USER MOD reduce.3.24.130724 H: found=0, std=0, add=1436, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1430 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 25 HIS : no HE2:sc= -0.314 K(o=-0.41,f=-2.7!) USER MOD Set 1.2: B 85 HIS : no HE2:sc= -0.0941 K(o=-0.41,f=-6!) USER MOD Set 2.1: B 29 LYS NZ :NH3+ 159:sc= 1.08 (180deg=0) USER MOD Set 2.2: B 50 GLN : amide:sc= 0.92 K(o=2,f=-4.2!) USER MOD Set 3.1: B 17 TYR OH : rot 30:sc= 0.894 USER MOD Set 3.2: B 38 ASN : amide:sc= 0.867 K(o=1.8,f=0.7) USER MOD Set 4.1: A 82 THR OG1 : rot 72:sc= 1.97 USER MOD Set 4.2: B 71 GLN : amide:sc= 0.854 K(o=2.8,f=2.1) USER MOD Set 5.1: A 81 THR OG1 : rot 79:sc= 1.21 USER MOD Set 5.2: B 74 MET CE :methyl 178:sc= -0.013 (180deg=-0.0231) USER MOD Set 6.1: A 41 SER OG : rot 81:sc= 1.39 USER MOD Set 6.2: A 42 HIS : no HD1:sc= 0.825 K(o=2.2,f=-3.1!) USER MOD Set 7.1: A 17 TYR OH : rot 161:sc= 0.918 USER MOD Set 7.2: A 38 ASN : amide:sc= 0.819 K(o=1.7,f=-1.8) USER MOD Set 8.1: A 1 SER N :NH3+ -136:sc= -0.0393 (180deg=-0.23) USER MOD Set 8.2: B 41 SER OG : rot -101:sc= 1.9 USER MOD Set 8.3: B 42 HIS : no HE2:sc= 0.482 K(o=2.3,f=-5.6!) USER MOD Single : A 1 SER OG : rot 141:sc= 1.63 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 HIS : no HE2:sc= 0.855 K(o=0.85,f=-2.7!) USER MOD Single : A 16 GLN : amide:sc= 0.919 K(o=0.92,f=-5.9!) USER MOD Single : A 18 SER OG : rot 173:sc= 1.33 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ -147:sc= 0.519 (180deg=0.122) USER MOD Single : A 28 LYS NZ :NH3+ 172:sc= -0.0013 (180deg=-0.111) USER MOD Single : A 29 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0282) USER MOD Single : A 30 SER OG : rot 166:sc= 1.31 USER MOD Single : A 33 LYS NZ :NH3+ -170:sc= 0.801 (180deg=0.701) USER MOD Single : A 37 ASN : amide:sc= 2.84 K(o=2.8,f=-5.6!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= 0.792 K(o=0.79,f=-4.8!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 154:sc= -0.389 (180deg=-2.9) USER MOD Single : A 59 THR OG1 : rot 80:sc= 1.1 USER MOD Single : A 62 SER OG : rot 160:sc= -0.215 USER MOD Single : A 68 CYS SG : rot 83:sc= 0.0652 USER MOD Single : A 71 GLN : amide:sc= 0.761 K(o=0.76,f=0) USER MOD Single : A 74 MET CE :methyl 163:sc= -0.437 (180deg=-0.855) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 CYS SG : rot 166:sc= 0.0765 USER MOD Single : A 85 HIS : no HE2:sc= -0.537 K(o=-0.54,f=-2.9) USER MOD Single : B 1 SER N :NH3+ 150:sc= 0.793 (180deg=0.263) USER MOD Single : B 1 SER OG : rot 180:sc= 0.0625 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 16 GLN : amide:sc= 1.18 K(o=1.2,f=-0.082) USER MOD Single : B 18 SER OG : rot 136:sc= 0.934 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 HIS : no HE2:sc= 0.55 K(o=0.55,f=-4.5!) USER MOD Single : B 26 LYS NZ :NH3+ 172:sc= 0.669 (180deg=0.586) USER MOD Single : B 28 LYS NZ :NH3+ -173:sc= -0.0209 (180deg=-0.0898) USER MOD Single : B 30 SER OG : rot 172:sc= 1.31 USER MOD Single : B 33 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0774) USER MOD Single : B 37 ASN : amide:sc= 2.47 K(o=2.5,f=-4.9!) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl 157:sc= -0.342 (180deg=-2.3) USER MOD Single : B 59 THR OG1 : rot 80:sc= 1.17 USER MOD Single : B 62 SER OG : rot 160:sc= -0.153 USER MOD Single : B 68 CYS SG : rot 82:sc= -0.147 USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 81 THR OG1 : rot 80:sc= 1.2 USER MOD Single : B 82 THR OG1 : rot 78:sc= 1.17 USER MOD Single : B 84 CYS SG : rot 161:sc= 0.291 USER MOD Single : D 74 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 9.602 3.790 -12.783 1.00 0.00 N ATOM 2 CA SER A 1 8.738 3.848 -13.973 1.00 0.00 C ATOM 3 C SER A 1 7.421 3.116 -13.716 1.00 0.00 C ATOM 4 O SER A 1 6.432 3.731 -13.323 1.00 0.00 O ATOM 5 CB SER A 1 9.484 3.262 -15.177 1.00 0.00 C ATOM 6 OG SER A 1 10.039 2.013 -14.799 1.00 0.00 O ATOM 0 H1 SER A 1 10.023 4.726 -12.613 1.00 0.00 H new ATOM 0 H2 SER A 1 9.036 3.510 -11.957 1.00 0.00 H new ATOM 0 H3 SER A 1 10.359 3.093 -12.937 1.00 0.00 H new ATOM 0 HA SER A 1 8.493 4.887 -14.194 1.00 0.00 H new ATOM 0 HB2 SER A 1 8.803 3.135 -16.019 1.00 0.00 H new ATOM 0 HB3 SER A 1 10.270 3.943 -15.503 1.00 0.00 H new ATOM 0 HG SER A 1 9.946 1.376 -15.538 1.00 0.00 H new ATOM 14 N GLU A 2 7.413 1.796 -13.919 1.00 0.00 N ATOM 15 CA GLU A 2 6.219 0.968 -13.807 1.00 0.00 C ATOM 16 C GLU A 2 5.497 1.233 -12.483 1.00 0.00 C ATOM 17 O GLU A 2 4.296 1.513 -12.466 1.00 0.00 O ATOM 18 CB GLU A 2 6.558 -0.525 -13.943 1.00 0.00 C ATOM 19 CG GLU A 2 7.078 -0.917 -15.336 1.00 0.00 C ATOM 20 CD GLU A 2 8.586 -0.744 -15.481 1.00 0.00 C ATOM 21 OE1 GLU A 2 9.308 -1.453 -14.748 1.00 0.00 O ATOM 22 OE2 GLU A 2 8.989 0.093 -16.319 1.00 0.00 O ATOM 0 H GLU A 2 8.250 1.269 -14.169 1.00 0.00 H new ATOM 0 HA GLU A 2 5.553 1.238 -14.627 1.00 0.00 H new ATOM 0 HB2 GLU A 2 7.309 -0.787 -13.198 1.00 0.00 H new ATOM 0 HB3 GLU A 2 5.668 -1.112 -13.719 1.00 0.00 H new ATOM 0 HG2 GLU A 2 6.816 -1.956 -15.536 1.00 0.00 H new ATOM 0 HG3 GLU A 2 6.574 -0.311 -16.089 1.00 0.00 H new ATOM 29 N LEU A 3 6.231 1.169 -11.369 1.00 0.00 N ATOM 30 CA LEU A 3 5.614 1.405 -10.072 1.00 0.00 C ATOM 31 C LEU A 3 5.098 2.839 -9.970 1.00 0.00 C ATOM 32 O LEU A 3 4.041 3.059 -9.390 1.00 0.00 O ATOM 33 CB LEU A 3 6.548 1.074 -8.908 1.00 0.00 C ATOM 34 CG LEU A 3 7.126 -0.347 -8.972 1.00 0.00 C ATOM 35 CD1 LEU A 3 7.735 -0.695 -7.610 1.00 0.00 C ATOM 36 CD2 LEU A 3 6.081 -1.397 -9.361 1.00 0.00 C ATOM 0 H LEU A 3 7.229 0.961 -11.342 1.00 0.00 H new ATOM 0 HA LEU A 3 4.766 0.724 -9.996 1.00 0.00 H new ATOM 0 HB2 LEU A 3 7.369 1.791 -8.896 1.00 0.00 H new ATOM 0 HB3 LEU A 3 6.005 1.195 -7.971 1.00 0.00 H new ATOM 0 HG LEU A 3 7.888 -0.362 -9.752 1.00 0.00 H new ATOM 0 HD11 LEU A 3 8.149 -1.703 -7.643 1.00 0.00 H new ATOM 0 HD12 LEU A 3 8.527 0.015 -7.374 1.00 0.00 H new ATOM 0 HD13 LEU A 3 6.962 -0.645 -6.843 1.00 0.00 H new ATOM 0 HD21 LEU A 3 6.548 -2.382 -9.390 1.00 0.00 H new ATOM 0 HD22 LEU A 3 5.276 -1.399 -8.626 1.00 0.00 H new ATOM 0 HD23 LEU A 3 5.675 -1.159 -10.344 1.00 0.00 H new ATOM 48 N GLU A 4 5.805 3.814 -10.545 1.00 0.00 N ATOM 49 CA GLU A 4 5.334 5.191 -10.539 1.00 0.00 C ATOM 50 C GLU A 4 3.997 5.291 -11.285 1.00 0.00 C ATOM 51 O GLU A 4 3.079 5.963 -10.817 1.00 0.00 O ATOM 52 CB GLU A 4 6.419 6.133 -11.083 1.00 0.00 C ATOM 53 CG GLU A 4 6.070 7.611 -10.837 1.00 0.00 C ATOM 54 CD GLU A 4 5.125 8.232 -11.868 1.00 0.00 C ATOM 55 OE1 GLU A 4 4.960 7.629 -12.950 1.00 0.00 O ATOM 56 OE2 GLU A 4 4.609 9.328 -11.565 1.00 0.00 O ATOM 0 H GLU A 4 6.699 3.673 -11.016 1.00 0.00 H new ATOM 0 HA GLU A 4 5.142 5.515 -9.516 1.00 0.00 H new ATOM 0 HB2 GLU A 4 7.373 5.901 -10.609 1.00 0.00 H new ATOM 0 HB3 GLU A 4 6.545 5.963 -12.152 1.00 0.00 H new ATOM 0 HG2 GLU A 4 5.617 7.702 -9.850 1.00 0.00 H new ATOM 0 HG3 GLU A 4 6.994 8.189 -10.819 1.00 0.00 H new ATOM 63 N LYS A 5 3.868 4.599 -12.422 1.00 0.00 N ATOM 64 CA LYS A 5 2.625 4.592 -13.184 1.00 0.00 C ATOM 65 C LYS A 5 1.505 3.972 -12.348 1.00 0.00 C ATOM 66 O LYS A 5 0.435 4.561 -12.203 1.00 0.00 O ATOM 67 CB LYS A 5 2.801 3.887 -14.537 1.00 0.00 C ATOM 68 CG LYS A 5 3.839 4.568 -15.442 1.00 0.00 C ATOM 69 CD LYS A 5 3.497 6.031 -15.758 1.00 0.00 C ATOM 70 CE LYS A 5 4.517 6.609 -16.743 1.00 0.00 C ATOM 71 NZ LYS A 5 4.256 8.036 -17.007 1.00 0.00 N ATOM 0 H LYS A 5 4.614 4.037 -12.832 1.00 0.00 H new ATOM 0 HA LYS A 5 2.344 5.621 -13.409 1.00 0.00 H new ATOM 0 HB2 LYS A 5 3.101 2.853 -14.365 1.00 0.00 H new ATOM 0 HB3 LYS A 5 1.841 3.859 -15.053 1.00 0.00 H new ATOM 0 HG2 LYS A 5 4.816 4.526 -14.960 1.00 0.00 H new ATOM 0 HG3 LYS A 5 3.920 4.011 -16.375 1.00 0.00 H new ATOM 0 HD2 LYS A 5 2.495 6.095 -16.181 1.00 0.00 H new ATOM 0 HD3 LYS A 5 3.493 6.618 -14.840 1.00 0.00 H new ATOM 0 HE2 LYS A 5 5.523 6.489 -16.341 1.00 0.00 H new ATOM 0 HE3 LYS A 5 4.479 6.051 -17.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 4.963 8.400 -17.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 3.305 8.146 -17.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 4.316 8.570 -16.117 1.00 0.00 H new ATOM 85 N ALA A 6 1.771 2.801 -11.766 1.00 0.00 N ATOM 86 CA ALA A 6 0.846 2.145 -10.850 1.00 0.00 C ATOM 87 C ALA A 6 0.386 3.116 -9.753 1.00 0.00 C ATOM 88 O ALA A 6 -0.809 3.284 -9.511 1.00 0.00 O ATOM 89 CB ALA A 6 1.539 0.910 -10.268 1.00 0.00 C ATOM 0 H ALA A 6 2.636 2.283 -11.919 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.052 1.831 -11.382 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.863 0.404 -9.579 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.809 0.230 -11.076 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.439 1.215 -9.734 1.00 0.00 H new ATOM 95 N VAL A 7 1.346 3.776 -9.108 1.00 0.00 N ATOM 96 CA VAL A 7 1.125 4.749 -8.050 1.00 0.00 C ATOM 97 C VAL A 7 0.208 5.885 -8.524 1.00 0.00 C ATOM 98 O VAL A 7 -0.833 6.125 -7.906 1.00 0.00 O ATOM 99 CB VAL A 7 2.505 5.213 -7.544 1.00 0.00 C ATOM 100 CG1 VAL A 7 2.524 6.558 -6.817 1.00 0.00 C ATOM 101 CG2 VAL A 7 3.097 4.143 -6.616 1.00 0.00 C ATOM 0 H VAL A 7 2.335 3.640 -9.319 1.00 0.00 H new ATOM 0 HA VAL A 7 0.591 4.307 -7.209 1.00 0.00 H new ATOM 0 HB VAL A 7 3.101 5.355 -8.445 1.00 0.00 H new ATOM 0 HG11 VAL A 7 3.542 6.788 -6.504 1.00 0.00 H new ATOM 0 HG12 VAL A 7 2.165 7.339 -7.487 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.878 6.507 -5.941 1.00 0.00 H new ATOM 0 HG21 VAL A 7 4.073 4.471 -6.258 1.00 0.00 H new ATOM 0 HG22 VAL A 7 2.432 3.990 -5.766 1.00 0.00 H new ATOM 0 HG23 VAL A 7 3.207 3.207 -7.164 1.00 0.00 H new ATOM 111 N VAL A 8 0.548 6.588 -9.613 1.00 0.00 N ATOM 112 CA VAL A 8 -0.292 7.706 -10.032 1.00 0.00 C ATOM 113 C VAL A 8 -1.661 7.219 -10.507 1.00 0.00 C ATOM 114 O VAL A 8 -2.655 7.903 -10.278 1.00 0.00 O ATOM 115 CB VAL A 8 0.393 8.654 -11.030 1.00 0.00 C ATOM 116 CG1 VAL A 8 1.652 9.264 -10.406 1.00 0.00 C ATOM 117 CG2 VAL A 8 0.723 7.996 -12.371 1.00 0.00 C ATOM 0 H VAL A 8 1.366 6.409 -10.196 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.457 8.321 -9.147 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.327 9.443 -11.249 1.00 0.00 H new ATOM 0 HG11 VAL A 8 2.126 9.933 -11.124 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.380 9.825 -9.512 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.347 8.468 -10.137 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.204 8.724 -13.025 1.00 0.00 H new ATOM 0 HG22 VAL A 8 1.396 7.154 -12.207 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -0.196 7.641 -12.838 1.00 0.00 H new ATOM 127 N ALA A 9 -1.738 6.030 -11.118 1.00 0.00 N ATOM 128 CA ALA A 9 -3.019 5.420 -11.445 1.00 0.00 C ATOM 129 C ALA A 9 -3.865 5.257 -10.178 1.00 0.00 C ATOM 130 O ALA A 9 -5.013 5.698 -10.148 1.00 0.00 O ATOM 131 CB ALA A 9 -2.817 4.087 -12.173 1.00 0.00 C ATOM 0 H ALA A 9 -0.926 5.477 -11.393 1.00 0.00 H new ATOM 0 HA ALA A 9 -3.561 6.077 -12.125 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -3.788 3.650 -12.407 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -2.263 4.257 -13.096 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -2.256 3.405 -11.534 1.00 0.00 H new ATOM 137 N LEU A 10 -3.291 4.675 -9.116 1.00 0.00 N ATOM 138 CA LEU A 10 -3.992 4.523 -7.844 1.00 0.00 C ATOM 139 C LEU A 10 -4.505 5.876 -7.349 1.00 0.00 C ATOM 140 O LEU A 10 -5.695 6.006 -7.053 1.00 0.00 O ATOM 141 CB LEU A 10 -3.074 3.901 -6.774 1.00 0.00 C ATOM 142 CG LEU A 10 -3.393 2.430 -6.483 1.00 0.00 C ATOM 143 CD1 LEU A 10 -2.984 1.526 -7.649 1.00 0.00 C ATOM 144 CD2 LEU A 10 -2.648 1.997 -5.218 1.00 0.00 C ATOM 0 H LEU A 10 -2.341 4.303 -9.118 1.00 0.00 H new ATOM 0 HA LEU A 10 -4.837 3.855 -8.012 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -2.038 3.983 -7.102 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -3.163 4.474 -5.851 1.00 0.00 H new ATOM 0 HG LEU A 10 -4.470 2.334 -6.343 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -3.225 0.490 -7.408 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.524 1.825 -8.548 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -1.912 1.618 -7.822 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.870 0.951 -5.005 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -1.575 2.117 -5.369 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -2.967 2.614 -4.378 1.00 0.00 H new ATOM 156 N ILE A 11 -3.619 6.876 -7.270 1.00 0.00 N ATOM 157 CA ILE A 11 -3.996 8.192 -6.762 1.00 0.00 C ATOM 158 C ILE A 11 -5.131 8.762 -7.609 1.00 0.00 C ATOM 159 O ILE A 11 -6.166 9.153 -7.073 1.00 0.00 O ATOM 160 CB ILE A 11 -2.782 9.145 -6.723 1.00 0.00 C ATOM 161 CG1 ILE A 11 -1.781 8.643 -5.667 1.00 0.00 C ATOM 162 CG2 ILE A 11 -3.212 10.588 -6.403 1.00 0.00 C ATOM 163 CD1 ILE A 11 -0.494 9.471 -5.610 1.00 0.00 C ATOM 0 H ILE A 11 -2.642 6.796 -7.551 1.00 0.00 H new ATOM 0 HA ILE A 11 -4.348 8.087 -5.736 1.00 0.00 H new ATOM 0 HB ILE A 11 -2.312 9.152 -7.706 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -2.259 8.659 -4.687 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -1.528 7.605 -5.881 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -2.334 11.233 -6.383 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -3.904 10.940 -7.169 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -3.704 10.614 -5.430 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.167 9.063 -4.845 1.00 0.00 H new ATOM 0 HD12 ILE A 11 0.005 9.435 -6.578 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -0.737 10.505 -5.366 1.00 0.00 H new ATOM 175 N ASP A 12 -4.952 8.799 -8.931 1.00 0.00 N ATOM 176 CA ASP A 12 -5.909 9.445 -9.814 1.00 0.00 C ATOM 177 C ASP A 12 -7.270 8.759 -9.732 1.00 0.00 C ATOM 178 O ASP A 12 -8.280 9.424 -9.507 1.00 0.00 O ATOM 179 CB ASP A 12 -5.386 9.449 -11.253 1.00 0.00 C ATOM 180 CG ASP A 12 -6.405 10.108 -12.178 1.00 0.00 C ATOM 181 OD1 ASP A 12 -6.457 11.357 -12.172 1.00 0.00 O ATOM 182 OD2 ASP A 12 -7.138 9.349 -12.849 1.00 0.00 O ATOM 0 H ASP A 12 -4.150 8.387 -9.408 1.00 0.00 H new ATOM 0 HA ASP A 12 -6.035 10.478 -9.491 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -4.438 9.985 -11.302 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -5.192 8.428 -11.581 1.00 0.00 H new ATOM 187 N VAL A 13 -7.299 7.433 -9.900 1.00 0.00 N ATOM 188 CA VAL A 13 -8.544 6.672 -9.895 1.00 0.00 C ATOM 189 C VAL A 13 -9.258 6.882 -8.561 1.00 0.00 C ATOM 190 O VAL A 13 -10.427 7.270 -8.519 1.00 0.00 O ATOM 191 CB VAL A 13 -8.252 5.185 -10.166 1.00 0.00 C ATOM 192 CG1 VAL A 13 -9.497 4.306 -9.977 1.00 0.00 C ATOM 193 CG2 VAL A 13 -7.752 4.997 -11.606 1.00 0.00 C ATOM 0 H VAL A 13 -6.464 6.864 -10.042 1.00 0.00 H new ATOM 0 HA VAL A 13 -9.203 7.023 -10.689 1.00 0.00 H new ATOM 0 HB VAL A 13 -7.492 4.880 -9.447 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -9.242 3.266 -10.179 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -9.856 4.399 -8.952 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.278 4.628 -10.666 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -7.549 3.941 -11.786 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -8.514 5.344 -12.304 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -6.838 5.572 -11.752 1.00 0.00 H new ATOM 203 N PHE A 14 -8.543 6.633 -7.463 1.00 0.00 N ATOM 204 CA PHE A 14 -9.118 6.783 -6.140 1.00 0.00 C ATOM 205 C PHE A 14 -9.672 8.195 -5.947 1.00 0.00 C ATOM 206 O PHE A 14 -10.815 8.363 -5.521 1.00 0.00 O ATOM 207 CB PHE A 14 -8.066 6.464 -5.080 1.00 0.00 C ATOM 208 CG PHE A 14 -8.573 6.729 -3.684 1.00 0.00 C ATOM 209 CD1 PHE A 14 -9.248 5.727 -2.966 1.00 0.00 C ATOM 210 CD2 PHE A 14 -8.442 8.014 -3.135 1.00 0.00 C ATOM 211 CE1 PHE A 14 -9.722 5.994 -1.671 1.00 0.00 C ATOM 212 CE2 PHE A 14 -8.975 8.295 -1.873 1.00 0.00 C ATOM 213 CZ PHE A 14 -9.599 7.281 -1.128 1.00 0.00 C ATOM 0 H PHE A 14 -7.570 6.328 -7.471 1.00 0.00 H new ATOM 0 HA PHE A 14 -9.947 6.083 -6.035 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -7.770 5.419 -5.166 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -7.174 7.064 -5.262 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -9.402 4.754 -3.409 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -7.929 8.787 -3.688 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -10.182 5.207 -1.092 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -8.907 9.295 -1.470 1.00 0.00 H new ATOM 0 HZ PHE A 14 -9.983 7.492 -0.141 1.00 0.00 H new ATOM 223 N HIS A 15 -8.853 9.213 -6.226 1.00 0.00 N ATOM 224 CA HIS A 15 -9.223 10.588 -5.950 1.00 0.00 C ATOM 225 C HIS A 15 -10.427 10.990 -6.797 1.00 0.00 C ATOM 226 O HIS A 15 -11.352 11.610 -6.279 1.00 0.00 O ATOM 227 CB HIS A 15 -8.035 11.530 -6.161 1.00 0.00 C ATOM 228 CG HIS A 15 -8.324 12.942 -5.714 1.00 0.00 C ATOM 229 ND1 HIS A 15 -9.083 13.317 -4.624 1.00 0.00 N ATOM 230 CD2 HIS A 15 -7.909 14.088 -6.339 1.00 0.00 C ATOM 231 CE1 HIS A 15 -9.125 14.659 -4.606 1.00 0.00 C ATOM 232 NE2 HIS A 15 -8.422 15.175 -5.627 1.00 0.00 N ATOM 0 H HIS A 15 -7.929 9.102 -6.644 1.00 0.00 H new ATOM 0 HA HIS A 15 -9.510 10.670 -4.902 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -7.173 11.149 -5.613 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -7.764 11.536 -7.217 1.00 0.00 H new ATOM 0 HD1 HIS A 15 -9.530 12.690 -3.955 1.00 0.00 H new ATOM 0 HD2 HIS A 15 -7.294 14.142 -7.225 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -9.654 15.245 -3.869 1.00 0.00 H new ATOM 240 N GLN A 16 -10.433 10.620 -8.082 1.00 0.00 N ATOM 241 CA GLN A 16 -11.574 10.838 -8.959 1.00 0.00 C ATOM 242 C GLN A 16 -12.849 10.272 -8.330 1.00 0.00 C ATOM 243 O GLN A 16 -13.846 10.981 -8.202 1.00 0.00 O ATOM 244 CB GLN A 16 -11.307 10.150 -10.307 1.00 0.00 C ATOM 245 CG GLN A 16 -10.451 11.011 -11.243 1.00 0.00 C ATOM 246 CD GLN A 16 -11.257 12.135 -11.891 1.00 0.00 C ATOM 247 OE1 GLN A 16 -12.487 12.108 -11.910 1.00 0.00 O ATOM 248 NE2 GLN A 16 -10.577 13.132 -12.448 1.00 0.00 N ATOM 0 H GLN A 16 -9.644 10.161 -8.537 1.00 0.00 H new ATOM 0 HA GLN A 16 -11.712 11.909 -9.110 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -10.805 9.198 -10.133 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -12.257 9.925 -10.792 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -9.620 11.439 -10.682 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -10.020 10.381 -12.021 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -9.557 13.132 -12.420 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -11.075 13.897 -12.904 1.00 0.00 H new ATOM 257 N TYR A 17 -12.803 9.008 -7.902 1.00 0.00 N ATOM 258 CA TYR A 17 -13.988 8.325 -7.403 1.00 0.00 C ATOM 259 C TYR A 17 -14.430 8.985 -6.086 1.00 0.00 C ATOM 260 O TYR A 17 -15.588 9.371 -5.934 1.00 0.00 O ATOM 261 CB TYR A 17 -13.743 6.808 -7.310 1.00 0.00 C ATOM 262 CG TYR A 17 -13.768 6.040 -8.636 1.00 0.00 C ATOM 263 CD1 TYR A 17 -13.128 6.536 -9.791 1.00 0.00 C ATOM 264 CD2 TYR A 17 -14.405 4.782 -8.705 1.00 0.00 C ATOM 265 CE1 TYR A 17 -13.075 5.770 -10.965 1.00 0.00 C ATOM 266 CE2 TYR A 17 -14.322 3.999 -9.873 1.00 0.00 C ATOM 267 CZ TYR A 17 -13.636 4.488 -10.998 1.00 0.00 C ATOM 268 OH TYR A 17 -13.521 3.750 -12.139 1.00 0.00 O ATOM 0 H TYR A 17 -11.955 8.441 -7.893 1.00 0.00 H new ATOM 0 HA TYR A 17 -14.820 8.431 -8.099 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -12.775 6.645 -6.837 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -14.497 6.378 -6.650 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -12.674 7.516 -9.771 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -14.961 4.417 -7.854 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -12.599 6.171 -11.848 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -14.785 3.024 -9.904 1.00 0.00 H new ATOM 0 HH TYR A 17 -13.679 2.805 -11.934 1.00 0.00 H new ATOM 278 N SER A 18 -13.488 9.188 -5.161 1.00 0.00 N ATOM 279 CA SER A 18 -13.691 9.954 -3.931 1.00 0.00 C ATOM 280 C SER A 18 -14.336 11.312 -4.211 1.00 0.00 C ATOM 281 O SER A 18 -15.266 11.716 -3.518 1.00 0.00 O ATOM 282 CB SER A 18 -12.349 10.140 -3.222 1.00 0.00 C ATOM 283 OG SER A 18 -11.773 8.878 -2.956 1.00 0.00 O ATOM 0 H SER A 18 -12.543 8.816 -5.250 1.00 0.00 H new ATOM 0 HA SER A 18 -14.373 9.397 -3.289 1.00 0.00 H new ATOM 0 HB2 SER A 18 -11.678 10.733 -3.843 1.00 0.00 H new ATOM 0 HB3 SER A 18 -12.491 10.689 -2.291 1.00 0.00 H new ATOM 0 HG SER A 18 -10.867 9.000 -2.602 1.00 0.00 H new ATOM 289 N GLY A 19 -13.838 12.014 -5.228 1.00 0.00 N ATOM 290 CA GLY A 19 -14.260 13.354 -5.582 1.00 0.00 C ATOM 291 C GLY A 19 -15.743 13.405 -5.927 1.00 0.00 C ATOM 292 O GLY A 19 -16.387 14.423 -5.684 1.00 0.00 O ATOM 0 H GLY A 19 -13.109 11.649 -5.841 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -14.056 14.031 -4.752 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -13.676 13.707 -6.432 1.00 0.00 H new ATOM 296 N ARG A 20 -16.288 12.324 -6.497 1.00 0.00 N ATOM 297 CA ARG A 20 -17.692 12.300 -6.882 1.00 0.00 C ATOM 298 C ARG A 20 -18.571 12.484 -5.641 1.00 0.00 C ATOM 299 O ARG A 20 -19.502 13.285 -5.673 1.00 0.00 O ATOM 300 CB ARG A 20 -18.033 11.056 -7.712 1.00 0.00 C ATOM 301 CG ARG A 20 -16.924 10.757 -8.733 1.00 0.00 C ATOM 302 CD ARG A 20 -17.445 10.115 -10.024 1.00 0.00 C ATOM 303 NE ARG A 20 -16.397 9.359 -10.730 1.00 0.00 N ATOM 304 CZ ARG A 20 -15.300 9.858 -11.322 1.00 0.00 C ATOM 305 NH1 ARG A 20 -15.035 11.169 -11.307 1.00 0.00 N ATOM 306 NH2 ARG A 20 -14.455 9.022 -11.934 1.00 0.00 N ATOM 0 H ARG A 20 -15.778 11.464 -6.698 1.00 0.00 H new ATOM 0 HA ARG A 20 -17.901 13.139 -7.546 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -18.166 10.199 -7.052 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -18.979 11.208 -8.231 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -16.407 11.684 -8.980 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -16.189 10.094 -8.277 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -18.275 9.449 -9.788 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -17.837 10.891 -10.682 1.00 0.00 H new ATOM 0 HE ARG A 20 -16.517 8.347 -10.774 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -15.673 11.813 -10.839 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -14.195 11.525 -11.764 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -14.648 8.021 -11.947 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -13.617 9.386 -12.388 1.00 0.00 H new ATOM 320 N GLU A 21 -18.269 11.772 -4.546 1.00 0.00 N ATOM 321 CA GLU A 21 -18.878 12.045 -3.250 1.00 0.00 C ATOM 322 C GLU A 21 -18.066 11.420 -2.110 1.00 0.00 C ATOM 323 O GLU A 21 -18.152 10.223 -1.843 1.00 0.00 O ATOM 324 CB GLU A 21 -20.384 11.717 -3.196 1.00 0.00 C ATOM 325 CG GLU A 21 -20.749 10.330 -3.730 1.00 0.00 C ATOM 326 CD GLU A 21 -22.239 10.038 -3.594 1.00 0.00 C ATOM 327 OE1 GLU A 21 -23.026 10.759 -4.244 1.00 0.00 O ATOM 328 OE2 GLU A 21 -22.565 9.096 -2.836 1.00 0.00 O ATOM 0 H GLU A 21 -17.602 11.000 -4.540 1.00 0.00 H new ATOM 0 HA GLU A 21 -18.839 13.124 -3.103 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -20.724 11.796 -2.163 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -20.928 12.468 -3.769 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -20.460 10.258 -4.779 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -20.181 9.573 -3.190 1.00 0.00 H new ATOM 335 N GLY A 22 -17.316 12.255 -1.393 1.00 0.00 N ATOM 336 CA GLY A 22 -16.465 11.846 -0.296 1.00 0.00 C ATOM 337 C GLY A 22 -15.458 12.961 -0.032 1.00 0.00 C ATOM 338 O GLY A 22 -15.279 13.845 -0.872 1.00 0.00 O ATOM 0 H GLY A 22 -17.288 13.259 -1.570 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -17.061 11.653 0.596 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -15.949 10.918 -0.541 1.00 0.00 H new ATOM 342 N ASP A 23 -14.830 12.962 1.144 1.00 0.00 N ATOM 343 CA ASP A 23 -13.987 14.059 1.607 1.00 0.00 C ATOM 344 C ASP A 23 -12.602 14.013 0.966 1.00 0.00 C ATOM 345 O ASP A 23 -11.603 13.920 1.675 1.00 0.00 O ATOM 346 CB ASP A 23 -13.931 14.046 3.143 1.00 0.00 C ATOM 347 CG ASP A 23 -13.086 15.181 3.717 1.00 0.00 C ATOM 348 OD1 ASP A 23 -13.171 16.298 3.160 1.00 0.00 O ATOM 349 OD2 ASP A 23 -12.370 14.910 4.707 1.00 0.00 O ATOM 0 H ASP A 23 -14.895 12.191 1.808 1.00 0.00 H new ATOM 0 HA ASP A 23 -14.425 15.006 1.293 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -14.944 14.118 3.539 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -13.525 13.092 3.479 1.00 0.00 H new ATOM 354 N LYS A 24 -12.553 14.109 -0.369 1.00 0.00 N ATOM 355 CA LYS A 24 -11.361 14.263 -1.202 1.00 0.00 C ATOM 356 C LYS A 24 -10.464 13.017 -1.196 1.00 0.00 C ATOM 357 O LYS A 24 -10.253 12.391 -2.234 1.00 0.00 O ATOM 358 CB LYS A 24 -10.575 15.525 -0.811 1.00 0.00 C ATOM 359 CG LYS A 24 -11.448 16.787 -0.828 1.00 0.00 C ATOM 360 CD LYS A 24 -10.604 18.061 -0.682 1.00 0.00 C ATOM 361 CE LYS A 24 -9.897 18.136 0.678 1.00 0.00 C ATOM 362 NZ LYS A 24 -9.184 19.415 0.839 1.00 0.00 N ATOM 0 H LYS A 24 -13.404 14.079 -0.930 1.00 0.00 H new ATOM 0 HA LYS A 24 -11.709 14.382 -2.228 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -10.152 15.392 0.185 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -9.739 15.656 -1.497 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -12.011 16.828 -1.760 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -12.176 16.737 -0.018 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -9.861 18.095 -1.478 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -11.244 18.935 -0.805 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -10.629 18.022 1.478 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -9.192 17.310 0.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -8.716 19.437 1.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -8.470 19.511 0.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -9.862 20.201 0.775 1.00 0.00 H new ATOM 376 N HIS A 25 -9.952 12.676 -0.014 1.00 0.00 N ATOM 377 CA HIS A 25 -9.094 11.539 0.275 1.00 0.00 C ATOM 378 C HIS A 25 -9.908 10.343 0.784 1.00 0.00 C ATOM 379 O HIS A 25 -9.311 9.434 1.359 1.00 0.00 O ATOM 380 CB HIS A 25 -8.085 11.944 1.361 1.00 0.00 C ATOM 381 CG HIS A 25 -7.054 12.943 0.919 1.00 0.00 C ATOM 382 ND1 HIS A 25 -7.063 14.293 1.185 1.00 0.00 N ATOM 383 CD2 HIS A 25 -5.839 12.635 0.370 1.00 0.00 C ATOM 384 CE1 HIS A 25 -5.875 14.785 0.793 1.00 0.00 C ATOM 385 NE2 HIS A 25 -5.101 13.816 0.280 1.00 0.00 N ATOM 0 H HIS A 25 -10.142 13.229 0.822 1.00 0.00 H new ATOM 0 HA HIS A 25 -8.586 11.248 -0.644 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -8.631 12.357 2.209 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -7.575 11.049 1.716 1.00 0.00 H new ATOM 0 HD1 HIS A 25 -7.829 14.822 1.602 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -5.510 11.654 0.062 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -5.583 15.821 0.879 1.00 0.00 H new ATOM 393 N LYS A 26 -11.241 10.330 0.642 1.00 0.00 N ATOM 394 CA LYS A 26 -12.079 9.330 1.294 1.00 0.00 C ATOM 395 C LYS A 26 -13.240 8.898 0.394 1.00 0.00 C ATOM 396 O LYS A 26 -13.789 9.729 -0.326 1.00 0.00 O ATOM 397 CB LYS A 26 -12.607 9.871 2.631 1.00 0.00 C ATOM 398 CG LYS A 26 -11.550 10.549 3.515 1.00 0.00 C ATOM 399 CD LYS A 26 -12.072 10.697 4.949 1.00 0.00 C ATOM 400 CE LYS A 26 -11.083 11.479 5.816 1.00 0.00 C ATOM 401 NZ LYS A 26 -11.548 11.543 7.213 1.00 0.00 N ATOM 0 H LYS A 26 -11.757 11.005 0.078 1.00 0.00 H new ATOM 0 HA LYS A 26 -11.465 8.450 1.485 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -13.404 10.587 2.428 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -13.053 9.048 3.189 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -10.633 9.960 3.514 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -11.300 11.529 3.109 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -13.035 11.208 4.938 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -12.240 9.711 5.382 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -10.103 11.004 5.776 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -10.965 12.488 5.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -11.253 12.446 7.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -12.585 11.472 7.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -11.134 10.756 7.753 1.00 0.00 H new ATOM 415 N LEU A 27 -13.623 7.617 0.469 1.00 0.00 N ATOM 416 CA LEU A 27 -14.727 7.020 -0.282 1.00 0.00 C ATOM 417 C LEU A 27 -15.911 6.736 0.649 1.00 0.00 C ATOM 418 O LEU A 27 -15.748 6.022 1.640 1.00 0.00 O ATOM 419 CB LEU A 27 -14.287 5.676 -0.884 1.00 0.00 C ATOM 420 CG LEU A 27 -13.200 5.757 -1.965 1.00 0.00 C ATOM 421 CD1 LEU A 27 -12.629 4.353 -2.182 1.00 0.00 C ATOM 422 CD2 LEU A 27 -13.745 6.238 -3.312 1.00 0.00 C ATOM 0 H LEU A 27 -13.153 6.946 1.077 1.00 0.00 H new ATOM 0 HA LEU A 27 -15.016 7.720 -1.066 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.925 5.038 -0.077 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -15.162 5.185 -1.310 1.00 0.00 H new ATOM 0 HG LEU A 27 -12.450 6.469 -1.620 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -11.854 4.390 -2.948 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -12.201 3.986 -1.249 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -13.425 3.682 -2.504 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -12.934 6.277 -4.040 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -14.513 5.548 -3.661 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -14.176 7.232 -3.196 1.00 0.00 H new ATOM 434 N LYS A 28 -17.101 7.255 0.323 1.00 0.00 N ATOM 435 CA LYS A 28 -18.345 6.877 0.996 1.00 0.00 C ATOM 436 C LYS A 28 -18.678 5.419 0.663 1.00 0.00 C ATOM 437 O LYS A 28 -18.035 4.822 -0.194 1.00 0.00 O ATOM 438 CB LYS A 28 -19.481 7.776 0.496 1.00 0.00 C ATOM 439 CG LYS A 28 -19.280 9.244 0.874 1.00 0.00 C ATOM 440 CD LYS A 28 -19.861 9.565 2.258 1.00 0.00 C ATOM 441 CE LYS A 28 -19.532 11.001 2.685 1.00 0.00 C ATOM 442 NZ LYS A 28 -20.058 11.997 1.735 1.00 0.00 N ATOM 0 H LYS A 28 -17.226 7.948 -0.415 1.00 0.00 H new ATOM 0 HA LYS A 28 -18.228 6.992 2.074 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -19.556 7.691 -0.588 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -20.426 7.424 0.910 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -18.216 9.479 0.864 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -19.753 9.879 0.126 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -20.942 9.428 2.241 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -19.462 8.865 2.993 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -19.949 11.189 3.674 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -18.451 11.115 2.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -19.933 12.952 2.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -19.543 11.923 0.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -21.070 11.820 1.571 1.00 0.00 H new ATOM 456 N LYS A 29 -19.705 4.843 1.300 1.00 0.00 N ATOM 457 CA LYS A 29 -20.121 3.476 0.996 1.00 0.00 C ATOM 458 C LYS A 29 -20.476 3.315 -0.484 1.00 0.00 C ATOM 459 O LYS A 29 -20.130 2.307 -1.094 1.00 0.00 O ATOM 460 CB LYS A 29 -21.240 3.016 1.946 1.00 0.00 C ATOM 461 CG LYS A 29 -22.548 3.812 1.830 1.00 0.00 C ATOM 462 CD LYS A 29 -23.568 3.258 2.836 1.00 0.00 C ATOM 463 CE LYS A 29 -24.939 3.928 2.692 1.00 0.00 C ATOM 464 NZ LYS A 29 -24.882 5.375 2.967 1.00 0.00 N ATOM 0 H LYS A 29 -20.258 5.302 2.024 1.00 0.00 H new ATOM 0 HA LYS A 29 -19.276 2.810 1.173 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -21.452 1.964 1.753 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -20.878 3.085 2.972 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -22.363 4.868 2.026 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -22.943 3.740 0.817 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -23.673 2.183 2.691 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -23.196 3.408 3.849 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -25.317 3.766 1.682 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -25.645 3.457 3.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -25.841 5.774 2.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -24.483 5.533 3.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -24.282 5.840 2.256 1.00 0.00 H new ATOM 478 N SER A 30 -21.133 4.319 -1.067 1.00 0.00 N ATOM 479 CA SER A 30 -21.482 4.350 -2.474 1.00 0.00 C ATOM 480 C SER A 30 -20.217 4.303 -3.335 1.00 0.00 C ATOM 481 O SER A 30 -20.089 3.454 -4.221 1.00 0.00 O ATOM 482 CB SER A 30 -22.235 5.664 -2.713 1.00 0.00 C ATOM 483 OG SER A 30 -21.647 6.682 -1.914 1.00 0.00 O ATOM 0 H SER A 30 -21.440 5.147 -0.557 1.00 0.00 H new ATOM 0 HA SER A 30 -22.097 3.491 -2.743 1.00 0.00 H new ATOM 0 HB2 SER A 30 -22.190 5.938 -3.767 1.00 0.00 H new ATOM 0 HB3 SER A 30 -23.289 5.547 -2.459 1.00 0.00 H new ATOM 0 HG SER A 30 -21.956 7.559 -2.222 1.00 0.00 H new ATOM 489 N GLU A 31 -19.266 5.205 -3.062 1.00 0.00 N ATOM 490 CA GLU A 31 -18.070 5.290 -3.878 1.00 0.00 C ATOM 491 C GLU A 31 -17.217 4.041 -3.698 1.00 0.00 C ATOM 492 O GLU A 31 -16.732 3.505 -4.687 1.00 0.00 O ATOM 493 CB GLU A 31 -17.304 6.596 -3.620 1.00 0.00 C ATOM 494 CG GLU A 31 -18.219 7.820 -3.773 1.00 0.00 C ATOM 495 CD GLU A 31 -19.059 7.745 -5.046 1.00 0.00 C ATOM 496 OE1 GLU A 31 -18.452 7.842 -6.133 1.00 0.00 O ATOM 497 OE2 GLU A 31 -20.285 7.543 -4.911 1.00 0.00 O ATOM 0 H GLU A 31 -19.308 5.873 -2.292 1.00 0.00 H new ATOM 0 HA GLU A 31 -18.360 5.325 -4.928 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -16.881 6.579 -2.616 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -16.469 6.674 -4.317 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -18.877 7.892 -2.907 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -17.614 8.726 -3.790 1.00 0.00 H new ATOM 504 N LEU A 32 -17.070 3.547 -2.467 1.00 0.00 N ATOM 505 CA LEU A 32 -16.341 2.318 -2.192 1.00 0.00 C ATOM 506 C LEU A 32 -16.989 1.155 -2.942 1.00 0.00 C ATOM 507 O LEU A 32 -16.303 0.428 -3.654 1.00 0.00 O ATOM 508 CB LEU A 32 -16.231 2.089 -0.675 1.00 0.00 C ATOM 509 CG LEU A 32 -15.313 0.927 -0.237 1.00 0.00 C ATOM 510 CD1 LEU A 32 -15.999 -0.444 -0.310 1.00 0.00 C ATOM 511 CD2 LEU A 32 -13.956 0.908 -0.949 1.00 0.00 C ATOM 0 H LEU A 32 -17.456 3.993 -1.635 1.00 0.00 H new ATOM 0 HA LEU A 32 -15.318 2.396 -2.559 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -15.869 3.007 -0.213 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -17.231 1.906 -0.280 1.00 0.00 H new ATOM 0 HG LEU A 32 -15.107 1.129 0.814 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.301 -1.218 0.010 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.872 -0.449 0.343 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -16.312 -0.640 -1.336 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -13.368 0.064 -0.589 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -14.110 0.810 -2.024 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.423 1.836 -0.742 1.00 0.00 H new ATOM 523 N LYS A 33 -18.313 1.006 -2.852 1.00 0.00 N ATOM 524 CA LYS A 33 -19.024 -0.056 -3.549 1.00 0.00 C ATOM 525 C LYS A 33 -18.680 -0.009 -5.035 1.00 0.00 C ATOM 526 O LYS A 33 -18.200 -0.996 -5.602 1.00 0.00 O ATOM 527 CB LYS A 33 -20.528 0.152 -3.325 1.00 0.00 C ATOM 528 CG LYS A 33 -21.449 -0.595 -4.302 1.00 0.00 C ATOM 529 CD LYS A 33 -22.913 -0.257 -3.988 1.00 0.00 C ATOM 530 CE LYS A 33 -23.841 -0.797 -5.081 1.00 0.00 C ATOM 531 NZ LYS A 33 -23.896 -2.266 -5.073 1.00 0.00 N ATOM 0 H LYS A 33 -18.914 1.616 -2.297 1.00 0.00 H new ATOM 0 HA LYS A 33 -18.733 -1.035 -3.168 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -20.774 -0.160 -2.310 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -20.744 1.218 -3.392 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -21.212 -0.314 -5.328 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -21.288 -1.670 -4.220 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -23.191 -0.684 -3.024 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -23.032 0.823 -3.904 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -24.844 -0.395 -4.938 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -23.495 -0.451 -6.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -24.393 -2.599 -5.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -22.929 -2.650 -5.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -24.405 -2.590 -4.226 1.00 0.00 H new ATOM 545 N GLU A 34 -18.936 1.134 -5.670 1.00 0.00 N ATOM 546 CA GLU A 34 -18.760 1.242 -7.104 1.00 0.00 C ATOM 547 C GLU A 34 -17.291 1.006 -7.450 1.00 0.00 C ATOM 548 O GLU A 34 -16.994 0.245 -8.361 1.00 0.00 O ATOM 549 CB GLU A 34 -19.258 2.618 -7.579 1.00 0.00 C ATOM 550 CG GLU A 34 -18.883 2.957 -9.033 1.00 0.00 C ATOM 551 CD GLU A 34 -19.418 1.968 -10.070 1.00 0.00 C ATOM 552 OE1 GLU A 34 -20.405 1.269 -9.750 1.00 0.00 O ATOM 553 OE2 GLU A 34 -18.837 1.943 -11.176 1.00 0.00 O ATOM 0 H GLU A 34 -19.262 1.986 -5.214 1.00 0.00 H new ATOM 0 HA GLU A 34 -19.348 0.484 -7.622 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -20.343 2.654 -7.477 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -18.850 3.386 -6.922 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -19.259 3.952 -9.270 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -17.797 2.999 -9.115 1.00 0.00 H new ATOM 560 N LEU A 35 -16.380 1.642 -6.713 1.00 0.00 N ATOM 561 CA LEU A 35 -14.942 1.480 -6.849 1.00 0.00 C ATOM 562 C LEU A 35 -14.569 -0.001 -6.872 1.00 0.00 C ATOM 563 O LEU A 35 -13.923 -0.441 -7.821 1.00 0.00 O ATOM 564 CB LEU A 35 -14.270 2.267 -5.712 1.00 0.00 C ATOM 565 CG LEU A 35 -12.745 2.172 -5.538 1.00 0.00 C ATOM 566 CD1 LEU A 35 -12.291 0.807 -5.008 1.00 0.00 C ATOM 567 CD2 LEU A 35 -11.992 2.569 -6.808 1.00 0.00 C ATOM 0 H LEU A 35 -16.637 2.305 -5.982 1.00 0.00 H new ATOM 0 HA LEU A 35 -14.585 1.881 -7.797 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -14.521 3.319 -5.848 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -14.728 1.948 -4.776 1.00 0.00 H new ATOM 0 HG LEU A 35 -12.485 2.902 -4.771 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -11.206 0.799 -4.906 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -12.749 0.624 -4.036 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -12.595 0.026 -5.705 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -10.919 2.486 -6.636 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -12.281 1.907 -7.624 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.239 3.598 -7.071 1.00 0.00 H new ATOM 579 N ILE A 36 -14.979 -0.786 -5.869 1.00 0.00 N ATOM 580 CA ILE A 36 -14.597 -2.193 -5.826 1.00 0.00 C ATOM 581 C ILE A 36 -15.191 -2.929 -7.029 1.00 0.00 C ATOM 582 O ILE A 36 -14.456 -3.595 -7.755 1.00 0.00 O ATOM 583 CB ILE A 36 -14.982 -2.867 -4.494 1.00 0.00 C ATOM 584 CG1 ILE A 36 -14.372 -2.192 -3.252 1.00 0.00 C ATOM 585 CG2 ILE A 36 -14.557 -4.342 -4.519 1.00 0.00 C ATOM 586 CD1 ILE A 36 -12.857 -2.322 -3.106 1.00 0.00 C ATOM 0 H ILE A 36 -15.563 -0.475 -5.093 1.00 0.00 H new ATOM 0 HA ILE A 36 -13.510 -2.249 -5.884 1.00 0.00 H new ATOM 0 HB ILE A 36 -16.064 -2.767 -4.408 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -14.627 -1.132 -3.275 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -14.842 -2.614 -2.364 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -14.831 -4.815 -3.576 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -15.060 -4.852 -5.340 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -13.478 -4.407 -4.658 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -12.534 -1.811 -2.199 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -12.586 -3.376 -3.045 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -12.368 -1.871 -3.970 1.00 0.00 H new ATOM 598 N ASN A 37 -16.504 -2.804 -7.252 1.00 0.00 N ATOM 599 CA ASN A 37 -17.177 -3.481 -8.364 1.00 0.00 C ATOM 600 C ASN A 37 -16.485 -3.173 -9.692 1.00 0.00 C ATOM 601 O ASN A 37 -16.237 -4.060 -10.504 1.00 0.00 O ATOM 602 CB ASN A 37 -18.644 -3.043 -8.468 1.00 0.00 C ATOM 603 CG ASN A 37 -19.549 -3.772 -7.483 1.00 0.00 C ATOM 604 OD1 ASN A 37 -20.124 -4.803 -7.808 1.00 0.00 O ATOM 605 ND2 ASN A 37 -19.700 -3.246 -6.277 1.00 0.00 N ATOM 0 H ASN A 37 -17.124 -2.237 -6.673 1.00 0.00 H new ATOM 0 HA ASN A 37 -17.127 -4.551 -8.164 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -18.711 -1.970 -8.290 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -19.001 -3.221 -9.482 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -20.306 -3.701 -5.595 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -19.210 -2.386 -6.031 1.00 0.00 H new ATOM 612 N ASN A 38 -16.226 -1.890 -9.923 1.00 0.00 N ATOM 613 CA ASN A 38 -15.691 -1.368 -11.163 1.00 0.00 C ATOM 614 C ASN A 38 -14.249 -1.830 -11.345 1.00 0.00 C ATOM 615 O ASN A 38 -13.911 -2.444 -12.359 1.00 0.00 O ATOM 616 CB ASN A 38 -15.775 0.161 -11.087 1.00 0.00 C ATOM 617 CG ASN A 38 -15.218 0.853 -12.319 1.00 0.00 C ATOM 618 OD1 ASN A 38 -14.011 1.050 -12.428 1.00 0.00 O ATOM 619 ND2 ASN A 38 -16.087 1.297 -13.221 1.00 0.00 N ATOM 0 H ASN A 38 -16.391 -1.165 -9.224 1.00 0.00 H new ATOM 0 HA ASN A 38 -16.259 -1.731 -12.020 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -16.816 0.455 -10.953 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -15.231 0.505 -10.208 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -15.757 1.818 -14.033 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -17.084 1.116 -13.101 1.00 0.00 H new ATOM 626 N GLU A 39 -13.399 -1.554 -10.353 1.00 0.00 N ATOM 627 CA GLU A 39 -11.973 -1.752 -10.507 1.00 0.00 C ATOM 628 C GLU A 39 -11.578 -3.199 -10.235 1.00 0.00 C ATOM 629 O GLU A 39 -10.840 -3.761 -11.035 1.00 0.00 O ATOM 630 CB GLU A 39 -11.196 -0.778 -9.617 1.00 0.00 C ATOM 631 CG GLU A 39 -11.290 0.669 -10.130 1.00 0.00 C ATOM 632 CD GLU A 39 -10.577 0.889 -11.465 1.00 0.00 C ATOM 633 OE1 GLU A 39 -9.664 0.090 -11.775 1.00 0.00 O ATOM 634 OE2 GLU A 39 -10.934 1.874 -12.145 1.00 0.00 O ATOM 0 H GLU A 39 -13.681 -1.194 -9.441 1.00 0.00 H new ATOM 0 HA GLU A 39 -11.712 -1.541 -11.544 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -11.584 -0.828 -8.599 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -10.150 -1.081 -9.575 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -12.340 0.940 -10.239 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -10.863 1.339 -9.384 1.00 0.00 H new ATOM 641 N LEU A 40 -12.099 -3.839 -9.182 1.00 0.00 N ATOM 642 CA LEU A 40 -11.831 -5.256 -8.932 1.00 0.00 C ATOM 643 C LEU A 40 -12.876 -6.109 -9.659 1.00 0.00 C ATOM 644 O LEU A 40 -13.320 -7.131 -9.140 1.00 0.00 O ATOM 645 CB LEU A 40 -11.786 -5.597 -7.431 1.00 0.00 C ATOM 646 CG LEU A 40 -10.509 -5.167 -6.698 1.00 0.00 C ATOM 647 CD1 LEU A 40 -10.479 -3.670 -6.384 1.00 0.00 C ATOM 648 CD2 LEU A 40 -10.416 -5.935 -5.374 1.00 0.00 C ATOM 0 H LEU A 40 -12.707 -3.398 -8.492 1.00 0.00 H new ATOM 0 HA LEU A 40 -10.839 -5.482 -9.323 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -12.640 -5.128 -6.943 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -11.905 -6.674 -7.316 1.00 0.00 H new ATOM 0 HG LEU A 40 -9.669 -5.387 -7.357 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -9.552 -3.426 -5.865 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -10.536 -3.102 -7.313 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -11.328 -3.414 -5.750 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -9.511 -5.637 -4.844 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -11.288 -5.709 -4.760 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -10.383 -7.006 -5.576 1.00 0.00 H new ATOM 660 N SER A 41 -13.245 -5.714 -10.877 1.00 0.00 N ATOM 661 CA SER A 41 -14.267 -6.365 -11.680 1.00 0.00 C ATOM 662 C SER A 41 -13.882 -7.804 -12.017 1.00 0.00 C ATOM 663 O SER A 41 -14.748 -8.652 -12.217 1.00 0.00 O ATOM 664 CB SER A 41 -14.453 -5.538 -12.956 1.00 0.00 C ATOM 665 OG SER A 41 -13.213 -4.965 -13.347 1.00 0.00 O ATOM 0 H SER A 41 -12.826 -4.908 -11.341 1.00 0.00 H new ATOM 0 HA SER A 41 -15.200 -6.416 -11.119 1.00 0.00 H new ATOM 0 HB2 SER A 41 -14.840 -6.170 -13.756 1.00 0.00 H new ATOM 0 HB3 SER A 41 -15.189 -4.752 -12.786 1.00 0.00 H new ATOM 0 HG SER A 41 -12.679 -5.634 -13.824 1.00 0.00 H new ATOM 671 N HIS A 42 -12.576 -8.055 -12.130 1.00 0.00 N ATOM 672 CA HIS A 42 -12.018 -9.350 -12.477 1.00 0.00 C ATOM 673 C HIS A 42 -11.493 -10.024 -11.204 1.00 0.00 C ATOM 674 O HIS A 42 -11.671 -11.222 -11.005 1.00 0.00 O ATOM 675 CB HIS A 42 -10.917 -9.150 -13.529 1.00 0.00 C ATOM 676 CG HIS A 42 -11.338 -8.345 -14.744 1.00 0.00 C ATOM 677 ND1 HIS A 42 -11.813 -7.044 -14.767 1.00 0.00 N ATOM 678 CD2 HIS A 42 -11.240 -8.761 -16.047 1.00 0.00 C ATOM 679 CE1 HIS A 42 -11.995 -6.701 -16.054 1.00 0.00 C ATOM 680 NE2 HIS A 42 -11.663 -7.715 -16.871 1.00 0.00 N ATOM 0 H HIS A 42 -11.865 -7.340 -11.977 1.00 0.00 H new ATOM 0 HA HIS A 42 -12.776 -10.004 -12.909 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -10.069 -8.653 -13.057 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -10.569 -10.128 -13.861 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -10.896 -9.729 -16.379 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -12.359 -5.740 -16.387 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -11.710 -7.720 -17.890 1.00 0.00 H new ATOM 688 N PHE A 43 -10.837 -9.239 -10.343 1.00 0.00 N ATOM 689 CA PHE A 43 -10.250 -9.698 -9.091 1.00 0.00 C ATOM 690 C PHE A 43 -11.295 -10.247 -8.115 1.00 0.00 C ATOM 691 O PHE A 43 -11.037 -11.283 -7.501 1.00 0.00 O ATOM 692 CB PHE A 43 -9.424 -8.574 -8.439 1.00 0.00 C ATOM 693 CG PHE A 43 -7.927 -8.661 -8.688 1.00 0.00 C ATOM 694 CD1 PHE A 43 -7.430 -8.716 -10.004 1.00 0.00 C ATOM 695 CD2 PHE A 43 -7.027 -8.666 -7.604 1.00 0.00 C ATOM 696 CE1 PHE A 43 -6.044 -8.714 -10.234 1.00 0.00 C ATOM 697 CE2 PHE A 43 -5.639 -8.668 -7.831 1.00 0.00 C ATOM 698 CZ PHE A 43 -5.150 -8.671 -9.151 1.00 0.00 C ATOM 0 H PHE A 43 -10.699 -8.242 -10.507 1.00 0.00 H new ATOM 0 HA PHE A 43 -9.587 -10.528 -9.334 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -9.785 -7.614 -8.809 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -9.601 -8.588 -7.364 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -8.115 -8.760 -10.838 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -7.405 -8.668 -6.592 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -5.665 -8.746 -11.245 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -4.952 -8.667 -6.997 1.00 0.00 H new ATOM 0 HZ PHE A 43 -4.086 -8.640 -9.332 1.00 0.00 H new ATOM 708 N LEU A 44 -12.409 -9.537 -7.900 1.00 0.00 N ATOM 709 CA LEU A 44 -13.416 -9.892 -6.909 1.00 0.00 C ATOM 710 C LEU A 44 -14.795 -10.068 -7.547 1.00 0.00 C ATOM 711 O LEU A 44 -15.013 -9.702 -8.699 1.00 0.00 O ATOM 712 CB LEU A 44 -13.443 -8.828 -5.797 1.00 0.00 C ATOM 713 CG LEU A 44 -13.295 -9.476 -4.418 1.00 0.00 C ATOM 714 CD1 LEU A 44 -11.855 -9.945 -4.174 1.00 0.00 C ATOM 715 CD2 LEU A 44 -13.697 -8.492 -3.316 1.00 0.00 C ATOM 0 H LEU A 44 -12.634 -8.689 -8.420 1.00 0.00 H new ATOM 0 HA LEU A 44 -13.149 -10.853 -6.469 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -12.637 -8.111 -5.955 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -14.379 -8.271 -5.843 1.00 0.00 H new ATOM 0 HG LEU A 44 -13.956 -10.343 -4.393 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -11.783 -10.401 -3.186 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -11.577 -10.677 -4.932 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -11.180 -9.091 -4.230 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -13.585 -8.970 -2.343 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -13.057 -7.611 -3.363 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -14.736 -8.193 -3.456 1.00 0.00 H new ATOM 727 N GLU A 45 -15.728 -10.642 -6.781 1.00 0.00 N ATOM 728 CA GLU A 45 -17.111 -10.793 -7.207 1.00 0.00 C ATOM 729 C GLU A 45 -17.810 -9.429 -7.216 1.00 0.00 C ATOM 730 O GLU A 45 -17.365 -8.490 -6.559 1.00 0.00 O ATOM 731 CB GLU A 45 -17.852 -11.746 -6.257 1.00 0.00 C ATOM 732 CG GLU A 45 -17.164 -13.106 -6.069 1.00 0.00 C ATOM 733 CD GLU A 45 -17.067 -13.880 -7.377 1.00 0.00 C ATOM 734 OE1 GLU A 45 -18.140 -14.284 -7.874 1.00 0.00 O ATOM 735 OE2 GLU A 45 -15.926 -14.049 -7.858 1.00 0.00 O ATOM 0 H GLU A 45 -15.540 -11.013 -5.850 1.00 0.00 H new ATOM 0 HA GLU A 45 -17.124 -11.209 -8.215 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -17.954 -11.265 -5.284 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.860 -11.911 -6.638 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.164 -12.954 -5.662 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -17.719 -13.695 -5.339 1.00 0.00 H new ATOM 742 N GLU A 46 -18.942 -9.347 -7.918 1.00 0.00 N ATOM 743 CA GLU A 46 -19.830 -8.196 -7.900 1.00 0.00 C ATOM 744 C GLU A 46 -20.448 -8.060 -6.509 1.00 0.00 C ATOM 745 O GLU A 46 -20.966 -9.034 -5.966 1.00 0.00 O ATOM 746 CB GLU A 46 -20.908 -8.405 -8.975 1.00 0.00 C ATOM 747 CG GLU A 46 -21.990 -7.318 -8.987 1.00 0.00 C ATOM 748 CD GLU A 46 -23.060 -7.612 -10.032 1.00 0.00 C ATOM 749 OE1 GLU A 46 -22.714 -7.548 -11.232 1.00 0.00 O ATOM 750 OE2 GLU A 46 -24.201 -7.906 -9.612 1.00 0.00 O ATOM 0 H GLU A 46 -19.269 -10.098 -8.526 1.00 0.00 H new ATOM 0 HA GLU A 46 -19.287 -7.276 -8.117 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -20.430 -8.439 -9.954 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -21.382 -9.374 -8.818 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -22.451 -7.250 -8.001 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -21.534 -6.350 -9.193 1.00 0.00 H new ATOM 757 N ILE A 47 -20.397 -6.852 -5.952 1.00 0.00 N ATOM 758 CA ILE A 47 -20.778 -6.534 -4.583 1.00 0.00 C ATOM 759 C ILE A 47 -21.997 -5.624 -4.626 1.00 0.00 C ATOM 760 O ILE A 47 -21.873 -4.402 -4.750 1.00 0.00 O ATOM 761 CB ILE A 47 -19.606 -5.908 -3.804 1.00 0.00 C ATOM 762 CG1 ILE A 47 -18.290 -6.510 -4.307 1.00 0.00 C ATOM 763 CG2 ILE A 47 -19.822 -6.170 -2.307 1.00 0.00 C ATOM 764 CD1 ILE A 47 -17.090 -6.203 -3.426 1.00 0.00 C ATOM 0 H ILE A 47 -20.074 -6.034 -6.468 1.00 0.00 H new ATOM 0 HA ILE A 47 -21.035 -7.447 -4.046 1.00 0.00 H new ATOM 0 HB ILE A 47 -19.559 -4.830 -3.961 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -18.404 -7.591 -4.384 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -18.094 -6.138 -5.313 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -19.001 -5.733 -1.739 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -20.762 -5.719 -1.991 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -19.857 -7.244 -2.127 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -16.199 -6.665 -3.851 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -16.947 -5.124 -3.369 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -17.262 -6.600 -2.426 1.00 0.00 H new ATOM 776 N LYS A 48 -23.169 -6.252 -4.567 1.00 0.00 N ATOM 777 CA LYS A 48 -24.460 -5.599 -4.668 1.00 0.00 C ATOM 778 C LYS A 48 -24.904 -5.090 -3.295 1.00 0.00 C ATOM 779 O LYS A 48 -25.212 -3.913 -3.122 1.00 0.00 O ATOM 780 CB LYS A 48 -25.458 -6.625 -5.217 1.00 0.00 C ATOM 781 CG LYS A 48 -26.783 -5.988 -5.655 1.00 0.00 C ATOM 782 CD LYS A 48 -27.888 -7.044 -5.794 1.00 0.00 C ATOM 783 CE LYS A 48 -27.398 -8.293 -6.535 1.00 0.00 C ATOM 784 NZ LYS A 48 -28.516 -9.190 -6.877 1.00 0.00 N ATOM 0 H LYS A 48 -23.242 -7.262 -4.444 1.00 0.00 H new ATOM 0 HA LYS A 48 -24.404 -4.738 -5.334 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -25.011 -7.143 -6.066 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -25.656 -7.377 -4.453 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -27.086 -5.235 -4.927 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -26.645 -5.474 -6.607 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -28.246 -7.327 -4.804 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -28.735 -6.614 -6.329 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -26.876 -7.997 -7.445 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -26.678 -8.827 -5.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -28.150 -10.025 -7.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -28.998 -9.492 -6.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -29.190 -8.687 -7.489 1.00 0.00 H new ATOM 798 N GLU A 49 -24.957 -6.018 -2.334 1.00 0.00 N ATOM 799 CA GLU A 49 -25.552 -5.842 -1.022 1.00 0.00 C ATOM 800 C GLU A 49 -24.918 -4.683 -0.242 1.00 0.00 C ATOM 801 O GLU A 49 -23.845 -4.837 0.344 1.00 0.00 O ATOM 802 CB GLU A 49 -25.448 -7.175 -0.268 1.00 0.00 C ATOM 803 CG GLU A 49 -26.277 -7.174 1.023 1.00 0.00 C ATOM 804 CD GLU A 49 -26.159 -8.482 1.802 1.00 0.00 C ATOM 805 OE1 GLU A 49 -25.574 -9.436 1.244 1.00 0.00 O ATOM 806 OE2 GLU A 49 -26.640 -8.497 2.954 1.00 0.00 O ATOM 0 H GLU A 49 -24.566 -6.951 -2.464 1.00 0.00 H new ATOM 0 HA GLU A 49 -26.601 -5.566 -1.135 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -25.786 -7.984 -0.915 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -24.404 -7.375 -0.028 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -25.953 -6.348 1.657 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -27.324 -6.996 0.777 1.00 0.00 H new ATOM 813 N GLN A 50 -25.608 -3.540 -0.183 1.00 0.00 N ATOM 814 CA GLN A 50 -25.168 -2.338 0.518 1.00 0.00 C ATOM 815 C GLN A 50 -24.764 -2.638 1.966 1.00 0.00 C ATOM 816 O GLN A 50 -23.823 -2.043 2.484 1.00 0.00 O ATOM 817 CB GLN A 50 -26.242 -1.240 0.473 1.00 0.00 C ATOM 818 CG GLN A 50 -26.384 -0.577 -0.909 1.00 0.00 C ATOM 819 CD GLN A 50 -27.111 -1.436 -1.942 1.00 0.00 C ATOM 820 OE1 GLN A 50 -27.695 -2.468 -1.621 1.00 0.00 O ATOM 821 NE2 GLN A 50 -27.100 -1.009 -3.199 1.00 0.00 N ATOM 0 H GLN A 50 -26.515 -3.426 -0.636 1.00 0.00 H new ATOM 0 HA GLN A 50 -24.284 -1.972 -0.004 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -27.201 -1.669 0.762 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -26.000 -0.475 1.211 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -26.920 0.365 -0.794 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -25.391 -0.335 -1.288 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -26.608 -0.149 -3.441 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -27.583 -1.541 -3.923 1.00 0.00 H new ATOM 830 N GLU A 51 -25.445 -3.578 2.621 1.00 0.00 N ATOM 831 CA GLU A 51 -25.095 -3.984 3.973 1.00 0.00 C ATOM 832 C GLU A 51 -23.640 -4.475 4.008 1.00 0.00 C ATOM 833 O GLU A 51 -22.882 -4.130 4.912 1.00 0.00 O ATOM 834 CB GLU A 51 -26.062 -5.064 4.487 1.00 0.00 C ATOM 835 CG GLU A 51 -27.548 -4.678 4.369 1.00 0.00 C ATOM 836 CD GLU A 51 -28.198 -5.162 3.071 1.00 0.00 C ATOM 837 OE1 GLU A 51 -27.937 -4.528 2.025 1.00 0.00 O ATOM 838 OE2 GLU A 51 -28.932 -6.170 3.142 1.00 0.00 O ATOM 0 H GLU A 51 -26.247 -4.073 2.230 1.00 0.00 H new ATOM 0 HA GLU A 51 -25.185 -3.124 4.636 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -25.891 -5.986 3.931 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -25.833 -5.275 5.532 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -28.093 -5.094 5.217 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -27.641 -3.594 4.431 1.00 0.00 H new ATOM 845 N VAL A 52 -23.233 -5.250 3.001 1.00 0.00 N ATOM 846 CA VAL A 52 -21.877 -5.764 2.925 1.00 0.00 C ATOM 847 C VAL A 52 -20.915 -4.646 2.543 1.00 0.00 C ATOM 848 O VAL A 52 -19.864 -4.534 3.168 1.00 0.00 O ATOM 849 CB VAL A 52 -21.779 -6.958 1.966 1.00 0.00 C ATOM 850 CG1 VAL A 52 -20.331 -7.466 1.921 1.00 0.00 C ATOM 851 CG2 VAL A 52 -22.685 -8.089 2.462 1.00 0.00 C ATOM 0 H VAL A 52 -23.832 -5.533 2.226 1.00 0.00 H new ATOM 0 HA VAL A 52 -21.592 -6.134 3.910 1.00 0.00 H new ATOM 0 HB VAL A 52 -22.091 -6.643 0.970 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -20.264 -8.314 1.239 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -19.676 -6.668 1.573 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -20.024 -7.778 2.919 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -22.615 -8.937 1.780 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -22.369 -8.398 3.459 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -23.716 -7.739 2.500 1.00 0.00 H new ATOM 861 N VAL A 53 -21.243 -3.818 1.540 1.00 0.00 N ATOM 862 CA VAL A 53 -20.344 -2.734 1.161 1.00 0.00 C ATOM 863 C VAL A 53 -20.058 -1.853 2.385 1.00 0.00 C ATOM 864 O VAL A 53 -18.902 -1.558 2.695 1.00 0.00 O ATOM 865 CB VAL A 53 -20.824 -1.960 -0.083 1.00 0.00 C ATOM 866 CG1 VAL A 53 -21.492 -2.870 -1.119 1.00 0.00 C ATOM 867 CG2 VAL A 53 -21.677 -0.718 0.204 1.00 0.00 C ATOM 0 H VAL A 53 -22.102 -3.879 0.993 1.00 0.00 H new ATOM 0 HA VAL A 53 -19.394 -3.160 0.840 1.00 0.00 H new ATOM 0 HB VAL A 53 -19.901 -1.572 -0.514 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -21.811 -2.275 -1.974 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -20.782 -3.628 -1.449 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -22.359 -3.356 -0.671 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -21.962 -0.247 -0.737 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -22.574 -1.011 0.750 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -21.102 -0.012 0.803 1.00 0.00 H new ATOM 877 N ASP A 54 -21.122 -1.507 3.120 1.00 0.00 N ATOM 878 CA ASP A 54 -21.055 -0.807 4.390 1.00 0.00 C ATOM 879 C ASP A 54 -20.177 -1.566 5.386 1.00 0.00 C ATOM 880 O ASP A 54 -19.301 -0.967 5.999 1.00 0.00 O ATOM 881 CB ASP A 54 -22.464 -0.589 4.948 1.00 0.00 C ATOM 882 CG ASP A 54 -22.413 0.212 6.244 1.00 0.00 C ATOM 883 OD1 ASP A 54 -22.414 1.457 6.138 1.00 0.00 O ATOM 884 OD2 ASP A 54 -22.367 -0.437 7.312 1.00 0.00 O ATOM 0 H ASP A 54 -22.077 -1.717 2.831 1.00 0.00 H new ATOM 0 HA ASP A 54 -20.597 0.168 4.226 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -23.074 -0.063 4.214 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -22.942 -1.552 5.128 1.00 0.00 H new ATOM 889 N LYS A 55 -20.386 -2.875 5.551 1.00 0.00 N ATOM 890 CA LYS A 55 -19.600 -3.646 6.505 1.00 0.00 C ATOM 891 C LYS A 55 -18.105 -3.599 6.161 1.00 0.00 C ATOM 892 O LYS A 55 -17.289 -3.338 7.044 1.00 0.00 O ATOM 893 CB LYS A 55 -20.096 -5.097 6.565 1.00 0.00 C ATOM 894 CG LYS A 55 -19.507 -5.821 7.786 1.00 0.00 C ATOM 895 CD LYS A 55 -19.753 -7.334 7.745 1.00 0.00 C ATOM 896 CE LYS A 55 -18.890 -8.016 6.676 1.00 0.00 C ATOM 897 NZ LYS A 55 -18.932 -9.481 6.819 1.00 0.00 N ATOM 0 H LYS A 55 -21.086 -3.414 5.041 1.00 0.00 H new ATOM 0 HA LYS A 55 -19.730 -3.194 7.488 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -21.185 -5.113 6.617 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -19.812 -5.622 5.653 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -18.435 -5.631 7.835 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -19.945 -5.409 8.695 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -19.533 -7.766 8.721 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -20.806 -7.527 7.541 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -19.243 -7.734 5.684 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -17.860 -7.668 6.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -18.340 -9.919 6.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -18.573 -9.749 7.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -19.913 -9.812 6.716 1.00 0.00 H new ATOM 911 N VAL A 56 -17.725 -3.872 4.907 1.00 0.00 N ATOM 912 CA VAL A 56 -16.310 -3.961 4.552 1.00 0.00 C ATOM 913 C VAL A 56 -15.631 -2.595 4.683 1.00 0.00 C ATOM 914 O VAL A 56 -14.512 -2.509 5.185 1.00 0.00 O ATOM 915 CB VAL A 56 -16.063 -4.630 3.185 1.00 0.00 C ATOM 916 CG1 VAL A 56 -16.636 -6.054 3.141 1.00 0.00 C ATOM 917 CG2 VAL A 56 -16.599 -3.828 1.998 1.00 0.00 C ATOM 0 H VAL A 56 -18.370 -4.033 4.133 1.00 0.00 H new ATOM 0 HA VAL A 56 -15.840 -4.631 5.272 1.00 0.00 H new ATOM 0 HB VAL A 56 -14.978 -4.668 3.084 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -16.443 -6.494 2.162 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -16.161 -6.661 3.912 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -17.711 -6.019 3.317 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -16.387 -4.363 1.072 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -17.676 -3.698 2.104 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -16.116 -2.851 1.971 1.00 0.00 H new ATOM 927 N MET A 57 -16.297 -1.513 4.269 1.00 0.00 N ATOM 928 CA MET A 57 -15.715 -0.188 4.441 1.00 0.00 C ATOM 929 C MET A 57 -15.671 0.198 5.926 1.00 0.00 C ATOM 930 O MET A 57 -14.626 0.616 6.420 1.00 0.00 O ATOM 931 CB MET A 57 -16.374 0.825 3.499 1.00 0.00 C ATOM 932 CG MET A 57 -17.859 1.096 3.745 1.00 0.00 C ATOM 933 SD MET A 57 -18.302 2.516 4.764 1.00 0.00 S ATOM 934 CE MET A 57 -17.576 3.830 3.764 1.00 0.00 C ATOM 0 H MET A 57 -17.215 -1.529 3.824 1.00 0.00 H new ATOM 0 HA MET A 57 -14.669 -0.192 4.134 1.00 0.00 H new ATOM 0 HB2 MET A 57 -15.834 1.769 3.576 1.00 0.00 H new ATOM 0 HB3 MET A 57 -16.253 0.472 2.475 1.00 0.00 H new ATOM 0 HG2 MET A 57 -18.342 1.217 2.775 1.00 0.00 H new ATOM 0 HG3 MET A 57 -18.289 0.207 4.206 1.00 0.00 H new ATOM 0 HE1 MET A 57 -18.107 4.764 3.949 1.00 0.00 H new ATOM 0 HE2 MET A 57 -16.526 3.952 4.030 1.00 0.00 H new ATOM 0 HE3 MET A 57 -17.655 3.570 2.708 1.00 0.00 H new ATOM 944 N GLU A 58 -16.759 -0.026 6.672 1.00 0.00 N ATOM 945 CA GLU A 58 -16.802 0.205 8.114 1.00 0.00 C ATOM 946 C GLU A 58 -15.654 -0.533 8.807 1.00 0.00 C ATOM 947 O GLU A 58 -14.953 0.039 9.638 1.00 0.00 O ATOM 948 CB GLU A 58 -18.164 -0.234 8.668 1.00 0.00 C ATOM 949 CG GLU A 58 -18.244 -0.042 10.184 1.00 0.00 C ATOM 950 CD GLU A 58 -19.663 -0.271 10.690 1.00 0.00 C ATOM 951 OE1 GLU A 58 -20.008 -1.457 10.891 1.00 0.00 O ATOM 952 OE2 GLU A 58 -20.376 0.740 10.864 1.00 0.00 O ATOM 0 H GLU A 58 -17.637 -0.374 6.287 1.00 0.00 H new ATOM 0 HA GLU A 58 -16.678 1.269 8.313 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -18.956 0.340 8.186 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -18.336 -1.282 8.424 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -17.562 -0.734 10.678 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -17.920 0.966 10.444 1.00 0.00 H new ATOM 959 N THR A 59 -15.421 -1.783 8.409 1.00 0.00 N ATOM 960 CA THR A 59 -14.371 -2.634 8.956 1.00 0.00 C ATOM 961 C THR A 59 -13.008 -1.940 8.865 1.00 0.00 C ATOM 962 O THR A 59 -12.177 -2.123 9.752 1.00 0.00 O ATOM 963 CB THR A 59 -14.393 -3.981 8.203 1.00 0.00 C ATOM 964 OG1 THR A 59 -15.519 -4.721 8.621 1.00 0.00 O ATOM 965 CG2 THR A 59 -13.127 -4.834 8.333 1.00 0.00 C ATOM 0 H THR A 59 -15.970 -2.240 7.681 1.00 0.00 H new ATOM 0 HA THR A 59 -14.549 -2.822 10.015 1.00 0.00 H new ATOM 0 HB THR A 59 -14.445 -3.727 7.144 1.00 0.00 H new ATOM 0 HG1 THR A 59 -16.316 -4.396 8.153 1.00 0.00 H new ATOM 0 HG21 THR A 59 -13.250 -5.757 7.766 1.00 0.00 H new ATOM 0 HG22 THR A 59 -12.273 -4.280 7.943 1.00 0.00 H new ATOM 0 HG23 THR A 59 -12.956 -5.073 9.383 1.00 0.00 H new ATOM 973 N LEU A 60 -12.770 -1.144 7.816 1.00 0.00 N ATOM 974 CA LEU A 60 -11.518 -0.419 7.639 1.00 0.00 C ATOM 975 C LEU A 60 -11.640 1.071 7.955 1.00 0.00 C ATOM 976 O LEU A 60 -10.694 1.814 7.717 1.00 0.00 O ATOM 977 CB LEU A 60 -11.000 -0.638 6.218 1.00 0.00 C ATOM 978 CG LEU A 60 -10.868 -2.122 5.843 1.00 0.00 C ATOM 979 CD1 LEU A 60 -10.298 -2.222 4.428 1.00 0.00 C ATOM 980 CD2 LEU A 60 -9.940 -2.870 6.809 1.00 0.00 C ATOM 0 H LEU A 60 -13.445 -0.988 7.068 1.00 0.00 H new ATOM 0 HA LEU A 60 -10.802 -0.818 8.357 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -11.674 -0.151 5.514 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -10.028 -0.156 6.114 1.00 0.00 H new ATOM 0 HG LEU A 60 -11.856 -2.579 5.900 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -10.199 -3.271 4.149 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -10.969 -1.722 3.729 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -9.319 -1.744 4.396 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -9.872 -3.916 6.511 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -8.948 -2.420 6.782 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -10.340 -2.806 7.821 1.00 0.00 H new ATOM 992 N ASP A 61 -12.774 1.539 8.481 1.00 0.00 N ATOM 993 CA ASP A 61 -13.001 2.958 8.757 1.00 0.00 C ATOM 994 C ASP A 61 -12.216 3.403 9.999 1.00 0.00 C ATOM 995 O ASP A 61 -12.794 3.766 11.023 1.00 0.00 O ATOM 996 CB ASP A 61 -14.507 3.231 8.876 1.00 0.00 C ATOM 997 CG ASP A 61 -14.845 4.673 9.257 1.00 0.00 C ATOM 998 OD1 ASP A 61 -14.067 5.588 8.902 1.00 0.00 O ATOM 999 OD2 ASP A 61 -15.889 4.851 9.922 1.00 0.00 O ATOM 0 H ASP A 61 -13.563 0.942 8.728 1.00 0.00 H new ATOM 0 HA ASP A 61 -12.626 3.556 7.926 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -14.986 2.994 7.926 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -14.931 2.559 9.622 1.00 0.00 H new ATOM 1004 N SER A 62 -10.884 3.419 9.887 1.00 0.00 N ATOM 1005 CA SER A 62 -9.961 3.864 10.925 1.00 0.00 C ATOM 1006 C SER A 62 -10.334 5.260 11.424 1.00 0.00 C ATOM 1007 O SER A 62 -10.212 5.564 12.608 1.00 0.00 O ATOM 1008 CB SER A 62 -8.543 3.870 10.350 1.00 0.00 C ATOM 1009 OG SER A 62 -8.477 4.768 9.259 1.00 0.00 O ATOM 0 H SER A 62 -10.407 3.111 9.040 1.00 0.00 H new ATOM 0 HA SER A 62 -10.017 3.182 11.773 1.00 0.00 H new ATOM 0 HB2 SER A 62 -7.829 4.164 11.119 1.00 0.00 H new ATOM 0 HB3 SER A 62 -8.267 2.867 10.025 1.00 0.00 H new ATOM 0 HG SER A 62 -7.543 5.018 9.097 1.00 0.00 H new ATOM 1015 N ASP A 63 -10.810 6.098 10.501 1.00 0.00 N ATOM 1016 CA ASP A 63 -11.148 7.487 10.757 1.00 0.00 C ATOM 1017 C ASP A 63 -12.414 7.608 11.607 1.00 0.00 C ATOM 1018 O ASP A 63 -12.701 8.697 12.097 1.00 0.00 O ATOM 1019 CB ASP A 63 -11.390 8.203 9.420 1.00 0.00 C ATOM 1020 CG ASP A 63 -10.219 8.084 8.452 1.00 0.00 C ATOM 1021 OD1 ASP A 63 -10.116 7.005 7.828 1.00 0.00 O ATOM 1022 OD2 ASP A 63 -9.466 9.076 8.340 1.00 0.00 O ATOM 0 H ASP A 63 -10.973 5.817 9.534 1.00 0.00 H new ATOM 0 HA ASP A 63 -10.318 7.941 11.299 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -12.283 7.790 8.951 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -11.589 9.258 9.611 1.00 0.00 H new ATOM 1027 N GLY A 64 -13.198 6.532 11.750 1.00 0.00 N ATOM 1028 CA GLY A 64 -14.498 6.581 12.403 1.00 0.00 C ATOM 1029 C GLY A 64 -15.393 7.647 11.766 1.00 0.00 C ATOM 1030 O GLY A 64 -16.165 8.301 12.462 1.00 0.00 O ATOM 0 H GLY A 64 -12.942 5.604 11.413 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -14.981 5.606 12.333 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -14.368 6.797 13.464 1.00 0.00 H new ATOM 1034 N ASP A 65 -15.272 7.828 10.446 1.00 0.00 N ATOM 1035 CA ASP A 65 -15.910 8.899 9.690 1.00 0.00 C ATOM 1036 C ASP A 65 -16.882 8.303 8.668 1.00 0.00 C ATOM 1037 O ASP A 65 -17.334 8.985 7.751 1.00 0.00 O ATOM 1038 CB ASP A 65 -14.792 9.707 9.012 1.00 0.00 C ATOM 1039 CG ASP A 65 -15.261 10.991 8.330 1.00 0.00 C ATOM 1040 OD1 ASP A 65 -16.239 11.592 8.824 1.00 0.00 O ATOM 1041 OD2 ASP A 65 -14.588 11.372 7.347 1.00 0.00 O ATOM 0 H ASP A 65 -14.709 7.211 9.861 1.00 0.00 H new ATOM 0 HA ASP A 65 -16.492 9.555 10.337 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -14.041 9.962 9.760 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -14.303 9.075 8.271 1.00 0.00 H new ATOM 1046 N GLY A 66 -17.180 7.007 8.787 1.00 0.00 N ATOM 1047 CA GLY A 66 -17.906 6.261 7.779 1.00 0.00 C ATOM 1048 C GLY A 66 -17.001 6.042 6.571 1.00 0.00 C ATOM 1049 O GLY A 66 -16.521 4.936 6.340 1.00 0.00 O ATOM 0 H GLY A 66 -16.917 6.448 9.598 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -18.232 5.303 8.183 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -18.803 6.804 7.483 1.00 0.00 H new ATOM 1053 N GLU A 67 -16.779 7.112 5.808 1.00 0.00 N ATOM 1054 CA GLU A 67 -16.014 7.087 4.575 1.00 0.00 C ATOM 1055 C GLU A 67 -14.592 6.554 4.794 1.00 0.00 C ATOM 1056 O GLU A 67 -13.894 6.974 5.716 1.00 0.00 O ATOM 1057 CB GLU A 67 -16.065 8.448 3.868 1.00 0.00 C ATOM 1058 CG GLU A 67 -15.663 9.639 4.750 1.00 0.00 C ATOM 1059 CD GLU A 67 -15.807 10.968 4.017 1.00 0.00 C ATOM 1060 OE1 GLU A 67 -15.826 10.939 2.766 1.00 0.00 O ATOM 1061 OE2 GLU A 67 -15.912 12.000 4.712 1.00 0.00 O ATOM 0 H GLU A 67 -17.137 8.038 6.041 1.00 0.00 H new ATOM 0 HA GLU A 67 -16.482 6.375 3.895 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -15.407 8.417 2.999 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -17.076 8.612 3.496 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -16.282 9.651 5.647 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -14.631 9.516 5.077 1.00 0.00 H new ATOM 1068 N CYS A 68 -14.177 5.608 3.947 1.00 0.00 N ATOM 1069 CA CYS A 68 -12.897 4.918 4.073 1.00 0.00 C ATOM 1070 C CYS A 68 -11.813 5.800 3.464 1.00 0.00 C ATOM 1071 O CYS A 68 -11.950 6.212 2.311 1.00 0.00 O ATOM 1072 CB CYS A 68 -12.948 3.549 3.371 1.00 0.00 C ATOM 1073 SG CYS A 68 -12.834 2.224 4.589 1.00 0.00 S ATOM 0 H CYS A 68 -14.729 5.299 3.147 1.00 0.00 H new ATOM 0 HA CYS A 68 -12.675 4.737 5.125 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -13.875 3.456 2.806 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -12.130 3.468 2.656 1.00 0.00 H new ATOM 0 HG CYS A 68 -14.008 2.004 5.102 1.00 0.00 H new ATOM 1079 N ASP A 69 -10.757 6.108 4.223 1.00 0.00 N ATOM 1080 CA ASP A 69 -9.705 7.005 3.766 1.00 0.00 C ATOM 1081 C ASP A 69 -8.780 6.287 2.787 1.00 0.00 C ATOM 1082 O ASP A 69 -8.701 5.057 2.783 1.00 0.00 O ATOM 1083 CB ASP A 69 -8.946 7.577 4.973 1.00 0.00 C ATOM 1084 CG ASP A 69 -7.805 8.505 4.563 1.00 0.00 C ATOM 1085 OD1 ASP A 69 -8.087 9.707 4.376 1.00 0.00 O ATOM 1086 OD2 ASP A 69 -6.676 7.986 4.414 1.00 0.00 O ATOM 0 H ASP A 69 -10.613 5.743 5.164 1.00 0.00 H new ATOM 0 HA ASP A 69 -10.148 7.843 3.228 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -9.642 8.123 5.610 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -8.546 6.756 5.568 1.00 0.00 H new ATOM 1091 N PHE A 70 -8.046 7.058 1.983 1.00 0.00 N ATOM 1092 CA PHE A 70 -7.074 6.536 1.039 1.00 0.00 C ATOM 1093 C PHE A 70 -6.143 5.516 1.691 1.00 0.00 C ATOM 1094 O PHE A 70 -5.914 4.453 1.125 1.00 0.00 O ATOM 1095 CB PHE A 70 -6.270 7.682 0.419 1.00 0.00 C ATOM 1096 CG PHE A 70 -5.309 7.211 -0.651 1.00 0.00 C ATOM 1097 CD1 PHE A 70 -5.814 6.552 -1.783 1.00 0.00 C ATOM 1098 CD2 PHE A 70 -3.921 7.387 -0.515 1.00 0.00 C ATOM 1099 CE1 PHE A 70 -4.969 6.209 -2.847 1.00 0.00 C ATOM 1100 CE2 PHE A 70 -3.063 6.982 -1.551 1.00 0.00 C ATOM 1101 CZ PHE A 70 -3.589 6.416 -2.728 1.00 0.00 C ATOM 0 H PHE A 70 -8.116 8.076 1.974 1.00 0.00 H new ATOM 0 HA PHE A 70 -7.620 6.019 0.250 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -6.957 8.411 -0.011 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -5.712 8.194 1.203 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -6.865 6.307 -1.834 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -3.516 7.832 0.382 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -5.379 5.788 -3.753 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -1.995 7.105 -1.444 1.00 0.00 H new ATOM 0 HZ PHE A 70 -2.929 6.142 -3.538 1.00 0.00 H new ATOM 1111 N GLN A 71 -5.652 5.804 2.898 1.00 0.00 N ATOM 1112 CA GLN A 71 -4.824 4.868 3.644 1.00 0.00 C ATOM 1113 C GLN A 71 -5.510 3.500 3.783 1.00 0.00 C ATOM 1114 O GLN A 71 -4.864 2.458 3.654 1.00 0.00 O ATOM 1115 CB GLN A 71 -4.505 5.477 5.018 1.00 0.00 C ATOM 1116 CG GLN A 71 -3.694 4.556 5.942 1.00 0.00 C ATOM 1117 CD GLN A 71 -2.321 4.200 5.374 1.00 0.00 C ATOM 1118 OE1 GLN A 71 -1.315 4.798 5.741 1.00 0.00 O ATOM 1119 NE2 GLN A 71 -2.257 3.216 4.482 1.00 0.00 N ATOM 0 H GLN A 71 -5.818 6.688 3.379 1.00 0.00 H new ATOM 0 HA GLN A 71 -3.895 4.696 3.101 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -3.952 6.405 4.872 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -5.440 5.738 5.513 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -3.566 5.042 6.909 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -4.257 3.639 6.118 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -3.108 2.734 4.193 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -1.357 2.943 4.087 1.00 0.00 H new ATOM 1128 N GLU A 72 -6.811 3.505 4.073 1.00 0.00 N ATOM 1129 CA GLU A 72 -7.598 2.308 4.329 1.00 0.00 C ATOM 1130 C GLU A 72 -7.865 1.573 3.018 1.00 0.00 C ATOM 1131 O GLU A 72 -7.723 0.354 2.935 1.00 0.00 O ATOM 1132 CB GLU A 72 -8.883 2.709 5.064 1.00 0.00 C ATOM 1133 CG GLU A 72 -8.563 3.524 6.329 1.00 0.00 C ATOM 1134 CD GLU A 72 -7.564 2.818 7.241 1.00 0.00 C ATOM 1135 OE1 GLU A 72 -7.735 1.601 7.469 1.00 0.00 O ATOM 1136 OE2 GLU A 72 -6.634 3.520 7.699 1.00 0.00 O ATOM 0 H GLU A 72 -7.356 4.365 4.137 1.00 0.00 H new ATOM 0 HA GLU A 72 -7.054 1.614 4.969 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -9.518 3.296 4.400 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -9.445 1.815 5.335 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -8.163 4.496 6.040 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -9.485 3.710 6.880 1.00 0.00 H new ATOM 1143 N PHE A 73 -8.194 2.329 1.969 1.00 0.00 N ATOM 1144 CA PHE A 73 -8.258 1.792 0.616 1.00 0.00 C ATOM 1145 C PHE A 73 -6.940 1.078 0.293 1.00 0.00 C ATOM 1146 O PHE A 73 -6.948 -0.082 -0.113 1.00 0.00 O ATOM 1147 CB PHE A 73 -8.583 2.924 -0.367 1.00 0.00 C ATOM 1148 CG PHE A 73 -8.134 2.707 -1.803 1.00 0.00 C ATOM 1149 CD1 PHE A 73 -9.006 2.128 -2.742 1.00 0.00 C ATOM 1150 CD2 PHE A 73 -6.879 3.189 -2.224 1.00 0.00 C ATOM 1151 CE1 PHE A 73 -8.650 2.098 -4.103 1.00 0.00 C ATOM 1152 CE2 PHE A 73 -6.498 3.089 -3.574 1.00 0.00 C ATOM 1153 CZ PHE A 73 -7.401 2.582 -4.521 1.00 0.00 C ATOM 0 H PHE A 73 -8.421 3.321 2.036 1.00 0.00 H new ATOM 0 HA PHE A 73 -9.055 1.054 0.527 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -9.661 3.083 -0.364 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -8.125 3.842 0.002 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -9.947 1.707 -2.419 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -6.207 3.637 -1.507 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -9.342 1.700 -4.830 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -5.511 3.402 -3.882 1.00 0.00 H new ATOM 0 HZ PHE A 73 -7.136 2.564 -5.568 1.00 0.00 H new ATOM 1163 N MET A 74 -5.802 1.738 0.526 1.00 0.00 N ATOM 1164 CA MET A 74 -4.496 1.148 0.287 1.00 0.00 C ATOM 1165 C MET A 74 -4.260 -0.089 1.150 1.00 0.00 C ATOM 1166 O MET A 74 -3.667 -1.051 0.676 1.00 0.00 O ATOM 1167 CB MET A 74 -3.370 2.178 0.418 1.00 0.00 C ATOM 1168 CG MET A 74 -3.388 3.172 -0.754 1.00 0.00 C ATOM 1169 SD MET A 74 -1.787 3.861 -1.232 1.00 0.00 S ATOM 1170 CE MET A 74 -0.956 2.390 -1.877 1.00 0.00 C ATOM 0 H MET A 74 -5.767 2.692 0.884 1.00 0.00 H new ATOM 0 HA MET A 74 -4.484 0.807 -0.748 1.00 0.00 H new ATOM 0 HB2 MET A 74 -3.476 2.719 1.359 1.00 0.00 H new ATOM 0 HB3 MET A 74 -2.408 1.667 0.450 1.00 0.00 H new ATOM 0 HG2 MET A 74 -3.820 2.673 -1.621 1.00 0.00 H new ATOM 0 HG3 MET A 74 -4.053 3.996 -0.496 1.00 0.00 H new ATOM 0 HE1 MET A 74 -0.097 2.691 -2.477 1.00 0.00 H new ATOM 0 HE2 MET A 74 -0.619 1.769 -1.047 1.00 0.00 H new ATOM 0 HE3 MET A 74 -1.650 1.822 -2.496 1.00 0.00 H new ATOM 1180 N ALA A 75 -4.734 -0.099 2.395 1.00 0.00 N ATOM 1181 CA ALA A 75 -4.681 -1.297 3.230 1.00 0.00 C ATOM 1182 C ALA A 75 -5.466 -2.454 2.591 1.00 0.00 C ATOM 1183 O ALA A 75 -4.981 -3.586 2.527 1.00 0.00 O ATOM 1184 CB ALA A 75 -5.179 -0.991 4.645 1.00 0.00 C ATOM 0 H ALA A 75 -5.159 0.710 2.848 1.00 0.00 H new ATOM 0 HA ALA A 75 -3.641 -1.615 3.305 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -5.132 -1.896 5.251 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -4.551 -0.221 5.093 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -6.209 -0.638 4.600 1.00 0.00 H new ATOM 1190 N PHE A 76 -6.676 -2.177 2.094 1.00 0.00 N ATOM 1191 CA PHE A 76 -7.491 -3.190 1.429 1.00 0.00 C ATOM 1192 C PHE A 76 -6.748 -3.701 0.192 1.00 0.00 C ATOM 1193 O PHE A 76 -6.522 -4.899 0.024 1.00 0.00 O ATOM 1194 CB PHE A 76 -8.875 -2.628 1.084 1.00 0.00 C ATOM 1195 CG PHE A 76 -9.788 -3.608 0.376 1.00 0.00 C ATOM 1196 CD1 PHE A 76 -9.750 -3.678 -1.028 1.00 0.00 C ATOM 1197 CD2 PHE A 76 -10.687 -4.426 1.096 1.00 0.00 C ATOM 1198 CE1 PHE A 76 -10.598 -4.559 -1.714 1.00 0.00 C ATOM 1199 CE2 PHE A 76 -11.546 -5.297 0.401 1.00 0.00 C ATOM 1200 CZ PHE A 76 -11.508 -5.357 -1.004 1.00 0.00 C ATOM 0 H PHE A 76 -7.111 -1.255 2.142 1.00 0.00 H new ATOM 0 HA PHE A 76 -7.654 -4.033 2.100 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -9.359 -2.297 2.003 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -8.750 -1.747 0.455 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -9.065 -3.051 -1.580 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -10.715 -4.383 2.175 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -10.551 -4.624 -2.791 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -12.237 -5.922 0.948 1.00 0.00 H new ATOM 0 HZ PHE A 76 -12.178 -6.016 -1.535 1.00 0.00 H new ATOM 1210 N VAL A 77 -6.318 -2.773 -0.662 1.00 0.00 N ATOM 1211 CA VAL A 77 -5.499 -3.085 -1.822 1.00 0.00 C ATOM 1212 C VAL A 77 -4.285 -3.920 -1.403 1.00 0.00 C ATOM 1213 O VAL A 77 -3.953 -4.880 -2.089 1.00 0.00 O ATOM 1214 CB VAL A 77 -5.110 -1.787 -2.545 1.00 0.00 C ATOM 1215 CG1 VAL A 77 -4.049 -2.026 -3.629 1.00 0.00 C ATOM 1216 CG2 VAL A 77 -6.339 -1.148 -3.211 1.00 0.00 C ATOM 0 H VAL A 77 -6.532 -1.780 -0.564 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.067 -3.690 -2.529 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.699 -1.122 -1.785 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.805 -1.081 -4.114 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -3.151 -2.443 -3.173 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -4.437 -2.724 -4.371 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -6.042 -0.230 -3.718 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.762 -1.843 -3.937 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -7.086 -0.918 -2.451 1.00 0.00 H new ATOM 1226 N ALA A 78 -3.622 -3.593 -0.291 1.00 0.00 N ATOM 1227 CA ALA A 78 -2.458 -4.333 0.172 1.00 0.00 C ATOM 1228 C ALA A 78 -2.803 -5.800 0.426 1.00 0.00 C ATOM 1229 O ALA A 78 -2.129 -6.672 -0.124 1.00 0.00 O ATOM 1230 CB ALA A 78 -1.825 -3.670 1.399 1.00 0.00 C ATOM 0 H ALA A 78 -3.880 -2.809 0.308 1.00 0.00 H new ATOM 0 HA ALA A 78 -1.710 -4.311 -0.621 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -0.958 -4.249 1.719 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -1.512 -2.658 1.144 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -2.554 -3.631 2.208 1.00 0.00 H new ATOM 1236 N MET A 79 -3.845 -6.093 1.218 1.00 0.00 N ATOM 1237 CA MET A 79 -4.218 -7.490 1.457 1.00 0.00 C ATOM 1238 C MET A 79 -4.525 -8.205 0.134 1.00 0.00 C ATOM 1239 O MET A 79 -4.027 -9.304 -0.114 1.00 0.00 O ATOM 1240 CB MET A 79 -5.343 -7.653 2.501 1.00 0.00 C ATOM 1241 CG MET A 79 -6.663 -6.946 2.177 1.00 0.00 C ATOM 1242 SD MET A 79 -8.112 -7.383 3.176 1.00 0.00 S ATOM 1243 CE MET A 79 -7.721 -6.554 4.730 1.00 0.00 C ATOM 0 H MET A 79 -4.428 -5.402 1.691 1.00 0.00 H new ATOM 0 HA MET A 79 -3.353 -7.980 1.904 1.00 0.00 H new ATOM 0 HB2 MET A 79 -5.544 -8.717 2.627 1.00 0.00 H new ATOM 0 HB3 MET A 79 -4.980 -7.282 3.459 1.00 0.00 H new ATOM 0 HG2 MET A 79 -6.501 -5.872 2.270 1.00 0.00 H new ATOM 0 HG3 MET A 79 -6.903 -7.143 1.132 1.00 0.00 H new ATOM 0 HE1 MET A 79 -8.522 -6.731 5.448 1.00 0.00 H new ATOM 0 HE2 MET A 79 -6.785 -6.947 5.126 1.00 0.00 H new ATOM 0 HE3 MET A 79 -7.620 -5.483 4.556 1.00 0.00 H new ATOM 1253 N ILE A 80 -5.311 -7.561 -0.734 1.00 0.00 N ATOM 1254 CA ILE A 80 -5.711 -8.126 -2.019 1.00 0.00 C ATOM 1255 C ILE A 80 -4.466 -8.464 -2.845 1.00 0.00 C ATOM 1256 O ILE A 80 -4.279 -9.599 -3.287 1.00 0.00 O ATOM 1257 CB ILE A 80 -6.618 -7.120 -2.755 1.00 0.00 C ATOM 1258 CG1 ILE A 80 -7.925 -6.841 -1.990 1.00 0.00 C ATOM 1259 CG2 ILE A 80 -6.906 -7.564 -4.194 1.00 0.00 C ATOM 1260 CD1 ILE A 80 -9.033 -7.868 -2.205 1.00 0.00 C ATOM 0 H ILE A 80 -5.688 -6.629 -0.561 1.00 0.00 H new ATOM 0 HA ILE A 80 -6.272 -9.048 -1.866 1.00 0.00 H new ATOM 0 HB ILE A 80 -6.065 -6.182 -2.799 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -7.700 -6.790 -0.925 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -8.298 -5.860 -2.285 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -7.548 -6.829 -4.680 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -5.968 -7.646 -4.744 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -7.406 -8.532 -4.183 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -9.911 -7.583 -1.625 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -9.294 -7.906 -3.263 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -8.687 -8.850 -1.881 1.00 0.00 H new ATOM 1272 N THR A 81 -3.613 -7.462 -3.056 1.00 0.00 N ATOM 1273 CA THR A 81 -2.404 -7.580 -3.851 1.00 0.00 C ATOM 1274 C THR A 81 -1.513 -8.670 -3.257 1.00 0.00 C ATOM 1275 O THR A 81 -0.981 -9.487 -3.997 1.00 0.00 O ATOM 1276 CB THR A 81 -1.664 -6.232 -3.890 1.00 0.00 C ATOM 1277 OG1 THR A 81 -2.518 -5.216 -4.363 1.00 0.00 O ATOM 1278 CG2 THR A 81 -0.442 -6.260 -4.812 1.00 0.00 C ATOM 0 H THR A 81 -3.751 -6.529 -2.668 1.00 0.00 H new ATOM 0 HA THR A 81 -2.664 -7.854 -4.873 1.00 0.00 H new ATOM 0 HB THR A 81 -1.340 -6.038 -2.868 1.00 0.00 H new ATOM 0 HG1 THR A 81 -3.117 -4.930 -3.642 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.043 -5.284 -4.803 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.260 -7.018 -4.463 1.00 0.00 H new ATOM 0 HG23 THR A 81 -0.758 -6.498 -5.828 1.00 0.00 H new ATOM 1286 N THR A 82 -1.344 -8.695 -1.931 1.00 0.00 N ATOM 1287 CA THR A 82 -0.537 -9.713 -1.272 1.00 0.00 C ATOM 1288 C THR A 82 -1.093 -11.108 -1.566 1.00 0.00 C ATOM 1289 O THR A 82 -0.346 -11.988 -1.990 1.00 0.00 O ATOM 1290 CB THR A 82 -0.440 -9.424 0.234 1.00 0.00 C ATOM 1291 OG1 THR A 82 0.111 -8.134 0.424 1.00 0.00 O ATOM 1292 CG2 THR A 82 0.473 -10.428 0.941 1.00 0.00 C ATOM 0 H THR A 82 -1.760 -8.015 -1.295 1.00 0.00 H new ATOM 0 HA THR A 82 0.477 -9.684 -1.670 1.00 0.00 H new ATOM 0 HB THR A 82 -1.444 -9.497 0.652 1.00 0.00 H new ATOM 0 HG1 THR A 82 -0.549 -7.456 0.169 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.518 -10.193 2.004 1.00 0.00 H new ATOM 0 HG22 THR A 82 0.078 -11.435 0.808 1.00 0.00 H new ATOM 0 HG23 THR A 82 1.475 -10.372 0.514 1.00 0.00 H new ATOM 1300 N ALA A 83 -2.398 -11.320 -1.373 1.00 0.00 N ATOM 1301 CA ALA A 83 -3.002 -12.613 -1.675 1.00 0.00 C ATOM 1302 C ALA A 83 -2.747 -12.987 -3.138 1.00 0.00 C ATOM 1303 O ALA A 83 -2.302 -14.094 -3.442 1.00 0.00 O ATOM 1304 CB ALA A 83 -4.500 -12.568 -1.366 1.00 0.00 C ATOM 0 H ALA A 83 -3.047 -10.620 -1.013 1.00 0.00 H new ATOM 0 HA ALA A 83 -2.546 -13.381 -1.050 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.948 -13.536 -1.593 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.647 -12.339 -0.311 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -4.974 -11.798 -1.974 1.00 0.00 H new ATOM 1310 N CYS A 84 -2.965 -12.033 -4.048 1.00 0.00 N ATOM 1311 CA CYS A 84 -2.685 -12.245 -5.461 1.00 0.00 C ATOM 1312 C CYS A 84 -1.211 -12.571 -5.706 1.00 0.00 C ATOM 1313 O CYS A 84 -0.909 -13.463 -6.492 1.00 0.00 O ATOM 1314 CB CYS A 84 -3.182 -11.072 -6.300 1.00 0.00 C ATOM 1315 SG CYS A 84 -2.835 -11.465 -8.032 1.00 0.00 S ATOM 0 H CYS A 84 -3.334 -11.109 -3.826 1.00 0.00 H new ATOM 0 HA CYS A 84 -3.243 -13.123 -5.787 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -4.250 -10.916 -6.148 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -2.680 -10.150 -6.007 1.00 0.00 H new ATOM 0 HG CYS A 84 -3.502 -10.657 -8.802 1.00 0.00 H new ATOM 1321 N HIS A 85 -0.288 -11.908 -5.007 1.00 0.00 N ATOM 1322 CA HIS A 85 1.135 -12.177 -5.098 1.00 0.00 C ATOM 1323 C HIS A 85 1.405 -13.633 -4.723 1.00 0.00 C ATOM 1324 O HIS A 85 2.039 -14.370 -5.479 1.00 0.00 O ATOM 1325 CB HIS A 85 1.916 -11.206 -4.195 1.00 0.00 C ATOM 1326 CG HIS A 85 3.366 -11.119 -4.578 1.00 0.00 C ATOM 1327 ND1 HIS A 85 3.961 -10.051 -5.202 1.00 0.00 N ATOM 1328 CD2 HIS A 85 4.255 -12.157 -4.599 1.00 0.00 C ATOM 1329 CE1 HIS A 85 5.175 -10.450 -5.611 1.00 0.00 C ATOM 1330 NE2 HIS A 85 5.404 -11.724 -5.262 1.00 0.00 N ATOM 0 H HIS A 85 -0.519 -11.159 -4.354 1.00 0.00 H new ATOM 0 HA HIS A 85 1.474 -12.020 -6.122 1.00 0.00 H new ATOM 0 HB2 HIS A 85 1.466 -10.215 -4.255 1.00 0.00 H new ATOM 0 HB3 HIS A 85 1.835 -11.531 -3.158 1.00 0.00 H new ATOM 0 HD1 HIS A 85 3.555 -9.124 -5.331 1.00 0.00 H new ATOM 0 HD2 HIS A 85 4.096 -13.138 -4.177 1.00 0.00 H new ATOM 0 HE1 HIS A 85 5.874 -9.828 -6.150 1.00 0.00 H new ATOM 1338 N GLU A 86 0.915 -14.038 -3.549 1.00 0.00 N ATOM 1339 CA GLU A 86 1.104 -15.385 -3.042 1.00 0.00 C ATOM 1340 C GLU A 86 0.599 -16.413 -4.055 1.00 0.00 C ATOM 1341 O GLU A 86 1.322 -17.367 -4.340 1.00 0.00 O ATOM 1342 CB GLU A 86 0.431 -15.540 -1.669 1.00 0.00 C ATOM 1343 CG GLU A 86 1.111 -14.684 -0.584 1.00 0.00 C ATOM 1344 CD GLU A 86 2.390 -15.298 -0.013 1.00 0.00 C ATOM 1345 OE1 GLU A 86 3.021 -16.108 -0.726 1.00 0.00 O ATOM 1346 OE2 GLU A 86 2.714 -14.951 1.143 1.00 0.00 O ATOM 0 H GLU A 86 0.376 -13.435 -2.928 1.00 0.00 H new ATOM 0 HA GLU A 86 2.169 -15.569 -2.902 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -0.619 -15.256 -1.747 1.00 0.00 H new ATOM 0 HB3 GLU A 86 0.457 -16.588 -1.371 1.00 0.00 H new ATOM 0 HG2 GLU A 86 1.346 -13.706 -1.003 1.00 0.00 H new ATOM 0 HG3 GLU A 86 0.405 -14.521 0.230 1.00 0.00 H new ATOM 1353 N PHE A 87 -0.597 -16.200 -4.619 1.00 0.00 N ATOM 1354 CA PHE A 87 -1.125 -17.022 -5.711 1.00 0.00 C ATOM 1355 C PHE A 87 -0.139 -17.059 -6.876 1.00 0.00 C ATOM 1356 O PHE A 87 0.278 -18.121 -7.330 1.00 0.00 O ATOM 1357 CB PHE A 87 -2.490 -16.469 -6.178 1.00 0.00 C ATOM 1358 CG PHE A 87 -2.806 -16.542 -7.668 1.00 0.00 C ATOM 1359 CD1 PHE A 87 -2.739 -17.768 -8.355 1.00 0.00 C ATOM 1360 CD2 PHE A 87 -3.088 -15.363 -8.387 1.00 0.00 C ATOM 1361 CE1 PHE A 87 -2.967 -17.820 -9.740 1.00 0.00 C ATOM 1362 CE2 PHE A 87 -3.317 -15.414 -9.772 1.00 0.00 C ATOM 1363 CZ PHE A 87 -3.257 -16.643 -10.450 1.00 0.00 C ATOM 0 H PHE A 87 -1.225 -15.451 -4.329 1.00 0.00 H new ATOM 0 HA PHE A 87 -1.265 -18.040 -5.347 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -3.272 -17.006 -5.641 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -2.553 -15.425 -5.871 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -2.511 -18.675 -7.814 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -3.128 -14.415 -7.870 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -2.919 -18.766 -10.260 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -3.539 -14.508 -10.316 1.00 0.00 H new ATOM 0 HZ PHE A 87 -3.433 -16.683 -11.515 1.00 0.00 H new ATOM 1373 N PHE A 88 0.193 -15.871 -7.371 1.00 0.00 N ATOM 1374 CA PHE A 88 0.931 -15.663 -8.599 1.00 0.00 C ATOM 1375 C PHE A 88 2.297 -16.339 -8.543 1.00 0.00 C ATOM 1376 O PHE A 88 2.735 -16.922 -9.533 1.00 0.00 O ATOM 1377 CB PHE A 88 1.024 -14.150 -8.796 1.00 0.00 C ATOM 1378 CG PHE A 88 1.808 -13.686 -10.001 1.00 0.00 C ATOM 1379 CD1 PHE A 88 1.155 -13.512 -11.233 1.00 0.00 C ATOM 1380 CD2 PHE A 88 3.165 -13.334 -9.867 1.00 0.00 C ATOM 1381 CE1 PHE A 88 1.852 -12.967 -12.326 1.00 0.00 C ATOM 1382 CE2 PHE A 88 3.860 -12.786 -10.959 1.00 0.00 C ATOM 1383 CZ PHE A 88 3.202 -12.598 -12.187 1.00 0.00 C ATOM 0 H PHE A 88 -0.057 -14.998 -6.906 1.00 0.00 H new ATOM 0 HA PHE A 88 0.427 -16.118 -9.452 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.013 -13.750 -8.869 1.00 0.00 H new ATOM 0 HB3 PHE A 88 1.475 -13.714 -7.904 1.00 0.00 H new ATOM 0 HD1 PHE A 88 0.119 -13.797 -11.340 1.00 0.00 H new ATOM 0 HD2 PHE A 88 3.672 -13.485 -8.925 1.00 0.00 H new ATOM 0 HE1 PHE A 88 1.350 -12.832 -13.273 1.00 0.00 H new ATOM 0 HE2 PHE A 88 4.899 -12.510 -10.855 1.00 0.00 H new ATOM 0 HZ PHE A 88 3.733 -12.170 -13.024 1.00 0.00 H new ATOM 1442 N SER B 1 -10.201 -2.456 -13.539 1.00 0.00 N ATOM 1443 CA SER B 1 -9.173 -2.655 -14.577 1.00 0.00 C ATOM 1444 C SER B 1 -7.884 -1.894 -14.276 1.00 0.00 C ATOM 1445 O SER B 1 -6.795 -2.464 -14.262 1.00 0.00 O ATOM 1446 CB SER B 1 -9.742 -2.279 -15.947 1.00 0.00 C ATOM 1447 OG SER B 1 -10.991 -2.928 -16.098 1.00 0.00 O ATOM 0 H1 SER B 1 -11.146 -2.526 -13.968 1.00 0.00 H new ATOM 0 H2 SER B 1 -10.099 -3.186 -12.805 1.00 0.00 H new ATOM 0 H3 SER B 1 -10.084 -1.515 -13.111 1.00 0.00 H new ATOM 0 HA SER B 1 -8.903 -3.711 -14.584 1.00 0.00 H new ATOM 0 HB2 SER B 1 -9.863 -1.199 -16.025 1.00 0.00 H new ATOM 0 HB3 SER B 1 -9.058 -2.582 -16.739 1.00 0.00 H new ATOM 0 HG SER B 1 -11.375 -2.699 -16.970 1.00 0.00 H new ATOM 1455 N GLU B 2 -8.014 -0.595 -14.020 1.00 0.00 N ATOM 1456 CA GLU B 2 -6.879 0.287 -13.796 1.00 0.00 C ATOM 1457 C GLU B 2 -6.120 -0.157 -12.545 1.00 0.00 C ATOM 1458 O GLU B 2 -4.910 -0.390 -12.584 1.00 0.00 O ATOM 1459 CB GLU B 2 -7.355 1.744 -13.681 1.00 0.00 C ATOM 1460 CG GLU B 2 -8.301 2.171 -14.815 1.00 0.00 C ATOM 1461 CD GLU B 2 -7.734 1.857 -16.195 1.00 0.00 C ATOM 1462 OE1 GLU B 2 -6.807 2.588 -16.605 1.00 0.00 O ATOM 1463 OE2 GLU B 2 -8.228 0.883 -16.806 1.00 0.00 O ATOM 0 H GLU B 2 -8.917 -0.125 -13.962 1.00 0.00 H new ATOM 0 HA GLU B 2 -6.197 0.228 -14.645 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -7.862 1.878 -12.726 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -6.486 2.402 -13.676 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -9.259 1.665 -14.695 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -8.494 3.241 -14.740 1.00 0.00 H new ATOM 1470 N LEU B 3 -6.842 -0.306 -11.430 1.00 0.00 N ATOM 1471 CA LEU B 3 -6.216 -0.775 -10.205 1.00 0.00 C ATOM 1472 C LEU B 3 -5.651 -2.175 -10.416 1.00 0.00 C ATOM 1473 O LEU B 3 -4.532 -2.441 -10.002 1.00 0.00 O ATOM 1474 CB LEU B 3 -7.177 -0.745 -9.013 1.00 0.00 C ATOM 1475 CG LEU B 3 -7.765 0.646 -8.732 1.00 0.00 C ATOM 1476 CD1 LEU B 3 -8.571 0.584 -7.432 1.00 0.00 C ATOM 1477 CD2 LEU B 3 -6.690 1.728 -8.593 1.00 0.00 C ATOM 0 H LEU B 3 -7.841 -0.111 -11.357 1.00 0.00 H new ATOM 0 HA LEU B 3 -5.401 -0.092 -9.965 1.00 0.00 H new ATOM 0 HB2 LEU B 3 -7.992 -1.445 -9.197 1.00 0.00 H new ATOM 0 HB3 LEU B 3 -6.651 -1.094 -8.124 1.00 0.00 H new ATOM 0 HG LEU B 3 -8.392 0.915 -9.582 1.00 0.00 H new ATOM 0 HD11 LEU B 3 -8.995 1.565 -7.220 1.00 0.00 H new ATOM 0 HD12 LEU B 3 -9.376 -0.144 -7.537 1.00 0.00 H new ATOM 0 HD13 LEU B 3 -7.917 0.286 -6.612 1.00 0.00 H new ATOM 0 HD21 LEU B 3 -7.165 2.689 -8.395 1.00 0.00 H new ATOM 0 HD22 LEU B 3 -6.024 1.475 -7.768 1.00 0.00 H new ATOM 0 HD23 LEU B 3 -6.115 1.790 -9.517 1.00 0.00 H new ATOM 1489 N GLU B 4 -6.390 -3.064 -11.086 1.00 0.00 N ATOM 1490 CA GLU B 4 -5.899 -4.405 -11.381 1.00 0.00 C ATOM 1491 C GLU B 4 -4.565 -4.345 -12.134 1.00 0.00 C ATOM 1492 O GLU B 4 -3.642 -5.086 -11.802 1.00 0.00 O ATOM 1493 CB GLU B 4 -6.951 -5.208 -12.154 1.00 0.00 C ATOM 1494 CG GLU B 4 -8.207 -5.422 -11.296 1.00 0.00 C ATOM 1495 CD GLU B 4 -9.345 -6.105 -12.056 1.00 0.00 C ATOM 1496 OE1 GLU B 4 -9.356 -5.994 -13.300 1.00 0.00 O ATOM 1497 OE2 GLU B 4 -10.189 -6.735 -11.382 1.00 0.00 O ATOM 0 H GLU B 4 -7.330 -2.875 -11.433 1.00 0.00 H new ATOM 0 HA GLU B 4 -5.717 -4.922 -10.439 1.00 0.00 H new ATOM 0 HB2 GLU B 4 -7.216 -4.682 -13.071 1.00 0.00 H new ATOM 0 HB3 GLU B 4 -6.536 -6.172 -12.448 1.00 0.00 H new ATOM 0 HG2 GLU B 4 -7.947 -6.024 -10.426 1.00 0.00 H new ATOM 0 HG3 GLU B 4 -8.554 -4.458 -10.924 1.00 0.00 H new ATOM 1504 N LYS B 5 -4.444 -3.456 -13.124 1.00 0.00 N ATOM 1505 CA LYS B 5 -3.217 -3.300 -13.895 1.00 0.00 C ATOM 1506 C LYS B 5 -2.082 -2.875 -12.961 1.00 0.00 C ATOM 1507 O LYS B 5 -1.023 -3.501 -12.927 1.00 0.00 O ATOM 1508 CB LYS B 5 -3.437 -2.309 -15.048 1.00 0.00 C ATOM 1509 CG LYS B 5 -2.167 -2.014 -15.863 1.00 0.00 C ATOM 1510 CD LYS B 5 -1.509 -3.282 -16.424 1.00 0.00 C ATOM 1511 CE LYS B 5 -0.349 -2.911 -17.353 1.00 0.00 C ATOM 1512 NZ LYS B 5 0.325 -4.113 -17.875 1.00 0.00 N ATOM 0 H LYS B 5 -5.195 -2.827 -13.410 1.00 0.00 H new ATOM 0 HA LYS B 5 -2.934 -4.250 -14.348 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -4.202 -2.706 -15.715 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -3.823 -1.374 -14.642 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -2.417 -1.346 -16.687 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -1.451 -1.488 -15.232 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -1.145 -3.903 -15.606 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -2.246 -3.872 -16.969 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -0.723 -2.312 -18.183 1.00 0.00 H new ATOM 0 HE3 LYS B 5 0.369 -2.294 -16.813 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 1.106 -3.829 -18.501 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 0.702 -4.671 -17.083 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -0.356 -4.688 -18.411 1.00 0.00 H new ATOM 1526 N ALA B 6 -2.317 -1.810 -12.193 1.00 0.00 N ATOM 1527 CA ALA B 6 -1.365 -1.306 -11.214 1.00 0.00 C ATOM 1528 C ALA B 6 -0.899 -2.421 -10.263 1.00 0.00 C ATOM 1529 O ALA B 6 0.293 -2.614 -10.032 1.00 0.00 O ATOM 1530 CB ALA B 6 -2.040 -0.160 -10.458 1.00 0.00 C ATOM 0 H ALA B 6 -3.182 -1.272 -12.237 1.00 0.00 H new ATOM 0 HA ALA B 6 -0.467 -0.941 -11.713 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -1.351 0.241 -9.715 1.00 0.00 H new ATOM 0 HB2 ALA B 6 -2.315 0.627 -11.160 1.00 0.00 H new ATOM 0 HB3 ALA B 6 -2.936 -0.531 -9.960 1.00 0.00 H new ATOM 1536 N VAL B 7 -1.863 -3.165 -9.726 1.00 0.00 N ATOM 1537 CA VAL B 7 -1.673 -4.284 -8.820 1.00 0.00 C ATOM 1538 C VAL B 7 -0.791 -5.362 -9.465 1.00 0.00 C ATOM 1539 O VAL B 7 0.244 -5.721 -8.900 1.00 0.00 O ATOM 1540 CB VAL B 7 -3.072 -4.773 -8.396 1.00 0.00 C ATOM 1541 CG1 VAL B 7 -3.121 -6.185 -7.817 1.00 0.00 C ATOM 1542 CG2 VAL B 7 -3.668 -3.804 -7.363 1.00 0.00 C ATOM 0 H VAL B 7 -2.848 -2.990 -9.925 1.00 0.00 H new ATOM 0 HA VAL B 7 -1.131 -3.993 -7.921 1.00 0.00 H new ATOM 0 HB VAL B 7 -3.652 -4.800 -9.319 1.00 0.00 H new ATOM 0 HG11 VAL B 7 -4.148 -6.433 -7.550 1.00 0.00 H new ATOM 0 HG12 VAL B 7 -2.757 -6.895 -8.559 1.00 0.00 H new ATOM 0 HG13 VAL B 7 -2.493 -6.236 -6.928 1.00 0.00 H new ATOM 0 HG21 VAL B 7 -4.657 -4.153 -7.065 1.00 0.00 H new ATOM 0 HG22 VAL B 7 -3.020 -3.761 -6.488 1.00 0.00 H new ATOM 0 HG23 VAL B 7 -3.751 -2.810 -7.802 1.00 0.00 H new ATOM 1552 N VAL B 8 -1.156 -5.876 -10.646 1.00 0.00 N ATOM 1553 CA VAL B 8 -0.330 -6.903 -11.274 1.00 0.00 C ATOM 1554 C VAL B 8 1.052 -6.352 -11.633 1.00 0.00 C ATOM 1555 O VAL B 8 2.035 -7.078 -11.519 1.00 0.00 O ATOM 1556 CB VAL B 8 -1.016 -7.627 -12.446 1.00 0.00 C ATOM 1557 CG1 VAL B 8 -2.319 -8.297 -11.990 1.00 0.00 C ATOM 1558 CG2 VAL B 8 -1.263 -6.731 -13.661 1.00 0.00 C ATOM 0 H VAL B 8 -1.990 -5.607 -11.168 1.00 0.00 H new ATOM 0 HA VAL B 8 -0.187 -7.685 -10.528 1.00 0.00 H new ATOM 0 HB VAL B 8 -0.316 -8.395 -12.774 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -2.784 -8.802 -12.837 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -2.100 -9.025 -11.209 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -3.000 -7.541 -11.600 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -1.749 -7.309 -14.447 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -1.904 -5.898 -13.374 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -0.312 -6.347 -14.029 1.00 0.00 H new ATOM 1568 N ALA B 9 1.156 -5.076 -12.024 1.00 0.00 N ATOM 1569 CA ALA B 9 2.449 -4.445 -12.263 1.00 0.00 C ATOM 1570 C ALA B 9 3.314 -4.490 -10.997 1.00 0.00 C ATOM 1571 O ALA B 9 4.451 -4.958 -11.048 1.00 0.00 O ATOM 1572 CB ALA B 9 2.266 -3.016 -12.784 1.00 0.00 C ATOM 0 H ALA B 9 0.355 -4.464 -12.180 1.00 0.00 H new ATOM 0 HA ALA B 9 2.975 -5.005 -13.036 1.00 0.00 H new ATOM 0 HB1 ALA B 9 3.243 -2.563 -12.956 1.00 0.00 H new ATOM 0 HB2 ALA B 9 1.707 -3.039 -13.719 1.00 0.00 H new ATOM 0 HB3 ALA B 9 1.718 -2.428 -12.048 1.00 0.00 H new ATOM 1578 N LEU B 10 2.769 -4.051 -9.855 1.00 0.00 N ATOM 1579 CA LEU B 10 3.464 -4.118 -8.570 1.00 0.00 C ATOM 1580 C LEU B 10 3.920 -5.551 -8.286 1.00 0.00 C ATOM 1581 O LEU B 10 5.093 -5.781 -7.987 1.00 0.00 O ATOM 1582 CB LEU B 10 2.549 -3.615 -7.439 1.00 0.00 C ATOM 1583 CG LEU B 10 2.448 -2.083 -7.380 1.00 0.00 C ATOM 1584 CD1 LEU B 10 1.126 -1.673 -6.728 1.00 0.00 C ATOM 1585 CD2 LEU B 10 3.580 -1.491 -6.531 1.00 0.00 C ATOM 0 H LEU B 10 1.837 -3.641 -9.799 1.00 0.00 H new ATOM 0 HA LEU B 10 4.343 -3.476 -8.617 1.00 0.00 H new ATOM 0 HB2 LEU B 10 1.552 -4.034 -7.574 1.00 0.00 H new ATOM 0 HB3 LEU B 10 2.924 -3.985 -6.485 1.00 0.00 H new ATOM 0 HG LEU B 10 2.513 -1.710 -8.402 1.00 0.00 H new ATOM 0 HD11 LEU B 10 1.061 -0.586 -6.689 1.00 0.00 H new ATOM 0 HD12 LEU B 10 0.294 -2.066 -7.313 1.00 0.00 H new ATOM 0 HD13 LEU B 10 1.079 -2.075 -5.716 1.00 0.00 H new ATOM 0 HD21 LEU B 10 3.486 -0.405 -6.505 1.00 0.00 H new ATOM 0 HD22 LEU B 10 3.518 -1.885 -5.517 1.00 0.00 H new ATOM 0 HD23 LEU B 10 4.542 -1.761 -6.967 1.00 0.00 H new ATOM 1597 N ILE B 11 2.998 -6.515 -8.393 1.00 0.00 N ATOM 1598 CA ILE B 11 3.312 -7.919 -8.155 1.00 0.00 C ATOM 1599 C ILE B 11 4.457 -8.372 -9.062 1.00 0.00 C ATOM 1600 O ILE B 11 5.438 -8.928 -8.579 1.00 0.00 O ATOM 1601 CB ILE B 11 2.052 -8.787 -8.342 1.00 0.00 C ATOM 1602 CG1 ILE B 11 1.095 -8.522 -7.169 1.00 0.00 C ATOM 1603 CG2 ILE B 11 2.376 -10.286 -8.460 1.00 0.00 C ATOM 1604 CD1 ILE B 11 -0.256 -9.220 -7.328 1.00 0.00 C ATOM 0 H ILE B 11 2.025 -6.342 -8.645 1.00 0.00 H new ATOM 0 HA ILE B 11 3.646 -8.041 -7.124 1.00 0.00 H new ATOM 0 HB ILE B 11 1.579 -8.508 -9.284 1.00 0.00 H new ATOM 0 HG12 ILE B 11 1.563 -8.856 -6.243 1.00 0.00 H new ATOM 0 HG13 ILE B 11 0.934 -7.448 -7.075 1.00 0.00 H new ATOM 0 HG21 ILE B 11 1.452 -10.849 -8.590 1.00 0.00 H new ATOM 0 HG22 ILE B 11 3.026 -10.451 -9.320 1.00 0.00 H new ATOM 0 HG23 ILE B 11 2.881 -10.622 -7.554 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -0.886 -8.994 -6.468 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -0.743 -8.867 -8.237 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -0.104 -10.297 -7.392 1.00 0.00 H new ATOM 1616 N ASP B 12 4.337 -8.145 -10.368 1.00 0.00 N ATOM 1617 CA ASP B 12 5.267 -8.679 -11.347 1.00 0.00 C ATOM 1618 C ASP B 12 6.652 -8.064 -11.160 1.00 0.00 C ATOM 1619 O ASP B 12 7.649 -8.780 -11.091 1.00 0.00 O ATOM 1620 CB ASP B 12 4.727 -8.447 -12.761 1.00 0.00 C ATOM 1621 CG ASP B 12 5.610 -9.134 -13.793 1.00 0.00 C ATOM 1622 OD1 ASP B 12 6.636 -8.521 -14.160 1.00 0.00 O ATOM 1623 OD2 ASP B 12 5.255 -10.267 -14.185 1.00 0.00 O ATOM 0 H ASP B 12 3.588 -7.583 -10.773 1.00 0.00 H new ATOM 0 HA ASP B 12 5.367 -9.754 -11.199 1.00 0.00 H new ATOM 0 HB2 ASP B 12 3.709 -8.829 -12.834 1.00 0.00 H new ATOM 0 HB3 ASP B 12 4.682 -7.378 -12.968 1.00 0.00 H new ATOM 1628 N VAL B 13 6.715 -6.733 -11.066 1.00 0.00 N ATOM 1629 CA VAL B 13 7.975 -6.034 -10.862 1.00 0.00 C ATOM 1630 C VAL B 13 8.624 -6.524 -9.569 1.00 0.00 C ATOM 1631 O VAL B 13 9.794 -6.904 -9.576 1.00 0.00 O ATOM 1632 CB VAL B 13 7.747 -4.514 -10.876 1.00 0.00 C ATOM 1633 CG1 VAL B 13 9.001 -3.737 -10.448 1.00 0.00 C ATOM 1634 CG2 VAL B 13 7.361 -4.063 -12.290 1.00 0.00 C ATOM 0 H VAL B 13 5.902 -6.121 -11.129 1.00 0.00 H new ATOM 0 HA VAL B 13 8.664 -6.254 -11.677 1.00 0.00 H new ATOM 0 HB VAL B 13 6.948 -4.302 -10.165 1.00 0.00 H new ATOM 0 HG11 VAL B 13 8.793 -2.667 -10.473 1.00 0.00 H new ATOM 0 HG12 VAL B 13 9.282 -4.028 -9.436 1.00 0.00 H new ATOM 0 HG13 VAL B 13 9.820 -3.963 -11.131 1.00 0.00 H new ATOM 0 HG21 VAL B 13 7.200 -2.985 -12.297 1.00 0.00 H new ATOM 0 HG22 VAL B 13 8.163 -4.314 -12.984 1.00 0.00 H new ATOM 0 HG23 VAL B 13 6.445 -4.569 -12.596 1.00 0.00 H new ATOM 1644 N PHE B 14 7.872 -6.551 -8.462 1.00 0.00 N ATOM 1645 CA PHE B 14 8.416 -7.087 -7.222 1.00 0.00 C ATOM 1646 C PHE B 14 8.954 -8.498 -7.456 1.00 0.00 C ATOM 1647 O PHE B 14 10.105 -8.766 -7.131 1.00 0.00 O ATOM 1648 CB PHE B 14 7.359 -7.078 -6.116 1.00 0.00 C ATOM 1649 CG PHE B 14 7.862 -7.581 -4.771 1.00 0.00 C ATOM 1650 CD1 PHE B 14 8.040 -8.960 -4.529 1.00 0.00 C ATOM 1651 CD2 PHE B 14 8.069 -6.669 -3.722 1.00 0.00 C ATOM 1652 CE1 PHE B 14 8.335 -9.423 -3.236 1.00 0.00 C ATOM 1653 CE2 PHE B 14 8.371 -7.134 -2.431 1.00 0.00 C ATOM 1654 CZ PHE B 14 8.472 -8.510 -2.179 1.00 0.00 C ATOM 0 H PHE B 14 6.910 -6.216 -8.404 1.00 0.00 H new ATOM 0 HA PHE B 14 9.240 -6.452 -6.896 1.00 0.00 H new ATOM 0 HB2 PHE B 14 6.984 -6.062 -5.995 1.00 0.00 H new ATOM 0 HB3 PHE B 14 6.516 -7.693 -6.429 1.00 0.00 H new ATOM 0 HD1 PHE B 14 7.949 -9.664 -5.343 1.00 0.00 H new ATOM 0 HD2 PHE B 14 7.996 -5.608 -3.909 1.00 0.00 H new ATOM 0 HE1 PHE B 14 8.456 -10.481 -3.055 1.00 0.00 H new ATOM 0 HE2 PHE B 14 8.526 -6.428 -1.628 1.00 0.00 H new ATOM 0 HZ PHE B 14 8.654 -8.866 -1.176 1.00 0.00 H new ATOM 1664 N HIS B 15 8.128 -9.381 -8.028 1.00 0.00 N ATOM 1665 CA HIS B 15 8.452 -10.785 -8.237 1.00 0.00 C ATOM 1666 C HIS B 15 9.772 -10.936 -8.992 1.00 0.00 C ATOM 1667 O HIS B 15 10.617 -11.739 -8.598 1.00 0.00 O ATOM 1668 CB HIS B 15 7.306 -11.497 -8.964 1.00 0.00 C ATOM 1669 CG HIS B 15 7.638 -12.929 -9.299 1.00 0.00 C ATOM 1670 ND1 HIS B 15 8.044 -13.894 -8.405 1.00 0.00 N ATOM 1671 CD2 HIS B 15 7.748 -13.457 -10.558 1.00 0.00 C ATOM 1672 CE1 HIS B 15 8.369 -14.989 -9.114 1.00 0.00 C ATOM 1673 NE2 HIS B 15 8.206 -14.770 -10.430 1.00 0.00 N ATOM 0 H HIS B 15 7.198 -9.128 -8.363 1.00 0.00 H new ATOM 0 HA HIS B 15 8.578 -11.258 -7.263 1.00 0.00 H new ATOM 0 HB2 HIS B 15 6.412 -11.471 -8.341 1.00 0.00 H new ATOM 0 HB3 HIS B 15 7.071 -10.957 -9.881 1.00 0.00 H new ATOM 0 HD2 HIS B 15 7.521 -12.949 -11.484 1.00 0.00 H new ATOM 0 HE1 HIS B 15 8.714 -15.918 -8.685 1.00 0.00 H new ATOM 0 HE2 HIS B 15 8.382 -15.432 -11.186 1.00 0.00 H new ATOM 1681 N GLN B 16 9.954 -10.173 -10.075 1.00 0.00 N ATOM 1682 CA GLN B 16 11.215 -10.191 -10.802 1.00 0.00 C ATOM 1683 C GLN B 16 12.380 -9.944 -9.837 1.00 0.00 C ATOM 1684 O GLN B 16 13.331 -10.719 -9.812 1.00 0.00 O ATOM 1685 CB GLN B 16 11.221 -9.132 -11.913 1.00 0.00 C ATOM 1686 CG GLN B 16 10.335 -9.496 -13.111 1.00 0.00 C ATOM 1687 CD GLN B 16 10.411 -8.406 -14.179 1.00 0.00 C ATOM 1688 OE1 GLN B 16 11.494 -8.032 -14.612 1.00 0.00 O ATOM 1689 NE2 GLN B 16 9.276 -7.871 -14.617 1.00 0.00 N ATOM 0 H GLN B 16 9.249 -9.544 -10.459 1.00 0.00 H new ATOM 0 HA GLN B 16 11.331 -11.172 -11.262 1.00 0.00 H new ATOM 0 HB2 GLN B 16 10.886 -8.181 -11.499 1.00 0.00 H new ATOM 0 HB3 GLN B 16 12.244 -8.986 -12.259 1.00 0.00 H new ATOM 0 HG2 GLN B 16 10.655 -10.449 -13.532 1.00 0.00 H new ATOM 0 HG3 GLN B 16 9.303 -9.622 -12.783 1.00 0.00 H new ATOM 0 HE21 GLN B 16 8.383 -8.195 -14.245 1.00 0.00 H new ATOM 0 HE22 GLN B 16 9.298 -7.137 -15.325 1.00 0.00 H new ATOM 1698 N TYR B 17 12.294 -8.886 -9.026 1.00 0.00 N ATOM 1699 CA TYR B 17 13.383 -8.467 -8.151 1.00 0.00 C ATOM 1700 C TYR B 17 13.593 -9.485 -7.016 1.00 0.00 C ATOM 1701 O TYR B 17 14.689 -10.027 -6.855 1.00 0.00 O ATOM 1702 CB TYR B 17 13.126 -7.032 -7.654 1.00 0.00 C ATOM 1703 CG TYR B 17 13.452 -5.930 -8.657 1.00 0.00 C ATOM 1704 CD1 TYR B 17 12.792 -5.857 -9.900 1.00 0.00 C ATOM 1705 CD2 TYR B 17 14.395 -4.938 -8.327 1.00 0.00 C ATOM 1706 CE1 TYR B 17 13.008 -4.771 -10.764 1.00 0.00 C ATOM 1707 CE2 TYR B 17 14.629 -3.862 -9.204 1.00 0.00 C ATOM 1708 CZ TYR B 17 13.914 -3.762 -10.405 1.00 0.00 C ATOM 1709 OH TYR B 17 14.100 -2.678 -11.215 1.00 0.00 O ATOM 0 H TYR B 17 11.464 -8.297 -8.960 1.00 0.00 H new ATOM 0 HA TYR B 17 14.321 -8.446 -8.706 1.00 0.00 H new ATOM 0 HB2 TYR B 17 12.077 -6.945 -7.371 1.00 0.00 H new ATOM 0 HB3 TYR B 17 13.715 -6.866 -6.752 1.00 0.00 H new ATOM 0 HD1 TYR B 17 12.113 -6.645 -10.191 1.00 0.00 H new ATOM 0 HD2 TYR B 17 14.941 -5.003 -7.397 1.00 0.00 H new ATOM 0 HE1 TYR B 17 12.478 -4.713 -11.703 1.00 0.00 H new ATOM 0 HE2 TYR B 17 15.362 -3.111 -8.950 1.00 0.00 H new ATOM 0 HH TYR B 17 13.272 -2.489 -11.704 1.00 0.00 H new ATOM 1719 N SER B 18 12.544 -9.787 -6.246 1.00 0.00 N ATOM 1720 CA SER B 18 12.588 -10.766 -5.166 1.00 0.00 C ATOM 1721 C SER B 18 13.089 -12.120 -5.664 1.00 0.00 C ATOM 1722 O SER B 18 13.844 -12.792 -4.965 1.00 0.00 O ATOM 1723 CB SER B 18 11.210 -10.904 -4.530 1.00 0.00 C ATOM 1724 OG SER B 18 10.241 -11.274 -5.483 1.00 0.00 O ATOM 0 H SER B 18 11.629 -9.350 -6.360 1.00 0.00 H new ATOM 0 HA SER B 18 13.291 -10.411 -4.413 1.00 0.00 H new ATOM 0 HB2 SER B 18 11.246 -11.651 -3.737 1.00 0.00 H new ATOM 0 HB3 SER B 18 10.925 -9.960 -4.066 1.00 0.00 H new ATOM 0 HG SER B 18 9.667 -11.975 -5.110 1.00 0.00 H new ATOM 1730 N GLY B 19 12.689 -12.513 -6.876 1.00 0.00 N ATOM 1731 CA GLY B 19 13.111 -13.760 -7.480 1.00 0.00 C ATOM 1732 C GLY B 19 14.628 -13.807 -7.640 1.00 0.00 C ATOM 1733 O GLY B 19 15.216 -14.885 -7.578 1.00 0.00 O ATOM 0 H GLY B 19 12.059 -11.965 -7.462 1.00 0.00 H new ATOM 0 HA2 GLY B 19 12.781 -14.596 -6.864 1.00 0.00 H new ATOM 0 HA3 GLY B 19 12.636 -13.875 -8.454 1.00 0.00 H new ATOM 1737 N ARG B 20 15.270 -12.650 -7.848 1.00 0.00 N ATOM 1738 CA ARG B 20 16.715 -12.599 -7.999 1.00 0.00 C ATOM 1739 C ARG B 20 17.383 -12.829 -6.645 1.00 0.00 C ATOM 1740 O ARG B 20 18.234 -13.709 -6.540 1.00 0.00 O ATOM 1741 CB ARG B 20 17.179 -11.288 -8.644 1.00 0.00 C ATOM 1742 CG ARG B 20 16.318 -10.901 -9.856 1.00 0.00 C ATOM 1743 CD ARG B 20 17.112 -10.360 -11.056 1.00 0.00 C ATOM 1744 NE ARG B 20 16.708 -8.987 -11.394 1.00 0.00 N ATOM 1745 CZ ARG B 20 17.083 -7.894 -10.714 1.00 0.00 C ATOM 1746 NH1 ARG B 20 17.871 -8.010 -9.640 1.00 0.00 N ATOM 1747 NH2 ARG B 20 16.666 -6.689 -11.114 1.00 0.00 N ATOM 0 H ARG B 20 14.806 -11.744 -7.914 1.00 0.00 H new ATOM 0 HA ARG B 20 17.017 -13.397 -8.678 1.00 0.00 H new ATOM 0 HB2 ARG B 20 17.142 -10.488 -7.904 1.00 0.00 H new ATOM 0 HB3 ARG B 20 18.219 -11.387 -8.956 1.00 0.00 H new ATOM 0 HG2 ARG B 20 15.751 -11.775 -10.176 1.00 0.00 H new ATOM 0 HG3 ARG B 20 15.594 -10.147 -9.546 1.00 0.00 H new ATOM 0 HD2 ARG B 20 18.178 -10.381 -10.828 1.00 0.00 H new ATOM 0 HD3 ARG B 20 16.958 -11.009 -11.918 1.00 0.00 H new ATOM 0 HE ARG B 20 16.100 -8.857 -12.202 1.00 0.00 H new ATOM 0 HH11 ARG B 20 18.188 -8.931 -9.337 1.00 0.00 H new ATOM 0 HH12 ARG B 20 18.155 -7.177 -9.124 1.00 0.00 H new ATOM 0 HH21 ARG B 20 16.065 -6.603 -11.934 1.00 0.00 H new ATOM 0 HH22 ARG B 20 16.949 -5.855 -10.600 1.00 0.00 H new ATOM 1761 N GLU B 21 17.006 -12.058 -5.613 1.00 0.00 N ATOM 1762 CA GLU B 21 17.484 -12.308 -4.257 1.00 0.00 C ATOM 1763 C GLU B 21 16.404 -11.987 -3.215 1.00 0.00 C ATOM 1764 O GLU B 21 16.216 -10.833 -2.824 1.00 0.00 O ATOM 1765 CB GLU B 21 18.769 -11.516 -3.957 1.00 0.00 C ATOM 1766 CG GLU B 21 19.898 -11.661 -4.988 1.00 0.00 C ATOM 1767 CD GLU B 21 21.172 -10.940 -4.551 1.00 0.00 C ATOM 1768 OE1 GLU B 21 21.075 -10.083 -3.643 1.00 0.00 O ATOM 1769 OE2 GLU B 21 22.231 -11.266 -5.128 1.00 0.00 O ATOM 0 H GLU B 21 16.374 -11.262 -5.698 1.00 0.00 H new ATOM 0 HA GLU B 21 17.717 -13.371 -4.191 1.00 0.00 H new ATOM 0 HB2 GLU B 21 18.512 -10.460 -3.874 1.00 0.00 H new ATOM 0 HB3 GLU B 21 19.148 -11.829 -2.984 1.00 0.00 H new ATOM 0 HG2 GLU B 21 20.115 -12.718 -5.141 1.00 0.00 H new ATOM 0 HG3 GLU B 21 19.567 -11.261 -5.946 1.00 0.00 H new ATOM 1776 N GLY B 22 15.775 -13.028 -2.675 1.00 0.00 N ATOM 1777 CA GLY B 22 14.823 -12.916 -1.590 1.00 0.00 C ATOM 1778 C GLY B 22 14.025 -14.209 -1.507 1.00 0.00 C ATOM 1779 O GLY B 22 14.018 -14.993 -2.455 1.00 0.00 O ATOM 0 H GLY B 22 15.920 -13.987 -2.990 1.00 0.00 H new ATOM 0 HA2 GLY B 22 15.342 -12.731 -0.649 1.00 0.00 H new ATOM 0 HA3 GLY B 22 14.156 -12.070 -1.758 1.00 0.00 H new ATOM 1783 N ASP B 23 13.350 -14.450 -0.381 1.00 0.00 N ATOM 1784 CA ASP B 23 12.550 -15.650 -0.170 1.00 0.00 C ATOM 1785 C ASP B 23 11.210 -15.541 -0.899 1.00 0.00 C ATOM 1786 O ASP B 23 10.163 -15.621 -0.264 1.00 0.00 O ATOM 1787 CB ASP B 23 12.389 -15.882 1.340 1.00 0.00 C ATOM 1788 CG ASP B 23 11.611 -17.155 1.672 1.00 0.00 C ATOM 1789 OD1 ASP B 23 11.761 -18.137 0.912 1.00 0.00 O ATOM 1790 OD2 ASP B 23 10.889 -17.124 2.693 1.00 0.00 O ATOM 0 H ASP B 23 13.346 -13.811 0.414 1.00 0.00 H new ATOM 0 HA ASP B 23 13.055 -16.519 -0.592 1.00 0.00 H new ATOM 0 HB2 ASP B 23 13.376 -15.936 1.800 1.00 0.00 H new ATOM 0 HB3 ASP B 23 11.878 -15.026 1.781 1.00 0.00 H new ATOM 1795 N LYS B 24 11.259 -15.348 -2.225 1.00 0.00 N ATOM 1796 CA LYS B 24 10.135 -15.197 -3.151 1.00 0.00 C ATOM 1797 C LYS B 24 9.316 -13.931 -2.868 1.00 0.00 C ATOM 1798 O LYS B 24 9.234 -13.019 -3.685 1.00 0.00 O ATOM 1799 CB LYS B 24 9.231 -16.442 -3.146 1.00 0.00 C ATOM 1800 CG LYS B 24 9.984 -17.751 -3.410 1.00 0.00 C ATOM 1801 CD LYS B 24 8.966 -18.898 -3.454 1.00 0.00 C ATOM 1802 CE LYS B 24 9.658 -20.244 -3.687 1.00 0.00 C ATOM 1803 NZ LYS B 24 8.675 -21.343 -3.707 1.00 0.00 N ATOM 0 H LYS B 24 12.154 -15.290 -2.711 1.00 0.00 H new ATOM 0 HA LYS B 24 10.565 -15.091 -4.147 1.00 0.00 H new ATOM 0 HB2 LYS B 24 8.728 -16.511 -2.182 1.00 0.00 H new ATOM 0 HB3 LYS B 24 8.456 -16.320 -3.902 1.00 0.00 H new ATOM 0 HG2 LYS B 24 10.528 -17.691 -4.352 1.00 0.00 H new ATOM 0 HG3 LYS B 24 10.721 -17.929 -2.627 1.00 0.00 H new ATOM 0 HD2 LYS B 24 8.409 -18.930 -2.517 1.00 0.00 H new ATOM 0 HD3 LYS B 24 8.243 -18.716 -4.249 1.00 0.00 H new ATOM 0 HE2 LYS B 24 10.202 -20.220 -4.631 1.00 0.00 H new ATOM 0 HE3 LYS B 24 10.392 -20.421 -2.901 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 9.167 -22.246 -3.866 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 8.174 -21.377 -2.796 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 7.990 -21.182 -4.473 1.00 0.00 H new ATOM 1817 N HIS B 25 8.712 -13.875 -1.686 1.00 0.00 N ATOM 1818 CA HIS B 25 7.753 -12.874 -1.253 1.00 0.00 C ATOM 1819 C HIS B 25 8.448 -11.749 -0.476 1.00 0.00 C ATOM 1820 O HIS B 25 7.788 -11.027 0.273 1.00 0.00 O ATOM 1821 CB HIS B 25 6.730 -13.625 -0.391 1.00 0.00 C ATOM 1822 CG HIS B 25 5.469 -12.870 -0.069 1.00 0.00 C ATOM 1823 ND1 HIS B 25 5.108 -12.401 1.172 1.00 0.00 N ATOM 1824 CD2 HIS B 25 4.412 -12.664 -0.911 1.00 0.00 C ATOM 1825 CE1 HIS B 25 3.860 -11.919 1.077 1.00 0.00 C ATOM 1826 NE2 HIS B 25 3.399 -12.040 -0.180 1.00 0.00 N ATOM 0 H HIS B 25 8.892 -14.571 -0.963 1.00 0.00 H new ATOM 0 HA HIS B 25 7.264 -12.386 -2.096 1.00 0.00 H new ATOM 0 HB2 HIS B 25 6.458 -14.548 -0.903 1.00 0.00 H new ATOM 0 HB3 HIS B 25 7.210 -13.910 0.545 1.00 0.00 H new ATOM 0 HD1 HIS B 25 5.685 -12.417 2.013 1.00 0.00 H new ATOM 0 HD2 HIS B 25 4.368 -12.935 -1.955 1.00 0.00 H new ATOM 0 HE1 HIS B 25 3.302 -11.492 1.897 1.00 0.00 H new ATOM 1834 N LYS B 26 9.773 -11.605 -0.616 1.00 0.00 N ATOM 1835 CA LYS B 26 10.559 -10.642 0.144 1.00 0.00 C ATOM 1836 C LYS B 26 11.671 -10.066 -0.733 1.00 0.00 C ATOM 1837 O LYS B 26 12.067 -10.709 -1.701 1.00 0.00 O ATOM 1838 CB LYS B 26 11.152 -11.294 1.401 1.00 0.00 C ATOM 1839 CG LYS B 26 10.188 -12.196 2.186 1.00 0.00 C ATOM 1840 CD LYS B 26 10.838 -12.600 3.515 1.00 0.00 C ATOM 1841 CE LYS B 26 10.011 -13.654 4.261 1.00 0.00 C ATOM 1842 NZ LYS B 26 8.697 -13.139 4.685 1.00 0.00 N ATOM 0 H LYS B 26 10.327 -12.161 -1.267 1.00 0.00 H new ATOM 0 HA LYS B 26 9.902 -9.831 0.460 1.00 0.00 H new ATOM 0 HB2 LYS B 26 12.021 -11.884 1.109 1.00 0.00 H new ATOM 0 HB3 LYS B 26 11.510 -10.507 2.065 1.00 0.00 H new ATOM 0 HG2 LYS B 26 9.251 -11.671 2.371 1.00 0.00 H new ATOM 0 HG3 LYS B 26 9.946 -13.084 1.602 1.00 0.00 H new ATOM 0 HD2 LYS B 26 11.838 -12.991 3.326 1.00 0.00 H new ATOM 0 HD3 LYS B 26 10.954 -11.718 4.145 1.00 0.00 H new ATOM 0 HE2 LYS B 26 9.868 -14.522 3.617 1.00 0.00 H new ATOM 0 HE3 LYS B 26 10.565 -13.994 5.136 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 8.123 -13.920 5.062 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 8.828 -12.418 5.423 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 8.211 -12.715 3.869 1.00 0.00 H new ATOM 1856 N LEU B 27 12.183 -8.880 -0.387 1.00 0.00 N ATOM 1857 CA LEU B 27 13.296 -8.224 -1.070 1.00 0.00 C ATOM 1858 C LEU B 27 14.482 -8.079 -0.117 1.00 0.00 C ATOM 1859 O LEU B 27 14.325 -7.522 0.971 1.00 0.00 O ATOM 1860 CB LEU B 27 12.890 -6.811 -1.520 1.00 0.00 C ATOM 1861 CG LEU B 27 11.788 -6.759 -2.585 1.00 0.00 C ATOM 1862 CD1 LEU B 27 11.270 -5.321 -2.674 1.00 0.00 C ATOM 1863 CD2 LEU B 27 12.280 -7.172 -3.975 1.00 0.00 C ATOM 0 H LEU B 27 11.823 -8.337 0.398 1.00 0.00 H new ATOM 0 HA LEU B 27 13.566 -8.834 -1.932 1.00 0.00 H new ATOM 0 HB2 LEU B 27 12.557 -6.250 -0.647 1.00 0.00 H new ATOM 0 HB3 LEU B 27 13.773 -6.302 -1.908 1.00 0.00 H new ATOM 0 HG LEU B 27 11.011 -7.462 -2.285 1.00 0.00 H new ATOM 0 HD11 LEU B 27 10.484 -5.263 -3.427 1.00 0.00 H new ATOM 0 HD12 LEU B 27 10.868 -5.018 -1.707 1.00 0.00 H new ATOM 0 HD13 LEU B 27 12.088 -4.656 -2.951 1.00 0.00 H new ATOM 0 HD21 LEU B 27 11.455 -7.115 -4.685 1.00 0.00 H new ATOM 0 HD22 LEU B 27 13.079 -6.502 -4.292 1.00 0.00 H new ATOM 0 HD23 LEU B 27 12.657 -8.194 -3.939 1.00 0.00 H new ATOM 1875 N LYS B 28 15.666 -8.550 -0.526 1.00 0.00 N ATOM 1876 CA LYS B 28 16.908 -8.265 0.186 1.00 0.00 C ATOM 1877 C LYS B 28 17.203 -6.765 0.118 1.00 0.00 C ATOM 1878 O LYS B 28 16.611 -6.050 -0.687 1.00 0.00 O ATOM 1879 CB LYS B 28 18.058 -9.012 -0.495 1.00 0.00 C ATOM 1880 CG LYS B 28 17.996 -10.519 -0.245 1.00 0.00 C ATOM 1881 CD LYS B 28 18.873 -10.996 0.923 1.00 0.00 C ATOM 1882 CE LYS B 28 20.385 -10.800 0.716 1.00 0.00 C ATOM 1883 NZ LYS B 28 20.857 -11.358 -0.564 1.00 0.00 N ATOM 0 H LYS B 28 15.785 -9.134 -1.353 1.00 0.00 H new ATOM 0 HA LYS B 28 16.809 -8.581 1.225 1.00 0.00 H new ATOM 0 HB2 LYS B 28 18.028 -8.822 -1.568 1.00 0.00 H new ATOM 0 HB3 LYS B 28 19.008 -8.624 -0.129 1.00 0.00 H new ATOM 0 HG2 LYS B 28 16.962 -10.802 -0.048 1.00 0.00 H new ATOM 0 HG3 LYS B 28 18.302 -11.040 -1.152 1.00 0.00 H new ATOM 0 HD2 LYS B 28 18.572 -10.464 1.826 1.00 0.00 H new ATOM 0 HD3 LYS B 28 18.678 -12.054 1.097 1.00 0.00 H new ATOM 0 HE2 LYS B 28 20.618 -9.736 0.753 1.00 0.00 H new ATOM 0 HE3 LYS B 28 20.925 -11.273 1.536 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 21.895 -11.307 -0.603 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 20.556 -12.350 -0.642 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 20.454 -10.811 -1.351 1.00 0.00 H new ATOM 1897 N LYS B 29 18.166 -6.290 0.914 1.00 0.00 N ATOM 1898 CA LYS B 29 18.639 -4.912 0.824 1.00 0.00 C ATOM 1899 C LYS B 29 19.107 -4.577 -0.594 1.00 0.00 C ATOM 1900 O LYS B 29 18.832 -3.487 -1.088 1.00 0.00 O ATOM 1901 CB LYS B 29 19.705 -4.626 1.895 1.00 0.00 C ATOM 1902 CG LYS B 29 20.929 -5.552 1.859 1.00 0.00 C ATOM 1903 CD LYS B 29 21.956 -5.080 2.896 1.00 0.00 C ATOM 1904 CE LYS B 29 23.158 -6.031 2.936 1.00 0.00 C ATOM 1905 NZ LYS B 29 24.206 -5.531 3.842 1.00 0.00 N ATOM 0 H LYS B 29 18.633 -6.846 1.630 1.00 0.00 H new ATOM 0 HA LYS B 29 17.803 -4.244 1.033 1.00 0.00 H new ATOM 0 HB2 LYS B 29 20.044 -3.596 1.782 1.00 0.00 H new ATOM 0 HB3 LYS B 29 19.240 -4.702 2.878 1.00 0.00 H new ATOM 0 HG2 LYS B 29 20.629 -6.578 2.070 1.00 0.00 H new ATOM 0 HG3 LYS B 29 21.373 -5.548 0.863 1.00 0.00 H new ATOM 0 HD2 LYS B 29 22.291 -4.072 2.652 1.00 0.00 H new ATOM 0 HD3 LYS B 29 21.491 -5.031 3.881 1.00 0.00 H new ATOM 0 HE2 LYS B 29 22.832 -7.019 3.263 1.00 0.00 H new ATOM 0 HE3 LYS B 29 23.567 -6.146 1.932 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 24.822 -6.318 4.128 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 24.772 -4.809 3.353 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 23.765 -5.112 4.686 1.00 0.00 H new ATOM 1919 N SER B 30 19.777 -5.521 -1.260 1.00 0.00 N ATOM 1920 CA SER B 30 20.234 -5.357 -2.627 1.00 0.00 C ATOM 1921 C SER B 30 19.042 -5.099 -3.547 1.00 0.00 C ATOM 1922 O SER B 30 19.015 -4.106 -4.273 1.00 0.00 O ATOM 1923 CB SER B 30 20.954 -6.650 -3.024 1.00 0.00 C ATOM 1924 OG SER B 30 20.256 -7.755 -2.470 1.00 0.00 O ATOM 0 H SER B 30 20.016 -6.426 -0.855 1.00 0.00 H new ATOM 0 HA SER B 30 20.909 -4.506 -2.714 1.00 0.00 H new ATOM 0 HB2 SER B 30 20.998 -6.738 -4.110 1.00 0.00 H new ATOM 0 HB3 SER B 30 21.982 -6.635 -2.663 1.00 0.00 H new ATOM 0 HG SER B 30 20.635 -8.589 -2.818 1.00 0.00 H new ATOM 1930 N GLU B 31 18.033 -5.973 -3.490 1.00 0.00 N ATOM 1931 CA GLU B 31 16.876 -5.846 -4.359 1.00 0.00 C ATOM 1932 C GLU B 31 16.099 -4.574 -4.037 1.00 0.00 C ATOM 1933 O GLU B 31 15.773 -3.807 -4.936 1.00 0.00 O ATOM 1934 CB GLU B 31 15.990 -7.093 -4.269 1.00 0.00 C ATOM 1935 CG GLU B 31 16.730 -8.346 -4.754 1.00 0.00 C ATOM 1936 CD GLU B 31 17.217 -8.237 -6.196 1.00 0.00 C ATOM 1937 OE1 GLU B 31 16.497 -7.607 -7.002 1.00 0.00 O ATOM 1938 OE2 GLU B 31 18.315 -8.773 -6.464 1.00 0.00 O ATOM 0 H GLU B 31 18.000 -6.769 -2.853 1.00 0.00 H new ATOM 0 HA GLU B 31 17.222 -5.766 -5.390 1.00 0.00 H new ATOM 0 HB2 GLU B 31 15.666 -7.237 -3.238 1.00 0.00 H new ATOM 0 HB3 GLU B 31 15.091 -6.946 -4.868 1.00 0.00 H new ATOM 0 HG2 GLU B 31 17.584 -8.531 -4.102 1.00 0.00 H new ATOM 0 HG3 GLU B 31 16.069 -9.208 -4.665 1.00 0.00 H new ATOM 1945 N LEU B 32 15.814 -4.343 -2.756 1.00 0.00 N ATOM 1946 CA LEU B 32 15.084 -3.172 -2.292 1.00 0.00 C ATOM 1947 C LEU B 32 15.785 -1.895 -2.765 1.00 0.00 C ATOM 1948 O LEU B 32 15.140 -0.988 -3.291 1.00 0.00 O ATOM 1949 CB LEU B 32 14.923 -3.265 -0.766 1.00 0.00 C ATOM 1950 CG LEU B 32 14.014 -2.213 -0.108 1.00 0.00 C ATOM 1951 CD1 LEU B 32 14.734 -0.881 0.134 1.00 0.00 C ATOM 1952 CD2 LEU B 32 12.692 -1.993 -0.853 1.00 0.00 C ATOM 0 H LEU B 32 16.089 -4.975 -2.004 1.00 0.00 H new ATOM 0 HA LEU B 32 14.082 -3.136 -2.720 1.00 0.00 H new ATOM 0 HB2 LEU B 32 14.533 -4.253 -0.523 1.00 0.00 H new ATOM 0 HB3 LEU B 32 15.912 -3.193 -0.313 1.00 0.00 H new ATOM 0 HG LEU B 32 13.759 -2.635 0.864 1.00 0.00 H new ATOM 0 HD11 LEU B 32 14.046 -0.175 0.600 1.00 0.00 H new ATOM 0 HD12 LEU B 32 15.588 -1.043 0.791 1.00 0.00 H new ATOM 0 HD13 LEU B 32 15.080 -0.476 -0.817 1.00 0.00 H new ATOM 0 HD21 LEU B 32 12.102 -1.238 -0.332 1.00 0.00 H new ATOM 0 HD22 LEU B 32 12.899 -1.655 -1.869 1.00 0.00 H new ATOM 0 HD23 LEU B 32 12.134 -2.929 -0.888 1.00 0.00 H new ATOM 1964 N LYS B 33 17.115 -1.848 -2.645 1.00 0.00 N ATOM 1965 CA LYS B 33 17.903 -0.727 -3.129 1.00 0.00 C ATOM 1966 C LYS B 33 17.612 -0.482 -4.607 1.00 0.00 C ATOM 1967 O LYS B 33 17.173 0.613 -4.969 1.00 0.00 O ATOM 1968 CB LYS B 33 19.389 -1.017 -2.887 1.00 0.00 C ATOM 1969 CG LYS B 33 20.350 -0.073 -3.624 1.00 0.00 C ATOM 1970 CD LYS B 33 21.803 -0.465 -3.317 1.00 0.00 C ATOM 1971 CE LYS B 33 22.787 0.638 -3.717 1.00 0.00 C ATOM 1972 NZ LYS B 33 22.623 1.047 -5.122 1.00 0.00 N ATOM 0 H LYS B 33 17.668 -2.587 -2.210 1.00 0.00 H new ATOM 0 HA LYS B 33 17.635 0.180 -2.587 1.00 0.00 H new ATOM 0 HB2 LYS B 33 19.589 -0.956 -1.817 1.00 0.00 H new ATOM 0 HB3 LYS B 33 19.601 -2.042 -3.193 1.00 0.00 H new ATOM 0 HG2 LYS B 33 20.170 -0.122 -4.698 1.00 0.00 H new ATOM 0 HG3 LYS B 33 20.169 0.957 -3.317 1.00 0.00 H new ATOM 0 HD2 LYS B 33 21.906 -0.675 -2.252 1.00 0.00 H new ATOM 0 HD3 LYS B 33 22.051 -1.384 -3.848 1.00 0.00 H new ATOM 0 HE2 LYS B 33 22.643 1.503 -3.069 1.00 0.00 H new ATOM 0 HE3 LYS B 33 23.807 0.287 -3.559 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 23.420 1.653 -5.402 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 22.600 0.203 -5.729 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 21.733 1.574 -5.228 1.00 0.00 H new ATOM 1986 N GLU B 34 17.879 -1.469 -5.470 1.00 0.00 N ATOM 1987 CA GLU B 34 17.757 -1.220 -6.899 1.00 0.00 C ATOM 1988 C GLU B 34 16.297 -0.948 -7.270 1.00 0.00 C ATOM 1989 O GLU B 34 16.028 -0.111 -8.123 1.00 0.00 O ATOM 1990 CB GLU B 34 18.397 -2.318 -7.764 1.00 0.00 C ATOM 1991 CG GLU B 34 17.898 -3.733 -7.455 1.00 0.00 C ATOM 1992 CD GLU B 34 18.177 -4.716 -8.586 1.00 0.00 C ATOM 1993 OE1 GLU B 34 17.674 -4.465 -9.703 1.00 0.00 O ATOM 1994 OE2 GLU B 34 18.869 -5.722 -8.319 1.00 0.00 O ATOM 0 H GLU B 34 18.170 -2.412 -5.212 1.00 0.00 H new ATOM 0 HA GLU B 34 18.333 -0.322 -7.123 1.00 0.00 H new ATOM 0 HB2 GLU B 34 18.202 -2.097 -8.814 1.00 0.00 H new ATOM 0 HB3 GLU B 34 19.478 -2.288 -7.627 1.00 0.00 H new ATOM 0 HG2 GLU B 34 18.375 -4.091 -6.543 1.00 0.00 H new ATOM 0 HG3 GLU B 34 16.826 -3.702 -7.263 1.00 0.00 H new ATOM 2001 N LEU B 35 15.354 -1.624 -6.611 1.00 0.00 N ATOM 2002 CA LEU B 35 13.924 -1.413 -6.777 1.00 0.00 C ATOM 2003 C LEU B 35 13.611 0.069 -6.551 1.00 0.00 C ATOM 2004 O LEU B 35 13.070 0.718 -7.448 1.00 0.00 O ATOM 2005 CB LEU B 35 13.203 -2.369 -5.806 1.00 0.00 C ATOM 2006 CG LEU B 35 11.666 -2.336 -5.710 1.00 0.00 C ATOM 2007 CD1 LEU B 35 11.102 -1.003 -5.202 1.00 0.00 C ATOM 2008 CD2 LEU B 35 10.989 -2.762 -7.015 1.00 0.00 C ATOM 0 H LEU B 35 15.575 -2.351 -5.931 1.00 0.00 H new ATOM 0 HA LEU B 35 13.573 -1.642 -7.783 1.00 0.00 H new ATOM 0 HB2 LEU B 35 13.492 -3.385 -6.074 1.00 0.00 H new ATOM 0 HB3 LEU B 35 13.597 -2.178 -4.808 1.00 0.00 H new ATOM 0 HG LEU B 35 11.421 -3.078 -4.950 1.00 0.00 H new ATOM 0 HD11 LEU B 35 10.014 -1.060 -5.163 1.00 0.00 H new ATOM 0 HD12 LEU B 35 11.491 -0.800 -4.204 1.00 0.00 H new ATOM 0 HD13 LEU B 35 11.399 -0.201 -5.878 1.00 0.00 H new ATOM 0 HD21 LEU B 35 9.907 -2.721 -6.894 1.00 0.00 H new ATOM 0 HD22 LEU B 35 11.290 -2.089 -7.818 1.00 0.00 H new ATOM 0 HD23 LEU B 35 11.288 -3.780 -7.264 1.00 0.00 H new ATOM 2020 N ILE B 36 13.994 0.632 -5.396 1.00 0.00 N ATOM 2021 CA ILE B 36 13.715 2.035 -5.107 1.00 0.00 C ATOM 2022 C ILE B 36 14.440 2.927 -6.114 1.00 0.00 C ATOM 2023 O ILE B 36 13.804 3.759 -6.757 1.00 0.00 O ATOM 2024 CB ILE B 36 14.036 2.399 -3.641 1.00 0.00 C ATOM 2025 CG1 ILE B 36 13.039 1.674 -2.716 1.00 0.00 C ATOM 2026 CG2 ILE B 36 13.943 3.920 -3.418 1.00 0.00 C ATOM 2027 CD1 ILE B 36 13.233 1.992 -1.231 1.00 0.00 C ATOM 0 H ILE B 36 14.493 0.138 -4.656 1.00 0.00 H new ATOM 0 HA ILE B 36 12.645 2.209 -5.220 1.00 0.00 H new ATOM 0 HB ILE B 36 15.055 2.086 -3.413 1.00 0.00 H new ATOM 0 HG12 ILE B 36 12.024 1.945 -3.007 1.00 0.00 H new ATOM 0 HG13 ILE B 36 13.136 0.598 -2.864 1.00 0.00 H new ATOM 0 HG21 ILE B 36 14.173 4.150 -2.378 1.00 0.00 H new ATOM 0 HG22 ILE B 36 14.656 4.427 -4.068 1.00 0.00 H new ATOM 0 HG23 ILE B 36 12.934 4.261 -3.650 1.00 0.00 H new ATOM 0 HD11 ILE B 36 12.496 1.446 -0.643 1.00 0.00 H new ATOM 0 HD12 ILE B 36 14.235 1.695 -0.923 1.00 0.00 H new ATOM 0 HD13 ILE B 36 13.106 3.062 -1.069 1.00 0.00 H new ATOM 2039 N ASN B 37 15.758 2.751 -6.256 1.00 0.00 N ATOM 2040 CA ASN B 37 16.570 3.532 -7.186 1.00 0.00 C ATOM 2041 C ASN B 37 15.923 3.591 -8.568 1.00 0.00 C ATOM 2042 O ASN B 37 15.755 4.670 -9.127 1.00 0.00 O ATOM 2043 CB ASN B 37 17.985 2.950 -7.317 1.00 0.00 C ATOM 2044 CG ASN B 37 18.925 3.412 -6.210 1.00 0.00 C ATOM 2045 OD1 ASN B 37 19.732 4.311 -6.415 1.00 0.00 O ATOM 2046 ND2 ASN B 37 18.843 2.831 -5.022 1.00 0.00 N ATOM 0 H ASN B 37 16.290 2.060 -5.726 1.00 0.00 H new ATOM 0 HA ASN B 37 16.637 4.541 -6.778 1.00 0.00 H new ATOM 0 HB2 ASN B 37 17.926 1.862 -7.305 1.00 0.00 H new ATOM 0 HB3 ASN B 37 18.402 3.237 -8.283 1.00 0.00 H new ATOM 0 HD21 ASN B 37 19.456 3.131 -4.264 1.00 0.00 H new ATOM 0 HD22 ASN B 37 18.167 2.084 -4.865 1.00 0.00 H new ATOM 2053 N ASN B 38 15.578 2.434 -9.133 1.00 0.00 N ATOM 2054 CA ASN B 38 15.095 2.348 -10.496 1.00 0.00 C ATOM 2055 C ASN B 38 13.674 2.890 -10.587 1.00 0.00 C ATOM 2056 O ASN B 38 13.405 3.828 -11.338 1.00 0.00 O ATOM 2057 CB ASN B 38 15.073 0.876 -10.940 1.00 0.00 C ATOM 2058 CG ASN B 38 16.448 0.227 -11.053 1.00 0.00 C ATOM 2059 OD1 ASN B 38 17.478 0.892 -11.011 1.00 0.00 O ATOM 2060 ND2 ASN B 38 16.476 -1.094 -11.206 1.00 0.00 N ATOM 0 H ASN B 38 15.628 1.535 -8.653 1.00 0.00 H new ATOM 0 HA ASN B 38 15.757 2.933 -11.135 1.00 0.00 H new ATOM 0 HB2 ASN B 38 14.473 0.305 -10.231 1.00 0.00 H new ATOM 0 HB3 ASN B 38 14.573 0.809 -11.906 1.00 0.00 H new ATOM 0 HD21 ASN B 38 17.369 -1.579 -11.292 1.00 0.00 H new ATOM 0 HD22 ASN B 38 15.604 -1.622 -11.238 1.00 0.00 H new ATOM 2067 N GLU B 39 12.764 2.318 -9.796 1.00 0.00 N ATOM 2068 CA GLU B 39 11.346 2.581 -9.955 1.00 0.00 C ATOM 2069 C GLU B 39 10.944 3.920 -9.355 1.00 0.00 C ATOM 2070 O GLU B 39 10.128 4.636 -9.934 1.00 0.00 O ATOM 2071 CB GLU B 39 10.527 1.438 -9.347 1.00 0.00 C ATOM 2072 CG GLU B 39 10.740 0.112 -10.092 1.00 0.00 C ATOM 2073 CD GLU B 39 10.216 0.154 -11.528 1.00 0.00 C ATOM 2074 OE1 GLU B 39 9.083 0.658 -11.711 1.00 0.00 O ATOM 2075 OE2 GLU B 39 10.961 -0.318 -12.412 1.00 0.00 O ATOM 0 H GLU B 39 12.991 1.671 -9.041 1.00 0.00 H new ATOM 0 HA GLU B 39 11.134 2.637 -11.023 1.00 0.00 H new ATOM 0 HB2 GLU B 39 10.803 1.313 -8.300 1.00 0.00 H new ATOM 0 HB3 GLU B 39 9.469 1.699 -9.369 1.00 0.00 H new ATOM 0 HG2 GLU B 39 11.803 -0.127 -10.104 1.00 0.00 H new ATOM 0 HG3 GLU B 39 10.239 -0.690 -9.550 1.00 0.00 H new ATOM 2082 N LEU B 40 11.487 4.248 -8.181 1.00 0.00 N ATOM 2083 CA LEU B 40 11.060 5.411 -7.421 1.00 0.00 C ATOM 2084 C LEU B 40 11.850 6.665 -7.797 1.00 0.00 C ATOM 2085 O LEU B 40 11.539 7.732 -7.275 1.00 0.00 O ATOM 2086 CB LEU B 40 11.156 5.113 -5.918 1.00 0.00 C ATOM 2087 CG LEU B 40 9.946 5.648 -5.139 1.00 0.00 C ATOM 2088 CD1 LEU B 40 8.699 4.781 -5.355 1.00 0.00 C ATOM 2089 CD2 LEU B 40 10.291 5.620 -3.654 1.00 0.00 C ATOM 0 H LEU B 40 12.233 3.713 -7.736 1.00 0.00 H new ATOM 0 HA LEU B 40 10.020 5.619 -7.671 1.00 0.00 H new ATOM 0 HB2 LEU B 40 11.235 4.036 -5.768 1.00 0.00 H new ATOM 0 HB3 LEU B 40 12.068 5.558 -5.519 1.00 0.00 H new ATOM 0 HG LEU B 40 9.728 6.656 -5.491 1.00 0.00 H new ATOM 0 HD11 LEU B 40 7.866 5.194 -4.786 1.00 0.00 H new ATOM 0 HD12 LEU B 40 8.444 4.768 -6.415 1.00 0.00 H new ATOM 0 HD13 LEU B 40 8.900 3.764 -5.017 1.00 0.00 H new ATOM 0 HD21 LEU B 40 9.446 5.996 -3.077 1.00 0.00 H new ATOM 0 HD22 LEU B 40 10.511 4.596 -3.351 1.00 0.00 H new ATOM 0 HD23 LEU B 40 11.163 6.248 -3.471 1.00 0.00 H new ATOM 2101 N SER B 41 12.810 6.557 -8.726 1.00 0.00 N ATOM 2102 CA SER B 41 13.647 7.646 -9.234 1.00 0.00 C ATOM 2103 C SER B 41 12.856 8.935 -9.458 1.00 0.00 C ATOM 2104 O SER B 41 13.333 10.038 -9.206 1.00 0.00 O ATOM 2105 CB SER B 41 14.227 7.209 -10.588 1.00 0.00 C ATOM 2106 OG SER B 41 13.210 6.625 -11.392 1.00 0.00 O ATOM 0 H SER B 41 13.033 5.663 -9.163 1.00 0.00 H new ATOM 0 HA SER B 41 14.421 7.847 -8.493 1.00 0.00 H new ATOM 0 HB2 SER B 41 14.658 8.068 -11.102 1.00 0.00 H new ATOM 0 HB3 SER B 41 15.034 6.493 -10.432 1.00 0.00 H new ATOM 0 HG SER B 41 13.292 5.649 -11.365 1.00 0.00 H new ATOM 2112 N HIS B 42 11.646 8.772 -9.987 1.00 0.00 N ATOM 2113 CA HIS B 42 10.743 9.841 -10.368 1.00 0.00 C ATOM 2114 C HIS B 42 10.323 10.691 -9.158 1.00 0.00 C ATOM 2115 O HIS B 42 10.093 11.890 -9.296 1.00 0.00 O ATOM 2116 CB HIS B 42 9.516 9.201 -11.025 1.00 0.00 C ATOM 2117 CG HIS B 42 9.773 8.418 -12.296 1.00 0.00 C ATOM 2118 ND1 HIS B 42 10.888 7.664 -12.611 1.00 0.00 N ATOM 2119 CD2 HIS B 42 8.876 8.253 -13.319 1.00 0.00 C ATOM 2120 CE1 HIS B 42 10.662 7.077 -13.798 1.00 0.00 C ATOM 2121 NE2 HIS B 42 9.448 7.402 -14.268 1.00 0.00 N ATOM 0 H HIS B 42 11.256 7.847 -10.168 1.00 0.00 H new ATOM 0 HA HIS B 42 11.247 10.513 -11.062 1.00 0.00 H new ATOM 0 HB2 HIS B 42 9.047 8.535 -10.301 1.00 0.00 H new ATOM 0 HB3 HIS B 42 8.796 9.988 -11.247 1.00 0.00 H new ATOM 0 HD1 HIS B 42 11.731 7.570 -12.044 1.00 0.00 H new ATOM 0 HD2 HIS B 42 7.896 8.703 -13.381 1.00 0.00 H new ATOM 0 HE1 HIS B 42 11.363 6.431 -14.305 1.00 0.00 H new ATOM 2129 N PHE B 43 10.166 10.059 -7.990 1.00 0.00 N ATOM 2130 CA PHE B 43 9.649 10.670 -6.767 1.00 0.00 C ATOM 2131 C PHE B 43 10.764 10.922 -5.747 1.00 0.00 C ATOM 2132 O PHE B 43 10.726 11.919 -5.027 1.00 0.00 O ATOM 2133 CB PHE B 43 8.619 9.729 -6.112 1.00 0.00 C ATOM 2134 CG PHE B 43 7.178 9.764 -6.592 1.00 0.00 C ATOM 2135 CD1 PHE B 43 6.834 10.185 -7.891 1.00 0.00 C ATOM 2136 CD2 PHE B 43 6.167 9.303 -5.723 1.00 0.00 C ATOM 2137 CE1 PHE B 43 5.499 10.104 -8.326 1.00 0.00 C ATOM 2138 CE2 PHE B 43 4.835 9.208 -6.162 1.00 0.00 C ATOM 2139 CZ PHE B 43 4.508 9.578 -7.479 1.00 0.00 C ATOM 0 H PHE B 43 10.404 9.075 -7.869 1.00 0.00 H new ATOM 0 HA PHE B 43 9.194 11.620 -7.046 1.00 0.00 H new ATOM 0 HB2 PHE B 43 8.982 8.708 -6.234 1.00 0.00 H new ATOM 0 HB3 PHE B 43 8.615 9.940 -5.043 1.00 0.00 H new ATOM 0 HD1 PHE B 43 7.595 10.570 -8.553 1.00 0.00 H new ATOM 0 HD2 PHE B 43 6.419 9.021 -4.711 1.00 0.00 H new ATOM 0 HE1 PHE B 43 5.234 10.447 -9.315 1.00 0.00 H new ATOM 0 HE2 PHE B 43 4.067 8.853 -5.491 1.00 0.00 H new ATOM 0 HZ PHE B 43 3.497 9.458 -7.839 1.00 0.00 H new ATOM 2149 N LEU B 44 11.694 9.977 -5.606 1.00 0.00 N ATOM 2150 CA LEU B 44 12.691 9.933 -4.547 1.00 0.00 C ATOM 2151 C LEU B 44 14.074 9.831 -5.188 1.00 0.00 C ATOM 2152 O LEU B 44 14.240 9.126 -6.180 1.00 0.00 O ATOM 2153 CB LEU B 44 12.364 8.710 -3.671 1.00 0.00 C ATOM 2154 CG LEU B 44 12.673 8.874 -2.175 1.00 0.00 C ATOM 2155 CD1 LEU B 44 12.040 7.723 -1.386 1.00 0.00 C ATOM 2156 CD2 LEU B 44 14.169 8.891 -1.877 1.00 0.00 C ATOM 0 H LEU B 44 11.773 9.193 -6.254 1.00 0.00 H new ATOM 0 HA LEU B 44 12.683 10.828 -3.924 1.00 0.00 H new ATOM 0 HB2 LEU B 44 11.305 8.476 -3.783 1.00 0.00 H new ATOM 0 HB3 LEU B 44 12.922 7.853 -4.049 1.00 0.00 H new ATOM 0 HG LEU B 44 12.257 9.836 -1.876 1.00 0.00 H new ATOM 0 HD11 LEU B 44 12.262 7.844 -0.326 1.00 0.00 H new ATOM 0 HD12 LEU B 44 10.960 7.731 -1.534 1.00 0.00 H new ATOM 0 HD13 LEU B 44 12.447 6.775 -1.736 1.00 0.00 H new ATOM 0 HD21 LEU B 44 14.325 9.009 -0.805 1.00 0.00 H new ATOM 0 HD22 LEU B 44 14.617 7.954 -2.208 1.00 0.00 H new ATOM 0 HD23 LEU B 44 14.636 9.722 -2.405 1.00 0.00 H new ATOM 2168 N GLU B 45 15.058 10.549 -4.639 1.00 0.00 N ATOM 2169 CA GLU B 45 16.420 10.525 -5.154 1.00 0.00 C ATOM 2170 C GLU B 45 17.001 9.106 -5.115 1.00 0.00 C ATOM 2171 O GLU B 45 16.604 8.290 -4.285 1.00 0.00 O ATOM 2172 CB GLU B 45 17.312 11.481 -4.347 1.00 0.00 C ATOM 2173 CG GLU B 45 16.745 12.905 -4.249 1.00 0.00 C ATOM 2174 CD GLU B 45 16.445 13.511 -5.616 1.00 0.00 C ATOM 2175 OE1 GLU B 45 17.389 13.557 -6.435 1.00 0.00 O ATOM 2176 OE2 GLU B 45 15.278 13.910 -5.819 1.00 0.00 O ATOM 0 H GLU B 45 14.929 11.158 -3.831 1.00 0.00 H new ATOM 0 HA GLU B 45 16.392 10.854 -6.193 1.00 0.00 H new ATOM 0 HB2 GLU B 45 17.445 11.081 -3.342 1.00 0.00 H new ATOM 0 HB3 GLU B 45 18.299 11.521 -4.808 1.00 0.00 H new ATOM 0 HG2 GLU B 45 15.832 12.888 -3.654 1.00 0.00 H new ATOM 0 HG3 GLU B 45 17.457 13.540 -3.722 1.00 0.00 H new ATOM 2183 N GLU B 46 17.973 8.837 -5.993 1.00 0.00 N ATOM 2184 CA GLU B 46 18.724 7.598 -6.002 1.00 0.00 C ATOM 2185 C GLU B 46 19.418 7.397 -4.652 1.00 0.00 C ATOM 2186 O GLU B 46 19.754 8.362 -3.966 1.00 0.00 O ATOM 2187 CB GLU B 46 19.686 7.582 -7.196 1.00 0.00 C ATOM 2188 CG GLU B 46 20.883 8.494 -6.941 1.00 0.00 C ATOM 2189 CD GLU B 46 21.826 8.555 -8.137 1.00 0.00 C ATOM 2190 OE1 GLU B 46 21.377 9.066 -9.186 1.00 0.00 O ATOM 2191 OE2 GLU B 46 22.974 8.088 -7.980 1.00 0.00 O ATOM 0 H GLU B 46 18.257 9.490 -6.724 1.00 0.00 H new ATOM 0 HA GLU B 46 18.054 6.748 -6.132 1.00 0.00 H new ATOM 0 HB2 GLU B 46 20.031 6.564 -7.377 1.00 0.00 H new ATOM 0 HB3 GLU B 46 19.162 7.906 -8.095 1.00 0.00 H new ATOM 0 HG2 GLU B 46 20.529 9.498 -6.708 1.00 0.00 H new ATOM 0 HG3 GLU B 46 21.429 8.138 -6.068 1.00 0.00 H new ATOM 2198 N ILE B 47 19.627 6.138 -4.287 1.00 0.00 N ATOM 2199 CA ILE B 47 20.132 5.716 -2.989 1.00 0.00 C ATOM 2200 C ILE B 47 21.275 4.730 -3.213 1.00 0.00 C ATOM 2201 O ILE B 47 21.047 3.527 -3.328 1.00 0.00 O ATOM 2202 CB ILE B 47 19.014 5.118 -2.102 1.00 0.00 C ATOM 2203 CG1 ILE B 47 17.651 5.771 -2.390 1.00 0.00 C ATOM 2204 CG2 ILE B 47 19.429 5.291 -0.632 1.00 0.00 C ATOM 2205 CD1 ILE B 47 16.574 5.436 -1.357 1.00 0.00 C ATOM 0 H ILE B 47 19.442 5.354 -4.912 1.00 0.00 H new ATOM 0 HA ILE B 47 20.506 6.583 -2.445 1.00 0.00 H new ATOM 0 HB ILE B 47 18.892 4.058 -2.327 1.00 0.00 H new ATOM 0 HG12 ILE B 47 17.778 6.853 -2.430 1.00 0.00 H new ATOM 0 HG13 ILE B 47 17.308 5.454 -3.375 1.00 0.00 H new ATOM 0 HG21 ILE B 47 18.656 4.877 0.015 1.00 0.00 H new ATOM 0 HG22 ILE B 47 20.369 4.768 -0.455 1.00 0.00 H new ATOM 0 HG23 ILE B 47 19.557 6.351 -0.412 1.00 0.00 H new ATOM 0 HD11 ILE B 47 15.642 5.933 -1.628 1.00 0.00 H new ATOM 0 HD12 ILE B 47 16.416 4.358 -1.332 1.00 0.00 H new ATOM 0 HD13 ILE B 47 16.894 5.779 -0.373 1.00 0.00 H new ATOM 2217 N LYS B 48 22.500 5.253 -3.296 1.00 0.00 N ATOM 2218 CA LYS B 48 23.714 4.454 -3.411 1.00 0.00 C ATOM 2219 C LYS B 48 24.171 3.937 -2.041 1.00 0.00 C ATOM 2220 O LYS B 48 24.780 2.874 -1.937 1.00 0.00 O ATOM 2221 CB LYS B 48 24.811 5.267 -4.119 1.00 0.00 C ATOM 2222 CG LYS B 48 25.257 6.529 -3.362 1.00 0.00 C ATOM 2223 CD LYS B 48 26.312 7.286 -4.177 1.00 0.00 C ATOM 2224 CE LYS B 48 26.761 8.544 -3.426 1.00 0.00 C ATOM 2225 NZ LYS B 48 27.787 9.283 -4.182 1.00 0.00 N ATOM 0 H LYS B 48 22.675 6.258 -3.285 1.00 0.00 H new ATOM 0 HA LYS B 48 23.502 3.575 -4.019 1.00 0.00 H new ATOM 0 HB2 LYS B 48 25.679 4.626 -4.274 1.00 0.00 H new ATOM 0 HB3 LYS B 48 24.450 5.559 -5.105 1.00 0.00 H new ATOM 0 HG2 LYS B 48 24.398 7.174 -3.176 1.00 0.00 H new ATOM 0 HG3 LYS B 48 25.666 6.254 -2.390 1.00 0.00 H new ATOM 0 HD2 LYS B 48 27.170 6.640 -4.364 1.00 0.00 H new ATOM 0 HD3 LYS B 48 25.902 7.561 -5.149 1.00 0.00 H new ATOM 0 HE2 LYS B 48 25.901 9.190 -3.249 1.00 0.00 H new ATOM 0 HE3 LYS B 48 27.157 8.265 -2.449 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 28.070 10.129 -3.647 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 28.616 8.673 -4.329 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 27.400 9.570 -5.104 1.00 0.00 H new ATOM 2239 N GLU B 49 23.901 4.710 -0.985 1.00 0.00 N ATOM 2240 CA GLU B 49 24.442 4.478 0.345 1.00 0.00 C ATOM 2241 C GLU B 49 23.796 3.254 1.001 1.00 0.00 C ATOM 2242 O GLU B 49 22.762 3.375 1.656 1.00 0.00 O ATOM 2243 CB GLU B 49 24.267 5.743 1.197 1.00 0.00 C ATOM 2244 CG GLU B 49 24.984 6.946 0.560 1.00 0.00 C ATOM 2245 CD GLU B 49 25.006 8.177 1.462 1.00 0.00 C ATOM 2246 OE1 GLU B 49 24.270 8.171 2.475 1.00 0.00 O ATOM 2247 OE2 GLU B 49 25.761 9.111 1.117 1.00 0.00 O ATOM 0 H GLU B 49 23.290 5.525 -1.038 1.00 0.00 H new ATOM 0 HA GLU B 49 25.507 4.262 0.264 1.00 0.00 H new ATOM 0 HB2 GLU B 49 23.206 5.966 1.308 1.00 0.00 H new ATOM 0 HB3 GLU B 49 24.663 5.568 2.198 1.00 0.00 H new ATOM 0 HG2 GLU B 49 26.008 6.663 0.316 1.00 0.00 H new ATOM 0 HG3 GLU B 49 24.491 7.200 -0.379 1.00 0.00 H new ATOM 2254 N GLN B 50 24.434 2.087 0.855 1.00 0.00 N ATOM 2255 CA GLN B 50 23.972 0.811 1.396 1.00 0.00 C ATOM 2256 C GLN B 50 23.493 0.914 2.852 1.00 0.00 C ATOM 2257 O GLN B 50 22.502 0.292 3.222 1.00 0.00 O ATOM 2258 CB GLN B 50 25.057 -0.264 1.235 1.00 0.00 C ATOM 2259 CG GLN B 50 24.450 -1.668 1.394 1.00 0.00 C ATOM 2260 CD GLN B 50 25.498 -2.775 1.347 1.00 0.00 C ATOM 2261 OE1 GLN B 50 25.578 -3.595 2.255 1.00 0.00 O ATOM 2262 NE2 GLN B 50 26.300 -2.825 0.286 1.00 0.00 N ATOM 0 H GLN B 50 25.312 2.006 0.341 1.00 0.00 H new ATOM 0 HA GLN B 50 23.098 0.515 0.815 1.00 0.00 H new ATOM 0 HB2 GLN B 50 25.526 -0.173 0.255 1.00 0.00 H new ATOM 0 HB3 GLN B 50 25.840 -0.113 1.978 1.00 0.00 H new ATOM 0 HG2 GLN B 50 23.914 -1.722 2.342 1.00 0.00 H new ATOM 0 HG3 GLN B 50 23.718 -1.834 0.604 1.00 0.00 H new ATOM 0 HE21 GLN B 50 26.210 -2.129 -0.454 1.00 0.00 H new ATOM 0 HE22 GLN B 50 27.004 -3.559 0.213 1.00 0.00 H new ATOM 2271 N GLU B 51 24.161 1.716 3.685 1.00 0.00 N ATOM 2272 CA GLU B 51 23.742 1.890 5.070 1.00 0.00 C ATOM 2273 C GLU B 51 22.296 2.400 5.137 1.00 0.00 C ATOM 2274 O GLU B 51 21.496 1.931 5.945 1.00 0.00 O ATOM 2275 CB GLU B 51 24.695 2.853 5.797 1.00 0.00 C ATOM 2276 CG GLU B 51 26.179 2.475 5.658 1.00 0.00 C ATOM 2277 CD GLU B 51 26.445 1.019 6.034 1.00 0.00 C ATOM 2278 OE1 GLU B 51 26.298 0.709 7.235 1.00 0.00 O ATOM 2279 OE2 GLU B 51 26.775 0.246 5.108 1.00 0.00 O ATOM 0 H GLU B 51 24.989 2.251 3.423 1.00 0.00 H new ATOM 0 HA GLU B 51 23.782 0.922 5.570 1.00 0.00 H new ATOM 0 HB2 GLU B 51 24.547 3.860 5.407 1.00 0.00 H new ATOM 0 HB3 GLU B 51 24.433 2.880 6.855 1.00 0.00 H new ATOM 0 HG2 GLU B 51 26.501 2.647 4.631 1.00 0.00 H new ATOM 0 HG3 GLU B 51 26.779 3.127 6.293 1.00 0.00 H new ATOM 2286 N VAL B 52 21.947 3.344 4.264 1.00 0.00 N ATOM 2287 CA VAL B 52 20.611 3.906 4.209 1.00 0.00 C ATOM 2288 C VAL B 52 19.643 2.893 3.601 1.00 0.00 C ATOM 2289 O VAL B 52 18.543 2.733 4.126 1.00 0.00 O ATOM 2290 CB VAL B 52 20.611 5.238 3.443 1.00 0.00 C ATOM 2291 CG1 VAL B 52 19.200 5.838 3.429 1.00 0.00 C ATOM 2292 CG2 VAL B 52 21.588 6.227 4.097 1.00 0.00 C ATOM 0 H VAL B 52 22.589 3.737 3.576 1.00 0.00 H new ATOM 0 HA VAL B 52 20.272 4.123 5.222 1.00 0.00 H new ATOM 0 HB VAL B 52 20.930 5.050 2.418 1.00 0.00 H new ATOM 0 HG11 VAL B 52 19.211 6.782 2.884 1.00 0.00 H new ATOM 0 HG12 VAL B 52 18.515 5.145 2.941 1.00 0.00 H new ATOM 0 HG13 VAL B 52 18.869 6.014 4.453 1.00 0.00 H new ATOM 0 HG21 VAL B 52 21.579 7.167 3.545 1.00 0.00 H new ATOM 0 HG22 VAL B 52 21.286 6.409 5.128 1.00 0.00 H new ATOM 0 HG23 VAL B 52 22.594 5.808 4.083 1.00 0.00 H new ATOM 2302 N VAL B 53 20.018 2.207 2.513 1.00 0.00 N ATOM 2303 CA VAL B 53 19.121 1.221 1.920 1.00 0.00 C ATOM 2304 C VAL B 53 18.760 0.166 2.972 1.00 0.00 C ATOM 2305 O VAL B 53 17.591 -0.173 3.161 1.00 0.00 O ATOM 2306 CB VAL B 53 19.666 0.630 0.604 1.00 0.00 C ATOM 2307 CG1 VAL B 53 20.454 1.652 -0.221 1.00 0.00 C ATOM 2308 CG2 VAL B 53 20.439 -0.689 0.749 1.00 0.00 C ATOM 0 H VAL B 53 20.915 2.316 2.039 1.00 0.00 H new ATOM 0 HA VAL B 53 18.199 1.719 1.619 1.00 0.00 H new ATOM 0 HB VAL B 53 18.765 0.370 0.049 1.00 0.00 H new ATOM 0 HG11 VAL B 53 20.814 1.181 -1.136 1.00 0.00 H new ATOM 0 HG12 VAL B 53 19.807 2.491 -0.475 1.00 0.00 H new ATOM 0 HG13 VAL B 53 21.303 2.012 0.360 1.00 0.00 H new ATOM 0 HG21 VAL B 53 20.780 -1.021 -0.232 1.00 0.00 H new ATOM 0 HG22 VAL B 53 21.300 -0.536 1.400 1.00 0.00 H new ATOM 0 HG23 VAL B 53 19.787 -1.447 1.182 1.00 0.00 H new ATOM 2318 N ASP B 54 19.781 -0.299 3.700 1.00 0.00 N ATOM 2319 CA ASP B 54 19.633 -1.190 4.833 1.00 0.00 C ATOM 2320 C ASP B 54 18.722 -0.558 5.883 1.00 0.00 C ATOM 2321 O ASP B 54 17.804 -1.215 6.356 1.00 0.00 O ATOM 2322 CB ASP B 54 21.004 -1.541 5.418 1.00 0.00 C ATOM 2323 CG ASP B 54 20.863 -2.543 6.557 1.00 0.00 C ATOM 2324 OD1 ASP B 54 20.872 -3.755 6.248 1.00 0.00 O ATOM 2325 OD2 ASP B 54 20.738 -2.080 7.711 1.00 0.00 O ATOM 0 H ASP B 54 20.752 -0.055 3.505 1.00 0.00 H new ATOM 0 HA ASP B 54 19.168 -2.118 4.499 1.00 0.00 H new ATOM 0 HB2 ASP B 54 21.642 -1.957 4.638 1.00 0.00 H new ATOM 0 HB3 ASP B 54 21.492 -0.637 5.781 1.00 0.00 H new ATOM 2330 N LYS B 55 18.941 0.710 6.239 1.00 0.00 N ATOM 2331 CA LYS B 55 18.136 1.362 7.262 1.00 0.00 C ATOM 2332 C LYS B 55 16.654 1.393 6.875 1.00 0.00 C ATOM 2333 O LYS B 55 15.805 1.009 7.681 1.00 0.00 O ATOM 2334 CB LYS B 55 18.665 2.783 7.516 1.00 0.00 C ATOM 2335 CG LYS B 55 17.897 3.557 8.599 1.00 0.00 C ATOM 2336 CD LYS B 55 18.005 2.871 9.964 1.00 0.00 C ATOM 2337 CE LYS B 55 17.323 3.717 11.043 1.00 0.00 C ATOM 2338 NZ LYS B 55 17.416 3.069 12.363 1.00 0.00 N ATOM 0 H LYS B 55 19.667 1.300 5.833 1.00 0.00 H new ATOM 0 HA LYS B 55 18.218 0.784 8.182 1.00 0.00 H new ATOM 0 HB2 LYS B 55 19.714 2.722 7.804 1.00 0.00 H new ATOM 0 HB3 LYS B 55 18.623 3.346 6.584 1.00 0.00 H new ATOM 0 HG2 LYS B 55 18.289 4.572 8.669 1.00 0.00 H new ATOM 0 HG3 LYS B 55 16.848 3.639 8.314 1.00 0.00 H new ATOM 0 HD2 LYS B 55 17.543 1.885 9.920 1.00 0.00 H new ATOM 0 HD3 LYS B 55 19.054 2.720 10.220 1.00 0.00 H new ATOM 0 HE2 LYS B 55 17.788 4.702 11.085 1.00 0.00 H new ATOM 0 HE3 LYS B 55 16.276 3.869 10.782 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 16.946 3.663 13.075 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 16.951 2.139 12.327 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 18.416 2.946 12.620 1.00 0.00 H new ATOM 2352 N VAL B 56 16.322 1.854 5.662 1.00 0.00 N ATOM 2353 CA VAL B 56 14.923 2.032 5.279 1.00 0.00 C ATOM 2354 C VAL B 56 14.197 0.685 5.232 1.00 0.00 C ATOM 2355 O VAL B 56 13.046 0.597 5.651 1.00 0.00 O ATOM 2356 CB VAL B 56 14.747 2.853 3.983 1.00 0.00 C ATOM 2357 CG1 VAL B 56 15.330 4.268 4.116 1.00 0.00 C ATOM 2358 CG2 VAL B 56 15.328 2.178 2.741 1.00 0.00 C ATOM 0 H VAL B 56 16.997 2.107 4.940 1.00 0.00 H new ATOM 0 HA VAL B 56 14.451 2.633 6.056 1.00 0.00 H new ATOM 0 HB VAL B 56 13.668 2.917 3.843 1.00 0.00 H new ATOM 0 HG11 VAL B 56 15.185 4.811 3.182 1.00 0.00 H new ATOM 0 HG12 VAL B 56 14.824 4.795 4.925 1.00 0.00 H new ATOM 0 HG13 VAL B 56 16.396 4.203 4.336 1.00 0.00 H new ATOM 0 HG21 VAL B 56 15.166 2.815 1.871 1.00 0.00 H new ATOM 0 HG22 VAL B 56 16.397 2.019 2.880 1.00 0.00 H new ATOM 0 HG23 VAL B 56 14.836 1.218 2.585 1.00 0.00 H new ATOM 2368 N MET B 57 14.856 -0.373 4.751 1.00 0.00 N ATOM 2369 CA MET B 57 14.232 -1.690 4.722 1.00 0.00 C ATOM 2370 C MET B 57 14.189 -2.319 6.122 1.00 0.00 C ATOM 2371 O MET B 57 13.144 -2.815 6.541 1.00 0.00 O ATOM 2372 CB MET B 57 14.849 -2.551 3.615 1.00 0.00 C ATOM 2373 CG MET B 57 16.320 -2.928 3.796 1.00 0.00 C ATOM 2374 SD MET B 57 16.681 -4.527 4.553 1.00 0.00 S ATOM 2375 CE MET B 57 15.886 -5.618 3.352 1.00 0.00 C ATOM 0 H MET B 57 15.807 -0.341 4.383 1.00 0.00 H new ATOM 0 HA MET B 57 13.181 -1.601 4.448 1.00 0.00 H new ATOM 0 HB2 MET B 57 14.268 -3.469 3.530 1.00 0.00 H new ATOM 0 HB3 MET B 57 14.745 -2.020 2.669 1.00 0.00 H new ATOM 0 HG2 MET B 57 16.797 -2.904 2.816 1.00 0.00 H new ATOM 0 HG3 MET B 57 16.794 -2.155 4.400 1.00 0.00 H new ATOM 0 HE1 MET B 57 16.332 -6.611 3.412 1.00 0.00 H new ATOM 0 HE2 MET B 57 14.820 -5.685 3.571 1.00 0.00 H new ATOM 0 HE3 MET B 57 16.026 -5.217 2.348 1.00 0.00 H new ATOM 2385 N GLU B 58 15.274 -2.213 6.895 1.00 0.00 N ATOM 2386 CA GLU B 58 15.332 -2.657 8.285 1.00 0.00 C ATOM 2387 C GLU B 58 14.176 -2.044 9.076 1.00 0.00 C ATOM 2388 O GLU B 58 13.469 -2.743 9.797 1.00 0.00 O ATOM 2389 CB GLU B 58 16.685 -2.258 8.892 1.00 0.00 C ATOM 2390 CG GLU B 58 16.787 -2.594 10.384 1.00 0.00 C ATOM 2391 CD GLU B 58 18.175 -2.262 10.925 1.00 0.00 C ATOM 2392 OE1 GLU B 58 18.459 -1.050 11.044 1.00 0.00 O ATOM 2393 OE2 GLU B 58 18.920 -3.224 11.212 1.00 0.00 O ATOM 0 H GLU B 58 16.150 -1.809 6.564 1.00 0.00 H new ATOM 0 HA GLU B 58 15.236 -3.742 8.329 1.00 0.00 H new ATOM 0 HB2 GLU B 58 17.484 -2.767 8.354 1.00 0.00 H new ATOM 0 HB3 GLU B 58 16.839 -1.188 8.754 1.00 0.00 H new ATOM 0 HG2 GLU B 58 16.033 -2.035 10.939 1.00 0.00 H new ATOM 0 HG3 GLU B 58 16.576 -3.652 10.537 1.00 0.00 H new ATOM 2400 N THR B 59 13.939 -0.749 8.870 1.00 0.00 N ATOM 2401 CA THR B 59 12.879 0.001 9.532 1.00 0.00 C ATOM 2402 C THR B 59 11.522 -0.684 9.334 1.00 0.00 C ATOM 2403 O THR B 59 10.678 -0.621 10.226 1.00 0.00 O ATOM 2404 CB THR B 59 12.886 1.433 8.962 1.00 0.00 C ATOM 2405 OG1 THR B 59 14.024 2.117 9.443 1.00 0.00 O ATOM 2406 CG2 THR B 59 11.632 2.266 9.239 1.00 0.00 C ATOM 0 H THR B 59 14.491 -0.183 8.225 1.00 0.00 H new ATOM 0 HA THR B 59 13.052 0.037 10.608 1.00 0.00 H new ATOM 0 HB THR B 59 12.908 1.312 7.879 1.00 0.00 H new ATOM 0 HG1 THR B 59 14.811 1.849 8.923 1.00 0.00 H new ATOM 0 HG21 THR B 59 11.746 3.254 8.793 1.00 0.00 H new ATOM 0 HG22 THR B 59 10.763 1.770 8.806 1.00 0.00 H new ATOM 0 HG23 THR B 59 11.493 2.368 10.315 1.00 0.00 H new ATOM 2414 N LEU B 60 11.300 -1.331 8.185 1.00 0.00 N ATOM 2415 CA LEU B 60 10.048 -2.011 7.879 1.00 0.00 C ATOM 2416 C LEU B 60 10.147 -3.532 7.981 1.00 0.00 C ATOM 2417 O LEU B 60 9.207 -4.219 7.603 1.00 0.00 O ATOM 2418 CB LEU B 60 9.567 -1.589 6.491 1.00 0.00 C ATOM 2419 CG LEU B 60 9.449 -0.064 6.341 1.00 0.00 C ATOM 2420 CD1 LEU B 60 8.934 0.248 4.937 1.00 0.00 C ATOM 2421 CD2 LEU B 60 8.485 0.534 7.373 1.00 0.00 C ATOM 0 H LEU B 60 11.993 -1.395 7.439 1.00 0.00 H new ATOM 0 HA LEU B 60 9.321 -1.709 8.633 1.00 0.00 H new ATOM 0 HB2 LEU B 60 10.258 -1.971 5.740 1.00 0.00 H new ATOM 0 HB3 LEU B 60 8.597 -2.045 6.293 1.00 0.00 H new ATOM 0 HG LEU B 60 10.432 0.376 6.505 1.00 0.00 H new ATOM 0 HD11 LEU B 60 8.844 1.327 4.814 1.00 0.00 H new ATOM 0 HD12 LEU B 60 9.632 -0.145 4.198 1.00 0.00 H new ATOM 0 HD13 LEU B 60 7.958 -0.216 4.796 1.00 0.00 H new ATOM 0 HD21 LEU B 60 8.428 1.614 7.235 1.00 0.00 H new ATOM 0 HD22 LEU B 60 7.494 0.099 7.241 1.00 0.00 H new ATOM 0 HD23 LEU B 60 8.846 0.315 8.378 1.00 0.00 H new ATOM 2433 N ASP B 61 11.258 -4.083 8.472 1.00 0.00 N ATOM 2434 CA ASP B 61 11.460 -5.531 8.547 1.00 0.00 C ATOM 2435 C ASP B 61 10.622 -6.151 9.677 1.00 0.00 C ATOM 2436 O ASP B 61 11.153 -6.687 10.649 1.00 0.00 O ATOM 2437 CB ASP B 61 12.957 -5.841 8.672 1.00 0.00 C ATOM 2438 CG ASP B 61 13.259 -7.332 8.834 1.00 0.00 C ATOM 2439 OD1 ASP B 61 12.477 -8.164 8.320 1.00 0.00 O ATOM 2440 OD2 ASP B 61 14.284 -7.634 9.483 1.00 0.00 O ATOM 0 H ASP B 61 12.043 -3.538 8.829 1.00 0.00 H new ATOM 0 HA ASP B 61 11.107 -5.993 7.625 1.00 0.00 H new ATOM 0 HB2 ASP B 61 13.473 -5.468 7.787 1.00 0.00 H new ATOM 0 HB3 ASP B 61 13.362 -5.301 9.528 1.00 0.00 H new ATOM 2445 N SER B 62 9.296 -6.120 9.519 1.00 0.00 N ATOM 2446 CA SER B 62 8.323 -6.699 10.437 1.00 0.00 C ATOM 2447 C SER B 62 8.654 -8.162 10.725 1.00 0.00 C ATOM 2448 O SER B 62 8.494 -8.642 11.844 1.00 0.00 O ATOM 2449 CB SER B 62 6.932 -6.578 9.808 1.00 0.00 C ATOM 2450 OG SER B 62 6.902 -7.281 8.582 1.00 0.00 O ATOM 0 H SER B 62 8.858 -5.672 8.714 1.00 0.00 H new ATOM 0 HA SER B 62 8.350 -6.163 11.386 1.00 0.00 H new ATOM 0 HB2 SER B 62 6.179 -6.979 10.487 1.00 0.00 H new ATOM 0 HB3 SER B 62 6.687 -5.529 9.643 1.00 0.00 H new ATOM 0 HG SER B 62 5.973 -7.479 8.341 1.00 0.00 H new ATOM 2456 N ASP B 63 9.136 -8.861 9.694 1.00 0.00 N ATOM 2457 CA ASP B 63 9.430 -10.282 9.734 1.00 0.00 C ATOM 2458 C ASP B 63 10.670 -10.579 10.579 1.00 0.00 C ATOM 2459 O ASP B 63 10.914 -11.741 10.891 1.00 0.00 O ATOM 2460 CB ASP B 63 9.692 -10.784 8.306 1.00 0.00 C ATOM 2461 CG ASP B 63 8.555 -10.476 7.340 1.00 0.00 C ATOM 2462 OD1 ASP B 63 8.471 -9.296 6.932 1.00 0.00 O ATOM 2463 OD2 ASP B 63 7.812 -11.423 7.002 1.00 0.00 O ATOM 0 H ASP B 63 9.335 -8.436 8.788 1.00 0.00 H new ATOM 0 HA ASP B 63 8.573 -10.786 10.180 1.00 0.00 H new ATOM 0 HB2 ASP B 63 10.610 -10.331 7.932 1.00 0.00 H new ATOM 0 HB3 ASP B 63 9.856 -11.861 8.332 1.00 0.00 H new ATOM 2468 N GLY B 64 11.482 -9.566 10.908 1.00 0.00 N ATOM 2469 CA GLY B 64 12.767 -9.778 11.562 1.00 0.00 C ATOM 2470 C GLY B 64 13.639 -10.748 10.760 1.00 0.00 C ATOM 2471 O GLY B 64 14.373 -11.546 11.337 1.00 0.00 O ATOM 0 H GLY B 64 11.264 -8.586 10.727 1.00 0.00 H new ATOM 0 HA2 GLY B 64 13.284 -8.825 11.672 1.00 0.00 H new ATOM 0 HA3 GLY B 64 12.607 -10.172 12.566 1.00 0.00 H new ATOM 2475 N ASP B 65 13.545 -10.679 9.427 1.00 0.00 N ATOM 2476 CA ASP B 65 14.184 -11.604 8.495 1.00 0.00 C ATOM 2477 C ASP B 65 15.196 -10.862 7.619 1.00 0.00 C ATOM 2478 O ASP B 65 15.709 -11.411 6.647 1.00 0.00 O ATOM 2479 CB ASP B 65 13.082 -12.250 7.639 1.00 0.00 C ATOM 2480 CG ASP B 65 13.611 -13.327 6.694 1.00 0.00 C ATOM 2481 OD1 ASP B 65 14.194 -14.302 7.214 1.00 0.00 O ATOM 2482 OD2 ASP B 65 13.404 -13.163 5.471 1.00 0.00 O ATOM 0 H ASP B 65 13.004 -9.953 8.956 1.00 0.00 H new ATOM 0 HA ASP B 65 14.729 -12.376 9.038 1.00 0.00 H new ATOM 0 HB2 ASP B 65 12.330 -12.688 8.296 1.00 0.00 H new ATOM 0 HB3 ASP B 65 12.583 -11.476 7.055 1.00 0.00 H new ATOM 2487 N GLY B 66 15.461 -9.588 7.921 1.00 0.00 N ATOM 2488 CA GLY B 66 16.224 -8.709 7.058 1.00 0.00 C ATOM 2489 C GLY B 66 15.372 -8.319 5.855 1.00 0.00 C ATOM 2490 O GLY B 66 14.967 -7.168 5.717 1.00 0.00 O ATOM 0 H GLY B 66 15.145 -9.142 8.782 1.00 0.00 H new ATOM 0 HA2 GLY B 66 16.529 -7.818 7.606 1.00 0.00 H new ATOM 0 HA3 GLY B 66 17.135 -9.207 6.727 1.00 0.00 H new ATOM 2494 N GLU B 67 15.092 -9.300 4.997 1.00 0.00 N ATOM 2495 CA GLU B 67 14.359 -9.148 3.758 1.00 0.00 C ATOM 2496 C GLU B 67 12.993 -8.501 4.012 1.00 0.00 C ATOM 2497 O GLU B 67 12.227 -8.981 4.846 1.00 0.00 O ATOM 2498 CB GLU B 67 14.190 -10.516 3.086 1.00 0.00 C ATOM 2499 CG GLU B 67 15.487 -11.337 3.011 1.00 0.00 C ATOM 2500 CD GLU B 67 15.350 -12.583 2.139 1.00 0.00 C ATOM 2501 OE1 GLU B 67 14.202 -12.925 1.782 1.00 0.00 O ATOM 2502 OE2 GLU B 67 16.409 -13.170 1.829 1.00 0.00 O ATOM 0 H GLU B 67 15.387 -10.262 5.162 1.00 0.00 H new ATOM 0 HA GLU B 67 14.923 -8.493 3.094 1.00 0.00 H new ATOM 0 HB2 GLU B 67 13.440 -11.088 3.633 1.00 0.00 H new ATOM 0 HB3 GLU B 67 13.806 -10.369 2.077 1.00 0.00 H new ATOM 0 HG2 GLU B 67 16.286 -10.710 2.617 1.00 0.00 H new ATOM 0 HG3 GLU B 67 15.782 -11.634 4.017 1.00 0.00 H new ATOM 2509 N CYS B 68 12.684 -7.420 3.292 1.00 0.00 N ATOM 2510 CA CYS B 68 11.421 -6.706 3.465 1.00 0.00 C ATOM 2511 C CYS B 68 10.337 -7.465 2.708 1.00 0.00 C ATOM 2512 O CYS B 68 10.476 -7.684 1.506 1.00 0.00 O ATOM 2513 CB CYS B 68 11.528 -5.251 2.980 1.00 0.00 C ATOM 2514 SG CYS B 68 11.429 -4.135 4.393 1.00 0.00 S ATOM 0 H CYS B 68 13.296 -7.020 2.581 1.00 0.00 H new ATOM 0 HA CYS B 68 11.167 -6.660 4.524 1.00 0.00 H new ATOM 0 HB2 CYS B 68 12.469 -5.102 2.451 1.00 0.00 H new ATOM 0 HB3 CYS B 68 10.727 -5.032 2.274 1.00 0.00 H new ATOM 0 HG CYS B 68 12.597 -4.045 4.958 1.00 0.00 H new ATOM 2520 N ASP B 69 9.285 -7.901 3.405 1.00 0.00 N ATOM 2521 CA ASP B 69 8.244 -8.732 2.823 1.00 0.00 C ATOM 2522 C ASP B 69 7.361 -7.904 1.889 1.00 0.00 C ATOM 2523 O ASP B 69 7.294 -6.682 2.017 1.00 0.00 O ATOM 2524 CB ASP B 69 7.451 -9.407 3.949 1.00 0.00 C ATOM 2525 CG ASP B 69 6.365 -10.339 3.428 1.00 0.00 C ATOM 2526 OD1 ASP B 69 5.252 -9.831 3.167 1.00 0.00 O ATOM 2527 OD2 ASP B 69 6.669 -11.543 3.278 1.00 0.00 O ATOM 0 H ASP B 69 9.136 -7.684 4.390 1.00 0.00 H new ATOM 0 HA ASP B 69 8.686 -9.518 2.211 1.00 0.00 H new ATOM 0 HB2 ASP B 69 8.136 -9.972 4.582 1.00 0.00 H new ATOM 0 HB3 ASP B 69 6.996 -8.641 4.577 1.00 0.00 H new ATOM 2532 N PHE B 70 6.662 -8.569 0.967 1.00 0.00 N ATOM 2533 CA PHE B 70 5.727 -7.925 0.058 1.00 0.00 C ATOM 2534 C PHE B 70 4.761 -6.995 0.807 1.00 0.00 C ATOM 2535 O PHE B 70 4.527 -5.873 0.369 1.00 0.00 O ATOM 2536 CB PHE B 70 4.993 -8.976 -0.779 1.00 0.00 C ATOM 2537 CG PHE B 70 4.181 -8.362 -1.897 1.00 0.00 C ATOM 2538 CD1 PHE B 70 4.840 -7.925 -3.056 1.00 0.00 C ATOM 2539 CD2 PHE B 70 2.832 -8.031 -1.701 1.00 0.00 C ATOM 2540 CE1 PHE B 70 4.172 -7.143 -4.008 1.00 0.00 C ATOM 2541 CE2 PHE B 70 2.150 -7.271 -2.666 1.00 0.00 C ATOM 2542 CZ PHE B 70 2.825 -6.811 -3.812 1.00 0.00 C ATOM 0 H PHE B 70 6.733 -9.578 0.834 1.00 0.00 H new ATOM 0 HA PHE B 70 6.290 -7.291 -0.627 1.00 0.00 H new ATOM 0 HB2 PHE B 70 5.719 -9.671 -1.201 1.00 0.00 H new ATOM 0 HB3 PHE B 70 4.335 -9.556 -0.132 1.00 0.00 H new ATOM 0 HD1 PHE B 70 5.874 -8.194 -3.216 1.00 0.00 H new ATOM 0 HD2 PHE B 70 2.318 -8.360 -0.810 1.00 0.00 H new ATOM 0 HE1 PHE B 70 4.693 -6.798 -4.889 1.00 0.00 H new ATOM 0 HE2 PHE B 70 1.104 -7.039 -2.528 1.00 0.00 H new ATOM 0 HZ PHE B 70 2.306 -6.204 -4.539 1.00 0.00 H new ATOM 2552 N GLN B 71 4.251 -7.426 1.966 1.00 0.00 N ATOM 2553 CA GLN B 71 3.461 -6.577 2.859 1.00 0.00 C ATOM 2554 C GLN B 71 4.174 -5.250 3.155 1.00 0.00 C ATOM 2555 O GLN B 71 3.587 -4.175 3.063 1.00 0.00 O ATOM 2556 CB GLN B 71 3.225 -7.326 4.178 1.00 0.00 C ATOM 2557 CG GLN B 71 2.228 -8.485 4.039 1.00 0.00 C ATOM 2558 CD GLN B 71 0.789 -8.007 4.217 1.00 0.00 C ATOM 2559 OE1 GLN B 71 0.295 -7.937 5.337 1.00 0.00 O ATOM 2560 NE2 GLN B 71 0.090 -7.670 3.139 1.00 0.00 N ATOM 0 H GLN B 71 4.376 -8.378 2.311 1.00 0.00 H new ATOM 0 HA GLN B 71 2.515 -6.350 2.367 1.00 0.00 H new ATOM 0 HB2 GLN B 71 4.176 -7.714 4.545 1.00 0.00 H new ATOM 0 HB3 GLN B 71 2.857 -6.625 4.927 1.00 0.00 H new ATOM 0 HG2 GLN B 71 2.340 -8.948 3.059 1.00 0.00 H new ATOM 0 HG3 GLN B 71 2.453 -9.251 4.781 1.00 0.00 H new ATOM 0 HE21 GLN B 71 0.516 -7.734 2.214 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -0.873 -7.347 3.236 1.00 0.00 H new ATOM 2569 N GLU B 72 5.447 -5.328 3.539 1.00 0.00 N ATOM 2570 CA GLU B 72 6.234 -4.182 3.965 1.00 0.00 C ATOM 2571 C GLU B 72 6.526 -3.276 2.770 1.00 0.00 C ATOM 2572 O GLU B 72 6.445 -2.054 2.869 1.00 0.00 O ATOM 2573 CB GLU B 72 7.499 -4.681 4.673 1.00 0.00 C ATOM 2574 CG GLU B 72 7.140 -5.620 5.838 1.00 0.00 C ATOM 2575 CD GLU B 72 6.146 -4.992 6.814 1.00 0.00 C ATOM 2576 OE1 GLU B 72 6.336 -3.809 7.166 1.00 0.00 O ATOM 2577 OE2 GLU B 72 5.198 -5.718 7.187 1.00 0.00 O ATOM 0 H GLU B 72 5.965 -6.206 3.562 1.00 0.00 H new ATOM 0 HA GLU B 72 5.680 -3.575 4.681 1.00 0.00 H new ATOM 0 HB2 GLU B 72 8.137 -5.205 3.961 1.00 0.00 H new ATOM 0 HB3 GLU B 72 8.070 -3.832 5.048 1.00 0.00 H new ATOM 0 HG2 GLU B 72 6.718 -6.543 5.439 1.00 0.00 H new ATOM 0 HG3 GLU B 72 8.049 -5.891 6.375 1.00 0.00 H new ATOM 2584 N PHE B 73 6.813 -3.885 1.620 1.00 0.00 N ATOM 2585 CA PHE B 73 6.891 -3.166 0.357 1.00 0.00 C ATOM 2586 C PHE B 73 5.582 -2.399 0.123 1.00 0.00 C ATOM 2587 O PHE B 73 5.619 -1.187 -0.075 1.00 0.00 O ATOM 2588 CB PHE B 73 7.241 -4.149 -0.765 1.00 0.00 C ATOM 2589 CG PHE B 73 6.853 -3.731 -2.173 1.00 0.00 C ATOM 2590 CD1 PHE B 73 7.748 -2.992 -2.971 1.00 0.00 C ATOM 2591 CD2 PHE B 73 5.648 -4.200 -2.734 1.00 0.00 C ATOM 2592 CE1 PHE B 73 7.466 -2.779 -4.334 1.00 0.00 C ATOM 2593 CE2 PHE B 73 5.351 -3.948 -4.084 1.00 0.00 C ATOM 2594 CZ PHE B 73 6.283 -3.280 -4.895 1.00 0.00 C ATOM 0 H PHE B 73 6.996 -4.885 1.542 1.00 0.00 H new ATOM 0 HA PHE B 73 7.686 -2.420 0.377 1.00 0.00 H new ATOM 0 HB2 PHE B 73 8.317 -4.323 -0.744 1.00 0.00 H new ATOM 0 HB3 PHE B 73 6.760 -5.102 -0.547 1.00 0.00 H new ATOM 0 HD1 PHE B 73 8.651 -2.589 -2.537 1.00 0.00 H new ATOM 0 HD2 PHE B 73 4.951 -4.755 -2.124 1.00 0.00 H new ATOM 0 HE1 PHE B 73 8.163 -2.228 -4.949 1.00 0.00 H new ATOM 0 HE2 PHE B 73 4.406 -4.268 -4.498 1.00 0.00 H new ATOM 0 HZ PHE B 73 6.089 -3.152 -5.950 1.00 0.00 H new ATOM 2604 N MET B 74 4.427 -3.070 0.203 1.00 0.00 N ATOM 2605 CA MET B 74 3.134 -2.413 0.043 1.00 0.00 C ATOM 2606 C MET B 74 2.944 -1.286 1.062 1.00 0.00 C ATOM 2607 O MET B 74 2.402 -0.239 0.723 1.00 0.00 O ATOM 2608 CB MET B 74 1.970 -3.416 0.093 1.00 0.00 C ATOM 2609 CG MET B 74 1.913 -4.342 -1.131 1.00 0.00 C ATOM 2610 SD MET B 74 1.778 -3.575 -2.774 1.00 0.00 S ATOM 2611 CE MET B 74 0.171 -2.756 -2.651 1.00 0.00 C ATOM 0 H MET B 74 4.367 -4.073 0.379 1.00 0.00 H new ATOM 0 HA MET B 74 3.128 -1.962 -0.949 1.00 0.00 H new ATOM 0 HB2 MET B 74 2.060 -4.022 0.994 1.00 0.00 H new ATOM 0 HB3 MET B 74 1.031 -2.868 0.170 1.00 0.00 H new ATOM 0 HG2 MET B 74 2.810 -4.961 -1.124 1.00 0.00 H new ATOM 0 HG3 MET B 74 1.063 -5.012 -1.004 1.00 0.00 H new ATOM 0 HE1 MET B 74 -0.032 -2.213 -3.574 1.00 0.00 H new ATOM 0 HE2 MET B 74 -0.607 -3.503 -2.491 1.00 0.00 H new ATOM 0 HE3 MET B 74 0.181 -2.058 -1.814 1.00 0.00 H new ATOM 2621 N ALA B 75 3.394 -1.475 2.302 1.00 0.00 N ATOM 2622 CA ALA B 75 3.332 -0.439 3.331 1.00 0.00 C ATOM 2623 C ALA B 75 4.183 0.779 2.946 1.00 0.00 C ATOM 2624 O ALA B 75 3.730 1.921 3.046 1.00 0.00 O ATOM 2625 CB ALA B 75 3.757 -1.010 4.687 1.00 0.00 C ATOM 0 H ALA B 75 3.811 -2.350 2.621 1.00 0.00 H new ATOM 0 HA ALA B 75 2.300 -0.099 3.413 1.00 0.00 H new ATOM 0 HB1 ALA B 75 3.706 -0.227 5.444 1.00 0.00 H new ATOM 0 HB2 ALA B 75 3.089 -1.826 4.964 1.00 0.00 H new ATOM 0 HB3 ALA B 75 4.779 -1.384 4.620 1.00 0.00 H new ATOM 2631 N PHE B 76 5.418 0.543 2.493 1.00 0.00 N ATOM 2632 CA PHE B 76 6.312 1.606 2.049 1.00 0.00 C ATOM 2633 C PHE B 76 5.653 2.357 0.889 1.00 0.00 C ATOM 2634 O PHE B 76 5.480 3.574 0.927 1.00 0.00 O ATOM 2635 CB PHE B 76 7.677 1.033 1.656 1.00 0.00 C ATOM 2636 CG PHE B 76 8.648 2.060 1.114 1.00 0.00 C ATOM 2637 CD1 PHE B 76 9.421 2.874 1.971 1.00 0.00 C ATOM 2638 CD2 PHE B 76 8.762 2.201 -0.280 1.00 0.00 C ATOM 2639 CE1 PHE B 76 10.272 3.851 1.420 1.00 0.00 C ATOM 2640 CE2 PHE B 76 9.635 3.152 -0.823 1.00 0.00 C ATOM 2641 CZ PHE B 76 10.370 3.998 0.023 1.00 0.00 C ATOM 0 H PHE B 76 5.822 -0.391 2.425 1.00 0.00 H new ATOM 0 HA PHE B 76 6.487 2.309 2.864 1.00 0.00 H new ATOM 0 HB2 PHE B 76 8.122 0.553 2.528 1.00 0.00 H new ATOM 0 HB3 PHE B 76 7.530 0.257 0.905 1.00 0.00 H new ATOM 0 HD1 PHE B 76 9.360 2.748 3.042 1.00 0.00 H new ATOM 0 HD2 PHE B 76 8.175 1.574 -0.934 1.00 0.00 H new ATOM 0 HE1 PHE B 76 10.851 4.489 2.071 1.00 0.00 H new ATOM 0 HE2 PHE B 76 9.743 3.235 -1.894 1.00 0.00 H new ATOM 0 HZ PHE B 76 11.009 4.760 -0.397 1.00 0.00 H new ATOM 2651 N VAL B 77 5.220 1.604 -0.123 1.00 0.00 N ATOM 2652 CA VAL B 77 4.474 2.138 -1.250 1.00 0.00 C ATOM 2653 C VAL B 77 3.295 2.968 -0.734 1.00 0.00 C ATOM 2654 O VAL B 77 3.091 4.084 -1.202 1.00 0.00 O ATOM 2655 CB VAL B 77 4.041 0.982 -2.171 1.00 0.00 C ATOM 2656 CG1 VAL B 77 3.031 1.433 -3.236 1.00 0.00 C ATOM 2657 CG2 VAL B 77 5.257 0.389 -2.897 1.00 0.00 C ATOM 0 H VAL B 77 5.382 0.598 -0.179 1.00 0.00 H new ATOM 0 HA VAL B 77 5.097 2.805 -1.846 1.00 0.00 H new ATOM 0 HB VAL B 77 3.571 0.238 -1.528 1.00 0.00 H new ATOM 0 HG11 VAL B 77 2.757 0.583 -3.860 1.00 0.00 H new ATOM 0 HG12 VAL B 77 2.140 1.828 -2.748 1.00 0.00 H new ATOM 0 HG13 VAL B 77 3.479 2.209 -3.857 1.00 0.00 H new ATOM 0 HG21 VAL B 77 4.933 -0.427 -3.543 1.00 0.00 H new ATOM 0 HG22 VAL B 77 5.734 1.162 -3.500 1.00 0.00 H new ATOM 0 HG23 VAL B 77 5.969 0.010 -2.164 1.00 0.00 H new ATOM 2667 N ALA B 78 2.533 2.460 0.238 1.00 0.00 N ATOM 2668 CA ALA B 78 1.385 3.167 0.783 1.00 0.00 C ATOM 2669 C ALA B 78 1.771 4.526 1.358 1.00 0.00 C ATOM 2670 O ALA B 78 1.170 5.529 0.973 1.00 0.00 O ATOM 2671 CB ALA B 78 0.626 2.306 1.797 1.00 0.00 C ATOM 0 H ALA B 78 2.699 1.548 0.665 1.00 0.00 H new ATOM 0 HA ALA B 78 0.703 3.363 -0.045 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -0.226 2.865 2.184 1.00 0.00 H new ATOM 0 HB2 ALA B 78 0.272 1.397 1.310 1.00 0.00 H new ATOM 0 HB3 ALA B 78 1.291 2.042 2.620 1.00 0.00 H new ATOM 2677 N MET B 79 2.767 4.592 2.252 1.00 0.00 N ATOM 2678 CA MET B 79 3.164 5.884 2.813 1.00 0.00 C ATOM 2679 C MET B 79 3.585 6.860 1.705 1.00 0.00 C ATOM 2680 O MET B 79 3.163 8.019 1.698 1.00 0.00 O ATOM 2681 CB MET B 79 4.218 5.754 3.931 1.00 0.00 C ATOM 2682 CG MET B 79 5.526 5.073 3.522 1.00 0.00 C ATOM 2683 SD MET B 79 6.922 5.195 4.671 1.00 0.00 S ATOM 2684 CE MET B 79 6.365 4.116 6.003 1.00 0.00 C ATOM 0 H MET B 79 3.297 3.790 2.592 1.00 0.00 H new ATOM 0 HA MET B 79 2.286 6.308 3.299 1.00 0.00 H new ATOM 0 HB2 MET B 79 4.449 6.751 4.307 1.00 0.00 H new ATOM 0 HB3 MET B 79 3.780 5.195 4.758 1.00 0.00 H new ATOM 0 HG2 MET B 79 5.318 4.016 3.355 1.00 0.00 H new ATOM 0 HG3 MET B 79 5.839 5.491 2.565 1.00 0.00 H new ATOM 0 HE1 MET B 79 7.120 4.088 6.788 1.00 0.00 H new ATOM 0 HE2 MET B 79 5.430 4.497 6.413 1.00 0.00 H new ATOM 0 HE3 MET B 79 6.208 3.110 5.615 1.00 0.00 H new ATOM 2694 N ILE B 80 4.396 6.391 0.751 1.00 0.00 N ATOM 2695 CA ILE B 80 4.894 7.223 -0.340 1.00 0.00 C ATOM 2696 C ILE B 80 3.713 7.753 -1.162 1.00 0.00 C ATOM 2697 O ILE B 80 3.568 8.957 -1.373 1.00 0.00 O ATOM 2698 CB ILE B 80 5.880 6.411 -1.203 1.00 0.00 C ATOM 2699 CG1 ILE B 80 7.113 5.930 -0.410 1.00 0.00 C ATOM 2700 CG2 ILE B 80 6.307 7.191 -2.453 1.00 0.00 C ATOM 2701 CD1 ILE B 80 8.178 6.992 -0.145 1.00 0.00 C ATOM 0 H ILE B 80 4.723 5.425 0.717 1.00 0.00 H new ATOM 0 HA ILE B 80 5.434 8.082 0.059 1.00 0.00 H new ATOM 0 HB ILE B 80 5.340 5.519 -1.522 1.00 0.00 H new ATOM 0 HG12 ILE B 80 6.775 5.532 0.547 1.00 0.00 H new ATOM 0 HG13 ILE B 80 7.574 5.105 -0.954 1.00 0.00 H new ATOM 0 HG21 ILE B 80 7.002 6.589 -3.038 1.00 0.00 H new ATOM 0 HG22 ILE B 80 5.429 7.420 -3.056 1.00 0.00 H new ATOM 0 HG23 ILE B 80 6.794 8.119 -2.154 1.00 0.00 H new ATOM 0 HD11 ILE B 80 9.000 6.550 0.418 1.00 0.00 H new ATOM 0 HD12 ILE B 80 8.553 7.376 -1.094 1.00 0.00 H new ATOM 0 HD13 ILE B 80 7.742 7.809 0.430 1.00 0.00 H new ATOM 2713 N THR B 81 2.859 6.839 -1.623 1.00 0.00 N ATOM 2714 CA THR B 81 1.698 7.156 -2.437 1.00 0.00 C ATOM 2715 C THR B 81 0.775 8.119 -1.682 1.00 0.00 C ATOM 2716 O THR B 81 0.254 9.056 -2.275 1.00 0.00 O ATOM 2717 CB THR B 81 0.962 5.859 -2.806 1.00 0.00 C ATOM 2718 OG1 THR B 81 1.845 4.963 -3.441 1.00 0.00 O ATOM 2719 CG2 THR B 81 -0.203 6.095 -3.766 1.00 0.00 C ATOM 0 H THR B 81 2.961 5.842 -1.435 1.00 0.00 H new ATOM 0 HA THR B 81 2.017 7.647 -3.356 1.00 0.00 H new ATOM 0 HB THR B 81 0.579 5.454 -1.869 1.00 0.00 H new ATOM 0 HG1 THR B 81 2.386 4.503 -2.766 1.00 0.00 H new ATOM 0 HG21 THR B 81 -0.686 5.145 -3.992 1.00 0.00 H new ATOM 0 HG22 THR B 81 -0.925 6.768 -3.304 1.00 0.00 H new ATOM 0 HG23 THR B 81 0.170 6.541 -4.688 1.00 0.00 H new ATOM 2727 N THR B 82 0.558 7.899 -0.381 1.00 0.00 N ATOM 2728 CA THR B 82 -0.281 8.771 0.431 1.00 0.00 C ATOM 2729 C THR B 82 0.314 10.178 0.487 1.00 0.00 C ATOM 2730 O THR B 82 -0.391 11.150 0.211 1.00 0.00 O ATOM 2731 CB THR B 82 -0.508 8.147 1.816 1.00 0.00 C ATOM 2732 OG1 THR B 82 -1.118 6.885 1.643 1.00 0.00 O ATOM 2733 CG2 THR B 82 -1.440 8.989 2.690 1.00 0.00 C ATOM 0 H THR B 82 0.959 7.114 0.132 1.00 0.00 H new ATOM 0 HA THR B 82 -1.265 8.872 -0.028 1.00 0.00 H new ATOM 0 HB THR B 82 0.462 8.079 2.308 1.00 0.00 H new ATOM 0 HG1 THR B 82 -0.442 6.229 1.372 1.00 0.00 H new ATOM 0 HG21 THR B 82 -1.568 8.504 3.658 1.00 0.00 H new ATOM 0 HG22 THR B 82 -1.008 9.979 2.834 1.00 0.00 H new ATOM 0 HG23 THR B 82 -2.410 9.084 2.201 1.00 0.00 H new ATOM 2741 N ALA B 83 1.613 10.297 0.794 1.00 0.00 N ATOM 2742 CA ALA B 83 2.290 11.589 0.780 1.00 0.00 C ATOM 2743 C ALA B 83 2.097 12.270 -0.580 1.00 0.00 C ATOM 2744 O ALA B 83 1.718 13.438 -0.664 1.00 0.00 O ATOM 2745 CB ALA B 83 3.774 11.399 1.100 1.00 0.00 C ATOM 0 H ALA B 83 2.210 9.512 1.054 1.00 0.00 H new ATOM 0 HA ALA B 83 1.856 12.235 1.543 1.00 0.00 H new ATOM 0 HB1 ALA B 83 4.276 12.367 1.088 1.00 0.00 H new ATOM 0 HB2 ALA B 83 3.879 10.948 2.087 1.00 0.00 H new ATOM 0 HB3 ALA B 83 4.227 10.747 0.353 1.00 0.00 H new ATOM 2751 N CYS B 84 2.288 11.509 -1.660 1.00 0.00 N ATOM 2752 CA CYS B 84 2.036 12.023 -2.996 1.00 0.00 C ATOM 2753 C CYS B 84 0.581 12.454 -3.174 1.00 0.00 C ATOM 2754 O CYS B 84 0.340 13.524 -3.717 1.00 0.00 O ATOM 2755 CB CYS B 84 2.484 11.035 -4.067 1.00 0.00 C ATOM 2756 SG CYS B 84 2.168 11.803 -5.675 1.00 0.00 S ATOM 0 H CYS B 84 2.614 10.543 -1.630 1.00 0.00 H new ATOM 0 HA CYS B 84 2.641 12.921 -3.121 1.00 0.00 H new ATOM 0 HB2 CYS B 84 3.543 10.801 -3.955 1.00 0.00 H new ATOM 0 HB3 CYS B 84 1.938 10.096 -3.976 1.00 0.00 H new ATOM 0 HG CYS B 84 2.885 11.214 -6.585 1.00 0.00 H new ATOM 2762 N HIS B 85 -0.399 11.681 -2.702 1.00 0.00 N ATOM 2763 CA HIS B 85 -1.809 12.020 -2.841 1.00 0.00 C ATOM 2764 C HIS B 85 -2.122 13.359 -2.179 1.00 0.00 C ATOM 2765 O HIS B 85 -2.807 14.191 -2.776 1.00 0.00 O ATOM 2766 CB HIS B 85 -2.695 10.908 -2.270 1.00 0.00 C ATOM 2767 CG HIS B 85 -4.164 11.082 -2.578 1.00 0.00 C ATOM 2768 ND1 HIS B 85 -4.858 12.271 -2.679 1.00 0.00 N ATOM 2769 CD2 HIS B 85 -5.057 10.070 -2.800 1.00 0.00 C ATOM 2770 CE1 HIS B 85 -6.141 11.971 -2.938 1.00 0.00 C ATOM 2771 NE2 HIS B 85 -6.312 10.643 -3.020 1.00 0.00 N ATOM 0 H HIS B 85 -0.233 10.802 -2.212 1.00 0.00 H new ATOM 0 HA HIS B 85 -2.027 12.116 -3.905 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -2.361 9.950 -2.667 1.00 0.00 H new ATOM 0 HB3 HIS B 85 -2.562 10.869 -1.189 1.00 0.00 H new ATOM 0 HD1 HIS B 85 -4.467 13.207 -2.576 1.00 0.00 H new ATOM 0 HD2 HIS B 85 -4.832 9.014 -2.804 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -6.928 12.700 -3.063 1.00 0.00 H new ATOM 2779 N GLU B 86 -1.667 13.575 -0.944 1.00 0.00 N ATOM 2780 CA GLU B 86 -1.929 14.856 -0.297 1.00 0.00 C ATOM 2781 C GLU B 86 -1.235 15.994 -1.054 1.00 0.00 C ATOM 2782 O GLU B 86 -1.835 17.053 -1.265 1.00 0.00 O ATOM 2783 CB GLU B 86 -1.660 14.802 1.214 1.00 0.00 C ATOM 2784 CG GLU B 86 -0.252 14.340 1.610 1.00 0.00 C ATOM 2785 CD GLU B 86 -0.076 14.256 3.124 1.00 0.00 C ATOM 2786 OE1 GLU B 86 -0.613 15.153 3.808 1.00 0.00 O ATOM 2787 OE2 GLU B 86 0.573 13.284 3.567 1.00 0.00 O ATOM 0 H GLU B 86 -1.134 12.905 -0.390 1.00 0.00 H new ATOM 0 HA GLU B 86 -2.994 15.081 -0.358 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -1.831 15.794 1.633 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -2.387 14.132 1.673 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -0.055 13.363 1.168 1.00 0.00 H new ATOM 0 HG3 GLU B 86 0.484 15.031 1.198 1.00 0.00 H new ATOM 2794 N PHE B 87 -0.009 15.756 -1.538 1.00 0.00 N ATOM 2795 CA PHE B 87 0.683 16.727 -2.381 1.00 0.00 C ATOM 2796 C PHE B 87 -0.124 17.010 -3.652 1.00 0.00 C ATOM 2797 O PHE B 87 -0.254 18.153 -4.069 1.00 0.00 O ATOM 2798 CB PHE B 87 2.094 16.231 -2.711 1.00 0.00 C ATOM 2799 CG PHE B 87 2.854 17.154 -3.642 1.00 0.00 C ATOM 2800 CD1 PHE B 87 3.449 18.326 -3.138 1.00 0.00 C ATOM 2801 CD2 PHE B 87 2.800 16.944 -5.034 1.00 0.00 C ATOM 2802 CE1 PHE B 87 3.975 19.287 -4.018 1.00 0.00 C ATOM 2803 CE2 PHE B 87 3.323 17.907 -5.914 1.00 0.00 C ATOM 2804 CZ PHE B 87 3.904 19.083 -5.406 1.00 0.00 C ATOM 0 H PHE B 87 0.518 14.902 -1.359 1.00 0.00 H new ATOM 0 HA PHE B 87 0.776 17.666 -1.835 1.00 0.00 H new ATOM 0 HB2 PHE B 87 2.657 16.117 -1.785 1.00 0.00 H new ATOM 0 HB3 PHE B 87 2.027 15.243 -3.166 1.00 0.00 H new ATOM 0 HD1 PHE B 87 3.501 18.487 -2.071 1.00 0.00 H new ATOM 0 HD2 PHE B 87 2.356 16.041 -5.426 1.00 0.00 H new ATOM 0 HE1 PHE B 87 4.434 20.183 -3.627 1.00 0.00 H new ATOM 0 HE2 PHE B 87 3.279 17.744 -6.981 1.00 0.00 H new ATOM 0 HZ PHE B 87 4.295 19.828 -6.083 1.00 0.00 H new ATOM 2814 N PHE B 88 -0.697 15.965 -4.247 1.00 0.00 N ATOM 2815 CA PHE B 88 -1.430 16.010 -5.506 1.00 0.00 C ATOM 2816 C PHE B 88 -2.589 16.997 -5.391 1.00 0.00 C ATOM 2817 O PHE B 88 -2.916 17.683 -6.355 1.00 0.00 O ATOM 2818 CB PHE B 88 -1.935 14.597 -5.827 1.00 0.00 C ATOM 2819 CG PHE B 88 -2.429 14.356 -7.241 1.00 0.00 C ATOM 2820 CD1 PHE B 88 -3.773 14.613 -7.569 1.00 0.00 C ATOM 2821 CD2 PHE B 88 -1.598 13.698 -8.169 1.00 0.00 C ATOM 2822 CE1 PHE B 88 -4.289 14.200 -8.810 1.00 0.00 C ATOM 2823 CE2 PHE B 88 -2.115 13.284 -9.410 1.00 0.00 C ATOM 2824 CZ PHE B 88 -3.463 13.529 -9.727 1.00 0.00 C ATOM 0 H PHE B 88 -0.660 15.027 -3.847 1.00 0.00 H new ATOM 0 HA PHE B 88 -0.782 16.348 -6.314 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -1.128 13.893 -5.624 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -2.746 14.361 -5.138 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -4.410 15.129 -6.866 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -0.562 13.511 -7.927 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -5.321 14.399 -9.058 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -1.477 12.778 -10.119 1.00 0.00 H new ATOM 0 HZ PHE B 88 -3.863 13.201 -10.675 1.00 0.00 H new ATOM 3136 N PHE C 76 -18.165 -12.566 -1.769 1.00 0.00 N ATOM 3137 CA PHE C 76 -17.126 -11.735 -2.360 1.00 0.00 C ATOM 3138 C PHE C 76 -15.761 -11.962 -1.703 1.00 0.00 C ATOM 3139 O PHE C 76 -14.751 -11.516 -2.238 1.00 0.00 O ATOM 3140 CB PHE C 76 -17.535 -10.248 -2.283 1.00 0.00 C ATOM 3141 CG PHE C 76 -19.027 -10.005 -2.106 1.00 0.00 C ATOM 3142 CD1 PHE C 76 -19.897 -10.063 -3.211 1.00 0.00 C ATOM 3143 CD2 PHE C 76 -19.565 -9.992 -0.807 1.00 0.00 C ATOM 3144 CE1 PHE C 76 -21.287 -10.132 -3.018 1.00 0.00 C ATOM 3145 CE2 PHE C 76 -20.950 -10.113 -0.615 1.00 0.00 C ATOM 3146 CZ PHE C 76 -21.815 -10.151 -1.717 1.00 0.00 C ATOM 0 HA PHE C 76 -17.023 -12.023 -3.406 1.00 0.00 H new ATOM 0 HB2 PHE C 76 -17.004 -9.782 -1.453 1.00 0.00 H new ATOM 0 HB3 PHE C 76 -17.205 -9.747 -3.193 1.00 0.00 H new ATOM 0 HD1 PHE C 76 -19.494 -10.054 -4.213 1.00 0.00 H new ATOM 0 HD2 PHE C 76 -18.910 -9.889 0.046 1.00 0.00 H new ATOM 0 HE1 PHE C 76 -21.949 -10.170 -3.870 1.00 0.00 H new ATOM 0 HE2 PHE C 76 -21.351 -10.177 0.386 1.00 0.00 H new ATOM 0 HZ PHE C 76 -22.884 -10.195 -1.566 1.00 0.00 H new ATOM 3156 N LEU C 77 -15.725 -12.589 -0.522 1.00 0.00 N ATOM 3157 CA LEU C 77 -14.524 -12.710 0.293 1.00 0.00 C ATOM 3158 C LEU C 77 -13.820 -14.053 0.083 1.00 0.00 C ATOM 3159 O LEU C 77 -12.594 -14.082 0.018 1.00 0.00 O ATOM 3160 CB LEU C 77 -14.860 -12.492 1.776 1.00 0.00 C ATOM 3161 CG LEU C 77 -15.528 -11.137 2.082 1.00 0.00 C ATOM 3162 CD1 LEU C 77 -15.875 -11.071 3.574 1.00 0.00 C ATOM 3163 CD2 LEU C 77 -14.623 -9.944 1.743 1.00 0.00 C ATOM 0 H LEU C 77 -16.544 -13.031 -0.105 1.00 0.00 H new ATOM 0 HA LEU C 77 -13.829 -11.933 -0.027 1.00 0.00 H new ATOM 0 HB2 LEU C 77 -15.520 -13.293 2.108 1.00 0.00 H new ATOM 0 HB3 LEU C 77 -13.943 -12.572 2.360 1.00 0.00 H new ATOM 0 HG LEU C 77 -16.421 -11.071 1.461 1.00 0.00 H new ATOM 0 HD11 LEU C 77 -16.348 -10.114 3.796 1.00 0.00 H new ATOM 0 HD12 LEU C 77 -16.560 -11.881 3.824 1.00 0.00 H new ATOM 0 HD13 LEU C 77 -14.964 -11.171 4.164 1.00 0.00 H new ATOM 0 HD21 LEU C 77 -15.142 -9.015 1.978 1.00 0.00 H new ATOM 0 HD22 LEU C 77 -13.706 -10.005 2.329 1.00 0.00 H new ATOM 0 HD23 LEU C 77 -14.377 -9.964 0.681 1.00 0.00 H new ATOM 3588 N THR D 74 17.669 11.581 5.551 1.00 0.00 N ATOM 3589 CA THR D 74 16.995 12.840 5.282 1.00 0.00 C ATOM 3590 C THR D 74 17.268 13.335 3.860 1.00 0.00 C ATOM 3591 O THR D 74 16.378 13.921 3.254 1.00 0.00 O ATOM 3592 CB THR D 74 17.359 13.894 6.344 1.00 0.00 C ATOM 3593 OG1 THR D 74 16.377 14.910 6.364 1.00 0.00 O ATOM 3594 CG2 THR D 74 18.732 14.544 6.129 1.00 0.00 C ATOM 0 HA THR D 74 15.921 12.667 5.349 1.00 0.00 H new ATOM 0 HB THR D 74 17.401 13.361 7.294 1.00 0.00 H new ATOM 0 HG1 THR D 74 16.611 15.578 7.042 1.00 0.00 H new ATOM 0 HG21 THR D 74 18.916 15.275 6.917 1.00 0.00 H new ATOM 0 HG22 THR D 74 19.506 13.777 6.157 1.00 0.00 H new ATOM 0 HG23 THR D 74 18.751 15.043 5.160 1.00 0.00 H new ATOM 3602 N GLU D 75 18.475 13.110 3.328 1.00 0.00 N ATOM 3603 CA GLU D 75 18.879 13.587 2.010 1.00 0.00 C ATOM 3604 C GLU D 75 17.867 13.151 0.948 1.00 0.00 C ATOM 3605 O GLU D 75 17.380 13.961 0.162 1.00 0.00 O ATOM 3606 CB GLU D 75 20.273 13.027 1.689 1.00 0.00 C ATOM 3607 CG GLU D 75 21.354 13.591 2.626 1.00 0.00 C ATOM 3608 CD GLU D 75 22.620 12.737 2.638 1.00 0.00 C ATOM 3609 OE1 GLU D 75 22.900 12.097 1.602 1.00 0.00 O ATOM 3610 OE2 GLU D 75 23.297 12.747 3.690 1.00 0.00 O ATOM 0 H GLU D 75 19.204 12.585 3.811 1.00 0.00 H new ATOM 0 HA GLU D 75 18.913 14.676 2.009 1.00 0.00 H new ATOM 0 HB2 GLU D 75 20.254 11.940 1.771 1.00 0.00 H new ATOM 0 HB3 GLU D 75 20.529 13.264 0.656 1.00 0.00 H new ATOM 0 HG2 GLU D 75 21.606 14.605 2.316 1.00 0.00 H new ATOM 0 HG3 GLU D 75 20.955 13.657 3.638 1.00 0.00 H new ATOM 3617 N PHE D 76 17.542 11.859 0.948 1.00 0.00 N ATOM 3618 CA PHE D 76 16.640 11.255 -0.021 1.00 0.00 C ATOM 3619 C PHE D 76 15.202 11.487 0.440 1.00 0.00 C ATOM 3620 O PHE D 76 14.338 11.880 -0.344 1.00 0.00 O ATOM 3621 CB PHE D 76 16.950 9.756 -0.184 1.00 0.00 C ATOM 3622 CG PHE D 76 18.400 9.379 0.035 1.00 0.00 C ATOM 3623 CD1 PHE D 76 19.332 9.461 -1.014 1.00 0.00 C ATOM 3624 CD2 PHE D 76 18.841 9.096 1.337 1.00 0.00 C ATOM 3625 CE1 PHE D 76 20.696 9.231 -0.761 1.00 0.00 C ATOM 3626 CE2 PHE D 76 20.212 8.982 1.608 1.00 0.00 C ATOM 3627 CZ PHE D 76 21.134 8.990 0.553 1.00 0.00 C ATOM 0 H PHE D 76 17.905 11.196 1.633 1.00 0.00 H new ATOM 0 HA PHE D 76 16.776 11.717 -0.999 1.00 0.00 H new ATOM 0 HB2 PHE D 76 16.333 9.194 0.517 1.00 0.00 H new ATOM 0 HB3 PHE D 76 16.656 9.446 -1.187 1.00 0.00 H new ATOM 0 HD1 PHE D 76 19.001 9.700 -2.014 1.00 0.00 H new ATOM 0 HD2 PHE D 76 18.122 8.966 2.133 1.00 0.00 H new ATOM 0 HE1 PHE D 76 21.406 9.239 -1.575 1.00 0.00 H new ATOM 0 HE2 PHE D 76 20.556 8.888 2.627 1.00 0.00 H new ATOM 0 HZ PHE D 76 22.181 8.811 0.749 1.00 0.00 H new ATOM 3637 N LEU D 77 14.946 11.245 1.731 1.00 0.00 N ATOM 3638 CA LEU D 77 13.611 11.353 2.297 1.00 0.00 C ATOM 3639 C LEU D 77 13.081 12.790 2.282 1.00 0.00 C ATOM 3640 O LEU D 77 11.878 12.971 2.433 1.00 0.00 O ATOM 3641 CB LEU D 77 13.564 10.750 3.710 1.00 0.00 C ATOM 3642 CG LEU D 77 13.880 9.243 3.762 1.00 0.00 C ATOM 3643 CD1 LEU D 77 13.914 8.793 5.225 1.00 0.00 C ATOM 3644 CD2 LEU D 77 12.848 8.393 3.009 1.00 0.00 C ATOM 0 H LEU D 77 15.661 10.970 2.405 1.00 0.00 H new ATOM 0 HA LEU D 77 12.945 10.773 1.657 1.00 0.00 H new ATOM 0 HB2 LEU D 77 14.274 11.281 4.344 1.00 0.00 H new ATOM 0 HB3 LEU D 77 12.573 10.917 4.132 1.00 0.00 H new ATOM 0 HG LEU D 77 14.845 9.096 3.276 1.00 0.00 H new ATOM 0 HD11 LEU D 77 14.137 7.727 5.273 1.00 0.00 H new ATOM 0 HD12 LEU D 77 14.684 9.349 5.759 1.00 0.00 H new ATOM 0 HD13 LEU D 77 12.945 8.982 5.686 1.00 0.00 H new ATOM 0 HD21 LEU D 77 13.122 7.340 3.080 1.00 0.00 H new ATOM 0 HD22 LEU D 77 11.862 8.542 3.450 1.00 0.00 H new ATOM 0 HD23 LEU D 77 12.825 8.692 1.961 1.00 0.00 H new ATOM 3656 N ARG D 78 13.927 13.803 2.059 1.00 0.00 N ATOM 3657 CA ARG D 78 13.521 15.197 1.881 1.00 0.00 C ATOM 3658 C ARG D 78 12.313 15.287 0.940 1.00 0.00 C ATOM 3659 O ARG D 78 11.338 15.976 1.237 1.00 0.00 O ATOM 3660 CB ARG D 78 14.719 16.009 1.345 1.00 0.00 C ATOM 3661 CG ARG D 78 14.651 17.525 1.595 1.00 0.00 C ATOM 3662 CD ARG D 78 13.680 18.283 0.686 1.00 0.00 C ATOM 3663 NE ARG D 78 13.981 18.052 -0.731 1.00 0.00 N ATOM 3664 CZ ARG D 78 13.201 18.398 -1.764 1.00 0.00 C ATOM 3665 NH1 ARG D 78 11.962 18.868 -1.574 1.00 0.00 N ATOM 3666 NH2 ARG D 78 13.677 18.264 -3.006 1.00 0.00 N ATOM 0 H ARG D 78 14.936 13.670 1.996 1.00 0.00 H new ATOM 0 HA ARG D 78 13.217 15.618 2.839 1.00 0.00 H new ATOM 0 HB2 ARG D 78 15.631 15.623 1.800 1.00 0.00 H new ATOM 0 HB3 ARG D 78 14.801 15.838 0.272 1.00 0.00 H new ATOM 0 HG2 ARG D 78 14.363 17.695 2.632 1.00 0.00 H new ATOM 0 HG3 ARG D 78 15.649 17.945 1.468 1.00 0.00 H new ATOM 0 HD2 ARG D 78 12.659 17.967 0.899 1.00 0.00 H new ATOM 0 HD3 ARG D 78 13.735 19.350 0.902 1.00 0.00 H new ATOM 0 HE ARG D 78 14.862 17.587 -0.949 1.00 0.00 H new ATOM 0 HH11 ARG D 78 11.594 18.969 -0.628 1.00 0.00 H new ATOM 0 HH12 ARG D 78 11.386 19.125 -2.375 1.00 0.00 H new ATOM 0 HH21 ARG D 78 14.619 17.903 -3.155 1.00 0.00 H new ATOM 0 HH22 ARG D 78 13.098 18.522 -3.805 1.00 0.00 H new