 H new ATOM 0 HB2 GLU A 10 -4.748 7.665 10.988 1.00 0.49 H new ATOM 0 HB3 GLU A 10 -3.390 8.291 10.075 1.00 0.49 H new ATOM 0 HG2 GLU A 10 -4.859 8.260 8.011 1.00 0.54 H new ATOM 0 HG3 GLU A 10 -6.207 7.819 9.041 1.00 0.54 H new ATOM 151 N GLU A 11 -2.922 5.219 11.636 1.00 0.44 N ATOM 152 CA GLU A 11 -1.854 4.735 12.530 1.00 0.46 C ATOM 153 C GLU A 11 -1.112 3.528 11.912 1.00 0.45 C ATOM 154 O GLU A 11 0.081 3.358 12.161 1.00 0.47 O ATOM 155 CB GLU A 11 -2.423 4.360 13.922 1.00 0.52 C ATOM 156 CG GLU A 11 -1.363 4.176 15.015 1.00 0.61 C ATOM 157 CD GLU A 11 -1.958 3.843 16.372 1.00 0.69 C ATOM 158 OE1 GLU A 11 -2.497 4.758 17.028 1.00 0.79 O ATOM 159 OE2 GLU A 11 -1.884 2.665 16.780 1.00 0.81 O ATOM 0 H GLU A 11 -3.864 5.063 11.996 1.00 0.44 H new ATOM 0 HA GLU A 11 -1.139 5.548 12.656 1.00 0.46 H new ATOM 0 HB2 GLU A 11 -3.120 5.137 14.237 1.00 0.52 H new ATOM 0 HB3 GLU A 11 -2.995 3.437 13.830 1.00 0.52 H new ATOM 0 HG2 GLU A 11 -0.679 3.380 14.719 1.00 0.61 H new ATOM 0 HG3 GLU A 11 -0.773 5.089 15.098 1.00 0.61 H new ATOM 166 N SER A 12 -1.818 2.696 11.106 1.00 0.45 N ATOM 167 CA SER A 12 -1.196 1.517 10.457 1.00 0.47 C ATOM 168 C SER A 12 -0.092 1.944 9.471 1.00 0.44 C ATOM 169 O SER A 12 1.061 1.539 9.629 1.00 0.49 O ATOM 170 CB SER A 12 -2.252 0.657 9.736 1.00 0.52 C ATOM 171 OG SER A 12 -3.200 0.133 10.652 1.00 0.63 O ATOM 0 H SER A 12 -2.808 2.818 10.892 1.00 0.45 H new ATOM 0 HA SER A 12 -0.741 0.914 11.243 1.00 0.47 H new ATOM 0 HB2 SER A 12 -2.763 1.259 8.984 1.00 0.52 H new ATOM 0 HB3 SER A 12 -1.761 -0.161 9.209 1.00 0.52 H new ATOM 0 HG SER A 12 -3.688 0.870 11.075 1.00 0.63 H new ATOM 177 N ILE A 13 -0.445 2.774 8.466 1.00 0.42 N ATOM 178 CA ILE A 13 0.539 3.274 7.472 1.00 0.43 C ATOM 179 C ILE A 13 1.577 4.223 8.114 1.00 0.41 C ATOM 180 O ILE A 13 2.704 4.323 7.626 1.00 0.46 O ATOM 181 CB ILE A 13 -0.135 3.972 6.236 1.00 0.47 C ATOM 182 CG1 ILE A 13 -1.117 5.113 6.647 1.00 0.46 C ATOM 183 CG2 ILE A 13 -0.842 2.933 5.362 1.00 0.56 C ATOM 184 CD1 ILE A 13 -0.492 6.497 6.691 1.00 0.44 C ATOM 0 H ILE A 13 -1.396 3.112 8.319 1.00 0.42 H new ATOM 0 HA ILE A 13 1.056 2.387 7.106 1.00 0.43 H new ATOM 0 HB ILE A 13 0.661 4.443 5.660 1.00 0.47 H new ATOM 0 HG12 ILE A 13 -1.951 5.127 5.946 1.00 0.46 H new ATOM 0 HG13 ILE A 13 -1.530 4.883 7.629 1.00 0.46 H new ATOM 0 HG21 ILE A 13 -1.305 3.429 4.509 1.00 0.56 H new ATOM 0 HG22 ILE A 13 -0.116 2.202 5.006 1.00 0.56 H new ATOM 0 HG23 ILE A 13 -1.609 2.427 5.947 1.00 0.56 H new ATOM 0 HD11 ILE A 13 -1.246 7.227 6.985 1.00 0.44 H new ATOM 0 HD12 ILE A 13 0.323 6.505 7.414 1.00 0.44 H new ATOM 0 HD13 ILE A 13 -0.105 6.753 5.705 1.00 0.44 H new ATOM 196 N GLU A 14 1.184 4.913 9.207 1.00 0.39 N ATOM 197 CA GLU A 14 2.073 5.839 9.937 1.00 0.40 C ATOM 198 C GLU A 14 3.156 5.058 10.720 1.00 0.41 C ATOM 199 O GLU A 14 4.318 5.474 10.746 1.00 0.44 O ATOM 200 CB GLU A 14 1.225 6.741 10.874 1.00 0.43 C ATOM 201 CG GLU A 14 1.997 7.598 11.891 1.00 0.52 C ATOM 202 CD GLU A 14 2.301 6.892 13.215 1.00 0.61 C ATOM 203 OE1 GLU A 14 1.603 5.910 13.556 1.00 0.93 O ATOM 204 OE2 GLU A 14 3.238 7.334 13.914 1.00 1.00 O ATOM 0 H GLU A 14 0.247 4.844 9.605 1.00 0.39 H new ATOM 0 HA GLU A 14 2.593 6.478 9.223 1.00 0.40 H new ATOM 0 HB2 GLU A 14 0.625 7.407 10.254 1.00 0.43 H new ATOM 0 HB3 GLU A 14 0.531 6.104 11.423 1.00 0.43 H new ATOM 0 HG2 GLU A 14 2.937 7.917 11.440 1.00 0.52 H new ATOM 0 HG3 GLU A 14 1.421 8.500 12.099 1.00 0.52 H new ATOM 211 N THR A 15 2.758 3.932 11.362 1.00 0.42 N ATOM 212 CA THR A 15 3.686 3.075 12.135 1.00 0.45 C ATOM 213 C THR A 15 4.810 2.491 11.242 1.00 0.43 C ATOM 214 O THR A 15 5.940 2.338 11.709 1.00 0.45 O ATOM 215 CB THR A 15 2.927 1.925 12.875 1.00 0.50 C ATOM 216 OG1 THR A 15 1.993 2.486 13.808 1.00 0.65 O ATOM 217 CG2 THR A 15 3.872 0.988 13.639 1.00 0.77 C ATOM 0 H THR A 15 1.795 3.596 11.358 1.00 0.42 H new ATOM 0 HA THR A 15 4.150 3.715 12.885 1.00 0.45 H new ATOM 0 HB THR A 15 2.417 1.340 12.110 1.00 0.50 H new ATOM 0 HG1 THR A 15 1.148 2.677 13.350 1.00 0.65 H new ATOM 0 HG21 THR A 15 3.291 0.209 14.133 1.00 0.77 H new ATOM 0 HG22 THR A 15 4.573 0.530 12.941 1.00 0.77 H new ATOM 0 HG23 THR A 15 4.424 1.558 14.386 1.00 0.77 H new ATOM 225 N VAL A 16 4.500 2.179 9.960 1.00 0.41 N ATOM 226 CA VAL A 16 5.504 1.625 9.017 1.00 0.42 C ATOM 227 C VAL A 16 6.564 2.695 8.648 1.00 0.42 C ATOM 228 O VAL A 16 7.728 2.357 8.408 1.00 0.46 O ATOM 229 CB VAL A 16 4.843 1.037 7.715 1.00 0.44 C ATOM 230 CG1 VAL A 16 5.886 0.408 6.775 1.00 0.50 C ATOM 231 CG2 VAL A 16 3.762 0.007 8.068 1.00 0.49 C ATOM 0 H VAL A 16 3.571 2.300 9.557 1.00 0.41 H new ATOM 0 HA VAL A 16 5.997 0.800 9.531 1.00 0.42 H new ATOM 0 HB VAL A 16 4.379 1.871 7.188 1.00 0.44 H new ATOM 0 HG11 VAL A 16 5.387 0.015 5.889 1.00 0.50 H new ATOM 0 HG12 VAL A 16 6.611 1.166 6.477 1.00 0.50 H new ATOM 0 HG13 VAL A 16 6.400 -0.402 7.292 1.00 0.50 H new ATOM 0 HG21 VAL A 16 3.320 -0.385 7.152 1.00 0.49 H new ATOM 0 HG22 VAL A 16 4.209 -0.810 8.634 1.00 0.49 H new ATOM 0 HG23 VAL A 16 2.988 0.484 8.669 1.00 0.49 H new ATOM 241 N VAL A 17 6.150 3.982 8.613 1.00 0.42 N ATOM 242 CA VAL A 17 7.060 5.105 8.306 1.00 0.47 C ATOM 243 C VAL A 17 8.011 5.369 9.494 1.00 0.55 C ATOM 244 O VAL A 17 9.222 5.426 9.311 1.00 0.95 O ATOM 245 CB VAL A 17 6.264 6.418 7.951 1.00 0.51 C ATOM 246 CG1 VAL A 17 7.197 7.616 7.701 1.00 0.60 C ATOM 247 CG2 VAL A 17 5.345 6.193 6.740 1.00 0.52 C ATOM 0 H VAL A 17 5.188 4.267 8.795 1.00 0.42 H new ATOM 0 HA VAL A 17 7.647 4.821 7.433 1.00 0.47 H new ATOM 0 HB VAL A 17 5.650 6.659 8.819 1.00 0.51 H new ATOM 0 HG11 VAL A 17 6.602 8.497 7.460 1.00 0.60 H new ATOM 0 HG12 VAL A 17 7.787 7.811 8.597 1.00 0.60 H new ATOM 0 HG13 VAL A 17 7.864 7.390 6.869 1.00 0.60 H new ATOM 0 HG21 VAL A 17 4.807 7.114 6.515 1.00 0.52 H new ATOM 0 HG22 VAL A 17 5.945 5.903 5.877 1.00 0.52 H new ATOM 0 HG23 VAL A 17 4.631 5.402 6.967 1.00 0.52 H new ATOM 257 N THR A 18 7.442 5.491 10.714 1.00 0.47 N ATOM 258 CA THR A 18 8.217 5.782 11.944 1.00 0.51 C ATOM 259 C THR A 18 9.290 4.726 12.280 1.00 0.51 C ATOM 260 O THR A 18 10.429 5.087 12.587 1.00 0.60 O ATOM 261 CB THR A 18 7.288 5.935 13.184 1.00 0.56 C ATOM 262 OG1 THR A 18 6.453 4.775 13.323 1.00 0.57 O ATOM 263 CG2 THR A 18 6.410 7.179 13.083 1.00 0.62 C ATOM 0 H THR A 18 6.440 5.392 10.875 1.00 0.47 H new ATOM 0 HA THR A 18 8.725 6.721 11.723 1.00 0.51 H new ATOM 0 HB THR A 18 7.929 6.039 14.060 1.00 0.56 H new ATOM 0 HG1 THR A 18 6.480 4.251 12.495 1.00 0.57 H new ATOM 0 HG21 THR A 18 5.776 7.250 13.967 1.00 0.62 H new ATOM 0 HG22 THR A 18 7.041 8.065 13.017 1.00 0.62 H new ATOM 0 HG23 THR A 18 5.784 7.112 12.193 1.00 0.62 H new ATOM 271 N THR A 19 8.927 3.429 12.216 1.00 0.49 N ATOM 272 CA THR A 19 9.852 2.332 12.573 1.00 0.53 C ATOM 273 C THR A 19 11.080 2.232 11.635 1.00 0.53 C ATOM 274 O THR A 19 12.198 2.035 12.117 1.00 0.62 O ATOM 275 CB THR A 19 9.117 0.955 12.617 1.00 0.55 C ATOM 276 OG1 THR A 19 7.818 1.112 13.208 1.00 0.56 O ATOM 277 CG2 THR A 19 9.894 -0.083 13.430 1.00 0.66 C ATOM 0 H THR A 19 8.002 3.115 11.921 1.00 0.49 H new ATOM 0 HA THR A 19 10.220 2.581 13.568 1.00 0.53 H new ATOM 0 HB THR A 19 9.034 0.603 11.589 1.00 0.55 H new ATOM 0 HG1 THR A 19 7.171 1.359 12.515 1.00 0.56 H new ATOM 0 HG21 THR A 19 9.347 -1.026 13.434 1.00 0.66 H new ATOM 0 HG22 THR A 19 10.876 -0.235 12.982 1.00 0.66 H new ATOM 0 HG23 THR A 19 10.014 0.272 14.454 1.00 0.66 H new ATOM 285 N PHE A 20 10.874 2.372 10.308 1.00 0.53 N ATOM 286 CA PHE A 20 11.982 2.260 9.334 1.00 0.57 C ATOM 287 C PHE A 20 12.717 3.598 9.084 1.00 0.57 C ATOM 288 O PHE A 20 13.925 3.582 8.823 1.00 0.89 O ATOM 289 CB PHE A 20 11.483 1.672 8.001 1.00 0.64 C ATOM 290 CG PHE A 20 12.607 1.244 7.076 1.00 0.71 C ATOM 291 CD1 PHE A 20 13.247 0.022 7.255 1.00 0.83 C ATOM 292 CD2 PHE A 20 13.042 2.072 6.049 1.00 0.76 C ATOM 293 CE1 PHE A 20 14.284 -0.362 6.431 1.00 0.95 C ATOM 294 CE2 PHE A 20 14.083 1.688 5.225 1.00 0.86 C ATOM 295 CZ PHE A 20 14.703 0.470 5.416 1.00 0.93 C ATOM 0 H PHE A 20 9.963 2.560 9.890 1.00 0.53 H new ATOM 0 HA PHE A 20 12.708 1.581 9.782 1.00 0.57 H new ATOM 0 HB2 PHE A 20 10.844 0.813 8.207 1.00 0.64 H new ATOM 0 HB3 PHE A 20 10.866 2.413 7.493 1.00 0.64 H new ATOM 0 HD1 PHE A 20 12.927 -0.635 8.050 1.00 0.83 H new ATOM 0 HD2 PHE A 20 12.561 3.026 5.893 1.00 0.76 H new ATOM 0 HE1 PHE A 20 14.768 -1.316 6.581 1.00 0.95 H new ATOM 0 HE2 PHE A 20 14.412 2.342 4.431 1.00 0.86 H new ATOM 0 HZ PHE A 20 15.515 0.170 4.771 1.00 0.93 H new ATOM 305 N PHE A 21 12.006 4.745 9.157 1.00 0.71 N ATOM 306 CA PHE A 21 12.636 6.072 8.924 1.00 0.73 C ATOM 307 C PHE A 21 13.681 6.434 10.002 1.00 0.66 C ATOM 308 O PHE A 21 14.496 7.335 9.786 1.00 0.67 O ATOM 309 CB PHE A 21 11.573 7.192 8.794 1.00 1.04 C ATOM 310 CG PHE A 21 10.921 7.297 7.417 1.00 1.67 C ATOM 311 CD1 PHE A 21 10.614 6.162 6.658 1.00 1.97 C ATOM 312 CD2 PHE A 21 10.619 8.541 6.877 1.00 2.34 C ATOM 313 CE1 PHE A 21 10.033 6.277 5.412 1.00 2.74 C ATOM 314 CE2 PHE A 21 10.040 8.651 5.627 1.00 3.02 C ATOM 315 CZ PHE A 21 9.747 7.521 4.898 1.00 3.17 C ATOM 0 H PHE A 21 11.010 4.784 9.372 1.00 0.71 H new ATOM 0 HA PHE A 21 13.168 5.992 7.976 1.00 0.73 H new ATOM 0 HB2 PHE A 21 10.794 7.023 9.538 1.00 1.04 H new ATOM 0 HB3 PHE A 21 12.040 8.147 9.033 1.00 1.04 H new ATOM 0 HD1 PHE A 21 10.835 5.182 7.053 1.00 1.97 H new ATOM 0 HD2 PHE A 21 10.840 9.435 7.442 1.00 2.34 H new ATOM 0 HE1 PHE A 21 9.803 5.390 4.840 1.00 2.74 H new ATOM 0 HE2 PHE A 21 9.817 9.627 5.221 1.00 3.02 H new ATOM 0 HZ PHE A 21 9.293 7.611 3.922 1.00 3.17 H new ATOM 325 N THR A 22 13.656 5.735 11.163 1.00 0.75 N ATOM 326 CA THR A 22 14.643 5.960 12.236 1.00 0.89 C ATOM 327 C THR A 22 16.077 5.636 11.737 1.00 0.82 C ATOM 328 O THR A 22 17.044 6.266 12.173 1.00 0.97 O ATOM 329 CB THR A 22 14.319 5.103 13.502 1.00 1.11 C ATOM 330 OG1 THR A 22 12.914 5.163 13.799 1.00 1.25 O ATOM 331 CG2 THR A 22 15.113 5.564 14.727 1.00 1.37 C ATOM 0 H THR A 22 12.965 5.015 11.375 1.00 0.75 H new ATOM 0 HA THR A 22 14.588 7.013 12.512 1.00 0.89 H new ATOM 0 HB THR A 22 14.609 4.077 13.276 1.00 1.11 H new ATOM 0 HG1 THR A 22 12.724 4.621 14.593 1.00 1.25 H new ATOM 0 HG21 THR A 22 14.856 4.940 15.583 1.00 1.37 H new ATOM 0 HG22 THR A 22 16.180 5.478 14.523 1.00 1.37 H new ATOM 0 HG23 THR A 22 14.869 6.603 14.949 1.00 1.37 H new ATOM 339 N PHE A 23 16.193 4.644 10.820 1.00 0.69 N ATOM 340 CA PHE A 23 17.485 4.233 10.236 1.00 0.76 C ATOM 341 C PHE A 23 17.644 4.736 8.777 1.00 0.69 C ATOM 342 O PHE A 23 18.774 4.932 8.321 1.00 0.82 O ATOM 343 CB PHE A 23 17.643 2.696 10.303 1.00 0.87 C ATOM 344 CG PHE A 23 17.581 2.138 11.720 1.00 1.04 C ATOM 345 CD1 PHE A 23 18.704 2.158 12.542 1.00 1.34 C ATOM 346 CD2 PHE A 23 16.398 1.612 12.231 1.00 1.01 C ATOM 347 CE1 PHE A 23 18.647 1.668 13.833 1.00 1.55 C ATOM 348 CE2 PHE A 23 16.344 1.118 13.523 1.00 1.24 C ATOM 349 CZ PHE A 23 17.469 1.147 14.324 1.00 1.49 C ATOM 0 H PHE A 23 15.397 4.112 10.469 1.00 0.69 H new ATOM 0 HA PHE A 23 18.276 4.694 10.827 1.00 0.76 H new ATOM 0 HB2 PHE A 23 16.859 2.232 9.704 1.00 0.87 H new ATOM 0 HB3 PHE A 23 18.596 2.417 9.853 1.00 0.87 H new ATOM 0 HD1 PHE A 23 19.632 2.562 12.166 1.00 1.34 H new ATOM 0 HD2 PHE A 23 15.513 1.589 11.613 1.00 1.01 H new ATOM 0 HE1 PHE A 23 19.527 1.693 14.458 1.00 1.55 H new ATOM 0 HE2 PHE A 23 15.420 0.709 13.905 1.00 1.24 H new ATOM 0 HZ PHE A 23 17.426 0.762 15.332 1.00 1.49 H new ATOM 359 N ALA A 24 16.515 4.949 8.054 1.00 0.59 N ATOM 360 CA ALA A 24 16.544 5.437 6.651 1.00 0.67 C ATOM 361 C ALA A 24 16.954 6.922 6.522 1.00 0.62 C ATOM 362 O ALA A 24 17.386 7.347 5.446 1.00 0.83 O ATOM 363 CB ALA A 24 15.190 5.213 5.979 1.00 0.82 C ATOM 0 H ALA A 24 15.576 4.791 8.418 1.00 0.59 H new ATOM 0 HA ALA A 24 17.313 4.854 6.145 1.00 0.67 H new ATOM 0 HB1 ALA A 24 15.229 5.576 4.952 1.00 0.82 H new ATOM 0 HB2 ALA A 24 14.956 4.149 5.979 1.00 0.82 H new ATOM 0 HB3 ALA A 24 14.418 5.754 6.526 1.00 0.82 H new ATOM 369 N ARG A 25 16.814 7.703 7.616 1.00 0.61 N ATOM 370 CA ARG A 25 17.180 9.142 7.624 1.00 0.65 C ATOM 371 C ARG A 25 18.709 9.385 7.501 1.00 0.69 C ATOM 372 O ARG A 25 19.128 10.514 7.231 1.00 0.88 O ATOM 373 CB ARG A 25 16.640 9.835 8.899 1.00 0.75 C ATOM 374 CG ARG A 25 17.142 9.247 10.227 1.00 0.78 C ATOM 375 CD ARG A 25 16.493 9.931 11.428 1.00 0.97 C ATOM 376 NE ARG A 25 17.026 9.446 12.714 1.00 1.09 N ATOM 377 CZ ARG A 25 16.646 9.903 13.928 1.00 1.32 C ATOM 378 NH1 ARG A 25 15.793 10.932 14.054 1.00 1.55 N ATOM 379 NH2 ARG A 25 17.136 9.330 15.029 1.00 1.47 N ATOM 0 H ARG A 25 16.450 7.363 8.506 1.00 0.61 H new ATOM 0 HA ARG A 25 16.714 9.579 6.740 1.00 0.65 H new ATOM 0 HB2 ARG A 25 16.911 10.890 8.862 1.00 0.75 H new ATOM 0 HB3 ARG A 25 15.551 9.785 8.887 1.00 0.75 H new ATOM 0 HG2 ARG A 25 16.927 8.179 10.256 1.00 0.78 H new ATOM 0 HG3 ARG A 25 18.225 9.356 10.287 1.00 0.78 H new ATOM 0 HD2 ARG A 25 16.650 11.007 11.357 1.00 0.97 H new ATOM 0 HD3 ARG A 25 15.416 9.763 11.399 1.00 0.97 H new ATOM 0 HE ARG A 25 17.733 8.712 12.686 1.00 1.09 H new ATOM 0 HH11 ARG A 25 15.417 11.387 13.222 1.00 1.55 H new ATOM 0 HH12 ARG A 25 15.521 11.259 14.981 1.00 1.55 H new ATOM 0 HH21 ARG A 25 17.792 8.553 14.951 1.00 1.47 H new ATOM 0 HH22 ARG A 25 16.854 9.669 15.949 1.00 1.47 H new ATOM 393 N GLN A 26 19.534 8.329 7.699 1.00 0.73 N ATOM 394 CA GLN A 26 21.005 8.446 7.627 1.00 0.84 C ATOM 395 C GLN A 26 21.509 8.657 6.181 1.00 0.78 C ATOM 396 O GLN A 26 22.381 9.499 5.950 1.00 0.89 O ATOM 397 CB GLN A 26 21.667 7.195 8.246 1.00 1.01 C ATOM 398 CG GLN A 26 23.157 7.351 8.548 1.00 1.22 C ATOM 399 CD GLN A 26 23.756 6.114 9.202 1.00 1.49 C ATOM 400 OE1 GLN A 26 24.255 5.220 8.517 1.00 1.63 O ATOM 401 NE2 GLN A 26 23.707 6.050 10.534 1.00 1.80 N ATOM 0 H GLN A 26 19.203 7.388 7.910 1.00 0.73 H new ATOM 0 HA GLN A 26 21.288 9.330 8.198 1.00 0.84 H new ATOM 0 HB2 GLN A 26 21.146 6.943 9.170 1.00 1.01 H new ATOM 0 HB3 GLN A 26 21.533 6.354 7.565 1.00 1.01 H new ATOM 0 HG2 GLN A 26 23.691 7.562 7.622 1.00 1.22 H new ATOM 0 HG3 GLN A 26 23.303 8.210 9.203 1.00 1.22 H new ATOM 0 HE21 GLN A 26 23.285 6.811 11.066 1.00 1.80 H new ATOM 0 HE22 GLN A 26 24.091 5.240 11.020 1.00 1.80 H new ATOM 410 N GLU A 27 20.962 7.881 5.218 1.00 0.70 N ATOM 411 CA GLU A 27 21.366 7.980 3.798 1.00 0.76 C ATOM 412 C GLU A 27 20.657 9.159 3.091 1.00 0.93 C ATOM 413 O GLU A 27 19.900 9.900 3.731 1.00 1.59 O ATOM 414 CB GLU A 27 21.088 6.640 3.066 1.00 0.92 C ATOM 415 CG GLU A 27 21.784 5.420 3.684 1.00 1.09 C ATOM 416 CD GLU A 27 23.303 5.534 3.709 1.00 1.27 C ATOM 417 OE1 GLU A 27 23.924 5.458 2.628 1.00 1.52 O ATOM 418 OE2 GLU A 27 23.869 5.701 4.813 1.00 1.46 O ATOM 0 H GLU A 27 20.242 7.181 5.398 1.00 0.70 H new ATOM 0 HA GLU A 27 22.437 8.178 3.762 1.00 0.76 H new ATOM 0 HB2 GLU A 27 20.013 6.462 3.056 1.00 0.92 H new ATOM 0 HB3 GLU A 27 21.405 6.736 2.027 1.00 0.92 H new ATOM 0 HG2 GLU A 27 21.421 5.282 4.703 1.00 1.09 H new ATOM 0 HG3 GLU A 27 21.504 4.529 3.122 1.00 1.09 H new ATOM 425 N GLY A 28 20.913 9.333 1.767 1.00 0.79 N ATOM 426 CA GLY A 28 20.321 10.429 0.985 1.00 0.92 C ATOM 427 C GLY A 28 18.797 10.523 1.085 1.00 0.73 C ATOM 428 O GLY A 28 18.104 9.507 0.955 1.00 0.72 O ATOM 0 H GLY A 28 21.527 8.723 1.227 1.00 0.79 H new ATOM 0 HA2 GLY A 28 20.754 11.372 1.318 1.00 0.92 H new ATOM 0 HA3 GLY A 28 20.598 10.303 -0.062 1.00 0.92 H new ATOM 432 N ARG A 29 18.284 11.760 1.310 1.00 0.72 N ATOM 433 CA ARG A 29 16.837 12.049 1.448 1.00 0.71 C ATOM 434 C ARG A 29 16.226 11.381 2.699 1.00 0.68 C ATOM 435 O ARG A 29 16.482 10.206 2.979 1.00 0.76 O ATOM 436 CB ARG A 29 16.038 11.658 0.168 1.00 0.73 C ATOM 437 CG ARG A 29 15.831 12.802 -0.832 1.00 0.92 C ATOM 438 CD ARG A 29 17.138 13.310 -1.445 1.00 1.31 C ATOM 439 NE ARG A 29 16.908 14.391 -2.422 1.00 1.46 N ATOM 440 CZ ARG A 29 17.769 14.760 -3.396 1.00 1.91 C ATOM 441 NH1 ARG A 29 18.967 14.174 -3.533 1.00 2.60 N ATOM 442 NH2 ARG A 29 17.428 15.745 -4.233 1.00 2.05 N ATOM 0 H ARG A 29 18.870 12.590 1.401 1.00 0.72 H new ATOM 0 HA ARG A 29 16.753 13.128 1.576 1.00 0.71 H new ATOM 0 HB2 ARG A 29 16.560 10.844 -0.335 1.00 0.73 H new ATOM 0 HB3 ARG A 29 15.063 11.275 0.468 1.00 0.73 H new ATOM 0 HG2 ARG A 29 15.170 12.463 -1.630 1.00 0.92 H new ATOM 0 HG3 ARG A 29 15.327 13.628 -0.330 1.00 0.92 H new ATOM 0 HD2 ARG A 29 17.793 13.671 -0.653 1.00 1.31 H new ATOM 0 HD3 ARG A 29 17.654 12.484 -1.934 1.00 1.31 H new ATOM 0 HE ARG A 29 16.027 14.902 -2.357 1.00 1.46 H new ATOM 0 HH11 ARG A 29 19.247 13.431 -2.893 1.00 2.60 H new ATOM 0 HH12 ARG A 29 19.598 14.472 -4.277 1.00 2.60 H new ATOM 0 HH21 ARG A 29 16.526 16.210 -4.133 1.00 2.05 H new ATOM 0 HH22 ARG A 29 18.070 16.032 -4.972 1.00 2.05 H new ATOM 456 N LYS A 30 15.410 12.154 3.445 1.00 0.67 N ATOM 457 CA LYS A 30 14.738 11.659 4.668 1.00 0.67 C ATOM 458 C LYS A 30 13.465 10.858 4.328 1.00 0.66 C ATOM 459 O LYS A 30 13.079 9.959 5.079 1.00 0.72 O ATOM 460 CB LYS A 30 14.384 12.831 5.610 1.00 0.76 C ATOM 461 CG LYS A 30 15.587 13.644 6.104 1.00 0.82 C ATOM 462 CD LYS A 30 16.459 12.857 7.087 1.00 0.89 C ATOM 463 CE LYS A 30 17.655 13.668 7.591 1.00 1.00 C ATOM 464 NZ LYS A 30 18.692 13.873 6.537 1.00 1.22 N ATOM 0 H LYS A 30 15.199 13.127 3.222 1.00 0.67 H new ATOM 0 HA LYS A 30 15.436 10.993 5.175 1.00 0.67 H new ATOM 0 HB2 LYS A 30 13.698 13.501 5.092 1.00 0.76 H new ATOM 0 HB3 LYS A 30 13.851 12.436 6.474 1.00 0.76 H new ATOM 0 HG2 LYS A 30 16.192 13.949 5.250 1.00 0.82 H new ATOM 0 HG3 LYS A 30 15.233 14.556 6.586 1.00 0.82 H new ATOM 0 HD2 LYS A 30 15.852 12.545 7.937 1.00 0.89 H new ATOM 0 HD3 LYS A 30 16.818 11.949 6.602 1.00 0.89 H new ATOM 0 HE2 LYS A 30 17.308 14.638 7.948 1.00 1.00 H new ATOM 0 HE3 LYS A 30 18.104 13.157 8.443 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 19.480 14.427 6.929 1.00 1.22 H new ATOM 0 HZ2 LYS A 30 19.045 12.950 6.213 1.00 1.22 H new ATOM 0 HZ3 LYS A 30 18.274 14.385 5.734 1.00 1.22 H new ATOM 478 N ASP A 31 12.812 11.205 3.195 1.00 0.66 N ATOM 479 CA ASP A 31 11.587 10.521 2.733 1.00 0.71 C ATOM 480 C ASP A 31 11.904 9.238 1.926 1.00 0.64 C ATOM 481 O ASP A 31 11.003 8.422 1.696 1.00 0.89 O ATOM 482 CB ASP A 31 10.733 11.472 1.867 1.00 0.87 C ATOM 483 CG ASP A 31 10.238 12.692 2.629 1.00 1.03 C ATOM 484 OD1 ASP A 31 9.192 12.586 3.302 1.00 1.38 O ATOM 485 OD2 ASP A 31 10.896 13.753 2.546 1.00 1.43 O ATOM 0 H ASP A 31 13.118 11.960 2.582 1.00 0.66 H new ATOM 0 HA ASP A 31 11.030 10.231 3.624 1.00 0.71 H new ATOM 0 HB2 ASP A 31 11.322 11.801 1.010 1.00 0.87 H new ATOM 0 HB3 ASP A 31 9.876 10.925 1.474 1.00 0.87 H new ATOM 490 N SER A 32 13.179 9.061 1.506 1.00 0.65 N ATOM 491 CA SER A 32 13.596 7.895 0.708 1.00 0.58 C ATOM 492 C SER A 32 14.237 6.793 1.569 1.00 0.56 C ATOM 493 O SER A 32 14.804 7.071 2.630 1.00 0.63 O ATOM 494 CB SER A 32 14.575 8.342 -0.393 1.00 0.58 C ATOM 495 OG SER A 32 14.888 7.277 -1.278 1.00 1.09 O ATOM 0 H SER A 32 13.934 9.715 1.710 1.00 0.65 H new ATOM 0 HA SER A 32 12.699 7.469 0.258 1.00 0.58 H new ATOM 0 HB2 SER A 32 14.138 9.167 -0.956 1.00 0.58 H new ATOM 0 HB3 SER A 32 15.491 8.717 0.064 1.00 0.58 H new ATOM 0 HG SER A 32 15.860 7.213 -1.382 1.00 1.09 H new ATOM 501 N LEU A 33 14.126 5.537 1.086 1.00 0.54 N ATOM 502 CA LEU A 33 14.692 4.353 1.759 1.00 0.54 C ATOM 503 C LEU A 33 16.007 3.941 1.070 1.00 0.52 C ATOM 504 O LEU A 33 16.181 4.188 -0.127 1.00 0.66 O ATOM 505 CB LEU A 33 13.693 3.165 1.730 1.00 0.55 C ATOM 506 CG LEU A 33 12.392 3.317 2.569 1.00 0.67 C ATOM 507 CD1 LEU A 33 11.412 4.307 1.925 1.00 0.76 C ATOM 508 CD2 LEU A 33 11.709 1.959 2.767 1.00 0.75 C ATOM 0 H LEU A 33 13.640 5.317 0.217 1.00 0.54 H new ATOM 0 HA LEU A 33 14.888 4.612 2.799 1.00 0.54 H new ATOM 0 HB2 LEU A 33 13.409 2.987 0.693 1.00 0.55 H new ATOM 0 HB3 LEU A 33 14.217 2.273 2.075 1.00 0.55 H new ATOM 0 HG LEU A 33 12.682 3.714 3.542 1.00 0.67 H new ATOM 0 HD11 LEU A 33 10.516 4.385 2.541 1.00 0.76 H new ATOM 0 HD12 LEU A 33 11.884 5.286 1.845 1.00 0.76 H new ATOM 0 HD13 LEU A 33 11.139 3.954 0.931 1.00 0.76 H new ATOM 0 HD21 LEU A 33 10.802 2.091 3.356 1.00 0.75 H new ATOM 0 HD22 LEU A 33 11.453 1.536 1.796 1.00 0.75 H new ATOM 0 HD23 LEU A 33 12.386 1.284 3.290 1.00 0.75 H new ATOM 520 N SER A 34 16.926 3.300 1.824 1.00 0.50 N ATOM 521 CA SER A 34 18.218 2.851 1.263 1.00 0.52 C ATOM 522 C SER A 34 18.051 1.496 0.554 1.00 0.47 C ATOM 523 O SER A 34 17.224 0.677 0.966 1.00 0.47 O ATOM 524 CB SER A 34 19.286 2.762 2.366 1.00 0.62 C ATOM 525 OG SER A 34 20.556 2.403 1.840 1.00 0.68 O ATOM 0 H SER A 34 16.799 3.084 2.813 1.00 0.50 H new ATOM 0 HA SER A 34 18.551 3.584 0.529 1.00 0.52 H new ATOM 0 HB2 SER A 34 19.362 3.722 2.877 1.00 0.62 H new ATOM 0 HB3 SER A 34 18.980 2.027 3.111 1.00 0.62 H new ATOM 0 HG SER A 34 21.211 2.357 2.568 1.00 0.68 H new ATOM 531 N VAL A 35 18.845 1.265 -0.515 1.00 0.50 N ATOM 532 CA VAL A 35 18.772 0.014 -1.307 1.00 0.49 C ATOM 533 C VAL A 35 19.318 -1.230 -0.549 1.00 0.45 C ATOM 534 O VAL A 35 18.952 -2.359 -0.892 1.00 0.46 O ATOM 535 CB VAL A 35 19.491 0.178 -2.696 1.00 0.59 C ATOM 536 CG1 VAL A 35 21.016 0.282 -2.557 1.00 0.63 C ATOM 537 CG2 VAL A 35 19.106 -0.947 -3.669 1.00 0.64 C ATOM 0 H VAL A 35 19.544 1.928 -0.850 1.00 0.50 H new ATOM 0 HA VAL A 35 17.711 -0.170 -1.478 1.00 0.49 H new ATOM 0 HB VAL A 35 19.140 1.122 -3.114 1.00 0.59 H new ATOM 0 HG11 VAL A 35 21.465 0.394 -3.544 1.00 0.63 H new ATOM 0 HG12 VAL A 35 21.267 1.148 -1.944 1.00 0.63 H new ATOM 0 HG13 VAL A 35 21.401 -0.622 -2.084 1.00 0.63 H new ATOM 0 HG21 VAL A 35 19.622 -0.800 -4.618 1.00 0.64 H new ATOM 0 HG22 VAL A 35 19.393 -1.909 -3.245 1.00 0.64 H new ATOM 0 HG23 VAL A 35 18.029 -0.931 -3.836 1.00 0.64 H new ATOM 547 N ASN A 36 20.183 -1.025 0.470 1.00 0.45 N ATOM 548 CA ASN A 36 20.764 -2.137 1.255 1.00 0.46 C ATOM 549 C ASN A 36 20.057 -2.324 2.618 1.00 0.44 C ATOM 550 O ASN A 36 20.010 -3.446 3.133 1.00 0.55 O ATOM 551 CB ASN A 36 22.281 -1.910 1.452 1.00 0.55 C ATOM 552 CG ASN A 36 23.011 -3.135 2.009 1.00 0.64 C ATOM 553 OD1 ASN A 36 23.380 -4.039 1.259 1.00 0.82 O ATOM 554 ND2 ASN A 36 23.232 -3.168 3.327 1.00 0.77 N ATOM 0 H ASN A 36 20.494 -0.100 0.768 1.00 0.45 H new ATOM 0 HA ASN A 36 20.609 -3.056 0.690 1.00 0.46 H new ATOM 0 HB2 ASN A 36 22.727 -1.634 0.496 1.00 0.55 H new ATOM 0 HB3 ASN A 36 22.430 -1.068 2.128 1.00 0.55 H new ATOM 0 HD21 ASN A 36 23.721 -3.961 3.742 1.00 0.77 H new ATOM 0 HD22 ASN A 36 22.911 -2.400 3.917 1.00 0.77 H new ATOM 561 N GLU A 37 19.507 -1.232 3.204 1.00 0.44 N ATOM 562 CA GLU A 37 18.818 -1.310 4.514 1.00 0.46 C ATOM 563 C GLU A 37 17.446 -2.000 4.411 1.00 0.41 C ATOM 564 O GLU A 37 17.070 -2.742 5.323 1.00 0.43 O ATOM 565 CB GLU A 37 18.656 0.089 5.140 1.00 0.55 C ATOM 566 CG GLU A 37 19.985 0.773 5.469 1.00 0.70 C ATOM 567 CD GLU A 37 19.810 2.082 6.222 1.00 0.83 C ATOM 568 OE1 GLU A 37 19.677 2.037 7.462 1.00 1.54 O ATOM 569 OE2 GLU A 37 19.806 3.148 5.569 1.00 1.25 O ATOM 0 H GLU A 37 19.527 -0.298 2.795 1.00 0.44 H new ATOM 0 HA GLU A 37 19.450 -1.918 5.161 1.00 0.46 H new ATOM 0 HB2 GLU A 37 18.092 0.721 4.454 1.00 0.55 H new ATOM 0 HB3 GLU A 37 18.066 0.003 6.052 1.00 0.55 H new ATOM 0 HG2 GLU A 37 20.597 0.097 6.065 1.00 0.70 H new ATOM 0 HG3 GLU A 37 20.528 0.963 4.543 1.00 0.70 H new ATOM 576 N PHE A 38 16.700 -1.756 3.307 1.00 0.40 N ATOM 577 CA PHE A 38 15.373 -2.382 3.108 1.00 0.39 C ATOM 578 C PHE A 38 15.514 -3.913 2.932 1.00 0.37 C ATOM 579 O PHE A 38 14.686 -4.670 3.440 1.00 0.40 O ATOM 580 CB PHE A 38 14.604 -1.720 1.925 1.00 0.43 C ATOM 581 CG PHE A 38 14.724 -2.404 0.568 1.00 0.41 C ATOM 582 CD1 PHE A 38 15.807 -2.153 -0.270 1.00 0.49 C ATOM 583 CD2 PHE A 38 13.743 -3.295 0.133 1.00 0.50 C ATOM 584 CE1 PHE A 38 15.906 -2.770 -1.502 1.00 0.61 C ATOM 585 CE2 PHE A 38 13.844 -3.913 -1.098 1.00 0.61 C ATOM 586 CZ PHE A 38 14.925 -3.649 -1.914 1.00 0.65 C ATOM 0 H PHE A 38 16.991 -1.138 2.550 1.00 0.40 H new ATOM 0 HA PHE A 38 14.775 -2.210 4.003 1.00 0.39 H new ATOM 0 HB2 PHE A 38 13.548 -1.670 2.190 1.00 0.43 H new ATOM 0 HB3 PHE A 38 14.955 -0.693 1.822 1.00 0.43 H new ATOM 0 HD1 PHE A 38 16.579 -1.468 0.047 1.00 0.49 H new ATOM 0 HD2 PHE A 38 12.894 -3.504 0.767 1.00 0.50 H new ATOM 0 HE1 PHE A 38 16.751 -2.565 -2.143 1.00 0.61 H new ATOM 0 HE2 PHE A 38 13.078 -4.602 -1.422 1.00 0.61 H new ATOM 0 HZ PHE A 38 15.004 -4.131 -2.877 1.00 0.65 H new ATOM 596 N LYS A 39 16.581 -4.354 2.217 1.00 0.37 N ATOM 597 CA LYS A 39 16.853 -5.794 1.996 1.00 0.40 C ATOM 598 C LYS A 39 17.187 -6.502 3.330 1.00 0.38 C ATOM 599 O LYS A 39 16.743 -7.631 3.557 1.00 0.42 O ATOM 600 CB LYS A 39 18.008 -5.979 0.986 1.00 0.46 C ATOM 601 CG LYS A 39 18.124 -7.394 0.402 1.00 0.55 C ATOM 602 CD LYS A 39 19.359 -7.551 -0.492 1.00 0.64 C ATOM 603 CE LYS A 39 19.469 -8.953 -1.099 1.00 0.76 C ATOM 604 NZ LYS A 39 18.575 -9.135 -2.281 1.00 0.87 N ATOM 0 H LYS A 39 17.265 -3.732 1.785 1.00 0.37 H new ATOM 0 HA LYS A 39 15.953 -6.249 1.583 1.00 0.40 H new ATOM 0 HB2 LYS A 39 17.874 -5.272 0.167 1.00 0.46 H new ATOM 0 HB3 LYS A 39 18.947 -5.724 1.477 1.00 0.46 H new ATOM 0 HG2 LYS A 39 18.172 -8.118 1.215 1.00 0.55 H new ATOM 0 HG3 LYS A 39 17.228 -7.622 -0.175 1.00 0.55 H new ATOM 0 HD2 LYS A 39 19.319 -6.814 -1.294 1.00 0.64 H new ATOM 0 HD3 LYS A 39 20.255 -7.340 0.091 1.00 0.64 H new ATOM 0 HE2 LYS A 39 20.501 -9.137 -1.396 1.00 0.76 H new ATOM 0 HE3 LYS A 39 19.219 -9.695 -0.340 1.00 0.76 H new ATOM 0 HZ1 LYS A 39 18.806 -10.031 -2.756 1.00 0.87 H new ATOM 0 HZ2 LYS A 39 17.584 -9.155 -1.967 1.00 0.87 H new ATOM 0 HZ3 LYS A 39 18.712 -8.346 -2.944 1.00 0.87 H new ATOM 618 N GLU A 40 17.968 -5.824 4.208 1.00 0.38 N ATOM 619 CA GLU A 40 18.340 -6.377 5.531 1.00 0.40 C ATOM 620 C GLU A 40 17.101 -6.520 6.442 1.00 0.40 C ATOM 621 O GLU A 40 17.028 -7.458 7.243 1.00 0.44 O ATOM 622 CB GLU A 40 19.413 -5.503 6.224 1.00 0.45 C ATOM 623 CG GLU A 40 20.809 -5.634 5.620 1.00 0.49 C ATOM 624 CD GLU A 40 21.858 -4.810 6.354 1.00 0.59 C ATOM 625 OE1 GLU A 40 21.933 -3.588 6.108 1.00 0.64 O ATOM 626 OE2 GLU A 40 22.604 -5.390 7.173 1.00 0.73 O ATOM 0 H GLU A 40 18.350 -4.897 4.023 1.00 0.38 H new ATOM 0 HA GLU A 40 18.762 -7.368 5.362 1.00 0.40 H new ATOM 0 HB2 GLU A 40 19.104 -4.459 6.174 1.00 0.45 H new ATOM 0 HB3 GLU A 40 19.459 -5.772 7.279 1.00 0.45 H new ATOM 0 HG2 GLU A 40 21.106 -6.683 5.631 1.00 0.49 H new ATOM 0 HG3 GLU A 40 20.777 -5.323 4.576 1.00 0.49 H new ATOM 633 N LEU A 41 16.132 -5.583 6.312 1.00 0.39 N ATOM 634 CA LEU A 41 14.876 -5.615 7.098 1.00 0.41 C ATOM 635 C LEU A 41 14.025 -6.847 6.722 1.00 0.40 C ATOM 636 O LEU A 41 13.393 -7.454 7.589 1.00 0.44 O ATOM 637 CB LEU A 41 14.062 -4.320 6.856 1.00 0.44 C ATOM 638 CG LEU A 41 12.856 -4.066 7.803 1.00 0.55 C ATOM 639 CD1 LEU A 41 13.310 -3.426 9.120 1.00 0.65 C ATOM 640 CD2 LEU A 41 11.797 -3.199 7.107 1.00 0.58 C ATOM 0 H LEU A 41 16.197 -4.794 5.669 1.00 0.39 H new ATOM 0 HA LEU A 41 15.136 -5.683 8.154 1.00 0.41 H new ATOM 0 HB2 LEU A 41 14.741 -3.471 6.935 1.00 0.44 H new ATOM 0 HB3 LEU A 41 13.692 -4.337 5.831 1.00 0.44 H new ATOM 0 HG LEU A 41 12.406 -5.029 8.042 1.00 0.55 H new ATOM 0 HD11 LEU A 41 12.444 -3.260 9.761 1.00 0.65 H new ATOM 0 HD12 LEU A 41 14.013 -4.089 9.623 1.00 0.65 H new ATOM 0 HD13 LEU A 41 13.796 -2.472 8.913 1.00 0.65 H new ATOM 0 HD21 LEU A 41 10.960 -3.032 7.785 1.00 0.58 H new ATOM 0 HD22 LEU A 41 12.236 -2.241 6.830 1.00 0.58 H new ATOM 0 HD23 LEU A 41 11.442 -3.708 6.211 1.00 0.58 H new ATOM 652 N VAL A 42 14.016 -7.200 5.416 1.00 0.36 N ATOM 653 CA VAL A 42 13.263 -8.363 4.903 1.00 0.37 C ATOM 654 C VAL A 42 13.880 -9.694 5.389 1.00 0.38 C ATOM 655 O VAL A 42 13.150 -10.662 5.603 1.00 0.41 O ATOM 656 CB VAL A 42 13.171 -8.340 3.335 1.00 0.40 C ATOM 657 CG1 VAL A 42 12.546 -9.624 2.762 1.00 0.45 C ATOM 658 CG2 VAL A 42 12.388 -7.110 2.858 1.00 0.41 C ATOM 0 H VAL A 42 14.527 -6.690 4.695 1.00 0.36 H new ATOM 0 HA VAL A 42 12.252 -8.292 5.303 1.00 0.37 H new ATOM 0 HB VAL A 42 14.193 -8.284 2.960 1.00 0.40 H new ATOM 0 HG11 VAL A 42 12.506 -9.556 1.675 1.00 0.45 H new ATOM 0 HG12 VAL A 42 13.152 -10.483 3.050 1.00 0.45 H new ATOM 0 HG13 VAL A 42 11.536 -9.744 3.155 1.00 0.45 H new ATOM 0 HG21 VAL A 42 12.335 -7.112 1.769 1.00 0.41 H new ATOM 0 HG22 VAL A 42 11.379 -7.138 3.270 1.00 0.41 H new ATOM 0 HG23 VAL A 42 12.892 -6.204 3.195 1.00 0.41 H new ATOM 668 N THR A 43 15.216 -9.732 5.574 1.00 0.39 N ATOM 669 CA THR A 43 15.916 -10.946 6.034 1.00 0.42 C ATOM 670 C THR A 43 16.249 -10.877 7.553 1.00 0.49 C ATOM 671 O THR A 43 17.221 -11.494 8.010 1.00 0.80 O ATOM 672 CB THR A 43 17.222 -11.171 5.199 1.00 0.45 C ATOM 673 OG1 THR A 43 17.021 -10.768 3.831 1.00 0.46 O ATOM 674 CG2 THR A 43 17.671 -12.635 5.222 1.00 0.50 C ATOM 0 H THR A 43 15.831 -8.934 5.411 1.00 0.39 H new ATOM 0 HA THR A 43 15.246 -11.792 5.881 1.00 0.42 H new ATOM 0 HB THR A 43 18.000 -10.562 5.659 1.00 0.45 H new ATOM 0 HG1 THR A 43 17.018 -9.790 3.775 1.00 0.46 H new ATOM 0 HG21 THR A 43 18.580 -12.746 4.631 1.00 0.50 H new ATOM 0 HG22 THR A 43 17.867 -12.939 6.250 1.00 0.50 H new ATOM 0 HG23 THR A 43 16.886 -13.263 4.802 1.00 0.50 H new ATOM 682 N GLN A 44 15.423 -10.140 8.343 1.00 0.41 N ATOM 683 CA GLN A 44 15.642 -10.002 9.798 1.00 0.44 C ATOM 684 C GLN A 44 14.326 -9.719 10.562 1.00 0.44 C ATOM 685 O GLN A 44 13.956 -10.491 11.451 1.00 0.50 O ATOM 686 CB GLN A 44 16.685 -8.889 10.079 1.00 0.48 C ATOM 687 CG GLN A 44 17.223 -8.881 11.512 1.00 0.65 C ATOM 688 CD GLN A 44 18.234 -7.769 11.768 1.00 0.77 C ATOM 689 OE1 GLN A 44 19.435 -7.962 11.581 1.00 1.02 O ATOM 690 NE2 GLN A 44 17.758 -6.600 12.198 1.00 1.10 N ATOM 0 H GLN A 44 14.607 -9.638 7.994 1.00 0.41 H new ATOM 0 HA GLN A 44 16.027 -10.954 10.163 1.00 0.44 H new ATOM 0 HB2 GLN A 44 17.521 -9.008 9.390 1.00 0.48 H new ATOM 0 HB3 GLN A 44 16.232 -7.920 9.867 1.00 0.48 H new ATOM 0 HG2 GLN A 44 16.389 -8.772 12.206 1.00 0.65 H new ATOM 0 HG3 GLN A 44 17.690 -9.843 11.723 1.00 0.65 H new ATOM 0 HE21 GLN A 44 16.755 -6.479 12.341 1.00 1.10 H new ATOM 0 HE22 GLN A 44 18.397 -5.827 12.384 1.00 1.10 H new ATOM 699 N GLN A 45 13.625 -8.616 10.209 1.00 0.41 N ATOM 700 CA GLN A 45 12.371 -8.210 10.893 1.00 0.43 C ATOM 701 C GLN A 45 11.094 -8.519 10.073 1.00 0.41 C ATOM 702 O GLN A 45 9.992 -8.499 10.635 1.00 0.45 O ATOM 703 CB GLN A 45 12.447 -6.698 11.233 1.00 0.47 C ATOM 704 CG GLN A 45 11.472 -6.229 12.320 1.00 0.59 C ATOM 705 CD GLN A 45 11.759 -4.809 12.820 1.00 0.64 C ATOM 706 OE1 GLN A 45 12.232 -3.956 12.066 1.00 0.65 O ATOM 707 NE2 GLN A 45 11.477 -4.543 14.100 1.00 0.84 N ATOM 0 H GLN A 45 13.906 -7.990 9.454 1.00 0.41 H new ATOM 0 HA GLN A 45 12.290 -8.803 11.804 1.00 0.43 H new ATOM 0 HB2 GLN A 45 13.463 -6.463 11.551 1.00 0.47 H new ATOM 0 HB3 GLN A 45 12.257 -6.127 10.324 1.00 0.47 H new ATOM 0 HG2 GLN A 45 10.455 -6.271 11.929 1.00 0.59 H new ATOM 0 HG3 GLN A 45 11.518 -6.920 13.162 1.00 0.59 H new ATOM 0 HE21 GLN A 45 11.086 -5.271 14.698 1.00 0.84 H new ATOM 0 HE22 GLN A 45 11.653 -3.612 14.478 1.00 0.84 H new ATOM 716 N LEU A 46 11.234 -8.812 8.757 1.00 0.40 N ATOM 717 CA LEU A 46 10.080 -9.113 7.889 1.00 0.40 C ATOM 718 C LEU A 46 10.351 -10.334 6.950 1.00 0.40 C ATOM 719 O LEU A 46 10.158 -10.231 5.732 1.00 0.42 O ATOM 720 CB LEU A 46 9.744 -7.838 7.074 1.00 0.41 C ATOM 721 CG LEU A 46 8.342 -7.790 6.410 1.00 0.40 C ATOM 722 CD1 LEU A 46 7.520 -6.614 6.955 1.00 0.59 C ATOM 723 CD2 LEU A 46 8.456 -7.710 4.881 1.00 0.67 C ATOM 0 H LEU A 46 12.134 -8.845 8.279 1.00 0.40 H new ATOM 0 HA LEU A 46 9.229 -9.396 8.508 1.00 0.40 H new ATOM 0 HB2 LEU A 46 9.838 -6.976 7.735 1.00 0.41 H new ATOM 0 HB3 LEU A 46 10.496 -7.725 6.293 1.00 0.41 H new ATOM 0 HG LEU A 46 7.823 -8.715 6.660 1.00 0.40 H new ATOM 0 HD11 LEU A 46 6.541 -6.601 6.475 1.00 0.59 H new ATOM 0 HD12 LEU A 46 7.394 -6.726 8.032 1.00 0.59 H new ATOM 0 HD13 LEU A 46 8.040 -5.679 6.746 1.00 0.59 H new ATOM 0 HD21 LEU A 46 7.458 -7.678 4.443 1.00 0.67 H new ATOM 0 HD22 LEU A 46 9.003 -6.809 4.604 1.00 0.67 H new ATOM 0 HD23 LEU A 46 8.987 -8.586 4.509 1.00 0.67 H new ATOM 735 N PRO A 47 10.807 -11.518 7.489 1.00 0.42 N ATOM 736 CA PRO A 47 11.074 -12.715 6.656 1.00 0.45 C ATOM 737 C PRO A 47 9.834 -13.609 6.385 1.00 0.47 C ATOM 738 O PRO A 47 9.737 -14.215 5.311 1.00 0.52 O ATOM 739 CB PRO A 47 12.120 -13.461 7.493 1.00 0.49 C ATOM 740 CG PRO A 47 11.756 -13.162 8.909 1.00 0.49 C ATOM 741 CD PRO A 47 11.146 -11.780 8.917 1.00 0.46 C ATOM 0 HA PRO A 47 11.394 -12.440 5.651 1.00 0.45 H new ATOM 0 HB2 PRO A 47 12.094 -14.533 7.295 1.00 0.49 H new ATOM 0 HB3 PRO A 47 13.129 -13.119 7.263 1.00 0.49 H new ATOM 0 HG2 PRO A 47 11.050 -13.899 9.291 1.00 0.49 H new ATOM 0 HG3 PRO A 47 12.636 -13.201 9.551 1.00 0.49 H new ATOM 0 HD2 PRO A 47 10.259 -11.740 9.550 1.00 0.46 H new ATOM 0 HD3 PRO A 47 11.846 -11.039 9.302 1.00 0.46 H new ATOM 749 N HIS A 48 8.895 -13.686 7.352 1.00 0.47 N ATOM 750 CA HIS A 48 7.678 -14.525 7.223 1.00 0.52 C ATOM 751 C HIS A 48 6.698 -13.983 6.168 1.00 0.50 C ATOM 752 O HIS A 48 6.095 -14.765 5.428 1.00 0.57 O ATOM 753 CB HIS A 48 6.955 -14.648 8.580 1.00 0.57 C ATOM 754 CG HIS A 48 7.787 -15.285 9.658 1.00 0.65 C ATOM 755 ND1 HIS A 48 8.526 -14.555 10.569 1.00 0.69 N ATOM 756 CD2 HIS A 48 7.995 -16.588 9.966 1.00 0.79 C ATOM 757 CE1 HIS A 48 9.150 -15.382 11.387 1.00 0.80 C ATOM 758 NE2 HIS A 48 8.846 -16.619 11.044 1.00 0.85 N ATOM 0 H HIS A 48 8.954 -13.177 8.234 1.00 0.47 H new ATOM 0 HA HIS A 48 8.013 -15.508 6.893 1.00 0.52 H new ATOM 0 HB2 HIS A 48 6.650 -13.655 8.909 1.00 0.57 H new ATOM 0 HB3 HIS A 48 6.045 -15.232 8.444 1.00 0.57 H new ATOM 0 HD2 HIS A 48 7.571 -17.442 9.459 1.00 0.79 H new ATOM 0 HE1 HIS A 48 9.800 -15.094 12.200 1.00 0.80 H new ATOM 0 HE2 HIS A 48 9.188 -17.462 11.505 1.00 0.85 H new ATOM 767 N LEU A 49 6.539 -12.643 6.112 1.00 0.46 N ATOM 768 CA LEU A 49 5.623 -11.991 5.156 1.00 0.46 C ATOM 769 C LEU A 49 6.074 -12.214 3.699 1.00 0.45 C ATOM 770 O LEU A 49 5.296 -12.727 2.886 1.00 0.53 O ATOM 771 CB LEU A 49 5.503 -10.484 5.481 1.00 0.47 C ATOM 772 CG LEU A 49 4.561 -9.645 4.583 1.00 0.50 C ATOM 773 CD1 LEU A 49 3.140 -10.209 4.577 1.00 0.87 C ATOM 774 CD2 LEU A 49 4.556 -8.184 5.040 1.00 0.53 C ATOM 0 H LEU A 49 7.035 -11.992 6.720 1.00 0.46 H new ATOM 0 HA LEU A 49 4.639 -12.448 5.259 1.00 0.46 H new ATOM 0 HB2 LEU A 49 5.164 -10.386 6.512 1.00 0.47 H new ATOM 0 HB3 LEU A 49 6.500 -10.046 5.429 1.00 0.47 H new ATOM 0 HG LEU A 49 4.940 -9.696 3.562 1.00 0.50 H new ATOM 0 HD11 LEU A 49 2.507 -9.595 3.936 1.00 0.87 H new ATOM 0 HD12 LEU A 49 3.156 -11.231 4.199 1.00 0.87 H new ATOM 0 HD13 LEU A 49 2.742 -10.204 5.592 1.00 0.87 H new ATOM 0 HD21 LEU A 49 3.890 -7.605 4.400 1.00 0.53 H new ATOM 0 HD22 LEU A 49 4.209 -8.127 6.072 1.00 0.53 H new ATOM 0 HD23 LEU A 49 5.566 -7.779 4.974 1.00 0.53 H new ATOM 786 N LEU A 50 7.324 -11.829 3.377 1.00 0.43 N ATOM 787 CA LEU A 50 7.874 -12.002 2.024 1.00 0.45 C ATOM 788 C LEU A 50 8.639 -13.333 1.950 1.00 0.48 C ATOM 789 O LEU A 50 9.738 -13.456 2.504 1.00 0.54 O ATOM 790 CB LEU A 50 8.800 -10.819 1.642 1.00 0.48 C ATOM 791 CG LEU A 50 8.141 -9.418 1.562 1.00 0.57 C ATOM 792 CD1 LEU A 50 9.192 -8.347 1.256 1.00 0.66 C ATOM 793 CD2 LEU A 50 7.021 -9.382 0.515 1.00 0.73 C ATOM 0 H LEU A 50 7.970 -11.396 4.037 1.00 0.43 H new ATOM 0 HA LEU A 50 7.051 -12.019 1.310 1.00 0.45 H new ATOM 0 HB2 LEU A 50 9.611 -10.773 2.369 1.00 0.48 H new ATOM 0 HB3 LEU A 50 9.251 -11.039 0.675 1.00 0.48 H new ATOM 0 HG LEU A 50 7.695 -9.206 2.534 1.00 0.57 H new ATOM 0 HD11 LEU A 50 8.711 -7.370 1.204 1.00 0.66 H new ATOM 0 HD12 LEU A 50 9.944 -8.339 2.045 1.00 0.66 H new ATOM 0 HD13 LEU A 50 9.670 -8.568 0.301 1.00 0.66 H new ATOM 0 HD21 LEU A 50 6.582 -8.385 0.486 1.00 0.73 H new ATOM 0 HD22 LEU A 50 7.431 -9.626 -0.465 1.00 0.73 H new ATOM 0 HD23 LEU A 50 6.253 -10.109 0.779 1.00 0.73 H new ATOM 805 N LYS A 51 8.039 -14.332 1.275 1.00 0.55 N ATOM 806 CA LYS A 51 8.652 -15.672 1.123 1.00 0.66 C ATOM 807 C LYS A 51 10.008 -15.624 0.381 1.00 0.63 C ATOM 808 O LYS A 51 10.876 -16.468 0.632 1.00 0.76 O ATOM 809 CB LYS A 51 7.678 -16.642 0.411 1.00 0.78 C ATOM 810 CG LYS A 51 7.266 -16.227 -1.008 1.00 0.78 C ATOM 811 CD LYS A 51 6.253 -17.199 -1.616 1.00 1.18 C ATOM 812 CE LYS A 51 5.750 -16.733 -2.984 1.00 1.16 C ATOM 813 NZ LYS A 51 6.786 -16.865 -4.052 1.00 1.32 N ATOM 0 H LYS A 51 7.129 -14.239 0.824 1.00 0.55 H new ATOM 0 HA LYS A 51 8.852 -16.043 2.128 1.00 0.66 H new ATOM 0 HB2 LYS A 51 8.141 -17.628 0.364 1.00 0.78 H new ATOM 0 HB3 LYS A 51 6.779 -16.741 1.019 1.00 0.78 H new ATOM 0 HG2 LYS A 51 6.838 -15.225 -0.983 1.00 0.78 H new ATOM 0 HG3 LYS A 51 8.150 -16.180 -1.643 1.00 0.78 H new ATOM 0 HD2 LYS A 51 6.712 -18.183 -1.716 1.00 1.18 H new ATOM 0 HD3 LYS A 51 5.406 -17.309 -0.938 1.00 1.18 H new ATOM 0 HE2 LYS A 51 4.871 -17.315 -3.261 1.00 1.16 H new ATOM 0 HE3 LYS A 51 5.434 -15.692 -2.916 1.00 1.16 H new ATOM 0 HZ1 LYS A 51 6.346 -16.716 -4.983 1.00 1.32 H new ATOM 0 HZ2 LYS A 51 7.531 -16.154 -3.903 1.00 1.32 H new ATOM 0 HZ3 LYS A 51 7.204 -17.817 -4.015 1.00 1.32 H new ATOM 827 N ASP A 52 10.184 -14.633 -0.520 1.00 0.64 N ATOM 828 CA ASP A 52 11.429 -14.478 -1.288 1.00 0.71 C ATOM 829 C ASP A 52 12.416 -13.526 -0.574 1.00 0.59 C ATOM 830 O ASP A 52 12.630 -12.392 -1.019 1.00 0.73 O ATOM 831 CB ASP A 52 11.126 -13.964 -2.717 1.00 0.99 C ATOM 832 CG ASP A 52 10.244 -14.905 -3.522 1.00 1.46 C ATOM 833 OD1 ASP A 52 10.787 -15.848 -4.136 1.00 2.08 O ATOM 834 OD2 ASP A 52 9.013 -14.696 -3.539 1.00 2.02 O ATOM 0 H ASP A 52 9.476 -13.930 -0.730 1.00 0.64 H new ATOM 0 HA ASP A 52 11.899 -15.459 -1.359 1.00 0.71 H new ATOM 0 HB2 ASP A 52 10.640 -12.991 -2.650 1.00 0.99 H new ATOM 0 HB3 ASP A 52 12.066 -13.815 -3.249 1.00 0.99 H new ATOM 839 N VAL A 53 13.012 -13.991 0.549 1.00 0.51 N ATOM 840 CA VAL A 53 13.998 -13.177 1.310 1.00 0.52 C ATOM 841 C VAL A 53 15.344 -13.074 0.550 1.00 0.56 C ATOM 842 O VAL A 53 15.982 -12.020 0.569 1.00 0.71 O ATOM 843 CB VAL A 53 14.251 -13.708 2.771 1.00 0.59 C ATOM 844 CG1 VAL A 53 13.020 -13.499 3.654 1.00 0.65 C ATOM 845 CG2 VAL A 53 14.684 -15.181 2.788 1.00 0.64 C ATOM 0 H VAL A 53 12.833 -14.913 0.947 1.00 0.51 H new ATOM 0 HA VAL A 53 13.553 -12.186 1.400 1.00 0.52 H new ATOM 0 HB VAL A 53 15.075 -13.123 3.180 1.00 0.59 H new ATOM 0 HG11 VAL A 53 13.223 -13.875 4.657 1.00 0.65 H new ATOM 0 HG12 VAL A 53 12.786 -12.436 3.706 1.00 0.65 H new ATOM 0 HG13 VAL A 53 12.172 -14.037 3.230 1.00 0.65 H new ATOM 0 HG21 VAL A 53 14.846 -15.501 3.817 1.00 0.64 H new ATOM 0 HG22 VAL A 53 13.905 -15.795 2.336 1.00 0.64 H new ATOM 0 HG23 VAL A 53 15.609 -15.295 2.223 1.00 0.64 H new ATOM 855 N GLY A 54 15.761 -14.184 -0.105 1.00 0.53 N ATOM 856 CA GLY A 54 17.001 -14.211 -0.885 1.00 0.64 C ATOM 857 C GLY A 54 16.790 -13.804 -2.346 1.00 0.61 C ATOM 858 O GLY A 54 17.712 -13.279 -2.975 1.00 0.83 O ATOM 0 H GLY A 54 15.250 -15.067 -0.103 1.00 0.53 H new ATOM 0 HA2 GLY A 54 17.728 -13.540 -0.427 1.00 0.64 H new ATOM 0 HA3 GLY A 54 17.426 -15.214 -0.849 1.00 0.64 H new ATOM 862 N SER A 55 15.570 -14.052 -2.886 1.00 0.57 N ATOM 863 CA SER A 55 15.232 -13.704 -4.278 1.00 0.58 C ATOM 864 C SER A 55 14.442 -12.375 -4.338 1.00 0.51 C ATOM 865 O SER A 55 13.359 -12.303 -4.934 1.00 0.62 O ATOM 866 CB SER A 55 14.431 -14.850 -4.932 1.00 0.74 C ATOM 867 OG SER A 55 14.437 -14.734 -6.346 1.00 0.85 O ATOM 0 H SER A 55 14.807 -14.493 -2.372 1.00 0.57 H new ATOM 0 HA SER A 55 16.158 -13.566 -4.836 1.00 0.58 H new ATOM 0 HB2 SER A 55 14.859 -15.809 -4.641 1.00 0.74 H new ATOM 0 HB3 SER A 55 13.404 -14.835 -4.567 1.00 0.74 H new ATOM 0 HG SER A 55 13.924 -15.472 -6.737 1.00 0.85 H new ATOM 873 N LEU A 56 15.003 -11.317 -3.717 1.00 0.49 N ATOM 874 CA LEU A 56 14.377 -9.979 -3.693 1.00 0.53 C ATOM 875 C LEU A 56 14.733 -9.166 -4.963 1.00 0.58 C ATOM 876 O LEU A 56 14.056 -8.186 -5.271 1.00 1.03 O ATOM 877 CB LEU A 56 14.810 -9.204 -2.414 1.00 0.67 C ATOM 878 CG LEU A 56 13.726 -8.356 -1.691 1.00 0.83 C ATOM 879 CD1 LEU A 56 13.137 -7.282 -2.606 1.00 1.22 C ATOM 880 CD2 LEU A 56 12.620 -9.241 -1.106 1.00 1.21 C ATOM 0 H LEU A 56 15.894 -11.365 -3.223 1.00 0.49 H new ATOM 0 HA LEU A 56 13.296 -10.115 -3.676 1.00 0.53 H new ATOM 0 HB2 LEU A 56 15.205 -9.927 -1.700 1.00 0.67 H new ATOM 0 HB3 LEU A 56 15.632 -8.541 -2.684 1.00 0.67 H new ATOM 0 HG LEU A 56 14.222 -7.847 -0.865 1.00 0.83 H new ATOM 0 HD11 LEU A 56 12.384 -6.713 -2.061 1.00 1.22 H new ATOM 0 HD12 LEU A 56 13.930 -6.611 -2.937 1.00 1.22 H new ATOM 0 HD13 LEU A 56 12.677 -7.755 -3.473 1.00 1.22 H new ATOM 0 HD21 LEU A 56 11.879 -8.616 -0.608 1.00 1.21 H new ATOM 0 HD22 LEU A 56 12.141 -9.802 -1.908 1.00 1.21 H new ATOM 0 HD23 LEU A 56 13.052 -9.935 -0.385 1.00 1.21 H new ATOM 892 N ASP A 57 15.792 -9.588 -5.703 1.00 0.49 N ATOM 893 CA ASP A 57 16.245 -8.901 -6.945 1.00 0.53 C ATOM 894 C ASP A 57 15.112 -8.671 -7.975 1.00 0.47 C ATOM 895 O ASP A 57 15.142 -7.672 -8.705 1.00 0.50 O ATOM 896 CB ASP A 57 17.424 -9.654 -7.608 1.00 0.67 C ATOM 897 CG ASP A 57 17.168 -11.140 -7.831 1.00 0.70 C ATOM 898 OD1 ASP A 57 16.447 -11.481 -8.791 1.00 0.77 O ATOM 899 OD2 ASP A 57 17.696 -11.957 -7.047 1.00 0.77 O ATOM 0 H ASP A 57 16.352 -10.405 -5.460 1.00 0.49 H new ATOM 0 HA ASP A 57 16.583 -7.916 -6.625 1.00 0.53 H new ATOM 0 HB2 ASP A 57 17.646 -9.187 -8.567 1.00 0.67 H new ATOM 0 HB3 ASP A 57 18.311 -9.539 -6.985 1.00 0.67 H new ATOM 904 N GLU A 58 14.122 -9.593 -8.044 1.00 0.46 N ATOM 905 CA GLU A 58 12.978 -9.450 -8.978 1.00 0.51 C ATOM 906 C GLU A 58 12.156 -8.177 -8.654 1.00 0.47 C ATOM 907 O GLU A 58 11.710 -7.480 -9.573 1.00 0.56 O ATOM 908 CB GLU A 58 12.074 -10.708 -8.951 1.00 0.60 C ATOM 909 CG GLU A 58 11.163 -10.852 -10.176 1.00 0.79 C ATOM 910 CD GLU A 58 10.123 -11.951 -10.020 1.00 0.92 C ATOM 911 OE1 GLU A 58 9.123 -11.724 -9.308 1.00 1.02 O ATOM 912 OE2 GLU A 58 10.310 -13.037 -10.609 1.00 1.09 O ATOM 0 H GLU A 58 14.091 -10.436 -7.470 1.00 0.46 H new ATOM 0 HA GLU A 58 13.382 -9.348 -9.985 1.00 0.51 H new ATOM 0 HB2 GLU A 58 12.705 -11.594 -8.875 1.00 0.60 H new ATOM 0 HB3 GLU A 58 11.456 -10.679 -8.054 1.00 0.60 H new ATOM 0 HG2 GLU A 58 10.657 -9.904 -10.358 1.00 0.79 H new ATOM 0 HG3 GLU A 58 11.775 -11.061 -11.054 1.00 0.79 H new ATOM 919 N LYS A 59 11.964 -7.884 -7.345 1.00 0.42 N ATOM 920 CA LYS A 59 11.234 -6.677 -6.898 1.00 0.47 C ATOM 921 C LYS A 59 12.189 -5.471 -6.745 1.00 0.53 C ATOM 922 O LYS A 59 11.769 -4.335 -6.965 1.00 0.91 O ATOM 923 CB LYS A 59 10.487 -6.931 -5.563 1.00 0.52 C ATOM 924 CG LYS A 59 9.126 -7.623 -5.708 1.00 0.60 C ATOM 925 CD LYS A 59 9.253 -9.110 -6.045 1.00 0.81 C ATOM 926 CE LYS A 59 7.890 -9.790 -6.146 1.00 1.17 C ATOM 927 NZ LYS A 59 8.012 -11.243 -6.459 1.00 1.55 N ATOM 0 H LYS A 59 12.305 -8.468 -6.582 1.00 0.42 H new ATOM 0 HA LYS A 59 10.498 -6.444 -7.667 1.00 0.47 H new ATOM 0 HB2 LYS A 59 11.121 -7.540 -4.918 1.00 0.52 H new ATOM 0 HB3 LYS A 59 10.341 -5.976 -5.057 1.00 0.52 H new ATOM 0 HG2 LYS A 59 8.566 -7.512 -4.780 1.00 0.60 H new ATOM 0 HG3 LYS A 59 8.551 -7.125 -6.489 1.00 0.60 H new ATOM 0 HD2 LYS A 59 9.786 -9.224 -6.989 1.00 0.81 H new ATOM 0 HD3 LYS A 59 9.850 -9.606 -5.280 1.00 0.81 H new ATOM 0 HE2 LYS A 59 7.352 -9.666 -5.206 1.00 1.17 H new ATOM 0 HE3 LYS A 59 7.297 -9.301 -6.919 1.00 1.17 H new ATOM 0 HZ1 LYS A 59 7.081 -11.697 -6.369 1.00 1.55 H new ATOM 0 HZ2 LYS A 59 8.362 -11.360 -7.431 1.00 1.55 H new ATOM 0 HZ3 LYS A 59 8.679 -11.686 -5.795 1.00 1.55 H new ATOM 941 N MET A 60 13.476 -5.723 -6.388 1.00 0.39 N ATOM 942 CA MET A 60 14.489 -4.652 -6.213 1.00 0.41 C ATOM 943 C MET A 60 14.667 -3.829 -7.501 1.00 0.42 C ATOM 944 O MET A 60 14.814 -2.607 -7.436 1.00 0.46 O ATOM 945 CB MET A 60 15.846 -5.248 -5.763 1.00 0.45 C ATOM 946 CG MET A 60 16.868 -4.208 -5.285 1.00 0.53 C ATOM 947 SD MET A 60 18.321 -4.936 -4.481 1.00 0.66 S ATOM 948 CE MET A 60 19.075 -5.855 -5.828 1.00 0.84 C ATOM 0 H MET A 60 13.836 -6.662 -6.216 1.00 0.39 H new ATOM 0 HA MET A 60 14.126 -3.982 -5.434 1.00 0.41 H new ATOM 0 HB2 MET A 60 15.667 -5.960 -4.958 1.00 0.45 H new ATOM 0 HB3 MET A 60 16.277 -5.808 -6.593 1.00 0.45 H new ATOM 0 HG2 MET A 60 17.195 -3.613 -6.138 1.00 0.53 H new ATOM 0 HG3 MET A 60 16.381 -3.526 -4.588 1.00 0.53 H new ATOM 0 HE1 MET A 60 20.107 -6.095 -5.572 1.00 0.84 H new ATOM 0 HE2 MET A 60 18.519 -6.777 -5.996 1.00 0.84 H new ATOM 0 HE3 MET A 60 19.058 -5.251 -6.735 1.00 0.84 H new ATOM 958 N LYS A 61 14.663 -4.508 -8.668 1.00 0.44 N ATOM 959 CA LYS A 61 14.782 -3.827 -9.971 1.00 0.49 C ATOM 960 C LYS A 61 13.537 -2.957 -10.254 1.00 0.46 C ATOM 961 O LYS A 61 13.653 -1.894 -10.868 1.00 0.49 O ATOM 962 CB LYS A 61 14.982 -4.849 -11.112 1.00 0.59 C ATOM 963 CG LYS A 61 16.418 -5.373 -11.266 1.00 0.70 C ATOM 964 CD LYS A 61 17.375 -4.342 -11.889 1.00 1.11 C ATOM 965 CE LYS A 61 17.103 -4.116 -13.379 1.00 1.90 C ATOM 966 NZ LYS A 61 18.049 -3.136 -13.990 1.00 2.56 N ATOM 0 H LYS A 61 14.579 -5.522 -8.733 1.00 0.44 H new ATOM 0 HA LYS A 61 15.657 -3.179 -9.927 1.00 0.49 H new ATOM 0 HB2 LYS A 61 14.318 -5.696 -10.942 1.00 0.59 H new ATOM 0 HB3 LYS A 61 14.676 -4.388 -12.051 1.00 0.59 H new ATOM 0 HG2 LYS A 61 16.798 -5.667 -10.287 1.00 0.70 H new ATOM 0 HG3 LYS A 61 16.406 -6.270 -11.886 1.00 0.70 H new ATOM 0 HD2 LYS A 61 17.280 -3.395 -11.358 1.00 1.11 H new ATOM 0 HD3 LYS A 61 18.403 -4.679 -11.758 1.00 1.11 H new ATOM 0 HE2 LYS A 61 17.178 -5.067 -13.907 1.00 1.90 H new ATOM 0 HE3 LYS A 61 16.081 -3.759 -13.509 1.00 1.90 H new ATOM 0 HZ1 LYS A 61 17.823 -3.018 -14.998 1.00 2.56 H new ATOM 0 HZ2 LYS A 61 17.960 -2.220 -13.506 1.00 2.56 H new ATOM 0 HZ3 LYS A 61 19.023 -3.487 -13.892 1.00 2.56 H new ATOM 980 N SER A 62 12.350 -3.425 -9.798 1.00 0.44 N ATOM 981 CA SER A 62 11.078 -2.697 -9.978 1.00 0.46 C ATOM 982 C SER A 62 11.010 -1.435 -9.093 1.00 0.43 C ATOM 983 O SER A 62 10.440 -0.421 -9.509 1.00 0.47 O ATOM 984 CB SER A 62 9.878 -3.612 -9.670 1.00 0.53 C ATOM 985 OG SER A 62 9.854 -4.741 -10.528 1.00 0.61 O ATOM 0 H SER A 62 12.251 -4.310 -9.300 1.00 0.44 H new ATOM 0 HA SER A 62 11.033 -2.383 -11.021 1.00 0.46 H new ATOM 0 HB2 SER A 62 9.928 -3.943 -8.633 1.00 0.53 H new ATOM 0 HB3 SER A 62 8.951 -3.049 -9.781 1.00 0.53 H new ATOM 0 HG SER A 62 9.082 -5.303 -10.307 1.00 0.61 H new ATOM 991 N LEU A 63 11.597 -1.501 -7.873 1.00 0.40 N ATOM 992 CA LEU A 63 11.605 -0.358 -6.935 1.00 0.43 C ATOM 993 C LEU A 63 12.473 0.790 -7.469 1.00 0.45 C ATOM 994 O LEU A 63 11.971 1.897 -7.678 1.00 0.53 O ATOM 995 CB LEU A 63 12.110 -0.776 -5.527 1.00 0.45 C ATOM 996 CG LEU A 63 11.298 -1.865 -4.792 1.00 0.42 C ATOM 997 CD1 LEU A 63 12.028 -2.304 -3.520 1.00 0.48 C ATOM 998 CD2 LEU A 63 9.873 -1.394 -4.471 1.00 0.68 C ATOM 0 H LEU A 63 12.069 -2.333 -7.519 1.00 0.40 H new ATOM 0 HA LEU A 63 10.574 -0.015 -6.847 1.00 0.43 H new ATOM 0 HB2 LEU A 63 13.138 -1.126 -5.625 1.00 0.45 H new ATOM 0 HB3 LEU A 63 12.135 0.113 -4.897 1.00 0.45 H new ATOM 0 HG LEU A 63 11.210 -2.723 -5.459 1.00 0.42 H new ATOM 0 HD11 LEU A 63 11.444 -3.072 -3.012 1.00 0.48 H new ATOM 0 HD12 LEU A 63 13.006 -2.706 -3.782 1.00 0.48 H new ATOM 0 HD13 LEU A 63 12.154 -1.447 -2.858 1.00 0.48 H new ATOM 0 HD21 LEU A 63 9.335 -2.189 -3.954 1.00 0.68 H new ATOM 0 HD22 LEU A 63 9.917 -0.511 -3.833 1.00 0.68 H new ATOM 0 HD23 LEU A 63 9.354 -1.147 -5.397 1.00 0.68 H new ATOM 1010 N ASP A 64 13.771 0.516 -7.704 1.00 0.45 N ATOM 1011 CA ASP A 64 14.705 1.533 -8.210 1.00 0.51 C ATOM 1012 C ASP A 64 14.636 1.614 -9.750 1.00 0.50 C ATOM 1013 O ASP A 64 15.525 1.122 -10.456 1.00 0.54 O ATOM 1014 CB ASP A 64 16.141 1.242 -7.716 1.00 0.60 C ATOM 1015 CG ASP A 64 17.104 2.401 -7.950 1.00 0.83 C ATOM 1016 OD1 ASP A 64 16.882 3.487 -7.367 1.00 1.28 O ATOM 1017 OD2 ASP A 64 18.076 2.223 -8.715 1.00 1.39 O ATOM 0 H ASP A 64 14.193 -0.400 -7.551 1.00 0.45 H new ATOM 0 HA ASP A 64 14.412 2.507 -7.817 1.00 0.51 H new ATOM 0 HB2 ASP A 64 16.112 1.012 -6.651 1.00 0.60 H new ATOM 0 HB3 ASP A 64 16.520 0.355 -8.224 1.00 0.60 H new ATOM 1022 N VAL A 65 13.546 2.224 -10.253 1.00 0.51 N ATOM 1023 CA VAL A 65 13.326 2.402 -11.702 1.00 0.55 C ATOM 1024 C VAL A 65 13.925 3.749 -12.196 1.00 0.55 C ATOM 1025 O VAL A 65 14.309 3.864 -13.364 1.00 0.60 O ATOM 1026 CB VAL A 65 11.800 2.276 -12.066 1.00 0.64 C ATOM 1027 CG1 VAL A 65 10.956 3.438 -11.524 1.00 0.67 C ATOM 1028 CG2 VAL A 65 11.596 2.110 -13.577 1.00 0.73 C ATOM 0 H VAL A 65 12.799 2.605 -9.673 1.00 0.51 H new ATOM 0 HA VAL A 65 13.850 1.600 -12.223 1.00 0.55 H new ATOM 0 HB VAL A 65 11.445 1.373 -11.569 1.00 0.64 H new ATOM 0 HG11 VAL A 65 9.914 3.294 -11.808 1.00 0.67 H new ATOM 0 HG12 VAL A 65 11.035 3.469 -10.437 1.00 0.67 H new ATOM 0 HG13 VAL A 65 11.319 4.377 -11.942 1.00 0.67 H new ATOM 0 HG21 VAL A 65 10.531 2.026 -13.793 1.00 0.73 H new ATOM 0 HG22 VAL A 65 12.004 2.977 -14.097 1.00 0.73 H new ATOM 0 HG23 VAL A 65 12.107 1.209 -13.916 1.00 0.73 H new ATOM 1038 N ASN A 66 14.009 4.749 -11.286 1.00 0.56 N ATOM 1039 CA ASN A 66 14.568 6.090 -11.595 1.00 0.60 C ATOM 1040 C ASN A 66 16.107 6.050 -11.829 1.00 0.59 C ATOM 1041 O ASN A 66 16.662 6.978 -12.427 1.00 0.66 O ATOM 1042 CB ASN A 66 14.218 7.071 -10.444 1.00 0.67 C ATOM 1043 CG ASN A 66 14.296 8.548 -10.830 1.00 0.94 C ATOM 1044 OD1 ASN A 66 13.320 9.120 -11.317 1.00 1.29 O ATOM 1045 ND2 ASN A 66 15.444 9.183 -10.600 1.00 1.44 N ATOM 0 H ASN A 66 13.693 4.651 -10.321 1.00 0.56 H new ATOM 0 HA ASN A 66 14.118 6.435 -12.526 1.00 0.60 H new ATOM 0 HB2 ASN A 66 13.210 6.853 -10.090 1.00 0.67 H new ATOM 0 HB3 ASN A 66 14.895 6.890 -9.609 1.00 0.67 H new ATOM 0 HD21 ASN A 66 15.534 10.173 -10.828 1.00 1.44 H new ATOM 0 HD22 ASN A 66 16.233 8.679 -10.195 1.00 1.44 H new ATOM 1052 N GLN A 67 16.786 4.978 -11.340 1.00 0.55 N ATOM 1053 CA GLN A 67 18.250 4.788 -11.491 1.00 0.60 C ATOM 1054 C GLN A 67 19.060 5.916 -10.804 1.00 0.63 C ATOM 1055 O GLN A 67 19.809 6.654 -11.458 1.00 0.78 O ATOM 1056 CB GLN A 67 18.656 4.625 -12.983 1.00 0.70 C ATOM 1057 CG GLN A 67 18.091 3.366 -13.666 1.00 0.88 C ATOM 1058 CD GLN A 67 18.864 2.945 -14.925 1.00 1.20 C ATOM 1059 OE1 GLN A 67 20.078 3.139 -15.018 1.00 1.96 O ATOM 1060 NE2 GLN A 67 18.165 2.359 -15.907 1.00 1.86 N ATOM 0 H GLN A 67 16.331 4.221 -10.830 1.00 0.55 H new ATOM 0 HA GLN A 67 18.501 3.859 -10.979 1.00 0.60 H new ATOM 0 HB2 GLN A 67 18.322 5.503 -13.535 1.00 0.70 H new ATOM 0 HB3 GLN A 67 19.744 4.602 -13.050 1.00 0.70 H new ATOM 0 HG2 GLN A 67 18.100 2.542 -12.953 1.00 0.88 H new ATOM 0 HG3 GLN A 67 17.050 3.545 -13.933 1.00 0.88 H new ATOM 0 HE21 GLN A 67 17.161 2.212 -15.801 1.00 1.86 H new ATOM 0 HE22 GLN A 67 18.637 2.060 -16.760 1.00 1.86 H new ATOM 1069 N ASP A 68 18.875 6.056 -9.472 1.00 0.62 N ATOM 1070 CA ASP A 68 19.599 7.070 -8.667 1.00 0.71 C ATOM 1071 C ASP A 68 19.951 6.544 -7.245 1.00 0.77 C ATOM 1072 O ASP A 68 20.296 7.335 -6.357 1.00 1.32 O ATOM 1073 CB ASP A 68 18.753 8.367 -8.579 1.00 0.78 C ATOM 1074 CG ASP A 68 19.560 9.607 -8.188 1.00 1.08 C ATOM 1075 OD1 ASP A 68 20.780 9.648 -8.468 1.00 1.41 O ATOM 1076 OD2 ASP A 68 18.962 10.541 -7.612 1.00 1.37 O ATOM 0 H ASP A 68 18.231 5.480 -8.930 1.00 0.62 H new ATOM 0 HA ASP A 68 20.543 7.287 -9.167 1.00 0.71 H new ATOM 0 HB2 ASP A 68 18.276 8.545 -9.543 1.00 0.78 H new ATOM 0 HB3 ASP A 68 17.955 8.220 -7.851 1.00 0.78 H new ATOM 1081 N SER A 69 19.886 5.199 -7.039 1.00 0.62 N ATOM 1082 CA SER A 69 20.181 4.550 -5.738 1.00 0.67 C ATOM 1083 C SER A 69 19.325 5.111 -4.564 1.00 0.68 C ATOM 1084 O SER A 69 19.766 5.096 -3.406 1.00 1.24 O ATOM 1085 CB SER A 69 21.687 4.646 -5.416 1.00 0.82 C ATOM 1086 OG SER A 69 22.474 4.083 -6.457 1.00 1.31 O ATOM 0 H SER A 69 19.628 4.539 -7.772 1.00 0.62 H new ATOM 0 HA SER A 69 19.903 3.501 -5.842 1.00 0.67 H new ATOM 0 HB2 SER A 69 21.964 5.690 -5.271 1.00 0.82 H new ATOM 0 HB3 SER A 69 21.895 4.128 -4.479 1.00 0.82 H new ATOM 0 HG SER A 69 23.424 4.159 -6.227 1.00 1.31 H new ATOM 1092 N GLU A 70 18.093 5.580 -4.867 1.00 0.66 N ATOM 1093 CA GLU A 70 17.172 6.132 -3.851 1.00 0.77 C ATOM 1094 C GLU A 70 15.764 5.546 -4.042 1.00 0.64 C ATOM 1095 O GLU A 70 15.133 5.778 -5.081 1.00 0.75 O ATOM 1096 CB GLU A 70 17.126 7.673 -3.940 1.00 1.13 C ATOM 1097 CG GLU A 70 18.333 8.375 -3.318 1.00 1.41 C ATOM 1098 CD GLU A 70 18.192 9.890 -3.288 1.00 1.90 C ATOM 1099 OE1 GLU A 70 17.146 10.383 -2.816 1.00 2.41 O ATOM 1100 OE2 GLU A 70 19.130 10.585 -3.737 1.00 2.42 O ATOM 0 H GLU A 70 17.713 5.586 -5.814 1.00 0.66 H new ATOM 0 HA GLU A 70 17.539 5.855 -2.863 1.00 0.77 H new ATOM 0 HB2 GLU A 70 17.052 7.963 -4.988 1.00 1.13 H new ATOM 0 HB3 GLU A 70 16.221 8.027 -3.447 1.00 1.13 H new ATOM 0 HG2 GLU A 70 18.474 8.009 -2.301 1.00 1.41 H new ATOM 0 HG3 GLU A 70 19.229 8.110 -3.880 1.00 1.41 H new ATOM 1107 N LEU A 71 15.270 4.797 -3.032 1.00 0.57 N ATOM 1108 CA LEU A 71 13.949 4.152 -3.103 1.00 0.51 C ATOM 1109 C LEU A 71 12.884 4.951 -2.318 1.00 0.51 C ATOM 1110 O LEU A 71 12.512 4.579 -1.199 1.00 0.53 O ATOM 1111 CB LEU A 71 14.030 2.687 -2.588 1.00 0.53 C ATOM 1112 CG LEU A 71 14.885 1.689 -3.424 1.00 0.66 C ATOM 1113 CD1 LEU A 71 16.388 1.974 -3.308 1.00 0.95 C ATOM 1114 CD2 LEU A 71 14.588 0.249 -2.997 1.00 0.74 C ATOM 0 H LEU A 71 15.770 4.627 -2.159 1.00 0.57 H new ATOM 0 HA LEU A 71 13.642 4.137 -4.149 1.00 0.51 H new ATOM 0 HB2 LEU A 71 14.428 2.706 -1.573 1.00 0.53 H new ATOM 0 HB3 LEU A 71 13.015 2.294 -2.525 1.00 0.53 H new ATOM 0 HG LEU A 71 14.607 1.823 -4.470 1.00 0.66 H new ATOM 0 HD11 LEU A 71 16.943 1.252 -3.908 1.00 0.95 H new ATOM 0 HD12 LEU A 71 16.596 2.982 -3.668 1.00 0.95 H new ATOM 0 HD13 LEU A 71 16.695 1.891 -2.265 1.00 0.95 H new ATOM 0 HD21 LEU A 71 15.192 -0.438 -3.589 1.00 0.74 H new ATOM 0 HD22 LEU A 71 14.828 0.126 -1.941 1.00 0.74 H new ATOM 0 HD23 LEU A 71 13.532 0.033 -3.156 1.00 0.74 H new ATOM 1126 N LYS A 72 12.402 6.063 -2.917 1.00 0.53 N ATOM 1127 CA LYS A 72 11.351 6.916 -2.303 1.00 0.56 C ATOM 1128 C LYS A 72 10.013 6.158 -2.282 1.00 0.50 C ATOM 1129 O LYS A 72 9.856 5.226 -3.053 1.00 0.48 O ATOM 1130 CB LYS A 72 11.211 8.238 -3.091 1.00 0.63 C ATOM 1131 CG LYS A 72 10.429 9.335 -2.359 1.00 0.86 C ATOM 1132 CD LYS A 72 10.421 10.670 -3.115 1.00 1.00 C ATOM 1133 CE LYS A 72 9.526 10.653 -4.364 1.00 1.43 C ATOM 1134 NZ LYS A 72 10.197 10.062 -5.566 1.00 1.89 N ATOM 0 H LYS A 72 12.723 6.394 -3.827 1.00 0.53 H new ATOM 0 HA LYS A 72 11.637 7.154 -1.278 1.00 0.56 H new ATOM 0 HB2 LYS A 72 12.207 8.614 -3.325 1.00 0.63 H new ATOM 0 HB3 LYS A 72 10.718 8.030 -4.040 1.00 0.63 H new ATOM 0 HG2 LYS A 72 9.402 9.003 -2.208 1.00 0.86 H new ATOM 0 HG3 LYS A 72 10.863 9.486 -1.371 1.00 0.86 H new ATOM 0 HD2 LYS A 72 10.081 11.458 -2.443 1.00 1.00 H new ATOM 0 HD3 LYS A 72 11.440 10.919 -3.410 1.00 1.00 H new ATOM 0 HE2 LYS A 72 8.621 10.086 -4.146 1.00 1.43 H new ATOM 0 HE3 LYS A 72 9.216 11.672 -4.594 1.00 1.43 H new ATOM 0 HZ1 LYS A 72 9.973 10.634 -6.405 1.00 1.89 H new ATOM 0 HZ2 LYS A 72 11.227 10.052 -5.419 1.00 1.89 H new ATOM 0 HZ3 LYS A 72 9.858 9.089 -5.709 1.00 1.89 H new ATOM 1148 N PHE A 73 9.051 6.559 -1.412 1.00 0.53 N ATOM 1149 CA PHE A 73 7.733 5.867 -1.321 1.00 0.50 C ATOM 1150 C PHE A 73 7.006 5.778 -2.680 1.00 0.47 C ATOM 1151 O PHE A 73 6.225 4.848 -2.893 1.00 0.47 O ATOM 1152 CB PHE A 73 6.810 6.508 -0.255 1.00 0.56 C ATOM 1153 CG PHE A 73 6.154 5.482 0.648 1.00 0.69 C ATOM 1154 CD1 PHE A 73 5.016 4.801 0.239 1.00 0.89 C ATOM 1155 CD2 PHE A 73 6.691 5.182 1.896 1.00 0.87 C ATOM 1156 CE1 PHE A 73 4.430 3.850 1.053 1.00 1.12 C ATOM 1157 CE2 PHE A 73 6.104 4.237 2.712 1.00 1.11 C ATOM 1158 CZ PHE A 73 4.974 3.567 2.291 1.00 1.20 C ATOM 0 H PHE A 73 9.157 7.345 -0.771 1.00 0.53 H new ATOM 0 HA PHE A 73 7.960 4.848 -1.007 1.00 0.50 H new ATOM 0 HB2 PHE A 73 7.391 7.201 0.353 1.00 0.56 H new ATOM 0 HB3 PHE A 73 6.037 7.093 -0.754 1.00 0.56 H new ATOM 0 HD1 PHE A 73 4.583 5.017 -0.727 1.00 0.89 H new ATOM 0 HD2 PHE A 73 7.580 5.696 2.231 1.00 0.87 H new ATOM 0 HE1 PHE A 73 3.545 3.327 0.721 1.00 1.12 H new ATOM 0 HE2 PHE A 73 6.529 4.022 3.681 1.00 1.11 H new ATOM 0 HZ PHE A 73 4.516 2.824 2.927 1.00 1.20 H new ATOM 1168 N ASN A 74 7.253 6.749 -3.588 1.00 0.49 N ATOM 1169 CA ASN A 74 6.663 6.728 -4.943 1.00 0.51 C ATOM 1170 C ASN A 74 7.267 5.556 -5.762 1.00 0.49 C ATOM 1171 O ASN A 74 6.584 4.967 -6.604 1.00 0.53 O ATOM 1172 CB ASN A 74 6.909 8.078 -5.657 1.00 0.57 C ATOM 1173 CG ASN A 74 5.888 8.377 -6.757 1.00 0.65 C ATOM 1174 OD1 ASN A 74 5.402 7.470 -7.434 1.00 0.98 O ATOM 1175 ND2 ASN A 74 5.550 9.656 -6.941 1.00 0.91 N ATOM 0 H ASN A 74 7.854 7.553 -3.407 1.00 0.49 H new ATOM 0 HA ASN A 74 5.586 6.578 -4.861 1.00 0.51 H new ATOM 0 HB2 ASN A 74 6.884 8.881 -4.920 1.00 0.57 H new ATOM 0 HB3 ASN A 74 7.909 8.075 -6.091 1.00 0.57 H new ATOM 0 HD21 ASN A 74 4.870 9.906 -7.660 1.00 0.91 H new ATOM 0 HD22 ASN A 74 5.971 10.383 -6.363 1.00 0.91 H new ATOM 1182 N GLU A 75 8.556 5.240 -5.489 1.00 0.46 N ATOM 1183 CA GLU A 75 9.288 4.134 -6.137 1.00 0.47 C ATOM 1184 C GLU A 75 9.144 2.828 -5.320 1.00 0.43 C ATOM 1185 O GLU A 75 8.980 1.749 -5.893 1.00 0.44 O ATOM 1186 CB GLU A 75 10.784 4.513 -6.286 1.00 0.53 C ATOM 1187 CG GLU A 75 11.112 5.309 -7.549 1.00 0.61 C ATOM 1188 CD GLU A 75 10.530 6.715 -7.550 1.00 0.78 C ATOM 1189 OE1 GLU A 75 11.207 7.643 -7.059 1.00 0.98 O ATOM 1190 OE2 GLU A 75 9.397 6.886 -8.048 1.00 1.03 O ATOM 0 H GLU A 75 9.117 5.751 -4.808 1.00 0.46 H new ATOM 0 HA GLU A 75 8.861 3.964 -7.126 1.00 0.47 H new ATOM 0 HB2 GLU A 75 11.087 5.095 -5.416 1.00 0.53 H new ATOM 0 HB3 GLU A 75 11.379 3.600 -6.282 1.00 0.53 H new ATOM 0 HG2 GLU A 75 12.195 5.373 -7.658 1.00 0.61 H new ATOM 0 HG3 GLU A 75 10.736 4.768 -8.417 1.00 0.61 H new ATOM 1197 N TYR A 76 9.204 2.947 -3.971 1.00 0.42 N ATOM 1198 CA TYR A 76 9.067 1.808 -3.036 1.00 0.41 C ATOM 1199 C TYR A 76 7.628 1.234 -3.039 1.00 0.39 C ATOM 1200 O TYR A 76 7.411 0.119 -2.560 1.00 0.52 O ATOM 1201 CB TYR A 76 9.470 2.246 -1.603 1.00 0.44 C ATOM 1202 CG TYR A 76 9.648 1.110 -0.589 1.00 0.45 C ATOM 1203 CD1 TYR A 76 10.719 0.226 -0.678 1.00 0.52 C ATOM 1204 CD2 TYR A 76 8.752 0.943 0.464 1.00 0.51 C ATOM 1205 CE1 TYR A 76 10.886 -0.790 0.247 1.00 0.59 C ATOM 1206 CE2 TYR A 76 8.918 -0.068 1.393 1.00 0.57 C ATOM 1207 CZ TYR A 76 9.984 -0.935 1.281 1.00 0.59 C ATOM 1208 OH TYR A 76 10.160 -1.943 2.213 1.00 0.69 O ATOM 0 H TYR A 76 9.349 3.841 -3.501 1.00 0.42 H new ATOM 0 HA TYR A 76 9.737 1.017 -3.373 1.00 0.41 H new ATOM 0 HB2 TYR A 76 10.404 2.806 -1.662 1.00 0.44 H new ATOM 0 HB3 TYR A 76 8.711 2.931 -1.225 1.00 0.44 H new ATOM 0 HD1 TYR A 76 11.432 0.334 -1.482 1.00 0.52 H new ATOM 0 HD2 TYR A 76 7.912 1.615 0.557 1.00 0.51 H new ATOM 0 HE1 TYR A 76 11.722 -1.469 0.159 1.00 0.59 H new ATOM 0 HE2 TYR A 76 8.214 -0.178 2.205 1.00 0.57 H new ATOM 0 HH TYR A 76 9.438 -1.906 2.875 1.00 0.69 H new ATOM 1218 N TRP A 77 6.651 2.012 -3.582 1.00 0.40 N ATOM 1219 CA TRP A 77 5.228 1.601 -3.681 1.00 0.42 C ATOM 1220 C TRP A 77 5.058 0.210 -4.363 1.00 0.37 C ATOM 1221 O TRP A 77 4.087 -0.497 -4.076 1.00 0.39 O ATOM 1222 CB TRP A 77 4.410 2.729 -4.394 1.00 0.58 C ATOM 1223 CG TRP A 77 3.420 2.296 -5.456 1.00 0.49 C ATOM 1224 CD1 TRP A 77 2.115 1.945 -5.269 1.00 0.53 C ATOM 1225 CD2 TRP A 77 3.662 2.190 -6.870 1.00 0.78 C ATOM 1226 NE1 TRP A 77 1.534 1.616 -6.472 1.00 0.77 N ATOM 1227 CE2 TRP A 77 2.463 1.761 -7.470 1.00 0.97 C ATOM 1228 CE3 TRP A 77 4.778 2.415 -7.683 1.00 1.04 C ATOM 1229 CZ2 TRP A 77 2.350 1.552 -8.843 1.00 1.40 C ATOM 1230 CZ3 TRP A 77 4.663 2.207 -9.044 1.00 1.45 C ATOM 1231 CH2 TRP A 77 3.458 1.781 -9.612 1.00 1.62 C ATOM 0 H TRP A 77 6.831 2.941 -3.962 1.00 0.40 H new ATOM 0 HA TRP A 77 4.830 1.473 -2.674 1.00 0.42 H new ATOM 0 HB2 TRP A 77 3.866 3.286 -3.631 1.00 0.58 H new ATOM 0 HB3 TRP A 77 5.116 3.421 -4.852 1.00 0.58 H new ATOM 0 HD1 TRP A 77 1.611 1.928 -4.314 1.00 0.53 H new ATOM 0 HE1 TRP A 77 0.568 1.313 -6.601 1.00 0.77 H new ATOM 0 HE3 TRP A 77 5.713 2.745 -7.254 1.00 1.04 H new ATOM 0 HZ2 TRP A 77 1.421 1.221 -9.284 1.00 1.40 H new ATOM 0 HZ3 TRP A 77 5.519 2.376 -9.681 1.00 1.45 H new ATOM 0 HH2 TRP A 77 3.401 1.630 -10.680 1.00 1.62 H new ATOM 1242 N ARG A 78 6.012 -0.177 -5.252 1.00 0.39 N ATOM 1243 CA ARG A 78 5.977 -1.484 -5.953 1.00 0.42 C ATOM 1244 C ARG A 78 6.061 -2.663 -4.952 1.00 0.40 C ATOM 1245 O ARG A 78 5.447 -3.709 -5.178 1.00 0.45 O ATOM 1246 CB ARG A 78 7.123 -1.587 -6.993 1.00 0.49 C ATOM 1247 CG ARG A 78 7.026 -0.593 -8.162 1.00 0.64 C ATOM 1248 CD ARG A 78 6.033 -1.029 -9.247 1.00 0.82 C ATOM 1249 NE ARG A 78 6.529 -2.164 -10.053 1.00 1.11 N ATOM 1250 CZ ARG A 78 6.741 -2.160 -11.398 1.00 1.57 C ATOM 1251 NH1 ARG A 78 6.450 -1.096 -12.163 1.00 1.96 N ATOM 1252 NH2 ARG A 78 7.229 -3.256 -11.983 1.00 1.93 N ATOM 0 H ARG A 78 6.815 0.401 -5.499 1.00 0.39 H new ATOM 0 HA ARG A 78 5.023 -1.546 -6.477 1.00 0.42 H new ATOM 0 HB2 ARG A 78 8.073 -1.433 -6.482 1.00 0.49 H new ATOM 0 HB3 ARG A 78 7.139 -2.600 -7.396 1.00 0.49 H new ATOM 0 HG2 ARG A 78 6.728 0.382 -7.777 1.00 0.64 H new ATOM 0 HG3 ARG A 78 8.012 -0.471 -8.609 1.00 0.64 H new ATOM 0 HD2 ARG A 78 5.089 -1.307 -8.779 1.00 0.82 H new ATOM 0 HD3 ARG A 78 5.826 -0.185 -9.905 1.00 0.82 H new ATOM 0 HE ARG A 78 6.731 -3.031 -9.555 1.00 1.11 H new ATOM 0 HH11 ARG A 78 6.057 -0.255 -11.739 1.00 1.96 H new ATOM 0 HH12 ARG A 78 6.622 -1.128 -13.168 1.00 1.96 H new ATOM 0 HH21 ARG A 78 7.438 -4.083 -11.423 1.00 1.93 H new ATOM 0 HH22 ARG A 78 7.393 -3.267 -12.990 1.00 1.93 H new ATOM 1266 N LEU A 79 6.822 -2.483 -3.845 1.00 0.37 N ATOM 1267 CA LEU A 79 6.958 -3.520 -2.803 1.00 0.37 C ATOM 1268 C LEU A 79 5.851 -3.367 -1.741 1.00 0.36 C ATOM 1269 O LEU A 79 5.453 -4.360 -1.130 1.00 0.39 O ATOM 1270 CB LEU A 79 8.357 -3.475 -2.146 1.00 0.40 C ATOM 1271 CG LEU A 79 8.729 -4.687 -1.255 1.00 0.44 C ATOM 1272 CD1 LEU A 79 8.877 -5.964 -2.089 1.00 0.49 C ATOM 1273 CD2 LEU A 79 10.015 -4.413 -0.471 1.00 0.53 C ATOM 0 H LEU A 79 7.348 -1.630 -3.655 1.00 0.37 H new ATOM 0 HA LEU A 79 6.847 -4.493 -3.281 1.00 0.37 H new ATOM 0 HB2 LEU A 79 9.104 -3.386 -2.935 1.00 0.40 H new ATOM 0 HB3 LEU A 79 8.423 -2.571 -1.541 1.00 0.40 H new ATOM 0 HG LEU A 79 7.915 -4.836 -0.546 1.00 0.44 H new ATOM 0 HD11 LEU A 79 9.138 -6.797 -1.436 1.00 0.49 H new ATOM 0 HD12 LEU A 79 7.935 -6.180 -2.594 1.00 0.49 H new ATOM 0 HD13 LEU A 79 9.663 -5.825 -2.831 1.00 0.49 H new ATOM 0 HD21 LEU A 79 10.256 -5.278 0.147 1.00 0.53 H new ATOM 0 HD22 LEU A 79 10.833 -4.226 -1.167 1.00 0.53 H new ATOM 0 HD23 LEU A 79 9.874 -3.540 0.166 1.00 0.53 H new ATOM 1285 N ILE A 80 5.360 -2.118 -1.526 1.00 0.38 N ATOM 1286 CA ILE A 80 4.271 -1.837 -0.558 1.00 0.41 C ATOM 1287 C ILE A 80 2.992 -2.622 -0.939 1.00 0.40 C ATOM 1288 O ILE A 80 2.273 -3.095 -0.052 1.00 0.43 O ATOM 1289 CB ILE A 80 3.973 -0.295 -0.463 1.00 0.49 C ATOM 1290 CG1 ILE A 80 5.187 0.467 0.136 1.00 0.53 C ATOM 1291 CG2 ILE A 80 2.691 0.016 0.333 1.00 0.59 C ATOM 1292 CD1 ILE A 80 5.455 0.210 1.617 1.00 0.61 C ATOM 0 H ILE A 80 5.703 -1.290 -2.012 1.00 0.38 H new ATOM 0 HA ILE A 80 4.602 -2.170 0.426 1.00 0.41 H new ATOM 0 HB ILE A 80 3.805 0.053 -1.482 1.00 0.49 H new ATOM 0 HG12 ILE A 80 6.079 0.197 -0.429 1.00 0.53 H new ATOM 0 HG13 ILE A 80 5.030 1.536 -0.007 1.00 0.53 H new ATOM 0 HG21 ILE A 80 2.536 1.094 0.366 1.00 0.59 H new ATOM 0 HG22 ILE A 80 1.838 -0.459 -0.151 1.00 0.59 H new ATOM 0 HG23 ILE A 80 2.791 -0.367 1.349 1.00 0.59 H new ATOM 0 HD11 ILE A 80 6.322 0.789 1.936 1.00 0.61 H new ATOM 0 HD12 ILE A 80 4.585 0.509 2.201 1.00 0.61 H new ATOM 0 HD13 ILE A 80 5.650 -0.851 1.773 1.00 0.61 H new ATOM 1304 N GLY A 81 2.715 -2.747 -2.258 1.00 0.40 N ATOM 1305 CA GLY A 81 1.560 -3.514 -2.727 1.00 0.44 C ATOM 1306 C GLY A 81 1.718 -5.000 -2.435 1.00 0.41 C ATOM 1307 O GLY A 81 0.778 -5.640 -1.961 1.00 0.47 O ATOM 0 H GLY A 81 3.274 -2.328 -3.001 1.00 0.40 H new ATOM 0 HA2 GLY A 81 0.656 -3.142 -2.245 1.00 0.44 H new ATOM 0 HA3 GLY A 81 1.434 -3.365 -3.799 1.00 0.44 H new ATOM 1311 N GLU A 82 2.923 -5.545 -2.716 1.00 0.38 N ATOM 1312 CA GLU A 82 3.242 -6.965 -2.448 1.00 0.38 C ATOM 1313 C GLU A 82 3.352 -7.238 -0.929 1.00 0.36 C ATOM 1314 O GLU A 82 3.185 -8.377 -0.492 1.00 0.42 O ATOM 1315 CB GLU A 82 4.559 -7.376 -3.148 1.00 0.43 C ATOM 1316 CG GLU A 82 4.512 -7.321 -4.677 1.00 0.51 C ATOM 1317 CD GLU A 82 3.658 -8.421 -5.291 1.00 0.62 C ATOM 1318 OE1 GLU A 82 2.439 -8.206 -5.451 1.00 0.86 O ATOM 1319 OE2 GLU A 82 4.211 -9.495 -5.607 1.00 0.83 O ATOM 0 H GLU A 82 3.693 -5.020 -3.130 1.00 0.38 H new ATOM 0 HA GLU A 82 2.425 -7.563 -2.851 1.00 0.38 H new ATOM 0 HB2 GLU A 82 5.360 -6.724 -2.799 1.00 0.43 H new ATOM 0 HB3 GLU A 82 4.817 -8.390 -2.842 1.00 0.43 H new ATOM 0 HG2 GLU A 82 4.122 -6.352 -4.987 1.00 0.51 H new ATOM 0 HG3 GLU A 82 5.527 -7.397 -5.068 1.00 0.51 H new ATOM 1326 N LEU A 83 3.628 -6.179 -0.138 1.00 0.36 N ATOM 1327 CA LEU A 83 3.751 -6.272 1.329 1.00 0.39 C ATOM 1328 C LEU A 83 2.402 -6.650 1.974 1.00 0.40 C ATOM 1329 O LEU A 83 2.347 -7.505 2.854 1.00 0.49 O ATOM 1330 CB LEU A 83 4.256 -4.915 1.889 1.00 0.44 C ATOM 1331 CG LEU A 83 4.883 -4.929 3.302 1.00 0.49 C ATOM 1332 CD1 LEU A 83 6.202 -5.702 3.315 1.00 0.67 C ATOM 1333 CD2 LEU A 83 5.101 -3.498 3.805 1.00 0.61 C ATOM 0 H LEU A 83 3.771 -5.236 -0.500 1.00 0.36 H new ATOM 0 HA LEU A 83 4.468 -7.056 1.573 1.00 0.39 H new ATOM 0 HB2 LEU A 83 4.995 -4.516 1.194 1.00 0.44 H new ATOM 0 HB3 LEU A 83 3.417 -4.219 1.897 1.00 0.44 H new ATOM 0 HG LEU A 83 4.188 -5.436 3.971 1.00 0.49 H new ATOM 0 HD11 LEU A 83 6.618 -5.694 4.322 1.00 0.67 H new ATOM 0 HD12 LEU A 83 6.024 -6.731 3.004 1.00 0.67 H new ATOM 0 HD13 LEU A 83 6.906 -5.232 2.628 1.00 0.67 H new ATOM 0 HD21 LEU A 83 5.543 -3.526 4.801 1.00 0.61 H new ATOM 0 HD22 LEU A 83 5.771 -2.971 3.125 1.00 0.61 H new ATOM 0 HD23 LEU A 83 4.144 -2.977 3.847 1.00 0.61 H new ATOM 1345 N ALA A 84 1.316 -6.017 1.502 1.00 0.39 N ATOM 1346 CA ALA A 84 -0.038 -6.265 2.020 1.00 0.45 C ATOM 1347 C ALA A 84 -0.805 -7.330 1.202 1.00 0.45 C ATOM 1348 O ALA A 84 -1.789 -7.889 1.699 1.00 0.55 O ATOM 1349 CB ALA A 84 -0.799 -4.949 2.065 1.00 0.54 C ATOM 0 H ALA A 84 1.352 -5.323 0.755 1.00 0.39 H new ATOM 0 HA ALA A 84 0.052 -6.673 3.027 1.00 0.45 H new ATOM 0 HB1 ALA A 84 -1.805 -5.123 2.448 1.00 0.54 H new ATOM 0 HB2 ALA A 84 -0.278 -4.249 2.719 1.00 0.54 H new ATOM 0 HB3 ALA A 84 -0.861 -4.530 1.061 1.00 0.54 H new ATOM 1355 N LYS A 85 -0.358 -7.612 -0.045 1.00 0.42 N ATOM 1356 CA LYS A 85 -1.003 -8.627 -0.908 1.00 0.46 C ATOM 1357 C LYS A 85 -0.599 -10.053 -0.473 1.00 0.47 C ATOM 1358 O LYS A 85 -1.464 -10.913 -0.296 1.00 0.55 O ATOM 1359 CB LYS A 85 -0.627 -8.399 -2.397 1.00 0.49 C ATOM 1360 CG LYS A 85 -1.417 -9.256 -3.401 1.00 0.59 C ATOM 1361 CD LYS A 85 -0.796 -9.254 -4.807 1.00 0.64 C ATOM 1362 CE LYS A 85 -0.985 -7.919 -5.536 1.00 0.69 C ATOM 1363 NZ LYS A 85 -0.419 -7.941 -6.920 1.00 0.96 N ATOM 0 H LYS A 85 0.445 -7.151 -0.474 1.00 0.42 H new ATOM 0 HA LYS A 85 -2.083 -8.523 -0.800 1.00 0.46 H new ATOM 0 HB2 LYS A 85 -0.781 -7.347 -2.639 1.00 0.49 H new ATOM 0 HB3 LYS A 85 0.436 -8.603 -2.524 1.00 0.49 H new ATOM 0 HG2 LYS A 85 -1.470 -10.281 -3.034 1.00 0.59 H new ATOM 0 HG3 LYS A 85 -2.441 -8.886 -3.461 1.00 0.59 H new ATOM 0 HD2 LYS A 85 0.269 -9.473 -4.730 1.00 0.64 H new ATOM 0 HD3 LYS A 85 -1.244 -10.053 -5.398 1.00 0.64 H new ATOM 0 HE2 LYS A 85 -2.048 -7.682 -5.585 1.00 0.69 H new ATOM 0 HE3 LYS A 85 -0.507 -7.124 -4.963 1.00 0.69 H new ATOM 0 HZ1 LYS A 85 -0.702 -7.077 -7.425 1.00 0.96 H new ATOM 0 HZ2 LYS A 85 0.619 -7.988 -6.870 1.00 0.96 H new ATOM 0 HZ3 LYS A 85 -0.779 -8.773 -7.429 1.00 0.96 H new ATOM 1377 N GLU A 86 0.722 -10.279 -0.282 1.00 0.42 N ATOM 1378 CA GLU A 86 1.262 -11.601 0.107 1.00 0.46 C ATOM 1379 C GLU A 86 0.711 -12.118 1.457 1.00 0.52 C ATOM 1380 O GLU A 86 0.576 -13.327 1.624 1.00 0.92 O ATOM 1381 CB GLU A 86 2.807 -11.582 0.148 1.00 0.49 C ATOM 1382 CG GLU A 86 3.486 -11.366 -1.213 1.00 0.55 C ATOM 1383 CD GLU A 86 3.387 -12.571 -2.137 1.00 1.03 C ATOM 1384 OE1 GLU A 86 2.408 -12.652 -2.907 1.00 1.65 O ATOM 1385 OE2 GLU A 86 4.295 -13.430 -2.091 1.00 1.52 O ATOM 0 H GLU A 86 1.435 -9.558 -0.392 1.00 0.42 H new ATOM 0 HA GLU A 86 0.924 -12.293 -0.664 1.00 0.46 H new ATOM 0 HB2 GLU A 86 3.129 -10.793 0.828 1.00 0.49 H new ATOM 0 HB3 GLU A 86 3.157 -12.526 0.567 1.00 0.49 H new ATOM 0 HG2 GLU A 86 3.034 -10.504 -1.703 1.00 0.55 H new ATOM 0 HG3 GLU A 86 4.537 -11.126 -1.052 1.00 0.55 H new ATOM 1392 N ILE A 87 0.377 -11.223 2.411 1.00 0.44 N ATOM 1393 CA ILE A 87 -0.154 -11.657 3.729 1.00 0.47 C ATOM 1394 C ILE A 87 -1.486 -12.444 3.576 1.00 0.51 C ATOM 1395 O ILE A 87 -1.702 -13.437 4.277 1.00 0.61 O ATOM 1396 CB ILE A 87 -0.291 -10.440 4.727 1.00 0.51 C ATOM 1397 CG1 ILE A 87 0.113 -10.840 6.180 1.00 0.59 C ATOM 1398 CG2 ILE A 87 -1.673 -9.761 4.682 1.00 0.55 C ATOM 1399 CD1 ILE A 87 -0.856 -11.739 6.929 1.00 0.66 C ATOM 0 H ILE A 87 0.462 -10.213 2.301 1.00 0.44 H new ATOM 0 HA ILE A 87 0.570 -12.344 4.166 1.00 0.47 H new ATOM 0 HB ILE A 87 0.417 -9.688 4.380 1.00 0.51 H new ATOM 0 HG12 ILE A 87 1.081 -11.340 6.140 1.00 0.59 H new ATOM 0 HG13 ILE A 87 0.250 -9.927 6.760 1.00 0.59 H new ATOM 0 HG21 ILE A 87 -1.696 -8.935 5.392 1.00 0.55 H new ATOM 0 HG22 ILE A 87 -1.859 -9.381 3.677 1.00 0.55 H new ATOM 0 HG23 ILE A 87 -2.443 -10.486 4.944 1.00 0.55 H new ATOM 0 HD11 ILE A 87 -0.465 -11.946 7.925 1.00 0.66 H new ATOM 0 HD12 ILE A 87 -1.822 -11.241 7.015 1.00 0.66 H new ATOM 0 HD13 ILE A 87 -0.978 -12.676 6.385 1.00 0.66 H new ATOM 1411 N ARG A 88 -2.356 -12.008 2.639 1.00 0.54 N ATOM 1412 CA ARG A 88 -3.647 -12.676 2.386 1.00 0.68 C ATOM 1413 C ARG A 88 -3.622 -13.568 1.114 1.00 0.68 C ATOM 1414 O ARG A 88 -4.676 -14.035 0.673 1.00 0.87 O ATOM 1415 CB ARG A 88 -4.791 -11.636 2.325 1.00 0.83 C ATOM 1416 CG ARG A 88 -4.711 -10.614 1.184 1.00 0.91 C ATOM 1417 CD ARG A 88 -5.742 -9.498 1.363 1.00 1.05 C ATOM 1418 NE ARG A 88 -6.110 -8.839 0.099 1.00 1.18 N ATOM 1419 CZ ARG A 88 -7.016 -7.845 -0.008 1.00 1.39 C ATOM 1420 NH1 ARG A 88 -7.662 -7.370 1.067 1.00 1.74 N ATOM 1421 NH2 ARG A 88 -7.284 -7.328 -1.205 1.00 1.73 N ATOM 0 H ARG A 88 -2.185 -11.196 2.046 1.00 0.54 H new ATOM 0 HA ARG A 88 -3.832 -13.348 3.224 1.00 0.68 H new ATOM 0 HB2 ARG A 88 -5.737 -12.171 2.241 1.00 0.83 H new ATOM 0 HB3 ARG A 88 -4.813 -11.094 3.271 1.00 0.83 H new ATOM 0 HG2 ARG A 88 -3.710 -10.184 1.147 1.00 0.91 H new ATOM 0 HG3 ARG A 88 -4.877 -11.116 0.231 1.00 0.91 H new ATOM 0 HD2 ARG A 88 -6.639 -9.912 1.824 1.00 1.05 H new ATOM 0 HD3 ARG A 88 -5.345 -8.752 2.052 1.00 1.05 H new ATOM 0 HE ARG A 88 -5.649 -9.155 -0.754 1.00 1.18 H new ATOM 0 HH11 ARG A 88 -7.472 -7.761 1.990 1.00 1.74 H new ATOM 0 HH12 ARG A 88 -8.343 -6.618 0.962 1.00 1.74 H new ATOM 0 HH21 ARG A 88 -6.806 -7.684 -2.033 1.00 1.73 H new ATOM 0 HH22 ARG A 88 -7.968 -6.576 -1.294 1.00 1.73 H new ATOM 1435 N LYS A 89 -2.416 -13.799 0.530 1.00 0.58 N ATOM 1436 CA LYS A 89 -2.240 -14.654 -0.671 1.00 0.64 C ATOM 1437 C LYS A 89 -0.751 -14.719 -1.103 1.00 0.58 C ATOM 1438 O LYS A 89 -0.388 -14.267 -2.197 1.00 0.69 O ATOM 1439 CB LYS A 89 -3.138 -14.198 -1.859 1.00 0.76 C ATOM 1440 CG LYS A 89 -3.054 -12.703 -2.203 1.00 0.77 C ATOM 1441 CD LYS A 89 -3.683 -12.371 -3.562 1.00 1.00 C ATOM 1442 CE LYS A 89 -2.745 -12.676 -4.733 1.00 1.22 C ATOM 1443 NZ LYS A 89 -3.281 -12.169 -6.029 1.00 1.52 N ATOM 0 H LYS A 89 -1.544 -13.399 0.878 1.00 0.58 H new ATOM 0 HA LYS A 89 -2.561 -15.657 -0.389 1.00 0.64 H new ATOM 0 HB2 LYS A 89 -2.865 -14.774 -2.743 1.00 0.76 H new ATOM 0 HB3 LYS A 89 -4.174 -14.444 -1.626 1.00 0.76 H new ATOM 0 HG2 LYS A 89 -3.555 -12.127 -1.425 1.00 0.77 H new ATOM 0 HG3 LYS A 89 -2.009 -12.393 -2.206 1.00 0.77 H new ATOM 0 HD2 LYS A 89 -4.605 -12.941 -3.681 1.00 1.00 H new ATOM 0 HD3 LYS A 89 -3.956 -11.316 -3.584 1.00 1.00 H new ATOM 0 HE2 LYS A 89 -1.771 -12.225 -4.543 1.00 1.22 H new ATOM 0 HE3 LYS A 89 -2.590 -13.753 -4.802 1.00 1.22 H new ATOM 0 HZ1 LYS A 89 -2.614 -12.397 -6.794 1.00 1.52 H new ATOM 0 HZ2 LYS A 89 -4.199 -12.618 -6.224 1.00 1.52 H new ATOM 0 HZ3 LYS A 89 -3.405 -11.138 -5.974 1.00 1.52 H new ATOM 1457 N LYS A 90 0.112 -15.289 -0.233 1.00 0.56 N ATOM 1458 CA LYS A 90 1.558 -15.417 -0.541 1.00 0.55 C ATOM 1459 C LYS A 90 1.819 -16.594 -1.496 1.00 0.55 C ATOM 1460 O LYS A 90 2.616 -16.471 -2.432 1.00 0.60 O ATOM 1461 CB LYS A 90 2.429 -15.553 0.736 1.00 0.61 C ATOM 1462 CG LYS A 90 2.002 -16.640 1.752 1.00 0.71 C ATOM 1463 CD LYS A 90 1.389 -16.075 3.049 1.00 0.97 C ATOM 1464 CE LYS A 90 2.361 -15.210 3.868 1.00 1.39 C ATOM 1465 NZ LYS A 90 3.660 -15.895 4.152 1.00 1.87 N ATOM 0 H LYS A 90 -0.160 -15.664 0.676 1.00 0.56 H new ATOM 0 HA LYS A 90 1.852 -14.491 -1.036 1.00 0.55 H new ATOM 0 HB2 LYS A 90 3.455 -15.757 0.429 1.00 0.61 H new ATOM 0 HB3 LYS A 90 2.435 -14.591 1.248 1.00 0.61 H new ATOM 0 HG2 LYS A 90 1.278 -17.303 1.278 1.00 0.71 H new ATOM 0 HG3 LYS A 90 2.871 -17.247 2.007 1.00 0.71 H new ATOM 0 HD2 LYS A 90 0.512 -15.479 2.796 1.00 0.97 H new ATOM 0 HD3 LYS A 90 1.044 -16.903 3.668 1.00 0.97 H new ATOM 0 HE2 LYS A 90 2.556 -14.283 3.328 1.00 1.39 H new ATOM 0 HE3 LYS A 90 1.888 -14.936 4.811 1.00 1.39 H new ATOM 0 HZ1 LYS A 90 4.259 -15.276 4.735 1.00 1.87 H new ATOM 0 HZ2 LYS A 90 3.480 -16.783 4.662 1.00 1.87 H new ATOM 0 HZ3 LYS A 90 4.146 -16.103 3.256 1.00 1.87 H new ATOM 1479 N LYS A 91 1.142 -17.726 -1.243 1.00 0.57 N ATOM 1480 CA LYS A 91 1.256 -18.933 -2.065 1.00 0.64 C ATOM 1481 C LYS A 91 -0.158 -19.378 -2.475 1.00 0.69 C ATOM 1482 O LYS A 91 -0.638 -20.432 -2.043 1.00 0.71 O ATOM 1483 CB LYS A 91 1.982 -20.061 -1.294 1.00 0.72 C ATOM 1484 CG LYS A 91 3.444 -19.769 -0.961 1.00 0.85 C ATOM 1485 CD LYS A 91 4.074 -20.898 -0.137 1.00 0.97 C ATOM 1486 CE LYS A 91 5.539 -20.623 0.205 1.00 1.29 C ATOM 1487 NZ LYS A 91 6.462 -20.884 -0.943 1.00 1.53 N ATOM 0 H LYS A 91 0.498 -17.826 -0.458 1.00 0.57 H new ATOM 0 HA LYS A 91 1.848 -18.715 -2.954 1.00 0.64 H new ATOM 0 HB2 LYS A 91 1.444 -20.253 -0.366 1.00 0.72 H new ATOM 0 HB3 LYS A 91 1.934 -20.976 -1.885 1.00 0.72 H new ATOM 0 HG2 LYS A 91 4.008 -19.634 -1.884 1.00 0.85 H new ATOM 0 HG3 LYS A 91 3.511 -18.833 -0.407 1.00 0.85 H new ATOM 0 HD2 LYS A 91 3.507 -21.031 0.785 1.00 0.97 H new ATOM 0 HD3 LYS A 91 4.003 -21.833 -0.693 1.00 0.97 H new ATOM 0 HE2 LYS A 91 5.645 -19.585 0.521 1.00 1.29 H new ATOM 0 HE3 LYS A 91 5.833 -21.245 1.050 1.00 1.29 H new ATOM 0 HZ1 LYS A 91 7.436 -20.649 -0.665 1.00 1.53 H new ATOM 0 HZ2 LYS A 91 6.410 -21.888 -1.209 1.00 1.53 H new ATOM 0 HZ3 LYS A 91 6.182 -20.296 -1.754 1.00 1.53 H new ATOM 1501 N ASP A 92 -0.835 -18.540 -3.295 1.00 0.78 N ATOM 1502 CA ASP A 92 -2.211 -18.826 -3.768 1.00 0.87 C ATOM 1503 C ASP A 92 -2.226 -19.967 -4.816 1.00 1.03 C ATOM 1504 O ASP A 92 -2.519 -19.749 -5.999 1.00 1.81 O ATOM 1505 CB ASP A 92 -2.902 -17.537 -4.300 1.00 0.89 C ATOM 1506 CG ASP A 92 -2.114 -16.801 -5.380 1.00 0.98 C ATOM 1507 OD1 ASP A 92 -1.189 -16.040 -5.024 1.00 1.01 O ATOM 1508 OD2 ASP A 92 -2.429 -16.980 -6.575 1.00 1.18 O ATOM 0 H ASP A 92 -0.451 -17.661 -3.643 1.00 0.78 H new ATOM 0 HA ASP A 92 -2.791 -19.174 -2.913 1.00 0.87 H new ATOM 0 HB2 ASP A 92 -3.881 -17.802 -4.698 1.00 0.89 H new ATOM 0 HB3 ASP A 92 -3.071 -16.858 -3.464 1.00 0.89 H new ATOM 1513 N LEU A 93 -1.906 -21.193 -4.344 1.00 0.67 N ATOM 1514 CA LEU A 93 -1.852 -22.411 -5.182 1.00 0.70 C ATOM 1515 C LEU A 93 -1.644 -23.658 -4.288 1.00 0.70 C ATOM 1516 O LEU A 93 -2.359 -24.655 -4.432 1.00 0.79 O ATOM 1517 CB LEU A 93 -0.721 -22.318 -6.243 1.00 0.77 C ATOM 1518 CG LEU A 93 -0.938 -23.130 -7.545 1.00 0.97 C ATOM 1519 CD1 LEU A 93 -2.062 -22.527 -8.396 1.00 1.24 C ATOM 1520 CD2 LEU A 93 0.360 -23.215 -8.354 1.00 1.15 C ATOM 0 H LEU A 93 -1.677 -21.365 -3.365 1.00 0.67 H new ATOM 0 HA LEU A 93 -2.801 -22.500 -5.711 1.00 0.70 H new ATOM 0 HB2 LEU A 93 -0.587 -21.270 -6.511 1.00 0.77 H new ATOM 0 HB3 LEU A 93 0.209 -22.650 -5.783 1.00 0.77 H new ATOM 0 HG LEU A 93 -1.236 -24.139 -7.260 1.00 0.97 H new ATOM 0 HD11 LEU A 93 -2.190 -23.119 -9.302 1.00 1.24 H new ATOM 0 HD12 LEU A 93 -2.991 -22.530 -7.826 1.00 1.24 H new ATOM 0 HD13 LEU A 93 -1.805 -21.502 -8.665 1.00 1.24 H new ATOM 0 HD21 LEU A 93 0.185 -23.789 -9.264 1.00 1.15 H new ATOM 0 HD22 LEU A 93 0.691 -22.210 -8.617 1.00 1.15 H new ATOM 0 HD23 LEU A 93 1.129 -23.706 -7.758 1.00 1.15 H new ATOM 1532 N LYS A 94 -0.651 -23.582 -3.368 1.00 0.70 N ATOM 1533 CA LYS A 94 -0.336 -24.678 -2.428 1.00 0.77 C ATOM 1534 C LYS A 94 -1.189 -24.559 -1.142 1.00 0.71 C ATOM 1535 O LYS A 94 -1.885 -25.511 -0.770 1.00 0.77 O ATOM 1536 CB LYS A 94 1.179 -24.661 -2.089 1.00 0.92 C ATOM 1537 CG LYS A 94 1.709 -25.959 -1.466 1.00 1.09 C ATOM 1538 CD LYS A 94 1.937 -27.062 -2.510 1.00 1.23 C ATOM 1539 CE LYS A 94 1.583 -28.456 -1.987 1.00 1.57 C ATOM 1540 NZ LYS A 94 0.108 -28.672 -1.890 1.00 1.73 N ATOM 0 H LYS A 94 -0.052 -22.764 -3.260 1.00 0.70 H new ATOM 0 HA LYS A 94 -0.579 -25.629 -2.902 1.00 0.77 H new ATOM 0 HB2 LYS A 94 1.740 -24.456 -3.001 1.00 0.92 H new ATOM 0 HB3 LYS A 94 1.375 -23.837 -1.402 1.00 0.92 H new ATOM 0 HG2 LYS A 94 2.646 -25.754 -0.949 1.00 1.09 H new ATOM 0 HG3 LYS A 94 1.002 -26.314 -0.716 1.00 1.09 H new ATOM 0 HD2 LYS A 94 1.338 -26.848 -3.395 1.00 1.23 H new ATOM 0 HD3 LYS A 94 2.981 -27.050 -2.822 1.00 1.23 H new ATOM 0 HE2 LYS A 94 2.015 -29.209 -2.647 1.00 1.57 H new ATOM 0 HE3 LYS A 94 2.033 -28.597 -1.004 1.00 1.57 H new ATOM 0 HZ1 LYS A 94 -0.080 -29.630 -1.531 1.00 1.73 H new ATOM 0 HZ2 LYS A 94 -0.303 -27.972 -1.240 1.00 1.73 H new ATOM 0 HZ3 LYS A 94 -0.321 -28.565 -2.831 1.00 1.73 H new ATOM 1554 N ILE A 95 -1.123 -23.383 -0.472 1.00 0.68 N ATOM 1555 CA ILE A 95 -1.893 -23.110 0.764 1.00 0.67 C ATOM 1556 C ILE A 95 -2.911 -21.981 0.514 1.00 0.67 C ATOM 1557 O ILE A 95 -2.588 -20.996 -0.156 1.00 0.77 O ATOM 1558 CB ILE A 95 -0.961 -22.733 1.977 1.00 0.75 C ATOM 1559 CG1 ILE A 95 0.064 -21.623 1.599 1.00 0.87 C ATOM 1560 CG2 ILE A 95 -0.246 -23.983 2.510 1.00 0.85 C ATOM 1561 CD1 ILE A 95 0.782 -20.983 2.781 1.00 1.06 C ATOM 0 H ILE A 95 -0.538 -22.603 -0.771 1.00 0.68 H new ATOM 0 HA ILE A 95 -2.418 -24.028 1.028 1.00 0.67 H new ATOM 0 HB ILE A 95 -1.593 -22.328 2.767 1.00 0.75 H new ATOM 0 HG12 ILE A 95 0.809 -22.050 0.928 1.00 0.87 H new ATOM 0 HG13 ILE A 95 -0.456 -20.843 1.043 1.00 0.87 H new ATOM 0 HG21 ILE A 95 0.394 -23.707 3.348 1.00 0.85 H new ATOM 0 HG22 ILE A 95 -0.986 -24.711 2.843 1.00 0.85 H new ATOM 0 HG23 ILE A 95 0.362 -24.420 1.718 1.00 0.85 H new ATOM 0 HD11 ILE A 95 1.474 -20.223 2.418 1.00 1.06 H new ATOM 0 HD12 ILE A 95 0.051 -20.521 3.444 1.00 1.06 H new ATOM 0 HD13 ILE A 95 1.335 -21.747 3.327 1.00 1.06 H new ATOM 1573 N ARG A 96 -4.141 -22.126 1.048 1.00 0.71 N ATOM 1574 CA ARG A 96 -5.202 -21.112 0.863 1.00 0.77 C ATOM 1575 C ARG A 96 -6.084 -20.947 2.125 1.00 0.77 C ATOM 1576 O ARG A 96 -7.301 -20.741 2.017 1.00 0.93 O ATOM 1577 CB ARG A 96 -6.061 -21.466 -0.376 1.00 0.93 C ATOM 1578 CG ARG A 96 -6.737 -22.846 -0.317 1.00 1.05 C ATOM 1579 CD ARG A 96 -7.680 -23.093 -1.495 1.00 1.26 C ATOM 1580 NE ARG A 96 -8.861 -22.201 -1.481 1.00 1.40 N ATOM 1581 CZ ARG A 96 -10.123 -22.545 -1.831 1.00 1.83 C ATOM 1582 NH1 ARG A 96 -10.424 -23.782 -2.263 1.00 2.26 N ATOM 1583 NH2 ARG A 96 -11.091 -21.632 -1.760 1.00 2.18 N ATOM 0 H ARG A 96 -4.424 -22.930 1.608 1.00 0.71 H new ATOM 0 HA ARG A 96 -4.717 -20.150 0.696 1.00 0.77 H new ATOM 0 HB2 ARG A 96 -6.831 -20.704 -0.497 1.00 0.93 H new ATOM 0 HB3 ARG A 96 -5.429 -21.424 -1.263 1.00 0.93 H new ATOM 0 HG2 ARG A 96 -5.971 -23.621 -0.302 1.00 1.05 H new ATOM 0 HG3 ARG A 96 -7.296 -22.932 0.615 1.00 1.05 H new ATOM 0 HD2 ARG A 96 -7.134 -22.951 -2.428 1.00 1.26 H new ATOM 0 HD3 ARG A 96 -8.014 -24.130 -1.476 1.00 1.26 H new ATOM 0 HE ARG A 96 -8.710 -21.238 -1.180 1.00 1.40 H new ATOM 0 HH11 ARG A 96 -9.693 -24.489 -2.334 1.00 2.26 H new ATOM 0 HH12 ARG A 96 -11.384 -24.013 -2.520 1.00 2.26 H new ATOM 0 HH21 ARG A 96 -10.877 -20.686 -1.445 1.00 2.18 H new ATOM 0 HH22 ARG A 96 -12.045 -21.879 -2.021 1.00 2.18 H new ATOM 1597 N LYS A 97 -5.463 -21.019 3.322 1.00 0.72 N ATOM 1598 CA LYS A 97 -6.190 -20.864 4.601 1.00 0.75 C ATOM 1599 C LYS A 97 -5.216 -20.663 5.784 1.00 0.74 C ATOM 1600 O LYS A 97 -4.763 -21.635 6.398 1.00 0.95 O ATOM 1601 CB LYS A 97 -7.136 -22.068 4.866 1.00 0.87 C ATOM 1602 CG LYS A 97 -6.518 -23.449 4.605 1.00 0.94 C ATOM 1603 CD LYS A 97 -7.448 -24.598 5.018 1.00 1.10 C ATOM 1604 CE LYS A 97 -7.183 -25.098 6.444 1.00 1.36 C ATOM 1605 NZ LYS A 97 -7.626 -24.131 7.492 1.00 1.74 N ATOM 0 H LYS A 97 -4.462 -21.183 3.429 1.00 0.72 H new ATOM 0 HA LYS A 97 -6.804 -19.967 4.516 1.00 0.75 H new ATOM 0 HB2 LYS A 97 -7.471 -22.026 5.903 1.00 0.87 H new ATOM 0 HB3 LYS A 97 -8.022 -21.959 4.240 1.00 0.87 H new ATOM 0 HG2 LYS A 97 -6.280 -23.542 3.545 1.00 0.94 H new ATOM 0 HG3 LYS A 97 -5.579 -23.532 5.152 1.00 0.94 H new ATOM 0 HD2 LYS A 97 -8.483 -24.266 4.941 1.00 1.10 H new ATOM 0 HD3 LYS A 97 -7.326 -25.426 4.320 1.00 1.10 H new ATOM 0 HE2 LYS A 97 -7.698 -26.047 6.592 1.00 1.36 H new ATOM 0 HE3 LYS A 97 -6.117 -25.292 6.563 1.00 1.36 H new ATOM 0 HZ1 LYS A 97 -7.661 -24.611 8.414 1.00 1.74 H new ATOM 0 HZ2 LYS A 97 -6.954 -23.338 7.539 1.00 1.74 H new ATOM 0 HZ3 LYS A 97 -8.572 -23.770 7.253 1.00 1.74 H new ATOM 1619 N LYS A 98 -4.888 -19.390 6.090 1.00 0.69 N ATOM 1620 CA LYS A 98 -3.973 -19.056 7.198 1.00 0.72 C ATOM 1621 C LYS A 98 -4.284 -17.660 7.753 1.00 0.76 C ATOM 1622 O LYS A 98 -4.715 -17.514 8.894 1.00 0.98 O ATOM 1623 CB LYS A 98 -2.499 -19.150 6.738 1.00 0.88 C ATOM 1624 CG LYS A 98 -1.494 -19.275 7.888 1.00 1.04 C ATOM 1625 CD LYS A 98 -0.051 -19.411 7.397 1.00 1.35 C ATOM 1626 CE LYS A 98 0.913 -19.770 8.534 1.00 1.61 C ATOM 1627 NZ LYS A 98 0.788 -21.199 8.963 1.00 1.71 N ATOM 0 H LYS A 98 -5.244 -18.578 5.585 1.00 0.69 H new ATOM 0 HA LYS A 98 -4.124 -19.781 7.998 1.00 0.72 H new ATOM 0 HB2 LYS A 98 -2.389 -20.011 6.078 1.00 0.88 H new ATOM 0 HB3 LYS A 98 -2.255 -18.265 6.151 1.00 0.88 H new ATOM 0 HG2 LYS A 98 -1.574 -18.399 8.532 1.00 1.04 H new ATOM 0 HG3 LYS A 98 -1.750 -20.142 8.497 1.00 1.04 H new ATOM 0 HD2 LYS A 98 -0.002 -20.179 6.625 1.00 1.35 H new ATOM 0 HD3 LYS A 98 0.265 -18.475 6.936 1.00 1.35 H new ATOM 0 HE2 LYS A 98 1.937 -19.579 8.212 1.00 1.61 H new ATOM 0 HE3 LYS A 98 0.721 -19.120 9.388 1.00 1.61 H new ATOM 0 HZ1 LYS A 98 1.472 -21.395 9.721 1.00 1.71 H new ATOM 0 HZ2 LYS A 98 -0.176 -21.373 9.313 1.00 1.71 H new ATOM 0 HZ3 LYS A 98 0.981 -21.823 8.153 1.00 1.71 H new TER 1641 LYS A 98 ATOM 1642 N MET B 1 -5.061 -17.792 2.905 1.00 0.85 N ATOM 1643 CA MET B 1 -5.540 -16.624 2.163 1.00 0.86 C ATOM 1644 C MET B 1 -6.093 -15.516 3.095 1.00 0.76 C ATOM 1645 O MET B 1 -6.561 -14.481 2.609 1.00 0.93 O ATOM 1646 CB MET B 1 -6.606 -17.057 1.127 1.00 1.04 C ATOM 1647 CG MET B 1 -7.915 -17.575 1.734 1.00 1.09 C ATOM 1648 SD MET B 1 -9.094 -18.163 0.501 1.00 1.44 S ATOM 1649 CE MET B 1 -10.499 -18.546 1.546 1.00 1.75 C ATOM 0 H1 MET B 1 -4.780 -18.537 2.236 1.00 0.85 H new ATOM 0 H2 MET B 1 -4.242 -17.522 3.486 1.00 0.85 H new ATOM 0 H3 MET B 1 -5.820 -18.147 3.521 1.00 0.85 H new ATOM 0 HA MET B 1 -4.686 -16.193 1.641 1.00 0.86 H new ATOM 0 HB2 MET B 1 -6.831 -16.208 0.481 1.00 1.04 H new ATOM 0 HB3 MET B 1 -6.182 -17.836 0.493 1.00 1.04 H new ATOM 0 HG2 MET B 1 -7.690 -18.386 2.426 1.00 1.09 H new ATOM 0 HG3 MET B 1 -8.377 -16.778 2.317 1.00 1.09 H new ATOM 0 HE1 MET B 1 -11.317 -18.923 0.932 1.00 1.75 H new ATOM 0 HE2 MET B 1 -10.214 -19.304 2.276 1.00 1.75 H new ATOM 0 HE3 MET B 1 -10.822 -17.644 2.066 1.00 1.75 H new ATOM 1659 N ALA B 2 -6.052 -15.742 4.428 1.00 0.73 N ATOM 1660 CA ALA B 2 -6.534 -14.764 5.419 1.00 0.67 C ATOM 1661 C ALA B 2 -5.351 -14.024 6.068 1.00 0.60 C ATOM 1662 O ALA B 2 -4.217 -14.513 6.028 1.00 0.68 O ATOM 1663 CB ALA B 2 -7.385 -15.464 6.478 1.00 0.78 C ATOM 0 H ALA B 2 -5.687 -16.601 4.840 1.00 0.73 H new ATOM 0 HA ALA B 2 -7.154 -14.026 4.910 1.00 0.67 H new ATOM 0 HB1 ALA B 2 -7.736 -14.732 7.205 1.00 0.78 H new ATOM 0 HB2 ALA B 2 -8.241 -15.940 6.000 1.00 0.78 H new ATOM 0 HB3 ALA B 2 -6.786 -16.220 6.985 1.00 0.78 H new ATOM 1669 N ALA B 3 -5.619 -12.850 6.674 1.00 0.57 N ATOM 1670 CA ALA B 3 -4.566 -12.042 7.321 1.00 0.57 C ATOM 1671 C ALA B 3 -4.448 -12.369 8.822 1.00 0.58 C ATOM 1672 O ALA B 3 -5.352 -12.054 9.603 1.00 0.69 O ATOM 1673 CB ALA B 3 -4.827 -10.551 7.097 1.00 0.64 C ATOM 0 H ALA B 3 -6.552 -12.441 6.729 1.00 0.57 H new ATOM 0 HA ALA B 3 -3.611 -12.296 6.860 1.00 0.57 H new ATOM 0 HB1 ALA B 3 -4.043 -9.968 7.580 1.00 0.64 H new ATOM 0 HB2 ALA B 3 -4.831 -10.339 6.028 1.00 0.64 H new ATOM 0 HB3 ALA B 3 -5.793 -10.283 7.524 1.00 0.64 H new ATOM 1679 N GLU B 4 -3.320 -13.007 9.212 1.00 0.56 N ATOM 1680 CA GLU B 4 -3.065 -13.411 10.611 1.00 0.59 C ATOM 1681 C GLU B 4 -2.033 -12.471 11.299 1.00 0.56 C ATOM 1682 O GLU B 4 -1.077 -12.040 10.648 1.00 0.54 O ATOM 1683 CB GLU B 4 -2.564 -14.874 10.627 1.00 0.66 C ATOM 1684 CG GLU B 4 -2.419 -15.495 12.015 1.00 0.79 C ATOM 1685 CD GLU B 4 -1.977 -16.948 11.962 1.00 0.91 C ATOM 1686 OE1 GLU B 4 -2.852 -17.830 11.831 1.00 1.10 O ATOM 1687 OE2 GLU B 4 -0.756 -17.202 12.048 1.00 1.00 O ATOM 0 H GLU B 4 -2.567 -13.254 8.570 1.00 0.56 H new ATOM 0 HA GLU B 4 -3.995 -13.333 11.175 1.00 0.59 H new ATOM 0 HB2 GLU B 4 -3.254 -15.484 10.043 1.00 0.66 H new ATOM 0 HB3 GLU B 4 -1.598 -14.916 10.125 1.00 0.66 H new ATOM 0 HG2 GLU B 4 -1.695 -14.920 12.592 1.00 0.79 H new ATOM 0 HG3 GLU B 4 -3.372 -15.428 12.540 1.00 0.79 H new ATOM 1694 N PRO B 5 -2.212 -12.137 12.628 1.00 0.62 N ATOM 1695 CA PRO B 5 -1.275 -11.253 13.382 1.00 0.65 C ATOM 1696 C PRO B 5 0.186 -11.764 13.418 1.00 0.59 C ATOM 1697 O PRO B 5 0.434 -12.923 13.768 1.00 0.68 O ATOM 1698 CB PRO B 5 -1.875 -11.224 14.804 1.00 0.83 C ATOM 1699 CG PRO B 5 -3.311 -11.557 14.617 1.00 0.80 C ATOM 1700 CD PRO B 5 -3.350 -12.551 13.494 1.00 0.73 C ATOM 0 HA PRO B 5 -1.196 -10.275 12.907 1.00 0.65 H new ATOM 0 HB2 PRO B 5 -1.383 -11.946 15.456 1.00 0.83 H new ATOM 0 HB3 PRO B 5 -1.753 -10.244 15.265 1.00 0.83 H new ATOM 0 HG2 PRO B 5 -3.738 -11.977 15.528 1.00 0.80 H new ATOM 0 HG3 PRO B 5 -3.892 -10.667 14.374 1.00 0.80 H new ATOM 0 HD2 PRO B 5 -3.229 -13.572 13.856 1.00 0.73 H new ATOM 0 HD3 PRO B 5 -4.298 -12.514 12.957 1.00 0.73 H new ATOM 1708 N LEU B 6 1.148 -10.879 13.052 1.00 0.61 N ATOM 1709 CA LEU B 6 2.594 -11.212 13.026 1.00 0.70 C ATOM 1710 C LEU B 6 3.430 -10.066 13.672 1.00 0.73 C ATOM 1711 O LEU B 6 2.910 -9.359 14.540 1.00 1.24 O ATOM 1712 CB LEU B 6 3.012 -11.505 11.557 1.00 0.87 C ATOM 1713 CG LEU B 6 2.370 -12.760 10.918 1.00 0.95 C ATOM 1714 CD1 LEU B 6 2.609 -12.791 9.408 1.00 1.18 C ATOM 1715 CD2 LEU B 6 2.907 -14.038 11.575 1.00 1.08 C ATOM 0 H LEU B 6 0.944 -9.921 12.768 1.00 0.61 H new ATOM 0 HA LEU B 6 2.790 -12.105 13.620 1.00 0.70 H new ATOM 0 HB2 LEU B 6 2.759 -10.638 10.946 1.00 0.87 H new ATOM 0 HB3 LEU B 6 4.096 -11.615 11.521 1.00 0.87 H new ATOM 0 HG LEU B 6 1.295 -12.710 11.089 1.00 0.95 H new ATOM 0 HD11 LEU B 6 2.147 -13.683 8.985 1.00 1.18 H new ATOM 0 HD12 LEU B 6 2.170 -11.904 8.952 1.00 1.18 H new ATOM 0 HD13 LEU B 6 3.681 -12.808 9.210 1.00 1.18 H new ATOM 0 HD21 LEU B 6 2.443 -14.908 11.111 1.00 1.08 H new ATOM 0 HD22 LEU B 6 3.988 -14.089 11.442 1.00 1.08 H new ATOM 0 HD23 LEU B 6 2.673 -14.026 12.639 1.00 1.08 H new ATOM 1727 N THR B 7 4.728 -9.893 13.280 1.00 0.52 N ATOM 1728 CA THR B 7 5.595 -8.817 13.829 1.00 0.50 C ATOM 1729 C THR B 7 4.948 -7.428 13.616 1.00 0.48 C ATOM 1730 O THR B 7 4.078 -7.288 12.758 1.00 0.53 O ATOM 1731 CB THR B 7 7.018 -8.839 13.174 1.00 0.53 C ATOM 1732 OG1 THR B 7 7.434 -10.192 12.946 1.00 0.92 O ATOM 1733 CG2 THR B 7 8.072 -8.146 14.046 1.00 1.06 C ATOM 0 H THR B 7 5.190 -10.484 12.589 1.00 0.52 H new ATOM 0 HA THR B 7 5.702 -9.002 14.898 1.00 0.50 H new ATOM 0 HB THR B 7 6.939 -8.296 12.232 1.00 0.53 H new ATOM 0 HG1 THR B 7 7.399 -10.388 11.986 1.00 0.92 H new ATOM 0 HG21 THR B 7 9.041 -8.188 13.548 1.00 1.06 H new ATOM 0 HG22 THR B 7 7.789 -7.105 14.201 1.00 1.06 H new ATOM 0 HG23 THR B 7 8.137 -8.652 15.009 1.00 1.06 H new ATOM 1741 N GLU B 8 5.377 -6.415 14.399 1.00 0.49 N ATOM 1742 CA GLU B 8 4.832 -5.035 14.318 1.00 0.49 C ATOM 1743 C GLU B 8 4.681 -4.511 12.862 1.00 0.44 C ATOM 1744 O GLU B 8 3.628 -3.966 12.516 1.00 0.47 O ATOM 1745 CB GLU B 8 5.703 -4.073 15.156 1.00 0.54 C ATOM 1746 CG GLU B 8 5.111 -2.674 15.336 1.00 0.95 C ATOM 1747 CD GLU B 8 5.878 -1.828 16.340 1.00 1.01 C ATOM 1748 OE1 GLU B 8 7.064 -1.527 16.081 1.00 1.29 O ATOM 1749 OE2 GLU B 8 5.294 -1.464 17.383 1.00 1.51 O ATOM 0 H GLU B 8 6.107 -6.526 15.103 1.00 0.49 H new ATOM 0 HA GLU B 8 3.823 -5.073 14.729 1.00 0.49 H new ATOM 0 HB2 GLU B 8 5.866 -4.514 16.139 1.00 0.54 H new ATOM 0 HB3 GLU B 8 6.680 -3.982 14.682 1.00 0.54 H new ATOM 0 HG2 GLU B 8 5.100 -2.164 14.373 1.00 0.95 H new ATOM 0 HG3 GLU B 8 4.075 -2.763 15.661 1.00 0.95 H new ATOM 1756 N LEU B 9 5.724 -4.688 12.020 1.00 0.42 N ATOM 1757 CA LEU B 9 5.690 -4.239 10.604 1.00 0.39 C ATOM 1758 C LEU B 9 4.730 -5.096 9.754 1.00 0.38 C ATOM 1759 O LEU B 9 4.003 -4.562 8.912 1.00 0.39 O ATOM 1760 CB LEU B 9 7.106 -4.266 9.991 1.00 0.41 C ATOM 1761 CG LEU B 9 8.047 -3.120 10.427 1.00 0.50 C ATOM 1762 CD1 LEU B 9 9.508 -3.491 10.179 1.00 0.63 C ATOM 1763 CD2 LEU B 9 7.692 -1.816 9.700 1.00 0.65 C ATOM 0 H LEU B 9 6.598 -5.137 12.293 1.00 0.42 H new ATOM 0 HA LEU B 9 5.318 -3.215 10.599 1.00 0.39 H new ATOM 0 HB2 LEU B 9 7.576 -5.215 10.249 1.00 0.41 H new ATOM 0 HB3 LEU B 9 7.012 -4.241 8.905 1.00 0.41 H new ATOM 0 HG LEU B 9 7.912 -2.963 11.497 1.00 0.50 H new ATOM 0 HD11 LEU B 9 10.151 -2.669 10.494 1.00 0.63 H new ATOM 0 HD12 LEU B 9 9.758 -4.386 10.749 1.00 0.63 H new ATOM 0 HD13 LEU B 9 9.659 -3.684 9.117 1.00 0.63 H new ATOM 0 HD21 LEU B 9 8.368 -1.024 10.023 1.00 0.65 H new ATOM 0 HD22 LEU B 9 7.791 -1.961 8.624 1.00 0.65 H new ATOM 0 HD23 LEU B 9 6.665 -1.536 9.936 1.00 0.65 H new ATOM 1775 N GLU B 10 4.747 -6.427 9.977 1.00 0.39 N ATOM 1776 CA GLU B 10 3.868 -7.368 9.248 1.00 0.41 C ATOM 1777 C GLU B 10 2.397 -7.253 9.720 1.00 0.42 C ATOM 1778 O GLU B 10 1.479 -7.591 8.969 1.00 0.47 O ATOM 1779 CB GLU B 10 4.361 -8.821 9.431 1.00 0.46 C ATOM 1780 CG GLU B 10 5.791 -9.065 8.951 1.00 0.50 C ATOM 1781 CD GLU B 10 6.269 -10.491 9.194 1.00 0.56 C ATOM 1782 OE1 GLU B 10 5.675 -11.426 8.616 1.00 0.95 O ATOM 1783 OE2 GLU B 10 7.235 -10.672 9.966 1.00 0.95 O ATOM 0 H GLU B 10 5.361 -6.876 10.657 1.00 0.39 H new ATOM 0 HA GLU B 10 3.910 -7.103 8.192 1.00 0.41 H new ATOM 0 HB2 GLU B 10 4.295 -9.085 10.487 1.00 0.46 H new ATOM 0 HB3 GLU B 10 3.690 -9.490 8.892 1.00 0.46 H new ATOM 0 HG2 GLU B 10 5.853 -8.844 7.885 1.00 0.50 H new ATOM 0 HG3 GLU B 10 6.462 -8.372 9.459 1.00 0.50 H new ATOM 1790 N GLU B 11 2.195 -6.773 10.969 1.00 0.42 N ATOM 1791 CA GLU B 11 0.861 -6.600 11.566 1.00 0.45 C ATOM 1792 C GLU B 11 0.226 -5.254 11.150 1.00 0.43 C ATOM 1793 O GLU B 11 -0.998 -5.170 11.046 1.00 0.45 O ATOM 1794 CB GLU B 11 0.966 -6.710 13.103 1.00 0.51 C ATOM 1795 CG GLU B 11 -0.369 -6.889 13.830 1.00 0.62 C ATOM 1796 CD GLU B 11 -0.198 -7.060 15.331 1.00 0.70 C ATOM 1797 OE1 GLU B 11 -0.113 -6.032 16.037 1.00 0.85 O ATOM 1798 OE2 GLU B 11 -0.149 -8.218 15.797 1.00 0.82 O ATOM 0 H GLU B 11 2.957 -6.496 11.588 1.00 0.42 H new ATOM 0 HA GLU B 11 0.208 -7.390 11.195 1.00 0.45 H new ATOM 0 HB2 GLU B 11 1.613 -7.552 13.349 1.00 0.51 H new ATOM 0 HB3 GLU B 11 1.453 -5.812 13.484 1.00 0.51 H new ATOM 0 HG2 GLU B 11 -1.003 -6.024 13.636 1.00 0.62 H new ATOM 0 HG3 GLU B 11 -0.885 -7.759 13.425 1.00 0.62 H new ATOM 1805 N SER B 12 1.057 -4.205 10.918 1.00 0.43 N ATOM 1806 CA SER B 12 0.554 -2.874 10.498 1.00 0.44 C ATOM 1807 C SER B 12 -0.228 -2.973 9.171 1.00 0.42 C ATOM 1808 O SER B 12 -1.365 -2.507 9.085 1.00 0.47 O ATOM 1809 CB SER B 12 1.710 -1.861 10.366 1.00 0.48 C ATOM 1810 OG SER B 12 2.314 -1.604 11.626 1.00 0.56 O ATOM 0 H SER B 12 2.071 -4.256 11.014 1.00 0.43 H new ATOM 0 HA SER B 12 -0.126 -2.518 11.272 1.00 0.44 H new ATOM 0 HB2 SER B 12 2.458 -2.247 9.673 1.00 0.48 H new ATOM 0 HB3 SER B 12 1.334 -0.929 9.943 1.00 0.48 H new ATOM 0 HG SER B 12 2.768 -2.413 11.942 1.00 0.56 H new ATOM 1816 N ILE B 13 0.390 -3.602 8.146 1.00 0.40 N ATOM 1817 CA ILE B 13 -0.263 -3.795 6.829 1.00 0.41 C ATOM 1818 C ILE B 13 -1.427 -4.820 6.903 1.00 0.41 C ATOM 1819 O ILE B 13 -2.338 -4.780 6.069 1.00 0.48 O ATOM 1820 CB ILE B 13 0.745 -4.199 5.689 1.00 0.46 C ATOM 1821 CG1 ILE B 13 1.626 -5.436 6.048 1.00 0.45 C ATOM 1822 CG2 ILE B 13 1.630 -3.004 5.317 1.00 0.53 C ATOM 1823 CD1 ILE B 13 0.941 -6.784 5.882 1.00 0.45 C ATOM 0 H ILE B 13 1.334 -3.983 8.203 1.00 0.40 H new ATOM 0 HA ILE B 13 -0.673 -2.820 6.566 1.00 0.41 H new ATOM 0 HB ILE B 13 0.140 -4.493 4.831 1.00 0.46 H new ATOM 0 HG12 ILE B 13 2.519 -5.420 5.424 1.00 0.45 H new ATOM 0 HG13 ILE B 13 1.958 -5.339 7.082 1.00 0.45 H new ATOM 0 HG21 ILE B 13 2.323 -3.296 4.528 1.00 0.53 H new ATOM 0 HG22 ILE B 13 1.004 -2.183 4.966 1.00 0.53 H new ATOM 0 HG23 ILE B 13 2.193 -2.682 6.193 1.00 0.53 H new ATOM 0 HD11 ILE B 13 1.633 -7.580 6.156 1.00 0.45 H new ATOM 0 HD12 ILE B 13 0.064 -6.828 6.528 1.00 0.45 H new ATOM 0 HD13 ILE B 13 0.634 -6.911 4.844 1.00 0.45 H new ATOM 1835 N GLU B 14 -1.387 -5.726 7.907 1.00 0.40 N ATOM 1836 CA GLU B 14 -2.443 -6.737 8.121 1.00 0.43 C ATOM 1837 C GLU B 14 -3.725 -6.089 8.687 1.00 0.45 C ATOM 1838 O GLU B 14 -4.833 -6.479 8.306 1.00 0.48 O ATOM 1839 CB GLU B 14 -1.919 -7.852 9.068 1.00 0.46 C ATOM 1840 CG GLU B 14 -2.977 -8.819 9.627 1.00 0.57 C ATOM 1841 CD GLU B 14 -3.480 -8.428 11.011 1.00 0.64 C ATOM 1842 OE1 GLU B 14 -2.750 -8.667 11.996 1.00 0.92 O ATOM 1843 OE2 GLU B 14 -4.599 -7.883 11.106 1.00 1.00 O ATOM 0 H GLU B 14 -0.627 -5.775 8.586 1.00 0.40 H new ATOM 0 HA GLU B 14 -2.699 -7.184 7.160 1.00 0.43 H new ATOM 0 HB2 GLU B 14 -1.171 -8.435 8.530 1.00 0.46 H new ATOM 0 HB3 GLU B 14 -1.410 -7.378 9.907 1.00 0.46 H new ATOM 0 HG2 GLU B 14 -3.822 -8.859 8.939 1.00 0.57 H new ATOM 0 HG3 GLU B 14 -2.554 -9.823 9.672 1.00 0.57 H new ATOM 1850 N THR B 15 -3.563 -5.097 9.593 1.00 0.45 N ATOM 1851 CA THR B 15 -4.702 -4.394 10.227 1.00 0.49 C ATOM 1852 C THR B 15 -5.620 -3.703 9.190 1.00 0.47 C ATOM 1853 O THR B 15 -6.833 -3.661 9.388 1.00 0.50 O ATOM 1854 CB THR B 15 -4.220 -3.337 11.266 1.00 0.54 C ATOM 1855 OG1 THR B 15 -3.125 -3.856 12.032 1.00 0.75 O ATOM 1856 CG2 THR B 15 -5.342 -2.936 12.221 1.00 0.88 C ATOM 0 H THR B 15 -2.650 -4.764 9.902 1.00 0.45 H new ATOM 0 HA THR B 15 -5.278 -5.165 10.739 1.00 0.49 H new ATOM 0 HB THR B 15 -3.903 -2.456 10.708 1.00 0.54 H new ATOM 0 HG1 THR B 15 -2.330 -3.923 11.463 1.00 0.75 H new ATOM 0 HG21 THR B 15 -4.969 -2.198 12.931 1.00 0.88 H new ATOM 0 HG22 THR B 15 -6.168 -2.508 11.653 1.00 0.88 H new ATOM 0 HG23 THR B 15 -5.691 -3.816 12.762 1.00 0.88 H new ATOM 1864 N VAL B 16 -5.037 -3.162 8.097 1.00 0.45 N ATOM 1865 CA VAL B 16 -5.821 -2.484 7.032 1.00 0.47 C ATOM 1866 C VAL B 16 -6.743 -3.495 6.303 1.00 0.47 C ATOM 1867 O VAL B 16 -7.830 -3.129 5.847 1.00 0.52 O ATOM 1868 CB VAL B 16 -4.895 -1.751 5.989 1.00 0.49 C ATOM 1869 CG1 VAL B 16 -5.704 -0.939 4.960 1.00 0.56 C ATOM 1870 CG2 VAL B 16 -3.877 -0.846 6.698 1.00 0.53 C ATOM 0 H VAL B 16 -4.032 -3.180 7.927 1.00 0.45 H new ATOM 0 HA VAL B 16 -6.434 -1.727 7.521 1.00 0.47 H new ATOM 0 HB VAL B 16 -4.358 -2.528 5.445 1.00 0.49 H new ATOM 0 HG11 VAL B 16 -5.022 -0.452 4.263 1.00 0.56 H new ATOM 0 HG12 VAL B 16 -6.368 -1.606 4.411 1.00 0.56 H new ATOM 0 HG13 VAL B 16 -6.295 -0.183 5.477 1.00 0.56 H new ATOM 0 HG21 VAL B 16 -3.250 -0.352 5.956 1.00 0.53 H new ATOM 0 HG22 VAL B 16 -4.405 -0.095 7.285 1.00 0.53 H new ATOM 0 HG23 VAL B 16 -3.252 -1.448 7.357 1.00 0.53 H new ATOM 1880 N VAL B 17 -6.298 -4.773 6.216 1.00 0.46 N ATOM 1881 CA VAL B 17 -7.071 -5.851 5.571 1.00 0.50 C ATOM 1882 C VAL B 17 -8.250 -6.291 6.470 1.00 0.57 C ATOM 1883 O VAL B 17 -9.405 -6.188 6.058 1.00 0.97 O ATOM 1884 CB VAL B 17 -6.151 -7.085 5.226 1.00 0.53 C ATOM 1885 CG1 VAL B 17 -6.953 -8.331 4.812 1.00 0.63 C ATOM 1886 CG2 VAL B 17 -5.137 -6.717 4.137 1.00 0.55 C ATOM 0 H VAL B 17 -5.399 -5.079 6.589 1.00 0.46 H new ATOM 0 HA VAL B 17 -7.474 -5.459 4.637 1.00 0.50 H new ATOM 0 HB VAL B 17 -5.618 -7.341 6.142 1.00 0.53 H new ATOM 0 HG11 VAL B 17 -6.267 -9.147 4.587 1.00 0.63 H new ATOM 0 HG12 VAL B 17 -7.613 -8.626 5.628 1.00 0.63 H new ATOM 0 HG13 VAL B 17 -7.548 -8.103 3.928 1.00 0.63 H new ATOM 0 HG21 VAL B 17 -4.512 -7.582 3.914 1.00 0.55 H new ATOM 0 HG22 VAL B 17 -5.667 -6.410 3.235 1.00 0.55 H new ATOM 0 HG23 VAL B 17 -4.510 -5.897 4.486 1.00 0.55 H new ATOM 1896 N THR B 18 -7.937 -6.750 7.704 1.00 0.50 N ATOM 1897 CA THR B 18 -8.952 -7.237 8.672 1.00 0.52 C ATOM 1898 C THR B 18 -10.023 -6.186 9.034 1.00 0.54 C ATOM 1899 O THR B 18 -11.189 -6.543 9.233 1.00 0.67 O ATOM 1900 CB THR B 18 -8.292 -7.755 9.984 1.00 0.56 C ATOM 1901 OG1 THR B 18 -7.493 -6.720 10.581 1.00 0.58 O ATOM 1902 CG2 THR B 18 -7.413 -8.979 9.719 1.00 0.62 C ATOM 0 H THR B 18 -6.981 -6.794 8.057 1.00 0.50 H new ATOM 0 HA THR B 18 -9.453 -8.057 8.157 1.00 0.52 H new ATOM 0 HB THR B 18 -9.093 -8.042 10.665 1.00 0.56 H new ATOM 0 HG1 THR B 18 -6.591 -7.062 10.753 1.00 0.58 H new ATOM 0 HG21 THR B 18 -6.967 -9.316 10.655 1.00 0.62 H new ATOM 0 HG22 THR B 18 -8.021 -9.779 9.298 1.00 0.62 H new ATOM 0 HG23 THR B 18 -6.624 -8.715 9.015 1.00 0.62 H new ATOM 1910 N THR B 19 -9.631 -4.896 9.116 1.00 0.53 N ATOM 1911 CA THR B 19 -10.570 -3.808 9.458 1.00 0.57 C ATOM 1912 C THR B 19 -11.617 -3.579 8.344 1.00 0.57 C ATOM 1913 O THR B 19 -12.798 -3.392 8.652 1.00 0.66 O ATOM 1914 CB THR B 19 -9.812 -2.479 9.771 1.00 0.60 C ATOM 1915 OG1 THR B 19 -8.888 -2.697 10.845 1.00 0.61 O ATOM 1916 CG2 THR B 19 -10.758 -1.337 10.162 1.00 0.69 C ATOM 0 H THR B 19 -8.674 -4.584 8.950 1.00 0.53 H new ATOM 0 HA THR B 19 -11.101 -4.122 10.357 1.00 0.57 H new ATOM 0 HB THR B 19 -9.293 -2.186 8.859 1.00 0.60 H new ATOM 0 HG1 THR B 19 -8.149 -3.260 10.532 1.00 0.61 H new ATOM 0 HG21 THR B 19 -10.177 -0.438 10.369 1.00 0.69 H new ATOM 0 HG22 THR B 19 -11.450 -1.142 9.343 1.00 0.69 H new ATOM 0 HG23 THR B 19 -11.320 -1.619 11.053 1.00 0.69 H new ATOM 1924 N PHE B 20 -11.188 -3.605 7.060 1.00 0.56 N ATOM 1925 CA PHE B 20 -12.109 -3.379 5.926 1.00 0.60 C ATOM 1926 C PHE B 20 -12.348 -4.653 5.073 1.00 0.60 C ATOM 1927 O PHE B 20 -12.685 -4.541 3.889 1.00 0.94 O ATOM 1928 CB PHE B 20 -11.587 -2.215 5.045 1.00 0.68 C ATOM 1929 CG PHE B 20 -12.678 -1.459 4.304 1.00 0.75 C ATOM 1930 CD1 PHE B 20 -13.608 -0.688 5.002 1.00 0.91 C ATOM 1931 CD2 PHE B 20 -12.776 -1.517 2.921 1.00 0.80 C ATOM 1932 CE1 PHE B 20 -14.601 0.002 4.333 1.00 1.02 C ATOM 1933 CE2 PHE B 20 -13.769 -0.827 2.250 1.00 0.90 C ATOM 1934 CZ PHE B 20 -14.680 -0.066 2.958 1.00 0.97 C ATOM 0 H PHE B 20 -10.220 -3.778 6.787 1.00 0.56 H new ATOM 0 HA PHE B 20 -13.078 -3.111 6.348 1.00 0.60 H new ATOM 0 HB2 PHE B 20 -11.038 -1.515 5.675 1.00 0.68 H new ATOM 0 HB3 PHE B 20 -10.878 -2.613 4.319 1.00 0.68 H new ATOM 0 HD1 PHE B 20 -13.551 -0.630 6.079 1.00 0.91 H new ATOM 0 HD2 PHE B 20 -12.067 -2.109 2.361 1.00 0.80 H new ATOM 0 HE1 PHE B 20 -15.315 0.594 4.887 1.00 1.02 H new ATOM 0 HE2 PHE B 20 -13.833 -0.883 1.173 1.00 0.90 H new ATOM 0 HZ PHE B 20 -15.454 0.475 2.434 1.00 0.97 H new ATOM 1944 N PHE B 21 -12.199 -5.863 5.665 1.00 0.71 N ATOM 1945 CA PHE B 21 -12.455 -7.121 4.924 1.00 0.72 C ATOM 1946 C PHE B 21 -13.968 -7.406 4.882 1.00 0.68 C ATOM 1947 O PHE B 21 -14.489 -7.837 3.849 1.00 0.71 O ATOM 1948 CB PHE B 21 -11.704 -8.324 5.538 1.00 1.01 C ATOM 1949 CG PHE B 21 -11.578 -9.514 4.594 1.00 1.63 C ATOM 1950 CD1 PHE B 21 -12.616 -10.431 4.464 1.00 2.26 C ATOM 1951 CD2 PHE B 21 -10.431 -9.706 3.829 1.00 1.93 C ATOM 1952 CE1 PHE B 21 -12.512 -11.503 3.599 1.00 2.92 C ATOM 1953 CE2 PHE B 21 -10.325 -10.781 2.965 1.00 2.67 C ATOM 1954 CZ PHE B 21 -11.365 -11.680 2.851 1.00 3.08 C ATOM 0 H PHE B 21 -11.909 -5.994 6.634 1.00 0.71 H new ATOM 0 HA PHE B 21 -12.078 -6.987 3.910 1.00 0.72 H new ATOM 0 HB2 PHE B 21 -10.707 -8.003 5.839 1.00 1.01 H new ATOM 0 HB3 PHE B 21 -12.223 -8.642 6.442 1.00 1.01 H new ATOM 0 HD1 PHE B 21 -13.516 -10.303 5.048 1.00 2.26 H new ATOM 0 HD2 PHE B 21 -9.613 -9.006 3.911 1.00 1.93 H new ATOM 0 HE1 PHE B 21 -13.329 -12.204 3.508 1.00 2.92 H new ATOM 0 HE2 PHE B 21 -9.428 -10.917 2.379 1.00 2.67 H new ATOM 0 HZ PHE B 21 -11.282 -12.521 2.178 1.00 3.08 H new ATOM 1964 N THR B 22 -14.667 -7.154 6.015 1.00 0.76 N ATOM 1965 CA THR B 22 -16.129 -7.350 6.116 1.00 0.91 C ATOM 1966 C THR B 22 -16.880 -6.467 5.088 1.00 0.84 C ATOM 1967 O THR B 22 -17.947 -6.852 4.599 1.00 1.01 O ATOM 1968 CB THR B 22 -16.637 -7.046 7.562 1.00 1.10 C ATOM 1969 OG1 THR B 22 -15.870 -7.796 8.521 1.00 1.23 O ATOM 1970 CG2 THR B 22 -18.124 -7.368 7.744 1.00 1.37 C ATOM 0 H THR B 22 -14.237 -6.813 6.875 1.00 0.76 H new ATOM 0 HA THR B 22 -16.338 -8.396 5.890 1.00 0.91 H new ATOM 0 HB THR B 22 -16.507 -5.976 7.724 1.00 1.10 H new ATOM 0 HG1 THR B 22 -16.193 -7.599 9.425 1.00 1.23 H new ATOM 0 HG21 THR B 22 -18.424 -7.138 8.766 1.00 1.37 H new ATOM 0 HG22 THR B 22 -18.714 -6.769 7.050 1.00 1.37 H new ATOM 0 HG23 THR B 22 -18.294 -8.426 7.545 1.00 1.37 H new ATOM 1978 N PHE B 23 -16.304 -5.286 4.768 1.00 0.69 N ATOM 1979 CA PHE B 23 -16.886 -4.356 3.783 1.00 0.75 C ATOM 1980 C PHE B 23 -16.412 -4.696 2.351 1.00 0.70 C ATOM 1981 O PHE B 23 -17.164 -4.503 1.394 1.00 0.83 O ATOM 1982 CB PHE B 23 -16.512 -2.899 4.126 1.00 0.84 C ATOM 1983 CG PHE B 23 -17.088 -2.407 5.440 1.00 1.00 C ATOM 1984 CD1 PHE B 23 -16.399 -2.590 6.634 1.00 1.03 C ATOM 1985 CD2 PHE B 23 -18.318 -1.760 5.478 1.00 1.32 C ATOM 1986 CE1 PHE B 23 -16.924 -2.140 7.828 1.00 1.27 C ATOM 1987 CE2 PHE B 23 -18.843 -1.310 6.673 1.00 1.54 C ATOM 1988 CZ PHE B 23 -18.146 -1.502 7.849 1.00 1.48 C ATOM 0 H PHE B 23 -15.432 -4.956 5.182 1.00 0.69 H new ATOM 0 HA PHE B 23 -17.970 -4.464 3.824 1.00 0.75 H new ATOM 0 HB2 PHE B 23 -15.426 -2.812 4.162 1.00 0.84 H new ATOM 0 HB3 PHE B 23 -16.857 -2.248 3.323 1.00 0.84 H new ATOM 0 HD1 PHE B 23 -15.442 -3.090 6.627 1.00 1.03 H new ATOM 0 HD2 PHE B 23 -18.869 -1.608 4.562 1.00 1.32 H new ATOM 0 HE1 PHE B 23 -16.377 -2.288 8.747 1.00 1.27 H new ATOM 0 HE2 PHE B 23 -19.799 -0.808 6.688 1.00 1.54 H new ATOM 0 HZ PHE B 23 -18.558 -1.153 8.784 1.00 1.48 H new ATOM 1998 N ALA B 24 -15.163 -5.203 2.212 1.00 0.61 N ATOM 1999 CA ALA B 24 -14.594 -5.573 0.894 1.00 0.67 C ATOM 2000 C ALA B 24 -15.185 -6.889 0.334 1.00 0.65 C ATOM 2001 O ALA B 24 -15.175 -7.096 -0.883 1.00 0.85 O ATOM 2002 CB ALA B 24 -13.067 -5.672 0.968 1.00 0.77 C ATOM 0 H ALA B 24 -14.531 -5.365 2.996 1.00 0.61 H new ATOM 0 HA ALA B 24 -14.871 -4.776 0.204 1.00 0.67 H new ATOM 0 HB1 ALA B 24 -12.672 -5.945 -0.011 1.00 0.77 H new ATOM 0 HB2 ALA B 24 -12.654 -4.710 1.271 1.00 0.77 H new ATOM 0 HB3 ALA B 24 -12.787 -6.432 1.697 1.00 0.77 H new ATOM 2008 N ARG B 25 -15.706 -7.772 1.220 1.00 0.62 N ATOM 2009 CA ARG B 25 -16.294 -9.062 0.796 1.00 0.68 C ATOM 2010 C ARG B 25 -17.794 -8.942 0.406 1.00 0.70 C ATOM 2011 O ARG B 25 -18.429 -9.957 0.109 1.00 0.87 O ATOM 2012 CB ARG B 25 -16.099 -10.131 1.904 1.00 0.77 C ATOM 2013 CG ARG B 25 -16.973 -9.949 3.156 1.00 0.80 C ATOM 2014 CD ARG B 25 -16.582 -10.916 4.272 1.00 1.01 C ATOM 2015 NE ARG B 25 -17.447 -10.787 5.459 1.00 1.10 N ATOM 2016 CZ ARG B 25 -17.421 -11.609 6.532 1.00 1.38 C ATOM 2017 NH1 ARG B 25 -16.563 -12.637 6.609 1.00 1.73 N ATOM 2018 NH2 ARG B 25 -18.259 -11.383 7.548 1.00 1.48 N ATOM 0 H ARG B 25 -15.730 -7.614 2.227 1.00 0.62 H new ATOM 0 HA ARG B 25 -15.764 -9.374 -0.104 1.00 0.68 H new ATOM 0 HB2 ARG B 25 -16.304 -11.113 1.478 1.00 0.77 H new ATOM 0 HB3 ARG B 25 -15.052 -10.128 2.208 1.00 0.77 H new ATOM 0 HG2 ARG B 25 -16.882 -8.924 3.516 1.00 0.80 H new ATOM 0 HG3 ARG B 25 -18.020 -10.103 2.893 1.00 0.80 H new ATOM 0 HD2 ARG B 25 -16.634 -11.938 3.898 1.00 1.01 H new ATOM 0 HD3 ARG B 25 -15.546 -10.734 4.560 1.00 1.01 H new ATOM 0 HE ARG B 25 -18.117 -10.018 5.472 1.00 1.10 H new ATOM 0 HH11 ARG B 25 -15.909 -12.814 5.846 1.00 1.73 H new ATOM 0 HH12 ARG B 25 -16.564 -13.242 7.430 1.00 1.73 H new ATOM 0 HH21 ARG B 25 -18.909 -10.598 7.508 1.00 1.48 H new ATOM 0 HH22 ARG B 25 -18.249 -11.996 8.363 1.00 1.48 H new ATOM 2032 N GLN B 26 -18.348 -7.704 0.391 1.00 0.71 N ATOM 2033 CA GLN B 26 -19.768 -7.472 0.051 1.00 0.79 C ATOM 2034 C GLN B 26 -19.994 -7.488 -1.475 1.00 0.73 C ATOM 2035 O GLN B 26 -20.959 -8.094 -1.948 1.00 0.84 O ATOM 2036 CB GLN B 26 -20.249 -6.129 0.656 1.00 0.90 C ATOM 2037 CG GLN B 26 -21.738 -6.090 0.999 1.00 1.09 C ATOM 2038 CD GLN B 26 -22.185 -4.745 1.563 1.00 1.31 C ATOM 2039 OE1 GLN B 26 -22.623 -3.870 0.818 1.00 1.46 O ATOM 2040 NE2 GLN B 26 -22.074 -4.564 2.880 1.00 1.68 N ATOM 0 H GLN B 26 -17.830 -6.853 0.611 1.00 0.71 H new ATOM 0 HA GLN B 26 -20.354 -8.285 0.480 1.00 0.79 H new ATOM 0 HB2 GLN B 26 -19.675 -5.925 1.560 1.00 0.90 H new ATOM 0 HB3 GLN B 26 -20.030 -5.327 -0.049 1.00 0.90 H new ATOM 0 HG2 GLN B 26 -22.317 -6.313 0.103 1.00 1.09 H new ATOM 0 HG3 GLN B 26 -21.959 -6.873 1.724 1.00 1.09 H new ATOM 0 HE21 GLN B 26 -21.706 -5.312 3.468 1.00 1.68 H new ATOM 0 HE22 GLN B 26 -22.357 -3.678 3.299 1.00 1.68 H new ATOM 2049 N GLU B 27 -19.102 -6.813 -2.232 1.00 0.66 N ATOM 2050 CA GLU B 27 -19.195 -6.744 -3.706 1.00 0.71 C ATOM 2051 C GLU B 27 -18.096 -7.601 -4.377 1.00 0.88 C ATOM 2052 O GLU B 27 -17.260 -8.188 -3.680 1.00 1.45 O ATOM 2053 CB GLU B 27 -19.108 -5.270 -4.177 1.00 0.83 C ATOM 2054 CG GLU B 27 -20.197 -4.351 -3.607 1.00 0.93 C ATOM 2055 CD GLU B 27 -21.613 -4.764 -3.995 1.00 1.04 C ATOM 2056 OE1 GLU B 27 -21.965 -4.638 -5.188 1.00 1.23 O ATOM 2057 OE2 GLU B 27 -22.367 -5.213 -3.105 1.00 1.16 O ATOM 0 H GLU B 27 -18.306 -6.306 -1.844 1.00 0.66 H new ATOM 0 HA GLU B 27 -20.160 -7.152 -4.008 1.00 0.71 H new ATOM 0 HB2 GLU B 27 -18.132 -4.871 -3.899 1.00 0.83 H new ATOM 0 HB3 GLU B 27 -19.164 -5.246 -5.265 1.00 0.83 H new ATOM 0 HG2 GLU B 27 -20.117 -4.338 -2.520 1.00 0.93 H new ATOM 0 HG3 GLU B 27 -20.018 -3.333 -3.952 1.00 0.93 H new ATOM 2064 N GLY B 28 -18.129 -7.667 -5.737 1.00 0.73 N ATOM 2065 CA GLY B 28 -17.171 -8.439 -6.559 1.00 0.86 C ATOM 2066 C GLY B 28 -15.823 -8.784 -5.908 1.00 0.69 C ATOM 2067 O GLY B 28 -15.099 -7.885 -5.469 1.00 0.66 O ATOM 0 H GLY B 28 -18.831 -7.179 -6.293 1.00 0.73 H new ATOM 0 HA2 GLY B 28 -17.653 -9.370 -6.858 1.00 0.86 H new ATOM 0 HA3 GLY B 28 -16.974 -7.875 -7.471 1.00 0.86 H new ATOM 2071 N ARG B 29 -15.498 -10.102 -5.862 1.00 0.68 N ATOM 2072 CA ARG B 29 -14.237 -10.635 -5.282 1.00 0.65 C ATOM 2073 C ARG B 29 -14.135 -10.394 -3.756 1.00 0.62 C ATOM 2074 O ARG B 29 -14.617 -9.382 -3.240 1.00 0.69 O ATOM 2075 CB ARG B 29 -12.978 -10.065 -6.006 1.00 0.66 C ATOM 2076 CG ARG B 29 -12.179 -11.090 -6.819 1.00 0.84 C ATOM 2077 CD ARG B 29 -12.891 -11.511 -8.106 1.00 1.28 C ATOM 2078 NE ARG B 29 -12.041 -12.354 -8.965 1.00 1.44 N ATOM 2079 CZ ARG B 29 -12.477 -13.087 -10.014 1.00 1.93 C ATOM 2080 NH1 ARG B 29 -13.771 -13.102 -10.371 1.00 2.62 N ATOM 2081 NH2 ARG B 29 -11.598 -13.801 -10.719 1.00 2.09 N ATOM 0 H ARG B 29 -16.109 -10.831 -6.230 1.00 0.68 H new ATOM 0 HA ARG B 29 -14.267 -11.713 -5.443 1.00 0.65 H new ATOM 0 HB2 ARG B 29 -13.293 -9.261 -6.672 1.00 0.66 H new ATOM 0 HB3 ARG B 29 -12.318 -9.621 -5.260 1.00 0.66 H new ATOM 0 HG2 ARG B 29 -11.205 -10.669 -7.069 1.00 0.84 H new ATOM 0 HG3 ARG B 29 -11.997 -11.972 -6.205 1.00 0.84 H new ATOM 0 HD2 ARG B 29 -13.801 -12.055 -7.854 1.00 1.28 H new ATOM 0 HD3 ARG B 29 -13.194 -10.622 -8.659 1.00 1.28 H new ATOM 0 HE ARG B 29 -11.044 -12.387 -8.751 1.00 1.44 H new ATOM 0 HH11 ARG B 29 -14.451 -12.552 -9.847 1.00 2.62 H new ATOM 0 HH12 ARG B 29 -14.074 -13.664 -11.167 1.00 2.62 H new ATOM 0 HH21 ARG B 29 -10.610 -13.790 -10.464 1.00 2.09 H new ATOM 0 HH22 ARG B 29 -11.914 -14.358 -11.513 1.00 2.09 H new ATOM 2095 N LYS B 30 -13.489 -11.344 -3.046 1.00 0.64 N ATOM 2096 CA LYS B 30 -13.295 -11.254 -1.582 1.00 0.65 C ATOM 2097 C LYS B 30 -12.105 -10.335 -1.251 1.00 0.63 C ATOM 2098 O LYS B 30 -12.143 -9.604 -0.257 1.00 0.67 O ATOM 2099 CB LYS B 30 -13.053 -12.650 -0.964 1.00 0.73 C ATOM 2100 CG LYS B 30 -14.200 -13.651 -1.149 1.00 0.79 C ATOM 2101 CD LYS B 30 -15.421 -13.316 -0.288 1.00 0.87 C ATOM 2102 CE LYS B 30 -16.591 -14.266 -0.557 1.00 1.01 C ATOM 2103 NZ LYS B 30 -17.208 -14.038 -1.901 1.00 1.11 N ATOM 0 H LYS B 30 -13.092 -12.185 -3.465 1.00 0.64 H new ATOM 0 HA LYS B 30 -14.206 -10.835 -1.154 1.00 0.65 H new ATOM 0 HB2 LYS B 30 -12.149 -13.072 -1.402 1.00 0.73 H new ATOM 0 HB3 LYS B 30 -12.864 -12.530 0.103 1.00 0.73 H new ATOM 0 HG2 LYS B 30 -14.495 -13.670 -2.198 1.00 0.79 H new ATOM 0 HG3 LYS B 30 -13.848 -14.652 -0.899 1.00 0.79 H new ATOM 0 HD2 LYS B 30 -15.147 -13.368 0.766 1.00 0.87 H new ATOM 0 HD3 LYS B 30 -15.734 -12.291 -0.486 1.00 0.87 H new ATOM 0 HE2 LYS B 30 -16.243 -15.297 -0.489 1.00 1.01 H new ATOM 0 HE3 LYS B 30 -17.349 -14.134 0.216 1.00 1.01 H new ATOM 0 HZ1 LYS B 30 -18.056 -14.631 -1.999 1.00 1.11 H new ATOM 0 HZ2 LYS B 30 -17.473 -13.037 -1.996 1.00 1.11 H new ATOM 0 HZ3 LYS B 30 -16.524 -14.287 -2.644 1.00 1.11 H new ATOM 2117 N ASP B 31 -11.055 -10.380 -2.101 1.00 0.65 N ATOM 2118 CA ASP B 31 -9.848 -9.551 -1.931 1.00 0.69 C ATOM 2119 C ASP B 31 -9.903 -8.331 -2.880 1.00 0.64 C ATOM 2120 O ASP B 31 -8.920 -8.010 -3.561 1.00 0.88 O ATOM 2121 CB ASP B 31 -8.588 -10.411 -2.190 1.00 0.83 C ATOM 2122 CG ASP B 31 -8.384 -11.497 -1.141 1.00 0.94 C ATOM 2123 OD1 ASP B 31 -9.244 -12.398 -1.041 1.00 1.24 O ATOM 2124 OD2 ASP B 31 -7.363 -11.449 -0.427 1.00 1.36 O ATOM 0 H ASP B 31 -11.023 -10.989 -2.918 1.00 0.65 H new ATOM 0 HA ASP B 31 -9.802 -9.175 -0.909 1.00 0.69 H new ATOM 0 HB2 ASP B 31 -8.666 -10.874 -3.174 1.00 0.83 H new ATOM 0 HB3 ASP B 31 -7.711 -9.764 -2.211 1.00 0.83 H new ATOM 2129 N SER B 32 -11.073 -7.650 -2.911 1.00 0.65 N ATOM 2130 CA SER B 32 -11.291 -6.471 -3.765 1.00 0.59 C ATOM 2131 C SER B 32 -12.351 -5.538 -3.152 1.00 0.57 C ATOM 2132 O SER B 32 -13.372 -6.005 -2.641 1.00 0.64 O ATOM 2133 CB SER B 32 -11.716 -6.906 -5.176 1.00 0.59 C ATOM 2134 OG SER B 32 -11.839 -5.795 -6.050 1.00 1.13 O ATOM 0 H SER B 32 -11.884 -7.905 -2.347 1.00 0.65 H new ATOM 0 HA SER B 32 -10.352 -5.922 -3.834 1.00 0.59 H new ATOM 0 HB2 SER B 32 -10.984 -7.606 -5.578 1.00 0.59 H new ATOM 0 HB3 SER B 32 -12.667 -7.435 -5.123 1.00 0.59 H new ATOM 0 HG SER B 32 -12.784 -5.649 -6.263 1.00 1.13 H new ATOM 2140 N LEU B 33 -12.097 -4.218 -3.228 1.00 0.55 N ATOM 2141 CA LEU B 33 -13.004 -3.195 -2.676 1.00 0.56 C ATOM 2142 C LEU B 33 -13.918 -2.627 -3.780 1.00 0.55 C ATOM 2143 O LEU B 33 -13.552 -2.634 -4.958 1.00 0.72 O ATOM 2144 CB LEU B 33 -12.186 -2.048 -2.021 1.00 0.59 C ATOM 2145 CG LEU B 33 -11.516 -2.355 -0.651 1.00 0.69 C ATOM 2146 CD1 LEU B 33 -10.473 -3.472 -0.756 1.00 0.79 C ATOM 2147 CD2 LEU B 33 -10.876 -1.089 -0.071 1.00 0.75 C ATOM 0 H LEU B 33 -11.263 -3.833 -3.671 1.00 0.55 H new ATOM 0 HA LEU B 33 -13.628 -3.664 -1.915 1.00 0.56 H new ATOM 0 HB2 LEU B 33 -11.406 -1.746 -2.720 1.00 0.59 H new ATOM 0 HB3 LEU B 33 -12.847 -1.191 -1.891 1.00 0.59 H new ATOM 0 HG LEU B 33 -12.302 -2.701 0.021 1.00 0.69 H new ATOM 0 HD11 LEU B 33 -10.032 -3.651 0.225 1.00 0.79 H new ATOM 0 HD12 LEU B 33 -10.952 -4.385 -1.111 1.00 0.79 H new ATOM 0 HD13 LEU B 33 -9.692 -3.176 -1.456 1.00 0.79 H new ATOM 0 HD21 LEU B 33 -10.412 -1.322 0.887 1.00 0.75 H new ATOM 0 HD22 LEU B 33 -10.118 -0.716 -0.760 1.00 0.75 H new ATOM 0 HD23 LEU B 33 -11.642 -0.327 0.073 1.00 0.75 H new ATOM 2159 N SER B 34 -15.111 -2.140 -3.388 1.00 0.52 N ATOM 2160 CA SER B 34 -16.077 -1.555 -4.342 1.00 0.53 C ATOM 2161 C SER B 34 -15.744 -0.075 -4.615 1.00 0.50 C ATOM 2162 O SER B 34 -14.971 0.533 -3.869 1.00 0.52 O ATOM 2163 CB SER B 34 -17.508 -1.687 -3.796 1.00 0.62 C ATOM 2164 OG SER B 34 -18.471 -1.303 -4.764 1.00 0.69 O ATOM 0 H SER B 34 -15.430 -2.139 -2.419 1.00 0.52 H new ATOM 0 HA SER B 34 -16.007 -2.102 -5.282 1.00 0.53 H new ATOM 0 HB2 SER B 34 -17.688 -2.718 -3.491 1.00 0.62 H new ATOM 0 HB3 SER B 34 -17.618 -1.067 -2.906 1.00 0.62 H new ATOM 0 HG SER B 34 -19.354 -1.246 -4.342 1.00 0.69 H new ATOM 2170 N VAL B 35 -16.331 0.496 -5.690 1.00 0.52 N ATOM 2171 CA VAL B 35 -16.096 1.909 -6.065 1.00 0.53 C ATOM 2172 C VAL B 35 -16.781 2.905 -5.091 1.00 0.48 C ATOM 2173 O VAL B 35 -16.308 4.036 -4.935 1.00 0.52 O ATOM 2174 CB VAL B 35 -16.538 2.188 -7.549 1.00 0.64 C ATOM 2175 CG1 VAL B 35 -18.057 2.066 -7.741 1.00 0.67 C ATOM 2176 CG2 VAL B 35 -16.029 3.551 -8.041 1.00 0.71 C ATOM 0 H VAL B 35 -16.970 0.001 -6.313 1.00 0.52 H new ATOM 0 HA VAL B 35 -15.021 2.074 -5.989 1.00 0.53 H new ATOM 0 HB VAL B 35 -16.075 1.413 -8.161 1.00 0.64 H new ATOM 0 HG11 VAL B 35 -18.310 2.268 -8.782 1.00 0.67 H new ATOM 0 HG12 VAL B 35 -18.377 1.058 -7.479 1.00 0.67 H new ATOM 0 HG13 VAL B 35 -18.564 2.786 -7.098 1.00 0.67 H new ATOM 0 HG21 VAL B 35 -16.353 3.711 -9.070 1.00 0.71 H new ATOM 0 HG22 VAL B 35 -16.432 4.341 -7.407 1.00 0.71 H new ATOM 0 HG23 VAL B 35 -14.940 3.571 -7.996 1.00 0.71 H new ATOM 2186 N ASN B 36 -17.890 2.482 -4.442 1.00 0.47 N ATOM 2187 CA ASN B 36 -18.628 3.338 -3.489 1.00 0.48 C ATOM 2188 C ASN B 36 -18.198 3.087 -2.025 1.00 0.46 C ATOM 2189 O ASN B 36 -18.204 4.022 -1.220 1.00 0.66 O ATOM 2190 CB ASN B 36 -20.148 3.115 -3.654 1.00 0.55 C ATOM 2191 CG ASN B 36 -20.996 4.108 -2.858 1.00 0.64 C ATOM 2192 OD1 ASN B 36 -21.097 5.280 -3.224 1.00 0.83 O ATOM 2193 ND2 ASN B 36 -21.621 3.646 -1.773 1.00 0.79 N ATOM 0 H ASN B 36 -18.292 1.552 -4.562 1.00 0.47 H new ATOM 0 HA ASN B 36 -18.386 4.376 -3.718 1.00 0.48 H new ATOM 0 HB2 ASN B 36 -20.407 3.192 -4.710 1.00 0.55 H new ATOM 0 HB3 ASN B 36 -20.396 2.102 -3.338 1.00 0.55 H new ATOM 0 HD21 ASN B 36 -22.206 4.270 -1.217 1.00 0.79 H new ATOM 0 HD22 ASN B 36 -21.514 2.669 -1.500 1.00 0.79 H new ATOM 2200 N GLU B 37 -17.818 1.835 -1.691 1.00 0.46 N ATOM 2201 CA GLU B 37 -17.408 1.465 -0.314 1.00 0.50 C ATOM 2202 C GLU B 37 -16.063 2.096 0.097 1.00 0.45 C ATOM 2203 O GLU B 37 -15.920 2.546 1.239 1.00 0.46 O ATOM 2204 CB GLU B 37 -17.328 -0.067 -0.169 1.00 0.62 C ATOM 2205 CG GLU B 37 -18.674 -0.774 -0.331 1.00 0.69 C ATOM 2206 CD GLU B 37 -18.584 -2.279 -0.154 1.00 0.88 C ATOM 2207 OE1 GLU B 37 -17.797 -2.921 -0.885 1.00 1.61 O ATOM 2208 OE2 GLU B 37 -19.300 -2.817 0.716 1.00 1.28 O ATOM 0 H GLU B 37 -17.786 1.061 -2.355 1.00 0.46 H new ATOM 0 HA GLU B 37 -18.172 1.861 0.355 1.00 0.50 H new ATOM 0 HB2 GLU B 37 -16.632 -0.457 -0.912 1.00 0.62 H new ATOM 0 HB3 GLU B 37 -16.917 -0.309 0.811 1.00 0.62 H new ATOM 0 HG2 GLU B 37 -19.379 -0.371 0.396 1.00 0.69 H new ATOM 0 HG3 GLU B 37 -19.076 -0.554 -1.320 1.00 0.69 H new ATOM 2215 N PHE B 38 -15.078 2.122 -0.828 1.00 0.43 N ATOM 2216 CA PHE B 38 -13.746 2.698 -0.540 1.00 0.43 C ATOM 2217 C PHE B 38 -13.822 4.232 -0.337 1.00 0.39 C ATOM 2218 O PHE B 38 -13.095 4.778 0.496 1.00 0.42 O ATOM 2219 CB PHE B 38 -12.720 2.299 -1.641 1.00 0.48 C ATOM 2220 CG PHE B 38 -12.500 3.316 -2.753 1.00 0.46 C ATOM 2221 CD1 PHE B 38 -13.381 3.409 -3.825 1.00 0.52 C ATOM 2222 CD2 PHE B 38 -11.412 4.179 -2.714 1.00 0.55 C ATOM 2223 CE1 PHE B 38 -13.177 4.337 -4.829 1.00 0.61 C ATOM 2224 CE2 PHE B 38 -11.207 5.107 -3.716 1.00 0.65 C ATOM 2225 CZ PHE B 38 -12.089 5.186 -4.774 1.00 0.66 C ATOM 0 H PHE B 38 -15.179 1.754 -1.774 1.00 0.43 H new ATOM 0 HA PHE B 38 -13.392 2.277 0.401 1.00 0.43 H new ATOM 0 HB2 PHE B 38 -11.761 2.103 -1.161 1.00 0.48 H new ATOM 0 HB3 PHE B 38 -13.048 1.363 -2.093 1.00 0.48 H new ATOM 0 HD1 PHE B 38 -14.234 2.749 -3.874 1.00 0.52 H new ATOM 0 HD2 PHE B 38 -10.717 4.123 -1.889 1.00 0.55 H new ATOM 0 HE1 PHE B 38 -13.868 4.398 -5.656 1.00 0.61 H new ATOM 0 HE2 PHE B 38 -10.356 5.771 -3.671 1.00 0.65 H new ATOM 0 HZ PHE B 38 -11.929 5.911 -5.558 1.00 0.66 H new ATOM 2235 N LYS B 39 -14.710 4.915 -1.102 1.00 0.37 N ATOM 2236 CA LYS B 39 -14.901 6.380 -0.992 1.00 0.38 C ATOM 2237 C LYS B 39 -15.552 6.749 0.360 1.00 0.36 C ATOM 2238 O LYS B 39 -15.215 7.782 0.946 1.00 0.39 O ATOM 2239 CB LYS B 39 -15.751 6.919 -2.168 1.00 0.43 C ATOM 2240 CG LYS B 39 -15.717 8.445 -2.330 1.00 0.50 C ATOM 2241 CD LYS B 39 -16.654 8.927 -3.445 1.00 0.60 C ATOM 2242 CE LYS B 39 -16.682 10.454 -3.567 1.00 0.70 C ATOM 2243 NZ LYS B 39 -15.440 11.011 -4.183 1.00 0.81 N ATOM 0 H LYS B 39 -15.305 4.472 -1.802 1.00 0.37 H new ATOM 0 HA LYS B 39 -13.918 6.849 -1.040 1.00 0.38 H new ATOM 0 HB2 LYS B 39 -15.401 6.460 -3.093 1.00 0.43 H new ATOM 0 HB3 LYS B 39 -16.785 6.604 -2.027 1.00 0.43 H new ATOM 0 HG2 LYS B 39 -16.002 8.916 -1.389 1.00 0.50 H new ATOM 0 HG3 LYS B 39 -14.698 8.763 -2.550 1.00 0.50 H new ATOM 0 HD2 LYS B 39 -16.336 8.495 -4.394 1.00 0.60 H new ATOM 0 HD3 LYS B 39 -17.663 8.562 -3.251 1.00 0.60 H new ATOM 0 HE2 LYS B 39 -17.543 10.750 -4.166 1.00 0.70 H new ATOM 0 HE3 LYS B 39 -16.818 10.890 -2.577 1.00 0.70 H new ATOM 0 HZ1 LYS B 39 -15.515 12.047 -4.240 1.00 0.81 H new ATOM 0 HZ2 LYS B 39 -14.618 10.755 -3.599 1.00 0.81 H new ATOM 0 HZ3 LYS B 39 -15.321 10.619 -5.139 1.00 0.81 H new ATOM 2257 N GLU B 40 -16.488 5.895 0.846 1.00 0.35 N ATOM 2258 CA GLU B 40 -17.167 6.112 2.146 1.00 0.38 C ATOM 2259 C GLU B 40 -16.159 6.019 3.313 1.00 0.38 C ATOM 2260 O GLU B 40 -16.317 6.708 4.321 1.00 0.41 O ATOM 2261 CB GLU B 40 -18.311 5.091 2.350 1.00 0.43 C ATOM 2262 CG GLU B 40 -19.536 5.334 1.466 1.00 0.47 C ATOM 2263 CD GLU B 40 -20.556 4.209 1.548 1.00 0.56 C ATOM 2264 OE1 GLU B 40 -20.349 3.167 0.889 1.00 0.63 O ATOM 2265 OE2 GLU B 40 -21.564 4.370 2.272 1.00 0.69 O ATOM 0 H GLU B 40 -16.788 5.052 0.357 1.00 0.35 H new ATOM 0 HA GLU B 40 -17.596 7.114 2.134 1.00 0.38 H new ATOM 0 HB2 GLU B 40 -17.928 4.090 2.153 1.00 0.43 H new ATOM 0 HB3 GLU B 40 -18.621 5.114 3.395 1.00 0.43 H new ATOM 0 HG2 GLU B 40 -20.010 6.270 1.760 1.00 0.47 H new ATOM 0 HG3 GLU B 40 -19.214 5.451 0.431 1.00 0.47 H new ATOM 2272 N LEU B 41 -15.126 5.158 3.157 1.00 0.37 N ATOM 2273 CA LEU B 41 -14.070 4.982 4.172 1.00 0.40 C ATOM 2274 C LEU B 41 -13.140 6.213 4.222 1.00 0.38 C ATOM 2275 O LEU B 41 -12.704 6.612 5.306 1.00 0.40 O ATOM 2276 CB LEU B 41 -13.260 3.696 3.886 1.00 0.44 C ATOM 2277 CG LEU B 41 -12.255 3.261 4.978 1.00 0.55 C ATOM 2278 CD1 LEU B 41 -12.978 2.783 6.243 1.00 0.68 C ATOM 2279 CD2 LEU B 41 -11.315 2.175 4.441 1.00 0.64 C ATOM 0 H LEU B 41 -15.005 4.572 2.331 1.00 0.37 H new ATOM 0 HA LEU B 41 -14.546 4.883 5.147 1.00 0.40 H new ATOM 0 HB2 LEU B 41 -13.962 2.879 3.723 1.00 0.44 H new ATOM 0 HB3 LEU B 41 -12.713 3.837 2.954 1.00 0.44 H new ATOM 0 HG LEU B 41 -11.657 4.130 5.250 1.00 0.55 H new ATOM 0 HD11 LEU B 41 -12.244 2.484 6.991 1.00 0.68 H new ATOM 0 HD12 LEU B 41 -13.591 3.592 6.639 1.00 0.68 H new ATOM 0 HD13 LEU B 41 -13.614 1.932 5.999 1.00 0.68 H new ATOM 0 HD21 LEU B 41 -10.615 1.881 5.223 1.00 0.64 H new ATOM 0 HD22 LEU B 41 -11.899 1.308 4.132 1.00 0.64 H new ATOM 0 HD23 LEU B 41 -10.762 2.563 3.586 1.00 0.64 H new ATOM 2291 N VAL B 42 -12.845 6.809 3.042 1.00 0.37 N ATOM 2292 CA VAL B 42 -11.985 8.010 2.948 1.00 0.38 C ATOM 2293 C VAL B 42 -12.674 9.241 3.590 1.00 0.39 C ATOM 2294 O VAL B 42 -11.984 10.127 4.093 1.00 0.43 O ATOM 2295 CB VAL B 42 -11.571 8.325 1.462 1.00 0.43 C ATOM 2296 CG1 VAL B 42 -10.760 9.629 1.342 1.00 0.48 C ATOM 2297 CG2 VAL B 42 -10.775 7.162 0.854 1.00 0.47 C ATOM 0 H VAL B 42 -13.191 6.476 2.142 1.00 0.37 H new ATOM 0 HA VAL B 42 -11.074 7.791 3.505 1.00 0.38 H new ATOM 0 HB VAL B 42 -12.499 8.457 0.905 1.00 0.43 H new ATOM 0 HG11 VAL B 42 -10.499 9.801 0.298 1.00 0.48 H new ATOM 0 HG12 VAL B 42 -11.357 10.464 1.709 1.00 0.48 H new ATOM 0 HG13 VAL B 42 -9.849 9.547 1.935 1.00 0.48 H new ATOM 0 HG21 VAL B 42 -10.502 7.406 -0.173 1.00 0.47 H new ATOM 0 HG22 VAL B 42 -9.871 6.994 1.440 1.00 0.47 H new ATOM 0 HG23 VAL B 42 -11.386 6.259 0.862 1.00 0.47 H new ATOM 2307 N THR B 43 -14.027 9.285 3.576 1.00 0.38 N ATOM 2308 CA THR B 43 -14.784 10.406 4.165 1.00 0.42 C ATOM 2309 C THR B 43 -15.472 9.981 5.488 1.00 0.48 C ATOM 2310 O THR B 43 -16.617 10.369 5.757 1.00 0.83 O ATOM 2311 CB THR B 43 -15.844 10.958 3.153 1.00 0.44 C ATOM 2312 OG1 THR B 43 -15.341 10.897 1.806 1.00 0.46 O ATOM 2313 CG2 THR B 43 -16.230 12.404 3.479 1.00 0.49 C ATOM 0 H THR B 43 -14.612 8.558 3.164 1.00 0.38 H new ATOM 0 HA THR B 43 -14.074 11.202 4.390 1.00 0.42 H new ATOM 0 HB THR B 43 -16.730 10.330 3.241 1.00 0.44 H new ATOM 0 HG1 THR B 43 -15.335 9.966 1.501 1.00 0.46 H new ATOM 0 HG21 THR B 43 -16.967 12.755 2.757 1.00 0.49 H new ATOM 0 HG22 THR B 43 -16.654 12.450 4.482 1.00 0.49 H new ATOM 0 HG23 THR B 43 -15.344 13.037 3.430 1.00 0.49 H new ATOM 2321 N GLN B 44 -14.760 9.193 6.328 1.00 0.42 N ATOM 2322 CA GLN B 44 -15.304 8.718 7.615 1.00 0.44 C ATOM 2323 C GLN B 44 -14.179 8.284 8.580 1.00 0.44 C ATOM 2324 O GLN B 44 -14.078 8.814 9.692 1.00 0.50 O ATOM 2325 CB GLN B 44 -16.296 7.552 7.380 1.00 0.47 C ATOM 2326 CG GLN B 44 -17.277 7.314 8.529 1.00 0.58 C ATOM 2327 CD GLN B 44 -18.248 6.165 8.262 1.00 0.67 C ATOM 2328 OE1 GLN B 44 -18.594 5.879 7.112 1.00 0.91 O ATOM 2329 NE2 GLN B 44 -18.711 5.504 9.324 1.00 0.98 N ATOM 0 H GLN B 44 -13.810 8.875 6.135 1.00 0.42 H new ATOM 0 HA GLN B 44 -15.836 9.548 8.080 1.00 0.44 H new ATOM 0 HB2 GLN B 44 -16.863 7.751 6.470 1.00 0.47 H new ATOM 0 HB3 GLN B 44 -15.728 6.638 7.208 1.00 0.47 H new ATOM 0 HG2 GLN B 44 -16.716 7.103 9.440 1.00 0.58 H new ATOM 0 HG3 GLN B 44 -17.845 8.227 8.709 1.00 0.58 H new ATOM 0 HE21 GLN B 44 -18.405 5.766 10.261 1.00 0.98 H new ATOM 0 HE22 GLN B 44 -19.371 4.737 9.199 1.00 0.98 H new ATOM 2338 N GLN B 45 -13.335 7.323 8.140 1.00 0.42 N ATOM 2339 CA GLN B 45 -12.223 6.796 8.959 1.00 0.43 C ATOM 2340 C GLN B 45 -10.837 7.245 8.434 1.00 0.41 C ATOM 2341 O GLN B 45 -9.839 7.097 9.152 1.00 0.46 O ATOM 2342 CB GLN B 45 -12.310 5.254 9.007 1.00 0.47 C ATOM 2343 CG GLN B 45 -11.487 4.604 10.127 1.00 0.57 C ATOM 2344 CD GLN B 45 -11.877 3.150 10.399 1.00 0.62 C ATOM 2345 OE1 GLN B 45 -12.291 2.424 9.495 1.00 0.70 O ATOM 2346 NE2 GLN B 45 -11.749 2.711 11.655 1.00 0.73 N ATOM 0 H GLN B 45 -13.405 6.896 7.217 1.00 0.42 H new ATOM 0 HA GLN B 45 -12.324 7.206 9.964 1.00 0.43 H new ATOM 0 HB2 GLN B 45 -13.354 4.965 9.127 1.00 0.47 H new ATOM 0 HB3 GLN B 45 -11.976 4.854 8.049 1.00 0.47 H new ATOM 0 HG2 GLN B 45 -10.430 4.646 9.863 1.00 0.57 H new ATOM 0 HG3 GLN B 45 -11.610 5.183 11.042 1.00 0.57 H new ATOM 0 HE21 GLN B 45 -11.403 3.338 12.382 1.00 0.73 H new ATOM 0 HE22 GLN B 45 -11.997 1.749 11.887 1.00 0.73 H new ATOM 2355 N LEU B 46 -10.770 7.794 7.195 1.00 0.39 N ATOM 2356 CA LEU B 46 -9.500 8.254 6.597 1.00 0.38 C ATOM 2357 C LEU B 46 -9.624 9.676 5.952 1.00 0.38 C ATOM 2358 O LEU B 46 -9.067 9.903 4.869 1.00 0.41 O ATOM 2359 CB LEU B 46 -9.053 7.209 5.535 1.00 0.40 C ATOM 2360 CG LEU B 46 -7.536 6.969 5.399 1.00 0.41 C ATOM 2361 CD1 LEU B 46 -6.993 6.149 6.577 1.00 0.58 C ATOM 2362 CD2 LEU B 46 -7.226 6.276 4.068 1.00 0.62 C ATOM 0 H LEU B 46 -11.583 7.927 6.594 1.00 0.39 H new ATOM 0 HA LEU B 46 -8.754 8.340 7.387 1.00 0.38 H new ATOM 0 HB2 LEU B 46 -9.529 6.257 5.772 1.00 0.40 H new ATOM 0 HB3 LEU B 46 -9.437 7.524 4.565 1.00 0.40 H new ATOM 0 HG LEU B 46 -7.037 7.938 5.414 1.00 0.41 H new ATOM 0 HD11 LEU B 46 -5.921 5.997 6.451 1.00 0.58 H new ATOM 0 HD12 LEU B 46 -7.177 6.684 7.508 1.00 0.58 H new ATOM 0 HD13 LEU B 46 -7.495 5.182 6.609 1.00 0.58 H new ATOM 0 HD21 LEU B 46 -6.152 6.112 3.985 1.00 0.62 H new ATOM 0 HD22 LEU B 46 -7.743 5.317 4.028 1.00 0.62 H new ATOM 0 HD23 LEU B 46 -7.562 6.905 3.243 1.00 0.62 H new ATOM 2374 N PRO B 47 -10.316 10.677 6.603 1.00 0.40 N ATOM 2375 CA PRO B 47 -10.475 12.030 6.021 1.00 0.42 C ATOM 2376 C PRO B 47 -9.242 12.949 6.171 1.00 0.42 C ATOM 2377 O PRO B 47 -8.928 13.705 5.248 1.00 0.46 O ATOM 2378 CB PRO B 47 -11.678 12.587 6.793 1.00 0.48 C ATOM 2379 CG PRO B 47 -11.586 11.956 8.142 1.00 0.48 C ATOM 2380 CD PRO B 47 -10.994 10.586 7.928 1.00 0.44 C ATOM 0 HA PRO B 47 -10.607 11.982 4.940 1.00 0.42 H new ATOM 0 HB2 PRO B 47 -11.637 13.674 6.860 1.00 0.48 H new ATOM 0 HB3 PRO B 47 -12.617 12.334 6.300 1.00 0.48 H new ATOM 0 HG2 PRO B 47 -10.960 12.550 8.808 1.00 0.48 H new ATOM 0 HG3 PRO B 47 -12.569 11.886 8.607 1.00 0.48 H new ATOM 0 HD2 PRO B 47 -10.288 10.330 8.718 1.00 0.44 H new ATOM 0 HD3 PRO B 47 -11.765 9.816 7.928 1.00 0.44 H new ATOM 2388 N HIS B 48 -8.548 12.883 7.327 1.00 0.42 N ATOM 2389 CA HIS B 48 -7.363 13.731 7.579 1.00 0.44 C ATOM 2390 C HIS B 48 -6.133 13.287 6.759 1.00 0.43 C ATOM 2391 O HIS B 48 -5.229 14.099 6.529 1.00 0.49 O ATOM 2392 CB HIS B 48 -7.009 13.754 9.081 1.00 0.49 C ATOM 2393 CG HIS B 48 -8.060 14.383 9.954 1.00 0.56 C ATOM 2394 ND1 HIS B 48 -8.747 13.688 10.928 1.00 0.67 N ATOM 2395 CD2 HIS B 48 -8.538 15.654 9.997 1.00 0.70 C ATOM 2396 CE1 HIS B 48 -9.602 14.497 11.527 1.00 0.79 C ATOM 2397 NE2 HIS B 48 -9.494 15.696 10.985 1.00 0.81 N ATOM 0 H HIS B 48 -8.785 12.256 8.096 1.00 0.42 H new ATOM 0 HA HIS B 48 -7.630 14.737 7.256 1.00 0.44 H new ATOM 0 HB2 HIS B 48 -6.838 12.732 9.418 1.00 0.49 H new ATOM 0 HB3 HIS B 48 -6.072 14.295 9.213 1.00 0.49 H new ATOM 0 HD2 HIS B 48 -8.226 16.478 9.372 1.00 0.70 H new ATOM 0 HE1 HIS B 48 -10.276 14.224 12.326 1.00 0.79 H new ATOM 0 HE2 HIS B 48 -10.032 16.519 11.255 1.00 0.81 H new ATOM 2406 N LEU B 49 -6.099 12.009 6.311 1.00 0.41 N ATOM 2407 CA LEU B 49 -4.972 11.483 5.523 1.00 0.42 C ATOM 2408 C LEU B 49 -4.993 12.052 4.092 1.00 0.40 C ATOM 2409 O LEU B 49 -4.077 12.789 3.711 1.00 0.48 O ATOM 2410 CB LEU B 49 -4.991 9.938 5.509 1.00 0.43 C ATOM 2411 CG LEU B 49 -3.660 9.240 5.157 1.00 0.52 C ATOM 2412 CD1 LEU B 49 -2.579 9.532 6.199 1.00 0.88 C ATOM 2413 CD2 LEU B 49 -3.878 7.736 5.019 1.00 0.62 C ATOM 0 H LEU B 49 -6.840 11.330 6.484 1.00 0.41 H new ATOM 0 HA LEU B 49 -4.044 11.803 5.996 1.00 0.42 H new ATOM 0 HB2 LEU B 49 -5.310 9.591 6.492 1.00 0.43 H new ATOM 0 HB3 LEU B 49 -5.747 9.612 4.795 1.00 0.43 H new ATOM 0 HG LEU B 49 -3.313 9.639 4.204 1.00 0.52 H new ATOM 0 HD11 LEU B 49 -1.656 9.024 5.918 1.00 0.88 H new ATOM 0 HD12 LEU B 49 -2.402 10.606 6.248 1.00 0.88 H new ATOM 0 HD13 LEU B 49 -2.908 9.174 7.175 1.00 0.88 H new ATOM 0 HD21 LEU B 49 -2.933 7.253 4.771 1.00 0.62 H new ATOM 0 HD22 LEU B 49 -4.254 7.335 5.960 1.00 0.62 H new ATOM 0 HD23 LEU B 49 -4.603 7.544 4.228 1.00 0.62 H new ATOM 2425 N LEU B 50 -6.038 11.711 3.306 1.00 0.38 N ATOM 2426 CA LEU B 50 -6.176 12.221 1.935 1.00 0.41 C ATOM 2427 C LEU B 50 -6.914 13.570 1.983 1.00 0.45 C ATOM 2428 O LEU B 50 -8.141 13.608 2.123 1.00 0.52 O ATOM 2429 CB LEU B 50 -6.913 11.207 1.023 1.00 0.44 C ATOM 2430 CG LEU B 50 -6.225 9.825 0.844 1.00 0.51 C ATOM 2431 CD1 LEU B 50 -7.103 8.877 0.024 1.00 0.57 C ATOM 2432 CD2 LEU B 50 -4.841 9.962 0.196 1.00 0.70 C ATOM 0 H LEU B 50 -6.791 11.089 3.600 1.00 0.38 H new ATOM 0 HA LEU B 50 -5.186 12.364 1.503 1.00 0.41 H new ATOM 0 HB2 LEU B 50 -7.912 11.044 1.428 1.00 0.44 H new ATOM 0 HB3 LEU B 50 -7.038 11.658 0.039 1.00 0.44 H new ATOM 0 HG LEU B 50 -6.090 9.401 1.839 1.00 0.51 H new ATOM 0 HD11 LEU B 50 -6.598 7.917 -0.086 1.00 0.57 H new ATOM 0 HD12 LEU B 50 -8.055 8.730 0.534 1.00 0.57 H new ATOM 0 HD13 LEU B 50 -7.282 9.308 -0.961 1.00 0.57 H new ATOM 0 HD21 LEU B 50 -4.391 8.975 0.087 1.00 0.70 H new ATOM 0 HD22 LEU B 50 -4.943 10.425 -0.786 1.00 0.70 H new ATOM 0 HD23 LEU B 50 -4.204 10.584 0.826 1.00 0.70 H new ATOM 2444 N LYS B 51 -6.132 14.674 1.906 1.00 0.50 N ATOM 2445 CA LYS B 51 -6.664 16.062 1.962 1.00 0.58 C ATOM 2446 C LYS B 51 -7.901 16.279 1.065 1.00 0.53 C ATOM 2447 O LYS B 51 -8.855 16.942 1.484 1.00 0.61 O ATOM 2448 CB LYS B 51 -5.564 17.100 1.614 1.00 0.68 C ATOM 2449 CG LYS B 51 -4.784 16.825 0.318 1.00 0.72 C ATOM 2450 CD LYS B 51 -3.926 18.020 -0.105 1.00 1.06 C ATOM 2451 CE LYS B 51 -3.106 17.738 -1.367 1.00 1.03 C ATOM 2452 NZ LYS B 51 -3.955 17.460 -2.567 1.00 1.23 N ATOM 0 H LYS B 51 -5.118 14.630 1.804 1.00 0.50 H new ATOM 0 HA LYS B 51 -6.988 16.213 2.992 1.00 0.58 H new ATOM 0 HB2 LYS B 51 -6.028 18.083 1.537 1.00 0.68 H new ATOM 0 HB3 LYS B 51 -4.856 17.145 2.442 1.00 0.68 H new ATOM 0 HG2 LYS B 51 -4.145 15.953 0.458 1.00 0.72 H new ATOM 0 HG3 LYS B 51 -5.484 16.582 -0.481 1.00 0.72 H new ATOM 0 HD2 LYS B 51 -4.570 18.882 -0.280 1.00 1.06 H new ATOM 0 HD3 LYS B 51 -3.252 18.286 0.710 1.00 1.06 H new ATOM 0 HE2 LYS B 51 -2.463 18.593 -1.574 1.00 1.03 H new ATOM 0 HE3 LYS B 51 -2.453 16.885 -1.186 1.00 1.03 H new ATOM 0 HZ1 LYS B 51 -3.347 17.344 -3.403 1.00 1.23 H new ATOM 0 HZ2 LYS B 51 -4.501 16.588 -2.412 1.00 1.23 H new ATOM 0 HZ3 LYS B 51 -4.608 18.254 -2.722 1.00 1.23 H new ATOM 2466 N ASP B 52 -7.883 15.713 -0.156 1.00 0.48 N ATOM 2467 CA ASP B 52 -9.002 15.848 -1.099 1.00 0.54 C ATOM 2468 C ASP B 52 -10.000 14.677 -0.917 1.00 0.48 C ATOM 2469 O ASP B 52 -9.908 13.657 -1.609 1.00 0.60 O ATOM 2470 CB ASP B 52 -8.463 15.921 -2.554 1.00 0.69 C ATOM 2471 CG ASP B 52 -9.424 16.590 -3.534 1.00 1.20 C ATOM 2472 OD1 ASP B 52 -10.641 16.635 -3.252 1.00 1.78 O ATOM 2473 OD2 ASP B 52 -8.950 17.076 -4.583 1.00 1.94 O ATOM 0 H ASP B 52 -7.104 15.158 -0.510 1.00 0.48 H new ATOM 0 HA ASP B 52 -9.539 16.774 -0.894 1.00 0.54 H new ATOM 0 HB2 ASP B 52 -7.519 16.467 -2.555 1.00 0.69 H new ATOM 0 HB3 ASP B 52 -8.248 14.911 -2.903 1.00 0.69 H new ATOM 2478 N VAL B 53 -10.939 14.830 0.043 1.00 0.44 N ATOM 2479 CA VAL B 53 -11.961 13.792 0.331 1.00 0.45 C ATOM 2480 C VAL B 53 -13.201 13.919 -0.584 1.00 0.46 C ATOM 2481 O VAL B 53 -13.849 12.912 -0.885 1.00 0.57 O ATOM 2482 CB VAL B 53 -12.429 13.797 1.833 1.00 0.53 C ATOM 2483 CG1 VAL B 53 -11.267 13.506 2.780 1.00 0.60 C ATOM 2484 CG2 VAL B 53 -13.128 15.111 2.227 1.00 0.58 C ATOM 0 H VAL B 53 -11.013 15.660 0.632 1.00 0.44 H new ATOM 0 HA VAL B 53 -11.464 12.844 0.127 1.00 0.45 H new ATOM 0 HB VAL B 53 -13.163 12.996 1.928 1.00 0.53 H new ATOM 0 HG11 VAL B 53 -11.625 13.517 3.809 1.00 0.60 H new ATOM 0 HG12 VAL B 53 -10.848 12.526 2.552 1.00 0.60 H new ATOM 0 HG13 VAL B 53 -10.497 14.267 2.656 1.00 0.60 H new ATOM 0 HG21 VAL B 53 -13.431 15.062 3.273 1.00 0.58 H new ATOM 0 HG22 VAL B 53 -12.440 15.945 2.087 1.00 0.58 H new ATOM 0 HG23 VAL B 53 -14.008 15.257 1.601 1.00 0.58 H new ATOM 2494 N GLY B 54 -13.527 15.160 -1.010 1.00 0.44 N ATOM 2495 CA GLY B 54 -14.689 15.403 -1.863 1.00 0.51 C ATOM 2496 C GLY B 54 -14.432 15.106 -3.333 1.00 0.51 C ATOM 2497 O GLY B 54 -15.240 14.426 -3.969 1.00 0.67 O ATOM 0 H GLY B 54 -12.998 15.999 -0.773 1.00 0.44 H new ATOM 0 HA2 GLY B 54 -15.520 14.789 -1.516 1.00 0.51 H new ATOM 0 HA3 GLY B 54 -14.996 16.444 -1.758 1.00 0.51 H new ATOM 2501 N SER B 55 -13.308 15.617 -3.874 1.00 0.51 N ATOM 2502 CA SER B 55 -12.947 15.411 -5.283 1.00 0.57 C ATOM 2503 C SER B 55 -11.903 14.283 -5.419 1.00 0.52 C ATOM 2504 O SER B 55 -10.768 14.515 -5.861 1.00 0.63 O ATOM 2505 CB SER B 55 -12.436 16.730 -5.899 1.00 0.74 C ATOM 2506 OG SER B 55 -12.341 16.639 -7.312 1.00 0.92 O ATOM 0 H SER B 55 -12.635 16.177 -3.351 1.00 0.51 H new ATOM 0 HA SER B 55 -13.836 15.103 -5.833 1.00 0.57 H new ATOM 0 HB2 SER B 55 -13.109 17.544 -5.630 1.00 0.74 H new ATOM 0 HB3 SER B 55 -11.459 16.973 -5.482 1.00 0.74 H new ATOM 0 HG SER B 55 -12.448 15.705 -7.588 1.00 0.92 H new ATOM 2512 N LEU B 56 -12.299 13.052 -5.024 1.00 0.47 N ATOM 2513 CA LEU B 56 -11.423 11.870 -5.114 1.00 0.47 C ATOM 2514 C LEU B 56 -11.725 11.122 -6.429 1.00 0.48 C ATOM 2515 O LEU B 56 -12.280 10.018 -6.428 1.00 0.81 O ATOM 2516 CB LEU B 56 -11.598 10.960 -3.856 1.00 0.58 C ATOM 2517 CG LEU B 56 -10.452 9.956 -3.516 1.00 0.75 C ATOM 2518 CD1 LEU B 56 -10.399 8.787 -4.503 1.00 1.09 C ATOM 2519 CD2 LEU B 56 -9.089 10.659 -3.432 1.00 1.24 C ATOM 0 H LEU B 56 -13.223 12.855 -4.639 1.00 0.47 H new ATOM 0 HA LEU B 56 -10.377 12.178 -5.130 1.00 0.47 H new ATOM 0 HB2 LEU B 56 -11.742 11.608 -2.992 1.00 0.58 H new ATOM 0 HB3 LEU B 56 -12.517 10.388 -3.982 1.00 0.58 H new ATOM 0 HG LEU B 56 -10.681 9.545 -2.533 1.00 0.75 H new ATOM 0 HD11 LEU B 56 -9.587 8.114 -4.227 1.00 1.09 H new ATOM 0 HD12 LEU B 56 -11.344 8.245 -4.476 1.00 1.09 H new ATOM 0 HD13 LEU B 56 -10.228 9.168 -5.510 1.00 1.09 H new ATOM 0 HD21 LEU B 56 -8.317 9.928 -3.194 1.00 1.24 H new ATOM 0 HD22 LEU B 56 -8.862 11.128 -4.389 1.00 1.24 H new ATOM 0 HD23 LEU B 56 -9.120 11.421 -2.653 1.00 1.24 H new ATOM 2531 N ASP B 57 -11.376 11.776 -7.553 1.00 0.48 N ATOM 2532 CA ASP B 57 -11.578 11.223 -8.908 1.00 0.49 C ATOM 2533 C ASP B 57 -10.234 10.993 -9.628 1.00 0.44 C ATOM 2534 O ASP B 57 -10.120 10.057 -10.428 1.00 0.46 O ATOM 2535 CB ASP B 57 -12.494 12.143 -9.750 1.00 0.60 C ATOM 2536 CG ASP B 57 -11.993 13.580 -9.861 1.00 0.64 C ATOM 2537 OD1 ASP B 57 -11.122 13.843 -10.715 1.00 0.69 O ATOM 2538 OD2 ASP B 57 -12.474 14.436 -9.089 1.00 0.73 O ATOM 0 H ASP B 57 -10.947 12.701 -7.549 1.00 0.48 H new ATOM 0 HA ASP B 57 -12.069 10.256 -8.797 1.00 0.49 H new ATOM 0 HB2 ASP B 57 -12.591 11.724 -10.752 1.00 0.60 H new ATOM 0 HB3 ASP B 57 -13.491 12.149 -9.309 1.00 0.60 H new ATOM 2543 N GLU B 58 -9.222 11.855 -9.350 1.00 0.45 N ATOM 2544 CA GLU B 58 -7.879 11.731 -9.956 1.00 0.50 C ATOM 2545 C GLU B 58 -7.242 10.366 -9.609 1.00 0.47 C ATOM 2546 O GLU B 58 -6.611 9.741 -10.466 1.00 0.57 O ATOM 2547 CB GLU B 58 -6.967 12.890 -9.491 1.00 0.59 C ATOM 2548 CG GLU B 58 -5.680 13.039 -10.301 1.00 0.73 C ATOM 2549 CD GLU B 58 -4.927 14.322 -9.987 1.00 0.92 C ATOM 2550 OE1 GLU B 58 -4.100 14.309 -9.052 1.00 1.06 O ATOM 2551 OE2 GLU B 58 -5.169 15.338 -10.673 1.00 1.10 O ATOM 0 H GLU B 58 -9.315 12.643 -8.709 1.00 0.45 H new ATOM 0 HA GLU B 58 -7.987 11.789 -11.039 1.00 0.50 H new ATOM 0 HB2 GLU B 58 -7.528 13.823 -9.546 1.00 0.59 H new ATOM 0 HB3 GLU B 58 -6.708 12.735 -8.444 1.00 0.59 H new ATOM 0 HG2 GLU B 58 -5.031 12.186 -10.103 1.00 0.73 H new ATOM 0 HG3 GLU B 58 -5.921 13.016 -11.364 1.00 0.73 H new ATOM 2558 N LYS B 59 -7.425 9.913 -8.345 1.00 0.43 N ATOM 2559 CA LYS B 59 -6.898 8.615 -7.882 1.00 0.48 C ATOM 2560 C LYS B 59 -7.815 7.467 -8.352 1.00 0.54 C ATOM 2561 O LYS B 59 -7.321 6.446 -8.824 1.00 0.91 O ATOM 2562 CB LYS B 59 -6.750 8.579 -6.338 1.00 0.52 C ATOM 2563 CG LYS B 59 -5.514 9.311 -5.784 1.00 0.59 C ATOM 2564 CD LYS B 59 -5.666 10.838 -5.781 1.00 0.79 C ATOM 2565 CE LYS B 59 -4.474 11.530 -5.120 1.00 1.19 C ATOM 2566 NZ LYS B 59 -4.629 13.015 -5.081 1.00 1.47 N ATOM 0 H LYS B 59 -7.935 10.432 -7.630 1.00 0.43 H new ATOM 0 HA LYS B 59 -5.907 8.485 -8.318 1.00 0.48 H new ATOM 0 HB2 LYS B 59 -7.643 9.018 -5.892 1.00 0.52 H new ATOM 0 HB3 LYS B 59 -6.711 7.538 -6.016 1.00 0.52 H new ATOM 0 HG2 LYS B 59 -5.323 8.969 -4.767 1.00 0.59 H new ATOM 0 HG3 LYS B 59 -4.642 9.040 -6.380 1.00 0.59 H new ATOM 0 HD2 LYS B 59 -5.770 11.194 -6.806 1.00 0.79 H new ATOM 0 HD3 LYS B 59 -6.581 11.110 -5.255 1.00 0.79 H new ATOM 0 HE2 LYS B 59 -4.356 11.153 -4.104 1.00 1.19 H new ATOM 0 HE3 LYS B 59 -3.563 11.276 -5.662 1.00 1.19 H new ATOM 0 HZ1 LYS B 59 -3.797 13.439 -4.624 1.00 1.47 H new ATOM 0 HZ2 LYS B 59 -4.715 13.381 -6.051 1.00 1.47 H new ATOM 0 HZ3 LYS B 59 -5.483 13.261 -4.541 1.00 1.47 H new ATOM 2580 N MET B 60 -9.154 7.663 -8.244 1.00 0.40 N ATOM 2581 CA MET B 60 -10.165 6.650 -8.651 1.00 0.43 C ATOM 2582 C MET B 60 -9.919 6.090 -10.075 1.00 0.45 C ATOM 2583 O MET B 60 -10.125 4.893 -10.307 1.00 0.49 O ATOM 2584 CB MET B 60 -11.584 7.253 -8.548 1.00 0.47 C ATOM 2585 CG MET B 60 -12.715 6.218 -8.535 1.00 0.55 C ATOM 2586 SD MET B 60 -14.357 6.954 -8.341 1.00 0.67 S ATOM 2587 CE MET B 60 -14.671 7.588 -9.991 1.00 0.81 C ATOM 0 H MET B 60 -9.562 8.522 -7.875 1.00 0.40 H new ATOM 0 HA MET B 60 -10.070 5.808 -7.965 1.00 0.43 H new ATOM 0 HB2 MET B 60 -11.646 7.851 -7.639 1.00 0.47 H new ATOM 0 HB3 MET B 60 -11.739 7.931 -9.387 1.00 0.47 H new ATOM 0 HG2 MET B 60 -12.687 5.648 -9.464 1.00 0.55 H new ATOM 0 HG3 MET B 60 -12.543 5.512 -7.723 1.00 0.55 H new ATOM 0 HE1 MET B 60 -15.649 8.068 -10.016 1.00 0.81 H new ATOM 0 HE2 MET B 60 -13.903 8.316 -10.253 1.00 0.81 H new ATOM 0 HE3 MET B 60 -14.651 6.766 -10.706 1.00 0.81 H new ATOM 2597 N LYS B 61 -9.486 6.955 -11.021 1.00 0.47 N ATOM 2598 CA LYS B 61 -9.201 6.528 -12.412 1.00 0.53 C ATOM 2599 C LYS B 61 -7.898 5.709 -12.485 1.00 0.48 C ATOM 2600 O LYS B 61 -7.830 4.718 -13.219 1.00 0.52 O ATOM 2601 CB LYS B 61 -9.117 7.738 -13.364 1.00 0.63 C ATOM 2602 CG LYS B 61 -10.477 8.303 -13.784 1.00 0.78 C ATOM 2603 CD LYS B 61 -10.374 9.235 -15.003 1.00 1.13 C ATOM 2604 CE LYS B 61 -9.857 10.630 -14.642 1.00 1.87 C ATOM 2605 NZ LYS B 61 -10.867 11.434 -13.891 1.00 2.39 N ATOM 0 H LYS B 61 -9.327 7.948 -10.849 1.00 0.47 H new ATOM 0 HA LYS B 61 -10.029 5.895 -12.732 1.00 0.53 H new ATOM 0 HB2 LYS B 61 -8.542 8.528 -12.880 1.00 0.63 H new ATOM 0 HB3 LYS B 61 -8.566 7.445 -14.258 1.00 0.63 H new ATOM 0 HG2 LYS B 61 -11.153 7.480 -14.015 1.00 0.78 H new ATOM 0 HG3 LYS B 61 -10.914 8.849 -12.948 1.00 0.78 H new ATOM 0 HD2 LYS B 61 -9.710 8.787 -15.742 1.00 1.13 H new ATOM 0 HD3 LYS B 61 -11.355 9.326 -15.469 1.00 1.13 H new ATOM 0 HE2 LYS B 61 -8.952 10.535 -14.041 1.00 1.87 H new ATOM 0 HE3 LYS B 61 -9.580 11.159 -15.554 1.00 1.87 H new ATOM 0 HZ1 LYS B 61 -10.526 12.411 -13.788 1.00 2.39 H new ATOM 0 HZ2 LYS B 61 -11.767 11.435 -14.412 1.00 2.39 H new ATOM 0 HZ3 LYS B 61 -11.012 11.017 -12.950 1.00 2.39 H new ATOM 2619 N SER B 62 -6.863 6.139 -11.728 1.00 0.46 N ATOM 2620 CA SER B 62 -5.564 5.435 -11.676 1.00 0.47 C ATOM 2621 C SER B 62 -5.677 4.101 -10.908 1.00 0.44 C ATOM 2622 O SER B 62 -4.881 3.186 -11.138 1.00 0.50 O ATOM 2623 CB SER B 62 -4.489 6.323 -11.029 1.00 0.54 C ATOM 2624 OG SER B 62 -4.247 7.483 -11.808 1.00 0.63 O ATOM 0 H SER B 62 -6.904 6.974 -11.143 1.00 0.46 H new ATOM 0 HA SER B 62 -5.271 5.215 -12.702 1.00 0.47 H new ATOM 0 HB2 SER B 62 -4.807 6.614 -10.028 1.00 0.54 H new ATOM 0 HB3 SER B 62 -3.564 5.757 -10.918 1.00 0.54 H new ATOM 0 HG SER B 62 -3.561 8.031 -11.374 1.00 0.63 H new ATOM 2630 N LEU B 63 -6.665 4.009 -9.989 1.00 0.41 N ATOM 2631 CA LEU B 63 -6.910 2.793 -9.199 1.00 0.44 C ATOM 2632 C LEU B 63 -7.526 1.691 -10.076 1.00 0.47 C ATOM 2633 O LEU B 63 -6.915 0.642 -10.277 1.00 0.57 O ATOM 2634 CB LEU B 63 -7.854 3.098 -8.010 1.00 0.45 C ATOM 2635 CG LEU B 63 -7.275 3.993 -6.891 1.00 0.42 C ATOM 2636 CD1 LEU B 63 -8.392 4.564 -6.001 1.00 0.47 C ATOM 2637 CD2 LEU B 63 -6.254 3.224 -6.055 1.00 0.69 C ATOM 0 H LEU B 63 -7.308 4.773 -9.779 1.00 0.41 H new ATOM 0 HA LEU B 63 -5.952 2.445 -8.813 1.00 0.44 H new ATOM 0 HB2 LEU B 63 -8.753 3.576 -8.400 1.00 0.45 H new ATOM 0 HB3 LEU B 63 -8.163 2.152 -7.566 1.00 0.45 H new ATOM 0 HG LEU B 63 -6.765 4.832 -7.365 1.00 0.42 H new ATOM 0 HD11 LEU B 63 -7.954 5.189 -5.223 1.00 0.47 H new ATOM 0 HD12 LEU B 63 -9.071 5.163 -6.608 1.00 0.47 H new ATOM 0 HD13 LEU B 63 -8.944 3.745 -5.540 1.00 0.47 H new ATOM 0 HD21 LEU B 63 -5.860 3.874 -5.274 1.00 0.69 H new ATOM 0 HD22 LEU B 63 -6.735 2.359 -5.599 1.00 0.69 H new ATOM 0 HD23 LEU B 63 -5.437 2.890 -6.695 1.00 0.69 H new ATOM 2649 N ASP B 64 -8.727 1.965 -10.627 1.00 0.47 N ATOM 2650 CA ASP B 64 -9.453 1.005 -11.466 1.00 0.55 C ATOM 2651 C ASP B 64 -9.054 1.190 -12.944 1.00 0.53 C ATOM 2652 O ASP B 64 -9.728 1.903 -13.698 1.00 0.60 O ATOM 2653 CB ASP B 64 -10.975 1.179 -11.252 1.00 0.66 C ATOM 2654 CG ASP B 64 -11.809 0.065 -11.865 1.00 0.85 C ATOM 2655 OD1 ASP B 64 -12.045 0.104 -13.090 1.00 1.32 O ATOM 2656 OD2 ASP B 64 -12.232 -0.841 -11.116 1.00 1.27 O ATOM 0 H ASP B 64 -9.213 2.853 -10.501 1.00 0.47 H new ATOM 0 HA ASP B 64 -9.188 -0.013 -11.181 1.00 0.55 H new ATOM 0 HB2 ASP B 64 -11.179 1.228 -10.182 1.00 0.66 H new ATOM 0 HB3 ASP B 64 -11.287 2.132 -11.680 1.00 0.66 H new ATOM 2661 N VAL B 65 -7.934 0.551 -13.330 1.00 0.53 N ATOM 2662 CA VAL B 65 -7.404 0.622 -14.707 1.00 0.56 C ATOM 2663 C VAL B 65 -7.988 -0.499 -15.614 1.00 0.56 C ATOM 2664 O VAL B 65 -7.993 -0.360 -16.839 1.00 0.61 O ATOM 2665 CB VAL B 65 -5.831 0.599 -14.703 1.00 0.64 C ATOM 2666 CG1 VAL B 65 -5.258 -0.740 -14.212 1.00 0.68 C ATOM 2667 CG2 VAL B 65 -5.253 0.977 -16.074 1.00 0.72 C ATOM 0 H VAL B 65 -7.374 -0.025 -12.702 1.00 0.53 H new ATOM 0 HA VAL B 65 -7.726 1.572 -15.134 1.00 0.56 H new ATOM 0 HB VAL B 65 -5.519 1.358 -13.986 1.00 0.64 H new ATOM 0 HG11 VAL B 65 -4.169 -0.698 -14.230 1.00 0.68 H new ATOM 0 HG12 VAL B 65 -5.597 -0.929 -13.193 1.00 0.68 H new ATOM 0 HG13 VAL B 65 -5.601 -1.544 -14.864 1.00 0.68 H new ATOM 0 HG21 VAL B 65 -4.164 0.949 -16.030 1.00 0.72 H new ATOM 0 HG22 VAL B 65 -5.604 0.269 -16.825 1.00 0.72 H new ATOM 0 HG23 VAL B 65 -5.580 1.982 -16.342 1.00 0.72 H new ATOM 2677 N ASN B 66 -8.494 -1.591 -14.998 1.00 0.56 N ATOM 2678 CA ASN B 66 -9.083 -2.733 -15.731 1.00 0.60 C ATOM 2679 C ASN B 66 -10.506 -2.425 -16.274 1.00 0.61 C ATOM 2680 O ASN B 66 -10.959 -3.090 -17.207 1.00 0.68 O ATOM 2681 CB ASN B 66 -9.123 -3.974 -14.800 1.00 0.65 C ATOM 2682 CG ASN B 66 -9.185 -5.304 -15.547 1.00 0.90 C ATOM 2683 OD1 ASN B 66 -8.159 -5.953 -15.759 1.00 1.38 O ATOM 2684 ND2 ASN B 66 -10.384 -5.723 -15.951 1.00 1.32 N ATOM 0 H ASN B 66 -8.505 -1.705 -13.984 1.00 0.56 H new ATOM 0 HA ASN B 66 -8.452 -2.931 -16.597 1.00 0.60 H new ATOM 0 HB2 ASN B 66 -8.239 -3.967 -14.163 1.00 0.65 H new ATOM 0 HB3 ASN B 66 -9.990 -3.896 -14.144 1.00 0.65 H new ATOM 0 HD21 ASN B 66 -10.473 -6.607 -16.453 1.00 1.32 H new ATOM 0 HD22 ASN B 66 -11.213 -5.160 -15.758 1.00 1.32 H new ATOM 2691 N GLN B 67 -11.206 -1.414 -15.691 1.00 0.59 N ATOM 2692 CA GLN B 67 -12.588 -1.029 -16.098 1.00 0.64 C ATOM 2693 C GLN B 67 -13.582 -2.203 -15.899 1.00 0.64 C ATOM 2694 O GLN B 67 -14.192 -2.691 -16.862 1.00 0.77 O ATOM 2695 CB GLN B 67 -12.653 -0.507 -17.565 1.00 0.75 C ATOM 2696 CG GLN B 67 -12.247 0.958 -17.764 1.00 0.96 C ATOM 2697 CD GLN B 67 -10.743 1.191 -17.708 1.00 1.28 C ATOM 2698 OE1 GLN B 67 -10.040 0.971 -18.697 1.00 2.02 O ATOM 2699 NE2 GLN B 67 -10.240 1.662 -16.569 1.00 1.87 N ATOM 0 H GLN B 67 -10.832 -0.846 -14.931 1.00 0.59 H new ATOM 0 HA GLN B 67 -12.883 -0.207 -15.445 1.00 0.64 H new ATOM 0 HB2 GLN B 67 -12.008 -1.132 -18.183 1.00 0.75 H new ATOM 0 HB3 GLN B 67 -13.671 -0.637 -17.933 1.00 0.75 H new ATOM 0 HG2 GLN B 67 -12.623 1.302 -18.727 1.00 0.96 H new ATOM 0 HG3 GLN B 67 -12.728 1.566 -16.998 1.00 0.96 H new ATOM 0 HE21 GLN B 67 -10.854 1.831 -15.772 1.00 1.87 H new ATOM 0 HE22 GLN B 67 -9.241 1.853 -16.493 1.00 1.87 H new ATOM 2708 N ASP B 68 -13.729 -2.661 -14.640 1.00 0.65 N ATOM 2709 CA ASP B 68 -14.650 -3.770 -14.301 1.00 0.72 C ATOM 2710 C ASP B 68 -15.416 -3.516 -12.975 1.00 0.79 C ATOM 2711 O ASP B 68 -16.007 -4.449 -12.418 1.00 1.30 O ATOM 2712 CB ASP B 68 -13.851 -5.091 -14.224 1.00 0.76 C ATOM 2713 CG ASP B 68 -14.702 -6.320 -14.515 1.00 0.97 C ATOM 2714 OD1 ASP B 68 -15.339 -6.841 -13.577 1.00 1.16 O ATOM 2715 OD2 ASP B 68 -14.735 -6.754 -15.686 1.00 1.25 O ATOM 0 H ASP B 68 -13.223 -2.282 -13.840 1.00 0.65 H new ATOM 0 HA ASP B 68 -15.402 -3.837 -15.087 1.00 0.72 H new ATOM 0 HB2 ASP B 68 -13.025 -5.051 -14.934 1.00 0.76 H new ATOM 0 HB3 ASP B 68 -13.413 -5.187 -13.231 1.00 0.76 H new ATOM 2720 N SER B 69 -15.420 -2.249 -12.474 1.00 0.66 N ATOM 2721 CA SER B 69 -16.108 -1.868 -11.217 1.00 0.71 C ATOM 2722 C SER B 69 -15.566 -2.635 -9.982 1.00 0.71 C ATOM 2723 O SER B 69 -16.287 -2.814 -8.993 1.00 1.26 O ATOM 2724 CB SER B 69 -17.634 -2.055 -11.357 1.00 0.86 C ATOM 2725 OG SER B 69 -18.328 -1.389 -10.312 1.00 1.35 O ATOM 0 H SER B 69 -14.947 -1.470 -12.931 1.00 0.66 H new ATOM 0 HA SER B 69 -15.896 -0.813 -11.045 1.00 0.71 H new ATOM 0 HB2 SER B 69 -17.964 -1.668 -12.321 1.00 0.86 H new ATOM 0 HB3 SER B 69 -17.877 -3.118 -11.340 1.00 0.86 H new ATOM 0 HG SER B 69 -17.923 -1.621 -9.450 1.00 1.35 H new ATOM 2731 N GLU B 70 -14.282 -3.053 -10.033 1.00 0.69 N ATOM 2732 CA GLU B 70 -13.643 -3.792 -8.932 1.00 0.75 C ATOM 2733 C GLU B 70 -12.250 -3.226 -8.647 1.00 0.62 C ATOM 2734 O GLU B 70 -11.431 -3.098 -9.567 1.00 0.78 O ATOM 2735 CB GLU B 70 -13.526 -5.291 -9.266 1.00 1.11 C ATOM 2736 CG GLU B 70 -14.860 -6.019 -9.370 1.00 1.39 C ATOM 2737 CD GLU B 70 -14.696 -7.477 -9.762 1.00 1.87 C ATOM 2738 OE1 GLU B 70 -14.617 -7.760 -10.976 1.00 2.40 O ATOM 2739 OE2 GLU B 70 -14.644 -8.333 -8.855 1.00 2.37 O ATOM 0 H GLU B 70 -13.669 -2.888 -10.831 1.00 0.69 H new ATOM 0 HA GLU B 70 -14.270 -3.677 -8.048 1.00 0.75 H new ATOM 0 HB2 GLU B 70 -12.992 -5.400 -10.210 1.00 1.11 H new ATOM 0 HB3 GLU B 70 -12.921 -5.775 -8.500 1.00 1.11 H new ATOM 0 HG2 GLU B 70 -15.379 -5.959 -8.413 1.00 1.39 H new ATOM 0 HG3 GLU B 70 -15.488 -5.517 -10.105 1.00 1.39 H new ATOM 2746 N LEU B 71 -11.990 -2.880 -7.373 1.00 0.54 N ATOM 2747 CA LEU B 71 -10.688 -2.344 -6.956 1.00 0.51 C ATOM 2748 C LEU B 71 -9.884 -3.416 -6.204 1.00 0.50 C ATOM 2749 O LEU B 71 -9.748 -3.365 -4.976 1.00 0.52 O ATOM 2750 CB LEU B 71 -10.845 -1.066 -6.093 1.00 0.58 C ATOM 2751 CG LEU B 71 -11.352 0.196 -6.836 1.00 0.78 C ATOM 2752 CD1 LEU B 71 -12.882 0.226 -6.909 1.00 1.13 C ATOM 2753 CD2 LEU B 71 -10.821 1.478 -6.180 1.00 0.92 C ATOM 0 H LEU B 71 -12.668 -2.964 -6.616 1.00 0.54 H new ATOM 0 HA LEU B 71 -10.140 -2.063 -7.855 1.00 0.51 H new ATOM 0 HB2 LEU B 71 -11.534 -1.285 -5.277 1.00 0.58 H new ATOM 0 HB3 LEU B 71 -9.880 -0.835 -5.642 1.00 0.58 H new ATOM 0 HG LEU B 71 -10.966 0.148 -7.854 1.00 0.78 H new ATOM 0 HD11 LEU B 71 -13.204 1.124 -7.436 1.00 1.13 H new ATOM 0 HD12 LEU B 71 -13.238 -0.655 -7.443 1.00 1.13 H new ATOM 0 HD13 LEU B 71 -13.294 0.230 -5.900 1.00 1.13 H new ATOM 0 HD21 LEU B 71 -11.194 2.346 -6.724 1.00 0.92 H new ATOM 0 HD22 LEU B 71 -11.160 1.525 -5.145 1.00 0.92 H new ATOM 0 HD23 LEU B 71 -9.731 1.475 -6.205 1.00 0.92 H new ATOM 2765 N LYS B 72 -9.367 -4.408 -6.965 1.00 0.52 N ATOM 2766 CA LYS B 72 -8.533 -5.506 -6.411 1.00 0.54 C ATOM 2767 C LYS B 72 -7.263 -4.901 -5.774 1.00 0.48 C ATOM 2768 O LYS B 72 -7.022 -3.711 -5.938 1.00 0.46 O ATOM 2769 CB LYS B 72 -8.155 -6.489 -7.553 1.00 0.60 C ATOM 2770 CG LYS B 72 -7.920 -7.942 -7.128 1.00 0.78 C ATOM 2771 CD LYS B 72 -7.443 -8.800 -8.305 1.00 0.91 C ATOM 2772 CE LYS B 72 -7.265 -10.272 -7.923 1.00 1.29 C ATOM 2773 NZ LYS B 72 -6.109 -10.498 -7.005 1.00 1.81 N ATOM 0 H LYS B 72 -9.513 -4.472 -7.972 1.00 0.52 H new ATOM 0 HA LYS B 72 -9.087 -6.053 -5.648 1.00 0.54 H new ATOM 0 HB2 LYS B 72 -8.949 -6.472 -8.300 1.00 0.60 H new ATOM 0 HB3 LYS B 72 -7.252 -6.121 -8.040 1.00 0.60 H new ATOM 0 HG2 LYS B 72 -7.179 -7.973 -6.329 1.00 0.78 H new ATOM 0 HG3 LYS B 72 -8.843 -8.358 -6.723 1.00 0.78 H new ATOM 0 HD2 LYS B 72 -8.162 -8.724 -9.121 1.00 0.91 H new ATOM 0 HD3 LYS B 72 -6.497 -8.407 -8.677 1.00 0.91 H new ATOM 0 HE2 LYS B 72 -8.177 -10.631 -7.446 1.00 1.29 H new ATOM 0 HE3 LYS B 72 -7.125 -10.863 -8.828 1.00 1.29 H new ATOM 0 HZ1 LYS B 72 -6.037 -11.511 -6.780 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 -5.232 -10.182 -7.467 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 -6.252 -9.958 -6.128 1.00 1.81 H new ATOM 2787 N PHE B 73 -6.441 -5.691 -5.052 1.00 0.51 N ATOM 2788 CA PHE B 73 -5.211 -5.125 -4.442 1.00 0.49 C ATOM 2789 C PHE B 73 -4.195 -4.670 -5.519 1.00 0.46 C ATOM 2790 O PHE B 73 -3.301 -3.870 -5.224 1.00 0.46 O ATOM 2791 CB PHE B 73 -4.559 -6.087 -3.427 1.00 0.55 C ATOM 2792 CG PHE B 73 -4.032 -5.354 -2.206 1.00 0.69 C ATOM 2793 CD1 PHE B 73 -4.895 -4.977 -1.182 1.00 0.90 C ATOM 2794 CD2 PHE B 73 -2.694 -5.009 -2.102 1.00 0.89 C ATOM 2795 CE1 PHE B 73 -4.433 -4.289 -0.082 1.00 1.15 C ATOM 2796 CE2 PHE B 73 -2.230 -4.313 -1.006 1.00 1.14 C ATOM 2797 CZ PHE B 73 -3.101 -3.955 0.006 1.00 1.23 C ATOM 0 H PHE B 73 -6.593 -6.685 -4.879 1.00 0.51 H new ATOM 0 HA PHE B 73 -5.522 -4.241 -3.885 1.00 0.49 H new ATOM 0 HB2 PHE B 73 -5.289 -6.834 -3.115 1.00 0.55 H new ATOM 0 HB3 PHE B 73 -3.741 -6.623 -3.909 1.00 0.55 H new ATOM 0 HD1 PHE B 73 -5.943 -5.228 -1.251 1.00 0.90 H new ATOM 0 HD2 PHE B 73 -2.008 -5.288 -2.888 1.00 0.89 H new ATOM 0 HE1 PHE B 73 -5.114 -4.012 0.709 1.00 1.15 H new ATOM 0 HE2 PHE B 73 -1.185 -4.047 -0.938 1.00 1.14 H new ATOM 0 HZ PHE B 73 -2.736 -3.413 0.866 1.00 1.23 H new ATOM 2807 N ASN B 74 -4.336 -5.192 -6.761 1.00 0.47 N ATOM 2808 CA ASN B 74 -3.487 -4.790 -7.900 1.00 0.50 C ATOM 2809 C ASN B 74 -3.960 -3.414 -8.440 1.00 0.48 C ATOM 2810 O ASN B 74 -3.150 -2.625 -8.928 1.00 0.54 O ATOM 2811 CB ASN B 74 -3.542 -5.873 -9.005 1.00 0.55 C ATOM 2812 CG ASN B 74 -2.429 -5.764 -10.055 1.00 0.63 C ATOM 2813 OD1 ASN B 74 -1.987 -4.669 -10.407 1.00 0.99 O ATOM 2814 ND2 ASN B 74 -1.972 -6.913 -10.568 1.00 0.93 N ATOM 0 H ASN B 74 -5.035 -5.896 -6.997 1.00 0.47 H new ATOM 0 HA ASN B 74 -2.452 -4.694 -7.572 1.00 0.50 H new ATOM 0 HB2 ASN B 74 -3.488 -6.856 -8.537 1.00 0.55 H new ATOM 0 HB3 ASN B 74 -4.507 -5.812 -9.508 1.00 0.55 H new ATOM 0 HD21 ASN B 74 -1.235 -6.899 -11.273 1.00 0.93 H new ATOM 0 HD22 ASN B 74 -2.361 -7.802 -10.254 1.00 0.93 H new ATOM 2821 N GLU B 75 -5.289 -3.151 -8.338 1.00 0.44 N ATOM 2822 CA GLU B 75 -5.907 -1.876 -8.763 1.00 0.47 C ATOM 2823 C GLU B 75 -5.833 -0.845 -7.619 1.00 0.41 C ATOM 2824 O GLU B 75 -5.505 0.321 -7.845 1.00 0.42 O ATOM 2825 CB GLU B 75 -7.379 -2.113 -9.183 1.00 0.54 C ATOM 2826 CG GLU B 75 -7.572 -2.541 -10.643 1.00 0.64 C ATOM 2827 CD GLU B 75 -6.932 -3.879 -10.994 1.00 0.76 C ATOM 2828 OE1 GLU B 75 -7.174 -4.867 -10.268 1.00 0.91 O ATOM 2829 OE2 GLU B 75 -6.199 -3.936 -12.005 1.00 0.93 O ATOM 0 H GLU B 75 -5.959 -3.820 -7.958 1.00 0.44 H new ATOM 0 HA GLU B 75 -5.359 -1.485 -9.620 1.00 0.47 H new ATOM 0 HB2 GLU B 75 -7.808 -2.878 -8.536 1.00 0.54 H new ATOM 0 HB3 GLU B 75 -7.943 -1.196 -9.011 1.00 0.54 H new ATOM 0 HG2 GLU B 75 -8.640 -2.595 -10.855 1.00 0.64 H new ATOM 0 HG3 GLU B 75 -7.157 -1.771 -11.293 1.00 0.64 H new ATOM 2836 N TYR B 76 -6.144 -1.305 -6.386 1.00 0.41 N ATOM 2837 CA TYR B 76 -6.091 -0.477 -5.159 1.00 0.39 C ATOM 2838 C TYR B 76 -4.625 -0.128 -4.777 1.00 0.36 C ATOM 2839 O TYR B 76 -4.394 0.736 -3.927 1.00 0.43 O ATOM 2840 CB TYR B 76 -6.796 -1.225 -3.999 1.00 0.43 C ATOM 2841 CG TYR B 76 -7.285 -0.346 -2.851 1.00 0.44 C ATOM 2842 CD1 TYR B 76 -8.271 0.617 -3.057 1.00 0.50 C ATOM 2843 CD2 TYR B 76 -6.781 -0.498 -1.557 1.00 0.52 C ATOM 2844 CE1 TYR B 76 -8.733 1.401 -2.021 1.00 0.58 C ATOM 2845 CE2 TYR B 76 -7.247 0.281 -0.516 1.00 0.59 C ATOM 2846 CZ TYR B 76 -8.219 1.228 -0.750 1.00 0.59 C ATOM 2847 OH TYR B 76 -8.683 1.998 0.293 1.00 0.71 O ATOM 0 H TYR B 76 -6.440 -2.266 -6.213 1.00 0.41 H new ATOM 0 HA TYR B 76 -6.611 0.462 -5.349 1.00 0.39 H new ATOM 0 HB2 TYR B 76 -7.649 -1.769 -4.406 1.00 0.43 H new ATOM 0 HB3 TYR B 76 -6.107 -1.968 -3.597 1.00 0.43 H new ATOM 0 HD1 TYR B 76 -8.681 0.752 -4.047 1.00 0.50 H new ATOM 0 HD2 TYR B 76 -6.015 -1.236 -1.368 1.00 0.52 H new ATOM 0 HE1 TYR B 76 -9.493 2.147 -2.202 1.00 0.58 H new ATOM 0 HE2 TYR B 76 -6.850 0.148 0.479 1.00 0.59 H new ATOM 0 HH TYR B 76 -8.217 1.747 1.118 1.00 0.71 H new ATOM 2857 N TRP B 77 -3.653 -0.843 -5.404 1.00 0.39 N ATOM 2858 CA TRP B 77 -2.189 -0.647 -5.235 1.00 0.40 C ATOM 2859 C TRP B 77 -1.780 0.848 -5.132 1.00 0.35 C ATOM 2860 O TRP B 77 -0.917 1.199 -4.324 1.00 0.37 O ATOM 2861 CB TRP B 77 -1.488 -1.295 -6.463 1.00 0.58 C ATOM 2862 CG TRP B 77 -0.024 -1.657 -6.332 1.00 0.48 C ATOM 2863 CD1 TRP B 77 0.866 -1.304 -5.350 1.00 0.56 C ATOM 2864 CD2 TRP B 77 0.718 -2.458 -7.266 1.00 0.74 C ATOM 2865 NE1 TRP B 77 2.104 -1.842 -5.621 1.00 0.79 N ATOM 2866 CE2 TRP B 77 2.034 -2.555 -6.789 1.00 0.94 C ATOM 2867 CE3 TRP B 77 0.386 -3.111 -8.463 1.00 0.98 C ATOM 2868 CZ2 TRP B 77 3.019 -3.274 -7.467 1.00 1.34 C ATOM 2869 CZ3 TRP B 77 1.364 -3.822 -9.129 1.00 1.37 C ATOM 2870 CH2 TRP B 77 2.664 -3.900 -8.631 1.00 1.54 C ATOM 0 H TRP B 77 -3.874 -1.593 -6.059 1.00 0.39 H new ATOM 0 HA TRP B 77 -1.885 -1.111 -4.297 1.00 0.40 H new ATOM 0 HB2 TRP B 77 -2.035 -2.202 -6.721 1.00 0.58 H new ATOM 0 HB3 TRP B 77 -1.590 -0.611 -7.306 1.00 0.58 H new ATOM 0 HD1 TRP B 77 0.630 -0.694 -4.491 1.00 0.56 H new ATOM 0 HE1 TRP B 77 2.938 -1.728 -5.045 1.00 0.79 H new ATOM 0 HE3 TRP B 77 -0.618 -3.058 -8.857 1.00 0.98 H new ATOM 0 HZ2 TRP B 77 4.028 -3.334 -7.086 1.00 1.34 H new ATOM 0 HZ3 TRP B 77 1.118 -4.327 -10.052 1.00 1.37 H new ATOM 0 HH2 TRP B 77 3.406 -4.466 -9.175 1.00 1.54 H new ATOM 2881 N ARG B 78 -2.418 1.718 -5.951 1.00 0.37 N ATOM 2882 CA ARG B 78 -2.105 3.167 -5.984 1.00 0.41 C ATOM 2883 C ARG B 78 -2.538 3.925 -4.713 1.00 0.38 C ATOM 2884 O ARG B 78 -1.873 4.894 -4.337 1.00 0.45 O ATOM 2885 CB ARG B 78 -2.730 3.843 -7.227 1.00 0.49 C ATOM 2886 CG ARG B 78 -2.213 3.312 -8.571 1.00 0.68 C ATOM 2887 CD ARG B 78 -0.758 3.719 -8.856 1.00 0.88 C ATOM 2888 NE ARG B 78 -0.616 4.453 -10.127 1.00 1.17 N ATOM 2889 CZ ARG B 78 -0.356 3.897 -11.337 1.00 1.72 C ATOM 2890 NH1 ARG B 78 -0.273 2.568 -11.498 1.00 2.14 N ATOM 2891 NH2 ARG B 78 -0.203 4.691 -12.400 1.00 2.15 N ATOM 0 H ARG B 78 -3.155 1.440 -6.599 1.00 0.37 H new ATOM 0 HA ARG B 78 -1.018 3.226 -6.036 1.00 0.41 H new ATOM 0 HB2 ARG B 78 -3.811 3.711 -7.191 1.00 0.49 H new ATOM 0 HB3 ARG B 78 -2.538 4.915 -7.177 1.00 0.49 H new ATOM 0 HG2 ARG B 78 -2.289 2.225 -8.580 1.00 0.68 H new ATOM 0 HG3 ARG B 78 -2.852 3.683 -9.372 1.00 0.68 H new ATOM 0 HD2 ARG B 78 -0.391 4.340 -8.039 1.00 0.88 H new ATOM 0 HD3 ARG B 78 -0.133 2.826 -8.884 1.00 0.88 H new ATOM 0 HE ARG B 78 -0.722 5.467 -10.094 1.00 1.17 H new ATOM 0 HH11 ARG B 78 -0.407 1.948 -10.699 1.00 2.14 H new ATOM 0 HH12 ARG B 78 -0.076 2.177 -12.419 1.00 2.14 H new ATOM 0 HH21 ARG B 78 -0.282 5.703 -12.296 1.00 2.15 H new ATOM 0 HH22 ARG B 78 -0.007 4.286 -13.315 1.00 2.15 H new ATOM 2905 N LEU B 79 -3.639 3.505 -4.048 1.00 0.33 N ATOM 2906 CA LEU B 79 -4.103 4.202 -2.827 1.00 0.34 C ATOM 2907 C LEU B 79 -3.226 3.865 -1.614 1.00 0.32 C ATOM 2908 O LEU B 79 -3.007 4.731 -0.776 1.00 0.36 O ATOM 2909 CB LEU B 79 -5.589 3.912 -2.503 1.00 0.36 C ATOM 2910 CG LEU B 79 -6.343 5.092 -1.827 1.00 0.41 C ATOM 2911 CD1 LEU B 79 -6.767 6.144 -2.856 1.00 0.49 C ATOM 2912 CD2 LEU B 79 -7.550 4.602 -1.020 1.00 0.48 C ATOM 0 H LEU B 79 -4.210 2.707 -4.327 1.00 0.33 H new ATOM 0 HA LEU B 79 -4.012 5.267 -3.040 1.00 0.34 H new ATOM 0 HB2 LEU B 79 -6.105 3.649 -3.427 1.00 0.36 H new ATOM 0 HB3 LEU B 79 -5.642 3.041 -1.849 1.00 0.36 H new ATOM 0 HG LEU B 79 -5.648 5.562 -1.131 1.00 0.41 H new ATOM 0 HD11 LEU B 79 -7.292 6.956 -2.352 1.00 0.49 H new ATOM 0 HD12 LEU B 79 -5.884 6.539 -3.357 1.00 0.49 H new ATOM 0 HD13 LEU B 79 -7.428 5.687 -3.592 1.00 0.49 H new ATOM 0 HD21 LEU B 79 -8.052 5.454 -0.562 1.00 0.48 H new ATOM 0 HD22 LEU B 79 -8.244 4.085 -1.682 1.00 0.48 H new ATOM 0 HD23 LEU B 79 -7.213 3.918 -0.241 1.00 0.48 H new ATOM 2924 N ILE B 80 -2.733 2.608 -1.517 1.00 0.34 N ATOM 2925 CA ILE B 80 -1.846 2.196 -0.400 1.00 0.37 C ATOM 2926 C ILE B 80 -0.552 3.047 -0.437 1.00 0.36 C ATOM 2927 O ILE B 80 -0.026 3.428 0.615 1.00 0.39 O ATOM 2928 CB ILE B 80 -1.487 0.666 -0.427 1.00 0.44 C ATOM 2929 CG1 ILE B 80 -2.748 -0.234 -0.614 1.00 0.47 C ATOM 2930 CG2 ILE B 80 -0.718 0.248 0.843 1.00 0.54 C ATOM 2931 CD1 ILE B 80 -3.777 -0.174 0.510 1.00 0.56 C ATOM 0 H ILE B 80 -2.931 1.868 -2.190 1.00 0.34 H new ATOM 0 HA ILE B 80 -2.391 2.367 0.528 1.00 0.37 H new ATOM 0 HB ILE B 80 -0.841 0.515 -1.292 1.00 0.44 H new ATOM 0 HG12 ILE B 80 -3.238 0.049 -1.546 1.00 0.47 H new ATOM 0 HG13 ILE B 80 -2.420 -1.267 -0.727 1.00 0.47 H new ATOM 0 HG21 ILE B 80 -0.485 -0.816 0.794 1.00 0.54 H new ATOM 0 HG22 ILE B 80 0.207 0.820 0.913 1.00 0.54 H new ATOM 0 HG23 ILE B 80 -1.333 0.444 1.722 1.00 0.54 H new ATOM 0 HD11 ILE B 80 -4.610 -0.837 0.276 1.00 0.56 H new ATOM 0 HD12 ILE B 80 -3.313 -0.489 1.445 1.00 0.56 H new ATOM 0 HD13 ILE B 80 -4.144 0.847 0.613 1.00 0.56 H new ATOM 2943 N GLY B 81 -0.048 3.333 -1.666 1.00 0.36 N ATOM 2944 CA GLY B 81 1.133 4.177 -1.841 1.00 0.39 C ATOM 2945 C GLY B 81 0.824 5.639 -1.534 1.00 0.37 C ATOM 2946 O GLY B 81 1.613 6.312 -0.867 1.00 0.42 O ATOM 0 H GLY B 81 -0.449 2.987 -2.538 1.00 0.36 H new ATOM 0 HA2 GLY B 81 1.932 3.827 -1.187 1.00 0.39 H new ATOM 0 HA3 GLY B 81 1.497 4.088 -2.864 1.00 0.39 H new ATOM 2950 N GLU B 82 -0.341 6.127 -2.027 1.00 0.34 N ATOM 2951 CA GLU B 82 -0.793 7.512 -1.773 1.00 0.36 C ATOM 2952 C GLU B 82 -1.230 7.705 -0.300 1.00 0.33 C ATOM 2953 O GLU B 82 -1.248 8.837 0.189 1.00 0.40 O ATOM 2954 CB GLU B 82 -1.952 7.896 -2.722 1.00 0.41 C ATOM 2955 CG GLU B 82 -1.525 8.194 -4.163 1.00 0.49 C ATOM 2956 CD GLU B 82 -0.751 9.499 -4.309 1.00 0.61 C ATOM 2957 OE1 GLU B 82 -1.291 10.560 -3.927 1.00 0.91 O ATOM 2958 OE2 GLU B 82 0.394 9.457 -4.809 1.00 0.79 O ATOM 0 H GLU B 82 -0.982 5.580 -2.602 1.00 0.34 H new ATOM 0 HA GLU B 82 0.054 8.170 -1.966 1.00 0.36 H new ATOM 0 HB2 GLU B 82 -2.679 7.084 -2.733 1.00 0.41 H new ATOM 0 HB3 GLU B 82 -2.459 8.773 -2.319 1.00 0.41 H new ATOM 0 HG2 GLU B 82 -0.909 7.372 -4.529 1.00 0.49 H new ATOM 0 HG3 GLU B 82 -2.412 8.234 -4.796 1.00 0.49 H new ATOM 2965 N LEU B 83 -1.594 6.595 0.395 1.00 0.33 N ATOM 2966 CA LEU B 83 -2.000 6.632 1.820 1.00 0.35 C ATOM 2967 C LEU B 83 -0.828 7.133 2.683 1.00 0.37 C ATOM 2968 O LEU B 83 -0.980 8.079 3.462 1.00 0.45 O ATOM 2969 CB LEU B 83 -2.466 5.224 2.313 1.00 0.42 C ATOM 2970 CG LEU B 83 -3.966 5.091 2.702 1.00 0.51 C ATOM 2971 CD1 LEU B 83 -4.801 4.491 1.571 1.00 0.69 C ATOM 2972 CD2 LEU B 83 -4.129 4.274 3.990 1.00 0.63 C ATOM 0 H LEU B 83 -1.613 5.661 -0.014 1.00 0.33 H new ATOM 0 HA LEU B 83 -2.842 7.318 1.917 1.00 0.35 H new ATOM 0 HB2 LEU B 83 -2.250 4.498 1.529 1.00 0.42 H new ATOM 0 HB3 LEU B 83 -1.863 4.947 3.178 1.00 0.42 H new ATOM 0 HG LEU B 83 -4.340 6.099 2.882 1.00 0.51 H new ATOM 0 HD11 LEU B 83 -5.842 4.417 1.887 1.00 0.69 H new ATOM 0 HD12 LEU B 83 -4.734 5.130 0.691 1.00 0.69 H new ATOM 0 HD13 LEU B 83 -4.424 3.498 1.328 1.00 0.69 H new ATOM 0 HD21 LEU B 83 -5.187 4.196 4.240 1.00 0.63 H new ATOM 0 HD22 LEU B 83 -3.716 3.276 3.842 1.00 0.63 H new ATOM 0 HD23 LEU B 83 -3.599 4.769 4.804 1.00 0.63 H new ATOM 2984 N ALA B 84 0.347 6.486 2.517 1.00 0.38 N ATOM 2985 CA ALA B 84 1.570 6.853 3.250 1.00 0.44 C ATOM 2986 C ALA B 84 2.232 8.114 2.667 1.00 0.45 C ATOM 2987 O ALA B 84 2.899 8.844 3.397 1.00 0.55 O ATOM 2988 CB ALA B 84 2.559 5.696 3.255 1.00 0.55 C ATOM 0 H ALA B 84 0.470 5.702 1.876 1.00 0.38 H new ATOM 0 HA ALA B 84 1.277 7.076 4.276 1.00 0.44 H new ATOM 0 HB1 ALA B 84 3.456 5.987 3.801 1.00 0.55 H new ATOM 0 HB2 ALA B 84 2.104 4.831 3.738 1.00 0.55 H new ATOM 0 HB3 ALA B 84 2.826 5.441 2.229 1.00 0.55 H new ATOM 2994 N LYS B 85 2.066 8.360 1.346 1.00 0.41 N ATOM 2995 CA LYS B 85 2.637 9.563 0.699 1.00 0.45 C ATOM 2996 C LYS B 85 1.908 10.842 1.173 1.00 0.47 C ATOM 2997 O LYS B 85 2.501 11.925 1.181 1.00 0.57 O ATOM 2998 CB LYS B 85 2.563 9.459 -0.844 1.00 0.49 C ATOM 2999 CG LYS B 85 3.464 10.458 -1.587 1.00 0.57 C ATOM 3000 CD LYS B 85 3.138 10.569 -3.084 1.00 0.66 C ATOM 3001 CE LYS B 85 3.702 9.407 -3.914 1.00 0.79 C ATOM 3002 NZ LYS B 85 2.948 8.128 -3.726 1.00 1.10 N ATOM 0 H LYS B 85 1.548 7.749 0.715 1.00 0.41 H new ATOM 0 HA LYS B 85 3.685 9.624 0.992 1.00 0.45 H new ATOM 0 HB2 LYS B 85 2.838 8.447 -1.142 1.00 0.49 H new ATOM 0 HB3 LYS B 85 1.531 9.614 -1.158 1.00 0.49 H new ATOM 0 HG2 LYS B 85 3.364 11.441 -1.126 1.00 0.57 H new ATOM 0 HG3 LYS B 85 4.505 10.156 -1.470 1.00 0.57 H new ATOM 0 HD2 LYS B 85 2.056 10.607 -3.212 1.00 0.66 H new ATOM 0 HD3 LYS B 85 3.537 11.508 -3.467 1.00 0.66 H new ATOM 0 HE2 LYS B 85 3.684 9.680 -4.969 1.00 0.79 H new ATOM 0 HE3 LYS B 85 4.746 9.249 -3.644 1.00 0.79 H new ATOM 0 HZ1 LYS B 85 2.897 7.619 -4.631 1.00 1.10 H new ATOM 0 HZ2 LYS B 85 3.436 7.537 -3.023 1.00 1.10 H new ATOM 0 HZ3 LYS B 85 1.985 8.338 -3.393 1.00 1.10 H new ATOM 3016 N GLU B 86 0.621 10.706 1.569 1.00 0.42 N ATOM 3017 CA GLU B 86 -0.188 11.842 2.046 1.00 0.46 C ATOM 3018 C GLU B 86 -0.279 11.879 3.598 1.00 0.50 C ATOM 3019 O GLU B 86 -1.288 12.331 4.147 1.00 0.81 O ATOM 3020 CB GLU B 86 -1.595 11.781 1.405 1.00 0.52 C ATOM 3021 CG GLU B 86 -1.606 11.957 -0.118 1.00 0.59 C ATOM 3022 CD GLU B 86 -1.346 13.388 -0.564 1.00 1.01 C ATOM 3023 OE1 GLU B 86 -2.274 14.221 -0.468 1.00 1.48 O ATOM 3024 OE2 GLU B 86 -0.214 13.672 -1.010 1.00 1.68 O ATOM 0 H GLU B 86 0.123 9.816 1.566 1.00 0.42 H new ATOM 0 HA GLU B 86 0.304 12.765 1.741 1.00 0.46 H new ATOM 0 HB2 GLU B 86 -2.052 10.822 1.651 1.00 0.52 H new ATOM 0 HB3 GLU B 86 -2.218 12.555 1.852 1.00 0.52 H new ATOM 0 HG2 GLU B 86 -0.851 11.305 -0.557 1.00 0.59 H new ATOM 0 HG3 GLU B 86 -2.572 11.633 -0.507 1.00 0.59 H new ATOM 3031 N ILE B 87 0.782 11.403 4.299 1.00 0.48 N ATOM 3032 CA ILE B 87 0.842 11.415 5.780 1.00 0.51 C ATOM 3033 C ILE B 87 1.916 12.421 6.270 1.00 0.53 C ATOM 3034 O ILE B 87 1.712 13.096 7.284 1.00 0.58 O ATOM 3035 CB ILE B 87 1.094 9.968 6.363 1.00 0.56 C ATOM 3036 CG1 ILE B 87 0.497 9.804 7.795 1.00 0.61 C ATOM 3037 CG2 ILE B 87 2.576 9.549 6.325 1.00 0.62 C ATOM 3038 CD1 ILE B 87 1.154 10.618 8.904 1.00 0.63 C ATOM 0 H ILE B 87 1.611 11.005 3.857 1.00 0.48 H new ATOM 0 HA ILE B 87 -0.127 11.744 6.155 1.00 0.51 H new ATOM 0 HB ILE B 87 0.562 9.286 5.699 1.00 0.56 H new ATOM 0 HG12 ILE B 87 -0.559 10.070 7.757 1.00 0.61 H new ATOM 0 HG13 ILE B 87 0.550 8.750 8.068 1.00 0.61 H new ATOM 0 HG21 ILE B 87 2.681 8.546 6.739 1.00 0.62 H new ATOM 0 HG22 ILE B 87 2.929 9.555 5.294 1.00 0.62 H new ATOM 0 HG23 ILE B 87 3.167 10.249 6.915 1.00 0.62 H new ATOM 0 HD11 ILE B 87 0.650 10.418 9.850 1.00 0.63 H new ATOM 0 HD12 ILE B 87 2.205 10.339 8.986 1.00 0.63 H new ATOM 0 HD13 ILE B 87 1.078 11.680 8.670 1.00 0.63 H new ATOM 3050 N ARG B 88 3.050 12.516 5.535 1.00 0.57 N ATOM 3051 CA ARG B 88 4.144 13.440 5.877 1.00 0.67 C ATOM 3052 C ARG B 88 4.371 14.478 4.757 1.00 0.67 C ATOM 3053 O ARG B 88 4.532 15.664 5.050 1.00 0.84 O ATOM 3054 CB ARG B 88 5.454 12.673 6.241 1.00 0.75 C ATOM 3055 CG ARG B 88 6.309 12.140 5.073 1.00 0.82 C ATOM 3056 CD ARG B 88 5.727 10.882 4.427 1.00 1.05 C ATOM 3057 NE ARG B 88 6.606 10.354 3.367 1.00 1.17 N ATOM 3058 CZ ARG B 88 6.986 9.065 3.217 1.00 1.26 C ATOM 3059 NH1 ARG B 88 6.541 8.090 4.027 1.00 1.64 N ATOM 3060 NH2 ARG B 88 7.816 8.746 2.227 1.00 1.55 N ATOM 0 H ARG B 88 3.226 11.959 4.699 1.00 0.57 H new ATOM 0 HA ARG B 88 3.845 13.990 6.769 1.00 0.67 H new ATOM 0 HB2 ARG B 88 6.078 13.336 6.841 1.00 0.75 H new ATOM 0 HB3 ARG B 88 5.185 11.828 6.875 1.00 0.75 H new ATOM 0 HG2 ARG B 88 6.405 12.919 4.316 1.00 0.82 H new ATOM 0 HG3 ARG B 88 7.314 11.923 5.436 1.00 0.82 H new ATOM 0 HD2 ARG B 88 5.578 10.118 5.190 1.00 1.05 H new ATOM 0 HD3 ARG B 88 4.747 11.109 4.007 1.00 1.05 H new ATOM 0 HE ARG B 88 6.960 11.023 2.684 1.00 1.17 H new ATOM 0 HH11 ARG B 88 5.895 8.312 4.785 1.00 1.64 H new ATOM 0 HH12 ARG B 88 6.849 7.128 3.884 1.00 1.64 H new ATOM 0 HH21 ARG B 88 8.157 9.470 1.594 1.00 1.55 H new ATOM 0 HH22 ARG B 88 8.112 7.778 2.101 1.00 1.55 H new ATOM 3074 N LYS B 89 4.360 14.037 3.472 1.00 0.60 N ATOM 3075 CA LYS B 89 4.573 14.946 2.328 1.00 0.67 C ATOM 3076 C LYS B 89 3.253 15.254 1.576 1.00 0.63 C ATOM 3077 O LYS B 89 3.227 15.308 0.340 1.00 0.76 O ATOM 3078 CB LYS B 89 5.659 14.384 1.372 1.00 0.76 C ATOM 3079 CG LYS B 89 5.333 13.034 0.702 1.00 0.78 C ATOM 3080 CD LYS B 89 6.397 12.620 -0.324 1.00 1.06 C ATOM 3081 CE LYS B 89 6.241 13.349 -1.663 1.00 1.32 C ATOM 3082 NZ LYS B 89 7.412 13.129 -2.565 1.00 1.65 N ATOM 0 H LYS B 89 4.207 13.063 3.209 1.00 0.60 H new ATOM 0 HA LYS B 89 4.934 15.895 2.725 1.00 0.67 H new ATOM 0 HB2 LYS B 89 5.843 15.121 0.590 1.00 0.76 H new ATOM 0 HB3 LYS B 89 6.588 14.275 1.932 1.00 0.76 H new ATOM 0 HG2 LYS B 89 5.250 12.262 1.467 1.00 0.78 H new ATOM 0 HG3 LYS B 89 4.363 13.100 0.209 1.00 0.78 H new ATOM 0 HD2 LYS B 89 7.387 12.824 0.083 1.00 1.06 H new ATOM 0 HD3 LYS B 89 6.336 11.545 -0.491 1.00 1.06 H new ATOM 0 HE2 LYS B 89 5.333 13.005 -2.158 1.00 1.32 H new ATOM 0 HE3 LYS B 89 6.120 14.417 -1.481 1.00 1.32 H new ATOM 0 HZ1 LYS B 89 7.263 13.640 -3.458 1.00 1.65 H new ATOM 0 HZ2 LYS B 89 8.276 13.481 -2.105 1.00 1.65 H new ATOM 0 HZ3 LYS B 89 7.513 12.113 -2.761 1.00 1.65 H new ATOM 3096 N LYS B 90 2.157 15.481 2.336 1.00 0.58 N ATOM 3097 CA LYS B 90 0.838 15.815 1.749 1.00 0.56 C ATOM 3098 C LYS B 90 0.826 17.256 1.200 1.00 0.54 C ATOM 3099 O LYS B 90 0.237 17.521 0.147 1.00 0.58 O ATOM 3100 CB LYS B 90 -0.309 15.616 2.778 1.00 0.59 C ATOM 3101 CG LYS B 90 -0.153 16.372 4.121 1.00 0.66 C ATOM 3102 CD LYS B 90 -0.292 15.455 5.347 1.00 0.96 C ATOM 3103 CE LYS B 90 -1.733 14.995 5.593 1.00 1.48 C ATOM 3104 NZ LYS B 90 -2.615 16.092 6.086 1.00 2.03 N ATOM 0 H LYS B 90 2.159 15.439 3.355 1.00 0.58 H new ATOM 0 HA LYS B 90 0.668 15.129 0.919 1.00 0.56 H new ATOM 0 HB2 LYS B 90 -1.245 15.928 2.314 1.00 0.59 H new ATOM 0 HB3 LYS B 90 -0.399 14.551 2.991 1.00 0.59 H new ATOM 0 HG2 LYS B 90 0.822 16.858 4.147 1.00 0.66 H new ATOM 0 HG3 LYS B 90 -0.904 17.160 4.177 1.00 0.66 H new ATOM 0 HD2 LYS B 90 0.344 14.580 5.213 1.00 0.96 H new ATOM 0 HD3 LYS B 90 0.071 15.981 6.230 1.00 0.96 H new ATOM 0 HE2 LYS B 90 -2.144 14.593 4.667 1.00 1.48 H new ATOM 0 HE3 LYS B 90 -1.731 14.183 6.320 1.00 1.48 H new ATOM 0 HZ1 LYS B 90 -3.553 15.706 6.316 1.00 2.03 H new ATOM 0 HZ2 LYS B 90 -2.197 16.517 6.938 1.00 2.03 H new ATOM 0 HZ3 LYS B 90 -2.710 16.819 5.348 1.00 2.03 H new ATOM 3118 N LYS B 91 1.486 18.176 1.929 1.00 0.55 N ATOM 3119 CA LYS B 91 1.582 19.592 1.549 1.00 0.59 C ATOM 3120 C LYS B 91 2.990 20.121 1.889 1.00 0.62 C ATOM 3121 O LYS B 91 3.155 20.920 2.816 1.00 0.69 O ATOM 3122 CB LYS B 91 0.509 20.418 2.289 1.00 0.64 C ATOM 3123 CG LYS B 91 -0.938 20.084 1.920 1.00 0.74 C ATOM 3124 CD LYS B 91 -1.926 20.871 2.788 1.00 0.84 C ATOM 3125 CE LYS B 91 -3.380 20.471 2.539 1.00 1.14 C ATOM 3126 NZ LYS B 91 -3.932 21.080 1.293 1.00 1.36 N ATOM 0 H LYS B 91 1.968 17.954 2.800 1.00 0.55 H new ATOM 0 HA LYS B 91 1.412 19.688 0.477 1.00 0.59 H new ATOM 0 HB2 LYS B 91 0.637 20.272 3.362 1.00 0.64 H new ATOM 0 HB3 LYS B 91 0.684 21.475 2.088 1.00 0.64 H new ATOM 0 HG2 LYS B 91 -1.110 20.314 0.869 1.00 0.74 H new ATOM 0 HG3 LYS B 91 -1.111 19.015 2.045 1.00 0.74 H new ATOM 0 HD2 LYS B 91 -1.685 20.713 3.839 1.00 0.84 H new ATOM 0 HD3 LYS B 91 -1.808 21.936 2.590 1.00 0.84 H new ATOM 0 HE2 LYS B 91 -3.449 19.385 2.471 1.00 1.14 H new ATOM 0 HE3 LYS B 91 -3.989 20.776 3.390 1.00 1.14 H new ATOM 0 HZ1 LYS B 91 -4.920 20.779 1.168 1.00 1.36 H new ATOM 0 HZ2 LYS B 91 -3.892 22.117 1.366 1.00 1.36 H new ATOM 0 HZ3 LYS B 91 -3.369 20.769 0.476 1.00 1.36 H new ATOM 3140 N ASP B 92 4.006 19.666 1.130 1.00 0.66 N ATOM 3141 CA ASP B 92 5.416 20.066 1.363 1.00 0.74 C ATOM 3142 C ASP B 92 5.669 21.588 1.195 1.00 0.92 C ATOM 3143 O ASP B 92 6.611 22.114 1.795 1.00 1.72 O ATOM 3144 CB ASP B 92 6.374 19.257 0.452 1.00 0.75 C ATOM 3145 CG ASP B 92 6.139 19.475 -1.040 1.00 0.88 C ATOM 3146 OD1 ASP B 92 5.210 18.852 -1.592 1.00 0.93 O ATOM 3147 OD2 ASP B 92 6.888 20.268 -1.649 1.00 1.15 O ATOM 0 H ASP B 92 3.881 19.021 0.350 1.00 0.66 H new ATOM 0 HA ASP B 92 5.623 19.834 2.408 1.00 0.74 H new ATOM 0 HB2 ASP B 92 7.402 19.528 0.691 1.00 0.75 H new ATOM 0 HB3 ASP B 92 6.263 18.196 0.676 1.00 0.75 H new ATOM 3152 N LEU B 93 4.829 22.291 0.401 1.00 0.63 N ATOM 3153 CA LEU B 93 4.997 23.741 0.169 1.00 0.66 C ATOM 3154 C LEU B 93 4.287 24.595 1.244 1.00 0.69 C ATOM 3155 O LEU B 93 4.873 25.564 1.738 1.00 0.82 O ATOM 3156 CB LEU B 93 4.502 24.148 -1.239 1.00 0.71 C ATOM 3157 CG LEU B 93 5.057 23.316 -2.433 1.00 0.97 C ATOM 3158 CD1 LEU B 93 4.031 22.283 -2.914 1.00 1.27 C ATOM 3159 CD2 LEU B 93 5.486 24.224 -3.592 1.00 1.18 C ATOM 0 H LEU B 93 4.033 21.879 -0.086 1.00 0.63 H new ATOM 0 HA LEU B 93 6.067 23.939 0.238 1.00 0.66 H new ATOM 0 HB2 LEU B 93 3.414 24.081 -1.252 1.00 0.71 H new ATOM 0 HB3 LEU B 93 4.759 25.195 -1.403 1.00 0.71 H new ATOM 0 HG LEU B 93 5.937 22.782 -2.075 1.00 0.97 H new ATOM 0 HD11 LEU B 93 4.447 21.718 -3.748 1.00 1.27 H new ATOM 0 HD12 LEU B 93 3.791 21.602 -2.098 1.00 1.27 H new ATOM 0 HD13 LEU B 93 3.125 22.794 -3.239 1.00 1.27 H new ATOM 0 HD21 LEU B 93 5.869 23.614 -4.410 1.00 1.18 H new ATOM 0 HD22 LEU B 93 4.628 24.800 -3.940 1.00 1.18 H new ATOM 0 HD23 LEU B 93 6.266 24.905 -3.251 1.00 1.18 H new ATOM 3171 N LYS B 94 3.030 24.238 1.609 1.00 0.66 N ATOM 3172 CA LYS B 94 2.260 24.998 2.624 1.00 0.74 C ATOM 3173 C LYS B 94 2.756 24.719 4.064 1.00 0.70 C ATOM 3174 O LYS B 94 3.200 25.646 4.750 1.00 0.79 O ATOM 3175 CB LYS B 94 0.739 24.700 2.503 1.00 0.84 C ATOM 3176 CG LYS B 94 -0.174 25.681 3.258 1.00 1.00 C ATOM 3177 CD LYS B 94 -0.249 27.052 2.574 1.00 1.15 C ATOM 3178 CE LYS B 94 -1.192 28.015 3.294 1.00 1.45 C ATOM 3179 NZ LYS B 94 -0.631 28.513 4.589 1.00 1.61 N ATOM 0 H LYS B 94 2.533 23.437 1.220 1.00 0.66 H new ATOM 0 HA LYS B 94 2.426 26.056 2.423 1.00 0.74 H new ATOM 0 HB2 LYS B 94 0.464 24.709 1.448 1.00 0.84 H new ATOM 0 HB3 LYS B 94 0.550 23.692 2.873 1.00 0.84 H new ATOM 0 HG2 LYS B 94 -1.176 25.258 3.330 1.00 1.00 H new ATOM 0 HG3 LYS B 94 0.194 25.805 4.276 1.00 1.00 H new ATOM 0 HD2 LYS B 94 0.749 27.489 2.533 1.00 1.15 H new ATOM 0 HD3 LYS B 94 -0.583 26.923 1.545 1.00 1.15 H new ATOM 0 HE2 LYS B 94 -1.403 28.864 2.644 1.00 1.45 H new ATOM 0 HE3 LYS B 94 -2.141 27.514 3.483 1.00 1.45 H new ATOM 0 HZ1 LYS B 94 -1.311 29.162 5.035 1.00 1.61 H new ATOM 0 HZ2 LYS B 94 -0.454 27.708 5.223 1.00 1.61 H new ATOM 0 HZ3 LYS B 94 0.262 29.016 4.410 1.00 1.61 H new ATOM 3193 N ILE B 95 2.683 23.445 4.508 1.00 0.65 N ATOM 3194 CA ILE B 95 3.112 23.043 5.872 1.00 0.66 C ATOM 3195 C ILE B 95 4.401 22.202 5.826 1.00 0.68 C ATOM 3196 O ILE B 95 4.582 21.388 4.917 1.00 0.78 O ATOM 3197 CB ILE B 95 1.985 22.261 6.636 1.00 0.74 C ATOM 3198 CG1 ILE B 95 1.405 21.103 5.777 1.00 0.83 C ATOM 3199 CG2 ILE B 95 0.877 23.233 7.068 1.00 0.84 C ATOM 3200 CD1 ILE B 95 0.469 20.157 6.515 1.00 1.04 C ATOM 0 H ILE B 95 2.330 22.673 3.942 1.00 0.65 H new ATOM 0 HA ILE B 95 3.314 23.963 6.421 1.00 0.66 H new ATOM 0 HB ILE B 95 2.427 21.809 7.524 1.00 0.74 H new ATOM 0 HG12 ILE B 95 0.869 21.533 4.931 1.00 0.83 H new ATOM 0 HG13 ILE B 95 2.234 20.524 5.369 1.00 0.83 H new ATOM 0 HG21 ILE B 95 0.098 22.685 7.598 1.00 0.84 H new ATOM 0 HG22 ILE B 95 1.297 23.994 7.726 1.00 0.84 H new ATOM 0 HG23 ILE B 95 0.449 23.712 6.187 1.00 0.84 H new ATOM 0 HD11 ILE B 95 0.118 19.385 5.830 1.00 1.04 H new ATOM 0 HD12 ILE B 95 1.002 19.692 7.344 1.00 1.04 H new ATOM 0 HD13 ILE B 95 -0.384 20.716 6.900 1.00 1.04 H new ATOM 3212 N ARG B 96 5.298 22.393 6.821 1.00 0.70 N ATOM 3213 CA ARG B 96 6.580 21.654 6.866 1.00 0.79 C ATOM 3214 C ARG B 96 7.101 21.395 8.307 1.00 0.79 C ATOM 3215 O ARG B 96 8.317 21.318 8.522 1.00 1.02 O ATOM 3216 CB ARG B 96 7.641 22.399 6.015 1.00 0.99 C ATOM 3217 CG ARG B 96 7.885 23.859 6.422 1.00 1.12 C ATOM 3218 CD ARG B 96 8.958 24.531 5.564 1.00 1.41 C ATOM 3219 NE ARG B 96 10.291 23.938 5.760 1.00 1.59 N ATOM 3220 CZ ARG B 96 11.175 24.287 6.726 1.00 2.01 C ATOM 3221 NH1 ARG B 96 10.889 25.232 7.637 1.00 2.42 N ATOM 3222 NH2 ARG B 96 12.357 23.671 6.784 1.00 2.37 N ATOM 0 H ARG B 96 5.160 23.044 7.594 1.00 0.70 H new ATOM 0 HA ARG B 96 6.394 20.667 6.443 1.00 0.79 H new ATOM 0 HB2 ARG B 96 8.584 21.856 6.080 1.00 0.99 H new ATOM 0 HB3 ARG B 96 7.330 22.375 4.970 1.00 0.99 H new ATOM 0 HG2 ARG B 96 6.953 24.418 6.337 1.00 1.12 H new ATOM 0 HG3 ARG B 96 8.185 23.896 7.469 1.00 1.12 H new ATOM 0 HD2 ARG B 96 8.680 24.452 4.513 1.00 1.41 H new ATOM 0 HD3 ARG B 96 8.998 25.593 5.804 1.00 1.41 H new ATOM 0 HE ARG B 96 10.573 23.201 5.113 1.00 1.59 H new ATOM 0 HH11 ARG B 96 9.987 25.707 7.613 1.00 2.42 H new ATOM 0 HH12 ARG B 96 11.574 25.474 8.353 1.00 2.42 H new ATOM 0 HH21 ARG B 96 12.588 22.945 6.105 1.00 2.37 H new ATOM 0 HH22 ARG B 96 13.030 23.926 7.507 1.00 2.37 H new ATOM 3236 N LYS B 97 6.186 21.244 9.292 1.00 0.72 N ATOM 3237 CA LYS B 97 6.582 20.965 10.693 1.00 0.76 C ATOM 3238 C LYS B 97 5.383 20.469 11.534 1.00 0.76 C ATOM 3239 O LYS B 97 4.786 21.230 12.306 1.00 1.04 O ATOM 3240 CB LYS B 97 7.273 22.189 11.352 1.00 0.89 C ATOM 3241 CG LYS B 97 6.495 23.513 11.253 1.00 0.94 C ATOM 3242 CD LYS B 97 7.037 24.593 12.197 1.00 1.16 C ATOM 3243 CE LYS B 97 6.777 24.278 13.676 1.00 1.49 C ATOM 3244 NZ LYS B 97 7.112 25.427 14.565 1.00 1.86 N ATOM 0 H LYS B 97 5.179 21.310 9.146 1.00 0.72 H new ATOM 0 HA LYS B 97 7.316 20.159 10.664 1.00 0.76 H new ATOM 0 HB2 LYS B 97 7.445 21.965 12.405 1.00 0.89 H new ATOM 0 HB3 LYS B 97 8.251 22.326 10.891 1.00 0.89 H new ATOM 0 HG2 LYS B 97 6.538 23.879 10.227 1.00 0.94 H new ATOM 0 HG3 LYS B 97 5.445 23.330 11.482 1.00 0.94 H new ATOM 0 HD2 LYS B 97 8.110 24.703 12.037 1.00 1.16 H new ATOM 0 HD3 LYS B 97 6.578 25.550 11.948 1.00 1.16 H new ATOM 0 HE2 LYS B 97 5.729 24.011 13.810 1.00 1.49 H new ATOM 0 HE3 LYS B 97 7.367 23.410 13.970 1.00 1.49 H new ATOM 0 HZ1 LYS B 97 6.920 25.168 15.554 1.00 1.86 H new ATOM 0 HZ2 LYS B 97 8.118 25.666 14.458 1.00 1.86 H new ATOM 0 HZ3 LYS B 97 6.531 26.249 14.304 1.00 1.86 H new ATOM 3258 N LYS B 98 5.032 19.178 11.370 1.00 0.71 N ATOM 3259 CA LYS B 98 3.909 18.565 12.105 1.00 0.74 C ATOM 3260 C LYS B 98 4.128 17.051 12.267 1.00 0.90 C ATOM 3261 O LYS B 98 4.496 16.627 13.382 1.00 1.07 O ATOM 3262 CB LYS B 98 2.558 18.860 11.392 1.00 0.96 C ATOM 3263 CG LYS B 98 1.447 19.366 12.318 1.00 1.08 C ATOM 3264 CD LYS B 98 0.961 18.297 13.306 1.00 1.52 C ATOM 3265 CE LYS B 98 -0.210 18.790 14.160 1.00 1.69 C ATOM 3266 NZ LYS B 98 -1.416 19.114 13.343 1.00 1.85 N ATOM 3267 OXT LYS B 98 3.947 16.308 11.274 1.00 1.15 O ATOM 0 H LYS B 98 5.511 18.540 10.734 1.00 0.71 H new ATOM 0 HA LYS B 98 3.868 19.008 13.100 1.00 0.74 H new ATOM 0 HB2 LYS B 98 2.728 19.601 10.611 1.00 0.96 H new ATOM 0 HB3 LYS B 98 2.216 17.950 10.899 1.00 0.96 H new ATOM 0 HG2 LYS B 98 1.810 20.230 12.875 1.00 1.08 H new ATOM 0 HG3 LYS B 98 0.605 19.706 11.715 1.00 1.08 H new ATOM 0 HD2 LYS B 98 0.658 17.407 12.755 1.00 1.52 H new ATOM 0 HD3 LYS B 98 1.785 18.004 13.956 1.00 1.52 H new ATOM 0 HE2 LYS B 98 -0.467 18.026 14.894 1.00 1.69 H new ATOM 0 HE3 LYS B 98 0.097 19.676 14.716 1.00 1.69 H new ATOM 0 HZ1 LYS B 98 -2.235 19.246 13.970 1.00 1.85 H new ATOM 0 HZ2 LYS B 98 -1.247 19.989 12.806 1.00 1.85 H new ATOM 0 HZ3 LYS B 98 -1.608 18.334 12.682 1.00 1.85 H new TER 3281 LYS B 98 HETATM 3282 NAA ANW A 99 10.288 13.046 7.299 1.00 4.56 N HETATM 3283 NAB ANW A 99 10.746 14.283 5.389 1.00 6.22 N HETATM 3284 CAC ANW A 99 12.294 8.690 14.182 1.00 5.26 C HETATM 3285 CAD ANW A 99 11.372 9.913 14.167 1.00 4.51 C HETATM 3286 CAE ANW A 99 10.074 9.582 14.909 1.00 5.16 C HETATM 3287 CAF ANW A 99 11.093 10.276 12.854 1.00 3.64 C HETATM 3288 CAG ANW A 99 11.547 11.499 12.371 1.00 3.13 C HETATM 3289 CAH ANW A 99 11.319 11.854 11.047 1.00 2.76 C HETATM 3290 CAI ANW A 99 10.625 10.992 10.205 1.00 3.04 C HETATM 3291 CAJ ANW A 99 10.166 9.770 10.687 1.00 3.59 C HETATM 3292 CAK ANW A 99 10.406 9.410 12.007 1.00 3.84 C HETATM 3293 CAL ANW A 99 10.648 12.642 8.525 1.00 3.63 C HETATM 3294 CAM ANW A 99 10.907 14.068 6.690 1.00 5.17 C HETATM 3295 CAN ANW A 99 11.940 14.754 7.316 1.00 5.05 C HETATM 3296 CAO ANW A 99 12.331 14.357 8.590 1.00 4.25 C HETATM 3297 CAP ANW A 99 11.678 13.291 9.196 1.00 3.42 C HETATM 3298 CAQ ANW A 99 11.897 13.008 10.536 1.00 3.01 C HETATM 3299 CAR ANW A 99 12.502 15.889 6.744 1.00 6.05 C HETATM 3300 OAS ANW A 99 10.293 11.395 8.944 1.00 3.49 O HETATM 3301 OAT ANW A 99 12.537 13.774 11.256 1.00 3.52 O HETATM 3302 OAU ANW A 99 13.455 16.467 7.313 1.00 6.33 O HETATM 3303 OAV ANW A 99 12.056 16.343 5.667 1.00 6.88 O HETATM 0 HOAV ANW A 99 11.475 17.111 5.851 1.00 6.88 H new HETATM 0 HNAB ANW A 99 10.146 13.667 4.841 1.00 6.22 H new HETATM 0 HNAA ANW A 99 11.223 15.064 4.938 1.00 6.22 H new HETATM 0 HAEB ANW A 99 9.577 8.746 14.417 1.00 5.16 H new HETATM 0 HAEA ANW A 99 10.303 9.312 15.940 1.00 5.16 H new HETATM 0 HACB ANW A 99 12.523 8.420 15.213 1.00 5.26 H new HETATM 0 HACA ANW A 99 11.797 7.854 13.690 1.00 5.26 H new HETATM 0 HAO ANW A 99 13.139 14.875 9.106 1.00 4.25 H new HETATM 0 HAK ANW A 99 10.056 8.448 12.381 1.00 3.84 H new HETATM 0 HAJ ANW A 99 9.618 9.095 10.029 1.00 3.59 H new HETATM 0 HAG ANW A 99 12.083 12.180 13.032 1.00 3.13 H new HETATM 0 HAE ANW A 99 9.417 10.452 14.899 1.00 5.16 H new HETATM 0 HAD ANW A 99 11.866 10.747 14.665 1.00 4.51 H new HETATM 0 HAC ANW A 99 13.218 8.925 13.654 1.00 5.26 H new HETATM 3317 NAA ANW B 99 -12.397 -19.187 6.134 1.00 4.81 N HETATM 3318 NAB ANW B 99 -13.205 -21.048 5.001 1.00 6.57 N HETATM 3319 CAC ANW B 99 -9.206 -11.603 6.984 1.00 5.53 C HETATM 3320 CAD ANW B 99 -10.658 -11.864 7.392 1.00 4.77 C HETATM 3321 CAE ANW B 99 -10.912 -11.272 8.780 1.00 5.55 C HETATM 3322 CAF ANW B 99 -10.910 -13.232 7.391 1.00 3.85 C HETATM 3323 CAG ANW B 99 -11.688 -13.778 6.375 1.00 3.21 C HETATM 3324 CAH ANW B 99 -11.964 -15.141 6.362 1.00 2.83 C HETATM 3325 CAI ANW B 99 -11.464 -15.960 7.370 1.00 3.21 C HETATM 3326 CAJ ANW B 99 -10.696 -15.413 8.392 1.00 3.83 C HETATM 3327 CAK ANW B 99 -10.411 -14.053 8.398 1.00 4.12 C HETATM 3328 CAL ANW B 99 -12.271 -17.854 6.217 1.00 3.82 C HETATM 3329 CAM ANW B 99 -13.277 -19.752 5.293 1.00 5.45 C HETATM 3330 CAN ANW B 99 -14.099 -18.975 4.488 1.00 5.26 C HETATM 3331 CAO ANW B 99 -13.982 -17.593 4.548 1.00 4.33 C HETATM 3332 CAP ANW B 99 -13.061 -17.029 5.424 1.00 3.50 C HETATM 3333 CAQ ANW B 99 -12.813 -15.664 5.395 1.00 3.00 C HETATM 3334 CAR ANW B 99 -15.128 -19.553 3.751 1.00 6.31 C HETATM 3335 OAS ANW B 99 -11.626 -17.312 7.287 1.00 3.68 O HETATM 3336 OAT ANW B 99 -13.306 -14.945 4.526 1.00 3.40 O HETATM 3337 OAU ANW B 99 -15.808 -18.848 2.974 1.00 6.52 O HETATM 3338 OAV ANW B 99 -15.390 -20.768 3.878 1.00 7.25 O HETATM 0 HOAV ANW B 99 -16.150 -21.000 3.304 1.00 7.25 H new HETATM 0 HNAB ANW B 99 -12.474 -21.625 5.418 1.00 6.57 H new HETATM 0 HNAA ANW B 99 -13.880 -21.465 4.360 1.00 6.57 H new HETATM 0 HAEB ANW B 99 -10.242 -11.738 9.503 1.00 5.55 H new HETATM 0 HAEA ANW B 99 -10.729 -10.198 8.756 1.00 5.55 H new HETATM 0 HACB ANW B 99 -9.022 -10.529 6.960 1.00 5.53 H new HETATM 0 HACA ANW B 99 -8.536 -12.070 7.706 1.00 5.53 H new HETATM 0 HAO ANW B 99 -14.604 -16.958 3.917 1.00 4.33 H new HETATM 0 HAK ANW B 99 -9.796 -13.629 9.192 1.00 4.12 H new HETATM 0 HAJ ANW B 99 -10.317 -16.052 9.190 1.00 3.83 H new HETATM 0 HAG ANW B 99 -12.082 -13.136 5.587 1.00 3.21 H new HETATM 0 HAE ANW B 99 -11.946 -11.458 9.071 1.00 5.55 H new HETATM 0 HAD ANW B 99 -11.330 -11.388 6.677 1.00 4.77 H new HETATM 0 HAC ANW B 99 -9.024 -12.025 5.995 1.00 5.53 H new